A0A3Q0KGB0_SCHMA Loading...

GYF domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KGB0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,136 aa.

						>A0A3Q0KGB0_SCHMA|A0A3Q0KGB0
MTAQPESFQFSPQWIRELSDDAFNSRRQSSRSPTEGRVSSKSPSLFSNFVQKHSNCSVPGDKRKDMVVGKVSKLVWPGDTIYATSVAETDSQGQSSREVIKQYSHSIQFSDSIYGQKSNANQLINPASHCVDTSKQAIQWTQKSSLISPPEPCWQLHSDSGIETSVNKIPDTINLNTAGHSLPSSSARPLEVQHVGASLLSGNSSVVSNATLNINSILPNDGIPVPRSDPYSQNNTDSYNNQSKRAVSAYYGINDADKNLDSSVNSNAIWMQQHIWSKSVPQHLHGFNPTDSTSNSVSSFCGVAATETNRHSSCSVPDADNIHGFFSQLPSFNRLVQPNSNQAYSLSNSSVQHPPNMQSAEKGFVRRNGSDQSDEHMWLYEDPQGRTQGTFSDAQMNEWLMAGIYFTPNLRIRRQCDDTFSTLASYTQLFERVPFVSGPRIPPIRGEINQAMLALSTSGFLNKPHFKNSDNPPTDVLPCNSTNHDQSDGSRVNANMVGNSTVDTSRSLLSEPQHQLYQQLSDFSTSACIAATSVAGISVPTCQVTEESLNTTNSKSLSYGFINTSVPVSAPMSLLNNSINNLRIRDNVEVDFKSVLDNPNNVQQHKPTISSTSTFMNLTSLIPMNPSFPSFNLQFPSRLQGTNGTTMDDLTSAASSFLSPGFWSVLTQYLNLHPPSANQTSTPMQQLAETAQLAAQLAALVGSHSPDQTPMQPSQALALAQLLIARGVGLGSINTETPASNGLLTSKKDKPSDNECIANSSIFHTSEISAVNERRQESQAQWPSLGSTLNQNASHCSEGRFNPVPLNKVSSELSYGKNCGNDSSDNTSTVSQNHHNCRPNYLDKPQSTPSKPSTSPRPTNVKSKIQPDSTLSEPIQSISSDGYNRTQQNGRGPKNTEVCSGGSVRSTEQKQTAVSSSRTGSTNQSRVKGSKSNNVRSPTKVVVQNNSLSSQISSSVNIRPMEAACTPVASNSETDPDQTVEDELKKLTQWCQSRLGSMPMREKVDIPTVVELLATLDAPYEVERMVQTFLGETARTAQFVKDFLDRRRPFWQLHRKRREQESTIQASTGQNSSNQPTSTVRSTEKKKRTNPNDTAINNTQRQNSSICNGLSWNKSDSTHLSNVEQIQDNQVGILSI
					

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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	38.4	Very low	36.9	Very low	244 Å²	244	152 Å²	152	100%	1.202	82%	0.822	S	S	*	*				0	105.6	0	-80.8	175.6	163.6	0	0	106.2
2	T	34.7	Very low	36.6	Very low	147 Å²	147	148 Å²	148	90%	0.902	81%	0.81	S	S	*	*			trans	-135.1	109.8	-166.2	-10.7	0	0	0	0	106.1
3	A	45.7	Very low	36.5	Very low	101 Å²	101	150 Å²	150	84%	0.835	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-101.3	128.2	173.5	0	0	0	0	0	107.7
4	Q	37	Very low	36.5	Very low	184 Å²	184	152.5 Å²	152.5	86%	0.86	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-82.5	151.7	167.8	-74	-164.1	-26.3	0	0	110
5	P	44.9	Very low	36.4	Very low	123 Å²	123	150.2 Å²	150.2	80%	0.799	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-74.3	129.1	164.9	31.5	-31.6	0	0	0	109.7
6	E	38.8	Very low	36.4	Very low	166 Å²	166	155.1 Å²	155.1	78%	0.776	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-75.1	125.7	173.2	-67	-179.4	134	0	0	110.5	F8	E6-F8 HydrophobicContact CB-CE2 4.36Å; E6-F8 PolarHBondContact O-N 2.74Å
7	S	34.7	Very low	36.3	Very low	113 Å²	113	156.8 Å²	156.8	79%	0.79	80%	0.798	S	S	*	*			trans	-81.5	100.8	173.7	53.1	0	0	0	0	110.7	Q9	S7-Q9 PolarHBondContact O-N 2.75Å
8	F	32.9	Very low	36.3	Very low	156 Å²	156	157.3 Å²	157.3	68%	0.684	80%	0.802	S	S	*	*			trans	-73.1	87	176.5	-90.3	-87	0	0	0	112.2	E6 F10	E6-F8 HydrophobicContact CB-CE2 4.36Å; E6-F8 PolarHBondContact O-N 2.74Å; F8-F10 HydrophobicContact CB-CD2 4.31Å; F8-F10 HydrophobicContact CB-CE2 4.36Å; F8-F10 HydrophobicContact CD1-CD2 4.24Å; F8-F10 AromaticContact CD1-CE2 3.57Å; F8-F10 HydrophobicContact CD1-CE2 3.57Å; F8-F10 HydrophobicContact CD1-CZ 4.24Å; F8-F10 HydrophobicContact CE1-CE2 4.34Å; F8-F10 HydrophobicContact CG-CE2 4.35Å; F8-F10 PolarHBondContact O-N 2.72Å; F8-F10 VanDerWaalsContact O-N 3.16Å
9	Q	32.4	Very low	36.2	Very low	176 Å²	176	154.6 Å²	154.6	82%	0.822	80%	0.798	S	S	*	*			trans	-81.7	83.4	175.1	-169.2	-176.1	21.3	0	0	111	S7 S11	S7-Q9 PolarHBondContact O-N 2.75Å; Q9-S11 PolarHBondContact O-N 3.08Å
10	F	36	Very low	36.1	Very low	176 Å²	176	154.2 Å²	154.2	77%	0.772	80%	0.798	S	S	*	*			trans	-77.1	111.6	176.6	-90.5	-76.8	0	0	0	112.3	F8	F8-F10 HydrophobicContact CB-CD2 4.31Å; F8-F10 HydrophobicContact CB-CE2 4.36Å; F8-F10 HydrophobicContact CD1-CD2 4.24Å; F8-F10 AromaticContact CD1-CE2 3.57Å; F8-F10 HydrophobicContact CD1-CE2 3.57Å; F8-F10 HydrophobicContact CD1-CZ 4.24Å; F8-F10 HydrophobicContact CE1-CE2 4.34Å; F8-F10 HydrophobicContact CG-CE2 4.35Å; F8-F10 PolarHBondContact O-N 2.72Å; F8-F10 VanDerWaalsContact O-N 3.16Å
11	S	30.1	Very low	36	Very low	86 Å²	86	155.3 Å²	155.3	60%	0.601	81%	0.805	S	S	*	*			trans	-82.3	126.3	179.5	-171.8	0	0	0	0	112.2	Q9 Q13	Q9-S11 PolarHBondContact O-N 3.08Å; S11-Q13 PolarHBondContact O-N 2.82Å
12	P	33.5	Very low	35.8	Very low	104 Å²	104	147.7 Å²	147.7	68%	0.675	78%	0.78	S	S	*	*			trans	-84.6	66.5	-171.5	34.7	-37.3	0	0	0	113.1
13	Q	35.3	Very low	35.8	Very low	174 Å²	174	150 Å²	150	81%	0.813	78%	0.779	S	S	*	*			trans	-95.4	-5.7	174.4	-71.4	-149.3	-19.4	0	0	115.4	S11	S11-Q13 PolarHBondContact O-N 2.82Å
14	W	37	Very low	35.2	Very low	185 Å²	185	153.1 Å²	153.1	70%	0.701	78%	0.781	S	S	*	*	S	Bend	trans	-91.2	-6.7	-175.4	64.7	-85.6	0	0	0	115.1	R16	W14-R16 VanDerWaalsContact C-N 3.3Å; W14-R16 PolarHBondContact O-N 3.26Å; W14-R16 VanDerWaalsContact O-N 3.15Å
15	I	35.2	Very low	34.9	Very low	118 Å²	118	149.8 Å²	149.8	61%	0.605	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	58.6	-179.2	-45.8	-178.7	0	0	0	110.2
16	R	36.5	Very low	34.2	Very low	228 Å²	228	155.7 Å²	155.7	86%	0.86	78%	0.784	S	S	*	*	T	Hydrogen-bonded Turn	trans	-150.8	6.5	178.7	-126.6	174.3	-172.5	158.6	4	117.4	W14	W14-R16 VanDerWaalsContact C-N 3.3Å; W14-R16 PolarHBondContact O-N 3.26Å; W14-R16 VanDerWaalsContact O-N 3.15Å
17	E	33.8	Very low	34	Very low	185 Å²	185	159.5 Å²	159.5	86%	0.864	79%	0.792	S	S	*	*	S	Bend	trans	-124.8	17.6	-176.8	-83.9	-168.8	146.7	0	0	114.8
18	L	36.2	Very low	34	Very low	166 Å²	166	164 Å²	164	87%	0.869	80%	0.8	S	S	*	*	S	Bend	trans	-125.5	30.8	-174.1	-70.5	176.1	0	0	0	115.1
19	S	34.9	Very low	34.2	Very low	105 Å²	105	161.7 Å²	161.7	73%	0.734	80%	0.803	S	S	*	*	S	Bend	trans	-141.7	-5.7	179.8	-160.8	0	0	0	0	118.2
20	D	33.9	Very low	34.3	Very low	147 Å²	147	157.9 Å²	157.9	79%	0.786	80%	0.796	S	S	*	*	S	Bend	trans	-101.1	-23.7	-173.5	-68.7	-59.1	0	0	0	114.9	A22	D20-A22 VanDerWaalsContact C-N 3.32Å; D20-A22 PolarHBondContact O-N 3.38Å
21	D	33.3	Very low	34.2	Very low	178 Å²	178	157.5 Å²	157.5	95%	0.952	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	60	-179.5	-84.4	-43.8	0	0	0	113.8
22	A	35.8	Very low	34.4	Very low	83 Å²	83	157.6 Å²	157.6	69%	0.686	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.3	-22.8	178.3	0	0	0	0	0	117.5	D20	D20-A22 VanDerWaalsContact C-N 3.32Å; D20-A22 PolarHBondContact O-N 3.38Å
23	F	33.1	Very low	34.7	Very low	197 Å²	197	157.8 Å²	157.8	86%	0.864	79%	0.792	S	S	*	*	S	Bend	trans	-139.3	64	-168.1	-106.5	-83.4	0	0	0	115.3
24	N	33.1	Very low	34.8	Very low	165 Å²	165	154.9 Å²	154.9	88%	0.882	79%	0.786	S	S	*	*			trans	-141.4	161.2	159.5	-111	-49.3	0	0	0	112.2
25	S	31.2	Very low	34.6	Very low	115 Å²	115	155.4 Å²	155.4	80%	0.804	80%	0.796	S	S	*	*			trans	68.3	61.3	172.6	-59.1	0	0	0	0	118.8
26	R	31.2	Very low	34.5	Very low	246 Å²	246	153.4 Å²	153.4	93%	0.928	81%	0.805	S	S	*	*			trans	-143.8	61.3	149.6	-165.3	169.4	-87.9	-120.8	-0.7	115
27	R	33.1	Very low	34.3	Very low	246 Å²	246	154 Å²	154	93%	0.928	81%	0.807	S	S	*	*			trans	-150	92.6	151.5	-76.8	-159.5	-174.8	-147	2.8	111.7
28	Q	36.4	Very low	34.3	Very low	208 Å²	208	150.9 Å²	150.9	97%	0.972	80%	0.8	S	S	*	*			trans	-165.8	172.7	139.8	-108.4	175.7	37.2	0	0	110.1
29	S	36.2	Very low	34.1	Very low	107 Å²	107	148 Å²	148	75%	0.748	79%	0.794	S	S	*	*			trans	-128.6	137.8	-146.8	-168.6	0	0	0	0	116.1
30	S	34	Very low	33.9	Very low	96 Å²	96	147.2 Å²	147.2	67%	0.671	79%	0.789	S	S	*	*			trans	79.2	155.2	150.5	83.1	0	0	0	0	120.6
31	R	35.2	Very low	33.9	Very low	168 Å²	168	149.7 Å²	149.7	63%	0.634	79%	0.793	S	S	*	*			trans	79.1	93.9	161.7	-62.3	179.6	-177	-151.6	-4.1	119
32	S	33.7	Very low	33.8	Very low	88 Å²	88	146.7 Å²	146.7	62%	0.615	79%	0.786	S	S	*	*			trans	-68.6	-177.3	144.3	59.2	0	0	0	0	110.8
33	P	40	Very low	34.1	Very low	109 Å²	109	148.7 Å²	148.7	71%	0.708	79%	0.792	S	S	*	*			cis	-146.5	-168.3	16.8	34.2	-7.9	0	0	0	118.1
34	T	36.5	Very low	34	Very low	113 Å²	113	144.7 Å²	144.7	69%	0.693	79%	0.788	S	S	*	*			trans	102.5	98.4	145.8	-42	0	0	0	0	119.8
35	E	32.4	Very low	34.1	Very low	195 Å²	195	143.9 Å²	143.9	91%	0.911	78%	0.783	S	S	*	*			trans	41.8	124.2	137.4	-51.2	-170.5	147.8	0	0	122.2
36	G	33.6	Very low	34.1	Very low	77 Å²	77	147.4 Å²	147.4	79%	0.794	78%	0.784	S	S	*	*			trans	-146.8	-7.7	-176.1	0	0	0	0	0	120.5
37	R	32.1	Very low	33.9	Very low	240 Å²	240	140.1 Å²	140.1	91%	0.906	77%	0.771	S	S	*	*			trans	70.4	146.1	164	-138.8	-170.4	-176.8	168.3	1.8	120.2
38	V	34.9	Very low	33.9	Very low	119 Å²	119	134.9 Å²	134.9	72%	0.721	76%	0.761	S	S	*	*			trans	76.6	91.3	159.5	-160.8	0	0	0	0	121.5
39	S	31.1	Very low	33.6	Very low	105 Å²	105	134.8 Å²	134.8	73%	0.734	76%	0.758	S	S	*	*				39.7	125.1	119.9	-158	0	0	0	0	122
40	S	30.5	Very low	33.4	Very low	90 Å²	90	134.8 Å²	134.8	63%	0.629	75%	0.753	S	S	*	*				173.7	165.6	83.6	62.2	0	0	0	0	115.1
41	K	34.8	Very low	33.2	Very low	198 Å²	198	137.9 Å²	137.9	86%	0.861	76%	0.757	S	S	*	*			trans	68	99.4	162.6	-62.1	171.8	-174.7	173	0	118.9
42	S	30	Very low	32.9	Very low	116 Å²	116	138 Å²	138	81%	0.811	76%	0.762	S	S	*	*			trans	-89.2	147.6	149.9	48.8	0	0	0	0	111.1
43	P	43.9	Very low	33	Very low	124 Å²	124	142.1 Å²	142.1	81%	0.805	77%	0.771	S	S	*	*			trans	-103.7	129.5	167.4	34.5	-27.4	0	0	0	111.9
44	S	29.3	Very low	32.6	Very low	113 Å²	113	141.2 Å²	141.2	79%	0.79	77%	0.768	S	S	*	*			trans	-125.4	89.9	173.2	57.2	0	0	0	0	111.4
45	L	35.7	Very low	32.2	Very low	148 Å²	148	143.1 Å²	143.1	78%	0.775	77%	0.774	S	S	*	*			trans	-146.3	137.6	175.8	-68.3	176.3	0	0	0	107
46	F	31.6	Very low	32.1	Very low	190 Å²	190	140.3 Å²	140.3	83%	0.833	77%	0.774	S	S	*	*			cis	-137.9	159	19.6	-116.3	-84.4	0	0	0	112.5
47	S	27.5	Very low	32	Very low	93 Å²	93	142.5 Å²	142.5	65%	0.65	78%	0.777	S	S	*	*			trans	-133.4	170.4	162	-175.8	0	0	0	0	109.2
48	N	32.3	Very low	32.2	Very low	136 Å²	136	137.5 Å²	137.5	73%	0.727	77%	0.773	S	S	*	*			trans	80.9	112.4	-176.6	-45.9	-76	0	0	0	116.7
49	F	29.7	Very low	32.3	Very low	206 Å²	206	138.1 Å²	138.1	90%	0.904	78%	0.779	S	S	*	*				-143.7	148.4	112	-145.4	-96.5	0	0	0	111
50	V	32.8	Very low	32.5	Very low	106 Å²	106	136.9 Å²	136.9	64%	0.642	78%	0.784	S	S	*	*			trans	-144.4	125.2	-163.1	167.1	0	0	0	0	112.3
51	Q	29.1	Very low	32.6	Very low	162 Å²	162	138.9 Å²	138.9	76%	0.757	79%	0.787	S	S	*	*			trans	63.4	142.4	155.2	-137.5	74	5.5	0	0	121.9
52	K	30.4	Very low	32.9	Very low	171 Å²	171	139.4 Å²	139.4	74%	0.743	79%	0.789	S	S	*	*			trans	78	144.1	165.4	-47	178.5	-177	172.9	0	114.3
53	H	35.9	Very low	32.9	Very low	173 Å²	173	143.7 Å²	143.7	80%	0.801	79%	0.788	S	S	*	*			cis	-138.5	164.7	33.7	-98.6	-90.2	0	0	0	117.1
54	S	29.8	Very low	32.6	Very low	90 Å²	90	146.6 Å²	146.6	63%	0.629	79%	0.788	S	S	*	*			trans	-59.1	155.3	-172.4	-44.7	0	0	0	0	120.2
55	N	28.4	Very low	32.9	Very low	153 Å²	153	148 Å²	148	82%	0.818	79%	0.787	S	S	*	*			trans	62.3	124.2	140.4	-59.5	-0.1	0	0	0	122
56	C	31.5	Very low	32.6	Very low	137 Å²	137	147.2 Å²	147.2	93%	0.926	78%	0.78	S	S	*	*				-154.3	161.9	129.8	-99	0	0	0	0	110.8
57	S	31.7	Very low	32.8	Very low	122 Å²	122	145.2 Å²	145.2	85%	0.853	78%	0.783	S	S	*	*			trans	-118.8	153.7	-169	-56.1	0	0	0	0	113.7
58	V	35.1	Very low	32.9	Very low	136 Å²	136	146.4 Å²	146.4	82%	0.824	79%	0.786	S	S	*	*			trans	-77.9	158.1	160.1	-130.3	0	0	0	0	109.7
59	P	36.7	Very low	32.9	Very low	131 Å²	131	143.2 Å²	143.2	85%	0.851	79%	0.786	S	S	*	*				-148	172	72.8	39.5	-20.8	0	0	0	116.4
60	G	35.4	Very low	33.2	Very low	80 Å²	80	139.5 Å²	139.5	83%	0.825	77%	0.769	S	S	*	*			trans	169.5	105.8	166.7	0	0	0	0	0	114.9
61	D	33.4	Very low	33.1	Very low	132 Å²	132	140.7 Å²	140.7	71%	0.706	78%	0.776	S	S	*	*			trans	-110	141.6	-178.5	169.7	38.4	0	0	0	112.4
62	K	39.5	Very low	33.4	Very low	208 Å²	208	138.7 Å²	138.7	90%	0.904	78%	0.781	S	S	*	*			trans	-153	113.5	152	-70.6	-159.7	178.6	178.2	0	111.9
63	R	30.5	Very low	33.5	Very low	206 Å²	206	140 Å²	140	78%	0.777	79%	0.786	S	S	*	*			trans	-82.9	153.8	165	-62.2	177.9	177.3	179.9	-2.3	112.3
64	K	39.1	Very low	33.3	Very low	185 Å²	185	139.2 Å²	139.2	80%	0.804	79%	0.787	S	S	*	*			trans	-149.4	116.9	153.5	-87.3	-154.4	171	-165.5	0	113.3
65	D	34.7	Very low	33.5	Very low	144 Å²	144	140.9 Å²	140.9	77%	0.77	79%	0.793	S	S	*	*			trans	62.8	161.1	134.7	-46.4	-35.6	0	0	0	120.8
66	M	30.3	Very low	33.7	Very low	130 Å²	130	144.7 Å²	144.7	64%	0.64	80%	0.796	S	S	*	*			trans	-154	139.3	-153.9	174	179.8	66.5	0	0	111.3	V68 K168	M66-V68 HydrophobicContact CG-CG2 4.15Å; M66-V68 HydrophobicContact SD-CG2 4.31Å; M66-K168 PolarHBondContact SD-NZ 2.85Å
67	V	34.1	Very low	33.9	Very low	148 Å²	148	144 Å²	144	90%	0.897	79%	0.79	S	S	*	*			trans	-128.6	146.4	167	-179.4	0	0	0	0	108.4
68	V	30.8	Very low	34	Very low	118 Å²	118	141.5 Å²	141.5	72%	0.715	78%	0.784	S	S	*	*			trans	-125.8	140.4	-170.2	174.4	0	0	0	0	110.7	M66	M66-V68 HydrophobicContact CG-CG2 4.15Å; M66-V68 HydrophobicContact SD-CG2 4.31Å
69	G	32.5	Very low	34	Very low	69 Å²	69	142.8 Å²	142.8	71%	0.711	79%	0.786	S	S	*	*			trans	-131.4	142.4	169.3	0	0	0	0	0	111.8
70	K	35.4	Very low	33.9	Very low	128 Å²	128	142.5 Å²	142.5	56%	0.557	78%	0.782	S	S	*	*			trans	-83.1	127	175.9	-80.3	162.5	167.7	160.9	0	109	E163 T164	K70-E163 IonicContact NZ-OE1 3.72Å; K70-E163 PolarHBondContact NZ-OE1 2.92Å; K70-T164 WeakPolarHBondContact CE-OG1 3.44Å; K70-T164 PolarHBondContact NZ-OG1 2.91Å
71	V	31.2	Very low	34	Very low	131 Å²	131	146.1 Å²	146.1	79%	0.794	78%	0.78	S	S	*	*				71	114.7	73.6	174	0	0	0	0	113.6
72	S	33.9	Very low	33.9	Very low	121 Å²	121	149.6 Å²	149.6	85%	0.846	79%	0.785	S	S	*	*			trans	-160.2	140.6	137.8	-81.7	0	0	0	0	110.5
73	K	33.2	Very low	33.5	Very low	197 Å²	197	144.5 Å²	144.5	86%	0.857	78%	0.782	S	S	*	*			trans	-136.4	137.3	171.6	-98.2	-170.9	173.1	-173.5	0	107.5
74	L	31.7	Very low	33.6	Very low	158 Å²	158	140.5 Å²	140.5	83%	0.827	78%	0.781	S	S	*	*			trans	-85.2	152.5	160.4	-96.1	72.8	0	0	0	110.1
75	V	33.5	Very low	33.2	Very low	125 Å²	125	137.2 Å²	137.2	76%	0.758	78%	0.781	S	S	*	*			trans	-129.4	138.2	175.2	170	0	0	0	0	107.4
76	W	33	Very low	33.1	Very low	233 Å²	233	136.6 Å²	136.6	88%	0.883	78%	0.782	S	S	*	*			trans	-103.1	132	165.6	-70.2	88.6	0	0	0	108.7
77	P	36.6	Very low	33.3	Very low	123 Å²	123	134.3 Å²	134.3	80%	0.799	78%	0.784	S	S	*	*			trans	-91.7	150.2	177.9	35.7	-33.2	0	0	0	111.9
78	G	33.3	Very low	33.1	Very low	69 Å²	69	136.7 Å²	136.7	71%	0.711	79%	0.785	S	S	*	*			trans	129.6	80.7	169.1	0	0	0	0	0	114.4
79	D	35.6	Very low	33.5	Very low	162 Å²	162	137.6 Å²	137.6	87%	0.866	79%	0.791	S	S	*	*				-174.5	133.6	113.1	-97.6	-17.6	0	0	0	111.4
80	T	34.4	Very low	33.4	Very low	125 Å²	125	141.8 Å²	141.8	77%	0.767	80%	0.797	S	S	*	*			trans	-112.4	105.4	-178.1	-61.9	0	0	0	0	109.3	Y82	T80-Y82 HydrophobicContact CG2-CD2 4.49Å
81	I	36.2	Very low	33.3	Very low	156 Å²	156	140.7 Å²	140.7	80%	0.8	81%	0.806	S	S	*	*			trans	-108.3	119.7	171.8	-58.4	-178.4	0	0	0	108.9	A83	I81-A83 PolarHBondContact O-N 2.58Å
82	Y	33.2	Very low	33.3	Very low	205 Å²	205	143.7 Å²	143.7	80%	0.804	81%	0.811	S	S	*	*			trans	-67.2	128.1	176	-96.6	-105.7	0	0	0	110.9	T80 T84	T80-Y82 HydrophobicContact CG2-CD2 4.49Å; Y82-T84 PolarHBondContact O-N 3.34Å
83	A	30.1	Very low	33.3	Very low	102 Å²	102	141.7 Å²	141.7	84%	0.843	81%	0.81	S	S	*	*			trans	-83.1	101	171.2	0	0	0	0	0	110.4	I81 S85	I81-A83 PolarHBondContact O-N 2.58Å; A83-S85 PolarHBondContact O-N 2.95Å
84	T	33.2	Very low	33.3	Very low	122 Å²	122	141.6 Å²	141.6	75%	0.748	81%	0.812	S	S	*	*			trans	-90.1	102.8	174.1	-47.7	0	0	0	0	110.1	Y82 V86	Y82-T84 PolarHBondContact O-N 3.34Å; T84-V86 HydrophobicContact CG2-CG2 4.36Å
85	S	30.4	Very low	33.3	Very low	115 Å²	115	139 Å²	139	80%	0.804	81%	0.807	S	S	*	*			trans	-74.3	128.7	170.3	-177.3	0	0	0	0	110.4	A83	A83-S85 PolarHBondContact O-N 2.95Å
86	V	32.9	Very low	33.3	Very low	131 Å²	131	138 Å²	138	79%	0.794	81%	0.806	S	S	*	*			trans	-131.3	120	165.7	-174.4	0	0	0	0	107.3	T84	T84-V86 HydrophobicContact CG2-CG2 4.36Å
87	A	34.5	Very low	33.4	Very low	82 Å²	82	137.5 Å²	137.5	68%	0.678	80%	0.804	S	S	*	*			trans	-91.1	149.1	177.9	0	0	0	0	0	110.9
88	E	29.3	Very low	33.2	Very low	198 Å²	198	138.8 Å²	138.8	93%	0.925	80%	0.799	S	S	*	*			trans	-71.7	132.1	171.3	-64.6	171	108.8	0	0	110.8
89	T	39.7	Very low	33.3	Very low	137 Å²	137	142.4 Å²	142.4	84%	0.84	81%	0.807	S	S	*	*			trans	-138.1	126.2	161.9	50.2	0	0	0	0	109.8
90	D	30	Very low	33.1	Very low	158 Å²	158	140.5 Å²	140.5	85%	0.845	80%	0.796	S	S	*	*			trans	-89.9	137.1	-172.7	176.9	19.4	0	0	0	112.5
91	S	33	Very low	33	Very low	104 Å²	104	144.6 Å²	144.6	73%	0.727	80%	0.803	S	S	*	*			trans	-178.6	115.9	154	26	0	0	0	0	115.4
92	Q	32.7	Very low	32.8	Very low	194 Å²	194	144.8 Å²	144.8	91%	0.907	80%	0.801	S	S	*	*			trans	15.6	135.8	141.7	-53.5	177.5	-50.2	0	0	121.8
93	G	32.1	Very low	32.8	Very low	80 Å²	80	146.5 Å²	146.5	83%	0.825	81%	0.807	S	S	*	*			trans	162.6	74.4	153.4	0	0	0	0	0	122.6
94	Q	33.2	Very low	32.7	Very low	194 Å²	194	145.7 Å²	145.7	91%	0.907	80%	0.795	S	S	*	*			trans	13.3	120.1	154	-67.3	-175.2	-30.2	0	0	124.7
95	S	33	Very low	32.8	Very low	103 Å²	103	149.3 Å²	149.3	72%	0.72	80%	0.803	S	S	*	*				77.3	120.5	111.2	-154.6	0	0	0	0	125.6
96	S	33.3	Very low	32.7	Very low	104 Å²	104	148.7 Å²	148.7	73%	0.727	80%	0.799	S	S	*	*			trans	100.5	128.3	131.3	-72.9	0	0	0	0	125.9
97	R	35.6	Very low	32.6	Very low	223 Å²	223	150.4 Å²	150.4	84%	0.842	80%	0.802	S	S	*	*			trans	80.2	87.8	140.1	-77.5	-176.3	165.9	171.2	-2.2	124.4
98	E	32.5	Very low	32.3	Very low	151 Å²	151	153.1 Å²	153.1	71%	0.706	80%	0.801	S	S	*	*				42.6	124.7	98.5	-172.4	-178.5	-135.9	0	0	122.2
99	V	34.7	Very low	32.4	Very low	145 Å²	145	152.4 Å²	152.4	88%	0.879	80%	0.795	S	S	*	*			trans	-148.6	144.9	146.2	-179	0	0	0	0	109.8
100	I	30.9	Very low	32	Very low	122 Å²	122	150.8 Å²	150.8	63%	0.626	79%	0.789	S	S	*	*			trans	-125.2	147.8	-175.3	-61	164.9	0	0	0	111.9
101	K	33.7	Very low	31.9	Very low	210 Å²	210	150.8 Å²	150.8	91%	0.913	79%	0.789	S	S	*	*			trans	-144	146.5	148.9	-75.4	-160.5	176.4	-179.1	0	112.4
102	Q	31.5	Very low	31.8	Very low	161 Å²	161	151 Å²	151	75%	0.752	79%	0.79	S	S	*	*			trans	-103.2	165.1	180	-56.2	172.1	-75.8	0	0	112.2
103	Y	32.3	Very low	31.8	Very low	241 Å²	241	149.7 Å²	149.7	95%	0.945	79%	0.788	S	S	*	*			trans	-149.4	152.5	131.4	-108.1	-77.1	0	0	0	109.9
104	S	29.5	Very low	31.8	Very low	84 Å²	84	157 Å²	157	59%	0.587	79%	0.792	S	S	*	*			trans	-132.3	152.8	-172.3	-47.8	0	0	0	0	111.4
105	H	34	Very low	31.7	Very low	199 Å²	199	150.9 Å²	150.9	92%	0.921	78%	0.781	S	S	*	*			trans	-152.9	159.1	147.8	-95.9	-68.8	0	0	0	110.3
106	S	28.2	Very low	31.8	Very low	102 Å²	102	153.6 Å²	153.6	71%	0.713	78%	0.782	S	S	*	*			trans	-156.8	146.8	-166.3	173.4	0	0	0	0	112
107	I	30.9	Very low	31.7	Very low	167 Å²	167	156.7 Å²	156.7	86%	0.856	78%	0.783	S	S	*	*			trans	-142.1	144.9	164	-59.6	-175.7	0	0	0	107.9
108	Q	29.3	Very low	31.5	Very low	139 Å²	139	151.3 Å²	151.3	65%	0.65	78%	0.779	S	S	*	*			trans	-112.4	173.4	180	-57.7	-173.3	-41.8	0	0	112
109	F	30.1	Very low	31.4	Very low	182 Å²	182	152 Å²	152	80%	0.798	79%	0.787	S	S	*	*				-176.5	114	102	-94	-63.1	0	0	0	115.2
110	S	31	Very low	31.3	Very low	104 Å²	104	149.3 Å²	149.3	73%	0.727	78%	0.781	S	S	*	*			trans	34.2	142	141.1	-54.5	0	0	0	0	125.5
111	D	27.8	Very low	31.2	Very low	158 Å²	158	150.8 Å²	150.8	85%	0.845	79%	0.79	S	S	*	*			trans	-86.1	168.8	172.5	-62.3	-79.7	0	0	0	116.9
112	S	30.8	Very low	31.2	Very low	107 Å²	107	150 Å²	150	75%	0.748	79%	0.79	S	S	*	*			trans	71.9	124.8	140.4	-169.1	0	0	0	0	121.5
113	I	34.3	Very low	31.1	Very low	167 Å²	167	149.8 Å²	149.8	86%	0.856	79%	0.793	S	S	*	*				-146.4	146.3	127.4	-69.8	-161.5	0	0	0	108.8
114	Y	30.7	Very low	31.2	Very low	235 Å²	235	145.7 Å²	145.7	92%	0.922	79%	0.786	S	S	*	*			trans	-131.9	125.3	170	-154.7	-81.7	0	0	0	109.6
115	G	30.9	Very low	31.4	Very low	65 Å²	65	148.5 Å²	148.5	67%	0.67	79%	0.794	S	S	*	*			trans	157.3	131.4	168.5	0	0	0	0	0	119.9
116	Q	35.1	Very low	31.4	Very low	159 Å²	159	144.9 Å²	144.9	74%	0.743	79%	0.788	S	S	*	*			trans	72.4	105.2	157	-60.4	-152.1	51.6	0	0	122.2
117	K	31.4	Very low	31.8	Very low	170 Å²	170	144.8 Å²	144.8	74%	0.739	79%	0.794	S	S	*	*				78.7	125.6	121.4	-70.1	-177.8	-175.8	151.4	0	122.2
118	S	32.9	Very low	31.9	Very low	109 Å²	109	141.9 Å²	141.9	76%	0.762	79%	0.788	S	S	*	*			trans	78	105.4	131.5	65	0	0	0	0	121.2
119	N	29	Very low	32.2	Very low	165 Å²	165	143.9 Å²	143.9	88%	0.882	80%	0.797	S	S	*	*			trans	88.4	159.6	131.6	-140.2	-0.5	0	0	0	118.3
120	A	33.5	Very low	32.1	Very low	89 Å²	89	140.4 Å²	140.4	74%	0.736	79%	0.794	S	S	*	*			trans	68.7	116.7	-179.2	0	0	0	0	0	117.5
121	N	28.9	Very low	32.2	Very low	154 Å²	154	141.9 Å²	141.9	82%	0.824	80%	0.799	S	S	*	*			trans	-65	134.7	171	-53.1	-29.2	0	0	0	111.6
122	Q	34.4	Very low	32.4	Very low	193 Å²	193	140.3 Å²	140.3	90%	0.902	79%	0.79	S	S	*	*			trans	-160.9	153.5	136.2	-118.7	153.1	105.7	0	0	113.2
123	L	29.3	Very low	32.7	Very low	156 Å²	156	141.7 Å²	141.7	82%	0.817	79%	0.794	S	S	*	*			trans	-114.2	112.8	-168	177.4	118.6	0	0	0	109.7
124	I	33.8	Very low	32.5	Very low	156 Å²	156	138.3 Å²	138.3	80%	0.8	79%	0.785	S	S	*	*			trans	-137.6	128.8	174	-58.4	-177.4	0	0	0	108.9
125	N	34.2	Very low	33	Very low	143 Å²	143	136.8 Å²	136.8	77%	0.765	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-75.6	151.8	179.9	-88.3	-25.7	0	0	0	112.8
126	P	33.4	Very low	33.2	Very low	122 Å²	122	142.7 Å²	142.7	79%	0.792	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-73	140.3	171.6	31.5	-34.3	0	0	0	111.4
127	A	35.6	Very low	32.8	Very low	101 Å²	101	139.2 Å²	139.2	84%	0.835	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-94.7	142	172.2	0	0	0	0	0	111.3
128	S	33.4	Very low	33.1	Very low	105 Å²	105	138.6 Å²	138.6	73%	0.734	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-64.7	151.7	-177.8	54.5	0	0	0	0	114.5
129	H	34.9	Very low	33.1	Very low	182 Å²	182	141.6 Å²	141.6	84%	0.843	80%	0.797	S	S	*	*			trans	-138.5	112.4	139	-139.9	-59.6	0	0	0	110.6
130	C	28.4	Very low	32.9	Very low	109 Å²	109	145.4 Å²	145.4	74%	0.736	80%	0.799	S	S	*	*			trans	-101.1	159	168.9	-62	0	0	0	0	109.5
131	V	33.7	Very low	33	Very low	135 Å²	135	147.9 Å²	147.9	82%	0.818	81%	0.805	S	S	*	*			trans	-135	121.8	160.5	-179.9	0	0	0	0	106.5
132	D	31.5	Very low	33	Very low	124 Å²	124	148.8 Å²	148.8	66%	0.663	81%	0.805	S	S	*	*			trans	-106.5	153.2	178.7	174.9	9.2	0	0	0	108.7	S134	D132-S134 WeakPolarHBondContact OD1-CB 3.15Å; D132-S134 PolarHBondContact OD1-N 2.96Å; D132-S134 PolarHBondContact OD1-OG 3.43Å
133	T	37.5	Very low	33	Very low	137 Å²	137	149.4 Å²	149.4	84%	0.84	81%	0.805	S	S	*	*			trans	-149.7	56.4	169.3	-38.7	0	0	0	0	112.4
134	S	30.2	Very low	33	Very low	96 Å²	96	146.7 Å²	146.7	67%	0.671	80%	0.798	S	S	*	*			trans	-78.3	119.3	177.8	-61.6	0	0	0	0	114	D132	D132-S134 WeakPolarHBondContact OD1-CB 3.15Å; D132-S134 PolarHBondContact OD1-N 2.96Å; D132-S134 PolarHBondContact OD1-OG 3.43Å
135	K	40.1	Very low	32.9	Very low	203 Å²	203	144.2 Å²	144.2	88%	0.883	80%	0.795	S	S	*	*			trans	-174.5	138.8	165.2	-104	154	-171.7	174.1	0	108.1
136	Q	35	Very low	32.7	Very low	188 Å²	188	145.1 Å²	145.1	88%	0.879	80%	0.799	S	S	*	*			cis	-135.5	160.5	16.3	-53.4	175.4	25.2	0	0	111.1
137	A	27.9	Very low	32.7	Very low	86 Å²	86	147.5 Å²	147.5	71%	0.711	80%	0.804	S	S	*	*			trans	-113.1	-163.7	166	0	0	0	0	0	109.9
138	I	36.5	Very low	32.6	Very low	158 Å²	158	147.7 Å²	147.7	81%	0.81	80%	0.799	S	S	*	*			trans	86.3	128.9	-173.2	-53.9	157.5	0	0	0	110.8
139	Q	34.6	Very low	33.1	Very low	172 Å²	172	148.4 Å²	148.4	80%	0.804	80%	0.801	S	S	*	*			cis	-145.9	154.6	8.7	-146.3	159.8	3.6	0	0	112.1
140	W	24.4	Very low	33.6	Very low	244 Å²	244	145.5 Å²	145.5	92%	0.924	80%	0.798	S	S	*	*			trans	-84.9	144.8	160.9	-89.1	42.9	0	0	0	110.8
141	T	35.9	Very low	33.8	Very low	141 Å²	141	147.7 Å²	147.7	87%	0.865	80%	0.798	S	S	*	*			trans	-155.8	139.6	139.9	-12.9	0	0	0	0	112.9
142	Q	28.9	Very low	34	Very low	173 Å²	173	147 Å²	147	81%	0.808	80%	0.796	S	S	*	*			trans	-85.3	129.5	-176.2	179.3	-175	14.7	0	0	111.2
143	K	34.3	Very low	33.8	Very low	207 Å²	207	145.1 Å²	145.1	90%	0.9	79%	0.791	S	S	*	*			trans	-151.9	111.4	162.6	-138.9	169.8	-171.4	175.4	0	113.1
144	S	29.1	Very low	33.4	Very low	98 Å²	98	149.3 Å²	149.3	69%	0.685	79%	0.792	S	S	*	*			trans	-73.7	146.1	178.9	-37.3	0	0	0	0	111.9
145	S	31.3	Very low	33.5	Very low	105 Å²	105	152.5 Å²	152.5	73%	0.734	80%	0.796	S	S	*	*				163.4	141.7	123.1	-74.4	0	0	0	0	112.9
146	L	30.2	Very low	32.8	Very low	162 Å²	162	150.5 Å²	150.5	85%	0.848	79%	0.794	S	S	*	*			trans	55.9	99.2	150.2	-61.9	163.6	0	0	0	118.5
147	I	33.6	Very low	32.6	Very low	172 Å²	172	150.7 Å²	150.7	88%	0.882	80%	0.795	S	S	*	*				-170.4	132	113.6	-93.4	151.9	0	0	0	107.8
148	S	33.9	Very low	32.6	Very low	105 Å²	105	151.3 Å²	151.3	73%	0.734	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-97.6	146.5	-177.8	-53.9	0	0	0	0	111.9
149	P	43.6	Very low	32.4	Very low	119 Å²	119	151.6 Å²	151.6	77%	0.773	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-70.3	141.4	157.6	32	-32.7	0	0	0	109.6
150	P	44.8	Very low	32.2	Very low	122 Å²	122	148.4 Å²	148.4	79%	0.792	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-86	130.7	179.1	32.2	-32.7	0	0	0	112.4
151	E	32.5	Very low	32.6	Very low	155 Å²	155	140.1 Å²	140.1	72%	0.724	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-69.5	164	152.4	-69.5	-163.5	162.7	0	0	110.9	C153	E151-C153 PolarHBondContact OE2-SG 2.8Å
152	P	38.7	Very low	32.3	Very low	120 Å²	120	140.6 Å²	140.6	78%	0.779	78%	0.78	S	S	*	*			trans	-129.1	89.6	134	35.2	-25.4	0	0	0	112.6	W154	P152-W154 PolarHBondContact O-N 3.18Å
153	C	26.3	Very low	32.4	Very low	84 Å²	84	139.3 Å²	139.3	57%	0.568	77%	0.773	S	S	*	*			trans	-67.8	109.9	153.2	-79.8	0	0	0	0	110	E151	E151-C153 PolarHBondContact OE2-SG 2.8Å
154	W	30.5	Very low	32.3	Very low	226 Å²	226	133.2 Å²	133.2	86%	0.856	75%	0.754	S	S	*	*			trans	-142.7	109.4	146	-67.6	104.2	0	0	0	108.7	P152	P152-W154 PolarHBondContact O-N 3.18Å
155	Q	31.1	Very low	32.4	Very low	162 Å²	162	133.6 Å²	133.6	76%	0.757	76%	0.757	S	S	*	*				79.6	118.1	84	-140.3	77.1	0.1	0	0	112.9
156	L	25.3	Very low	32.4	Very low	161 Å²	161	134.1 Å²	134.1	84%	0.843	76%	0.755	S	S	*	*			trans	-63.6	138.2	175.4	-68.9	156.2	0	0	0	111.4
157	H	31.4	Very low	32.3	Very low	193 Å²	193	133.4 Å²	133.4	89%	0.894	75%	0.752	S	S	*	*			trans	-145.4	127.4	143.5	-126.1	-85.2	0	0	0	110.3
158	S	27.7	Very low	32.2	Very low	98 Å²	98	132.6 Å²	132.6	69%	0.685	74%	0.742	S	S	*	*			trans	-75.9	144.9	176.1	-48.2	0	0	0	0	110.6
159	D	32.3	Very low	32.6	Very low	165 Å²	165	134.7 Å²	134.7	88%	0.882	74%	0.743	S	S	*	*				-162.1	166.6	115.1	-117.3	-32.8	0	0	0	115.5
160	S	31	Very low	32.2	Very low	105 Å²	105	133.6 Å²	133.6	73%	0.734	74%	0.736	S	S	*	*			trans	-75.1	155.5	-164.4	61.8	0	0	0	0	118.6
161	G	32	Very low	31.5	Very low	69 Å²	69	134.5 Å²	134.5	71%	0.711	74%	0.735	S	S	*	*			trans	153.3	100	160.8	0	0	0	0	0	113.5
162	I	30.3	Very low	31.5	Very low	152 Å²	152	134 Å²	134	78%	0.779	74%	0.742	S	S	*	*				67.1	115.5	50.2	-58.1	178.8	0	0	0	111.2
163	E	31.4	Very low	31	Very low	145 Å²	145	134.5 Å²	134.5	68%	0.678	74%	0.737	S	S	*	*			cis	-158.2	177.8	4.3	-128.5	-175.7	157.7	0	0	116.6	K70	K70-E163 IonicContact NZ-OE1 3.72Å; K70-E163 PolarHBondContact NZ-OE1 2.92Å
164	T	30.7	Very low	31.2	Very low	79 Å²	79	137.1 Å²	137.1	49%	0.485	75%	0.745	S	S	.	*			trans	-47.1	160.9	163.4	54.8	0	0	0	0	114.5	K70	K70-T164 WeakPolarHBondContact CE-OG1 3.44Å; K70-T164 PolarHBondContact NZ-OG1 2.91Å
165	S	32.3	Very low	31	Very low	107 Å²	107	132.9 Å²	132.9	75%	0.748	74%	0.739	S	S	*	*				-169.6	147.4	54.9	44.4	0	0	0	0	111.2
166	V	30.7	Very low	30.9	Very low	115 Å²	115	132 Å²	132	70%	0.697	74%	0.739	S	S	*	*			cis	82.2	119.6	47.6	173.2	0	0	0	0	114.5
167	N	28.8	Very low	31	Very low	147 Å²	147	129.9 Å²	129.9	79%	0.786	73%	0.733	S	S	*	*			trans	69.4	159.5	168	-69.9	-26	0	0	0	117
168	K	30.6	Very low	30.9	Very low	156 Å²	156	125.4 Å²	125.4	68%	0.678	73%	0.729	S	S	*	*			cis	-151.4	153.7	12.8	-144.3	165.3	-172.8	179.4	0	111.8	M66	M66-K168 PolarHBondContact SD-NZ 2.85Å
169	I	41.7	Very low	31	Very low	148 Å²	148	123.7 Å²	123.7	76%	0.759	73%	0.728	S	S	*	*			trans	-73.4	162.6	164.7	-29.3	179.2	0	0	0	109.4
170	P	35.8	Very low	31	Very low	96 Å²	96	124.5 Å²	124.5	62%	0.623	73%	0.726	S	S	*	*				-143	166.6	109.8	40	-27.9	0	0	0	115.7
171	D	31.2	Very low	31.1	Very low	142 Å²	142	124.6 Å²	124.6	76%	0.759	73%	0.726	S	S	*	*			trans	-68.6	164.2	176.7	-32.9	-102.5	0	0	0	113.5
172	T	32.7	Very low	31.1	Very low	143 Å²	143	129 Å²	129	88%	0.877	73%	0.732	S	S	*	*			trans	-158.4	145.3	142.3	-74.8	0	0	0	0	111.1
173	I	28.3	Very low	31.5	Very low	131 Å²	131	127.5 Å²	127.5	67%	0.672	73%	0.733	S	S	*	*			trans	-99.7	146.2	-174.6	-63.6	152.4	0	0	0	110.9	L175	I173-L175 HydrophobicContact CG2-CD1 4.12Å; I173-L175 HydrophobicContact CG2-CG 4.26Å
174	N	28.5	Very low	31.4	Very low	140 Å²	140	125.4 Å²	125.4	75%	0.749	73%	0.734	S	S	*	*			trans	179.4	127.3	138	-90.7	-51.1	0	0	0	108.1
175	L	28.2	Very low	31.5	Very low	137 Å²	137	126.6 Å²	126.6	72%	0.717	75%	0.746	S	S	*	*				75.3	140.4	50.5	-70	171	0	0	0	115.1	I173	I173-L175 HydrophobicContact CG2-CD1 4.12Å; I173-L175 HydrophobicContact CG2-CG 4.26Å
