X5DRB1_HUMAN Loading...

p125

In absence of DNA repair, the XPC complex also acts as a transcription coactivator: XPC interacts with the DNA-binding transcription factor E2F1 at a subset of promoters to recruit KAT2A and histone acetyltransferase complexes (HAT). KAT2A recruitment specifically promotes acetylation of histone variant H2A.Z.1/H2A.Z, but not H2A.Z.2/H2A.V, thereby promoting expression of target genes.

AlphaFold DB (Q01831), UniProt , Accession X5DRB1, Species HUMAN (Homo sapiens, Human), Gene XPC, Length 940 aa.

						>X5DRB1_HUMAN|X5DRB1|XPC
MARKRAAGGEPRGRELRSQKSKAKSKARREEEEEDAFEDEKPPKKSLLSKVSQGKRKRGCSHPGGSADGPAKKKVAKVTVKSENLKVIKDEALSDGDDLRDFPSDLKKAHHLKRGATMNEDSNEEEEESENDWEEVEELSEPVLGDVRESTAFSRSLLPVKPVEIEIETPEQAKTRERSEKIKLEFETYLRRAMKRFNKGVHEDTHKVHLLCLLANGFYRNNICSQPDLHAIGLSIIPARFTRVLPRDVDTYYLSNLVKWFIGTFTVNAELSASEQDNLQTTLERRFAIYSARDDEELVHIFLLILRALQLLTRLVLSLQPIPLKSATAKGKKPSKERLTADPGGSSETSSQVLENHTKPKTSKGTKQEETFAKGTCRPSAKGKRNKGGRKKRSKPSSSEEDEGPGDKQEKATQRRPHGRERRVASRVSYKEESGSDEAGSGSDFELSSGEASDPSDEDSEPGPPKQRKAPAPQRTKAGSKSASRTHRGSHRKDPSLPAASSSSSSSKRGKKMCSDGEKAEKRSIAGIDQWLEVFCEQEEKWVCVDCVHGVVGQPLTCYKYATKPMTYVVGIDSDGWVRDVTQRYDPVWMTVTRKCRVDAEWWAETLRPYQSPFMDREKKEDLEFQAKHMDQPLPTAIGLYKNHPLYALKRHLLKYEAIYPETAAILGYCRGEAVYSRDCVHTLHSRDTWLKKARVVRLGEVPYKMVKGFSNRARKARLAEPQLREENDLGLFGYWQTEEYQPPVAVDGKVPRNEFGNVYLFLPSMMPIGCVQLNLPNLHRVARKLDIDCVQAITGFDFHGGYSHPVTDGYIVCEEFKDVLLTAWENEQAVIERKEKEKKEKRALGNWKLLAKGLLIRERLKRRYGPKSEAAAPHTDAGGGLSSDEEEGTSSQAEAARILAASWPQNREDEEKQKLKGGPKKTKREKKAAASHLFPFEQL
					

Structure Viewer

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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	40.6	Very low	42.5	Very low	252 Å²	252	156.2 Å²	156.2	100%	1.241	90%	0.895	S	S	*	*				0	129.1	0	-60.9	-178.6	-171.1	0	0	107.6
2	A	43.3	Very low	42.2	Very low	107 Å²	107	163.5 Å²	163.5	88%	0.884	90%	0.898	S	S	*	*			trans	-137.6	104.3	177.9	0	0	0	0	0	109.8
3	R	50.1	Low	41.6	Very low	245 Å²	245	157.4 Å²	157.4	93%	0.925	90%	0.895	S	S	*	*	P	Polyproline II helix	trans	-89.8	122.7	168.3	-82.1	-177.6	168.6	179.5	-4	108	R5	R3-R5 PolarHBondContact O-N 3.43Å
4	K	43.3	Very low	41.4	Very low	183 Å²	183	163.9 Å²	163.9	80%	0.796	90%	0.898	S	S	*	*	P	Polyproline II helix	trans	-53.2	124	160.8	-87.9	-178.5	169.9	-178.8	0	108.1
5	R	47.2	Very low	41	Very low	247 Å²	247	164.7 Å²	164.7	93%	0.932	89%	0.893	S	S	*	*	P	Polyproline II helix	trans	-93.2	123.5	156.8	-80	-173.1	171.7	-171.4	-2.5	107.5	R3	R3-R5 PolarHBondContact O-N 3.43Å
6	A	39.9	Very low	41	Very low	104 Å²	104	165.9 Å²	165.9	86%	0.86	90%	0.897	S	S	*	*	P	Polyproline II helix	trans	-90.2	140.5	163.5	0	0	0	0	0	108
7	A	47.5	Very low	40.7	Very low	109 Å²	109	168.8 Å²	168.8	90%	0.901	89%	0.892	S	S	*	*			trans	-129.7	110.8	167.9	0	0	0	0	0	107.2
8	G	37.5	Very low	40.5	Very low	84 Å²	84	165.4 Å²	165.4	87%	0.866	89%	0.885	S	S	*	*			trans	-110.6	143.2	164.8	0	0	0	0	0	108.3
9	G	40.6	Very low	40.4	Very low	74 Å²	74	166.3 Å²	166.3	76%	0.763	88%	0.883	S	S	*	*			trans	157.9	77	-178	0	0	0	0	0	112.6
10	E	34.7	Very low	40.2	Very low	192 Å²	192	168.5 Å²	168.5	90%	0.897	89%	0.885	S	S	*	*			trans	-65.1	152.2	159.6	-69.3	-172.2	119.7	0	0	110.7
11	P	42.6	Very low	40.1	Very low	121 Å²	121	166.2 Å²	166.2	79%	0.786	88%	0.882	S	S	*	*			trans	-132.3	117.1	136.1	33.1	-20.7	0	0	0	113.1
12	R	39	Very low	39.9	Very low	244 Å²	244	164.5 Å²	164.5	92%	0.921	87%	0.868	S	S	*	*			trans	18.6	116.4	143.4	-63	-177.9	174.1	-159.7	-3.7	117.5
13	G	34.5	Very low	39.7	Very low	84 Å²	84	164.2 Å²	164.2	87%	0.866	87%	0.866	S	S	*	*			trans	-74.6	-177.6	177.2	0	0	0	0	0	116
14	R	39	Very low	39	Very low	249 Å²	249	162.8 Å²	162.8	94%	0.94	87%	0.866	S	S	*	*			trans	-146.8	114.3	171.7	-158.8	177.4	-167.4	-167.1	3.4	109.4
15	E	35.5	Very low	38.7	Very low	175 Å²	175	159.8 Å²	159.8	82%	0.818	87%	0.868	S	S	*	*			trans	-65.7	147.6	172.9	-65.9	-179.1	111.1	0	0	111.3
16	L	40.8	Very low	38.1	Very low	184 Å²	184	157.9 Å²	157.9	96%	0.963	87%	0.867	S	S	*	*			trans	-133	131.1	151.4	-99.2	168.2	0	0	0	109.8
17	R	35.7	Very low	37.8	Very low	215 Å²	215	157.4 Å²	157.4	81%	0.811	86%	0.863	S	S	*	*			trans	-96.4	162.3	-169	-112.3	176.4	172.2	-170.4	-1.3	111.7
18	S	37.1	Very low	37.2	Very low	108 Å²	108	161.9 Å²	161.9	76%	0.755	86%	0.856	S	S	*	*			trans	74.6	152.2	160.1	81.4	0	0	0	0	116.1
19	Q	39.3	Very low	36.8	Very low	183 Å²	183	169.7 Å²	169.7	86%	0.855	86%	0.86	S	S	*	*			cis	-150.8	151.1	13.5	-146.2	162.4	42.1	0	0	111.6
20	K	35.1	Very low	36.8	Very low	210 Å²	210	172 Å²	172	91%	0.913	85%	0.85	S	S	*	*			trans	-83.2	136.9	177.1	-79.6	176.3	174.8	170.8	0	111.7
21	S	39.2	Very low	36.8	Very low	120 Å²	120	170.8 Å²	170.8	84%	0.839	85%	0.845	S	S	*	*			trans	-143.8	125.2	154.7	55.6	0	0	0	0	111.5
22	K	35.8	Very low	36.4	Very low	217 Å²	217	173.7 Å²	173.7	94%	0.943	85%	0.848	S	S	*	*			trans	-79.4	135.7	174.2	-73.2	175.1	173.7	175	0	110.3
23	A	40.4	Very low	36.2	Very low	101 Å²	101	171.8 Å²	171.8	84%	0.835	85%	0.849	S	S	*	*			trans	-142.7	134.3	155.6	0	0	0	0	0	110
24	K	35.3	Very low	36.2	Very low	214 Å²	214	176.3 Å²	176.3	93%	0.93	85%	0.848	S	S	*	*			trans	-95.5	125.4	172.1	-85.2	179.3	169.6	179.9	0	109
25	S	37.3	Very low	35.9	Very low	120 Å²	120	172 Å²	172	84%	0.839	84%	0.844	S	S	*	*			trans	-159.6	142.8	151.7	43.1	0	0	0	0	111.8
26	K	34.1	Very low	35.9	Very low	208 Å²	208	167.5 Å²	167.5	90%	0.904	84%	0.837	S	S	*	*			trans	-63.3	145.4	177.6	-58	163.9	172.9	178.5	0	111.3
27	A	34.1	Very low	35.7	Very low	93 Å²	93	168.5 Å²	168.5	77%	0.769	83%	0.833	S	S	*	*				167.8	148.7	109.9	0	0	0	0	0	113.2
28	R	33.6	Very low	35.8	Very low	203 Å²	203	167 Å²	167	77%	0.766	84%	0.836	S	S	*	*			trans	53.7	108.8	159.7	-71	-175.3	167.6	-153.9	-4.2	120.2	E30	R28-E30 WeakPolarHBondContact CD-OE1 3.38Å; R28-E30 IonicContact CZ-OE1 3.18Å; R28-E30 IonicContact NE-OE1 3.16Å; R28-E30 IonicContact NH1-OE1 2.89Å; R28-E30 PolarHBondContact NH1-OE1 3.31Å
29	R	30.5	Very low	35.7	Very low	248 Å²	248	167.9 Å²	167.9	94%	0.936	83%	0.832	S	S	*	*				-82.6	148.5	126.7	-82.1	177.2	165.4	175.4	-7.8	107.9
30	E	39.2	Very low	35.7	Very low	122 Å²	122	168.3 Å²	168.3	57%	0.57	83%	0.834	S	S	*	*			trans	-118.1	115.9	162.7	-71.7	167.6	174.2	0	0	104.2	R28	R28-E30 WeakPolarHBondContact CD-OE1 3.38Å; R28-E30 IonicContact CZ-OE1 3.18Å; R28-E30 IonicContact NE-OE1 3.16Å; R28-E30 IonicContact NH1-OE1 2.89Å; R28-E30 PolarHBondContact NH1-OE1 3.31Å
31	E	36.1	Very low	35.5	Very low	168 Å²	168	166.5 Å²	166.5	79%	0.785	83%	0.826	S	S	*	*				74.8	106	97.2	-70.8	166.9	-164.3	0	0	110.3
32	E	32.9	Very low	35.6	Very low	181 Å²	181	166.4 Å²	166.4	85%	0.846	82%	0.823	S	S	*	*				65.3	109.9	55.5	-71.6	-178.5	-176	0	0	114.8
33	E	34.2	Very low	35.8	Very low	204 Å²	204	161.3 Å²	161.3	95%	0.953	81%	0.812	S	S	*	*			trans	-134.4	97.2	144.8	-80.8	-167.3	155	0	0	107.9
34	E	34.8	Very low	35.6	Very low	179 Å²	179	165.9 Å²	165.9	84%	0.836	81%	0.813	S	S	*	*			trans	-99	134.6	157.1	-70.9	-170.1	152.7	0	0	107.8
35	D	33.6	Very low	35.5	Very low	159 Å²	159	165 Å²	165	85%	0.85	81%	0.809	S	S	*	*			trans	-108.3	85.8	173.7	-159.4	6	0	0	0	109.4
36	A	35.7	Very low	35.2	Very low	81 Å²	81	164.2 Å²	164.2	67%	0.669	80%	0.803	S	S	*	*			trans	-131.4	107.9	179.2	0	0	0	0	0	110
37	F	36.9	Very low	35.3	Very low	204 Å²	204	161.9 Å²	161.9	90%	0.895	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-91.5	117.3	178.2	-110.9	-94.2	0	0	0	111.4
38	E	36.5	Very low	35.2	Very low	185 Å²	185	165.2 Å²	165.2	86%	0.864	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-92.3	172.2	176	-93.7	-146.2	160.3	0	0	114.8
39	D	36.1	Very low	35.5	Very low	125 Å²	125	161 Å²	161	67%	0.668	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-50.6	146.5	-175.5	-87.2	-69.7	0	0	0	117.6
40	E	37.9	Very low	35.6	Very low	193 Å²	193	158.5 Å²	158.5	90%	0.902	80%	0.801	S	S	*	*			trans	-135.3	139	137.1	-98.7	-149.7	146.2	0	0	113
41	K	32.5	Very low	35.5	Very low	172 Å²	172	159.6 Å²	159.6	75%	0.748	82%	0.816	S	S	*	*			trans	-125.9	166	162.2	-69.4	174	178.9	125.1	0	106.1
42	P	41.3	Very low	35.7	Very low	118 Å²	118	157 Å²	157	77%	0.766	82%	0.817	S	S	*	*			cis	-142.6	-138.4	18.5	43	-20	0	0	0	111
43	P	40	Very low	35.8	Very low	110 Å²	110	156.5 Å²	156.5	71%	0.714	81%	0.814	S	S	*	*			cis	-123.9	170.4	-36.3	33	-14.6	0	0	0	115.5
44	K	34.3	Very low	36.2	Very low	197 Å²	197	151 Å²	151	86%	0.857	81%	0.812	S	S	*	*			trans	-14.9	129.7	165.2	-55	168.8	-179	173.1	0	119.4
45	K	34.5	Very low	36.3	Very low	195 Å²	195	150.4 Å²	150.4	85%	0.848	81%	0.807	S	S	*	*				171.1	125.9	108.3	-94.8	174	-177.9	178	0	115.3
46	S	31.2	Very low	36.6	Very low	103 Å²	103	154.4 Å²	154.4	72%	0.72	81%	0.81	S	S	*	*			trans	58.3	146.7	140.2	66.7	0	0	0	0	124.3
47	L	36	Very low	36.7	Very low	160 Å²	160	159.6 Å²	159.6	84%	0.838	82%	0.817	S	S	*	*			trans	100.4	87.3	155.7	-57.1	178.1	0	0	0	120.5
48	L	32.6	Very low	36.9	Very low	162 Å²	162	161.4 Å²	161.4	85%	0.848	82%	0.818	S	S	*	*			trans	7.2	123.2	133.8	-66.7	162.9	0	0	0	120.8
49	S	38	Very low	36.9	Very low	114 Å²	114	155.9 Å²	155.9	80%	0.797	81%	0.811	S	S	*	*				-174.8	116.2	127.4	38.4	0	0	0	0	108.8
50	K	33.5	Very low	37	Very low	196 Å²	196	156.1 Å²	156.1	85%	0.852	82%	0.821	S	S	*	*				72.4	141.4	70.2	-90.6	-169.5	176.1	177.1	0	115.8
51	V	36.3	Very low	37	Very low	146 Å²	146	151.2 Å²	151.2	89%	0.885	81%	0.808	S	S	*	*			trans	88	130.4	174.3	-173	0	0	0	0	113.6
52	S	40.4	Very low	37.3	Very low	114 Å²	114	151.8 Å²	151.8	80%	0.797	81%	0.813	S	S	*	*			cis	-138.8	163	12.4	47.5	0	0	0	0	113.9
53	Q	35.7	Very low	37.4	Very low	170 Å²	170	152.1 Å²	152.1	79%	0.794	82%	0.815	S	S	*	*			trans	-104.5	148.9	-178.6	-68.1	-173.5	-42.9	0	0	114.1
54	G	42	Very low	37	Very low	87 Å²	87	150.6 Å²	150.6	90%	0.897	82%	0.819	S	S	*	*			trans	-103.5	140.9	151.2	0	0	0	0	0	110.8
55	K	37.5	Very low	37.1	Very low	167 Å²	167	145.3 Å²	145.3	73%	0.726	82%	0.821	S	S	*	*			trans	-130.9	140	-152.5	-156.8	178.5	-162.9	168.9	0	114
56	R	38.8	Very low	37.2	Very low	243 Å²	243	141.8 Å²	141.8	92%	0.917	82%	0.821	S	S	*	*			trans	179.5	107.6	145.9	-97.2	153.2	-173.3	-137.1	-1.3	109.4
57	K	39.6	Very low	37.4	Very low	190 Å²	190	140.9 Å²	140.9	83%	0.826	82%	0.82	S	S	*	*				58.4	129.2	80.4	-91.4	-168.9	170.1	-175.3	0	113.5
58	R	39.9	Very low	37.6	Very low	242 Å²	242	141.3 Å²	141.3	91%	0.913	82%	0.823	S	S	*	*			cis	-133	178.8	-0.5	-49.2	-175.4	-166.8	-154.2	8.2	108.9
59	G	36.4	Very low	37.9	Very low	69 Å²	69	137.1 Å²	137.1	71%	0.711	82%	0.819	S	S	*	*			cis	135.1	145.4	-10.7	0	0	0	0	0	115.4
60	C	38.8	Very low	38	Very low	131 Å²	131	137.9 Å²	137.9	89%	0.885	82%	0.821	S	S	*	*			trans	97.5	138.9	171.9	-73.1	0	0	0	0	118.4
61	S	38.1	Very low	38.1	Very low	90 Å²	90	132.5 Å²	132.5	63%	0.629	81%	0.813	S	S	*	*			cis	-176.4	138.4	-29.1	39.1	0	0	0	0	112.7
62	H	37.5	Very low	38.2	Very low	183 Å²	183	135.2 Å²	135.2	85%	0.847	81%	0.813	S	S	*	*			trans	67.8	161.8	160.7	-66.8	-57.9	0	0	0	119.5
63	P	45.2	Very low	38	Very low	125 Å²	125	140 Å²	140	81%	0.812	82%	0.82	S	S	*	*			cis	-119	178.4	-0.3	39.9	-26.2	0	0	0	114.7
64	G	31.3	Very low	38.2	Very low	78 Å²	78	142.1 Å²	142.1	80%	0.804	83%	0.826	S	S	*	*			trans	-116.3	157.5	165.9	0	0	0	0	0	111.2
65	G	36.3	Very low	37.8	Very low	87 Å²	87	144.3 Å²	144.3	90%	0.897	82%	0.821	S	S	*	*			trans	-178.3	118.5	177.1	0	0	0	0	0	110.6
66	S	36.2	Very low	37.7	Very low	120 Å²	120	141.1 Å²	141.1	84%	0.839	83%	0.827	S	S	*	*			trans	-95.8	148.1	-174.7	52.4	0	0	0	0	113
67	A	36.2	Very low	37.4	Very low	84 Å²	84	137.6 Å²	137.6	69%	0.694	82%	0.818	S	S	*	*				175.9	145.3	120.5	0	0	0	0	0	113.9
68	D	38.6	Very low	37.2	Very low	169 Å²	169	134.8 Å²	134.8	90%	0.904	82%	0.816	S	S	*	*			trans	62.6	138.4	149	-59.3	-22	0	0	0	124.5
69	G	38.7	Very low	36.8	Very low	74 Å²	74	128.2 Å²	128.2	76%	0.763	80%	0.803	S	S	*	*			trans	127.3	92	157.9	0	0	0	0	0	116.1
70	P	40.8	Very low	36.8	Very low	131 Å²	131	131.2 Å²	131.2	85%	0.851	81%	0.808	S	S	*	*			trans	-99.5	156.1	-174.1	37.2	-34.2	0	0	0	115.1
71	A	35.3	Very low	36.4	Very low	82 Å²	82	134.1 Å²	134.1	68%	0.678	81%	0.805	S	S	*	*				143.8	139.9	119	0	0	0	0	0	116.7
72	K	38.2	Very low	36.3	Very low	204 Å²	204	134.6 Å²	134.6	89%	0.887	81%	0.809	S	S	*	*			trans	70.9	87.3	154.3	-64.1	160.8	-175.1	175	0	119.3
73	K	36.6	Very low	36.2	Very low	215 Å²	215	134.4 Å²	134.4	94%	0.935	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-99.4	131.6	140.3	-87.3	-176.5	174.8	177.8	0	109.5
74	K	39.8	Very low	35.5	Very low	213 Å²	213	135.8 Å²	135.8	93%	0.926	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-92.2	141.4	167.6	-82.3	-172.9	174.7	-177.8	0	109.8
75	V	33.1	Very low	35.7	Very low	133 Å²	133	140.6 Å²	140.6	81%	0.806	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-90.9	140.8	172.6	172.4	0	0	0	0	109.1	K77	V75-K77 HydrophobicContact CG1-CB 4.19Å
76	A	37.1	Very low	35.4	Very low	101 Å²	101	145 Å²	145	84%	0.835	81%	0.809	S	S	*	*			trans	-122.1	105.3	160.6	0	0	0	0	0	108.5
77	K	32.3	Very low	35	Very low	169 Å²	169	145.4 Å²	145.4	74%	0.735	81%	0.806	S	S	*	*			trans	-114.5	108.8	173.3	174.3	179.5	179.4	175.1	0	106.6	V75 T79	V75-K77 HydrophobicContact CG1-CB 4.19Å; K77-T79 HydrophobicContact CG-CG2 4.43Å
78	V	35.1	Very low	34.9	Very low	131 Å²	131	148.5 Å²	148.5	79%	0.794	81%	0.81	S	S	*	*			trans	-96.3	101.9	174.8	179.6	0	0	0	0	108.5	V80	V78-V80 HydrophobicContact CG1-CG2 4.2Å
79	T	30.7	Very low	34.5	Very low	104 Å²	104	147.9 Å²	147.9	64%	0.638	80%	0.799	S	S	*	*			trans	-94.3	124.7	161	45.4	0	0	0	0	108.4	K77	K77-T79 HydrophobicContact CG-CG2 4.43Å
80	V	37	Very low	34.3	Very low	132 Å²	132	150.9 Å²	150.9	80%	0.8	80%	0.797	S	S	*	*			trans	-102.6	125.1	161.3	-178.9	0	0	0	0	107.8	V78	V78-V80 HydrophobicContact CG1-CG2 4.2Å
81	K	30	Very low	33.8	Very low	191 Å²	191	151.5 Å²	151.5	83%	0.83	79%	0.789	S	S	*	*			trans	-115.4	172	168.1	-98.4	-169.9	173.8	-171.5	0	107.6
82	S	36.8	Very low	33.6	Very low	101 Å²	101	152 Å²	152	71%	0.706	79%	0.794	S	S	*	*			trans	83.5	139.3	-178.2	-57.3	0	0	0	0	113.3
83	E	35.1	Very low	33.5	Very low	178 Å²	178	150.6 Å²	150.6	83%	0.832	80%	0.795	S	S	*	*			cis	-148.9	160	11.9	-139.7	141.1	-123.9	0	0	113.3
84	N	30.2	Very low	33.2	Very low	154 Å²	154	145 Å²	145	82%	0.824	78%	0.783	S	S	*	*			trans	-72.9	130.2	176.5	-74.9	-72.2	0	0	0	110.9
85	L	35.2	Very low	33	Very low	180 Å²	180	142.2 Å²	142.2	94%	0.942	78%	0.778	S	S	*	*			trans	-128.9	126.9	149.1	-91.2	171.2	0	0	0	110.9
86	K	30.4	Very low	33.1	Very low	179 Å²	179	139 Å²	139	78%	0.778	77%	0.772	S	S	*	*			trans	-97.1	145	179.3	-89	-180	175.1	179.4	0	109.5
87	V	28.4	Very low	33.2	Very low	128 Å²	128	142 Å²	142	78%	0.776	77%	0.774	S	S	*	*			trans	64.3	118.6	150.4	177.2	0	0	0	0	116.2
88	I	33.4	Very low	33.3	Very low	149 Å²	149	140.7 Å²	140.7	76%	0.764	78%	0.775	S	S	*	*				-154.3	148.3	114.6	-94.3	147.5	0	0	0	107.9	D90	I88-D90 WeakPolarHBondContact CG2-OD2 3.37Å
89	K	29.3	Very low	33.4	Very low	156 Å²	156	142.3 Å²	142.3	68%	0.678	78%	0.778	S	S	*	*			trans	-129.4	107	-174.8	175.3	-151.2	174.7	-155.1	0	107.3	E91	K89-E91 WeakPolarHBondContact CE-OE1 3.43Å; K89-E91 IonicContact NZ-OE1 4Å; K89-E91 PolarHBondContact NZ-OE1 3.33Å
90	D	36.4	Very low	33.6	Very low	137 Å²	137	147.8 Å²	147.8	73%	0.733	79%	0.787	S	S	*	*			trans	-137.7	115.5	168	-62.7	-57.6	0	0	0	103.8	I88	I88-D90 WeakPolarHBondContact CG2-OD2 3.37Å
91	E	29.5	Very low	33.6	Very low	145 Å²	145	148 Å²	148	68%	0.678	78%	0.784	S	S	*	*			cis	57.7	124.3	42.1	-77	-162	-135	0	0	115	K89	K89-E91 WeakPolarHBondContact CE-OE1 3.43Å; K89-E91 IonicContact NZ-OE1 4Å; K89-E91 PolarHBondContact NZ-OE1 3.33Å
92	A	30	Very low	33.7	Very low	93 Å²	93	146.6 Å²	146.6	77%	0.769	78%	0.778	S	S	*	*			trans	62.5	115.8	-180	0	0	0	0	0	117.4
93	L	37.1	Very low	33.7	Very low	174 Å²	174	146.9 Å²	146.9	91%	0.911	78%	0.777	S	S	*	*				-152.4	113.3	94.9	-92.3	-179.2	0	0	0	110.6
94	S	30.4	Very low	33.5	Very low	97 Å²	97	144 Å²	144	68%	0.678	78%	0.777	S	S	*	*			trans	-83	145.8	154.4	167	0	0	0	0	108
95	D	35.3	Very low	33.9	Very low	154 Å²	154	144.4 Å²	144.4	82%	0.824	78%	0.779	S	S	*	*			trans	160	118.8	144.7	-79.8	-7.3	0	0	0	106.5
96	G	36.2	Very low	33.7	Very low	67 Å²	67	143.6 Å²	143.6	69%	0.691	78%	0.775	S	S	*	*				104.8	143.7	92.5	0	0	0	0	0	108
97	D	38.1	Very low	34	Very low	163 Å²	163	144.7 Å²	144.7	87%	0.872	78%	0.78	S	S	*	*			cis	-151.9	174.5	0.5	-97.4	-45.2	0	0	0	110.2
98	D	35.5	Very low	34.1	Very low	142 Å²	142	148.9 Å²	148.9	76%	0.759	79%	0.787	S	S	*	*			trans	-44.5	137.7	169.3	-89.8	-56.9	0	0	0	114.8
99	L	37.6	Very low	34.1	Very low	164 Å²	164	146 Å²	146	86%	0.859	79%	0.786	S	S	*	*				-152.1	105.7	124.9	-157.9	63.4	0	0	0	112.3
100	R	33.8	Very low	34.1	Very low	220 Å²	220	147.7 Å²	147.7	83%	0.83	80%	0.796	S	S	*	*			trans	-87.5	130.9	153.7	-67.1	177.6	176.4	179.7	1.5	107.5
101	D	36.7	Very low	34	Very low	137 Å²	137	149.6 Å²	149.6	73%	0.733	80%	0.8	S	S	*	*			trans	-162.9	167.2	138.2	-103.6	-9.5	0	0	0	114.2
102	F	33.3	Very low	34.2	Very low	160 Å²	160	150.4 Å²	150.4	70%	0.702	81%	0.808	S	S	*	*			trans	-72.6	172.2	-143.1	-78.7	-94.8	0	0	0	119.6
103	P	35.4	Very low	34.3	Very low	107 Å²	107	155.9 Å²	155.9	70%	0.695	82%	0.815	S	S	*	*			trans	-103.6	155.9	-166.5	39.3	-33	0	0	0	114.2
104	S	32.2	Very low	33.9	Very low	117 Å²	117	159.2 Å²	159.2	82%	0.818	82%	0.815	S	S	*	*				170.6	123.8	125.5	38.4	0	0	0	0	111.1
105	D	37	Very low	33.9	Very low	164 Å²	164	157.6 Å²	157.6	88%	0.877	81%	0.814	S	S	*	*				-164.2	142.6	124.7	-126.9	-23.2	0	0	0	113.4
106	L	32.4	Very low	33.5	Very low	162 Å²	162	155.1 Å²	155.1	85%	0.848	82%	0.815	S	S	*	*			trans	-94.5	112.1	-177.3	-82.4	155.8	0	0	0	111
107	K	35.6	Very low	33.2	Very low	203 Å²	203	157.3 Å²	157.3	88%	0.883	82%	0.815	S	S	*	*			trans	-151	112.9	155.5	-105.9	139.6	-169.9	172.5	0	114.3	A109	K107-A109 PolarHBondContact O-N 3.1Å
108	K	31.2	Very low	33	Very low	215 Å²	215	155.4 Å²	155.4	94%	0.935	80%	0.802	S	S	*	*			trans	-33.2	117.1	173.5	-61.2	165.6	178.8	175.5	0	115.5
109	A	33.6	Very low	32.7	Very low	89 Å²	89	153.9 Å²	153.9	74%	0.736	79%	0.794	S	S	*	*			trans	-149	116.5	146.7	0	0	0	0	0	109.4	K107 H111	K107-A109 PolarHBondContact O-N 3.1Å; A109-H111 PolarHBondContact O-N 2.67Å; A109-H111 VanDerWaalsContact O-N 3.13Å
110	H	29.6	Very low	32.5	Very low	192 Å²	192	153 Å²	153	89%	0.889	79%	0.785	S	S	*	*			trans	-77.1	94.8	174.1	-107.5	-88.3	0	0	0	109.1
111	H	34.1	Very low	32.3	Very low	177 Å²	177	148.2 Å²	148.2	82%	0.819	78%	0.776	S	S	*	*			trans	-103.3	107.2	162.3	-113.3	-82.1	0	0	0	109.2	A109 K113	A109-H111 PolarHBondContact O-N 2.67Å; A109-H111 VanDerWaalsContact O-N 3.13Å; H111-K113 PolarHBondContact O-N 3.4Å
112	L	32.7	Very low	32	Very low	162 Å²	162	146.9 Å²	146.9	85%	0.848	78%	0.778	S	S	*	*			trans	-69.3	94	170.3	-78.4	161.9	0	0	0	108.7	R114	L112-R114 PolarHBondContact O-N 3.22Å
113	K	32.8	Very low	32	Very low	208 Å²	208	145.5 Å²	145.5	90%	0.904	78%	0.778	S	S	*	*			trans	-77	90.3	172.9	-140.8	178.6	-172.9	-175.7	0	108.2	H111 G115	H111-K113 PolarHBondContact O-N 3.4Å; K113-G115 VanDerWaalsContact C-N 3.34Å; K113-G115 PolarHBondContact O-N 3.42Å
114	R	29.3	Very low	31.9	Very low	244 Å²	244	148.4 Å²	148.4	92%	0.921	78%	0.782	S	S	*	*			trans	-70.2	89.8	175.4	-164.9	178.6	-161.6	175	3.7	108.6	L112 A116	L112-R114 PolarHBondContact O-N 3.22Å; R114-A116 PolarHBondContact O-N 3.12Å
115	G	29	Very low	32.1	Very low	63 Å²	63	151.6 Å²	151.6	65%	0.649	78%	0.784	S	S	*	*			trans	-66.8	126.2	169.7	0	0	0	0	0	109.4	K113 T117	K113-G115 VanDerWaalsContact C-N 3.34Å; K113-G115 PolarHBondContact O-N 3.42Å; G115-T117 PolarHBondContact O-N 2.89Å; G115-T117 VanDerWaalsContact O-N 3.12Å
116	A	28.5	Very low	32.2	Very low	102 Å²	102	151.1 Å²	151.1	84%	0.843	78%	0.777	S	S	*	*			trans	-82.1	83.7	178.6	0	0	0	0	0	110.4	R114	R114-A116 PolarHBondContact O-N 3.12Å
117	T	28.4	Very low	32.3	Very low	113 Å²	113	149.6 Å²	149.6	69%	0.693	77%	0.765	S	S	*	*			trans	-84.3	121.2	150.8	46.8	0	0	0	0	107.5	G115 N119	G115-T117 PolarHBondContact O-N 2.89Å; G115-T117 VanDerWaalsContact O-N 3.12Å; T117-N119 VanDerWaalsContact C-N 3.31Å; T117-N119 PolarHBondContact O-N 3.27Å; T117-N119 PolarHBondContact OG1-OD1 3.38Å
118	M	33.5	Very low	32.4	Very low	122 Å²	122	147.1 Å²	147.1	60%	0.601	76%	0.757	S	S	*	*			trans	-75.8	87.5	173.7	-61.3	-172.1	85.7	0	0	108.5	E120 F762 L763 P764	M118-E120 PolarHBondContact O-N 3.36Å; M118-F762 VanDerWaalsContact CE-O 3.28Å; M118-F762 WeakPolarHBondContact CE-O 3.45Å; M118-L763 HydrophobicContact CE-CD2 3.83Å; M118-L763 HydrophobicContact SD-CD2 3.95Å; M118-P764 HydrophobicContact SD-CG 4.33Å
119	N	29.8	Very low	32.6	Very low	110 Å²	110	141.8 Å²	141.8	59%	0.588	75%	0.747	S	S	*	*			trans	-65.4	121.7	166.3	-76.3	44	0	0	0	108.3	T117 D121	T117-N119 VanDerWaalsContact C-N 3.31Å; T117-N119 PolarHBondContact O-N 3.27Å; T117-N119 PolarHBondContact OG1-OD1 3.38Å; N119-D121 HydrophobicContact CB-CB 4.48Å; N119-D121 PolarHBondContact ND2-OD2 3.33Å; N119-D121 PolarHBondContact O-N 3.13Å
120	E	33.1	Very low	32.7	Very low	145 Å²	145	145.8 Å²	145.8	68%	0.678	75%	0.75	S	S	*	*			trans	-74.1	17.7	176.7	-114.6	-160.2	149	0	0	113.1	M118 S122 K693	M118-E120 PolarHBondContact O-N 3.36Å; E120-S122 VanDerWaalsContact C-N 3.33Å; E120-S122 PolarHBondContact O-N 3.42Å; E120-K693 WeakPolarHBondContact OE1-CE 3.3Å; E120-K693 IonicContact OE1-NZ 2.78Å; E120-K693 PolarHBondContact OE1-NZ 2.9Å; E120-K693 IonicContact OE2-NZ 3.87Å
121	D	29.5	Very low	33	Very low	120 Å²	120	142.8 Å²	142.8	64%	0.642	74%	0.741	S	S	*	*			trans	-81.9	67.6	-174.3	-59.8	-38.5	0	0	0	112.4	N119	N119-D121 HydrophobicContact CB-CB 4.48Å; N119-D121 PolarHBondContact ND2-OD2 3.33Å; N119-D121 PolarHBondContact O-N 3.13Å
122	S	31.7	Very low	33.3	Very low	110 Å²	110	139.9 Å²	139.9	77%	0.769	73%	0.731	S	S	*	*	S	Bend	trans	-143.3	45.8	173.6	51.9	0	0	0	0	114.1	E120	E120-S122 VanDerWaalsContact C-N 3.33Å; E120-S122 PolarHBondContact O-N 3.42Å
123	N	33.6	Very low	33.7	Very low	130 Å²	130	144.4 Å²	144.4	70%	0.695	74%	0.737	S	S	*	*	S	Bend	trans	-152.2	10.9	163.6	-148.1	44.1	0	0	0	117
124	E	33.2	Very low	34.3	Very low	169 Å²	169	140.5 Å²	140.5	79%	0.79	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-82.6	-7.6	-174.3	-63	-150	140.6	0	0	115.6	E126	E124-E126 VanDerWaalsContact C-N 3.25Å; E124-E126 PolarHBondContact O-N 3.41Å
125	E	36.2	Very low	34.6	Very low	183 Å²	183	137 Å²	137	86%	0.855	72%	0.716	S	S	*	*	G	3₁₀ helix	trans	-72.9	-5.7	-175.4	-66.3	-151.3	151.4	0	0	115.4
126	E	37.9	Very low	35.3	Very low	155 Å²	155	140.3 Å²	140.3	72%	0.724	72%	0.723	S	S	*	*	G	3₁₀ helix	trans	-101	-8.8	-178.7	-68	-158.8	158.4	0	0	115.9	E124	E124-E126 VanDerWaalsContact C-N 3.25Å; E124-E126 PolarHBondContact O-N 3.41Å
127	E	35.8	Very low	35.8	Very low	130 Å²	130	143.8 Å²	143.8	61%	0.607	72%	0.722	S	S	*	*	S	Bend	trans	-99.7	-6.8	-174.1	-62.4	-144.1	154	0	0	116.4	S129	E127-S129 PolarHBondContact O-N 3.45Å
128	E	35.8	Very low	36.1	Very low	150 Å²	150	147 Å²	147	70%	0.701	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	10	-179.6	-113.3	-166.4	172.5	0	0	115.1	K199	E128-K199 IonicContact OE1-NZ 2.75Å; E128-K199 PolarHBondContact OE1-NZ 2.89Å
129	S	35.3	Very low	36.4	Very low	104 Å²	104	149.1 Å²	149.1	73%	0.727	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.2	-11.1	-163.7	-170.1	0	0	0	0	117.8	E127	E127-S129 PolarHBondContact O-N 3.45Å
130	E	37.2	Very low	36.5	Very low	173 Å²	173	149.4 Å²	149.4	81%	0.808	75%	0.753	S	S	*	*	S	Bend	trans	-99.7	1.5	-167.4	-70.4	-158.3	144.7	0	0	116.1
131	N	35.5	Very low	36.4	Very low	129 Å²	129	150.7 Å²	150.7	69%	0.69	76%	0.759	S	S	*	*	S	Bend	trans	-132.1	24.5	-157.5	-119.9	105.3	0	0	0	117.2
132	D	41	Very low	36.8	Very low	116 Å²	116	150.6 Å²	150.6	62%	0.62	77%	0.765	S	S	*	*			trans	-145.6	64.8	174.1	-157.1	28.8	0	0	0	114.2	E134	D132-E134 VanDerWaalsContact C-N 3.32Å; D132-E134 PolarHBondContact O-N 2.87Å
133	W	40.4	Very low	36.9	Very low	256 Å²	256	152 Å²	152	97%	0.97	77%	0.768	S	S	*	*			trans	-86.4	74.8	161.6	-74.3	99.1	0	0	0	109.3
134	E	44.3	Very low	37	Very low	127 Å²	127	153.7 Å²	153.7	59%	0.593	78%	0.777	S	S	*	*			trans	-83.1	139.9	171.2	-162.1	162.2	-130.1	0	0	111.2	D132 V136	D132-E134 VanDerWaalsContact C-N 3.32Å; D132-E134 PolarHBondContact O-N 2.87Å; E134-V136 PolarHBondContact O-N 2.81Å
135	E	37.2	Very low	37	Very low	170 Å²	170	148.5 Å²	148.5	79%	0.794	77%	0.768	S	S	*	*			trans	-60.8	121	-171.7	-165.7	163.5	-163.9	0	0	110.7	E137	E135-E137 PolarHBondContact O-N 3.34Å
136	V	43.3	Very low	36.9	Very low	132 Å²	132	147.9 Å²	147.9	80%	0.8	77%	0.771	S	S	*	*			trans	-67.4	106	174.3	176	0	0	0	0	107.6	E134 E138	E134-V136 PolarHBondContact O-N 2.81Å; V136-E138 PolarHBondContact O-N 2.7Å
137	E	39.8	Very low	37	Very low	176 Å²	176	147.2 Å²	147.2	82%	0.822	78%	0.777	S	S	*	*			trans	-59.5	107.3	170.8	-164.6	169.7	-146.1	0	0	107.7	E135 L139	E135-E137 PolarHBondContact O-N 3.34Å; E137-L139 PolarHBondContact O-N 2.69Å
138	E	33.5	Very low	36.9	Very low	181 Å²	181	150.9 Å²	150.9	85%	0.846	79%	0.785	S	S	*	*			trans	-60.2	100.3	-178.9	-71.4	179.5	150.5	0	0	108.9	V136 S140	V136-E138 PolarHBondContact O-N 2.7Å; E138-S140 PolarHBondContact O-N 3.35Å; E138-S140 VanDerWaalsContact O-N 3.11Å
139	L	39.3	Very low	36.8	Very low	165 Å²	165	150.3 Å²	150.3	86%	0.864	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-58.6	119.9	175.5	-78.4	174.8	0	0	0	108.6	E137 E141	E137-L139 PolarHBondContact O-N 2.69Å; L139-E141 PolarHBondContact O-N 2.59Å
140	S	31.6	Very low	36.7	Very low	116 Å²	116	150.4 Å²	150.4	81%	0.811	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-52.7	122.6	-169.3	-44.4	0	0	0	0	111.5	E138	E138-S140 PolarHBondContact O-N 3.35Å; E138-S140 VanDerWaalsContact O-N 3.11Å
141	E	32.1	Very low	36.6	Very low	172 Å²	172	148.6 Å²	148.6	80%	0.804	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-54.9	135.3	170.7	-64.7	-176.2	141.1	0	0	109.6	L139 V143	L139-E141 PolarHBondContact O-N 2.59Å; E141-V143 PolarHBondContact O-N 3.39Å
142	P	37.4	Very low	36.7	Very low	118 Å²	118	147.2 Å²	147.2	77%	0.766	79%	0.791	S	S	*	*			trans	-69.1	105.2	172.4	28.4	-31.9	0	0	0	108.4	L144	P142-L144 PolarHBondContact O-N 3.03Å
143	V	33.6	Very low	36.4	Very low	139 Å²	139	151.7 Å²	151.7	84%	0.842	81%	0.805	S	S	*	*			trans	-60.2	96.8	172.6	177.8	0	0	0	0	108.9	E141 G145	E141-V143 PolarHBondContact O-N 3.39Å; V143-G145 VanDerWaalsContact C-N 3.33Å; V143-G145 PolarHBondContact O-N 3.26Å
144	L	37.4	Very low	36.4	Very low	167 Å²	167	145.6 Å²	145.6	87%	0.874	80%	0.801	S	S	*	*			trans	-71.3	93.5	163.8	-77.2	171.8	0	0	0	107.6	P142 D146	P142-L144 PolarHBondContact O-N 3.03Å; L144-D146 PolarHBondContact O-N 2.74Å
145	G	32.5	Very low	36.2	Very low	59 Å²	59	150.4 Å²	150.4	61%	0.608	81%	0.814	S	S	*	*			trans	-69.3	120.5	173.8	0	0	0	0	0	111	V143 V147	V143-G145 VanDerWaalsContact C-N 3.33Å; V143-G145 PolarHBondContact O-N 3.26Å; G145-V147 PolarHBondContact O-N 3.14Å; G145-V147 VanDerWaalsContact O-N 3.17Å
146	D	34.8	Very low	36.2	Very low	170 Å²	170	146.7 Å²	146.7	91%	0.909	81%	0.807	S	S	*	*			trans	-57.5	113.7	167.6	-99.1	-36.7	0	0	0	110.2	L144	L144-D146 PolarHBondContact O-N 2.74Å
147	V	38.1	Very low	36.3	Very low	142 Å²	142	148.7 Å²	148.7	86%	0.861	81%	0.812	S	S	*	*			trans	-99.2	97.6	166.5	177.7	0	0	0	0	108.1	G145	G145-V147 PolarHBondContact O-N 3.14Å; G145-V147 VanDerWaalsContact O-N 3.17Å
148	R	34.2	Very low	36.5	Very low	206 Å²	206	148 Å²	148	78%	0.777	81%	0.814	S	S	*	*			trans	-85.5	122.3	175.7	-175.6	175.4	173.8	166	4.7	110.9
149	E	34	Very low	37.4	Very low	139 Å²	139	145 Å²	145	65%	0.65	81%	0.809	S	S	*	*			trans	45.5	108.9	155	-61.6	173.7	133.4	0	0	118.5
150	S	33.5	Very low	38	Very low	105 Å²	105	143.8 Å²	143.8	73%	0.734	81%	0.809	S	S	*	*				176	141.2	100.6	-78.2	0	0	0	0	115.1
151	T	34.7	Very low	39.4	Very low	136 Å²	136	146.8 Å²	146.8	83%	0.834	81%	0.807	S	S	*	*			trans	51.1	104.3	147.7	58.6	0	0	0	0	120.3
152	A	37.8	Very low	40.6	Very low	100 Å²	100	144 Å²	144	83%	0.826	80%	0.804	S	S	*	*				179.3	136.7	100.8	0	0	0	0	0	112.4
153	F	35.3	Very low	41.7	Very low	209 Å²	209	144.5 Å²	144.5	92%	0.917	80%	0.804	S	S	*	*			trans	-72.6	145.8	-173.7	-83.5	-113.5	0	0	0	114.6
154	S	39.7	Very low	43.3	Very low	128 Å²	128	146.1 Å²	146.1	90%	0.895	80%	0.803	S	S	*	*			trans	-152.4	62.6	155.4	-77.9	0	0	0	0	113.5
155	R	40.9	Very low	44.7	Very low	228 Å²	228	144.9 Å²	144.9	86%	0.86	80%	0.796	S	S	*	*			trans	43.2	81.9	141.2	-156.9	170.2	-174.6	164.1	-0.1	120.5
156	S	37.6	Very low	46.5	Very low	92 Å²	92	151 Å²	151	64%	0.643	81%	0.809	S	S	*	*				40.3	115.3	127.3	65.5	0	0	0	0	121.9
157	L	44	Very low	48.2	Very low	174 Å²	174	150 Å²	150	91%	0.911	80%	0.802	S	S	*	*			trans	-136.4	121.9	134.9	-73.8	178.3	0	0	0	108.4
158	L	44.2	Very low	49.6	Very low	163 Å²	163	147.2 Å²	147.2	85%	0.853	78%	0.779	S	S	*	*			trans	-97.7	124.9	-178.7	-70.7	171.4	0	0	0	111.3
159	P	52.1	Low	51.7	Low	116 Å²	116	140.7 Å²	140.7	75%	0.753	76%	0.762	S	S	*	*			trans	-93.5	109.2	159.8	3.7	16.5	0	0	0	109.4	K161	P159-K161 PolarHBondContact O-N 3.28Å; P159-K161 VanDerWaalsContact O-N 3.1Å
160	V	51.8	Low	53.8	Low	141 Å²	141	138.6 Å²	138.6	86%	0.855	76%	0.761	S	S	*	*			trans	-69.9	104.1	172	178.9	0	0	0	0	109.1
161	K	61.9	Low	56	Low	179 Å²	179	141.1 Å²	141.1	78%	0.778	76%	0.761	S	S	*	*			trans	-135.5	135.7	162.2	-72.6	-169	176	-175.1	0	109.2	P159	P159-K161 PolarHBondContact O-N 3.28Å; P159-K161 VanDerWaalsContact O-N 3.1Å
162	P	57.7	Low	58.1	Low	113 Å²	113	139.7 Å²	139.7	73%	0.734	75%	0.745	S	S	*	*			trans	-64.4	139.3	178.6	27.9	-34.1	0	0	0	110.3	E164	P162-E164 PolarHBondContact O-N 2.97Å
163	V	59.8	Low	60	Low	128 Å²	128	136.3 Å²	136.3	78%	0.776	72%	0.717	S	S	*	*			trans	-79.7	102.9	171.5	179	0	0	0	0	107.7	I165	V163-I165 HydrophobicContact CG1-CG1 4.08Å; V163-I165 PolarHBondContact O-N 3.06Å
164	E	68.3	Low	62.3	Low	174 Å²	174	132.1 Å²	132.1	81%	0.813	70%	0.698	S	S	*	*			trans	-71.3	106.9	169.7	-70.5	177.1	171.4	0	0	108.9	P162 E166	P162-E164 PolarHBondContact O-N 2.97Å; E164-E166 PolarHBondContact O-N 2.96Å
165	I	66.5	Low	64.3	Low	141 Å²	141	130.3 Å²	130.3	72%	0.723	68%	0.682	S	S	*	*			trans	-89.2	94.5	172.2	-56.4	175.9	0	0	0	107.1	V163 I167	V163-I165 HydrophobicContact CG1-CG1 4.08Å; V163-I165 PolarHBondContact O-N 3.06Å; I165-I167 HydrophobicContact CG2-CG1 4.38Å; I165-I167 PolarHBondContact O-N 3.26Å; I165-I167 VanDerWaalsContact O-N 3.08Å
166	E	69.5	Low	66.3	Low	188 Å²	188	125.6 Å²	125.6	88%	0.879	66%	0.664	S	S	*	*			trans	-66.4	105.7	169	-77.6	-164.4	135.5	0	0	109.8	E164 E168	E164-E166 PolarHBondContact O-N 2.96Å; E166-E168 PolarHBondContact O-N 3.34Å
167	I	70	Confident	68.5	Low	149 Å²	149	127.1 Å²	127.1	76%	0.764	66%	0.661	S	S	*	*			trans	-78.3	105.5	171.5	-58.8	175.6	0	0	0	107.6	I165 T169	I165-I167 HydrophobicContact CG2-CG1 4.38Å; I165-I167 PolarHBondContact O-N 3.26Å; I165-I167 VanDerWaalsContact O-N 3.08Å; I167-T169 PolarHBondContact O-N 3.36Å
168	E	68.5	Low	70.4	Confident	83 Å²	83	127 Å²	127	39%	0.388	65%	0.648	S	S	.	*			trans	-55.3	121.3	-178.7	-170.2	170.2	-176.3	0	0	110.8	E166 Q172 A173 R176	E166-E168 PolarHBondContact O-N 3.34Å; E168-Q172 HydrophobicContact CG-CB 3.76Å; E168-A173 HydrophobicContact CG-CB 4.3Å; E168-A173 WeakPolarHBondContact OE1-CA 3.42Å; E168-A173 PolarHBondContact OE1-N 3.34Å; E168-R176 VanDerWaalsContact OE1-CD 3.32Å; E168-R176 WeakPolarHBondContact OE1-CD 3.24Å; E168-R176 IonicContact OE2-NH1 2.66Å; E168-R176 PolarHBondContact OE2-NH1 3.37Å; E168-R176 VanDerWaalsContact OE2-NH1 3.09Å
169	T	77.6	Confident	72.2	Confident	68 Å²	68	121.4 Å²	121.4	42%	0.417	62%	0.623	S	S	.	*			trans	-67.3	150.5	-179.1	60.8	0	0	0	0	110.9	I167 E171 Q172 A173	I167-T169 PolarHBondContact O-N 3.36Å; T169-E171 PolarHBondContact O-N 3.22Å; T169-Q172 WeakPolarHBondContact O-CA 3.27Å; T169-Q172 WeakPolarHBondContact O-CB 3.36Å; T169-Q172 PolarHBondContact O-N 3.38Å; T169-Q172 VanDerWaalsContact OG1-CG 3.31Å; T169-Q172 WeakPolarHBondContact OG1-CG 3.32Å; T169-Q172 PolarHBondContact OG1-OE1 3.47Å; T169-A173 PolarHBondContact O-N 2.8Å
170	P	79.4	Confident	73.9	Confident	95 Å²	95	120.1 Å²	120.1	62%	0.617	61%	0.607	S	S	*	*	H	α-helix	trans	-63.6	-14.1	-177.3	25.1	-35.6	0	0	0	114.3	K174	P170-K174 WeakPolarHBondContact O-CD 3.22Å; P170-K174 VanDerWaalsContact O-CG 3.26Å; P170-K174 WeakPolarHBondContact O-CG 3.38Å; P170-K174 PolarHBondContact O-N 2.84Å
171	E	78.7	Confident	75.6	Confident	158 Å²	158	119.5 Å²	119.5	74%	0.738	59%	0.593	S	S	*	*	H	α-helix	trans	-83.5	-36.8	170.3	-61.4	-162.8	152.7	0	0	112.6	T169 T175	T169-E171 PolarHBondContact O-N 3.22Å; E171-T175 WeakPolarHBondContact O-CB 3.46Å; E171-T175 PolarHBondContact O-N 3.09Å; E171-T175 VanDerWaalsContact O-N 3.08Å; E171-T175 PolarHBondContact O-OG1 3.08Å
172	Q	78.4	Confident	76.7	Confident	106 Å²	106	116.2 Å²	116.2	50%	0.495	58%	0.583	S	S	.	*	H	α-helix	trans	-65.1	-49	172.4	-74.4	164.1	-42.1	0	0	110.2	E168 T169 K174 T175 R176	E168-Q172 HydrophobicContact CG-CB 3.76Å; T169-Q172 WeakPolarHBondContact O-CA 3.27Å; T169-Q172 WeakPolarHBondContact O-CB 3.36Å; T169-Q172 PolarHBondContact O-N 3.38Å; T169-Q172 VanDerWaalsContact OG1-CG 3.31Å; T169-Q172 WeakPolarHBondContact OG1-CG 3.32Å; T169-Q172 PolarHBondContact OG1-OE1 3.47Å; Q172-K174 PolarHBondContact O-N 3.42Å; Q172-T175 CarbonylContact O-C 3.54Å; Q172-T175 WeakPolarHBondContact O-CA 3.46Å; Q172-T175 WeakPolarHBondContact O-CB 3.36Å; Q172-T175 PolarHBondContact O-N 2.93Å; Q172-R176 WeakPolarHBondContact O-CB 3.48Å; Q172-R176 PolarHBondContact O-N 3.47Å
173	A	78.5	Confident	78	Confident	29 Å²	29	117.6 Å²	117.6	24%	0.24	58%	0.577	C	S	.	*	H	α-helix	trans	-54.4	-49.4	177	0	0	0	0	0	112.1	E168 T169 T175 R176 E177	E168-A173 HydrophobicContact CG-CB 4.3Å; E168-A173 WeakPolarHBondContact OE1-CA 3.42Å; E168-A173 PolarHBondContact OE1-N 3.34Å; T169-A173 PolarHBondContact O-N 2.8Å; A173-T175 VanDerWaalsContact C-N 3.27Å; A173-T175 PolarHBondContact O-N 3.49Å; A173-R176 WeakPolarHBondContact O-CB 3.37Å; A173-R176 PolarHBondContact O-N 3.37Å; A173-E177 WeakPolarHBondContact O-CB 3.35Å; A173-E177 WeakPolarHBondContact O-CG 3.48Å; A173-E177 PolarHBondContact O-N 2.94Å
174	K	82.8	Confident	79.4	Confident	121 Å²	121	116.5 Å²	116.5	53%	0.526	57%	0.566	S	S	.	*	H	α-helix	trans	-62.4	-30.9	175.1	-74.1	172.1	-173.9	170	0	113.7	P170 Q172 R178	P170-K174 WeakPolarHBondContact O-CD 3.22Å; P170-K174 VanDerWaalsContact O-CG 3.26Å; P170-K174 WeakPolarHBondContact O-CG 3.38Å; P170-K174 PolarHBondContact O-N 2.84Å; Q172-K174 PolarHBondContact O-N 3.42Å; K174-R178 WeakPolarHBondContact O-CB 3.17Å; K174-R178 VanDerWaalsContact O-CD 3.31Å; K174-R178 WeakPolarHBondContact O-CD 3.21Å; K174-R178 WeakPolarHBondContact O-CG 3.4Å; K174-R178 PolarHBondContact O-N 3.33Å
175	T	83	Confident	80.2	Confident	90 Å²	90	112.7 Å²	112.7	55%	0.552	55%	0.548	S	S	*	.	H	α-helix	trans	-76.1	-39.1	177.6	-58.6	0	0	0	0	110.8	E171 Q172 A173 R178 S179	E171-T175 WeakPolarHBondContact O-CB 3.46Å; E171-T175 PolarHBondContact O-N 3.09Å; E171-T175 VanDerWaalsContact O-N 3.08Å; E171-T175 PolarHBondContact O-OG1 3.08Å; Q172-T175 CarbonylContact O-C 3.54Å; Q172-T175 WeakPolarHBondContact O-CA 3.46Å; Q172-T175 WeakPolarHBondContact O-CB 3.36Å; Q172-T175 PolarHBondContact O-N 2.93Å; A173-T175 VanDerWaalsContact C-N 3.27Å; A173-T175 PolarHBondContact O-N 3.49Å; T175-R178 PolarHBondContact O-N 2.98Å; T175-S179 PolarHBondContact O-N 2.94Å
176	R	82.5	Confident	81.2	Confident	129 Å²	129	111.9 Å²	111.9	49%	0.487	54%	0.54	S	S	.	.	H	α-helix	trans	-62.7	-53.6	172.8	178.8	179.8	172.1	-176.4	-1.6	111.2	E168 Q172 A173 R178 S179 E180	E168-R176 VanDerWaalsContact OE1-CD 3.32Å; E168-R176 WeakPolarHBondContact OE1-CD 3.24Å; E168-R176 IonicContact OE2-NH1 2.66Å; E168-R176 PolarHBondContact OE2-NH1 3.37Å; E168-R176 VanDerWaalsContact OE2-NH1 3.09Å; Q172-R176 WeakPolarHBondContact O-CB 3.48Å; Q172-R176 PolarHBondContact O-N 3.47Å; A173-R176 WeakPolarHBondContact O-CB 3.37Å; A173-R176 PolarHBondContact O-N 3.37Å; R176-R178 VanDerWaalsContact C-N 3.28Å; R176-R178 PolarHBondContact O-N 2.7Å; R176-S179 CarbonylContact O-C 3.54Å; R176-S179 WeakPolarHBondContact O-CA 3.33Å; R176-S179 WeakPolarHBondContact O-CB 3.4Å; R176-S179 PolarHBondContact O-N 2.94Å; R176-S179 PolarHBondContact O-OG 2.9Å; R176-E180 HydrophobicContact CG-CG 4.38Å; R176-E180 WeakPolarHBondContact CG-OE1 3.49Å; R176-E180 IonicContact CZ-OE1 2.84Å; R176-E180 IonicContact NE-OE1 3.09Å; R176-E180 PolarHBondContact NE-OE1 3.29Å; R176-E180 IonicContact NH2-OE1 2.96Å; R176-E180 WeakPolarHBondContact O-CG 3.48Å; R176-E180 PolarHBondContact O-N 3.43Å
177	E	83	Confident	82.1	Confident	124 Å²	124	107.1 Å²	107.1	58%	0.579	52%	0.518	S	S	*	.	H	α-helix	trans	-50.7	-46.1	173.6	-76.1	173	176.7	0	0	111.7	A173 S179 E180 K181	A173-E177 WeakPolarHBondContact O-CB 3.35Å; A173-E177 WeakPolarHBondContact O-CG 3.48Å; A173-E177 PolarHBondContact O-N 2.94Å; E177-S179 PolarHBondContact O-N 3.16Å; E177-E180 PolarHBondContact O-N 2.83Å; E177-K181 VanDerWaalsContact O-CB 3.24Å; E177-K181 WeakPolarHBondContact O-CB 3.37Å; E177-K181 PolarHBondContact O-N 3.46Å
178	R	83.5	Confident	83.1	Confident	172 Å²	172	102 Å²	102	65%	0.649	49%	0.493	S	S	*	.	H	α-helix	trans	-62	-42.5	175	-75.4	167.8	-177.2	-174.1	0.2	112	K174 T175 R176 K181 I182	K174-R178 WeakPolarHBondContact O-CB 3.17Å; K174-R178 VanDerWaalsContact O-CD 3.31Å; K174-R178 WeakPolarHBondContact O-CD 3.21Å; K174-R178 WeakPolarHBondContact O-CG 3.4Å; K174-R178 PolarHBondContact O-N 3.33Å; T175-R178 PolarHBondContact O-N 2.98Å; R176-R178 VanDerWaalsContact C-N 3.28Å; R176-R178 PolarHBondContact O-N 2.7Å; R178-K181 PolarHBondContact O-N 3.26Å; R178-I182 WeakPolarHBondContact O-CB 3.29Å; R178-I182 WeakPolarHBondContact O-CD1 3.48Å; R178-I182 VanDerWaalsContact O-CG1 3.25Å; R178-I182 WeakPolarHBondContact O-CG1 3.32Å; R178-I182 PolarHBondContact O-N 3.17Å
179	S	83	Confident	84	Confident	46 Å²	46	104.4 Å²	104.4	32%	0.322	50%	0.5	S	S	.	.	H	α-helix	trans	-68.2	-36.9	179	82.7	0	0	0	0	112.6	T175 R176 E177 K183	T175-S179 PolarHBondContact O-N 2.94Å; R176-S179 CarbonylContact O-C 3.54Å; R176-S179 WeakPolarHBondContact O-CA 3.33Å; R176-S179 WeakPolarHBondContact O-CB 3.4Å; R176-S179 PolarHBondContact O-N 2.94Å; R176-S179 PolarHBondContact O-OG 2.9Å; E177-S179 PolarHBondContact O-N 3.16Å; S179-K183 WeakPolarHBondContact O-CB 3.3Å; S179-K183 VanDerWaalsContact O-CG 3.24Å; S179-K183 WeakPolarHBondContact O-CG 3.16Å; S179-K183 PolarHBondContact O-N 3.28Å
180	E	87.2	Confident	84.5	Confident	89 Å²	89	105.3 Å²	105.3	42%	0.416	50%	0.501	S	S	.	.	H	α-helix	trans	-70.5	-41.5	175.8	-71.4	172.8	177.1	0	0	110.4	R176 E177 K183 L184	R176-E180 HydrophobicContact CG-CG 4.38Å; R176-E180 WeakPolarHBondContact CG-OE1 3.49Å; R176-E180 IonicContact CZ-OE1 2.84Å; R176-E180 IonicContact NE-OE1 3.09Å; R176-E180 PolarHBondContact NE-OE1 3.29Å; R176-E180 IonicContact NH2-OE1 2.96Å; R176-E180 WeakPolarHBondContact O-CG 3.48Å; R176-E180 PolarHBondContact O-N 3.43Å; E177-E180 PolarHBondContact O-N 2.83Å; E180-K183 WeakPolarHBondContact O-CB 3.37Å; E180-K183 PolarHBondContact O-N 3.39Å; E180-L184 WeakPolarHBondContact O-CB 3.46Å; E180-L184 PolarHBondContact O-N 3.34Å
181	K	88.1	Confident	85	Confident	128 Å²	128	107 Å²	107	56%	0.557	50%	0.496	S	S	*	.	H	α-helix	trans	-60.9	-44.8	171.3	-171.8	172.1	-168.8	-79.7	0	112.4	E177 R178 L184 E185	E177-K181 VanDerWaalsContact O-CB 3.24Å; E177-K181 WeakPolarHBondContact O-CB 3.37Å; E177-K181 PolarHBondContact O-N 3.46Å; R178-K181 PolarHBondContact O-N 3.26Å; K181-L184 PolarHBondContact O-N 3.47Å; K181-E185 IonicContact NZ-OE1 3.54Å; K181-E185 PolarHBondContact NZ-OE1 3.46Å; K181-E185 WeakPolarHBondContact O-CB 3.3Å; K181-E185 WeakPolarHBondContact O-CG 3.39Å; K181-E185 PolarHBondContact O-N 3.35Å
182	I	84.9	Confident	85.5	Confident	110 Å²	110	106.4 Å²	106.4	56%	0.564	49%	0.487	S	S	*	.	H	α-helix	trans	-63.3	-41	175.3	-72.3	159.8	0	0	0	111	R178 E185 F186	R178-I182 WeakPolarHBondContact O-CB 3.29Å; R178-I182 WeakPolarHBondContact O-CD1 3.48Å; R178-I182 VanDerWaalsContact O-CG1 3.25Å; R178-I182 WeakPolarHBondContact O-CG1 3.32Å; R178-I182 PolarHBondContact O-N 3.17Å; I182-E185 PolarHBondContact O-N 3.03Å; I182-F186 VanDerWaalsContact O-CB 3.27Å; I182-F186 WeakPolarHBondContact O-CB 3.45Å; I182-F186 PolarHBondContact O-N 3.22Å
183	K	85.8	Confident	86	Confident	141 Å²	141	103.1 Å²	103.1	61%	0.613	48%	0.477	S	S	*	.	H	α-helix	trans	-61.6	-44.1	174.2	-75.2	167	-177.8	173.5	0	111.6	S179 E180 F186 E187	S179-K183 WeakPolarHBondContact O-CB 3.3Å; S179-K183 VanDerWaalsContact O-CG 3.24Å; S179-K183 WeakPolarHBondContact O-CG 3.16Å; S179-K183 PolarHBondContact O-N 3.28Å; E180-K183 WeakPolarHBondContact O-CB 3.37Å; E180-K183 PolarHBondContact O-N 3.39Å; K183-F186 PolarHBondContact O-N 3.01Å; K183-E187 WeakPolarHBondContact O-CB 3.45Å; K183-E187 PolarHBondContact O-N 3.33Å
184	L	87.8	Confident	86.5	Confident	106 Å²	106	106.8 Å²	106.8	56%	0.555	49%	0.491	S	S	*	.	H	α-helix	trans	-66.1	-42.3	177.8	-165.6	87.3	0	0	0	112	E180 K181 F186 E187 T188	E180-L184 WeakPolarHBondContact O-CB 3.46Å; E180-L184 PolarHBondContact O-N 3.34Å; K181-L184 PolarHBondContact O-N 3.47Å; L184-F186 VanDerWaalsContact C-N 3.34Å; L184-E187 PolarHBondContact O-N 3.09Å; L184-T188 WeakPolarHBondContact O-CB 3.5Å; L184-T188 VanDerWaalsContact O-CG2 3.3Å; L184-T188 WeakPolarHBondContact O-CG2 3.4Å; L184-T188 PolarHBondContact O-N 2.78Å; L184-T188 PolarHBondContact O-OG1 2.71Å
185	E	86.6	Confident	86.8	Confident	93 Å²	93	107.6 Å²	107.6	44%	0.435	50%	0.495	S	S	.	.	H	α-helix	trans	-62.7	-40.5	174.2	-76.2	172.6	-176.8	0	0	111.2	K181 I182 T188 Y189	K181-E185 IonicContact NZ-OE1 3.54Å; K181-E185 PolarHBondContact NZ-OE1 3.46Å; K181-E185 WeakPolarHBondContact O-CB 3.3Å; K181-E185 WeakPolarHBondContact O-CG 3.39Å; K181-E185 PolarHBondContact O-N 3.35Å; I182-E185 PolarHBondContact O-N 3.03Å; E185-T188 WeakPolarHBondContact CA-OG1 3.13Å; E185-T188 PolarHBondContact O-OG1 3.5Å; E185-T188 VanDerWaalsContact O-OG1 3.09Å; E185-Y189 VanDerWaalsContact O-CB 3.29Å; E185-Y189 WeakPolarHBondContact O-CB 3.3Å; E185-Y189 PolarHBondContact O-N 3.29Å
186	F	86.3	Confident	87.2	Confident	125 Å²	125	110.8 Å²	110.8	55%	0.548	50%	0.497	S	S	.	.	H	α-helix	trans	-69.5	-42.9	175.5	-175.4	-108.7	0	0	0	112.8	I182 K183 L184 Y189 L190	I182-F186 VanDerWaalsContact O-CB 3.27Å; I182-F186 WeakPolarHBondContact O-CB 3.45Å; I182-F186 PolarHBondContact O-N 3.22Å; K183-F186 PolarHBondContact O-N 3.01Å; L184-F186 VanDerWaalsContact C-N 3.34Å; F186-Y189 WeakPolarHBondContact O-CB 3.47Å; F186-Y189 PolarHBondContact O-N 3.17Å; F186-L190 HydrophobicContact CD1-CD1 4Å; F186-L190 HydrophobicContact CD1-CG 4.48Å; F186-L190 HydrophobicContact CE1-CD1 3.51Å; F186-L190 HydrophobicContact CE1-CG 4.15Å; F186-L190 HydrophobicContact CZ-CD1 3.92Å; F186-L190 HydrophobicContact CZ-CD2 4.33Å; F186-L190 HydrophobicContact CZ-CG 4.18Å; F186-L190 WeakPolarHBondContact O-CG 3.38Å; F186-L190 PolarHBondContact O-N 2.81Å
187	E	89.5	Confident	87.6	Confident	88 Å²	88	111 Å²	111	41%	0.411	50%	0.501	S	S	.	.	H	α-helix	trans	-66.8	-38.8	177.4	-163.9	-166.7	169.9	0	0	111.6	K183 L184 L190 R191	K183-E187 WeakPolarHBondContact O-CB 3.45Å; K183-E187 PolarHBondContact O-N 3.33Å; L184-E187 PolarHBondContact O-N 3.09Å; E187-L190 PolarHBondContact O-N 3.28Å; E187-R191 PolarHBondContact O-N 2.87Å; E187-R191 IonicContact OE1-CZ 3.44Å; E187-R191 IonicContact OE1-NH1 2.66Å; E187-R191 PolarHBondContact OE1-NH1 3.38Å; E187-R191 IonicContact OE1-NH2 2.82Å; E187-R191 PolarHBondContact OE1-NH2 2.98Å; E187-R191 IonicContact OE2-NH2 3.3Å; E187-R191 PolarHBondContact OE2-NH2 3.21Å
188	T	89.3	Confident	88	Confident	40 Å²	40	109 Å²	109	25%	0.245	50%	0.495	C	S	.	.	H	α-helix	trans	-70.3	-34.4	173.2	55.7	0	0	0	0	112.4	L184 E185 R191 R192	L184-T188 WeakPolarHBondContact O-CB 3.5Å; L184-T188 VanDerWaalsContact O-CG2 3.3Å; L184-T188 WeakPolarHBondContact O-CG2 3.4Å; L184-T188 PolarHBondContact O-N 2.78Å; L184-T188 PolarHBondContact O-OG1 2.71Å; E185-T188 WeakPolarHBondContact CA-OG1 3.13Å; E185-T188 PolarHBondContact O-OG1 3.5Å; E185-T188 VanDerWaalsContact O-OG1 3.09Å; T188-R191 PolarHBondContact O-N 3.18Å; T188-R192 WeakPolarHBondContact O-CG 3.45Å; T188-R192 PolarHBondContact O-N 3.09Å; T188-R192 PolarHBondContact OG1-NH2 2.85Å
189	Y	87.8	Confident	88.4	Confident	134 Å²	134	105.5 Å²	105.5	53%	0.525	48%	0.484	S	S	.	.	H	α-helix	trans	-60.8	-48	168.7	171.1	-94	0	0	0	111.4	E185 F186 R191 R192 A193	E185-Y189 VanDerWaalsContact O-CB 3.29Å; E185-Y189 WeakPolarHBondContact O-CB 3.3Å; E185-Y189 PolarHBondContact O-N 3.29Å; F186-Y189 WeakPolarHBondContact O-CB 3.47Å; F186-Y189 PolarHBondContact O-N 3.17Å; Y189-R191 PolarHBondContact O-N 3.26Å; Y189-R192 PolarHBondContact O-N 3.04Å; Y189-A193 WeakPolarHBondContact O-CB 3.25Å; Y189-A193 PolarHBondContact O-N 3.1Å
190	L	88.5	Confident	88.8	Confident	87 Å²	87	104.5 Å²	104.5	46%	0.455	48%	0.481	S	S	.	.	H	α-helix	trans	-61.4	-41.7	176	-72.6	179.1	0	0	0	112.2	F186 E187 R192 A193 M194	F186-L190 HydrophobicContact CD1-CD1 4Å; F186-L190 HydrophobicContact CD1-CG 4.48Å; F186-L190 HydrophobicContact CE1-CD1 3.51Å; F186-L190 HydrophobicContact CE1-CG 4.15Å; F186-L190 HydrophobicContact CZ-CD1 3.92Å; F186-L190 HydrophobicContact CZ-CD2 4.33Å; F186-L190 HydrophobicContact CZ-CG 4.18Å; F186-L190 WeakPolarHBondContact O-CG 3.38Å; F186-L190 PolarHBondContact O-N 2.81Å; E187-L190 PolarHBondContact O-N 3.28Å; L190-R192 PolarHBondContact O-N 2.99Å; L190-A193 PolarHBondContact O-N 2.86Å; L190-M194 WeakPolarHBondContact O-CB 3.47Å; L190-M194 PolarHBondContact O-N 3.48Å
191	R	90.1	Very high	89.1	Confident	131 Å²	131	103.4 Å²	103.4	49%	0.494	48%	0.48	S	S	.	.	H	α-helix	trans	-60.4	-42.7	172.9	-81.2	-165.8	-95.4	-89.1	-0.1	112.1	E187 T188 Y189 K195	E187-R191 PolarHBondContact O-N 2.87Å; E187-R191 IonicContact OE1-CZ 3.44Å; E187-R191 IonicContact OE1-NH1 2.66Å; E187-R191 PolarHBondContact OE1-NH1 3.38Å; E187-R191 IonicContact OE1-NH2 2.82Å; E187-R191 PolarHBondContact OE1-NH2 2.98Å; E187-R191 IonicContact OE2-NH2 3.3Å; E187-R191 PolarHBondContact OE2-NH2 3.21Å; T188-R191 PolarHBondContact O-N 3.18Å; Y189-R191 PolarHBondContact O-N 3.26Å; R191-K195 WeakPolarHBondContact O-CB 3.13Å; R191-K195 WeakPolarHBondContact O-CG 3.48Å; R191-K195 PolarHBondContact O-N 3.41Å
192	R	88.6	Confident	89.4	Confident	145 Å²	145	100.2 Å²	100.2	55%	0.547	47%	0.467	S	S	.	.	H	α-helix	trans	-65.1	-43.9	175.3	-72.9	178.4	-128.9	150.9	6.2	111.8	T188 Y189 L190 K195 R196	T188-R192 WeakPolarHBondContact O-CG 3.45Å; T188-R192 PolarHBondContact O-N 3.09Å; T188-R192 PolarHBondContact OG1-NH2 2.85Å; Y189-R192 PolarHBondContact O-N 3.04Å; L190-R192 PolarHBondContact O-N 2.99Å; R192-K195 PolarHBondContact O-N 3.39Å; R192-R196 WeakPolarHBondContact O-CG 3.42Å; R192-R196 PolarHBondContact O-N 3.42Å
193	A	88.4	Confident	89.8	Confident	37 Å²	37	98 Å²	98	31%	0.306	45%	0.454	S	S	.	.	H	α-helix	trans	-61.3	-44.5	176.7	0	0	0	0	0	111.7	Y189 L190 R196 F197	Y189-A193 WeakPolarHBondContact O-CB 3.25Å; Y189-A193 PolarHBondContact O-N 3.1Å; L190-A193 PolarHBondContact O-N 2.86Å; A193-R196 PolarHBondContact O-N 3.02Å; A193-F197 WeakPolarHBondContact O-CB 3.13Å; A193-F197 PolarHBondContact O-N 3.32Å
194	M	89.5	Confident	90.2	Very high	107 Å²	107	95.2 Å²	95.2	53%	0.527	45%	0.446	S	S	.	.	H	α-helix	trans	-65.8	-40	175.7	-167.8	67.1	-174.3	0	0	112.3	L190 F197 N198	L190-M194 WeakPolarHBondContact O-CB 3.47Å; L190-M194 PolarHBondContact O-N 3.48Å; M194-F197 PolarHBondContact O-N 2.95Å; M194-N198 WeakPolarHBondContact O-CB 3.25Å; M194-N198 VanDerWaalsContact O-CG 3.22Å; M194-N198 PolarHBondContact O-N 3.21Å; M194-N198 PolarHBondContact O-ND2 2.94Å
195	K	90	Very high	90.6	Very high	138 Å²	138	93.2 Å²	93.2	60%	0.6	44%	0.438	S	S	*	.	H	α-helix	trans	-60.1	-46.3	172.4	-82.2	-168.7	171.9	-164.2	0	111.5	R191 R192 N198 K199	R191-K195 WeakPolarHBondContact O-CB 3.13Å; R191-K195 WeakPolarHBondContact O-CG 3.48Å; R191-K195 PolarHBondContact O-N 3.41Å; R192-K195 PolarHBondContact O-N 3.39Å; K195-N198 PolarHBondContact O-N 3.14Å; K195-K199 WeakPolarHBondContact O-CB 3.49Å; K195-K199 PolarHBondContact O-N 3.2Å
196	R	90.3	Very high	91	Very high	157 Å²	157	88.9 Å²	88.9	59%	0.592	42%	0.418	S	S	*	.	H	α-helix	trans	-61.6	-45	176.4	-72.8	174.4	-178.4	175.2	-5.3	112.2	R192 A193 K199 G200	R192-R196 WeakPolarHBondContact O-CG 3.42Å; R192-R196 PolarHBondContact O-N 3.42Å; A193-R196 PolarHBondContact O-N 3.02Å; R196-K199 WeakPolarHBondContact O-CB 3.47Å; R196-K199 PolarHBondContact O-N 3.12Å; R196-G200 PolarHBondContact O-N 3.31Å
197	F	91.7	Very high	91.4	Very high	134 Å²	134	85 Å²	85	59%	0.588	40%	0.401	S	S	*	.	H	α-helix	trans	-60.9	-47.8	176.4	-178.8	-98.3	0	0	0	111.6	A193 M194 K199 G200 V201	A193-F197 WeakPolarHBondContact O-CB 3.13Å; A193-F197 PolarHBondContact O-N 3.32Å; M194-F197 PolarHBondContact O-N 2.95Å; F197-K199 VanDerWaalsContact C-N 3.32Å; F197-K199 PolarHBondContact O-N 3.08Å; F197-G200 PolarHBondContact O-N 3.34Å; F197-V201 HydrophobicContact CD1-CG2 4.17Å; F197-V201 HydrophobicContact CE1-CG2 3.74Å; F197-V201 HydrophobicContact CE2-CG2 4.33Å; F197-V201 HydrophobicContact CZ-CG2 3.83Å; F197-V201 WeakPolarHBondContact O-CG2 3.27Å; F197-V201 PolarHBondContact O-N 3.26Å
198	N	91.7	Very high	91.8	Very high	82 Å²	82	85 Å²	85	44%	0.439	41%	0.407	S	S	.	.	H	α-helix	trans	-63.3	-36	176.8	-71.2	-12.4	0	0	0	112.6	M194 K195 H202	M194-N198 WeakPolarHBondContact O-CB 3.25Å; M194-N198 VanDerWaalsContact O-CG 3.22Å; M194-N198 PolarHBondContact O-N 3.21Å; M194-N198 PolarHBondContact O-ND2 2.94Å; K195-N198 PolarHBondContact O-N 3.14Å; N198-H202 WeakPolarHBondContact O-CB 3.44Å; N198-H202 PolarHBondContact O-N 3.01Å
199	K	90.7	Very high	92.1	Very high	97 Å²	97	86 Å²	86	42%	0.422	41%	0.408	S	S	.	.	H	α-helix	trans	-58.9	-53.2	172.8	-174.1	-169.1	176.6	-159.4	0	110.1	E128 K195 R196 F197 V201 H202 E203	E128-K199 IonicContact OE1-NZ 2.75Å; E128-K199 PolarHBondContact OE1-NZ 2.89Å; K195-K199 WeakPolarHBondContact O-CB 3.49Å; K195-K199 PolarHBondContact O-N 3.2Å; R196-K199 WeakPolarHBondContact O-CB 3.47Å; R196-K199 PolarHBondContact O-N 3.12Å; F197-K199 VanDerWaalsContact C-N 3.32Å; F197-K199 PolarHBondContact O-N 3.08Å; K199-V201 PolarHBondContact O-N 2.92Å; K199-H202 PolarHBondContact O-N 3.26Å; K199-H202 VanDerWaalsContact O-N 3.15Å; K199-E203 WeakPolarHBondContact CE-OE1 3.44Å; K199-E203 IonicContact NZ-OE1 3.2Å; K199-E203 WeakPolarHBondContact O-CG 3.35Å; K199-E203 PolarHBondContact O-N 3.45Å
200	G	92	Very high	92.5	Very high	25 Å²	25	79.6 Å²	79.6	26%	0.258	38%	0.383	S	S	.	.	H	α-helix	trans	-58.4	-46.2	177.4	0	0	0	0	0	113.4	R196 F197 H202 E203 D204	R196-G200 PolarHBondContact O-N 3.31Å; F197-G200 PolarHBondContact O-N 3.34Å; G200-H202 VanDerWaalsContact C-N 3.29Å; G200-H202 PolarHBondContact O-N 2.94Å; G200-E203 PolarHBondContact O-N 3.3Å; G200-D204 PolarHBondContact O-N 3.48Å
201	V	94	Very high	92.9	Very high	67 Å²	67	79 Å²	79	41%	0.406	38%	0.38	S	S	.	.	H	α-helix	trans	-60.7	-37.2	176.2	172	0	0	0	0	112.1	F197 K199 T205	F197-V201 HydrophobicContact CD1-CG2 4.17Å; F197-V201 HydrophobicContact CE1-CG2 3.74Å; F197-V201 HydrophobicContact CE2-CG2 4.33Å; F197-V201 HydrophobicContact CZ-CG2 3.83Å; F197-V201 WeakPolarHBondContact O-CG2 3.27Å; F197-V201 PolarHBondContact O-N 3.26Å; K199-V201 PolarHBondContact O-N 2.92Å; V201-T205 WeakPolarHBondContact O-CB 3.32Å; V201-T205 PolarHBondContact O-N 3.2Å; V201-T205 PolarHBondContact O-OG1 3.07Å
202	H	93.1	Very high	93.2	Very high	61 Å²	61	76.3 Å²	76.3	28%	0.282	38%	0.381	S	S	.	.	H	α-helix	trans	-70.6	-41.3	176.7	-173.8	80.9	0	0	0	112.1	N198 K199 G200 T205 H206 P323 L324	N198-H202 WeakPolarHBondContact O-CB 3.44Å; N198-H202 PolarHBondContact O-N 3.01Å; K199-H202 PolarHBondContact O-N 3.26Å; K199-H202 VanDerWaalsContact O-N 3.15Å; G200-H202 VanDerWaalsContact C-N 3.29Å; G200-H202 PolarHBondContact O-N 2.94Å; H202-T205 PolarHBondContact O-N 3.21Å; H202-H206 PolarHBondContact O-N 3.04Å; H202-P323 PolarHBondContact NE2-O 3.5Å; H202-L324 PolarHBondContact CD2-O 3.22Å; H202-L324 PolarHBondContact NE2-O 2.95Å