176	N	27.7	Very low	31.5	Very low	143 Å²	143	126 Å²	126	77%	0.765	74%	0.742	S	S	*	*			trans	83.8	146.3	175	-64.7	-52.8	0	0	0	119
177	T	28.1	Very low	31.5	Very low	117 Å²	117	125 Å²	125	72%	0.718	75%	0.745	S	S	*	*			cis	-171	141.6	-28.5	-103.5	0	0	0	0	109
178	A	30	Very low	31.7	Very low	98 Å²	98	128.3 Å²	128.3	81%	0.81	75%	0.746	S	S	*	*			trans	61.4	157.3	172	0	0	0	0	0	116.9
179	G	29.4	Very low	32.1	Very low	63 Å²	63	125.4 Å²	125.4	65%	0.649	74%	0.744	S	S	*	*			cis	164.9	173.3	-9.5	0	0	0	0	0	112.9
180	H	32.6	Very low	31.5	Very low	182 Å²	182	125 Å²	125	84%	0.843	74%	0.742	S	S	*	*			trans	72.3	119.3	167.6	-64.9	-80.4	0	0	0	120.9
181	S	32.4	Very low	31.2	Very low	107 Å²	107	127.2 Å²	127.2	75%	0.748	74%	0.744	S	S	*	*			trans	86.4	109.6	137	-57.3	0	0	0	0	121.5
182	L	32.9	Very low	31.3	Very low	160 Å²	160	125.3 Å²	125.3	84%	0.838	74%	0.738	S	S	*	*				-0.1	152.4	118.2	-69.7	169.5	0	0	0	117.9
183	P	37.2	Very low	31.3	Very low	122 Å²	122	126.7 Å²	126.7	79%	0.792	73%	0.734	S	S	*	*			cis	-140.9	168.1	31.9	42	-24.2	0	0	0	119.3
184	S	29.7	Very low	31.5	Very low	101 Å²	101	128.2 Å²	128.2	71%	0.706	74%	0.738	S	S	*	*			trans	-55.5	163.8	160.7	-177	0	0	0	0	115.5
185	S	32.5	Very low	32	Very low	103 Å²	103	128.1 Å²	128.1	72%	0.72	74%	0.742	S	S	*	*			trans	108.1	109.1	134.7	-151.8	0	0	0	0	120.3
186	S	32	Very low	32.4	Very low	96 Å²	96	124.7 Å²	124.7	67%	0.671	74%	0.74	S	S	*	*				54.2	115.7	122	-160.9	0	0	0	0	122
187	A	30.7	Very low	32.7	Very low	92 Å²	92	122.1 Å²	122.1	76%	0.76	74%	0.739	S	S	*	*				-135.8	134.3	124.3	0	0	0	0	0	107.9
188	R	33.7	Very low	32.8	Very low	217 Å²	217	121.7 Å²	121.7	82%	0.819	74%	0.74	S	S	*	*			cis	74.5	155.1	44.9	-75.5	-171.1	164.3	-140.8	1.3	113.3
189	P	38.5	Very low	32.8	Very low	96 Å²	96	123.9 Å²	123.9	62%	0.623	74%	0.738	S	S	*	*			cis	-139.6	-135.1	-39.4	40.2	-21.9	0	0	0	110.6
190	L	30	Very low	32.8	Very low	139 Å²	139	128 Å²	128	73%	0.728	74%	0.744	S	S	*	*			trans	78.5	145.7	169.4	-48	179.9	0	0	0	115.4
191	E	30.3	Very low	32.6	Very low	142 Å²	142	124 Å²	124	66%	0.664	74%	0.737	S	S	*	*			cis	-150.6	134	-14.1	-113.1	179.4	78.4	0	0	108.4
192	V	31.3	Very low	32.4	Very low	102 Å²	102	121.7 Å²	121.7	62%	0.618	73%	0.729	S	S	*	*				67.8	104	90.3	173.7	0	0	0	0	115.8
193	Q	33.7	Very low	32.1	Very low	172 Å²	172	120.9 Å²	120.9	80%	0.804	73%	0.726	S	S	*	*			trans	169.6	150	130.2	-96.8	152	72.2	0	0	108.6
194	H	32.4	Very low	31.7	Very low	163 Å²	163	120.5 Å²	120.5	76%	0.755	73%	0.726	S	S	*	*			cis	176.5	164.1	-17.2	-135.2	-106	0	0	0	105.4
195	V	39	Very low	31.5	Very low	139 Å²	139	120.4 Å²	120.4	84%	0.842	73%	0.725	S	S	*	*			trans	97.1	128.6	163.6	-170	0	0	0	0	117.8
196	G	36.6	Very low	31.3	Very low	64 Å²	64	121.3 Å²	121.3	66%	0.66	73%	0.726	S	S	*	*			trans	69.3	82.6	162.3	0	0	0	0	0	115.6
197	A	32.9	Very low	31.1	Very low	90 Å²	90	122.6 Å²	122.6	74%	0.744	73%	0.73	S	S	*	*			cis	67	139.2	31.3	0	0	0	0	0	115.7
198	S	31.9	Very low	31.1	Very low	108 Å²	108	123.6 Å²	123.6	76%	0.755	73%	0.731	S	S	*	*			trans	76	146.3	158.3	-62.3	0	0	0	0	118.7
199	L	29.5	Very low	30.8	Very low	143 Å²	143	121 Å²	121	75%	0.749	73%	0.734	S	S	*	*			cis	-149.2	148.2	-18.2	-90.8	152.7	0	0	0	104.8
200	L	28.7	Very low	30.5	Very low	150 Å²	150	121.3 Å²	121.3	79%	0.785	74%	0.744	S	S	*	*				66.8	130.4	55.5	-131.8	179.1	0	0	0	113.5
201	S	28.5	Very low	30.6	Very low	99 Å²	99	120.5 Å²	120.5	69%	0.692	75%	0.745	S	S	*	*			trans	71.4	152.7	172.8	-152.7	0	0	0	0	115.5	N203	S201-N203 PolarHBondContact OG-ND2 3.18Å
202	G	29	Very low	30.7	Very low	57 Å²	57	121.2 Å²	121.2	59%	0.588	75%	0.753	S	S	*	*			cis	-149	154.9	-0.9	0	0	0	0	0	110.8
203	N	26.7	Very low	30.7	Very low	144 Å²	144	121.6 Å²	121.6	77%	0.77	75%	0.751	S	S	*	*				89.8	139.7	76.5	-67.6	-11.3	0	0	0	112.1	S201	S201-N203 PolarHBondContact OG-ND2 3.18Å
204	S	27.2	Very low	30.8	Very low	114 Å²	114	120.5 Å²	120.5	80%	0.797	75%	0.749	S	S	*	*			trans	28.6	136	148.7	-61.1	0	0	0	0	120.7
205	S	27.3	Very low	30.6	Very low	98 Å²	98	118.2 Å²	118.2	69%	0.685	74%	0.743	S	S	*	*			cis	174.4	-164.8	5.3	47.9	0	0	0	0	108.7
206	V	28.4	Very low	30.2	Very low	122 Å²	122	116.9 Å²	116.9	74%	0.739	74%	0.739	S	S	*	*			trans	75.4	105.9	153.7	172.9	0	0	0	0	118.1
207	V	27.5	Very low	30.1	Very low	124 Å²	124	121.3 Å²	121.3	75%	0.752	75%	0.747	S	S	*	*				38.5	117.1	129.4	-167.2	0	0	0	0	119.1
208	S	29.9	Very low	30.3	Very low	113 Å²	113	124.3 Å²	124.3	79%	0.79	75%	0.749	S	S	*	*				-177.9	148	113.4	-79.5	0	0	0	0	113.6
209	N	27.4	Very low	30.8	Very low	163 Å²	163	124.3 Å²	124.3	87%	0.872	75%	0.747	S	S	*	*			trans	-85	144.8	163.5	-50.4	-61.6	0	0	0	109.5
210	A	33.4	Very low	31	Very low	101 Å²	101	122.8 Å²	122.8	84%	0.835	74%	0.739	S	S	*	*			trans	-161.4	103.3	146.9	0	0	0	0	0	112.4
211	T	31.4	Very low	31.2	Very low	123 Å²	123	122.7 Å²	122.7	76%	0.755	74%	0.74	S	S	*	*			trans	-45.6	165.4	161.2	-37.4	0	0	0	0	114.9
212	L	32.4	Very low	31.5	Very low	156 Å²	156	121.3 Å²	121.3	82%	0.817	74%	0.741	S	S	*	*			trans	98.2	144.7	158.8	-55.8	172.3	0	0	0	116.1
213	N	30.1	Very low	31.9	Very low	110 Å²	110	126.2 Å²	126.2	59%	0.588	75%	0.752	S	S	*	*			cis	162.1	-179.1	-15.9	-179.3	24.9	0	0	0	104.5
214	I	36	Very low	32.4	Very low	149 Å²	149	125 Å²	125	76%	0.764	75%	0.752	S	S	*	*			trans	87.3	128.4	167	-51.1	165.3	0	0	0	113.5
215	N	29.3	Very low	33	Very low	116 Å²	116	125.8 Å²	125.8	62%	0.62	75%	0.751	S	S	*	*			cis	-178.7	141	-38.7	-112.5	-13	0	0	0	107.4
216	S	29.3	Very low	33.5	Very low	110 Å²	110	126 Å²	126	77%	0.769	75%	0.751	S	S	*	*			trans	64.2	173.7	159	-48.2	0	0	0	0	114.4
217	I	34.5	Very low	33.5	Very low	158 Å²	158	131 Å²	131	81%	0.81	76%	0.756	S	S	*	*			cis	-137.9	132	17.9	-72.2	175.5	0	0	0	110.1
218	L	38.9	Very low	34	Very low	152 Å²	152	130.4 Å²	130.4	80%	0.796	76%	0.758	S	S	*	*			trans	-70.7	150.3	158.9	-103.6	85.7	0	0	0	109.2
219	P	42.2	Very low	34.2	Very low	109 Å²	109	132.1 Å²	132.1	71%	0.708	76%	0.758	S	S	*	*				-156.7	-164.7	71.5	48.2	-28	0	0	0	112
220	N	33	Very low	34.7	Very low	111 Å²	111	129.5 Å²	129.5	59%	0.594	75%	0.749	S	S	*	*			cis	-161.2	-179.6	-22.9	-120.2	36.3	0	0	0	109.6
221	D	32.7	Very low	34.5	Very low	148 Å²	148	135.1 Å²	135.1	79%	0.791	75%	0.751	S	S	*	*			trans	45	138.2	143.4	-53.6	-30.9	0	0	0	122.3
222	G	35.5	Very low	34.4	Very low	69 Å²	69	133.2 Å²	133.2	71%	0.711	74%	0.742	S	S	*	*			cis	-174.8	168.7	1.7	0	0	0	0	0	115.2
223	I	36	Very low	34.4	Very low	161 Å²	161	133.2 Å²	133.2	83%	0.826	74%	0.738	S	S	*	*			trans	-93.4	138.4	-179.1	-68.8	163.9	0	0	0	109.4
224	P	37.3	Very low	34.4	Very low	119 Å²	119	134.3 Å²	134.3	77%	0.773	74%	0.744	S	S	*	*				-142.4	123.2	120.8	32	-15.6	0	0	0	114.7
225	V	40.1	Very low	34	Very low	129 Å²	129	134.2 Å²	134.2	78%	0.782	75%	0.745	S	S	*	*			trans	-84.1	134.1	155.8	168.7	0	0	0	0	108
226	P	38.3	Very low	34.2	Very low	104 Å²	104	135.5 Å²	135.5	68%	0.675	76%	0.757	S	S	*	*				-145.8	146	123.6	35.2	-19.4	0	0	0	116.3
227	R	29.3	Very low	34.2	Very low	227 Å²	227	137.2 Å²	137.2	86%	0.857	76%	0.758	S	S	*	*			trans	9.2	145.3	132.2	-46.5	176.1	165	107.2	-3.9	117.3
228	S	36.2	Very low	34.1	Very low	111 Å²	111	135.5 Å²	135.5	78%	0.776	76%	0.76	S	S	*	*			cis	-163.4	158.9	37.2	-41.4	0	0	0	0	113.3
229	D	34	Very low	33.5	Very low	149 Å²	149	139 Å²	139	80%	0.797	76%	0.764	S	S	*	*			trans	-53.1	162.2	148.4	-67.1	-73.9	0	0	0	111.7
230	P	39.5	Very low	33.1	Very low	107 Å²	107	140.7 Å²	140.7	70%	0.695	77%	0.767	S	S	*	*			cis	-152.1	163	35.4	43.1	-22.2	0	0	0	120.6
231	Y	29.3	Very low	32.8	Very low	220 Å²	220	141.6 Å²	141.6	86%	0.863	77%	0.772	S	S	*	*			trans	61.9	153.9	140.5	-90.8	-106.8	0	0	0	124.1
232	S	29.5	Very low	32.8	Very low	82 Å²	82	142.5 Å²	142.5	57%	0.573	77%	0.772	S	S	*	*			trans	77.1	93.1	155	-81.1	0	0	0	0	121.6
233	Q	31.9	Very low	32.8	Very low	156 Å²	156	143.3 Å²	143.3	73%	0.729	77%	0.766	S	S	*	*				86.6	123.2	106.4	-81.8	173.1	-51.6	0	0	121.7
234	N	29.1	Very low	32.8	Very low	134 Å²	134	144.3 Å²	144.3	72%	0.717	76%	0.764	S	S	*	*			trans	88.6	118.8	137.1	-58.8	-8.4	0	0	0	120
235	N	27.3	Very low	32.4	Very low	146 Å²	146	150.2 Å²	150.2	78%	0.781	77%	0.771	S	S	*	*			trans	30	119.6	145.9	-63.4	6.8	0	0	0	119.6
236	T	34.7	Very low	32.1	Very low	144 Å²	144	147.6 Å²	147.6	88%	0.883	76%	0.763	S	S	*	*				-151.6	144.1	111.6	-4.3	0	0	0	0	111.1
237	D	28.7	Very low	31.9	Very low	145 Å²	145	149 Å²	149	78%	0.775	77%	0.77	S	S	*	*			trans	-69	142.3	178.6	-57.4	-96.1	0	0	0	112.3
238	S	32.7	Very low	32.2	Very low	122 Å²	122	143.6 Å²	143.6	85%	0.853	77%	0.766	S	S	*	*			trans	-156.1	115.6	149.6	-85.1	0	0	0	0	111.4	N240	S238-N240 PolarHBondContact O-N 2.79Å
239	Y	26.4	Very low	32.1	Very low	226 Å²	226	141.5 Å²	141.5	89%	0.886	76%	0.756	S	S	*	*			trans	-56.8	131.5	159.3	-87.1	-115.5	0	0	0	109.6
240	N	32.7	Very low	32.1	Very low	145 Å²	145	145.3 Å²	145.3	78%	0.775	76%	0.761	S	S	*	*				-152.5	148	123.9	-143.2	-22.1	0	0	0	113	S238	S238-N240 PolarHBondContact O-N 2.79Å
241	N	28.5	Very low	31.8	Very low	130 Å²	130	150.9 Å²	150.9	70%	0.695	77%	0.77	S	S	*	*			trans	-82	140.5	168.2	-67.3	-84.7	0	0	0	109.5
242	Q	32.7	Very low	32.1	Very low	167 Å²	167	143.6 Å²	143.6	78%	0.78	76%	0.761	S	S	*	*				-172.1	154.3	129	-108.6	158.1	100.1	0	0	116
243	S	33.7	Very low	32.5	Very low	85 Å²	85	147 Å²	147	59%	0.594	77%	0.771	S	S	*	*			trans	71.6	111.4	162.5	-64.9	0	0	0	0	116.6
244	K	36	Very low	32.6	Very low	182 Å²	182	146.3 Å²	146.3	79%	0.791	77%	0.773	S	S	*	*				62.3	123.6	76.2	-63.3	159.9	-172.5	167.9	0	109.5
245	R	29.9	Very low	33	Very low	244 Å²	244	147.3 Å²	147.3	92%	0.921	78%	0.778	S	S	*	*			cis	-173.7	169.2	34.5	-120.7	-176.8	176.5	-171.7	-1.2	106.8
246	A	33.7	Very low	33.3	Very low	74 Å²	74	144.9 Å²	144.9	61%	0.612	78%	0.779	S	S	*	*			cis	-166.6	172.1	-7.3	0	0	0	0	0	110
247	V	33.9	Very low	33.3	Very low	133 Å²	133	144.9 Å²	144.9	81%	0.806	77%	0.773	S	S	*	*			trans	67.4	117.6	149	171.3	0	0	0	0	116.5
248	S	35.9	Very low	33.9	Very low	113 Å²	113	147.6 Å²	147.6	79%	0.79	78%	0.778	S	S	*	*			cis	77.3	143.9	43.5	-154.8	0	0	0	0	112.9
249	A	33.3	Very low	33.8	Very low	67 Å²	67	148.9 Å²	148.9	55%	0.554	78%	0.775	S	S	*	*			cis	-140.4	-174.8	4.5	0	0	0	0	0	109.4
250	Y	34.7	Very low	34.3	Very low	230 Å²	230	146.1 Å²	146.1	90%	0.902	78%	0.775	S	S	*	*				-160.2	157.7	55.7	-113	-82.5	0	0	0	114.3
251	Y	33.3	Very low	34.2	Very low	224 Å²	224	146.3 Å²	146.3	88%	0.878	78%	0.776	S	S	*	*			trans	-94.2	-177	172.9	-76.3	-110.5	0	0	0	110.8
252	G	34.8	Very low	34.2	Very low	67 Å²	67	144.8 Å²	144.8	69%	0.691	78%	0.776	S	S	*	*			cis	-171.9	-138.4	5.2	0	0	0	0	0	108.9
253	I	38.3	Very low	34	Very low	153 Å²	153	142.4 Å²	142.4	79%	0.785	78%	0.777	S	S	*	*			cis	-151.9	172	-0.7	-64.4	-177	0	0	0	107.2
254	N	34.7	Very low	34	Very low	141 Å²	141	144.5 Å²	144.5	75%	0.754	79%	0.786	S	S	*	*			trans	-82.9	-173.1	-175	-36.7	-38.6	0	0	0	113.7
255	D	37.3	Very low	34	Very low	155 Å²	155	143.1 Å²	143.1	83%	0.829	79%	0.787	S	S	*	*				-167.5	164.6	62	-111.2	-31.6	0	0	0	114
256	A	34.4	Very low	33.9	Very low	96 Å²	96	136.4 Å²	136.4	79%	0.793	78%	0.778	S	S	*	*			trans	-157.4	123.2	170.1	0	0	0	0	0	113.7
257	D	34.3	Very low	33.8	Very low	143 Å²	143	140.7 Å²	140.7	77%	0.765	79%	0.791	S	S	*	*			trans	-169.6	135.7	139	-157.9	-13	0	0	0	111.2
258	K	40.6	Very low	33.8	Very low	202 Å²	202	138.8 Å²	138.8	88%	0.878	79%	0.789	S	S	*	*			trans	-158.9	120.3	156.8	-81.6	-150.9	177.4	-177.5	0	110.9
259	N	29.8	Very low	33.7	Very low	149 Å²	149	141.7 Å²	141.7	80%	0.797	79%	0.794	S	S	*	*			trans	-53.8	139.2	163.6	-85.9	-103.9	0	0	0	111.8
260	L	38.8	Very low	33.6	Very low	168 Å²	168	150 Å²	150	88%	0.88	81%	0.811	S	S	*	*			trans	-154	157.8	141	-138.9	73.4	0	0	0	111.9
261	D	30.3	Very low	33.5	Very low	150 Å²	150	147.7 Å²	147.7	80%	0.802	81%	0.81	S	S	*	*			trans	-38.7	156.6	-162.1	-94.9	-66.4	0	0	0	122.4
262	S	27.8	Very low	33.4	Very low	98 Å²	98	145.4 Å²	145.4	69%	0.685	81%	0.808	S	S	*	*			trans	-78.7	157.3	165.8	63.8	0	0	0	0	113
263	S	27.8	Very low	33.4	Very low	116 Å²	116	151.2 Å²	151.2	81%	0.811	82%	0.817	S	S	*	*			trans	76	121.6	179.4	81.7	0	0	0	0	116.6
264	V	35.4	Very low	33.2	Very low	130 Å²	130	152.6 Å²	152.6	79%	0.788	82%	0.82	S	S	*	*				-179.4	129.8	120.3	149.7	0	0	0	0	109
265	N	34.4	Very low	33.2	Very low	152 Å²	152	152.6 Å²	152.6	81%	0.813	82%	0.818	S	S	*	*			trans	42.8	114.8	166.1	-81.3	-6.2	0	0	0	121.9
266	S	28.5	Very low	32.8	Very low	103 Å²	103	157.3 Å²	157.3	72%	0.72	83%	0.825	S	S	*	*			trans	-50.8	165.7	141.9	-45.7	0	0	0	0	112.9
267	N	30.8	Very low	32.6	Very low	165 Å²	165	157.8 Å²	157.8	88%	0.882	82%	0.822	S	S	*	*			trans	100.9	44.4	173.8	-52.2	-21.9	0	0	0	117.4
268	A	34.2	Very low	32.5	Very low	93 Å²	93	160.5 Å²	160.5	77%	0.769	83%	0.827	S	S	*	*			trans	-138.8	6	171.1	0	0	0	0	0	115.8	W270	A268-W270 PolarHBondContact O-N 3.24Å
269	I	33.5	Very low	32.1	Very low	174 Å²	174	156.9 Å²	156.9	89%	0.892	83%	0.827	S	S	*	*			trans	-89.5	68.4	-168.9	-47.4	-178.8	0	0	0	111.6
270	W	31.2	Very low	32.4	Very low	241 Å²	241	156.2 Å²	156.2	91%	0.913	83%	0.828	S	S	*	*	S	Bend	trans	-150	29.8	170.2	-142.6	69.9	0	0	0	116.3	A268	A268-W270 PolarHBondContact O-N 3.24Å
271	M	32.5	Very low	32.3	Very low	181 Å²	181	154.1 Å²	154.1	89%	0.892	83%	0.825	S	S	*	*			trans	-145.6	77.6	171.2	-84.1	-150.7	165.9	0	0	113.7
272	Q	32.8	Very low	32.4	Very low	176 Å²	176	156.5 Å²	156.5	82%	0.822	83%	0.831	S	S	*	*			trans	-151.5	55	174.9	-150.6	92.3	71	0	0	115
273	Q	34.3	Very low	32.7	Very low	190 Å²	190	159.6 Å²	159.6	89%	0.888	83%	0.834	S	S	*	*	S	Bend	trans	-133.2	22.2	171.7	-131.4	-179.6	27	0	0	115.1
274	H	34.6	Very low	32.8	Very low	182 Å²	182	160.4 Å²	160.4	84%	0.843	83%	0.829	S	S	*	*			trans	-133.3	40.9	-178.7	-79.1	-12.9	0	0	0	114.4
275	I	33	Very low	32.6	Very low	141 Å²	141	162.8 Å²	162.8	72%	0.723	83%	0.831	S	S	*	*			trans	-131.9	100.8	161	-54.2	178.5	0	0	0	109.5
276	W	30.4	Very low	32.2	Very low	254 Å²	254	158.5 Å²	158.5	96%	0.962	82%	0.823	S	S	*	*			trans	-154.5	113.3	141.3	-101.2	13.9	0	0	0	107
277	S	30.5	Very low	32.3	Very low	106 Å²	106	163.8 Å²	163.8	74%	0.741	83%	0.833	S	S	*	*			trans	-161.4	120.1	178.6	-81.6	0	0	0	0	109.9
278	K	32.3	Very low	32.3	Very low	200 Å²	200	162.2 Å²	162.2	87%	0.87	83%	0.825	S	S	*	*			trans	65.8	105.6	167.6	-51.7	179.8	-177.1	-177.2	0	116.6
279	S	30.9	Very low	32.4	Very low	125 Å²	125	163.5 Å²	163.5	87%	0.874	83%	0.825	S	S	*	*			trans	-158.9	66.7	145.6	-82.9	0	0	0	0	111.4
280	V	36.6	Very low	32.4	Very low	136 Å²	136	160.3 Å²	160.3	82%	0.824	81%	0.814	S	S	*	*			trans	-129.9	111.4	160	-178.9	0	0	0	0	106.8
281	P	36.3	Very low	32.3	Very low	124 Å²	124	155.9 Å²	155.9	81%	0.805	81%	0.808	S	S	*	*			trans	-70.1	131.2	-178.6	-19.5	32.6	0	0	0	111.9
282	Q	31.7	Very low	32.4	Very low	199 Å²	199	152.7 Å²	152.7	93%	0.93	80%	0.804	S	S	*	*			trans	-89	107	162.8	-73.2	-167	-5.4	0	0	109.5
283	H	34.1	Very low	32.2	Very low	164 Å²	164	151.6 Å²	151.6	76%	0.759	81%	0.809	S	S	*	*			trans	-149.1	128.5	163.8	-158.1	-126.3	0	0	0	112
284	L	31.6	Very low	32.1	Very low	133 Å²	133	147.5 Å²	147.5	70%	0.696	80%	0.802	S	S	*	*			trans	60.6	101.2	167.5	-64.6	173.5	0	0	0	120.6
285	H	29.8	Very low	32	Very low	180 Å²	180	146.2 Å²	146.2	83%	0.833	80%	0.801	S	S	*	*				68.9	88.9	106.4	-134.6	-94.1	0	0	0	119.7
286	G	26.8	Very low	32	Very low	62 Å²	62	144.5 Å²	144.5	64%	0.639	80%	0.802	S	S	*	*			trans	60.4	121.3	132.4	0	0	0	0	0	120.6
287	F	31.5	Very low	32.1	Very low	213 Å²	213	138.9 Å²	138.9	93%	0.934	80%	0.795	S	S	*	*				-166.6	143.1	106.2	-103.2	-72.2	0	0	0	110.3
288	N	30.4	Very low	32.3	Very low	132 Å²	132	138.8 Å²	138.8	71%	0.706	79%	0.794	S	S	*	*			trans	-107.9	141.1	169.9	-173.5	-13.2	0	0	0	107.4	T290	N288-T290 PolarHBondContact OD1-N 2.68Å
289	P	36.4	Very low	32.5	Very low	120 Å²	120	134.3 Å²	134.3	78%	0.779	79%	0.788	S	S	*	*			trans	-129.4	129.5	140.6	34.9	-24.7	0	0	0	112.8
290	T	33.5	Very low	32.5	Very low	107 Å²	107	137.5 Å²	137.5	66%	0.656	79%	0.787	S	S	*	*			trans	-72.1	151	170.1	48.2	0	0	0	0	112.6	N288	N288-T290 PolarHBondContact OD1-N 2.68Å
291	D	28.9	Very low	32.3	Very low	149 Å²	149	136.7 Å²	136.7	80%	0.797	79%	0.786	S	S	*	*			trans	32.5	108.3	145.8	-54.8	-19.8	0	0	0	119.2
292	S	33	Very low	32	Very low	114 Å²	114	134 Å²	134	80%	0.797	78%	0.781	S	S	*	*			trans	-165.1	116.5	133.1	-85.2	0	0	0	0	112.8	S294	S292-S294 PolarHBondContact O-N 3.49Å
293	T	30.3	Very low	32	Very low	152 Å²	152	131.5 Å²	131.5	93%	0.933	78%	0.779	S	S	*	*			trans	-82	92.4	163.4	46.3	0	0	0	0	110.8
294	S	32.1	Very low	31.8	Very low	105 Å²	105	128 Å²	128	73%	0.734	78%	0.778	S	S	*	*			trans	-160.4	154.2	157	47.9	0	0	0	0	112.3	S292	S292-S294 PolarHBondContact O-N 3.49Å
295	N	31	Very low	31.7	Very low	155 Å²	155	126 Å²	126	83%	0.829	78%	0.781	S	S	*	*			trans	-73.1	170.5	-166.4	-58.4	-42	0	0	0	115.1
296	S	34.2	Very low	31.8	Very low	105 Å²	105	123.1 Å²	123.1	73%	0.734	78%	0.776	S	S	*	*			trans	95.9	90.9	152.1	-56.4	0	0	0	0	119.6
297	V	32.5	Very low	32	Very low	135 Å²	135	128.2 Å²	128.2	82%	0.818	78%	0.783	S	S	*	*			trans	36.3	143.8	130.6	-64.2	0	0	0	0	123.4
298	S	34.6	Very low	32.1	Very low	105 Å²	105	124.3 Å²	124.3	73%	0.734	78%	0.777	S	S	*	*			trans	84.5	96.7	149.1	63.8	0	0	0	0	121.4
299	S	36.3	Very low	32.1	Very low	106 Å²	106	123.9 Å²	123.9	74%	0.741	77%	0.774	S	S	*	*				66.7	110	120.2	-58.9	0	0	0	0	123.3
300	F	31.3	Very low	32	Very low	192 Å²	192	129.5 Å²	129.5	84%	0.842	78%	0.78	S	S	*	*			trans	83.7	122.9	131.9	-89.9	-94.8	0	0	0	122.7
301	C	31.1	Very low	31.9	Very low	118 Å²	118	132.3 Å²	132.3	80%	0.797	79%	0.786	S	S	*	*			trans	27.1	139.2	149.7	-60.5	0	0	0	0	122.5
302	G	31.1	Very low	32.3	Very low	68 Å²	68	131.2 Å²	131.2	70%	0.701	79%	0.79	S	S	*	*			cis	152	-175.6	-4.8	0	0	0	0	0	114.7
303	V	30.8	Very low	32.2	Very low	147 Å²	147	130.1 Å²	130.1	89%	0.891	78%	0.782	S	S	*	*			trans	82.2	133.5	168.3	-172.2	0	0	0	0	118.4
304	A	30.8	Very low	32.1	Very low	89 Å²	89	128.4 Å²	128.4	74%	0.736	77%	0.774	S	S	*	*			trans	62.5	131.6	171.5	0	0	0	0	0	117
305	A	30.3	Very low	32.1	Very low	92 Å²	92	128 Å²	128	76%	0.76	77%	0.772	S	S	*	*			cis	69.5	130	42.6	0	0	0	0	0	112.2
306	T	31.3	Very low	32.3	Very low	119 Å²	119	125.1 Å²	125.1	73%	0.73	76%	0.76	S	S	*	*			cis	-151.8	151.5	24.8	46	0	0	0	0	113.9
307	E	29.9	Very low	32.7	Very low	170 Å²	170	126.1 Å²	126.1	79%	0.794	76%	0.763	S	S	*	*			trans	61.2	164.5	140.8	-68.3	-175.6	165.8	0	0	123.6
308	T	34.3	Very low	32.7	Very low	130 Å²	130	127.3 Å²	127.3	80%	0.798	77%	0.765	S	S	*	*			trans	67.6	115.1	174.5	66.6	0	0	0	0	116.6
309	N	29.8	Very low	32.9	Very low	123 Å²	123	126.5 Å²	126.5	66%	0.658	77%	0.765	S	S	*	*				71.1	95.5	60.2	-173.2	0.7	0	0	0	114
310	R	35.1	Very low	32.8	Very low	238 Å²	238	129 Å²	129	90%	0.898	77%	0.77	S	S	*	*				-166.5	151.2	125.5	-102.9	150.1	-169.9	158.8	3.7	114.9
311	H	31.9	Very low	33	Very low	167 Å²	167	126.8 Å²	126.8	77%	0.773	77%	0.767	S	S	*	*			trans	-71.1	149.1	-179.8	-53.4	-122.2	0	0	0	112.6
312	S	37.3	Very low	33.5	Very low	126 Å²	126	127.9 Å²	127.9	88%	0.881	76%	0.763	S	S	*	*			trans	-170.7	161.1	132.4	-83.1	0	0	0	0	111
313	S	31	Very low	33.5	Very low	90 Å²	90	133.6 Å²	133.6	63%	0.629	77%	0.771	S	S	*	*			trans	-121.8	167.6	-175.4	-69.8	0	0	0	0	112.3
314	C	27.2	Very low	33.6	Very low	116 Å²	116	129.5 Å²	129.5	78%	0.784	76%	0.759	S	S	*	*			trans	64.6	155.8	162.1	84.6	0	0	0	0	116.6
315	S	31.8	Very low	33.8	Very low	97 Å²	97	134.7 Å²	134.7	68%	0.678	77%	0.766	S	S	*	*			cis	-137.3	178.9	8.4	-82.3	0	0	0	0	111.9
316	V	36	Very low	33.9	Very low	95 Å²	95	139.1 Å²	139.1	58%	0.576	77%	0.768	S	S	*	*			trans	-106.7	139.9	162.5	149.9	0	0	0	0	108.7
317	P	41.8	Very low	33.9	Very low	125 Å²	125	137.6 Å²	137.6	81%	0.812	76%	0.763	S	S	*	*			trans	-98.9	144.8	154.1	35.6	-27.6	0	0	0	111
318	D	32.6	Very low	34.3	Very low	160 Å²	160	138.7 Å²	138.7	86%	0.856	77%	0.767	S	S	*	*			trans	-119.3	141.1	171	-163.5	2.6	0	0	0	107.7
319	A	38.8	Very low	34.2	Very low	88 Å²	88	140.2 Å²	140.2	73%	0.727	77%	0.77	S	S	*	*			trans	-167.8	134.4	-179.8	0	0	0	0	0	113.4
320	D	35.3	Very low	34.5	Very low	158 Å²	158	139.6 Å²	139.6	85%	0.845	77%	0.773	S	S	*	*			trans	-71	166.5	178.5	-49.1	-100.4	0	0	0	114.8
321	N	35	Very low	34.5	Very low	147 Å²	147	133.2 Å²	133.2	79%	0.786	77%	0.765	S	S	*	*				151.6	167	102.3	-158.8	-1.9	0	0	0	113.6
322	I	40.6	Very low	34.7	Very low	140 Å²	140	135.3 Å²	135.3	72%	0.718	77%	0.772	S	S	*	*			trans	82.3	66.4	162.5	-37.8	-174.7	0	0	0	118.3
323	H	32.5	Very low	34.5	Very low	188 Å²	188	136.5 Å²	136.5	87%	0.87	77%	0.768	S	S	*	*				45.4	120	102.2	-160.4	-81.7	0	0	0	120.5
324	G	33	Very low	34.6	Very low	62 Å²	62	142.4 Å²	142.4	64%	0.639	78%	0.777	S	S	*	*			trans	176	121.4	161.1	0	0	0	0	0	117.9
325	F	34.6	Very low	34.9	Very low	198 Å²	198	143.9 Å²	143.9	87%	0.868	78%	0.776	S	S	*	*			trans	51.9	100	162.8	-71.5	-94.1	0	0	0	119.1
326	F	31.1	Very low	35.1	Very low	184 Å²	184	144.3 Å²	144.3	81%	0.807	78%	0.775	S	S	*	*				63.9	135.8	83.7	-91.7	-118.2	0	0	0	115.4
327	S	31.7	Very low	35.1	Very low	88 Å²	88	148.4 Å²	148.4	62%	0.615	79%	0.787	S	S	*	*			cis	146.9	120.9	-11.8	-95.2	0	0	0	0	106.2
328	Q	38.4	Very low	35	Very low	192 Å²	192	147.5 Å²	147.5	90%	0.897	78%	0.781	S	S	*	*				-179.9	133.6	128.8	-97.7	162.2	19.7	0	0	113.2
329	L	32.1	Very low	35	Very low	163 Å²	163	146.8 Å²	146.8	85%	0.853	78%	0.778	S	S	*	*			trans	-101.5	-174.7	167.7	-77.4	164.1	0	0	0	107.4
330	P	36.5	Very low	34.9	Very low	110 Å²	110	148.4 Å²	148.4	71%	0.714	78%	0.784	S	S	*	*			cis	-138.2	-176.5	9.4	41.5	-21.6	0	0	0	116.4
331	S	36	Very low	35	Very low	104 Å²	104	147.7 Å²	147.7	73%	0.727	78%	0.78	S	S	*	*			trans	-84.4	156	174.6	20.7	0	0	0	0	114.2
332	F	35.6	Very low	35.4	Very low	210 Å²	210	149.2 Å²	149.2	92%	0.921	78%	0.782	S	S	*	*			trans	-139.2	174.7	154.8	-93.6	-70.9	0	0	0	111.2
333	N	33.3	Very low	35.1	Very low	151 Å²	151	146.5 Å²	146.5	81%	0.807	78%	0.781	S	S	*	*			trans	-133.5	169.2	-152.2	-146	-46.3	0	0	0	112.4
334	R	32.5	Very low	35.3	Very low	214 Å²	214	147.5 Å²	147.5	81%	0.808	78%	0.779	S	S	*	*			trans	80.4	145.3	158.4	-105.7	-178	-158.4	-147.1	2.6	121.4
335	L	33.3	Very low	35.4	Very low	147 Å²	147	149.2 Å²	149.2	77%	0.77	78%	0.781	S	S	*	*			trans	69.6	150.2	156.7	-61.7	164.9	0	0	0	117.6
336	V	36.7	Very low	35.3	Very low	107 Å²	107	147.5 Å²	147.5	65%	0.648	78%	0.78	S	S	*	*			cis	-169.7	153.9	-35.8	104.4	0	0	0	0	108.9
337	Q	35.2	Very low	35.6	Very low	180 Å²	180	144.3 Å²	144.3	84%	0.841	78%	0.78	S	S	*	*			trans	70.5	162.2	167.9	-80.4	169	40.6	0	0	119.7
338	P	39.5	Very low	35.6	Very low	106 Å²	106	147.3 Å²	147.3	69%	0.688	79%	0.789	S	S	*	*			trans	-128.9	-164.2	-156.5	45.2	-29.1	0	0	0	115.6
339	N	32.6	Very low	35.6	Very low	146 Å²	146	142.8 Å²	142.8	78%	0.781	78%	0.779	S	S	*	*			trans	72.6	120.5	167.8	-69.2	-6.4	0	0	0	119
340	S	38.1	Very low	35.7	Very low	122 Å²	122	140.1 Å²	140.1	85%	0.853	77%	0.774	S	S	*	*				-173.2	153.2	102	40.3	0	0	0	0	113.1
341	N	37.2	Very low	36	Very low	143 Å²	143	141.6 Å²	141.6	77%	0.765	78%	0.781	S	S	*	*			trans	-84.7	156.7	-168.3	-48.6	-25.6	0	0	0	113.5
342	Q	43	Very low	35.9	Very low	178 Å²	178	144.5 Å²	144.5	83%	0.832	78%	0.783	S	S	*	*			trans	-163.4	143.9	131.1	-113.8	162.8	94.3	0	0	112.5
343	A	35.1	Very low	36	Very low	84 Å²	84	143.3 Å²	143.3	69%	0.694	78%	0.779	S	S	*	*			trans	-156.4	135	-176.6	0	0	0	0	0	112.3
344	Y	36.6	Very low	36	Very low	209 Å²	209	141 Å²	141	82%	0.82	77%	0.773	S	S	*	*			trans	-159.6	166.6	169.3	-60	-72.3	0	0	0	110
345	S	33.8	Very low	36.7	Very low	98 Å²	98	137.3 Å²	137.3	69%	0.685	78%	0.776	S	S	*	*				-167.6	135.1	-66.3	-101	0	0	0	0	112.7
346	L	33.1	Very low	36.7	Very low	162 Å²	162	136.8 Å²	136.8	85%	0.848	78%	0.775	S	S	*	*			trans	68.8	156.5	146.6	-68.4	165.7	0	0	0	123
347	S	36.8	Very low	36.7	Very low	116 Å²	116	138.5 Å²	138.5	81%	0.811	78%	0.777	S	S	*	*			trans	79.6	145.3	157.3	76.6	0	0	0	0	119.6
348	N	32.8	Very low	36.8	Very low	152 Å²	152	138.1 Å²	138.1	81%	0.813	78%	0.775	S	S	*	*			cis	-162.6	177.1	-32.3	-159.2	8	0	0	0	110.4
349	S	38.2	Very low	36.5	Very low	96 Å²	96	138.2 Å²	138.2	67%	0.671	78%	0.779	S	S	*	*			trans	79.2	91	154.1	-56.7	0	0	0	0	120.7
350	S	34.2	Very low	36.5	Very low	108 Å²	108	135.9 Å²	135.9	76%	0.755	78%	0.78	S	S	*	*				18.3	125.2	125.2	-169.8	0	0	0	0	121
351	V	42.4	Very low	36.5	Very low	141 Å²	141	139 Å²	139	86%	0.855	78%	0.781	S	S	*	*				-146.8	144.4	127.9	164.6	0	0	0	0	108.3
352	Q	33.1	Very low	36.2	Very low	165 Å²	165	141.8 Å²	141.8	77%	0.771	79%	0.786	S	S	*	*			trans	-81.7	142.2	175.9	-68	153.2	-96.9	0	0	112.5
353	H	37.6	Very low	35.6	Very low	184 Å²	184	137.1 Å²	137.1	85%	0.852	79%	0.786	S	S	*	*			trans	-169.6	158.4	130.5	-98.6	-65	0	0	0	109.6
354	P	34.6	Very low	35.5	Very low	104 Å²	104	142 Å²	142	68%	0.675	79%	0.792	S	S	*	*			trans	-87.2	143.8	-155.4	32.3	-36.3	0	0	0	115	N356	P354-N356 PolarHBondContact O-N 3.16Å; P354-N356 VanDerWaalsContact O-N 3.07Å
355	P	46	Very low	35.1	Very low	135 Å²	135	137.4 Å²	137.4	88%	0.877	79%	0.785	S	S	*	*			trans	-78.1	89.2	171.2	32.5	-33.7	0	0	0	111.1	M357	P355-M357 PolarHBondContact O-N 3.33Å
356	N	33.6	Very low	34.9	Very low	137 Å²	137	143.1 Å²	143.1	73%	0.733	79%	0.792	S	S	*	*			trans	-85.5	97.6	159.3	176.3	17.1	0	0	0	109.4	P354	P354-N356 PolarHBondContact O-N 3.16Å; P354-N356 VanDerWaalsContact O-N 3.07Å
357	M	36.2	Very low	35	Very low	143 Å²	143	146.7 Å²	146.7	70%	0.704	79%	0.794	S	S	*	*			trans	-166.1	142.5	148.8	-104.9	-50.6	104.5	0	0	111.7	P355	P355-M357 PolarHBondContact O-N 3.33Å
358	Q	37.4	Very low	34.6	Very low	171 Å²	171	148.3 Å²	148.3	80%	0.799	79%	0.794	S	S	*	*			trans	63.1	79.3	163.2	-60.8	178.3	13.6	0	0	116.6
359	S	34.4	Very low	34.6	Very low	108 Å²	108	143.7 Å²	143.7	76%	0.755	78%	0.782	S	S	*	*				2.5	132.9	125.7	-43.3	0	0	0	0	116
360	A	32	Very low	34.5	Very low	98 Å²	98	144.4 Å²	144.4	81%	0.81	79%	0.787	S	S	*	*				47.9	120.7	73.3	0	0	0	0	0	111.7
361	E	38.4	Very low	34.8	Very low	188 Å²	188	146.1 Å²	146.1	88%	0.879	79%	0.788	S	S	*	*				-136.6	154.8	56.4	-169.3	171.2	116.9	0	0	114.7	G363	E361-G363 PolarHBondContact O-N 3.4Å
362	K	30	Very low	35.2	Very low	200 Å²	200	144.5 Å²	144.5	87%	0.87	77%	0.771	S	S	*	*			trans	-85	93.5	172.4	-72.2	177.9	171.3	177.1	0	110.5	F364	K362-F364 PolarHBondContact O-N 2.9Å
363	G	32.1	Very low	36.6	Very low	81 Å²	81	138 Å²	138	84%	0.835	74%	0.744	S	S	*	*			trans	-68.2	65.3	173	0	0	0	0	0	114.3	E361	E361-G363 PolarHBondContact O-N 3.4Å
364	F	31.9	Very low	38.5	Very low	187 Å²	187	132.9 Å²	132.9	82%	0.82	72%	0.723	S	S	*	*			trans	-85.2	156.8	162.1	-162.5	-103.7	0	0	0	108.7	K362	K362-F364 PolarHBondContact O-N 2.9Å
365	V	28.7	Very low	40.5	Very low	111 Å²	111	131 Å²	131	67%	0.673	71%	0.705	S	S	*	*			trans	69.9	137.6	-173.4	-163	0	0	0	0	112.3
366	R	30	Very low	42.3	Very low	218 Å²	218	127.2 Å²	127.2	82%	0.823	68%	0.675	S	S	*	*			cis	-104.5	123.6	4.7	-56.7	-94.7	-171.7	163.2	4.7	111.4
367	R	33.8	Very low	44.9	Very low	237 Å²	237	122.1 Å²	122.1	89%	0.894	65%	0.647	S	S	*	*			trans	-99	122.9	141.3	-172	-177.5	-72.8	-162.3	0.3	105.4	G369	R367-G369 VanDerWaalsContact C-N 3.29Å; R367-G369 PolarHBondContact O-N 3.16Å
368	N	29.4	Very low	47.6	Very low	151 Å²	151	115.4 Å²	115.4	81%	0.807	61%	0.614	S	S	*	*			trans	-73.2	89.5	174.6	-72.2	-8.6	0	0	0	107.8
369	G	32.8	Very low	50.4	Low	55 Å²	55	108.2 Å²	108.2	57%	0.567	58%	0.581	S	S	*	*			trans	-128.3	118.1	-179.1	0	0	0	0	0	110.4	R367 D371	R367-G369 VanDerWaalsContact C-N 3.29Å; R367-G369 PolarHBondContact O-N 3.16Å; G369-D371 PolarHBondContact O-N 3.07Å
370	S	35.2	Very low	53.2	Low	111 Å²	111	105.4 Å²	105.4	78%	0.776	56%	0.555	S	S	*	*			trans	-71.5	83.8	159	51	0	0	0	0	107.7	Q372	S370-Q372 PolarHBondContact O-N 3.09Å
371	D	41.3	Very low	56.2	Low	143 Å²	143	102.6 Å²	102.6	77%	0.765	53%	0.525	S	S	*	.			trans	-73.1	72.2	-177	-164.3	18.9	0	0	0	110.7	G369 S373	G369-D371 PolarHBondContact O-N 3.07Å; D371-S373 PolarHBondContact O-N 3.49Å
372	Q	50.6	Low	58.7	Low	107 Å²	107	94.3 Å²	94.3	50%	0.5	49%	0.486	S	S	.	.			trans	-68.9	80.5	159.8	-72.8	-173.6	82	0	0	106.9	S370 D374 M377	S370-Q372 PolarHBondContact O-N 3.09Å; Q372-D374 PolarHBondContact O-N 3.13Å; Q372-M377 HydrophobicContact CB-SD 4.09Å
373	S	63.4	Low	61.4	Low	30 Å²	30	90.9 Å²	90.9	21%	0.21	48%	0.484	C	S	.	.			trans	-48.1	137.1	-176.8	59	0	0	0	0	111.1	D371 E375 H376	D371-S373 PolarHBondContact O-N 3.49Å; S373-E375 PolarHBondContact O-N 3.13Å; S373-H376 PolarHBondContact O-N 3.01Å; S373-H376 PolarHBondContact OG-CD2 3.43Å
374	D	76.7	Confident	64.1	Low	75 Å²	75	93 Å²	93	40%	0.401	47%	0.473	S	S	.	.	G	3₁₀ helix	trans	-46.9	-15.8	-175.9	-65.8	16.5	0	0	0	116.2	Q372 H376 Q415 C416	Q372-D374 PolarHBondContact O-N 3.13Å; D374-H376 VanDerWaalsContact C-N 3.28Å; D374-H376 PolarHBondContact O-N 3.2Å; D374-Q415 HydrophobicContact CB-CB 3.95Å; D374-Q415 HydrophobicContact CB-CG 4.02Å; D374-Q415 PolarHBondContact O-N 2.96Å; D374-Q415 PolarHBondContact OD1-NE2 2.85Å; D374-Q415 PolarHBondContact OD2-NE2 2.78Å; D374-C416 HydrophobicContact CB-CB 4.26Å; D374-C416 PolarHBondContact O-N 3.22Å