203	E	93.4	Very high	93.6	Very high	62 Å²	62	71.2 Å²	71.2	29%	0.29	37%	0.365	S	S	.	.	H	α-helix	trans	-61.7	-42.4	173.8	-68.2	175	-179.6	0	0	111.7	K199 G200 H206 K207 L324	K199-E203 WeakPolarHBondContact CE-OE1 3.44Å; K199-E203 IonicContact NZ-OE1 3.2Å; K199-E203 WeakPolarHBondContact O-CG 3.35Å; K199-E203 PolarHBondContact O-N 3.45Å; G200-E203 PolarHBondContact O-N 3.3Å; E203-H206 WeakPolarHBondContact O-CB 3.26Å; E203-H206 PolarHBondContact O-N 3.4Å; E203-K207 WeakPolarHBondContact O-CG 3.49Å; E203-K207 PolarHBondContact O-N 3.19Å; E203-L324 HydrophobicContact CB-CD1 4.15Å; E203-L324 HydrophobicContact CG-CD1 3.84Å
204	D	94.4	Very high	94	Very high	84 Å²	84	69.7 Å²	69.7	45%	0.449	35%	0.351	S	S	.	.	H	α-helix	trans	-69.7	-34.3	175.8	-69.9	-21	0	0	0	112.2	G200 H206 K207 V208	G200-D204 PolarHBondContact O-N 3.48Å; D204-H206 VanDerWaalsContact C-N 3.33Å; D204-H206 PolarHBondContact O-N 3.1Å; D204-K207 PolarHBondContact O-N 3.25Å; D204-K207 IonicContact OD1-NZ 3.63Å; D204-K207 PolarHBondContact OD1-NZ 3.03Å; D204-V208 WeakPolarHBondContact O-CG2 3.43Å; D204-V208 PolarHBondContact O-N 2.86Å
205	T	95.9	Very high	94.3	Very high	63 Å²	63	67.2 Å²	67.2	39%	0.387	35%	0.348	S	S	.	.	H	α-helix	trans	-63.1	-40.1	172.1	-58.4	0	0	0	0	111.3	V201 H202 H209 I322	V201-T205 WeakPolarHBondContact O-CB 3.32Å; V201-T205 PolarHBondContact O-N 3.2Å; V201-T205 PolarHBondContact O-OG1 3.07Å; H202-T205 PolarHBondContact O-N 3.21Å; T205-H209 WeakPolarHBondContact O-CB 3.33Å; T205-H209 PolarHBondContact O-N 3.31Å; T205-I322 HydrophobicContact CG2-CD1 4.01Å
206	H	95.3	Very high	94.5	Very high	3 Å²	3	63.8 Å²	63.8	1%	0.014	34%	0.336	C	S	.	.	H	α-helix	trans	-61.4	-49.2	172.5	176.3	95.7	0	0	0	111.6	H202 E203 D204 V208 H209 L210 P321 I322 L324 Y568	H202-H206 PolarHBondContact O-N 3.04Å; E203-H206 WeakPolarHBondContact O-CB 3.26Å; E203-H206 PolarHBondContact O-N 3.4Å; D204-H206 VanDerWaalsContact C-N 3.33Å; D204-H206 PolarHBondContact O-N 3.1Å; H206-V208 PolarHBondContact O-N 3.3Å; H206-H209 PolarHBondContact O-N 3.41Å; H206-L210 WeakPolarHBondContact O-CB 3.38Å; H206-L210 PolarHBondContact O-N 3.45Å; H206-P321 VanDerWaalsContact CE1-CG 3.45Å; H206-P321 WeakPolarHBondContact CE1-CG 3.29Å; H206-I322 PolarHBondContact ND1-O 2.98Å; H206-L324 HydrophobicContact CB-CD1 3.79Å; H206-Y568 AromaticContact CE1-CE2 3.78Å; H206-Y568 AromaticContact NE2-CE2 3.49Å; H206-Y568 WeakPolarHBondContact NE2-CE2 3.48Å; H206-Y568 AromaticContact NE2-CZ 3.51Å; H206-Y568 PolarHBondContact NE2-OH 3.23Å
207	K	95.6	Very high	94.7	Very high	44 Å²	44	56.3 Å²	56.3	19%	0.191	31%	0.308	C	S	.	.	H	α-helix	trans	-56.6	-49.3	177	-70.2	171.6	-161.8	159.1	0	111.9	E203 D204 H209 L210 L211 V598 W602	E203-K207 WeakPolarHBondContact O-CG 3.49Å; E203-K207 PolarHBondContact O-N 3.19Å; D204-K207 PolarHBondContact O-N 3.25Å; D204-K207 IonicContact OD1-NZ 3.63Å; D204-K207 PolarHBondContact OD1-NZ 3.03Å; K207-H209 PolarHBondContact O-N 3.08Å; K207-L210 WeakPolarHBondContact O-CB 3.24Å; K207-L210 PolarHBondContact O-N 2.94Å; K207-L211 WeakPolarHBondContact O-CG 3.26Å; K207-L211 PolarHBondContact O-N 2.78Å; K207-V598 HydrophobicContact CD-CG2 4.31Å; K207-V598 HydrophobicContact CG-CG2 3.87Å; K207-W602 HydrophobicContact CB-CH2 3.6Å; K207-W602 HydrophobicContact CB-CZ2 3.74Å; K207-W602 HydrophobicContact CB-CZ3 4.23Å; K207-W602 HydrophobicContact CD-CD2 4.17Å; K207-W602 HydrophobicContact CD-CH2 4.36Å; K207-W602 HydrophobicContact CD-CZ2 3.99Å; K207-W602 HydrophobicContact CG-CD2 4.3Å; K207-W602 HydrophobicContact CG-CE3 4.16Å; K207-W602 HydrophobicContact CG-CH2 3.69Å; K207-W602 HydrophobicContact CG-CZ2 3.82Å; K207-W602 HydrophobicContact CG-CZ3 3.86Å
208	V	96.9	Very high	94.9	Very high	87 Å²	87	51.4 Å²	51.4	53%	0.527	29%	0.286	S	S	.	.	H	α-helix	trans	-62.9	-42.2	-179.9	171.4	0	0	0	0	111.5	D204 H206 L211 C212	D204-V208 WeakPolarHBondContact O-CG2 3.43Å; D204-V208 PolarHBondContact O-N 2.86Å; H206-V208 PolarHBondContact O-N 3.3Å; V208-L211 PolarHBondContact O-N 3.12Å; V208-C212 PolarHBondContact O-N 2.83Å; V208-C212 PolarHBondContact O-SG 3.27Å
209	H	97	Very high	95.1	Very high	60 Å²	60	53.1 Å²	53.1	28%	0.278	29%	0.287	S	S	.	.	H	α-helix	trans	-64.3	-42.3	176.3	-172.6	-163.6	0	0	0	111.4	T205 H206 K207 L211 C212 L213 I322	T205-H209 WeakPolarHBondContact O-CB 3.33Å; T205-H209 PolarHBondContact O-N 3.31Å; H206-H209 PolarHBondContact O-N 3.41Å; K207-H209 PolarHBondContact O-N 3.08Å; H209-L211 VanDerWaalsContact C-N 3.34Å; H209-L211 PolarHBondContact O-N 2.86Å; H209-C212 WeakPolarHBondContact O-CB 3.44Å; H209-C212 PolarHBondContact O-N 3.24Å; H209-C212 VanDerWaalsContact O-N 3.11Å; H209-L213 WeakPolarHBondContact O-CG 3.49Å; H209-L213 PolarHBondContact O-N 3.26Å; H209-I322 HydrophobicContact CB-CD1 4.45Å; H209-I322 PolarHBondContact ND1-N 3.24Å; H209-I322 VanDerWaalsContact ND1-N 3.17Å
210	L	95.8	Very high	95.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-59.9	-41.6	176.6	-172.2	61.4	0	0	0	112.3	H206 K207 L213 L214 L319 P321 Y568 W602 W603	H206-L210 WeakPolarHBondContact O-CB 3.38Å; H206-L210 PolarHBondContact O-N 3.45Å; K207-L210 WeakPolarHBondContact O-CB 3.24Å; K207-L210 PolarHBondContact O-N 2.94Å; L210-L213 PolarHBondContact O-N 2.7Å; L210-L214 PolarHBondContact O-N 3.01Å; L210-L319 HydrophobicContact CD1-CB 3.97Å; L210-L319 HydrophobicContact CD1-CD1 3.65Å; L210-L319 HydrophobicContact CD1-CG 4.47Å; L210-P321 HydrophobicContact CB-CB 4.38Å; L210-P321 HydrophobicContact CD1-CB 4.43Å; L210-P321 HydrophobicContact CD1-CG 4.21Å; L210-Y568 HydrophobicContact CD1-CD1 4.36Å; L210-Y568 HydrophobicContact CD1-CD2 3.75Å; L210-Y568 HydrophobicContact CD1-CE2 4.14Å; L210-Y568 HydrophobicContact CD1-CG 3.87Å; L210-Y568 HydrophobicContact CD2-CD1 4.03Å; L210-Y568 HydrophobicContact CD2-CD2 4.28Å; L210-Y568 HydrophobicContact CD2-CE1 3.71Å; L210-Y568 HydrophobicContact CD2-CE2 3.98Å; L210-Y568 HydrophobicContact CD2-CG 4.3Å; L210-W602 HydrophobicContact CD2-CZ3 4.4Å; L210-W603 HydrophobicContact CD1-CH2 4.16Å; L210-W603 HydrophobicContact CD1-CZ3 4.37Å; L210-W603 HydrophobicContact CD2-CE3 3.69Å; L210-W603 HydrophobicContact CD2-CH2 3.85Å; L210-W603 HydrophobicContact CD2-CZ3 3.31Å; L210-W603 HydrophobicContact CG-CE3 4.46Å; L210-W603 HydrophobicContact CG-CH2 3.88Å; L210-W603 HydrophobicContact CG-CZ3 3.6Å
211	L	96.5	Very high	95.4	Very high	74 Å²	74	49.3 Å²	49.3	39%	0.387	26%	0.262	S	S	.	.	H	α-helix	trans	-63.3	-38.6	173.1	-69	172.6	0	0	0	112.7	K207 V208 H209 L214 A215 W602 T606	K207-L211 WeakPolarHBondContact O-CG 3.26Å; K207-L211 PolarHBondContact O-N 2.78Å; V208-L211 PolarHBondContact O-N 3.12Å; H209-L211 VanDerWaalsContact C-N 3.34Å; H209-L211 PolarHBondContact O-N 2.86Å; L211-L214 PolarHBondContact O-N 3.01Å; L211-A215 WeakPolarHBondContact O-CB 3.08Å; L211-A215 PolarHBondContact O-N 3.36Å; L211-W602 HydrophobicContact CD1-CH2 4.49Å; L211-W602 HydrophobicContact CD1-CZ2 4.29Å; L211-W602 HydrophobicContact CD2-CH2 4.41Å; L211-W602 HydrophobicContact CG-CH2 4.25Å; L211-T606 HydrophobicContact CD2-CG2 3.53Å
212	C	97.4	Very high	95.4	Very high	76 Å²	76	50.1 Å²	50.1	51%	0.514	27%	0.265	S	S	.	.	H	α-helix	trans	-66.3	-39.5	176.1	-65.2	0	0	0	0	112	V208 H209 A215 N216	V208-C212 PolarHBondContact O-N 2.83Å; V208-C212 PolarHBondContact O-SG 3.27Å; H209-C212 WeakPolarHBondContact O-CB 3.44Å; H209-C212 PolarHBondContact O-N 3.24Å; H209-C212 VanDerWaalsContact O-N 3.11Å; C212-A215 PolarHBondContact O-N 3.04Å; C212-N216 PolarHBondContact O-N 3.16Å
213	L	96.4	Very high	95.4	Very high	38 Å²	38	48.1 Å²	48.1	20%	0.199	26%	0.256	C	S	.	.	H	α-helix	trans	-65.6	-41.4	175.3	-66.8	171.6	0	0	0	111.5	H209 L210 N216 G217 L319 P321	H209-L213 WeakPolarHBondContact O-CG 3.49Å; H209-L213 PolarHBondContact O-N 3.26Å; L210-L213 PolarHBondContact O-N 2.7Å; L213-N216 WeakPolarHBondContact O-CB 3.37Å; L213-N216 PolarHBondContact O-N 3.21Å; L213-G217 PolarHBondContact O-N 3.43Å; L213-L319 HydrophobicContact CB-CB 4.33Å; L213-L319 HydrophobicContact CB-CD2 4.12Å; L213-L319 HydrophobicContact CD1-CB 4.13Å; L213-P321 HydrophobicContact CD1-CB 4.33Å
214	L	95.9	Very high	95.4	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.026	24%	0.242	C	C	.	.	H	α-helix	trans	-63.3	-41.4	173.9	-175	64.7	0	0	0	111.8	L210 L211 N216 G217 F218 V570 V578 L607	L210-L214 PolarHBondContact O-N 3.01Å; L211-L214 PolarHBondContact O-N 3.01Å; L214-N216 PolarHBondContact O-N 3.27Å; L214-G217 WeakPolarHBondContact O-CA 3.32Å; L214-G217 PolarHBondContact O-N 3Å; L214-G217 VanDerWaalsContact O-N 3.13Å; L214-F218 HydrophobicContact CD1-CE2 4.18Å; L214-F218 HydrophobicContact CD1-CZ 4.46Å; L214-F218 HydrophobicContact CD2-CE2 4.05Å; L214-F218 HydrophobicContact CG-CD2 4.16Å; L214-F218 HydrophobicContact CG-CE2 3.67Å; L214-F218 HydrophobicContact CG-CZ 4.37Å; L214-F218 VanDerWaalsContact O-CD2 3.28Å; L214-F218 WeakPolarHBondContact O-CD2 3.28Å; L214-F218 PolarHBondContact O-N 3.2Å; L214-V570 HydrophobicContact CD1-CG2 4.21Å; L214-V578 HydrophobicContact CD1-CG1 4.22Å; L214-L607 HydrophobicContact CD2-CD2 4.04Å
215	A	96	Very high	95.3	Very high	55 Å²	55	42.8 Å²	42.8	46%	0.455	23%	0.232	S	C	.	.	H	α-helix	trans	-63	-39.1	175.1	0	0	0	0	0	113.2	L211 C212 G217 F218 Y219	L211-A215 WeakPolarHBondContact O-CB 3.08Å; L211-A215 PolarHBondContact O-N 3.36Å; C212-A215 PolarHBondContact O-N 3.04Å; A215-G217 VanDerWaalsContact C-N 3.34Å; A215-F218 PolarHBondContact O-N 3.17Å; A215-Y219 PolarHBondContact O-N 2.93Å
216	N	94.7	Very high	95.2	Very high	66 Å²	66	43.2 Å²	43.2	35%	0.353	23%	0.23	S	C	.	.	H	α-helix	trans	-62.3	-41.1	170.6	175.3	38.8	0	0	0	111.2	C212 L213 L214 Y219 R220	C212-N216 PolarHBondContact O-N 3.16Å; L213-N216 WeakPolarHBondContact O-CB 3.37Å; L213-N216 PolarHBondContact O-N 3.21Å; L214-N216 PolarHBondContact O-N 3.27Å; N216-Y219 WeakPolarHBondContact O-CB 3.33Å; N216-Y219 PolarHBondContact O-N 3.46Å; N216-R220 PolarHBondContact ND2-NE 3.41Å; N216-R220 WeakPolarHBondContact O-CG 3.49Å; N216-R220 PolarHBondContact O-N 3.15Å; N216-R220 PolarHBondContact OD1-NE 2.9Å; N216-R220 VanDerWaalsContact OD1-NE 3.13Å
217	G	95.4	Very high	95.1	Very high	0 Å²	0	47 Å²	47	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-58.6	-47.7	173.4	0	0	0	0	0	113.3	L213 L214 A215 Y219 R220 N221 I572	L213-G217 PolarHBondContact O-N 3.43Å; L214-G217 WeakPolarHBondContact O-CA 3.32Å; L214-G217 PolarHBondContact O-N 3Å; L214-G217 VanDerWaalsContact O-N 3.13Å; A215-G217 VanDerWaalsContact C-N 3.34Å; G217-Y219 VanDerWaalsContact C-N 3.33Å; G217-Y219 PolarHBondContact O-N 3.43Å; G217-R220 PolarHBondContact O-N 3.49Å; G217-N221 WeakPolarHBondContact O-CB 3.46Å; G217-N221 PolarHBondContact O-N 2.96Å; G217-I572 VanDerWaalsContact C-CD1 3.46Å
218	F	95.5	Very high	95	Very high	30 Å²	30	49.6 Å²	49.6	13%	0.132	27%	0.27	C	S	.	.	H	α-helix	trans	-59.5	-41.3	173.7	-73.7	-58.2	0	0	0	112.8	L214 A215 N221 N222 I572 G576 V578 Y610	L214-F218 HydrophobicContact CD1-CE2 4.18Å; L214-F218 HydrophobicContact CD1-CZ 4.46Å; L214-F218 HydrophobicContact CD2-CE2 4.05Å; L214-F218 HydrophobicContact CG-CD2 4.16Å; L214-F218 HydrophobicContact CG-CE2 3.67Å; L214-F218 HydrophobicContact CG-CZ 4.37Å; L214-F218 VanDerWaalsContact O-CD2 3.28Å; L214-F218 WeakPolarHBondContact O-CD2 3.28Å; L214-F218 PolarHBondContact O-N 3.2Å; A215-F218 PolarHBondContact O-N 3.17Å; F218-N221 PolarHBondContact O-N 3.4Å; F218-N222 WeakPolarHBondContact O-CB 3.45Å; F218-N222 PolarHBondContact O-N 3.32Å; F218-N222 PolarHBondContact O-ND2 3.05Å; F218-I572 HydrophobicContact CD1-CG2 4.22Å; F218-I572 HydrophobicContact CE1-CG2 4.38Å; F218-G576 WeakPolarHBondContact CE1-O 3.4Å; F218-V578 HydrophobicContact CD1-CG2 4.44Å; F218-V578 HydrophobicContact CE1-CG2 3.34Å; F218-V578 HydrophobicContact CZ-CG2 3.43Å; F218-V578 VanDerWaalsContact CZ-CG2 3.43Å; F218-Y610 AromaticContact CE1-CD1 3.82Å; F218-Y610 HydrophobicContact CE1-CD1 3.82Å; F218-Y610 HydrophobicContact CE1-CE1 4.06Å; F218-Y610 HydrophobicContact CE1-CG 4.32Å; F218-Y610 HydrophobicContact CE2-CD1 4.32Å; F218-Y610 AromaticContact CE2-CE1 3.95Å; F218-Y610 HydrophobicContact CE2-CE1 3.95Å; F218-Y610 HydrophobicContact CE2-CE2 4.17Å; F218-Y610 AromaticContact CE2-CZ 3.87Å; F218-Y610 AromaticContact CZ-CD1 3.42Å; F218-Y610 HydrophobicContact CZ-CD1 3.42Å; F218-Y610 VanDerWaalsContact CZ-CD1 3.42Å; F218-Y610 AromaticContact CZ-CD2 3.94Å; F218-Y610 HydrophobicContact CZ-CD2 3.94Å; F218-Y610 AromaticContact CZ-CE1 3.48Å; F218-Y610 HydrophobicContact CZ-CE1 3.48Å; F218-Y610 VanDerWaalsContact CZ-CE1 3.48Å; F218-Y610 HydrophobicContact CZ-CE2 4.01Å; F218-Y610 AromaticContact CZ-CG 3.65Å; F218-Y610 HydrophobicContact CZ-CG 3.65Å; F218-Y610 AromaticContact CZ-CZ 3.78Å
219	Y	94.8	Very high	94.8	Very high	118 Å²	118	45.4 Å²	45.4	46%	0.463	25%	0.245	S	C	.	.	H	α-helix	trans	-61.7	-49.3	177.6	173.9	-105.7	0	0	0	112	A215 N216 G217 N221 N222 I223	A215-Y219 PolarHBondContact O-N 2.93Å; N216-Y219 WeakPolarHBondContact O-CB 3.33Å; N216-Y219 PolarHBondContact O-N 3.46Å; G217-Y219 VanDerWaalsContact C-N 3.33Å; G217-Y219 PolarHBondContact O-N 3.43Å; Y219-N221 PolarHBondContact O-N 3.39Å; Y219-N222 PolarHBondContact O-N 2.91Å; Y219-I223 HydrophobicContact CD1-CD1 4.42Å; Y219-I223 HydrophobicContact CD2-CD1 4.29Å; Y219-I223 HydrophobicContact CE1-CD1 3.82Å; Y219-I223 HydrophobicContact CE2-CD1 3.66Å; Y219-I223 PolarHBondContact O-N 3.06Å
220	R	94.3	Very high	94.7	Very high	42 Å²	42	44.5 Å²	44.5	16%	0.158	24%	0.241	C	C	.	.	H	α-helix	trans	-57.7	-48.1	174.3	-68.7	169.4	-178.2	-138.4	-10.9	111.4	N216 G217 N222 I223 C224 L279 E296 L315	N216-R220 PolarHBondContact ND2-NE 3.41Å; N216-R220 WeakPolarHBondContact O-CG 3.49Å; N216-R220 PolarHBondContact O-N 3.15Å; N216-R220 PolarHBondContact OD1-NE 2.9Å; N216-R220 VanDerWaalsContact OD1-NE 3.13Å; G217-R220 PolarHBondContact O-N 3.49Å; R220-N222 PolarHBondContact O-N 3.19Å; R220-I223 PolarHBondContact O-N 3.24Å; R220-C224 PolarHBondContact O-N 3.32Å; R220-L279 HydrophobicContact CG-CD2 4.42Å; R220-E296 IonicContact CZ-OE2 3.51Å; R220-E296 IonicContact NH1-OE2 2.83Å; R220-E296 PolarHBondContact NH1-OE2 3.26Å; R220-E296 IonicContact NH2-OE2 2.71Å; R220-E296 PolarHBondContact NH2-OE2 3.46Å; R220-L315 HydrophobicContact CB-CD2 3.99Å
221	N	95.1	Very high	94.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59	-46.2	-180	-172.2	60.3	0	0	0	112.6	G217 F218 Y219 I223 C224 S225 R307 I572 D573	G217-N221 WeakPolarHBondContact O-CB 3.46Å; G217-N221 PolarHBondContact O-N 2.96Å; F218-N221 PolarHBondContact O-N 3.4Å; Y219-N221 PolarHBondContact O-N 3.39Å; N221-I223 VanDerWaalsContact C-N 3.31Å; N221-I223 PolarHBondContact O-N 3.27Å; N221-C224 CarbonylContact O-C 3.54Å; N221-C224 PolarHBondContact O-N 3.02Å; N221-S225 PolarHBondContact O-N 3.17Å; N221-S225 PolarHBondContact O-OG 2.99Å; N221-R307 PolarHBondContact O-NH1 2.84Å; N221-R307 PolarHBondContact OD1-NH1 2.68Å; N221-R307 PolarHBondContact OD1-NH2 3.03Å; N221-I572 HydrophobicContact CB-CB 4.45Å; N221-I572 HydrophobicContact CB-CG2 3.84Å; N221-D573 PolarHBondContact ND2-O 2.84Å; N221-D573 PolarHBondContact OD1-O 2.95Å
222	N	94.3	Very high	94.5	Very high	85 Å²	85	46.6 Å²	46.6	46%	0.455	26%	0.261	S	S	.	.	H	α-helix	trans	-65.2	-32.5	-179.5	-71.8	-21.8	0	0	0	112.7	F218 Y219 R220 S225 Q226	F218-N222 WeakPolarHBondContact O-CB 3.45Å; F218-N222 PolarHBondContact O-N 3.32Å; F218-N222 PolarHBondContact O-ND2 3.05Å; Y219-N222 PolarHBondContact O-N 2.91Å; R220-N222 PolarHBondContact O-N 3.19Å; N222-S225 PolarHBondContact O-N 2.76Å; N222-Q226 PolarHBondContact O-NE2 3.12Å
223	I	93.6	Very high	94.2	Very high	19 Å²	19	43 Å²	43	10%	0.097	24%	0.236	C	C	.	.	H	α-helix	trans	-72.1	-43.6	173.5	-69	-179.2	0	0	0	110.1	Y219 R220 N221 S225 Q226 L229 L279 Q280 L283	Y219-I223 HydrophobicContact CD1-CD1 4.42Å; Y219-I223 HydrophobicContact CD2-CD1 4.29Å; Y219-I223 HydrophobicContact CE1-CD1 3.82Å; Y219-I223 HydrophobicContact CE2-CD1 3.66Å; Y219-I223 PolarHBondContact O-N 3.06Å; R220-I223 PolarHBondContact O-N 3.24Å; N221-I223 VanDerWaalsContact C-N 3.31Å; N221-I223 PolarHBondContact O-N 3.27Å; I223-S225 PolarHBondContact O-N 3.02Å; I223-Q226 WeakPolarHBondContact O-CG 3.48Å; I223-Q226 PolarHBondContact O-N 2.92Å; I223-Q226 VanDerWaalsContact O-N 3.09Å; I223-L229 HydrophobicContact CG2-CD1 4.08Å; I223-L229 WeakPolarHBondContact O-CD1 3.36Å; I223-L279 HydrophobicContact CB-CD2 4.44Å; I223-L279 HydrophobicContact CD1-CB 3.86Å; I223-L279 HydrophobicContact CD1-CD2 4.16Å; I223-L279 HydrophobicContact CD1-CG 4.39Å; I223-L279 HydrophobicContact CG2-CB 4.49Å; I223-L279 HydrophobicContact CG2-CD2 4.27Å; I223-L279 HydrophobicContact CG2-CG 4.18Å; I223-Q280 HydrophobicContact CG2-CB 4.18Å; I223-L283 HydrophobicContact CG2-CD1 4.21Å
224	C	93.3	Very high	94.1	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	3.4	172.1	-66.1	0	0	0	0	114.6	R220 N221 H230 L303 L304 R307	R220-C224 PolarHBondContact O-N 3.32Å; N221-C224 CarbonylContact O-C 3.54Å; N221-C224 PolarHBondContact O-N 3.02Å; C224-H230 PolarHBondContact O-NE2 3.4Å; C224-L303 HydrophobicContact CB-CD2 3.73Å; C224-L303 HydrophobicContact CB-CG 4.19Å; C224-L304 HydrophobicContact CB-CD2 4.25Å; C224-L304 HydrophobicContact CB-CG 4.3Å; C224-L304 WeakPolarHBondContact O-CD2 3.47Å; C224-R307 WeakPolarHBondContact O-CD 3.44Å; C224-R307 PolarHBondContact O-NH1 3.37Å
225	S	92.3	Very high	93.9	Very high	34 Å²	34	49.4 Å²	49.4	24%	0.238	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.1	8.8	170.9	-67.2	0	0	0	0	113.2	N221 N222 I223 R307 S574	N221-S225 PolarHBondContact O-N 3.17Å; N221-S225 PolarHBondContact O-OG 2.99Å; N222-S225 PolarHBondContact O-N 2.76Å; I223-S225 PolarHBondContact O-N 3.02Å; S225-R307 PolarHBondContact OG-NH1 3.22Å; S225-S574 PolarHBondContact OG-O 3.29Å
226	Q	92.9	Very high	93.8	Very high	72 Å²	72	48 Å²	48	34%	0.336	26%	0.262	S	S	.	.			trans	-74.7	133.4	175	-63.2	-51.4	-60.4	0	0	112	N222 I223 D228 L229 H230	N222-Q226 PolarHBondContact O-NE2 3.12Å; I223-Q226 WeakPolarHBondContact O-CG 3.48Å; I223-Q226 PolarHBondContact O-N 2.92Å; I223-Q226 VanDerWaalsContact O-N 3.09Å; Q226-D228 VanDerWaalsContact C-N 3.33Å; Q226-D228 PolarHBondContact O-N 3.4Å; Q226-L229 HydrophobicContact CB-CD1 4.39Å; Q226-L229 PolarHBondContact O-N 2.73Å; Q226-H230 PolarHBondContact O-N 2.99Å
227	P	93.5	Very high	93.7	Very high	83 Å²	83	45.4 Å²	45.4	54%	0.539	25%	0.248	S	C	.	.	H	α-helix	trans	-66.8	-31.3	-175.7	27.3	-35.3	0	0	0	113.3	L229 H230 A231	P227-L229 VanDerWaalsContact C-N 3.35Å; P227-L229 PolarHBondContact O-N 3.29Å; P227-H230 WeakPolarHBondContact O-CB 3.22Å; P227-H230 PolarHBondContact O-N 3.5Å; P227-H230 VanDerWaalsContact O-N 3.16Å; P227-A231 PolarHBondContact O-N 3.24Å
228	D	93.3	Very high	93.6	Very high	97 Å²	97	46.9 Å²	46.9	52%	0.519	26%	0.258	S	S	.	.	H	α-helix	trans	-63.3	-42.6	179.9	-55.6	-29.3	0	0	0	111.1	Q226 A231 I232	Q226-D228 VanDerWaalsContact C-N 3.33Å; Q226-D228 PolarHBondContact O-N 3.4Å; D228-A231 PolarHBondContact O-N 3.29Å; D228-I232 WeakPolarHBondContact O-CG1 3.38Å; D228-I232 PolarHBondContact O-N 3.42Å; D228-I232 VanDerWaalsContact O-N 3.1Å
229	L	93.6	Very high	93.4	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-67	-34.9	174.2	-73.2	172.8	0	0	0	112.2	I223 Q226 P227 G233 Q280 L283 E284 F287 L304	I223-L229 HydrophobicContact CG2-CD1 4.08Å; I223-L229 WeakPolarHBondContact O-CD1 3.36Å; Q226-L229 HydrophobicContact CB-CD1 4.39Å; Q226-L229 PolarHBondContact O-N 2.73Å; P227-L229 VanDerWaalsContact C-N 3.35Å; P227-L229 PolarHBondContact O-N 3.29Å; L229-G233 PolarHBondContact O-N 2.77Å; L229-Q280 HydrophobicContact CD1-CG 4.24Å; L229-Q280 HydrophobicContact CG-CG 4.45Å; L229-L283 HydrophobicContact CD1-CD1 4.41Å; L229-L283 HydrophobicContact CD2-CB 4.05Å; L229-E284 HydrophobicContact CD2-CG 3.66Å; L229-F287 HydrophobicContact CD2-CE2 4.48Å; L229-L304 HydrophobicContact CB-CD1 4.07Å; L229-L304 HydrophobicContact CB-CD2 3.6Å; L229-L304 HydrophobicContact CB-CG 4.47Å; L229-L304 HydrophobicContact CD1-CD1 4.08Å; L229-L304 HydrophobicContact CD1-CD2 4.3Å; L229-L304 HydrophobicContact CD2-CD1 4.4Å; L229-L304 HydrophobicContact CG-CD1 4.44Å
230	H	93.9	Very high	93.3	Very high	41 Å²	41	49.6 Å²	49.6	19%	0.19	28%	0.279	C	S	.	.	H	α-helix	trans	-66.7	-39.2	173.7	-59	156.4	0	0	0	111.8	C224 Q226 P227 G233 L234 L304 A308	C224-H230 PolarHBondContact O-NE2 3.4Å; Q226-H230 PolarHBondContact O-N 2.99Å; P227-H230 WeakPolarHBondContact O-CB 3.22Å; P227-H230 PolarHBondContact O-N 3.5Å; P227-H230 VanDerWaalsContact O-N 3.16Å; H230-G233 PolarHBondContact O-N 3.13Å; H230-L234 WeakPolarHBondContact O-CB 3.38Å; H230-L234 PolarHBondContact O-N 3.29Å; H230-L304 VanDerWaalsContact CD2-CD2 3.47Å; H230-L304 WeakPolarHBondContact CD2-CD2 3.29Å; H230-A308 HydrophobicContact CB-CB 4.35Å; H230-A308 WeakPolarHBondContact O-CB 3.39Å
231	A	94	Very high	93.2	Very high	63 Å²	63	48 Å²	48	52%	0.521	27%	0.274	S	S	.	.	H	α-helix	trans	-64	-42.7	176.5	0	0	0	0	0	111.9	P227 D228 L234 S235	P227-A231 PolarHBondContact O-N 3.24Å; D228-A231 PolarHBondContact O-N 3.29Å; A231-L234 PolarHBondContact O-N 2.98Å; A231-S235 PolarHBondContact O-N 3.35Å; A231-S235 VanDerWaalsContact O-N 3.12Å
232	I	93.6	Very high	93	Very high	55 Å²	55	51.1 Å²	51.1	28%	0.282	29%	0.293	S	S	.	.	H	α-helix	trans	-60.6	-49.8	172.5	-65.6	166.5	0	0	0	110.1	D228 L234 S235 I236 E284 F287	D228-I232 WeakPolarHBondContact O-CG1 3.38Å; D228-I232 PolarHBondContact O-N 3.42Å; D228-I232 VanDerWaalsContact O-N 3.1Å; I232-L234 PolarHBondContact O-N 2.98Å; I232-S235 PolarHBondContact O-N 3.49Å; I232-S235 PolarHBondContact O-OG 3.02Å; I232-I236 HydrophobicContact CG2-CD1 4.41Å; I232-E284 HydrophobicContact CD1-CG 3.98Å; I232-F287 HydrophobicContact CG2-CB 3.53Å; I232-F287 HydrophobicContact CG2-CD1 4.27Å; I232-F287 HydrophobicContact CG2-CD2 3.95Å; I232-F287 HydrophobicContact CG2-CG 3.67Å
233	G	92.3	Very high	92.8	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-55.2	-47.8	176.2	0	0	0	0	0	112.7	L229 H230 S235 I236 I237	L229-G233 PolarHBondContact O-N 2.77Å; H230-G233 PolarHBondContact O-N 3.13Å; G233-S235 VanDerWaalsContact C-N 3.29Å; G233-S235 PolarHBondContact O-N 2.69Å; G233-I236 PolarHBondContact O-N 3.43Å; G233-I236 VanDerWaalsContact O-N 3.13Å; G233-I237 WeakPolarHBondContact O-CG1 3.46Å; G233-I237 PolarHBondContact O-N 2.94Å
234	L	93	Very high	92.5	Very high	82 Å²	82	58.7 Å²	58.7	43%	0.429	32%	0.319	S	S	.	.	H	α-helix	trans	-61.5	-35.9	-179.6	-169.3	60.4	0	0	0	112.8	H230 A231 I232 I236 I237 T242 A308	H230-L234 WeakPolarHBondContact O-CB 3.38Å; H230-L234 PolarHBondContact O-N 3.29Å; A231-L234 PolarHBondContact O-N 2.98Å; I232-L234 PolarHBondContact O-N 2.98Å; L234-I236 PolarHBondContact O-N 3.42Å; L234-I237 PolarHBondContact O-N 3.36Å; L234-T242 HydrophobicContact CD1-CG2 3.81Å; L234-A308 HydrophobicContact CB-CB 4.1Å
235	S	93.4	Very high	92.2	Very high	96 Å²	96	64 Å²	64	67%	0.671	35%	0.347	S	S	*	.	H	α-helix	trans	-65	-22.7	178.6	77.1	0	0	0	0	113.8	A231 I232 G233	A231-S235 PolarHBondContact O-N 3.35Å; A231-S235 VanDerWaalsContact O-N 3.12Å; I232-S235 PolarHBondContact O-N 3.49Å; I232-S235 PolarHBondContact O-OG 3.02Å; G233-S235 VanDerWaalsContact C-N 3.29Å; G233-S235 PolarHBondContact O-N 2.69Å
236	I	92.4	Very high	91.8	Very high	25 Å²	25	64.4 Å²	64.4	13%	0.128	35%	0.349	C	S	.	.	H	α-helix	trans	-91.8	-24.1	-177.3	-72.5	166.7	0	0	0	112.2	I232 G233 L234 P238 W260 F265 F287 Y290	I232-I236 HydrophobicContact CG2-CD1 4.41Å; G233-I236 PolarHBondContact O-N 3.43Å; G233-I236 VanDerWaalsContact O-N 3.13Å; L234-I236 PolarHBondContact O-N 3.42Å; I236-P238 WeakPolarHBondContact O-CD 3.45Å; I236-W260 HydrophobicContact CG2-CH2 4.24Å; I236-W260 HydrophobicContact CG2-CZ2 4.27Å; I236-F265 HydrophobicContact CG2-CE2 4.35Å; I236-F265 HydrophobicContact CG2-CZ 4.25Å; I236-F287 HydrophobicContact CD1-CB 4Å; I236-F287 HydrophobicContact CD1-CD1 3.56Å; I236-F287 HydrophobicContact CD1-CE1 4.46Å; I236-F287 HydrophobicContact CD1-CG 4.19Å; I236-Y290 HydrophobicContact CD1-CE1 4.15Å; I236-Y290 HydrophobicContact CG1-CE1 4.12Å; I236-Y290 HydrophobicContact CG2-CE1 3.68Å
237	I	93.3	Very high	91.5	Very high	11 Å²	11	69.3 Å²	69.3	6%	0.056	36%	0.364	C	S	.	.	S	Bend	trans	-74.7	126.5	-172.4	-64.1	164.5	0	0	0	110.9	G233 L234 A239 F241 T242 W260 I305 A308 L309	G233-I237 WeakPolarHBondContact O-CG1 3.46Å; G233-I237 PolarHBondContact O-N 2.94Å; L234-I237 PolarHBondContact O-N 3.36Å; I237-A239 PolarHBondContact O-N 3.13Å; I237-F241 HydrophobicContact CG2-CB 3.76Å; I237-F241 HydrophobicContact CG2-CD2 4.18Å; I237-F241 HydrophobicContact CG2-CG 4.45Å; I237-T242 HydrophobicContact CB-CG2 4.36Å; I237-T242 HydrophobicContact CG2-CG2 3.97Å; I237-W260 HydrophobicContact CG1-CH2 4.18Å; I237-W260 HydrophobicContact CG1-CZ3 4.4Å; I237-I305 HydrophobicContact CD1-CB 4.25Å; I237-I305 HydrophobicContact CD1-CG1 4.35Å; I237-I305 HydrophobicContact CD1-CG2 3.77Å; I237-I305 HydrophobicContact CG1-CG1 4.32Å; I237-I305 HydrophobicContact CG1-CG2 4.02Å; I237-A308 HydrophobicContact CD1-CB 4.21Å; I237-L309 HydrophobicContact CD1-CD1 4.25Å; I237-L309 HydrophobicContact CD1-CD2 4.31Å; I237-L309 HydrophobicContact CD1-CG 3.9Å; I237-L309 HydrophobicContact CG2-CD2 4.28Å
238	P	93.8	Very high	91.2	Very high	31 Å²	31	69.4 Å²	69.4	20%	0.201	36%	0.36	C	S	.	.			trans	-56.5	132.4	176	-28.1	33.7	0	0	0	112.7	I236 R240 F241 W260	I236-P238 WeakPolarHBondContact O-CD 3.45Å; P238-R240 HydrophobicContact CB-CG 4.21Å; P238-R240 PolarHBondContact O-N 3.06Å; P238-F241 HydrophobicContact CB-CD2 4.1Å; P238-F241 HydrophobicContact CB-CE2 4.45Å; P238-F241 HydrophobicContact CG-CD2 4.24Å; P238-F241 HydrophobicContact CG-CE2 4.3Å; P238-F241 PolarHBondContact O-N 2.93Å; P238-W260 HydrophobicContact CG-CD2 4.13Å; P238-W260 HydrophobicContact CG-CG 4.43Å; P238-W260 HydrophobicContact CG-CZ2 3.94Å
239	A	91.6	Very high	91	Very high	60 Å²	60	64.9 Å²	64.9	50%	0.496	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-7.5	-175.1	0	0	0	0	0	116.2	I237 T242 R243	I237-A239 PolarHBondContact O-N 3.13Å; A239-T242 WeakPolarHBondContact CA-OG1 3.4Å; A239-T242 PolarHBondContact O-OG1 3.47Å; A239-R243 VanDerWaalsContact O-CD 3.3Å; A239-R243 WeakPolarHBondContact O-CD 3.29Å; A239-R243 VanDerWaalsContact O-CG 3.22Å; A239-R243 WeakPolarHBondContact O-CG 3.47Å; A239-R243 PolarHBondContact O-NE 2.92Å
240	R	92.1	Very high	90.8	Very high	145 Å²	145	67.5 Å²	67.5	55%	0.547	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-31.9	169.3	66.5	179.5	-179.8	-91.9	-3.7	112.7	P238	P238-R240 HydrophobicContact CB-CG 4.21Å; P238-R240 PolarHBondContact O-N 3.06Å
241	F	92.4	Very high	90.7	Very high	10 Å²	10	68.2 Å²	68.2	4%	0.044	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-35.1	-178	-66.3	-61	0	0	0	111.7	I237 P238 R243 V244 Y253 N256 L257 W260	I237-F241 HydrophobicContact CG2-CB 3.76Å; I237-F241 HydrophobicContact CG2-CD2 4.18Å; I237-F241 HydrophobicContact CG2-CG 4.45Å; P238-F241 HydrophobicContact CB-CD2 4.1Å; P238-F241 HydrophobicContact CB-CE2 4.45Å; P238-F241 HydrophobicContact CG-CD2 4.24Å; P238-F241 HydrophobicContact CG-CE2 4.3Å; P238-F241 PolarHBondContact O-N 2.93Å; F241-R243 PolarHBondContact O-N 2.9Å; F241-V244 PolarHBondContact O-N 3.02Å; F241-Y253 HydrophobicContact CB-CE2 4.41Å; F241-Y253 HydrophobicContact CD1-CD2 4.44Å; F241-Y253 AromaticContact CD1-CE2 3.84Å; F241-Y253 HydrophobicContact CD1-CE2 3.84Å; F241-Y253 AromaticContact CD1-CZ 3.99Å; F241-Y253 PolarHBondContact O-OH 3.45Å; F241-N256 HydrophobicContact CE1-CB 4.48Å; F241-L257 HydrophobicContact CB-CD1 4.26Å; F241-L257 HydrophobicContact CD1-CB 4.45Å; F241-L257 HydrophobicContact CD1-CD1 3.89Å; F241-L257 HydrophobicContact CD2-CD1 3.74Å; F241-L257 HydrophobicContact CE1-CB 4.09Å; F241-L257 HydrophobicContact CE1-CD1 4.07Å; F241-L257 HydrophobicContact CE2-CD1 3.9Å; F241-L257 HydrophobicContact CG-CD1 3.73Å; F241-L257 HydrophobicContact CZ-CB 4.38Å; F241-L257 HydrophobicContact CZ-CD1 4.07Å; F241-W260 HydrophobicContact CD2-CE3 4.39Å; F241-W260 HydrophobicContact CE2-CB 3.87Å; F241-W260 AromaticContact CE2-CD2 3.84Å; F241-W260 HydrophobicContact CE2-CD2 3.84Å; F241-W260 AromaticContact CE2-CE3 3.91Å; F241-W260 HydrophobicContact CE2-CE3 3.91Å; F241-W260 AromaticContact CE2-CG 3.79Å; F241-W260 HydrophobicContact CE2-CG 3.79Å; F241-W260 HydrophobicContact CZ-CB 3.94Å; F241-W260 HydrophobicContact CZ-CG 4.36Å
242	T	90.3	Very high	90.6	Very high	64 Å²	64	72.7 Å²	72.7	39%	0.393	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-7.1	178.6	60.1	0	0	0	0	114.4	L234 I237 A239 L309	L234-T242 HydrophobicContact CD1-CG2 3.81Å; I237-T242 HydrophobicContact CB-CG2 4.36Å; I237-T242 HydrophobicContact CG2-CG2 3.97Å; A239-T242 WeakPolarHBondContact CA-OG1 3.4Å; A239-T242 PolarHBondContact O-OG1 3.47Å; T242-L309 HydrophobicContact CG2-CD2 3.9Å
243	R	89.5	Confident	90.5	Very high	212 Å²	212	71 Å²	71	80%	0.8	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-15.5	175.4	-76.9	171.6	-174	-153.3	0.5	114	A239 F241	A239-R243 VanDerWaalsContact O-CD 3.3Å; A239-R243 WeakPolarHBondContact O-CD 3.29Å; A239-R243 VanDerWaalsContact O-CG 3.22Å; A239-R243 WeakPolarHBondContact O-CG 3.47Å; A239-R243 PolarHBondContact O-NE 2.92Å; F241-R243 PolarHBondContact O-N 2.9Å
244	V	88.2	Confident	90.6	Very high	51 Å²	51	71 Å²	71	31%	0.309	35%	0.352	S	S	.	.	S	Bend	trans	-86.4	130.4	179.9	-178.8	0	0	0	0	108	F241 D248 V249 Y253	F241-V244 PolarHBondContact O-N 3.02Å; V244-D248 HydrophobicContact CG1-CB 3.88Å; V244-V249 HydrophobicContact CG1-CG2 4.24Å; V244-Y253 HydrophobicContact CB-CD2 4.16Å; V244-Y253 HydrophobicContact CB-CE2 3.63Å; V244-Y253 HydrophobicContact CG1-CD2 4.09Å; V244-Y253 HydrophobicContact CG1-CE2 3.99Å; V244-Y253 HydrophobicContact CG2-CD2 3.95Å; V244-Y253 HydrophobicContact CG2-CE2 3.6Å
245	L	86.4	Confident	90.7	Very high	112 Å²	112	68.7 Å²	68.7	59%	0.586	34%	0.343	S	S	*	.			trans	-69.1	146.5	175.5	-70.8	161.7	0	0	0	109.4	R247 D248	L245-R247 PolarHBondContact O-N 2.85Å; L245-D248 PolarHBondContact O-N 2.83Å
246	P	84.2	Confident	90.7	Very high	42 Å²	42	66.3 Å²	66.3	27%	0.273	32%	0.323	S	S	.	.	G	3₁₀ helix	trans	-52.4	-29	176.2	-30.9	37.4	0	0	0	114.4	D248 Q310 L311	P246-D248 VanDerWaalsContact C-N 3.29Å; P246-D248 PolarHBondContact O-N 2.99Å; P246-Q310 HydrophobicContact CG-CB 4.43Å; P246-L311 HydrophobicContact CB-CD2 3.87Å; P246-L311 HydrophobicContact CG-CD2 4.3Å
247	R	86	Confident	90.8	Very high	176 Å²	176	65.1 Å²	65.1	66%	0.664	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-69.4	-23	176.5	-51.1	-146.9	167.6	146.5	-0.4	114.6	L245 E537 Q538	L245-R247 PolarHBondContact O-N 2.85Å; R247-E537 VanDerWaalsContact CG-OE2 3.27Å; R247-E537 WeakPolarHBondContact CG-OE2 3.24Å; R247-E537 IonicContact NE-OE2 2.87Å; R247-Q538 WeakPolarHBondContact O-CG 3.38Å; R247-Q538 PolarHBondContact O-NE2 2.86Å
248	D	88.3	Confident	90.9	Very high	84 Å²	84	64.6 Å²	64.6	45%	0.449	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-100.8	9.5	-175.2	-60.4	-36	0	0	0	112.3	V244 L245 P246 D250	V244-D248 HydrophobicContact CG1-CB 3.88Å; L245-D248 PolarHBondContact O-N 2.83Å; P246-D248 VanDerWaalsContact C-N 3.29Å; P246-D248 PolarHBondContact O-N 2.99Å; D248-D250 PolarHBondContact O-N 3.02Å
249	V	88.8	Confident	91	Very high	3 Å²	3	68.9 Å²	68.9	2%	0.018	33%	0.329	C	S	.	.			trans	-80.8	113.9	178	172.7	0	0	0	0	110.5	V244 Y253 L254 L311	V244-V249 HydrophobicContact CG1-CG2 4.24Å; V249-Y253 HydrophobicContact CB-CD1 4.35Å; V249-Y253 HydrophobicContact CG1-CD1 3.7Å; V249-Y253 HydrophobicContact CG1-CE1 4.23Å; V249-Y253 HydrophobicContact CG1-CG 4.36Å; V249-Y253 HydrophobicContact CG2-CD1 3.97Å; V249-Y253 HydrophobicContact CG2-CE1 3.93Å; V249-Y253 HydrophobicContact CG2-CG 4.4Å; V249-L254 HydrophobicContact CG1-CD1 4.41Å; V249-L254 HydrophobicContact CG1-CD2 3.95Å; V249-L254 HydrophobicContact CG1-CG 3.9Å; V249-L311 HydrophobicContact CB-CD2 4.49Å; V249-L311 HydrophobicContact CG1-CD1 4.39Å; V249-L311 HydrophobicContact CG2-CD1 4.43Å; V249-L311 HydrophobicContact CG2-CD2 3.79Å
250	D	89.7	Confident	91.2	Very high	55 Å²	55	67.8 Å²	67.8	29%	0.294	31%	0.312	S	S	.	.			trans	-107.3	176.5	174	72.6	-11.2	0	0	0	112	D248 Y252 Y253 L254	D248-D250 PolarHBondContact O-N 3.02Å; D250-Y252 PolarHBondContact O-N 2.79Å; D250-Y252 PolarHBondContact OD1-N 2.86Å; D250-Y252 WeakPolarHBondContact OD2-CB 3.5Å; D250-Y253 PolarHBondContact O-N 2.85Å; D250-Y253 VanDerWaalsContact OD1-CB 3.25Å; D250-Y253 WeakPolarHBondContact OD1-CB 3.39Å; D250-Y253 PolarHBondContact OD1-N 2.91Å; D250-L254 PolarHBondContact O-N 3.3Å
251	T	91.1	Very high	91.3	Very high	56 Å²	56	60.9 Å²	60.9	34%	0.344	29%	0.286	S	S	.	.	H	α-helix	trans	-62.5	-26.8	176.8	52.5	0	0	0	0	113.2	S255 V543	T251-S255 WeakPolarHBondContact O-CB 3.39Å; T251-S255 PolarHBondContact O-N 2.91Å; T251-V543 HydrophobicContact CG2-CG1 4.14Å; T251-V543 HydrophobicContact CG2-CG2 4.01Å
252	Y	91.6	Very high	91.4	Very high	156 Å²	156	64 Å²	64	61%	0.612	30%	0.303	S	S	*	.	H	α-helix	trans	-74.3	-43	178.2	179.9	-105.5	0	0	0	112.3	D250 S255 N256	D250-Y252 PolarHBondContact O-N 2.79Å; D250-Y252 PolarHBondContact OD1-N 2.86Å; D250-Y252 WeakPolarHBondContact OD2-CB 3.5Å; Y252-S255 PolarHBondContact O-N 3.46Å; Y252-N256 WeakPolarHBondContact CE1-ND2 3.33Å; Y252-N256 PolarHBondContact O-N 3.44Å; Y252-N256 PolarHBondContact O-ND2 3.27Å
253	Y	93.1	Very high	91.5	Very high	19 Å²	19	64.2 Å²	64.2	8%	0.075	32%	0.318	C	S	.	.	H	α-helix	trans	-55.5	-50.8	170.3	175.8	-82.9	0	0	0	110.3	F241 V244 V249 D250 S255 N256 L257	F241-Y253 HydrophobicContact CB-CE2 4.41Å; F241-Y253 HydrophobicContact CD1-CD2 4.44Å; F241-Y253 AromaticContact CD1-CE2 3.84Å; F241-Y253 HydrophobicContact CD1-CE2 3.84Å; F241-Y253 AromaticContact CD1-CZ 3.99Å; F241-Y253 PolarHBondContact O-OH 3.45Å; V244-Y253 HydrophobicContact CB-CD2 4.16Å; V244-Y253 HydrophobicContact CB-CE2 3.63Å; V244-Y253 HydrophobicContact CG1-CD2 4.09Å; V244-Y253 HydrophobicContact CG1-CE2 3.99Å; V244-Y253 HydrophobicContact CG2-CD2 3.95Å; V244-Y253 HydrophobicContact CG2-CE2 3.6Å; V249-Y253 HydrophobicContact CB-CD1 4.35Å; V249-Y253 HydrophobicContact CG1-CD1 3.7Å; V249-Y253 HydrophobicContact CG1-CE1 4.23Å; V249-Y253 HydrophobicContact CG1-CG 4.36Å; V249-Y253 HydrophobicContact CG2-CD1 3.97Å; V249-Y253 HydrophobicContact CG2-CE1 3.93Å; V249-Y253 HydrophobicContact CG2-CG 4.4Å; D250-Y253 PolarHBondContact O-N 2.85Å; D250-Y253 VanDerWaalsContact OD1-CB 3.25Å; D250-Y253 WeakPolarHBondContact OD1-CB 3.39Å; D250-Y253 PolarHBondContact OD1-N 2.91Å; Y253-S255 VanDerWaalsContact C-N 3.35Å; Y253-S255 PolarHBondContact O-N 2.92Å; Y253-N256 PolarHBondContact O-N 2.83Å; Y253-N256 VanDerWaalsContact O-N 3.12Å; Y253-L257 HydrophobicContact CE1-CD2 4.18Å; Y253-L257 WeakPolarHBondContact O-CB 3.39Å; Y253-L257 PolarHBondContact O-N 3.01Å
254	L	93.7	Very high	91.7	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-59.8	-43.4	178.1	-68.8	176.5	0	0	0	111.7	V249 D250 N256 L257 V258 L306 L311 V534 V543 V545 V552	V249-L254 HydrophobicContact CG1-CD1 4.41Å; V249-L254 HydrophobicContact CG1-CD2 3.95Å; V249-L254 HydrophobicContact CG1-CG 3.9Å; D250-L254 PolarHBondContact O-N 3.3Å; L254-N256 VanDerWaalsContact C-N 3.31Å; L254-N256 PolarHBondContact O-N 2.8Å; L254-L257 PolarHBondContact O-N 3.46Å; L254-V258 WeakPolarHBondContact O-CB 3.24Å; L254-V258 VanDerWaalsContact O-CG2 3.29Å; L254-V258 WeakPolarHBondContact O-CG2 3.14Å; L254-V258 PolarHBondContact O-N 2.65Å; L254-L306 HydrophobicContact CD2-CD2 4.23Å; L254-L311 HydrophobicContact CD2-CD1 4.46Å; L254-V534 HydrophobicContact CD1-CB 4.05Å; L254-V534 HydrophobicContact CD1-CG1 4.31Å; L254-V534 HydrophobicContact CD1-CG2 4.36Å; L254-V534 HydrophobicContact CD2-CB 4.43Å; L254-V534 HydrophobicContact CD2-CG1 4.26Å; L254-V534 HydrophobicContact CD2-CG2 4.13Å; L254-V543 HydrophobicContact CD1-CB 4.36Å; L254-V543 HydrophobicContact CD1-CG1 4.23Å; L254-V545 HydrophobicContact CD1-CG2 4.38Å; L254-V552 HydrophobicContact CB-CG1 3.95Å; L254-V552 HydrophobicContact CB-CG2 4.41Å
255	S	94.4	Very high	91.9	Very high	34 Å²	34	54 Å²	54	24%	0.238	28%	0.278	C	S	.	.	H	α-helix	trans	-59	-40.5	175.1	-173.9	0	0	0	0	112.4	T251 Y252 Y253 K259	T251-S255 WeakPolarHBondContact O-CB 3.39Å; T251-S255 PolarHBondContact O-N 2.91Å; Y252-S255 PolarHBondContact O-N 3.46Å; Y253-S255 VanDerWaalsContact C-N 3.35Å; Y253-S255 PolarHBondContact O-N 2.92Å; S255-K259 VanDerWaalsContact O-CG 3.24Å; S255-K259 WeakPolarHBondContact O-CG 3.46Å; S255-K259 PolarHBondContact O-N 2.68Å; S255-K259 VanDerWaalsContact OG-CE 3.26Å; S255-K259 WeakPolarHBondContact OG-CE 3.49Å; S255-K259 PolarHBondContact OG-NZ 3.08Å
256	N	94.4	Very high	92.2	Very high	46 Å²	46	52.4 Å²	52.4	25%	0.246	27%	0.273	C	S	.	.	H	α-helix	trans	-75.8	-32.4	179.3	-67.8	-29.1	0	0	0	113.2	F241 Y252 Y253 L254 K259 W260	F241-N256 HydrophobicContact CE1-CB 4.48Å; Y252-N256 WeakPolarHBondContact CE1-ND2 3.33Å; Y252-N256 PolarHBondContact O-N 3.44Å; Y252-N256 PolarHBondContact O-ND2 3.27Å; Y253-N256 PolarHBondContact O-N 2.83Å; Y253-N256 VanDerWaalsContact O-N 3.12Å; L254-N256 VanDerWaalsContact C-N 3.31Å; L254-N256 PolarHBondContact O-N 2.8Å; N256-K259 PolarHBondContact OD1-NZ 3.38Å; N256-K259 VanDerWaalsContact OD1-NZ 3.08Å; N256-W260 PolarHBondContact O-N 3.18Å; N256-W260 VanDerWaalsContact O-N 3.07Å
257	L	94.9	Very high	92.5	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-65.3	-45.3	172.1	-174	69.6	0	0	0	110.8	F241 Y253 L254 W260 F261 F302 L306 L309	F241-L257 HydrophobicContact CB-CD1 4.26Å; F241-L257 HydrophobicContact CD1-CB 4.45Å; F241-L257 HydrophobicContact CD1-CD1 3.89Å; F241-L257 HydrophobicContact CD2-CD1 3.74Å; F241-L257 HydrophobicContact CE1-CB 4.09Å; F241-L257 HydrophobicContact CE1-CD1 4.07Å; F241-L257 HydrophobicContact CE2-CD1 3.9Å; F241-L257 HydrophobicContact CG-CD1 3.73Å; F241-L257 HydrophobicContact CZ-CB 4.38Å; F241-L257 HydrophobicContact CZ-CD1 4.07Å; Y253-L257 HydrophobicContact CE1-CD2 4.18Å; Y253-L257 WeakPolarHBondContact O-CB 3.39Å; Y253-L257 PolarHBondContact O-N 3.01Å; L254-L257 PolarHBondContact O-N 3.46Å; L257-W260 HydrophobicContact CD1-CE3 3.81Å; L257-W260 HydrophobicContact CD1-CZ3 4.06Å; L257-W260 PolarHBondContact O-N 3.23Å; L257-F261 WeakPolarHBondContact O-CB 3.49Å; L257-F261 PolarHBondContact O-N 3.11Å; L257-F302 HydrophobicContact CD2-CE2 4.35Å; L257-F302 HydrophobicContact CD2-CZ 4.3Å; L257-F302 HydrophobicContact CG-CE2 4.2Å; L257-F302 HydrophobicContact CG-CZ 4.42Å; L257-L306 HydrophobicContact CD2-CD2 3.56Å; L257-L309 HydrophobicContact CD1-CD1 4.22Å; L257-L309 HydrophobicContact CD2-CD1 3.82Å
258	V	95.4	Very high	92.7	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.006	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-45	175.7	171.1	0	0	0	0	111.7	L254 W260 F261 I262 F302 V545 V552	L254-V258 WeakPolarHBondContact O-CB 3.24Å; L254-V258 VanDerWaalsContact O-CG2 3.29Å; L254-V258 WeakPolarHBondContact O-CG2 3.14Å; L254-V258 PolarHBondContact O-N 2.65Å; V258-W260 VanDerWaalsContact C-N 3.32Å; V258-W260 PolarHBondContact O-N 3.05Å; V258-F261 PolarHBondContact O-N 2.92Å; V258-I262 HydrophobicContact CG1-CD1 3.66Å; V258-I262 HydrophobicContact CG1-CG1 4.38Å; V258-I262 WeakPolarHBondContact O-CG1 3.46Å; V258-I262 PolarHBondContact O-N 3.43Å; V258-F302 HydrophobicContact CG2-CE1 3.87Å; V258-F302 HydrophobicContact CG2-CE2 4.37Å; V258-F302 HydrophobicContact CG2-CZ 3.51Å; V258-V545 HydrophobicContact CG2-CG1 3.48Å; V258-V545 VanDerWaalsContact CG2-CG1 3.48Å; V258-V552 HydrophobicContact CB-CG2 4.44Å; V258-V552 HydrophobicContact CG2-CG2 3.92Å
259	K	94.8	Very high	92.6	Very high	120 Å²	120	48.6 Å²	48.6	52%	0.522	28%	0.279	S	S	.	.	H	α-helix	trans	-58.6	-42.8	175	-73.2	166.5	-157.6	156.5	0	112.3	S255 N256 G263	S255-K259 VanDerWaalsContact O-CG 3.24Å; S255-K259 WeakPolarHBondContact O-CG 3.46Å; S255-K259 PolarHBondContact O-N 2.68Å; S255-K259 VanDerWaalsContact OG-CE 3.26Å; S255-K259 WeakPolarHBondContact OG-CE 3.49Å; S255-K259 PolarHBondContact OG-NZ 3.08Å; N256-K259 PolarHBondContact OD1-NZ 3.38Å; N256-K259 VanDerWaalsContact OD1-NZ 3.08Å; K259-G263 PolarHBondContact O-N 2.97Å; K259-G263 VanDerWaalsContact O-N 3.14Å
260	W	95.5	Very high	92.4	Very high	37 Å²	37	56.9 Å²	56.9	14%	0.14	32%	0.317	C	S	.	.	H	α-helix	trans	-64.6	-45	175.5	163.2	66.4	0	0	0	111.5	I236 I237 P238 F241 N256 L257 V258 G263 T264 I305	I236-W260 HydrophobicContact CG2-CH2 4.24Å; I236-W260 HydrophobicContact CG2-CZ2 4.27Å; I237-W260 HydrophobicContact CG1-CH2 4.18Å; I237-W260 HydrophobicContact CG1-CZ3 4.4Å; P238-W260 HydrophobicContact CG-CD2 4.13Å; P238-W260 HydrophobicContact CG-CG 4.43Å; P238-W260 HydrophobicContact CG-CZ2 3.94Å; F241-W260 HydrophobicContact CD2-CE3 4.39Å; F241-W260 HydrophobicContact CE2-CB 3.87Å; F241-W260 AromaticContact CE2-CD2 3.84Å; F241-W260 HydrophobicContact CE2-CD2 3.84Å; F241-W260 AromaticContact CE2-CE3 3.91Å; F241-W260 HydrophobicContact CE2-CE3 3.91Å; F241-W260 AromaticContact CE2-CG 3.79Å; F241-W260 HydrophobicContact CE2-CG 3.79Å; F241-W260 HydrophobicContact CZ-CB 3.94Å; F241-W260 HydrophobicContact CZ-CG 4.36Å; N256-W260 PolarHBondContact O-N 3.18Å; N256-W260 VanDerWaalsContact O-N 3.07Å; L257-W260 HydrophobicContact CD1-CE3 3.81Å; L257-W260 HydrophobicContact CD1-CZ3 4.06Å; L257-W260 PolarHBondContact O-N 3.23Å; V258-W260 VanDerWaalsContact C-N 3.32Å; V258-W260 PolarHBondContact O-N 3.05Å; W260-G263 CarbonylContact O-C 3.56Å; W260-G263 PolarHBondContact O-N 3.35Å; W260-T264 HydrophobicContact CZ2-CG2 4.14Å; W260-T264 PolarHBondContact NE1-OG1 3.49Å; W260-T264 WeakPolarHBondContact O-CB 3.28Å; W260-T264 PolarHBondContact O-N 3.17Å; W260-T264 VanDerWaalsContact O-N 3.08Å; W260-T264 PolarHBondContact O-OG1 3.04Å; W260-I305 HydrophobicContact CH2-CD1 4.26Å; W260-I305 HydrophobicContact CZ3-CD1 4.27Å; W260-I305 HydrophobicContact CZ3-CG2 4.3Å
261	F	95.3	Very high	92.1	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-59.8	-49.1	-179.9	175.2	-103.5	0	0	0	112.1	L257 V258 G263 T264 F265 L298 I301 F302 I305 C547	L257-F261 WeakPolarHBondContact O-CB 3.49Å; L257-F261 PolarHBondContact O-N 3.11Å; V258-F261 PolarHBondContact O-N 2.92Å; F261-G263 VanDerWaalsContact C-N 3.26Å; F261-G263 PolarHBondContact O-N 3.37Å; F261-T264 PolarHBondContact O-N 3.48Å; F261-F265 AromaticContact CD2-CD2 3.35Å; F261-F265 HydrophobicContact CD2-CD2 3.35Å; F261-F265 AromaticContact CD2-CE2 3.81Å; F261-F265 HydrophobicContact CD2-CE2 3.81Å; F261-F265 HydrophobicContact CD2-CG 4.15Å; F261-F265 HydrophobicContact CE2-CB 4.02Å; F261-F265 HydrophobicContact CE2-CD1 4.41Å; F261-F265 AromaticContact CE2-CD2 3.23Å; F261-F265 HydrophobicContact CE2-CD2 3.23Å; F261-F265 AromaticContact CE2-CE2 3.72Å; F261-F265 HydrophobicContact CE2-CE2 3.72Å; F261-F265 AromaticContact CE2-CG 3.63Å; F261-F265 HydrophobicContact CE2-CG 3.63Å; F261-F265 HydrophobicContact CE2-CZ 4.48Å; F261-F265 HydrophobicContact CG-CD2 4.35Å; F261-F265 HydrophobicContact CZ-CB 4.12Å; F261-F265 HydrophobicContact CZ-CD2 4.17Å; F261-F265 HydrophobicContact CZ-CG 4.17Å; F261-F265 PolarHBondContact O-N 2.99Å; F261-L298 HydrophobicContact CE1-CD1 3.74Å; F261-L298 HydrophobicContact CE1-CD2 4.33Å; F261-L298 HydrophobicContact CE1-CG 3.78Å; F261-L298 HydrophobicContact CZ-CD1 3.57Å; F261-L298 HydrophobicContact CZ-CG 3.91Å; F261-I301 HydrophobicContact CE2-CB 4.5Å; F261-I301 HydrophobicContact CE2-CG2 3.82Å; F261-I301 HydrophobicContact CZ-CB 4.45Å; F261-I301 HydrophobicContact CZ-CG2 4.22Å; F261-F302 HydrophobicContact CB-CD2 3.85Å; F261-F302 HydrophobicContact CB-CE2 3.82Å; F261-F302 HydrophobicContact CD1-CB 4.21Å; F261-F302 AromaticContact CD1-CD2 3.59Å; F261-F302 HydrophobicContact CD1-CD2 3.59Å; F261-F302 HydrophobicContact CD1-CE2 4.24Å; F261-F302 HydrophobicContact CD1-CG 4.01Å; F261-F302 HydrophobicContact CD2-CB 4.49Å; F261-F302 AromaticContact CD2-CD2 3.61Å; F261-F302 HydrophobicContact CD2-CD2 3.61Å; F261-F302 HydrophobicContact CD2-CE2 4.39Å; F261-F302 HydrophobicContact CD2-CG 4.47Å; F261-F302 HydrophobicContact CE1-CB 3.73Å; F261-F302 HydrophobicContact CE1-CD2 4Å; F261-F302 HydrophobicContact CE1-CG 4.04Å; F261-F302 HydrophobicContact CE2-CB 4.04Å; F261-F302 HydrophobicContact CE2-CD2 4.03Å; F261-F302 HydrophobicContact CE2-CG 4.5Å; F261-F302 AromaticContact CG-CD2 3.37Å; F261-F302 HydrophobicContact CG-CD2 3.37Å; F261-F302 AromaticContact CG-CE2 3.89Å; F261-F302 HydrophobicContact CG-CE2 3.89Å; F261-F302 HydrophobicContact CG-CG 4.23Å; F261-F302 HydrophobicContact CZ-CB 3.64Å; F261-F302 HydrophobicContact CZ-CD2 4.21Å; F261-F302 HydrophobicContact CZ-CG 4.29Å; F261-I305 HydrophobicContact CD2-CD1 3.58Å; F261-I305 HydrophobicContact CE2-CD1 3.73Å; F261-C547 HydrophobicContact CD1-CB 4Å; F261-C547 HydrophobicContact CE1-CB 3.97Å
262	I	93.5	Very high	91.3	Very high	75 Å²	75	57.3 Å²	57.3	39%	0.385	32%	0.324	S	S	.	.	H	α-helix	trans	-63.2	-32.2	177	-66.6	169.7	0	0	0	111.9	V258 T264 C547	V258-I262 HydrophobicContact CG1-CD1 3.66Å; V258-I262 HydrophobicContact CG1-CG1 4.38Å; V258-I262 WeakPolarHBondContact O-CG1 3.46Å; V258-I262 PolarHBondContact O-N 3.43Å; I262-T264 VanDerWaalsContact C-N 3.27Å; I262-T264 PolarHBondContact O-N 2.98Å; I262-C547 VanDerWaalsContact CD1-O 3.32Å; I262-C547 WeakPolarHBondContact CD1-O 3.21Å; I262-C547 VanDerWaalsContact CG1-O 3.26Å; I262-C547 WeakPolarHBondContact CG1-O 3.43Å
263	G	92.5	Very high	90.3	Very high	69 Å²	69	53 Å²	53	71%	0.711	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-7.4	172.9	0	0	0	0	0	114.8	K259 W260 F261	K259-G263 PolarHBondContact O-N 2.97Å; K259-G263 VanDerWaalsContact O-N 3.14Å; W260-G263 CarbonylContact O-C 3.56Å; W260-G263 PolarHBondContact O-N 3.35Å; F261-G263 VanDerWaalsContact C-N 3.26Å; F261-G263 PolarHBondContact O-N 3.37Å
264	T	93.1	Very high	89	Confident	40 Å²	40	54.2 Å²	54.2	25%	0.245	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-40.3	-174.1	-56.7	0	0	0	0	112.3	W260 F261 I262 Y290	W260-T264 HydrophobicContact CZ2-CG2 4.14Å; W260-T264 PolarHBondContact NE1-OG1 3.49Å; W260-T264 WeakPolarHBondContact O-CB 3.28Å; W260-T264 PolarHBondContact O-N 3.17Å; W260-T264 VanDerWaalsContact O-N 3.08Å; W260-T264 PolarHBondContact O-OG1 3.04Å; F261-T264 PolarHBondContact O-N 3.48Å; I262-T264 VanDerWaalsContact C-N 3.27Å; I262-T264 PolarHBondContact O-N 2.98Å; T264-Y290 HydrophobicContact CG2-CD1 3.85Å; T264-Y290 HydrophobicContact CG2-CE1 4.24Å
265	F	94.1	Very high	87.6	Confident	8 Å²	8	63.2 Å²	63.2	4%	0.035	37%	0.374	C	S	.	.			trans	-103.1	138.8	-179.6	-72.1	-93.9	0	0	0	111.3	I236 F261 F287 Y290 L298 I301 I305	I236-F265 HydrophobicContact CG2-CE2 4.35Å; I236-F265 HydrophobicContact CG2-CZ 4.25Å; F261-F265 AromaticContact CD2-CD2 3.35Å; F261-F265 HydrophobicContact CD2-CD2 3.35Å; F261-F265 AromaticContact CD2-CE2 3.81Å; F261-F265 HydrophobicContact CD2-CE2 3.81Å; F261-F265 HydrophobicContact CD2-CG 4.15Å; F261-F265 HydrophobicContact CE2-CB 4.02Å; F261-F265 HydrophobicContact CE2-CD1 4.41Å; F261-F265 AromaticContact CE2-CD2 3.23Å; F261-F265 HydrophobicContact CE2-CD2 3.23Å; F261-F265 AromaticContact CE2-CE2 3.72Å; F261-F265 HydrophobicContact CE2-CE2 3.72Å; F261-F265 AromaticContact CE2-CG 3.63Å; F261-F265 HydrophobicContact CE2-CG 3.63Å; F261-F265 HydrophobicContact CE2-CZ 4.48Å; F261-F265 HydrophobicContact CG-CD2 4.35Å; F261-F265 HydrophobicContact CZ-CB 4.12Å; F261-F265 HydrophobicContact CZ-CD2 4.17Å; F261-F265 HydrophobicContact CZ-CG 4.17Å; F261-F265 PolarHBondContact O-N 2.99Å; F265-F287 HydrophobicContact CE1-CD1 4.2Å; F265-F287 HydrophobicContact CZ-CD1 4.02Å; F265-F287 HydrophobicContact CZ-CE1 4.22Å; F265-Y290 WeakPolarHBondContact CA-O 3.38Å; F265-Y290 HydrophobicContact CE1-CD1 4.15Å; F265-Y290 HydrophobicContact CE2-CD1 4.36Å; F265-Y290 AromaticContact CZ-CD1 3.98Å; F265-Y290 HydrophobicContact CZ-CD1 3.98Å; F265-L298 HydrophobicContact CB-CD1 3.82Å; F265-I301 HydrophobicContact CD1-CD1 4.41Å; F265-I301 HydrophobicContact CD1-CG2 3.9Å; F265-I301 HydrophobicContact CE1-CG2 3.56Å; F265-I301 HydrophobicContact CE2-CG2 4.35Å; F265-I301 HydrophobicContact CG-CG2 4.42Å; F265-I301 HydrophobicContact CZ-CG2 3.8Å; F265-I305 HydrophobicContact CE2-CD1 3.88Å; F265-I305 HydrophobicContact CZ-CD1 4.32Å
266	T	91.9	Very high	86.3	Confident	79 Å²	79	69.5 Å²	69.5	49%	0.485	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	145.3	-178.1	47.8	0	0	0	0	111	Y290 S291 A292	T266-Y290 PolarHBondContact N-O 2.75Å; T266-Y290 VanDerWaalsContact N-O 3.08Å; T266-Y290 PolarHBondContact OG1-O 2.79Å; T266-S291 CarbonylContact O-C 3.58Å; T266-S291 WeakPolarHBondContact O-CA 3.33Å; T266-S291 PolarHBondContact OG1-OG 3.26Å; T266-A292 PolarHBondContact O-N 2.78Å
267	V	90.6	Very high	85.4	Confident	72 Å²	72	69.3 Å²	69.3	44%	0.436	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	121.8	171.2	-176.2	0	0	0	0	108.8	A292 L298	V267-A292 CarbonylContact C-O 3.59Å; V267-A292 WeakPolarHBondContact CA-O 3.47Å; V267-L298 HydrophobicContact CG2-CB 4.46Å; V267-L298 HydrophobicContact CG2-CD1 4.43Å; V267-L298 HydrophobicContact CG2-CD2 3.87Å; V267-L298 HydrophobicContact CG2-CG 4.48Å
268	N	89	Confident	84.9	Confident	64 Å²	64	74.5 Å²	74.5	34%	0.342	43%	0.426	S	S	.	.			trans	-130.7	103.5	177.3	-176.9	-1.7	0	0	0	110.5	E270 L271 A292 R293	N268-E270 PolarHBondContact O-N 3.33Å; N268-E270 VanDerWaalsContact O-N 3.17Å; N268-E270 WeakPolarHBondContact OD1-CB 3.35Å; N268-E270 PolarHBondContact OD1-N 2.97Å; N268-L271 HydrophobicContact CB-CD1 4.17Å; N268-L271 HydrophobicContact CB-CG 4.14Å; N268-L271 WeakPolarHBondContact O-CB 3.35Å; N268-L271 WeakPolarHBondContact O-CG 3.27Å; N268-L271 PolarHBondContact O-N 2.74Å; N268-A292 PolarHBondContact N-O 3.23Å; N268-R293 CarbonylContact C-O 3.56Å; N268-R293 WeakPolarHBondContact O-CA 3.35Å
269	A	87.2	Confident	84.6	Confident	87 Å²	87	76.2 Å²	76.2	72%	0.719	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-13.5	-178.8	0	0	0	0	0	114.4	L271 R293	A269-L271 PolarHBondContact O-N 2.85Å; A269-R293 WeakPolarHBondContact CA-O 3.12Å
270	E	84.1	Confident	84.3	Confident	177 Å²	177	73.1 Å²	73.1	83%	0.827	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	-8.8	177.3	-57.3	-176.4	166	0	0	112.9	N268 S272	N268-E270 PolarHBondContact O-N 3.33Å; N268-E270 VanDerWaalsContact O-N 3.17Å; N268-E270 WeakPolarHBondContact OD1-CB 3.35Å; N268-E270 PolarHBondContact OD1-N 2.97Å; E270-S272 PolarHBondContact O-N 2.86Å
271	L	83.6	Confident	84	Confident	28 Å²	28	73.4 Å²	73.4	15%	0.147	43%	0.429	C	S	.	.	S	Bend	trans	-64.8	120.3	178.5	-71.9	173.3	0	0	0	111.6	N268 A269 A273 R293	N268-L271 HydrophobicContact CB-CD1 4.17Å; N268-L271 HydrophobicContact CB-CG 4.14Å; N268-L271 WeakPolarHBondContact O-CB 3.35Å; N268-L271 WeakPolarHBondContact O-CG 3.27Å; N268-L271 PolarHBondContact O-N 2.74Å; A269-L271 PolarHBondContact O-N 2.85Å; L271-A273 PolarHBondContact O-N 3.12Å; L271-R293 HydrophobicContact CB-CB 4.21Å; L271-R293 HydrophobicContact CB-CG 4.33Å
272	S	75.2	Confident	83.8	Confident	92 Å²	92	74.4 Å²	74.4	64%	0.643	44%	0.435	S	S	*	.			trans	-55	127	-175.1	61.4	0	0	0	0	112.7	E270 S274	E270-S272 PolarHBondContact O-N 2.86Å; S272-S274 PolarHBondContact O-N 2.61Å
273	A	69	Low	83.8	Confident	64 Å²	64	70.8 Å²	70.8	53%	0.529	42%	0.416	S	S	.	.			trans	-88.7	92.3	164.9	0	0	0	0	0	108.7	L271	L271-A273 PolarHBondContact O-N 3.12Å
274	S	66.4	Low	83.7	Confident	46 Å²	46	70.4 Å²	70.4	32%	0.322	40%	0.396	S	S	.	.			trans	-77.7	127.5	170.1	119	0	0	0	0	108.5	S272 Q276 D277	S272-S274 PolarHBondContact O-N 2.61Å; S274-Q276 PolarHBondContact O-N 3.23Å; S274-D277 VanDerWaalsContact CB-OD2 3.27Å; S274-D277 WeakPolarHBondContact CB-OD2 3.34Å; S274-D277 WeakPolarHBondContact OG-CB 3.26Å; S274-D277 PolarHBondContact OG-N 3.09Å; S274-D277 VanDerWaalsContact OG-N 3.17Å; S274-D277 PolarHBondContact OG-OD2 3.33Å
275	E	64.5	Low	83.6	Confident	189 Å²	189	74.4 Å²	74.4	88%	0.883	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-13.8	-178.9	-63.7	-174.6	155.8	0	0	112.5
276	Q	67.2	Low	83.5	Confident	165 Å²	165	74.6 Å²	74.6	77%	0.771	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-20.2	178.1	-75.2	79.6	24.6	0	0	114.1	S274	S274-Q276 PolarHBondContact O-N 3.23Å
277	D	75.2	Confident	83.4	Confident	43 Å²	43	71 Å²	71	23%	0.23	39%	0.385	C	S	.	.	S	Bend	trans	-76.6	127.3	-178.6	-72.8	-50.8	0	0	0	111.6	S274 R285	S274-D277 VanDerWaalsContact CB-OD2 3.27Å; S274-D277 WeakPolarHBondContact CB-OD2 3.34Å; S274-D277 WeakPolarHBondContact OG-CB 3.26Å; S274-D277 PolarHBondContact OG-N 3.09Å; S274-D277 VanDerWaalsContact OG-N 3.17Å; S274-D277 PolarHBondContact OG-OD2 3.33Å; D277-R285 VanDerWaalsContact CG-NH1 3.28Å; D277-R285 IonicContact OD1-CZ 3.39Å; D277-R285 IonicContact OD1-NH1 3.35Å; D277-R285 PolarHBondContact OD1-NH1 3.23Å; D277-R285 IonicContact OD1-NH2 2.7Å; D277-R285 PolarHBondContact OD1-NH2 2.78Å; D277-R285 IonicContact OD2-CZ 3.52Å; D277-R285 IonicContact OD2-NH1 2.69Å; D277-R285 PolarHBondContact OD2-NH1 2.75Å; D277-R285 IonicContact OD2-NH2 3.6Å
278	N	85.8	Confident	83.4	Confident	108 Å²	108	71.3 Å²	71.3	58%	0.578	40%	0.395	S	S	*	.			trans	-65.3	149.5	170.8	-71.4	-40.8	0	0	0	110	Q280 T281 T282	N278-Q280 PolarHBondContact O-N 3.06Å; N278-Q280 VanDerWaalsContact O-N 3.09Å; N278-T281 PolarHBondContact N-OG1 2.95Å; N278-T281 VanDerWaalsContact N-OG1 3.14Å; N278-T281 PolarHBondContact O-N 2.83Å; N278-T281 PolarHBondContact O-OG1 3.21Å; N278-T282 PolarHBondContact O-N 2.85Å; N278-T282 PolarHBondContact O-OG1 3.13Å
279	L	87.2	Confident	83.5	Confident	37 Å²	37	72.7 Å²	72.7	19%	0.194	40%	0.402	C	S	.	.	H	α-helix	trans	-54.1	-36	-178.6	177.6	63.6	0	0	0	112.7	R220 I223 T282 L283	R220-L279 HydrophobicContact CG-CD2 4.42Å; I223-L279 HydrophobicContact CB-CD2 4.44Å; I223-L279 HydrophobicContact CD1-CB 3.86Å; I223-L279 HydrophobicContact CD1-CD2 4.16Å; I223-L279 HydrophobicContact CD1-CG 4.39Å; I223-L279 HydrophobicContact CG2-CB 4.49Å; I223-L279 HydrophobicContact CG2-CD2 4.27Å; I223-L279 HydrophobicContact CG2-CG 4.18Å; L279-T282 PolarHBondContact O-N 2.81Å; L279-L283 HydrophobicContact CD1-CD1 4.13Å; L279-L283 HydrophobicContact CD1-CG 4.19Å; L279-L283 HydrophobicContact CG-CD1 3.97Å; L279-L283 HydrophobicContact CG-CG 4.47Å; L279-L283 VanDerWaalsContact O-CG 3.3Å; L279-L283 WeakPolarHBondContact O-CG 3.45Å; L279-L283 PolarHBondContact O-N 3.5Å
280	Q	89.9	Confident	83.8	Confident	56 Å²	56	73.4 Å²	73.4	26%	0.262	39%	0.386	S	S	.	.	H	α-helix	trans	-56.6	-56.5	172.2	172.4	173.6	-6.9	0	0	112.1	I223 L229 N278 T282 L283 E284	I223-Q280 HydrophobicContact CG2-CB 4.18Å; L229-Q280 HydrophobicContact CD1-CG 4.24Å; L229-Q280 HydrophobicContact CG-CG 4.45Å; N278-Q280 PolarHBondContact O-N 3.06Å; N278-Q280 VanDerWaalsContact O-N 3.09Å; Q280-T282 PolarHBondContact O-N 3.15Å; Q280-L283 PolarHBondContact O-N 3.44Å; Q280-L283 VanDerWaalsContact O-N 3.09Å; Q280-E284 HydrophobicContact CG-CG 4.45Å; Q280-E284 WeakPolarHBondContact CG-OE1 3.48Å; Q280-E284 PolarHBondContact NE2-OE1 2.9Å; Q280-E284 WeakPolarHBondContact O-CG 3.42Å; Q280-E284 PolarHBondContact O-N 3.2Å
281	T	89.1	Confident	84.2	Confident	43 Å²	43	65.7 Å²	65.7	26%	0.264	35%	0.352	S	S	.	.	H	α-helix	trans	-63.1	-29.2	-179.2	42.7	0	0	0	0	112.8	N278 R285	N278-T281 PolarHBondContact N-OG1 2.95Å; N278-T281 VanDerWaalsContact N-OG1 3.14Å; N278-T281 PolarHBondContact O-N 2.83Å; N278-T281 PolarHBondContact O-OG1 3.21Å; T281-R285 WeakPolarHBondContact O-CG 3.36Å; T281-R285 PolarHBondContact O-N 3.38Å
282	T	91.2	Very high	84.6	Confident	20 Å²	20	64.3 Å²	64.3	12%	0.123	35%	0.345	C	S	.	.	H	α-helix	trans	-67.1	-48.2	172.1	-57.6	0	0	0	0	111	N278 L279 Q280 R285 R286 E297	N278-T282 PolarHBondContact O-N 2.85Å; N278-T282 PolarHBondContact O-OG1 3.13Å; L279-T282 PolarHBondContact O-N 2.81Å; Q280-T282 PolarHBondContact O-N 3.15Å; T282-R285 PolarHBondContact O-N 3.31Å; T282-R286 WeakPolarHBondContact O-CG 3.39Å; T282-R286 PolarHBondContact O-N 3.46Å; T282-E297 WeakPolarHBondContact CG2-OE1 3.38Å
283	L	92.1	Very high	85.4	Confident	0 Å²	0	64 Å²	64	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-63.9	-42	179	-69.5	168.1	0	0	0	112.2	I223 L229 L279 Q280 R285 R286 F287 H300 I301 L304	I223-L283 HydrophobicContact CG2-CD1 4.21Å; L229-L283 HydrophobicContact CD1-CD1 4.41Å; L229-L283 HydrophobicContact CD2-CB 4.05Å; L279-L283 HydrophobicContact CD1-CD1 4.13Å; L279-L283 HydrophobicContact CD1-CG 4.19Å; L279-L283 HydrophobicContact CG-CD1 3.97Å; L279-L283 HydrophobicContact CG-CG 4.47Å; L279-L283 VanDerWaalsContact O-CG 3.3Å; L279-L283 WeakPolarHBondContact O-CG 3.45Å; L279-L283 PolarHBondContact O-N 3.5Å; Q280-L283 PolarHBondContact O-N 3.44Å; Q280-L283 VanDerWaalsContact O-N 3.09Å; L283-R285 VanDerWaalsContact C-N 3.31Å; L283-R285 PolarHBondContact O-N 2.75Å; L283-R286 PolarHBondContact O-N 2.78Å; L283-F287 WeakPolarHBondContact O-CD2 3.48Å; L283-F287 PolarHBondContact O-N 2.77Å; L283-H300 HydrophobicContact CD1-CB 4.41Å; L283-H300 HydrophobicContact CD2-CB 3.96Å; L283-I301 HydrophobicContact CD2-CG1 3.92Å; L283-L304 HydrophobicContact CD1-CD1 4.09Å
284	E	91.8	Very high	86.4	Confident	61 Å²	61	62.9 Å²	62.9	29%	0.285	31%	0.314	S	S	.	.	H	α-helix	trans	-53.7	-46.5	173	-71.4	167	-175.7	0	0	111.6	L229 I232 Q280 F287 A288	L229-E284 HydrophobicContact CD2-CG 3.66Å; I232-E284 HydrophobicContact CD1-CG 3.98Å; Q280-E284 HydrophobicContact CG-CG 4.45Å; Q280-E284 WeakPolarHBondContact CG-OE1 3.48Å; Q280-E284 PolarHBondContact NE2-OE1 2.9Å; Q280-E284 WeakPolarHBondContact O-CG 3.42Å; Q280-E284 PolarHBondContact O-N 3.2Å; E284-F287 PolarHBondContact O-N 3.09Å; E284-A288 PolarHBondContact O-N 3.37Å
285	R	90.2	Very high	87.6	Confident	124 Å²	124	63.3 Å²	63.3	47%	0.468	31%	0.313	S	S	.	.	H	α-helix	trans	-68.2	-33.6	175.8	-67.7	179.8	-162.4	156.2	16.2	113	D277 T281 T282 L283 A288 I289	D277-R285 VanDerWaalsContact CG-NH1 3.28Å; D277-R285 IonicContact OD1-CZ 3.39Å; D277-R285 IonicContact OD1-NH1 3.35Å; D277-R285 PolarHBondContact OD1-NH1 3.23Å; D277-R285 IonicContact OD1-NH2 2.7Å; D277-R285 PolarHBondContact OD1-NH2 2.78Å; D277-R285 IonicContact OD2-CZ 3.52Å; D277-R285 IonicContact OD2-NH1 2.69Å; D277-R285 PolarHBondContact OD2-NH1 2.75Å; D277-R285 IonicContact OD2-NH2 3.6Å; T281-R285 WeakPolarHBondContact O-CG 3.36Å; T281-R285 PolarHBondContact O-N 3.38Å; T282-R285 PolarHBondContact O-N 3.31Å; L283-R285 VanDerWaalsContact C-N 3.31Å; L283-R285 PolarHBondContact O-N 2.75Å; R285-A288 PolarHBondContact O-N 3.19Å; R285-I289 WeakPolarHBondContact O-CG1 3.48Å; R285-I289 PolarHBondContact O-N 3.13Å
286	R	91.3	Very high	88.9	Confident	12 Å²	12	58.5 Å²	58.5	5%	0.045	29%	0.291	C	S	.	.	H	α-helix	trans	-66.8	-40.4	176.3	-64.7	-27.6	-173.7	-155.7	-8.4	112.2	T282 L283 A288 I289 Y290 S291 E297 I301	T282-R286 WeakPolarHBondContact O-CG 3.39Å; T282-R286 PolarHBondContact O-N 3.46Å; L283-R286 PolarHBondContact O-N 2.78Å; R286-A288 VanDerWaalsContact C-N 3.31Å; R286-A288 PolarHBondContact O-N 3.04Å; R286-I289 PolarHBondContact O-N 3.05Å; R286-Y290 PolarHBondContact O-N 3.31Å; R286-S291 VanDerWaalsContact CB-O 3.3Å; R286-S291 WeakPolarHBondContact CB-O 3.31Å; R286-S291 VanDerWaalsContact CD-O 3.32Å; R286-S291 WeakPolarHBondContact CD-O 3.19Å; R286-S291 WeakPolarHBondContact CG-O 3.1Å; R286-S291 PolarHBondContact O-N 2.66Å; R286-E297 WeakPolarHBondContact CG-OE2 3.41Å; R286-E297 IonicContact CZ-OE1 3.29Å; R286-E297 IonicContact CZ-OE2 3.75Å; R286-E297 IonicContact NE-OE1 2.71Å; R286-E297 IonicContact NE-OE2 3.03Å; R286-E297 PolarHBondContact NE-OE2 3.45Å; R286-E297 IonicContact NH2-OE1 3.03Å; R286-E297 PolarHBondContact NH2-OE1 3.39Å; R286-E297 IonicContact NH2-OE2 3.47Å; R286-E297 PolarHBondContact NH2-OE2 3.04Å; R286-I301 HydrophobicContact CB-CD1 3.71Å; R286-I301 HydrophobicContact CG-CD1 4.37Å
287	F	91	Very high	90	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.009	26%	0.256	C	S	.	.	H	α-helix	trans	-60.4	-39.6	173.3	-80.7	-68.8	0	0	0	112.6	L229 I232 I236 F265 L283 E284 I289 I301 L304 I305	L229-F287 HydrophobicContact CD2-CE2 4.48Å; I232-F287 HydrophobicContact CG2-CB 3.53Å; I232-F287 HydrophobicContact CG2-CD1 4.27Å; I232-F287 HydrophobicContact CG2-CD2 3.95Å; I232-F287 HydrophobicContact CG2-CG 3.67Å; I236-F287 HydrophobicContact CD1-CB 4Å; I236-F287 HydrophobicContact CD1-CD1 3.56Å; I236-F287 HydrophobicContact CD1-CE1 4.46Å; I236-F287 HydrophobicContact CD1-CG 4.19Å; F265-F287 HydrophobicContact CE1-CD1 4.2Å; F265-F287 HydrophobicContact CZ-CD1 4.02Å; F265-F287 HydrophobicContact CZ-CE1 4.22Å; L283-F287 WeakPolarHBondContact O-CD2 3.48Å; L283-F287 PolarHBondContact O-N 2.77Å; E284-F287 PolarHBondContact O-N 3.09Å; F287-I289 VanDerWaalsContact C-N 3.26Å; F287-I289 PolarHBondContact O-N 2.93Å; F287-I301 HydrophobicContact CD1-CG2 4.17Å; F287-I301 HydrophobicContact CE1-CG2 3.53Å; F287-I301 HydrophobicContact CZ-CB 4.3Å; F287-I301 HydrophobicContact CZ-CG1 4.49Å; F287-I301 HydrophobicContact CZ-CG2 3.74Å; F287-L304 HydrophobicContact CE2-CB 4.34Å; F287-L304 HydrophobicContact CE2-CD1 3.69Å; F287-L304 HydrophobicContact CZ-CB 3.85Å; F287-L304 HydrophobicContact CZ-CD1 4.03Å; F287-I305 HydrophobicContact CE1-CG1 4.44Å
288	A	90.4	Very high	90.9	Very high	79 Å²	79	49.5 Å²	49.5	65%	0.653	25%	0.248	S	C	*	.	H	α-helix	trans	-66.4	-24.8	178.3	0	0	0	0	0	114.1	E284 R285 R286	E284-A288 PolarHBondContact O-N 3.37Å; R285-A288 PolarHBondContact O-N 3.19Å; R286-A288 VanDerWaalsContact C-N 3.31Å; R286-A288 PolarHBondContact O-N 3.04Å
289	I	91.9	Very high	91.4	Very high	94 Å²	94	44.4 Å²	44.4	48%	0.482	22%	0.221	S	C	.	.	H	α-helix	trans	-102.7	-16.2	-176.4	-60.6	169.2	0	0	0	112	R285 R286 F287 S291	R285-I289 WeakPolarHBondContact O-CG1 3.48Å; R285-I289 PolarHBondContact O-N 3.13Å; R286-I289 PolarHBondContact O-N 3.05Å; F287-I289 VanDerWaalsContact C-N 3.26Å; F287-I289 PolarHBondContact O-N 2.93Å; I289-S291 PolarHBondContact O-N 3.46Å
290	Y	92.5	Very high	91.7	Very high	101 Å²	101	42.9 Å²	42.9	40%	0.396	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	31.7	-170.2	-58.9	-94.8	0	0	0	113.5	I236 T264 F265 T266 R286	I236-Y290 HydrophobicContact CD1-CE1 4.15Å; I236-Y290 HydrophobicContact CG1-CE1 4.12Å; I236-Y290 HydrophobicContact CG2-CE1 3.68Å; T264-Y290 HydrophobicContact CG2-CD1 3.85Å; T264-Y290 HydrophobicContact CG2-CE1 4.24Å; F265-Y290 WeakPolarHBondContact CA-O 3.38Å; F265-Y290 HydrophobicContact CE1-CD1 4.15Å; F265-Y290 HydrophobicContact CE2-CD1 4.36Å; F265-Y290 AromaticContact CZ-CD1 3.98Å; F265-Y290 HydrophobicContact CZ-CD1 3.98Å; T266-Y290 PolarHBondContact N-O 2.75Å; T266-Y290 VanDerWaalsContact N-O 3.08Å; T266-Y290 PolarHBondContact OG1-O 2.79Å; R286-Y290 PolarHBondContact O-N 3.31Å
291	S	92.9	Very high	92	Very high	15 Å²	15	40.2 Å²	40.2	11%	0.105	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	139.7	177	-57.8	0	0	0	0	112.3	T266 R286 I289	T266-S291 CarbonylContact O-C 3.58Å; T266-S291 WeakPolarHBondContact O-CA 3.33Å; T266-S291 PolarHBondContact OG1-OG 3.26Å; R286-S291 VanDerWaalsContact CB-O 3.3Å; R286-S291 WeakPolarHBondContact CB-O 3.31Å; R286-S291 VanDerWaalsContact CD-O 3.32Å; R286-S291 WeakPolarHBondContact CD-O 3.19Å; R286-S291 WeakPolarHBondContact CG-O 3.1Å; R286-S291 PolarHBondContact O-N 2.66Å; I289-S291 PolarHBondContact O-N 3.46Å
292	A	92.3	Very high	92.3	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	149.6	170.8	0	0	0	0	0	110.2	T266 V267 N268 E297 L298 I301	T266-A292 PolarHBondContact O-N 2.78Å; V267-A292 CarbonylContact C-O 3.59Å; V267-A292 WeakPolarHBondContact CA-O 3.47Å; N268-A292 PolarHBondContact N-O 3.23Å; A292-E297 HydrophobicContact CB-CB 3.92Å; A292-L298 HydrophobicContact CB-CB 3.88Å; A292-L298 HydrophobicContact CB-CD1 4.05Å; A292-I301 HydrophobicContact CB-CD1 4Å
293	R	90.7	Very high	92.5	Very high	85 Å²	85	37.2 Å²	37.2	32%	0.321	18%	0.182	S	C	.	.	S	Bend	trans	-69.4	-42.5	174.6	-174	-171.3	71.1	-162.2	1.5	112.1	N268 A269 L271 E297	N268-R293 CarbonylContact C-O 3.56Å; N268-R293 WeakPolarHBondContact O-CA 3.35Å; A269-R293 WeakPolarHBondContact CA-O 3.12Å; L271-R293 HydrophobicContact CB-CB 4.21Å; L271-R293 HydrophobicContact CB-CG 4.33Å; R293-E297 VanDerWaalsContact CB-CD 3.5Å; R293-E297 WeakPolarHBondContact CB-OE1 3.5Å; R293-E297 VanDerWaalsContact CB-OE2 3.29Å; R293-E297 WeakPolarHBondContact CB-OE2 3.04Å; R293-E297 PolarHBondContact N-OE2 2.65Å; R293-E297 IonicContact NE-OE1 3.55Å
294	D	90.4	Very high	92.7	Very high	40 Å²	40	37.2 Å²	37.2	21%	0.214	18%	0.182	C	C	.	.	S	Bend	trans	-146.3	172	-173.4	50.2	37	0	0	0	111.4	E296 E297 L298	D294-E296 PolarHBondContact O-N 2.84Å; D294-E296 PolarHBondContact OD1-N 3.17Å; D294-E297 PolarHBondContact O-N 2.85Å; D294-E297 PolarHBondContact OD1-N 3.24Å; D294-L298 PolarHBondContact O-N 3.41Å
295	D	91.5	Very high	92.8	Very high	56 Å²	56	34.3 Å²	34.3	30%	0.299	17%	0.168	S	C	.	.	H	α-helix	trans	-59.3	-28.2	177.6	-58.7	-20.9	0	0	0	111.9	V299 I528 V548	D295-V299 WeakPolarHBondContact O-CG2 3.33Å; D295-V299 PolarHBondContact O-N 3.39Å; D295-V299 VanDerWaalsContact O-N 3.15Å; D295-I528 HydrophobicContact CB-CD1 4.16Å; D295-V548 HydrophobicContact CB-CG1 4.23Å; D295-V548 HydrophobicContact CB-CG2 4.07Å
296	E	91.4	Very high	93.1	Very high	88 Å²	88	28.4 Å²	28.4	41%	0.411	15%	0.146	S	C	.	.	H	α-helix	trans	-66.1	-57.4	174.1	-73.2	-165.2	-153.7	0	0	111	R220 D294 L298 V299 H300 Q530	R220-E296 IonicContact CZ-OE2 3.51Å; R220-E296 IonicContact NH1-OE2 2.83Å; R220-E296 PolarHBondContact NH1-OE2 3.26Å; R220-E296 IonicContact NH2-OE2 2.71Å; R220-E296 PolarHBondContact NH2-OE2 3.46Å; D294-E296 PolarHBondContact O-N 2.84Å; D294-E296 PolarHBondContact OD1-N 3.17Å; E296-L298 PolarHBondContact O-N 3.47Å; E296-V299 PolarHBondContact O-N 3.33Å; E296-H300 PolarHBondContact O-N 3.38Å; E296-H300 VanDerWaalsContact O-N 3.16Å; E296-H300 PolarHBondContact O-ND1 2.94Å; E296-Q530 VanDerWaalsContact CA-NE2 3.35Å; E296-Q530 HydrophobicContact CG-CG 4.25Å; E296-Q530 PolarHBondContact O-NE2 2.99Å
297	E	92.3	Very high	93.2	Very high	9 Å²	9	28.7 Å²	28.7	4%	0.042	15%	0.147	C	C	.	.	H	α-helix	trans	-54	-40.4	176.2	-77.3	-175.9	-170.6	0	0	111.4	T282 R286 A292 R293 D294 V299 H300 I301	T282-E297 WeakPolarHBondContact CG2-OE1 3.38Å; R286-E297 WeakPolarHBondContact CG-OE2 3.41Å; R286-E297 IonicContact CZ-OE1 3.29Å; R286-E297 IonicContact CZ-OE2 3.75Å; R286-E297 IonicContact NE-OE1 2.71Å; R286-E297 IonicContact NE-OE2 3.03Å; R286-E297 PolarHBondContact NE-OE2 3.45Å; R286-E297 IonicContact NH2-OE1 3.03Å; R286-E297 PolarHBondContact NH2-OE1 3.39Å; R286-E297 IonicContact NH2-OE2 3.47Å; R286-E297 PolarHBondContact NH2-OE2 3.04Å; A292-E297 HydrophobicContact CB-CB 3.92Å; R293-E297 VanDerWaalsContact CB-CD 3.5Å; R293-E297 WeakPolarHBondContact CB-OE1 3.5Å; R293-E297 VanDerWaalsContact CB-OE2 3.29Å; R293-E297 WeakPolarHBondContact CB-OE2 3.04Å; R293-E297 PolarHBondContact N-OE2 2.65Å; R293-E297 IonicContact NE-OE1 3.55Å; D294-E297 PolarHBondContact O-N 2.85Å; D294-E297 PolarHBondContact OD1-N 3.24Å; E297-V299 PolarHBondContact O-N 3.31Å; E297-H300 PolarHBondContact O-N 3.41Å; E297-I301 VanDerWaalsContact O-CG1 3.3Å; E297-I301 WeakPolarHBondContact O-CG1 3.25Å; E297-I301 PolarHBondContact O-N 2.96Å
298	L	93.6	Very high	93.4	Very high	10 Å²	10	29.1 Å²	29.1	5%	0.052	15%	0.151	C	C	.	.	H	α-helix	trans	-60.1	-45.7	179	-169.2	72.8	0	0	0	112.5	F261 F265 V267 A292 D294 E296 H300 I301 F302 V548	F261-L298 HydrophobicContact CE1-CD1 3.74Å; F261-L298 HydrophobicContact CE1-CD2 4.33Å; F261-L298 HydrophobicContact CE1-CG 3.78Å; F261-L298 HydrophobicContact CZ-CD1 3.57Å; F261-L298 HydrophobicContact CZ-CG 3.91Å; F265-L298 HydrophobicContact CB-CD1 3.82Å; V267-L298 HydrophobicContact CG2-CB 4.46Å; V267-L298 HydrophobicContact CG2-CD1 4.43Å; V267-L298 HydrophobicContact CG2-CD2 3.87Å; V267-L298 HydrophobicContact CG2-CG 4.48Å; A292-L298 HydrophobicContact CB-CB 3.88Å; A292-L298 HydrophobicContact CB-CD1 4.05Å; D294-L298 PolarHBondContact O-N 3.41Å; E296-L298 PolarHBondContact O-N 3.47Å; L298-H300 VanDerWaalsContact C-N 3.34Å; L298-H300 PolarHBondContact O-N 3.02Å; L298-I301 PolarHBondContact O-N 3.45Å; L298-F302 PolarHBondContact O-N 3.39Å; L298-V548 HydrophobicContact CD2-CG2 4.35Å
299	V	95.1	Very high	93.5	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	12%	0.124	C	C	.	.	H	α-helix	trans	-63.8	-37	176.5	168.6	0	0	0	0	111.8	D295 E296 E297 F302 L303 L315 Q530 L532 V548	D295-V299 WeakPolarHBondContact O-CG2 3.33Å; D295-V299 PolarHBondContact O-N 3.39Å; D295-V299 VanDerWaalsContact O-N 3.15Å; E296-V299 PolarHBondContact O-N 3.33Å; E297-V299 PolarHBondContact O-N 3.31Å; V299-F302 PolarHBondContact O-N 3.2Å; V299-L303 WeakPolarHBondContact O-CB 3.05Å; V299-L303 PolarHBondContact O-N 3.14Å; V299-L315 HydrophobicContact CG1-CD1 4.42Å; V299-Q530 HydrophobicContact CG1-CG 4.33Å; V299-L532 HydrophobicContact CG1-CD2 3.65Å; V299-L532 HydrophobicContact CG1-CG 4.07Å; V299-V548 HydrophobicContact CG2-CG2 3.87Å
300	H	94.9	Very high	93.5	Very high	5 Å²	5	29.6 Å²	29.6	2%	0.023	14%	0.138	C	C	.	.	H	α-helix	trans	-66.9	-40.6	175.9	-64.9	100	0	0	0	112.2	L283 E296 E297 L298 L303 L304 Q530	L283-H300 HydrophobicContact CD1-CB 4.41Å; L283-H300 HydrophobicContact CD2-CB 3.96Å; E296-H300 PolarHBondContact O-N 3.38Å; E296-H300 VanDerWaalsContact O-N 3.16Å; E296-H300 PolarHBondContact O-ND1 2.94Å; E297-H300 PolarHBondContact O-N 3.41Å; L298-H300 VanDerWaalsContact C-N 3.34Å; L298-H300 PolarHBondContact O-N 3.02Å; H300-L303 PolarHBondContact O-N 2.84Å; H300-L304 WeakPolarHBondContact O-CG 3.48Å; H300-L304 PolarHBondContact O-N 3.48Å; H300-L304 VanDerWaalsContact O-N 3.1Å; H300-Q530 PolarHBondContact CE1-NE2 3.01Å; H300-Q530 VanDerWaalsContact CE1-NE2 3.26Å; H300-Q530 PolarHBondContact ND1-NE2 2.96Å
301	I	95.1	Very high	93.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.2	-43.6	174.7	-65.8	167.4	0	0	0	110.4	F261 F265 L283 R286 F287 A292 E297 L298 L304 I305	F261-I301 HydrophobicContact CE2-CB 4.5Å; F261-I301 HydrophobicContact CE2-CG2 3.82Å; F261-I301 HydrophobicContact CZ-CB 4.45Å; F261-I301 HydrophobicContact CZ-CG2 4.22Å; F265-I301 HydrophobicContact CD1-CD1 4.41Å; F265-I301 HydrophobicContact CD1-CG2 3.9Å; F265-I301 HydrophobicContact CE1-CG2 3.56Å; F265-I301 HydrophobicContact CE2-CG2 4.35Å; F265-I301 HydrophobicContact CG-CG2 4.42Å; F265-I301 HydrophobicContact CZ-CG2 3.8Å; L283-I301 HydrophobicContact CD2-CG1 3.92Å; R286-I301 HydrophobicContact CB-CD1 3.71Å; R286-I301 HydrophobicContact CG-CD1 4.37Å; F287-I301 HydrophobicContact CD1-CG2 4.17Å; F287-I301 HydrophobicContact CE1-CG2 3.53Å; F287-I301 HydrophobicContact CZ-CB 4.3Å; F287-I301 HydrophobicContact CZ-CG1 4.49Å; F287-I301 HydrophobicContact CZ-CG2 3.74Å; A292-I301 HydrophobicContact CB-CD1 4Å; E297-I301 VanDerWaalsContact O-CG1 3.3Å; E297-I301 WeakPolarHBondContact O-CG1 3.25Å; E297-I301 PolarHBondContact O-N 2.96Å; L298-I301 PolarHBondContact O-N 3.45Å; I301-L304 WeakPolarHBondContact O-CB 3.46Å; I301-L304 PolarHBondContact O-N 2.8Å; I301-I305 HydrophobicContact CG2-CD1 4.43Å; I301-I305 PolarHBondContact O-N 3.11Å; I301-I305 VanDerWaalsContact O-N 3.12Å
302	F	95.8	Very high	93.6	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-67.4	-37	178.4	-167.6	-120	0	0	0	112.9	L257 V258 F261 L298 V299 L304 I305 L306 L532 V545 C547	L257-F302 HydrophobicContact CD2-CE2 4.35Å; L257-F302 HydrophobicContact CD2-CZ 4.3Å; L257-F302 HydrophobicContact CG-CE2 4.2Å; L257-F302 HydrophobicContact CG-CZ 4.42Å; V258-F302 HydrophobicContact CG2-CE1 3.87Å; V258-F302 HydrophobicContact CG2-CE2 4.37Å; V258-F302 HydrophobicContact CG2-CZ 3.51Å; F261-F302 HydrophobicContact CB-CD2 3.85Å; F261-F302 HydrophobicContact CB-CE2 3.82Å; F261-F302 HydrophobicContact CD1-CB 4.21Å; F261-F302 AromaticContact CD1-CD2 3.59Å; F261-F302 HydrophobicContact CD1-CD2 3.59Å; F261-F302 HydrophobicContact CD1-CE2 4.24Å; F261-F302 HydrophobicContact CD1-CG 4.01Å; F261-F302 HydrophobicContact CD2-CB 4.49Å; F261-F302 AromaticContact CD2-CD2 3.61Å; F261-F302 HydrophobicContact CD2-CD2 3.61Å; F261-F302 HydrophobicContact CD2-CE2 4.39Å; F261-F302 HydrophobicContact CD2-CG 4.47Å; F261-F302 HydrophobicContact CE1-CB 3.73Å; F261-F302 HydrophobicContact CE1-CD2 4Å; F261-F302 HydrophobicContact CE1-CG 4.04Å; F261-F302 HydrophobicContact CE2-CB 4.04Å; F261-F302 HydrophobicContact CE2-CD2 4.03Å; F261-F302 HydrophobicContact CE2-CG 4.5Å; F261-F302 AromaticContact CG-CD2 3.37Å; F261-F302 HydrophobicContact CG-CD2 3.37Å; F261-F302 AromaticContact CG-CE2 3.89Å; F261-F302 HydrophobicContact CG-CE2 3.89Å; F261-F302 HydrophobicContact CG-CG 4.23Å; F261-F302 HydrophobicContact CZ-CB 3.64Å; F261-F302 HydrophobicContact CZ-CD2 4.21Å; F261-F302 HydrophobicContact CZ-CG 4.29Å; L298-F302 PolarHBondContact O-N 3.39Å; V299-F302 PolarHBondContact O-N 3.2Å; F302-L304 VanDerWaalsContact C-N 3.32Å; F302-L304 PolarHBondContact O-N 3.13Å; F302-I305 HydrophobicContact CD2-CG2 4.44Å; F302-I305 HydrophobicContact CE2-CG2 4.44Å; F302-I305 WeakPolarHBondContact O-CB 3.5Å; F302-I305 PolarHBondContact O-N 3.13Å; F302-L306 HydrophobicContact CD1-CD1 3.94Å; F302-L306 HydrophobicContact CD1-CG 4.45Å; F302-L306 HydrophobicContact CE1-CD1 3.64Å; F302-L306 HydrophobicContact CE1-CD2 4.28Å; F302-L306 HydrophobicContact CE1-CG 4.07Å; F302-L306 HydrophobicContact CZ-CD1 4.2Å; F302-L306 HydrophobicContact CZ-CD2 4.01Å; F302-L306 HydrophobicContact CZ-CG 4.14Å; F302-L306 WeakPolarHBondContact O-CG 3.48Å; F302-L306 PolarHBondContact O-N 3.39Å; F302-L532 HydrophobicContact CB-CD1 4.41Å; F302-L532 HydrophobicContact CD1-CD1 3.64Å; F302-L532 HydrophobicContact CE1-CD1 4.37Å; F302-L532 HydrophobicContact CG-CD1 4.43Å; F302-V545 HydrophobicContact CD1-CG1 4.49Å; F302-V545 HydrophobicContact CE1-CG1 3.62Å; F302-V545 HydrophobicContact CZ-CG1 4.38Å; F302-C547 HydrophobicContact CB-CB 4.11Å; F302-C547 HydrophobicContact CD1-CB 3.49Å; F302-C547 VanDerWaalsContact CD1-CB 3.49Å; F302-C547 HydrophobicContact CD2-CB 4.48Å; F302-C547 HydrophobicContact CE1-CB 4.05Å; F302-C547 HydrophobicContact CG-CB 3.76Å
303	L	96.1	Very high	93.7	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-60.1	-42.1	173.1	179.4	56.8	0	0	0	112.2	C224 V299 H300 I305 L306 R307 L315 L532	C224-L303 HydrophobicContact CB-CD2 3.73Å; C224-L303 HydrophobicContact CB-CG 4.19Å; V299-L303 WeakPolarHBondContact O-CB 3.05Å; V299-L303 PolarHBondContact O-N 3.14Å; H300-L303 PolarHBondContact O-N 2.84Å; L303-I305 VanDerWaalsContact C-N 3.33Å; L303-I305 PolarHBondContact O-N 3.08Å; L303-L306 PolarHBondContact O-N 3.11Å; L303-R307 HydrophobicContact CD1-CG 4.28Å; L303-R307 WeakPolarHBondContact O-CB 3.21Å; L303-R307 WeakPolarHBondContact O-CG 3.35Å; L303-R307 PolarHBondContact O-N 2.73Å; L303-L315 HydrophobicContact CD2-CB 3.84Å; L303-L315 HydrophobicContact CD2-CD1 4.19Å; L303-L315 HydrophobicContact CD2-CD2 4.4Å; L303-L315 HydrophobicContact CD2-CG 4.35Å; L303-L532 HydrophobicContact CB-CD1 3.8Å; L303-L532 HydrophobicContact CB-CD2 3.93Å; L303-L532 HydrophobicContact CD1-CD1 4.24Å; L303-L532 HydrophobicContact CD1-CD2 4.06Å; L303-L532 HydrophobicContact CD2-CD2 4.24Å; L303-L532 HydrophobicContact CG-CD2 4.3Å
304	L	95.5	Very high	94	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-63.6	-37.3	176	-77.4	166.4	0	0	0	112.2	C224 L229 H230 L283 F287 H300 I301 F302 R307 A308	C224-L304 HydrophobicContact CB-CD2 4.25Å; C224-L304 HydrophobicContact CB-CG 4.3Å; C224-L304 WeakPolarHBondContact O-CD2 3.47Å; L229-L304 HydrophobicContact CB-CD1 4.07Å; L229-L304 HydrophobicContact CB-CD2 3.6Å; L229-L304 HydrophobicContact CB-CG 4.47Å; L229-L304 HydrophobicContact CD1-CD1 4.08Å; L229-L304 HydrophobicContact CD1-CD2 4.3Å; L229-L304 HydrophobicContact CD2-CD1 4.4Å; L229-L304 HydrophobicContact CG-CD1 4.44Å; H230-L304 VanDerWaalsContact CD2-CD2 3.47Å; H230-L304 WeakPolarHBondContact CD2-CD2 3.29Å; L283-L304 HydrophobicContact CD1-CD1 4.09Å; F287-L304 HydrophobicContact CE2-CB 4.34Å; F287-L304 HydrophobicContact CE2-CD1 3.69Å; F287-L304 HydrophobicContact CZ-CB 3.85Å; F287-L304 HydrophobicContact CZ-CD1 4.03Å; H300-L304 WeakPolarHBondContact O-CG 3.48Å; H300-L304 PolarHBondContact O-N 3.48Å; H300-L304 VanDerWaalsContact O-N 3.1Å; I301-L304 WeakPolarHBondContact O-CB 3.46Å; I301-L304 PolarHBondContact O-N 2.8Å; F302-L304 VanDerWaalsContact C-N 3.32Å; F302-L304 PolarHBondContact O-N 3.13Å; L304-R307 PolarHBondContact O-N 3.31Å; L304-A308 VanDerWaalsContact O-CB 3.24Å; L304-A308 WeakPolarHBondContact O-CB 3.43Å; L304-A308 PolarHBondContact O-N 2.98Å
305	I	94.7	Very high	94.3	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-63	-45.4	173.1	-77.6	167	0	0	0	111.6	I237 W260 F261 F265 F287 I301 F302 L303 A308 L309	I237-I305 HydrophobicContact CD1-CB 4.25Å; I237-I305 HydrophobicContact CD1-CG1 4.35Å; I237-I305 HydrophobicContact CD1-CG2 3.77Å; I237-I305 HydrophobicContact CG1-CG1 4.32Å; I237-I305 HydrophobicContact CG1-CG2 4.02Å; W260-I305 HydrophobicContact CH2-CD1 4.26Å; W260-I305 HydrophobicContact CZ3-CD1 4.27Å; W260-I305 HydrophobicContact CZ3-CG2 4.3Å; F261-I305 HydrophobicContact CD2-CD1 3.58Å; F261-I305 HydrophobicContact CE2-CD1 3.73Å; F265-I305 HydrophobicContact CE2-CD1 3.88Å; F265-I305 HydrophobicContact CZ-CD1 4.32Å; F287-I305 HydrophobicContact CE1-CG1 4.44Å; I301-I305 HydrophobicContact CG2-CD1 4.43Å; I301-I305 PolarHBondContact O-N 3.11Å; I301-I305 VanDerWaalsContact O-N 3.12Å; F302-I305 HydrophobicContact CD2-CG2 4.44Å; F302-I305 HydrophobicContact CE2-CG2 4.44Å; F302-I305 WeakPolarHBondContact O-CB 3.5Å; F302-I305 PolarHBondContact O-N 3.13Å; L303-I305 VanDerWaalsContact C-N 3.33Å; L303-I305 PolarHBondContact O-N 3.08Å; I305-A308 PolarHBondContact O-N 2.89Å; I305-L309 PolarHBondContact O-N 3.46Å
306	L	95.2	Very high	94.6	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-67.8	-37.1	178.9	-63.7	166.9	0	0	0	112.2	L254 L257 F302 L303 L309 L311 T313 L532 V534	L254-L306 HydrophobicContact CD2-CD2 4.23Å; L257-L306 HydrophobicContact CD2-CD2 3.56Å; F302-L306 HydrophobicContact CD1-CD1 3.94Å; F302-L306 HydrophobicContact CD1-CG 4.45Å; F302-L306 HydrophobicContact CE1-CD1 3.64Å; F302-L306 HydrophobicContact CE1-CD2 4.28Å; F302-L306 HydrophobicContact CE1-CG 4.07Å; F302-L306 HydrophobicContact CZ-CD1 4.2Å; F302-L306 HydrophobicContact CZ-CD2 4.01Å; F302-L306 HydrophobicContact CZ-CG 4.14Å; F302-L306 WeakPolarHBondContact O-CG 3.48Å; F302-L306 PolarHBondContact O-N 3.39Å; L303-L306 PolarHBondContact O-N 3.11Å; L306-L309 PolarHBondContact O-N 3.33Å; L306-L311 HydrophobicContact CD2-CD1 4Å; L306-L311 WeakPolarHBondContact O-CB 3.32Å; L306-L311 PolarHBondContact O-N 3.17Å; L306-T313 HydrophobicContact CB-CG2 3.56Å; L306-T313 HydrophobicContact CD1-CG2 4.12Å; L306-T313 HydrophobicContact CG-CG2 4.44Å; L306-L532 HydrophobicContact CD1-CD1 3.59Å; L306-V534 HydrophobicContact CD1-CG2 3.87Å; L306-V534 HydrophobicContact CD2-CG2 4.27Å
307	R	94.7	Very high	94.8	Very high	17 Å²	17	15 Å²	15	6%	0.064	7%	0.074	C	C	.	.	H	α-helix	trans	-70	-36.7	175.3	-73.3	177.4	177	-179.3	2	112.7	N221 C224 S225 L303 L304 L309 Q310 T313	N221-R307 PolarHBondContact O-NH1 2.84Å; N221-R307 PolarHBondContact OD1-NH1 2.68Å; N221-R307 PolarHBondContact OD1-NH2 3.03Å; C224-R307 WeakPolarHBondContact O-CD 3.44Å; C224-R307 PolarHBondContact O-NH1 3.37Å; S225-R307 PolarHBondContact OG-NH1 3.22Å; L303-R307 HydrophobicContact CD1-CG 4.28Å; L303-R307 WeakPolarHBondContact O-CB 3.21Å; L303-R307 WeakPolarHBondContact O-CG 3.35Å; L303-R307 PolarHBondContact O-N 2.73Å; L304-R307 PolarHBondContact O-N 3.31Å; R307-L309 PolarHBondContact O-N 2.89Å; R307-Q310 WeakPolarHBondContact O-CA 3.46Å; R307-Q310 PolarHBondContact O-N 3.14Å; R307-T313 WeakPolarHBondContact CG-OG1 3.38Å; R307-T313 PolarHBondContact NE-OG1 2.96Å; R307-T313 PolarHBondContact NH2-O 2.55Å
308	A	93.9	Very high	95	Very high	12 Å²	12	14.9 Å²	14.9	10%	0.099	7%	0.074	C	C	.	.	H	α-helix	trans	-61.1	-30.7	171.4	0	0	0	0	0	112.7	H230 L234 I237 L304 I305 Q310	H230-A308 HydrophobicContact CB-CB 4.35Å; H230-A308 WeakPolarHBondContact O-CB 3.39Å; L234-A308 HydrophobicContact CB-CB 4.1Å; I237-A308 HydrophobicContact CD1-CB 4.21Å; L304-A308 VanDerWaalsContact O-CB 3.24Å; L304-A308 WeakPolarHBondContact O-CB 3.43Å; L304-A308 PolarHBondContact O-N 2.98Å; I305-A308 PolarHBondContact O-N 2.89Å; A308-Q310 PolarHBondContact O-N 3.49Å
309	L	93.5	Very high	95	Very high	18 Å²	18	14.8 Å²	14.8	9%	0.094	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	6.2	171.6	-70.7	167.5	0	0	0	114.1	I237 T242 L257 I305 L306 R307 L311	I237-L309 HydrophobicContact CD1-CD1 4.25Å; I237-L309 HydrophobicContact CD1-CD2 4.31Å; I237-L309 HydrophobicContact CD1-CG 3.9Å; I237-L309 HydrophobicContact CG2-CD2 4.28Å; T242-L309 HydrophobicContact CG2-CD2 3.9Å; L257-L309 HydrophobicContact CD1-CD1 4.22Å; L257-L309 HydrophobicContact CD2-CD1 3.82Å; I305-L309 PolarHBondContact O-N 3.46Å; L306-L309 PolarHBondContact O-N 3.33Å; R307-L309 PolarHBondContact O-N 2.89Å; L309-L311 HydrophobicContact CB-CD1 4.24Å; L309-L311 HydrophobicContact CB-CG 3.9Å; L309-L311 PolarHBondContact O-N 3.28Å
310	Q	92.3	Very high	94.9	Very high	165 Å²	165	17.3 Å²	17.3	77%	0.771	9%	0.085	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.4	28.2	-178.1	-56.3	-178.2	-19.2	0	0	113.7	P246 R307 A308	P246-Q310 HydrophobicContact CG-CB 4.43Å; R307-Q310 WeakPolarHBondContact O-CA 3.46Å; R307-Q310 PolarHBondContact O-N 3.14Å; A308-Q310 PolarHBondContact O-N 3.49Å
311	L	92.9	Very high	94.9	Very high	13 Å²	13	17.8 Å²	17.8	7%	0.068	9%	0.088	C	C	.	.			trans	-84.7	134.2	175.5	-52	-176.9	0	0	0	110.4	P246 V249 L254 L306 L309 T313 V534	P246-L311 HydrophobicContact CB-CD2 3.87Å; P246-L311 HydrophobicContact CG-CD2 4.3Å; V249-L311 HydrophobicContact CB-CD2 4.49Å; V249-L311 HydrophobicContact CG1-CD1 4.39Å; V249-L311 HydrophobicContact CG2-CD1 4.43Å; V249-L311 HydrophobicContact CG2-CD2 3.79Å; L254-L311 HydrophobicContact CD2-CD1 4.46Å; L306-L311 HydrophobicContact CD2-CD1 4Å; L306-L311 WeakPolarHBondContact O-CB 3.32Å; L306-L311 PolarHBondContact O-N 3.17Å; L309-L311 HydrophobicContact CB-CD1 4.24Å; L309-L311 HydrophobicContact CB-CG 3.9Å; L309-L311 PolarHBondContact O-N 3.28Å; L311-T313 HydrophobicContact CB-CG2 4.13Å; L311-T313 VanDerWaalsContact O-CG2 3.25Å; L311-T313 WeakPolarHBondContact O-CG2 3.46Å; L311-T313 PolarHBondContact O-N 2.82Å; L311-T313 PolarHBondContact O-OG1 3.35Å; L311-T313 VanDerWaalsContact O-OG1 3.1Å; L311-V534 HydrophobicContact CB-CG1 4.15Å; L311-V534 HydrophobicContact CD1-CG1 4.32Å
312	L	93.2	Very high	94.7	Very high	43 Å²	43	21.1 Å²	21.1	23%	0.225	11%	0.106	C	C	.	.			trans	-67.4	118.2	175.1	-171.9	77.1	0	0	0	109.4	F535 W542 D573 R617	L312-F535 HydrophobicContact CB-CB 4.15Å; L312-F535 HydrophobicContact CD2-CB 3.85Å; L312-F535 HydrophobicContact CD2-CD1 4.34Å; L312-F535 HydrophobicContact CD2-CG 4.18Å; L312-F535 HydrophobicContact CG-CB 4.39Å; L312-F535 PolarHBondContact O-N 2.96Å; L312-W542 HydrophobicContact CD2-CH2 3.58Å; L312-W542 HydrophobicContact CD2-CZ2 3.85Å; L312-W542 HydrophobicContact CD2-CZ3 4.46Å; L312-W542 HydrophobicContact CG-CH2 3.74Å; L312-W542 HydrophobicContact CG-CZ2 4.5Å; L312-W542 HydrophobicContact CG-CZ3 4.39Å; L312-D573 WeakPolarHBondContact CD1-OD1 3.47Å; L312-R617 VanDerWaalsContact CD2-CZ 3.46Å; L312-R617 VanDerWaalsContact CD2-NH1 3.26Å
313	T	95.7	Very high	94.5	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	123.5	-161.1	44.3	0	0	0	0	112.9	L306 R307 L311 E533 V534 S574	L306-T313 HydrophobicContact CB-CG2 3.56Å; L306-T313 HydrophobicContact CD1-CG2 4.12Å; L306-T313 HydrophobicContact CG-CG2 4.44Å; R307-T313 WeakPolarHBondContact CG-OG1 3.38Å; R307-T313 PolarHBondContact NE-OG1 2.96Å; R307-T313 PolarHBondContact NH2-O 2.55Å; L311-T313 HydrophobicContact CB-CG2 4.13Å; L311-T313 VanDerWaalsContact O-CG2 3.25Å; L311-T313 WeakPolarHBondContact O-CG2 3.46Å; L311-T313 PolarHBondContact O-N 2.82Å; L311-T313 PolarHBondContact O-OG1 3.35Å; L311-T313 VanDerWaalsContact O-OG1 3.1Å; T313-E533 WeakPolarHBondContact CA-O 3.25Å; T313-V534 HydrophobicContact CG2-CG1 4.49Å; T313-V534 HydrophobicContact CG2-CG2 4.13Å; T313-S574 PolarHBondContact O-N 3.33Å
314	R	96.2	Very high	94.1	Very high	11 Å²	11	26.3 Å²	26.3	4%	0.042	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	134.3	172.1	-67.8	162.3	172.3	176.8	-1.2	111.1	V316 L532 E533 W542 I572 D573 E621	R314-V316 HydrophobicContact CB-CG2 4.47Å; R314-L532 WeakPolarHBondContact O-CA 3.41Å; R314-E533 HydrophobicContact CB-CB 4.16Å; R314-E533 WeakPolarHBondContact CD-OE2 3.36Å; R314-E533 PolarHBondContact N-O 2.75Å; R314-E533 IonicContact NH1-OE2 2.66Å; R314-E533 PolarHBondContact NH1-OE2 2.92Å; R314-E533 VanDerWaalsContact NH1-OE2 3.15Å; R314-E533 PolarHBondContact O-N 3.06Å; R314-W542 HydrophobicContact CB-CZ3 4.32Å; R314-W542 HydrophobicContact CG-CE3 4.32Å; R314-W542 HydrophobicContact CG-CH2 3.65Å; R314-W542 HydrophobicContact CG-CZ2 4.32Å; R314-W542 HydrophobicContact CG-CZ3 3.67Å; R314-W542 VanDerWaalsContact CZ-CZ2 3.43Å; R314-W542 VanDerWaalsContact CZ-NE1 3.35Å; R314-I572 CarbonylContact C-O 3.55Å; R314-I572 WeakPolarHBondContact CA-O 3.5Å; R314-D573 HydrophobicContact CG-CB 4.12Å; R314-E621 IonicContact CZ-OE1 2.77Å; R314-E621 IonicContact CZ-OE2 3.15Å; R314-E621 IonicContact NH1-OE1 3.84Å; R314-E621 PolarHBondContact NH1-OE1 2.91Å; R314-E621 IonicContact NH1-OE2 2.68Å; R314-E621 PolarHBondContact NH1-OE2 2.72Å; R314-E621 VanDerWaalsContact NH1-OE2 3.13Å; R314-E621 IonicContact NH2-OE1 2.81Å; R314-E621 IonicContact NH2-OE2 2.85Å; R314-E621 PolarHBondContact NH2-OE2 2.71Å
315	L	97	Very high	93.3	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	114.3	159.3	176.8	57.5	0	0	0	107.8	R220 V299 L303 L317 L532 I572	R220-L315 HydrophobicContact CB-CD2 3.99Å; V299-L315 HydrophobicContact CG1-CD1 4.42Å; L303-L315 HydrophobicContact CD2-CB 3.84Å; L303-L315 HydrophobicContact CD2-CD1 4.19Å; L303-L315 HydrophobicContact CD2-CD2 4.4Å; L303-L315 HydrophobicContact CD2-CG 4.35Å; L315-L317 HydrophobicContact CD1-CD2 4.02Å; L315-L317 HydrophobicContact CD2-CD1 4.43Å; L315-L317 HydrophobicContact CD2-CD2 4.18Å; L315-L317 HydrophobicContact CD2-CG 4.5Å; L315-L317 HydrophobicContact CG-CD1 4.49Å; L315-L317 HydrophobicContact CG-CD2 3.86Å; L315-L317 HydrophobicContact CG-CG 4.08Å; L315-L532 HydrophobicContact CD1-CD2 3.89Å; L315-I572 PolarHBondContact N-O 3.45Å; L315-I572 PolarHBondContact O-N 2.95Å
316	V	97.1	Very high	91.7	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	126.2	179.2	-173.1	0	0	0	0	109.8	R314 Q530 W531 E533 V569 V570 V581 Y585	R314-V316 HydrophobicContact CB-CG2 4.47Å; V316-Q530 VanDerWaalsContact O-CA 3.28Å; V316-Q530 WeakPolarHBondContact O-CA 3.36Å; V316-W531 WeakPolarHBondContact CA-O 3.29Å; V316-W531 HydrophobicContact CB-CD2 4.46Å; V316-W531 HydrophobicContact CB-CG 4.38Å; V316-W531 WeakPolarHBondContact CB-O 3.32Å; V316-W531 HydrophobicContact CG1-CD2 4.38Å; V316-W531 HydrophobicContact CG1-CZ2 3.66Å; V316-W531 PolarHBondContact N-O 3.01Å; V316-W531 PolarHBondContact O-N 3.03Å; V316-W531 VanDerWaalsContact O-O 3.07Å; V316-E533 HydrophobicContact CG2-CB 4.01Å; V316-E533 HydrophobicContact CG2-CG 3.7Å; V316-V569 HydrophobicContact CG1-CG1 3.3Å; V316-V570 CarbonylContact C-O 3.56Å; V316-V570 WeakPolarHBondContact CA-O 3.41Å; V316-V581 HydrophobicContact CG1-CG2 3.91Å; V316-Y585 HydrophobicContact CG1-CE2 4.13Å
317	L	96.2	Very high	89.3	Confident	11 Å²	11	41.7 Å²	41.7	6%	0.058	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	120.4	-175.3	-57.5	174.8	0	0	0	110.1	L315 L319 Q530 V569 V570 I572	L315-L317 HydrophobicContact CD1-CD2 4.02Å; L315-L317 HydrophobicContact CD2-CD1 4.43Å; L315-L317 HydrophobicContact CD2-CD2 4.18Å; L315-L317 HydrophobicContact CD2-CG 4.5Å; L315-L317 HydrophobicContact CG-CD1 4.49Å; L315-L317 HydrophobicContact CG-CD2 3.86Å; L315-L317 HydrophobicContact CG-CG 4.08Å; L317-L319 HydrophobicContact CB-CD2 3.8Å; L317-L319 PolarHBondContact O-N 3.09Å; L317-Q530 HydrophobicContact CD2-CB 3.67Å; L317-V569 WeakPolarHBondContact O-CA 3.34Å; L317-V570 HydrophobicContact CB-CG2 4.17Å; L317-V570 PolarHBondContact N-O 2.7Å; L317-V570 PolarHBondContact O-N 3.31Å; L317-I572 HydrophobicContact CD1-CD1 4.01Å
318	S	95.7	Very high	86.5	Confident	6 Å²	6	46 Å²	46	4%	0.042	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	98.2	165.9	-171.1	0	0	0	0	109.1	Q320 D529 Y568	S318-Q320 PolarHBondContact O-N 3.48Å; S318-Q320 PolarHBondContact OG-NE2 3.39Å; S318-D529 PolarHBondContact N-O 2.87Å; S318-Y568 CarbonylContact C-O 3.4Å; S318-Y568 WeakPolarHBondContact CA-O 3.48Å
319	L	94.9	Very high	83.5	Confident	8 Å²	8	50 Å²	50	4%	0.042	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	129.1	-179.4	-44.6	-179.8	0	0	0	109.4	L210 L213 L317 P321 Y568 V570 W603	L210-L319 HydrophobicContact CD1-CB 3.97Å; L210-L319 HydrophobicContact CD1-CD1 3.65Å; L210-L319 HydrophobicContact CD1-CG 4.47Å; L213-L319 HydrophobicContact CB-CB 4.33Å; L213-L319 HydrophobicContact CB-CD2 4.12Å; L213-L319 HydrophobicContact CD1-CB 4.13Å; L317-L319 HydrophobicContact CB-CD2 3.8Å; L317-L319 PolarHBondContact O-N 3.09Å; L319-P321 WeakPolarHBondContact O-CD 3.41Å; L319-Y568 PolarHBondContact N-O 3.43Å; L319-V570 HydrophobicContact CD1-CG1 4.16Å; L319-V570 HydrophobicContact CD1-CG2 3.89Å; L319-V570 HydrophobicContact CD2-CG2 3.97Å; L319-V570 HydrophobicContact CG-CG2 4.01Å; L319-W603 HydrophobicContact CD1-CH2 4.44Å
320	Q	93	Very high	80.5	Confident	54 Å²	54	57.9 Å²	57.9	25%	0.252	33%	0.329	S	S	.	.			trans	-110.3	71.2	-179.2	-58.6	-64.9	-14.6	0	0	111	S318 D529 T563 P565	S318-Q320 PolarHBondContact O-N 3.48Å; S318-Q320 PolarHBondContact OG-NE2 3.39Å; Q320-D529 PolarHBondContact NE2-OD1 2.89Å; Q320-T563 PolarHBondContact NE2-O 3.25Å; Q320-P565 PolarHBondContact OE1-O 3.48Å
321	P	93.7	Very high	77.6	Confident	15 Å²	15	52.8 Å²	52.8	10%	0.097	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-69.7	169.5	178.3	32.2	-37.7	0	0	0	112.1	H206 L210 L213 L319 Y568	H206-P321 VanDerWaalsContact CE1-CG 3.45Å; H206-P321 WeakPolarHBondContact CE1-CG 3.29Å; L210-P321 HydrophobicContact CB-CB 4.38Å; L210-P321 HydrophobicContact CD1-CB 4.43Å; L210-P321 HydrophobicContact CD1-CG 4.21Å; L213-P321 HydrophobicContact CD1-CB 4.33Å; L319-P321 WeakPolarHBondContact O-CD 3.41Å; P321-Y568 HydrophobicContact CG-CD2 3.86Å; P321-Y568 HydrophobicContact CG-CE2 3.74Å
322	I	92.7	Very high	74.7	Confident	71 Å²	71	61.9 Å²	61.9	36%	0.364	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-62	128.3	173.5	-71.2	154.8	0	0	0	107.8	T205 H206 H209 L324	T205-I322 HydrophobicContact CG2-CD1 4.01Å; H206-I322 PolarHBondContact ND1-O 2.98Å; H209-I322 HydrophobicContact CB-CD1 4.45Å; H209-I322 PolarHBondContact ND1-N 3.24Å; H209-I322 VanDerWaalsContact ND1-N 3.17Å; I322-L324 PolarHBondContact O-N 3.36Å
323	P	91	Very high	71.6	Confident	82 Å²	82	69.4 Å²	69.4	53%	0.532	39%	0.39	S	S	.	.	P	Polyproline II helix	trans	-54.7	125.7	-172.9	-29.6	35.7	0	0	0	113.6	H202 K325	H202-P323 PolarHBondContact NE2-O 3.5Å; P323-K325 PolarHBondContact O-N 2.99Å
324	L	87.3	Confident	68.6	Low	26 Å²	26	75.3 Å²	75.3	14%	0.136	43%	0.428	C	S	.	.	S	Bend	trans	-59.9	-34.9	-176.7	-172.7	68.5	0	0	0	112.7	H202 E203 H206 I322 R597	H202-L324 PolarHBondContact CD2-O 3.22Å; H202-L324 PolarHBondContact NE2-O 2.95Å; E203-L324 HydrophobicContact CB-CD1 4.15Å; E203-L324 HydrophobicContact CG-CD1 3.84Å; H206-L324 HydrophobicContact CB-CD1 3.79Å; I322-L324 PolarHBondContact O-N 3.36Å; L324-R597 VanDerWaalsContact CD2-C 3.44Å; L324-R597 WeakPolarHBondContact CD2-O 3.12Å
325	K	79.5	Confident	65.6	Low	134 Å²	134	79.8 Å²	79.8	58%	0.583	46%	0.461	S	S	*	.	S	Bend	trans	-103.7	122	171.1	-71.8	168.3	178.5	164.7	0	107.9	P323 A327 K595	P323-K325 PolarHBondContact O-N 2.99Å; K325-A327 PolarHBondContact O-N 3.29Å; K325-A327 VanDerWaalsContact O-N 3.13Å; K325-K595 PolarHBondContact NZ-O 2.82Å
326	S	59.3	Low	62.6	Low	97 Å²	97	88.9 Å²	88.9	68%	0.678	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-56.5	118.7	168.3	54.7	0	0	0	0	108.7	T328	S326-T328 PolarHBondContact O-N 2.66Å; S326-T328 VanDerWaalsContact O-N 3.08Å
327	A	46.4	Very low	59.5	Low	92 Å²	92	97 Å²	97	76%	0.76	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-58	118	170.3	0	0	0	0	0	108	K325 A329	K325-A327 PolarHBondContact O-N 3.29Å; K325-A327 VanDerWaalsContact O-N 3.13Å; A327-A329 PolarHBondContact O-N 3.22Å
328	T	35	Very low	56.3	Low	108 Å²	108	106.2 Å²	106.2	66%	0.663	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-57.5	116.5	178	28.5	0	0	0	0	108.4	S326 K330	S326-T328 PolarHBondContact O-N 2.66Å; S326-T328 VanDerWaalsContact O-N 3.08Å; T328-K330 PolarHBondContact O-N 3.07Å
329	A	30.1	Very low	53.5	Low	96 Å²	96	113.7 Å²	113.7	79%	0.793	61%	0.611	S	S	*	*			trans	-76.6	60.6	-167.7	0	0	0	0	0	112.5	A327 G331	A327-A329 PolarHBondContact O-N 3.22Å; A329-G331 PolarHBondContact O-N 2.98Å
330	K	31.9	Very low	50.6	Low	184 Å²	184	118.8 Å²	118.8	80%	0.8	64%	0.643	S	S	*	*			trans	-76	60.6	163.2	-65.3	-160.9	175.6	-166.5	0	109.5	T328	T328-K330 PolarHBondContact O-N 3.07Å
331	G	30.9	Very low	47.8	Very low	57 Å²	57	120.9 Å²	120.9	59%	0.588	67%	0.67	S	S	*	*	S	Bend	trans	-155.5	116.7	-176.2	0	0	0	0	0	110.3	A329	A329-G331 PolarHBondContact O-N 2.98Å
332	K	31.2	Very low	45	Very low	204 Å²	204	127.7 Å²	127.7	89%	0.887	71%	0.706	S	S	*	*			trans	-33.4	133.7	-177.2	-63.4	170.6	177.7	177.5	0	114.1
333	K	28.2	Very low	42.3	Very low	201 Å²	201	130.3 Å²	130.3	87%	0.874	73%	0.727	S	S	*	*			trans	-42.9	125.4	165.4	-73.9	176.7	177.7	170.8	0	109.5	S335	K333-S335 PolarHBondContact O-N 2.93Å; K333-S335 VanDerWaalsContact O-N 3.17Å
334	P	33.8	Very low	39.5	Very low	124 Å²	124	130.5 Å²	130.5	81%	0.805	74%	0.744	S	S	*	*			trans	-65.2	119	173.4	26.2	-32.1	0	0	0	108.5	K336	P334-K336 PolarHBondContact O-N 3.31Å; P334-K336 VanDerWaalsContact O-N 3.13Å
335	S	33.1	Very low	36.9	Very low	105 Å²	105	133.4 Å²	133.4	73%	0.734	78%	0.78	S	S	*	*			trans	-62	113.9	171.2	43.4	0	0	0	0	108.4	K333 E337	K333-S335 PolarHBondContact O-N 2.93Å; K333-S335 VanDerWaalsContact O-N 3.17Å; S335-E337 PolarHBondContact O-N 2.87Å
336	K	34.1	Very low	34.7	Very low	192 Å²	192	132 Å²	132	84%	0.835	79%	0.787	S	S	*	*			trans	-77.2	73.4	-175.7	-165.3	173.3	-171.4	170.5	0	110	P334 R338	P334-K336 PolarHBondContact O-N 3.31Å; P334-K336 VanDerWaalsContact O-N 3.13Å; K336-R338 VanDerWaalsContact C-N 3.35Å; K336-R338 PolarHBondContact O-N 2.71Å
337	E	32	Very low	33.6	Very low	171 Å²	171	132.2 Å²	132.2	80%	0.799	79%	0.788	S	S	*	*			trans	-66.4	95.9	170.8	-79.1	-171.7	150.1	0	0	109.6	S335 L339	S335-E337 PolarHBondContact O-N 2.87Å; E337-L339 PolarHBondContact O-N 3.03Å
338	R	29.3	Very low	33.1	Very low	204 Å²	204	136.2 Å²	136.2	77%	0.77	79%	0.791	S	S	*	*			trans	-83.8	89	166.9	176.6	-177.3	-83.2	-163.5	-9.3	107.4	K336 T340	K336-R338 VanDerWaalsContact C-N 3.35Å; K336-R338 PolarHBondContact O-N 2.71Å; R338-T340 HydrophobicContact CG-CG2 4.25Å; R338-T340 PolarHBondContact O-N 2.7Å
339	L	35.6	Very low	32.9	Very low	162 Å²	162	137.3 Å²	137.3	85%	0.848	80%	0.798	S	S	*	*			trans	-74.7	106.1	162.8	-71.5	176.5	0	0	0	108.5	E337 A341	E337-L339 PolarHBondContact O-N 3.03Å; L339-A341 PolarHBondContact O-N 3.04Å
340	T	35	Very low	33.1	Very low	116 Å²	116	138 Å²	138	71%	0.712	80%	0.797	S	S	*	*			trans	-76.3	110.4	164.9	44.7	0	0	0	0	108.4	R338	R338-T340 HydrophobicContact CG-CG2 4.25Å; R338-T340 PolarHBondContact O-N 2.7Å
341	A	34.7	Very low	33.3	Very low	98 Å²	98	133.9 Å²	133.9	81%	0.81	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-89.7	116.8	166.5	0	0	0	0	0	108.8	L339	L339-A341 PolarHBondContact O-N 3.04Å
342	D	34	Very low	33.6	Very low	158 Å²	158	140.5 Å²	140.5	85%	0.845	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-80.2	152.5	163	-84.1	-47	0	0	0	110
343	P	35.4	Very low	33.6	Very low	126 Å²	126	136.7 Å²	136.7	82%	0.818	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-99.4	150.2	-160.5	36.9	-34.9	0	0	0	114.7
344	G	32.7	Very low	33.9	Very low	85 Å²	85	135.7 Å²	135.7	88%	0.876	80%	0.804	S	S	*	*			trans	138.5	138.6	156.3	0	0	0	0	0	115.4
345	G	31.7	Very low	33.9	Very low	87 Å²	87	136.6 Å²	136.6	90%	0.897	80%	0.797	S	S	*	*			trans	124.1	102.8	169.1	0	0	0	0	0	114.1
346	S	33.6	Very low	33.8	Very low	106 Å²	106	136.3 Å²	136.3	74%	0.741	79%	0.787	S	S	*	*			trans	-89.9	169.8	177.2	51.2	0	0	0	0	113.2
347	S	37.5	Very low	34.1	Very low	100 Å²	100	135 Å²	135	70%	0.699	78%	0.784	S	S	*	*			trans	64.4	148.6	161.8	58.5	0	0	0	0	117.5
348	E	35.1	Very low	34	Very low	177 Å²	177	131.9 Å²	131.9	83%	0.827	78%	0.777	S	S	*	*			cis	-158.5	155.3	-12.1	-115.9	167.4	-158.1	0	0	109.9
349	T	30.4	Very low	34.2	Very low	131 Å²	131	131.5 Å²	131.5	80%	0.804	78%	0.781	S	S	*	*			trans	5.7	124.1	150.6	-38.5	0	0	0	0	120.4
350	S	35.4	Very low	34.3	Very low	110 Å²	110	129.8 Å²	129.8	77%	0.769	78%	0.78	S	S	*	*				178.7	137.9	113.2	-171.4	0	0	0	0	114
351	S	34.9	Very low	34.3	Very low	98 Å²	98	133.4 Å²	133.4	69%	0.685	79%	0.785	S	S	*	*			trans	-68.7	158.2	172.7	43.1	0	0	0	0	115.1
352	Q	37.5	Very low	34.1	Very low	196 Å²	196	135 Å²	135	92%	0.916	79%	0.785	S	S	*	*				-161.9	141.4	123.2	-108	173.2	29.8	0	0	112.5
353	V	30.6	Very low	34.4	Very low	123 Å²	123	132 Å²	132	75%	0.745	78%	0.777	S	S	*	*			trans	-112.3	146.3	178.1	169.9	0	0	0	0	108.3
354	L	35.7	Very low	34.4	Very low	180 Å²	180	136 Å²	136	94%	0.942	78%	0.781	S	S	*	*			trans	-141.9	143.2	156.2	-101	172	0	0	0	110.6
355	E	32.7	Very low	34.3	Very low	143 Å²	143	135.2 Å²	135.2	67%	0.668	77%	0.773	S	S	*	*			trans	-137.9	163	-158.2	-147.2	-169.8	-154.1	0	0	111.5
356	N	32.1	Very low	34.4	Very low	99 Å²	99	136.9 Å²	136.9	53%	0.529	77%	0.766	S	S	.	*			trans	68.1	128.8	156.4	-56.2	-39.7	0	0	0	122
357	H	40.8	Very low	34.3	Very low	166 Å²	166	141 Å²	141	77%	0.769	77%	0.771	S	S	*	*				171.8	111.5	91.4	-87	-62.1	0	0	0	112.1
358	T	30.2	Very low	34	Very low	105 Å²	105	144.9 Å²	144.9	64%	0.644	78%	0.778	S	S	*	*				70	115.4	90.7	-20.2	0	0	0	0	119.1
359	K	33.6	Very low	33.7	Very low	195 Å²	195	145 Å²	145	85%	0.848	78%	0.779	S	S	*	*				152.8	140.2	117	-81.6	-177.7	-177.1	173.6	0	116.3
360	P	37.4	Very low	33.8	Very low	127 Å²	127	147.5 Å²	147.5	83%	0.825	78%	0.781	S	S	*	*			trans	-118.5	177.7	179	43.4	-34.4	0	0	0	115.8
361	K	33.9	Very low	33.5	Very low	192 Å²	192	147.5 Å²	147.5	84%	0.835	78%	0.777	S	S	*	*			trans	-152.4	118.8	168.2	-81.3	-167.2	-179.7	177.8	0	110.7
362	T	31.6	Very low	33.2	Very low	130 Å²	130	152.7 Å²	152.7	80%	0.798	79%	0.787	S	S	*	*				59.7	137.9	93.4	64.1	0	0	0	0	115.4
363	S	39.9	Very low	33.1	Very low	96 Å²	96	148.2 Å²	148.2	67%	0.671	78%	0.783	S	S	*	*			cis	-172.8	169.3	21	57.8	0	0	0	0	114.5
364	K	34.8	Very low	33	Very low	209 Å²	209	152.7 Å²	152.7	91%	0.909	79%	0.793	S	S	*	*			trans	68.2	151.6	163.3	-60.3	170.4	-179.9	178.5	0	116
365	G	31.9	Very low	32.9	Very low	69 Å²	69	147.6 Å²	147.6	71%	0.711	78%	0.784	S	S	*	*			cis	152.2	160.4	0.3	0	0	0	0	0	110
366	T	32.9	Very low	32.8	Very low	123 Å²	123	147 Å²	147	76%	0.755	79%	0.79	S	S	*	*			cis	-171.7	137.3	-6.1	-73.5	0	0	0	0	110
367	K	30.6	Very low	32.5	Very low	193 Å²	193	147.8 Å²	147.8	84%	0.839	80%	0.802	S	S	*	*			trans	67.4	159.2	174	-68.9	172.7	-178.6	-174.6	0	115.9
368	Q	32.9	Very low	32.1	Very low	180 Å²	180	151.9 Å²	151.9	84%	0.841	81%	0.811	S	S	*	*			cis	-150.5	164.3	19.7	-154.3	160.8	-14.4	0	0	112.2
369	E	26.9	Very low	32.5	Very low	181 Å²	181	152.7 Å²	152.7	85%	0.846	82%	0.818	S	S	*	*			trans	-78.7	155	177.1	-64.2	160.4	108.7	0	0	113
370	E	33.3	Very low	32.6	Very low	182 Å²	182	149.2 Å²	149.2	85%	0.85	82%	0.818	S	S	*	*				-177.1	121.3	122.4	-100.4	174.3	-157.7	0	0	114.8
371	T	28.8	Very low	32.6	Very low	111 Å²	111	146.7 Å²	146.7	68%	0.681	81%	0.808	S	S	*	*			trans	20.6	132.7	143	46	0	0	0	0	125.6
372	F	28.9	Very low	32.8	Very low	206 Å²	206	147.6 Å²	147.6	90%	0.904	81%	0.812	S	S	*	*			trans	52.6	118.7	139.7	-77.6	-89.7	0	0	0	122.7
373	A	35.6	Very low	33	Very low	102 Å²	102	144.9 Å²	144.9	84%	0.843	81%	0.81	S	S	*	*				-169.4	147	120.7	0	0	0	0	0	114.7
374	K	29	Very low	33	Very low	218 Å²	218	150.2 Å²	150.2	95%	0.948	82%	0.821	S	S	*	*			trans	-58.7	148.3	171.6	-77.4	164.8	168.4	167.3	0	113.5
375	G	32.3	Very low	33.1	Very low	73 Å²	73	149.4 Å²	149.4	75%	0.753	81%	0.812	S	S	*	*			trans	-174.8	61.7	173	0	0	0	0	0	119.6
376	T	30.5	Very low	33.4	Very low	129 Å²	129	153.1 Å²	153.1	79%	0.791	82%	0.816	S	S	*	*			trans	38.3	111.3	140.2	-44.9	0	0	0	0	122.4
377	C	26.4	Very low	33.7	Very low	117 Å²	117	155.8 Å²	155.8	79%	0.791	82%	0.817	S	S	*	*			trans	43.2	127.6	140.1	-56.4	0	0	0	0	123.3
378	R	33.3	Very low	34	Very low	251 Å²	251	150.6 Å²	150.6	95%	0.947	82%	0.818	S	S	*	*				-160.9	142.8	117	-118	177.9	176	-168.9	-0.8	114.6
379	P	37.8	Very low	34.1	Very low	123 Å²	123	145.9 Å²	145.9	80%	0.799	82%	0.818	S	S	*	*			trans	-108.9	160.7	-178.8	40	-33.6	0	0	0	114.8
380	S	36	Very low	34.8	Very low	121 Å²	121	149.5 Å²	149.5	85%	0.846	82%	0.824	S	S	*	*			trans	-172.6	147.9	169.2	-179	0	0	0	0	110.6
381	A	37.6	Very low	34.8	Very low	74 Å²	74	150.1 Å²	150.1	61%	0.612	82%	0.824	S	S	*	*			cis	-171.8	166.5	-25.2	0	0	0	0	0	110.4
382	K	37.6	Very low	35.1	Very low	212 Å²	212	153.9 Å²	153.9	92%	0.922	83%	0.831	S	S	*	*			trans	72.5	136.3	164.6	-54.4	172.9	-178.9	175.3	0	117.7
383	G	35.6	Very low	35.3	Very low	73 Å²	73	155.7 Å²	155.7	75%	0.753	83%	0.831	S	S	*	*			cis	131.6	125.1	-16.6	0	0	0	0	0	116.6
384	K	40.1	Very low	35.3	Very low	208 Å²	208	155.7 Å²	155.7	90%	0.904	83%	0.826	S	S	*	*			trans	-173.8	113	153.8	-102.3	174.5	179.8	-178.1	0	106.2
385	R	37.4	Very low	35.5	Very low	192 Å²	192	155 Å²	155	73%	0.725	82%	0.823	S	S	*	*				67.4	107.9	55.6	-81.2	-173	61.4	168.2	-7	115.6
386	N	38.8	Very low	36.1	Very low	147 Å²	147	157.2 Å²	157.2	79%	0.786	82%	0.824	S	S	*	*				-167.3	174.3	102.4	-91.5	-19.6	0	0	0	111.2
387	K	38.4	Very low	36.2	Very low	178 Å²	178	156.4 Å²	156.4	77%	0.774	82%	0.823	S	S	*	*				-167.2	124.5	-66.8	-172.2	-169.8	-175.3	-162.1	0	107.3
388	G	37.1	Very low	36.6	Very low	84 Å²	84	155.3 Å²	155.3	87%	0.866	82%	0.816	S	S	*	*			trans	169.1	115.1	171.9	0	0	0	0	0	114.3
389	G	34.4	Very low	36.7	Very low	81 Å²	81	148.4 Å²	148.4	84%	0.835	81%	0.807	S	S	*	*			trans	-179.8	157.3	172.3	0	0	0	0	0	111.4
390	R	42.1	Very low	36.7	Very low	257 Å²	257	150.7 Å²	150.7	97%	0.97	81%	0.807	S	S	*	*			trans	-145.8	145.1	168	-158.4	166.6	173.2	171.6	-4.7	110
391	K	33.8	Very low	36.7	Very low	196 Å²	196	154 Å²	154	85%	0.852	81%	0.809	S	S	*	*			trans	-141.3	170.4	-162.4	-128.4	-174.2	-173.5	179.5	0	110.2
392	K	35.5	Very low	36.8	Very low	190 Å²	190	158.2 Å²	158.2	83%	0.826	82%	0.821	S	S	*	*			trans	95.8	129.3	165.4	-53.3	-175.4	178	-176.6	0	114.4
393	R	31.6	Very low	36.7	Very low	243 Å²	243	156.9 Å²	156.9	92%	0.917	82%	0.818	S	S	*	*			cis	64.6	133.1	48.8	-75.4	-171.7	165.9	-169.8	-4.2	111.5
394	S	35.2	Very low	36.6	Very low	103 Å²	103	156.7 Å²	156.7	72%	0.72	82%	0.816	S	S	*	*			cis	-174.5	154.4	20.7	39.5	0	0	0	0	115.7
395	K	35.1	Very low	36.6	Very low	204 Å²	204	153.4 Å²	153.4	89%	0.887	82%	0.816	S	S	*	*			trans	80.6	157.4	145	-79.3	-169.7	173.8	-168.8	0	121.7
396	P	43.3	Very low	36.5	Very low	119 Å²	119	148 Å²	148	77%	0.773	82%	0.819	S	S	*	*			trans	-133.1	-162.8	-148.4	45.7	-27.8	0	0	0	116.8
397	S	33.6	Very low	36.2	Very low	111 Å²	111	148.3 Å²	148.3	78%	0.776	82%	0.822	S	S	*	*			trans	105.3	141	176.4	-157	0	0	0	0	113.2
398	S	34.8	Very low	36.2	Very low	94 Å²	94	149 Å²	149	66%	0.657	82%	0.824	S	S	*	*			cis	-165	158.8	-3.1	30.2	0	0	0	0	111.4
399	S	35.9	Very low	36.1	Very low	107 Å²	107	152.7 Å²	152.7	75%	0.748	82%	0.819	S	S	*	*			trans	60	153.7	149.6	69.3	0	0	0	0	119
400	E	37.2	Very low	35.9	Very low	171 Å²	171	157 Å²	157	80%	0.799	82%	0.818	S	S	*	*			cis	-139	144.7	12.7	-68.6	170.3	161.2	0	0	112.4