375	E	77.4	Confident	66.8	Low	65 Å²	65	86.6 Å²	86.6	30%	0.304	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-62.1	-24.8	167.4	-61.2	-179.7	-164.5	0	0	114.9	S373 R414 R440	S373-E375 PolarHBondContact O-N 3.13Å; E375-R414 VanDerWaalsContact O-CD 3.24Å; E375-R414 WeakPolarHBondContact O-CD 3.35Å; E375-R440 IonicContact OE1-NH1 3.83Å; E375-R440 WeakPolarHBondContact OE2-CD 3.47Å; E375-R440 IonicContact OE2-CZ 2.73Å; E375-R440 IonicContact OE2-NE 2.79Å; E375-R440 IonicContact OE2-NH1 3.62Å; E375-R440 PolarHBondContact OE2-NH1 3.17Å
376	H	82.6	Confident	69.8	Low	56 Å²	56	88 Å²	88	26%	0.259	45%	0.452	S	S	.	.	G	3₁₀ helix	trans	-107.5	-1.2	-177.3	-65.8	-64.5	0	0	0	113.2	S373 D374 S392 D393 R440	S373-H376 PolarHBondContact O-N 3.01Å; S373-H376 PolarHBondContact OG-CD2 3.43Å; D374-H376 VanDerWaalsContact C-N 3.28Å; D374-H376 PolarHBondContact O-N 3.2Å; H376-S392 WeakPolarHBondContact O-CA 3.41Å; H376-D393 IonicContact CE1-OD2 2.68Å; H376-D393 IonicContact CG-OD2 3.55Å; H376-D393 IonicContact ND1-OD2 3.96Å; H376-D393 PolarHBondContact ND1-OD2 2.7Å; H376-D393 PolarHBondContact O-N 3.27Å; H376-D393 VanDerWaalsContact O-N 3.14Å; H376-R440 PolarHBondContact NE2-NH2 3.14Å
377	M	89.6	Confident	72.8	Confident	29 Å²	29	80.9 Å²	80.9	14%	0.143	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	120.9	-176.3	-64	-59.6	-75.1	0	0	109.3	Q372 T390 F391 R414 Q415	Q372-M377 HydrophobicContact CB-SD 4.09Å; M377-T390 HydrophobicContact CB-CG2 4.42Å; M377-T390 WeakPolarHBondContact CE-OG1 3.41Å; M377-F391 CarbonylContact C-O 3.57Å; M377-F391 WeakPolarHBondContact CA-O 3.23Å; M377-R414 CarbonylContact O-C 3.58Å; M377-R414 WeakPolarHBondContact O-CA 3.45Å; M377-Q415 HydrophobicContact CB-CB 4.04Å; M377-Q415 WeakPolarHBondContact O-CB 3.1Å; M377-Q415 PolarHBondContact O-N 3.14Å
378	W	93	Very high	75.6	Confident	2 Å²	2	72.5 Å²	72.5	1%	0.008	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	152.4	-173.2	-67.1	85.8	0	0	0	112.9	T390 F391 D393 M396 I412 R413 R414 Y426 P434 F435	W378-T390 CarbonylContact O-C 3.5Å; W378-T390 VanDerWaalsContact O-CA 3.26Å; W378-T390 WeakPolarHBondContact O-CA 3.2Å; W378-F391 PolarHBondContact N-O 2.8Å; W378-F391 PolarHBondContact O-N 3.05Å; W378-D393 PolarHBondContact NE1-OD1 2.62Å; W378-M396 HydrophobicContact CB-CE 3.86Å; W378-M396 HydrophobicContact CB-CG 3.65Å; W378-M396 HydrophobicContact CB-SD 3.93Å; W378-M396 HydrophobicContact CG-CE 4.4Å; W378-M396 HydrophobicContact CG-CG 3.88Å; W378-I412 HydrophobicContact CE3-CB 4.42Å; W378-I412 HydrophobicContact CE3-CD1 4.13Å; W378-I412 HydrophobicContact CE3-CG1 4.38Å; W378-I412 HydrophobicContact CZ3-CD1 3.76Å; W378-I412 HydrophobicContact CZ3-CG1 4.12Å; W378-R413 CarbonylContact C-O 3.56Å; W378-R413 WeakPolarHBondContact CA-O 3.31Å; W378-R414 HydrophobicContact CD2-CG 3.66Å; W378-R414 HydrophobicContact CE3-CG 3.67Å; W378-R414 HydrophobicContact CG-CG 4.47Å; W378-R414 HydrophobicContact CH2-CG 3.51Å; W378-R414 HydrophobicContact CZ2-CG 3.51Å; W378-R414 HydrophobicContact CZ3-CG 3.6Å; W378-Y426 HydrophobicContact CH2-CD1 4.24Å; W378-Y426 HydrophobicContact CH2-CE1 4.15Å; W378-Y426 HydrophobicContact CZ3-CD1 4.34Å; W378-Y426 HydrophobicContact CZ3-CE1 4.06Å; W378-P434 HydrophobicContact CH2-CB 3.68Å; W378-P434 HydrophobicContact CH2-CG 4.38Å; W378-P434 HydrophobicContact CZ2-CB 3.98Å; W378-F435 AromaticContact CD2-CD1 3.95Å; W378-F435 HydrophobicContact CD2-CD1 3.95Å; W378-F435 AromaticContact CD2-CE1 3.67Å; W378-F435 HydrophobicContact CD2-CE1 3.67Å; W378-F435 AromaticContact CE2-CD1 3.61Å; W378-F435 AromaticContact CE2-CE1 3.79Å; W378-F435 HydrophobicContact CE3-CD1 4.48Å; W378-F435 AromaticContact CE3-CE1 3.83Å; W378-F435 HydrophobicContact CE3-CE1 3.83Å; W378-F435 HydrophobicContact CG-CD1 4.32Å; W378-F435 HydrophobicContact CG-CE1 4.17Å; W378-F435 HydrophobicContact CH2-CD1 4.47Å; W378-F435 HydrophobicContact CH2-CE1 4.26Å; W378-F435 AromaticContact CZ2-CD1 3.9Å; W378-F435 HydrophobicContact CZ2-CD1 3.9Å; W378-F435 HydrophobicContact CZ2-CE1 4.09Å; W378-F435 HydrophobicContact CZ3-CE1 4.12Å; W378-F435 AromaticContact NE1-CD1 3.77Å
379	L	94.4	Very high	78.4	Confident	21 Å²	21	67.5 Å²	67.5	11%	0.11	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	147	167.7	-53.6	94.4	0	0	0	108.8	T387 Q388 T390 I412 R413 Q415 F420	L379-T387 HydrophobicContact CB-CG2 3.95Å; L379-T387 HydrophobicContact CD2-CG2 3.45Å; L379-T387 VanDerWaalsContact CD2-CG2 3.45Å; L379-T387 HydrophobicContact CG-CG2 4.32Å; L379-Q388 CarbonylContact C-O 3.52Å; L379-Q388 VanDerWaalsContact CA-O 3.3Å; L379-Q388 WeakPolarHBondContact CA-O 3.41Å; L379-T390 HydrophobicContact CD1-CG2 3.64Å; L379-T390 HydrophobicContact CD2-CG2 3.98Å; L379-T390 HydrophobicContact CG-CG2 3.54Å; L379-I412 CarbonylContact O-C 3.59Å; L379-I412 VanDerWaalsContact O-CA 3.28Å; L379-I412 WeakPolarHBondContact O-CA 3.49Å; L379-R413 HydrophobicContact CB-CG 4.35Å; L379-R413 HydrophobicContact CD1-CG 4.25Å; L379-R413 PolarHBondContact N-O 3.48Å; L379-R413 PolarHBondContact O-N 3.09Å; L379-Q415 HydrophobicContact CD1-CB 4.19Å; L379-F420 HydrophobicContact CB-CE1 3.95Å; L379-F420 HydrophobicContact CB-CZ 4.14Å
380	Y	94.9	Very high	81.3	Confident	49 Å²	49	67.4 Å²	67.4	19%	0.192	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	158.2	168.8	71.2	-97.4	0	0	0	110.9	D382 T387 Q388 F391 M396 W399 F406 L410 R411	Y380-D382 HydrophobicContact CE2-CB 4.21Å; Y380-T387 CarbonylContact O-C 3.51Å; Y380-T387 WeakPolarHBondContact O-CA 3.08Å; Y380-Q388 HydrophobicContact CD1-CB 4.14Å; Y380-Q388 HydrophobicContact CD2-CB 4.11Å; Y380-Q388 HydrophobicContact CD2-CG 4.29Å; Y380-Q388 HydrophobicContact CE1-CB 3.75Å; Y380-Q388 HydrophobicContact CE2-CB 3.71Å; Y380-Q388 HydrophobicContact CE2-CG 3.65Å; Y380-Q388 HydrophobicContact CG-CB 4.31Å; Y380-Q388 PolarHBondContact N-O 2.83Å; Y380-Q388 PolarHBondContact O-N 3.35Å; Y380-F391 HydrophobicContact CD1-CD2 4.03Å; Y380-F391 AromaticContact CD1-CE2 3.81Å; Y380-F391 HydrophobicContact CD1-CE2 3.81Å; Y380-F391 AromaticContact CE1-CD2 3.96Å; Y380-F391 HydrophobicContact CE1-CD2 3.96Å; Y380-F391 AromaticContact CE1-CE2 3.42Å; Y380-F391 HydrophobicContact CE1-CE2 3.42Å; Y380-F391 VanDerWaalsContact CE1-CE2 3.42Å; Y380-F391 HydrophobicContact CE1-CZ 4.29Å; Y380-M396 HydrophobicContact CD1-CE 4.42Å; Y380-M396 HydrophobicContact CD1-SD 4.32Å; Y380-W399 HydrophobicContact CD1-CZ3 4.48Å; Y380-W399 HydrophobicContact CE1-CE3 4.34Å; Y380-W399 AromaticContact CE1-CZ3 3.8Å; Y380-W399 HydrophobicContact CE1-CZ3 3.8Å; Y380-F406 HydrophobicContact CD1-CE1 4.47Å; Y380-F406 HydrophobicContact CD1-CZ 4.42Å; Y380-L410 HydrophobicContact CD2-CD1 4.04Å; Y380-R411 CarbonylContact C-O 3.56Å; Y380-R411 VanDerWaalsContact CA-O 3.31Å; Y380-R411 WeakPolarHBondContact CA-O 3.46Å
381	E	94.5	Very high	84	Confident	39 Å²	39	64 Å²	64	18%	0.182	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	127.1	167.6	-66.3	175.7	170.5	0	0	109.3	R386 L410 R411 F420	E381-R386 WeakPolarHBondContact CA-O 3.45Å; E381-L410 WeakPolarHBondContact O-CD1 3.45Å; E381-R411 HydrophobicContact CB-CB 4.25Å; E381-R411 HydrophobicContact CG-CB 4.38Å; E381-R411 PolarHBondContact N-O 3.22Å; E381-R411 IonicContact OE1-CZ 3.55Å; E381-R411 IonicContact OE1-NH1 3.2Å; E381-R411 PolarHBondContact OE1-NH1 3.48Å; E381-R411 WeakPolarHBondContact OE2-CB 3.32Å; E381-R411 WeakPolarHBondContact OE2-CD 3.46Å; E381-R411 IonicContact OE2-CZ 3.71Å; E381-R411 IonicContact OE2-NE 2.74Å; E381-R411 IonicContact OE2-NH1 2.98Å; E381-R411 PolarHBondContact OE2-NH1 3.34Å; E381-F420 HydrophobicContact CG-CD1 3.9Å; E381-F420 HydrophobicContact CG-CD2 4.2Å; E381-F420 HydrophobicContact CG-CE1 3.91Å; E381-F420 HydrophobicContact CG-CE2 4.2Å; E381-F420 HydrophobicContact CG-CG 4.06Å; E381-F420 HydrophobicContact CG-CZ 4.07Å; E381-F420 WeakPolarHBondContact OE1-CD2 3.34Å; E381-F420 WeakPolarHBondContact OE1-CG 3.48Å
382	D	91.5	Very high	86.5	Confident	14 Å²	14	58.2 Å²	58.2	8%	0.075	32%	0.318	C	S	.	.			trans	-72.5	169.1	172.8	69.9	17.7	0	0	0	111.8	Y380 Q384 G385 R386 Q388	Y380-D382 HydrophobicContact CE2-CB 4.21Å; D382-Q384 PolarHBondContact O-N 3.13Å; D382-Q384 VanDerWaalsContact OD1-C 3.31Å; D382-Q384 VanDerWaalsContact OD1-CA 3.31Å; D382-Q384 WeakPolarHBondContact OD1-CA 3.49Å; D382-Q384 WeakPolarHBondContact OD1-CB 3.46Å; D382-Q384 PolarHBondContact OD1-N 2.72Å; D382-Q384 PolarHBondContact OD1-OE1 3.31Å; D382-Q384 PolarHBondContact OD2-OE1 3.44Å; D382-G385 PolarHBondContact O-N 3.4Å; D382-G385 PolarHBondContact OD1-N 3.32Å; D382-R386 PolarHBondContact N-O 2.97Å; D382-R386 WeakPolarHBondContact OD1-CB 3.35Å; D382-R386 PolarHBondContact OD1-N 2.71Å; D382-R386 IonicContact OD1-NE 3.73Å; D382-R386 IonicContact OD2-CZ 2.7Å; D382-R386 IonicContact OD2-NE 3.87Å; D382-R386 PolarHBondContact OD2-NE 3.05Å; D382-R386 IonicContact OD2-NH2 2.73Å; D382-R386 PolarHBondContact OD2-NH2 3.32Å; D382-Q388 HydrophobicContact CB-CG 4.07Å; D382-Q388 PolarHBondContact OD2-NE2 3.39Å
383	P	86.7	Confident	88.5	Confident	127 Å²	127	54.7 Å²	54.7	83%	0.825	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-7.4	177.5	-25.2	36.3	0	0	0	115
384	Q	87.9	Confident	89.8	Confident	127 Å²	127	56.5 Å²	56.5	59%	0.593	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	6.4	172.3	-58.5	78.9	28	0	0	112.3	D382 R386	D382-Q384 PolarHBondContact O-N 3.13Å; D382-Q384 VanDerWaalsContact OD1-C 3.31Å; D382-Q384 VanDerWaalsContact OD1-CA 3.31Å; D382-Q384 WeakPolarHBondContact OD1-CA 3.49Å; D382-Q384 WeakPolarHBondContact OD1-CB 3.46Å; D382-Q384 PolarHBondContact OD1-N 2.72Å; D382-Q384 PolarHBondContact OD1-OE1 3.31Å; D382-Q384 PolarHBondContact OD2-OE1 3.44Å; Q384-R386 VanDerWaalsContact C-N 3.29Å; Q384-R386 HydrophobicContact CB-CG 4.36Å; Q384-R386 PolarHBondContact O-N 3.06Å
385	G	88.3	Confident	90.5	Very high	51 Å²	51	56.6 Å²	56.6	53%	0.526	32%	0.318	S	S	.	.	S	Bend	trans	75.3	11.8	179.8	0	0	0	0	0	114.3	D382	D382-G385 PolarHBondContact O-N 3.4Å; D382-G385 PolarHBondContact OD1-N 3.32Å
386	R	91.1	Very high	91.3	Very high	142 Å²	142	53.5 Å²	53.5	54%	0.536	30%	0.303	S	S	.	.			trans	-91	131.7	-178.6	-53	173.5	-62.1	-172.9	0.4	109.7	E381 D382 Q384 Q388	E381-R386 WeakPolarHBondContact CA-O 3.45Å; D382-R386 PolarHBondContact N-O 2.97Å; D382-R386 WeakPolarHBondContact OD1-CB 3.35Å; D382-R386 PolarHBondContact OD1-N 2.71Å; D382-R386 IonicContact OD1-NE 3.73Å; D382-R386 IonicContact OD2-CZ 2.7Å; D382-R386 IonicContact OD2-NE 3.87Å; D382-R386 PolarHBondContact OD2-NE 3.05Å; D382-R386 IonicContact OD2-NH2 2.73Å; D382-R386 PolarHBondContact OD2-NH2 3.32Å; Q384-R386 VanDerWaalsContact C-N 3.29Å; Q384-R386 HydrophobicContact CB-CG 4.36Å; Q384-R386 PolarHBondContact O-N 3.06Å; R386-Q388 PolarHBondContact O-N 2.89Å
387	T	93.8	Very high	91.7	Very high	68 Å²	68	52.5 Å²	52.5	42%	0.417	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	121.3	170.7	-60.7	0	0	0	0	111	L379 Y380 F420	L379-T387 HydrophobicContact CB-CG2 3.95Å; L379-T387 HydrophobicContact CD2-CG2 3.45Å; L379-T387 VanDerWaalsContact CD2-CG2 3.45Å; L379-T387 HydrophobicContact CG-CG2 4.32Å; Y380-T387 CarbonylContact O-C 3.51Å; Y380-T387 WeakPolarHBondContact O-CA 3.08Å; T387-F420 HydrophobicContact CG2-CZ 3.72Å; T387-F420 WeakPolarHBondContact OG1-CZ 3.44Å
388	Q	93	Very high	91.8	Very high	61 Å²	61	57.3 Å²	57.3	29%	0.285	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	131.5	170.4	-55.9	-61.8	-16.8	0	0	108.7	L379 Y380 D382 R386 F391	L379-Q388 CarbonylContact C-O 3.52Å; L379-Q388 VanDerWaalsContact CA-O 3.3Å; L379-Q388 WeakPolarHBondContact CA-O 3.41Å; Y380-Q388 HydrophobicContact CD1-CB 4.14Å; Y380-Q388 HydrophobicContact CD2-CB 4.11Å; Y380-Q388 HydrophobicContact CD2-CG 4.29Å; Y380-Q388 HydrophobicContact CE1-CB 3.75Å; Y380-Q388 HydrophobicContact CE2-CB 3.71Å; Y380-Q388 HydrophobicContact CE2-CG 3.65Å; Y380-Q388 HydrophobicContact CG-CB 4.31Å; Y380-Q388 PolarHBondContact N-O 2.83Å; Y380-Q388 PolarHBondContact O-N 3.35Å; D382-Q388 HydrophobicContact CB-CG 4.07Å; D382-Q388 PolarHBondContact OD2-NE2 3.39Å; R386-Q388 PolarHBondContact O-N 2.89Å; Q388-F391 HydrophobicContact CB-CE2 4.03Å; Q388-F391 HydrophobicContact CB-CZ 4.39Å
389	G	88.6	Confident	91.7	Very high	45 Å²	45	60.4 Å²	60.4	46%	0.464	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	166	174.6	-179.4	0	0	0	0	0	114.2	F391	G389-F391 VanDerWaalsContact CA-CE2 3.48Å
390	T	92.1	Very high	91.5	Very high	54 Å²	54	61.3 Å²	61.3	33%	0.331	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	cis	-98.8	146.2	-0.6	41.5	0	0	0	0	113.4	M377 W378 L379 Q415	M377-T390 HydrophobicContact CB-CG2 4.42Å; M377-T390 WeakPolarHBondContact CE-OG1 3.41Å; W378-T390 CarbonylContact O-C 3.5Å; W378-T390 VanDerWaalsContact O-CA 3.26Å; W378-T390 WeakPolarHBondContact O-CA 3.2Å; L379-T390 HydrophobicContact CD1-CG2 3.64Å; L379-T390 HydrophobicContact CD2-CG2 3.98Å; L379-T390 HydrophobicContact CG-CG2 3.54Å; T390-Q415 HydrophobicContact CG2-CB 4.35Å
391	F	93.7	Very high	91.1	Very high	40 Å²	40	66 Å²	66	18%	0.175	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	146.7	-176	-51.5	-63.6	0	0	0	111	M377 W378 Y380 Q388 G389 Q395 M396 W399	M377-F391 CarbonylContact C-O 3.57Å; M377-F391 WeakPolarHBondContact CA-O 3.23Å; W378-F391 PolarHBondContact N-O 2.8Å; W378-F391 PolarHBondContact O-N 3.05Å; Y380-F391 HydrophobicContact CD1-CD2 4.03Å; Y380-F391 AromaticContact CD1-CE2 3.81Å; Y380-F391 HydrophobicContact CD1-CE2 3.81Å; Y380-F391 AromaticContact CE1-CD2 3.96Å; Y380-F391 HydrophobicContact CE1-CD2 3.96Å; Y380-F391 AromaticContact CE1-CE2 3.42Å; Y380-F391 HydrophobicContact CE1-CE2 3.42Å; Y380-F391 VanDerWaalsContact CE1-CE2 3.42Å; Y380-F391 HydrophobicContact CE1-CZ 4.29Å; Q388-F391 HydrophobicContact CB-CE2 4.03Å; Q388-F391 HydrophobicContact CB-CZ 4.39Å; G389-F391 VanDerWaalsContact CA-CE2 3.48Å; F391-Q395 HydrophobicContact CB-CB 4.25Å; F391-M396 HydrophobicContact CB-CG 4.14Å; F391-M396 HydrophobicContact CB-SD 3.96Å; F391-M396 HydrophobicContact CD2-SD 4.07Å; F391-M396 HydrophobicContact CG-SD 4.44Å; F391-W399 HydrophobicContact CB-CZ3 4.2Å; F391-W399 AromaticContact CD1-CH2 3.59Å; F391-W399 HydrophobicContact CD1-CH2 3.59Å; F391-W399 AromaticContact CD1-CZ3 4Å; F391-W399 HydrophobicContact CD1-CZ3 4Å; F391-W399 AromaticContact CD2-CH2 3.98Å; F391-W399 HydrophobicContact CD2-CH2 3.98Å; F391-W399 AromaticContact CD2-CZ3 3.57Å; F391-W399 HydrophobicContact CD2-CZ3 3.57Å; F391-W399 AromaticContact CE1-CH2 3.67Å; F391-W399 HydrophobicContact CE1-CH2 3.67Å; F391-W399 HydrophobicContact CE1-CZ3 4.27Å; F391-W399 HydrophobicContact CE2-CH2 4.03Å; F391-W399 AromaticContact CE2-CZ3 3.85Å; F391-W399 HydrophobicContact CE2-CZ3 3.85Å; F391-W399 AromaticContact CG-CH2 3.75Å; F391-W399 HydrophobicContact CG-CH2 3.75Å; F391-W399 AromaticContact CG-CZ3 3.64Å; F391-W399 HydrophobicContact CG-CZ3 3.64Å; F391-W399 AromaticContact CZ-CH2 3.88Å; F391-W399 HydrophobicContact CZ-CH2 3.88Å; F391-W399 HydrophobicContact CZ-CZ3 4.2Å
392	S	93.3	Very high	90.9	Very high	21 Å²	21	66.4 Å²	66.4	15%	0.147	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	159.9	179.7	69.4	0	0	0	0	112.7	H376 A394 Q395 M396	H376-S392 WeakPolarHBondContact O-CA 3.41Å; S392-A394 PolarHBondContact O-N 3.13Å; S392-A394 VanDerWaalsContact O-N 3.15Å; S392-Q395 PolarHBondContact O-N 2.98Å; S392-M396 PolarHBondContact O-N 3.09Å
393	D	91.7	Very high	90.5	Very high	32 Å²	32	68 Å²	68	17%	0.171	39%	0.394	C	S	.	.	H	α-helix	trans	-40	-48.9	167.9	-79.8	-28.7	0	0	0	112.4	H376 W378 Q395 M396 N397	H376-D393 IonicContact CE1-OD2 2.68Å; H376-D393 IonicContact CG-OD2 3.55Å; H376-D393 IonicContact ND1-OD2 3.96Å; H376-D393 PolarHBondContact ND1-OD2 2.7Å; H376-D393 PolarHBondContact O-N 3.27Å; H376-D393 VanDerWaalsContact O-N 3.14Å; W378-D393 PolarHBondContact NE1-OD1 2.62Å; D393-Q395 PolarHBondContact O-N 3.27Å; D393-M396 PolarHBondContact O-N 3.12Å; D393-N397 VanDerWaalsContact O-CB 3.25Å; D393-N397 WeakPolarHBondContact O-CB 3.48Å; D393-N397 PolarHBondContact O-N 3.02Å
394	A	91.4	Very high	90.1	Very high	68 Å²	68	64.6 Å²	64.6	56%	0.562	37%	0.368	S	S	*	.	H	α-helix	trans	-61.5	-41.6	-178.5	0	0	0	0	0	113	S392 E398	S392-A394 PolarHBondContact O-N 3.13Å; S392-A394 VanDerWaalsContact O-N 3.15Å; A394-E398 WeakPolarHBondContact O-CB 3.25Å; A394-E398 PolarHBondContact O-N 3.06Å
395	Q	92.1	Very high	89.7	Confident	78 Å²	78	62.8 Å²	62.8	36%	0.364	36%	0.356	S	S	.	.	H	α-helix	trans	-70.1	-43.3	179.4	-65.4	175.5	-64.3	0	0	111.6	F391 S392 D393 N397 E398 W399	F391-Q395 HydrophobicContact CB-CB 4.25Å; S392-Q395 PolarHBondContact O-N 2.98Å; D393-Q395 PolarHBondContact O-N 3.27Å; Q395-N397 VanDerWaalsContact C-N 3.31Å; Q395-N397 PolarHBondContact O-N 3.34Å; Q395-E398 PolarHBondContact O-N 2.86Å; Q395-W399 PolarHBondContact O-N 3.05Å
396	M	92.5	Very high	89.7	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-65	-37.8	176.8	-63.3	-67.6	-71.8	0	0	111.4	W378 Y380 F391 S392 D393 W399 L400 F406 I412 F435	W378-M396 HydrophobicContact CB-CE 3.86Å; W378-M396 HydrophobicContact CB-CG 3.65Å; W378-M396 HydrophobicContact CB-SD 3.93Å; W378-M396 HydrophobicContact CG-CE 4.4Å; W378-M396 HydrophobicContact CG-CG 3.88Å; Y380-M396 HydrophobicContact CD1-CE 4.42Å; Y380-M396 HydrophobicContact CD1-SD 4.32Å; F391-M396 HydrophobicContact CB-CG 4.14Å; F391-M396 HydrophobicContact CB-SD 3.96Å; F391-M396 HydrophobicContact CD2-SD 4.07Å; F391-M396 HydrophobicContact CG-SD 4.44Å; S392-M396 PolarHBondContact O-N 3.09Å; D393-M396 PolarHBondContact O-N 3.12Å; M396-W399 HydrophobicContact SD-CE3 4.17Å; M396-W399 HydrophobicContact SD-CZ3 4.19Å; M396-L400 WeakPolarHBondContact O-CB 3.5Å; M396-L400 PolarHBondContact O-N 2.74Å; M396-F406 HydrophobicContact CB-CE2 4.3Å; M396-F406 HydrophobicContact CE-CE2 3.68Å; M396-F406 HydrophobicContact CE-CZ 3.58Å; M396-F406 WeakPolarHBondContact O-CE2 3.44Å; M396-F406 HydrophobicContact SD-CE2 4.17Å; M396-F406 HydrophobicContact SD-CZ 3.75Å; M396-I412 HydrophobicContact CE-CG2 4.17Å; M396-F435 HydrophobicContact CB-CB 4.25Å; M396-F435 HydrophobicContact CB-CD1 3.42Å; M396-F435 VanDerWaalsContact CB-CD1 3.42Å; M396-F435 HydrophobicContact CB-CD2 3.84Å; M396-F435 HydrophobicContact CB-CE1 3.6Å; M396-F435 HydrophobicContact CB-CE2 3.99Å; M396-F435 HydrophobicContact CB-CG 3.56Å; M396-F435 HydrophobicContact CB-CZ 3.88Å; M396-F435 HydrophobicContact CE-CE1 3.75Å; M396-F435 HydrophobicContact CE-CZ 3.7Å; M396-F435 HydrophobicContact CG-CD1 4.17Å; M396-F435 HydrophobicContact CG-CE1 4.1Å
397	N	92.3	Very high	89.6	Confident	35 Å²	35	56.8 Å²	56.8	19%	0.187	32%	0.324	C	S	.	.	H	α-helix	trans	-67.4	-42.1	174.4	-165.4	59.2	0	0	0	111.9	D393 Q395 W399 L400 M401 F435	D393-N397 VanDerWaalsContact O-CB 3.25Å; D393-N397 WeakPolarHBondContact O-CB 3.48Å; D393-N397 PolarHBondContact O-N 3.02Å; Q395-N397 VanDerWaalsContact C-N 3.31Å; Q395-N397 PolarHBondContact O-N 3.34Å; N397-W399 PolarHBondContact O-N 3.13Å; N397-L400 PolarHBondContact O-N 3.47Å; N397-M401 PolarHBondContact ND2-SD 3.27Å; N397-M401 VanDerWaalsContact ND2-SD 3.36Å; N397-M401 WeakPolarHBondContact O-CB 3.38Å; N397-M401 VanDerWaalsContact O-CG 3.3Å; N397-M401 WeakPolarHBondContact O-CG 3.38Å; N397-M401 PolarHBondContact O-N 3.25Å; N397-F435 HydrophobicContact CB-CB 3.74Å
398	E	91.3	Very high	89.3	Confident	130 Å²	130	57.3 Å²	57.3	61%	0.607	33%	0.328	S	S	*	.	H	α-helix	trans	-58.9	-46.3	175.3	-174.2	-179.3	171.3	0	0	111.5	A394 Q395 L400 M401 A402	A394-E398 WeakPolarHBondContact O-CB 3.25Å; A394-E398 PolarHBondContact O-N 3.06Å; Q395-E398 PolarHBondContact O-N 2.86Å; E398-L400 PolarHBondContact O-N 3.14Å; E398-M401 PolarHBondContact O-N 3Å; E398-A402 WeakPolarHBondContact O-CB 3.43Å; E398-A402 PolarHBondContact O-N 3.45Å
399	W	90.7	Very high	89.2	Confident	67 Å²	67	60.3 Å²	60.3	25%	0.254	35%	0.346	S	S	.	.	H	α-helix	trans	-68.8	-30.9	177.9	-64	-21	0	0	0	113.8	Y380 F391 Q395 M396 N397 F406	Y380-W399 HydrophobicContact CD1-CZ3 4.48Å; Y380-W399 HydrophobicContact CE1-CE3 4.34Å; Y380-W399 AromaticContact CE1-CZ3 3.8Å; Y380-W399 HydrophobicContact CE1-CZ3 3.8Å; F391-W399 HydrophobicContact CB-CZ3 4.2Å; F391-W399 AromaticContact CD1-CH2 3.59Å; F391-W399 HydrophobicContact CD1-CH2 3.59Å; F391-W399 AromaticContact CD1-CZ3 4Å; F391-W399 HydrophobicContact CD1-CZ3 4Å; F391-W399 AromaticContact CD2-CH2 3.98Å; F391-W399 HydrophobicContact CD2-CH2 3.98Å; F391-W399 AromaticContact CD2-CZ3 3.57Å; F391-W399 HydrophobicContact CD2-CZ3 3.57Å; F391-W399 AromaticContact CE1-CH2 3.67Å; F391-W399 HydrophobicContact CE1-CH2 3.67Å; F391-W399 HydrophobicContact CE1-CZ3 4.27Å; F391-W399 HydrophobicContact CE2-CH2 4.03Å; F391-W399 AromaticContact CE2-CZ3 3.85Å; F391-W399 HydrophobicContact CE2-CZ3 3.85Å; F391-W399 AromaticContact CG-CH2 3.75Å; F391-W399 HydrophobicContact CG-CH2 3.75Å; F391-W399 AromaticContact CG-CZ3 3.64Å; F391-W399 HydrophobicContact CG-CZ3 3.64Å; F391-W399 AromaticContact CZ-CH2 3.88Å; F391-W399 HydrophobicContact CZ-CH2 3.88Å; F391-W399 HydrophobicContact CZ-CZ3 4.2Å; Q395-W399 PolarHBondContact O-N 3.05Å; M396-W399 HydrophobicContact SD-CE3 4.17Å; M396-W399 HydrophobicContact SD-CZ3 4.19Å; N397-W399 PolarHBondContact O-N 3.13Å; W399-F406 HydrophobicContact CB-CD1 4.15Å; W399-F406 HydrophobicContact CB-CD2 4.49Å; W399-F406 HydrophobicContact CB-CE1 3.88Å; W399-F406 HydrophobicContact CB-CE2 4.23Å; W399-F406 HydrophobicContact CB-CG 4.47Å; W399-F406 HydrophobicContact CB-CZ 3.94Å; W399-F406 AromaticContact CE3-CE1 3.99Å; W399-F406 HydrophobicContact CE3-CE1 3.99Å; W399-F406 AromaticContact CE3-CZ 3.76Å; W399-F406 HydrophobicContact CE3-CZ 3.76Å
400	L	90.9	Very high	89.4	Confident	39 Å²	39	59 Å²	59	20%	0.204	33%	0.328	C	S	.	.	H	α-helix	trans	-68.5	-48.5	170.4	-176.8	57.1	0	0	0	111.7	M396 N397 E398 A402 G403 F406 L423 V433 F435	M396-L400 WeakPolarHBondContact O-CB 3.5Å; M396-L400 PolarHBondContact O-N 2.74Å; N397-L400 PolarHBondContact O-N 3.47Å; E398-L400 PolarHBondContact O-N 3.14Å; L400-A402 VanDerWaalsContact C-N 3.26Å; L400-A402 PolarHBondContact O-N 3.08Å; L400-G403 WeakPolarHBondContact O-CA 3.36Å; L400-G403 PolarHBondContact O-N 3.32Å; L400-F406 HydrophobicContact CB-CD2 3.89Å; L400-F406 HydrophobicContact CD1-CB 3.91Å; L400-F406 HydrophobicContact CD1-CD2 4.34Å; L400-L423 HydrophobicContact CD1-CD2 3.75Å; L400-V433 HydrophobicContact CD2-CB 4.43Å; L400-V433 HydrophobicContact CD2-CG1 3.55Å; L400-V433 HydrophobicContact CD2-CG2 4.01Å; L400-F435 HydrophobicContact CB-CD2 4.31Å; L400-F435 HydrophobicContact CB-CE2 4.29Å; L400-F435 HydrophobicContact CD2-CD2 3.95Å; L400-F435 HydrophobicContact CD2-CE2 3.99Å
401	M	86.9	Confident	89.5	Confident	148 Å²	148	60.5 Å²	60.5	73%	0.729	33%	0.328	S	S	*	.	H	α-helix	trans	-64.6	-29.2	179	-72.8	-176.6	69.9	0	0	112.6	N397 E398 G403	N397-M401 PolarHBondContact ND2-SD 3.27Å; N397-M401 VanDerWaalsContact ND2-SD 3.36Å; N397-M401 WeakPolarHBondContact O-CB 3.38Å; N397-M401 VanDerWaalsContact O-CG 3.3Å; N397-M401 WeakPolarHBondContact O-CG 3.38Å; N397-M401 PolarHBondContact O-N 3.25Å; E398-M401 PolarHBondContact O-N 3Å; M401-G403 PolarHBondContact O-N 3.4Å
402	A	88.4	Confident	89.5	Confident	48 Å²	48	58.6 Å²	58.6	40%	0.397	32%	0.32	S	S	.	.	H	α-helix	trans	-63.4	-26.4	170.9	0	0	0	0	0	112.6	E398 L400 I404	E398-A402 WeakPolarHBondContact O-CB 3.43Å; E398-A402 PolarHBondContact O-N 3.45Å; L400-A402 VanDerWaalsContact C-N 3.26Å; L400-A402 PolarHBondContact O-N 3.08Å; A402-I404 HydrophobicContact CB-CD1 4.14Å; A402-I404 WeakPolarHBondContact O-CG1 3.45Å; A402-I404 PolarHBondContact O-N 2.91Å
403	G	83.3	Confident	89.5	Confident	48 Å²	48	60.2 Å²	60.2	50%	0.495	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	10.1	172.8	0	0	0	0	0	115.7	L400 M401	L400-G403 WeakPolarHBondContact O-CA 3.36Å; L400-G403 PolarHBondContact O-N 3.32Å; M401-G403 PolarHBondContact O-N 3.4Å
404	I	79.9	Confident	89.5	Confident	54 Å²	54	59 Å²	59	28%	0.277	32%	0.315	S	S	.	.	S	Bend	trans	-91.2	-65.5	-171.7	-63.8	155.6	0	0	0	111.1	A402 P1019	A402-I404 HydrophobicContact CB-CD1 4.14Å; A402-I404 WeakPolarHBondContact O-CG1 3.45Å; A402-I404 PolarHBondContact O-N 2.91Å; I404-P1019 HydrophobicContact CB-CG 4.31Å; I404-P1019 HydrophobicContact CD1-CG 3.61Å; I404-P1019 HydrophobicContact CG1-CG 3.85Å; I404-P1019 HydrophobicContact CG2-CG 3.46Å; I404-P1019 VanDerWaalsContact CG2-CG 3.46Å
405	Y	77.8	Confident	89.4	Confident	89 Å²	89	59.2 Å²	59.2	35%	0.349	31%	0.305	S	S	.	.	S	Bend	trans	-91.9	-31.3	-167.7	-62.1	-71.4	0	0	0	113.1	T407 A1018 Y1020	Y405-T407 PolarHBondContact O-N 3.48Å; Y405-A1018 HydrophobicContact CE1-CB 3.89Å; Y405-Y1020 AromaticContact CE2-CD2 3.94Å; Y405-Y1020 HydrophobicContact CE2-CD2 3.94Å; Y405-Y1020 AromaticContact CE2-CE2 3.51Å; Y405-Y1020 HydrophobicContact CE2-CE2 3.51Å; Y405-Y1020 AromaticContact CZ-CD2 3.66Å; Y405-Y1020 AromaticContact CZ-CE2 3.76Å; Y405-Y1020 WeakPolarHBondContact OH-CD2 3.42Å; Y405-Y1020 WeakPolarHBondContact OH-CE2 3.45Å
406	F	88.5	Confident	89.2	Confident	19 Å²	19	57.1 Å²	57.1	8%	0.083	30%	0.298	C	S	.	.			trans	-84.8	100.9	-173	-80.9	26.2	0	0	0	110.3	Y380 M396 W399 L400 L410 L423 F435	Y380-F406 HydrophobicContact CD1-CE1 4.47Å; Y380-F406 HydrophobicContact CD1-CZ 4.42Å; M396-F406 HydrophobicContact CB-CE2 4.3Å; M396-F406 HydrophobicContact CE-CE2 3.68Å; M396-F406 HydrophobicContact CE-CZ 3.58Å; M396-F406 WeakPolarHBondContact O-CE2 3.44Å; M396-F406 HydrophobicContact SD-CE2 4.17Å; M396-F406 HydrophobicContact SD-CZ 3.75Å; W399-F406 HydrophobicContact CB-CD1 4.15Å; W399-F406 HydrophobicContact CB-CD2 4.49Å; W399-F406 HydrophobicContact CB-CE1 3.88Å; W399-F406 HydrophobicContact CB-CE2 4.23Å; W399-F406 HydrophobicContact CB-CG 4.47Å; W399-F406 HydrophobicContact CB-CZ 3.94Å; W399-F406 AromaticContact CE3-CE1 3.99Å; W399-F406 HydrophobicContact CE3-CE1 3.99Å; W399-F406 AromaticContact CE3-CZ 3.76Å; W399-F406 HydrophobicContact CE3-CZ 3.76Å; L400-F406 HydrophobicContact CB-CD2 3.89Å; L400-F406 HydrophobicContact CD1-CB 3.91Å; L400-F406 HydrophobicContact CD1-CD2 4.34Å; F406-L410 HydrophobicContact CB-CD2 4.25Å; F406-L410 HydrophobicContact CD1-CD2 3.49Å; F406-L410 VanDerWaalsContact CD1-CD2 3.49Å; F406-L410 HydrophobicContact CD2-CD2 3.92Å; F406-L410 HydrophobicContact CE1-CD2 3.63Å; F406-L410 HydrophobicContact CE2-CD2 4.08Å; F406-L410 HydrophobicContact CG-CD2 3.62Å; F406-L410 HydrophobicContact CZ-CD2 3.91Å; F406-L423 HydrophobicContact CB-CD2 4.33Å; F406-F435 HydrophobicContact CD2-CE2 4.06Å; F406-F435 AromaticContact CE2-CE2 3.85Å; F406-F435 HydrophobicContact CE2-CE2 3.85Å; F406-F435 HydrophobicContact CE2-CZ 4.02Å
407	T	88.8	Confident	89	Confident	49 Å²	49	57.1 Å²	57.1	30%	0.301	30%	0.299	S	S	.	.			trans	-86.1	156	170.7	66.6	0	0	0	0	110.3	Y405 N409 L410	Y405-T407 PolarHBondContact O-N 3.48Å; T407-N409 PolarHBondContact O-N 2.85Å; T407-N409 VanDerWaalsContact O-N 3.11Å; T407-L410 WeakPolarHBondContact O-CB 3.32Å; T407-L410 PolarHBondContact O-N 2.82Å; T407-L410 PolarHBondContact OG1-N 3.28Å
408	P	88.6	Confident	88.8	Confident	79 Å²	79	60.4 Å²	60.4	51%	0.513	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-25.5	172	21.9	-33.7	0	0	0	113.1	L423 A424	P408-L423 PolarHBondContact O-N 3.47Å; P408-A424 HydrophobicContact CB-CB 4.03Å; P408-A424 VanDerWaalsContact O-CB 3.3Å; P408-A424 WeakPolarHBondContact O-CB 3.44Å; P408-A424 PolarHBondContact O-N 3.15Å
409	N	90.8	Very high	88.8	Confident	123 Å²	123	56.2 Å²	56.2	66%	0.658	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-5	179.1	-61.6	-18.6	0	0	0	113.5	T407 R411	T407-N409 PolarHBondContact O-N 2.85Å; T407-N409 VanDerWaalsContact O-N 3.11Å; N409-R411 PolarHBondContact O-N 2.74Å
410	L	92.7	Very high	88.9	Confident	17 Å²	17	53.9 Å²	53.9	9%	0.089	29%	0.291	C	S	.	.			trans	-57.2	120.2	178	-177.9	71.9	0	0	0	109.8	Y380 E381 F406 T407 I412 T422 L423	Y380-L410 HydrophobicContact CD2-CD1 4.04Å; E381-L410 WeakPolarHBondContact O-CD1 3.45Å; F406-L410 HydrophobicContact CB-CD2 4.25Å; F406-L410 HydrophobicContact CD1-CD2 3.49Å; F406-L410 VanDerWaalsContact CD1-CD2 3.49Å; F406-L410 HydrophobicContact CD2-CD2 3.92Å; F406-L410 HydrophobicContact CE1-CD2 3.63Å; F406-L410 HydrophobicContact CE2-CD2 4.08Å; F406-L410 HydrophobicContact CG-CD2 3.62Å; F406-L410 HydrophobicContact CZ-CD2 3.91Å; T407-L410 WeakPolarHBondContact O-CB 3.32Å; T407-L410 PolarHBondContact O-N 2.82Å; T407-L410 PolarHBondContact OG1-N 3.28Å; L410-I412 HydrophobicContact CD2-CG2 3.76Å; L410-I412 HydrophobicContact CG-CG2 3.84Å; L410-I412 PolarHBondContact O-N 2.83Å; L410-T422 CarbonylContact O-C 3.46Å; L410-T422 WeakPolarHBondContact O-CA 3.08Å; L410-L423 HydrophobicContact CB-CB 4.46Å; L410-L423 PolarHBondContact O-N 3.23Å