401	E	36.4	Very low	35.5	Very low	191 Å²	191	154.6 Å²	154.6	89%	0.893	81%	0.814	S	S	*	*			trans	26.6	129	131.7	-53	-179.3	177.7	0	0	123.2
402	D	38.1	Very low	35.3	Very low	161 Å²	161	150 Å²	150	86%	0.861	81%	0.812	S	S	*	*				-165.7	169.5	115.6	-154.3	-2.8	0	0	0	111.3
403	E	36.8	Very low	35.3	Very low	185 Å²	185	147.5 Å²	147.5	86%	0.864	81%	0.813	S	S	*	*			trans	-93.9	174.5	-152.7	-58.9	-164.8	151.2	0	0	119
404	G	32.8	Very low	35.4	Very low	68 Å²	68	144.6 Å²	144.6	70%	0.701	81%	0.81	S	S	*	*			trans	-101.4	-139.2	170.4	0	0	0	0	0	112.1
405	P	40.3	Very low	35.3	Very low	140 Å²	140	151.5 Å²	151.5	91%	0.909	82%	0.82	S	S	*	*			cis	-129.3	-175.2	-21.7	40.4	-24.6	0	0	0	112.5
406	G	35.8	Very low	35.1	Very low	77 Å²	77	153.1 Å²	153.1	79%	0.794	82%	0.821	S	S	*	*			trans	168.3	128.7	165.8	0	0	0	0	0	117.7
407	D	32.5	Very low	34.8	Very low	155 Å²	155	152.3 Å²	152.3	83%	0.829	82%	0.816	S	S	*	*			trans	-70.7	149.9	-179.4	-62.1	-68.1	0	0	0	115.4
408	K	38	Very low	34.8	Very low	192 Å²	192	155.7 Å²	155.7	84%	0.835	82%	0.819	S	S	*	*				173.9	119.9	110.7	-93.2	159.3	-173.5	172.9	0	115.4
409	Q	35	Very low	34.7	Very low	162 Å²	162	154.8 Å²	154.8	76%	0.757	82%	0.824	S	S	*	*				56.6	114.9	123.5	-151.9	166	16.4	0	0	121.4
410	E	29.4	Very low	34.7	Very low	171 Å²	171	161.9 Å²	161.9	80%	0.799	84%	0.835	S	S	*	*			trans	14.8	128.9	145.5	-56.2	179.7	123.4	0	0	120.8
411	K	34.4	Very low	34.5	Very low	207 Å²	207	162.9 Å²	162.9	90%	0.9	84%	0.839	S	S	*	*			trans	-152.5	127.7	130.7	-117.5	163.5	-171	172	0	112.8
412	A	29.1	Very low	34.5	Very low	98 Å²	98	165.2 Å²	165.2	81%	0.81	84%	0.84	S	S	*	*			trans	-77.1	146.8	175.2	0	0	0	0	0	111.6
413	T	35.4	Very low	34.4	Very low	138 Å²	138	169 Å²	169	85%	0.847	84%	0.842	S	S	*	*			trans	-137.3	117.8	162.9	-44.8	0	0	0	0	110.1
414	Q	33.1	Very low	34.2	Very low	183 Å²	183	167.3 Å²	167.3	86%	0.855	84%	0.844	S	S	*	*			trans	-76.4	140.3	-179.3	-63.7	174.1	-11.3	0	0	111.8
415	R	33.2	Very low	34.4	Very low	248 Å²	248	168.2 Å²	168.2	94%	0.936	85%	0.845	S	S	*	*			trans	-137.1	110.8	153	-77.4	-168	169.2	-172.9	-3.4	111
416	R	31.2	Very low	34.1	Very low	238 Å²	238	167 Å²	167	90%	0.898	84%	0.84	S	S	*	*			trans	-78.4	166.9	154	-85	-173.2	179	-163.5	1.8	107.9
417	P	37.4	Very low	34.1	Very low	102 Å²	102	174.7 Å²	174.7	66%	0.662	85%	0.845	S	S	*	*			cis	-155.7	-174.2	41.8	43.1	-20	0	0	0	119.9
418	H	33.9	Very low	34.1	Very low	182 Å²	182	172.3 Å²	172.3	84%	0.843	84%	0.836	S	S	*	*			trans	63.6	102.6	158.1	-58	-52.9	0	0	0	122
419	G	31.9	Very low	33.8	Very low	75 Å²	75	168.3 Å²	168.3	77%	0.773	83%	0.832	S	S	*	*				86.7	98.7	102.2	0	0	0	0	0	120.3
420	R	37.4	Very low	33.7	Very low	256 Å²	256	170.5 Å²	170.5	97%	0.966	84%	0.835	S	S	*	*				-166.1	138.2	129.5	-111.6	173.3	-179.2	-168.3	0.1	111.8
421	E	31.5	Very low	34	Very low	192 Å²	192	170.5 Å²	170.5	90%	0.897	83%	0.832	S	S	*	*			trans	-71.7	135.7	177.3	-62.7	167.9	101.5	0	0	111.9
422	R	37	Very low	34	Very low	240 Å²	240	168.2 Å²	168.2	91%	0.906	83%	0.825	S	S	*	*			trans	-156.3	107.2	149	-123.5	173.2	-176.1	178.7	1.1	114
423	R	37.2	Very low	34.3	Very low	241 Å²	241	170.6 Å²	170.6	91%	0.909	82%	0.819	S	S	*	*			trans	38.9	107.2	147.6	-61.6	-170.2	176.7	-139.2	-3.4	118.1
424	V	31.9	Very low	34.6	Very low	148 Å²	148	170.1 Å²	170.1	90%	0.897	82%	0.821	S	S	*	*			trans	-59.7	127.1	164.9	175.8	0	0	0	0	111.3
425	A	35.8	Very low	34.5	Very low	88 Å²	88	165.2 Å²	165.2	73%	0.727	82%	0.82	S	S	*	*			trans	-124.2	133.2	152.4	0	0	0	0	0	107.1	R427	A425-R427 PolarHBondContact O-N 3.28Å; A425-R427 VanDerWaalsContact O-N 3.1Å
426	S	35.4	Very low	34.7	Very low	113 Å²	113	159 Å²	159	79%	0.79	81%	0.814	S	S	*	*			trans	-67.6	106.7	-171.5	48.7	0	0	0	0	111.9
427	R	34.4	Very low	34.8	Very low	239 Å²	239	154.9 Å²	154.9	90%	0.902	81%	0.81	S	S	*	*			trans	-81.7	110.2	163.2	-80.5	-179	161.5	177.7	-6	108.9	A425	A425-R427 PolarHBondContact O-N 3.28Å; A425-R427 VanDerWaalsContact O-N 3.1Å
428	V	33.1	Very low	34.9	Very low	105 Å²	105	158.5 Å²	158.5	64%	0.636	82%	0.818	S	S	*	*			trans	-81.5	120.1	157.4	-177.2	0	0	0	0	106.9	Y430	V428-Y430 HydrophobicContact CG1-CD1 4.48Å; V428-Y430 HydrophobicContact CG1-CD2 4.43Å; V428-Y430 HydrophobicContact CG1-CE1 3.85Å; V428-Y430 HydrophobicContact CG1-CE2 3.8Å; V428-Y430 VanDerWaalsContact CG1-CZ 3.47Å
429	S	31.1	Very low	35.1	Very low	109 Å²	109	154 Å²	154	76%	0.762	81%	0.813	S	S	*	*			trans	-113.9	117.6	175.7	53.6	0	0	0	0	109.1
430	Y	33.9	Very low	35	Very low	208 Å²	208	154.4 Å²	154.4	82%	0.816	82%	0.816	S	S	*	*			trans	-88.3	139.5	170.8	-55.1	-77.4	0	0	0	109.5	V428	V428-Y430 HydrophobicContact CG1-CD1 4.48Å; V428-Y430 HydrophobicContact CG1-CD2 4.43Å; V428-Y430 HydrophobicContact CG1-CE1 3.85Å; V428-Y430 HydrophobicContact CG1-CE2 3.8Å; V428-Y430 VanDerWaalsContact CG1-CZ 3.47Å
431	K	35.2	Very low	35	Very low	171 Å²	171	148.2 Å²	148.2	74%	0.743	81%	0.812	S	S	*	*			trans	-92.5	113.7	176	-173.2	-169.2	-175.2	-163.4	0	107.3	E433	K431-E433 HydrophobicContact CD-CG 4.29Å; K431-E433 WeakPolarHBondContact CE-OE1 3.44Å; K431-E433 HydrophobicContact CG-CG 4.42Å; K431-E433 IonicContact NZ-OE1 2.6Å; K431-E433 PolarHBondContact NZ-OE1 2.93Å
432	E	35.8	Very low	34.9	Very low	159 Å²	159	141.8 Å²	141.8	74%	0.743	80%	0.798	S	S	*	*			trans	-75.8	126.2	166.1	-71.4	176.8	153.2	0	0	107.5	R713	E432-R713 IonicContact OE1-CZ 3.91Å; E432-R713 IonicContact OE1-NH2 3.78Å; E432-R713 PolarHBondContact OE1-NH2 2.87Å
433	E	35.1	Very low	34.6	Very low	148 Å²	148	135.6 Å²	135.6	69%	0.692	79%	0.791	S	S	*	*			trans	-108.2	127.3	164.8	-71.5	-169	167.5	0	0	108.9	K431	K431-E433 HydrophobicContact CD-CG 4.29Å; K431-E433 WeakPolarHBondContact CE-OE1 3.44Å; K431-E433 HydrophobicContact CG-CG 4.42Å; K431-E433 IonicContact NZ-OE1 2.6Å; K431-E433 PolarHBondContact NZ-OE1 2.93Å
434	S	40.6	Very low	34.6	Very low	127 Å²	127	131.5 Å²	131.5	89%	0.888	79%	0.787	S	S	*	*			trans	-67.4	140.6	177.2	-64.1	0	0	0	0	110.8
435	G	31.5	Very low	34.4	Very low	81 Å²	81	132.9 Å²	132.9	84%	0.835	78%	0.782	S	S	*	*			trans	-78.5	163.5	-176.7	0	0	0	0	0	115.1
436	S	37.5	Very low	34.4	Very low	116 Å²	116	137.5 Å²	137.5	81%	0.811	79%	0.788	S	S	*	*			trans	-147.3	131.7	147.6	58	0	0	0	0	107.3
437	D	33.2	Very low	34.1	Very low	153 Å²	153	139.4 Å²	139.4	82%	0.818	79%	0.789	S	S	*	*			trans	-63.5	147.8	-178.9	-51.7	-81.2	0	0	0	112.5
438	E	38.8	Very low	34.1	Very low	178 Å²	178	133.6 Å²	133.6	83%	0.832	79%	0.785	S	S	*	*				175.9	150.1	121	-94.1	-58.3	164.1	0	0	113.3
439	A	38.2	Very low	34.1	Very low	88 Å²	88	134.4 Å²	134.4	73%	0.727	80%	0.795	S	S	*	*			trans	19.3	112.9	164.5	0	0	0	0	0	121.3
440	G	30.8	Very low	34.2	Very low	82 Å²	82	132.6 Å²	132.6	85%	0.845	79%	0.794	S	S	*	*			trans	-78.5	173.6	174	0	0	0	0	0	117.7
441	S	36.7	Very low	34.3	Very low	126 Å²	126	132.1 Å²	132.1	88%	0.881	80%	0.799	S	S	*	*			trans	-158.4	149.4	152.4	-173.5	0	0	0	0	108.8
442	G	29.8	Very low	34	Very low	57 Å²	57	128.7 Å²	128.7	59%	0.588	80%	0.802	S	S	*	*			trans	-91.5	-165.2	-177.1	0	0	0	0	0	114.7
443	S	31.5	Very low	34	Very low	110 Å²	110	126.7 Å²	126.7	77%	0.769	81%	0.806	S	S	*	*			trans	62.6	133.2	-176.1	40.3	0	0	0	0	114.9
444	D	37.2	Very low	33.8	Very low	155 Å²	155	127.2 Å²	127.2	83%	0.829	81%	0.814	S	S	*	*			cis	-142.7	157.9	2.8	-78.7	-46.9	0	0	0	111.1
445	F	27.5	Very low	33.6	Very low	178 Å²	178	126.5 Å²	126.5	78%	0.781	81%	0.806	S	S	*	*			trans	-126.7	99.5	168.3	-179.3	-101.6	0	0	0	109.8	L447	F445-L447 HydrophobicContact CD1-CG 4.35Å; F445-L447 HydrophobicContact CE1-CD2 3.62Å; F445-L447 HydrophobicContact CE1-CG 3.74Å; F445-L447 HydrophobicContact CZ-CD2 4.09Å
446	E	35	Very low	33.7	Very low	184 Å²	184	128 Å²	128	86%	0.86	80%	0.804	S	S	*	*			trans	-86.4	130.4	165.4	-74.9	-157.3	140.6	0	0	110.8	S448	E446-S448 PolarHBondContact O-N 3.47Å
447	L	29.3	Very low	33.6	Very low	153 Å²	153	127.8 Å²	127.8	80%	0.801	79%	0.793	S	S	*	*			trans	-76.2	115.4	171.6	-78.9	158.7	0	0	0	109.8	F445	F445-L447 HydrophobicContact CD1-CG 4.35Å; F445-L447 HydrophobicContact CE1-CD2 3.62Å; F445-L447 HydrophobicContact CE1-CG 3.74Å; F445-L447 HydrophobicContact CZ-CD2 4.09Å
448	S	34.1	Very low	33.7	Very low	117 Å²	117	129 Å²	129	82%	0.818	79%	0.794	S	S	*	*			trans	-105.1	129.2	162.4	-167.9	0	0	0	0	110.6	E446	E446-S448 PolarHBondContact O-N 3.47Å
449	S	32.8	Very low	33.6	Very low	122 Å²	122	126.9 Å²	126.9	85%	0.853	79%	0.789	S	S	*	*			trans	-65	137.2	-171.2	51.8	0	0	0	0	114.1
450	G	33.8	Very low	33.5	Very low	72 Å²	72	127.8 Å²	127.8	74%	0.742	79%	0.79	S	S	*	*			trans	-164.5	72.4	178.2	0	0	0	0	0	114.8
451	E	36	Very low	33.7	Very low	198 Å²	198	132.5 Å²	132.5	93%	0.925	79%	0.79	S	S	*	*			trans	58.4	124.2	158.8	-57.3	-167.8	132.3	0	0	120.4
452	A	29.5	Very low	33.8	Very low	98 Å²	98	132.6 Å²	132.6	81%	0.81	79%	0.787	S	S	*	*			trans	-75.2	154.3	176.2	0	0	0	0	0	113.2
453	S	34.9	Very low	34.1	Very low	118 Å²	118	132.7 Å²	132.7	83%	0.825	79%	0.789	S	S	*	*			trans	-152.6	107.4	164.5	-77.4	0	0	0	0	110.4
454	D	30.8	Very low	34.5	Very low	159 Å²	159	133 Å²	133	85%	0.85	79%	0.788	S	S	*	*			trans	-56.8	134.9	179.8	-79.2	-59.3	0	0	0	113.7	S456	D454-S456 PolarHBondContact O-N 2.89Å
455	P	37.2	Very low	34.6	Very low	112 Å²	112	131.7 Å²	131.7	73%	0.727	79%	0.788	S	S	*	*			trans	-84.7	101.7	159.9	32.5	-28	0	0	0	109.6	D457	P455-D457 PolarHBondContact O-N 3.48Å; P455-D457 VanDerWaalsContact O-N 3.1Å
456	S	32.9	Very low	34.9	Very low	112 Å²	112	132.9 Å²	132.9	78%	0.783	79%	0.793	S	S	*	*			trans	-71.1	101.6	173	60.7	0	0	0	0	111.4	D454 E458	D454-S456 PolarHBondContact O-N 2.89Å; S456-E458 PolarHBondContact O-N 3.48Å
457	D	36.4	Very low	35.3	Very low	111 Å²	111	132.7 Å²	132.7	59%	0.594	79%	0.792	S	S	*	*			trans	-62.9	111.7	169.3	-82.4	-25.8	0	0	0	110.5	P455 R784	P455-D457 PolarHBondContact O-N 3.48Å; P455-D457 VanDerWaalsContact O-N 3.1Å; D457-R784 IonicContact OD2-CZ 2.75Å; D457-R784 IonicContact OD2-NH1 3.68Å; D457-R784 PolarHBondContact OD2-NH1 3.3Å; D457-R784 IonicContact OD2-NH2 2.96Å; D457-R784 PolarHBondContact OD2-NH2 2.99Å
458	E	35.4	Very low	35.7	Very low	178 Å²	178	137.3 Å²	137.3	83%	0.832	80%	0.799	S	S	*	*			trans	-102.7	95	161.5	-82	-129	120.4	0	0	110.3	S456 S460	S456-E458 PolarHBondContact O-N 3.48Å; E458-S460 PolarHBondContact O-N 3.3Å
459	D	36.1	Very low	35.8	Very low	135 Å²	135	141.1 Å²	141.1	72%	0.722	80%	0.801	S	S	*	*			trans	-60.5	102.7	166.9	-89.5	-41.1	0	0	0	110.3	R781	D459-R781 IonicContact OD2-NH1 3.59Å
460	S	35	Very low	36.1	Very low	107 Å²	107	139.6 Å²	139.6	75%	0.748	80%	0.795	S	S	*	*			trans	-97.2	100.3	166.2	-72.4	0	0	0	0	110	E458	E458-S460 PolarHBondContact O-N 3.3Å
461	E	36.1	Very low	36.4	Very low	180 Å²	180	142.1 Å²	142.1	84%	0.841	80%	0.798	S	S	*	*			trans	-58.4	139.7	175.1	-70.3	-159.8	142.7	0	0	112.1	G463	E461-G463 PolarHBondContact O-N 2.71Å
462	P	39.3	Very low	36.3	Very low	128 Å²	128	137 Å²	137	83%	0.831	79%	0.79	S	S	*	*			trans	-73.4	90.7	173.9	30.7	-33.6	0	0	0	110.4
463	G	34.8	Very low	37	Very low	60 Å²	60	138.6 Å²	138.6	62%	0.619	79%	0.792	S	S	*	*			trans	-58.8	148.5	171.1	0	0	0	0	0	112.3	E461	E461-G463 PolarHBondContact O-N 2.71Å
464	P	41.4	Very low	37.3	Very low	117 Å²	117	142.2 Å²	142.2	76%	0.76	80%	0.796	S	S	*	*			trans	-63.4	149.3	-173	26.3	-35.5	0	0	0	112.3	K466	P464-K466 PolarHBondContact O-N 3.24Å
465	P	38.4	Very low	37.4	Very low	127 Å²	127	145.4 Å²	145.4	83%	0.825	80%	0.796	S	S	*	*			trans	-64	113.5	-174.2	25.4	-34.1	0	0	0	111.2	Q467	P465-Q467 PolarHBondContact O-N 2.76Å; P465-Q467 VanDerWaalsContact O-N 3.14Å
466	K	34.7	Very low	37.7	Very low	202 Å²	202	146.5 Å²	146.5	88%	0.878	80%	0.801	S	S	*	*			trans	-60.5	117.1	172	-85.8	-179.4	176	172.4	0	109.9	P464 R468	P464-K466 PolarHBondContact O-N 3.24Å; K466-R468 PolarHBondContact O-N 3.38Å
467	Q	42	Very low	37.9	Very low	181 Å²	181	150.2 Å²	150.2	85%	0.846	80%	0.803	S	S	*	*			trans	-52.1	119.5	170.2	-68.6	177	-20.8	0	0	110.5	P465 K469	P465-Q467 PolarHBondContact O-N 2.76Å; P465-Q467 VanDerWaalsContact O-N 3.14Å; Q467-K469 PolarHBondContact O-N 3.18Å; Q467-K469 VanDerWaalsContact O-N 3.13Å
468	R	37.6	Very low	38.1	Very low	249 Å²	249	150.3 Å²	150.3	94%	0.94	82%	0.819	S	S	*	*			trans	-72.1	103.8	168.5	-67.8	177.7	80.1	175.7	5	108.1	K466 A470	K466-R468 PolarHBondContact O-N 3.38Å; R468-A470 PolarHBondContact O-N 2.88Å
469	K	36.8	Very low	38.2	Very low	198 Å²	198	145.1 Å²	145.1	86%	0.861	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-63.3	121.7	166	-73.3	-175.5	175.2	-178	0	108.8	Q467	Q467-K469 PolarHBondContact O-N 3.18Å; Q467-K469 VanDerWaalsContact O-N 3.13Å
470	A	38.4	Very low	38.3	Very low	89 Å²	89	144.2 Å²	144.2	74%	0.736	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-69.9	147.1	166.7	0	0	0	0	0	110	R468	R468-A470 PolarHBondContact O-N 2.88Å
471	P	40.2	Very low	38.5	Very low	125 Å²	125	148.5 Å²	148.5	81%	0.812	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-74.7	135.3	176	31	-33.3	0	0	0	110.7
472	A	35.1	Very low	38.6	Very low	92 Å²	92	145 Å²	145	76%	0.76	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-89.4	127.6	172.4	0	0	0	0	0	110.5
473	P	44.9	Very low	38.4	Very low	130 Å²	130	143.4 Å²	143.4	84%	0.844	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-76.5	158.2	169.5	31.3	-32.3	0	0	0	111.8
474	Q	40.6	Very low	38.6	Very low	195 Å²	195	146.5 Å²	146.5	91%	0.911	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-86.5	168.3	-161.8	-69.2	172	-47.7	0	0	115.7
475	R	33.3	Very low	38.1	Very low	225 Å²	225	152.1 Å²	152.1	85%	0.849	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-73.5	139.8	-174.8	-60.3	150	65	-172.7	5.5	114.4
476	T	42.1	Very low	38	Very low	136 Å²	136	152.8 Å²	152.8	83%	0.834	84%	0.837	S	S	*	*			trans	-139.1	99.4	141.4	46	0	0	0	0	107.3
477	K	38.4	Very low	38	Very low	189 Å²	189	151.5 Å²	151.5	82%	0.822	83%	0.834	S	S	*	*				71.7	133	88.4	-85.7	-166.3	175.3	-177.3	0	114.8
478	A	39.3	Very low	37.6	Very low	113 Å²	113	154.7 Å²	154.7	93%	0.934	84%	0.838	S	S	*	*			trans	67.5	138.8	-176.9	0	0	0	0	0	116
479	G	37.3	Very low	37.4	Very low	70 Å²	70	146.5 Å²	146.5	72%	0.722	83%	0.831	S	S	*	*			cis	-177.5	115.9	-9	0	0	0	0	0	113.5
480	S	38.9	Very low	37.4	Very low	116 Å²	116	142 Å²	142	81%	0.811	83%	0.825	S	S	*	*			trans	28.8	115	145.8	-48.6	0	0	0	0	121.5
481	K	38.7	Very low	37.3	Very low	196 Å²	196	145 Å²	145	85%	0.852	82%	0.823	S	S	*	*				171.7	124.6	108.2	-93.4	172.7	-178.5	-178.5	0	115
482	S	38.3	Very low	37	Very low	106 Å²	106	148.1 Å²	148.1	74%	0.741	82%	0.819	S	S	*	*			trans	22.2	117.4	143.3	56.9	0	0	0	0	122.9
483	A	35.5	Very low	37	Very low	96 Å²	96	153.4 Å²	153.4	79%	0.793	83%	0.825	S	S	*	*				42.3	123.4	123.5	0	0	0	0	0	122.3
484	S	38.6	Very low	36.4	Very low	125 Å²	125	153.8 Å²	153.8	87%	0.874	82%	0.819	S	S	*	*				-177.9	159.3	113.6	41.3	0	0	0	0	112.6
485	R	31.6	Very low	36.5	Very low	234 Å²	234	150.3 Å²	150.3	88%	0.883	81%	0.814	S	S	*	*			trans	-82.2	136.1	174.6	-64.6	155	66.3	174.5	1.7	109.3
486	T	36.6	Very low	36.6	Very low	141 Å²	141	144.8 Å²	144.8	87%	0.865	81%	0.809	S	S	*	*			trans	-172	159.2	130.7	21.8	0	0	0	0	114.5
487	H	34.7	Very low	36.1	Very low	176 Å²	176	146.3 Å²	146.3	82%	0.815	81%	0.812	S	S	*	*			trans	-52.1	171.8	-179.8	-71.3	-96.6	0	0	0	119.8
488	R	33.6	Very low	36.2	Very low	247 Å²	247	143.6 Å²	143.6	93%	0.932	81%	0.813	S	S	*	*			trans	75.5	96.9	154.7	-75.8	177.7	-178.8	-148.8	0.8	118
489	G	32.1	Very low	35.8	Very low	78 Å²	78	143.3 Å²	143.3	80%	0.804	81%	0.811	S	S	*	*				97	161.4	91.5	0	0	0	0	0	119.6
490	S	37.1	Very low	35.7	Very low	104 Å²	104	144 Å²	144	73%	0.727	81%	0.81	S	S	*	*			trans	89.3	112.3	159.8	-153.6	0	0	0	0	120.1
491	H	36.4	Very low	35.5	Very low	151 Å²	151	143.8 Å²	143.8	70%	0.699	81%	0.809	S	S	*	*			trans	52.2	152.1	133.5	-71.2	-129.6	0	0	0	120.7
492	R	34.2	Very low	35.3	Very low	191 Å²	191	139.1 Å²	139.1	72%	0.721	80%	0.8	S	S	*	*			cis	-175.5	154.6	-19.4	-106.6	-167.7	-164.2	-156	5.6	104.8
493	K	35.6	Very low	35.1	Very low	203 Å²	203	139.1 Å²	139.1	88%	0.883	80%	0.8	S	S	*	*			trans	178.7	115	137.2	-102.3	164.7	-176.5	-176.5	0	111.8
494	D	32	Very low	35.1	Very low	137 Å²	137	139.3 Å²	139.3	73%	0.733	80%	0.796	S	S	*	*			trans	-83.3	170.8	165.3	-53.9	-72.8	0	0	0	111
495	P	42.1	Very low	34.7	Very low	123 Å²	123	138.4 Å²	138.4	80%	0.799	79%	0.79	S	S	*	*			trans	-129.6	112.3	133.4	12.7	8.5	0	0	0	113.9
496	S	34.8	Very low	35	Very low	108 Å²	108	132.5 Å²	132.5	76%	0.755	78%	0.784	S	S	*	*			trans	17.6	128.9	141.3	55.9	0	0	0	0	122.5
497	L	33.5	Very low	34.8	Very low	169 Å²	169	131.2 Å²	131.2	89%	0.885	78%	0.781	S	S	*	*			trans	-82.2	163.6	151.3	-64.9	166	0	0	0	111.8
498	P	40.5	Very low	34.9	Very low	131 Å²	131	133.1 Å²	133.1	85%	0.851	79%	0.787	S	S	*	*			trans	-118	157.9	145.9	36.2	-27.2	0	0	0	112.6
499	A	29.5	Very low	34.8	Very low	107 Å²	107	133.9 Å²	133.9	88%	0.884	79%	0.79	S	S	*	*			trans	-129	153.6	-174.2	0	0	0	0	0	113.2
500	A	36.5	Very low	34.9	Very low	85 Å²	85	133.7 Å²	133.7	70%	0.702	79%	0.788	S	S	*	*			trans	-157.9	115.5	166.4	0	0	0	0	0	107.3
501	S	33.6	Very low	34.8	Very low	112 Å²	112	138.6 Å²	138.6	78%	0.783	80%	0.796	S	S	*	*				54	130.5	84.7	70	0	0	0	0	113.6
502	S	35.8	Very low	34.6	Very low	97 Å²	97	139.7 Å²	139.7	68%	0.678	80%	0.799	S	S	*	*			cis	-171.1	170.6	12.7	48.1	0	0	0	0	111.5
503	S	32.6	Very low	34.5	Very low	106 Å²	106	139.8 Å²	139.8	74%	0.741	81%	0.81	S	S	*	*			trans	62	150.9	152.1	44.9	0	0	0	0	119.6
504	S	35	Very low	34.3	Very low	101 Å²	101	134.9 Å²	134.9	71%	0.706	80%	0.8	S	S	*	*			cis	-170	149.3	-6.5	44	0	0	0	0	112.5
505	S	32.1	Very low	34.6	Very low	106 Å²	106	134 Å²	134	74%	0.741	81%	0.805	S	S	*	*			trans	46.1	120.7	144.4	63.9	0	0	0	0	123.4
506	S	36	Very low	34.1	Very low	110 Å²	110	136 Å²	136	77%	0.769	81%	0.808	S	S	*	*				176.5	95.8	121.8	41.7	0	0	0	0	111.3
507	S	32.5	Very low	34	Very low	113 Å²	113	134.2 Å²	134.2	79%	0.79	81%	0.807	S	S	*	*				53.8	98.1	86.2	75.4	0	0	0	0	116.4
508	K	37.3	Very low	34	Very low	217 Å²	217	135.4 Å²	135.4	94%	0.943	81%	0.808	S	S	*	*			trans	-146.9	111.1	149	-117.6	169.1	-173.1	171.9	0	111.8
509	R	32.3	Very low	33.4	Very low	262 Å²	262	139.1 Å²	139.1	99%	0.989	81%	0.811	S	S	*	*			trans	-68	140.4	173.7	-81.8	167.6	151	171.9	-8.6	110.5
510	G	34.1	Very low	33.6	Very low	74 Å²	74	137.7 Å²	137.7	76%	0.763	80%	0.799	S	S	*	*			trans	-145.6	101.9	170	0	0	0	0	0	110.7	K512	G510-K512 PolarHBondContact O-N 3.11Å
511	K	35.5	Very low	33.2	Very low	208 Å²	208	142.9 Å²	142.9	90%	0.904	81%	0.809	S	S	*	*			trans	-68.4	107.8	-173.2	-163.1	172.3	-178.5	-179.4	0	109.8
512	K	31.4	Very low	33	Very low	174 Å²	174	146.8 Å²	146.8	76%	0.757	81%	0.812	S	S	*	*				54.7	108.5	94.7	-164	179.4	-174.6	-178	0	115.2	G510 C514	G510-K512 PolarHBondContact O-N 3.11Å; K512-C514 WeakPolarHBondContact CE-SG 3.37Å
513	M	32.8	Very low	32.8	Very low	193 Å²	193	152.9 Å²	152.9	95%	0.951	82%	0.82	S	S	*	*			trans	-142.4	128.6	148.1	-145.3	143.1	172.5	0	0	106.7
514	C	31.3	Very low	33	Very low	99 Å²	99	153.8 Å²	153.8	67%	0.669	83%	0.826	S	S	*	*			trans	-101.4	150.9	-172.2	-68.8	0	0	0	0	110.9	K512	K512-C514 WeakPolarHBondContact CE-SG 3.37Å
515	S	36.7	Very low	33.9	Very low	120 Å²	120	155.8 Å²	155.8	84%	0.839	83%	0.827	S	S	*	*			trans	-116.6	136.4	157.9	-177	0	0	0	0	107.5
516	D	32	Very low	35.8	Very low	163 Å²	163	154.6 Å²	154.6	87%	0.872	82%	0.824	S	S	*	*			trans	-70.4	161.9	-176.7	-67.1	-61.9	0	0	0	113.1
517	G	33.1	Very low	38	Very low	71 Å²	71	150.4 Å²	150.4	73%	0.732	80%	0.799	S	S	*	*			trans	153.8	80.6	179.6	0	0	0	0	0	112.3	K519	G517-K519 PolarHBondContact O-N 2.99Å
518	E	32.5	Very low	40.7	Very low	195 Å²	195	146 Å²	146	91%	0.911	77%	0.766	S	S	*	*			trans	-6	109.6	175	-65.5	175.3	119	0	0	118	A520	E518-A520 PolarHBondContact O-N 3.19Å
519	K	28.7	Very low	43.3	Very low	208 Å²	208	137.7 Å²	137.7	90%	0.904	73%	0.732	S	S	*	*			trans	-90.7	80.9	157.3	-73.2	-172.2	176.7	-175.2	0	110.1	G517	G517-K519 PolarHBondContact O-N 2.99Å
520	A	33.1	Very low	46.3	Very low	77 Å²	77	125.4 Å²	125.4	64%	0.636	69%	0.685	S	S	*	*			trans	-65.6	140.6	153.8	0	0	0	0	0	108.9	E518 K522	E518-A520 PolarHBondContact O-N 3.19Å; A520-K522 VanDerWaalsContact C-N 3.34Å; A520-K522 PolarHBondContact O-N 3.29Å
521	E	28.4	Very low	49.2	Very low	195 Å²	195	122 Å²	122	91%	0.911	65%	0.65	S	S	*	*			trans	-69.4	86.8	-178.9	-64.8	-173.2	144.9	0	0	111	R523	E521-R523 VanDerWaalsContact C-N 3.32Å; E521-R523 PolarHBondContact O-N 3.49Å
522	K	30.8	Very low	52.2	Low	193 Å²	193	112.1 Å²	112.1	84%	0.839	61%	0.607	S	S	*	*			trans	-68	90.1	174.9	-70.7	-171.1	178.2	-173.6	0	110.8	A520	A520-K522 VanDerWaalsContact C-N 3.34Å; A520-K522 PolarHBondContact O-N 3.29Å
523	R	30.3	Very low	55.3	Low	226 Å²	226	103.9 Å²	103.9	85%	0.853	57%	0.571	S	S	*	*			trans	-44.2	137.2	134.9	-67	-179.3	178.2	178	-0.6	106.8	E521 I525	E521-R523 VanDerWaalsContact C-N 3.32Å; E521-R523 PolarHBondContact O-N 3.49Å; R523-I525 PolarHBondContact O-N 2.99Å
524	S	36.6	Very low	58.3	Low	124 Å²	124	94.7 Å²	94.7	87%	0.867	53%	0.526	S	S	*	.			trans	-70.9	84.4	177.9	56.2	0	0	0	0	109.3	A526	S524-A526 PolarHBondContact O-N 2.81Å
525	I	54.9	Low	61.3	Low	143 Å²	143	91.1 Å²	91.1	73%	0.733	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-54.4	123.3	169.3	-58.1	169	0	0	0	106	R523	R523-I525 PolarHBondContact O-N 2.99Å
526	A	72	Confident	64	Low	82 Å²	82	85.4 Å²	85.4	68%	0.678	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-58.9	142.4	176	0	0	0	0	0	108.8	S524	S524-A526 PolarHBondContact O-N 2.81Å
527	G	81.7	Confident	66.6	Low	22 Å²	22	81.6 Å²	81.6	23%	0.227	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-69	149.3	178.6	0	0	0	0	0	110.7	D529 Y561 T563	G527-D529 PolarHBondContact O-N 2.97Å; G527-Y561 CarbonylContact C-O 3.58Å; G527-Y561 WeakPolarHBondContact CA-O 3.49Å; G527-T563 VanDerWaalsContact CA-OG1 3.24Å; G527-T563 WeakPolarHBondContact CA-OG1 3.45Å; G527-T563 PolarHBondContact N-OG1 3.31Å; G527-T563 PolarHBondContact O-OG1 2.94Å
528	I	89.1	Confident	69.1	Low	20 Å²	20	83.9 Å²	83.9	10%	0.103	43%	0.428	C	S	.	.			trans	-83.2	98.1	176.8	-51.5	-165.3	0	0	0	108.2	D295 Q530 V548 H549 Y561 A562	D295-I528 HydrophobicContact CB-CD1 4.16Å; I528-Q530 VanDerWaalsContact C-N 3.3Å; I528-Q530 WeakPolarHBondContact CG2-O 3.39Å; I528-Q530 PolarHBondContact O-N 3.44Å; I528-V548 HydrophobicContact CD1-CB 3.72Å; I528-V548 HydrophobicContact CD1-CG1 3.53Å; I528-V548 HydrophobicContact CD1-CG2 3.95Å; I528-V548 HydrophobicContact CG2-CG2 4.49Å; I528-H549 VanDerWaalsContact CD1-CE1 3.46Å; I528-H549 WeakPolarHBondContact CD1-CE1 3.19Å; I528-Y561 PolarHBondContact N-O 2.82Å; I528-A562 WeakPolarHBondContact O-CA 3.41Å
529	D	92.9	Very high	71.7	Confident	42 Å²	42	78.4 Å²	78.4	23%	0.225	40%	0.402	C	S	.	.			trans	-87.8	9.9	-176.3	-72.8	-49.9	0	0	0	113.9	S318 Q320 G527 T563	S318-D529 PolarHBondContact N-O 2.87Å; Q320-D529 PolarHBondContact NE2-OD1 2.89Å; G527-D529 PolarHBondContact O-N 2.97Å; D529-T563 VanDerWaalsContact OD1-CB 3.25Å; D529-T563 WeakPolarHBondContact OD1-CB 3.41Å; D529-T563 PolarHBondContact OD1-N 2.81Å; D529-T563 PolarHBondContact OD1-OG1 3.27Å; D529-T563 WeakPolarHBondContact OD2-CB 3.41Å; D529-T563 PolarHBondContact OD2-OG1 2.82Å
530	Q	94.6	Very high	74.5	Confident	4 Å²	4	73.6 Å²	73.6	2%	0.019	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	141.1	172.2	61	169.7	47.3	0	0	113.7	E296 V299 H300 V316 L317 I528	E296-Q530 VanDerWaalsContact CA-NE2 3.35Å; E296-Q530 HydrophobicContact CG-CG 4.25Å; E296-Q530 PolarHBondContact O-NE2 2.99Å; V299-Q530 HydrophobicContact CG1-CG 4.33Å; H300-Q530 PolarHBondContact CE1-NE2 3.01Å; H300-Q530 VanDerWaalsContact CE1-NE2 3.26Å; H300-Q530 PolarHBondContact ND1-NE2 2.96Å; V316-Q530 VanDerWaalsContact O-CA 3.28Å; V316-Q530 WeakPolarHBondContact O-CA 3.36Å; L317-Q530 HydrophobicContact CD2-CB 3.67Å; I528-Q530 VanDerWaalsContact C-N 3.3Å; I528-Q530 WeakPolarHBondContact CG2-O 3.39Å; I528-Q530 PolarHBondContact O-N 3.44Å
531	W	95.7	Very high	77.4	Confident	4 Å²	4	75.1 Å²	75.1	2%	0.015	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	-175.1	176.7	60.2	87.4	0	0	0	108.5	V316 C558 A562 M566 V569 Y585	V316-W531 WeakPolarHBondContact CA-O 3.29Å; V316-W531 HydrophobicContact CB-CD2 4.46Å; V316-W531 HydrophobicContact CB-CG 4.38Å; V316-W531 WeakPolarHBondContact CB-O 3.32Å; V316-W531 HydrophobicContact CG1-CD2 4.38Å; V316-W531 HydrophobicContact CG1-CZ2 3.66Å; V316-W531 PolarHBondContact N-O 3.01Å; V316-W531 PolarHBondContact O-N 3.03Å; V316-W531 VanDerWaalsContact O-O 3.07Å; W531-C558 HydrophobicContact CD2-CB 4.15Å; W531-C558 HydrophobicContact CE3-CB 4.47Å; W531-C558 HydrophobicContact CZ2-CB 4.43Å; W531-A562 HydrophobicContact CZ3-CB 4.06Å; W531-M566 HydrophobicContact CH2-CE 3.66Å; W531-M566 HydrophobicContact CZ3-CE 4.29Å; W531-V569 HydrophobicContact CH2-CG1 3.96Å; W531-V569 HydrophobicContact CH2-CG2 4.48Å; W531-V569 HydrophobicContact CZ2-CG1 3.66Å; W531-Y585 AromaticContact CE2-CD1 3.95Å; W531-Y585 AromaticContact CE2-CE1 3.64Å; W531-Y585 AromaticContact CE2-CZ 3.82Å; W531-Y585 AromaticContact CZ2-CD1 3.63Å; W531-Y585 HydrophobicContact CZ2-CD1 3.63Å; W531-Y585 AromaticContact CZ2-CD2 3.86Å; W531-Y585 HydrophobicContact CZ2-CD2 3.86Å; W531-Y585 AromaticContact CZ2-CE1 3.77Å; W531-Y585 HydrophobicContact CZ2-CE1 3.77Å; W531-Y585 HydrophobicContact CZ2-CE2 4.02Å; W531-Y585 AromaticContact CZ2-CG 3.67Å; W531-Y585 HydrophobicContact CZ2-CG 3.67Å; W531-Y585 AromaticContact CZ2-CZ 3.98Å; W531-Y585 AromaticContact NE1-CD1 3.92Å; W531-Y585 AromaticContact NE1-CE1 3.13Å; W531-Y585 AromaticContact NE1-CE2 3.83Å; W531-Y585 AromaticContact NE1-CZ 3.09Å; W531-Y585 PolarHBondContact NE1-OH 3.09Å; W531-Y585 VanDerWaalsContact NE1-OH 3.12Å
532	L	97.1	Very high	80.5	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	160	-173	-51	-175.4	0	0	0	112.8	V299 F302 L303 L306 R314 L315 C544 V545	V299-L532 HydrophobicContact CG1-CD2 3.65Å; V299-L532 HydrophobicContact CG1-CG 4.07Å; F302-L532 HydrophobicContact CB-CD1 4.41Å; F302-L532 HydrophobicContact CD1-CD1 3.64Å; F302-L532 HydrophobicContact CE1-CD1 4.37Å; F302-L532 HydrophobicContact CG-CD1 4.43Å; L303-L532 HydrophobicContact CB-CD1 3.8Å; L303-L532 HydrophobicContact CB-CD2 3.93Å; L303-L532 HydrophobicContact CD1-CD1 4.24Å; L303-L532 HydrophobicContact CD1-CD2 4.06Å; L303-L532 HydrophobicContact CD2-CD2 4.24Å; L303-L532 HydrophobicContact CG-CD2 4.3Å; L306-L532 HydrophobicContact CD1-CD1 3.59Å; R314-L532 WeakPolarHBondContact O-CA 3.41Å; L315-L532 HydrophobicContact CD1-CD2 3.89Å; L532-C544 CarbonylContact O-C 3.54Å; L532-C544 WeakPolarHBondContact O-CA 3.36Å; L532-V545 PolarHBondContact N-O 3.39Å; L532-V545 PolarHBondContact O-N 2.83Å
533	E	96.6	Very high	83.6	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	139.3	163.4	-84.4	171.7	-176.8	0	0	109.5	T313 R314 V316 W542 V543 C544 R584 Y585	T313-E533 WeakPolarHBondContact CA-O 3.25Å; R314-E533 HydrophobicContact CB-CB 4.16Å; R314-E533 WeakPolarHBondContact CD-OE2 3.36Å; R314-E533 PolarHBondContact N-O 2.75Å; R314-E533 IonicContact NH1-OE2 2.66Å; R314-E533 PolarHBondContact NH1-OE2 2.92Å; R314-E533 VanDerWaalsContact NH1-OE2 3.15Å; R314-E533 PolarHBondContact O-N 3.06Å; V316-E533 HydrophobicContact CG2-CB 4.01Å; V316-E533 HydrophobicContact CG2-CG 3.7Å; E533-W542 HydrophobicContact CB-CB 4.5Å; E533-W542 HydrophobicContact CB-CE3 3.9Å; E533-W542 HydrophobicContact CG-CB 4.47Å; E533-V543 WeakPolarHBondContact CA-O 3.48Å; E533-C544 HydrophobicContact CG-CB 4.44Å; E533-R584 WeakPolarHBondContact OE1-CD 3.37Å; E533-R584 IonicContact OE1-CZ 2.72Å; E533-R584 IonicContact OE1-NH1 3.47Å; E533-R584 PolarHBondContact OE1-NH1 3.39Å; E533-R584 IonicContact OE2-NH1 2.69Å; E533-R584 PolarHBondContact OE2-NH1 3.13Å; E533-Y585 VanDerWaalsContact CG-OH 3.26Å; E533-Y585 WeakPolarHBondContact CG-OH 3.41Å; E533-Y585 WeakPolarHBondContact OE1-CE2 3.34Å; E533-Y585 PolarHBondContact OE1-OH 2.54Å
534	V	96	Very high	86.7	Confident	1 Å²	1	47 Å²	47	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	132.8	173.5	-173.2	0	0	0	0	108.4	L254 L306 L311 T313 C536 V543 V545	L254-V534 HydrophobicContact CD1-CB 4.05Å; L254-V534 HydrophobicContact CD1-CG1 4.31Å; L254-V534 HydrophobicContact CD1-CG2 4.36Å; L254-V534 HydrophobicContact CD2-CB 4.43Å; L254-V534 HydrophobicContact CD2-CG1 4.26Å; L254-V534 HydrophobicContact CD2-CG2 4.13Å; L306-V534 HydrophobicContact CD1-CG2 3.87Å; L306-V534 HydrophobicContact CD2-CG2 4.27Å; L311-V534 HydrophobicContact CB-CG1 4.15Å; L311-V534 HydrophobicContact CD1-CG1 4.32Å; T313-V534 HydrophobicContact CG2-CG1 4.49Å; T313-V534 HydrophobicContact CG2-CG2 4.13Å; V534-C536 PolarHBondContact O-N 3.4Å; V534-V543 PolarHBondContact N-O 3.39Å; V534-V543 PolarHBondContact O-N 3.28Å; V534-V545 HydrophobicContact CG2-CG2 4.01Å
535	F	94.4	Very high	89.5	Confident	23 Å²	23	41.1 Å²	41.1	10%	0.101	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	112.5	173.6	-171.3	-104	0	0	0	110	L312 E537 E540 K541 W542 R617	L312-F535 HydrophobicContact CB-CB 4.15Å; L312-F535 HydrophobicContact CD2-CB 3.85Å; L312-F535 HydrophobicContact CD2-CD1 4.34Å; L312-F535 HydrophobicContact CD2-CG 4.18Å; L312-F535 HydrophobicContact CG-CB 4.39Å; L312-F535 PolarHBondContact O-N 2.96Å; F535-E537 HydrophobicContact CD1-CG 4.17Å; F535-E537 HydrophobicContact CE1-CG 4.28Å; F535-E537 PolarHBondContact O-N 2.9Å; F535-E540 VanDerWaalsContact CE2-C 3.45Å; F535-E540 WeakPolarHBondContact CE2-O 3Å; F535-E540 HydrophobicContact CZ-CB 4.34Å; F535-K541 WeakPolarHBondContact CA-O 3.16Å; F535-W542 HydrophobicContact CB-CD2 3.94Å; F535-W542 HydrophobicContact CB-CE3 3.71Å; F535-W542 HydrophobicContact CB-CH2 3.96Å; F535-W542 HydrophobicContact CB-CZ2 4.13Å; F535-W542 HydrophobicContact CB-CZ3 3.74Å; F535-W542 AromaticContact CD2-CD1 3.91Å; F535-W542 AromaticContact CD2-CD2 3.85Å; F535-W542 HydrophobicContact CD2-CD2 3.85Å; F535-W542 AromaticContact CD2-CE2 3.68Å; F535-W542 HydrophobicContact CD2-CE3 4.49Å; F535-W542 HydrophobicContact CD2-CG 4.02Å; F535-W542 HydrophobicContact CD2-CZ2 4.24Å; F535-W542 AromaticContact CD2-NE1 3.7Å; F535-W542 HydrophobicContact CG-CD2 4.39Å; F535-W542 HydrophobicContact CG-CZ2 4.46Å; F535-R617 HydrophobicContact CD2-CG 4.37Å; F535-R617 HydrophobicContact CE2-CG 3.7Å; F535-R617 HydrophobicContact CZ-CG 4.05Å
536	C	92.6	Very high	91.4	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.007	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	109.3	174	-66	0	0	0	0	109	V534 Q538 E539 E540 K541 V543	V534-C536 PolarHBondContact O-N 3.4Å; C536-Q538 VanDerWaalsContact C-N 3.27Å; C536-Q538 PolarHBondContact O-N 2.99Å; C536-E539 HydrophobicContact CB-CB 4.41Å; C536-E539 PolarHBondContact O-N 3.14Å; C536-E540 PolarHBondContact O-N 3.33Å; C536-K541 PolarHBondContact N-O 3.08Å; C536-K541 PolarHBondContact O-N 2.89Å; C536-V543 HydrophobicContact CB-CG2 4.27Å; C536-V543 VanDerWaalsContact SG-CG2 3.51Å
537	E	88.3	Confident	92.4	Very high	83 Å²	83	30.7 Å²	30.7	39%	0.388	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-33.2	-176.5	-65.8	-165.6	167	0	0	113	R247 F535 E539 E540	R247-E537 VanDerWaalsContact CG-OE2 3.27Å; R247-E537 WeakPolarHBondContact CG-OE2 3.24Å; R247-E537 IonicContact NE-OE2 2.87Å; F535-E537 HydrophobicContact CD1-CG 4.17Å; F535-E537 HydrophobicContact CE1-CG 4.28Å; F535-E537 PolarHBondContact O-N 2.9Å; E537-E539 VanDerWaalsContact C-N 3.35Å; E537-E539 PolarHBondContact O-N 3.12Å; E537-E540 PolarHBondContact O-N 3.03Å
538	Q	85	Confident	92.9	Very high	119 Å²	119	31.3 Å²	31.3	56%	0.556	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-35.5	178.3	-57.6	-166.7	-18.2	0	0	113.6	R247 C536	R247-Q538 WeakPolarHBondContact O-CG 3.38Å; R247-Q538 PolarHBondContact O-NE2 2.86Å; C536-Q538 VanDerWaalsContact C-N 3.27Å; C536-Q538 PolarHBondContact O-N 2.99Å
539	E	86	Confident	93	Very high	80 Å²	80	33.7 Å²	33.7	37%	0.374	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.2	-8.8	-179.2	-63.2	-174.2	-159	0	0	112.5	C536 E537 K541	C536-E539 HydrophobicContact CB-CB 4.41Å; C536-E539 PolarHBondContact O-N 3.14Å; E537-E539 VanDerWaalsContact C-N 3.35Å; E537-E539 PolarHBondContact O-N 3.12Å; E539-K541 HydrophobicContact CB-CB 4.22Å; E539-K541 HydrophobicContact CB-CD 4.34Å; E539-K541 VanDerWaalsContact O-CG 3.31Å; E539-K541 WeakPolarHBondContact O-CG 3.3Å; E539-K541 PolarHBondContact O-N 2.84Å
540	E	89.2	Confident	92.9	Very high	106 Å²	106	33.3 Å²	33.3	50%	0.495	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.3	32.6	-168.5	-58.7	-168	106.8	0	0	114.4	F535 C536 E537 K620	F535-E540 VanDerWaalsContact CE2-C 3.45Å; F535-E540 WeakPolarHBondContact CE2-O 3Å; F535-E540 HydrophobicContact CZ-CB 4.34Å; C536-E540 PolarHBondContact O-N 3.33Å; E537-E540 PolarHBondContact O-N 3.03Å; E540-K620 IonicContact OE1-NZ 3.99Å; E540-K620 PolarHBondContact OE1-NZ 3.46Å; E540-K620 IonicContact OE2-NZ 2.72Å; E540-K620 PolarHBondContact OE2-NZ 2.95Å
541	K	92.6	Very high	92.7	Very high	109 Å²	109	34.2 Å²	34.2	47%	0.474	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	153.7	-170.3	-76	166	-165.7	171.6	0	113.1	F535 C536 E539	F535-K541 WeakPolarHBondContact CA-O 3.16Å; C536-K541 PolarHBondContact N-O 3.08Å; C536-K541 PolarHBondContact O-N 2.89Å; E539-K541 HydrophobicContact CB-CB 4.22Å; E539-K541 HydrophobicContact CB-CD 4.34Å; E539-K541 VanDerWaalsContact O-CG 3.31Å; E539-K541 WeakPolarHBondContact O-CG 3.3Å; E539-K541 PolarHBondContact O-N 2.84Å
542	W	94.7	Very high	92.7	Very high	11 Å²	11	35.1 Å²	35.1	4%	0.042	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	114.5	170.7	-68.2	99.6	0	0	0	110.7	L312 R314 E533 F535 E621	L312-W542 HydrophobicContact CD2-CH2 3.58Å; L312-W542 HydrophobicContact CD2-CZ2 3.85Å; L312-W542 HydrophobicContact CD2-CZ3 4.46Å; L312-W542 HydrophobicContact CG-CH2 3.74Å; L312-W542 HydrophobicContact CG-CZ2 4.5Å; L312-W542 HydrophobicContact CG-CZ3 4.39Å; R314-W542 HydrophobicContact CB-CZ3 4.32Å; R314-W542 HydrophobicContact CG-CE3 4.32Å; R314-W542 HydrophobicContact CG-CH2 3.65Å; R314-W542 HydrophobicContact CG-CZ2 4.32Å; R314-W542 HydrophobicContact CG-CZ3 3.67Å; R314-W542 VanDerWaalsContact CZ-CZ2 3.43Å; R314-W542 VanDerWaalsContact CZ-NE1 3.35Å; E533-W542 HydrophobicContact CB-CB 4.5Å; E533-W542 HydrophobicContact CB-CE3 3.9Å; E533-W542 HydrophobicContact CG-CB 4.47Å; F535-W542 HydrophobicContact CB-CD2 3.94Å; F535-W542 HydrophobicContact CB-CE3 3.71Å; F535-W542 HydrophobicContact CB-CH2 3.96Å; F535-W542 HydrophobicContact CB-CZ2 4.13Å; F535-W542 HydrophobicContact CB-CZ3 3.74Å; F535-W542 AromaticContact CD2-CD1 3.91Å; F535-W542 AromaticContact CD2-CD2 3.85Å; F535-W542 HydrophobicContact CD2-CD2 3.85Å; F535-W542 AromaticContact CD2-CE2 3.68Å; F535-W542 HydrophobicContact CD2-CE3 4.49Å; F535-W542 HydrophobicContact CD2-CG 4.02Å; F535-W542 HydrophobicContact CD2-CZ2 4.24Å; F535-W542 AromaticContact CD2-NE1 3.7Å; F535-W542 HydrophobicContact CG-CD2 4.39Å; F535-W542 HydrophobicContact CG-CZ2 4.46Å; W542-E621 VanDerWaalsContact CD1-OE1 3.27Å
543	V	95	Very high	92.4	Very high	9 Å²	9	37 Å²	37	6%	0.055	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	119.2	177	178.6	0	0	0	0	108.9	T251 L254 E533 V534 C536 V552	T251-V543 HydrophobicContact CG2-CG1 4.14Å; T251-V543 HydrophobicContact CG2-CG2 4.01Å; L254-V543 HydrophobicContact CD1-CB 4.36Å; L254-V543 HydrophobicContact CD1-CG1 4.23Å; E533-V543 WeakPolarHBondContact CA-O 3.48Å; V534-V543 PolarHBondContact N-O 3.39Å; V534-V543 PolarHBondContact O-N 3.28Å; C536-V543 HydrophobicContact CB-CG2 4.27Å; C536-V543 VanDerWaalsContact SG-CG2 3.51Å; V543-V552 HydrophobicContact CG1-CG1 3.69Å
544	C	95.6	Very high	92.2	Very high	5 Å²	5	41.8 Å²	41.8	3%	0.034	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	140.1	173.4	62.3	0	0	0	0	111.6	L532 E533 G553 Q554 P555 Y585	L532-C544 CarbonylContact O-C 3.54Å; L532-C544 WeakPolarHBondContact O-CA 3.36Å; E533-C544 HydrophobicContact CG-CB 4.44Å; C544-G553 PolarHBondContact O-N 3.44Å; C544-Q554 VanDerWaalsContact SG-C 3.56Å; C544-Q554 PolarHBondContact SG-N 2.87Å; C544-P555 VanDerWaalsContact SG-N 3.38Å; C544-Y585 HydrophobicContact CB-CE1 3.9Å; C544-Y585 VanDerWaalsContact CB-OH 3.27Å; C544-Y585 WeakPolarHBondContact CB-OH 3.47Å
545	V	96.1	Very high	92	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	115.6	-179.6	-175	0	0	0	0	110.2	L254 V258 F302 L532 V534 V552	L254-V545 HydrophobicContact CD1-CG2 4.38Å; V258-V545 HydrophobicContact CG2-CG1 3.48Å; V258-V545 VanDerWaalsContact CG2-CG1 3.48Å; F302-V545 HydrophobicContact CD1-CG1 4.49Å; F302-V545 HydrophobicContact CE1-CG1 3.62Å; F302-V545 HydrophobicContact CZ-CG1 4.38Å; L532-V545 PolarHBondContact N-O 3.39Å; L532-V545 PolarHBondContact O-N 2.83Å; V534-V545 HydrophobicContact CG2-CG2 4.01Å; V545-V552 HydrophobicContact CG1-CG2 4.11Å; V545-V552 HydrophobicContact CG2-CG1 4.39Å; V545-V552 HydrophobicContact CG2-CG2 4.42Å
546	D	94.7	Very high	91.9	Very high	5 Å²	5	47.3 Å²	47.3	3%	0.027	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	101.4	172.1	178.1	-14.1	0	0	0	108.3	V548 H549 G550 V551	D546-V548 VanDerWaalsContact C-N 3.29Å; D546-V548 PolarHBondContact OD1-N 3.38Å; D546-H549 PolarHBondContact OD1-N 2.87Å; D546-H549 IonicContact OD1-ND1 2.67Å; D546-H549 PolarHBondContact OD1-ND1 3.13Å; D546-H549 IonicContact OD2-CE1 3.97Å; D546-H549 IonicContact OD2-CG 2.65Å; D546-H549 IonicContact OD2-ND1 3.56Å; D546-H549 PolarHBondContact OD2-ND1 3.36Å; D546-G550 CarbonylContact O-C 3.48Å; D546-G550 WeakPolarHBondContact O-CA 3.13Å; D546-G550 PolarHBondContact O-N 2.97Å; D546-V551 HydrophobicContact CB-CB 4.33Å; D546-V551 PolarHBondContact N-O 2.85Å; D546-V551 PolarHBondContact O-N 3.08Å
547	C	93	Very high	91.8	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.007	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	-8.2	179.2	65.2	0	0	0	0	114.1	F261 I262 F302	F261-C547 HydrophobicContact CD1-CB 4Å; F261-C547 HydrophobicContact CE1-CB 3.97Å; I262-C547 VanDerWaalsContact CD1-O 3.32Å; I262-C547 WeakPolarHBondContact CD1-O 3.21Å; I262-C547 VanDerWaalsContact CG1-O 3.26Å; I262-C547 WeakPolarHBondContact CG1-O 3.43Å; F302-C547 HydrophobicContact CB-CB 4.11Å; F302-C547 HydrophobicContact CD1-CB 3.49Å; F302-C547 VanDerWaalsContact CD1-CB 3.49Å; F302-C547 HydrophobicContact CD2-CB 4.48Å; F302-C547 HydrophobicContact CE1-CB 4.05Å; F302-C547 HydrophobicContact CG-CB 3.76Å
548	V	91.7	Very high	92	Very high	35 Å²	35	44.8 Å²	44.8	21%	0.212	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-44.1	177.8	-168.3	0	0	0	0	109.8	D295 L298 V299 I528 D546	D295-V548 HydrophobicContact CB-CG1 4.23Å; D295-V548 HydrophobicContact CB-CG2 4.07Å; L298-V548 HydrophobicContact CD2-CG2 4.35Å; V299-V548 HydrophobicContact CG2-CG2 3.87Å; I528-V548 HydrophobicContact CD1-CB 3.72Å; I528-V548 HydrophobicContact CD1-CG1 3.53Å; I528-V548 HydrophobicContact CD1-CG2 3.95Å; I528-V548 HydrophobicContact CG2-CG2 4.49Å; D546-V548 VanDerWaalsContact C-N 3.29Å; D546-V548 PolarHBondContact OD1-N 3.38Å
549	H	90.6	Very high	92.3	Very high	70 Å²	70	41.7 Å²	41.7	32%	0.324	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-7.2	176.5	-59.6	100.5	0	0	0	114	I528 D546 V551 Y561	I528-H549 VanDerWaalsContact CD1-CE1 3.46Å; I528-H549 WeakPolarHBondContact CD1-CE1 3.19Å; D546-H549 PolarHBondContact OD1-N 2.87Å; D546-H549 IonicContact OD1-ND1 2.67Å; D546-H549 PolarHBondContact OD1-ND1 3.13Å; D546-H549 IonicContact OD2-CE1 3.97Å; D546-H549 IonicContact OD2-CG 2.65Å; D546-H549 IonicContact OD2-ND1 3.56Å; D546-H549 PolarHBondContact OD2-ND1 3.36Å; H549-V551 HydrophobicContact CB-CG2 3.93Å; H549-Y561 HydrophobicContact CB-CE2 4.35Å; H549-Y561 AromaticContact CD2-CD2 3.9Å; H549-Y561 AromaticContact CD2-CE2 3.75Å; H549-Y561 AromaticContact CD2-CZ 3.81Å; H549-Y561 VanDerWaalsContact CE1-CB 3.49Å; H549-Y561 WeakPolarHBondContact CE1-CB 3.45Å; H549-Y561 AromaticContact CE1-CD1 3.79Å; H549-Y561 AromaticContact CE1-CD2 3.49Å; H549-Y561 VanDerWaalsContact CE1-CD2 3.49Å; H549-Y561 WeakPolarHBondContact CE1-CD2 3.43Å; H549-Y561 AromaticContact CE1-CG 3.32Å; H549-Y561 AromaticContact CG-CD2 3.78Å; H549-Y561 AromaticContact CG-CE2 3.79Å; H549-Y561 AromaticContact ND1-CD2 3.52Å; H549-Y561 AromaticContact ND1-CG 3.85Å; H549-Y561 AromaticContact NE2-CD1 3.46Å; H549-Y561 WeakPolarHBondContact NE2-CD1 3.45Å; H549-Y561 AromaticContact NE2-CD2 3.71Å; H549-Y561 AromaticContact NE2-CE1 3.69Å; H549-Y561 AromaticContact NE2-CE2 3.95Å; H549-Y561 AromaticContact NE2-CG 3.48Å; H549-Y561 AromaticContact NE2-CZ 3.94Å
550	G	91.2	Very high	92.6	Very high	34 Å²	34	44.2 Å²	44.2	35%	0.351	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.9	33	179.5	0	0	0	0	0	114.5	D546	D546-G550 CarbonylContact O-C 3.48Å; D546-G550 WeakPolarHBondContact O-CA 3.13Å; D546-G550 PolarHBondContact O-N 2.97Å
551	V	91.8	Very high	92.7	Very high	23 Å²	23	43.3 Å²	43.3	14%	0.139	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	132.2	-170.1	-176.8	0	0	0	0	110.8	D546 H549 Q554 T557	D546-V551 HydrophobicContact CB-CB 4.33Å; D546-V551 PolarHBondContact N-O 2.85Å; D546-V551 PolarHBondContact O-N 3.08Å; H549-V551 HydrophobicContact CB-CG2 3.93Å; V551-Q554 HydrophobicContact CG1-CB 3.59Å; V551-Q554 HydrophobicContact CG1-CG 3.8Å; V551-T557 HydrophobicContact CG1-CG2 4.15Å; V551-T557 HydrophobicContact CG2-CG2 4.01Å
552	V	94	Very high	92.7	Very high	22 Å²	22	38.4 Å²	38.4	13%	0.133	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	134	178	176.8	0	0	0	0	108.6	L254 V258 V543 V545 Q554	L254-V552 HydrophobicContact CB-CG1 3.95Å; L254-V552 HydrophobicContact CB-CG2 4.41Å; V258-V552 HydrophobicContact CB-CG2 4.44Å; V258-V552 HydrophobicContact CG2-CG2 3.92Å; V543-V552 HydrophobicContact CG1-CG1 3.69Å; V545-V552 HydrophobicContact CG1-CG2 4.11Å; V545-V552 HydrophobicContact CG2-CG1 4.39Å; V545-V552 HydrophobicContact CG2-CG2 4.42Å; V552-Q554 PolarHBondContact O-N 3.47Å
553	G	91.5	Very high	92.6	Very high	40 Å²	40	40.2 Å²	40.2	41%	0.412	22%	0.22	S	C	.	.	S	Bend	trans	73.5	17.9	174.3	0	0	0	0	0	116	C544	C544-G553 PolarHBondContact O-N 3.44Å
554	Q	91.8	Very high	92.3	Very high	101 Å²	101	45.1 Å²	45.1	47%	0.472	24%	0.24	S	C	.	.			trans	-125.6	85	-178.6	-52	176.7	9.5	0	0	112.5	C544 V551 V552 L556 T557	C544-Q554 VanDerWaalsContact SG-C 3.56Å; C544-Q554 PolarHBondContact SG-N 2.87Å; V551-Q554 HydrophobicContact CG1-CB 3.59Å; V551-Q554 HydrophobicContact CG1-CG 3.8Å; V552-Q554 PolarHBondContact O-N 3.47Å; Q554-L556 VanDerWaalsContact C-N 3.32Å; Q554-L556 PolarHBondContact O-N 3.15Å; Q554-T557 WeakPolarHBondContact CB-OG1 3.39Å; Q554-T557 WeakPolarHBondContact O-CB 3.34Å; Q554-T557 PolarHBondContact O-N 2.93Å; Q554-T557 VanDerWaalsContact O-N 3.09Å; Q554-T557 PolarHBondContact OE1-OG1 3.47Å; Q554-T557 VanDerWaalsContact OE1-OG1 3.06Å
555	P	92.2	Very high	92	Very high	35 Å²	35	49.1 Å²	49.1	23%	0.227	27%	0.266	C	S	.	.	H	α-helix	trans	-67.9	-29.7	-174.6	25.6	-33.8	0	0	0	113.3	C544 T557 C558 Y559 R584 Y585	C544-P555 VanDerWaalsContact SG-N 3.38Å; P555-T557 PolarHBondContact O-N 3.17Å; P555-C558 WeakPolarHBondContact O-CB 3.39Å; P555-C558 PolarHBondContact O-N 2.87Å; P555-Y559 PolarHBondContact O-N 2.91Å; P555-Y559 VanDerWaalsContact O-N 3.11Å; P555-R584 HydrophobicContact CB-CG 4.11Å; P555-R584 WeakPolarHBondContact CB-O 3.35Å; P555-R584 HydrophobicContact CG-CG 4.44Å; P555-Y585 HydrophobicContact CB-CD1 3.68Å; P555-Y585 HydrophobicContact CB-CE1 3.76Å
556	L	91.8	Very high	91.7	Very high	105 Å²	105	49.4 Å²	49.4	55%	0.55	27%	0.267	S	S	.	.	H	α-helix	trans	-61.8	-28.6	173.9	-67	176.8	0	0	0	112.7	Q554 K560 P587	Q554-L556 VanDerWaalsContact C-N 3.32Å; Q554-L556 PolarHBondContact O-N 3.15Å; L556-K560 PolarHBondContact O-N 3.41Å; L556-K560 VanDerWaalsContact O-N 3.08Å; L556-P587 HydrophobicContact CD2-CB 4.19Å; L556-P587 HydrophobicContact CD2-CG 4.4Å
557	T	91.3	Very high	91.6	Very high	28 Å²	28	49.8 Å²	49.8	17%	0.172	27%	0.27	C	S	.	.	H	α-helix	trans	-73.3	-40.6	178.4	-50.2	0	0	0	0	110.3	V551 Q554 P555 K560 Y561	V551-T557 HydrophobicContact CG1-CG2 4.15Å; V551-T557 HydrophobicContact CG2-CG2 4.01Å; Q554-T557 WeakPolarHBondContact CB-OG1 3.39Å; Q554-T557 WeakPolarHBondContact O-CB 3.34Å; Q554-T557 PolarHBondContact O-N 2.93Å; Q554-T557 VanDerWaalsContact O-N 3.09Å; Q554-T557 PolarHBondContact OE1-OG1 3.47Å; Q554-T557 VanDerWaalsContact OE1-OG1 3.06Å; P555-T557 PolarHBondContact O-N 3.17Å; T557-K560 VanDerWaalsContact O-CB 3.29Å; T557-K560 WeakPolarHBondContact O-CB 3.28Å; T557-K560 PolarHBondContact O-N 3.44Å; T557-K560 VanDerWaalsContact O-N 3.14Å; T557-Y561 HydrophobicContact CG2-CD2 4.06Å; T557-Y561 HydrophobicContact CG2-CE2 3.6Å; T557-Y561 WeakPolarHBondContact O-CD2 3.35Å; T557-Y561 PolarHBondContact O-N 3.47Å
558	C	91.8	Very high	91.7	Very high	3 Å²	3	49.7 Å²	49.7	2%	0.02	27%	0.27	C	S	.	.	H	α-helix	trans	-59.4	-48.6	171.6	-53.1	0	0	0	0	111	W531 P555 K560 Y561 A562 Y585	W531-C558 HydrophobicContact CD2-CB 4.15Å; W531-C558 HydrophobicContact CE3-CB 4.47Å; W531-C558 HydrophobicContact CZ2-CB 4.43Å; P555-C558 WeakPolarHBondContact O-CB 3.39Å; P555-C558 PolarHBondContact O-N 2.87Å; C558-K560 PolarHBondContact O-N 3.28Å; C558-Y561 PolarHBondContact O-N 3.14Å; C558-Y561 VanDerWaalsContact O-N 3.11Å; C558-A562 WeakPolarHBondContact O-CB 3.21Å; C558-A562 PolarHBondContact O-N 3.03Å; C558-Y585 HydrophobicContact CB-CD1 3.96Å; C558-Y585 HydrophobicContact CB-CE1 4.13Å
559	Y	92.3	Very high	91.9	Very high	54 Å²	54	48 Å²	48	21%	0.212	26%	0.26	C	S	.	.	H	α-helix	trans	-59.6	-28.1	175.2	172.8	-98.4	0	0	0	114.1	P555 K564 M566 Y585 P587	P555-Y559 PolarHBondContact O-N 2.91Å; P555-Y559 VanDerWaalsContact O-N 3.11Å; Y559-K564 WeakPolarHBondContact O-CE 3.43Å; Y559-K564 PolarHBondContact O-NZ 2.87Å; Y559-M566 HydrophobicContact CD2-CB 4.38Å; Y559-M566 HydrophobicContact CD2-CE 4.14Å; Y559-M566 HydrophobicContact CD2-SD 3.8Å; Y559-M566 HydrophobicContact CE2-CB 4.31Å; Y559-Y585 WeakPolarHBondContact CB-O 3.1Å; Y559-P587 HydrophobicContact CD1-CG 3.91Å; Y559-P587 HydrophobicContact CE1-CG 3.65Å; Y559-P587 HydrophobicContact CG-CG 4.5Å
560	K	92.1	Very high	92.2	Very high	132 Å²	132	44.7 Å²	44.7	57%	0.574	24%	0.244	S	C	*	.	H	α-helix	trans	-67.1	-40.2	176.5	-174	-173	171.4	-164.5	0	111.5	L556 T557 C558 K564	L556-K560 PolarHBondContact O-N 3.41Å; L556-K560 VanDerWaalsContact O-N 3.08Å; T557-K560 VanDerWaalsContact O-CB 3.29Å; T557-K560 WeakPolarHBondContact O-CB 3.28Å; T557-K560 PolarHBondContact O-N 3.44Å; T557-K560 VanDerWaalsContact O-N 3.14Å; C558-K560 PolarHBondContact O-N 3.28Å; K560-K564 PolarHBondContact O-NZ 2.86Å
561	Y	91.6	Very high	92.4	Very high	87 Å²	87	43.1 Å²	43.1	34%	0.341	23%	0.227	S	C	.	.	H	α-helix	trans	-95.9	-20.5	-172.7	-63.7	-63.3	0	0	0	115	G527 I528 H549 T557 C558	G527-Y561 CarbonylContact C-O 3.58Å; G527-Y561 WeakPolarHBondContact CA-O 3.49Å; I528-Y561 PolarHBondContact N-O 2.82Å; H549-Y561 HydrophobicContact CB-CE2 4.35Å; H549-Y561 AromaticContact CD2-CD2 3.9Å; H549-Y561 AromaticContact CD2-CE2 3.75Å; H549-Y561 AromaticContact CD2-CZ 3.81Å; H549-Y561 VanDerWaalsContact CE1-CB 3.49Å; H549-Y561 WeakPolarHBondContact CE1-CB 3.45Å; H549-Y561 AromaticContact CE1-CD1 3.79Å; H549-Y561 AromaticContact CE1-CD2 3.49Å; H549-Y561 VanDerWaalsContact CE1-CD2 3.49Å; H549-Y561 WeakPolarHBondContact CE1-CD2 3.43Å; H549-Y561 AromaticContact CE1-CG 3.32Å; H549-Y561 AromaticContact CG-CD2 3.78Å; H549-Y561 AromaticContact CG-CE2 3.79Å; H549-Y561 AromaticContact ND1-CD2 3.52Å; H549-Y561 AromaticContact ND1-CG 3.85Å; H549-Y561 AromaticContact NE2-CD1 3.46Å; H549-Y561 WeakPolarHBondContact NE2-CD1 3.45Å; H549-Y561 AromaticContact NE2-CD2 3.71Å; H549-Y561 AromaticContact NE2-CE1 3.69Å; H549-Y561 AromaticContact NE2-CE2 3.95Å; H549-Y561 AromaticContact NE2-CG 3.48Å; H549-Y561 AromaticContact NE2-CZ 3.94Å; T557-Y561 HydrophobicContact CG2-CD2 4.06Å; T557-Y561 HydrophobicContact CG2-CE2 3.6Å; T557-Y561 WeakPolarHBondContact O-CD2 3.35Å; T557-Y561 PolarHBondContact O-N 3.47Å; C558-Y561 PolarHBondContact O-N 3.14Å; C558-Y561 VanDerWaalsContact O-N 3.11Å
562	A	92	Very high	92.7	Very high	6 Å²	6	42 Å²	42	5%	0.05	22%	0.221	C	C	.	.	S	Bend	trans	-66.7	159.6	174.8	0	0	0	0	0	114	I528 W531 C558 M566	I528-A562 WeakPolarHBondContact O-CA 3.41Å; W531-A562 HydrophobicContact CZ3-CB 4.06Å; C558-A562 WeakPolarHBondContact O-CB 3.21Å; C558-A562 PolarHBondContact O-N 3.03Å; A562-M566 HydrophobicContact CB-CE 3.37Å
563	T	92.1	Very high	92.6	Very high	49 Å²	49	41.2 Å²	41.2	30%	0.301	22%	0.216	S	C	.	.			trans	-70.9	140.2	179.6	-58.1	0	0	0	0	110.7	Q320 G527 D529	Q320-T563 PolarHBondContact NE2-O 3.25Å; G527-T563 VanDerWaalsContact CA-OG1 3.24Å; G527-T563 WeakPolarHBondContact CA-OG1 3.45Å; G527-T563 PolarHBondContact N-OG1 3.31Å; G527-T563 PolarHBondContact O-OG1 2.94Å; D529-T563 VanDerWaalsContact OD1-CB 3.25Å; D529-T563 WeakPolarHBondContact OD1-CB 3.41Å; D529-T563 PolarHBondContact OD1-N 2.81Å; D529-T563 PolarHBondContact OD1-OG1 3.27Å; D529-T563 WeakPolarHBondContact OD2-CB 3.41Å; D529-T563 PolarHBondContact OD2-OG1 2.82Å
564	K	88.7	Confident	92.6	Very high	113 Å²	113	40.9 Å²	40.9	49%	0.491	21%	0.207	S	C	.	.	S	Bend	trans	-110.5	137.4	-174.9	-74.4	163.8	-178.3	148.6	0	111.1	Y559 K560	Y559-K564 WeakPolarHBondContact O-CE 3.43Å; Y559-K564 PolarHBondContact O-NZ 2.87Å; K560-K564 PolarHBondContact O-NZ 2.86Å
565	P	88.9	Confident	92.5	Very high	88 Å²	88	41.2 Å²	41.2	57%	0.571	21%	0.212	S	C	*	.	S	Bend	cis	-84.1	129.3	5.7	32.8	-33.8	0	0	0	113.8	Q320 T567	Q320-P565 PolarHBondContact OE1-O 3.48Å; P565-T567 HydrophobicContact CB-CG2 4.41Å; P565-T567 HydrophobicContact CG-CG2 4.45Å; P565-T567 PolarHBondContact O-N 3.45Å
566	M	90.1	Very high	92.5	Very high	6 Å²	6	40 Å²	40	3%	0.03	21%	0.206	C	C	.	.			trans	-66.9	123.5	167.5	-179.9	175.6	-70.7	0	0	108.9	W531 Y559 A562 V569 T593	W531-M566 HydrophobicContact CH2-CE 3.66Å; W531-M566 HydrophobicContact CZ3-CE 4.29Å; Y559-M566 HydrophobicContact CD2-CB 4.38Å; Y559-M566 HydrophobicContact CD2-CE 4.14Å; Y559-M566 HydrophobicContact CD2-SD 3.8Å; Y559-M566 HydrophobicContact CE2-CB 4.31Å; A562-M566 HydrophobicContact CB-CE 3.37Å; M566-V569 HydrophobicContact CE-CG2 4.26Å; M566-V569 HydrophobicContact CG-CG2 3.51Å; M566-V569 HydrophobicContact SD-CG2 3.46Å; M566-V569 WeakPolarHBondContact SD-CG2 3.35Å; M566-T593 WeakPolarHBondContact O-CG2 3.33Å
567	T	92.2	Very high	92.6	Very high	13 Å²	13	38.8 Å²	38.8	8%	0.08	19%	0.194	C	C	.	.			trans	-127.2	-41.9	-173.9	47.8	0	0	0	0	113.8	P565 C596 R597	P565-T567 HydrophobicContact CB-CG2 4.41Å; P565-T567 HydrophobicContact CG-CG2 4.45Å; P565-T567 PolarHBondContact O-N 3.45Å; T567-C596 HydrophobicContact CG2-CB 4.33Å; T567-R597 VanDerWaalsContact O-CD 3.29Å; T567-R597 WeakPolarHBondContact O-CD 3.47Å; T567-R597 PolarHBondContact O-NH1 3.26Å; T567-R597 VanDerWaalsContact O-NH1 3.11Å
568	Y	95.1	Very high	92.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	120.2	175.6	-53.5	-93.4	0	0	0	108.8	H206 L210 S318 L319 P321 R597 V598 W603	H206-Y568 AromaticContact CE1-CE2 3.78Å; H206-Y568 AromaticContact NE2-CE2 3.49Å; H206-Y568 WeakPolarHBondContact NE2-CE2 3.48Å; H206-Y568 AromaticContact NE2-CZ 3.51Å; H206-Y568 PolarHBondContact NE2-OH 3.23Å; L210-Y568 HydrophobicContact CD1-CD1 4.36Å; L210-Y568 HydrophobicContact CD1-CD2 3.75Å; L210-Y568 HydrophobicContact CD1-CE2 4.14Å; L210-Y568 HydrophobicContact CD1-CG 3.87Å; L210-Y568 HydrophobicContact CD2-CD1 4.03Å; L210-Y568 HydrophobicContact CD2-CD2 4.28Å; L210-Y568 HydrophobicContact CD2-CE1 3.71Å; L210-Y568 HydrophobicContact CD2-CE2 3.98Å; L210-Y568 HydrophobicContact CD2-CG 4.3Å; S318-Y568 CarbonylContact C-O 3.4Å; S318-Y568 WeakPolarHBondContact CA-O 3.48Å; L319-Y568 PolarHBondContact N-O 3.43Å; P321-Y568 HydrophobicContact CG-CD2 3.86Å; P321-Y568 HydrophobicContact CG-CE2 3.74Å; Y568-R597 HydrophobicContact CD1-CG 4.36Å; Y568-R597 VanDerWaalsContact CD1-CZ 3.45Å; Y568-R597 HydrophobicContact CE1-CB 4.03Å; Y568-R597 HydrophobicContact CE1-CG 3.79Å; Y568-R597 HydrophobicContact CE2-CG 4.31Å; Y568-R597 WeakPolarHBondContact OH-CA 3.29Å; Y568-V598 HydrophobicContact CE1-CG1 4.31Å; Y568-V598 WeakPolarHBondContact OH-CG1 3.35Å; Y568-V598 PolarHBondContact OH-N 2.83Å; Y568-W603 HydrophobicContact CD1-CD2 4.42Å; Y568-W603 HydrophobicContact CD1-CH2 4.5Å; Y568-W603 HydrophobicContact CD1-CZ2 4.03Å; Y568-W603 HydrophobicContact CE1-CD2 4.42Å