411	R	93.8	Very high	89	Confident	87 Å²	87	52.3 Å²	52.3	33%	0.328	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	120.3	175.3	-77.9	-175.8	82.3	-137.6	10.6	109.2	Y380 E381 N409 F420 S421 T422 E447	Y380-R411 CarbonylContact C-O 3.56Å; Y380-R411 VanDerWaalsContact CA-O 3.31Å; Y380-R411 WeakPolarHBondContact CA-O 3.46Å; E381-R411 HydrophobicContact CB-CB 4.25Å; E381-R411 HydrophobicContact CG-CB 4.38Å; E381-R411 PolarHBondContact N-O 3.22Å; E381-R411 IonicContact OE1-CZ 3.55Å; E381-R411 IonicContact OE1-NH1 3.2Å; E381-R411 PolarHBondContact OE1-NH1 3.48Å; E381-R411 WeakPolarHBondContact OE2-CB 3.32Å; E381-R411 WeakPolarHBondContact OE2-CD 3.46Å; E381-R411 IonicContact OE2-CZ 3.71Å; E381-R411 IonicContact OE2-NE 2.74Å; E381-R411 IonicContact OE2-NH1 2.98Å; E381-R411 PolarHBondContact OE2-NH1 3.34Å; N409-R411 PolarHBondContact O-N 2.74Å; R411-F420 HydrophobicContact CB-CB 4.15Å; R411-F420 PolarHBondContact NH2-O 3.01Å; R411-S421 WeakPolarHBondContact CA-O 3.3Å; R411-T422 HydrophobicContact CG-CG2 4.34Å; R411-E447 IonicContact CZ-OE1 2.87Å; R411-E447 IonicContact NH2-OE1 3.61Å; R411-E447 PolarHBondContact NH2-OE1 2.75Å
412	I	93.5	Very high	89.3	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	162.3	-178.9	67.8	177.4	0	0	0	110.3	W378 L379 M396 L410 F420 S421 L423 Y426 P434 F435	W378-I412 HydrophobicContact CE3-CB 4.42Å; W378-I412 HydrophobicContact CE3-CD1 4.13Å; W378-I412 HydrophobicContact CE3-CG1 4.38Å; W378-I412 HydrophobicContact CZ3-CD1 3.76Å; W378-I412 HydrophobicContact CZ3-CG1 4.12Å; L379-I412 CarbonylContact O-C 3.59Å; L379-I412 VanDerWaalsContact O-CA 3.28Å; L379-I412 WeakPolarHBondContact O-CA 3.49Å; M396-I412 HydrophobicContact CE-CG2 4.17Å; L410-I412 HydrophobicContact CD2-CG2 3.76Å; L410-I412 HydrophobicContact CG-CG2 3.84Å; L410-I412 PolarHBondContact O-N 2.83Å; I412-F420 WeakPolarHBondContact O-CA 3.46Å; I412-S421 PolarHBondContact N-O 3.45Å; I412-S421 PolarHBondContact O-N 2.9Å; I412-S421 VanDerWaalsContact O-O 3.04Å; I412-L423 HydrophobicContact CD1-CB 4.29Å; I412-L423 HydrophobicContact CD1-CD1 3.86Å; I412-Y426 HydrophobicContact CD1-CD2 3.75Å; I412-Y426 HydrophobicContact CD1-CE2 4.31Å; I412-Y426 HydrophobicContact CD1-CG 4.1Å; I412-Y426 HydrophobicContact CG1-CD2 3.43Å; I412-Y426 VanDerWaalsContact CG1-CD2 3.43Å; I412-Y426 HydrophobicContact CG1-CE2 3.63Å; I412-Y426 HydrophobicContact CG1-CG 4.26Å; I412-Y426 WeakPolarHBondContact O-CE2 3.35Å; I412-P434 HydrophobicContact CD1-CG 4.27Å; I412-F435 HydrophobicContact CD1-CE1 3.91Å; I412-F435 HydrophobicContact CD1-CZ 3.68Å
413	R	93.1	Very high	89.5	Confident	55 Å²	55	45.3 Å²	45.3	21%	0.208	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	160.1	163.6	69.1	-173.9	-179.9	98.2	0.5	110.9	W378 L379 D417 T419 F420 Y426	W378-R413 CarbonylContact C-O 3.56Å; W378-R413 WeakPolarHBondContact CA-O 3.31Å; L379-R413 HydrophobicContact CB-CG 4.35Å; L379-R413 HydrophobicContact CD1-CG 4.25Å; L379-R413 PolarHBondContact N-O 3.48Å; L379-R413 PolarHBondContact O-N 3.09Å; R413-D417 HydrophobicContact CB-CB 4.07Å; R413-D417 PolarHBondContact NH1-O 3.48Å; R413-T419 WeakPolarHBondContact CB-O 3.48Å; R413-F420 HydrophobicContact CB-CD1 4.11Å; R413-F420 HydrophobicContact CB-CE1 4.47Å; R413-F420 HydrophobicContact CB-CG 4.48Å; R413-F420 HydrophobicContact CG-CD1 3.73Å; R413-F420 HydrophobicContact CG-CE1 3.65Å; R413-F420 HydrophobicContact CG-CE2 4.46Å; R413-F420 HydrophobicContact CG-CG 4.18Å; R413-F420 HydrophobicContact CG-CZ 4.02Å; R413-F420 VanDerWaalsContact NE-CE2 3.26Å; R413-F420 VanDerWaalsContact NE-CZ 3.3Å; R413-Y426 WeakPolarHBondContact CA-OH 3.45Å
414	R	91.6	Very high	89.9	Confident	5 Å²	5	44.8 Å²	44.8	2%	0.019	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	161.8	165.1	-62.1	170.8	-64.1	160.2	4.4	110.5	E375 M377 W378 C416 D417 I441 P442	E375-R414 VanDerWaalsContact O-CD 3.24Å; E375-R414 WeakPolarHBondContact O-CD 3.35Å; M377-R414 CarbonylContact O-C 3.58Å; M377-R414 WeakPolarHBondContact O-CA 3.45Å; W378-R414 HydrophobicContact CD2-CG 3.66Å; W378-R414 HydrophobicContact CE3-CG 3.67Å; W378-R414 HydrophobicContact CG-CG 4.47Å; W378-R414 HydrophobicContact CH2-CG 3.51Å; W378-R414 HydrophobicContact CZ2-CG 3.51Å; W378-R414 HydrophobicContact CZ3-CG 3.6Å; R414-C416 PolarHBondContact O-N 3.03Å; R414-D417 HydrophobicContact CB-CB 4.41Å; R414-D417 WeakPolarHBondContact CB-OD2 3.3Å; R414-D417 IonicContact CZ-OD1 3.71Å; R414-D417 IonicContact CZ-OD2 3.67Å; R414-D417 PolarHBondContact N-OD2 3.21Å; R414-D417 IonicContact NE-OD1 3.59Å; R414-D417 PolarHBondContact NE-OD1 3.27Å; R414-D417 IonicContact NE-OD2 3.44Å; R414-D417 PolarHBondContact NE-OD2 3.41Å; R414-D417 IonicContact NH2-OD1 2.72Å; R414-D417 PolarHBondContact NH2-OD1 3.47Å; R414-D417 IonicContact NH2-OD2 3.46Å; R414-D417 PolarHBondContact NH2-OD2 2.94Å; R414-D417 PolarHBondContact O-N 2.82Å; R414-I441 PolarHBondContact NH1-O 2.73Å; R414-P442 PolarHBondContact NH2-O 3.06Å
415	Q	90.2	Very high	90.5	Very high	74 Å²	74	43.3 Å²	43.3	35%	0.346	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-25.9	174.6	-175	177.1	-41	0	0	111.4	D374 M377 L379 T390	D374-Q415 HydrophobicContact CB-CB 3.95Å; D374-Q415 HydrophobicContact CB-CG 4.02Å; D374-Q415 PolarHBondContact O-N 2.96Å; D374-Q415 PolarHBondContact OD1-NE2 2.85Å; D374-Q415 PolarHBondContact OD2-NE2 2.78Å; M377-Q415 HydrophobicContact CB-CB 4.04Å; M377-Q415 WeakPolarHBondContact O-CB 3.1Å; M377-Q415 PolarHBondContact O-N 3.14Å; L379-Q415 HydrophobicContact CD1-CB 4.19Å; T390-Q415 HydrophobicContact CG2-CB 4.35Å
416	C	87.5	Confident	91.1	Very high	33 Å²	33	39 Å²	39	22%	0.223	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-4.9	171.1	68.3	0	0	0	0	115.7	D374 R414 P443	D374-C416 HydrophobicContact CB-CB 4.26Å; D374-C416 PolarHBondContact O-N 3.22Å; R414-C416 PolarHBondContact O-N 3.03Å; C416-P443 HydrophobicContact CB-CG 4.46Å
417	D	89.6	Confident	91.1	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.005	22%	0.223	C	C	.	.			trans	-98.7	133.6	178	-66	-32.1	0	0	0	110.6	R413 R414 T419 Y426 I444	R413-D417 HydrophobicContact CB-CB 4.07Å; R413-D417 PolarHBondContact NH1-O 3.48Å; R414-D417 HydrophobicContact CB-CB 4.41Å; R414-D417 WeakPolarHBondContact CB-OD2 3.3Å; R414-D417 IonicContact CZ-OD1 3.71Å; R414-D417 IonicContact CZ-OD2 3.67Å; R414-D417 PolarHBondContact N-OD2 3.21Å; R414-D417 IonicContact NE-OD1 3.59Å; R414-D417 PolarHBondContact NE-OD1 3.27Å; R414-D417 IonicContact NE-OD2 3.44Å; R414-D417 PolarHBondContact NE-OD2 3.41Å; R414-D417 IonicContact NH2-OD1 2.72Å; R414-D417 PolarHBondContact NH2-OD1 3.47Å; R414-D417 IonicContact NH2-OD2 3.46Å; R414-D417 PolarHBondContact NH2-OD2 2.94Å; R414-D417 PolarHBondContact O-N 2.82Å; D417-T419 VanDerWaalsContact C-N 3.32Å; D417-T419 PolarHBondContact O-N 3.04Å; D417-Y426 PolarHBondContact OD2-OH 2.99Å; D417-I444 PolarHBondContact OD1-N 3.22Å
418	D	88	Confident	91.2	Very high	103 Å²	103	42.1 Å²	42.1	55%	0.551	23%	0.227	S	C	*	.	S	Bend	trans	-73.2	-20.5	-172.5	-69.8	-41.4	0	0	0	113.7	I444 R445	D418-I444 PolarHBondContact N-O 2.74Å; D418-R445 VanDerWaalsContact OD2-CG 3.31Å; D418-R445 WeakPolarHBondContact OD2-CG 3.05Å; D418-R445 IonicContact OD2-NE 2.79Å
419	T	90.5	Very high	91.1	Very high	42 Å²	42	39.1 Å²	39.1	26%	0.258	21%	0.206	S	C	.	.	S	Bend	trans	-145.3	144.5	-164.6	45.3	0	0	0	0	113.3	R413 D417 G446 E447	R413-T419 WeakPolarHBondContact CB-O 3.48Å; D417-T419 VanDerWaalsContact C-N 3.32Å; D417-T419 PolarHBondContact O-N 3.04Å; T419-G446 WeakPolarHBondContact OG1-CA 3.36Å; T419-G446 PolarHBondContact OG1-N 2.72Å; T419-G446 PolarHBondContact OG1-O 3.35Å; T419-E447 PolarHBondContact OG1-N 3.42Å
420	F	92.9	Very high	90.7	Very high	19 Å²	19	34.9 Å²	34.9	8%	0.083	18%	0.182	C	C	.	.			trans	-77.4	128	177.9	-70.7	-85.2	0	0	0	113	L379 E381 T387 R411 I412 R413 E447	L379-F420 HydrophobicContact CB-CE1 3.95Å; L379-F420 HydrophobicContact CB-CZ 4.14Å; E381-F420 HydrophobicContact CG-CD1 3.9Å; E381-F420 HydrophobicContact CG-CD2 4.2Å; E381-F420 HydrophobicContact CG-CE1 3.91Å; E381-F420 HydrophobicContact CG-CE2 4.2Å; E381-F420 HydrophobicContact CG-CG 4.06Å; E381-F420 HydrophobicContact CG-CZ 4.07Å; E381-F420 WeakPolarHBondContact OE1-CD2 3.34Å; E381-F420 WeakPolarHBondContact OE1-CG 3.48Å; T387-F420 HydrophobicContact CG2-CZ 3.72Å; T387-F420 WeakPolarHBondContact OG1-CZ 3.44Å; R411-F420 HydrophobicContact CB-CB 4.15Å; R411-F420 PolarHBondContact NH2-O 3.01Å; I412-F420 WeakPolarHBondContact O-CA 3.46Å; R413-F420 HydrophobicContact CB-CD1 4.11Å; R413-F420 HydrophobicContact CB-CE1 4.47Å; R413-F420 HydrophobicContact CB-CG 4.48Å; R413-F420 HydrophobicContact CG-CD1 3.73Å; R413-F420 HydrophobicContact CG-CE1 3.65Å; R413-F420 HydrophobicContact CG-CE2 4.46Å; R413-F420 HydrophobicContact CG-CG 4.18Å; R413-F420 HydrophobicContact CG-CZ 4.02Å; R413-F420 VanDerWaalsContact NE-CE2 3.26Å; R413-F420 VanDerWaalsContact NE-CZ 3.3Å; F420-E447 VanDerWaalsContact O-OE1 3.09Å
421	S	92.5	Very high	90.3	Very high	6 Å²	6	41.1 Å²	41.1	4%	0.042	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	159.2	172.6	-56.5	0	0	0	0	110.6	R411 I412 E447 I448	R411-S421 WeakPolarHBondContact CA-O 3.3Å; I412-S421 PolarHBondContact N-O 3.45Å; I412-S421 PolarHBondContact O-N 2.9Å; I412-S421 VanDerWaalsContact O-O 3.04Å; S421-E447 WeakPolarHBondContact OG-CA 3.28Å; S421-I448 PolarHBondContact OG-N 3.24Å
422	T	93.5	Very high	89.9	Confident	41 Å²	41	39.7 Å²	39.7	25%	0.252	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	150.1	-177.5	67.6	0	0	0	0	111.9	L410 R411 A424 S425 Y426	L410-T422 CarbonylContact O-C 3.46Å; L410-T422 WeakPolarHBondContact O-CA 3.08Å; R411-T422 HydrophobicContact CG-CG2 4.34Å; T422-A424 PolarHBondContact O-N 3.03Å; T422-S425 WeakPolarHBondContact O-CB 2.94Å; T422-S425 PolarHBondContact O-N 3.22Å; T422-S425 PolarHBondContact OG1-N 2.92Å; T422-S425 PolarHBondContact OG1-OG 2.98Å; T422-S425 VanDerWaalsContact OG1-OG 3.14Å; T422-Y426 WeakPolarHBondContact O-CD2 3.4Å; T422-Y426 PolarHBondContact O-N 3.18Å
423	L	92.5	Very high	89.6	Confident	7 Å²	7	42 Å²	42	4%	0.037	22%	0.22	C	C	.	.	H	α-helix	trans	-54.7	-35.6	172	174.6	63.5	0	0	0	111.6	L400 F406 P408 L410 I412 Y426 T427 P434 F435	L400-L423 HydrophobicContact CD1-CD2 3.75Å; F406-L423 HydrophobicContact CB-CD2 4.33Å; P408-L423 PolarHBondContact O-N 3.47Å; L410-L423 HydrophobicContact CB-CB 4.46Å; L410-L423 PolarHBondContact O-N 3.23Å; I412-L423 HydrophobicContact CD1-CB 4.29Å; I412-L423 HydrophobicContact CD1-CD1 3.86Å; L423-Y426 PolarHBondContact O-N 3.06Å; L423-T427 WeakPolarHBondContact O-CB 3.4Å; L423-T427 PolarHBondContact O-N 3.08Å; L423-T427 PolarHBondContact O-OG1 2.94Å; L423-P434 HydrophobicContact CD1-CG 3.95Å; L423-F435 HydrophobicContact CD1-CE2 3.86Å; L423-F435 HydrophobicContact CD1-CZ 3.92Å
424	A	91.9	Very high	89.3	Confident	38 Å²	38	39.6 Å²	39.6	31%	0.314	21%	0.211	S	C	.	.	H	α-helix	trans	-61.5	-48.8	171.5	0	0	0	0	0	112.1	P408 T422 Y426 T427 Q428	P408-A424 HydrophobicContact CB-CB 4.03Å; P408-A424 VanDerWaalsContact O-CB 3.3Å; P408-A424 WeakPolarHBondContact O-CB 3.44Å; P408-A424 PolarHBondContact O-N 3.15Å; T422-A424 PolarHBondContact O-N 3.03Å; A424-Y426 VanDerWaalsContact C-N 3.35Å; A424-Y426 PolarHBondContact O-N 3.13Å; A424-T427 PolarHBondContact O-N 3.3Å; A424-Q428 VanDerWaalsContact O-CB 3.32Å; A424-Q428 WeakPolarHBondContact O-CB 3.4Å; A424-Q428 PolarHBondContact O-N 3.26Å
425	S	91.4	Very high	89.2	Confident	22 Å²	22	39.6 Å²	39.6	15%	0.154	21%	0.211	C	C	.	.	H	α-helix	trans	-60.1	-42.7	175.8	-67.6	0	0	0	0	112	T422 Q428 L429 L453	T422-S425 WeakPolarHBondContact O-CB 2.94Å; T422-S425 PolarHBondContact O-N 3.22Å; T422-S425 PolarHBondContact OG1-N 2.92Å; T422-S425 PolarHBondContact OG1-OG 2.98Å; T422-S425 VanDerWaalsContact OG1-OG 3.14Å; S425-Q428 PolarHBondContact O-N 2.79Å; S425-L429 WeakPolarHBondContact O-CB 3.34Å; S425-L429 PolarHBondContact O-N 2.95Å; S425-L453 WeakPolarHBondContact O-CD2 3.48Å
426	Y	90.6	Very high	89	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63.2	-43.9	175.3	-86.5	-79.5	0	0	0	112.5	W378 I412 R413 D417 T422 L423 A424 L429 F430 I444 I448	W378-Y426 HydrophobicContact CH2-CD1 4.24Å; W378-Y426 HydrophobicContact CH2-CE1 4.15Å; W378-Y426 HydrophobicContact CZ3-CD1 4.34Å; W378-Y426 HydrophobicContact CZ3-CE1 4.06Å; I412-Y426 HydrophobicContact CD1-CD2 3.75Å; I412-Y426 HydrophobicContact CD1-CE2 4.31Å; I412-Y426 HydrophobicContact CD1-CG 4.1Å; I412-Y426 HydrophobicContact CG1-CD2 3.43Å; I412-Y426 VanDerWaalsContact CG1-CD2 3.43Å; I412-Y426 HydrophobicContact CG1-CE2 3.63Å; I412-Y426 HydrophobicContact CG1-CG 4.26Å; I412-Y426 WeakPolarHBondContact O-CE2 3.35Å; R413-Y426 WeakPolarHBondContact CA-OH 3.45Å; D417-Y426 PolarHBondContact OD2-OH 2.99Å; T422-Y426 WeakPolarHBondContact O-CD2 3.4Å; T422-Y426 PolarHBondContact O-N 3.18Å; L423-Y426 PolarHBondContact O-N 3.06Å; A424-Y426 VanDerWaalsContact C-N 3.35Å; A424-Y426 PolarHBondContact O-N 3.13Å; Y426-L429 PolarHBondContact O-N 3.06Å; Y426-F430 AromaticContact CD1-CE2 3.56Å; Y426-F430 HydrophobicContact CD1-CE2 3.56Å; Y426-F430 AromaticContact CD1-CZ 3.6Å; Y426-F430 HydrophobicContact CD1-CZ 3.6Å; Y426-F430 HydrophobicContact CE1-CE2 4.31Å; Y426-F430 HydrophobicContact CE1-CZ 4.06Å; Y426-F430 WeakPolarHBondContact O-CD2 3.4Å; Y426-F430 WeakPolarHBondContact O-CG 3.42Å; Y426-F430 PolarHBondContact O-N 2.87Å; Y426-I444 HydrophobicContact CE1-CD1 3.95Å; Y426-I448 HydrophobicContact CD1-CD1 3.65Å; Y426-I448 HydrophobicContact CD2-CD1 3.79Å; Y426-I448 HydrophobicContact CE1-CD1 3.76Å; Y426-I448 HydrophobicContact CE2-CD1 3.86Å; Y426-I448 HydrophobicContact CG-CD1 3.7Å
427	T	89.8	Confident	88.5	Confident	48 Å²	48	43.3 Å²	43.3	29%	0.294	24%	0.243	S	C	.	.	H	α-helix	trans	-67.4	-37.3	179.6	-53.7	0	0	0	0	111.7	L423 A424 E431 R432	L423-T427 WeakPolarHBondContact O-CB 3.4Å; L423-T427 PolarHBondContact O-N 3.08Å; L423-T427 PolarHBondContact O-OG1 2.94Å; A424-T427 PolarHBondContact O-N 3.3Å; T427-E431 WeakPolarHBondContact O-CA 3.34Å; T427-E431 PolarHBondContact O-N 2.86Å; T427-R432 PolarHBondContact O-N 3.32Å
428	Q	89.5	Confident	87.8	Confident	84 Å²	84	45.5 Å²	45.5	39%	0.393	27%	0.265	S	S	.	.	H	α-helix	trans	-73.3	-35.2	175.6	-173.6	179.2	-0.5	0	0	112.3	A424 S425 F430 L453	A424-Q428 VanDerWaalsContact O-CB 3.32Å; A424-Q428 WeakPolarHBondContact O-CB 3.4Å; A424-Q428 PolarHBondContact O-N 3.26Å; S425-Q428 PolarHBondContact O-N 2.79Å; Q428-F430 VanDerWaalsContact C-N 3.33Å; Q428-F430 PolarHBondContact O-N 3.21Å; Q428-L453 HydrophobicContact CB-CD2 4.01Å; Q428-L453 HydrophobicContact CG-CD2 4.06Å
429	L	86.4	Confident	87.2	Confident	16 Å²	16	45.3 Å²	45.3	8%	0.084	27%	0.27	C	S	.	.	H	α-helix	trans	-67.6	-32.7	-179.6	-173.8	67.4	0	0	0	112.7	S425 Y426 I444 I448 M452 L453 S456	S425-L429 WeakPolarHBondContact O-CB 3.34Å; S425-L429 PolarHBondContact O-N 2.95Å; Y426-L429 PolarHBondContact O-N 3.06Å; L429-I444 HydrophobicContact CD2-CD1 3.75Å; L429-I448 HydrophobicContact CB-CG2 4.16Å; L429-I448 HydrophobicContact CD1-CG2 4.2Å; L429-I448 HydrophobicContact CD2-CD1 3.72Å; L429-I448 HydrophobicContact CD2-CG1 3.95Å; L429-I448 HydrophobicContact CD2-CG2 3.9Å; L429-I448 HydrophobicContact CG-CG2 4.32Å; L429-M452 HydrophobicContact CD1-CB 4.4Å; L429-M452 HydrophobicContact CD1-CG 3.71Å; L429-M452 HydrophobicContact CD1-SD 3.99Å; L429-M452 HydrophobicContact CD2-SD 3.81Å; L429-L453 HydrophobicContact CB-CD2 3.86Å; L429-L453 HydrophobicContact CD1-CD2 4.22Å; L429-S456 WeakPolarHBondContact CD1-OG 3.15Å; L429-S456 PolarHBondContact O-OG 2.88Å
430	F	83	Confident	86.1	Confident	34 Å²	34	51 Å²	51	15%	0.149	29%	0.287	C	S	.	.	H	α-helix	trans	-108.8	-1.7	-176.4	-48.2	-30.7	0	0	0	114.4	Y426 Q428 R432 P434 I441 I444	Y426-F430 AromaticContact CD1-CE2 3.56Å; Y426-F430 HydrophobicContact CD1-CE2 3.56Å; Y426-F430 AromaticContact CD1-CZ 3.6Å; Y426-F430 HydrophobicContact CD1-CZ 3.6Å; Y426-F430 HydrophobicContact CE1-CE2 4.31Å; Y426-F430 HydrophobicContact CE1-CZ 4.06Å; Y426-F430 WeakPolarHBondContact O-CD2 3.4Å; Y426-F430 WeakPolarHBondContact O-CG 3.42Å; Y426-F430 PolarHBondContact O-N 2.87Å; Q428-F430 VanDerWaalsContact C-N 3.33Å; Q428-F430 PolarHBondContact O-N 3.21Å; F430-R432 HydrophobicContact CB-CG 3.84Å; F430-R432 WeakPolarHBondContact O-CG 3.28Å; F430-R432 PolarHBondContact O-N 3.31Å; F430-P434 HydrophobicContact CD2-CB 3.99Å; F430-P434 HydrophobicContact CE2-CB 3.92Å; F430-I441 HydrophobicContact CD1-CG1 4.01Å; F430-I441 HydrophobicContact CD1-CG2 4.41Å; F430-I441 HydrophobicContact CD2-CD1 3.8Å; F430-I441 HydrophobicContact CD2-CG1 4.16Å; F430-I441 HydrophobicContact CE1-CB 4.21Å; F430-I441 HydrophobicContact CE1-CD1 4.26Å; F430-I441 HydrophobicContact CE1-CG1 3.7Å; F430-I441 HydrophobicContact CE1-CG2 3.43Å; F430-I441 VanDerWaalsContact CE1-CG2 3.43Å; F430-I441 HydrophobicContact CE2-CD1 3.41Å; F430-I441 VanDerWaalsContact CE2-CD1 3.41Å; F430-I441 HydrophobicContact CE2-CG1 3.81Å; F430-I441 HydrophobicContact CE2-CG2 4.46Å; F430-I441 HydrophobicContact CG-CD1 4.36Å; F430-I441 HydrophobicContact CG-CG1 4.26Å; F430-I441 HydrophobicContact CZ-CB 4.07Å; F430-I441 HydrophobicContact CZ-CD1 3.71Å; F430-I441 HydrophobicContact CZ-CG1 3.61Å; F430-I441 HydrophobicContact CZ-CG2 3.48Å; F430-I441 VanDerWaalsContact CZ-CG2 3.48Å; F430-I444 HydrophobicContact CE1-CD1 4.29Å; F430-I444 HydrophobicContact CZ-CD1 4.06Å
431	E	84	Confident	85.1	Confident	148 Å²	148	51.5 Å²	51.5	69%	0.692	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.2	17.3	-173	-53.3	-171.6	149.8	0	0	114.7	T427	T427-E431 WeakPolarHBondContact O-CA 3.34Å; T427-E431 PolarHBondContact O-N 2.86Å
432	R	85	Confident	84.5	Confident	58 Å²	58	55.9 Å²	55.9	22%	0.219	32%	0.318	C	S	.	.	S	Bend	trans	-153.7	160.7	-172.2	73.7	-160.6	-167.2	76.7	-0.9	111.3	T427 F430 V436 P439	T427-R432 PolarHBondContact O-N 3.32Å; F430-R432 HydrophobicContact CB-CG 3.84Å; F430-R432 WeakPolarHBondContact O-CG 3.28Å; F430-R432 PolarHBondContact O-N 3.31Å; R432-V436 PolarHBondContact NH1-O 3.26Å; R432-P439 PolarHBondContact NH2-O 3.23Å
433	V	88.5	Confident	83.9	Confident	48 Å²	48	57.5 Å²	57.5	29%	0.291	33%	0.329	S	S	.	.			trans	-58.9	125.3	170.9	171.3	0	0	0	0	109.4	L400 F435 V436	L400-V433 HydrophobicContact CD2-CB 4.43Å; L400-V433 HydrophobicContact CD2-CG1 3.55Å; L400-V433 HydrophobicContact CD2-CG2 4.01Å; V433-F435 HydrophobicContact CG1-CB 4.16Å; V433-F435 HydrophobicContact CG1-CD2 3.94Å; V433-F435 HydrophobicContact CG1-CG 4.37Å; V433-F435 PolarHBondContact O-N 3.4Å; V433-V436 HydrophobicContact CB-CG2 3.87Å; V433-V436 HydrophobicContact CG1-CG2 3.84Å; V433-V436 PolarHBondContact O-N 2.9Å
434	P	86.3	Confident	83.4	Confident	4 Å²	4	57.9 Å²	57.9	3%	0.026	33%	0.331	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-25.2	-173.4	25.5	-35.5	0	0	0	113.7	W378 I412 L423 F430 V436	W378-P434 HydrophobicContact CH2-CB 3.68Å; W378-P434 HydrophobicContact CH2-CG 4.38Å; W378-P434 HydrophobicContact CZ2-CB 3.98Å; I412-P434 HydrophobicContact CD1-CG 4.27Å; L423-P434 HydrophobicContact CD1-CG 3.95Å; F430-P434 HydrophobicContact CD2-CB 3.99Å; F430-P434 HydrophobicContact CE2-CB 3.92Å; P434-V436 VanDerWaalsContact C-N 3.34Å
435	F	89.3	Confident	83	Confident	6 Å²	6	65.8 Å²	65.8	3%	0.026	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-1.3	-176.9	-42.6	-50.7	0	0	0	114.4	W378 M396 N397 L400 F406 I412 L423 V433	W378-F435 AromaticContact CD2-CD1 3.95Å; W378-F435 HydrophobicContact CD2-CD1 3.95Å; W378-F435 AromaticContact CD2-CE1 3.67Å; W378-F435 HydrophobicContact CD2-CE1 3.67Å; W378-F435 AromaticContact CE2-CD1 3.61Å; W378-F435 AromaticContact CE2-CE1 3.79Å; W378-F435 HydrophobicContact CE3-CD1 4.48Å; W378-F435 AromaticContact CE3-CE1 3.83Å; W378-F435 HydrophobicContact CE3-CE1 3.83Å; W378-F435 HydrophobicContact CG-CD1 4.32Å; W378-F435 HydrophobicContact CG-CE1 4.17Å; W378-F435 HydrophobicContact CH2-CD1 4.47Å; W378-F435 HydrophobicContact CH2-CE1 4.26Å; W378-F435 AromaticContact CZ2-CD1 3.9Å; W378-F435 HydrophobicContact CZ2-CD1 3.9Å; W378-F435 HydrophobicContact CZ2-CE1 4.09Å; W378-F435 HydrophobicContact CZ3-CE1 4.12Å; W378-F435 AromaticContact NE1-CD1 3.77Å; M396-F435 HydrophobicContact CB-CB 4.25Å; M396-F435 HydrophobicContact CB-CD1 3.42Å; M396-F435 VanDerWaalsContact CB-CD1 3.42Å; M396-F435 HydrophobicContact CB-CD2 3.84Å; M396-F435 HydrophobicContact CB-CE1 3.6Å; M396-F435 HydrophobicContact CB-CE2 3.99Å; M396-F435 HydrophobicContact CB-CG 3.56Å; M396-F435 HydrophobicContact CB-CZ 3.88Å; M396-F435 HydrophobicContact CE-CE1 3.75Å; M396-F435 HydrophobicContact CE-CZ 3.7Å; M396-F435 HydrophobicContact CG-CD1 4.17Å; M396-F435 HydrophobicContact CG-CE1 4.1Å; N397-F435 HydrophobicContact CB-CB 3.74Å; L400-F435 HydrophobicContact CB-CD2 4.31Å; L400-F435 HydrophobicContact CB-CE2 4.29Å; L400-F435 HydrophobicContact CD2-CD2 3.95Å; L400-F435 HydrophobicContact CD2-CE2 3.99Å; F406-F435 HydrophobicContact CD2-CE2 4.06Å; F406-F435 AromaticContact CE2-CE2 3.85Å; F406-F435 HydrophobicContact CE2-CE2 3.85Å; F406-F435 HydrophobicContact CE2-CZ 4.02Å; I412-F435 HydrophobicContact CD1-CE1 3.91Å; I412-F435 HydrophobicContact CD1-CZ 3.68Å; L423-F435 HydrophobicContact CD1-CE2 3.86Å; L423-F435 HydrophobicContact CD1-CZ 3.92Å; V433-F435 HydrophobicContact CG1-CB 4.16Å; V433-F435 HydrophobicContact CG1-CD2 3.94Å; V433-F435 HydrophobicContact CG1-CG 4.37Å; V433-F435 PolarHBondContact O-N 3.4Å
436	V	86.2	Confident	82.5	Confident	67 Å²	67	66.1 Å²	66.1	41%	0.406	36%	0.36	S	S	.	.	S	Bend	trans	-94.4	143.5	179.1	175.8	0	0	0	0	109.7	R432 V433 P434 G438	R432-V436 PolarHBondContact NH1-O 3.26Å; V433-V436 HydrophobicContact CB-CG2 3.87Å; V433-V436 HydrophobicContact CG1-CG2 3.84Å; V433-V436 PolarHBondContact O-N 2.9Å; P434-V436 VanDerWaalsContact C-N 3.34Å; V436-G438 PolarHBondContact O-N 3.27Å
437	S	76.5	Confident	82.1	Confident	118 Å²	118	70.2 Å²	70.2	83%	0.825	38%	0.379	S	S	*	.	S	Bend	trans	-53.2	133.7	173.7	-63.3	0	0	0	0	112.1
438	G	75	Confident	81.9	Confident	46 Å²	46	68.4 Å²	68.4	47%	0.474	37%	0.368	S	S	.	.	S	Bend	trans	175.8	-159.5	-179	0	0	0	0	0	111.9	V436 R440	V436-G438 PolarHBondContact O-N 3.27Å; G438-R440 PolarHBondContact O-N 2.84Å
439	P	76.6	Confident	81.4	Confident	100 Å²	100	69.1 Å²	69.1	65%	0.649	37%	0.374	S	S	*	.	S	Bend	trans	-52.6	125.9	176.1	-26.6	35.2	0	0	0	111.5	R432 I441	R432-P439 PolarHBondContact NH2-O 3.23Å; P439-I441 PolarHBondContact O-N 2.83Å
440	R	67.6	Low	80.9	Confident	161 Å²	161	76.5 Å²	76.5	61%	0.608	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-66.6	128.2	177	-77.6	-166.7	175.7	-138.7	-1	109.8	E375 H376 G438	E375-R440 IonicContact OE1-NH1 3.83Å; E375-R440 WeakPolarHBondContact OE2-CD 3.47Å; E375-R440 IonicContact OE2-CZ 2.73Å; E375-R440 IonicContact OE2-NE 2.79Å; E375-R440 IonicContact OE2-NH1 3.62Å; E375-R440 PolarHBondContact OE2-NH1 3.17Å; H376-R440 PolarHBondContact NE2-NH2 3.14Å; G438-R440 PolarHBondContact O-N 2.84Å
441	I	72.1	Confident	80.5	Confident	29 Å²	29	78.2 Å²	78.2	15%	0.149	43%	0.429	C	S	.	.	P	Polyproline II helix	trans	-90.2	127.8	-178.1	-54.2	120.7	0	0	0	108.5	R414 F430 P439 I444	R414-I441 PolarHBondContact NH1-O 2.73Å; F430-I441 HydrophobicContact CD1-CG1 4.01Å; F430-I441 HydrophobicContact CD1-CG2 4.41Å; F430-I441 HydrophobicContact CD2-CD1 3.8Å; F430-I441 HydrophobicContact CD2-CG1 4.16Å; F430-I441 HydrophobicContact CE1-CB 4.21Å; F430-I441 HydrophobicContact CE1-CD1 4.26Å; F430-I441 HydrophobicContact CE1-CG1 3.7Å; F430-I441 HydrophobicContact CE1-CG2 3.43Å; F430-I441 VanDerWaalsContact CE1-CG2 3.43Å; F430-I441 HydrophobicContact CE2-CD1 3.41Å; F430-I441 VanDerWaalsContact CE2-CD1 3.41Å; F430-I441 HydrophobicContact CE2-CG1 3.81Å; F430-I441 HydrophobicContact CE2-CG2 4.46Å; F430-I441 HydrophobicContact CG-CD1 4.36Å; F430-I441 HydrophobicContact CG-CG1 4.26Å; F430-I441 HydrophobicContact CZ-CB 4.07Å; F430-I441 HydrophobicContact CZ-CD1 3.71Å; F430-I441 HydrophobicContact CZ-CG1 3.61Å; F430-I441 HydrophobicContact CZ-CG2 3.48Å; F430-I441 VanDerWaalsContact CZ-CG2 3.48Å; P439-I441 PolarHBondContact O-N 2.83Å; I441-I444 HydrophobicContact CG2-CD1 4.19Å; I441-I444 HydrophobicContact CG2-CG1 4.33Å
442	P	78	Confident	80.3	Confident	99 Å²	99	74.1 Å²	74.1	64%	0.643	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-57.7	157.1	171.6	-23.6	34.4	0	0	0	112.4	R414 I444	R414-P442 PolarHBondContact NH2-O 3.06Å; P442-I444 PolarHBondContact O-N 3.38Å
443	P	81.8	Confident	80.1	Confident	75 Å²	75	72 Å²	72	49%	0.487	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-52.9	124.3	171.4	-29.9	38.1	0	0	0	112.6	C416	C416-P443 HydrophobicContact CB-CG 4.46Å
444	I	83.1	Confident	79.5	Confident	15 Å²	15	72.5 Å²	72.5	8%	0.077	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-91.1	122.4	180	-56.5	-178.7	0	0	0	108.6	D417 D418 Y426 L429 F430 I441 P442 G446 I448 M452	D417-I444 PolarHBondContact OD1-N 3.22Å; D418-I444 PolarHBondContact N-O 2.74Å; Y426-I444 HydrophobicContact CE1-CD1 3.95Å; L429-I444 HydrophobicContact CD2-CD1 3.75Å; F430-I444 HydrophobicContact CE1-CD1 4.29Å; F430-I444 HydrophobicContact CZ-CD1 4.06Å; I441-I444 HydrophobicContact CG2-CD1 4.19Å; I441-I444 HydrophobicContact CG2-CG1 4.33Å; P442-I444 PolarHBondContact O-N 3.38Å; I444-G446 WeakPolarHBondContact CG2-O 3.33Å; I444-I448 HydrophobicContact CD1-CD1 4.01Å; I444-I448 HydrophobicContact CD1-CG1 4.25Å; I444-I448 HydrophobicContact CG2-CG1 4.24Å; I444-M452 HydrophobicContact CG2-CE 4.11Å; I444-M452 HydrophobicContact CG2-SD 4.33Å
445	R	82	Confident	78.7	Confident	203 Å²	203	78 Å²	78	77%	0.766	44%	0.441	S	S	*	.			trans	-106.9	116	177.2	-60.8	-162.4	165.4	160.7	-1.6	110.3	D418	D418-R445 VanDerWaalsContact OD2-CG 3.31Å; D418-R445 WeakPolarHBondContact OD2-CG 3.05Å; D418-R445 IonicContact OD2-NE 2.79Å
446	G	82.1	Confident	77.5	Confident	30 Å²	30	79 Å²	79	31%	0.309	45%	0.449	S	S	.	.	S	Bend	trans	85.2	158.5	-173.3	0	0	0	0	0	112.5	T419 I444	T419-G446 WeakPolarHBondContact OG1-CA 3.36Å; T419-G446 PolarHBondContact OG1-N 2.72Å; T419-G446 PolarHBondContact OG1-O 3.35Å; I444-G446 WeakPolarHBondContact CG2-O 3.33Å
447	E	81.3	Confident	76.2	Confident	86 Å²	86	80.7 Å²	80.7	40%	0.402	46%	0.459	S	S	.	.			trans	-64.2	150.4	-175	-61.6	-171.2	146.7	0	0	112.2	R411 T419 F420 S421 N449	R411-E447 IonicContact CZ-OE1 2.87Å; R411-E447 IonicContact NH2-OE1 3.61Å; R411-E447 PolarHBondContact NH2-OE1 2.75Å; T419-E447 PolarHBondContact OG1-N 3.42Å; F420-E447 VanDerWaalsContact O-OE1 3.09Å; S421-E447 WeakPolarHBondContact OG-CA 3.28Å; E447-N449 PolarHBondContact O-N 2.89Å; E447-N449 PolarHBondContact O-ND2 2.91Å
448	I	85.4	Confident	74.8	Confident	9 Å²	9	77 Å²	77	5%	0.046	43%	0.434	C	S	.	.			trans	-72	82.2	178.2	-57.9	169.8	0	0	0	109.1	S421 Y426 L429 I444 M452 L453	S421-I448 PolarHBondContact OG-N 3.24Å; Y426-I448 HydrophobicContact CD1-CD1 3.65Å; Y426-I448 HydrophobicContact CD2-CD1 3.79Å; Y426-I448 HydrophobicContact CE1-CD1 3.76Å; Y426-I448 HydrophobicContact CE2-CD1 3.86Å; Y426-I448 HydrophobicContact CG-CD1 3.7Å; L429-I448 HydrophobicContact CB-CG2 4.16Å; L429-I448 HydrophobicContact CD1-CG2 4.2Å; L429-I448 HydrophobicContact CD2-CD1 3.72Å; L429-I448 HydrophobicContact CD2-CG1 3.95Å; L429-I448 HydrophobicContact CD2-CG2 3.9Å; L429-I448 HydrophobicContact CG-CG2 4.32Å; I444-I448 HydrophobicContact CD1-CD1 4.01Å; I444-I448 HydrophobicContact CD1-CG1 4.25Å; I444-I448 HydrophobicContact CG2-CG1 4.24Å; I448-M452 HydrophobicContact CB-SD 4.48Å; I448-M452 HydrophobicContact CG1-SD 4.25Å; I448-M452 HydrophobicContact CG2-SD 4.19Å; I448-L453 HydrophobicContact CG2-CD2 3.55Å; I448-L453 HydrophobicContact CG2-CG 3.89Å
449	N	80.5	Confident	73.3	Confident	100 Å²	100	77.6 Å²	77.6	54%	0.535	44%	0.44	S	S	.	.			trans	-71.1	158.5	-179.7	-79.1	-76.4	0	0	0	112.1	E447 A451 M452 L453	E447-N449 PolarHBondContact O-N 2.89Å; E447-N449 PolarHBondContact O-ND2 2.91Å; N449-A451 PolarHBondContact O-N 2.76Å; N449-A451 VanDerWaalsContact O-N 3.08Å; N449-M452 WeakPolarHBondContact O-CB 3.35Å; N449-M452 PolarHBondContact O-N 2.87Å; N449-L453 PolarHBondContact O-N 2.96Å
450	Q	75.2	Confident	71.4	Confident	171 Å²	171	81.3 Å²	81.3	80%	0.799	45%	0.446	S	S	*	.	H	α-helix	trans	-53.8	-32.3	177.1	-66.5	-174	20.8	0	0	113.3	M452 L453 A454	Q450-M452 VanDerWaalsContact C-N 3.35Å; Q450-M452 PolarHBondContact O-N 2.63Å; Q450-L453 PolarHBondContact O-N 2.81Å; Q450-A454 VanDerWaalsContact O-CB 3.32Å; Q450-A454 WeakPolarHBondContact O-CB 3.22Å; Q450-A454 PolarHBondContact O-N 2.77Å
451	A	75	Confident	70	Confident	69 Å²	69	80.9 Å²	80.9	57%	0.57	46%	0.455	S	S	*	.	H	α-helix	trans	-63.5	-37.1	174.5	0	0	0	0	0	113	N449 L455	N449-A451 PolarHBondContact O-N 2.76Å; N449-A451 VanDerWaalsContact O-N 3.08Å; A451-L455 WeakPolarHBondContact O-CB 3.42Å; A451-L455 VanDerWaalsContact O-CG 3.26Å; A451-L455 WeakPolarHBondContact O-CG 3.26Å; A451-L455 PolarHBondContact O-N 3.41Å
452	M	78.6	Confident	68.1	Low	62 Å²	62	86.1 Å²	86.1	31%	0.305	48%	0.483	S	S	.	.	H	α-helix	trans	-71.4	-39.9	177.1	-161.1	-171.9	-68.2	0	0	110.9	L429 I444 I448 N449 Q450 L455 S456	L429-M452 HydrophobicContact CD1-CB 4.4Å; L429-M452 HydrophobicContact CD1-CG 3.71Å; L429-M452 HydrophobicContact CD1-SD 3.99Å; L429-M452 HydrophobicContact CD2-SD 3.81Å; I444-M452 HydrophobicContact CG2-CE 4.11Å; I444-M452 HydrophobicContact CG2-SD 4.33Å; I448-M452 HydrophobicContact CB-SD 4.48Å; I448-M452 HydrophobicContact CG1-SD 4.25Å; I448-M452 HydrophobicContact CG2-SD 4.19Å; N449-M452 WeakPolarHBondContact O-CB 3.35Å; N449-M452 PolarHBondContact O-N 2.87Å; Q450-M452 VanDerWaalsContact C-N 3.35Å; Q450-M452 PolarHBondContact O-N 2.63Å; M452-L455 PolarHBondContact O-N 2.86Å; M452-S456 PolarHBondContact O-N 2.71Å; M452-S456 VanDerWaalsContact O-N 3.1Å
453	L	80.8	Confident	66	Low	14 Å²	14	90 Å²	90	7%	0.073	49%	0.49	C	S	.	.	H	α-helix	trans	-64.8	-41.9	174.8	-61.3	173.4	0	0	0	112	S425 Q428 L429 I448 N449 Q450 L455 S456 T457	S425-L453 WeakPolarHBondContact O-CD2 3.48Å; Q428-L453 HydrophobicContact CB-CD2 4.01Å; Q428-L453 HydrophobicContact CG-CD2 4.06Å; L429-L453 HydrophobicContact CB-CD2 3.86Å; L429-L453 HydrophobicContact CD1-CD2 4.22Å; I448-L453 HydrophobicContact CG2-CD2 3.55Å; I448-L453 HydrophobicContact CG2-CG 3.89Å; N449-L453 PolarHBondContact O-N 2.96Å; Q450-L453 PolarHBondContact O-N 2.81Å; L453-L455 VanDerWaalsContact C-N 3.32Å; L453-L455 PolarHBondContact O-N 3.11Å; L453-S456 PolarHBondContact O-N 3.36Å; L453-T457 PolarHBondContact O-N 3.18Å; L453-T457 PolarHBondContact O-OG1 2.78Å
454	A	75.2	Confident	63.5	Low	59 Å²	59	91.3 Å²	91.3	49%	0.488	50%	0.499	S	S	.	.	H	α-helix	trans	-62.9	-38.6	174.3	0	0	0	0	0	111.9	Q450 T457 S458	Q450-A454 VanDerWaalsContact O-CB 3.32Å; Q450-A454 WeakPolarHBondContact O-CB 3.22Å; Q450-A454 PolarHBondContact O-N 2.77Å; A454-T457 PolarHBondContact O-N 3.24Å; A454-S458 PolarHBondContact O-N 2.85Å; A454-S458 PolarHBondContact O-OG 2.92Å
455	L	70.7	Confident	61	Low	118 Å²	118	98.4 Å²	98.4	62%	0.618	53%	0.531	S	S	*	.	H	α-helix	trans	-65.7	-36	175.5	-76.5	167.5	0	0	0	113.2	A451 M452 L453 S458	A451-L455 WeakPolarHBondContact O-CB 3.42Å; A451-L455 VanDerWaalsContact O-CG 3.26Å; A451-L455 WeakPolarHBondContact O-CG 3.26Å; A451-L455 PolarHBondContact O-N 3.41Å; M452-L455 PolarHBondContact O-N 2.86Å; L453-L455 VanDerWaalsContact C-N 3.32Å; L453-L455 PolarHBondContact O-N 3.11Å; L455-S458 PolarHBondContact O-OG 3.28Å
456	S	64.2	Low	58.6	Low	29 Å²	29	97.4 Å²	97.4	20%	0.203	53%	0.533	C	S	.	.	H	α-helix	trans	-67.4	-39.4	168.8	-76.6	0	0	0	0	112.4	L429 M452 L453 S458	L429-S456 WeakPolarHBondContact CD1-OG 3.15Å; L429-S456 PolarHBondContact O-OG 2.88Å; M452-S456 PolarHBondContact O-N 2.71Å; M452-S456 VanDerWaalsContact O-N 3.1Å; L453-S456 PolarHBondContact O-N 3.36Å; S456-S458 PolarHBondContact O-N 3.15Å
457	T	57.7	Low	56.3	Low	101 Å²	101	104.6 Å²	104.6	62%	0.62	56%	0.556	S	S	*	*	H	α-helix	trans	-65.8	-25.4	-179	-48.3	0	0	0	0	112.1	L453 A454	L453-T457 PolarHBondContact O-N 3.18Å; L453-T457 PolarHBondContact O-OG1 2.78Å; A454-T457 PolarHBondContact O-N 3.24Å
458	S	48.6	Very low	54	Low	41 Å²	41	108.1 Å²	108.1	29%	0.287	58%	0.577	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.4	128.1	165	64	0	0	0	0	110.8	A454 L455 S456 F460	A454-S458 PolarHBondContact O-N 2.85Å; A454-S458 PolarHBondContact O-OG 2.92Å; L455-S458 PolarHBondContact O-OG 3.28Å; S456-S458 PolarHBondContact O-N 3.15Å; S458-F460 PolarHBondContact O-N 2.81Å
459	G	42	Very low	51.6	Low	59 Å²	59	112 Å²	112	61%	0.608	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	35.1	-170	0	0	0	0	0	118.6
460	F	37.2	Very low	49.5	Very low	178 Å²	178	114 Å²	114	78%	0.781	62%	0.616	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-7.3	-178.3	-78.1	-77.9	0	0	0	115	S458 N462	S458-F460 PolarHBondContact O-N 2.81Å; F460-N462 PolarHBondContact O-N 3.33Å
461	L	38.8	Very low	47.7	Very low	151 Å²	151	113.4 Å²	113.4	79%	0.791	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.6	0.6	169.3	-128.7	151.4	0	0	0	112.7	K463	L461-K463 VanDerWaalsContact C-N 3.31Å; L461-K463 PolarHBondContact O-N 3.05Å
462	N	32.7	Very low	46	Very low	139 Å²	139	116.1 Å²	116.1	74%	0.743	63%	0.63	S	S	*	*	S	Bend	trans	-70.2	89.6	158.1	-83.6	-43.2	0	0	0	110.5	F460	F460-N462 PolarHBondContact O-N 3.33Å
463	K	32.6	Very low	44	Very low	180 Å²	180	118.5 Å²	118.5	78%	0.783	65%	0.65	S	S	*	*			trans	0.7	113.5	158.7	-167.4	176.7	-170.6	176.7	0	114.6	L461 H465	L461-K463 VanDerWaalsContact C-N 3.31Å; L461-K463 PolarHBondContact O-N 3.05Å; K463-H465 PolarHBondContact O-N 3.13Å
464	P	30.2	Very low	41.8	Very low	104 Å²	104	123.5 Å²	123.5	68%	0.675	68%	0.682	S	S	*	*			trans	-62	108.3	179.4	25.9	-33.9	0	0	0	109.7	F466	P464-F466 HydrophobicContact CB-CD2 4.31Å; P464-F466 PolarHBondContact O-N 2.83Å
465	H	30.5	Very low	39.8	Very low	164 Å²	164	129 Å²	129	76%	0.759	70%	0.702	S	S	*	*			trans	-80.3	63.7	-172	-157	-60.2	0	0	0	111.1	K463 K467	K463-H465 PolarHBondContact O-N 3.13Å; H465-K467 PolarHBondContact O-N 2.78Å
466	F	30.9	Very low	38.2	Very low	182 Å²	182	128.7 Å²	128.7	80%	0.798	71%	0.705	S	S	*	*			trans	-56.2	107.7	173.4	-96.2	-81.3	0	0	0	109.8	P464 N468	P464-F466 HydrophobicContact CB-CD2 4.31Å; P464-F466 PolarHBondContact O-N 2.83Å; F466-N468 PolarHBondContact O-N 3.38Å
467	K	34.4	Very low	36.8	Very low	180 Å²	180	134.5 Å²	134.5	78%	0.783	73%	0.733	S	S	*	*			trans	-75	93.3	-177.1	-63.3	178.4	-178.8	178	0	109.8	H465	H465-K467 PolarHBondContact O-N 2.78Å
468	N	32.5	Very low	35.8	Very low	160 Å²	160	136 Å²	136	86%	0.856	75%	0.745	S	S	*	*			trans	-99.6	90.6	159.4	-81.3	-6.8	0	0	0	108.7	F466	F466-N468 PolarHBondContact O-N 3.38Å
469	S	35.1	Very low	34.8	Very low	91 Å²	91	139.7 Å²	139.7	64%	0.636	77%	0.769	S	S	*	*			trans	-124.1	92.1	166.4	60.5	0	0	0	0	108.8
470	D	37	Very low	34.1	Very low	141 Å²	141	144.3 Å²	144.3	75%	0.754	78%	0.78	S	S	*	*			trans	45.1	102.5	142.8	-47.9	-56.1	0	0	0	118.7
471	N	37.3	Very low	33.9	Very low	159 Å²	159	141.5 Å²	141.5	85%	0.85	78%	0.783	S	S	*	*			trans	-162.2	112.8	148.7	-97.1	-67.4	0	0	0	109.9
472	P	38.7	Very low	33.6	Very low	127 Å²	127	140.7 Å²	140.7	83%	0.825	78%	0.784	S	S	*	*			trans	-101.8	125.9	175.9	34.6	-28.4	0	0	0	112.6
473	P	36.8	Very low	33.6	Very low	111 Å²	111	141.6 Å²	141.6	72%	0.721	79%	0.789	S	S	*	*			trans	-126.4	115	164	34.2	-19.3	0	0	0	113.1	D475	P473-D475 PolarHBondContact O-N 3.21Å
474	T	35.1	Very low	33.7	Very low	120 Å²	120	140.5 Å²	140.5	74%	0.736	79%	0.786	S	S	*	*			trans	-7.9	110.9	130.4	-52.7	0	0	0	0	116.2	V476	T474-V476 HydrophobicContact CG2-CB 4.17Å; T474-V476 HydrophobicContact CG2-CG2 3.46Å; T474-V476 VanDerWaalsContact CG2-CG2 3.46Å; T474-V476 PolarHBondContact O-N 3.18Å
475	D	32.5	Very low	33.8	Very low	173 Å²	173	140.5 Å²	140.5	93%	0.925	78%	0.781	S	S	*	*			trans	-80.5	107.7	153	-92.9	-40.7	0	0	0	109	P473	P473-D475 PolarHBondContact O-N 3.21Å
476	V	36.9	Very low	34	Very low	112 Å²	112	140.7 Å²	140.7	68%	0.679	78%	0.782	S	S	*	*			trans	-107.6	119.4	167.5	153.1	0	0	0	0	108.7	T474	T474-V476 HydrophobicContact CG2-CB 4.17Å; T474-V476 HydrophobicContact CG2-CG2 3.46Å; T474-V476 VanDerWaalsContact CG2-CG2 3.46Å; T474-V476 PolarHBondContact O-N 3.18Å
477	L	35.1	Very low	34.2	Very low	151 Å²	151	136.7 Å²	136.7	79%	0.791	78%	0.776	S	S	*	*			trans	40.3	117.3	156.3	-61	173.7	0	0	0	118.1
478	P	36.2	Very low	34.3	Very low	133 Å²	133	135.7 Å²	135.7	86%	0.864	78%	0.78	S	S	*	*			trans	-67.2	148.3	171.9	31.3	-35.4	0	0	0	111.2
479	C	28.3	Very low	34.5	Very low	118 Å²	118	131.8 Å²	131.8	80%	0.797	78%	0.777	S	S	*	*			trans	-132.3	138.3	166.9	59.5	0	0	0	0	111.3
480	N	27.8	Very low	34.6	Very low	157 Å²	157	132.2 Å²	132.2	84%	0.84	78%	0.78	S	S	*	*			trans	35.9	104.6	166.2	-63.8	-2.4	0	0	0	119.2
481	S	33.7	Very low	34.4	Very low	119 Å²	119	135.8 Å²	135.8	83%	0.832	78%	0.783	S	S	*	*				-150.2	119.6	124.2	-84	0	0	0	0	112.7
482	T	32.4	Very low	34.2	Very low	134 Å²	134	134.2 Å²	134.2	82%	0.822	78%	0.779	S	S	*	*			trans	-17.6	113.6	166.4	-41.2	0	0	0	0	118.4
483	N	31	Very low	34.1	Very low	157 Å²	157	134.9 Å²	134.9	84%	0.84	78%	0.776	S	S	*	*			trans	-136.2	113.5	135.8	-73.2	-60.1	0	0	0	104.1
484	H	35.5	Very low	34	Very low	157 Å²	157	132.7 Å²	132.7	73%	0.727	77%	0.767	S	S	*	*				39.8	115.4	81.9	-146.5	-7.3	0	0	0	113.6
485	D	32.5	Very low	34.1	Very low	105 Å²	105	134 Å²	134	56%	0.561	77%	0.769	S	S	*	*			trans	25.4	137.3	157.2	-78.9	-93.9	0	0	0	122.8
486	Q	35.1	Very low	34.3	Very low	167 Å²	167	133.2 Å²	133.2	78%	0.78	76%	0.762	S	S	*	*			trans	63.4	136	142.4	-64.4	162.6	55.4	0	0	117.4
487	S	35.3	Very low	34.4	Very low	98 Å²	98	134.3 Å²	134.3	69%	0.685	77%	0.769	S	S	*	*			cis	-172.5	-170.3	-10.3	49	0	0	0	0	106.9
488	D	36.1	Very low	34.6	Very low	160 Å²	160	129.8 Å²	129.8	86%	0.856	76%	0.758	S	S	*	*			trans	-36.3	140.8	164.8	-56.5	-91.1	0	0	0	115
489	G	37.3	Very low	34.6	Very low	77 Å²	77	131.4 Å²	131.4	79%	0.794	76%	0.76	S	S	*	*			trans	-156.6	33.1	-174.7	0	0	0	0	0	116.4
490	S	35.2	Very low	34.9	Very low	101 Å²	101	130.4 Å²	130.4	71%	0.706	75%	0.754	S	S	*	*			trans	-38.8	133.5	166	-90.9	0	0	0	0	115.4
491	R	33	Very low	35.2	Very low	215 Å²	215	128.4 Å²	128.4	81%	0.811	75%	0.747	S	S	*	*				63.2	132.1	127.5	-60.3	166.9	144.7	-167.9	-4	120.2
492	V	34.9	Very low	35.5	Very low	127 Å²	127	128 Å²	128	77%	0.77	74%	0.74	S	S	*	*			trans	66.9	164.3	137.1	-54.2	0	0	0	0	117.1
493	N	35.6	Very low	35.6	Very low	141 Å²	141	128.2 Å²	128.2	75%	0.754	74%	0.736	S	S	*	*			cis	-149.2	165.3	18.2	-143.8	-5.7	0	0	0	116.9
494	A	33.8	Very low	35.8	Very low	64 Å²	64	126.1 Å²	126.1	53%	0.529	73%	0.729	S	S	.	*			trans	-19.9	147.3	166.6	0	0	0	0	0	119.8
495	N	37.4	Very low	35.7	Very low	149 Å²	149	123.6 Å²	123.6	80%	0.797	73%	0.729	S	S	*	*				179.5	149.1	112.2	-88.9	-22.1	0	0	0	110.5
496	M	37	Very low	35.6	Very low	155 Å²	155	130.5 Å²	130.5	76%	0.764	75%	0.747	S	S	*	*			cis	-164.8	163.2	-14.5	-172.2	167.6	64.8	0	0	108.3
497	V	39.9	Very low	35.3	Very low	136 Å²	136	127.6 Å²	127.6	82%	0.824	75%	0.745	S	S	*	*			trans	73.1	128.6	174.7	-165.4	0	0	0	0	115.4
498	G	37.9	Very low	35	Very low	55 Å²	55	130.4 Å²	130.4	57%	0.567	75%	0.752	S	S	*	*			cis	163.5	125.5	-13.9	0	0	0	0	0	115.2
499	N	36.6	Very low	34.6	Very low	168 Å²	168	130.2 Å²	130.2	90%	0.898	75%	0.75	S	S	*	*			trans	66.4	142.1	152.1	-53.6	-1.4	0	0	0	118.3
500	S	35.8	Very low	34.2	Very low	96 Å²	96	132.1 Å²	132.1	67%	0.671	75%	0.751	S	S	*	*			cis	-159.6	142.5	-9	-143.7	0	0	0	0	112.3
501	T	34.1	Very low	33.8	Very low	115 Å²	115	136.4 Å²	136.4	71%	0.706	76%	0.76	S	S	*	*			trans	19.1	150.1	133.6	65.7	0	0	0	0	121.2
502	V	38.9	Very low	33.8	Very low	112 Å²	112	130.4 Å²	130.4	68%	0.679	75%	0.749	S	S	*	*			cis	-156.4	163.1	27.5	-136.8	0	0	0	0	112.7
503	D	34.6	Very low	33.8	Very low	138 Å²	138	133.2 Å²	133.2	74%	0.738	75%	0.754	S	S	*	*			trans	66.4	154.3	149.4	-73.4	-42.8	0	0	0	122.2
504	T	36.2	Very low	33.5	Very low	112 Å²	112	135.6 Å²	135.6	69%	0.687	76%	0.76	S	S	*	*			cis	-170.8	150.8	-36.2	-101.5	0	0	0	0	109.4
505	S	33.3	Very low	33.3	Very low	105 Å²	105	140.9 Å²	140.9	73%	0.734	77%	0.774	S	S	*	*			trans	73.6	97.8	167.8	-70	0	0	0	0	120.7
506	R	30	Very low	33	Very low	250 Å²	250	141 Å²	141	94%	0.943	77%	0.774	S	S	*	*			trans	38.8	122.8	133.8	-68.2	-174	170.2	-152.4	-3	120.6
507	S	28.9	Very low	32.6	Very low	106 Å²	106	142.5 Å²	142.5	74%	0.741	77%	0.772	S	S	*	*				130	140.6	118.6	-154.3	0	0	0	0	114.9
508	L	29.2	Very low	32.1	Very low	157 Å²	157	142.2 Å²	142.2	82%	0.822	76%	0.762	S	S	*	*			trans	74.4	143.5	171.9	-51.7	-176.7	0	0	0	118.7
509	L	27.3	Very low	31.8	Very low	155 Å²	155	147.3 Å²	147.3	81%	0.812	77%	0.771	S	S	*	*			trans	-51.9	134	-167.9	-63.8	64.6	0	0	0	115.8
510	S	28.5	Very low	31.6	Very low	118 Å²	118	144.1 Å²	144.1	83%	0.825	75%	0.753	S	S	*	*				171	114.9	120.4	-75.3	0	0	0	0	111.7
511	E	28.2	Very low	31.3	Very low	191 Å²	191	142 Å²	142	89%	0.893	74%	0.738	S	S	*	*			trans	-156.1	164.8	169.3	-115.8	-150.4	92.1	0	0	110.6
512	P	32.4	Very low	31.1	Very low	88 Å²	88	142 Å²	142	57%	0.571	73%	0.734	S	S	*	*				-133.4	156.3	-110.2	39.1	-22.1	0	0	0	115.2
513	Q	33.6	Very low	30.7	Very low	186 Å²	186	144 Å²	144	87%	0.869	73%	0.734	S	S	*	*			trans	-145.7	101	161.8	-77.6	-59.3	-67	0	0	111.2
514	H	30.2	Very low	30.3	Very low	191 Å²	191	142.7 Å²	142.7	88%	0.884	74%	0.736	S	S	*	*			trans	-153.1	83.7	164.4	-114.6	-58.1	0	0	0	109.8
515	Q	29.1	Very low	30	Very low	176 Å²	176	143.4 Å²	143.4	82%	0.822	74%	0.74	S	S	*	*			trans	-157.4	88.6	173.7	-111.8	159.6	30.6	0	0	111.4
516	L	30.6	Very low	29.8	Very low	152 Å²	152	143.5 Å²	143.5	80%	0.796	74%	0.741	S	S	*	*				-176.2	109.2	113	-78.5	-156.2	0	0	0	106.3
517	Y	29	Very low	29.7	Very low	186 Å²	186	135.8 Å²	135.8	73%	0.729	73%	0.731	S	S	*	*				69	128	89.5	-99.9	-109.4	0	0	0	113.6
518	Q	30	Very low	29.7	Very low	129 Å²	129	136.9 Å²	136.9	60%	0.603	74%	0.737	S	S	*	*			cis	-171.6	-177.7	-17.7	-132.1	-179.3	36	0	0	108
519	Q	31.3	Very low	29.7	Very low	162 Å²	162	137.9 Å²	137.9	76%	0.757	74%	0.741	S	S	*	*			trans	70.5	143.9	169.6	-61.7	179.8	-110.4	0	0	116.2
520	L	31.7	Very low	29.9	Very low	101 Å²	101	135 Å²	135	53%	0.529	74%	0.74	S	S	.	*			cis	-148.3	167.9	-9.9	-108.9	169.4	0	0	0	111.5	V566	L520-V566 WeakPolarHBondContact CD2-O 3.5Å
521	S	30	Very low	30	Very low	52 Å²	52	133.9 Å²	133.9	36%	0.364	74%	0.738	S	S	.	*			trans	-93.8	173.7	-157.6	-10.9	0	0	0	0	116.4	P567 V568	S521-P567 VanDerWaalsContact O-CB 3.3Å; S521-P567 WeakPolarHBondContact O-CB 3.5Å; S521-V568 PolarHBondContact O-N 3.44Å; S521-V568 VanDerWaalsContact O-N 3.14Å
522	D	30	Very low	30.2	Very low	116 Å²	116	131.4 Å²	131.4	62%	0.62	74%	0.736	S	S	*	*			trans	46.7	125.6	151.7	-45.9	-38.1	0	0	0	119.9	P567	D522-P567 HydrophobicContact CB-CB 3.83Å; D522-P567 HydrophobicContact CB-CG 4.48Å
523	F	30.8	Very low	30	Very low	152 Å²	152	132.5 Å²	132.5	67%	0.667	75%	0.745	S	S	*	*				-162.8	134.3	121.1	-110.9	-70.9	0	0	0	112	V568	F523-V568 HydrophobicContact CE2-CG2 4.5Å
524	S	26.2	Very low	30	Very low	112 Å²	112	129.5 Å²	129.5	78%	0.783	74%	0.74	S	S	*	*			trans	-88.3	142.8	160.6	178.9	0	0	0	0	108.9
525	T	30.5	Very low	30.3	Very low	127 Å²	127	125.4 Å²	125.4	78%	0.779	74%	0.739	S	S	*	*			trans	-143.3	115.8	174.1	-62	0	0	0	0	110.8
526	S	27.6	Very low	30.5	Very low	107 Å²	107	120 Å²	120	75%	0.748	73%	0.73	S	S	*	*			trans	-93.2	167.7	171.1	-176.9	0	0	0	0	110.6
527	A	28.3	Very low	30.7	Very low	88 Å²	88	121.3 Å²	121.3	73%	0.727	74%	0.736	S	S	*	*			trans	69.4	116.9	158.1	0	0	0	0	0	119.4
528	C	29.4	Very low	30.9	Very low	129 Å²	129	116.9 Å²	116.9	87%	0.872	73%	0.732	S	S	*	*			trans	-145.4	47.4	132.1	60	0	0	0	0	112.5
529	I	28.7	Very low	31.5	Very low	177 Å²	177	116.9 Å²	116.9	91%	0.908	74%	0.741	S	S	*	*			trans	-89.6	100.2	157.1	-58.7	178.3	0	0	0	106.9
530	A	31.7	Very low	31.9	Very low	95 Å²	95	114.8 Å²	114.8	79%	0.785	74%	0.741	S	S	*	*			trans	-132.4	111.8	178	0	0	0	0	0	109.7
531	A	31.4	Very low	32	Very low	95 Å²	95	115.6 Å²	115.6	79%	0.785	75%	0.75	S	S	*	*			trans	-65.7	160.4	-168.6	0	0	0	0	0	115.2
532	T	31.5	Very low	32.1	Very low	139 Å²	139	119.1 Å²	119.1	85%	0.853	77%	0.774	S	S	*	*			trans	-149.6	98.4	146	-63.6	0	0	0	0	111.2
533	S	29.2	Very low	32.1	Very low	110 Å²	110	122.3 Å²	122.3	77%	0.769	79%	0.785	S	S	*	*			trans	62.3	159.9	155.6	-120.1	0	0	0	0	118.2
534	V	33.8	Very low	32.3	Very low	124 Å²	124	121.2 Å²	121.2	75%	0.752	79%	0.79	S	S	*	*			cis	-140.4	136.8	8.2	-176.3	0	0	0	0	109.7
535	A	35	Very low	32.7	Very low	105 Å²	105	122 Å²	122	87%	0.868	79%	0.79	S	S	*	*			trans	57.7	153	165.8	0	0	0	0	0	118.5
536	G	33.5	Very low	32.7	Very low	62 Å²	62	124.8 Å²	124.8	64%	0.639	80%	0.795	S	S	*	*			cis	166	159.8	-7.3	0	0	0	0	0	110.9
537	I	35.2	Very low	33.1	Very low	180 Å²	180	129.2 Å²	129.2	92%	0.923	80%	0.803	S	S	*	*			trans	73	139	179.4	-49	167.1	0	0	0	113.5
538	S	34.3	Very low	33.3	Very low	92 Å²	92	130 Å²	130	64%	0.643	80%	0.803	S	S	*	*			cis	-174.3	123	-26.2	177.7	0	0	0	0	111.4
539	V	42	Very low	33.6	Very low	130 Å²	130	130.7 Å²	130.7	79%	0.788	80%	0.798	S	S	*	*			trans	58.9	141.4	136.7	174.1	0	0	0	0	120.4
540	P	39.3	Very low	33.9	Very low	117 Å²	117	128.9 Å²	128.9	76%	0.76	79%	0.79	S	S	*	*			cis	-139.1	-170.1	-21.1	40.1	-19.9	0	0	0	115.4
541	T	33.6	Very low	34	Very low	118 Å²	118	129.4 Å²	129.4	72%	0.724	78%	0.784	S	S	*	*			trans	-79.6	153.9	172.1	-52.2	0	0	0	0	114.6	Q543	T541-Q543 HydrophobicContact CG2-CG 4.49Å
542	C	33.2	Very low	34.2	Very low	126 Å²	126	130.2 Å²	130.2	85%	0.851	78%	0.779	S	S	*	*			trans	-125.4	138.3	153.1	-74.8	0	0	0	0	110.7
543	Q	28.8	Very low	34.3	Very low	184 Å²	184	131.2 Å²	131.2	86%	0.86	78%	0.779	S	S	*	*			trans	-118.1	146	166.9	-77.2	-172.5	-30.4	0	0	109.2	T541	T541-Q543 HydrophobicContact CG2-CG 4.49Å
544	V	35.7	Very low	34.3	Very low	129 Å²	129	130.5 Å²	130.5	78%	0.782	77%	0.774	S	S	*	*			trans	-140.3	104.1	171.5	178.6	0	0	0	0	110.6
545	T	34.6	Very low	34.3	Very low	127 Å²	127	134.8 Å²	134.8	78%	0.779	78%	0.783	S	S	*	*			trans	42.7	130.2	152.1	57.4	0	0	0	0	122.5
546	E	30.9	Very low	34	Very low	186 Å²	186	134.4 Å²	134.4	87%	0.869	77%	0.774	S	S	*	*			trans	-71	151	152.8	-50.4	173.8	147.1	0	0	111
547	E	36.2	Very low	33.9	Very low	200 Å²	200	139.3 Å²	139.3	94%	0.935	78%	0.784	S	S	*	*			trans	-126.4	133.8	144.6	-78.1	-160.2	125.5	0	0	109
548	S	31	Very low	33.7	Very low	104 Å²	104	134 Å²	134	73%	0.727	76%	0.764	S	S	*	*			trans	-100.3	161.6	178.5	67	0	0	0	0	110.4
549	L	37.4	Very low	33.4	Very low	145 Å²	145	139.3 Å²	139.3	76%	0.759	77%	0.771	S	S	*	*			trans	177.5	120.1	138.2	-95.5	163.1	0	0	0	111.4
550	N	33.5	Very low	32.9	Very low	139 Å²	139	136.9 Å²	136.9	74%	0.743	77%	0.772	S	S	*	*				57.9	138.4	126.5	-74.2	13.3	0	0	0	122.5
551	T	34.5	Very low	32.3	Very low	106 Å²	106	138.9 Å²	138.9	65%	0.65	77%	0.769	S	S	*	*			cis	-159.2	147.7	-15.9	-34.5	0	0	0	0	109.6
552	T	35	Very low	32.2	Very low	111 Å²	111	140.6 Å²	140.6	68%	0.681	77%	0.772	S	S	*	*			trans	25	126.2	155	53.7	0	0	0	0	121.3
553	N	34.5	Very low	32	Very low	160 Å²	160	140.6 Å²	140.6	86%	0.856	76%	0.763	S	S	*	*				-152.4	147.7	102.6	-122.8	-63.4	0	0	0	112.7
554	S	28.6	Very low	32.1	Very low	96 Å²	96	138.2 Å²	138.2	67%	0.671	76%	0.761	S	S	*	*			trans	-145.8	128	-166.3	56.2	0	0	0	0	112.8
555	K	34	Very low	31.9	Very low	214 Å²	214	136.7 Å²	136.7	93%	0.93	76%	0.757	S	S	*	*			trans	-140.6	95.3	159.6	-72.3	-166.1	178	176.3	0	111.2
556	S	29	Very low	31.7	Very low	97 Å²	97	136 Å²	136	68%	0.678	75%	0.752	S	S	*	*			trans	-95.7	142.5	162.9	160.9	0	0	0	0	109.4
557	L	31.4	Very low	31.9	Very low	165 Å²	165	128.7 Å²	128.7	86%	0.864	72%	0.721	S	S	*	*			trans	-156.9	129.6	142.1	-88.2	125	0	0	0	106.2
558	S	30.1	Very low	31.8	Very low	69 Å²	69	123.6 Å²	123.6	48%	0.483	70%	0.703	S	S	.	*			cis	72	138	45.9	-60.4	0	0	0	0	112.9
559	Y	27.4	Very low	31.8	Very low	203 Å²	203	122.3 Å²	122.3	80%	0.796	69%	0.694	S	S	*	*			cis	-155.2	158.9	-3.2	-103.7	-53.9	0	0	0	108.3	F561	Y559-F561 HydrophobicContact CD1-CD2 4.12Å; Y559-F561 AromaticContact CD1-CE2 3.82Å; Y559-F561 HydrophobicContact CD1-CE2 3.82Å; Y559-F561 AromaticContact CE1-CE2 3.79Å; Y559-F561 HydrophobicContact CE1-CE2 3.79Å
560	G	31.9	Very low	31.5	Very low	78 Å²	78	120 Å²	120	80%	0.804	70%	0.696	S	S	*	*			trans	-174.7	94.2	171.6	0	0	0	0	0	113.4
561	F	26.9	Very low	31.7	Very low	160 Å²	160	119.1 Å²	119.1	70%	0.702	70%	0.698	S	S	*	*			trans	-104.2	144.2	-173.9	-92.6	-114.9	0	0	0	113.5	Y559	Y559-F561 HydrophobicContact CD1-CD2 4.12Å; Y559-F561 AromaticContact CD1-CE2 3.82Å; Y559-F561 HydrophobicContact CD1-CE2 3.82Å; Y559-F561 AromaticContact CE1-CE2 3.79Å; Y559-F561 HydrophobicContact CE1-CE2 3.79Å
562	I	31.6	Very low	31.4	Very low	154 Å²	154	121.8 Å²	121.8	79%	0.79	71%	0.705	S	S	*	*			trans	-162.5	115.5	131	30.8	177.9	0	0	0	107.3
563	N	29.4	Very low	31.1	Very low	125 Å²	125	120.8 Å²	120.8	67%	0.668	70%	0.703	S	S	*	*				63.4	118.7	84	-60.6	-7.2	0	0	0	110.9
564	T	31.3	Very low	30.9	Very low	134 Å²	134	120.7 Å²	120.7	82%	0.822	70%	0.701	S	S	*	*			cis	-169	-170.1	39.4	45.3	0	0	0	0	110
565	S	30.9	Very low	31	Very low	97 Å²	97	122.9 Å²	122.9	68%	0.678	70%	0.704	S	S	*	*				-172.6	149.5	-69.4	60.5	0	0	0	0	112.5
566	V	31.3	Very low	30.6	Very low	112 Å²	112	118.5 Å²	118.5	68%	0.679	69%	0.691	S	S	*	*			trans	79.9	148.6	150.3	159	0	0	0	0	118.2	L520	L520-V566 WeakPolarHBondContact CD2-O 3.5Å
567	P	35	Very low	30.4	Very low	33 Å²	33	119.7 Å²	119.7	21%	0.214	69%	0.69	C	S	.	*			trans	-125.8	-142.9	-136.9	43.6	-28.7	0	0	0	115.5	S521 D522	S521-P567 VanDerWaalsContact O-CB 3.3Å; S521-P567 WeakPolarHBondContact O-CB 3.5Å; D522-P567 HydrophobicContact CB-CB 3.83Å; D522-P567 HydrophobicContact CB-CG 4.48Å
568	V	32.4	Very low	30.4	Very low	93 Å²	93	118 Å²	118	56%	0.564	69%	0.692	S	S	*	*			trans	118	92.4	153.5	-176.8	0	0	0	0	118.3	S521 F523	S521-V568 PolarHBondContact O-N 3.44Å; S521-V568 VanDerWaalsContact O-N 3.14Å; F523-V568 HydrophobicContact CE2-CG2 4.5Å
569	S	31.3	Very low	30.3	Very low	78 Å²	78	121.2 Å²	121.2	55%	0.545	70%	0.702	S	S	.	*				67.1	146.3	118.9	-49.2	0	0	0	0	125.9
570	A	31.8	Very low	30.2	Very low	97 Å²	97	117.7 Å²	117.7	80%	0.802	70%	0.697	S	S	*	*			trans	98.6	148.2	140.8	0	0	0	0	0	119.7
571	P	37.6	Very low	30	Very low	119 Å²	119	120.1 Å²	120.1	77%	0.773	69%	0.692	S	S	*	*			trans	-131.9	-147.9	-157.3	41.3	-19.5	0	0	0	113.2
572	M	28.2	Very low	30.3	Very low	162 Å²	162	119.9 Å²	119.9	80%	0.798	70%	0.697	S	S	*	*			trans	89.2	112.9	172.6	-62.5	-61.8	-74.8	0	0	117.9
573	S	27.8	Very low	30.1	Very low	91 Å²	91	122.3 Å²	122.3	64%	0.636	70%	0.696	S	S	*	*			trans	-11	140.1	145.3	57.4	0	0	0	0	118.9
574	L	31.9	Very low	30.2	Very low	157 Å²	157	122.9 Å²	122.9	82%	0.822	70%	0.698	S	S	*	*			trans	-147.5	134.7	131.7	-88.5	-178.3	0	0	0	110.9
575	L	30.1	Very low	29.9	Very low	142 Å²	142	126.5 Å²	126.5	74%	0.743	70%	0.697	S	S	*	*			trans	36.3	123.2	146	-56.3	173.2	0	0	0	119.6
576	N	26.3	Very low	30	Very low	123 Å²	123	128 Å²	128	66%	0.658	70%	0.697	S	S	*	*				66	122.9	61.6	-170.2	27.9	0	0	0	114.2
577	N	24.8	Very low	30	Very low	122 Å²	122	127.9 Å²	127.9	65%	0.652	69%	0.692	S	S	*	*			trans	55.3	105	168	-71.3	-30.6	0	0	0	119
578	S	31	Very low	29.9	Very low	129 Å²	129	132.2 Å²	132.2	90%	0.902	72%	0.718	S	S	*	*			trans	-149.2	99.7	132.6	-82.8	0	0	0	0	111.2
579	I	27.5	Very low	29.8	Very low	136 Å²	136	134.7 Å²	134.7	70%	0.697	72%	0.724	S	S	*	*			trans	-77.1	154.2	162	-53	172.8	0	0	0	107.5
580	N	26.2	Very low	29.9	Very low	129 Å²	129	135.6 Å²	135.6	69%	0.69	73%	0.726	S	S	*	*			trans	89.7	140.7	169	-48.5	-76.3	0	0	0	117
581	N	27.5	Very low	29.9	Very low	130 Å²	130	136.9 Å²	136.9	70%	0.695	72%	0.719	S	S	*	*			trans	71	136	175.3	-39.5	-74.4	0	0	0	113.7
582	L	32.3	Very low	29.5	Very low	155 Å²	155	138.3 Å²	138.3	81%	0.812	71%	0.713	S	S	*	*			cis	-121.4	150.2	-3.4	-71.5	86.1	0	0	0	108.4
583	R	27.5	Very low	29.8	Very low	205 Å²	205	137.4 Å²	137.4	77%	0.774	71%	0.705	S	S	*	*			cis	79.2	133.8	30	-155.9	-164.4	-163.9	151.6	4	113.1
584	I	30.8	Very low	30	Very low	137 Å²	137	138.8 Å²	138.8	70%	0.703	71%	0.714	S	S	*	*			trans	72.4	102.3	176.9	-45.6	-172.8	0	0	0	111.5
585	R	25.2	Very low	29.8	Very low	210 Å²	210	135.8 Å²	135.8	79%	0.792	70%	0.703	S	S	*	*				82.7	124.8	51.9	-175.8	-153.1	-157.2	146.3	6.4	111.5
586	D	33.5	Very low	29.8	Very low	127 Å²	127	136.9 Å²	136.9	68%	0.679	71%	0.708	S	S	*	*			trans	166.5	140.6	138.6	-85.7	1	0	0	0	108.5
587	N	31.1	Very low	30	Very low	110 Å²	110	138 Å²	138	59%	0.588	71%	0.714	S	S	*	*			cis	-164.3	173.5	-11.3	-115.4	-22.8	0	0	0	111.4
588	V	34.1	Very low	30.4	Very low	124 Å²	124	138.3 Å²	138.3	75%	0.752	72%	0.716	S	S	*	*			trans	71	131.1	153	157.2	0	0	0	0	117.5
589	E	29.7	Very low	30.3	Very low	146 Å²	146	136.9 Å²	136.9	68%	0.682	70%	0.704	S	S	*	*			cis	-167.5	128.3	-12.3	-149.2	49.8	-160.2	0	0	104.7
590	V	33.6	Very low	30.4	Very low	97 Å²	97	136.9 Å²	136.9	59%	0.588	71%	0.705	S	S	*	*				75.5	147.5	110.5	173.7	0	0	0	0	114.5
591	D	31.8	Very low	30.5	Very low	124 Å²	124	138.2 Å²	138.2	66%	0.663	71%	0.712	S	S	*	*			cis	-128.1	141.4	17.9	-116.6	-26.9	0	0	0	110
592	F	29.6	Very low	30.4	Very low	149 Å²	149	137.1 Å²	137.1	65%	0.654	71%	0.71	S	S	*	*				69.2	149.6	84.8	-79.6	-150.2	0	0	0	116.1
593	K	32.7	Very low	30.2	Very low	143 Å²	143	137 Å²	137	62%	0.622	71%	0.705	S	S	*	*			cis	-172.1	133.7	-26.9	-126.5	178.5	-168.2	154.4	0	110	V595	K593-V595 HydrophobicContact CB-CG2 3.82Å; K593-V595 HydrophobicContact CD-CG2 3.73Å; K593-V595 HydrophobicContact CG-CG2 3.74Å
594	S	32.4	Very low	30.1	Very low	119 Å²	119	134.6 Å²	134.6	83%	0.832	70%	0.703	S	S	*	*			trans	-148.6	87.2	149.4	42.8	0	0	0	0	107
595	V	28.7	Very low	29.9	Very low	95 Å²	95	135.9 Å²	135.9	58%	0.576	71%	0.705	S	S	*	*				57.6	97.5	71.3	-170.1	0	0	0	0	109.1	K593	K593-V595 HydrophobicContact CB-CG2 3.82Å; K593-V595 HydrophobicContact CD-CG2 3.73Å; K593-V595 HydrophobicContact CG-CG2 3.74Å
596	L	30.3	Very low	29.9	Very low	165 Å²	165	135.2 Å²	135.2	86%	0.864	71%	0.708	S	S	*	*			cis	79.7	55.5	47.2	-160	111	0	0	0	113.6
597	D	30.9	Very low	29.7	Very low	146 Å²	146	132.8 Å²	132.8	78%	0.781	70%	0.699	S	S	*	*			trans	-111.3	150.2	152.3	-86.2	-56.1	0	0	0	107.8
598	N	32.4	Very low	29.6	Very low	129 Å²	129	130.3 Å²	130.3	69%	0.69	69%	0.688	S	S	*	*			cis	-145.5	140.9	1.5	-162.5	-26.8	0	0	0	109
599	P	29.1	Very low	29.2	Very low	99 Å²	99	130.4 Å²	130.4	64%	0.643	68%	0.683	S	S	*	*			trans	-73.5	-168.2	173.4	-18	33.5	0	0	0	114.2
600	N	29.7	Very low	29.1	Very low	135 Å²	135	128.6 Å²	128.6	72%	0.722	69%	0.687	S	S	*	*			trans	83.4	67.9	166	-47.4	-56.5	0	0	0	118.5
601	N	26.7	Very low	28.8	Very low	157 Å²	157	128 Å²	128	84%	0.84	69%	0.687	S	S	*	*			trans	-149.1	105.5	136.1	-114	-27	0	0	0	106.6
602	V	26.9	Very low	28.7	Very low	108 Å²	108	129.2 Å²	129.2	66%	0.655	70%	0.699	S	S	*	*				67.2	83.2	62.7	-172.7	0	0	0	0	112.2
603	Q	27.5	Very low	28.7	Very low	153 Å²	153	127.5 Å²	127.5	72%	0.715	71%	0.706	S	S	*	*				70.7	105.9	122.6	-162.8	166.6	-19.1	0	0	119.4
604	Q	25.1	Very low	28.5	Very low	154 Å²	154	126.6 Å²	126.6	72%	0.72	71%	0.712	S	S	*	*			trans	73.6	172.6	160.4	-56.7	172.5	8.5	0	0	116.6
605	H	27.5	Very low	28.4	Very low	163 Å²	163	125.5 Å²	125.5	76%	0.755	69%	0.693	S	S	*	*			trans	72.8	111.2	168.7	-58	-82.4	0	0	0	122.1
606	K	24.4	Very low	28.6	Very low	196 Å²	196	126.6 Å²	126.6	85%	0.852	69%	0.693	S	S	*	*				63.8	171.9	127.7	-93.8	-153	162.5	-175	0	120.8
607	P	30.5	Very low	28.6	Very low	76 Å²	76	125.8 Å²	125.8	49%	0.494	69%	0.689	S	S	.	*			trans	-132.9	-152.1	-148.9	20.9	9.6	0	0	0	113.8
608	T	28	Very low	28.4	Very low	59 Å²	59	124.7 Å²	124.7	36%	0.362	68%	0.683	S	S	.	*			trans	101.8	119.5	177.2	-45.5	0	0	0	0	111.8	Q779 Q781	T608-Q779 HydrophobicContact CG2-CG 3.93Å; T608-Q781 PolarHBondContact OG1-OE1 3.26Å
609	I	26.1	Very low	28.2	Very low	125 Å²	125	124.6 Å²	124.6	64%	0.641	69%	0.687	S	S	*	*			cis	83.7	97.8	30.6	-51.2	173.7	0	0	0	115.2
610	S	28.2	Very low	28.2	Very low	108 Å²	108	124.6 Å²	124.6	76%	0.755	69%	0.689	S	S	*	*			trans	-167.2	139.8	151.3	-169.7	0	0	0	0	107.1
611	S	26.6	Very low	28	Very low	86 Å²	86	126.2 Å²	126.2	60%	0.601	70%	0.697	S	S	*	*			cis	152.9	150.6	-14.6	-89.7	0	0	0	0	104.7
612	T	30.1	Very low	28.3	Very low	148 Å²	148	126.3 Å²	126.3	91%	0.908	70%	0.696	S	S	*	*			trans	69	142	-166	76	0	0	0	0	114.2
613	S	29	Very low	28.6	Very low	113 Å²	113	127.1 Å²	127.1	79%	0.79	70%	0.704	S	S	*	*			cis	-130.2	150.1	-6.6	-168	0	0	0	0	110.7
614	T	29.4	Very low	28.9	Very low	124 Å²	124	128.6 Å²	128.6	76%	0.761	71%	0.713	S	S	*	*			trans	-105.9	119.8	-167.6	-58.7	0	0	0	0	111.9
615	F	30.1	Very low	29	Very low	97 Å²	97	126.8 Å²	126.8	43%	0.425	71%	0.708	S	S	.	*			trans	-139.3	108.3	167.4	-106.9	-85.8	0	0	0	113.7	P683 Q686	F615-P683 HydrophobicContact CD1-CB 4.35Å; F615-P683 VanDerWaalsContact CE1-CA 3.44Å; F615-P683 HydrophobicContact CE1-CB 3.75Å; F615-P683 HydrophobicContact CE2-CB 4.5Å; F615-P683 VanDerWaalsContact CZ-CA 3.43Å; F615-P683 HydrophobicContact CZ-CB 3.84Å; F615-Q686 HydrophobicContact CE1-CB 3.79Å; F615-Q686 HydrophobicContact CE1-CG 4.07Å; F615-Q686 HydrophobicContact CZ-CB 4.07Å; F615-Q686 HydrophobicContact CZ-CG 3.84Å
616	M	32.9	Very low	29.3	Very low	117 Å²	117	124.7 Å²	124.7	58%	0.576	71%	0.709	S	S	*	*			trans	-2.9	113.9	165	-64.4	-62	-145.9	0	0	118.7	L618	M616-L618 HydrophobicContact CB-CG 4.26Å; M616-L618 HydrophobicContact CE-CD1 4.03Å; M616-L618 HydrophobicContact CG-CD1 4.49Å; M616-L618 HydrophobicContact SD-CD1 4.04Å; M616-L618 HydrophobicContact SD-CD2 4.09Å; M616-L618 HydrophobicContact SD-CG 3.96Å
617	N	29.6	Very low	29.6	Very low	148 Å²	148	119.8 Å²	119.8	79%	0.791	70%	0.699	S	S	*	*			trans	-111.3	83.9	157.1	-155.8	-6.8	0	0	0	108.6	T619	N617-T619 PolarHBondContact O-N 3.01Å
618	L	26.2	Very low	29.6	Very low	123 Å²	123	124.8 Å²	124.8	64%	0.644	71%	0.714	S	S	*	*			trans	-92.1	80.6	-174.3	-71	179.5	0	0	0	111.4	M616	M616-L618 HydrophobicContact CB-CG 4.26Å; M616-L618 HydrophobicContact CE-CD1 4.03Å; M616-L618 HydrophobicContact CG-CD1 4.49Å; M616-L618 HydrophobicContact SD-CD1 4.04Å; M616-L618 HydrophobicContact SD-CD2 4.09Å; M616-L618 HydrophobicContact SD-CG 3.96Å
619	T	29.5	Very low	29.9	Very low	127 Å²	127	126.2 Å²	126.2	78%	0.779	72%	0.724	S	S	*	*			trans	-127	51.1	174.2	-40	0	0	0	0	111.1	N617	N617-T619 PolarHBondContact O-N 3.01Å
620	S	27.3	Very low	30.1	Very low	99 Å²	99	125.6 Å²	125.6	69%	0.692	73%	0.73	S	S	*	*			trans	-153.7	158.3	169.3	63.1	0	0	0	0	109.3