569	V	96.3	Very high	92.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	118	172.2	-170.5	0	0	0	0	108	V316 L317 W531 M566 V581 T582 Y585	V316-V569 HydrophobicContact CG1-CG1 3.3Å; L317-V569 WeakPolarHBondContact O-CA 3.34Å; W531-V569 HydrophobicContact CH2-CG1 3.96Å; W531-V569 HydrophobicContact CH2-CG2 4.48Å; W531-V569 HydrophobicContact CZ2-CG1 3.66Å; M566-V569 HydrophobicContact CE-CG2 4.26Å; M566-V569 HydrophobicContact CG-CG2 3.51Å; M566-V569 HydrophobicContact SD-CG2 3.46Å; M566-V569 WeakPolarHBondContact SD-CG2 3.35Å; V569-V581 HydrophobicContact CB-CG2 4.33Å; V569-V581 HydrophobicContact CG1-CG2 3.82Å; V569-V581 PolarHBondContact O-N 2.79Å; V569-T582 HydrophobicContact CG2-CG2 4.32Å; V569-T582 PolarHBondContact N-OG1 3.23Å; V569-T582 PolarHBondContact O-N 3.43Å; V569-T582 PolarHBondContact O-OG1 3.14Å; V569-Y585 HydrophobicContact CB-CD2 4.49Å; V569-Y585 HydrophobicContact CG1-CD2 3.91Å; V569-Y585 HydrophobicContact CG1-CE2 4.31Å
570	V	96.7	Very high	93.1	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.5	-179.3	-63.2	0	0	0	0	110.5	L214 V316 L317 L319 V578 R579 W603	L214-V570 HydrophobicContact CD1-CG2 4.21Å; V316-V570 CarbonylContact C-O 3.56Å; V316-V570 WeakPolarHBondContact CA-O 3.41Å; L317-V570 HydrophobicContact CB-CG2 4.17Å; L317-V570 PolarHBondContact N-O 2.7Å; L317-V570 PolarHBondContact O-N 3.31Å; L319-V570 HydrophobicContact CD1-CG1 4.16Å; L319-V570 HydrophobicContact CD1-CG2 3.89Å; L319-V570 HydrophobicContact CD2-CG2 3.97Å; L319-V570 HydrophobicContact CG-CG2 4.01Å; V570-V578 HydrophobicContact CB-CG1 4.05Å; V570-V578 HydrophobicContact CG1-CG1 4.38Å; V570-R579 CarbonylContact C-O 3.58Å; V570-R579 WeakPolarHBondContact CA-O 3.45Å; V570-W603 HydrophobicContact CG1-CH2 4.45Å; V570-W603 HydrophobicContact CG1-CZ2 3.9Å
571	G	96.5	Very high	93.2	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	120.9	170.2	0	0	0	0	0	109.9	V578 R579	G571-V578 WeakPolarHBondContact O-CA 3.4Å; G571-R579 PolarHBondContact N-O 3.43Å; G571-R579 PolarHBondContact O-N 3.18Å
572	I	96.7	Very high	93.4	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	114.3	178.7	-48.5	-178.5	0	0	0	109.1	G217 F218 N221 R314 L315 L317 W577 V578	G217-I572 VanDerWaalsContact C-CD1 3.46Å; F218-I572 HydrophobicContact CD1-CG2 4.22Å; F218-I572 HydrophobicContact CE1-CG2 4.38Å; N221-I572 HydrophobicContact CB-CB 4.45Å; N221-I572 HydrophobicContact CB-CG2 3.84Å; R314-I572 CarbonylContact C-O 3.55Å; R314-I572 WeakPolarHBondContact CA-O 3.5Å; L315-I572 PolarHBondContact N-O 3.45Å; L315-I572 PolarHBondContact O-N 2.95Å; L317-I572 HydrophobicContact CD1-CD1 4.01Å; I572-W577 CarbonylContact C-O 3.52Å; I572-W577 WeakPolarHBondContact CA-O 3.41Å; I572-V578 HydrophobicContact CG1-CG2 4.16Å; I572-V578 HydrophobicContact CG2-CG2 4.25Å
573	D	93.7	Very high	93.5	Very high	5 Å²	5	29.3 Å²	29.3	3%	0.027	15%	0.153	C	C	.	.			trans	-72.4	168	-177.4	-148.8	-19.1	0	0	0	112.6	N221 L312 R314 D575 G576 W577	N221-D573 PolarHBondContact ND2-O 2.84Å; N221-D573 PolarHBondContact OD1-O 2.95Å; L312-D573 WeakPolarHBondContact CD1-OD1 3.47Å; R314-D573 HydrophobicContact CG-CB 4.12Å; D573-D575 PolarHBondContact O-N 2.98Å; D573-G576 PolarHBondContact O-N 3.15Å; D573-W577 HydrophobicContact CB-CB 4.24Å; D573-W577 PolarHBondContact N-O 3.37Å
574	S	90.5	Very high	93.6	Very high	34 Å²	34	27.2 Å²	27.2	24%	0.238	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.7	-37.2	177	53.1	0	0	0	0	113.7	S225 T313 G576	S225-S574 PolarHBondContact OG-O 3.29Å; T313-S574 PolarHBondContact O-N 3.33Å; S574-G576 VanDerWaalsContact C-N 3.33Å
575	D	90.2	Very high	93.8	Very high	107 Å²	107	21.9 Å²	21.9	57%	0.572	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-12.8	177.7	-67.1	-16.7	0	0	0	113.9	D573 W577	D573-D575 PolarHBondContact O-N 2.98Å; D575-W577 VanDerWaalsContact CB-CD1 3.49Å; D575-W577 HydrophobicContact CB-CG 4.31Å; D575-W577 VanDerWaalsContact CB-NE1 3.25Å; D575-W577 PolarHBondContact OD2-NE1 2.81Å; D575-W577 VanDerWaalsContact OD2-NE1 3.12Å
576	G	91.2	Very high	93.9	Very high	9 Å²	9	17.8 Å²	17.8	9%	0.093	9%	0.09	C	C	.	.			trans	91	9.8	-174.1	0	0	0	0	0	115.3	F218 D573 S574	F218-G576 WeakPolarHBondContact CE1-O 3.4Å; D573-G576 PolarHBondContact O-N 3.15Å; S574-G576 VanDerWaalsContact C-N 3.33Å
577	W	94.5	Very high	93.9	Very high	81 Å²	81	19.9 Å²	19.9	31%	0.307	10%	0.104	S	C	.	.			trans	-66	142.8	167.9	-50	119.7	0	0	0	110.6	I572 D573 D575 Y610 Q611 P613	I572-W577 CarbonylContact C-O 3.52Å; I572-W577 WeakPolarHBondContact CA-O 3.41Å; D573-W577 HydrophobicContact CB-CB 4.24Å; D573-W577 PolarHBondContact N-O 3.37Å; D575-W577 VanDerWaalsContact CB-CD1 3.49Å; D575-W577 HydrophobicContact CB-CG 4.31Å; D575-W577 VanDerWaalsContact CB-NE1 3.25Å; D575-W577 PolarHBondContact OD2-NE1 2.81Å; D575-W577 VanDerWaalsContact OD2-NE1 3.12Å; W577-Y610 CarbonylContact C-O 3.59Å; W577-Y610 VanDerWaalsContact CA-O 3.29Å; W577-Y610 WeakPolarHBondContact CA-O 3.35Å; W577-Q611 WeakPolarHBondContact CZ3-O 3.37Å; W577-P613 HydrophobicContact CZ2-CG 3.98Å
578	V	95.6	Very high	93.8	Very high	4 Å²	4	21.5 Å²	21.5	2%	0.024	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	129.6	-176.1	-174.8	0	0	0	0	111.4	L214 F218 V570 G571 I572 L607 Y610	L214-V578 HydrophobicContact CD1-CG1 4.22Å; F218-V578 HydrophobicContact CD1-CG2 4.44Å; F218-V578 HydrophobicContact CE1-CG2 3.34Å; F218-V578 HydrophobicContact CZ-CG2 3.43Å; F218-V578 VanDerWaalsContact CZ-CG2 3.43Å; V570-V578 HydrophobicContact CB-CG1 4.05Å; V570-V578 HydrophobicContact CG1-CG1 4.38Å; G571-V578 WeakPolarHBondContact O-CA 3.4Å; I572-V578 HydrophobicContact CG1-CG2 4.16Å; I572-V578 HydrophobicContact CG2-CG2 4.25Å; V578-L607 HydrophobicContact CB-CD2 4.43Å; V578-L607 HydrophobicContact CG1-CD2 3.87Å; V578-Y610 HydrophobicContact CG2-CG 4.47Å; V578-Y610 PolarHBondContact N-O 3.44Å
579	R	94.7	Very high	93.6	Very high	36 Å²	36	22.9 Å²	22.9	14%	0.136	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	138.4	172	-168.2	68	178.9	-169.7	-1.5	110.9	V570 G571 V581 E618 D622	V570-R579 CarbonylContact C-O 3.58Å; V570-R579 WeakPolarHBondContact CA-O 3.45Å; G571-R579 PolarHBondContact N-O 3.43Å; G571-R579 PolarHBondContact O-N 3.18Å; R579-V581 HydrophobicContact CB-CG1 4.16Å; R579-V581 HydrophobicContact CG-CG1 4.02Å; R579-V581 PolarHBondContact O-N 3.13Å; R579-E618 IonicContact CZ-OE2 2.64Å; R579-E618 IonicContact NH1-OE1 2.65Å; R579-E618 IonicContact NH1-OE2 3.64Å; R579-E618 PolarHBondContact NH1-OE2 2.8Å; R579-D622 IonicContact CZ-OD1 3.54Å; R579-D622 IonicContact CZ-OD2 3.06Å; R579-D622 IonicContact NH2-OD1 2.69Å; R579-D622 PolarHBondContact NH2-OD1 3.42Å; R579-D622 IonicContact NH2-OD2 3.09Å; R579-D622 PolarHBondContact NH2-OD2 3.44Å
580	D	95.2	Very high	93.2	Very high	26 Å²	26	24 Å²	24	14%	0.139	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	111.3	164.9	-169.3	-33.1	0	0	0	108.9	T582 R597 W603 L607	D580-T582 WeakPolarHBondContact OD1-CB 3.49Å; D580-T582 PolarHBondContact OD1-N 3.25Å; D580-T582 PolarHBondContact OD1-OG1 2.75Å; D580-R597 IonicContact OD1-NH1 3.78Å; D580-R597 IonicContact OD2-CZ 2.69Å; D580-R597 IonicContact OD2-NH1 3.24Å; D580-R597 PolarHBondContact OD2-NH1 3.07Å; D580-R597 IonicContact OD2-NH2 2.66Å; D580-R597 PolarHBondContact OD2-NH2 3.35Å; D580-W603 PolarHBondContact OD2-NE1 3.12Å; D580-L607 HydrophobicContact CB-CD1 4.18Å
581	V	95.1	Very high	92.8	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.13	C	C	.	.			trans	-108.6	14.2	-177.8	-62.6	0	0	0	0	111.8	V316 V569 R579 Q583 R584 Y585	V316-V581 HydrophobicContact CG1-CG2 3.91Å; V569-V581 HydrophobicContact CB-CG2 4.33Å; V569-V581 HydrophobicContact CG1-CG2 3.82Å; V569-V581 PolarHBondContact O-N 2.79Å; R579-V581 HydrophobicContact CB-CG1 4.16Å; R579-V581 HydrophobicContact CG-CG1 4.02Å; R579-V581 PolarHBondContact O-N 3.13Å; V581-Q583 PolarHBondContact O-N 2.83Å; V581-R584 WeakPolarHBondContact O-CB 3.37Å; V581-R584 PolarHBondContact O-N 3.42Å; V581-Y585 HydrophobicContact CB-CE2 4.22Å; V581-Y585 HydrophobicContact CG2-CD2 4.23Å; V581-Y585 HydrophobicContact CG2-CE2 3.79Å; V581-Y585 WeakPolarHBondContact O-CD2 3.37Å
582	T	94.9	Very high	92.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-51.6	-36.8	-179.4	-49	0	0	0	0	112.1	V569 D580 R584 Y585 D586 W589 R597	V569-T582 HydrophobicContact CG2-CG2 4.32Å; V569-T582 PolarHBondContact N-OG1 3.23Å; V569-T582 PolarHBondContact O-N 3.43Å; V569-T582 PolarHBondContact O-OG1 3.14Å; D580-T582 WeakPolarHBondContact OD1-CB 3.49Å; D580-T582 PolarHBondContact OD1-N 3.25Å; D580-T582 PolarHBondContact OD1-OG1 2.75Å; T582-R584 VanDerWaalsContact C-N 3.28Å; T582-R584 PolarHBondContact O-N 2.83Å; T582-Y585 PolarHBondContact O-N 3.49Å; T582-Y585 VanDerWaalsContact O-N 3.17Å; T582-D586 HydrophobicContact CG2-CB 4.17Å; T582-D586 PolarHBondContact O-N 2.88Å; T582-W589 HydrophobicContact CG2-CE3 3.66Å; T582-W589 HydrophobicContact CG2-CZ3 3.62Å; T582-R597 PolarHBondContact OG1-NH1 2.92Å; T582-R597 VanDerWaalsContact OG1-NH1 3.14Å
583	Q	94	Very high	92	Very high	44 Å²	44	28.7 Å²	28.7	21%	0.206	15%	0.153	C	C	.	.	H	α-helix	trans	-60	-31.8	178.2	-56.1	-161.8	84.7	0	0	113.5	V581 W589 F625 K628	V581-Q583 PolarHBondContact O-N 2.83Å; Q583-W589 HydrophobicContact CG-CD2 4.18Å; Q583-W589 HydrophobicContact CG-CG 4.36Å; Q583-W589 HydrophobicContact CG-CZ2 4.07Å; Q583-F625 HydrophobicContact CB-CB 4.07Å; Q583-F625 HydrophobicContact CB-CD1 4.17Å; Q583-F625 HydrophobicContact CB-CD2 3.79Å; Q583-F625 HydrophobicContact CB-CE2 4.24Å; Q583-F625 HydrophobicContact CB-CG 3.74Å; Q583-F625 HydrophobicContact CG-CD2 4.29Å; Q583-K628 PolarHBondContact O-NZ 3Å
584	R	93.9	Very high	91.7	Very high	6 Å²	6	34.8 Å²	34.8	2%	0.023	18%	0.176	C	C	.	.	H	α-helix	trans	-69.7	-36.1	176.8	-171.7	170.4	-75.8	121.9	1.9	112.2	E533 P555 V581 T582 E621 E624 F625 K628	E533-R584 WeakPolarHBondContact OE1-CD 3.37Å; E533-R584 IonicContact OE1-CZ 2.72Å; E533-R584 IonicContact OE1-NH1 3.47Å; E533-R584 PolarHBondContact OE1-NH1 3.39Å; E533-R584 IonicContact OE2-NH1 2.69Å; E533-R584 PolarHBondContact OE2-NH1 3.13Å; P555-R584 HydrophobicContact CB-CG 4.11Å; P555-R584 WeakPolarHBondContact CB-O 3.35Å; P555-R584 HydrophobicContact CG-CG 4.44Å; V581-R584 WeakPolarHBondContact O-CB 3.37Å; V581-R584 PolarHBondContact O-N 3.42Å; T582-R584 VanDerWaalsContact C-N 3.28Å; T582-R584 PolarHBondContact O-N 2.83Å; R584-E621 IonicContact CZ-OE1 3.4Å; R584-E621 VanDerWaalsContact CZ-OE1 3.25Å; R584-E621 IonicContact NH1-OE1 2.65Å; R584-E621 PolarHBondContact NH1-OE1 2.67Å; R584-E621 IonicContact NH2-OE1 3.31Å; R584-E621 PolarHBondContact NH2-OE1 3.21Å; R584-E624 IonicContact CZ-OE1 2.74Å; R584-E624 IonicContact CZ-OE2 3.5Å; R584-E624 IonicContact NE-OE1 3.77Å; R584-E624 PolarHBondContact NE-OE1 3.46Å; R584-E624 VanDerWaalsContact NE-OE1 3.09Å; R584-E624 IonicContact NE-OE2 3.21Å; R584-E624 IonicContact NH2-OE1 3.15Å; R584-E624 PolarHBondContact NH2-OE1 3.44Å; R584-E624 IonicContact NH2-OE2 3.81Å; R584-E624 PolarHBondContact NH2-OE2 2.93Å; R584-F625 HydrophobicContact CB-CE1 3.75Å; R584-F625 HydrophobicContact CB-CZ 4.3Å; R584-F625 HydrophobicContact CG-CE1 4.49Å; R584-K628 VanDerWaalsContact C-NZ 3.26Å; R584-K628 PolarHBondContact O-NZ 2.78Å
585	Y	94	Very high	91.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-99	-43.5	-171	-62	-78.7	0	0	0	114.2	V316 W531 E533 C544 P555 C558 Y559 V569 V581 T582 P587	V316-Y585 HydrophobicContact CG1-CE2 4.13Å; W531-Y585 AromaticContact CE2-CD1 3.95Å; W531-Y585 AromaticContact CE2-CE1 3.64Å; W531-Y585 AromaticContact CE2-CZ 3.82Å; W531-Y585 AromaticContact CZ2-CD1 3.63Å; W531-Y585 HydrophobicContact CZ2-CD1 3.63Å; W531-Y585 AromaticContact CZ2-CD2 3.86Å; W531-Y585 HydrophobicContact CZ2-CD2 3.86Å; W531-Y585 AromaticContact CZ2-CE1 3.77Å; W531-Y585 HydrophobicContact CZ2-CE1 3.77Å; W531-Y585 HydrophobicContact CZ2-CE2 4.02Å; W531-Y585 AromaticContact CZ2-CG 3.67Å; W531-Y585 HydrophobicContact CZ2-CG 3.67Å; W531-Y585 AromaticContact CZ2-CZ 3.98Å; W531-Y585 AromaticContact NE1-CD1 3.92Å; W531-Y585 AromaticContact NE1-CE1 3.13Å; W531-Y585 AromaticContact NE1-CE2 3.83Å; W531-Y585 AromaticContact NE1-CZ 3.09Å; W531-Y585 PolarHBondContact NE1-OH 3.09Å; W531-Y585 VanDerWaalsContact NE1-OH 3.12Å; E533-Y585 VanDerWaalsContact CG-OH 3.26Å; E533-Y585 WeakPolarHBondContact CG-OH 3.41Å; E533-Y585 WeakPolarHBondContact OE1-CE2 3.34Å; E533-Y585 PolarHBondContact OE1-OH 2.54Å; C544-Y585 HydrophobicContact CB-CE1 3.9Å; C544-Y585 VanDerWaalsContact CB-OH 3.27Å; C544-Y585 WeakPolarHBondContact CB-OH 3.47Å; P555-Y585 HydrophobicContact CB-CD1 3.68Å; P555-Y585 HydrophobicContact CB-CE1 3.76Å; C558-Y585 HydrophobicContact CB-CD1 3.96Å; C558-Y585 HydrophobicContact CB-CE1 4.13Å; Y559-Y585 WeakPolarHBondContact CB-O 3.1Å; V569-Y585 HydrophobicContact CB-CD2 4.49Å; V569-Y585 HydrophobicContact CG1-CD2 3.91Å; V569-Y585 HydrophobicContact CG1-CE2 4.31Å; V581-Y585 HydrophobicContact CB-CE2 4.22Å; V581-Y585 HydrophobicContact CG2-CD2 4.23Å; V581-Y585 HydrophobicContact CG2-CE2 3.79Å; V581-Y585 WeakPolarHBondContact O-CD2 3.37Å; T582-Y585 PolarHBondContact O-N 3.49Å; T582-Y585 VanDerWaalsContact O-N 3.17Å; Y585-P587 VanDerWaalsContact O-CD 3.3Å; Y585-P587 WeakPolarHBondContact O-CD 3.25Å
586	D	91.8	Very high	91.5	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.011	17%	0.168	C	C	.	.			trans	-82.7	116.8	-172.4	177.6	23.5	0	0	0	112.3	T582 V588 W589 T593	T582-D586 HydrophobicContact CG2-CB 4.17Å; T582-D586 PolarHBondContact O-N 2.88Å; D586-V588 VanDerWaalsContact C-N 3.25Å; D586-V588 PolarHBondContact O-N 2.72Å; D586-V588 WeakPolarHBondContact OD1-CA 3.42Å; D586-V588 PolarHBondContact OD1-N 3.05Å; D586-W589 HydrophobicContact CB-CB 4.45Å; D586-W589 WeakPolarHBondContact OD2-CA 3.33Å; D586-W589 PolarHBondContact OD2-N 3.31Å; D586-T593 WeakPolarHBondContact OD2-CB 3.16Å; D586-T593 WeakPolarHBondContact OD2-CG2 3.42Å; D586-T593 PolarHBondContact OD2-OG1 3.12Å
587	P	89.2	Confident	91.5	Very high	51 Å²	51	34.9 Å²	34.9	33%	0.331	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-7.6	174.4	33.1	-34.8	0	0	0	113.5	L556 Y559 Y585	L556-P587 HydrophobicContact CD2-CB 4.19Å; L556-P587 HydrophobicContact CD2-CG 4.4Å; Y559-P587 HydrophobicContact CD1-CG 3.91Å; Y559-P587 HydrophobicContact CE1-CG 3.65Å; Y559-P587 HydrophobicContact CG-CG 4.5Å; Y585-P587 VanDerWaalsContact O-CD 3.3Å; Y585-P587 WeakPolarHBondContact O-CD 3.25Å
588	V	89.1	Confident	91.4	Very high	47 Å²	47	31.9 Å²	31.9	29%	0.285	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-108.1	6.9	-176.3	-155.9	0	0	0	0	112	D586 M590 T591 V592	D586-V588 VanDerWaalsContact C-N 3.25Å; D586-V588 PolarHBondContact O-N 2.72Å; D586-V588 WeakPolarHBondContact OD1-CA 3.42Å; D586-V588 PolarHBondContact OD1-N 3.05Å; V588-M590 PolarHBondContact O-N 3.3Å; V588-T591 VanDerWaalsContact CG1-OG1 3.22Å; V588-T591 WeakPolarHBondContact CG1-OG1 3.4Å; V588-T591 PolarHBondContact O-N 3.46Å; V588-T591 PolarHBondContact O-OG1 3.27Å; V588-V592 HydrophobicContact CG1-CB 3.76Å; V588-V592 HydrophobicContact CG1-CG2 3.67Å; V588-V592 PolarHBondContact O-N 3.18Å; V588-V592 VanDerWaalsContact O-N 3.1Å
589	W	90.8	Very high	91.1	Very high	28 Å²	28	35.9 Å²	35.9	11%	0.106	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.9	-56.2	-173.5	174.4	-116.9	0	0	0	113.7	T582 Q583 D586 T591 T593 R594 H629	T582-W589 HydrophobicContact CG2-CE3 3.66Å; T582-W589 HydrophobicContact CG2-CZ3 3.62Å; Q583-W589 HydrophobicContact CG-CD2 4.18Å; Q583-W589 HydrophobicContact CG-CG 4.36Å; Q583-W589 HydrophobicContact CG-CZ2 4.07Å; D586-W589 HydrophobicContact CB-CB 4.45Å; D586-W589 WeakPolarHBondContact OD2-CA 3.33Å; D586-W589 PolarHBondContact OD2-N 3.31Å; W589-T591 PolarHBondContact O-N 3.15Å; W589-T593 HydrophobicContact CE3-CG2 4.18Å; W589-T593 HydrophobicContact CZ3-CG2 4.39Å; W589-R594 WeakPolarHBondContact O-CB 3.32Å; W589-R594 PolarHBondContact O-N 3.47Å; W589-H629 WeakPolarHBondContact CB-NE2 3.46Å; W589-H629 AromaticContact CD1-NE2 3.32Å; W589-H629 VanDerWaalsContact CD1-NE2 3.32Å; W589-H629 AromaticContact CG-NE2 3.53Å
590	M	88.7	Confident	91	Very high	25 Å²	25	37.4 Å²	37.4	12%	0.123	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-12.1	-174.4	-66.6	-61.4	-170.4	0	0	114.4	V588 H629 H644 P645 L646	V588-M590 PolarHBondContact O-N 3.3Å; M590-H629 HydrophobicContact CE-CB 3.73Å; M590-H629 VanDerWaalsContact CE-CD2 3.43Å; M590-H629 WeakPolarHBondContact CE-CD2 3.46Å; M590-H629 VanDerWaalsContact CE-CG 3.4Å; M590-H644 WeakPolarHBondContact CB-NE2 3.44Å; M590-H644 PolarHBondContact O-CD2 3.1Å; M590-H644 VanDerWaalsContact O-CD2 3.28Å; M590-P645 HydrophobicContact CB-CG 4.29Å; M590-P645 HydrophobicContact CG-CG 4.4Å; M590-P645 VanDerWaalsContact O-CD 3.31Å; M590-P645 WeakPolarHBondContact O-CD 3.4Å; M590-P645 HydrophobicContact SD-CB 4.45Å; M590-P645 HydrophobicContact SD-CG 3.32Å; M590-P645 WeakPolarHBondContact SD-CG 3.22Å; M590-L646 HydrophobicContact CE-CD1 4.34Å
591	T	87.8	Confident	90.9	Very high	18 Å²	18	43.3 Å²	43.3	11%	0.11	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.6	-48.7	-169.5	62	0	0	0	0	114.9	V588 W589 K595 P635 L640	V588-T591 VanDerWaalsContact CG1-OG1 3.22Å; V588-T591 WeakPolarHBondContact CG1-OG1 3.4Å; V588-T591 PolarHBondContact O-N 3.46Å; V588-T591 PolarHBondContact O-OG1 3.27Å; W589-T591 PolarHBondContact O-N 3.15Å; T591-K595 WeakPolarHBondContact O-CD 3.36Å; T591-K595 WeakPolarHBondContact O-CE 3.46Å; T591-K595 PolarHBondContact O-NZ 3.01Å; T591-P635 HydrophobicContact CG2-CG 4.36Å; T591-L640 HydrophobicContact CG2-CB 3.98Å
592	V	87	Confident	90.9	Very high	68 Å²	68	46.4 Å²	46.4	41%	0.412	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.6	-52.7	-174.7	-179.5	0	0	0	0	111	V588 R594 K595 C596 L640	V588-V592 HydrophobicContact CG1-CB 3.76Å; V588-V592 HydrophobicContact CG1-CG2 3.67Å; V588-V592 PolarHBondContact O-N 3.18Å; V588-V592 VanDerWaalsContact O-N 3.1Å; V592-R594 PolarHBondContact O-N 3.24Å; V592-K595 WeakPolarHBondContact O-CA 3.49Å; V592-K595 WeakPolarHBondContact O-CB 3.4Å; V592-K595 PolarHBondContact O-N 2.87Å; V592-C596 PolarHBondContact O-N 2.46Å; V592-L640 HydrophobicContact CG2-CD2 4.39Å
593	T	89.6	Confident	90.9	Very high	12 Å²	12	47 Å²	47	7%	0.074	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-63	-42.7	-168	-50.3	0	0	0	0	112.8	M566 D586 W589 K595 C596 R597	M566-T593 WeakPolarHBondContact O-CG2 3.33Å; D586-T593 WeakPolarHBondContact OD2-CB 3.16Å; D586-T593 WeakPolarHBondContact OD2-CG2 3.42Å; D586-T593 PolarHBondContact OD2-OG1 3.12Å; W589-T593 HydrophobicContact CE3-CG2 4.18Å; W589-T593 HydrophobicContact CZ3-CG2 4.39Å; T593-K595 PolarHBondContact O-N 3.48Å; T593-K595 VanDerWaalsContact O-N 3.09Å; T593-C596 PolarHBondContact O-N 3.12Å; T593-R597 PolarHBondContact O-N 2.98Å
594	R	88.7	Confident	90.9	Very high	132 Å²	132	47.2 Å²	47.2	50%	0.498	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-52.8	-31.7	172.2	-176.2	176.9	177.3	-111.9	-4.2	113.2	W589 V592 C596	W589-R594 WeakPolarHBondContact O-CB 3.32Å; W589-R594 PolarHBondContact O-N 3.47Å; V592-R594 PolarHBondContact O-N 3.24Å; R594-C596 VanDerWaalsContact C-N 3.34Å
595	K	87	Confident	90.9	Very high	74 Å²	74	51.8 Å²	51.8	32%	0.322	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-84.4	-5.2	179.9	-60.6	170.8	-178.8	149.1	0	113.8	K325 T591 V592 T593 K642	K325-K595 PolarHBondContact NZ-O 2.82Å; T591-K595 WeakPolarHBondContact O-CD 3.36Å; T591-K595 WeakPolarHBondContact O-CE 3.46Å; T591-K595 PolarHBondContact O-NZ 3.01Å; V592-K595 WeakPolarHBondContact O-CA 3.49Å; V592-K595 WeakPolarHBondContact O-CB 3.4Å; V592-K595 PolarHBondContact O-N 2.87Å; T593-K595 PolarHBondContact O-N 3.48Å; T593-K595 VanDerWaalsContact O-N 3.09Å; K595-K642 VanDerWaalsContact CE-O 3.25Å; K595-K642 WeakPolarHBondContact CE-O 3.28Å; K595-K642 PolarHBondContact NZ-O 2.99Å
596	C	87.9	Confident	91	Very high	48 Å²	48	53 Å²	53	32%	0.324	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-105	-4.6	177.5	-68.3	0	0	0	0	112.9	T567 V592 T593 R594	T567-C596 HydrophobicContact CG2-CB 4.33Å; V592-C596 PolarHBondContact O-N 2.46Å; T593-C596 PolarHBondContact O-N 3.12Å; R594-C596 VanDerWaalsContact C-N 3.34Å
597	R	92.3	Very high	91.1	Very high	31 Å²	31	53.5 Å²	53.5	12%	0.117	28%	0.283	C	S	.	.	S	Bend	trans	-92.2	160.8	178.6	-68.4	173.3	60.4	132.3	-8.9	111.5	L324 T567 Y568 D580 T582 T593	L324-R597 VanDerWaalsContact CD2-C 3.44Å; L324-R597 WeakPolarHBondContact CD2-O 3.12Å; T567-R597 VanDerWaalsContact O-CD 3.29Å; T567-R597 WeakPolarHBondContact O-CD 3.47Å; T567-R597 PolarHBondContact O-NH1 3.26Å; T567-R597 VanDerWaalsContact O-NH1 3.11Å; Y568-R597 HydrophobicContact CD1-CG 4.36Å; Y568-R597 VanDerWaalsContact CD1-CZ 3.45Å; Y568-R597 HydrophobicContact CE1-CB 4.03Å; Y568-R597 HydrophobicContact CE1-CG 3.79Å; Y568-R597 HydrophobicContact CE2-CG 4.31Å; Y568-R597 WeakPolarHBondContact OH-CA 3.29Å; D580-R597 IonicContact OD1-NH1 3.78Å; D580-R597 IonicContact OD2-CZ 2.69Å; D580-R597 IonicContact OD2-NH1 3.24Å; D580-R597 PolarHBondContact OD2-NH1 3.07Å; D580-R597 IonicContact OD2-NH2 2.66Å; D580-R597 PolarHBondContact OD2-NH2 3.35Å; T582-R597 PolarHBondContact OG1-NH1 2.92Å; T582-R597 VanDerWaalsContact OG1-NH1 3.14Å; T593-R597 PolarHBondContact O-N 2.98Å
598	V	91.5	Very high	91.3	Very high	17 Å²	17	57.6 Å²	57.6	10%	0.103	29%	0.292	C	S	.	.			trans	-63.8	169.5	168.7	69.7	0	0	0	0	110.2	K207 Y568 A600 W602 W603	K207-V598 HydrophobicContact CD-CG2 4.31Å; K207-V598 HydrophobicContact CG-CG2 3.87Å; Y568-V598 HydrophobicContact CE1-CG1 4.31Å; Y568-V598 WeakPolarHBondContact OH-CG1 3.35Å; Y568-V598 PolarHBondContact OH-N 2.83Å; V598-A600 PolarHBondContact O-N 3.34Å; V598-W602 HydrophobicContact CG1-CE3 3.68Å; V598-W602 HydrophobicContact CG1-CZ3 3.91Å; V598-W602 HydrophobicContact CG2-CE3 4.02Å; V598-W603 HydrophobicContact CG1-CB 4.37Å
599	D	90.8	Very high	91.5	Very high	89 Å²	89	60 Å²	60	48%	0.476	31%	0.308	S	S	.	.			trans	-43.6	136.5	169.7	169.2	48.3	0	0	0	112.7	E601 W602 W603	D599-E601 PolarHBondContact OD1-N 3.05Å; D599-E601 PolarHBondContact OD2-N 2.99Å; D599-W602 HydrophobicContact CB-CB 4.34Å; D599-W602 WeakPolarHBondContact OD2-CB 3.43Å; D599-W602 PolarHBondContact OD2-N 2.92Å; D599-W603 PolarHBondContact O-N 3.12Å
600	A	91.5	Very high	91.6	Very high	68 Å²	68	63 Å²	63	56%	0.562	32%	0.32	S	S	*	.	H	α-helix	trans	-75.1	-33.8	-174.7	0	0	0	0	0	112	V598 W603 A604	V598-A600 PolarHBondContact O-N 3.34Å; A600-W603 PolarHBondContact O-N 2.89Å; A600-A604 WeakPolarHBondContact O-CB 3.18Å; A600-A604 PolarHBondContact O-N 2.94Å
601	E	93.3	Very high	91.8	Very high	149 Å²	149	65.8 Å²	65.8	70%	0.696	33%	0.333	S	S	*	.	H	α-helix	trans	-67.2	-53.2	179	-56.8	-167.8	167.4	0	0	109.6	D599 W603 A604 E605	D599-E601 PolarHBondContact OD1-N 3.05Å; D599-E601 PolarHBondContact OD2-N 2.99Å; E601-W603 VanDerWaalsContact C-N 3.25Å; E601-W603 PolarHBondContact O-N 2.95Å; E601-A604 PolarHBondContact O-N 2.9Å; E601-E605 WeakPolarHBondContact O-CG 3.34Å; E601-E605 PolarHBondContact O-N 2.89Å
602	W	95.1	Very high	91.9	Very high	66 Å²	66	65.4 Å²	65.4	25%	0.25	33%	0.331	C	S	.	.	H	α-helix	trans	-53	-39.9	175.4	-178.6	83	0	0	0	113.2	K207 L210 L211 V598 D599 T606	K207-W602 HydrophobicContact CB-CH2 3.6Å; K207-W602 HydrophobicContact CB-CZ2 3.74Å; K207-W602 HydrophobicContact CB-CZ3 4.23Å; K207-W602 HydrophobicContact CD-CD2 4.17Å; K207-W602 HydrophobicContact CD-CH2 4.36Å; K207-W602 HydrophobicContact CD-CZ2 3.99Å; K207-W602 HydrophobicContact CG-CD2 4.3Å; K207-W602 HydrophobicContact CG-CE3 4.16Å; K207-W602 HydrophobicContact CG-CH2 3.69Å; K207-W602 HydrophobicContact CG-CZ2 3.82Å; K207-W602 HydrophobicContact CG-CZ3 3.86Å; L210-W602 HydrophobicContact CD2-CZ3 4.4Å; L211-W602 HydrophobicContact CD1-CH2 4.49Å; L211-W602 HydrophobicContact CD1-CZ2 4.29Å; L211-W602 HydrophobicContact CD2-CH2 4.41Å; L211-W602 HydrophobicContact CG-CH2 4.25Å; V598-W602 HydrophobicContact CG1-CE3 3.68Å; V598-W602 HydrophobicContact CG1-CZ3 3.91Å; V598-W602 HydrophobicContact CG2-CE3 4.02Å; D599-W602 HydrophobicContact CB-CB 4.34Å; D599-W602 WeakPolarHBondContact OD2-CB 3.43Å; D599-W602 PolarHBondContact OD2-N 2.92Å; W602-T606 VanDerWaalsContact O-CB 3.32Å; W602-T606 WeakPolarHBondContact O-CB 3.32Å; W602-T606 PolarHBondContact O-N 2.99Å; W602-T606 PolarHBondContact O-OG1 3.05Å
603	W	94.8	Very high	92	Very high	11 Å²	11	66 Å²	66	4%	0.042	34%	0.336	C	S	.	.	H	α-helix	trans	-69.6	-41.9	177	-174.7	-114.5	0	0	0	112.5	L210 L319 Y568 V570 D580 V598 D599 A600 E601 T606 L607	L210-W603 HydrophobicContact CD1-CH2 4.16Å; L210-W603 HydrophobicContact CD1-CZ3 4.37Å; L210-W603 HydrophobicContact CD2-CE3 3.69Å; L210-W603 HydrophobicContact CD2-CH2 3.85Å; L210-W603 HydrophobicContact CD2-CZ3 3.31Å; L210-W603 HydrophobicContact CG-CE3 4.46Å; L210-W603 HydrophobicContact CG-CH2 3.88Å; L210-W603 HydrophobicContact CG-CZ3 3.6Å; L319-W603 HydrophobicContact CD1-CH2 4.44Å; Y568-W603 HydrophobicContact CD1-CD2 4.42Å; Y568-W603 HydrophobicContact CD1-CH2 4.5Å; Y568-W603 HydrophobicContact CD1-CZ2 4.03Å; Y568-W603 HydrophobicContact CE1-CD2 4.42Å; V570-W603 HydrophobicContact CG1-CH2 4.45Å; V570-W603 HydrophobicContact CG1-CZ2 3.9Å; D580-W603 PolarHBondContact OD2-NE1 3.12Å; V598-W603 HydrophobicContact CG1-CB 4.37Å; D599-W603 PolarHBondContact O-N 3.12Å; A600-W603 PolarHBondContact O-N 2.89Å; E601-W603 VanDerWaalsContact C-N 3.25Å; E601-W603 PolarHBondContact O-N 2.95Å; W603-T606 HydrophobicContact CE3-CG2 4.39Å; W603-T606 HydrophobicContact CZ3-CG2 4.31Å; W603-T606 PolarHBondContact O-N 3.49Å; W603-L607 HydrophobicContact CD2-CD1 4.46Å; W603-L607 HydrophobicContact CH2-CD2 4.38Å; W603-L607 HydrophobicContact CZ2-CD1 3.97Å; W603-L607 HydrophobicContact CZ2-CD2 4.3Å; W603-L607 HydrophobicContact CZ2-CG 4.32Å; W603-L607 PolarHBondContact O-N 2.75Å; W603-L607 VanDerWaalsContact O-N 3.13Å
604	A	93.6	Very high	91.9	Very high	49 Å²	49	70.8 Å²	70.8	41%	0.405	36%	0.356	S	S	.	.	H	α-helix	trans	-64.1	-40.8	174.8	0	0	0	0	0	111.8	A600 E601 T606 L607 R608	A600-A604 WeakPolarHBondContact O-CB 3.18Å; A600-A604 PolarHBondContact O-N 2.94Å; E601-A604 PolarHBondContact O-N 2.9Å; A604-T606 VanDerWaalsContact C-N 3.35Å; A604-L607 PolarHBondContact O-N 2.94Å; A604-R608 PolarHBondContact O-N 2.91Å
605	E	95.1	Very high	91.9	Very high	102 Å²	102	68.9 Å²	68.9	48%	0.477	35%	0.354	S	S	.	.	H	α-helix	trans	-62.4	-40.7	174.2	-58.1	-133.2	114.5	0	0	112.1	E601 L607 R608	E601-E605 WeakPolarHBondContact O-CG 3.34Å; E601-E605 PolarHBondContact O-N 2.89Å; E605-L607 VanDerWaalsContact C-N 3.33Å; E605-L607 PolarHBondContact O-N 3.36Å; E605-R608 WeakPolarHBondContact O-CB 3.48Å; E605-R608 PolarHBondContact O-N 3.48Å; E605-R608 IonicContact OE1-CZ 2.77Å; E605-R608 VanDerWaalsContact OE1-CZ 3.3Å; E605-R608 IonicContact OE1-NH1 3.72Å; E605-R608 PolarHBondContact OE1-NH1 2.91Å; E605-R608 IonicContact OE1-NH2 3.83Å; E605-R608 PolarHBondContact OE1-NH2 3.41Å
606	T	94.8	Very high	92.1	Very high	26 Å²	26	70.3 Å²	70.3	16%	0.16	37%	0.365	C	S	.	.	H	α-helix	trans	-63.4	-37.6	178.6	-65.1	0	0	0	0	112.1	L211 W602 W603 A604 P609	L211-T606 HydrophobicContact CD2-CG2 3.53Å; W602-T606 VanDerWaalsContact O-CB 3.32Å; W602-T606 WeakPolarHBondContact O-CB 3.32Å; W602-T606 PolarHBondContact O-N 2.99Å; W602-T606 PolarHBondContact O-OG1 3.05Å; W603-T606 HydrophobicContact CE3-CG2 4.39Å; W603-T606 HydrophobicContact CZ3-CG2 4.31Å; W603-T606 PolarHBondContact O-N 3.49Å; A604-T606 VanDerWaalsContact C-N 3.35Å; T606-P609 WeakPolarHBondContact O-CD 3.25Å
607	L	94	Very high	92.2	Very high	12 Å²	12	70.8 Å²	70.8	6%	0.063	36%	0.36	C	S	.	.	H	α-helix	trans	-85.7	-19.9	178.3	-64.1	-177.1	0	0	0	113.7	L214 V578 D580 W603 A604 E605 P609 Y610 Q611	L214-L607 HydrophobicContact CD2-CD2 4.04Å; V578-L607 HydrophobicContact CB-CD2 4.43Å; V578-L607 HydrophobicContact CG1-CD2 3.87Å; D580-L607 HydrophobicContact CB-CD1 4.18Å; W603-L607 HydrophobicContact CD2-CD1 4.46Å; W603-L607 HydrophobicContact CH2-CD2 4.38Å; W603-L607 HydrophobicContact CZ2-CD1 3.97Å; W603-L607 HydrophobicContact CZ2-CD2 4.3Å; W603-L607 HydrophobicContact CZ2-CG 4.32Å; W603-L607 PolarHBondContact O-N 2.75Å; W603-L607 VanDerWaalsContact O-N 3.13Å; A604-L607 PolarHBondContact O-N 2.94Å; E605-L607 VanDerWaalsContact C-N 3.33Å; E605-L607 PolarHBondContact O-N 3.36Å; L607-P609 VanDerWaalsContact C-N 3.33Å; L607-P609 VanDerWaalsContact O-N 3.14Å; L607-Y610 PolarHBondContact O-N 3.26Å; L607-Q611 PolarHBondContact O-N 2.9Å
608	R	93.8	Very high	92.2	Very high	138 Å²	138	69.7 Å²	69.7	52%	0.521	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-45.9	-42.3	-178.4	-165.5	-175.5	-68.8	146.2	0.3	114.6	A604 E605 Y610 Q611	A604-R608 PolarHBondContact O-N 2.91Å; E605-R608 WeakPolarHBondContact O-CB 3.48Å; E605-R608 PolarHBondContact O-N 3.48Å; E605-R608 IonicContact OE1-CZ 2.77Å; E605-R608 VanDerWaalsContact OE1-CZ 3.3Å; E605-R608 IonicContact OE1-NH1 3.72Å; E605-R608 PolarHBondContact OE1-NH1 2.91Å; E605-R608 IonicContact OE1-NH2 3.83Å; E605-R608 PolarHBondContact OE1-NH2 3.41Å; R608-Y610 PolarHBondContact O-N 3.41Å; R608-Q611 PolarHBondContact O-N 3.02Å
609	P	93.5	Very high	92.2	Very high	96 Å²	96	74.3 Å²	74.3	62%	0.623	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-69	-11.4	179.3	-20	34.3	0	0	0	115.3	T606 L607	T606-P609 WeakPolarHBondContact O-CD 3.25Å; L607-P609 VanDerWaalsContact C-N 3.33Å; L607-P609 VanDerWaalsContact O-N 3.14Å
610	Y	93.3	Very high	92.4	Very high	93 Å²	93	74.3 Å²	74.3	37%	0.365	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-119.2	11.8	-174.6	-51.3	-80.9	0	0	0	112.7	F218 W577 V578 L607 R608	F218-Y610 AromaticContact CE1-CD1 3.82Å; F218-Y610 HydrophobicContact CE1-CD1 3.82Å; F218-Y610 HydrophobicContact CE1-CE1 4.06Å; F218-Y610 HydrophobicContact CE1-CG 4.32Å; F218-Y610 HydrophobicContact CE2-CD1 4.32Å; F218-Y610 AromaticContact CE2-CE1 3.95Å; F218-Y610 HydrophobicContact CE2-CE1 3.95Å; F218-Y610 HydrophobicContact CE2-CE2 4.17Å; F218-Y610 AromaticContact CE2-CZ 3.87Å; F218-Y610 AromaticContact CZ-CD1 3.42Å; F218-Y610 HydrophobicContact CZ-CD1 3.42Å; F218-Y610 VanDerWaalsContact CZ-CD1 3.42Å; F218-Y610 AromaticContact CZ-CD2 3.94Å; F218-Y610 HydrophobicContact CZ-CD2 3.94Å; F218-Y610 AromaticContact CZ-CE1 3.48Å; F218-Y610 HydrophobicContact CZ-CE1 3.48Å; F218-Y610 VanDerWaalsContact CZ-CE1 3.48Å; F218-Y610 HydrophobicContact CZ-CE2 4.01Å; F218-Y610 AromaticContact CZ-CG 3.65Å; F218-Y610 HydrophobicContact CZ-CG 3.65Å; F218-Y610 AromaticContact CZ-CZ 3.78Å; W577-Y610 CarbonylContact C-O 3.59Å; W577-Y610 VanDerWaalsContact CA-O 3.29Å; W577-Y610 WeakPolarHBondContact CA-O 3.35Å; V578-Y610 HydrophobicContact CG2-CG 4.47Å; V578-Y610 PolarHBondContact N-O 3.44Å; L607-Y610 PolarHBondContact O-N 3.26Å; R608-Y610 PolarHBondContact O-N 3.41Å
611	Q	91.8	Very high	92.5	Very high	83 Å²	83	71.3 Å²	71.3	39%	0.388	35%	0.345	S	S	.	.			trans	-64.6	146.5	176	-73.2	176.4	-18.3	0	0	111.4	W577 L607 R608	W577-Q611 WeakPolarHBondContact CZ3-O 3.37Å; L607-Q611 PolarHBondContact O-N 2.9Å; R608-Q611 PolarHBondContact O-N 3.02Å
612	S	90.6	Very high	92.5	Very high	10 Å²	10	66.7 Å²	66.7	7%	0.07	33%	0.325	C	S	.	.			trans	-69.8	141.4	-179.5	-169.1	0	0	0	0	111.1	F614 E618	S612-F614 PolarHBondContact O-N 3.29Å; S612-F614 PolarHBondContact OG-N 2.9Å; S612-E618 VanDerWaalsContact CB-OE1 3.24Å; S612-E618 WeakPolarHBondContact CB-OE1 3.44Å; S612-E618 PolarHBondContact N-OE1 3.33Å
613	P	90	Very high	92.4	Very high	80 Å²	80	68.7 Å²	68.7	52%	0.519	34%	0.34	S	S	.	.	S	Bend	trans	-65.3	-17	168.5	28	-35.1	0	0	0	112.5	W577 M615	W577-P613 HydrophobicContact CZ2-CG 3.98Å; P613-M615 VanDerWaalsContact C-N 3.31Å; P613-M615 PolarHBondContact O-N 3.08Å; P613-M615 VanDerWaalsContact O-N 3.08Å
614	F	87.3	Confident	92.4	Very high	113 Å²	113	71.1 Å²	71.1	50%	0.496	35%	0.352	S	S	.	.			trans	-86.6	63.5	-178	-60.7	-73	0	0	0	112.5	S612 D616 R617 E618	S612-F614 PolarHBondContact O-N 3.29Å; S612-F614 PolarHBondContact OG-N 2.9Å; F614-D616 PolarHBondContact O-N 2.78Å; F614-R617 HydrophobicContact CB-CB 4.41Å; F614-R617 PolarHBondContact O-N 2.92Å; F614-E618 PolarHBondContact O-N 2.78Å
615	M	88.3	Confident	92.3	Very high	92 Å²	92	68.9 Å²	68.9	45%	0.453	33%	0.333	S	S	.	.	H	α-helix	trans	-51.3	-33.6	-175.7	-61.9	-56.5	-59.7	0	0	114.3	P613 E618 K619	P613-M615 VanDerWaalsContact C-N 3.31Å; P613-M615 PolarHBondContact O-N 3.08Å; P613-M615 VanDerWaalsContact O-N 3.08Å; M615-E618 PolarHBondContact O-N 2.76Å; M615-K619 WeakPolarHBondContact O-CG 3.43Å; M615-K619 PolarHBondContact O-N 2.99Å
616	D	90.7	Very high	92.2	Very high	104 Å²	104	69.6 Å²	69.6	56%	0.556	34%	0.336	S	S	*	.	H	α-helix	trans	-73.5	-29.7	-177.8	-59.9	-38.1	0	0	0	113.1	F614 K619 K620	F614-D616 PolarHBondContact O-N 2.78Å; D616-K619 IonicContact OD1-NZ 3.13Å; D616-K619 PolarHBondContact OD1-NZ 3.28Å; D616-K620 WeakPolarHBondContact O-CG 3.36Å; D616-K620 PolarHBondContact O-N 2.65Å; D616-K620 VanDerWaalsContact O-N 3.13Å
617	R	90.6	Very high	92.2	Very high	57 Å²	57	70.8 Å²	70.8	22%	0.215	35%	0.349	C	S	.	.	H	α-helix	trans	-67.9	-40.6	170.5	-173.8	-174.9	-71.1	137	-2.8	110.3	L312 F535 F614 K620 E621	L312-R617 VanDerWaalsContact CD2-CZ 3.46Å; L312-R617 VanDerWaalsContact CD2-NH1 3.26Å; F535-R617 HydrophobicContact CD2-CG 4.37Å; F535-R617 HydrophobicContact CE2-CG 3.7Å; F535-R617 HydrophobicContact CZ-CG 4.05Å; F614-R617 HydrophobicContact CB-CB 4.41Å; F614-R617 PolarHBondContact O-N 2.92Å; R617-K620 PolarHBondContact O-N 3.18Å; R617-E621 WeakPolarHBondContact O-CB 3.21Å; R617-E621 PolarHBondContact O-N 2.84Å
618	E	91.2	Very high	92.1	Very high	9 Å²	9	72.7 Å²	72.7	4%	0.042	36%	0.357	C	S	.	.	H	α-helix	trans	-65	-41.4	176.6	-65	-160.1	156.1	0	0	112.3	R579 S612 F614 M615 K620 E621 D622	R579-E618 IonicContact CZ-OE2 2.64Å; R579-E618 IonicContact NH1-OE1 2.65Å; R579-E618 IonicContact NH1-OE2 3.64Å; R579-E618 PolarHBondContact NH1-OE2 2.8Å; S612-E618 VanDerWaalsContact CB-OE1 3.24Å; S612-E618 WeakPolarHBondContact CB-OE1 3.44Å; S612-E618 PolarHBondContact N-OE1 3.33Å; F614-E618 PolarHBondContact O-N 2.78Å; M615-E618 PolarHBondContact O-N 2.76Å; E618-K620 PolarHBondContact O-N 3.37Å; E618-E621 WeakPolarHBondContact O-CB 3.38Å; E618-E621 PolarHBondContact O-N 2.92Å; E618-D622 PolarHBondContact O-N 3.23Å
619	K	93.1	Very high	91.9	Very high	113 Å²	113	66.5 Å²	66.5	49%	0.491	33%	0.333	S	S	.	.	H	α-helix	trans	-60.8	-42.4	173.4	-69.4	168.7	-162.2	160.7	0	112.4	M615 D616 E621 D622 L623	M615-K619 WeakPolarHBondContact O-CG 3.43Å; M615-K619 PolarHBondContact O-N 2.99Å; D616-K619 IonicContact OD1-NZ 3.13Å; D616-K619 PolarHBondContact OD1-NZ 3.28Å; K619-E621 VanDerWaalsContact C-N 3.32Å; K619-D622 PolarHBondContact O-N 2.92Å; K619-L623 WeakPolarHBondContact O-CG 3.33Å; K619-L623 PolarHBondContact O-N 3.18Å
620	K	93.3	Very high	91.7	Very high	90 Å²	90	67.5 Å²	67.5	39%	0.391	33%	0.331	S	S	.	.	H	α-helix	trans	-62.9	-39.9	175.9	-72.3	179.9	-173.2	-168.9	0	111.5	E540 D616 R617 E618 L623 E624	E540-K620 IonicContact OE1-NZ 3.99Å; E540-K620 PolarHBondContact OE1-NZ 3.46Å; E540-K620 IonicContact OE2-NZ 2.72Å; E540-K620 PolarHBondContact OE2-NZ 2.95Å; D616-K620 WeakPolarHBondContact O-CG 3.36Å; D616-K620 PolarHBondContact O-N 2.65Å; D616-K620 VanDerWaalsContact O-N 3.13Å; R617-K620 PolarHBondContact O-N 3.18Å; E618-K620 PolarHBondContact O-N 3.37Å; K620-L623 PolarHBondContact O-N 2.86Å; K620-E624 PolarHBondContact O-N 2.77Å
621	E	94	Very high	91.6	Very high	4 Å²	4	69.7 Å²	69.7	2%	0.019	35%	0.349	C	S	.	.	H	α-helix	trans	-65.6	-37.5	174.3	177.8	158.6	-127.1	0	0	112.5	R314 W542 R584 R617 E618 K619 E624 F625	R314-E621 IonicContact CZ-OE1 2.77Å; R314-E621 IonicContact CZ-OE2 3.15Å; R314-E621 IonicContact NH1-OE1 3.84Å; R314-E621 PolarHBondContact NH1-OE1 2.91Å; R314-E621 IonicContact NH1-OE2 2.68Å; R314-E621 PolarHBondContact NH1-OE2 2.72Å; R314-E621 VanDerWaalsContact NH1-OE2 3.13Å; R314-E621 IonicContact NH2-OE1 2.81Å; R314-E621 IonicContact NH2-OE2 2.85Å; R314-E621 PolarHBondContact NH2-OE2 2.71Å; W542-E621 VanDerWaalsContact CD1-OE1 3.27Å; R584-E621 IonicContact CZ-OE1 3.4Å; R584-E621 VanDerWaalsContact CZ-OE1 3.25Å; R584-E621 IonicContact NH1-OE1 2.65Å; R584-E621 PolarHBondContact NH1-OE1 2.67Å; R584-E621 IonicContact NH2-OE1 3.31Å; R584-E621 PolarHBondContact NH2-OE1 3.21Å; R617-E621 WeakPolarHBondContact O-CB 3.21Å; R617-E621 PolarHBondContact O-N 2.84Å; E618-E621 WeakPolarHBondContact O-CB 3.38Å; E618-E621 PolarHBondContact O-N 2.92Å; K619-E621 VanDerWaalsContact C-N 3.32Å; E621-E624 WeakPolarHBondContact O-CB 3.14Å; E621-E624 PolarHBondContact O-N 2.77Å; E621-F625 HydrophobicContact CG-CD2 4.48Å; E621-F625 HydrophobicContact CG-CE1 4.03Å; E621-F625 HydrophobicContact CG-CE2 3.7Å; E621-F625 HydrophobicContact CG-CZ 3.42Å; E621-F625 VanDerWaalsContact CG-CZ 3.42Å; E621-F625 WeakPolarHBondContact O-CD1 3.18Å; E621-F625 WeakPolarHBondContact O-CD2 3.39Å; E621-F625 VanDerWaalsContact O-CG 3.25Å; E621-F625 WeakPolarHBondContact O-CG 3.14Å; E621-F625 PolarHBondContact O-N 3.11Å; E621-F625 VanDerWaalsContact O-N 3.09Å
622	D	93.8	Very high	91.5	Very high	53 Å²	53	68.2 Å²	68.2	28%	0.283	34%	0.342	S	S	.	.	H	α-helix	trans	-67.2	-37.6	172.6	-75.1	-34.1	0	0	0	113.1	R579 E618 K619 F625 Q626	R579-D622 IonicContact CZ-OD1 3.54Å; R579-D622 IonicContact CZ-OD2 3.06Å; R579-D622 IonicContact NH2-OD1 2.69Å; R579-D622 PolarHBondContact NH2-OD1 3.42Å; R579-D622 IonicContact NH2-OD2 3.09Å; R579-D622 PolarHBondContact NH2-OD2 3.44Å; E618-D622 PolarHBondContact O-N 3.23Å; K619-D622 PolarHBondContact O-N 2.92Å; D622-F625 PolarHBondContact O-N 2.78Å; D622-Q626 VanDerWaalsContact O-CG 3.28Å; D622-Q626 WeakPolarHBondContact O-CG 3.29Å; D622-Q626 PolarHBondContact O-N 3.23Å
623	L	94	Very high	91.5	Very high	108 Å²	108	73.4 Å²	73.4	57%	0.565	38%	0.376	S	S	*	.	H	α-helix	trans	-66.3	-38.4	174.1	-69.2	170.7	0	0	0	111.8	K619 K620 F625 Q626 A627	K619-L623 WeakPolarHBondContact O-CG 3.33Å; K619-L623 PolarHBondContact O-N 3.18Å; K620-L623 PolarHBondContact O-N 2.86Å; L623-F625 VanDerWaalsContact C-N 3.33Å; L623-F625 PolarHBondContact O-N 3.01Å; L623-Q626 PolarHBondContact O-N 3.14Å; L623-A627 WeakPolarHBondContact O-CB 3.36Å; L623-A627 PolarHBondContact O-N 2.87Å
624	E	92.8	Very high	91.6	Very high	61 Å²	61	72.4 Å²	72.4	29%	0.285	37%	0.366	S	S	.	.	H	α-helix	trans	-56.5	-47.1	171	-174.1	-156.7	141.5	0	0	110.7	R584 K620 E621 K628	R584-E624 IonicContact CZ-OE1 2.74Å; R584-E624 IonicContact CZ-OE2 3.5Å; R584-E624 IonicContact NE-OE1 3.77Å; R584-E624 PolarHBondContact NE-OE1 3.46Å; R584-E624 VanDerWaalsContact NE-OE1 3.09Å; R584-E624 IonicContact NE-OE2 3.21Å; R584-E624 IonicContact NH2-OE1 3.15Å; R584-E624 PolarHBondContact NH2-OE1 3.44Å; R584-E624 IonicContact NH2-OE2 3.81Å; R584-E624 PolarHBondContact NH2-OE2 2.93Å; K620-E624 PolarHBondContact O-N 2.77Å; E621-E624 WeakPolarHBondContact O-CB 3.14Å; E621-E624 PolarHBondContact O-N 2.77Å; E624-K628 WeakPolarHBondContact O-CB 3.46Å; E624-K628 PolarHBondContact O-N 3.39Å
625	F	93.4	Very high	91.7	Very high	2 Å²	2	67.9 Å²	67.9	1%	0.009	35%	0.348	C	S	.	.	H	α-helix	trans	-65.9	-45.4	179	-60.1	-18.4	0	0	0	111.9	Q583 R584 E621 D622 L623 K628 H629	Q583-F625 HydrophobicContact CB-CB 4.07Å; Q583-F625 HydrophobicContact CB-CD1 4.17Å; Q583-F625 HydrophobicContact CB-CD2 3.79Å; Q583-F625 HydrophobicContact CB-CE2 4.24Å; Q583-F625 HydrophobicContact CB-CG 3.74Å; Q583-F625 HydrophobicContact CG-CD2 4.29Å; R584-F625 HydrophobicContact CB-CE1 3.75Å; R584-F625 HydrophobicContact CB-CZ 4.3Å; R584-F625 HydrophobicContact CG-CE1 4.49Å; E621-F625 HydrophobicContact CG-CD2 4.48Å; E621-F625 HydrophobicContact CG-CE1 4.03Å; E621-F625 HydrophobicContact CG-CE2 3.7Å; E621-F625 HydrophobicContact CG-CZ 3.42Å; E621-F625 VanDerWaalsContact CG-CZ 3.42Å; E621-F625 WeakPolarHBondContact O-CD1 3.18Å; E621-F625 WeakPolarHBondContact O-CD2 3.39Å; E621-F625 VanDerWaalsContact O-CG 3.25Å; E621-F625 WeakPolarHBondContact O-CG 3.14Å; E621-F625 PolarHBondContact O-N 3.11Å; E621-F625 VanDerWaalsContact O-N 3.09Å; D622-F625 PolarHBondContact O-N 2.78Å; L623-F625 VanDerWaalsContact C-N 3.33Å; L623-F625 PolarHBondContact O-N 3.01Å; F625-K628 PolarHBondContact O-N 3.25Å; F625-H629 PolarHBondContact O-CD2 3.28Å; F625-H629 PolarHBondContact O-N 3.35Å
626	Q	92.8	Very high	91.8	Very high	117 Å²	117	69.4 Å²	69.4	55%	0.547	36%	0.362	S	S	.	.	H	α-helix	trans	-59.1	-49.1	177.7	-72.9	172.3	36.3	0	0	111.5	D622 L623 K628 H629 M630	D622-Q626 VanDerWaalsContact O-CG 3.28Å; D622-Q626 WeakPolarHBondContact O-CG 3.29Å; D622-Q626 PolarHBondContact O-N 3.23Å; L623-Q626 PolarHBondContact O-N 3.14Å; Q626-K628 PolarHBondContact O-N 3.02Å; Q626-H629 PolarHBondContact O-N 3.24Å; Q626-H629 VanDerWaalsContact O-N 3.12Å; Q626-M630 WeakPolarHBondContact O-CG 3.23Å; Q626-M630 PolarHBondContact O-N 3.33Å
627	A	93.3	Very high	91.8	Very high	51 Å²	51	66.2 Å²	66.2	42%	0.421	35%	0.351	S	S	.	.	H	α-helix	trans	-56.7	-50.6	176	0	0	0	0	0	111.4	L623 H629 M630 D631	L623-A627 WeakPolarHBondContact O-CB 3.36Å; L623-A627 PolarHBondContact O-N 2.87Å; A627-H629 PolarHBondContact O-N 3.33Å; A627-H629 VanDerWaalsContact O-N 3.14Å; A627-M630 PolarHBondContact O-N 3.41Å; A627-D631 PolarHBondContact O-N 2.81Å
628	K	91.7	Very high	91.9	Very high	53 Å²	53	64.6 Å²	64.6	23%	0.23	35%	0.346	C	S	.	.	H	α-helix	trans	-56.5	-32	176.9	-174.7	-165.1	165.9	-162.5	0	113.2	Q583 R584 E624 F625 Q626 Q632	Q583-K628 PolarHBondContact O-NZ 3Å; R584-K628 VanDerWaalsContact C-NZ 3.26Å; R584-K628 PolarHBondContact O-NZ 2.78Å; E624-K628 WeakPolarHBondContact O-CB 3.46Å; E624-K628 PolarHBondContact O-N 3.39Å; F625-K628 PolarHBondContact O-N 3.25Å; Q626-K628 PolarHBondContact O-N 3.02Å; K628-Q632 WeakPolarHBondContact O-CG 3.49Å; K628-Q632 PolarHBondContact O-NE2 2.92Å
629	H	90.4	Very high	91.9	Very high	7 Å²	7	66.8 Å²	66.8	3%	0.032	37%	0.371	C	S	.	.	H	α-helix	trans	-82.3	-29.3	177.7	-70	-54.1	0	0	0	113.5	W589 M590 F625 Q626 A627 Q632 L646	W589-H629 WeakPolarHBondContact CB-NE2 3.46Å; W589-H629 AromaticContact CD1-NE2 3.32Å; W589-H629 VanDerWaalsContact CD1-NE2 3.32Å; W589-H629 AromaticContact CG-NE2 3.53Å; M590-H629 HydrophobicContact CE-CB 3.73Å; M590-H629 VanDerWaalsContact CE-CD2 3.43Å; M590-H629 WeakPolarHBondContact CE-CD2 3.46Å; M590-H629 VanDerWaalsContact CE-CG 3.4Å; F625-H629 PolarHBondContact O-CD2 3.28Å; F625-H629 PolarHBondContact O-N 3.35Å; Q626-H629 PolarHBondContact O-N 3.24Å; Q626-H629 VanDerWaalsContact O-N 3.12Å; A627-H629 PolarHBondContact O-N 3.33Å; A627-H629 VanDerWaalsContact O-N 3.14Å; H629-Q632 PolarHBondContact CE1-NE2 3.47Å; H629-Q632 PolarHBondContact CE1-OE1 3.14Å; H629-Q632 PolarHBondContact ND1-NE2 3.39Å; H629-Q632 VanDerWaalsContact ND1-NE2 3.12Å; H629-L646 HydrophobicContact CB-CD1 4.46Å
630	M	90.4	Very high	91.7	Very high	118 Å²	118	64.1 Å²	64.1	58%	0.581	36%	0.362	S	S	*	.	H	α-helix	trans	-75	-32.8	173.1	-65.7	-60.9	-73.8	0	0	112.2	Q626 A627 Q632 L646	Q626-M630 WeakPolarHBondContact O-CG 3.23Å; Q626-M630 PolarHBondContact O-N 3.33Å; A627-M630 PolarHBondContact O-N 3.41Å; M630-Q632 PolarHBondContact O-N 3.16Å; M630-L646 HydrophobicContact SD-CD1 3.99Å
631	D	91.2	Very high	91.7	Very high	138 Å²	138	60 Å²	60	74%	0.738	34%	0.344	S	S	*	.	S	Bend	trans	-72.6	-10	174.8	-70	-21.4	0	0	0	113.6	A627	A627-D631 PolarHBondContact O-N 2.81Å
632	Q	88.9	Confident	91.5	Very high	52 Å²	52	64.4 Å²	64.4	24%	0.243	36%	0.363	C	S	.	.	S	Bend	trans	-72	139	179.3	-84.8	163.8	48.5	0	0	111.9	K628 H629 M630	K628-Q632 WeakPolarHBondContact O-CG 3.49Å; K628-Q632 PolarHBondContact O-NE2 2.92Å; H629-Q632 PolarHBondContact CE1-NE2 3.47Å; H629-Q632 PolarHBondContact CE1-OE1 3.14Å; H629-Q632 PolarHBondContact ND1-NE2 3.39Å; H629-Q632 VanDerWaalsContact ND1-NE2 3.12Å; M630-Q632 PolarHBondContact O-N 3.16Å
633	P	90.9	Very high	91.3	Very high	119 Å²	119	67 Å²	67	77%	0.773	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-65.2	140.2	178.5	27.9	-34.9	0	0	0	111.3
634	L	90.9	Very high	91.2	Very high	60 Å²	60	62.2 Å²	62.2	31%	0.314	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-51.3	132.8	177.8	-68.2	175.1	0	0	0	111.5	T636 Y647	L634-T636 PolarHBondContact O-N 2.9Å; L634-Y647 HydrophobicContact CD2-CD1 4.41Å; L634-Y647 HydrophobicContact CD2-CD2 4.13Å; L634-Y647 HydrophobicContact CD2-CE1 3.98Å; L634-Y647 HydrophobicContact CD2-CE2 3.66Å
635	P	90.7	Very high	91.2	Very high	18 Å²	18	61.2 Å²	61.2	12%	0.117	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-55	131.2	-177.4	-26.3	31.8	0	0	0	113.7	T591 L640 Y641	T591-P635 HydrophobicContact CG2-CG 4.36Å; P635-L640 HydrophobicContact CB-CB 3.85Å; P635-L640 HydrophobicContact CB-CD1 4Å; P635-Y641 HydrophobicContact CB-CD2 4.28Å; P635-Y641 HydrophobicContact CB-CE2 3.73Å; P635-Y641 WeakPolarHBondContact CD-OH 3.36Å; P635-Y641 HydrophobicContact CG-CE1 4.3Å; P635-Y641 HydrophobicContact CG-CE2 4.37Å; P635-Y641 WeakPolarHBondContact O-CE2 3.38Å; P635-Y641 VanDerWaalsContact O-CZ 3.28Å; P635-Y641 PolarHBondContact O-OH 2.87Å
636	T	89.2	Confident	91.1	Very high	123 Å²	123	63.2 Å²	63.2	76%	0.755	36%	0.361	S	S	*	.	S	Bend	trans	-82.4	-16.1	-176.8	-32.2	0	0	0	0	113.5	L634	L634-T636 PolarHBondContact O-N 2.9Å
637	A	91.5	Very high	91.2	Very high	38 Å²	38	58.7 Å²	58.7	31%	0.314	34%	0.339	S	S	.	.	S	Bend	trans	-111.8	125.1	-177.7	0	0	0	0	0	110.9	G639 L640	A637-G639 VanDerWaalsContact C-N 3.27Å; A637-G639 PolarHBondContact O-N 3.12Å; A637-L640 HydrophobicContact CB-CD1 4.01Å; A637-L640 HydrophobicContact CB-CG 4.14Å; A637-L640 WeakPolarHBondContact O-CB 3.38Å; A637-L640 PolarHBondContact O-N 3.15Å
638	I	92.4	Very high	91.2	Very high	22 Å²	22	56.5 Å²	56.5	11%	0.113	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-53.2	-42.4	-175.2	-61.1	-179	0	0	0	112.3	L640 Y641 L649 H652 R671	I638-L640 PolarHBondContact O-N 3.49Å; I638-Y641 WeakPolarHBondContact O-CB 3.25Å; I638-Y641 PolarHBondContact O-N 2.81Å; I638-L649 HydrophobicContact CG2-CD1 3.87Å; I638-H652 PolarHBondContact O-CE1 3.27Å; I638-R671 HydrophobicContact CD1-CB 4.22Å; I638-R671 HydrophobicContact CD1-CG 4.4Å; I638-R671 HydrophobicContact CG1-CG 4.41Å
639	G	90.6	Very high	91.4	Very high	56 Å²	56	54 Å²	54	58%	0.577	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-59.8	-20.1	-178.8	0	0	0	0	0	115.1	A637 Y641 K642	A637-G639 VanDerWaalsContact C-N 3.27Å; A637-G639 PolarHBondContact O-N 3.12Å; G639-Y641 VanDerWaalsContact C-N 3.33Å; G639-K642 PolarHBondContact O-N 3.32Å
640	L	90.3	Very high	91.5	Very high	56 Å²	56	59.4 Å²	59.4	29%	0.293	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-73.4	-25.9	176.4	-58.1	175.7	0	0	0	112.2	T591 V592 P635 A637 I638 K642	T591-L640 HydrophobicContact CG2-CB 3.98Å; V592-L640 HydrophobicContact CG2-CD2 4.39Å; P635-L640 HydrophobicContact CB-CB 3.85Å; P635-L640 HydrophobicContact CB-CD1 4Å; A637-L640 HydrophobicContact CB-CD1 4.01Å; A637-L640 HydrophobicContact CB-CG 4.14Å; A637-L640 WeakPolarHBondContact O-CB 3.38Å; A637-L640 PolarHBondContact O-N 3.15Å; I638-L640 PolarHBondContact O-N 3.49Å; L640-K642 VanDerWaalsContact C-N 3.3Å; L640-K642 PolarHBondContact O-N 2.97Å
641	Y	92.1	Very high	91.6	Very high	4 Å²	4	60.1 Å²	60.1	2%	0.016	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-77.3	-8.6	174.7	-64.5	-91.2	0	0	0	113.8	P635 I638 G639 N643 H644 Y647 L649 H652 C670 V675	P635-Y641 HydrophobicContact CB-CD2 4.28Å; P635-Y641 HydrophobicContact CB-CE2 3.73Å; P635-Y641 WeakPolarHBondContact CD-OH 3.36Å; P635-Y641 HydrophobicContact CG-CE1 4.3Å; P635-Y641 HydrophobicContact CG-CE2 4.37Å; P635-Y641 WeakPolarHBondContact O-CE2 3.38Å; P635-Y641 VanDerWaalsContact O-CZ 3.28Å; P635-Y641 PolarHBondContact O-OH 2.87Å; I638-Y641 WeakPolarHBondContact O-CB 3.25Å; I638-Y641 PolarHBondContact O-N 2.81Å; G639-Y641 VanDerWaalsContact C-N 3.33Å; Y641-N643 PolarHBondContact O-N 2.63Å; Y641-H644 PolarHBondContact O-N 2.74Å; Y641-Y647 HydrophobicContact CE1-CD2 4.33Å; Y641-Y647 HydrophobicContact CE1-CG 4.46Å; Y641-L649 HydrophobicContact CD1-CD1 4.45Å; Y641-L649 HydrophobicContact CD1-CG 4.17Å; Y641-L649 HydrophobicContact CD2-CD1 3.76Å; Y641-L649 HydrophobicContact CD2-CG 4.35Å; Y641-L649 HydrophobicContact CE2-CD1 4.48Å; Y641-L649 HydrophobicContact CG-CD1 3.74Å; Y641-L649 HydrophobicContact CG-CG 3.91Å; Y641-H652 PolarHBondContact O-ND1 3.08Å; Y641-C670 HydrophobicContact CE2-CB 3.76Å; Y641-V675 HydrophobicContact CD1-CG1 4.38Å; Y641-V675 HydrophobicContact CE1-CB 4.48Å; Y641-V675 HydrophobicContact CE1-CG1 3.74Å; Y641-V675 HydrophobicContact CE1-CG2 3.83Å
642	K	90.7	Very high	91.7	Very high	97 Å²	97	55.9 Å²	55.9	42%	0.422	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	115.8	174.8	-173.8	173.1	-179.2	177.1	0	108	K595 G639 L640 H644	K595-K642 VanDerWaalsContact CE-O 3.25Å; K595-K642 WeakPolarHBondContact CE-O 3.28Å; K595-K642 PolarHBondContact NZ-O 2.99Å; G639-K642 PolarHBondContact O-N 3.32Å; L640-K642 VanDerWaalsContact C-N 3.3Å; L640-K642 PolarHBondContact O-N 2.97Å; K642-H644 VanDerWaalsContact C-N 3.3Å; K642-H644 PolarHBondContact O-N 2.9Å
643	N	88.4	Confident	91.9	Very high	106 Å²	106	55.3 Å²	55.3	57%	0.567	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	38.4	-177.6	-51.6	18.4	0	0	0	113	Y641	Y641-N643 PolarHBondContact O-N 2.63Å
644	H	92.3	Very high	92.1	Very high	8 Å²	8	52.9 Å²	52.9	4%	0.037	28%	0.284	C	S	.	.			trans	-75.9	137.9	172.9	-170	-92.2	0	0	0	110.2	M590 Y641 K642 L646 Y647	M590-H644 WeakPolarHBondContact CB-NE2 3.44Å; M590-H644 PolarHBondContact O-CD2 3.1Å; M590-H644 VanDerWaalsContact O-CD2 3.28Å; Y641-H644 PolarHBondContact O-N 2.74Å; K642-H644 VanDerWaalsContact C-N 3.3Å; K642-H644 PolarHBondContact O-N 2.9Å; H644-L646 PolarHBondContact ND1-N 3.33Å; H644-Y647 AromaticContact CE1-CD2 3.21Å; H644-Y647 WeakPolarHBondContact CE1-CD2 3.35Å; H644-Y647 AromaticContact CE1-CE2 3.69Å; H644-Y647 AromaticContact CE1-CG 3.98Å; H644-Y647 AromaticContact ND1-CD2 3.4Å; H644-Y647 WeakPolarHBondContact ND1-CD2 3.49Å; H644-Y647 AromaticContact ND1-CG 3.74Å; H644-Y647 PolarHBondContact ND1-N 3.33Å
645	P	92.1	Very high	92.1	Very high	40 Å²	40	53.3 Å²	53.3	26%	0.26	28%	0.283	S	S	.	.	S	Bend	trans	-69.7	-37.3	-173.6	24.7	-32.3	0	0	0	113.6	M590 R678	M590-P645 HydrophobicContact CB-CG 4.29Å; M590-P645 HydrophobicContact CG-CG 4.4Å; M590-P645 VanDerWaalsContact O-CD 3.31Å; M590-P645 WeakPolarHBondContact O-CD 3.4Å; M590-P645 HydrophobicContact SD-CB 4.45Å; M590-P645 HydrophobicContact SD-CG 3.32Å; M590-P645 WeakPolarHBondContact SD-CG 3.22Å; P645-R678 WeakPolarHBondContact O-CB 3.29Å; P645-R678 WeakPolarHBondContact O-CG 3.31Å
646	L	92.6	Very high	92.3	Very high	44 Å²	44	56 Å²	56	23%	0.23	29%	0.292	C	S	.	.	S	Bend	trans	-96.7	-18.3	-175.6	-59.1	175.6	0	0	0	114.7	M590 H629 M630 H644 S677 R678	M590-L646 HydrophobicContact CE-CD1 4.34Å; H629-L646 HydrophobicContact CB-CD1 4.46Å; M630-L646 HydrophobicContact SD-CD1 3.99Å; H644-L646 PolarHBondContact ND1-N 3.33Å; L646-S677 PolarHBondContact O-OG 3.33Å; L646-R678 PolarHBondContact O-N 3.17Å