621	L	27.5	Very low	30.1	Very low	169 Å²	169	130.1 Å²	130.1	89%	0.885	74%	0.737	S	S	*	*			trans	73.7	68.1	-171.1	-50.7	179.3	0	0	0	115.8
622	I	32.1	Very low	30.1	Very low	160 Å²	160	131.9 Å²	131.9	82%	0.821	74%	0.739	S	S	*	*	S	Bend		-142.6	137.3	121.2	-93.3	150	0	0	0	106.2
623	P	33.3	Very low	30.1	Very low	125 Å²	125	129.4 Å²	129.4	81%	0.812	72%	0.72	S	S	*	*			trans	-66.6	150.9	-177.4	-22.1	34.6	0	0	0	113.6
624	M	33.1	Very low	30.1	Very low	183 Å²	183	131.2 Å²	131.2	90%	0.901	72%	0.716	S	S	*	*			trans	-81.8	143.6	-179.2	-68.5	-175	168.7	0	0	113.1
625	N	28.5	Very low	30.1	Very low	117 Å²	117	131.2 Å²	131.2	63%	0.626	71%	0.706	S	S	*	*			trans	-129	114.8	149.6	-166.5	-10.3	0	0	0	107.2	S627	N625-S627 PolarHBondContact O-N 3.29Å
626	P	33.7	Very low	30	Very low	119 Å²	119	132 Å²	132	77%	0.773	72%	0.72	S	S	*	*			trans	-90.9	90.2	-159.6	34	-35.8	0	0	0	113.7
627	S	29.8	Very low	29.8	Very low	92 Å²	92	132.2 Å²	132.2	64%	0.643	73%	0.734	S	S	*	*			trans	-145.5	31.2	175.3	62.5	0	0	0	0	115.8	N625	N625-S627 PolarHBondContact O-N 3.29Å
628	F	30.8	Very low	29.7	Very low	182 Å²	182	134.6 Å²	134.6	80%	0.798	73%	0.732	S	S	*	*	S	Bend	trans	-132.4	136.9	168.9	-75	-82.1	0	0	0	111.4	S630	F628-S630 PolarHBondContact O-N 2.88Å
629	P	34.1	Very low	29.9	Very low	88 Å²	88	137 Å²	137	57%	0.571	74%	0.744	S	S	*	*			trans	-67.1	122.1	168.7	28.8	-32.5	0	0	0	109	F631	P629-F631 PolarHBondContact O-N 3.39Å
630	S	29.7	Very low	30	Very low	112 Å²	112	139 Å²	139	78%	0.783	75%	0.745	S	S	*	*			trans	-66.5	118.1	-178.5	-55.5	0	0	0	0	110.9	F628 N632	F628-S630 PolarHBondContact O-N 2.88Å; S630-N632 PolarHBondContact O-N 3.23Å
631	F	28.2	Very low	30.1	Very low	204 Å²	204	137.9 Å²	137.9	90%	0.895	75%	0.749	S	S	*	*			trans	-66.4	80.2	166.8	-76.4	-80.5	0	0	0	110.1	P629 L633	P629-F631 PolarHBondContact O-N 3.39Å; F631-L633 VanDerWaalsContact C-N 3.3Å; F631-L633 PolarHBondContact O-N 2.98Å
632	N	27.8	Very low	30.4	Very low	122 Å²	122	136.3 Å²	136.3	65%	0.652	75%	0.746	S	S	*	*			trans	-79.3	79.9	-179.5	-168.6	6.5	0	0	0	110	S630 Q634	S630-N632 PolarHBondContact O-N 3.23Å; N632-Q634 PolarHBondContact ND2-OE1 3.1Å; N632-Q634 PolarHBondContact O-N 2.79Å
633	L	29.9	Very low	30.4	Very low	97 Å²	97	137 Å²	137	51%	0.508	75%	0.751	S	S	.	*			trans	-68.3	72.1	167.2	-79.4	173	0	0	0	109.9	F631 F635	F631-L633 VanDerWaalsContact C-N 3.3Å; F631-L633 PolarHBondContact O-N 2.98Å; L633-F635 HydrophobicContact CB-CD2 4.17Å; L633-F635 HydrophobicContact CB-CE2 3.84Å; L633-F635 HydrophobicContact CD1-CE2 4.23Å; L633-F635 HydrophobicContact CD2-CZ 4.46Å; L633-F635 HydrophobicContact CG-CE2 4.44Å; L633-F635 WeakPolarHBondContact O-CD2 3.47Å; L633-F635 PolarHBondContact O-N 3.34Å
634	Q	27.6	Very low	30.3	Very low	151 Å²	151	134.6 Å²	134.6	71%	0.706	75%	0.75	S	S	*	*			trans	-76.6	70.4	177.7	-169.5	162.2	-17.6	0	0	110.1	N632	N632-Q634 PolarHBondContact ND2-OE1 3.1Å; N632-Q634 PolarHBondContact O-N 2.79Å
635	F	29.5	Very low	30.4	Very low	124 Å²	124	129.6 Å²	129.6	54%	0.544	73%	0.73	S	S	.	*			trans	-53.1	132.8	171.9	-72.5	-77.4	0	0	0	110	L633 S637	L633-F635 HydrophobicContact CB-CD2 4.17Å; L633-F635 HydrophobicContact CB-CE2 3.84Å; L633-F635 HydrophobicContact CD1-CE2 4.23Å; L633-F635 HydrophobicContact CD2-CZ 4.46Å; L633-F635 HydrophobicContact CG-CE2 4.44Å; L633-F635 WeakPolarHBondContact O-CD2 3.47Å; L633-F635 PolarHBondContact O-N 3.34Å; F635-S637 PolarHBondContact O-N 3.03Å; F635-S637 PolarHBondContact O-OG 3Å
636	P	28.3	Very low	30.8	Very low	112 Å²	112	128.2 Å²	128.2	73%	0.727	73%	0.726	S	S	*	*			trans	-66	99.7	-171.8	25.6	-34.3	0	0	0	110.9	R638	P636-R638 PolarHBondContact O-N 3.38Å
637	S	28.2	Very low	31.1	Very low	122 Å²	122	126.2 Å²	126.2	85%	0.853	71%	0.707	S	S	*	*			trans	-79.8	39.6	-169.4	-11.3	0	0	0	0	112.8	F635	F635-S637 PolarHBondContact O-N 3.03Å; F635-S637 PolarHBondContact O-OG 3Å
638	R	28.3	Very low	31.8	Very low	199 Å²	199	127 Å²	127	75%	0.751	70%	0.704	S	S	*	*			trans	-158.7	84.1	177	-175	178.5	-81	-100.5	0.5	111.4	P636	P636-R638 PolarHBondContact O-N 3.38Å
639	L	30.4	Very low	32.3	Very low	173 Å²	173	123.1 Å²	123.1	91%	0.906	69%	0.692	S	S	*	*			trans	-127.9	105	151.1	-76.6	179.6	0	0	0	107.9
640	Q	31.9	Very low	32.7	Very low	169 Å²	169	121.1 Å²	121.1	79%	0.79	68%	0.676	S	S	*	*			trans	-106.5	98.5	-168.2	-177.3	175.4	-5.5	0	0	110.3
641	G	28.5	Very low	33.6	Very low	76 Å²	76	117.9 Å²	117.9	78%	0.784	65%	0.651	S	S	*	*			trans	57.8	78	154.3	0	0	0	0	0	118.7
642	T	34	Very low	34.3	Very low	135 Å²	135	112.4 Å²	112.4	83%	0.828	64%	0.639	S	S	*	*			trans	-134.5	150.1	146.2	50	0	0	0	0	109.7
643	N	32.3	Very low	35.1	Very low	174 Å²	174	109.8 Å²	109.8	93%	0.93	63%	0.634	S	S	*	*	S	Bend	trans	-69.8	142.8	-171.8	-58.3	-31.9	0	0	0	112.5
644	G	32.1	Very low	36	Very low	76 Å²	76	106 Å²	106	78%	0.784	62%	0.616	S	S	*	*			trans	96.5	45.4	159.2	0	0	0	0	0	118.3	T646	G644-T646 PolarHBondContact O-N 2.82Å
645	T	34.4	Very low	36.8	Very low	78 Å²	78	101.6 Å²	101.6	48%	0.479	60%	0.603	S	S	.	*			trans	-75.2	115.8	160	56.5	0	0	0	0	109.7	R726	T645-R726 PolarHBondContact OG1-NH2 3.49Å
646	T	37.8	Very low	37.8	Very low	88 Å²	88	99.5 Å²	99.5	54%	0.54	60%	0.603	S	S	.	*			trans	-73.6	173.6	171.9	54.8	0	0	0	0	111.2	G644 D648	G644-T646 PolarHBondContact O-N 2.82Å; T646-D648 WeakPolarHBondContact CB-OD2 3.31Å; T646-D648 PolarHBondContact O-N 3.48Å; T646-D648 VanDerWaalsContact O-N 3.16Å; T646-D648 PolarHBondContact OG1-OD2 3.36Å
647	M	40.3	Very low	39	Very low	76 Å²	76	99.8 Å²	99.8	37%	0.374	59%	0.593	S	S	.	*	H	α-helix	trans	-64.5	-17.8	-179.2	-172	162.3	175.7	0	0	112.9	D649 L650 T651 W663	M647-D649 VanDerWaalsContact C-N 3.33Å; M647-D649 PolarHBondContact O-N 2.84Å; M647-L650 PolarHBondContact O-N 3.3Å; M647-T651 WeakPolarHBondContact O-CB 3.37Å; M647-T651 PolarHBondContact O-N 3.47Å; M647-T651 PolarHBondContact O-OG1 2.88Å; M647-W663 HydrophobicContact CE-CB 4.15Å; M647-W663 HydrophobicContact CE-CE3 3.91Å
648	D	44.2	Very low	40.8	Very low	110 Å²	110	94.8 Å²	94.8	59%	0.588	56%	0.557	S	S	*	*	H	α-helix	trans	-61	-35	-179	-47.6	-81.5	0	0	0	113.2	T646 T651 S652	T646-D648 WeakPolarHBondContact CB-OD2 3.31Å; T646-D648 PolarHBondContact O-N 3.48Å; T646-D648 VanDerWaalsContact O-N 3.16Å; T646-D648 PolarHBondContact OG1-OD2 3.36Å; D648-T651 PolarHBondContact O-N 2.75Å; D648-S652 VanDerWaalsContact O-CB 3.28Å; D648-S652 WeakPolarHBondContact O-CB 3.39Å; D648-S652 PolarHBondContact O-N 2.91Å
649	D	41.7	Very low	42.9	Very low	100 Å²	100	87 Å²	87	54%	0.535	53%	0.532	S	S	.	.	H	α-helix	trans	-69.5	-44.5	177.1	-86.1	-29.6	0	0	0	112.2	M647 T651 S652 A653	M647-D649 VanDerWaalsContact C-N 3.33Å; M647-D649 PolarHBondContact O-N 2.84Å; D649-T651 VanDerWaalsContact C-N 3.31Å; D649-S652 PolarHBondContact O-N 2.81Å; D649-A653 WeakPolarHBondContact O-CB 3.07Å; D649-A653 PolarHBondContact O-N 3.31Å
650	L	41.8	Very low	44.9	Very low	46 Å²	46	83.3 Å²	83.3	24%	0.241	52%	0.519	C	S	.	.	H	α-helix	trans	-66	-38.9	175.6	-76.3	170.6	0	0	0	110.8	M647 A653 A654 L722	M647-L650 PolarHBondContact O-N 3.3Å; L650-A653 PolarHBondContact O-N 3.31Å; L650-A654 PolarHBondContact O-N 3.35Å; L650-L722 HydrophobicContact CD2-CD2 3.9Å
651	T	49.3	Very low	47.1	Very low	43 Å²	43	76.7 Å²	76.7	26%	0.264	50%	0.496	S	S	.	.	H	α-helix	trans	-63.4	-45.6	173.1	-50.3	0	0	0	0	110	M647 D648 D649 A653 A654 S655	M647-T651 WeakPolarHBondContact O-CB 3.37Å; M647-T651 PolarHBondContact O-N 3.47Å; M647-T651 PolarHBondContact O-OG1 2.88Å; D648-T651 PolarHBondContact O-N 2.75Å; D649-T651 VanDerWaalsContact C-N 3.31Å; T651-A653 VanDerWaalsContact C-N 3.35Å; T651-A653 PolarHBondContact O-N 3.29Å; T651-A654 PolarHBondContact O-N 2.93Å; T651-S655 WeakPolarHBondContact O-CA 3.37Å; T651-S655 WeakPolarHBondContact O-CB 3.39Å; T651-S655 PolarHBondContact O-N 3.16Å; T651-S655 PolarHBondContact O-OG 2.91Å
652	S	42.4	Very low	49.5	Very low	90 Å²	90	73.1 Å²	73.1	63%	0.629	46%	0.459	S	S	*	.	H	α-helix	trans	-65.6	-34.2	178.8	-170.5	0	0	0	0	113.1	D648 D649	D648-S652 VanDerWaalsContact O-CB 3.28Å; D648-S652 WeakPolarHBondContact O-CB 3.39Å; D648-S652 PolarHBondContact O-N 2.91Å; D649-S652 PolarHBondContact O-N 2.81Å
653	A	44.3	Very low	51.6	Low	66 Å²	66	67.8 Å²	67.8	55%	0.545	42%	0.423	S	S	.	.	H	α-helix	trans	-76.7	-20.7	-179.4	0	0	0	0	0	114.1	D649 L650 T651	D649-A653 WeakPolarHBondContact O-CB 3.07Å; D649-A653 PolarHBondContact O-N 3.31Å; L650-A653 PolarHBondContact O-N 3.31Å; T651-A653 VanDerWaalsContact C-N 3.35Å; T651-A653 PolarHBondContact O-N 3.29Å
654	A	48.3	Very low	53.6	Low	18 Å²	18	62.8 Å²	62.8	15%	0.149	40%	0.402	C	S	.	.	H	α-helix	trans	-130	-8.7	-173.2	0	0	0	0	0	115.5	L650 T651 S656 F657 L658 W663	L650-A654 PolarHBondContact O-N 3.35Å; T651-A654 PolarHBondContact O-N 2.93Å; A654-S656 PolarHBondContact O-N 3.42Å; A654-F657 PolarHBondContact O-N 2.97Å; A654-L658 PolarHBondContact O-N 2.86Å; A654-W663 HydrophobicContact CB-CH2 4.17Å; A654-W663 HydrophobicContact CB-CZ2 3.55Å
655	S	45.9	Very low	55.8	Low	59 Å²	59	60.6 Å²	60.6	41%	0.413	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-14.6	170.3	56.5	0	0	0	0	113.7	T651 F657 L658	T651-S655 WeakPolarHBondContact O-CA 3.37Å; T651-S655 WeakPolarHBondContact O-CB 3.39Å; T651-S655 PolarHBondContact O-N 3.16Å; T651-S655 PolarHBondContact O-OG 2.91Å; S655-F657 PolarHBondContact O-N 2.99Å; S655-L658 WeakPolarHBondContact CA-O 3.47Å
656	S	48.7	Very low	58	Low	79 Å²	79	57.1 Å²	57.1	55%	0.552	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-24.9	164.7	45.3	0	0	0	0	113.1	A654	A654-S656 PolarHBondContact O-N 3.42Å
657	F	53.5	Low	59.9	Low	119 Å²	119	54.2 Å²	54.2	52%	0.522	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.3	-25.2	-179.1	-60.3	-69.6	0	0	0	114	A654 S655 Q708	A654-F657 PolarHBondContact O-N 2.97Å; S655-F657 PolarHBondContact O-N 2.99Å; F657-Q708 PolarHBondContact O-NE2 2.93Å
658	L	66.4	Low	61.5	Low	17 Å²	17	56.5 Å²	56.5	9%	0.089	34%	0.344	C	S	.	.	S	Bend	trans	-121.6	124	-169.8	-65.7	168.4	0	0	0	112.2	A654 S655 F662 W663 V701 L719	A654-L658 PolarHBondContact O-N 2.86Å; S655-L658 WeakPolarHBondContact CA-O 3.47Å; L658-F662 HydrophobicContact CB-CD1 3.95Å; L658-F662 HydrophobicContact CB-CG 4.47Å; L658-F662 HydrophobicContact CD1-CD1 4.02Å; L658-F662 HydrophobicContact CD1-CE1 3.78Å; L658-F662 HydrophobicContact CD1-CZ 4.41Å; L658-F662 HydrophobicContact CD2-CD1 4.41Å; L658-F662 HydrophobicContact CD2-CG 4.49Å; L658-F662 HydrophobicContact CG-CD1 4.35Å; L658-W663 HydrophobicContact CB-CZ2 4.37Å; L658-W663 HydrophobicContact CD1-CZ2 3.93Å; L658-V701 HydrophobicContact CD2-CG1 4.25Å; L658-V701 HydrophobicContact CD2-CG2 3.71Å; L658-L719 HydrophobicContact CD1-CD1 3.75Å
659	S	72.8	Confident	63	Low	34 Å²	34	54.6 Å²	54.6	24%	0.238	33%	0.329	C	S	.	.			trans	-52.1	144.1	-180	175.2	0	0	0	0	113	G661 F662	S659-G661 PolarHBondContact O-N 2.85Å; S659-G661 PolarHBondContact OG-N 2.86Å; S659-F662 WeakPolarHBondContact O-CB 3.31Å; S659-F662 PolarHBondContact O-N 3.29Å
660	P	72.2	Confident	64.6	Low	97 Å²	97	50.2 Å²	50.2	63%	0.63	31%	0.306	S	S	*	.	H	α-helix	trans	-53.2	-27	170.5	-27.4	35.9	0	0	0	114	W663 S664	P660-W663 PolarHBondContact O-N 2.91Å; P660-S664 PolarHBondContact O-N 2.96Å; P660-S664 PolarHBondContact O-OG 2.93Å; P660-S664 VanDerWaalsContact O-OG 3.11Å
661	G	77.7	Confident	66.2	Low	29 Å²	29	52.2 Å²	52.2	30%	0.299	32%	0.316	S	S	.	.	H	α-helix	trans	-62.8	-40.3	172.1	0	0	0	0	0	113.2	S659 W663 S664 V665	S659-G661 PolarHBondContact O-N 2.85Å; S659-G661 PolarHBondContact OG-N 2.86Å; G661-W663 PolarHBondContact O-N 3.41Å; G661-S664 PolarHBondContact O-N 2.93Å; G661-V665 WeakPolarHBondContact O-CG2 3.36Å; G661-V665 PolarHBondContact O-N 3.23Å; G661-V665 VanDerWaalsContact O-N 3.1Å
662	F	79.8	Confident	67.3	Low	2 Å²	2	57.2 Å²	57.2	1%	0.009	34%	0.341	C	S	.	.	H	α-helix	trans	-60.4	-44	176	167.9	-95.2	0	0	0	111.4	L658 S659 S664 V665 L666 L697 L700 V701 L719	L658-F662 HydrophobicContact CB-CD1 3.95Å; L658-F662 HydrophobicContact CB-CG 4.47Å; L658-F662 HydrophobicContact CD1-CD1 4.02Å; L658-F662 HydrophobicContact CD1-CE1 3.78Å; L658-F662 HydrophobicContact CD1-CZ 4.41Å; L658-F662 HydrophobicContact CD2-CD1 4.41Å; L658-F662 HydrophobicContact CD2-CG 4.49Å; L658-F662 HydrophobicContact CG-CD1 4.35Å; S659-F662 WeakPolarHBondContact O-CB 3.31Å; S659-F662 PolarHBondContact O-N 3.29Å; F662-S664 VanDerWaalsContact C-N 3.33Å; F662-S664 PolarHBondContact O-N 3.29Å; F662-V665 PolarHBondContact O-N 2.89Å; F662-L666 HydrophobicContact CE1-CB 4.4Å; F662-L666 HydrophobicContact CE1-CD2 3.79Å; F662-L666 HydrophobicContact CZ-CB 4.42Å; F662-L666 HydrophobicContact CZ-CD2 3.96Å; F662-L666 VanDerWaalsContact O-CB 3.27Å; F662-L666 WeakPolarHBondContact O-CB 3.48Å; F662-L666 PolarHBondContact O-N 2.93Å; F662-L697 HydrophobicContact CZ-CD2 4.39Å; F662-L700 HydrophobicContact CE2-CB 4.24Å; F662-L700 HydrophobicContact CE2-CD2 4.22Å; F662-V701 HydrophobicContact CD2-CB 4.45Å; F662-V701 HydrophobicContact CD2-CG2 3.56Å; F662-V701 HydrophobicContact CE2-CG2 3.43Å; F662-V701 VanDerWaalsContact CE2-CG2 3.43Å; F662-V701 HydrophobicContact CG-CG2 4.4Å; F662-V701 HydrophobicContact CZ-CG2 4.19Å; F662-L719 HydrophobicContact CZ-CD1 4.37Å
663	W	78.1	Confident	68.4	Low	22 Å²	22	58.2 Å²	58.2	8%	0.083	34%	0.335	C	S	.	.	H	α-helix	trans	-65.4	-35.6	179.2	-66.3	102.8	0	0	0	113	M647 A654 L658 P660 G661 L666 T667 L719	M647-W663 HydrophobicContact CE-CB 4.15Å; M647-W663 HydrophobicContact CE-CE3 3.91Å; A654-W663 HydrophobicContact CB-CH2 4.17Å; A654-W663 HydrophobicContact CB-CZ2 3.55Å; L658-W663 HydrophobicContact CB-CZ2 4.37Å; L658-W663 HydrophobicContact CD1-CZ2 3.93Å; P660-W663 PolarHBondContact O-N 2.91Å; G661-W663 PolarHBondContact O-N 3.41Å; W663-L666 HydrophobicContact CE3-CD2 3.85Å; W663-L666 HydrophobicContact CH2-CD2 4.44Å; W663-L666 HydrophobicContact CZ3-CD2 3.61Å; W663-T667 WeakPolarHBondContact O-CB 3.29Å; W663-T667 PolarHBondContact O-N 3.46Å; W663-T667 PolarHBondContact O-OG1 2.91Å; W663-L719 HydrophobicContact CH2-CD2 4.4Å
664	S	73.9	Confident	69.3	Low	70 Å²	70	58.9 Å²	58.9	49%	0.49	33%	0.334	S	S	.	.	H	α-helix	trans	-65.4	-42.4	175.5	-59.7	0	0	0	0	111.6	P660 G661 F662 T667 Q668	P660-S664 PolarHBondContact O-N 2.96Å; P660-S664 PolarHBondContact O-OG 2.93Å; P660-S664 VanDerWaalsContact O-OG 3.11Å; G661-S664 PolarHBondContact O-N 2.93Å; F662-S664 VanDerWaalsContact C-N 3.33Å; F662-S664 PolarHBondContact O-N 3.29Å; S664-T667 WeakPolarHBondContact O-CB 3.27Å; S664-Q668 PolarHBondContact O-N 2.78Å
665	V	78.3	Confident	69.8	Low	29 Å²	29	60.1 Å²	60.1	18%	0.176	34%	0.341	C	S	.	.	H	α-helix	trans	-78.2	-34.8	178.9	-174.1	0	0	0	0	112.1	G661 F662 T667 Q668 Y669 L700	G661-V665 WeakPolarHBondContact O-CG2 3.36Å; G661-V665 PolarHBondContact O-N 3.23Å; G661-V665 VanDerWaalsContact O-N 3.1Å; F662-V665 PolarHBondContact O-N 2.89Å; V665-T667 VanDerWaalsContact C-N 3.26Å; V665-T667 PolarHBondContact O-N 3.47Å; V665-Q668 PolarHBondContact O-N 3.23Å; V665-Q668 VanDerWaalsContact O-N 3.14Å; V665-Y669 WeakPolarHBondContact O-CB 3.33Å; V665-Y669 PolarHBondContact O-N 2.91Å; V665-L700 HydrophobicContact CG1-CD1 3.81Å; V665-L700 HydrophobicContact CG1-CD2 4.29Å; V665-L700 HydrophobicContact CG1-CG 4.19Å
666	L	80.3	Confident	70.2	Confident	5 Å²	5	61.6 Å²	61.6	3%	0.026	35%	0.351	C	S	.	.	H	α-helix	trans	-59.3	-39.8	170.8	179.6	60.5	0	0	0	111.2	F662 W663 Y669 L670 L697 L700 L723	F662-L666 HydrophobicContact CE1-CB 4.4Å; F662-L666 HydrophobicContact CE1-CD2 3.79Å; F662-L666 HydrophobicContact CZ-CB 4.42Å; F662-L666 HydrophobicContact CZ-CD2 3.96Å; F662-L666 VanDerWaalsContact O-CB 3.27Å; F662-L666 WeakPolarHBondContact O-CB 3.48Å; F662-L666 PolarHBondContact O-N 2.93Å; W663-L666 HydrophobicContact CE3-CD2 3.85Å; W663-L666 HydrophobicContact CH2-CD2 4.44Å; W663-L666 HydrophobicContact CZ3-CD2 3.61Å; L666-Y669 PolarHBondContact O-N 3.04Å; L666-L670 HydrophobicContact CD1-CD1 3.88Å; L666-L670 HydrophobicContact CD1-CG 3.99Å; L666-L670 HydrophobicContact CG-CD1 3.9Å; L666-L670 HydrophobicContact CG-CG 4.41Å; L666-L670 WeakPolarHBondContact O-CB 3.38Å; L666-L670 WeakPolarHBondContact O-CG 3.4Å; L666-L670 PolarHBondContact O-N 3.28Å; L666-L697 HydrophobicContact CD1-CD2 3.41Å; L666-L697 VanDerWaalsContact CD1-CD2 3.41Å; L666-L700 HydrophobicContact CB-CD2 4.21Å; L666-L700 HydrophobicContact CD1-CD2 4.34Å; L666-L723 HydrophobicContact CD1-CD1 4.19Å; L666-L723 HydrophobicContact CD2-CD1 4.36Å
667	T	77.2	Confident	70.4	Confident	27 Å²	27	62 Å²	62	17%	0.166	36%	0.359	C	S	.	.	H	α-helix	trans	-61.2	-44.2	173.7	-60.8	0	0	0	0	111.7	W663 S664 V665 N671 L730	W663-T667 WeakPolarHBondContact O-CB 3.29Å; W663-T667 PolarHBondContact O-N 3.46Å; W663-T667 PolarHBondContact O-OG1 2.91Å; S664-T667 WeakPolarHBondContact O-CB 3.27Å; V665-T667 VanDerWaalsContact C-N 3.26Å; V665-T667 PolarHBondContact O-N 3.47Å; T667-N671 WeakPolarHBondContact O-CB 3.39Å; T667-N671 PolarHBondContact O-N 2.99Å; T667-N671 VanDerWaalsContact O-N 3.15Å; T667-L730 HydrophobicContact CG2-CD1 4Å
668	Q	75.5	Confident	70	Confident	124 Å²	124	64 Å²	64	58%	0.579	38%	0.375	S	S	*	.	H	α-helix	trans	-64.7	-43.1	174.4	-68.9	178.5	5.1	0	0	111.9	S664 V665 N671 L672	S664-Q668 PolarHBondContact O-N 2.78Å; V665-Q668 PolarHBondContact O-N 3.23Å; V665-Q668 VanDerWaalsContact O-N 3.14Å; Q668-N671 PolarHBondContact O-N 3.11Å; Q668-L672 WeakPolarHBondContact O-CB 3.43Å; Q668-L672 WeakPolarHBondContact O-CG 3.15Å; Q668-L672 PolarHBondContact O-N 3.45Å
669	Y	74.5	Confident	69.1	Low	71 Å²	71	70 Å²	70	28%	0.278	40%	0.403	S	S	.	.	H	α-helix	trans	-62.4	-45.9	-179.7	-168.9	-94.2	0	0	0	112	V665 L666 N671 L672 H673 Q696	V665-Y669 WeakPolarHBondContact O-CB 3.33Å; V665-Y669 PolarHBondContact O-N 2.91Å; L666-Y669 PolarHBondContact O-N 3.04Å; Y669-N671 VanDerWaalsContact C-N 3.33Å; Y669-N671 PolarHBondContact O-N 3.49Å; Y669-L672 PolarHBondContact O-N 3.49Å; Y669-H673 HydrophobicContact CE1-CB 4.26Å; Y669-H673 AromaticContact CZ-ND1 3.96Å; Y669-H673 PolarHBondContact O-N 2.74Å; Y669-H673 PolarHBondContact OH-ND1 2.79Å; Y669-Q696 PolarHBondContact OH-OE1 2.66Å
670	L	75	Confident	67.9	Low	8 Å²	8	75.7 Å²	75.7	4%	0.042	44%	0.436	C	S	.	.	H	α-helix	trans	-70.8	-25.5	178.5	-67.2	171.4	0	0	0	113.3	L666 H673 P674 L723 L730	L666-L670 HydrophobicContact CD1-CD1 3.88Å; L666-L670 HydrophobicContact CD1-CG 3.99Å; L666-L670 HydrophobicContact CG-CD1 3.9Å; L666-L670 HydrophobicContact CG-CG 4.41Å; L666-L670 WeakPolarHBondContact O-CB 3.38Å; L666-L670 WeakPolarHBondContact O-CG 3.4Å; L666-L670 PolarHBondContact O-N 3.28Å; L670-H673 CarbonylContact O-C 3.49Å; L670-P674 WeakPolarHBondContact O-CA 3Å; L670-L723 HydrophobicContact CD1-CD1 4.33Å; L670-L723 HydrophobicContact CD1-CD2 3.89Å; L670-L730 HydrophobicContact CB-CD1 4.38Å; L670-L730 HydrophobicContact CD1-CD1 4.24Å
671	N	75.4	Confident	67.3	Low	87 Å²	87	72.3 Å²	72.3	47%	0.465	42%	0.415	S	S	.	.	H	α-helix	trans	-75.8	-33.4	169.9	-96.5	-21.1	0	0	0	112.8	T667 Q668 Y669 L730	T667-N671 WeakPolarHBondContact O-CB 3.39Å; T667-N671 PolarHBondContact O-N 2.99Å; T667-N671 VanDerWaalsContact O-N 3.15Å; Q668-N671 PolarHBondContact O-N 3.11Å; Y669-N671 VanDerWaalsContact C-N 3.33Å; Y669-N671 PolarHBondContact O-N 3.49Å; N671-L730 PolarHBondContact OD1-O 3.05Å
672	L	74	Confident	67.3	Low	149 Å²	149	74.8 Å²	74.8	78%	0.78	43%	0.425	S	S	*	.	H	α-helix	trans	-77.2	-30.2	174.8	-77.7	161.2	0	0	0	112.6	Q668 Y669	Q668-L672 WeakPolarHBondContact O-CB 3.43Å; Q668-L672 WeakPolarHBondContact O-CG 3.15Å; Q668-L672 PolarHBondContact O-N 3.45Å; Y669-L672 PolarHBondContact O-N 3.49Å
673	H	65.6	Low	66.8	Low	110 Å²	110	77.7 Å²	77.7	51%	0.509	44%	0.443	S	S	.	.	S	Bend	trans	-137.3	74.5	-175.4	-158.5	-169.9	0	0	0	110.8	Y669 L670	Y669-H673 HydrophobicContact CE1-CB 4.26Å; Y669-H673 AromaticContact CZ-ND1 3.96Å; Y669-H673 PolarHBondContact O-N 2.74Å; Y669-H673 PolarHBondContact OH-ND1 2.79Å; L670-H673 CarbonylContact O-C 3.49Å
674	P	62.9	Low	66.4	Low	81 Å²	81	83.6 Å²	83.6	53%	0.526	47%	0.474	S	S	.	.			trans	-65.4	136.2	178.5	26.6	-34.5	0	0	0	110.9	L670 S676	L670-P674 WeakPolarHBondContact O-CA 3Å; P674-S676 PolarHBondContact O-N 3.17Å
675	P	58.3	Low	66.7	Low	44 Å²	44	84.8 Å²	84.8	29%	0.286	47%	0.472	S	S	.	.			trans	-62.9	131.8	-179.2	24.8	-33.4	0	0	0	111.3	A677	P675-A677 VanDerWaalsContact C-N 3.31Å; P675-A677 PolarHBondContact O-N 3.21Å
676	S	53.6	Low	66.5	Low	90 Å²	90	86.9 Å²	86.9	63%	0.629	48%	0.479	S	S	*	.			trans	-77.3	74	-171.6	-158	0	0	0	0	112.5	P674 N678 Q679	P674-S676 PolarHBondContact O-N 3.17Å; S676-N678 PolarHBondContact O-N 3.4Å; S676-Q679 PolarHBondContact OG-NE2 2.97Å
677	A	53.3	Low	66.5	Low	88 Å²	88	91.2 Å²	91.2	73%	0.727	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-0.2	-170.3	0	0	0	0	0	116.6	P675	P675-A677 VanDerWaalsContact C-N 3.31Å; P675-A677 PolarHBondContact O-N 3.21Å
678	N	45.2	Very low	66.8	Low	160 Å²	160	92.1 Å²	92.1	86%	0.856	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.7	33.8	-166.8	-79.8	-20.6	0	0	0	114.4	S676	S676-N678 PolarHBondContact O-N 3.4Å
679	Q	47.7	Very low	66.9	Low	144 Å²	144	89.7 Å²	89.7	67%	0.673	50%	0.501	S	S	*	.	S	Bend	trans	-127.7	142	173.8	-68.5	-170.1	78.8	0	0	112.5	S676 S681	S676-Q679 PolarHBondContact OG-NE2 2.97Å; Q679-S681 PolarHBondContact O-N 2.85Å; Q679-S681 PolarHBondContact O-OG 2.76Å
680	T	48	Very low	67.5	Low	152 Å²	152	87.3 Å²	87.3	93%	0.933	49%	0.494	S	S	*	.			trans	-78.5	61.9	-176	-38.9	0	0	0	0	111.4
681	S	59.8	Low	68	Low	26 Å²	26	89.2 Å²	89.2	18%	0.182	51%	0.511	C	S	.	.			trans	-68	136.3	-175.7	38.8	0	0	0	0	112.6	Q679 Q685 Q686	Q679-S681 PolarHBondContact O-N 2.85Å; Q679-S681 PolarHBondContact O-OG 2.76Å; S681-Q685 VanDerWaalsContact CB-CG 3.47Å; S681-Q686 WeakPolarHBondContact OG-CG 3.45Å; S681-Q686 PolarHBondContact OG-NE2 3.09Å; S681-Q686 VanDerWaalsContact OG-NE2 3.11Å
682	T	76	Confident	68.5	Low	82 Å²	82	90.9 Å²	90.9	50%	0.503	52%	0.516	S	S	.	.			trans	-68.2	163.5	176.7	70.4	0	0	0	0	111.6	M684 Q685 Q686	T682-M684 PolarHBondContact O-N 2.8Å; T682-Q685 WeakPolarHBondContact O-CA 3.41Å; T682-Q685 WeakPolarHBondContact O-CB 3.34Å; T682-Q685 PolarHBondContact O-N 3.02Å; T682-Q685 WeakPolarHBondContact OG1-CB 3.39Å; T682-Q685 PolarHBondContact OG1-N 3.4Å; T682-Q686 PolarHBondContact O-N 2.85Å
683	P	71.3	Confident	69.1	Low	62 Å²	62	85 Å²	85	40%	0.403	49%	0.485	S	S	.	.	H	α-helix	trans	-62.8	-21	176.4	21	-32.1	0	0	0	115.6	F615 L687	F615-P683 HydrophobicContact CD1-CB 4.35Å; F615-P683 VanDerWaalsContact CE1-CA 3.44Å; F615-P683 HydrophobicContact CE1-CB 3.75Å; F615-P683 HydrophobicContact CE2-CB 4.5Å; F615-P683 VanDerWaalsContact CZ-CA 3.43Å; F615-P683 HydrophobicContact CZ-CB 3.84Å; P683-L687 WeakPolarHBondContact O-CB 3.3Å
684	M	68.3	Low	70.2	Confident	147 Å²	147	80.2 Å²	80.2	72%	0.724	46%	0.464	S	S	*	.	H	α-helix	trans	-75.1	-39.8	167.5	-69.1	-68.1	-70.2	0	0	111.6	T682 A688	T682-M684 PolarHBondContact O-N 2.8Å; M684-A688 WeakPolarHBondContact O-CB 3.29Å; M684-A688 PolarHBondContact O-N 3.5Å
685	Q	79.7	Confident	71.4	Confident	94 Å²	94	79.4 Å²	79.4	44%	0.439	46%	0.464	S	S	.	.	H	α-helix	trans	-66.5	-50.2	-177.5	-175.8	71.4	29.1	0	0	111.9	S681 T682 L687 A688 E689	S681-Q685 VanDerWaalsContact CB-CG 3.47Å; T682-Q685 WeakPolarHBondContact O-CA 3.41Å; T682-Q685 WeakPolarHBondContact O-CB 3.34Å; T682-Q685 PolarHBondContact O-N 3.02Å; T682-Q685 WeakPolarHBondContact OG1-CB 3.39Å; T682-Q685 PolarHBondContact OG1-N 3.4Å; Q685-L687 VanDerWaalsContact C-N 3.29Å; Q685-L687 PolarHBondContact O-N 3.17Å; Q685-A688 WeakPolarHBondContact O-CB 3.29Å; Q685-A688 PolarHBondContact O-N 3.04Å; Q685-A688 VanDerWaalsContact O-N 3.15Å; Q685-E689 VanDerWaalsContact CG-OE1 3.29Å; Q685-E689 WeakPolarHBondContact CG-OE1 3.29Å; Q685-E689 PolarHBondContact NE2-OE1 2.73Å; Q685-E689 WeakPolarHBondContact O-CG 3.48Å; Q685-E689 PolarHBondContact O-N 2.95Å
686	Q	75.5	Confident	72.7	Confident	73 Å²	73	80.4 Å²	80.4	34%	0.341	47%	0.465	S	S	.	.	H	α-helix	trans	-64.8	-33.7	178.2	-67.2	-170.1	1.7	0	0	112.7	F615 S681 T682 T690	F615-Q686 HydrophobicContact CE1-CB 3.79Å; F615-Q686 HydrophobicContact CE1-CG 4.07Å; F615-Q686 HydrophobicContact CZ-CB 4.07Å; F615-Q686 HydrophobicContact CZ-CG 3.84Å; S681-Q686 WeakPolarHBondContact OG-CG 3.45Å; S681-Q686 PolarHBondContact OG-NE2 3.09Å; S681-Q686 VanDerWaalsContact OG-NE2 3.11Å; T682-Q686 PolarHBondContact O-N 2.85Å; Q686-T690 VanDerWaalsContact O-CB 3.31Å; Q686-T690 WeakPolarHBondContact O-CB 3.12Å; Q686-T690 PolarHBondContact O-N 3.38Å; Q686-T690 PolarHBondContact O-OG1 2.79Å
687	L	79.1	Confident	74.2	Confident	97 Å²	97	76.3 Å²	76.3	51%	0.508	44%	0.436	S	S	.	.	H	α-helix	trans	-67.3	-40.4	174.7	-177.1	61	0	0	0	111	P683 Q685 A691	P683-L687 WeakPolarHBondContact O-CB 3.3Å; Q685-L687 VanDerWaalsContact C-N 3.29Å; Q685-L687 PolarHBondContact O-N 3.17Å; L687-A691 VanDerWaalsContact O-CB 3.27Å; L687-A691 WeakPolarHBondContact O-CB 3.46Å; L687-A691 PolarHBondContact O-N 3.31Å
688	A	83.3	Confident	75.7	Confident	46 Å²	46	73.6 Å²	73.6	38%	0.38	41%	0.414	S	S	.	.	H	α-helix	trans	-65.4	-44	173.8	0	0	0	0	0	112.3	M684 Q685 A691 Q692	M684-A688 WeakPolarHBondContact O-CB 3.29Å; M684-A688 PolarHBondContact O-N 3.5Å; Q685-A688 WeakPolarHBondContact O-CB 3.29Å; Q685-A688 PolarHBondContact O-N 3.04Å; Q685-A688 VanDerWaalsContact O-N 3.15Å; A688-A691 PolarHBondContact O-N 3.34Å; A688-Q692 WeakPolarHBondContact O-CB 3.23Å; A688-Q692 WeakPolarHBondContact O-CG 3.26Å; A688-Q692 PolarHBondContact O-N 3.46Å
689	E	79.4	Confident	77.4	Confident	73 Å²	73	69.1 Å²	69.1	34%	0.341	40%	0.4	S	S	.	.	H	α-helix	trans	-62.2	-43.7	175.9	-73.2	161.9	180	0	0	111.4	Q685 Q692 L693	Q685-E689 VanDerWaalsContact CG-OE1 3.29Å; Q685-E689 WeakPolarHBondContact CG-OE1 3.29Å; Q685-E689 PolarHBondContact NE2-OE1 2.73Å; Q685-E689 WeakPolarHBondContact O-CG 3.48Å; Q685-E689 PolarHBondContact O-N 2.95Å; E689-Q692 PolarHBondContact O-N 2.98Å; E689-L693 WeakPolarHBondContact O-CB 3.09Å; E689-L693 PolarHBondContact O-N 2.9Å
690	T	85.3	Confident	78.8	Confident	20 Å²	20	63.3 Å²	63.3	12%	0.123	37%	0.373	C	S	.	.	H	α-helix	trans	-63.5	-41.5	174.7	-54.6	0	0	0	0	111.6	Q686 A694 L717 A720 Q721 I724	Q686-T690 VanDerWaalsContact O-CB 3.31Å; Q686-T690 WeakPolarHBondContact O-CB 3.12Å; Q686-T690 PolarHBondContact O-N 3.38Å; Q686-T690 PolarHBondContact O-OG1 2.79Å; T690-A694 VanDerWaalsContact O-CB 3.29Å; T690-A694 WeakPolarHBondContact O-CB 3.38Å; T690-A694 PolarHBondContact O-N 3.31Å; T690-L717 HydrophobicContact CG2-CD1 3.94Å; T690-A720 HydrophobicContact CG2-CB 4.1Å; T690-Q721 HydrophobicContact CG2-CG 3.88Å; T690-I724 HydrophobicContact CG2-CD1 4.13Å; T690-I724 WeakPolarHBondContact OG1-CD1 2.96Å
691	A	86.4	Confident	80	Confident	49 Å²	49	56.2 Å²	56.2	41%	0.405	33%	0.329	S	S	.	.	H	α-helix	trans	-70.2	-36.9	178	0	0	0	0	0	112.7	L687 A688 A695	L687-A691 VanDerWaalsContact O-CB 3.27Å; L687-A691 WeakPolarHBondContact O-CB 3.46Å; L687-A691 PolarHBondContact O-N 3.31Å; A688-A691 PolarHBondContact O-N 3.34Å; A691-A695 WeakPolarHBondContact O-CB 3.25Å; A691-A695 PolarHBondContact O-N 2.93Å
692	Q	85.7	Confident	80.4	Confident	122 Å²	122	57.3 Å²	57.3	57%	0.57	34%	0.344	S	S	*	.	H	α-helix	trans	-65.2	-45.6	173.1	-78.4	-179.8	-20.9	0	0	111.2	A688 E689 A695 Q696	A688-Q692 WeakPolarHBondContact O-CB 3.23Å; A688-Q692 WeakPolarHBondContact O-CG 3.26Å; A688-Q692 PolarHBondContact O-N 3.46Å; E689-Q692 PolarHBondContact O-N 2.98Å; Q692-A695 PolarHBondContact O-N 2.96Å; Q692-Q696 WeakPolarHBondContact O-CG 3.38Å; Q692-Q696 PolarHBondContact O-N 2.88Å
693	L	87.3	Confident	79.8	Confident	26 Å²	26	56.7 Å²	56.7	14%	0.136	34%	0.344	C	S	.	.	H	α-helix	trans	-65.8	-39.6	177.4	-164.5	147.3	0	0	0	110.8	E689 A695 Q696 L697 A720 L723	E689-L693 WeakPolarHBondContact O-CB 3.09Å; E689-L693 PolarHBondContact O-N 2.9Å; L693-A695 PolarHBondContact O-N 2.93Å; L693-Q696 PolarHBondContact O-N 3.28Å; L693-L697 HydrophobicContact CD2-CD1 3.68Å; L693-L697 HydrophobicContact CD2-CG 3.99Å; L693-L697 VanDerWaalsContact O-CG 3.27Å; L693-L697 WeakPolarHBondContact O-CG 3.29Å; L693-L697 PolarHBondContact O-N 3.08Å; L693-A720 HydrophobicContact CB-CB 4.38Å; L693-A720 HydrophobicContact CD2-CB 3.54Å; L693-L723 HydrophobicContact CD2-CD1 4.25Å
694	A	88.8	Confident	79.4	Confident	8 Å²	8	57.6 Å²	57.6	7%	0.066	34%	0.342	C	S	.	.	H	α-helix	trans	-58.7	-45.2	170.8	0	0	0	0	0	112.4	T690 Q696 L697 A698 A716 L717 A720	T690-A694 VanDerWaalsContact O-CB 3.29Å; T690-A694 WeakPolarHBondContact O-CB 3.38Å; T690-A694 PolarHBondContact O-N 3.31Å; A694-Q696 VanDerWaalsContact C-N 3.35Å; A694-Q696 PolarHBondContact O-N 2.78Å; A694-L697 PolarHBondContact O-N 2.98Å; A694-A698 WeakPolarHBondContact O-CB 3.46Å; A694-A698 PolarHBondContact O-N 3.21Å; A694-A716 HydrophobicContact CB-CB 4.16Å; A694-A716 WeakPolarHBondContact O-CB 3.27Å; A694-L717 HydrophobicContact CB-CD1 4.34Å; A694-A720 HydrophobicContact CB-CB 3.93Å
695	A	86.7	Confident	78.9	Confident	64 Å²	64	51.7 Å²	51.7	53%	0.529	32%	0.316	S	S	.	.	H	α-helix	trans	-63.6	-38.6	176.7	0	0	0	0	0	112.6	A691 Q692 L693 A698 A699	A691-A695 WeakPolarHBondContact O-CB 3.25Å; A691-A695 PolarHBondContact O-N 2.93Å; Q692-A695 PolarHBondContact O-N 2.96Å; L693-A695 PolarHBondContact O-N 2.93Å; A695-A698 PolarHBondContact O-N 3.12Å; A695-A699 PolarHBondContact O-N 3.18Å
696	Q	86.2	Confident	77.9	Confident	65 Å²	65	52.8 Å²	52.8	30%	0.304	33%	0.331	S	S	.	.	H	α-helix	trans	-63.4	-46.4	174.2	-68.7	156.1	15.9	0	0	111.3	Y669 Q692 L693 A694 A698 A699 L700	Y669-Q696 PolarHBondContact OH-OE1 2.66Å; Q692-Q696 WeakPolarHBondContact O-CG 3.38Å; Q692-Q696 PolarHBondContact O-N 2.88Å; L693-Q696 PolarHBondContact O-N 3.28Å; A694-Q696 VanDerWaalsContact C-N 3.35Å; A694-Q696 PolarHBondContact O-N 2.78Å; Q696-A698 PolarHBondContact O-N 3.4Å; Q696-A699 PolarHBondContact O-N 2.74Å; Q696-L700 WeakPolarHBondContact O-CB 3.4Å; Q696-L700 PolarHBondContact O-N 3.43Å
697	L	86	Confident	77.2	Confident	4 Å²	4	57.2 Å²	57.2	2%	0.021	36%	0.357	C	S	.	.	H	α-helix	trans	-61.6	-41.8	176	-67.2	175.6	0	0	0	112.3	F662 L666 L693 A694 A699 L700 V701 M711 L719 A720 L723	F662-L697 HydrophobicContact CZ-CD2 4.39Å; L666-L697 HydrophobicContact CD1-CD2 3.41Å; L666-L697 VanDerWaalsContact CD1-CD2 3.41Å; L693-L697 HydrophobicContact CD2-CD1 3.68Å; L693-L697 HydrophobicContact CD2-CG 3.99Å; L693-L697 VanDerWaalsContact O-CG 3.27Å; L693-L697 WeakPolarHBondContact O-CG 3.29Å; L693-L697 PolarHBondContact O-N 3.08Å; A694-L697 PolarHBondContact O-N 2.98Å; L697-A699 VanDerWaalsContact C-N 3.35Å; L697-A699 PolarHBondContact O-N 3Å; L697-L700 PolarHBondContact O-N 3.04Å; L697-L700 VanDerWaalsContact O-N 3.17Å; L697-V701 PolarHBondContact O-N 3.35Å; L697-V701 VanDerWaalsContact O-N 3.07Å; L697-M711 VanDerWaalsContact C-CE 3.44Å; L697-M711 HydrophobicContact CB-CE 3.72Å; L697-M711 WeakPolarHBondContact O-CE 3.41Å; L697-L719 HydrophobicContact CD1-CB 3.73Å; L697-A720 HydrophobicContact CD1-CB 4.13Å; L697-L723 HydrophobicContact CD1-CD1 4.1Å; L697-L723 HydrophobicContact CD2-CD1 4.06Å
698	A	83.4	Confident	76.3	Confident	31 Å²	31	55.8 Å²	55.8	26%	0.256	35%	0.348	S	S	.	.	H	α-helix	trans	-63	-40.6	177.5	0	0	0	0	0	112	A694 A695 Q696 G702 A716	A694-A698 WeakPolarHBondContact O-CB 3.46Å; A694-A698 PolarHBondContact O-N 3.21Å; A695-A698 PolarHBondContact O-N 3.12Å; Q696-A698 PolarHBondContact O-N 3.4Å; A698-G702 PolarHBondContact O-N 2.84Å; A698-A716 HydrophobicContact CB-CB 4.09Å
699	A	81.9	Confident	75.6	Confident	67 Å²	67	59.3 Å²	59.3	55%	0.554	36%	0.364	S	S	*	.	H	α-helix	trans	-64.6	-38.2	172	0	0	0	0	0	112.3	A695 Q696 L697 G702 S703	A695-A699 PolarHBondContact O-N 3.18Å; Q696-A699 PolarHBondContact O-N 2.74Å; L697-A699 VanDerWaalsContact C-N 3.35Å; L697-A699 PolarHBondContact O-N 3Å; A699-G702 PolarHBondContact O-N 2.92Å; A699-G702 VanDerWaalsContact O-N 3.17Å; A699-S703 PolarHBondContact O-N 3.43Å
700	L	77.3	Confident	75.2	Confident	21 Å²	21	60.5 Å²	60.5	11%	0.11	38%	0.379	C	S	.	.	H	α-helix	trans	-68.8	-32.9	-178	-153.5	72.5	0	0	0	113.6	F662 V665 L666 Q696 L697 S703 H704	F662-L700 HydrophobicContact CE2-CB 4.24Å; F662-L700 HydrophobicContact CE2-CD2 4.22Å; V665-L700 HydrophobicContact CG1-CD1 3.81Å; V665-L700 HydrophobicContact CG1-CD2 4.29Å; V665-L700 HydrophobicContact CG1-CG 4.19Å; L666-L700 HydrophobicContact CB-CD2 4.21Å; L666-L700 HydrophobicContact CD1-CD2 4.34Å; Q696-L700 WeakPolarHBondContact O-CB 3.4Å; Q696-L700 PolarHBondContact O-N 3.43Å; L697-L700 PolarHBondContact O-N 3.04Å; L697-L700 VanDerWaalsContact O-N 3.17Å; L700-S703 PolarHBondContact O-OG 2.98Å; L700-H704 PolarHBondContact O-CD2 2.87Å
701	V	72.6	Confident	75	Confident	4 Å²	4	60.3 Å²	60.3	2%	0.024	38%	0.377	C	S	.	.	H	α-helix	trans	-64.7	-46.5	169.2	175.6	0	0	0	0	109.8	L658 F662 L697 S703 H704 S705 M711	L658-V701 HydrophobicContact CD2-CG1 4.25Å; L658-V701 HydrophobicContact CD2-CG2 3.71Å; F662-V701 HydrophobicContact CD2-CB 4.45Å; F662-V701 HydrophobicContact CD2-CG2 3.56Å; F662-V701 HydrophobicContact CE2-CG2 3.43Å; F662-V701 VanDerWaalsContact CE2-CG2 3.43Å; F662-V701 HydrophobicContact CG-CG2 4.4Å; F662-V701 HydrophobicContact CZ-CG2 4.19Å; L697-V701 PolarHBondContact O-N 3.35Å; L697-V701 VanDerWaalsContact O-N 3.07Å; V701-S703 VanDerWaalsContact C-N 3.25Å; V701-S703 PolarHBondContact O-N 2.91Å; V701-H704 PolarHBondContact O-N 3.37Å; V701-S705 PolarHBondContact O-N 3.26Å; V701-M711 HydrophobicContact CB-CB 4.18Å; V701-M711 HydrophobicContact CG1-CB 4.28Å; V701-M711 HydrophobicContact CG2-CB 4.02Å; V701-M711 HydrophobicContact CG2-CE 3.63Å; V701-M711 HydrophobicContact CG2-SD 4.13Å
702	G	67.7	Low	74.8	Confident	48 Å²	48	63.2 Å²	63.2	50%	0.495	38%	0.382	S	S	.	.	H	α-helix	trans	-61.8	-25.3	179.4	0	0	0	0	0	115	A698 A699	A698-G702 PolarHBondContact O-N 2.84Å; A699-G702 PolarHBondContact O-N 2.92Å; A699-G702 VanDerWaalsContact O-N 3.17Å
703	S	63.7	Low	74.7	Confident	70 Å²	70	62.3 Å²	62.3	49%	0.49	39%	0.386	S	S	.	.	H	α-helix	trans	-89.4	-15.1	178	65.3	0	0	0	0	114.9	A699 L700 V701	A699-S703 PolarHBondContact O-N 3.43Å; L700-S703 PolarHBondContact O-OG 2.98Å; V701-S703 VanDerWaalsContact C-N 3.25Å; V701-S703 PolarHBondContact O-N 2.91Å
704	H	63.5	Low	74.6	Confident	81 Å²	81	65 Å²	65	38%	0.375	41%	0.407	S	S	.	.	H	α-helix	trans	-119.8	0.3	-173	-69.7	-60.9	0	0	0	116.2	L700 V701	L700-H704 PolarHBondContact O-CD2 2.87Å; V701-H704 PolarHBondContact O-N 3.37Å
705	S	56.9	Low	74.5	Confident	23 Å²	23	67.9 Å²	67.9	16%	0.161	42%	0.42	C	S	.	.			trans	-153.8	96	159.5	-73.2	0	0	0	0	110.1	V701 D707 Q708	V701-S705 PolarHBondContact O-N 3.26Å; S705-D707 PolarHBondContact O-N 2.85Å; S705-Q708 PolarHBondContact O-N 2.95Å
706	P	58.8	Low	74.6	Confident	117 Å²	117	65 Å²	65	76%	0.76	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-19	-179.4	27.6	-35.3	0	0	0	113.4
707	D	61.7	Low	74.7	Confident	166 Å²	166	64.8 Å²	64.8	89%	0.888	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-5.8	173.9	-58	-55.2	0	0	0	113.6	S705	S705-D707 PolarHBondContact O-N 2.85Å
708	Q	60.1	Low	74.8	Confident	67 Å²	67	66.3 Å²	66.3	31%	0.313	41%	0.409	S	S	.	.	S	Bend	trans	-86.7	145.3	171.9	-75.7	-161.6	-46.2	0	0	110.9	F657 S705	F657-Q708 PolarHBondContact O-NE2 2.93Å; S705-Q708 PolarHBondContact O-N 2.95Å
709	T	68.1	Low	75	Confident	119 Å²	119	66 Å²	66	73%	0.73	40%	0.403	S	S	*	.	P	Polyproline II helix	trans	-60.1	138.9	172.4	46.1	0	0	0	0	110.2	M711	T709-M711 PolarHBondContact O-N 3.16Å
710	P	72	Confident	75.3	Confident	99 Å²	99	62.8 Å²	62.8	64%	0.643	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-59.7	128.1	176.4	25.1	-33.7	0	0	0	109.2	Q712	P710-Q712 PolarHBondContact O-N 3.29Å
711	M	80	Confident	75.6	Confident	16 Å²	16	66.9 Å²	66.9	8%	0.079	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-56	128.4	-175	178.4	165.4	53.1	0	0	110.8	L697 V701 T709 Q715 A716 L719	L697-M711 VanDerWaalsContact C-CE 3.44Å; L697-M711 HydrophobicContact CB-CE 3.72Å; L697-M711 WeakPolarHBondContact O-CE 3.41Å; V701-M711 HydrophobicContact CB-CB 4.18Å; V701-M711 HydrophobicContact CG1-CB 4.28Å; V701-M711 HydrophobicContact CG2-CB 4.02Å; V701-M711 HydrophobicContact CG2-CE 3.63Å; V701-M711 HydrophobicContact CG2-SD 4.13Å; T709-M711 PolarHBondContact O-N 3.16Å; M711-Q715 HydrophobicContact CG-CB 3.56Å; M711-Q715 HydrophobicContact SD-CB 4.05Å; M711-A716 HydrophobicContact CE-CB 3.83Å; M711-A716 HydrophobicContact CG-CB 4.22Å; M711-A716 HydrophobicContact SD-CB 4.32Å; M711-L719 HydrophobicContact CE-CD1 4.41Å; M711-L719 HydrophobicContact SD-CD1 3.83Å
712	Q	82.6	Confident	76	Confident	109 Å²	109	69.8 Å²	69.8	51%	0.509	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-61.3	143.7	-177.6	-71	-66	-38	0	0	110.5	P710 S714 Q715 A716	P710-Q712 PolarHBondContact O-N 3.29Å; Q712-S714 PolarHBondContact O-N 2.8Å; Q712-Q715 HydrophobicContact CB-CB 4.39Å; Q712-Q715 HydrophobicContact CB-CG 4.11Å; Q712-Q715 WeakPolarHBondContact O-CA 3.36Å; Q712-Q715 WeakPolarHBondContact O-CB 3.34Å; Q712-Q715 PolarHBondContact O-N 2.91Å; Q712-A716 PolarHBondContact O-N 2.92Å
713	P	83.7	Confident	76.7	Confident	103 Å²	103	68.7 Å²	68.7	67%	0.669	39%	0.393	S	S	*	.	H	α-helix	trans	-54.2	-31.1	179.6	-28.4	35.7	0	0	0	113.7	L717	P713-L717 VanDerWaalsContact O-CB 3.27Å; P713-L717 WeakPolarHBondContact O-CB 3.32Å; P713-L717 PolarHBondContact O-N 3.48Å
714	S	83.8	Confident	77.3	Confident	83 Å²	83	68.9 Å²	68.9	58%	0.58	39%	0.388	S	S	*	.	H	α-helix	trans	-69.1	-41.5	173.4	50.3	0	0	0	0	113.7	Q712 A718	Q712-S714 PolarHBondContact O-N 2.8Å; S714-A718 VanDerWaalsContact O-CB 3.32Å; S714-A718 WeakPolarHBondContact O-CB 3.29Å; S714-A718 PolarHBondContact O-N 3.33Å
715	Q	86.9	Confident	77.8	Confident	69 Å²	69	69.1 Å²	69.1	32%	0.322	40%	0.404	S	S	.	.	H	α-helix	trans	-66.1	-42.7	174.1	-68.6	169	-31.7	0	0	110.9	M711 Q712 A718 L719	M711-Q715 HydrophobicContact CG-CB 3.56Å; M711-Q715 HydrophobicContact SD-CB 4.05Å; Q712-Q715 HydrophobicContact CB-CB 4.39Å; Q712-Q715 HydrophobicContact CB-CG 4.11Å; Q712-Q715 WeakPolarHBondContact O-CA 3.36Å; Q712-Q715 WeakPolarHBondContact O-CB 3.34Å; Q712-Q715 PolarHBondContact O-N 2.91Å; Q715-A718 PolarHBondContact O-N 3.47Å; Q715-L719 PolarHBondContact O-N 2.9Å
716	A	89.1	Confident	78.2	Confident	2 Å²	2	73.9 Å²	73.9	2%	0.017	42%	0.419	C	S	.	.	H	α-helix	trans	-62.4	-43.5	176.7	0	0	0	0	0	111.9	A694 A698 M711 Q712 A720	A694-A716 HydrophobicContact CB-CB 4.16Å; A694-A716 WeakPolarHBondContact O-CB 3.27Å; A698-A716 HydrophobicContact CB-CB 4.09Å; M711-A716 HydrophobicContact CE-CB 3.83Å; M711-A716 HydrophobicContact CG-CB 4.22Å; M711-A716 HydrophobicContact SD-CB 4.32Å; Q712-A716 PolarHBondContact O-N 2.92Å; A716-A720 WeakPolarHBondContact O-CB 3.22Å; A716-A720 PolarHBondContact O-N 2.95Å
717	L	89.7	Confident	77.9	Confident	61 Å²	61	70.8 Å²	70.8	32%	0.319	41%	0.407	S	S	.	.	H	α-helix	trans	-65	-41.3	174.3	-166.1	78.6	0	0	0	111.8	T690 A694 P713 A720 Q721	T690-L717 HydrophobicContact CG2-CD1 3.94Å; A694-L717 HydrophobicContact CB-CD1 4.34Å; P713-L717 VanDerWaalsContact O-CB 3.27Å; P713-L717 WeakPolarHBondContact O-CB 3.32Å; P713-L717 PolarHBondContact O-N 3.48Å; L717-A720 PolarHBondContact O-N 3.45Å; L717-Q721 WeakPolarHBondContact O-CB 3.43Å; L717-Q721 VanDerWaalsContact O-CG 3.29Å; L717-Q721 WeakPolarHBondContact O-CG 3.19Å; L717-Q721 PolarHBondContact O-N 3.32Å
718	A	87	Confident	77.4	Confident	37 Å²	37	64.7 Å²	64.7	31%	0.306	38%	0.376	S	S	.	.	H	α-helix	trans	-65	-42.5	178.4	0	0	0	0	0	112.3	S714 Q715 L722	S714-A718 VanDerWaalsContact O-CB 3.32Å; S714-A718 WeakPolarHBondContact O-CB 3.29Å; S714-A718 PolarHBondContact O-N 3.33Å; Q715-A718 PolarHBondContact O-N 3.47Å; A718-L722 WeakPolarHBondContact O-CB 3.36Å; A718-L722 PolarHBondContact O-N 3.05Å
719	L	86.8	Confident	76.4	Confident	23 Å²	23	64 Å²	64	12%	0.12	39%	0.387	C	S	.	.	H	α-helix	trans	-66	-39.1	172.2	-78.2	-178.8	0	0	0	112.2	L658 F662 W663 L697 M711 Q715 L722 L723	L658-L719 HydrophobicContact CD1-CD1 3.75Å; F662-L719 HydrophobicContact CZ-CD1 4.37Å; W663-L719 HydrophobicContact CH2-CD2 4.4Å; L697-L719 HydrophobicContact CD1-CB 3.73Å; M711-L719 HydrophobicContact CE-CD1 4.41Å; M711-L719 HydrophobicContact SD-CD1 3.83Å; Q715-L719 PolarHBondContact O-N 2.9Å; L719-L722 HydrophobicContact CD2-CD2 4.43Å; L719-L722 PolarHBondContact O-N 3.28Å; L719-L723 WeakPolarHBondContact O-CB 3.44Å; L719-L723 WeakPolarHBondContact O-CG 3.43Å; L719-L723 PolarHBondContact O-N 3.37Å
720	A	88.7	Confident	74.9	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-61.8	-47.4	176.3	0	0	0	0	0	111.6	T690 L693 A694 L697 A716 L717 L722 L723 I724	T690-A720 HydrophobicContact CG2-CB 4.1Å; L693-A720 HydrophobicContact CB-CB 4.38Å; L693-A720 HydrophobicContact CD2-CB 3.54Å; A694-A720 HydrophobicContact CB-CB 3.93Å; L697-A720 HydrophobicContact CD1-CB 4.13Å; A716-A720 WeakPolarHBondContact O-CB 3.22Å; A716-A720 PolarHBondContact O-N 2.95Å; L717-A720 PolarHBondContact O-N 3.45Å; A720-L722 VanDerWaalsContact C-N 3.32Å; A720-L722 PolarHBondContact O-N 3.23Å; A720-L723 PolarHBondContact O-N 2.75Å; A720-I724 WeakPolarHBondContact O-CB 2.94Å; A720-I724 WeakPolarHBondContact O-CD1 3.34Å; A720-I724 VanDerWaalsContact O-CG1 3.25Å; A720-I724 WeakPolarHBondContact O-CG1 3.3Å; A720-I724 PolarHBondContact O-N 3.05Å
721	Q	84	Confident	72.9	Confident	107 Å²	107	58.8 Å²	58.8	50%	0.5	36%	0.364	S	S	.	.	H	α-helix	trans	-59.8	-40.6	173.8	-73.4	174.4	-13.5	0	0	111.9	T690 L717 A725	T690-Q721 HydrophobicContact CG2-CG 3.88Å; L717-Q721 WeakPolarHBondContact O-CB 3.43Å; L717-Q721 VanDerWaalsContact O-CG 3.29Å; L717-Q721 WeakPolarHBondContact O-CG 3.19Å; L717-Q721 PolarHBondContact O-N 3.32Å; Q721-A725 WeakPolarHBondContact O-CB 3.31Å; Q721-A725 PolarHBondContact O-N 3.27Å
722	L	81.8	Confident	70.5	Confident	66 Å²	66	63.2 Å²	63.2	35%	0.346	40%	0.396	S	S	.	.	H	α-helix	trans	-66.6	-41.9	178.5	-174.3	64.1	0	0	0	112.7	L650 A718 L719 A720 R726	L650-L722 HydrophobicContact CD2-CD2 3.9Å; A718-L722 WeakPolarHBondContact O-CB 3.36Å; A718-L722 PolarHBondContact O-N 3.05Å; L719-L722 HydrophobicContact CD2-CD2 4.43Å; L719-L722 PolarHBondContact O-N 3.28Å; A720-L722 VanDerWaalsContact C-N 3.32Å; A720-L722 PolarHBondContact O-N 3.23Å; L722-R726 HydrophobicContact CD1-CG 4.26Å; L722-R726 WeakPolarHBondContact O-CB 3.47Å; L722-R726 WeakPolarHBondContact O-CG 3.2Å; L722-R726 PolarHBondContact O-N 3.08Å
723	L	81.2	Confident	67.8	Low	25 Å²	25	65 Å²	65	13%	0.131	41%	0.408	C	S	.	.	H	α-helix	trans	-67.6	-43.6	177.5	-72.6	171.6	0	0	0	111.8	L666 L670 L693 L697 L719 A720 G727	L666-L723 HydrophobicContact CD1-CD1 4.19Å; L666-L723 HydrophobicContact CD2-CD1 4.36Å; L670-L723 HydrophobicContact CD1-CD1 4.33Å; L670-L723 HydrophobicContact CD1-CD2 3.89Å; L693-L723 HydrophobicContact CD2-CD1 4.25Å; L697-L723 HydrophobicContact CD1-CD1 4.1Å; L697-L723 HydrophobicContact CD2-CD1 4.06Å; L719-L723 WeakPolarHBondContact O-CB 3.44Å; L719-L723 WeakPolarHBondContact O-CG 3.43Å; L719-L723 PolarHBondContact O-N 3.37Å; A720-L723 PolarHBondContact O-N 2.75Å; L723-G727 PolarHBondContact O-N 2.84Å; L723-G727 VanDerWaalsContact O-N 3.12Å
724	I	77.8	Confident	65.2	Low	73 Å²	73	67.1 Å²	67.1	37%	0.374	41%	0.414	S	S	.	.	H	α-helix	trans	-64.3	-47.6	176.1	-68.1	166.1	0	0	0	110.3	T690 A720 R726 G727	T690-I724 HydrophobicContact CG2-CD1 4.13Å; T690-I724 WeakPolarHBondContact OG1-CD1 2.96Å; A720-I724 WeakPolarHBondContact O-CB 2.94Å; A720-I724 WeakPolarHBondContact O-CD1 3.34Å; A720-I724 VanDerWaalsContact O-CG1 3.25Å; A720-I724 WeakPolarHBondContact O-CG1 3.3Å; A720-I724 PolarHBondContact O-N 3.05Å; I724-R726 VanDerWaalsContact C-N 3.31Å; I724-R726 PolarHBondContact O-N 2.86Å; I724-G727 PolarHBondContact O-N 3.49Å
725	A	73.3	Confident	62.5	Low	87 Å²	87	69.6 Å²	69.6	72%	0.719	43%	0.426	S	S	*	.	H	α-helix	trans	-68.5	-24.7	-178.7	0	0	0	0	0	114.2	Q721	Q721-A725 WeakPolarHBondContact O-CB 3.31Å; Q721-A725 PolarHBondContact O-N 3.27Å
726	R	64.1	Low	59.8	Low	123 Å²	123	75.5 Å²	75.5	46%	0.464	45%	0.453	S	S	.	.	H	α-helix	trans	-93.7	-5	174.9	-65.7	-177.1	91.4	97.4	-5.2	113.7	T645 L722 I724 V728	T645-R726 PolarHBondContact OG1-NH2 3.49Å; L722-R726 HydrophobicContact CD1-CG 4.26Å; L722-R726 WeakPolarHBondContact O-CB 3.47Å; L722-R726 WeakPolarHBondContact O-CG 3.2Å; L722-R726 PolarHBondContact O-N 3.08Å; I724-R726 VanDerWaalsContact C-N 3.31Å; I724-R726 PolarHBondContact O-N 2.86Å; R726-V728 VanDerWaalsContact C-N 3.28Å; R726-V728 HydrophobicContact CB-CG2 3.42Å; R726-V728 VanDerWaalsContact CB-CG2 3.42Å; R726-V728 PolarHBondContact O-N 3.39Å
727	G	53.7	Low	57	Low	51 Å²	51	81.8 Å²	81.8	53%	0.526	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.4	34.6	174.2	0	0	0	0	0	114.6	L723 I724 G729	L723-G727 PolarHBondContact O-N 2.84Å; L723-G727 VanDerWaalsContact O-N 3.12Å; I724-G727 PolarHBondContact O-N 3.49Å; G727-G729 PolarHBondContact O-N 2.79Å
728	V	50.3	Low	54.3	Low	38 Å²	38	85.1 Å²	85.1	23%	0.23	52%	0.517	C	S	.	.			trans	-79.1	82.1	-160.7	-161.7	0	0	0	0	113.1	R726 L730	R726-V728 VanDerWaalsContact C-N 3.28Å; R726-V728 HydrophobicContact CB-CG2 3.42Å; R726-V728 VanDerWaalsContact CB-CG2 3.42Å; R726-V728 PolarHBondContact O-N 3.39Å; V728-L730 HydrophobicContact CG1-CD2 3.62Å; V728-L730 HydrophobicContact CG1-CG 4Å; V728-L730 PolarHBondContact O-N 2.84Å
729	G	40.4	Very low	51.3	Low	52 Å²	52	87.9 Å²	87.9	54%	0.536	54%	0.54	S	S	.	.			trans	-76.3	111.1	160.6	0	0	0	0	0	110.5	G727 G731	G727-G729 PolarHBondContact O-N 2.79Å; G729-G731 PolarHBondContact O-N 3.14Å
730	L	36	Very low	48.9	Very low	46 Å²	46	92.1 Å²	92.1	24%	0.241	57%	0.571	C	S	.	*			trans	-80.4	43.9	-176.4	-67.4	170.9	0	0	0	113.5	T667 L670 N671 V728	T667-L730 HydrophobicContact CG2-CD1 4Å; L670-L730 HydrophobicContact CB-CD1 4.38Å; L670-L730 HydrophobicContact CD1-CD1 4.24Å; N671-L730 PolarHBondContact OD1-O 3.05Å; V728-L730 HydrophobicContact CG1-CD2 3.62Å; V728-L730 HydrophobicContact CG1-CG 4Å; V728-L730 PolarHBondContact O-N 2.84Å
731	G	29.5	Very low	46.1	Very low	64 Å²	64	100.6 Å²	100.6	66%	0.66	62%	0.617	S	S	*	*			trans	-76.8	131.1	176.4	0	0	0	0	0	112.5	G729	G729-G731 PolarHBondContact O-N 3.14Å
732	S	29.8	Very low	43.5	Very low	108 Å²	108	98.9 Å²	98.9	76%	0.755	63%	0.628	S	S	*	*			trans	84.1	62.2	175.3	-165	0	0	0	0	117.7
733	I	26.7	Very low	40.9	Very low	146 Å²	146	103.4 Å²	103.4	75%	0.749	65%	0.651	S	S	*	*			trans	-91.7	91.4	143.7	17.5	172.8	0	0	0	108.8
734	N	28.3	Very low	38.3	Very low	149 Å²	149	108.5 Å²	108.5	80%	0.797	68%	0.678	S	S	*	*			trans	-117.4	131.6	164.2	-88.4	-29.5	0	0	0	108.7
735	T	28.1	Very low	36	Very low	135 Å²	135	110.5 Å²	110.5	83%	0.828	69%	0.694	S	S	*	*			trans	-69.8	127.6	178.2	47.6	0	0	0	0	111.8
736	E	29.8	Very low	33.9	Very low	193 Å²	193	111 Å²	111	90%	0.902	69%	0.692	S	S	*	*			trans	-161.8	120.1	143.2	-116.6	165.8	-163.7	0	0	111.5
737	T	29	Very low	32.4	Very low	133 Å²	133	114 Å²	114	82%	0.816	71%	0.709	S	S	*	*			trans	-89.2	121.8	176.5	44.6	0	0	0	0	111	A739	T737-A739 PolarHBondContact O-N 3.01Å
738	P	33.7	Very low	31.3	Very low	131 Å²	131	119.9 Å²	119.9	85%	0.851	72%	0.72	S	S	*	*			trans	-79	98.8	168	31.2	-31.6	0	0	0	110
739	A	25.2	Very low	30.6	Very low	96 Å²	96	124 Å²	124	79%	0.793	74%	0.74	S	S	*	*			trans	-91.5	118	171	0	0	0	0	0	110.7	T737	T737-A739 PolarHBondContact O-N 3.01Å
740	S	35.1	Very low	30.2	Very low	112 Å²	112	130.8 Å²	130.8	78%	0.783	76%	0.755	S	S	*	*			trans	-143.1	127.1	169.9	58.1	0	0	0	0	111.3
741	N	29.5	Very low	30	Very low	177 Å²	177	133.4 Å²	133.4	95%	0.947	78%	0.775	S	S	*	*			trans	-83.1	149.3	-173.7	-57.1	-63.7	0	0	0	112.6
742	G	30.6	Very low	29.9	Very low	71 Å²	71	134.3 Å²	134.3	73%	0.732	77%	0.771	S	S	*	*			trans	164	74	176.7	0	0	0	0	0	111.6
743	L	26.9	Very low	29.8	Very low	161 Å²	161	135.6 Å²	135.6	84%	0.843	77%	0.77	S	S	*	*				73.2	130.4	72.3	-174.1	61.6	0	0	0	113.6
744	L	27.4	Very low	29.8	Very low	132 Å²	132	134.7 Å²	134.7	69%	0.691	77%	0.766	S	S	*	*			trans	70.1	99.3	168	-73.7	165	0	0	0	119.4
745	T	28.8	Very low	29.8	Very low	115 Å²	115	135.8 Å²	135.8	71%	0.706	77%	0.766	S	S	*	*				80.6	144.3	123.6	57.3	0	0	0	0	123
746	S	28.7	Very low	29.7	Very low	99 Å²	99	134.4 Å²	134.4	69%	0.692	76%	0.761	S	S	*	*			trans	83.2	117.4	136.4	-84.5	0	0	0	0	119.4
747	K	33.7	Very low	29.6	Very low	186 Å²	186	131 Å²	131	81%	0.809	75%	0.748	S	S	*	*			trans	74.6	127.4	158.6	-59.4	175.6	-179.1	178.8	0	114
748	K	29.1	Very low	29.4	Very low	173 Å²	173	129.6 Å²	129.6	75%	0.752	75%	0.75	S	S	*	*			cis	72.7	141.8	45.2	-167.5	-169.2	157.1	174.8	0	110.6
749	D	35.9	Very low	28.9	Very low	124 Å²	124	129.1 Å²	129.1	66%	0.663	74%	0.74	S	S	*	*			trans	76.6	62	175.6	-53	-38.3	0	0	0	114.8
750	K	31.7	Very low	29	Very low	196 Å²	196	128.8 Å²	128.8	85%	0.852	73%	0.732	S	S	*	*				-57.9	162.5	127.9	-133.7	-162.1	176.5	-175.7	0	108.6
751	P	32.9	Very low	28.3	Very low	100 Å²	100	127.6 Å²	127.6	65%	0.649	72%	0.724	S	S	*	*			cis	-125.1	-119.4	-4.1	40.9	-23.1	0	0	0	109.8
752	S	26.1	Very low	28	Very low	84 Å²	84	125.4 Å²	125.4	59%	0.587	71%	0.711	S	S	*	*			trans	67	116.2	156	47.8	0	0	0	0	118.1
753	D	27.9	Very low	27.7	Very low	135 Å²	135	130.1 Å²	130.1	72%	0.722	71%	0.712	S	S	*	*				95.4	113.7	126.1	-60.6	6.5	0	0	0	119.3
754	N	28.4	Very low	27.6	Very low	126 Å²	126	129.5 Å²	129.5	67%	0.674	70%	0.704	S	S	*	*			trans	88.2	106.6	139.2	-58.4	-0.6	0	0	0	115.9
755	E	27.5	Very low	27.6	Very low	172 Å²	172	128.7 Å²	128.7	80%	0.804	71%	0.705	S	S	*	*				70.2	92.2	71.5	-174.3	-157.1	167.5	0	0	109.7
756	C	26.5	Very low	27.9	Very low	107 Å²	107	127 Å²	127	72%	0.723	70%	0.697	S	S	*	*			trans	-158.7	135.4	164.9	-104.5	0	0	0	0	110.8
757	I	27.2	Very low	28.3	Very low	120 Å²	120	130.2 Å²	130.2	62%	0.615	70%	0.702	S	S	*	*			trans	58.5	91.7	138.4	-54.5	167	0	0	0	113.4	N759	I757-N759 HydrophobicContact CG2-CB 3.87Å; I757-N759 WeakPolarHBondContact CG2-ND2 3.23Å
758	A	24	Very low	28.4	Very low	105 Å²	105	128.3 Å²	128.3	87%	0.868	70%	0.699	S	S	*	*			cis	50.1	54.3	43.4	0	0	0	0	0	112.6
759	N	24.8	Very low	28.8	Very low	120 Å²	120	125.5 Å²	125.5	64%	0.642	70%	0.701	S	S	*	*			trans	-134.3	132.4	158.5	-98.4	-42.4	0	0	0	108.2	I757	I757-N759 HydrophobicContact CG2-CB 3.87Å; I757-N759 WeakPolarHBondContact CG2-ND2 3.23Å
760	S	26	Very low	28.8	Very low	89 Å²	89	123.2 Å²	123.2	62%	0.622	70%	0.699	S	S	*	*				60.3	92	77.4	-46.6	0	0	0	0	109.4
761	S	21.2	Very low	29.1	Very low	88 Å²	88	120.4 Å²	120.4	62%	0.615	70%	0.698	S	S	*	*				94.7	110.6	76.8	68.6	0	0	0	0	111.5
762	I	22.3	Very low	29.2	Very low	131 Å²	131	121.5 Å²	121.5	67%	0.672	70%	0.699	S	S	*	*			trans	65.1	149.8	145.6	-35.8	149.9	0	0	0	116.2
763	F	24.2	Very low	29.7	Very low	170 Å²	170	123 Å²	123	75%	0.746	70%	0.697	S	S	*	*			trans	69.9	162.3	172.7	-38.2	-75.4	0	0	0	114
764	H	25.3	Very low	30	Very low	148 Å²	148	125.1 Å²	125.1	69%	0.685	69%	0.694	S	S	*	*			cis	-146.2	130	8.8	-146.5	-69.4	0	0	0	111.1
765	T	28.2	Very low	30.3	Very low	115 Å²	115	128.7 Å²	128.7	71%	0.706	70%	0.698	S	S	*	*			trans	60.5	151.3	157	35.3	0	0	0	0	118.4
766	S	34.7	Very low	30.7	Very low	78 Å²	78	126.4 Å²	126.4	55%	0.545	69%	0.688	S	S	.	*			cis	-145.3	143.6	-0.9	-97.2	0	0	0	0	108.6
767	E	36.2	Very low	31	Very low	167 Å²	167	128.9 Å²	128.9	78%	0.78	69%	0.688	S	S	*	*				59.4	143.9	102.6	-44.8	171	95.3	0	0	114.7
768	I	37.1	Very low	31.2	Very low	147 Å²	147	127.4 Å²	127.4	75%	0.754	69%	0.689	S	S	*	*			cis	-145	138.5	27.5	-69.7	171.3	0	0	0	110.8
769	S	36.2	Very low	31.5	Very low	114 Å²	114	129.3 Å²	129.3	80%	0.797	68%	0.68	S	S	*	*			trans	66.7	147.8	156	-71.3	0	0	0	0	121.5
770	A	37.3	Very low	32	Very low	76 Å²	76	127.7 Å²	127.7	63%	0.628	68%	0.683	S	S	*	*			cis	-167	150.3	-13.1	0	0	0	0	0	112.3
771	V	37.4	Very low	32.2	Very low	136 Å²	136	127.4 Å²	127.4	82%	0.824	67%	0.672	S	S	*	*			trans	51.4	129.5	134.5	172.3	0	0	0	0	118.3
772	N	35.5	Very low	32.7	Very low	124 Å²	124	133.4 Å²	133.4	66%	0.663	68%	0.682	S	S	*	*			cis	-178.7	-173	-6.3	-145.4	2.8	0	0	0	106.7
773	E	36.3	Very low	33.3	Very low	116 Å²	116	133 Å²	133	54%	0.542	69%	0.687	S	S	.	*			cis	-161.9	169.8	-2.1	-154.7	169.4	-133.5	0	0	111.1
774	R	34.2	Very low	33.5	Very low	178 Å²	178	129.5 Å²	129.5	67%	0.672	68%	0.684	S	S	*	*			trans	42.6	120	148.3	-88.8	-177.1	-90.7	-129.2	-1.4	121.1
775	R	34.9	Very low	33.7	Very low	202 Å²	202	129.5 Å²	129.5	76%	0.762	69%	0.688	S	S	*	*				74.8	158.7	81.9	-74.6	-162.6	-166.1	-173.4	-5	113.8
776	Q	35.3	Very low	33.8	Very low	124 Å²	124	127.1 Å²	127.1	58%	0.579	69%	0.686	S	S	*	*			cis	-161.3	160.2	2.3	-118.1	174.5	-80	0	0	106.4
777	E	32.9	Very low	33.5	Very low	158 Å²	158	126.4 Å²	126.4	74%	0.738	68%	0.681	S	S	*	*			cis	-160.4	-163.5	-7.1	-156.6	136.9	57.1	0	0	110.9
778	S	31.6	Very low	33.3	Very low	90 Å²	90	124.6 Å²	124.6	63%	0.629	68%	0.682	S	S	*	*			trans	-74.1	-168.7	177.1	-44.3	0	0	0	0	114.6
779	Q	30.3	Very low	32.9	Very low	144 Å²	144	122.8 Å²	122.8	67%	0.673	67%	0.673	S	S	*	*			cis	-165.6	165.1	14.4	-150	176.9	7.8	0	0	113.6	T608	T608-Q779 HydrophobicContact CG2-CG 3.93Å
780	A	35.1	Very low	32.6	Very low	87 Å²	87	122.7 Å²	122.7	72%	0.719	66%	0.664	S	S	*	*			trans	72.2	162.5	147.7	0	0	0	0	0	121.5
781	Q	30.6	Very low	32.3	Very low	83 Å²	83	126.1 Å²	126.1	39%	0.388	67%	0.667	S	S	.	*				-177.7	130.9	-56.8	164.3	154.8	36.5	0	0	112.1	T608	T608-Q781 PolarHBondContact OG1-OE1 3.26Å
782	W	30.9	Very low	31.9	Very low	214 Å²	214	126.4 Å²	126.4	81%	0.811	66%	0.664	S	S	*	*			trans	-2	143.5	154.7	-50.1	106	0	0	0	120.8
783	P	34.3	Very low	31.6	Very low	121 Å²	121	124.6 Å²	124.6	79%	0.786	67%	0.666	S	S	*	*				-129.1	178.6	77.4	9.7	13.8	0	0	0	113.1
784	S	30.1	Very low	31.5	Very low	98 Å²	98	124.3 Å²	124.3	69%	0.685	68%	0.677	S	S	*	*			cis	131.2	150.4	-2.6	-165	0	0	0	0	110.4
785	L	29.4	Very low	31.5	Very low	148 Å²	148	123.9 Å²	123.9	78%	0.775	68%	0.682	S	S	*	*			trans	74.6	112.7	173	-49.5	-179.4	0	0	0	119.6
786	G	29.2	Very low	31.3	Very low	64 Å²	64	119.3 Å²	119.3	66%	0.66	68%	0.68	S	S	*	*				86.6	99	104	0	0	0	0	0	121
787	S	29.1	Very low	31.4	Very low	63 Å²	63	117.9 Å²	117.9	44%	0.441	68%	0.683	S	S	.	*				49.8	101.7	129.5	67	0	0	0	0	122.3	D1116	S787-D1116 VanDerWaalsContact CA-CG 3.45Å; S787-D1116 WeakPolarHBondContact CA-OD1 3.32Å; S787-D1116 WeakPolarHBondContact CA-OD2 3.44Å; S787-D1116 WeakPolarHBondContact CB-OD1 3.48Å; S787-D1116 PolarHBondContact N-OD2 3.44Å; S787-D1116 VanDerWaalsContact N-OD2 3.08Å
788	T	31.7	Very low	31.4	Very low	129 Å²	129	116.9 Å²	116.9	79%	0.791	68%	0.679	S	S	*	*				-164.8	133.2	127.7	16.5	0	0	0	0	107.5
789	L	29.1	Very low	31.7	Very low	109 Å²	109	115.9 Å²	115.9	57%	0.571	68%	0.683	S	S	*	*				57.4	102.5	79.2	-171.7	61.3	0	0	0	115.1	T1118	L789-T1118 HydrophobicContact CD1-CG2 3.76Å
790	N	28.9	Very low	31.9	Very low	113 Å²	113	118.6 Å²	118.6	60%	0.604	69%	0.687	S	S	*	*			trans	80.7	156.3	148.9	-156.6	29.1	0	0	0	120.1
791	Q	31.2	Very low	32.1	Very low	148 Å²	148	124.7 Å²	124.7	69%	0.692	70%	0.697	S	S	*	*			trans	-60.8	136.9	178	-52.8	149.2	26.2	0	0	112
792	N	30.3	Very low	32.1	Very low	141 Å²	141	127.4 Å²	127.4	75%	0.754	72%	0.715	S	S	*	*				174.5	125.6	105.5	-90.6	-48.2	0	0	0	114.5
793	A	29.2	Very low	32.3	Very low	87 Å²	87	122.5 Å²	122.5	72%	0.719	71%	0.71	S	S	*	*			trans	47.5	152.8	135.6	0	0	0	0	0	123.8
794	S	34.2	Very low	32.1	Very low	109 Å²	109	122.3 Å²	122.3	76%	0.762	71%	0.707	S	S	*	*			trans	80.4	138	158.8	85.1	0	0	0	0	117.4
795	H	32.9	Very low	32.4	Very low	170 Å²	170	122.9 Å²	122.9	79%	0.787	71%	0.708	S	S	*	*			cis	-164.9	166.6	-18.6	-136.9	-92.2	0	0	0	111.4
796	C	31.8	Very low	32.3	Very low	106 Å²	106	122.5 Å²	122.5	72%	0.716	71%	0.706	S	S	*	*			trans	67.1	161.6	160.5	-63.9	0	0	0	0	117.6
797	S	36.5	Very low	32.1	Very low	93 Å²	93	125.7 Å²	125.7	65%	0.65	71%	0.708	S	S	*	*			cis	-173.6	156.8	-26.6	-99.8	0	0	0	0	107
798	E	33.7	Very low	32	Very low	137 Å²	137	131 Å²	131	64%	0.64	72%	0.723	S	S	*	*			cis	-160	171.8	-6.9	-132.6	172	92.9	0	0	109.3	R800	E798-R800 IonicContact OE1-CZ 3.74Å; E798-R800 IonicContact OE1-NE 3.51Å; E798-R800 PolarHBondContact OE1-NE 2.86Å; E798-R800 IonicContact OE1-NH2 2.69Å; E798-R800 PolarHBondContact OE1-NH2 3.25Å
799	G	37.7	Very low	31.8	Very low	69 Å²	69	130.5 Å²	130.5	71%	0.711	72%	0.72	S	S	*	*			trans	151.9	48.8	173.2	0	0	0	0	0	115.7
800	R	33.8	Very low	31.7	Very low	201 Å²	201	130.4 Å²	130.4	76%	0.758	73%	0.728	S	S	*	*				57.1	86.2	100.9	-63.8	-168.4	-174.8	-165.5	3.5	116.1	E798	E798-R800 IonicContact OE1-CZ 3.74Å; E798-R800 IonicContact OE1-NE 3.51Å; E798-R800 PolarHBondContact OE1-NE 2.86Å; E798-R800 IonicContact OE1-NH2 2.69Å; E798-R800 PolarHBondContact OE1-NH2 3.25Å
801	F	40.1	Very low	31.7	Very low	215 Å²	215	129.3 Å²	129.3	94%	0.943	73%	0.729	S	S	*	*				-142.3	134.9	127.4	-100.1	-77.3	0	0	0	109.3
802	N	29.8	Very low	31.6	Very low	140 Å²	140	130.5 Å²	130.5	75%	0.749	74%	0.735	S	S	*	*			trans	-150.7	144	-177.1	-121.4	-39	0	0	0	105.1
803	P	35	Very low	31.7	Very low	111 Å²	111	130.8 Å²	130.8	72%	0.721	74%	0.735	S	S	*	*				-148.3	-178.7	79.9	42	-21.6	0	0	0	112.2
804	V	31.4	Very low	31.7	Very low	118 Å²	118	130.5 Å²	130.5	72%	0.715	73%	0.729	S	S	*	*			cis	69	149.5	28.1	176.7	0	0	0	0	111.3
805	P	36.4	Very low	31.6	Very low	109 Å²	109	134.7 Å²	134.7	71%	0.708	73%	0.729	S	S	*	*			cis	-121.9	-160.8	-2.7	34	-12.2	0	0	0	114.2
806	L	25.7	Very low	31.5	Very low	141 Å²	141	129.2 Å²	129.2	74%	0.738	72%	0.718	S	S	*	*			trans	-46.7	165.1	168	-53.8	77.6	0	0	0	116.5
807	N	25.4	Very low	31.7	Very low	130 Å²	130	130.4 Å²	130.4	70%	0.695	71%	0.711	S	S	*	*			trans	81.3	128.5	136.9	-95.8	-31.4	0	0	0	121.1
808	K	27	Very low	31.4	Very low	176 Å²	176	131 Å²	131	77%	0.765	71%	0.707	S	S	*	*			trans	73.2	124.7	133.9	-78.8	-172.8	174.8	-175.6	0	121.6
809	V	27.5	Very low	31.2	Very low	118 Å²	118	130 Å²	130	72%	0.715	71%	0.714	S	S	*	*				78.5	106.2	127.7	176.5	0	0	0	0	117.5
810	S	26.6	Very low	30.9	Very low	107 Å²	107	130.2 Å²	130.2	75%	0.748	72%	0.716	S	S	*	*			trans	66.9	166.6	153.7	-49.5	0	0	0	0	115.7
811	S	29.5	Very low	30.6	Very low	90 Å²	90	127.4 Å²	127.4	63%	0.629	72%	0.716	S	S	*	*			cis	-142.8	151.8	5.8	-45.3	0	0	0	0	110.5