647	Y	94.1	Very high	92.5	Very high	22 Å²	22	50.7 Å²	50.7	9%	0.086	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.4	-165.7	-56.3	-45.7	0	0	0	111.9	L634 Y641 H644 L667 V675 Y676	L634-Y647 HydrophobicContact CD2-CD1 4.41Å; L634-Y647 HydrophobicContact CD2-CD2 4.13Å; L634-Y647 HydrophobicContact CD2-CE1 3.98Å; L634-Y647 HydrophobicContact CD2-CE2 3.66Å; Y641-Y647 HydrophobicContact CE1-CD2 4.33Å; Y641-Y647 HydrophobicContact CE1-CG 4.46Å; H644-Y647 AromaticContact CE1-CD2 3.21Å; H644-Y647 WeakPolarHBondContact CE1-CD2 3.35Å; H644-Y647 AromaticContact CE1-CE2 3.69Å; H644-Y647 AromaticContact CE1-CG 3.98Å; H644-Y647 AromaticContact ND1-CD2 3.4Å; H644-Y647 WeakPolarHBondContact ND1-CD2 3.49Å; H644-Y647 AromaticContact ND1-CG 3.74Å; H644-Y647 PolarHBondContact ND1-N 3.33Å; Y647-L667 HydrophobicContact CD1-CD1 3.81Å; Y647-L667 HydrophobicContact CE1-CD1 3.83Å; Y647-V675 HydrophobicContact CD1-CG1 4.3Å; Y647-V675 HydrophobicContact CG-CG1 4.18Å; Y647-Y676 WeakPolarHBondContact CA-O 3.21Å
648	A	94.8	Very high	92.7	Very high	5 Å²	5	49.5 Å²	49.5	4%	0.041	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	146.8	176.6	0	0	0	0	0	112	Y676 V681	A648-Y676 PolarHBondContact N-O 3.14Å; A648-Y676 PolarHBondContact O-N 2.75Å; A648-V681 HydrophobicContact CB-CG2 3.44Å; A648-V681 VanDerWaalsContact CB-CG2 3.44Å
649	L	94.7	Very high	92.8	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	141.1	168	-70.2	176.3	0	0	0	108.9	I638 Y641 R651 H652 E673 A674 V675	I638-L649 HydrophobicContact CG2-CD1 3.87Å; Y641-L649 HydrophobicContact CD1-CD1 4.45Å; Y641-L649 HydrophobicContact CD1-CG 4.17Å; Y641-L649 HydrophobicContact CD2-CD1 3.76Å; Y641-L649 HydrophobicContact CD2-CG 4.35Å; Y641-L649 HydrophobicContact CE2-CD1 4.48Å; Y641-L649 HydrophobicContact CG-CD1 3.74Å; Y641-L649 HydrophobicContact CG-CG 3.91Å; L649-R651 HydrophobicContact CB-CG 3.88Å; L649-R651 HydrophobicContact CD1-CG 4.4Å; L649-R651 PolarHBondContact O-N 3.46Å; L649-H652 PolarHBondContact O-N 2.99Å; L649-E673 HydrophobicContact CD2-CB 4.15Å; L649-A674 WeakPolarHBondContact CD2-O 3.46Å; L649-V675 HydrophobicContact CD2-CB 4.48Å; L649-V675 HydrophobicContact CD2-CG2 3.84Å
650	K	93.3	Very high	92.9	Very high	121 Å²	121	50.2 Å²	50.2	53%	0.526	23%	0.234	S	C	.	.	G	3₁₀ helix	trans	-52.4	-32	178.5	-82.2	175.1	169.4	170.3	0	113.7	H652 L653 I659 Y676	K650-H652 VanDerWaalsContact C-N 3.31Å; K650-H652 PolarHBondContact O-N 3.1Å; K650-L653 HydrophobicContact CG-CD1 4.29Å; K650-I659 HydrophobicContact CD-CD1 4.4Å; K650-I659 HydrophobicContact CG-CD1 3.6Å; K650-Y676 HydrophobicContact CD-CE2 3.8Å; K650-Y676 WeakPolarHBondContact CE-OH 3.35Å; K650-Y676 HydrophobicContact CG-CD2 4.4Å; K650-Y676 HydrophobicContact CG-CE2 3.9Å; K650-Y676 PolarHBondContact NZ-OH 3.4Å
651	R	92.5	Very high	93.1	Very high	133 Å²	133	50.2 Å²	50.2	50%	0.502	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-70.1	-17.6	176.8	65.4	158.3	68	-158	-1.2	115.8	L649 E673	L649-R651 HydrophobicContact CB-CG 3.88Å; L649-R651 HydrophobicContact CD1-CG 4.4Å; L649-R651 PolarHBondContact O-N 3.46Å; R651-E673 WeakPolarHBondContact CD-OE2 3.47Å; R651-E673 VanDerWaalsContact CG-OE2 3.31Å; R651-E673 WeakPolarHBondContact CG-OE2 3.39Å; R651-E673 IonicContact CZ-OE1 2.71Å; R651-E673 IonicContact CZ-OE2 3.92Å; R651-E673 IonicContact NE-OE1 2.64Å; R651-E673 PolarHBondContact NE-OE1 2.9Å; R651-E673 IonicContact NE-OE2 3.74Å; R651-E673 PolarHBondContact NE-OE2 3.31Å; R651-E673 IonicContact NH2-OE1 2.7Å; R651-E673 PolarHBondContact NH2-OE1 3.08Å; R651-E673 IonicContact NH2-OE2 3.91Å
652	H	93.4	Very high	92.8	Very high	50 Å²	50	57.1 Å²	57.1	23%	0.231	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-107.5	0.8	-176.8	-61.7	154	0	0	0	112.6	I638 Y641 L649 K650 L654	I638-H652 PolarHBondContact O-CE1 3.27Å; Y641-H652 PolarHBondContact O-ND1 3.08Å; L649-H652 PolarHBondContact O-N 2.99Å; K650-H652 VanDerWaalsContact C-N 3.31Å; K650-H652 PolarHBondContact O-N 3.1Å; H652-L654 PolarHBondContact O-N 2.89Å
653	L	93.4	Very high	92.8	Very high	40 Å²	40	58.6 Å²	58.6	21%	0.209	29%	0.286	C	S	.	.			trans	-65.5	130	173.6	-60.6	174.3	0	0	0	109.2	K650 E657 I659 V681	K650-L653 HydrophobicContact CG-CD1 4.29Å; L653-E657 WeakPolarHBondContact CA-OE2 3.24Å; L653-E657 HydrophobicContact CB-CB 4.27Å; L653-E657 HydrophobicContact CD2-CB 4.46Å; L653-I659 HydrophobicContact CD1-CD1 3.86Å; L653-I659 HydrophobicContact CD1-CG1 3.91Å; L653-I659 HydrophobicContact CD2-CG1 4.19Å; L653-V681 HydrophobicContact CD2-CB 4.32Å; L653-V681 HydrophobicContact CD2-CG1 3.58Å; L653-V681 HydrophobicContact CD2-CG2 3.69Å
654	L	93.2	Very high	92.9	Very high	67 Å²	67	54 Å²	54	35%	0.351	26%	0.264	S	S	.	.			trans	-67	167	178.3	-62.4	167.6	0	0	0	111.7	H652 Y656 E657 K705	H652-L654 PolarHBondContact O-N 2.89Å; L654-Y656 PolarHBondContact O-N 2.91Å; L654-Y656 VanDerWaalsContact O-N 3.09Å; L654-E657 HydrophobicContact CB-CB 4.32Å; L654-E657 HydrophobicContact CB-CG 3.96Å; L654-E657 HydrophobicContact CD1-CG 4.45Å; L654-E657 PolarHBondContact N-OE2 2.97Å; L654-E657 VanDerWaalsContact N-OE2 3.11Å; L654-E657 PolarHBondContact O-N 3.39Å; L654-K705 PolarHBondContact O-NZ 3.32Å
655	K	91.5	Very high	93	Very high	70 Å²	70	57.2 Å²	57.2	30%	0.304	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.2	-39.4	178.9	-177.5	-178.3	174.8	-162.1	0	112	K705 V707 K708	K655-K705 WeakPolarHBondContact O-CE 3.19Å; K655-K705 PolarHBondContact O-NZ 3.2Å; K655-V707 HydrophobicContact CD-CG1 4.13Å; K655-V707 HydrophobicContact CG-CG1 3.78Å; K655-K708 PolarHBondContact NZ-O 3.46Å
656	Y	94.5	Very high	93	Very high	75 Å²	75	59 Å²	59	29%	0.294	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	7	-178	-59.5	-76.8	0	0	0	114	L654 L684 L732	L654-Y656 PolarHBondContact O-N 2.91Å; L654-Y656 VanDerWaalsContact O-N 3.09Å; Y656-L684 WeakPolarHBondContact O-CB 3.39Å; Y656-L684 PolarHBondContact O-N 3.16Å; Y656-L732 HydrophobicContact CD1-CD1 3.55Å; Y656-L732 HydrophobicContact CD1-CD2 3.8Å; Y656-L732 HydrophobicContact CD1-CG 4.34Å; Y656-L732 HydrophobicContact CE1-CD1 4.12Å; Y656-L732 HydrophobicContact CE1-CD2 3.96Å; Y656-L732 HydrophobicContact CG-CD1 4.5Å
657	E	94.9	Very high	93	Very high	10 Å²	10	61.1 Å²	61.1	5%	0.047	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	154.2	174.1	-72.9	-179	160.9	0	0	112.2	L653 L654 R678 V681 H682 T683 K705	L653-E657 WeakPolarHBondContact CA-OE2 3.24Å; L653-E657 HydrophobicContact CB-CB 4.27Å; L653-E657 HydrophobicContact CD2-CB 4.46Å; L654-E657 HydrophobicContact CB-CB 4.32Å; L654-E657 HydrophobicContact CB-CG 3.96Å; L654-E657 HydrophobicContact CD1-CG 4.45Å; L654-E657 PolarHBondContact N-OE2 2.97Å; L654-E657 VanDerWaalsContact N-OE2 3.11Å; L654-E657 PolarHBondContact O-N 3.39Å; E657-R678 IonicContact OE1-CZ 3.46Å; E657-R678 VanDerWaalsContact OE1-CZ 3.31Å; E657-R678 IonicContact OE1-NH1 3.03Å; E657-R678 PolarHBondContact OE1-NH1 3.4Å; E657-R678 VanDerWaalsContact OE1-NH1 3.09Å; E657-R678 IonicContact OE1-NH2 2.75Å; E657-R678 PolarHBondContact OE1-NH2 3.02Å; E657-R678 IonicContact OE2-NH1 2.68Å; E657-R678 PolarHBondContact OE2-NH1 2.99Å; E657-R678 IonicContact OE2-NH2 2.78Å; E657-V681 HydrophobicContact CB-CG1 3.94Å; E657-V681 HydrophobicContact CG-CG1 4.05Å; E657-H682 WeakPolarHBondContact CA-O 3.26Å; E657-T683 HydrophobicContact CG-CG2 4.32Å; E657-K705 PolarHBondContact O-NZ 2.84Å
658	A	94.4	Very high	92.9	Very high	13 Å²	13	60.8 Å²	60.8	11%	0.107	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	164.2	162.8	0	0	0	0	0	111.3	V681 H682 L684 Y704	A658-V681 WeakPolarHBondContact O-CA 3.3Å; A658-H682 PolarHBondContact N-O 3.33Å; A658-H682 PolarHBondContact O-N 3.19Å; A658-L684 HydrophobicContact CB-CD1 3.74Å; A658-L684 HydrophobicContact CB-CD2 4.49Å; A658-L684 HydrophobicContact CB-CG 4.25Å; A658-Y704 HydrophobicContact CB-CD1 4.03Å; A658-Y704 HydrophobicContact CB-CE1 3.62Å
659	I	95.2	Very high	92.9	Very high	13 Å²	13	68 Å²	68	7%	0.067	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	128.2	172.6	-66.1	157.7	0	0	0	108.1	K650 L653 A664 Y676 C680 V681 Y704	K650-I659 HydrophobicContact CD-CD1 4.4Å; K650-I659 HydrophobicContact CG-CD1 3.6Å; L653-I659 HydrophobicContact CD1-CD1 3.86Å; L653-I659 HydrophobicContact CD1-CG1 3.91Å; L653-I659 HydrophobicContact CD2-CG1 4.19Å; I659-A664 HydrophobicContact CG2-CB 3.67Å; I659-Y676 HydrophobicContact CD1-CD1 4.3Å; I659-Y676 HydrophobicContact CD1-CD2 3.47Å; I659-Y676 VanDerWaalsContact CD1-CD2 3.47Å; I659-Y676 HydrophobicContact CD1-CE2 3.89Å; I659-Y676 HydrophobicContact CD1-CG 3.7Å; I659-Y676 HydrophobicContact CG2-CD1 4.22Å; I659-Y676 HydrophobicContact CG2-CG 4.49Å; I659-C680 CarbonylContact C-O 3.59Å; I659-C680 VanDerWaalsContact CA-O 3.24Å; I659-C680 WeakPolarHBondContact CA-O 3.29Å; I659-C680 HydrophobicContact CG2-CB 4.05Å; I659-V681 HydrophobicContact CG1-CG2 4.06Å; I659-Y704 PolarHBondContact O-OH 3.46Å
660	Y	93.1	Very high	92.7	Very high	81 Å²	81	68.3 Å²	68.3	32%	0.318	34%	0.341	S	S	.	.	S	Bend	trans	-134.1	142	173.5	172.8	-90.6	0	0	0	110.2	C680 Y704 W736	Y660-C680 PolarHBondContact N-O 3.48Å; Y660-Y704 HydrophobicContact CD2-CE2 4.25Å; Y660-W736 AromaticContact CD1-CD2 3.81Å; Y660-W736 HydrophobicContact CD1-CD2 3.81Å; Y660-W736 AromaticContact CD1-CE3 3.57Å; Y660-W736 HydrophobicContact CD1-CE3 3.57Å; Y660-W736 HydrophobicContact CD1-CG 4.49Å; Y660-W736 HydrophobicContact CD1-CH2 4.12Å; Y660-W736 HydrophobicContact CD1-CZ2 4.33Å; Y660-W736 AromaticContact CD1-CZ3 3.74Å; Y660-W736 HydrophobicContact CD1-CZ3 3.74Å; Y660-W736 AromaticContact CD2-CD2 3.83Å; Y660-W736 HydrophobicContact CD2-CD2 3.83Å; Y660-W736 AromaticContact CD2-CE2 3.32Å; Y660-W736 HydrophobicContact CD2-CE3 4.24Å; Y660-W736 HydrophobicContact CD2-CG 4.48Å; Y660-W736 AromaticContact CD2-CH2 3.8Å; Y660-W736 HydrophobicContact CD2-CH2 3.8Å; Y660-W736 AromaticContact CD2-CZ2 3.32Å; Y660-W736 HydrophobicContact CD2-CZ2 3.32Å; Y660-W736 HydrophobicContact CD2-CZ3 4.22Å; Y660-W736 AromaticContact CD2-NE1 3.69Å; Y660-W736 HydrophobicContact CE1-CB 4.33Å; Y660-W736 AromaticContact CE1-CD2 3.71Å; Y660-W736 HydrophobicContact CE1-CD2 3.71Å; Y660-W736 AromaticContact CE1-CE3 3.83Å; Y660-W736 HydrophobicContact CE1-CE3 3.83Å; Y660-W736 AromaticContact CE1-CG 3.92Å; Y660-W736 HydrophobicContact CE1-CG 3.92Å; Y660-W736 HydrophobicContact CE1-CZ3 4.45Å; Y660-W736 AromaticContact CE2-CD1 3.66Å; Y660-W736 AromaticContact CE2-CD2 3.74Å; Y660-W736 HydrophobicContact CE2-CD2 3.74Å; Y660-W736 AromaticContact CE2-CE2 3.42Å; Y660-W736 VanDerWaalsContact CE2-CE2 3.42Å; Y660-W736 HydrophobicContact CE2-CE3 4.47Å; Y660-W736 AromaticContact CE2-CG 3.91Å; Y660-W736 HydrophobicContact CE2-CG 3.91Å; Y660-W736 AromaticContact CE2-CZ2 3.94Å; Y660-W736 HydrophobicContact CE2-CZ2 3.94Å; Y660-W736 AromaticContact CE2-NE1 3.33Å; Y660-W736 VanDerWaalsContact CE2-NE1 3.33Å; Y660-W736 AromaticContact CG-CD2 3.87Å; Y660-W736 HydrophobicContact CG-CD2 3.87Å; Y660-W736 AromaticContact CG-CE2 3.72Å; Y660-W736 AromaticContact CG-CE3 3.79Å; Y660-W736 HydrophobicContact CG-CE3 3.79Å; Y660-W736 AromaticContact CG-CH2 3.48Å; Y660-W736 HydrophobicContact CG-CH2 3.48Å; Y660-W736 VanDerWaalsContact CG-CH2 3.48Å; Y660-W736 AromaticContact CG-CZ2 3.55Å; Y660-W736 HydrophobicContact CG-CZ2 3.55Å; Y660-W736 AromaticContact CG-CZ3 3.6Å; Y660-W736 HydrophobicContact CG-CZ3 3.6Å; Y660-W736 AromaticContact CZ-CD1 3.69Å; Y660-W736 AromaticContact CZ-CD2 3.67Å; Y660-W736 AromaticContact CZ-CE2 3.89Å; Y660-W736 AromaticContact CZ-CG 3.59Å; Y660-W736 AromaticContact CZ-NE1 3.85Å
661	P	93.1	Very high	92.5	Very high	55 Å²	55	71.9 Å²	71.9	36%	0.357	35%	0.352	S	S	.	.	S	Bend	cis	-65.1	161.9	-10.6	30.9	-36.5	0	0	0	111.7	T663 A664	P661-T663 PolarHBondContact O-N 2.71Å; P661-T663 VanDerWaalsContact O-N 3.11Å; P661-A664 VanDerWaalsContact O-CB 3.25Å; P661-A664 WeakPolarHBondContact O-CB 3.44Å; P661-A664 PolarHBondContact O-N 2.96Å
662	E	87.5	Confident	92.4	Very high	150 Å²	150	68.7 Å²	68.7	70%	0.701	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-24.4	176.6	-65.4	-169.7	179.9	0	0	112.7	A664 Y704	E662-A664 VanDerWaalsContact C-N 3.26Å; E662-A664 PolarHBondContact O-N 3.38Å; E662-Y704 HydrophobicContact CG-CE2 4.09Å; E662-Y704 WeakPolarHBondContact CG-OH 3.44Å
663	T	90.5	Very high	92.3	Very high	127 Å²	127	68.9 Å²	68.9	78%	0.779	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	6.9	175.1	52	0	0	0	0	114.2	P661 A665	P661-T663 PolarHBondContact O-N 2.71Å; P661-T663 VanDerWaalsContact O-N 3.11Å; T663-A665 PolarHBondContact O-N 2.95Å
664	A	90.9	Very high	92.4	Very high	11 Å²	11	67.8 Å²	67.8	9%	0.091	36%	0.358	C	S	.	.			trans	-49.9	135.7	-179.6	0	0	0	0	0	112.8	I659 P661 E662 Y676 C680	I659-A664 HydrophobicContact CG2-CB 3.67Å; P661-A664 VanDerWaalsContact O-CB 3.25Å; P661-A664 WeakPolarHBondContact O-CB 3.44Å; P661-A664 PolarHBondContact O-N 2.96Å; E662-A664 VanDerWaalsContact C-N 3.26Å; E662-A664 PolarHBondContact O-N 3.38Å; A664-Y676 HydrophobicContact CB-CD1 4.06Å; A664-Y676 HydrophobicContact CB-CE1 4.46Å; A664-Y676 WeakPolarHBondContact O-CE1 3.43Å; A664-C680 HydrophobicContact CB-CB 4.04Å
665	A	92.5	Very high	92.5	Very high	74 Å²	74	64.6 Å²	64.6	61%	0.612	34%	0.341	S	S	*	.			trans	-60.9	136.8	-175.4	0	0	0	0	0	112.1	T663	T663-A665 PolarHBondContact O-N 2.95Å
666	I	94.1	Very high	92.7	Very high	78 Å²	78	62 Å²	62	40%	0.4	33%	0.329	S	S	.	.			trans	-88.2	109.9	176.8	-59.5	172.7	0	0	0	108	G668 Y669 A674 Y676	I666-G668 VanDerWaalsContact C-N 3.29Å; I666-G668 WeakPolarHBondContact CG2-O 3.35Å; I666-G668 PolarHBondContact O-N 3.11Å; I666-Y669 HydrophobicContact CG2-CD2 4.49Å; I666-Y669 HydrophobicContact CG2-CE1 4.31Å; I666-Y669 HydrophobicContact CG2-CE2 3.95Å; I666-A674 HydrophobicContact CB-CB 4.5Å; I666-A674 HydrophobicContact CD1-CB 4.02Å; I666-A674 HydrophobicContact CG1-CB 4.06Å; I666-A674 HydrophobicContact CG2-CB 3.69Å; I666-Y676 HydrophobicContact CG1-CE1 3.89Å
667	L	91.7	Very high	92.7	Very high	88 Å²	88	59.4 Å²	59.4	46%	0.461	32%	0.322	S	S	.	.			trans	-72.6	-23.8	-178.7	-60.6	178.6	0	0	0	112.7	Y647 V675	Y647-L667 HydrophobicContact CD1-CD1 3.81Å; Y647-L667 HydrophobicContact CE1-CD1 3.83Å; L667-V675 PolarHBondContact N-O 3.15Å
668	G	92.8	Very high	92.7	Very high	15 Å²	15	62.7 Å²	62.7	16%	0.155	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	170.6	-169.4	179.2	0	0	0	0	0	112.3	I666 V675	I666-G668 VanDerWaalsContact C-N 3.29Å; I666-G668 WeakPolarHBondContact CG2-O 3.35Å; I666-G668 PolarHBondContact O-N 3.11Å; G668-V675 PolarHBondContact O-N 2.66Å
669	Y	93.6	Very high	92.6	Very high	157 Å²	157	68 Å²	68	62%	0.616	36%	0.361	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.6	124.5	-178.9	-66.9	-90.7	0	0	0	112.2	I666 E673 A674	I666-Y669 HydrophobicContact CG2-CD2 4.49Å; I666-Y669 HydrophobicContact CG2-CE1 4.31Å; I666-Y669 HydrophobicContact CG2-CE2 3.95Å; Y669-E673 CarbonylContact C-O 3.58Å; Y669-E673 VanDerWaalsContact CA-O 3.25Å; Y669-E673 WeakPolarHBondContact CA-O 3.16Å; Y669-A674 HydrophobicContact CD1-CB 4.37Å; Y669-A674 HydrophobicContact CE1-CB 4.04Å
670	C	90.8	Very high	92.6	Very high	6 Å²	6	68.9 Å²	68.9	4%	0.041	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	111.1	170.1	-167.6	0	0	0	0	109.8	Y641 G672 E673 V675	Y641-C670 HydrophobicContact CE2-CB 3.76Å; C670-G672 PolarHBondContact O-N 3.29Å; C670-G672 VanDerWaalsContact O-N 3.1Å; C670-E673 PolarHBondContact N-O 3.34Å; C670-E673 PolarHBondContact O-N 3.29Å; C670-V675 HydrophobicContact CB-CG2 4.23Å
671	R	89.2	Confident	92.6	Very high	197 Å²	197	65.9 Å²	65.9	74%	0.743	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	34	179.9	-54.6	-171.6	-178.7	-175.1	-4.6	114.6	I638	I638-R671 HydrophobicContact CD1-CB 4.22Å; I638-R671 HydrophobicContact CD1-CG 4.4Å; I638-R671 HydrophobicContact CG1-CG 4.41Å
672	G	89.6	Confident	92.7	Very high	66 Å²	66	66.4 Å²	66.4	68%	0.68	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.3	-4.2	180	0	0	0	0	0	115.3	C670	C670-G672 PolarHBondContact O-N 3.29Å; C670-G672 VanDerWaalsContact O-N 3.1Å
673	E	93.1	Very high	93.1	Very high	54 Å²	54	62.5 Å²	62.5	25%	0.252	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	134.7	173.6	-67.8	-170.8	-179.1	0	0	112.2	L649 R651 Y669 C670	L649-E673 HydrophobicContact CD2-CB 4.15Å; R651-E673 WeakPolarHBondContact CD-OE2 3.47Å; R651-E673 VanDerWaalsContact CG-OE2 3.31Å; R651-E673 WeakPolarHBondContact CG-OE2 3.39Å; R651-E673 IonicContact CZ-OE1 2.71Å; R651-E673 IonicContact CZ-OE2 3.92Å; R651-E673 IonicContact NE-OE1 2.64Å; R651-E673 PolarHBondContact NE-OE1 2.9Å; R651-E673 IonicContact NE-OE2 3.74Å; R651-E673 PolarHBondContact NE-OE2 3.31Å; R651-E673 IonicContact NH2-OE1 2.7Å; R651-E673 PolarHBondContact NH2-OE1 3.08Å; R651-E673 IonicContact NH2-OE2 3.91Å; Y669-E673 CarbonylContact C-O 3.58Å; Y669-E673 VanDerWaalsContact CA-O 3.25Å; Y669-E673 WeakPolarHBondContact CA-O 3.16Å; C670-E673 PolarHBondContact N-O 3.34Å; C670-E673 PolarHBondContact O-N 3.29Å
674	A	93.9	Very high	93.3	Very high	17 Å²	17	56.4 Å²	56.4	14%	0.14	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	128.8	174.4	0	0	0	0	0	111.5	L649 I666 Y669 Y676	L649-A674 WeakPolarHBondContact CD2-O 3.46Å; I666-A674 HydrophobicContact CB-CB 4.5Å; I666-A674 HydrophobicContact CD1-CB 4.02Å; I666-A674 HydrophobicContact CG1-CB 4.06Å; I666-A674 HydrophobicContact CG2-CB 3.69Å; Y669-A674 HydrophobicContact CD1-CB 4.37Å; Y669-A674 HydrophobicContact CE1-CB 4.04Å; A674-Y676 HydrophobicContact CB-CD2 4.47Å; A674-Y676 HydrophobicContact CB-CE2 3.63Å; A674-Y676 WeakPolarHBondContact O-CD2 3.19Å; A674-Y676 WeakPolarHBondContact O-CE2 3.39Å
675	V	95.8	Very high	93.5	Very high	0 Å²	0	58 Å²	58	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	130.5	171.1	-177	0	0	0	0	108.5	Y641 Y647 L649 L667 G668 C670	Y641-V675 HydrophobicContact CD1-CG1 4.38Å; Y641-V675 HydrophobicContact CE1-CB 4.48Å; Y641-V675 HydrophobicContact CE1-CG1 3.74Å; Y641-V675 HydrophobicContact CE1-CG2 3.83Å; Y647-V675 HydrophobicContact CD1-CG1 4.3Å; Y647-V675 HydrophobicContact CG-CG1 4.18Å; L649-V675 HydrophobicContact CD2-CB 4.48Å; L649-V675 HydrophobicContact CD2-CG2 3.84Å; L667-V675 PolarHBondContact N-O 3.15Å; G668-V675 PolarHBondContact O-N 2.66Å; C670-V675 HydrophobicContact CB-CG2 4.23Å
676	Y	95.5	Very high	93.6	Very high	14 Å²	14	55 Å²	55	6%	0.055	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	158.8	176.9	-62.6	-87.9	0	0	0	109.8	Y647 A648 K650 I659 A664 I666 A674	Y647-Y676 WeakPolarHBondContact CA-O 3.21Å; A648-Y676 PolarHBondContact N-O 3.14Å; A648-Y676 PolarHBondContact O-N 2.75Å; K650-Y676 HydrophobicContact CD-CE2 3.8Å; K650-Y676 WeakPolarHBondContact CE-OH 3.35Å; K650-Y676 HydrophobicContact CG-CD2 4.4Å; K650-Y676 HydrophobicContact CG-CE2 3.9Å; K650-Y676 PolarHBondContact NZ-OH 3.4Å; I659-Y676 HydrophobicContact CD1-CD1 4.3Å; I659-Y676 HydrophobicContact CD1-CD2 3.47Å; I659-Y676 VanDerWaalsContact CD1-CD2 3.47Å; I659-Y676 HydrophobicContact CD1-CE2 3.89Å; I659-Y676 HydrophobicContact CD1-CG 3.7Å; I659-Y676 HydrophobicContact CG2-CD1 4.22Å; I659-Y676 HydrophobicContact CG2-CG 4.49Å; A664-Y676 HydrophobicContact CB-CD1 4.06Å; A664-Y676 HydrophobicContact CB-CE1 4.46Å; A664-Y676 WeakPolarHBondContact O-CE1 3.43Å; I666-Y676 HydrophobicContact CG1-CE1 3.89Å; A674-Y676 HydrophobicContact CB-CD2 4.47Å; A674-Y676 HydrophobicContact CB-CE2 3.63Å; A674-Y676 WeakPolarHBondContact O-CD2 3.19Å; A674-Y676 WeakPolarHBondContact O-CE2 3.39Å
677	S	95	Very high	93.6	Very high	21 Å²	21	58.1 Å²	58.1	15%	0.147	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	145.9	165.5	-172	0	0	0	0	109.7	L646 D679 C680	L646-S677 PolarHBondContact O-OG 3.33Å; S677-D679 PolarHBondContact O-N 3.05Å; S677-D679 VanDerWaalsContact OG-CG 3.27Å; S677-D679 PolarHBondContact OG-N 3.17Å; S677-D679 PolarHBondContact OG-OD2 3.12Å; S677-C680 PolarHBondContact O-N 2.84Å
678	R	93.9	Very high	93.6	Very high	80 Å²	80	59.3 Å²	59.3	30%	0.302	30%	0.298	S	S	.	.	S	Bend	trans	-67.3	-25.2	170.5	-174.1	62.2	178.1	164.8	5.4	111.4	P645 L646 E657 C680 V681	P645-R678 WeakPolarHBondContact O-CB 3.29Å; P645-R678 WeakPolarHBondContact O-CG 3.31Å; L646-R678 PolarHBondContact O-N 3.17Å; E657-R678 IonicContact OE1-CZ 3.46Å; E657-R678 VanDerWaalsContact OE1-CZ 3.31Å; E657-R678 IonicContact OE1-NH1 3.03Å; E657-R678 PolarHBondContact OE1-NH1 3.4Å; E657-R678 VanDerWaalsContact OE1-NH1 3.09Å; E657-R678 IonicContact OE1-NH2 2.75Å; E657-R678 PolarHBondContact OE1-NH2 3.02Å; E657-R678 IonicContact OE2-NH1 2.68Å; E657-R678 PolarHBondContact OE2-NH1 2.99Å; E657-R678 IonicContact OE2-NH2 2.78Å; R678-C680 PolarHBondContact O-N 2.96Å; R678-V681 WeakPolarHBondContact O-CB 3.49Å; R678-V681 PolarHBondContact O-N 3.47Å
679	D	93.7	Very high	93.6	Very high	124 Å²	124	60.9 Å²	60.9	66%	0.663	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-31.7	177	-44.9	-47	0	0	0	112.4	S677 V681	S677-D679 PolarHBondContact O-N 3.05Å; S677-D679 VanDerWaalsContact OG-CG 3.27Å; S677-D679 PolarHBondContact OG-N 3.17Å; S677-D679 PolarHBondContact OG-OD2 3.12Å; D679-V681 PolarHBondContact O-N 2.72Å
680	C	94.1	Very high	93.7	Very high	31 Å²	31	53.9 Å²	53.9	21%	0.209	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-4.5	175	-53.1	0	0	0	0	112.8	I659 Y660 A664 S677 R678 H682	I659-C680 CarbonylContact C-O 3.59Å; I659-C680 VanDerWaalsContact CA-O 3.24Å; I659-C680 WeakPolarHBondContact CA-O 3.29Å; I659-C680 HydrophobicContact CG2-CB 4.05Å; Y660-C680 PolarHBondContact N-O 3.48Å; A664-C680 HydrophobicContact CB-CB 4.04Å; S677-C680 PolarHBondContact O-N 2.84Å; R678-C680 PolarHBondContact O-N 2.96Å; C680-H682 PolarHBondContact O-CD2 3.49Å
681	V	94.6	Very high	93.8	Very high	19 Å²	19	55.9 Å²	55.9	12%	0.115	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	112.5	177.8	-175.7	0	0	0	0	110	A648 L653 E657 A658 I659 R678 D679	A648-V681 HydrophobicContact CB-CG2 3.44Å; A648-V681 VanDerWaalsContact CB-CG2 3.44Å; L653-V681 HydrophobicContact CD2-CB 4.32Å; L653-V681 HydrophobicContact CD2-CG1 3.58Å; L653-V681 HydrophobicContact CD2-CG2 3.69Å; E657-V681 HydrophobicContact CB-CG1 3.94Å; E657-V681 HydrophobicContact CG-CG1 4.05Å; A658-V681 WeakPolarHBondContact O-CA 3.3Å; I659-V681 HydrophobicContact CG1-CG2 4.06Å; R678-V681 WeakPolarHBondContact O-CB 3.49Å; R678-V681 PolarHBondContact O-N 3.47Å; D679-V681 PolarHBondContact O-N 2.72Å
682	H	95	Very high	93.9	Very high	66 Å²	66	50.8 Å²	50.8	31%	0.306	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	142.2	179	-64.4	-84.9	0	0	0	111.4	E657 A658 C680 W736	E657-H682 WeakPolarHBondContact CA-O 3.26Å; A658-H682 PolarHBondContact N-O 3.33Å; A658-H682 PolarHBondContact O-N 3.19Å; C680-H682 PolarHBondContact O-CD2 3.49Å; H682-W736 HydrophobicContact CB-CH2 4.21Å; H682-W736 HydrophobicContact CB-CZ3 3.67Å; H682-W736 AromaticContact CG-CZ3 3.77Å
683	T	95	Very high	94.1	Very high	67 Å²	67	50.9 Å²	50.9	41%	0.411	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	128.2	169.4	50.3	0	0	0	0	109.6	E657 H685	E657-T683 HydrophobicContact CG-CG2 4.32Å; T683-H685 PolarHBondContact OG1-NE2 2.64Å
684	L	95.6	Very high	94.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.242	C	C	.	.			trans	-104	135.4	178.3	-46.9	177.3	0	0	0	109.2	Y656 A658 Y704 K705 L732 F733 W736	Y656-L684 WeakPolarHBondContact O-CB 3.39Å; Y656-L684 PolarHBondContact O-N 3.16Å; A658-L684 HydrophobicContact CB-CD1 3.74Å; A658-L684 HydrophobicContact CB-CD2 4.49Å; A658-L684 HydrophobicContact CB-CG 4.25Å; L684-Y704 HydrophobicContact CD1-CD1 3.91Å; L684-Y704 HydrophobicContact CD2-CD1 3.97Å; L684-K705 HydrophobicContact CD1-CB 3.46Å; L684-K705 VanDerWaalsContact CD1-CB 3.46Å; L684-K705 HydrophobicContact CD1-CD 3.82Å; L684-K705 HydrophobicContact CD1-CG 4.31Å; L684-L732 HydrophobicContact CB-CB 3.74Å; L684-L732 HydrophobicContact CB-CD1 4.35Å; L684-L732 HydrophobicContact CD1-CB 4.25Å; L684-F733 WeakPolarHBondContact CA-O 3.35Å; L684-W736 HydrophobicContact CD2-CH2 3.7Å; L684-W736 HydrophobicContact CD2-CZ2 4.3Å
685	H	95.2	Very high	94.2	Very high	44 Å²	44	49.8 Å²	49.8	20%	0.204	24%	0.243	C	C	.	.	B	Isolated β-bridge	trans	-120.1	155.9	-179.2	-63.9	-56.8	0	0	0	111.3	T683 T689 W690 L732 F733	T683-H685 PolarHBondContact OG1-NE2 2.64Å; H685-T689 HydrophobicContact CB-CG2 3.78Å; H685-W690 HydrophobicContact CB-CD2 4.01Å; H685-W690 HydrophobicContact CB-CG 4.03Å; H685-W690 HydrophobicContact CB-CZ2 4.26Å; H685-W690 AromaticContact CD2-CE2 3.98Å; H685-W690 AromaticContact CD2-CH2 3.81Å; H685-W690 AromaticContact CD2-CZ2 3.75Å; H685-W690 PolarHBondContact O-NE1 2.96Å; H685-L732 WeakPolarHBondContact O-CA 3.48Å; H685-F733 PolarHBondContact N-O 3.08Å; H685-F733 VanDerWaalsContact N-O 3.08Å; H685-F733 PolarHBondContact O-N 2.74Å
686	S	94.4	Very high	94.2	Very high	12 Å²	12	52.6 Å²	52.6	8%	0.084	26%	0.26	C	S	.	.			trans	-68.8	162.9	167.7	64.5	0	0	0	0	110.3	D688 T689 W690	S686-D688 PolarHBondContact O-N 2.95Å; S686-T689 PolarHBondContact O-N 3.02Å; S686-T689 PolarHBondContact OG-N 3.29Å; S686-T689 PolarHBondContact OG-OG1 3.28Å; S686-W690 PolarHBondContact O-N 2.65Å
687	R	93.3	Very high	94.2	Very high	143 Å²	143	52.1 Å²	52.1	54%	0.54	26%	0.259	S	S	.	.	H	α-helix	trans	-53.8	-42	177	-171.5	177.1	-71	170.7	-3.4	112.2	T689 W690 L691 V697 F733	R687-T689 PolarHBondContact O-N 2.87Å; R687-W690 PolarHBondContact O-N 2.69Å; R687-L691 PolarHBondContact O-N 3.46Å; R687-V697 HydrophobicContact CB-CG2 4.21Å; R687-V697 HydrophobicContact CG-CB 4.43Å; R687-V697 HydrophobicContact CG-CG2 4.05Å; R687-F733 HydrophobicContact CB-CE2 4.5Å
688	D	90.8	Very high	94.2	Very high	113 Å²	113	55.9 Å²	55.9	60%	0.604	27%	0.27	S	S	*	.	H	α-helix	trans	-66.4	-35.2	178.2	-43.1	-41.3	0	0	0	112.7	S686 L691 K692	S686-D688 PolarHBondContact O-N 2.95Å; D688-L691 PolarHBondContact O-N 2.8Å; D688-K692 PolarHBondContact O-N 3.15Å
689	T	92.7	Very high	94.1	Very high	48 Å²	48	60.8 Å²	60.8	29%	0.294	30%	0.301	S	S	.	.	H	α-helix	trans	-77.7	-32.7	179	-61.5	0	0	0	0	111.5	H685 S686 R687 L691 K692 K693	H685-T689 HydrophobicContact CB-CG2 3.78Å; S686-T689 PolarHBondContact O-N 3.02Å; S686-T689 PolarHBondContact OG-N 3.29Å; S686-T689 PolarHBondContact OG-OG1 3.28Å; R687-T689 PolarHBondContact O-N 2.87Å; T689-L691 VanDerWaalsContact C-N 3.33Å; T689-K692 WeakPolarHBondContact O-CB 3.29Å; T689-K692 PolarHBondContact O-N 3.3Å; T689-K693 PolarHBondContact O-N 3.36Å
690	W	95.7	Very high	94	Very high	10 Å²	10	58.7 Å²	58.7	4%	0.038	31%	0.309	C	S	.	.	H	α-helix	trans	-63.1	-39.2	167.6	-79.3	120.8	0	0	0	112.1	H685 S686 R687 K692 K693 A694 R695 F733 Y735 T738	H685-W690 HydrophobicContact CB-CD2 4.01Å; H685-W690 HydrophobicContact CB-CG 4.03Å; H685-W690 HydrophobicContact CB-CZ2 4.26Å; H685-W690 AromaticContact CD2-CE2 3.98Å; H685-W690 AromaticContact CD2-CH2 3.81Å; H685-W690 AromaticContact CD2-CZ2 3.75Å; H685-W690 PolarHBondContact O-NE1 2.96Å; S686-W690 PolarHBondContact O-N 2.65Å; R687-W690 PolarHBondContact O-N 2.69Å; W690-K692 VanDerWaalsContact C-N 3.26Å; W690-K692 PolarHBondContact O-N 3.43Å; W690-K693 HydrophobicContact CZ3-CD 4.42Å; W690-K693 CarbonylContact O-C 3.49Å; W690-K693 WeakPolarHBondContact O-CA 3.39Å; W690-K693 PolarHBondContact O-N 3.23Å; W690-A694 PolarHBondContact O-N 3.46Å; W690-R695 CarbonylContact C-O 3.48Å; W690-R695 HydrophobicContact CB-CB 4.48Å; W690-R695 HydrophobicContact CE3-CB 4.18Å; W690-R695 PolarHBondContact O-N 2.87Å; W690-R695 VanDerWaalsContact O-O 3.08Å; W690-F733 PolarHBondContact NE1-O 2.91Å; W690-Y735 HydrophobicContact CH2-CD2 4.06Å; W690-Y735 HydrophobicContact CZ3-CD2 4.08Å; W690-T738 HydrophobicContact CB-CG2 4.42Å; W690-T738 HydrophobicContact CD2-CG2 3.77Å; W690-T738 HydrophobicContact CE3-CG2 4.38Å; W690-T738 HydrophobicContact CG-CG2 3.77Å
691	L	92.9	Very high	94	Very high	47 Å²	47	60.3 Å²	60.3	25%	0.246	31%	0.313	C	S	.	.	H	α-helix	trans	-60.4	-35.6	175.8	-175.8	64.3	0	0	0	112.1	R687 D688 T689 K693 A694 R695 Y741 Y760 M766	R687-L691 PolarHBondContact O-N 3.46Å; D688-L691 PolarHBondContact O-N 2.8Å; T689-L691 VanDerWaalsContact C-N 3.33Å; L691-K693 VanDerWaalsContact C-N 3.26Å; L691-K693 PolarHBondContact O-N 3.47Å; L691-A694 PolarHBondContact O-N 2.9Å; L691-R695 WeakPolarHBondContact CA-O 3.4Å; L691-R695 PolarHBondContact N-O 3Å; L691-R695 VanDerWaalsContact N-O 3.16Å; L691-Y741 HydrophobicContact CD1-CD2 3.82Å; L691-Y741 HydrophobicContact CD1-CE2 4.04Å; L691-Y760 HydrophobicContact CD2-CD2 4.42Å; L691-M766 HydrophobicContact CD1-CE 3.86Å; L691-M766 HydrophobicContact CG-CE 4.2Å; L691-M766 WeakPolarHBondContact O-CE 3.35Å
692	K	92.6	Very high	94	Very high	91 Å²	91	64.7 Å²	64.7	40%	0.396	34%	0.34	S	S	.	.	H	α-helix	trans	-62	-31.7	172	-65.8	178.4	-179.6	-176.1	0	113.5	D688 T689 W690 A694 F762	D688-K692 PolarHBondContact O-N 3.15Å; T689-K692 WeakPolarHBondContact O-CB 3.29Å; T689-K692 PolarHBondContact O-N 3.3Å; W690-K692 VanDerWaalsContact C-N 3.26Å; W690-K692 PolarHBondContact O-N 3.43Å; K692-A694 PolarHBondContact O-N 2.92Å; K692-F762 HydrophobicContact CB-CD2 4.24Å; K692-F762 HydrophobicContact CB-CG 4.26Å; K692-F762 HydrophobicContact CG-CD1 4.32Å; K692-F762 HydrophobicContact CG-CD2 4.07Å; K692-F762 HydrophobicContact CG-CE1 4.32Å; K692-F762 HydrophobicContact CG-CE2 4.03Å; K692-F762 HydrophobicContact CG-CG 4.21Å; K692-F762 HydrophobicContact CG-CZ 4.18Å; K692-F762 VanDerWaalsContact O-CB 3.27Å; K692-F762 WeakPolarHBondContact O-CB 3.39Å
693	K	93.1	Very high	93.9	Very high	67 Å²	67	63.5 Å²	63.5	29%	0.291	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	20.7	174	-62.2	-165.5	177.5	-124	0	112.8	E120 T689 W690 L691 R695	E120-K693 WeakPolarHBondContact OE1-CE 3.3Å; E120-K693 IonicContact OE1-NZ 2.78Å; E120-K693 PolarHBondContact OE1-NZ 2.9Å; E120-K693 IonicContact OE2-NZ 3.87Å; T689-K693 PolarHBondContact O-N 3.36Å; W690-K693 HydrophobicContact CZ3-CD 4.42Å; W690-K693 CarbonylContact O-C 3.49Å; W690-K693 WeakPolarHBondContact O-CA 3.39Å; W690-K693 PolarHBondContact O-N 3.23Å; L691-K693 VanDerWaalsContact C-N 3.26Å; L691-K693 PolarHBondContact O-N 3.47Å; K693-R695 VanDerWaalsContact C-N 3.28Å; K693-R695 PolarHBondContact O-N 3.21Å
694	A	93.8	Very high	93.9	Very high	4 Å²	4	62.9 Å²	62.9	3%	0.033	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	52	41.4	-175.5	0	0	0	0	0	113.7	W690 L691 K692 Y741 L763 M766	W690-A694 PolarHBondContact O-N 3.46Å; L691-A694 PolarHBondContact O-N 2.9Å; K692-A694 PolarHBondContact O-N 2.92Å; A694-Y741 VanDerWaalsContact C-CB 3.48Å; A694-Y741 VanDerWaalsContact O-CB 3.25Å; A694-Y741 WeakPolarHBondContact O-CB 3.42Å; A694-Y741 PolarHBondContact O-N 3.11Å; A694-L763 HydrophobicContact CB-CB 4.29Å; A694-L763 HydrophobicContact CB-CD1 3.74Å; A694-M766 HydrophobicContact CB-CG 3.58Å; A694-M766 HydrophobicContact CB-SD 4.06Å
695	R	95.7	Very high	93.8	Very high	44 Å²	44	65.8 Å²	65.8	17%	0.166	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	147.7	175.5	-61.7	-174.3	78.6	89	-1.2	112	W690 L691 K693 Y735 T738 E739	W690-R695 CarbonylContact C-O 3.48Å; W690-R695 HydrophobicContact CB-CB 4.48Å; W690-R695 HydrophobicContact CE3-CB 4.18Å; W690-R695 PolarHBondContact O-N 2.87Å; W690-R695 VanDerWaalsContact O-O 3.08Å; L691-R695 WeakPolarHBondContact CA-O 3.4Å; L691-R695 PolarHBondContact N-O 3Å; L691-R695 VanDerWaalsContact N-O 3.16Å; K693-R695 VanDerWaalsContact C-N 3.28Å; K693-R695 PolarHBondContact O-N 3.21Å; R695-Y735 PolarHBondContact NH1-OH 2.85Å; R695-T738 PolarHBondContact NE-OG1 3.07Å; R695-T738 PolarHBondContact NH2-O 3.16Å; R695-E739 CarbonylContact C-O 3.55Å; R695-E739 WeakPolarHBondContact CA-O 3.44Å; R695-E739 WeakPolarHBondContact CB-O 3.37Å
696	V	95.1	Very high	93.7	Very high	59 Å²	59	67.8 Å²	67.8	36%	0.358	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	137.8	178.8	-173.5	0	0	0	0	109.1	R698 T738 E739 Y741	V696-R698 PolarHBondContact O-N 3.27Å; V696-T738 CarbonylContact O-C 3.53Å; V696-T738 VanDerWaalsContact O-CA 3.23Å; V696-T738 WeakPolarHBondContact O-CA 3.42Å; V696-E739 PolarHBondContact N-O 3.29Å; V696-E739 PolarHBondContact O-N 3.44Å; V696-Y741 HydrophobicContact CG2-CD2 3.65Å; V696-Y741 HydrophobicContact CG2-CG 4.4Å
697	V	95.9	Very high	93.5	Very high	5 Å²	5	68 Å²	68	3%	0.03	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	128.9	172.5	178.1	0	0	0	0	108.9	R687 E701 F733 T738	R687-V697 HydrophobicContact CB-CG2 4.21Å; R687-V697 HydrophobicContact CG-CB 4.43Å; R687-V697 HydrophobicContact CG-CG2 4.05Å; V697-E701 HydrophobicContact CG1-CB 3.94Å; V697-F733 HydrophobicContact CB-CD1 4.47Å; V697-F733 HydrophobicContact CB-CG 4.43Å; V697-F733 HydrophobicContact CG1-CD1 3.45Å; V697-F733 VanDerWaalsContact CG1-CD1 3.45Å; V697-F733 HydrophobicContact CG1-CD2 4.34Å; V697-F733 HydrophobicContact CG1-CE1 3.57Å; V697-F733 HydrophobicContact CG1-CE2 4.45Å; V697-F733 HydrophobicContact CG1-CG 3.86Å; V697-F733 HydrophobicContact CG1-CZ 4.09Å; V697-F733 HydrophobicContact CG2-CB 3.95Å; V697-F733 HydrophobicContact CG2-CD1 4.14Å; V697-F733 HydrophobicContact CG2-CD2 3.65Å; V697-F733 HydrophobicContact CG2-CE2 4.17Å; V697-F733 HydrophobicContact CG2-CG 3.63Å; V697-T738 HydrophobicContact CG2-CG2 4.14Å
698	R	95.9	Very high	93.3	Very high	99 Å²	99	64.9 Å²	64.9	37%	0.374	34%	0.342	S	S	.	.	P	Polyproline II helix	trans	-56.3	147.4	179.3	-69.3	174.9	169.2	137.4	6.3	111.8	V696 G700 E701 W736 Q737 E739	V696-R698 PolarHBondContact O-N 3.27Å; R698-G700 PolarHBondContact O-N 2.83Å; R698-E701 HydrophobicContact CB-CG 3.61Å; R698-E701 PolarHBondContact O-N 3.06Å; R698-W736 PolarHBondContact NH1-O 2.97Å; R698-W736 VanDerWaalsContact NH1-O 3.09Å; R698-Q737 PolarHBondContact N-O 3.28Å; R698-E739 VanDerWaalsContact CG-CD 3.49Å; R698-E739 HydrophobicContact CG-CG 3.72Å; R698-E739 IonicContact CZ-OE1 2.65Å; R698-E739 IonicContact NE-OE1 3.65Å; R698-E739 PolarHBondContact NE-OE1 3.11Å; R698-E739 IonicContact NH2-OE1 3.71Å
699	L	91.5	Very high	92.9	Very high	183 Å²	183	59.7 Å²	59.7	96%	0.958	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	124.4	177.7	-61.4	177.4	0	0	0	110.3
700	G	91.8	Very high	92.3	Very high	80 Å²	80	63.2 Å²	63.2	83%	0.825	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.9	-4.4	-180	0	0	0	0	0	115.9	R698	R698-G700 PolarHBondContact O-N 2.83Å
701	E	93.4	Very high	91.5	Very high	66 Å²	66	66 Å²	66	31%	0.308	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-64.6	134	175.5	-75.2	-73.6	166.5	0	0	112.5	V697 R698 Q737	V697-E701 HydrophobicContact CG1-CB 3.94Å; R698-E701 HydrophobicContact CB-CG 3.61Å; R698-E701 PolarHBondContact O-N 3.06Å; E701-Q737 HydrophobicContact CB-CB 4.45Å; E701-Q737 HydrophobicContact CG-CB 4.08Å; E701-Q737 PolarHBondContact OE2-NE2 2.85Å
702	V	93.6	Very high	90.6	Very high	110 Å²	110	68.6 Å²	68.6	67%	0.667	36%	0.362	S	S	*	.	P	Polyproline II helix	trans	-84.5	131.5	173.9	179.7	0	0	0	0	108.8	Y704 Q737	V702-Y704 PolarHBondContact O-N 3.38Å; V702-Q737 PolarHBondContact O-NE2 2.87Å
703	P	94.4	Very high	89.9	Confident	41 Å²	41	72.8 Å²	72.8	27%	0.266	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-59.7	125.2	178.2	23.2	-33.5	0	0	0	111.6	K705 M706 L732 F733	P703-K705 VanDerWaalsContact C-N 3.28Å; P703-K705 PolarHBondContact O-N 3.45Å; P703-M706 HydrophobicContact CB-SD 3.81Å; P703-M706 HydrophobicContact CG-CG 4.42Å; P703-M706 HydrophobicContact CG-SD 3.36Å; P703-M706 WeakPolarHBondContact CG-SD 3.13Å; P703-L732 CarbonylContact C-O 3.51Å; P703-F733 VanDerWaalsContact CA-CE1 3.46Å; P703-F733 HydrophobicContact CB-CD1 4.34Å; P703-F733 HydrophobicContact CB-CE1 3.78Å; P703-F733 HydrophobicContact CB-CE2 4.32Å; P703-F733 HydrophobicContact CB-CZ 3.78Å; P703-F733 HydrophobicContact CG-CE1 4.49Å; P703-F733 HydrophobicContact CG-CZ 4.41Å
704	Y	93.5	Very high	89.2	Confident	55 Å²	55	70 Å²	70	22%	0.216	37%	0.365	C	S	.	.	S	Bend	trans	-64.6	-30.3	-178	-169.7	-112.8	0	0	0	113.2	A658 I659 Y660 E662 L684 V702 L732 W736	A658-Y704 HydrophobicContact CB-CD1 4.03Å; A658-Y704 HydrophobicContact CB-CE1 3.62Å; I659-Y704 PolarHBondContact O-OH 3.46Å; Y660-Y704 HydrophobicContact CD2-CE2 4.25Å; E662-Y704 HydrophobicContact CG-CE2 4.09Å; E662-Y704 WeakPolarHBondContact CG-OH 3.44Å; L684-Y704 HydrophobicContact CD1-CD1 3.91Å; L684-Y704 HydrophobicContact CD2-CD1 3.97Å; V702-Y704 PolarHBondContact O-N 3.38Å; Y704-L732 PolarHBondContact N-O 2.88Å; Y704-W736 HydrophobicContact CD1-CH2 4.25Å; Y704-W736 AromaticContact CD1-CZ2 3.84Å; Y704-W736 HydrophobicContact CD1-CZ2 3.84Å; Y704-W736 HydrophobicContact CD2-CZ2 4.11Å; Y704-W736 HydrophobicContact CE1-CH2 4.28Å; Y704-W736 HydrophobicContact CE1-CZ2 4.03Å; Y704-W736 HydrophobicContact CE2-CZ2 4.31Å; Y704-W736 AromaticContact CG-CZ2 3.87Å; Y704-W736 HydrophobicContact CG-CZ2 3.87Å
705	K	93.6	Very high	88.4	Confident	61 Å²	61	76.5 Å²	76.5	27%	0.265	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	123.1	177	-165.2	-176.7	-171.5	-177	0	110.4	L654 K655 E657 L684 P703 V707 L732	L654-K705 PolarHBondContact O-NZ 3.32Å; K655-K705 WeakPolarHBondContact O-CE 3.19Å; K655-K705 PolarHBondContact O-NZ 3.2Å; E657-K705 PolarHBondContact O-NZ 2.84Å; L684-K705 HydrophobicContact CD1-CB 3.46Å; L684-K705 VanDerWaalsContact CD1-CB 3.46Å; L684-K705 HydrophobicContact CD1-CD 3.82Å; L684-K705 HydrophobicContact CD1-CG 4.31Å; P703-K705 VanDerWaalsContact C-N 3.28Å; P703-K705 PolarHBondContact O-N 3.45Å; K705-V707 HydrophobicContact CD-CG2 4.03Å; K705-V707 HydrophobicContact CG-CG2 3.84Å; K705-L732 HydrophobicContact CB-CB 4.38Å; K705-L732 HydrophobicContact CB-CD1 4.49Å; K705-L732 HydrophobicContact CD-CD1 4.38Å; K705-L732 PolarHBondContact N-O 3.23Å; K705-L732 WeakPolarHBondContact O-CB 3.2Å; K705-L732 PolarHBondContact O-N 3.03Å
706	M	93.6	Very high	87.6	Confident	85 Å²	85	81.8 Å²	81.8	42%	0.419	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	130.7	170.9	-65	-60.4	-62.6	0	0	109.8	P703 N728 G731	P703-M706 HydrophobicContact CB-SD 3.81Å; P703-M706 HydrophobicContact CG-CG 4.42Å; P703-M706 HydrophobicContact CG-SD 3.36Å; P703-M706 WeakPolarHBondContact CG-SD 3.13Å; M706-N728 HydrophobicContact CB-CB 3.9Å; M706-N728 WeakPolarHBondContact CE-O 3.27Å; M706-N728 PolarHBondContact O-ND2 2.85Å; M706-G731 WeakPolarHBondContact SD-CA 3.41Å
707	V	90.8	Very high	86.8	Confident	17 Å²	17	80.9 Å²	80.9	10%	0.103	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	151.4	-178.5	-165.8	0	0	0	0	111.6	K655 K705 G709 N728 D729 L730 L732	K655-V707 HydrophobicContact CD-CG1 4.13Å; K655-V707 HydrophobicContact CG-CG1 3.78Å; K705-V707 HydrophobicContact CD-CG2 4.03Å; K705-V707 HydrophobicContact CG-CG2 3.84Å; V707-G709 PolarHBondContact O-N 3.32Å; V707-G709 VanDerWaalsContact O-N 3.17Å; V707-N728 WeakPolarHBondContact CA-OD1 3.43Å; V707-D729 PolarHBondContact O-N 2.91Å; V707-L730 PolarHBondContact N-O 3.17Å; V707-L730 WeakPolarHBondContact O-CA 3.37Å; V707-L730 VanDerWaalsContact O-CB 3.24Å; V707-L730 WeakPolarHBondContact O-CB 3.41Å; V707-L730 PolarHBondContact O-N 2.91Å; V707-L732 HydrophobicContact CB-CD1 4.28Å; V707-L732 HydrophobicContact CG2-CD1 3.5Å; V707-L732 VanDerWaalsContact CG2-CD1 3.5Å; V707-L732 HydrophobicContact CG2-CG 4.22Å
708	K	88.1	Confident	86.1	Confident	77 Å²	77	81.9 Å²	81.9	34%	0.335	42%	0.415	S	S	.	.			trans	-60.3	112.5	172.7	-168.6	169	178.3	166.7	0	112.3	K655 R725 N728 D729	K655-K708 PolarHBondContact NZ-O 3.46Å; K708-R725 WeakPolarHBondContact CE-O 3.28Å; K708-R725 PolarHBondContact NZ-O 3.01Å; K708-N728 PolarHBondContact N-OD1 3.45Å; K708-D729 WeakPolarHBondContact CA-OD1 3.33Å
709	G	83.4	Confident	85.2	Confident	4 Å²	4	83.6 Å²	83.6	4%	0.041	43%	0.431	C	S	.	.			trans	-78.4	146.1	177.1	0	0	0	0	0	112.7	V707 R718 D729	V707-G709 PolarHBondContact O-N 3.32Å; V707-G709 VanDerWaalsContact O-N 3.17Å; G709-R718 VanDerWaalsContact O-CZ 3.31Å; G709-R718 PolarHBondContact O-NH1 2.87Å; G709-R718 PolarHBondContact O-NH2 3.07Å; G709-D729 PolarHBondContact N-OD1 3.05Å
710	F	79.2	Confident	84.9	Confident	122 Å²	122	78.8 Å²	78.8	54%	0.535	42%	0.417	S	S	.	.			trans	-102.2	0.8	-177.8	-71.6	-56.1	0	0	0	115	R715	F710-R715 PolarHBondContact O-NH2 2.88Å
711	S	78.7	Confident	84.3	Confident	70 Å²	70	80.1 Å²	80.1	49%	0.49	40%	0.402	S	S	.	.	S	Bend	trans	-55.5	153.9	-178.5	77.4	0	0	0	0	112.4	R713 A714 R715	S711-R713 PolarHBondContact O-N 3Å; S711-A714 WeakPolarHBondContact O-CB 3.39Å; S711-A714 PolarHBondContact O-N 3.13Å; S711-A714 VanDerWaalsContact OG-CB 3.3Å; S711-A714 WeakPolarHBondContact OG-CB 3.36Å; S711-A714 PolarHBondContact OG-N 2.66Å; S711-A714 VanDerWaalsContact OG-N 3.17Å; S711-R715 WeakPolarHBondContact O-CB 3.41Å; S711-R715 PolarHBondContact O-N 3.18Å
712	N	75.9	Confident	83.5	Confident	100 Å²	100	81 Å²	81	54%	0.535	41%	0.413	S	S	.	.	H	α-helix	trans	-63.6	-27.4	179.1	-75.9	-35.4	0	0	0	112.5	R715 K716	N712-R715 PolarHBondContact OD1-NH1 2.92Å; N712-R715 PolarHBondContact OD1-NH2 3.31Å; N712-K716 WeakPolarHBondContact O-CB 3.29Å; N712-K716 VanDerWaalsContact O-CG 3.22Å; N712-K716 WeakPolarHBondContact O-CG 3.47Å; N712-K716 PolarHBondContact O-N 3.46Å; N712-K716 VanDerWaalsContact O-N 3.13Å
713	R	77.1	Confident	82.6	Confident	180 Å²	180	84.6 Å²	84.6	68%	0.679	42%	0.423	S	S	*	.	H	α-helix	trans	-67.4	-54.3	172.2	-176	177.2	-101	-177.3	-5.2	110.7	E432 S711 R715 K716 A717	E432-R713 IonicContact OE1-CZ 3.91Å; E432-R713 IonicContact OE1-NH2 3.78Å; E432-R713 PolarHBondContact OE1-NH2 2.87Å; S711-R713 PolarHBondContact O-N 3Å; R713-R715 VanDerWaalsContact C-N 3.31Å; R713-R715 PolarHBondContact O-N 2.9Å; R713-K716 PolarHBondContact O-N 3.46Å; R713-K716 VanDerWaalsContact O-N 3.14Å; R713-A717 PolarHBondContact O-N 2.87Å
714	A	77.4	Confident	81.5	Confident	7 Å²	7	84.8 Å²	84.8	6%	0.058	42%	0.422	C	S	.	.	H	α-helix	trans	-52.3	-46.2	174.9	0	0	0	0	0	113.1	S711 K716 A717 R718 D729	S711-A714 WeakPolarHBondContact O-CB 3.39Å; S711-A714 PolarHBondContact O-N 3.13Å; S711-A714 VanDerWaalsContact OG-CB 3.3Å; S711-A714 WeakPolarHBondContact OG-CB 3.36Å; S711-A714 PolarHBondContact OG-N 2.66Å; S711-A714 VanDerWaalsContact OG-N 3.17Å; A714-K716 PolarHBondContact O-N 3.35Å; A714-A717 PolarHBondContact O-N 3.39Å; A714-R718 WeakPolarHBondContact O-CG 3.49Å; A714-R718 PolarHBondContact O-N 3.48Å; A714-R718 VanDerWaalsContact O-N 3.12Å; A714-D729 WeakPolarHBondContact CB-OD2 3.07Å
715	R	77.4	Confident	80.3	Confident	142 Å²	142	89 Å²	89	54%	0.536	44%	0.437	S	S	.	.	H	α-helix	trans	-66.2	-37.1	-179.8	-161.1	-174.5	-48.5	164.3	9	112.7	F710 S711 N712 R713 L719	F710-R715 PolarHBondContact O-NH2 2.88Å; S711-R715 WeakPolarHBondContact O-CB 3.41Å; S711-R715 PolarHBondContact O-N 3.18Å; N712-R715 PolarHBondContact OD1-NH1 2.92Å; N712-R715 PolarHBondContact OD1-NH2 3.31Å; R713-R715 VanDerWaalsContact C-N 3.31Å; R713-R715 PolarHBondContact O-N 2.9Å; R715-L719 WeakPolarHBondContact O-CB 3.47Å; R715-L719 PolarHBondContact O-N 3.14Å
716	K	79.6	Confident	79.3	Confident	154 Å²	154	94.5 Å²	94.5	67%	0.67	46%	0.464	S	S	*	.	H	α-helix	trans	-70	-44.1	174.7	-77.1	173.6	179.5	-178	0	111.7	N712 R713 A714 R718 L719 A720	N712-K716 WeakPolarHBondContact O-CB 3.29Å; N712-K716 VanDerWaalsContact O-CG 3.22Å; N712-K716 WeakPolarHBondContact O-CG 3.47Å; N712-K716 PolarHBondContact O-N 3.46Å; N712-K716 VanDerWaalsContact O-N 3.13Å; R713-K716 PolarHBondContact O-N 3.46Å; R713-K716 VanDerWaalsContact O-N 3.14Å; A714-K716 PolarHBondContact O-N 3.35Å; K716-R718 PolarHBondContact O-N 3.49Å; K716-L719 WeakPolarHBondContact O-CB 3.5Å; K716-L719 PolarHBondContact O-N 2.82Å; K716-A720 PolarHBondContact O-N 2.94Å
717	A	79	Confident	78.5	Confident	41 Å²	41	95.9 Å²	95.9	34%	0.339	47%	0.469	S	S	.	.	H	α-helix	trans	-56.7	-50.5	177.3	0	0	0	0	0	111.6	R713 A714 L719 A720 E721	R713-A717 PolarHBondContact O-N 2.87Å; A714-A717 PolarHBondContact O-N 3.39Å; A717-L719 PolarHBondContact O-N 3.17Å; A717-L719 VanDerWaalsContact O-N 3.16Å; A717-A720 PolarHBondContact O-N 2.93Å; A717-A720 VanDerWaalsContact O-N 3.14Å; A717-E721 PolarHBondContact O-N 2.86Å
718	R	79.4	Confident	78.1	Confident	26 Å²	26	98.8 Å²	98.8	10%	0.098	48%	0.484	C	S	.	.	H	α-helix	trans	-68.4	-11.2	176.3	-62.2	-171.6	-62.2	-109	-5.4	115.2	G709 A714 K716 L724 D729	G709-R718 VanDerWaalsContact O-CZ 3.31Å; G709-R718 PolarHBondContact O-NH1 2.87Å; G709-R718 PolarHBondContact O-NH2 3.07Å; A714-R718 WeakPolarHBondContact O-CG 3.49Å; A714-R718 PolarHBondContact O-N 3.48Å; A714-R718 VanDerWaalsContact O-N 3.12Å; K716-R718 PolarHBondContact O-N 3.49Å; R718-L724 WeakPolarHBondContact CD-O 3.28Å; R718-L724 HydrophobicContact CG-CB 4.13Å; R718-L724 VanDerWaalsContact CG-O 3.28Å; R718-L724 WeakPolarHBondContact CG-O 3.35Å; R718-D729 VanDerWaalsContact NH1-CG 3.33Å; R718-D729 IonicContact NH1-OD1 3.06Å; R718-D729 PolarHBondContact NH1-OD1 2.99Å; R718-D729 IonicContact NH1-OD2 2.76Å; R718-D729 PolarHBondContact NH1-OD2 3.1Å
719	L	78.5	Confident	78	Confident	135 Å²	135	98.6 Å²	98.6	71%	0.707	49%	0.487	S	S	*	.	H	α-helix	trans	-90	-36.5	172.2	-175.7	64.7	0	0	0	111.2	R715 K716 A717	R715-L719 WeakPolarHBondContact O-CB 3.47Å; R715-L719 PolarHBondContact O-N 3.14Å; K716-L719 WeakPolarHBondContact O-CB 3.5Å; K716-L719 PolarHBondContact O-N 2.82Å; A717-L719 PolarHBondContact O-N 3.17Å; A717-L719 VanDerWaalsContact O-N 3.16Å
720	A	83.6	Confident	78.3	Confident	81 Å²	81	100.8 Å²	100.8	67%	0.669	50%	0.497	S	S	*	.	H	α-helix	trans	-68.6	-43.5	173.9	0	0	0	0	0	111.6	K716 A717	K716-A720 PolarHBondContact O-N 2.94Å; A717-A720 PolarHBondContact O-N 2.93Å; A717-A720 VanDerWaalsContact O-N 3.14Å
721	E	80.8	Confident	79	Confident	108 Å²	108	95.7 Å²	95.7	51%	0.505	48%	0.479	S	S	.	.			trans	-116.9	103.9	-177.3	-69.8	178.1	-146	0	0	111	A717 Q723 L724	A717-E721 PolarHBondContact O-N 2.86Å; E721-Q723 PolarHBondContact O-N 3.24Å; E721-Q723 VanDerWaalsContact O-N 3.11Å; E721-L724 HydrophobicContact CB-CD1 3.85Å; E721-L724 HydrophobicContact CB-CG 3.8Å; E721-L724 HydrophobicContact CG-CD1 4.48Å; E721-L724 PolarHBondContact O-N 3.19Å; E721-L724 WeakPolarHBondContact OE2-CD1 3.42Å
722	P	75.6	Confident	79.8	Confident	85 Å²	85	92.4 Å²	92.4	55%	0.552	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-61.1	-20	179.9	-26.3	35.7	0	0	0	114.7	R725	P722-R725 WeakPolarHBondContact O-CB 3.42Å; P722-R725 WeakPolarHBondContact O-CD 3.26Å; P722-R725 VanDerWaalsContact O-CG 3.28Å; P722-R725 WeakPolarHBondContact O-CG 3.33Å
723	Q	75	Confident	80.8	Confident	185 Å²	185	88.2 Å²	88.2	86%	0.864	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-70.4	-36.1	178.4	-64.1	-179.2	-1.2	0	0	111.9	E721 R725	E721-Q723 PolarHBondContact O-N 3.24Å; E721-Q723 VanDerWaalsContact O-N 3.11Å; Q723-R725 PolarHBondContact O-N 3.34Å; Q723-R725 VanDerWaalsContact O-N 3.15Å
724	L	72	Confident	81.6	Confident	46 Å²	46	79.6 Å²	79.6	24%	0.241	40%	0.401	C	S	.	.	G	3₁₀ helix	trans	-74.8	0.4	-179.6	-51.2	-178.6	0	0	0	113.6	R718 E721 E726 E727	R718-L724 WeakPolarHBondContact CD-O 3.28Å; R718-L724 HydrophobicContact CG-CB 4.13Å; R718-L724 VanDerWaalsContact CG-O 3.28Å; R718-L724 WeakPolarHBondContact CG-O 3.35Å; E721-L724 HydrophobicContact CB-CD1 3.85Å; E721-L724 HydrophobicContact CB-CG 3.8Å; E721-L724 HydrophobicContact CG-CD1 4.48Å; E721-L724 PolarHBondContact O-N 3.19Å; E721-L724 WeakPolarHBondContact OE2-CD1 3.42Å; L724-E726 PolarHBondContact O-N 2.84Å; L724-E726 VanDerWaalsContact O-N 3.13Å; L724-E727 WeakPolarHBondContact CD2-OE2 3.43Å; L724-E727 PolarHBondContact O-N 3.18Å; L724-E727 VanDerWaalsContact O-N 3.1Å
725	R	68.3	Low	82.5	Confident	142 Å²	142	85.4 Å²	85.4	54%	0.536	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-59.1	-30.1	-170	-83	-179.5	175.2	-167.3	2.7	114.8	K708 P722 Q723	K708-R725 WeakPolarHBondContact CE-O 3.28Å; K708-R725 PolarHBondContact NZ-O 3.01Å; P722-R725 WeakPolarHBondContact O-CB 3.42Å; P722-R725 WeakPolarHBondContact O-CD 3.26Å; P722-R725 VanDerWaalsContact O-CG 3.28Å; P722-R725 WeakPolarHBondContact O-CG 3.33Å; Q723-R725 PolarHBondContact O-N 3.34Å; Q723-R725 VanDerWaalsContact O-N 3.15Å
726	E	71.3	Confident	83.3	Confident	177 Å²	177	81.2 Å²	81.2	83%	0.827	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-107	1.9	-179.8	-63.9	-172.7	173.4	0	0	113	L724	L724-E726 PolarHBondContact O-N 2.84Å; L724-E726 VanDerWaalsContact O-N 3.13Å
727	E	78	Confident	84.1	Confident	114 Å²	114	74.2 Å²	74.2	53%	0.533	38%	0.376	S	S	.	.			trans	-74.6	140.1	-177.5	-166.5	160.6	-168.9	0	0	112.2	L724 D729	L724-E727 WeakPolarHBondContact CD2-OE2 3.43Å; L724-E727 PolarHBondContact O-N 3.18Å; L724-E727 VanDerWaalsContact O-N 3.1Å; E727-D729 PolarHBondContact O-N 3.4Å
728	N	82.7	Confident	84.9	Confident	79 Å²	79	72.4 Å²	72.4	42%	0.422	36%	0.361	S	S	.	.			trans	-90.2	95.9	177.6	-77.9	-34.5	0	0	0	108.8	M706 V707 K708	M706-N728 HydrophobicContact CB-CB 3.9Å; M706-N728 WeakPolarHBondContact CE-O 3.27Å; M706-N728 PolarHBondContact O-ND2 2.85Å; V707-N728 WeakPolarHBondContact CA-OD1 3.43Å; K708-N728 PolarHBondContact N-OD1 3.45Å
729	D	85.6	Confident	85.6	Confident	73 Å²	73	75.8 Å²	75.8	39%	0.39	38%	0.377	S	S	.	.			trans	-94.4	-12.8	-169.7	56.2	-30.3	0	0	0	114.9	V707 K708 G709 A714 R718 E727	V707-D729 PolarHBondContact O-N 2.91Å; K708-D729 WeakPolarHBondContact CA-OD1 3.33Å; G709-D729 PolarHBondContact N-OD1 3.05Å; A714-D729 WeakPolarHBondContact CB-OD2 3.07Å; R718-D729 VanDerWaalsContact NH1-CG 3.33Å; R718-D729 IonicContact NH1-OD1 3.06Å; R718-D729 PolarHBondContact NH1-OD1 2.99Å; R718-D729 IonicContact NH1-OD2 2.76Å; R718-D729 PolarHBondContact NH1-OD2 3.1Å; E727-D729 PolarHBondContact O-N 3.4Å
730	L	88.9	Confident	86.4	Confident	49 Å²	49	75.6 Å²	75.6	26%	0.257	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	112	179.2	-173.1	66.7	0	0	0	111.1	V707 L732	V707-L730 PolarHBondContact N-O 3.17Å; V707-L730 WeakPolarHBondContact O-CA 3.37Å; V707-L730 VanDerWaalsContact O-CB 3.24Å; V707-L730 WeakPolarHBondContact O-CB 3.41Å; V707-L730 PolarHBondContact O-N 2.91Å; L730-L732 HydrophobicContact CD2-CD2 4.11Å; L730-L732 HydrophobicContact CG-CD2 4.2Å
731	G	93.2	Very high	86.9	Confident	15 Å²	15	74.5 Å²	74.5	16%	0.155	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	128.8	169.1	0	0	0	0	0	111.9	M706	M706-G731 WeakPolarHBondContact SD-CA 3.41Å
732	L	95.8	Very high	87.5	Confident	1 Å²	1	77.5 Å²	77.5	1%	0.005	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	140.5	173.5	-53	176.1	0	0	0	110.1	Y656 L684 H685 P703 Y704 K705 V707 L730	Y656-L732 HydrophobicContact CD1-CD1 3.55Å; Y656-L732 HydrophobicContact CD1-CD2 3.8Å; Y656-L732 HydrophobicContact CD1-CG 4.34Å; Y656-L732 HydrophobicContact CE1-CD1 4.12Å; Y656-L732 HydrophobicContact CE1-CD2 3.96Å; Y656-L732 HydrophobicContact CG-CD1 4.5Å; L684-L732 HydrophobicContact CB-CB 3.74Å; L684-L732 HydrophobicContact CB-CD1 4.35Å; L684-L732 HydrophobicContact CD1-CB 4.25Å; H685-L732 WeakPolarHBondContact O-CA 3.48Å; P703-L732 CarbonylContact C-O 3.51Å; Y704-L732 PolarHBondContact N-O 2.88Å; K705-L732 HydrophobicContact CB-CB 4.38Å; K705-L732 HydrophobicContact CB-CD1 4.49Å; K705-L732 HydrophobicContact CD-CD1 4.38Å; K705-L732 PolarHBondContact N-O 3.23Å; K705-L732 WeakPolarHBondContact O-CB 3.2Å; K705-L732 PolarHBondContact O-N 3.03Å; V707-L732 HydrophobicContact CB-CD1 4.28Å; V707-L732 HydrophobicContact CG2-CD1 3.5Å; V707-L732 VanDerWaalsContact CG2-CD1 3.5Å; V707-L732 HydrophobicContact CG2-CG 4.22Å; L730-L732 HydrophobicContact CD2-CD2 4.11Å; L730-L732 HydrophobicContact CG-CD2 4.2Å
733	F	97	Very high	88.3	Confident	12 Å²	12	75 Å²	75	5%	0.053	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-121.7	145.5	-176.1	-57.4	-90.5	0	0	0	110	L684 H685 R687 W690 V697 P703 Q737	L684-F733 WeakPolarHBondContact CA-O 3.35Å; H685-F733 PolarHBondContact N-O 3.08Å; H685-F733 VanDerWaalsContact N-O 3.08Å; H685-F733 PolarHBondContact O-N 2.74Å; R687-F733 HydrophobicContact CB-CE2 4.5Å; W690-F733 PolarHBondContact NE1-O 2.91Å; V697-F733 HydrophobicContact CB-CD1 4.47Å; V697-F733 HydrophobicContact CB-CG 4.43Å; V697-F733 HydrophobicContact CG1-CD1 3.45Å; V697-F733 VanDerWaalsContact CG1-CD1 3.45Å; V697-F733 HydrophobicContact CG1-CD2 4.34Å; V697-F733 HydrophobicContact CG1-CE1 3.57Å; V697-F733 HydrophobicContact CG1-CE2 4.45Å; V697-F733 HydrophobicContact CG1-CG 3.86Å; V697-F733 HydrophobicContact CG1-CZ 4.09Å; V697-F733 HydrophobicContact CG2-CB 3.95Å; V697-F733 HydrophobicContact CG2-CD1 4.14Å; V697-F733 HydrophobicContact CG2-CD2 3.65Å; V697-F733 HydrophobicContact CG2-CE2 4.17Å; V697-F733 HydrophobicContact CG2-CG 3.63Å; P703-F733 VanDerWaalsContact CA-CE1 3.46Å; P703-F733 HydrophobicContact CB-CD1 4.34Å; P703-F733 HydrophobicContact CB-CE1 3.78Å; P703-F733 HydrophobicContact CB-CE2 4.32Å; P703-F733 HydrophobicContact CB-CZ 3.78Å; P703-F733 HydrophobicContact CG-CE1 4.49Å; P703-F733 HydrophobicContact CG-CZ 4.41Å; F733-Q737 HydrophobicContact CB-CB 4.4Å
734	G	95.4	Very high	89.1	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	32%	0.323	C	S	.	.			trans	-86.5	165	173.1	0	0	0	0	0	112.9	W736 Q737	G734-W736 PolarHBondContact O-N 3.09Å; G734-Q737 VanDerWaalsContact N-OE1 3.12Å; G734-Q737 WeakPolarHBondContact O-CB 3.42Å; G734-Q737 PolarHBondContact O-N 2.86Å
735	Y	95	Very high	90.1	Very high	129 Å²	129	70.5 Å²	70.5	51%	0.506	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-54.1	-40.5	179.1	-179.5	-99.5	0	0	0	112.6	W690 R695 Q737 T738	W690-Y735 HydrophobicContact CH2-CD2 4.06Å; W690-Y735 HydrophobicContact CZ3-CD2 4.08Å; R695-Y735 PolarHBondContact NH1-OH 2.85Å; Y735-Q737 PolarHBondContact O-N 3.07Å; Y735-Q737 VanDerWaalsContact O-N 3.16Å; Y735-T738 PolarHBondContact O-N 3.06Å; Y735-T738 PolarHBondContact O-OG1 2.98Å
736	W	94.2	Very high	91.2	Very high	53 Å²	53	64.7 Å²	64.7	20%	0.201	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-62.9	-17.8	178.6	59.8	92.5	0	0	0	114.7	Y660 H682 L684 R698 Y704 G734	Y660-W736 AromaticContact CD1-CD2 3.81Å; Y660-W736 HydrophobicContact CD1-CD2 3.81Å; Y660-W736 AromaticContact CD1-CE3 3.57Å; Y660-W736 HydrophobicContact CD1-CE3 3.57Å; Y660-W736 HydrophobicContact CD1-CG 4.49Å; Y660-W736 HydrophobicContact CD1-CH2 4.12Å; Y660-W736 HydrophobicContact CD1-CZ2 4.33Å; Y660-W736 AromaticContact CD1-CZ3 3.74Å; Y660-W736 HydrophobicContact CD1-CZ3 3.74Å; Y660-W736 AromaticContact CD2-CD2 3.83Å; Y660-W736 HydrophobicContact CD2-CD2 3.83Å; Y660-W736 AromaticContact CD2-CE2 3.32Å; Y660-W736 HydrophobicContact CD2-CE3 4.24Å; Y660-W736 HydrophobicContact CD2-CG 4.48Å; Y660-W736 AromaticContact CD2-CH2 3.8Å; Y660-W736 HydrophobicContact CD2-CH2 3.8Å; Y660-W736 AromaticContact CD2-CZ2 3.32Å; Y660-W736 HydrophobicContact CD2-CZ2 3.32Å; Y660-W736 HydrophobicContact CD2-CZ3 4.22Å; Y660-W736 AromaticContact CD2-NE1 3.69Å; Y660-W736 HydrophobicContact CE1-CB 4.33Å; Y660-W736 AromaticContact CE1-CD2 3.71Å; Y660-W736 HydrophobicContact CE1-CD2 3.71Å; Y660-W736 AromaticContact CE1-CE3 3.83Å; Y660-W736 HydrophobicContact CE1-CE3 3.83Å; Y660-W736 AromaticContact CE1-CG 3.92Å; Y660-W736 HydrophobicContact CE1-CG 3.92Å; Y660-W736 HydrophobicContact CE1-CZ3 4.45Å; Y660-W736 AromaticContact CE2-CD1 3.66Å; Y660-W736 AromaticContact CE2-CD2 3.74Å; Y660-W736 HydrophobicContact CE2-CD2 3.74Å; Y660-W736 AromaticContact CE2-CE2 3.42Å; Y660-W736 VanDerWaalsContact CE2-CE2 3.42Å; Y660-W736 HydrophobicContact CE2-CE3 4.47Å; Y660-W736 AromaticContact CE2-CG 3.91Å; Y660-W736 HydrophobicContact CE2-CG 3.91Å; Y660-W736 AromaticContact CE2-CZ2 3.94Å; Y660-W736 HydrophobicContact CE2-CZ2 3.94Å; Y660-W736 AromaticContact CE2-NE1 3.33Å; Y660-W736 VanDerWaalsContact CE2-NE1 3.33Å; Y660-W736 AromaticContact CG-CD2 3.87Å; Y660-W736 HydrophobicContact CG-CD2 3.87Å; Y660-W736 AromaticContact CG-CE2 3.72Å; Y660-W736 AromaticContact CG-CE3 3.79Å; Y660-W736 HydrophobicContact CG-CE3 3.79Å; Y660-W736 AromaticContact CG-CH2 3.48Å; Y660-W736 HydrophobicContact CG-CH2 3.48Å; Y660-W736 VanDerWaalsContact CG-CH2 3.48Å; Y660-W736 AromaticContact CG-CZ2 3.55Å; Y660-W736 HydrophobicContact CG-CZ2 3.55Å; Y660-W736 AromaticContact CG-CZ3 3.6Å; Y660-W736 HydrophobicContact CG-CZ3 3.6Å; Y660-W736 AromaticContact CZ-CD1 3.69Å; Y660-W736 AromaticContact CZ-CD2 3.67Å; Y660-W736 AromaticContact CZ-CE2 3.89Å; Y660-W736 AromaticContact CZ-CG 3.59Å; Y660-W736 AromaticContact CZ-NE1 3.85Å; H682-W736 HydrophobicContact CB-CH2 4.21Å; H682-W736 HydrophobicContact CB-CZ3 3.67Å; H682-W736 AromaticContact CG-CZ3 3.77Å; L684-W736 HydrophobicContact CD2-CH2 3.7Å; L684-W736 HydrophobicContact CD2-CZ2 4.3Å; R698-W736 PolarHBondContact NH1-O 2.97Å; R698-W736 VanDerWaalsContact NH1-O 3.09Å; Y704-W736 HydrophobicContact CD1-CH2 4.25Å; Y704-W736 AromaticContact CD1-CZ2 3.84Å; Y704-W736 HydrophobicContact CD1-CZ2 3.84Å; Y704-W736 HydrophobicContact CD2-CZ2 4.11Å; Y704-W736 HydrophobicContact CE1-CH2 4.28Å; Y704-W736 HydrophobicContact CE1-CZ2 4.03Å; Y704-W736 HydrophobicContact CE2-CZ2 4.31Å; Y704-W736 AromaticContact CG-CZ2 3.87Å; Y704-W736 HydrophobicContact CG-CZ2 3.87Å; G734-W736 PolarHBondContact O-N 3.09Å
737	Q	95.9	Very high	92.1	Very high	8 Å²	8	60.7 Å²	60.7	4%	0.037	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-93.5	4.4	177.4	-50.1	-169.3	-87.1	0	0	112.8	R698 E701 V702 F733 G734 Y735	R698-Q737 PolarHBondContact N-O 3.28Å; E701-Q737 HydrophobicContact CB-CB 4.45Å; E701-Q737 HydrophobicContact CG-CB 4.08Å; E701-Q737 PolarHBondContact OE2-NE2 2.85Å; V702-Q737 PolarHBondContact O-NE2 2.87Å; F733-Q737 HydrophobicContact CB-CB 4.4Å; G734-Q737 VanDerWaalsContact N-OE1 3.12Å; G734-Q737 WeakPolarHBondContact O-CB 3.42Å; G734-Q737 PolarHBondContact O-N 2.86Å; Y735-Q737 PolarHBondContact O-N 3.07Å; Y735-Q737 VanDerWaalsContact O-N 3.16Å
738	T	95.9	Very high	92.4	Very high	3 Å²	3	62 Å²	62	2%	0.018	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	140.5	-172.6	65.7	0	0	0	0	112.3	W690 R695 V696 V697 Y735	W690-T738 HydrophobicContact CB-CG2 4.42Å; W690-T738 HydrophobicContact CD2-CG2 3.77Å; W690-T738 HydrophobicContact CE3-CG2 4.38Å; W690-T738 HydrophobicContact CG-CG2 3.77Å; R695-T738 PolarHBondContact NE-OG1 3.07Å; R695-T738 PolarHBondContact NH2-O 3.16Å; V696-T738 CarbonylContact O-C 3.53Å; V696-T738 VanDerWaalsContact O-CA 3.23Å; V696-T738 WeakPolarHBondContact O-CA 3.42Å; V697-T738 HydrophobicContact CG2-CG2 4.14Å; Y735-T738 PolarHBondContact O-N 3.06Å; Y735-T738 PolarHBondContact O-OG1 2.98Å
739	E	95.7	Very high	92.6	Very high	96 Å²	96	58.8 Å²	58.8	45%	0.449	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	162.4	170.8	-75.8	170.7	175.2	0	0	110.1	R695 V696 R698	R695-E739 CarbonylContact C-O 3.55Å; R695-E739 WeakPolarHBondContact CA-O 3.44Å; R695-E739 WeakPolarHBondContact CB-O 3.37Å; V696-E739 PolarHBondContact N-O 3.29Å; V696-E739 PolarHBondContact O-N 3.44Å; R698-E739 VanDerWaalsContact CG-CD 3.49Å; R698-E739 HydrophobicContact CG-CG 3.72Å; R698-E739 IonicContact CZ-OE1 2.65Å; R698-E739 IonicContact NE-OE1 3.65Å; R698-E739 PolarHBondContact NE-OE1 3.11Å; R698-E739 IonicContact NH2-OE1 3.71Å
740	E	94.8	Very high	92.8	Very high	132 Å²	132	61.5 Å²	61.5	62%	0.617	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.6	138.9	174.5	-170.3	165.3	-171	0	0	110.5	Q742	E740-Q742 PolarHBondContact O-N 2.99Å
741	Y	93.9	Very high	92.9	Very high	58 Å²	58	59.4 Å²	59.4	23%	0.227	30%	0.301	C	S	.	.			trans	-67.1	118.7	178.2	174.5	-101.5	0	0	0	109.6	L691 A694 V696 P743 P744 M766	L691-Y741 HydrophobicContact CD1-CD2 3.82Å; L691-Y741 HydrophobicContact CD1-CE2 4.04Å; A694-Y741 VanDerWaalsContact C-CB 3.48Å; A694-Y741 VanDerWaalsContact O-CB 3.25Å; A694-Y741 WeakPolarHBondContact O-CB 3.42Å; A694-Y741 PolarHBondContact O-N 3.11Å; V696-Y741 HydrophobicContact CG2-CD2 3.65Å; V696-Y741 HydrophobicContact CG2-CG 4.4Å; Y741-P743 HydrophobicContact CE1-CB 4.06Å; Y741-P743 VanDerWaalsContact O-CD 3.23Å; Y741-P743 WeakPolarHBondContact O-CD 3.45Å; Y741-P744 WeakPolarHBondContact OH-CD 3.47Å; Y741-M766 HydrophobicContact CD1-CB 4.24Å; Y741-M766 HydrophobicContact CD1-CE 4.11Å; Y741-M766 HydrophobicContact CD1-CG 4.02Å; Y741-M766 HydrophobicContact CE1-CB 4.19Å; Y741-M766 HydrophobicContact CE1-CE 4.09Å; Y741-M766 HydrophobicContact CE1-CG 4.4Å; Y741-M766 HydrophobicContact CG-CE 4.41Å
742	Q	92.4	Very high	92.8	Very high	171 Å²	171	60.5 Å²	60.5	80%	0.799	31%	0.306	S	S	*	.			trans	-84.7	110.6	172.5	-64.9	-179.3	8.4	0	0	108.6	E740	E740-Q742 PolarHBondContact O-N 2.99Å
743	P	92.7	Very high	92.6	Very high	31 Å²	31	67.4 Å²	67.4	20%	0.201	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-66.2	141.7	178.8	25.9	-33.3	0	0	0	111.1	Y741 M767 I769	Y741-P743 HydrophobicContact CE1-CB 4.06Å; Y741-P743 VanDerWaalsContact O-CD 3.23Å; Y741-P743 WeakPolarHBondContact O-CD 3.45Å; P743-M767 WeakPolarHBondContact CB-O 3.45Å; P743-I769 HydrophobicContact CG-CD1 4.21Å; P743-I769 HydrophobicContact CG-CG1 3.95Å
744	P	92.4	Very high	92.3	Very high	49 Å²	49	68.6 Å²	68.6	32%	0.318	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-66.6	148.6	176.9	29.4	-35.9	0	0	0	110.9	Y741 P752 P768 I769	Y741-P744 WeakPolarHBondContact OH-CD 3.47Å; P744-P752 HydrophobicContact CB-CB 3.76Å; P744-P752 HydrophobicContact CB-CG 3.88Å; P744-P752 HydrophobicContact CG-CB 3.52Å; P744-P752 HydrophobicContact CG-CG 3.91Å; P744-P768 HydrophobicContact CG-CB 4.47Å; P744-P768 CarbonylContact O-C 3.52Å; P744-P768 WeakPolarHBondContact O-CA 3.25Å; P744-P768 WeakPolarHBondContact O-CB 3.34Å; P744-I769 PolarHBondContact O-N 2.84Å
745	V	92.2	Very high	92	Very high	88 Å²	88	77.6 Å²	77.6	53%	0.533	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-83	136.6	174	-171.8	0	0	0	0	109.3	P752 I769	V745-P752 WeakPolarHBondContact O-CG 3.33Å; V745-I769 HydrophobicContact CB-CB 4.5Å; V745-I769 HydrophobicContact CG1-CB 4.45Å; V745-I769 HydrophobicContact CG2-CB 4.19Å; V745-I769 HydrophobicContact CG2-CD1 4.18Å
746	A	91.9	Very high	91.7	Very high	21 Å²	21	78.1 Å²	78.1	17%	0.174	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-73.1	136.8	170.8	0	0	0	0	0	110.8	I769	A746-I769 PolarHBondContact N-O 3.17Å
747	V	89.8	Confident	91.5	Very high	92 Å²	92	77 Å²	77	56%	0.558	39%	0.391	S	S	*	.	B	Isolated β-bridge	trans	-134.7	144.6	-177.2	-174.2	0	0	0	0	108.5	G749 K750	V747-G749 PolarHBondContact O-N 3.12Å; V747-K750 PolarHBondContact O-N 3.31Å
748	D	85.7	Confident	91.3	Very high	141 Å²	141	78.6 Å²	78.6	75%	0.754	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	35.5	-179.7	-52.5	-31.5	0	0	0	114.4	K750	D748-K750 PolarHBondContact O-N 3.41Å
749	G	85.3	Confident	91.1	Very high	12 Å²	12	78.9 Å²	78.9	12%	0.124	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.4	15	-179.5	0	0	0	0	0	114.9	V747 C814	V747-G749 PolarHBondContact O-N 3.12Å; G749-C814 PolarHBondContact O-SG 3.44Å
750	K	90	Very high	91	Very high	130 Å²	130	77 Å²	77	57%	0.565	39%	0.391	S	S	*	.	B	Isolated β-bridge	trans	-109	139.2	-179.3	-67.5	167.1	-173	164.2	0	111.8	V747 D748 D789	V747-K750 PolarHBondContact O-N 3.31Å; D748-K750 PolarHBondContact O-N 3.41Å; K750-D789 WeakPolarHBondContact CA-OD2 3.36Å
751	V	92	Very high	90.9	Very high	6 Å²	6	71.1 Å²	71.1	4%	0.036	36%	0.363	C	S	.	.			trans	-84.3	125.5	-179.5	-177.4	0	0	0	0	109.3	R753 V759 D789 V791 I812	V751-R753 VanDerWaalsContact O-CG 3.25Å; V751-R753 WeakPolarHBondContact O-CG 3.48Å; V751-R753 PolarHBondContact O-N 3.02Å; V751-V759 HydrophobicContact CG1-CG2 3.69Å; V751-D789 PolarHBondContact N-OD2 2.82Å; V751-V791 HydrophobicContact CB-CB 4.48Å; V751-V791 HydrophobicContact CB-CG2 3.9Å; V751-V791 HydrophobicContact CG1-CB 4.35Å; V751-V791 HydrophobicContact CG1-CG2 4.25Å; V751-V791 HydrophobicContact CG2-CG2 4.45Å; V751-I812 HydrophobicContact CG1-CB 4.22Å; V751-I812 HydrophobicContact CG1-CG2 3.81Å; V751-I812 HydrophobicContact CG2-CG2 4.49Å
752	P	91.6	Very high	90.8	Very high	37 Å²	37	69.6 Å²	69.6	24%	0.24	36%	0.358	C	S	.	.			trans	-61.1	125.4	176.3	-24	34.6	0	0	0	111.8	P744 V745 V759 P768	P744-P752 HydrophobicContact CB-CB 3.76Å; P744-P752 HydrophobicContact CB-CG 3.88Å; P744-P752 HydrophobicContact CG-CB 3.52Å; P744-P752 HydrophobicContact CG-CG 3.91Å; V745-P752 WeakPolarHBondContact O-CG 3.33Å; P752-V759 WeakPolarHBondContact O-CG2 3.44Å; P752-P768 HydrophobicContact CG-CB 4.29Å
753	R	90.9	Very high	90.7	Very high	146 Å²	146	64 Å²	64	55%	0.551	33%	0.333	S	S	*	.			trans	-110.6	153	-174	-50.8	-175.1	-174.8	177.4	-1.3	112.4	V751 D789 V791	V751-R753 VanDerWaalsContact O-CG 3.25Å; V751-R753 WeakPolarHBondContact O-CG 3.48Å; V751-R753 PolarHBondContact O-N 3.02Å; R753-D789 IonicContact CZ-OD1 3.5Å; R753-D789 IonicContact NE-OD1 2.74Å; R753-D789 IonicContact NH2-OD1 3.58Å; R753-D789 PolarHBondContact NH2-OD1 3.32Å; R753-D789 IonicContact NH2-OD2 3.97Å; R753-V791 HydrophobicContact CG-CG1 4.45Å; R753-V791 HydrophobicContact CG-CG2 4.16Å
754	N	91	Very high	90.7	Very high	37 Å²	37	66.8 Å²	66.8	20%	0.198	35%	0.351	C	S	.	.			trans	-79.6	177.6	168.6	70.9	17.1	0	0	0	112.2	F756 G757 N758 Y760	N754-F756 PolarHBondContact O-N 3.38Å; N754-F756 WeakPolarHBondContact OD1-CA 3.46Å; N754-F756 WeakPolarHBondContact OD1-CB 3.5Å; N754-F756 PolarHBondContact OD1-N 2.79Å; N754-G757 PolarHBondContact O-N 3.42Å; N754-G757 PolarHBondContact OD1-N 3.07Å; N754-N758 PolarHBondContact N-O 3.38Å; N754-N758 PolarHBondContact ND2-O 2.95Å; N754-N758 PolarHBondContact OD1-N 3.41Å; N754-N758 PolarHBondContact OD1-O 3.44Å; N754-N758 VanDerWaalsContact OD1-O 3.05Å; N754-Y760 HydrophobicContact CB-CD2 4.35Å; N754-Y760 HydrophobicContact CB-CE2 4.17Å; N754-Y760 WeakPolarHBondContact ND2-CE1 3.3Å; N754-Y760 VanDerWaalsContact ND2-CE2 3.27Å; N754-Y760 WeakPolarHBondContact ND2-CE2 3.24Å
755	E	89.1	Confident	90.6	Very high	189 Å²	189	67.3 Å²	67.3	88%	0.883	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-22.6	177.4	-62.2	173.8	-173.8	0	0	114.4
756	F	88.3	Confident	90.6	Very high	140 Å²	140	63.2 Å²	63.2	61%	0.614	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	4.8	178.9	-57.1	-77.1	0	0	0	113.3	N754 N758 Y760	N754-F756 PolarHBondContact O-N 3.38Å; N754-F756 WeakPolarHBondContact OD1-CA 3.46Å; N754-F756 WeakPolarHBondContact OD1-CB 3.5Å; N754-F756 PolarHBondContact OD1-N 2.79Å; F756-N758 VanDerWaalsContact C-N 3.3Å; F756-N758 PolarHBondContact O-N 3.2Å; F756-N758 PolarHBondContact O-ND2 3.29Å; F756-Y760 WeakPolarHBondContact CD2-OH 3.47Å; F756-Y760 WeakPolarHBondContact CE2-OH 3.46Å
757	G	89.4	Confident	90.6	Very high	30 Å²	30	64.6 Å²	64.6	31%	0.309	33%	0.334	S	S	.	.	S	Bend	trans	74.1	14.4	-178	0	0	0	0	0	114.9	N754 V791	N754-G757 PolarHBondContact O-N 3.42Å; N754-G757 PolarHBondContact OD1-N 3.07Å; G757-V791 WeakPolarHBondContact O-CG1 3.18Å
758	N	92.4	Very high	90.8	Very high	41 Å²	41	60.3 Å²	60.3	22%	0.219	31%	0.309	C	S	.	.	S	Bend	trans	-116.8	178.2	179	-63.6	-63.8	0	0	0	110.9	N754 F756 I794	N754-N758 PolarHBondContact N-O 3.38Å; N754-N758 PolarHBondContact ND2-O 2.95Å; N754-N758 PolarHBondContact OD1-N 3.41Å; N754-N758 PolarHBondContact OD1-O 3.44Å; N754-N758 VanDerWaalsContact OD1-O 3.05Å; F756-N758 VanDerWaalsContact C-N 3.3Å; F756-N758 PolarHBondContact O-N 3.2Å; F756-N758 PolarHBondContact O-ND2 3.29Å; N758-I794 HydrophobicContact CB-CD1 3.67Å; N758-I794 HydrophobicContact CB-CG1 4.11Å
759	V	92.4	Very high	91.1	Very high	10 Å²	10	58 Å²	58	6%	0.061	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.3	169.6	-169.7	0	0	0	0	109.9	V751 P752 P768 V791 Q792 I794 I812	V751-V759 HydrophobicContact CG1-CG2 3.69Å; P752-V759 WeakPolarHBondContact O-CG2 3.44Å; V759-P768 HydrophobicContact CG1-CG 4.07Å; V759-V791 HydrophobicContact CG2-CB 4.23Å; V759-V791 HydrophobicContact CG2-CG1 3.82Å; V759-Q792 PolarHBondContact N-O 3.3Å; V759-I794 PolarHBondContact O-N 3.36Å; V759-I812 HydrophobicContact CB-CD1 3.69Å; V759-I812 HydrophobicContact CG1-CD1 3.69Å; V759-I812 HydrophobicContact CG2-CD1 4.11Å
760	Y	93	Very high	91.4	Very high	57 Å²	57	59.2 Å²	59.2	22%	0.224	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	120.1	169.7	-68.2	-48	0	0	0	109.8	L691 N754 F756 F762 I794 F797	L691-Y760 HydrophobicContact CD2-CD2 4.42Å; N754-Y760 HydrophobicContact CB-CD2 4.35Å; N754-Y760 HydrophobicContact CB-CE2 4.17Å; N754-Y760 WeakPolarHBondContact ND2-CE1 3.3Å; N754-Y760 VanDerWaalsContact ND2-CE2 3.27Å; N754-Y760 WeakPolarHBondContact ND2-CE2 3.24Å; F756-Y760 WeakPolarHBondContact CD2-OH 3.47Å; F756-Y760 WeakPolarHBondContact CE2-OH 3.46Å; Y760-F762 HydrophobicContact CD1-CE1 4.31Å; Y760-F762 AromaticContact CD1-CE2 3.95Å; Y760-F762 HydrophobicContact CD1-CE2 3.95Å; Y760-F762 AromaticContact CD1-CZ 3.5Å; Y760-F762 HydrophobicContact CD1-CZ 3.5Å; Y760-F762 VanDerWaalsContact CD1-CZ 3.5Å; Y760-F762 HydrophobicContact CD2-CE2 4.42Å; Y760-F762 HydrophobicContact CE1-CZ 4.11Å; Y760-F762 AromaticContact CG-CE2 3.76Å; Y760-F762 HydrophobicContact CG-CE2 3.76Å; Y760-F762 AromaticContact CG-CZ 3.83Å; Y760-F762 HydrophobicContact CG-CZ 3.83Å; Y760-I794 HydrophobicContact CD1-CB 4.13Å; Y760-I794 HydrophobicContact CD1-CD1 4.46Å; Y760-I794 HydrophobicContact CD1-CG2 4.24Å; Y760-I794 HydrophobicContact CE1-CD1 4.19Å; Y760-I794 HydrophobicContact CE1-CG2 4.43Å; Y760-F797 HydrophobicContact CE1-CZ 4.2Å
761	L	92.3	Very high	91.5	Very high	8 Å²	8	53.6 Å²	53.6	4%	0.042	28%	0.284	C	S	.	.			trans	-130.1	60.3	-177.7	-165.2	78.3	0	0	0	109.6	M767 Q773 A793 I794 I812	L761-M767 HydrophobicContact CD1-CB 3.85Å; L761-M767 HydrophobicContact CD1-CE 4.38Å; L761-M767 HydrophobicContact CD1-CG 4.26Å; L761-M767 HydrophobicContact CD2-CE 4.48Å; L761-Q773 HydrophobicContact CD2-CB 4.44Å; L761-Q773 VanDerWaalsContact CD2-CD 3.5Å; L761-Q773 HydrophobicContact CD2-CG 4.1Å; L761-A793 HydrophobicContact CB-CB 4.16Å; L761-A793 HydrophobicContact CD2-CB 4.05Å; L761-I794 PolarHBondContact N-O 2.89Å; L761-I812 HydrophobicContact CB-CD1 4.43Å; L761-I812 HydrophobicContact CD1-CD1 4.14Å; L761-I812 HydrophobicContact CD2-CD1 4.26Å
762	F	91.4	Very high	91.6	Very high	25 Å²	25	54.8 Å²	54.8	11%	0.11	29%	0.292	C	S	.	.	S	Bend	trans	-73.1	-29.8	-178.2	-54.6	-62.6	0	0	0	112.7	M118 K692 Y760 M766 F797	M118-F762 VanDerWaalsContact CE-O 3.28Å; M118-F762 WeakPolarHBondContact CE-O 3.45Å; K692-F762 HydrophobicContact CB-CD2 4.24Å; K692-F762 HydrophobicContact CB-CG 4.26Å; K692-F762 HydrophobicContact CG-CD1 4.32Å; K692-F762 HydrophobicContact CG-CD2 4.07Å; K692-F762 HydrophobicContact CG-CE1 4.32Å; K692-F762 HydrophobicContact CG-CE2 4.03Å; K692-F762 HydrophobicContact CG-CG 4.21Å; K692-F762 HydrophobicContact CG-CZ 4.18Å; K692-F762 VanDerWaalsContact O-CB 3.27Å; K692-F762 WeakPolarHBondContact O-CB 3.39Å; Y760-F762 HydrophobicContact CD1-CE1 4.31Å; Y760-F762 AromaticContact CD1-CE2 3.95Å; Y760-F762 HydrophobicContact CD1-CE2 3.95Å; Y760-F762 AromaticContact CD1-CZ 3.5Å; Y760-F762 HydrophobicContact CD1-CZ 3.5Å; Y760-F762 VanDerWaalsContact CD1-CZ 3.5Å; Y760-F762 HydrophobicContact CD2-CE2 4.42Å; Y760-F762 HydrophobicContact CE1-CZ 4.11Å; Y760-F762 AromaticContact CG-CE2 3.76Å; Y760-F762 HydrophobicContact CG-CE2 3.76Å; Y760-F762 AromaticContact CG-CZ 3.83Å; Y760-F762 HydrophobicContact CG-CZ 3.83Å; F762-M766 HydrophobicContact CB-SD 3.89Å; F762-M766 HydrophobicContact CD2-CE 4.01Å; F762-M766 HydrophobicContact CD2-SD 3.75Å; F762-M766 HydrophobicContact CG-SD 4.28Å; F762-F797 HydrophobicContact CE1-CD2 4.43Å; F762-F797 HydrophobicContact CE1-CE2 4.02Å; F762-F797 HydrophobicContact CZ-CE2 4.08Å
763	L	91.4	Very high	91.6	Very high	55 Å²	55	55.8 Å²	55.8	29%	0.288	29%	0.293	S	S	.	.	S	Bend	trans	-133	152.2	174	-72.4	171.8	0	0	0	109.4	M118 A694 S765 M766	M118-L763 HydrophobicContact CE-CD2 3.83Å; M118-L763 HydrophobicContact SD-CD2 3.95Å; A694-L763 HydrophobicContact CB-CB 4.29Å; A694-L763 HydrophobicContact CB-CD1 3.74Å; L763-S765 PolarHBondContact O-N 3.32Å; L763-S765 VanDerWaalsContact O-N 3.15Å; L763-M766 HydrophobicContact CB-CG 4.42Å; L763-M766 WeakPolarHBondContact O-CB 3.46Å; L763-M766 PolarHBondContact O-N 3.32Å
764	P	91.4	Very high	91.7	Very high	89 Å²	89	49.7 Å²	49.7	58%	0.578	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-56.1	-30.7	178.2	-27	35.4	0	0	0	114.2	M118 M766 M767	M118-P764 HydrophobicContact SD-CG 4.33Å; P764-M766 PolarHBondContact O-N 2.98Å; P764-M767 WeakPolarHBondContact O-CB 3.46Å; P764-M767 PolarHBondContact O-N 3.45Å
765	S	91.5	Very high	91.7	Very high	60 Å²	60	52 Å²	52	42%	0.42	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-68	-13.1	176.8	52.8	0	0	0	0	114.7	L763 M767	L763-S765 PolarHBondContact O-N 3.32Å; L763-S765 VanDerWaalsContact O-N 3.15Å; S765-M767 VanDerWaalsContact C-N 3.29Å
766	M	92.3	Very high	91.6	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.01	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-84.2	-2.1	176.1	-59.4	-172.7	70.3	0	0	113.5	L691 A694 Y741 F762 L763 P764	L691-M766 HydrophobicContact CD1-CE 3.86Å; L691-M766 HydrophobicContact CG-CE 4.2Å; L691-M766 WeakPolarHBondContact O-CE 3.35Å; A694-M766 HydrophobicContact CB-CG 3.58Å; A694-M766 HydrophobicContact CB-SD 4.06Å; Y741-M766 HydrophobicContact CD1-CB 4.24Å; Y741-M766 HydrophobicContact CD1-CE 4.11Å; Y741-M766 HydrophobicContact CD1-CG 4.02Å; Y741-M766 HydrophobicContact CE1-CB 4.19Å; Y741-M766 HydrophobicContact CE1-CE 4.09Å; Y741-M766 HydrophobicContact CE1-CG 4.4Å; Y741-M766 HydrophobicContact CG-CE 4.41Å; F762-M766 HydrophobicContact CB-SD 3.89Å; F762-M766 HydrophobicContact CD2-CE 4.01Å; F762-M766 HydrophobicContact CD2-SD 3.75Å; F762-M766 HydrophobicContact CG-SD 4.28Å; L763-M766 HydrophobicContact CB-CG 4.42Å; L763-M766 WeakPolarHBondContact O-CB 3.46Å; L763-M766 PolarHBondContact O-N 3.32Å; P764-M766 PolarHBondContact O-N 2.98Å
767	M	91.8	Very high	91.5	Very high	49 Å²	49	42 Å²	42	24%	0.241	25%	0.247	C	C	.	.	S	Bend	trans	-63.3	128.5	-179.3	-163.8	170.8	-56.3	0	0	110.5	P743 L761 P764 S765 I769 C771 Q773	P743-M767 WeakPolarHBondContact CB-O 3.45Å; L761-M767 HydrophobicContact CD1-CB 3.85Å; L761-M767 HydrophobicContact CD1-CE 4.38Å; L761-M767 HydrophobicContact CD1-CG 4.26Å; L761-M767 HydrophobicContact CD2-CE 4.48Å; P764-M767 WeakPolarHBondContact O-CB 3.46Å; P764-M767 PolarHBondContact O-N 3.45Å; S765-M767 VanDerWaalsContact C-N 3.29Å; M767-I769 PolarHBondContact O-N 2.9Å; M767-C771 VanDerWaalsContact SD-O 3.36Å; M767-Q773 HydrophobicContact CE-CB 3.84Å
768	P	93.4	Very high	91.2	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.013	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-54.9	137.8	174.4	-26.3	35.1	0	0	0	111.6	P744 P752 V759 G770 C771	P744-P768 HydrophobicContact CG-CB 4.47Å; P744-P768 CarbonylContact O-C 3.52Å; P744-P768 WeakPolarHBondContact O-CA 3.25Å; P744-P768 WeakPolarHBondContact O-CB 3.34Å; P752-P768 HydrophobicContact CG-CB 4.29Å; V759-P768 HydrophobicContact CG1-CG 4.07Å; P768-G770 PolarHBondContact O-N 3.32Å; P768-C771 HydrophobicContact CB-CB 4.17Å; P768-C771 WeakPolarHBondContact O-CB 3.44Å; P768-C771 PolarHBondContact O-N 2.84Å
769	I	92.5	Very high	91	Very high	94 Å²	94	43.3 Å²	43.3	48%	0.482	25%	0.247	S	C	.	.	B	Isolated β-bridge	trans	-69	128.2	-176.9	-58.6	171	0	0	0	108.4	P743 P744 V745 A746 M767	P743-I769 HydrophobicContact CG-CD1 4.21Å; P743-I769 HydrophobicContact CG-CG1 3.95Å; P744-I769 PolarHBondContact O-N 2.84Å; V745-I769 HydrophobicContact CB-CB 4.5Å; V745-I769 HydrophobicContact CG1-CB 4.45Å; V745-I769 HydrophobicContact CG2-CB 4.19Å; V745-I769 HydrophobicContact CG2-CD1 4.18Å; A746-I769 PolarHBondContact N-O 3.17Å; M767-I769 PolarHBondContact O-N 2.9Å
770	G	91.2	Very high	90.8	Very high	37 Å²	37	45.7 Å²	45.7	38%	0.381	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	10.8	-172.2	0	0	0	0	0	114.5	P768 C814 E815	P768-G770 PolarHBondContact O-N 3.32Å; G770-C814 CarbonylContact O-C 3.41Å; G770-C814 WeakPolarHBondContact O-CA 3.32Å; G770-E815 PolarHBondContact O-N 3.09Å
771	C	92.9	Very high	90.6	Very high	11 Å²	11	48.8 Å²	48.8	7%	0.074	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	158.6	173	-70.4	0	0	0	0	112.9	M767 P768 I812 V813	M767-C771 VanDerWaalsContact SD-O 3.36Å; P768-C771 HydrophobicContact CB-CB 4.17Å; P768-C771 WeakPolarHBondContact O-CB 3.44Å; P768-C771 PolarHBondContact O-N 2.84Å; C771-I812 HydrophobicContact CB-CG2 3.51Å; C771-V813 CarbonylContact C-O 3.52Å; C771-V813 WeakPolarHBondContact CA-O 3.27Å
772	V	92.6	Very high	90.5	Very high	32 Å²	32	48.7 Å²	48.7	19%	0.194	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	140.9	176.2	179.1	0	0	0	0	109.7	L774 V813 E815 K818	V772-L774 HydrophobicContact CG1-CD2 4.35Å; V772-V813 PolarHBondContact N-O 2.83Å; V772-V813 PolarHBondContact O-N 3.28Å; V772-V813 VanDerWaalsContact O-N 3.16Å; V772-E815 HydrophobicContact CG2-CB 4.01Å; V772-E815 HydrophobicContact CG2-CG 3.98Å; V772-K818 HydrophobicContact CG1-CD 4.37Å; V772-K818 HydrophobicContact CG2-CD 4.43Å
773	Q	93.3	Very high	90.5	Very high	58 Å²	58	47.6 Å²	47.6	27%	0.271	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	130.1	172.3	-170.9	-171.7	7.1	0	0	110.8	L761 M767 N775 D809 Y811	L761-Q773 HydrophobicContact CD2-CB 4.44Å; L761-Q773 VanDerWaalsContact CD2-CD 3.5Å; L761-Q773 HydrophobicContact CD2-CG 4.1Å; M767-Q773 HydrophobicContact CE-CB 3.84Å; Q773-N775 WeakPolarHBondContact CG-OD1 3.27Å; Q773-N775 PolarHBondContact NE2-OD1 3.16Å; Q773-D809 PolarHBondContact NE2-O 3.05Å; Q773-Y811 CarbonylContact C-O 3.58Å; Q773-Y811 WeakPolarHBondContact CA-O 3.3Å
774	L	92	Very high	90.5	Very high	17 Å²	17	51.1 Å²	51.1	9%	0.089	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	109.1	178.9	-65.2	176.7	0	0	0	110.9	V772 L776 L779 G810 Y811 K818 L821 L822	V772-L774 HydrophobicContact CG1-CD2 4.35Å; L774-L776 VanDerWaalsContact C-N 3.3Å; L774-L776 PolarHBondContact O-N 3.23Å; L774-L776 VanDerWaalsContact O-N 3.12Å; L774-L779 HydrophobicContact CB-CD2 3.57Å; L774-L779 HydrophobicContact CD1-CD2 4Å; L774-L779 HydrophobicContact CG-CD2 4.46Å; L774-G810 WeakPolarHBondContact O-CA 3.46Å; L774-Y811 PolarHBondContact N-O 3.29Å; L774-Y811 PolarHBondContact O-N 2.86Å; L774-K818 HydrophobicContact CD2-CG 4.48Å; L774-L821 HydrophobicContact CD1-CD2 3.81Å; L774-L822 HydrophobicContact CD2-CD2 4.47Å
775	N	90.5	Very high	90.4	Very high	85 Å²	85	52.3 Å²	52.3	46%	0.455	27%	0.269	S	S	.	.			trans	-90.6	61	-177.9	-65.9	16.9	0	0	0	111	Q773 D809 G810	Q773-N775 WeakPolarHBondContact CG-OD1 3.27Å; Q773-N775 PolarHBondContact NE2-OD1 3.16Å; N775-D809 PolarHBondContact ND2-OD1 2.72Å; N775-D809 VanDerWaalsContact ND2-OD1 3.15Å; N775-D809 PolarHBondContact ND2-OD2 3.05Å; N775-G810 WeakPolarHBondContact OD1-CA 3.3Å
776	L	87.7	Confident	90.4	Very high	39 Å²	39	52.9 Å²	52.9	20%	0.204	27%	0.267	C	S	.	.			trans	-113.4	134.2	-177.6	-61.5	175.2	0	0	0	112.1	L774 L779 L822 W825	L774-L776 VanDerWaalsContact C-N 3.3Å; L774-L776 PolarHBondContact O-N 3.23Å; L774-L776 VanDerWaalsContact O-N 3.12Å; L776-L779 HydrophobicContact CB-CB 4.22Å; L776-L779 HydrophobicContact CB-CD1 4.21Å; L776-L779 HydrophobicContact CB-CD2 4.25Å; L776-L779 HydrophobicContact CB-CG 4.48Å; L776-L779 HydrophobicContact CD1-CD1 4.06Å; L776-L779 WeakPolarHBondContact O-CB 3.47Å; L776-L822 HydrophobicContact CD1-CD2 3.59Å; L776-W825 HydrophobicContact CB-CD2 4.46Å; L776-W825 HydrophobicContact CB-CZ2 4.31Å; L776-W825 HydrophobicContact CD1-CD2 4.04Å; L776-W825 HydrophobicContact CD1-CE3 4.27Å; L776-W825 HydrophobicContact CD1-CG 4.25Å; L776-W825 HydrophobicContact CD2-CH2 4.11Å; L776-W825 HydrophobicContact CD2-CZ2 4.13Å; L776-W825 HydrophobicContact CD2-CZ3 4.34Å
777	P	86.4	Confident	90.3	Very high	81 Å²	81	60.2 Å²	60.2	53%	0.526	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	141.9	179.5	28.4	-35.3	0	0	0	111.1	L779 W825	P777-L779 PolarHBondContact O-N 3.43Å; P777-L779 VanDerWaalsContact O-N 3.12Å; P777-W825 HydrophobicContact CG-CZ2 4.01Å; P777-W825 PolarHBondContact O-NE1 2.96Å
778	N	82.7	Confident	90.3	Very high	98 Å²	98	58.7 Å²	58.7	52%	0.524	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.6	15.2	178.5	-57.4	-28.3	0	0	0	115.6	H780 R781	N778-H780 VanDerWaalsContact C-N 3.32Å; N778-H780 PolarHBondContact O-N 3.44Å; N778-R781 VanDerWaalsContact O-CB 3.29Å; N778-R781 WeakPolarHBondContact O-CB 3.4Å; N778-R781 PolarHBondContact O-N 3.45Å
779	L	88.7	Confident	90.2	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59	-39.3	-175.8	-166.9	66.3	0	0	0	113.2	L774 L776 P777 R781 V782 A783 Y811 L821 W825	L774-L779 HydrophobicContact CB-CD2 3.57Å; L774-L779 HydrophobicContact CD1-CD2 4Å; L774-L779 HydrophobicContact CG-CD2 4.46Å; L776-L779 HydrophobicContact CB-CB 4.22Å; L776-L779 HydrophobicContact CB-CD1 4.21Å; L776-L779 HydrophobicContact CB-CD2 4.25Å; L776-L779 HydrophobicContact CB-CG 4.48Å; L776-L779 HydrophobicContact CD1-CD1 4.06Å; L776-L779 WeakPolarHBondContact O-CB 3.47Å; P777-L779 PolarHBondContact O-N 3.43Å; P777-L779 VanDerWaalsContact O-N 3.12Å; L779-R781 PolarHBondContact O-N 2.95Å; L779-R781 VanDerWaalsContact O-N 3.17Å; L779-V782 WeakPolarHBondContact O-CA 3.25Å; L779-V782 WeakPolarHBondContact O-CB 3.34Å; L779-V782 PolarHBondContact O-N 3.26Å; L779-A783 PolarHBondContact O-N 3.2Å; L779-Y811 HydrophobicContact CB-CD2 3.7Å; L779-Y811 HydrophobicContact CB-CE2 3.9Å; L779-Y811 HydrophobicContact CD2-CD2 4.13Å; L779-Y811 HydrophobicContact CG-CD2 4.48Å; L779-L821 HydrophobicContact CD1-CD2 3.7Å; L779-L821 HydrophobicContact CD1-CG 3.89Å; L779-L821 HydrophobicContact CD2-CD2 3.68Å; L779-L821 HydrophobicContact CG-CD2 3.69Å; L779-L821 HydrophobicContact CG-CG 4.32Å; L779-W825 HydrophobicContact CD1-CB 3.91Å; L779-W825 HydrophobicContact CD1-CG 3.94Å
780	H	87.4	Confident	90.1	Very high	60 Å²	60	56 Å²	56	28%	0.278	29%	0.287	S	S	.	.	H	α-helix	trans	-55.8	-30.8	173.1	175.4	-104	0	0	0	113.6	N778 R784 Y811	N778-H780 VanDerWaalsContact C-N 3.32Å; N778-H780 PolarHBondContact O-N 3.44Å; H780-R784 PolarHBondContact CE1-NE 2.69Å; H780-R784 WeakPolarHBondContact O-CB 3.24Å; H780-R784 VanDerWaalsContact O-CG 3.3Å; H780-R784 WeakPolarHBondContact O-CG 3.45Å; H780-R784 PolarHBondContact O-N 2.91Å; H780-Y811 HydrophobicContact CB-CD1 4.21Å; H780-Y811 HydrophobicContact CB-CE1 3.49Å; H780-Y811 VanDerWaalsContact CB-CE1 3.49Å
781	R	88.7	Confident	90.2	Very high	123 Å²	123	54.6 Å²	54.6	46%	0.464	27%	0.27	S	S	.	.	H	α-helix	trans	-70.3	-34.3	174.2	-173.4	-177.8	-178.1	157.8	6.7	111.9	D459 N778 L779 K785	D459-R781 IonicContact OD2-NH1 3.59Å; N778-R781 VanDerWaalsContact O-CB 3.29Å; N778-R781 WeakPolarHBondContact O-CB 3.4Å; N778-R781 PolarHBondContact O-N 3.45Å; L779-R781 PolarHBondContact O-N 2.95Å; L779-R781 VanDerWaalsContact O-N 3.17Å; R781-K785 WeakPolarHBondContact O-CG 3.25Å
782	V	90.6	Very high	90.2	Very high	6 Å²	6	57.4 Å²	57.4	4%	0.036	28%	0.282	C	S	.	.	H	α-helix	trans	-73.7	-45.5	176.4	-176.8	0	0	0	0	109.8	L779 R784 K785 L786 A824 W825 E828	L779-V782 WeakPolarHBondContact O-CA 3.25Å; L779-V782 WeakPolarHBondContact O-CB 3.34Å; L779-V782 PolarHBondContact O-N 3.26Å; V782-R784 PolarHBondContact O-N 2.88Å; V782-K785 WeakPolarHBondContact O-CB 3.19Å; V782-K785 PolarHBondContact O-N 3.18Å; V782-L786 HydrophobicContact CG1-CD1 4.43Å; V782-L786 PolarHBondContact O-N 3Å; V782-A824 HydrophobicContact CG1-CB 3.64Å; V782-W825 HydrophobicContact CG1-CB 4.49Å; V782-W825 HydrophobicContact CG2-CB 4.42Å; V782-E828 HydrophobicContact CG2-CB 3.95Å; V782-E828 HydrophobicContact CG2-CG 4.08Å
783	A	91.2	Very high	90.2	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.008	27%	0.273	C	S	.	.	H	α-helix	trans	-55.4	-47.8	175.1	0	0	0	0	0	112.4	L779 K785 L786 D787 I788 C790 L821	L779-A783 PolarHBondContact O-N 3.2Å; A783-K785 PolarHBondContact O-N 2.89Å; A783-K785 VanDerWaalsContact O-N 3.11Å; A783-L786 PolarHBondContact O-N 3Å; A783-D787 PolarHBondContact O-N 2.83Å; A783-D787 VanDerWaalsContact O-N 3.12Å; A783-I788 PolarHBondContact O-N 3.11Å; A783-C790 HydrophobicContact CB-CB 3.33Å; A783-L821 HydrophobicContact CB-CD1 3.87Å
784	R	90.8	Very high	90.2	Very high	129 Å²	129	53.5 Å²	53.5	49%	0.487	26%	0.262	S	S	.	.	H	α-helix	trans	-62.2	-12.9	175	-74.6	-165.8	-58.8	171.7	7.7	115	D457 H780 V782	D457-R784 IonicContact OD2-CZ 2.75Å; D457-R784 IonicContact OD2-NH1 3.68Å; D457-R784 PolarHBondContact OD2-NH1 3.3Å; D457-R784 IonicContact OD2-NH2 2.96Å; D457-R784 PolarHBondContact OD2-NH2 2.99Å; H780-R784 PolarHBondContact CE1-NE 2.69Å; H780-R784 WeakPolarHBondContact O-CB 3.24Å; H780-R784 VanDerWaalsContact O-CG 3.3Å; H780-R784 WeakPolarHBondContact O-CG 3.45Å; H780-R784 PolarHBondContact O-N 2.91Å; V782-R784 PolarHBondContact O-N 2.88Å
785	K	90.8	Very high	90.2	Very high	114 Å²	114	54.8 Å²	54.8	50%	0.496	27%	0.271	S	S	.	.	H	α-helix	trans	-92.4	-14.3	172.5	-69	-177.5	-169.6	-172.1	0	113.5	R781 V782 A783 E828	R781-K785 WeakPolarHBondContact O-CG 3.25Å; V782-K785 WeakPolarHBondContact O-CB 3.19Å; V782-K785 PolarHBondContact O-N 3.18Å; A783-K785 PolarHBondContact O-N 2.89Å; A783-K785 VanDerWaalsContact O-N 3.11Å; K785-E828 IonicContact NZ-OE1 3.68Å; K785-E828 PolarHBondContact NZ-OE1 3.41Å; K785-E828 IonicContact NZ-OE2 2.66Å; K785-E828 PolarHBondContact NZ-OE2 2.92Å
786	L	90.4	Very high	90.3	Very high	72 Å²	72	51.7 Å²	51.7	38%	0.377	26%	0.259	S	S	.	.	H	α-helix	trans	-112.6	1.8	-176.5	-63.3	178.4	0	0	0	112.3	V782 A783 I788 V820 L821 A824	V782-L786 HydrophobicContact CG1-CD1 4.43Å; V782-L786 PolarHBondContact O-N 3Å; A783-L786 PolarHBondContact O-N 3Å; L786-I788 HydrophobicContact CB-CD1 3.68Å; L786-I788 HydrophobicContact CB-CG1 3.9Å; L786-I788 HydrophobicContact CD1-CD1 3.73Å; L786-I788 HydrophobicContact CG-CD1 4.4Å; L786-I788 PolarHBondContact O-N 2.82Å; L786-V820 HydrophobicContact CD1-CG1 4.37Å; L786-L821 HydrophobicContact CD1-CD1 4.46Å; L786-A824 HydrophobicContact CD1-CB 3.53Å
787	D	90.4	Very high	90.5	Very high	156 Å²	156	53.2 Å²	53.2	83%	0.834	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	30.2	-172.8	-60	-37.4	0	0	0	114.2	A783	A783-D787 PolarHBondContact O-N 2.83Å; A783-D787 VanDerWaalsContact O-N 3.12Å
788	I	91.7	Very high	90.7	Very high	18 Å²	18	53.2 Å²	53.2	9%	0.092	26%	0.26	C	S	.	.			trans	-87.4	134	175.9	-65.7	166.5	0	0	0	109.8	A783 L786 C790 V813 F817 V820 L821	A783-I788 PolarHBondContact O-N 3.11Å; L786-I788 HydrophobicContact CB-CD1 3.68Å; L786-I788 HydrophobicContact CB-CG1 3.9Å; L786-I788 HydrophobicContact CD1-CD1 3.73Å; L786-I788 HydrophobicContact CG-CD1 4.4Å; L786-I788 PolarHBondContact O-N 2.82Å; I788-C790 PolarHBondContact O-N 3.45Å; I788-V813 HydrophobicContact CG2-CG1 3.87Å; I788-F817 HydrophobicContact CD1-CB 4.2Å; I788-F817 HydrophobicContact CD1-CD1 4.24Å; I788-F817 HydrophobicContact CD1-CG 4.37Å; I788-F817 HydrophobicContact CG1-CB 4.48Å; I788-F817 HydrophobicContact CG1-CD1 4.12Å; I788-F817 HydrophobicContact CG1-CG 4.21Å; I788-F817 HydrophobicContact CG2-CB 3.74Å; I788-F817 HydrophobicContact CG2-CD2 3.85Å; I788-F817 HydrophobicContact CG2-CG 3.81Å; I788-V820 HydrophobicContact CD1-CG1 4.2Å; I788-L821 HydrophobicContact CB-CD1 4.36Å; I788-L821 HydrophobicContact CD1-CD1 3.94Å; I788-L821 HydrophobicContact CG2-CD1 4.26Å
789	D	91.9	Very high	90.9	Very high	27 Å²	27	55.6 Å²	55.6	14%	0.144	27%	0.266	C	S	.	.			trans	-69.4	123.5	175.7	-168.1	22.4	0	0	0	111.6	K750 V751 R753	K750-D789 WeakPolarHBondContact CA-OD2 3.36Å; V751-D789 PolarHBondContact N-OD2 2.82Å; R753-D789 IonicContact CZ-OD1 3.5Å; R753-D789 IonicContact NE-OD1 2.74Å; R753-D789 IonicContact NH2-OD1 3.58Å; R753-D789 PolarHBondContact NH2-OD1 3.32Å; R753-D789 IonicContact NH2-OD2 3.97Å
790	C	90.9	Very high	90.7	Very high	13 Å²	13	60.3 Å²	60.3	9%	0.088	29%	0.288	C	S	.	.			trans	-146.2	108.8	-171.3	176.4	0	0	0	0	109.6	A783 I788 Y811 V813	A783-C790 HydrophobicContact CB-CB 3.33Å; I788-C790 PolarHBondContact O-N 3.45Å; C790-Y811 VanDerWaalsContact SG-CB 3.6Å; C790-V813 HydrophobicContact CB-CG2 4.04Å
791	V	92.5	Very high	90.2	Very high	6 Å²	6	61 Å²	61	4%	0.036	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	145.3	-169	-175.4	0	0	0	0	110.5	V751 R753 G757 V759 Y811 I812	V751-V791 HydrophobicContact CB-CB 4.48Å; V751-V791 HydrophobicContact CB-CG2 3.9Å; V751-V791 HydrophobicContact CG1-CB 4.35Å; V751-V791 HydrophobicContact CG1-CG2 4.25Å; V751-V791 HydrophobicContact CG2-CG2 4.45Å; R753-V791 HydrophobicContact CG-CG1 4.45Å; R753-V791 HydrophobicContact CG-CG2 4.16Å; G757-V791 WeakPolarHBondContact O-CG1 3.18Å; V759-V791 HydrophobicContact CG2-CB 4.23Å; V759-V791 HydrophobicContact CG2-CG1 3.82Å; V791-Y811 CarbonylContact O-C 3.52Å; V791-Y811 VanDerWaalsContact O-CA 3.27Å; V791-Y811 WeakPolarHBondContact O-CA 3.38Å; V791-I812 PolarHBondContact N-O 3.22Å; V791-I812 PolarHBondContact O-N 3.49Å
792	Q	92.7	Very high	89.8	Confident	70 Å²	70	58.6 Å²	58.6	33%	0.327	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	132.9	178	-72.2	175.3	63.2	0	0	111.3	V759 T808 Y811	V759-Q792 PolarHBondContact N-O 3.3Å; Q792-T808 HydrophobicContact CB-CG2 4.15Å; Q792-Y811 HydrophobicContact CG-CD1 3.78Å; Q792-Y811 HydrophobicContact CG-CE1 3.43Å; Q792-Y811 VanDerWaalsContact CG-CE1 3.43Å
793	A	93.3	Very high	89.3	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	117.1	172.1	0	0	0	0	0	109.9	L761 T808 D809 G810 I812	L761-A793 HydrophobicContact CB-CB 4.16Å; L761-A793 HydrophobicContact CD2-CB 4.05Å; A793-T808 VanDerWaalsContact O-CA 3.24Å; A793-T808 WeakPolarHBondContact O-CA 3.47Å; A793-D809 PolarHBondContact O-N 3.31Å; A793-D809 VanDerWaalsContact O-N 3.08Å; A793-G810 PolarHBondContact N-O 3.2Å; A793-I812 HydrophobicContact CB-CD1 4.11Å; A793-I812 HydrophobicContact CB-CG1 3.87Å
794	I	93.6	Very high	89.1	Confident	8 Å²	8	69.2 Å²	69.2	4%	0.041	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	109.9	169.9	-60.8	174.2	0	0	0	107.9	N758 V759 Y760 L761 G796 F797 P806 V807 T808	N758-I794 HydrophobicContact CB-CD1 3.67Å; N758-I794 HydrophobicContact CB-CG1 4.11Å; V759-I794 PolarHBondContact O-N 3.36Å; Y760-I794 HydrophobicContact CD1-CB 4.13Å; Y760-I794 HydrophobicContact CD1-CD1 4.46Å; Y760-I794 HydrophobicContact CD1-CG2 4.24Å; Y760-I794 HydrophobicContact CE1-CD1 4.19Å; Y760-I794 HydrophobicContact CE1-CG2 4.43Å; L761-I794 PolarHBondContact N-O 2.89Å; I794-G796 WeakPolarHBondContact CG2-O 3.23Å; I794-F797 HydrophobicContact CG2-CE2 4.31Å; I794-F797 HydrophobicContact CG2-CZ 4.25Å; I794-P806 HydrophobicContact CD1-CB 4.07Å; I794-P806 HydrophobicContact CG1-CB 4.23Å; I794-P806 HydrophobicContact CG2-CB 3.99Å; I794-V807 WeakPolarHBondContact CA-O 3.29Å; I794-T808 HydrophobicContact CG1-CG2 4.15Å
795	T	91.8	Very high	89	Confident	45 Å²	45	66.8 Å²	66.8	28%	0.276	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	-16.5	179.8	54.1	0	0	0	0	113.2	V807 D809	T795-V807 PolarHBondContact N-O 2.99Å; T795-D809 HydrophobicContact CG2-CB 3.81Å
796	G	92.1	Very high	89.1	Confident	20 Å²	20	64.7 Å²	64.7	21%	0.206	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-171.6	-169	-179.2	0	0	0	0	0	113.7	I794 V807	I794-G796 WeakPolarHBondContact CG2-O 3.23Å; G796-V807 PolarHBondContact O-N 3.44Å
797	F	91.5	Very high	89.2	Confident	71 Å²	71	64.1 Å²	64.1	31%	0.311	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	127.9	175.5	-68.5	-92.1	0	0	0	109.9	Y760 F762 I794 F799 H805 P806	Y760-F797 HydrophobicContact CE1-CZ 4.2Å; F762-F797 HydrophobicContact CE1-CD2 4.43Å; F762-F797 HydrophobicContact CE1-CE2 4.02Å; F762-F797 HydrophobicContact CZ-CE2 4.08Å; I794-F797 HydrophobicContact CG2-CE2 4.31Å; I794-F797 HydrophobicContact CG2-CZ 4.25Å; F797-F799 HydrophobicContact CB-CE2 4.23Å; F797-F799 HydrophobicContact CB-CZ 4.31Å; F797-H805 CarbonylContact C-O 3.5Å; F797-H805 VanDerWaalsContact CA-O 3.28Å; F797-H805 WeakPolarHBondContact CA-O 3.27Å; F797-P806 HydrophobicContact CD1-CB 4.22Å; F797-P806 HydrophobicContact CE1-CB 4.01Å
798	D	91.9	Very high	89.3	Confident	81 Å²	81	59.9 Å²	59.9	43%	0.433	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	151.1	172.8	-166.9	-9.1	0	0	0	109.7	H800 S804 H805 V807	D798-H800 IonicContact OD2-CD2 3.32Å; D798-H800 PolarHBondContact OD2-CD2 3.33Å; D798-H800 VanDerWaalsContact OD2-CD2 3.24Å; D798-S804 CarbonylContact O-C 3.05Å; D798-S804 WeakPolarHBondContact O-CA 3.34Å; D798-H805 PolarHBondContact N-O 2.9Å; D798-H805 PolarHBondContact O-N 2.8Å; D798-V807 HydrophobicContact CB-CG2 3.94Å
799	F	85.8	Confident	89.1	Confident	147 Å²	147	62.8 Å²	62.8	65%	0.645	36%	0.361	S	S	*	.			trans	-121.2	40.6	-173.1	-66.5	-85.8	0	0	0	112.6	F797 Y803 S804	F797-F799 HydrophobicContact CB-CE2 4.23Å; F797-F799 HydrophobicContact CB-CZ 4.31Å; F799-Y803 CarbonylContact C-O 3.55Å; F799-Y803 WeakPolarHBondContact CA-O 3.39Å; F799-S804 VanDerWaalsContact CE1-OG 3.28Å; F799-S804 WeakPolarHBondContact CE1-OG 3.22Å
800	H	84.8	Confident	89.1	Confident	100 Å²	100	62.2 Å²	62.2	46%	0.463	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-84.5	151	176.4	64.3	42.3	0	0	0	113.4	D798 G802 Y803 H805	D798-H800 IonicContact OD2-CD2 3.32Å; D798-H800 PolarHBondContact OD2-CD2 3.33Å; D798-H800 VanDerWaalsContact OD2-CD2 3.24Å; H800-G802 PolarHBondContact O-N 3.09Å; H800-Y803 PolarHBondContact O-N 2.83Å; H800-H805 AromaticContact CE1-CD2 3.2Å; H800-H805 PolarHBondContact CE1-CD2 3.41Å; H800-H805 AromaticContact CE1-CE1 4Å; H800-H805 AromaticContact CE1-CG 3.55Å; H800-H805 AromaticContact CE1-NE2 3.52Å; H800-H805 AromaticContact ND1-CD2 3.29Å; H800-H805 PolarHBondContact ND1-CD2 2.87Å; H800-H805 VanDerWaalsContact ND1-CD2 3.29Å; H800-H805 AromaticContact ND1-NE2 3.55Å
801	G	77.5	Confident	89.1	Confident	75 Å²	75	63.6 Å²	63.6	77%	0.773	37%	0.365	S	S	*	.	G	3₁₀ helix	trans	70.2	11.3	174.5	0	0	0	0	0	115.7	Y803	G801-Y803 WeakPolarHBondContact O-CD2 3.46Å
802	G	79.4	Confident	89.2	Confident	71 Å²	71	63.3 Å²	63.3	73%	0.732	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	83.9	6.8	179.8	0	0	0	0	0	115	H800	H800-G802 PolarHBondContact O-N 3.09Å
803	Y	80.7	Confident	89.2	Confident	171 Å²	171	60 Å²	60	67%	0.671	35%	0.348	S	S	*	.	S	Bend	trans	-126.2	163.9	175.6	-63.6	-82.8	0	0	0	110.1	F799 H800 G801	F799-Y803 CarbonylContact C-O 3.55Å; F799-Y803 WeakPolarHBondContact CA-O 3.39Å; H800-Y803 PolarHBondContact O-N 2.83Å; G801-Y803 WeakPolarHBondContact O-CD2 3.46Å
804	S	86.8	Confident	89.3	Confident	60 Å²	60	60.2 Å²	60.2	42%	0.42	35%	0.349	S	S	.	.			trans	-99	131.8	174	-172.8	0	0	0	0	109.2	D798 F799	D798-S804 CarbonylContact O-C 3.05Å; D798-S804 WeakPolarHBondContact O-CA 3.34Å; F799-S804 VanDerWaalsContact CE1-OG 3.28Å; F799-S804 WeakPolarHBondContact CE1-OG 3.22Å
805	H	89.4	Confident	89.2	Confident	77 Å²	77	65.4 Å²	65.4	36%	0.356	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	128.2	-177.2	-66	-91.1	0	0	0	109.2	F797 D798 H800 V807	F797-H805 CarbonylContact C-O 3.5Å; F797-H805 VanDerWaalsContact CA-O 3.28Å; F797-H805 WeakPolarHBondContact CA-O 3.27Å; D798-H805 PolarHBondContact N-O 2.9Å; D798-H805 PolarHBondContact O-N 2.8Å; H800-H805 AromaticContact CE1-CD2 3.2Å; H800-H805 PolarHBondContact CE1-CD2 3.41Å; H800-H805 AromaticContact CE1-CE1 4Å; H800-H805 AromaticContact CE1-CG 3.55Å; H800-H805 AromaticContact CE1-NE2 3.52Å; H800-H805 AromaticContact ND1-CD2 3.29Å; H800-H805 PolarHBondContact ND1-CD2 2.87Å; H800-H805 VanDerWaalsContact ND1-CD2 3.29Å; H800-H805 AromaticContact ND1-NE2 3.55Å; H805-V807 PolarHBondContact O-N 3.47Å
806	P	92.2	Very high	89.3	Confident	70 Å²	70	70.7 Å²	70.7	46%	0.455	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	130.1	176.7	28.1	-33.1	0	0	0	110	I794 F797	I794-P806 HydrophobicContact CD1-CB 4.07Å; I794-P806 HydrophobicContact CG1-CB 4.23Å; I794-P806 HydrophobicContact CG2-CB 3.99Å; F797-P806 HydrophobicContact CD1-CB 4.22Å; F797-P806 HydrophobicContact CE1-CB 4.01Å
807	V	92.5	Very high	89.3	Confident	61 Å²	61	72.9 Å²	72.9	37%	0.37	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	119.1	170.9	-179.6	0	0	0	0	107.2	I794 T795 G796 D798 H805	I794-V807 WeakPolarHBondContact CA-O 3.29Å; T795-V807 PolarHBondContact N-O 2.99Å; G796-V807 PolarHBondContact O-N 3.44Å; D798-V807 HydrophobicContact CB-CG2 3.94Å; H805-V807 PolarHBondContact O-N 3.47Å
808	T	91.6	Very high	89.3	Confident	67 Å²	67	72.9 Å²	72.9	41%	0.411	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	132.2	175.7	51	0	0	0	0	110.6	Q792 A793 I794	Q792-T808 HydrophobicContact CB-CG2 4.15Å; A793-T808 VanDerWaalsContact O-CA 3.24Å; A793-T808 WeakPolarHBondContact O-CA 3.47Å; I794-T808 HydrophobicContact CG1-CG2 4.15Å
809	D	88.8	Confident	89.4	Confident	78 Å²	78	74.1 Å²	74.1	42%	0.417	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	98.3	177.2	-172.1	20.1	0	0	0	110.3	Q773 N775 A793 T795	Q773-D809 PolarHBondContact NE2-O 3.05Å; N775-D809 PolarHBondContact ND2-OD1 2.72Å; N775-D809 VanDerWaalsContact ND2-OD1 3.15Å; N775-D809 PolarHBondContact ND2-OD2 3.05Å; A793-D809 PolarHBondContact O-N 3.31Å; A793-D809 VanDerWaalsContact O-N 3.08Å; T795-D809 HydrophobicContact CG2-CB 3.81Å
810	G	90.4	Very high	89.7	Confident	15 Å²	15	70.8 Å²	70.8	16%	0.155	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	74.7	-172.3	-177.4	0	0	0	0	0	115	L774 N775 A793	L774-G810 WeakPolarHBondContact O-CA 3.46Å; N775-G810 WeakPolarHBondContact OD1-CA 3.3Å; A793-G810 PolarHBondContact N-O 3.2Å
811	Y	92.5	Very high	90.1	Very high	42 Å²	42	66 Å²	66	17%	0.165	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	147.4	-178	-60.8	-86.3	0	0	0	110.7	Q773 L774 L779 H780 C790 V791 Q792	Q773-Y811 CarbonylContact C-O 3.58Å; Q773-Y811 WeakPolarHBondContact CA-O 3.3Å; L774-Y811 PolarHBondContact N-O 3.29Å; L774-Y811 PolarHBondContact O-N 2.86Å; L779-Y811 HydrophobicContact CB-CD2 3.7Å; L779-Y811 HydrophobicContact CB-CE2 3.9Å; L779-Y811 HydrophobicContact CD2-CD2 4.13Å; L779-Y811 HydrophobicContact CG-CD2 4.48Å; H780-Y811 HydrophobicContact CB-CD1 4.21Å; H780-Y811 HydrophobicContact CB-CE1 3.49Å; H780-Y811 VanDerWaalsContact CB-CE1 3.49Å; C790-Y811 VanDerWaalsContact SG-CB 3.6Å; V791-Y811 CarbonylContact O-C 3.52Å; V791-Y811 VanDerWaalsContact O-CA 3.27Å; V791-Y811 WeakPolarHBondContact O-CA 3.38Å; Q792-Y811 HydrophobicContact CG-CD1 3.78Å; Q792-Y811 HydrophobicContact CG-CE1 3.43Å; Q792-Y811 VanDerWaalsContact CG-CE1 3.43Å
812	I	93.6	Very high	90.8	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	132.4	172.9	-51.3	-165.9	0	0	0	108.4	V751 V759 L761 C771 V791 A793	V751-I812 HydrophobicContact CG1-CB 4.22Å; V751-I812 HydrophobicContact CG1-CG2 3.81Å; V751-I812 HydrophobicContact CG2-CG2 4.49Å; V759-I812 HydrophobicContact CB-CD1 3.69Å; V759-I812 HydrophobicContact CG1-CD1 3.69Å; V759-I812 HydrophobicContact CG2-CD1 4.11Å; L761-I812 HydrophobicContact CB-CD1 4.43Å; L761-I812 HydrophobicContact CD1-CD1 4.14Å; L761-I812 HydrophobicContact CD2-CD1 4.26Å; C771-I812 HydrophobicContact CB-CG2 3.51Å; V791-I812 PolarHBondContact N-O 3.22Å; V791-I812 PolarHBondContact O-N 3.49Å; A793-I812 HydrophobicContact CB-CD1 4.11Å; A793-I812 HydrophobicContact CB-CG1 3.87Å
813	V	93.3	Very high	91.4	Very high	2 Å²	2	65 Å²	65	1%	0.012	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	148.2	-179.5	-175.4	0	0	0	0	107.8	C771 V772 I788 C790 F817 L821	C771-V813 CarbonylContact C-O 3.52Å; C771-V813 WeakPolarHBondContact CA-O 3.27Å; V772-V813 PolarHBondContact N-O 2.83Å; V772-V813 PolarHBondContact O-N 3.28Å; V772-V813 VanDerWaalsContact O-N 3.16Å; I788-V813 HydrophobicContact CG2-CG1 3.87Å; C790-V813 HydrophobicContact CB-CG2 4.04Å; V813-F817 HydrophobicContact CG1-CB 3.94Å; V813-L821 HydrophobicContact CB-CD2 4.48Å; V813-L821 HydrophobicContact CG1-CD2 4.29Å; V813-L821 HydrophobicContact CG2-CD2 3.8Å
814	C	94.1	Very high	92	Very high	4 Å²	4	58 Å²	58	3%	0.027	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	143.1	173.6	-58.5	0	0	0	0	111.1	G749 G770 E816 F817	G749-C814 PolarHBondContact O-SG 3.44Å; G770-C814 CarbonylContact O-C 3.41Å; G770-C814 WeakPolarHBondContact O-CA 3.32Å; C814-E816 PolarHBondContact O-N 2.66Å; C814-F817 HydrophobicContact CB-CD2 4.17Å; C814-F817 PolarHBondContact O-N 2.8Å; C814-F817 VanDerWaalsContact O-N 3.07Å
815	E	93.4	Very high	92.3	Very high	117 Å²	117	57.4 Å²	57.4	55%	0.547	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-57.2	-37.1	-174	-174.5	166.2	-157.3	0	0	112.3	G770 V772 F817 K818	G770-E815 PolarHBondContact O-N 3.09Å; V772-E815 HydrophobicContact CG2-CB 4.01Å; V772-E815 HydrophobicContact CG2-CG 3.98Å; E815-F817 PolarHBondContact O-N 3.31Å; E815-F817 VanDerWaalsContact O-N 3.17Å; E815-K818 WeakPolarHBondContact O-CB 3.36Å; E815-K818 PolarHBondContact O-N 2.99Å; E815-K818 VanDerWaalsContact O-N 3.11Å
816	E	92.3	Very high	92.4	Very high	156 Å²	156	59.5 Å²	59.5	73%	0.729	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-53.1	-34	176.6	-58.7	177	166.7	0	0	113.9	C814	C814-E816 PolarHBondContact O-N 2.66Å
817	F	92.5	Very high	92.4	Very high	65 Å²	65	60.7 Å²	60.7	29%	0.285	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-96	-6.3	-176.6	-63.6	-57.2	0	0	0	114	I788 V813 C814 E815 D819 V820 L821	I788-F817 HydrophobicContact CD1-CB 4.2Å; I788-F817 HydrophobicContact CD1-CD1 4.24Å; I788-F817 HydrophobicContact CD1-CG 4.37Å; I788-F817 HydrophobicContact CG1-CB 4.48Å; I788-F817 HydrophobicContact CG1-CD1 4.12Å; I788-F817 HydrophobicContact CG1-CG 4.21Å; I788-F817 HydrophobicContact CG2-CB 3.74Å; I788-F817 HydrophobicContact CG2-CD2 3.85Å; I788-F817 HydrophobicContact CG2-CG 3.81Å; V813-F817 HydrophobicContact CG1-CB 3.94Å; C814-F817 HydrophobicContact CB-CD2 4.17Å; C814-F817 PolarHBondContact O-N 2.8Å; C814-F817 VanDerWaalsContact O-N 3.07Å; E815-F817 PolarHBondContact O-N 3.31Å; E815-F817 VanDerWaalsContact O-N 3.17Å; F817-D819 PolarHBondContact O-N 3.42Å; F817-V820 PolarHBondContact O-N 2.75Å; F817-L821 VanDerWaalsContact O-CB 3.26Å; F817-L821 WeakPolarHBondContact O-CB 3.44Å; F817-L821 PolarHBondContact O-N 2.96Å
818	K	92.1	Very high	92.3	Very high	71 Å²	71	59.2 Å²	59.2	31%	0.309	31%	0.305	S	S	.	.	H	α-helix	trans	-50.9	-53.4	-174.6	178.7	-169.8	173.2	-168	0	112.2	V772 L774 E815 L821 L822	V772-K818 HydrophobicContact CG1-CD 4.37Å; V772-K818 HydrophobicContact CG2-CD 4.43Å; L774-K818 HydrophobicContact CD2-CG 4.48Å; E815-K818 WeakPolarHBondContact O-CB 3.36Å; E815-K818 PolarHBondContact O-N 2.99Å; E815-K818 VanDerWaalsContact O-N 3.11Å; K818-L821 PolarHBondContact O-N 3.11Å; K818-L822 HydrophobicContact CG-CD1 4.01Å; K818-L822 WeakPolarHBondContact O-CB 3.33Å; K818-L822 VanDerWaalsContact O-CG 3.26Å; K818-L822 WeakPolarHBondContact O-CG 3.28Å; K818-L822 PolarHBondContact O-N 3.39Å
819	D	93.4	Very high	92.2	Very high	107 Å²	107	57.9 Å²	57.9	57%	0.572	29%	0.294	S	S	*	.	H	α-helix	trans	-73.2	-35	-172.6	-62	-16.8	0	0	0	112.1	F817 T823	F817-D819 PolarHBondContact O-N 3.42Å; D819-T823 WeakPolarHBondContact O-CB 3.28Å; D819-T823 PolarHBondContact O-N 3.21Å; D819-T823 PolarHBondContact O-OG1 3.16Å
820	V	92.9	Very high	92.3	Very high	78 Å²	78	56 Å²	56	47%	0.473	29%	0.29	S	S	.	.	H	α-helix	trans	-61.6	-46.6	172.6	-178	0	0	0	0	110.2	L786 I788 F817 A824	L786-V820 HydrophobicContact CD1-CG1 4.37Å; I788-V820 HydrophobicContact CD1-CG1 4.2Å; F817-V820 PolarHBondContact O-N 2.75Å; V820-A824 WeakPolarHBondContact O-CB 3.48Å; V820-A824 PolarHBondContact O-N 2.76Å
821	L	92	Very high	92.3	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-69.8	-39.2	-177.9	-161	84.9	0	0	0	112.2	L774 L779 A783 L786 I788 V813 F817 K818 W825	L774-L821 HydrophobicContact CD1-CD2 3.81Å; L779-L821 HydrophobicContact CD1-CD2 3.7Å; L779-L821 HydrophobicContact CD1-CG 3.89Å; L779-L821 HydrophobicContact CD2-CD2 3.68Å; L779-L821 HydrophobicContact CG-CD2 3.69Å; L779-L821 HydrophobicContact CG-CG 4.32Å; A783-L821 HydrophobicContact CB-CD1 3.87Å; L786-L821 HydrophobicContact CD1-CD1 4.46Å; I788-L821 HydrophobicContact CB-CD1 4.36Å; I788-L821 HydrophobicContact CD1-CD1 3.94Å; I788-L821 HydrophobicContact CG2-CD1 4.26Å; V813-L821 HydrophobicContact CB-CD2 4.48Å; V813-L821 HydrophobicContact CG1-CD2 4.29Å; V813-L821 HydrophobicContact CG2-CD2 3.8Å; F817-L821 VanDerWaalsContact O-CB 3.26Å; F817-L821 WeakPolarHBondContact O-CB 3.44Å; F817-L821 PolarHBondContact O-N 2.96Å; K818-L821 PolarHBondContact O-N 3.11Å; L821-W825 VanDerWaalsContact O-CB 3.24Å; L821-W825 WeakPolarHBondContact O-CB 3.49Å; L821-W825 PolarHBondContact O-N 3.05Å
822	L	92.5	Very high	92.2	Very high	47 Å²	47	57.6 Å²	57.6	25%	0.246	30%	0.299	C	S	.	.	H	α-helix	trans	-60.8	-52.6	172.7	-75.3	171.6	0	0	0	110.9	L774 L776 K818 A824 W825 E826	L774-L822 HydrophobicContact CD2-CD2 4.47Å; L776-L822 HydrophobicContact CD1-CD2 3.59Å; K818-L822 HydrophobicContact CG-CD1 4.01Å; K818-L822 WeakPolarHBondContact O-CB 3.33Å; K818-L822 VanDerWaalsContact O-CG 3.26Å; K818-L822 WeakPolarHBondContact O-CG 3.28Å; K818-L822 PolarHBondContact O-N 3.39Å; L822-A824 VanDerWaalsContact C-N 3.29Å; L822-A824 PolarHBondContact O-N 2.79Å; L822-W825 PolarHBondContact O-N 2.73Å; L822-W825 VanDerWaalsContact O-N 3.08Å; L822-E826 WeakPolarHBondContact O-CG 3.31Å; L822-E826 PolarHBondContact O-N 3.01Å
823	T	92.9	Very high	92.1	Very high	78 Å²	78	62.4 Å²	62.4	48%	0.479	32%	0.321	S	S	.	.	H	α-helix	trans	-58.1	-42.2	178.9	-55	0	0	0	0	111.5	D819 N827	D819-T823 WeakPolarHBondContact O-CB 3.28Å; D819-T823 PolarHBondContact O-N 3.21Å; D819-T823 PolarHBondContact O-OG1 3.16Å; T823-N827 PolarHBondContact O-N 3.43Å; T823-N827 VanDerWaalsContact O-N 3.14Å; T823-N827 PolarHBondContact O-ND2 3.44Å
824	A	92.5	Very high	92.1	Very high	23 Å²	23	69 Å²	69	19%	0.19	35%	0.345	C	S	.	.	H	α-helix	trans	-70.8	-33.9	177.2	0	0	0	0	0	113.1	V782 L786 V820 L822 N827 E828	V782-A824 HydrophobicContact CG1-CB 3.64Å; L786-A824 HydrophobicContact CD1-CB 3.53Å; V820-A824 WeakPolarHBondContact O-CB 3.48Å; V820-A824 PolarHBondContact O-N 2.76Å; L822-A824 VanDerWaalsContact C-N 3.29Å; L822-A824 PolarHBondContact O-N 2.79Å; A824-N827 PolarHBondContact O-N 3.05Å; A824-E828 WeakPolarHBondContact O-CB 3.49Å; A824-E828 PolarHBondContact O-N 3.16Å
825	W	92.7	Very high	92	Very high	47 Å²	47	74 Å²	74	18%	0.178	37%	0.367	C	S	.	.	H	α-helix	trans	-67.4	-45.1	175.4	179.5	90.9	0	0	0	111.2	L776 P777 L779 V782 L821 L822 N827 E828 Q829	L776-W825 HydrophobicContact CB-CD2 4.46Å; L776-W825 HydrophobicContact CB-CZ2 4.31Å; L776-W825 HydrophobicContact CD1-CD2 4.04Å; L776-W825 HydrophobicContact CD1-CE3 4.27Å; L776-W825 HydrophobicContact CD1-CG 4.25Å; L776-W825 HydrophobicContact CD2-CH2 4.11Å; L776-W825 HydrophobicContact CD2-CZ2 4.13Å; L776-W825 HydrophobicContact CD2-CZ3 4.34Å; P777-W825 HydrophobicContact CG-CZ2 4.01Å; P777-W825 PolarHBondContact O-NE1 2.96Å; L779-W825 HydrophobicContact CD1-CB 3.91Å; L779-W825 HydrophobicContact CD1-CG 3.94Å; V782-W825 HydrophobicContact CG1-CB 4.49Å; V782-W825 HydrophobicContact CG2-CB 4.42Å; L821-W825 VanDerWaalsContact O-CB 3.24Å; L821-W825 WeakPolarHBondContact O-CB 3.49Å; L821-W825 PolarHBondContact O-N 3.05Å; L822-W825 PolarHBondContact O-N 2.73Å; L822-W825 VanDerWaalsContact O-N 3.08Å; W825-N827 VanDerWaalsContact C-N 3.3Å; W825-N827 PolarHBondContact O-N 2.84Å; W825-E828 PolarHBondContact O-N 3.05Å; W825-E828 VanDerWaalsContact O-N 3.16Å; W825-Q829 HydrophobicContact CD2-CG 3.77Å; W825-Q829 VanDerWaalsContact CE2-NE2 3.32Å; W825-Q829 HydrophobicContact CE3-CG 3.97Å; W825-Q829 HydrophobicContact CG-CG 4.47Å; W825-Q829 HydrophobicContact CH2-CG 3.72Å; W825-Q829 HydrophobicContact CZ2-CG 3.5Å; W825-Q829 HydrophobicContact CZ3-CG 3.95Å; W825-Q829 VanDerWaalsContact NE1-NE2 3.13Å; W825-Q829 WeakPolarHBondContact O-CG 3.43Å; W825-Q829 PolarHBondContact O-N 3.48Å
826	E	92.9	Very high	91.9	Very high	121 Å²	121	72.7 Å²	72.7	57%	0.565	36%	0.361	S	S	*	.	H	α-helix	trans	-57.9	-43.4	174.2	-71	178.8	177.3	0	0	111.7	L822 Q829 A830	L822-E826 WeakPolarHBondContact O-CG 3.31Å; L822-E826 PolarHBondContact O-N 3.01Å; E826-Q829 PolarHBondContact O-N 3.06Å; E826-A830 WeakPolarHBondContact O-CB 3.48Å; E826-A830 PolarHBondContact O-N 3.26Å
827	N	91.8	Very high	91.9	Very high	95 Å²	95	70.2 Å²	70.2	51%	0.508	35%	0.347	S	S	.	.	H	α-helix	trans	-62.4	-44.5	174.3	-80.4	-57.3	0	0	0	112.6	T823 A824 W825 A830 V831	T823-N827 PolarHBondContact O-N 3.43Å; T823-N827 VanDerWaalsContact O-N 3.14Å; T823-N827 PolarHBondContact O-ND2 3.44Å; A824-N827 PolarHBondContact O-N 3.05Å; W825-N827 VanDerWaalsContact C-N 3.3Å; W825-N827 PolarHBondContact O-N 2.84Å; N827-A830 PolarHBondContact O-N 2.83Å; N827-V831 WeakPolarHBondContact O-CG2 3.45Å; N827-V831 PolarHBondContact O-N 3.08Å
828	E	89.7	Confident	92	Very high	30 Å²	30	71.1 Å²	71.1	14%	0.14	35%	0.353	C	S	.	.	H	α-helix	trans	-64.8	-42.1	176.5	-171.1	72.7	-173.3	0	0	111.2	V782 K785 A824 W825 V831 I832	V782-E828 HydrophobicContact CG2-CB 3.95Å; V782-E828 HydrophobicContact CG2-CG 4.08Å; K785-E828 IonicContact NZ-OE1 3.68Å; K785-E828 PolarHBondContact NZ-OE1 3.41Å; K785-E828 IonicContact NZ-OE2 2.66Å; K785-E828 PolarHBondContact NZ-OE2 2.92Å; A824-E828 WeakPolarHBondContact O-CB 3.49Å; A824-E828 PolarHBondContact O-N 3.16Å; W825-E828 PolarHBondContact O-N 3.05Å; W825-E828 VanDerWaalsContact O-N 3.16Å; E828-V831 CarbonylContact O-C 3.52Å; E828-V831 WeakPolarHBondContact O-CB 3.45Å; E828-V831 PolarHBondContact O-N 3.33Å; E828-V831 VanDerWaalsContact O-N 3.14Å; E828-I832 HydrophobicContact CG-CD1 3.93Å; E828-I832 HydrophobicContact CG-CG1 4.44Å; E828-I832 VanDerWaalsContact O-CG1 3.29Å; E828-I832 WeakPolarHBondContact O-CG1 3.47Å; E828-I832 PolarHBondContact O-N 2.68Å
829	Q	90.1	Very high	92	Very high	40 Å²	40	73.6 Å²	73.6	19%	0.187	36%	0.364	C	S	.	.	H	α-helix	trans	-61.8	-45	174.4	-67	-52.8	-30.9	0	0	111.4	W825 E826 V831 I832 E833	W825-Q829 HydrophobicContact CD2-CG 3.77Å; W825-Q829 VanDerWaalsContact CE2-NE2 3.32Å; W825-Q829 HydrophobicContact CE3-CG 3.97Å; W825-Q829 HydrophobicContact CG-CG 4.47Å; W825-Q829 HydrophobicContact CH2-CG 3.72Å; W825-Q829 HydrophobicContact CZ2-CG 3.5Å; W825-Q829 HydrophobicContact CZ3-CG 3.95Å; W825-Q829 VanDerWaalsContact NE1-NE2 3.13Å; W825-Q829 WeakPolarHBondContact O-CG 3.43Å; W825-Q829 PolarHBondContact O-N 3.48Å; E826-Q829 PolarHBondContact O-N 3.06Å; Q829-V831 PolarHBondContact O-N 2.89Å; Q829-I832 PolarHBondContact O-N 2.87Å; Q829-I832 VanDerWaalsContact O-N 3.11Å; Q829-E833 WeakPolarHBondContact O-CB 3.27Å; Q829-E833 PolarHBondContact O-N 2.85Å
830	A	91.1	Very high	91.9	Very high	38 Å²	38	74.2 Å²	74.2	31%	0.314	36%	0.361	S	S	.	.	H	α-helix	trans	-61.2	-29.8	175.4	0	0	0	0	0	112.5	E826 N827 R834	E826-A830 WeakPolarHBondContact O-CB 3.48Å; E826-A830 PolarHBondContact O-N 3.26Å; N827-A830 PolarHBondContact O-N 2.83Å; A830-R834 WeakPolarHBondContact O-CB 3.34Å; A830-R834 WeakPolarHBondContact O-CG 3.36Å; A830-R834 PolarHBondContact O-N 2.64Å; A830-R834 PolarHBondContact O-NE 3.22Å
831	V	91.2	Very high	92	Very high	44 Å²	44	76 Å²	76	27%	0.267	36%	0.364	S	S	.	.	H	α-helix	trans	-77.7	-39.5	173.1	168.3	0	0	0	0	111.8	N827 E828 Q829 R834 K835	N827-V831 WeakPolarHBondContact O-CG2 3.45Å; N827-V831 PolarHBondContact O-N 3.08Å; E828-V831 CarbonylContact O-C 3.52Å; E828-V831 WeakPolarHBondContact O-CB 3.45Å; E828-V831 PolarHBondContact O-N 3.33Å; E828-V831 VanDerWaalsContact O-N 3.14Å; Q829-V831 PolarHBondContact O-N 2.89Å; V831-R834 PolarHBondContact O-N 3.31Å; V831-K835 HydrophobicContact CG1-CD 3.94Å; V831-K835 WeakPolarHBondContact O-CB 3.46Å; V831-K835 VanDerWaalsContact O-CG 3.28Å; V831-K835 WeakPolarHBondContact O-CG 3.41Å; V831-K835 PolarHBondContact O-N 3.06Å
832	I	89.3	Confident	92	Very high	47 Å²	47	82.3 Å²	82.3	24%	0.241	39%	0.392	C	S	.	.	H	α-helix	trans	-62.5	-49.6	174.3	-71.2	164.2	0	0	0	109.7	E828 Q829 R834 K835 E836	E828-I832 HydrophobicContact CG-CD1 3.93Å; E828-I832 HydrophobicContact CG-CG1 4.44Å; E828-I832 VanDerWaalsContact O-CG1 3.29Å; E828-I832 WeakPolarHBondContact O-CG1 3.47Å; E828-I832 PolarHBondContact O-N 2.68Å; Q829-I832 PolarHBondContact O-N 2.87Å; Q829-I832 VanDerWaalsContact O-N 3.11Å; I832-R834 PolarHBondContact O-N 2.84Å; I832-K835 CarbonylContact O-C 3.59Å; I832-K835 PolarHBondContact O-N 2.84Å; I832-E836 WeakPolarHBondContact O-CB 3.46Å; I832-E836 PolarHBondContact O-N 3.48Å
833	E	91.1	Very high	92.1	Very high	101 Å²	101	88.2 Å²	88.2	47%	0.472	41%	0.411	S	S	.	.	H	α-helix	trans	-58	-44	175.3	-81.1	-161.8	-162.4	0	0	112.7	Q829 E836 K837	Q829-E833 WeakPolarHBondContact O-CB 3.27Å; Q829-E833 PolarHBondContact O-N 2.85Å; E833-E836 PolarHBondContact O-N 3.01Å; E833-K837 WeakPolarHBondContact O-CB 3.25Å; E833-K837 VanDerWaalsContact O-CG 3.25Å; E833-K837 WeakPolarHBondContact O-CG 3.48Å; E833-K837 PolarHBondContact O-N 3.09Å; E833-K837 IonicContact OE2-NZ 2.75Å; E833-K837 PolarHBondContact OE2-NZ 2.84Å
834	R	93	Very high	92.1	Very high	139 Å²	139	86.4 Å²	86.4	53%	0.525	40%	0.404	S	S	.	.	H	α-helix	trans	-61.4	-47.9	175.1	-85.6	176.9	-83.4	170	-10.7	111.1	A830 V831 I832 E836 K837 E838	A830-R834 WeakPolarHBondContact O-CB 3.34Å; A830-R834 WeakPolarHBondContact O-CG 3.36Å; A830-R834 PolarHBondContact O-N 2.64Å; A830-R834 PolarHBondContact O-NE 3.22Å; V831-R834 PolarHBondContact O-N 3.31Å; I832-R834 PolarHBondContact O-N 2.84Å; R834-E836 VanDerWaalsContact C-N 3.27Å; R834-E836 PolarHBondContact O-N 3.01Å; R834-K837 PolarHBondContact O-N 3.11Å; R834-E838 WeakPolarHBondContact O-CB 3.13Å; R834-E838 WeakPolarHBondContact O-CG 3.47Å; R834-E838 PolarHBondContact O-N 3Å
835	K	92.9	Very high	92.1	Very high	111 Å²	111	91 Å²	91	48%	0.483	43%	0.425	S	S	.	.	H	α-helix	trans	-61.6	-33.4	175.2	-73.5	168.9	-179.4	169.9	0	112.3	V831 I832 K839	V831-K835 HydrophobicContact CG1-CD 3.94Å; V831-K835 WeakPolarHBondContact O-CB 3.46Å; V831-K835 VanDerWaalsContact O-CG 3.28Å; V831-K835 WeakPolarHBondContact O-CG 3.41Å; V831-K835 PolarHBondContact O-N 3.06Å; I832-K835 CarbonylContact O-C 3.59Å; I832-K835 PolarHBondContact O-N 2.84Å; K835-K839 VanDerWaalsContact O-CB 3.29Å; K835-K839 WeakPolarHBondContact O-CB 3.23Å; K835-K839 WeakPolarHBondContact O-CD 3.42Å; K835-K839 WeakPolarHBondContact O-CG 3.47Å; K835-K839 PolarHBondContact O-N 3.25Å
836	E	91.6	Very high	92.2	Very high	88 Å²	88	90.6 Å²	90.6	41%	0.411	44%	0.435	S	S	.	.	H	α-helix	trans	-71.1	-45.1	173.3	-83.9	-156.3	-170.1	0	0	113.1	I832 E833 R834 K839 K840	I832-E836 WeakPolarHBondContact O-CB 3.46Å; I832-E836 PolarHBondContact O-N 3.48Å; E833-E836 PolarHBondContact O-N 3.01Å; R834-E836 VanDerWaalsContact C-N 3.27Å; R834-E836 PolarHBondContact O-N 3.01Å; E836-K839 CarbonylContact O-C 3.57Å; E836-K839 PolarHBondContact O-N 2.87Å; E836-K840 WeakPolarHBondContact O-CB 3.25Å; E836-K840 WeakPolarHBondContact O-CD 3.44Å; E836-K840 VanDerWaalsContact O-CG 3.23Å; E836-K840 WeakPolarHBondContact O-CG 3.38Å; E836-K840 PolarHBondContact O-N 3.27Å; E836-K840 IonicContact OE2-NZ 3.91Å; E836-K840 PolarHBondContact OE2-NZ 3.47Å
837	K	92.6	Very high	92.2	Very high	104 Å²	104	90.1 Å²	90.1	45%	0.452	44%	0.436	S	S	.	.	H	α-helix	trans	-59	-48.9	175.1	-73	163.5	-170.7	162.8	0	109.2	E833 R834 K839 K840 E841	E833-K837 WeakPolarHBondContact O-CB 3.25Å; E833-K837 VanDerWaalsContact O-CG 3.25Å; E833-K837 WeakPolarHBondContact O-CG 3.48Å; E833-K837 PolarHBondContact O-N 3.09Å; E833-K837 IonicContact OE2-NZ 2.75Å; E833-K837 PolarHBondContact OE2-NZ 2.84Å; R834-K837 PolarHBondContact O-N 3.11Å; K837-K839 PolarHBondContact O-N 2.74Å; K837-K840 CarbonylContact O-C 3.5Å; K837-K840 WeakPolarHBondContact O-CB 3.36Å; K837-K840 PolarHBondContact O-N 3.05Å; K837-K840 VanDerWaalsContact O-N 3.13Å; K837-E841 WeakPolarHBondContact O-CB 3.33Å; K837-E841 WeakPolarHBondContact O-CG 3.32Å; K837-E841 PolarHBondContact O-N 2.89Å
838	E	93.1	Very high	92.3	Very high	84 Å²	84	93.7 Å²	93.7	39%	0.393	44%	0.443	S	S	.	.	H	α-helix	trans	-57.5	-43.6	171	-77	-176.1	-131.7	0	0	113.5	R834 K840 E841 K842	R834-E838 WeakPolarHBondContact O-CB 3.13Å; R834-E838 WeakPolarHBondContact O-CG 3.47Å; R834-E838 PolarHBondContact O-N 3Å; E838-K840 VanDerWaalsContact C-N 3.34Å; E838-E841 PolarHBondContact O-N 2.83Å; E838-K842 WeakPolarHBondContact O-CB 3.49Å; E838-K842 WeakPolarHBondContact O-CD 3.36Å; E838-K842 WeakPolarHBondContact O-CG 3.23Å; E838-K842 PolarHBondContact O-N 3.35Å; E838-K842 IonicContact OE2-NZ 3.58Å; E838-K842 PolarHBondContact OE2-NZ 2.65Å
839	K	93.2	Very high	92.4	Very high	124 Å²	124	99 Å²	99	54%	0.539	47%	0.465	S	S	.	.	H	α-helix	trans	-63.9	-39.8	176.4	-79.7	167.1	-177.6	178.7	0	111.1	K835 E836 K837 R843	K835-K839 VanDerWaalsContact O-CB 3.29Å; K835-K839 WeakPolarHBondContact O-CB 3.23Å; K835-K839 WeakPolarHBondContact O-CD 3.42Å; K835-K839 WeakPolarHBondContact O-CG 3.47Å; K835-K839 PolarHBondContact O-N 3.25Å; E836-K839 CarbonylContact O-C 3.57Å; E836-K839 PolarHBondContact O-N 2.87Å; K837-K839 PolarHBondContact O-N 2.74Å; K839-R843 WeakPolarHBondContact O-CB 3.49Å; K839-R843 WeakPolarHBondContact O-CD 3.5Å; K839-R843 WeakPolarHBondContact O-CG 3.24Å; K839-R843 PolarHBondContact O-N 3.04Å
840	K	91.8	Very high	92.5	Very high	119 Å²	119	103 Å²	103	52%	0.517	49%	0.487	S	S	.	.	H	α-helix	trans	-66.7	-44	176.7	-74.2	159.2	176.3	158.7	0	110.5	E836 K837 E838 R843 A844	E836-K840 WeakPolarHBondContact O-CB 3.25Å; E836-K840 WeakPolarHBondContact O-CD 3.44Å; E836-K840 VanDerWaalsContact O-CG 3.23Å; E836-K840 WeakPolarHBondContact O-CG 3.38Å; E836-K840 PolarHBondContact O-N 3.27Å; E836-K840 IonicContact OE2-NZ 3.91Å; E836-K840 PolarHBondContact OE2-NZ 3.47Å; K837-K840 CarbonylContact O-C 3.5Å; K837-K840 WeakPolarHBondContact O-CB 3.36Å; K837-K840 PolarHBondContact O-N 3.05Å; K837-K840 VanDerWaalsContact O-N 3.13Å; E838-K840 VanDerWaalsContact C-N 3.34Å; K840-R843 PolarHBondContact O-N 2.94Å; K840-A844 WeakPolarHBondContact O-CB 3.49Å; K840-A844 PolarHBondContact O-N 3.29Å
841	E	93.2	Very high	92.5	Very high	117 Å²	117	105.6 Å²	105.6	55%	0.547	50%	0.496	S	S	.	.	H	α-helix	trans	-65.5	-47.8	174.6	-74	168.2	-166.4	0	0	112.4	K837 E838 R843 A844 L845	K837-E841 WeakPolarHBondContact O-CB 3.33Å; K837-E841 WeakPolarHBondContact O-CG 3.32Å; K837-E841 PolarHBondContact O-N 2.89Å; E838-E841 PolarHBondContact O-N 2.83Å; E841-R843 VanDerWaalsContact C-N 3.28Å; E841-R843 PolarHBondContact O-N 3.16Å; E841-A844 CarbonylContact O-C 3.57Å; E841-A844 WeakPolarHBondContact O-CB 3.48Å; E841-A844 PolarHBondContact O-N 2.88Å; E841-L845 WeakPolarHBondContact O-CB 3.37Å; E841-L845 WeakPolarHBondContact O-CG 3.34Å; E841-L845 PolarHBondContact O-N 3.45Å
842	K	93.6	Very high	92.7	Very high	132 Å²	132	105.8 Å²	105.8	57%	0.574	50%	0.502	S	S	*	.	H	α-helix	trans	-60.3	-37.7	175.5	-73.3	162	-179.4	164	0	111.4	E838 G846	E838-K842 WeakPolarHBondContact O-CB 3.49Å; E838-K842 WeakPolarHBondContact O-CD 3.36Å; E838-K842 WeakPolarHBondContact O-CG 3.23Å; E838-K842 PolarHBondContact O-N 3.35Å; E838-K842 IonicContact OE2-NZ 3.58Å; E838-K842 PolarHBondContact OE2-NZ 2.65Å; K842-G846 PolarHBondContact O-N 2.93Å
843	R	93.1	Very high	92.8	Very high	170 Å²	170	109 Å²	109	64%	0.642	51%	0.514	S	S	*	.	H	α-helix	trans	-66	-44.6	170.4	-74	167.6	-175.7	177.9	2	111.9	K839 K840 E841 G846 N847	K839-R843 WeakPolarHBondContact O-CB 3.49Å; K839-R843 WeakPolarHBondContact O-CD 3.5Å; K839-R843 WeakPolarHBondContact O-CG 3.24Å; K839-R843 PolarHBondContact O-N 3.04Å; K840-R843 PolarHBondContact O-N 2.94Å; E841-R843 VanDerWaalsContact C-N 3.28Å; E841-R843 PolarHBondContact O-N 3.16Å; R843-G846 PolarHBondContact O-N 3.45Å; R843-N847 WeakPolarHBondContact O-CB 3.37Å; R843-N847 PolarHBondContact O-N 3.39Å; R843-N847 PolarHBondContact O-ND2 3.01Å
844	A	93.4	Very high	92.9	Very high	41 Å²	41	106 Å²	106	34%	0.339	51%	0.51	S	S	.	.	H	α-helix	trans	-62.9	-49.4	177.9	0	0	0	0	0	111.6	K840 E841 G846 N847 W848	K840-A844 WeakPolarHBondContact O-CB 3.49Å; K840-A844 PolarHBondContact O-N 3.29Å; E841-A844 CarbonylContact O-C 3.57Å; E841-A844 WeakPolarHBondContact O-CB 3.48Å; E841-A844 PolarHBondContact O-N 2.88Å; A844-G846 VanDerWaalsContact C-N 3.32Å; A844-G846 PolarHBondContact O-N 3.33Å; A844-N847 CarbonylContact O-C 3.55Å; A844-N847 WeakPolarHBondContact O-CB 3.41Å; A844-N847 PolarHBondContact O-N 3.1Å; A844-N847 VanDerWaalsContact O-N 3.14Å; A844-W848 WeakPolarHBondContact O-CB 3.44Å; A844-W848 PolarHBondContact O-N 2.91Å
845	L	93.6	Very high	92.9	Very high	119 Å²	119	103.5 Å²	103.5	62%	0.623	51%	0.507	S	S	*	.	H	α-helix	trans	-60.8	-38.6	174.6	-69.5	173.6	0	0	0	112	E841 W848 K849	E841-L845 WeakPolarHBondContact O-CB 3.37Å; E841-L845 WeakPolarHBondContact O-CG 3.34Å; E841-L845 PolarHBondContact O-N 3.45Å; L845-W848 PolarHBondContact O-N 2.94Å; L845-K849 VanDerWaalsContact O-CB 3.25Å; L845-K849 WeakPolarHBondContact O-CB 3.45Å; L845-K849 PolarHBondContact O-N 2.86Å
846	G	94	Very high	92.8	Very high	38 Å²	38	103.7 Å²	103.7	39%	0.392	51%	0.512	S	S	.	.	H	α-helix	trans	-60.1	-45.4	171.4	0	0	0	0	0	112.6	K842 R843 A844 K849 L850	K842-G846 PolarHBondContact O-N 2.93Å; R843-G846 PolarHBondContact O-N 3.45Å; A844-G846 VanDerWaalsContact C-N 3.32Å; A844-G846 PolarHBondContact O-N 3.33Å; G846-K849 PolarHBondContact O-N 3.29Å; G846-L850 PolarHBondContact O-N 2.99Å
847	N	92.5	Very high	92.6	Very high	111 Å²	111	102.9 Å²	102.9	59%	0.594	51%	0.51	S	S	*	.	H	α-helix	trans	-66.6	-41.4	176	-68.6	-14.3	0	0	0	112.2	R843 A844 L850 L851	R843-N847 WeakPolarHBondContact O-CB 3.37Å; R843-N847 PolarHBondContact O-N 3.39Å; R843-N847 PolarHBondContact O-ND2 3.01Å; A844-N847 CarbonylContact O-C 3.55Å; A844-N847 WeakPolarHBondContact O-CB 3.41Å; A844-N847 PolarHBondContact O-N 3.1Å; A844-N847 VanDerWaalsContact O-N 3.14Å; N847-L850 WeakPolarHBondContact O-CB 3.47Å; N847-L850 PolarHBondContact O-N 3.23Å; N847-L851 WeakPolarHBondContact O-CB 3.41Å; N847-L851 PolarHBondContact O-N 3.34Å
848	W	93.3	Very high	92.4	Very high	170 Å²	170	105.4 Å²	105.4	64%	0.644	52%	0.517	S	S	*	.	H	α-helix	trans	-63.6	-41.3	174.2	-81.6	113.7	0	0	0	112	A844 L845 L850 L851 A852	A844-W848 WeakPolarHBondContact O-CB 3.44Å; A844-W848 PolarHBondContact O-N 2.91Å; L845-W848 PolarHBondContact O-N 2.94Å; W848-L850 VanDerWaalsContact C-N 3.31Å; W848-L850 PolarHBondContact O-N 3.03Å; W848-L851 HydrophobicContact CE3-CD2 3.86Å; W848-L851 HydrophobicContact CZ3-CD2 3.77Å; W848-L851 PolarHBondContact O-N 2.79Å; W848-A852 VanDerWaalsContact O-CB 3.29Å; W848-A852 WeakPolarHBondContact O-CB 3.47Å; W848-A852 PolarHBondContact O-N 3.25Å
849	K	92.8	Very high	92.1	Very high	141 Å²	141	105.5 Å²	105.5	61%	0.613	52%	0.517	S	S	*	.	H	α-helix	trans	-63.1	-37.6	174	-171.7	175.6	-175.3	177.3	0	111.4	L845 G846 K853	L845-K849 VanDerWaalsContact O-CB 3.25Å; L845-K849 WeakPolarHBondContact O-CB 3.45Å; L845-K849 PolarHBondContact O-N 2.86Å; G846-K849 PolarHBondContact O-N 3.29Å; K849-K853 WeakPolarHBondContact O-CB 3.24Å; K849-K853 WeakPolarHBondContact O-CG 3.49Å; K849-K853 PolarHBondContact O-N 3.17Å
850	L	91	Very high	91.7	Very high	125 Å²	125	103.8 Å²	103.8	65%	0.654	51%	0.507	S	S	*	.	H	α-helix	trans	-65.9	-45.8	173.4	-162.1	82.2	0	0	0	111.5	G846 N847 W848 G854	G846-L850 PolarHBondContact O-N 2.99Å; N847-L850 WeakPolarHBondContact O-CB 3.47Å; N847-L850 PolarHBondContact O-N 3.23Å; W848-L850 VanDerWaalsContact C-N 3.31Å; W848-L850 PolarHBondContact O-N 3.03Å; L850-G854 PolarHBondContact O-N 3.4Å
851	L	93.1	Very high	91.4	Very high	93 Å²	93	102.3 Å²	102.3	49%	0.487	51%	0.505	S	S	.	.	H	α-helix	trans	-63.2	-48	178.4	-175.2	68.7	0	0	0	111.8	N847 W848 G854 L855	N847-L851 WeakPolarHBondContact O-CB 3.41Å; N847-L851 PolarHBondContact O-N 3.34Å; W848-L851 HydrophobicContact CE3-CD2 3.86Å; W848-L851 HydrophobicContact CZ3-CD2 3.77Å; W848-L851 PolarHBondContact O-N 2.79Å; L851-G854 CarbonylContact O-C 3.55Å; L851-G854 WeakPolarHBondContact O-CA 3.4Å; L851-G854 PolarHBondContact O-N 2.81Å; L851-G854 VanDerWaalsContact O-N 3.14Å; L851-L855 HydrophobicContact CG-CD1 4.39Å; L851-L855 WeakPolarHBondContact O-CG 3.48Å; L851-L855 PolarHBondContact O-N 2.84Å
852	A	93.7	Very high	91	Very high	48 Å²	48	103.6 Å²	103.6	40%	0.397	51%	0.509	S	S	.	.	H	α-helix	trans	-63	-44	178	0	0	0	0	0	111.8	W848 G854 L855 L856	W848-A852 VanDerWaalsContact O-CB 3.29Å; W848-A852 WeakPolarHBondContact O-CB 3.47Å; W848-A852 PolarHBondContact O-N 3.25Å; A852-G854 VanDerWaalsContact C-N 3.32Å; A852-G854 PolarHBondContact O-N 3.32Å; A852-L855 PolarHBondContact O-N 3.31Å; A852-L856 WeakPolarHBondContact O-CB 3.37Å; A852-L856 WeakPolarHBondContact O-CG 3.43Å; A852-L856 PolarHBondContact O-N 3.05Å
853	K	91.6	Very high	90.5	Very high	115 Å²	115	106.5 Å²	106.5	50%	0.5	52%	0.516	S	S	.	.	H	α-helix	trans	-58.3	-44	170.5	-80.5	-171.6	171.5	-163.5	0	111.5	K849 L855 L856 I857	K849-K853 WeakPolarHBondContact O-CB 3.24Å; K849-K853 WeakPolarHBondContact O-CG 3.49Å; K849-K853 PolarHBondContact O-N 3.17Å; K853-L855 PolarHBondContact O-N 2.84Å; K853-L856 PolarHBondContact O-N 3.19Å; K853-I857 WeakPolarHBondContact O-CB 3.3Å; K853-I857 WeakPolarHBondContact O-CD1 2.96Å; K853-I857 WeakPolarHBondContact O-CG1 3.46Å; K853-I857 PolarHBondContact O-N 2.75Å
854	G	93.4	Very high	89.8	Confident	38 Å²	38	103 Å²	103	39%	0.392	50%	0.503	S	S	.	.	H	α-helix	trans	-60.3	-41.8	176.3	0	0	0	0	0	113.4	L850 L851 A852 R858	L850-G854 PolarHBondContact O-N 3.4Å; L851-G854 CarbonylContact O-C 3.55Å; L851-G854 WeakPolarHBondContact O-CA 3.4Å; L851-G854 PolarHBondContact O-N 2.81Å; L851-G854 VanDerWaalsContact O-N 3.14Å; A852-G854 VanDerWaalsContact C-N 3.32Å; A852-G854 PolarHBondContact O-N 3.32Å; G854-R858 WeakPolarHBondContact O-CB 3.49Å; G854-R858 PolarHBondContact O-N 3.46Å
855	L	93	Very high	89.2	Confident	86 Å²	86	109.6 Å²	109.6	45%	0.45	52%	0.52	S	S	.	.	H	α-helix	trans	-67.6	-45	176.2	-71.3	172.3	0	0	0	112.2	L851 A852 K853 I857 R858 E859	L851-L855 HydrophobicContact CG-CD1 4.39Å; L851-L855 WeakPolarHBondContact O-CG 3.48Å; L851-L855 PolarHBondContact O-N 2.84Å; A852-L855 PolarHBondContact O-N 3.31Å; K853-L855 PolarHBondContact O-N 2.84Å; L855-I857 VanDerWaalsContact C-N 3.34Å; L855-I857 PolarHBondContact O-N 2.97Å; L855-R858 WeakPolarHBondContact O-CB 3.47Å; L855-R858 PolarHBondContact O-N 2.83Å; L855-R858 VanDerWaalsContact O-N 3.15Å; L855-E859 PolarHBondContact O-N 3.49Å
856	L	90.8	Very high	87.8	Confident	114 Å²	114	105.1 Å²	105.1	60%	0.597	50%	0.503	S	S	*	.	H	α-helix	trans	-63.2	-38.5	175.5	-71.4	171	0	0	0	112.1	A852 K853 E859 R860	A852-L856 WeakPolarHBondContact O-CB 3.37Å; A852-L856 WeakPolarHBondContact O-CG 3.43Å; A852-L856 PolarHBondContact O-N 3.05Å; K853-L856 PolarHBondContact O-N 3.19Å; L856-E859 PolarHBondContact O-N 3.41Å; L856-R860 WeakPolarHBondContact O-CB 3.24Å; L856-R860 PolarHBondContact O-N 2.92Å
857	I	86.9	Confident	86.2	Confident	72 Å²	72	109.7 Å²	109.7	37%	0.369	53%	0.525	S	S	.	.	H	α-helix	trans	-64.1	-43.4	172.5	-71	165.3	0	0	0	110.2	K853 L855 E859 R860 L861	K853-I857 WeakPolarHBondContact O-CB 3.3Å; K853-I857 WeakPolarHBondContact O-CD1 2.96Å; K853-I857 WeakPolarHBondContact O-CG1 3.46Å; K853-I857 PolarHBondContact O-N 2.75Å; L855-I857 VanDerWaalsContact C-N 3.34Å; L855-I857 PolarHBondContact O-N 2.97Å; I857-E859 PolarHBondContact O-N 2.81Å; I857-R860 PolarHBondContact O-N 3.28Å; I857-L861 HydrophobicContact CG2-CD1 3.84Å; I857-L861 HydrophobicContact CG2-CG 4.45Å; I857-L861 WeakPolarHBondContact O-CB 3.5Å; I857-L861 VanDerWaalsContact O-CG 3.28Å; I857-L861 WeakPolarHBondContact O-CG 3.36Å; I857-L861 PolarHBondContact O-N 3.1Å
858	R	88.7	Confident	84.2	Confident	156 Å²	156	113.4 Å²	113.4	59%	0.589	54%	0.536	S	S	*	.	H	α-helix	trans	-62.1	-40.6	176.3	-167.8	-179.9	76.3	157.6	1.6	112.3	G854 L855 K862	G854-R858 WeakPolarHBondContact O-CB 3.49Å; G854-R858 PolarHBondContact O-N 3.46Å; L855-R858 WeakPolarHBondContact O-CB 3.47Å; L855-R858 PolarHBondContact O-N 2.83Å; L855-R858 VanDerWaalsContact O-N 3.15Å; R858-K862 PolarHBondContact O-N 3.46Å
859	E	88.3	Confident	82	Confident	87 Å²	87	110.9 Å²	110.9	41%	0.407	54%	0.544	S	S	.	.	H	α-helix	trans	-70.6	-43.2	176.5	-160.3	-164.9	142	0	0	111.8	L855 L856 I857 L861 K862 R863	L855-E859 PolarHBondContact O-N 3.49Å; L856-E859 PolarHBondContact O-N 3.41Å; I857-E859 PolarHBondContact O-N 2.81Å; E859-L861 VanDerWaalsContact C-N 3.29Å; E859-L861 PolarHBondContact O-N 3.5Å; E859-K862 CarbonylContact O-C 3.6Å; E859-K862 WeakPolarHBondContact O-CA 3.49Å; E859-K862 WeakPolarHBondContact O-CB 3.32Å; E859-K862 PolarHBondContact O-N 3.37Å; E859-K862 VanDerWaalsContact O-N 3.08Å; E859-R863 PolarHBondContact O-N 3.12Å; E859-R863 IonicContact OE1-CZ 3.73Å; E859-R863 VanDerWaalsContact OE1-CZ 3.29Å; E859-R863 IonicContact OE1-NE 3.09Å; E859-R863 PolarHBondContact OE1-NE 3.47Å; E859-R863 IonicContact OE1-NH2 3.25Å; E859-R863 PolarHBondContact OE1-NH2 3.48Å
860	R	84.3	Confident	79.5	Confident	87 Å²	87	112.6 Å²	112.6	33%	0.328	56%	0.555	S	S	.	*	H	α-helix	trans	-59.3	-39	173.9	-179.2	-178.4	-76.4	-164.6	-6.1	111.9	L856 I857 R863 R864 I899 S903	L856-R860 WeakPolarHBondContact O-CB 3.24Å; L856-R860 PolarHBondContact O-N 2.92Å; I857-R860 PolarHBondContact O-N 3.28Å; R860-R863 PolarHBondContact O-N 3.26Å; R860-R864 WeakPolarHBondContact O-CG 3.41Å; R860-R864 PolarHBondContact O-N 3.1Å; R860-R864 VanDerWaalsContact O-N 3.08Å; R860-I899 PolarHBondContact NH1-O 3.18Å; R860-S903 PolarHBondContact NH1-OG 2.83Å; R860-S903 VanDerWaalsContact NH1-OG 3.12Å
861	L	85.4	Confident	77.1	Confident	88 Å²	88	111.4 Å²	111.4	46%	0.461	56%	0.563	S	S	.	*	H	α-helix	trans	-65.1	-44.5	172	-76.8	164.6	0	0	0	111.3	I857 E859 R863 R864 Y865	I857-L861 HydrophobicContact CG2-CD1 3.84Å; I857-L861 HydrophobicContact CG2-CG 4.45Å; I857-L861 WeakPolarHBondContact O-CB 3.5Å; I857-L861 VanDerWaalsContact O-CG 3.28Å; I857-L861 WeakPolarHBondContact O-CG 3.36Å; I857-L861 PolarHBondContact O-N 3.1Å; E859-L861 VanDerWaalsContact C-N 3.29Å; E859-L861 PolarHBondContact O-N 3.5Å; L861-R863 VanDerWaalsContact C-N 3.31Å; L861-R863 PolarHBondContact O-N 3.17Å; L861-R864 PolarHBondContact O-N 3Å; L861-Y865 HydrophobicContact CD2-CD2 3.81Å; L861-Y865 HydrophobicContact CD2-CE2 3.89Å; L861-Y865 PolarHBondContact O-N 3.36Å
862	K	85.3	Confident	74.5	Confident	145 Å²	145	111.3 Å²	111.3	63%	0.63	58%	0.576	S	S	*	*	H	α-helix	trans	-60.1	-34.9	172.5	-81.8	-169.3	171	-163.7	0	113.3	R858 E859 G866	R858-K862 PolarHBondContact O-N 3.46Å; E859-K862 CarbonylContact O-C 3.6Å; E859-K862 WeakPolarHBondContact O-CA 3.49Å; E859-K862 WeakPolarHBondContact O-CB 3.32Å; E859-K862 PolarHBondContact O-N 3.37Å; E859-K862 VanDerWaalsContact O-N 3.08Å; K862-G866 WeakPolarHBondContact O-CA 3.45Å; K862-G866 PolarHBondContact O-N 3.16Å
863	R	81.7	Confident	71.9	Confident	193 Å²	193	113.5 Å²	113.5	73%	0.728	59%	0.594	S	S	*	*	H	α-helix	trans	-75.9	-29.7	176.8	-66.9	-170.4	-169.1	-152	5.3	113.4	E859 R860 L861	E859-R863 PolarHBondContact O-N 3.12Å; E859-R863 IonicContact OE1-CZ 3.73Å; E859-R863 VanDerWaalsContact OE1-CZ 3.29Å; E859-R863 IonicContact OE1-NE 3.09Å; E859-R863 PolarHBondContact OE1-NE 3.47Å; E859-R863 IonicContact OE1-NH2 3.25Å; E859-R863 PolarHBondContact OE1-NH2 3.48Å; R860-R863 PolarHBondContact O-N 3.26Å; L861-R863 VanDerWaalsContact C-N 3.31Å; L861-R863 PolarHBondContact O-N 3.17Å
864	R	79	Confident	69.4	Low	96 Å²	96	113.5 Å²	113.5	36%	0.362	61%	0.605	S	S	.	*	H	α-helix	trans	-87.2	-37.2	178.8	-68.9	-174	-162.9	-130.4	6.2	114	R860 L861 A896 L900	R860-R864 WeakPolarHBondContact O-CG 3.41Å; R860-R864 PolarHBondContact O-N 3.1Å; R860-R864 VanDerWaalsContact O-N 3.08Å; L861-R864 PolarHBondContact O-N 3Å; R864-A896 PolarHBondContact NH2-O 2.87Å; R864-L900 VanDerWaalsContact NH1-CD1 3.31Å
865	Y	80	Confident	67	Low	179 Å²	179	120.3 Å²	120.3	70%	0.702	63%	0.627	S	S	*	*	H	α-helix	trans	-127.6	3.5	-171.5	-54	-75.7	0	0	0	113.5	L861	L861-Y865 HydrophobicContact CD2-CD2 3.81Å; L861-Y865 HydrophobicContact CD2-CE2 3.89Å; L861-Y865 PolarHBondContact O-N 3.36Å
866	G	64.1	Low	64.4	Low	25 Å²	25	121.3 Å²	121.3	26%	0.258	64%	0.637	S	S	.	*	S	Bend	trans	-64.1	151.7	162.3	0	0	0	0	0	109.5	K862 K868	K862-G866 WeakPolarHBondContact O-CA 3.45Å; K862-G866 PolarHBondContact O-N 3.16Å; G866-K868 PolarHBondContact O-N 2.67Å
867	P	61.7	Low	62	Low	134 Å²	134	123.5 Å²	123.5	87%	0.87	65%	0.649	S	S	*	*			trans	-59.9	112.9	179.3	25.5	-33.3	0	0	0	108.8	S869	P867-S869 PolarHBondContact O-N 2.85Å; P867-S869 VanDerWaalsContact O-N 3.07Å
868	K	50.5	Low	59.8	Low	189 Å²	189	124.7 Å²	124.7	82%	0.822	67%	0.67	S	S	*	*			trans	-64.6	107.5	161.2	-73.6	-176.5	176.4	-177.1	0	105.5	G866 E870	G866-K868 PolarHBondContact O-N 2.67Å; K868-E870 PolarHBondContact O-N 2.76Å
869	S	46	Very low	57.2	Low	117 Å²	117	121.2 Å²	121.2	82%	0.818	68%	0.682	S	S	*	*			trans	-60.2	123.6	166.7	-168.8	0	0	0	0	107.2	P867	P867-S869 PolarHBondContact O-N 2.85Å; P867-S869 VanDerWaalsContact O-N 3.07Å
870	E	41.6	Very low	54.7	Low	178 Å²	178	121 Å²	121	83%	0.832	70%	0.704	S	S	*	*			trans	-63.4	169.1	161.5	-66.2	178.7	138.9	0	0	109.8	K868	K868-E870 PolarHBondContact O-N 2.76Å
871	A	40.6	Very low	52.4	Low	100 Å²	100	120.5 Å²	120.5	83%	0.826	73%	0.725	S	S	*	*			trans	-8.5	144.9	170.7	0	0	0	0	0	118.7
872	A	38.3	Very low	50.1	Low	91 Å²	91	124.4 Å²	124.4	75%	0.752	75%	0.746	S	S	*	*			cis	-142.9	132.3	32.2	0	0	0	0	0	111.6
873	A	37.7	Very low	48	Very low	94 Å²	94	122.8 Å²	122.8	78%	0.777	75%	0.752	S	S	*	*				79.8	112.6	98	0	0	0	0	0	113.7
874	P	40.3	Very low	46.2	Very low	114 Å²	114	118.1 Å²	118.1	74%	0.74	75%	0.749	S	S	*	*			trans	-99.9	151.5	-175.5	37.7	-33.4	0	0	0	114.3
875	H	42.3	Very low	44.4	Very low	181 Å²	181	120.3 Å²	120.3	84%	0.838	77%	0.768	S	S	*	*			trans	-133.9	101.6	155.3	-72.9	-72.1	0	0	0	105.5
876	T	39	Very low	42.6	Very low	108 Å²	108	120 Å²	120	66%	0.663	77%	0.773	S	S	*	*				75	140.1	81.2	58.2	0	0	0	0	114.3
877	D	39.7	Very low	41.6	Very low	159 Å²	159	127.2 Å²	127.2	85%	0.85	80%	0.8	S	S	*	*			trans	72	139.3	178.4	-54	-22.4	0	0	0	118.2
878	A	40.8	Very low	40.5	Very low	98 Å²	98	129.7 Å²	129.7	81%	0.81	80%	0.8	S	S	*	*			cis	-167.3	143.6	-23.7	0	0	0	0	0	108.3
879	G	35.2	Very low	39.9	Very low	82 Å²	82	123.4 Å²	123.4	85%	0.845	79%	0.789	S	S	*	*			trans	152.7	90	165.7	0	0	0	0	0	118.3
880	G	34.6	Very low	39.7	Very low	84 Å²	84	125.4 Å²	125.4	87%	0.866	80%	0.796	S	S	*	*			trans	74.2	116.4	167.5	0	0	0	0	0	114.5
881	G	36.2	Very low	40.1	Very low	75 Å²	75	120.3 Å²	120.3	77%	0.773	78%	0.78	S	S	*	*			cis	100.3	120.6	44.2	0	0	0	0	0	107.3
882	L	38	Very low	41.3	Very low	171 Å²	171	120.1 Å²	120.1	90%	0.895	77%	0.773	S	S	*	*			cis	-139.3	127.1	28.5	-59.8	158.9	0	0	0	108.9
883	S	41	Very low	42.5	Very low	110 Å²	110	123.7 Å²	123.7	77%	0.769	77%	0.774	S	S	*	*				68.2	100.5	94.9	-159.5	0	0	0	0	114.2
884	S	43.6	Very low	43.9	Very low	95 Å²	95	122.2 Å²	122.2	66%	0.664	76%	0.762	S	S	*	*				73.8	136.5	85.7	-119.5	0	0	0	0	113.3
885	D	40.9	Very low	45.3	Very low	142 Å²	142	121.7 Å²	121.7	76%	0.759	75%	0.75	S	S	*	*			cis	-127.4	156.3	8.9	-62	-51.2	0	0	0	110
886	E	42.1	Very low	46.6	Very low	172 Å²	172	114.7 Å²	114.7	80%	0.804	72%	0.723	S	S	*	*			cis	69.5	88.4	34.6	-66.2	-64.4	154.8	0	0	116
887	E	43.2	Very low	48.2	Very low	178 Å²	178	112.1 Å²	112.1	83%	0.832	71%	0.713	S	S	*	*			trans	-148	140.2	144	-82.3	-146.9	151.6	0	0	111.9
888	E	39.3	Very low	49.7	Very low	186 Å²	186	114.1 Å²	114.1	87%	0.869	71%	0.708	S	S	*	*			trans	43.5	126	162.5	-53.7	-165.2	143.3	0	0	119.6
889	G	38.1	Very low	51.2	Low	57 Å²	57	113.2 Å²	113.2	59%	0.588	69%	0.689	S	S	*	*			cis	127.6	124.2	25.3	0	0	0	0	0	109.6	S891	G889-S891 PolarHBondContact O-N 2.97Å; G889-S891 VanDerWaalsContact O-N 3.12Å
890	T	40.9	Very low	52.6	Low	158 Å²	158	112.2 Å²	112.2	97%	0.969	66%	0.664	S	S	*	*	S	Bend	trans	68.1	-15.1	171.4	70	0	0	0	0	121.8
891	S	50.5	Low	54.1	Low	71 Å²	71	111.2 Å²	111.2	50%	0.497	65%	0.647	S	S	.	*			trans	-76.6	-22.1	-177.5	-173.7	0	0	0	0	116.3	G889 Q893 A894 E895	G889-S891 PolarHBondContact O-N 2.97Å; G889-S891 VanDerWaalsContact O-N 3.12Å; S891-Q893 PolarHBondContact O-N 2.92Å; S891-Q893 VanDerWaalsContact O-N 3.08Å; S891-A894 PolarHBondContact O-N 2.91Å; S891-A894 VanDerWaalsContact O-N 3.14Å; S891-E895 PolarHBondContact O-N 3.5Å; S891-E895 VanDerWaalsContact O-N 3.1Å
892	S	64.7	Low	55.5	Low	96 Å²	96	111.7 Å²	111.7	67%	0.671	64%	0.644	S	S	*	*	H	α-helix	trans	-59.7	-32.7	-157	67.9	0	0	0	0	116.5	A896	S892-A896 WeakPolarHBondContact O-CB 3.44Å; S892-A896 PolarHBondContact O-N 3.46Å
893	Q	65	Low	56.5	Low	166 Å²	166	105.4 Å²	105.4	78%	0.776	62%	0.615	S	S	*	*	H	α-helix	trans	-77.8	-37.2	-179.6	-168.4	173.2	1.9	0	0	112.6	S891 A896 A897	S891-Q893 PolarHBondContact O-N 2.92Å; S891-Q893 VanDerWaalsContact O-N 3.08Å; Q893-A896 PolarHBondContact O-N 3.26Å; Q893-A897 WeakPolarHBondContact O-CB 3.4Å; Q893-A897 PolarHBondContact O-N 3.17Å
894	A	67.4	Low	56.8	Low	63 Å²	63	108.7 Å²	108.7	52%	0.521	61%	0.61	S	S	.	*	H	α-helix	trans	-69	-38.9	175.5	0	0	0	0	0	110.8	S891 A897 R898	S891-A894 PolarHBondContact O-N 2.91Å; S891-A894 VanDerWaalsContact O-N 3.14Å; A894-A897 WeakPolarHBondContact O-CB 3.41Å; A894-A897 PolarHBondContact O-N 3.27Å; A894-R898 PolarHBondContact O-N 2.75Å
895	E	68.5	Low	57.2	Low	104 Å²	104	109.1 Å²	109.1	49%	0.486	61%	0.61	S	S	.	*	H	α-helix	trans	-67.1	-44	173	-171	164.3	-161.3	0	0	111.8	S891 A897 R898 I899	S891-E895 PolarHBondContact O-N 3.5Å; S891-E895 VanDerWaalsContact O-N 3.1Å; E895-A897 PolarHBondContact O-N 2.73Å; E895-A897 VanDerWaalsContact O-N 3.16Å; E895-R898 PolarHBondContact O-N 2.87Å; E895-I899 HydrophobicContact CG-CD1 3.78Å; E895-I899 HydrophobicContact CG-CG1 4.42Å; E895-I899 VanDerWaalsContact O-CB 3.3Å; E895-I899 WeakPolarHBondContact O-CB 3.39Å; E895-I899 VanDerWaalsContact O-CG1 3.29Å; E895-I899 WeakPolarHBondContact O-CG1 3.42Å; E895-I899 PolarHBondContact O-N 2.96Å
896	A	70.3	Confident	57.5	Low	34 Å²	34	108.4 Å²	108.4	28%	0.281	60%	0.603	S	S	.	*	H	α-helix	trans	-63.6	-18.6	173	0	0	0	0	0	114.1	R864 S892 Q893 L900	R864-A896 PolarHBondContact NH2-O 2.87Å; S892-A896 WeakPolarHBondContact O-CB 3.44Å; S892-A896 PolarHBondContact O-N 3.46Å; Q893-A896 PolarHBondContact O-N 3.26Å; A896-L900 WeakPolarHBondContact O-CB 3.32Å; A896-L900 PolarHBondContact O-N 2.87Å
897	A	71.9	Confident	57.9	Low	53 Å²	53	104.3 Å²	104.3	44%	0.438	59%	0.586	S	S	.	*	H	α-helix	trans	-85.6	-44.2	171.4	0	0	0	0	0	112.3	Q893 A894 E895 I899 L900 A901	Q893-A897 WeakPolarHBondContact O-CB 3.4Å; Q893-A897 PolarHBondContact O-N 3.17Å; A894-A897 WeakPolarHBondContact O-CB 3.41Å; A894-A897 PolarHBondContact O-N 3.27Å; E895-A897 PolarHBondContact O-N 2.73Å; E895-A897 VanDerWaalsContact O-N 3.16Å; A897-I899 VanDerWaalsContact C-N 3.33Å; A897-I899 PolarHBondContact O-N 3Å; A897-L900 WeakPolarHBondContact O-CA 3.43Å; A897-L900 WeakPolarHBondContact O-CB 3.15Å; A897-L900 PolarHBondContact O-N 3.42Å; A897-A901 PolarHBondContact O-N 3.17Å
898	R	72	Confident	58	Low	202 Å²	202	105.7 Å²	105.7	76%	0.762	58%	0.584	S	S	*	*	H	α-helix	trans	-57.8	-45.3	171	-75.6	179.5	174.5	171.5	-0.3	111.5	A894 E895 L900 A901 A902	A894-R898 PolarHBondContact O-N 2.75Å; E895-R898 PolarHBondContact O-N 2.87Å; R898-L900 PolarHBondContact O-N 3.45Å; R898-A901 PolarHBondContact O-N 3.22Å; R898-A902 WeakPolarHBondContact O-CB 3.44Å; R898-A902 PolarHBondContact O-N 2.89Å
899	I	71.9	Confident	58.4	Low	78 Å²	78	102.6 Å²	102.6	40%	0.4	57%	0.569	S	S	.	*	H	α-helix	trans	-67.7	-19.5	174.5	-67	170.8	0	0	0	112.2	R860 E895 A897 S903	R860-I899 PolarHBondContact NH1-O 3.18Å; E895-I899 HydrophobicContact CG-CD1 3.78Å; E895-I899 HydrophobicContact CG-CG1 4.42Å; E895-I899 VanDerWaalsContact O-CB 3.3Å; E895-I899 WeakPolarHBondContact O-CB 3.39Å; E895-I899 VanDerWaalsContact O-CG1 3.29Å; E895-I899 WeakPolarHBondContact O-CG1 3.42Å; E895-I899 PolarHBondContact O-N 2.96Å; A897-I899 VanDerWaalsContact C-N 3.33Å; A897-I899 PolarHBondContact O-N 3Å; I899-S903 VanDerWaalsContact O-CB 3.29Å; I899-S903 WeakPolarHBondContact O-CB 3.48Å; I899-S903 PolarHBondContact O-OG 2.93Å
900	L	63.8	Low	58.9	Low	62 Å²	62	103.1 Å²	103.1	33%	0.325	56%	0.559	S	S	.	*	H	α-helix	trans	-77.5	-51.4	171.6	-133.2	177	0	0	0	110.7	R864 A896 A897 R898 A902 S903 W904	R864-L900 VanDerWaalsContact NH1-CD1 3.31Å; A896-L900 WeakPolarHBondContact O-CB 3.32Å; A896-L900 PolarHBondContact O-N 2.87Å; A897-L900 WeakPolarHBondContact O-CA 3.43Å; A897-L900 WeakPolarHBondContact O-CB 3.15Å; A897-L900 PolarHBondContact O-N 3.42Å; R898-L900 PolarHBondContact O-N 3.45Å; L900-A902 PolarHBondContact O-N 3.1Å; L900-S903 WeakPolarHBondContact CA-OG 3.31Å; L900-S903 WeakPolarHBondContact O-CA 3.38Å; L900-S903 PolarHBondContact O-N 3.09Å; L900-S903 PolarHBondContact O-OG 3.35Å; L900-W904 PolarHBondContact O-N 2.79Å
901	A	67.1	Low	59.4	Low	62 Å²	62	101 Å²	101	51%	0.512	54%	0.538	S	S	.	.	H	α-helix	trans	-57.1	-47.8	177.3	0	0	0	0	0	111.3	A897 R898 S903 W904	A897-A901 PolarHBondContact O-N 3.17Å; R898-A901 PolarHBondContact O-N 3.22Å; A901-S903 PolarHBondContact O-N 2.74Å; A901-S903 VanDerWaalsContact O-N 3.11Å; A901-W904 PolarHBondContact O-N 3.08Å
902	A	65.5	Low	59.5	Low	85 Å²	85	104 Å²	104	70%	0.702	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-9.8	175.3	0	0	0	0	0	114.7	R898 L900	R898-A902 WeakPolarHBondContact O-CB 3.44Å; R898-A902 PolarHBondContact O-N 2.89Å; L900-A902 PolarHBondContact O-N 3.1Å
903	S	58.3	Low	59	Low	40 Å²	40	104 Å²	104	28%	0.28	53%	0.532	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-8	178.7	69.6	0	0	0	0	114.7	R860 I899 L900 A901	R860-S903 PolarHBondContact NH1-OG 2.83Å; R860-S903 VanDerWaalsContact NH1-OG 3.12Å; I899-S903 VanDerWaalsContact O-CB 3.29Å; I899-S903 WeakPolarHBondContact O-CB 3.48Å; I899-S903 PolarHBondContact O-OG 2.93Å; L900-S903 WeakPolarHBondContact CA-OG 3.31Å; L900-S903 WeakPolarHBondContact O-CA 3.38Å; L900-S903 PolarHBondContact O-N 3.09Å; L900-S903 PolarHBondContact O-OG 3.35Å; A901-S903 PolarHBondContact O-N 2.74Å; A901-S903 VanDerWaalsContact O-N 3.11Å
904	W	48.8	Very low	58.6	Low	179 Å²	179	102.8 Å²	102.8	68%	0.678	53%	0.526	S	S	*	.	S	Bend	trans	-78.4	145.6	173.9	-106.1	73.8	0	0	0	111.6	L900 A901 Q906	L900-W904 PolarHBondContact O-N 2.79Å; A901-W904 PolarHBondContact O-N 3.08Å; W904-Q906 PolarHBondContact O-N 3.29Å
905	P	51.1	Low	57.9	Low	103 Å²	103	107.4 Å²	107.4	67%	0.669	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.5	53.8	-175.1	33.2	-37.4	0	0	0	114	N907	P905-N907 VanDerWaalsContact C-N 3.28Å
906	Q	47.2	Very low	57	Low	127 Å²	127	108.3 Å²	108.3	59%	0.593	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-25.1	167.4	-78	177.7	-87.3	0	0	112.4	W904 R908 E909 D910	W904-Q906 PolarHBondContact O-N 3.29Å; Q906-R908 PolarHBondContact O-N 3.35Å; Q906-E909 PolarHBondContact O-N 2.82Å; Q906-D910 PolarHBondContact O-N 3.48Å
907	N	49.6	Very low	56.2	Low	86 Å²	86	115.4 Å²	115.4	46%	0.46	57%	0.567	S	S	.	*	H	α-helix	trans	-52.6	-19.8	-179.6	-69.7	48.3	0	0	0	115.4	P905 D910 E911	P905-N907 VanDerWaalsContact C-N 3.28Å; N907-D910 PolarHBondContact O-N 2.88Å; N907-E911 WeakPolarHBondContact O-CB 3.22Å; N907-E911 WeakPolarHBondContact O-CG 3.41Å; N907-E911 PolarHBondContact O-N 3.44Å
908	R	45.2	Very low	55.3	Low	207 Å²	207	116.3 Å²	116.3	78%	0.781	58%	0.581	S	S	*	*	H	α-helix	trans	-70	-36	178.1	-147.5	175.7	-165.6	134.7	4.7	112.1	Q906	Q906-R908 PolarHBondContact O-N 3.35Å
909	E	47.7	Very low	53.9	Low	121 Å²	121	108.9 Å²	108.9	57%	0.565	57%	0.567	S	S	*	*	H	α-helix	trans	-78.9	-36.4	171.4	-67.2	-174.1	-156.4	0	0	111.7	Q906 E912 K913	Q906-E909 PolarHBondContact O-N 2.82Å; E909-E912 PolarHBondContact O-N 3.17Å; E909-K913 HydrophobicContact CB-CD 4.49Å; E909-K913 WeakPolarHBondContact O-CB 3.44Å; E909-K913 VanDerWaalsContact O-CG 3.22Å; E909-K913 WeakPolarHBondContact O-CG 3.39Å; E909-K913 PolarHBondContact O-N 3.44Å; E909-K913 IonicContact OE2-NZ 2.8Å; E909-K913 PolarHBondContact OE2-NZ 3.1Å
910	D	50.1	Low	53.1	Low	69 Å²	69	111.1 Å²	111.1	37%	0.369	59%	0.587	S	S	.	*	H	α-helix	trans	-75	-30.8	-176.5	-66.1	-36.7	0	0	0	113.2	Q906 N907 K913 Q914	Q906-D910 PolarHBondContact O-N 3.48Å; N907-D910 PolarHBondContact O-N 2.88Å; D910-K913 PolarHBondContact O-N 2.96Å; D910-Q914 VanDerWaalsContact O-CB 3.27Å; D910-Q914 WeakPolarHBondContact O-CB 3.28Å; D910-Q914 VanDerWaalsContact O-CG 3.3Å; D910-Q914 WeakPolarHBondContact O-CG 3.12Å; D910-Q914 PolarHBondContact O-N 3.49Å
911	E	51.7	Low	52.7	Low	112 Å²	112	118.2 Å²	118.2	52%	0.523	62%	0.615	S	S	.	*	H	α-helix	trans	-67.4	-34.4	169.1	-77.4	-175.8	-162.5	0	0	112.1	N907 K915	N907-E911 WeakPolarHBondContact O-CB 3.22Å; N907-E911 WeakPolarHBondContact O-CG 3.41Å; N907-E911 PolarHBondContact O-N 3.44Å; E911-K915 WeakPolarHBondContact O-CB 3.43Å; E911-K915 VanDerWaalsContact O-CG 3.32Å; E911-K915 WeakPolarHBondContact O-CG 3.44Å; E911-K915 PolarHBondContact O-N 3.34Å
912	E	50.9	Low	52.4	Low	134 Å²	134	120.8 Å²	120.8	63%	0.626	61%	0.614	S	S	*	*	H	α-helix	trans	-71.1	-43.9	172.5	-73.3	-174.7	169.2	0	0	111.3	E909 Q914 K915 L916	E909-E912 PolarHBondContact O-N 3.17Å; E912-Q914 VanDerWaalsContact C-N 3.35Å; E912-Q914 PolarHBondContact O-N 3.14Å; E912-K915 PolarHBondContact O-N 3.21Å; E912-L916 WeakPolarHBondContact O-CB 3.31Å; E912-L916 VanDerWaalsContact O-CG 3.23Å; E912-L916 WeakPolarHBondContact O-CG 3.47Å; E912-L916 PolarHBondContact O-N 3.11Å
913	K	55.4	Low	52.9	Low	97 Å²	97	120.3 Å²	120.3	42%	0.422	60%	0.603	S	S	.	*	H	α-helix	trans	-65	-33.9	175.5	-69.7	164.5	-167.1	164.7	0	112.4	E909 D910 K917	E909-K913 HydrophobicContact CB-CD 4.49Å; E909-K913 WeakPolarHBondContact O-CB 3.44Å; E909-K913 VanDerWaalsContact O-CG 3.22Å; E909-K913 WeakPolarHBondContact O-CG 3.39Å; E909-K913 PolarHBondContact O-N 3.44Å; E909-K913 IonicContact OE2-NZ 2.8Å; E909-K913 PolarHBondContact OE2-NZ 3.1Å; D910-K913 PolarHBondContact O-N 2.96Å; K913-K917 WeakPolarHBondContact O-CB 3.21Å; K913-K917 WeakPolarHBondContact O-CG 3.26Å; K913-K917 PolarHBondContact O-N 3.19Å; K913-K917 VanDerWaalsContact O-N 3.16Å
914	Q	55.3	Low	53.7	Low	141 Å²	141	127.5 Å²	127.5	66%	0.659	63%	0.629	S	S	*	*	H	α-helix	trans	-73.4	-42.6	173.5	-77.2	-175.5	-3.7	0	0	112.1	D910 E912 L916 K917 G918	D910-Q914 VanDerWaalsContact O-CB 3.27Å; D910-Q914 WeakPolarHBondContact O-CB 3.28Å; D910-Q914 VanDerWaalsContact O-CG 3.3Å; D910-Q914 WeakPolarHBondContact O-CG 3.12Å; D910-Q914 PolarHBondContact O-N 3.49Å; E912-Q914 VanDerWaalsContact C-N 3.35Å; E912-Q914 PolarHBondContact O-N 3.14Å; Q914-L916 PolarHBondContact O-N 3.13Å; Q914-K917 PolarHBondContact O-N 3.3Å; Q914-G918 PolarHBondContact O-N 2.69Å
915	K	52.5	Low	55	Low	160 Å²	160	129.3 Å²	129.3	70%	0.696	64%	0.636	S	S	*	*	H	α-helix	trans	-61	-33.2	172	-78.5	174.6	178.2	170.1	0	112.6	E911 E912 K917	E911-K915 WeakPolarHBondContact O-CB 3.43Å; E911-K915 VanDerWaalsContact O-CG 3.32Å; E911-K915 WeakPolarHBondContact O-CG 3.44Å; E911-K915 PolarHBondContact O-N 3.34Å; E912-K915 PolarHBondContact O-N 3.21Å; K915-K917 VanDerWaalsContact C-N 3.34Å
916	L	51.5	Low	56.1	Low	123 Å²	123	128.7 Å²	128.7	64%	0.644	62%	0.624	S	S	*	*	H	α-helix	trans	-73.9	-20.2	173.2	-72.6	167.7	0	0	0	113.9	E912 Q914	E912-L916 WeakPolarHBondContact O-CB 3.31Å; E912-L916 VanDerWaalsContact O-CG 3.23Å; E912-L916 WeakPolarHBondContact O-CG 3.47Å; E912-L916 PolarHBondContact O-N 3.11Å; Q914-L916 PolarHBondContact O-N 3.13Å
917	K	53.1	Low	57.4	Low	183 Å²	183	129.5 Å²	129.5	80%	0.796	63%	0.626	S	S	*	*	H	α-helix	trans	-93.9	-22.2	178.4	-78.5	179.2	176.7	-176	0	114.6	K913 Q914 K915	K913-K917 WeakPolarHBondContact O-CB 3.21Å; K913-K917 WeakPolarHBondContact O-CG 3.26Å; K913-K917 PolarHBondContact O-N 3.19Å; K913-K917 VanDerWaalsContact O-N 3.16Å; Q914-K917 PolarHBondContact O-N 3.3Å; K915-K917 VanDerWaalsContact C-N 3.34Å
918	G	51.7	Low	58.7	Low	71 Å²	71	133.2 Å²	133.2	73%	0.732	64%	0.638	S	S	*	*	H	α-helix	trans	-98.5	-4.8	-178	0	0	0	0	0	116.4	Q914	Q914-G918 PolarHBondContact O-N 2.69Å
919	G	44.1	Very low	60.3	Low	46 Å²	46	125.6 Å²	125.6	47%	0.474	62%	0.619	S	S	.	*	S	Bend	trans	-82.8	152.1	-177.2	0	0	0	0	0	114
920	P	53.8	Low	61.5	Low	125 Å²	125	122.5 Å²	122.5	81%	0.812	61%	0.614	S	S	*	*			trans	-57	151.7	171	25.6	-34	0	0	0	111.2	K922	P920-K922 PolarHBondContact O-N 2.94Å
921	K	55	Low	62.7	Low	211 Å²	211	121.3 Å²	121.3	92%	0.917	61%	0.614	S	S	*	*			trans	-58.3	100	-173.9	-72.4	177.4	179	171.8	0	111.3	T923	K921-T923 PolarHBondContact O-N 3.43Å
922	K	60.8	Low	63.9	Low	116 Å²	116	120 Å²	120	50%	0.504	62%	0.618	S	S	.	*			trans	-46.6	129.7	177.6	-69.3	-171	176.7	-174.1	0	112	P920 E926 K927	P920-K922 PolarHBondContact O-N 2.94Å; K922-E926 WeakPolarHBondContact CA-OE2 3.43Å; K922-E926 HydrophobicContact CB-CB 4.35Å; K922-K927 HydrophobicContact CB-CG 4.47Å
923	T	76.7	Confident	65	Low	76 Å²	76	121.1 Å²	121.1	47%	0.466	62%	0.622	S	S	.	*			trans	-62.3	157.9	-178.6	63.8	0	0	0	0	111.7	K921 R925 E926 K927	K921-T923 PolarHBondContact O-N 3.43Å; T923-R925 PolarHBondContact O-N 3.31Å; T923-R925 VanDerWaalsContact O-N 3.11Å; T923-E926 PolarHBondContact N-OE2 3.43Å; T923-E926 PolarHBondContact O-N 3.12Å; T923-E926 WeakPolarHBondContact OG1-CG 3.33Å; T923-E926 PolarHBondContact OG1-N 3.06Å; T923-E926 PolarHBondContact OG1-OE2 2.76Å; T923-K927 PolarHBondContact O-N 3.27Å; T923-K927 VanDerWaalsContact O-N 3.1Å
924	K	76	Confident	66.1	Low	190 Å²	190	120.5 Å²	120.5	83%	0.826	62%	0.623	S	S	*	*	H	α-helix	trans	-60.1	-22.4	175.4	-159.3	173.9	-174.7	176.7	0	112.3	K928	K924-K928 PolarHBondContact O-N 3.42Å
925	R	75.6	Confident	66.6	Low	218 Å²	218	120 Å²	120	82%	0.823	62%	0.619	S	S	*	*	H	α-helix	trans	-77.2	-47.3	176.1	-169.3	174	176.5	178.6	-3.8	111.8	T923 K927 K928 A929	T923-R925 PolarHBondContact O-N 3.31Å; T923-R925 VanDerWaalsContact O-N 3.11Å; R925-K927 VanDerWaalsContact C-N 3.35Å; R925-K927 PolarHBondContact O-N 3.21Å; R925-K928 PolarHBondContact O-N 3.08Å; R925-A929 PolarHBondContact O-N 3.24Å
926	E	74.3	Confident	67.5	Low	90 Å²	90	116.9 Å²	116.9	42%	0.421	62%	0.615	S	S	.	*	H	α-helix	trans	-60.4	-41.1	173.7	-74.2	168.9	93.4	0	0	112.6	K922 T923 K928 A929 A930	K922-E926 WeakPolarHBondContact CA-OE2 3.43Å; K922-E926 HydrophobicContact CB-CB 4.35Å; T923-E926 PolarHBondContact N-OE2 3.43Å; T923-E926 PolarHBondContact O-N 3.12Å; T923-E926 WeakPolarHBondContact OG1-CG 3.33Å; T923-E926 PolarHBondContact OG1-N 3.06Å; T923-E926 PolarHBondContact OG1-OE2 2.76Å; E926-K928 VanDerWaalsContact C-N 3.27Å; E926-K928 PolarHBondContact O-N 3.1Å; E926-A929 PolarHBondContact O-N 3.13Å; E926-A929 VanDerWaalsContact O-N 3.16Å; E926-A930 WeakPolarHBondContact O-CB 3.44Å; E926-A930 PolarHBondContact O-N 3.28Å
927	K	73.8	Confident	69	Low	143 Å²	143	117.9 Å²	117.9	62%	0.622	61%	0.614	S	S	*	*	H	α-helix	trans	-60.8	-36.9	176.1	-70.4	-171.9	179.5	-174	0	112.2	K922 T923 R925 A931	K922-K927 HydrophobicContact CB-CG 4.47Å; T923-K927 PolarHBondContact O-N 3.27Å; T923-K927 VanDerWaalsContact O-N 3.1Å; R925-K927 VanDerWaalsContact C-N 3.35Å; R925-K927 PolarHBondContact O-N 3.21Å; K927-A931 WeakPolarHBondContact O-CB 3.28Å; K927-A931 PolarHBondContact O-N 3Å; K927-A931 VanDerWaalsContact O-N 3.1Å
928	K	78.4	Confident	70	Confident	164 Å²	164	113.4 Å²	113.4	71%	0.713	60%	0.596	S	S	*	*	H	α-helix	trans	-70.1	-38.8	172.8	-87	-169.3	170.5	-171.5	0	112.9	K924 R925 E926 A931 S932	K924-K928 PolarHBondContact O-N 3.42Å; R925-K928 PolarHBondContact O-N 3.08Å; E926-K928 VanDerWaalsContact C-N 3.27Å; E926-K928 PolarHBondContact O-N 3.1Å; K928-A931 PolarHBondContact O-N 2.95Å; K928-S932 PolarHBondContact O-N 2.93Å; K928-S932 VanDerWaalsContact O-N 3.1Å
929	A	77.1	Confident	71.1	Confident	47 Å²	47	115.8 Å²	115.8	39%	0.388	59%	0.588	S	S	.	*	H	α-helix	trans	-62.7	-50	175.8	0	0	0	0	0	111	R925 E926 A931 S932 H933	R925-A929 PolarHBondContact O-N 3.24Å; E926-A929 PolarHBondContact O-N 3.13Å; E926-A929 VanDerWaalsContact O-N 3.16Å; A929-A931 VanDerWaalsContact C-N 3.34Å; A929-A931 PolarHBondContact O-N 3.1Å; A929-S932 WeakPolarHBondContact O-CB 3.44Å; A929-S932 PolarHBondContact O-N 3.14Å; A929-S932 PolarHBondContact O-OG 3.05Å; A929-H933 PolarHBondContact O-CD2 2.93Å; A929-H933 PolarHBondContact O-N 3.16Å
930	A	73.8	Confident	72	Confident	57 Å²	57	123.6 Å²	123.6	47%	0.471	62%	0.618	S	S	.	*	H	α-helix	trans	-56.9	-44.9	175.6	0	0	0	0	0	112.4	E926 S932 H933	E926-A930 WeakPolarHBondContact O-CB 3.44Å; E926-A930 PolarHBondContact O-N 3.28Å; A930-S932 PolarHBondContact O-N 2.69Å; A930-H933 PolarHBondContact O-N 2.93Å; A930-H933 VanDerWaalsContact O-N 3.12Å
931	A	74.8	Confident	72.9	Confident	43 Å²	43	123.5 Å²	123.5	36%	0.355	61%	0.608	S	S	.	*	H	α-helix	trans	-62.3	-27.3	176	0	0	0	0	0	113.6	K927 K928 A929 H933 Q939	K927-A931 WeakPolarHBondContact O-CB 3.28Å; K927-A931 PolarHBondContact O-N 3Å; K927-A931 VanDerWaalsContact O-N 3.1Å; K928-A931 PolarHBondContact O-N 2.95Å; A929-A931 VanDerWaalsContact C-N 3.34Å; A929-A931 PolarHBondContact O-N 3.1Å; A931-H933 VanDerWaalsContact C-N 3.29Å; A931-H933 PolarHBondContact O-N 3.47Å; A931-Q939 PolarHBondContact O-NE2 2.6Å
932	S	78.1	Confident	73.9	Confident	86 Å²	86	118.9 Å²	118.9	60%	0.601	59%	0.592	S	S	*	*	H	α-helix	trans	-77.5	-9.9	176.8	74.9	0	0	0	0	114.8	K928 A929 A930	K928-S932 PolarHBondContact O-N 2.93Å; K928-S932 VanDerWaalsContact O-N 3.1Å; A929-S932 WeakPolarHBondContact O-CB 3.44Å; A929-S932 PolarHBondContact O-N 3.14Å; A929-S932 PolarHBondContact O-OG 3.05Å; A930-S932 PolarHBondContact O-N 2.69Å
933	H	73.5	Confident	74.6	Confident	157 Å²	157	119.1 Å²	119.1	73%	0.727	60%	0.597	S	S	*	*	H	α-helix	trans	-99	-12	175.1	-69.1	-67.9	0	0	0	114	A929 A930 A931	A929-H933 PolarHBondContact O-CD2 2.93Å; A929-H933 PolarHBondContact O-N 3.16Å; A930-H933 PolarHBondContact O-N 2.93Å; A930-H933 VanDerWaalsContact O-N 3.12Å; A931-H933 VanDerWaalsContact C-N 3.29Å; A931-H933 PolarHBondContact O-N 3.47Å
934	L	77.4	Confident	74.5	Confident	83 Å²	83	121.6 Å²	121.6	44%	0.435	61%	0.605	S	S	.	*	S	Bend	trans	-73.3	139.5	173.9	-69.3	170.8	0	0	0	110.8	E938 Q939	L934-E938 WeakPolarHBondContact CA-OE2 3.2Å; L934-E938 HydrophobicContact CB-CB 4.13Å; L934-E938 HydrophobicContact CD2-CB 3.98Å; L934-Q939 HydrophobicContact CB-CG 4.02Å
935	F	66.6	Low	74.4	Confident	132 Å²	132	117.3 Å²	117.3	58%	0.579	59%	0.591	S	S	*	*			trans	-67.8	156.8	171.7	-81.5	-88.5	0	0	0	111.1	F937 E938 Q939	F935-F937 HydrophobicContact CB-CD1 3.68Å; F935-F937 HydrophobicContact CB-CE1 3.44Å; F935-F937 VanDerWaalsContact CB-CE1 3.44Å; F935-F937 HydrophobicContact CB-CZ 4.23Å; F935-F937 HydrophobicContact CD1-CE1 4.44Å; F935-F937 HydrophobicContact CD2-CE1 4.44Å; F935-F937 HydrophobicContact CG-CD1 4.48Å; F935-F937 AromaticContact CG-CE1 3.89Å; F935-F937 HydrophobicContact CG-CE1 3.89Å; F935-F937 PolarHBondContact O-N 3.19Å; F935-E938 HydrophobicContact CB-CG 4.21Å; F935-E938 PolarHBondContact N-OE2 3.46Å; F935-E938 CarbonylContact O-C 3.59Å; F935-E938 WeakPolarHBondContact O-CA 3.43Å; F935-E938 WeakPolarHBondContact O-CB 3.19Å; F935-E938 PolarHBondContact O-N 3.11Å; F935-Q939 PolarHBondContact O-N 3.15Å
936	P	72.4	Confident	74.3	Confident	94 Å²	94	110.6 Å²	110.6	61%	0.61	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-23.3	-179.6	-27.6	36.1	0	0	0	115.5
937	F	82.5	Confident	74.3	Confident	144 Å²	144	112.1 Å²	112.1	63%	0.632	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-10.9	174.2	75.6	-92.3	0	0	0	113.6	F935	F935-F937 HydrophobicContact CB-CD1 3.68Å; F935-F937 HydrophobicContact CB-CE1 3.44Å; F935-F937 VanDerWaalsContact CB-CE1 3.44Å; F935-F937 HydrophobicContact CB-CZ 4.23Å; F935-F937 HydrophobicContact CD1-CE1 4.44Å; F935-F937 HydrophobicContact CD2-CE1 4.44Å; F935-F937 HydrophobicContact CG-CD1 4.48Å; F935-F937 AromaticContact CG-CE1 3.89Å; F935-F937 HydrophobicContact CG-CE1 3.89Å; F935-F937 PolarHBondContact O-N 3.19Å
938	E	74.1	Confident	74.3	Confident	89 Å²	89	109.7 Å²	109.7	42%	0.416	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-98.3	-3.4	172.1	-53.9	173	142.4	0	0	111.4	L934 F935	L934-E938 WeakPolarHBondContact CA-OE2 3.2Å; L934-E938 HydrophobicContact CB-CB 4.13Å; L934-E938 HydrophobicContact CD2-CB 3.98Å; F935-E938 HydrophobicContact CB-CG 4.21Å; F935-E938 PolarHBondContact N-OE2 3.46Å; F935-E938 CarbonylContact O-C 3.59Å; F935-E938 WeakPolarHBondContact O-CA 3.43Å; F935-E938 WeakPolarHBondContact O-CB 3.19Å; F935-E938 PolarHBondContact O-N 3.11Å
939	Q	74.7	Confident	74	Confident	121 Å²	121	105.2 Å²	105.2	57%	0.565	57%	0.573	S	S	*	*			trans	-96.5	-6.6	171	-68.7	-175.5	-9.4	0	0	112.9	A931 L934 F935	A931-Q939 PolarHBondContact O-NE2 2.6Å; L934-Q939 HydrophobicContact CB-CG 4.02Å; F935-Q939 PolarHBondContact O-N 3.15Å
940	L	62.6	Low	73.7	Confident	209 Å²	209	110.5 Å²	110.5	100%	1.094	59%	0.59	S	S	*	*			trans	-96.9	0	172	-75.3	166.4	0	0	0	109.9

Retrieved 940 of 940 residues in 327.7 ms (Link to these results)

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