812	E	29.8	Very low	30.1	Very low	172 Å²	172	123.7 Å²	123.7	80%	0.804	71%	0.706	S	S	*	*			trans	50.4	141.7	133.3	-65	-178.9	122.7	0	0	121.2
813	L	31.3	Very low	30	Very low	147 Å²	147	121.9 Å²	121.9	77%	0.77	70%	0.704	S	S	*	*			cis	-130.9	143.8	5.1	-74.6	95.8	0	0	0	109
814	S	29.4	Very low	29.7	Very low	82 Å²	82	121.2 Å²	121.2	57%	0.573	70%	0.702	S	S	*	*				63	125.8	74.3	-136.8	0	0	0	0	113.5
815	Y	32.8	Very low	29.6	Very low	197 Å²	197	121.9 Å²	121.9	77%	0.773	70%	0.702	S	S	*	*			cis	-143.7	157.6	13.5	-69.2	-117	0	0	0	110.2	K940	Y815-K940 HydrophobicContact CD1-CD 4.44Å
816	G	31.3	Very low	29.1	Very low	54 Å²	54	122.6 Å²	122.6	56%	0.557	70%	0.7	S	S	*	*			cis	119.9	95.5	-26.3	0	0	0	0	0	118	K940	G816-K940 WeakPolarHBondContact O-CE 3.29Å; G816-K940 PolarHBondContact O-NZ 2.88Å
817	K	34.4	Very low	29.3	Very low	131 Å²	131	121.7 Å²	121.7	57%	0.57	70%	0.701	S	S	*	*			trans	128.3	155.8	163.2	-88	-156	141.6	53.1	0	114.9	K940	K817-K940 HydrophobicContact CD-CB 4Å; K817-K940 HydrophobicContact CD-CD 3.97Å; K817-K940 HydrophobicContact CD-CG 3.66Å; K817-K940 HydrophobicContact CG-CD 4.37Å
818	N	30.8	Very low	29.4	Very low	107 Å²	107	120.1 Å²	120.1	57%	0.572	70%	0.7	S	S	*	*			cis	-159.3	144.4	-10.3	-129.1	38.2	0	0	0	107.4
819	C	28.7	Very low	29.5	Very low	114 Å²	114	117.8 Å²	117.8	77%	0.77	70%	0.7	S	S	*	*				51.9	130.6	82.6	-40.1	0	0	0	0	117.7
820	G	31.4	Very low	29.6	Very low	74 Å²	74	118.4 Å²	118.4	76%	0.763	70%	0.704	S	S	*	*			trans	119	89.4	179.5	0	0	0	0	0	111.1
821	N	29	Very low	29.7	Very low	143 Å²	143	118 Å²	118	77%	0.765	70%	0.701	S	S	*	*			cis	78	139.1	49.4	-119.3	72.3	0	0	0	114.7
822	D	28	Very low	30	Very low	136 Å²	136	121.5 Å²	121.5	73%	0.727	71%	0.708	S	S	*	*			trans	72.6	89.3	162.7	-52.1	-46.9	0	0	0	121.3
823	S	27.9	Very low	30	Very low	102 Å²	102	118.7 Å²	118.7	71%	0.713	70%	0.698	S	S	*	*				77.1	133.8	112.3	-163.6	0	0	0	0	122.2
824	S	29.4	Very low	30.3	Very low	97 Å²	97	118.3 Å²	118.3	68%	0.678	69%	0.692	S	S	*	*			trans	73.9	148.7	144.3	42.8	0	0	0	0	121.3
825	D	29.2	Very low	30.8	Very low	133 Å²	133	121.2 Å²	121.2	71%	0.711	70%	0.696	S	S	*	*			trans	78.9	97.1	152.2	-74.1	20.1	0	0	0	121.4
826	N	26.8	Very low	30.8	Very low	123 Å²	123	118.3 Å²	118.3	66%	0.658	69%	0.694	S	S	*	*				76.8	108.3	117.7	-63.5	-40.2	0	0	0	119.9
827	T	28.6	Very low	30.8	Very low	123 Å²	123	120.4 Å²	120.4	76%	0.755	70%	0.699	S	S	*	*				47.2	107.2	113.8	-47.7	0	0	0	0	117.7
828	S	28.2	Very low	30.6	Very low	97 Å²	97	124.8 Å²	124.8	68%	0.678	71%	0.712	S	S	*	*				178.2	131	113.1	42.3	0	0	0	0	116.1
829	T	29	Very low	31.3	Very low	127 Å²	127	124.4 Å²	124.4	78%	0.779	72%	0.715	S	S	*	*			trans	68.6	163.4	137.7	59.3	0	0	0	0	122.2
830	V	29.9	Very low	31.6	Very low	131 Å²	131	125.4 Å²	125.4	79%	0.794	71%	0.713	S	S	*	*			trans	81.3	122.6	164	-167.1	0	0	0	0	116.1
831	S	28.8	Very low	31.8	Very low	97 Å²	97	131.4 Å²	131.4	68%	0.678	71%	0.714	S	S	*	*			cis	-173.8	173.6	-26.6	-104.2	0	0	0	0	108.6
832	Q	34.7	Very low	32.1	Very low	165 Å²	165	130.6 Å²	130.6	77%	0.771	71%	0.709	S	S	*	*			trans	78.6	142.2	161.2	-47.7	-160.9	2.6	0	0	117.3
833	N	30.4	Very low	32.5	Very low	113 Å²	113	129.4 Å²	129.4	60%	0.604	70%	0.703	S	S	*	*			cis	-168.3	-179.8	-20.9	-106.6	-18.9	0	0	0	110.4
834	H	37.1	Very low	32.9	Very low	139 Å²	139	132.4 Å²	132.4	64%	0.644	70%	0.703	S	S	*	*			trans	83.6	83.7	150.9	-57.9	-48.9	0	0	0	120.1
835	H	39.5	Very low	33.2	Very low	143 Å²	143	133.1 Å²	133.1	66%	0.662	71%	0.705	S	S	*	*				101.1	119.5	109.4	-75.2	-48.1	0	0	0	122.8
836	N	33.5	Very low	33.3	Very low	135 Å²	135	135.7 Å²	135.7	72%	0.722	71%	0.713	S	S	*	*			trans	73.8	149	130.7	-59.3	0.9	0	0	0	118.3
837	C	31.5	Very low	33.6	Very low	98 Å²	98	134.8 Å²	134.8	66%	0.662	72%	0.716	S	S	*	*			cis	-155.1	123.9	-7.5	-119.9	0	0	0	0	108.9
838	R	30.9	Very low	33.6	Very low	223 Å²	223	134.9 Å²	134.9	84%	0.842	72%	0.717	S	S	*	*				99.6	151.6	98.3	-94.3	-165.9	80.3	155.6	4.9	114.8
839	P	44.1	Very low	34	Very low	99 Å²	99	135.5 Å²	135.5	64%	0.643	72%	0.719	S	S	*	*			trans	-121.9	-174.5	-168.2	44.9	-33	0	0	0	114.2
840	N	36.6	Very low	34.2	Very low	135 Å²	135	135.3 Å²	135.3	72%	0.722	72%	0.722	S	S	*	*			trans	-157.9	125	149.2	-95.7	-24.7	0	0	0	109.1
841	Y	35	Very low	34.4	Very low	201 Å²	201	138.6 Å²	138.6	79%	0.788	73%	0.726	S	S	*	*				75	137.1	95.1	-93.3	-118.6	0	0	0	113.7
842	L	35	Very low	34.8	Very low	125 Å²	125	139.4 Å²	139.4	65%	0.654	73%	0.729	S	S	*	*			cis	-161.5	147.1	18.4	172.7	60.3	0	0	0	112.8
843	D	37.6	Very low	34.5	Very low	112 Å²	112	136.5 Å²	136.5	60%	0.599	73%	0.727	S	S	*	*			trans	58.4	150	159.4	-82	-14.1	0	0	0	121.5
844	K	35.1	Very low	34.6	Very low	165 Å²	165	137.2 Å²	137.2	72%	0.717	74%	0.735	S	S	*	*			cis	-154.7	150.6	-10.1	-135.6	165.7	-164.6	80.9	0	111.5
845	P	36.5	Very low	34.6	Very low	111 Å²	111	135.6 Å²	135.6	72%	0.721	74%	0.74	S	S	*	*			trans	-106.5	-166.3	176.7	40.6	-34.8	0	0	0	114.1
846	Q	30.1	Very low	34.7	Very low	188 Å²	188	134.5 Å²	134.5	88%	0.879	75%	0.745	S	S	*	*			trans	82.9	151.6	175.3	-62.7	-178.2	-23.3	0	0	117.1
847	S	33.6	Very low	35.1	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	75%	0.747	S	S	*	*			cis	-165.8	163.9	-24.2	55.2	0	0	0	0	112.5
848	T	27.8	Very low	35.5	Very low	124 Å²	124	138.3 Å²	138.3	76%	0.761	75%	0.75	S	S	*	*			trans	-60.2	177	162.6	51.8	0	0	0	0	114
849	P	37.6	Very low	35.8	Very low	111 Å²	111	131.7 Å²	131.7	72%	0.721	73%	0.734	S	S	*	*			cis	-133.9	-179.2	-40.6	37.7	-21.9	0	0	0	112.6
850	S	33.8	Very low	35.2	Very low	122 Å²	122	133.7 Å²	133.7	85%	0.853	74%	0.74	S	S	*	*			trans	-174.9	153	143.5	-88.9	0	0	0	0	116
851	K	34	Very low	35.5	Very low	201 Å²	201	133.5 Å²	133.5	87%	0.874	74%	0.743	S	S	*	*			trans	-102.3	-170.4	164.8	-68.5	177.6	169.3	174.4	0	108.9
852	P	37.1	Very low	35.6	Very low	114 Å²	114	132.6 Å²	132.6	74%	0.74	74%	0.743	S	S	*	*			cis	-132.9	-178.1	-13.9	39.8	-23	0	0	0	115.1
853	S	28.8	Very low	35.9	Very low	104 Å²	104	131.8 Å²	131.8	73%	0.727	75%	0.748	S	S	*	*			trans	70.6	156.7	147.4	-134.6	0	0	0	0	118.2
854	T	32.4	Very low	35.7	Very low	128 Å²	128	135.8 Å²	135.8	79%	0.785	76%	0.76	S	S	*	*			cis	-147.3	162.5	3	-35.1	0	0	0	0	110.9
855	S	37.1	Very low	35.7	Very low	105 Å²	105	136 Å²	136	73%	0.734	77%	0.767	S	S	*	*			trans	-69.7	173.3	158.1	-130	0	0	0	0	111.1
856	P	40.6	Very low	35.7	Very low	119 Å²	119	139.1 Å²	139.1	77%	0.773	77%	0.772	S	S	*	*			cis	-153.9	-176.7	45.6	43.3	-20.2	0	0	0	120.1
857	R	42.1	Very low	35.8	Very low	203 Å²	203	135.2 Å²	135.2	77%	0.766	76%	0.763	S	S	*	*			trans	-50.1	152.4	167.3	-172.5	-157	-175.4	-162.2	5.5	117.5	T859	R857-T859 HydrophobicContact CG-CG2 4.41Å; R857-T859 VanDerWaalsContact CZ-CG2 3.49Å
858	P	40.5	Very low	35.4	Very low	110 Å²	110	136.8 Å²	136.8	71%	0.714	76%	0.763	S	S	*	*				-125.3	151.2	115.2	2.6	19.7	0	0	0	111.6
859	T	35.9	Very low	35.4	Very low	84 Å²	84	135 Å²	135	52%	0.515	76%	0.756	S	S	.	*			cis	71.2	146.3	49.3	75.8	0	0	0	0	114.2	R857	R857-T859 HydrophobicContact CG-CG2 4.41Å; R857-T859 VanDerWaalsContact CZ-CG2 3.49Å
860	N	33.1	Very low	34.9	Very low	142 Å²	142	135.3 Å²	135.3	76%	0.759	76%	0.756	S	S	*	*			cis	-165.2	-164.3	18.8	-148.7	-37.4	0	0	0	112.3
861	V	42.4	Very low	34.6	Very low	131 Å²	131	136.8 Å²	136.8	79%	0.794	75%	0.753	S	S	*	*			trans	84.1	137.4	160.2	-171.1	0	0	0	0	117.3
862	K	36	Very low	34.3	Very low	182 Å²	182	131.9 Å²	131.9	79%	0.791	74%	0.744	S	S	*	*			cis	-170.3	166.5	-25.4	-171	70.2	169.1	-164	0	109.4
863	S	42.4	Very low	34.4	Very low	108 Å²	108	133.7 Å²	133.7	76%	0.755	74%	0.743	S	S	*	*			trans	64	132.5	174.9	42	0	0	0	0	116.6
864	K	32.2	Very low	34.9	Very low	196 Å²	196	133.9 Å²	133.9	85%	0.852	74%	0.742	S	S	*	*			cis	72	97.8	12.3	-165.2	-169.9	179.1	-177.8	0	116.6
865	I	35.3	Very low	35	Very low	169 Å²	169	133.4 Å²	133.4	87%	0.867	73%	0.733	S	S	*	*			trans	-173.9	153.2	137.2	-100.3	157.6	0	0	0	109.5
866	Q	36.1	Very low	34.9	Very low	176 Å²	176	136.9 Å²	136.9	82%	0.822	74%	0.738	S	S	*	*			trans	-84.8	-179.6	171.9	-69.7	177.1	-21.3	0	0	109.2
867	P	32.8	Very low	34.6	Very low	107 Å²	107	135.5 Å²	135.5	70%	0.695	73%	0.731	S	S	*	*			cis	-145.9	-165.2	16.4	35.4	-9	0	0	0	115.1
868	D	25.6	Very low	34.2	Very low	136 Å²	136	133.2 Å²	133.2	73%	0.727	73%	0.733	S	S	*	*			trans	65.9	159	134.5	-110.2	-64.8	0	0	0	125.5
869	S	28.6	Very low	34	Very low	86 Å²	86	133.1 Å²	133.1	60%	0.601	73%	0.734	S	S	*	*			trans	45.1	90	144.8	-66.1	0	0	0	0	117.8
870	T	26.5	Very low	34	Very low	119 Å²	119	133.1 Å²	133.1	73%	0.73	74%	0.738	S	S	*	*				71.9	139.1	73	68.7	0	0	0	0	116.9
871	L	27.5	Very low	34.2	Very low	152 Å²	152	133.1 Å²	133.1	80%	0.796	74%	0.738	S	S	*	*			trans	86	139.3	139.1	-89.1	165.1	0	0	0	121.2
872	S	28.5	Very low	33.9	Very low	98 Å²	98	130.1 Å²	130.1	69%	0.685	73%	0.734	S	S	*	*			trans	95.7	101.8	148.5	-64.1	0	0	0	0	117.7
873	E	38	Very low	34	Very low	153 Å²	153	131 Å²	131	72%	0.715	73%	0.733	S	S	*	*				94	165.2	67.9	-86.4	-77.1	118.7	0	0	109.5	I875	E873-I875 PolarHBondContact OE2-N 2.72Å
874	P	40.5	Very low	33.5	Very low	108 Å²	108	132.2 Å²	132.2	70%	0.701	73%	0.731	S	S	*	*			cis	-152.2	164.5	32.4	43.3	-20.4	0	0	0	122.9
875	I	33.5	Very low	33.5	Very low	117 Å²	117	133.1 Å²	133.1	60%	0.6	73%	0.729	S	S	*	*			trans	115.1	125.6	139.9	-58.2	-159.1	0	0	0	119.8	E873	E873-I875 PolarHBondContact OE2-N 2.72Å
876	Q	34.7	Very low	33.2	Very low	178 Å²	178	130.2 Å²	130.2	83%	0.832	72%	0.72	S	S	*	*			trans	72.5	135.4	157.2	-77	152.6	24.5	0	0	120.1
877	S	33.8	Very low	33	Very low	91 Å²	91	129.1 Å²	129.1	64%	0.636	72%	0.715	S	S	*	*			cis	-171.7	138	-11	47.5	0	0	0	0	115.9
878	I	35.2	Very low	32.9	Very low	155 Å²	155	130.4 Å²	130.4	80%	0.795	71%	0.712	S	S	*	*			trans	80	114.4	146.2	-62.3	158.7	0	0	0	121.4
879	S	35.3	Very low	33	Very low	107 Å²	107	130.6 Å²	130.6	75%	0.748	71%	0.712	S	S	*	*			trans	48.9	151.3	143.3	-79.3	0	0	0	0	124.2
880	S	37.2	Very low	33	Very low	85 Å²	85	129.8 Å²	129.8	59%	0.594	72%	0.718	S	S	*	*			cis	-164.1	145.9	-6.5	-112.8	0	0	0	0	113.9
881	D	36.5	Very low	33.1	Very low	141 Å²	141	136.6 Å²	136.6	75%	0.754	73%	0.73	S	S	*	*			trans	53.2	144	141.8	-53	-56.7	0	0	0	123.6
882	G	36.3	Very low	33.6	Very low	69 Å²	69	132.5 Å²	132.5	71%	0.711	73%	0.725	S	S	*	*			trans	-178.6	-3.6	176	0	0	0	0	0	124.1
883	Y	37.3	Very low	34.4	Very low	199 Å²	199	133.9 Å²	133.9	78%	0.78	73%	0.731	S	S	*	*			trans	55.3	100.3	163.4	-71.8	-92.9	0	0	0	123
884	N	32.5	Very low	34.2	Very low	134 Å²	134	135.7 Å²	135.7	72%	0.717	74%	0.737	S	S	*	*				72.8	143.1	110	-95.5	-64.5	0	0	0	125.8
885	R	31.4	Very low	33.9	Very low	215 Å²	215	137 Å²	137	81%	0.811	74%	0.738	S	S	*	*			trans	84.9	95.3	142	-78.5	-168.9	174.2	-156.2	-1.8	124.3
886	T	28.7	Very low	33.9	Very low	109 Å²	109	137.1 Å²	137.1	67%	0.669	74%	0.744	S	S	*	*				60.9	128.3	93.5	-56.9	0	0	0	0	121.9
887	Q	32	Very low	34.1	Very low	152 Å²	152	136.7 Å²	136.7	71%	0.71	74%	0.742	S	S	*	*			trans	94.7	136.2	147.4	-92.4	-179	119.9	0	0	123.1
888	Q	30.9	Very low	34.3	Very low	135 Å²	135	138.2 Å²	138.2	63%	0.631	75%	0.748	S	S	*	*			trans	79.9	141.4	138.1	-78.2	-175.4	41.4	0	0	122.6
889	N	27.7	Very low	34.3	Very low	139 Å²	139	135.9 Å²	135.9	74%	0.743	74%	0.744	S	S	*	*			trans	45	110.7	144.4	-49.7	-19.5	0	0	0	118
890	G	29.2	Very low	34.3	Very low	69 Å²	69	136.5 Å²	136.5	71%	0.711	75%	0.748	S	S	*	*			cis	102.9	155.2	48.1	0	0	0	0	0	111.5
891	R	28.6	Very low	34.4	Very low	263 Å²	263	136.2 Å²	136.2	99%	0.992	76%	0.759	S	S	*	*			trans	71.4	140	-176.9	-52.1	-178.2	175.5	-152.1	-2.9	115.6
892	G	37.1	Very low	34.5	Very low	66 Å²	66	133 Å²	133	68%	0.68	76%	0.759	S	S	*	*			trans	-133.9	-168.9	164.7	0	0	0	0	0	110.4
893	P	45.9	Very low	34.4	Very low	127 Å²	127	135.3 Å²	135.3	83%	0.825	76%	0.764	S	S	*	*			trans	-100.6	136.6	152.4	-1.7	23.1	0	0	0	109.3
894	K	34.4	Very low	34.5	Very low	190 Å²	190	132.3 Å²	132.3	83%	0.826	77%	0.766	S	S	*	*				80.1	130.1	50.3	-75.6	-169.4	172.5	-170.6	0	114.5
895	N	32.8	Very low	34.6	Very low	135 Å²	135	137.1 Å²	137.1	72%	0.722	77%	0.774	S	S	*	*			trans	113.1	100.7	161.1	-63.5	2.7	0	0	0	112.7
896	T	34.3	Very low	34.8	Very low	121 Å²	121	132 Å²	132	74%	0.742	77%	0.771	S	S	*	*				73.2	139	74	64.8	0	0	0	0	111.5
897	E	39.7	Very low	35.2	Very low	169 Å²	169	132.4 Å²	132.4	79%	0.79	77%	0.774	S	S	*	*			cis	-140.4	147.6	33.4	-75.6	-175.4	126.1	0	0	112.7
898	V	36.3	Very low	35.3	Very low	123 Å²	123	132.2 Å²	132.2	75%	0.745	77%	0.773	S	S	*	*				65.1	137	98.3	-171.3	0	0	0	0	113.9
899	C	36.2	Very low	35.6	Very low	106 Å²	106	133 Å²	133	72%	0.716	78%	0.776	S	S	*	*			cis	-140.4	139.8	11.7	-125.3	0	0	0	0	108.7
900	S	36.2	Very low	36	Very low	119 Å²	119	133.4 Å²	133.4	83%	0.832	77%	0.771	S	S	*	*				81.2	130.9	70.4	-55.5	0	0	0	0	116.7
901	G	38.2	Very low	36.3	Very low	80 Å²	80	136.9 Å²	136.9	83%	0.825	77%	0.769	S	S	*	*			trans	155.5	94	158.9	0	0	0	0	0	118.9
902	G	38.9	Very low	36.4	Very low	73 Å²	73	130 Å²	130	75%	0.753	76%	0.756	S	S	*	*			trans	76.5	128.3	165.9	0	0	0	0	0	116.1
903	S	34.1	Very low	36.2	Very low	117 Å²	117	130.7 Å²	130.7	82%	0.818	76%	0.756	S	S	*	*			cis	69.3	137.1	22.9	-137.6	0	0	0	0	113.7
904	V	39.4	Very low	35.5	Very low	136 Å²	136	130.9 Å²	130.9	82%	0.824	76%	0.755	S	S	*	*			cis	-140.9	157.5	30.6	-164.7	0	0	0	0	113.2
905	R	34	Very low	35.3	Very low	236 Å²	236	127 Å²	127	89%	0.891	75%	0.751	S	S	*	*			trans	-110.5	146.1	165.5	-80.4	-179.7	169	-174.8	-2.1	111.3
906	S	36.3	Very low	35.3	Very low	107 Å²	107	125.5 Å²	125.5	75%	0.748	75%	0.751	S	S	*	*			trans	-169.1	129.3	143	-91.9	0	0	0	0	107.6
907	T	36.2	Very low	35.3	Very low	118 Å²	118	124.7 Å²	124.7	72%	0.724	75%	0.751	S	S	*	*				49.1	131.6	85.4	64.8	0	0	0	0	112.7
908	E	34.6	Very low	35.2	Very low	147 Å²	147	127.1 Å²	127.1	69%	0.687	75%	0.753	S	S	*	*				-178.3	152.5	71.5	-178.1	149.4	149.3	0	0	113.8
909	Q	37.4	Very low	35.1	Very low	151 Å²	151	127.8 Å²	127.8	71%	0.706	76%	0.757	S	S	*	*			trans	62	159.8	158.2	-79.4	-175.9	62.8	0	0	120.5
910	K	36.4	Very low	35.1	Very low	148 Å²	148	126.6 Å²	126.6	64%	0.643	76%	0.763	S	S	*	*			cis	-177.5	145.6	-29.5	-160.3	-170.7	-176.3	-149.3	0	111.3
911	Q	36.2	Very low	35.1	Very low	142 Å²	142	125.9 Å²	125.9	66%	0.664	76%	0.758	S	S	*	*			trans	60.6	159.9	152.5	-87.8	172.3	-29.8	0	0	119.6
912	T	29.9	Very low	35.1	Very low	118 Å²	118	126.7 Å²	126.7	72%	0.724	75%	0.747	S	S	*	*			cis	-159.4	139	-39.9	11.9	0	0	0	0	111.2
913	A	31.8	Very low	35	Very low	82 Å²	82	130.3 Å²	130.3	68%	0.678	75%	0.749	S	S	*	*			trans	50.6	150.9	133	0	0	0	0	0	124.7
914	V	32.4	Very low	35.4	Very low	131 Å²	131	132.9 Å²	132.9	79%	0.794	75%	0.748	S	S	*	*			trans	64.3	105.7	151.7	-69.7	0	0	0	0	123.2
915	S	30.6	Very low	35.4	Very low	107 Å²	107	131.7 Å²	131.7	75%	0.748	75%	0.745	S	S	*	*				83.8	147.5	116.8	-57.9	0	0	0	0	123.3
916	S	33.2	Very low	35.4	Very low	104 Å²	104	131.2 Å²	131.2	73%	0.727	74%	0.744	S	S	*	*			trans	81.3	87.7	146.8	-62.6	0	0	0	0	122.2
917	S	33.8	Very low	35.6	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	75%	0.749	S	S	*	*				86.4	165.3	114.5	81.6	0	0	0	0	122.1
918	R	37.8	Very low	35.4	Very low	220 Å²	220	136.9 Å²	136.9	83%	0.83	76%	0.757	S	S	*	*			trans	84.7	101.4	155.8	-76.5	-179.7	173.7	-142.7	-3	121.5
919	T	33.4	Very low	35.4	Very low	137 Å²	137	133.8 Å²	133.8	84%	0.84	76%	0.764	S	S	*	*				50.8	128.8	122.5	58.6	0	0	0	0	121.7
920	G	35.3	Very low	35.3	Very low	80 Å²	80	131.8 Å²	131.8	83%	0.825	77%	0.766	S	S	*	*			trans	-165.2	80.2	170.4	0	0	0	0	0	118.1
921	S	38.2	Very low	35.3	Very low	104 Å²	104	133.9 Å²	133.9	73%	0.727	78%	0.776	S	S	*	*			trans	43.5	105.5	150.9	-162.7	0	0	0	0	123.8
922	T	36.4	Very low	35.3	Very low	97 Å²	97	131.5 Å²	131.5	60%	0.595	77%	0.774	S	S	*	*				31.9	127.6	109.5	-35.6	0	0	0	0	122.3	Q924	T922-Q924 HydrophobicContact CG2-CG 4.46Å
923	N	37.6	Very low	35.5	Very low	149 Å²	149	132.7 Å²	132.7	80%	0.797	78%	0.776	S	S	*	*				170.7	125	122.9	-83.7	-30.5	0	0	0	109.3
924	Q	42.7	Very low	35.5	Very low	172 Å²	172	135.5 Å²	135.5	80%	0.804	78%	0.78	S	S	*	*			cis	82.3	98.2	31.8	-69.5	-149.5	90.5	0	0	117.8	T922	T922-Q924 HydrophobicContact CG2-CG 4.46Å
925	S	39.8	Very low	35.5	Very low	110 Å²	110	134.6 Å²	134.6	77%	0.769	77%	0.774	S	S	*	*				175.1	131.8	126.4	-151.1	0	0	0	0	108
926	R	32.9	Very low	35.6	Very low	227 Å²	227	140.5 Å²	140.5	86%	0.857	78%	0.78	S	S	*	*			cis	65.9	115.9	42.7	-179.1	-171.3	-82.6	-155.3	0.8	113.5
927	V	40.1	Very low	35.7	Very low	142 Å²	142	140.6 Å²	140.6	86%	0.861	78%	0.781	S	S	*	*				-158.5	159.7	109.6	-165.5	0	0	0	0	109.2
928	K	32.5	Very low	36	Very low	202 Å²	202	141 Å²	141	88%	0.878	78%	0.781	S	S	*	*			trans	-88.8	159.6	173.9	-58.1	173.3	176.6	-180	0	111.8
929	G	35.6	Very low	36	Very low	81 Å²	81	137 Å²	137	84%	0.835	78%	0.781	S	S	*	*			trans	-157.1	77.2	176.8	0	0	0	0	0	115.7
930	S	35.3	Very low	36.1	Very low	109 Å²	109	134.1 Å²	134.1	76%	0.762	76%	0.757	S	S	*	*			trans	-57.4	164.5	-175.1	-44.7	0	0	0	0	118.5
931	K	36.2	Very low	36	Very low	193 Å²	193	136.7 Å²	136.7	84%	0.839	76%	0.757	S	S	*	*			trans	100	103.3	148.5	-72.9	178.6	176.3	179.6	0	120.9
932	S	35.2	Very low	35.7	Very low	91 Å²	91	137.4 Å²	137.4	64%	0.636	76%	0.756	S	S	*	*				84.1	116.6	111.7	76.3	0	0	0	0	122.4
933	N	35.1	Very low	35.5	Very low	143 Å²	143	138.2 Å²	138.2	77%	0.765	76%	0.76	S	S	*	*				79.3	121.8	123.1	-62	12.2	0	0	0	121.2
934	N	31.1	Very low	35.2	Very low	142 Å²	142	138.7 Å²	138.7	76%	0.759	76%	0.758	S	S	*	*				90.3	130.6	129	-95.7	2.2	0	0	0	121.6
935	V	32.8	Very low	34.7	Very low	111 Å²	111	136.2 Å²	136.2	67%	0.673	75%	0.75	S	S	*	*			trans	78	101.1	131.3	171.8	0	0	0	0	117.1
936	R	32.8	Very low	34.3	Very low	232 Å²	232	137.5 Å²	137.5	88%	0.875	75%	0.749	S	S	*	*				92.1	97.6	122.8	-164	170.1	-166.4	159.1	3.2	118.1
937	S	35.4	Very low	34.4	Very low	105 Å²	105	132 Å²	132	73%	0.734	75%	0.745	S	S	*	*			trans	-44.6	165.3	145.9	-25.4	0	0	0	0	112.7
938	P	40.1	Very low	34.3	Very low	114 Å²	114	132.3 Å²	132.3	74%	0.74	74%	0.741	S	S	*	*			cis	-138.2	-174.4	13.1	39.9	-21.1	0	0	0	114.8
939	T	37.9	Very low	34.4	Very low	135 Å²	135	127.4 Å²	127.4	83%	0.828	73%	0.732	S	S	*	*				167.1	170.6	120.4	-68.7	0	0	0	0	111.8
940	K	34.9	Very low	34.5	Very low	78 Å²	78	128.4 Å²	128.4	34%	0.339	73%	0.726	S	S	.	*			trans	-111.9	128	-162.2	-37.3	162.1	43.7	174.6	0	111.8	Y815 G816 K817	Y815-K940 HydrophobicContact CD1-CD 4.44Å; G816-K940 WeakPolarHBondContact O-CE 3.29Å; G816-K940 PolarHBondContact O-NZ 2.88Å; K817-K940 HydrophobicContact CD-CB 4Å; K817-K940 HydrophobicContact CD-CD 3.97Å; K817-K940 HydrophobicContact CD-CG 3.66Å; K817-K940 HydrophobicContact CG-CD 4.37Å
941	V	33.3	Very low	34.9	Very low	134 Å²	134	131.3 Å²	131.3	81%	0.812	73%	0.728	S	S	*	*			trans	-169.9	139.3	143.3	-92.5	0	0	0	0	106.9
942	V	32.7	Very low	34.9	Very low	119 Å²	119	128.9 Å²	128.9	72%	0.721	72%	0.722	S	S	*	*			cis	83.8	151.4	46.2	177.7	0	0	0	0	112.3
943	V	32.1	Very low	35	Very low	113 Å²	113	129.9 Å²	129.9	69%	0.685	73%	0.729	S	S	*	*			trans	87.7	111.6	-164.6	-175.3	0	0	0	0	111.1
944	Q	31.4	Very low	35.2	Very low	160 Å²	160	128 Å²	128	75%	0.748	73%	0.727	S	S	*	*			cis	102.7	155.3	34.9	-175.8	-175	8.8	0	0	111.3
945	N	31.3	Very low	35.4	Very low	120 Å²	120	126.2 Å²	126.2	64%	0.642	73%	0.726	S	S	*	*			trans	81.1	143.1	-177.6	-49.4	-43.8	0	0	0	113.6
946	N	30.7	Very low	35.6	Very low	137 Å²	137	127.1 Å²	127.1	73%	0.733	73%	0.731	S	S	*	*			cis	167.2	167.9	-21.1	-102.6	-2.1	0	0	0	104.9
947	S	36	Very low	35.7	Very low	110 Å²	110	122 Å²	122	77%	0.769	72%	0.721	S	S	*	*			trans	81.7	148.7	159.6	88.7	0	0	0	0	117
948	L	37.4	Very low	35.7	Very low	150 Å²	150	124.7 Å²	124.7	79%	0.785	73%	0.726	S	S	*	*			cis	-160.1	141.1	1.6	-134.1	162.6	0	0	0	111.3
949	S	35.2	Very low	35.4	Very low	99 Å²	99	129.6 Å²	129.6	69%	0.692	73%	0.73	S	S	*	*			trans	56.8	157.1	164.8	-79.3	0	0	0	0	118.9
950	S	37.7	Very low	35.5	Very low	101 Å²	101	128.2 Å²	128.2	71%	0.706	72%	0.723	S	S	*	*			cis	-148.5	138.8	11	11.9	0	0	0	0	109
951	Q	42.8	Very low	35.5	Very low	171 Å²	171	133.4 Å²	133.4	80%	0.799	75%	0.751	S	S	*	*				63.1	132.6	83.6	-91	-177.3	6.4	0	0	113.2
952	I	37.3	Very low	35.5	Very low	142 Å²	142	135.5 Å²	135.5	73%	0.728	75%	0.752	S	S	*	*			cis	-150.1	146.2	18.6	-56.1	-178.4	0	0	0	111.7
953	S	37.9	Very low	35.7	Very low	111 Å²	111	134.7 Å²	134.7	78%	0.776	76%	0.757	S	S	*	*			trans	58.8	151.5	158.4	-75.4	0	0	0	0	121.5
954	S	38.5	Very low	35.9	Very low	104 Å²	104	134.5 Å²	134.5	73%	0.727	77%	0.767	S	S	*	*			cis	-154.7	161.2	-8.6	42.2	0	0	0	0	112.5
955	S	35	Very low	35.9	Very low	104 Å²	104	133 Å²	133	73%	0.727	77%	0.773	S	S	*	*			trans	-34.6	152.7	164.6	49.4	0	0	0	0	115.8
956	V	38.2	Very low	36.3	Very low	130 Å²	130	132.8 Å²	132.8	79%	0.788	78%	0.776	S	S	*	*			cis	-129.2	149.5	38.3	175.1	0	0	0	0	113.8
957	N	33.1	Very low	36.5	Very low	124 Å²	124	132.6 Å²	132.6	66%	0.663	78%	0.783	S	S	*	*			trans	-112.1	116.3	176.3	170.9	39.2	0	0	0	110.4
958	I	37.1	Very low	36.4	Very low	163 Å²	163	133 Å²	133	84%	0.836	78%	0.781	S	S	*	*			trans	-125.6	119	151.9	-61.8	-176.7	0	0	0	106.3
959	R	32.9	Very low	36.2	Very low	217 Å²	217	129.8 Å²	129.8	82%	0.819	78%	0.775	S	S	*	*			trans	-113.6	173.1	-176.6	-110.5	-158.6	178.7	-142	1.5	110.2
960	P	39.8	Very low	36.2	Very low	106 Å²	106	130.3 Å²	130.3	69%	0.688	78%	0.779	S	S	*	*			trans	-93.8	178.8	-139.6	39.8	-40.1	0	0	0	113.3
961	M	35.9	Very low	36.2	Very low	186 Å²	186	132.6 Å²	132.6	92%	0.916	78%	0.783	S	S	*	*			trans	-139.1	135.2	147.6	-169.7	158.4	167.8	0	0	110.2
962	E	31.8	Very low	36.2	Very low	179 Å²	179	129 Å²	129	84%	0.836	78%	0.777	S	S	*	*			trans	-86.9	142.2	177.7	-63.1	155.2	120.9	0	0	109.9
963	A	37.1	Very low	36.5	Very low	101 Å²	101	131.5 Å²	131.5	84%	0.835	79%	0.786	S	S	*	*			trans	-143.2	128.7	165.5	0	0	0	0	0	108.6
964	A	36.5	Very low	36.8	Very low	109 Å²	109	130.8 Å²	130.8	90%	0.901	78%	0.777	S	S	*	*			trans	-71.5	133.8	-164.7	0	0	0	0	0	113.9
965	C	31.1	Very low	37.6	Very low	129 Å²	129	130.3 Å²	130.3	87%	0.872	77%	0.766	S	S	*	*			trans	-120.4	137.5	149.2	-74.1	0	0	0	0	109.2
966	T	41.2	Very low	38.6	Very low	115 Å²	115	129.9 Å²	129.9	71%	0.706	76%	0.761	S	S	*	*			trans	-65.2	156.4	179.4	43.9	0	0	0	0	112.2	V968	T966-V968 VanDerWaalsContact C-N 3.32Å; T966-V968 PolarHBondContact O-N 3.47Å
967	P	33	Very low	39.6	Very low	134 Å²	134	127.4 Å²	127.4	87%	0.87	74%	0.743	S	S	*	*			trans	-68.4	89.1	173.3	30.1	-35	0	0	0	110.3	A969	P967-A969 PolarHBondContact O-N 3.35Å
968	V	35.1	Very low	41	Very low	119 Å²	119	125.8 Å²	125.8	72%	0.721	73%	0.731	S	S	*	*			trans	-63.7	126.7	166.3	179	0	0	0	0	107.2	T966 S970	T966-V968 VanDerWaalsContact C-N 3.32Å; T966-V968 PolarHBondContact O-N 3.47Å; V968-S970 PolarHBondContact O-N 2.84Å
969	A	32.3	Very low	42.5	Very low	82 Å²	82	120.6 Å²	120.6	68%	0.678	71%	0.707	S	S	*	*			trans	-67.6	97.2	178.6	0	0	0	0	0	109.6	P967 N971	P967-A969 PolarHBondContact O-N 3.35Å; A969-N971 PolarHBondContact O-N 2.92Å
970	S	35.6	Very low	44.3	Very low	109 Å²	109	110.4 Å²	110.4	76%	0.762	67%	0.669	S	S	*	*			trans	-69.3	76.4	171.7	-61.5	0	0	0	0	110.3	V968 S972	V968-S970 PolarHBondContact O-N 2.84Å; S970-S972 PolarHBondContact O-N 2.81Å
971	N	38.3	Very low	45.9	Very low	150 Å²	150	109 Å²	109	80%	0.802	65%	0.654	S	S	*	*			trans	-65.3	77.6	154.2	-71	-10.3	0	0	0	107.1	A969 E973	A969-N971 PolarHBondContact O-N 2.92Å; N971-E973 PolarHBondContact O-N 2.95Å
972	S	41.9	Very low	48	Very low	94 Å²	94	103.9 Å²	103.9	66%	0.657	63%	0.63	S	S	*	*			trans	-59.5	118.5	167.3	52	0	0	0	0	107.5	S970 T974	S970-S972 PolarHBondContact O-N 2.81Å; S972-T974 PolarHBondContact O-N 3.48Å
973	E	43.1	Very low	50.2	Low	196 Å²	196	98 Å²	98	92%	0.916	60%	0.602	S	S	*	*			trans	-56	106.3	169.5	-73.3	169.3	82.8	0	0	108	N971 D975	N971-E973 PolarHBondContact O-N 2.95Å; E973-D975 PolarHBondContact O-N 3.35Å
974	T	46.2	Very low	52.2	Low	96 Å²	96	94.8 Å²	94.8	59%	0.589	57%	0.571	S	S	*	*			trans	-63.5	120.8	177.4	-50.3	0	0	0	0	107.7	S972 T979	S972-T974 PolarHBondContact O-N 3.48Å; T974-T979 WeakPolarHBondContact CG2-OG1 3.24Å
975	D	54.3	Low	54.3	Low	94 Å²	94	94.4 Å²	94.4	50%	0.503	55%	0.549	S	S	.	.			trans	-49.8	129.2	179.6	-164.4	-42.7	0	0	0	110.1	E973 D977 Q978 T979	E973-D975 PolarHBondContact O-N 3.35Å; D975-D977 PolarHBondContact O-N 3.38Å; D975-D977 VanDerWaalsContact O-N 3.09Å; D975-D977 WeakPolarHBondContact OD1-CB 3.42Å; D975-D977 PolarHBondContact OD1-N 2.88Å; D975-Q978 HydrophobicContact CB-CB 4.15Å; D975-Q978 PolarHBondContact O-N 2.82Å; D975-Q978 VanDerWaalsContact O-N 3.07Å; D975-T979 PolarHBondContact O-N 3.35Å; D975-T979 PolarHBondContact O-OG1 3.23Å; D975-T979 VanDerWaalsContact O-OG1 3.13Å
976	P	56.7	Low	56.7	Low	95 Å²	95	93.7 Å²	93.7	62%	0.617	53%	0.531	S	S	*	.	H	α-helix	trans	-59	-16.6	173.8	25.8	-35.8	0	0	0	112.7	R1057	P976-R1057 PolarHBondContact O-NH2 2.69Å
977	D	59.1	Low	58.7	Low	77 Å²	77	88.7 Å²	88.7	41%	0.412	50%	0.5	S	S	.	.	H	α-helix	trans	-72.6	-54.3	168.5	-151.8	-4.1	0	0	0	112.4	D975 T979 V980 E981 R1057	D975-D977 PolarHBondContact O-N 3.38Å; D975-D977 VanDerWaalsContact O-N 3.09Å; D975-D977 WeakPolarHBondContact OD1-CB 3.42Å; D975-D977 PolarHBondContact OD1-N 2.88Å; D977-T979 PolarHBondContact O-N 2.81Å; D977-T979 VanDerWaalsContact O-N 3.13Å; D977-V980 PolarHBondContact O-N 3.04Å; D977-E981 PolarHBondContact O-N 2.66Å; D977-R1057 VanDerWaalsContact CA-NH2 3.35Å; D977-R1057 IonicContact OD1-CZ 2.74Å; D977-R1057 IonicContact OD1-NH1 2.75Å; D977-R1057 PolarHBondContact OD1-NH1 2.75Å; D977-R1057 IonicContact OD1-NH2 2.58Å; D977-R1057 PolarHBondContact OD1-NH2 3.14Å; D977-R1057 IonicContact OD2-NH1 2.66Å
978	Q	61	Low	61.1	Low	90 Å²	90	83.6 Å²	83.6	42%	0.421	47%	0.466	S	S	.	.	H	α-helix	trans	-59.2	-33.2	-175.9	-167	60.2	85.8	0	0	113.1	D975 E981 D982	D975-Q978 HydrophobicContact CB-CB 4.15Å; D975-Q978 PolarHBondContact O-N 2.82Å; D975-Q978 VanDerWaalsContact O-N 3.07Å; Q978-E981 PolarHBondContact O-N 2.85Å; Q978-D982 PolarHBondContact NE2-OD1 2.77Å; Q978-D982 PolarHBondContact O-N 2.94Å
979	T	68.3	Low	63.4	Low	54 Å²	54	84.6 Å²	84.6	33%	0.331	46%	0.463	S	S	.	.	H	α-helix	trans	-66.4	-36.1	179	-53.8	0	0	0	0	113	T974 D975 D977 E983 L1053	T974-T979 WeakPolarHBondContact CG2-OG1 3.24Å; D975-T979 PolarHBondContact O-N 3.35Å; D975-T979 PolarHBondContact O-OG1 3.23Å; D975-T979 VanDerWaalsContact O-OG1 3.13Å; D977-T979 PolarHBondContact O-N 2.81Å; D977-T979 VanDerWaalsContact O-N 3.13Å; T979-E983 PolarHBondContact O-N 3.32Å; T979-L1053 HydrophobicContact CG2-CD2 3.95Å
980	V	71	Confident	66	Low	4 Å²	4	82.2 Å²	82.2	2%	0.024	44%	0.437	C	S	.	.	H	α-helix	trans	-70.1	-44.4	176.6	169.9	0	0	0	0	110.1	D977 D982 E983 L984 F1050 L1053 R1057	D977-V980 PolarHBondContact O-N 3.04Å; V980-D982 VanDerWaalsContact C-N 3.34Å; V980-D982 PolarHBondContact O-N 2.91Å; V980-E983 PolarHBondContact O-N 2.91Å; V980-L984 WeakPolarHBondContact O-CB 3.5Å; V980-L984 PolarHBondContact O-N 3.24Å; V980-F1050 HydrophobicContact CG1-CD2 3.83Å; V980-F1050 HydrophobicContact CG1-CE2 3.4Å; V980-F1050 HydrophobicContact CG1-CZ 4.31Å; V980-F1050 WeakPolarHBondContact O-CD2 3.48Å; V980-L1053 HydrophobicContact CG2-CB 4.15Å; V980-L1053 HydrophobicContact CG2-CD2 3.49Å; V980-L1053 VanDerWaalsContact CG2-CD2 3.49Å; V980-L1053 HydrophobicContact CG2-CG 3.54Å; V980-R1057 VanDerWaalsContact CG2-NH2 3.3Å
981	E	75.2	Confident	68.3	Low	77 Å²	77	77 Å²	77	36%	0.36	40%	0.4	S	S	.	.	H	α-helix	trans	-61.8	-38	177.1	-81.5	-58.6	118.9	0	0	113.1	D977 Q978 L984 K985	D977-E981 PolarHBondContact O-N 2.66Å; Q978-E981 PolarHBondContact O-N 2.85Å; E981-L984 PolarHBondContact O-N 3.22Å; E981-K985 WeakPolarHBondContact O-CD 3.32Å; E981-K985 WeakPolarHBondContact O-CE 3.27Å; E981-K985 WeakPolarHBondContact O-CG 3.37Å; E981-K985 PolarHBondContact O-N 3.24Å
982	D	79.8	Confident	70.3	Confident	77 Å²	77	74.1 Å²	74.1	41%	0.412	38%	0.382	S	S	.	.	H	α-helix	trans	-74.1	-35.1	179.9	-71.6	-13.1	0	0	0	112.6	Q978 V980 K985 K986	Q978-D982 PolarHBondContact NE2-OD1 2.77Å; Q978-D982 PolarHBondContact O-N 2.94Å; V980-D982 VanDerWaalsContact C-N 3.34Å; V980-D982 PolarHBondContact O-N 2.91Å; D982-K985 IonicContact OD1-NZ 3.19Å; D982-K985 PolarHBondContact OD1-NZ 3.17Å; D982-K986 VanDerWaalsContact O-CB 3.23Å; D982-K986 WeakPolarHBondContact O-CB 3.37Å; D982-K986 PolarHBondContact O-N 3.47Å
983	E	76.8	Confident	72.3	Confident	55 Å²	55	74 Å²	74	26%	0.257	38%	0.382	S	S	.	.	H	α-helix	trans	-68.7	-32.3	168.3	-70.6	-64.5	123.6	0	0	112.2	T979 V980 K986 L987 F1050	T979-E983 PolarHBondContact O-N 3.32Å; V980-E983 PolarHBondContact O-N 2.91Å; E983-K986 PolarHBondContact O-N 3.5Å; E983-K986 VanDerWaalsContact OE1-CD 3.25Å; E983-K986 WeakPolarHBondContact OE1-CD 3.5Å; E983-K986 IonicContact OE1-NZ 3.9Å; E983-K986 PolarHBondContact OE1-NZ 3.28Å; E983-K986 WeakPolarHBondContact OE2-CD 3.44Å; E983-K986 IonicContact OE2-NZ 2.68Å; E983-K986 PolarHBondContact OE2-NZ 3.23Å; E983-L987 WeakPolarHBondContact O-CB 3.49Å; E983-L987 PolarHBondContact O-N 2.81Å; E983-F1050 HydrophobicContact CB-CB 4.15Å; E983-F1050 HydrophobicContact CB-CD2 4.44Å
984	L	78.7	Confident	74	Confident	35 Å²	35	69.8 Å²	69.8	18%	0.183	36%	0.357	C	S	.	.	H	α-helix	trans	-67	-43.8	173.2	-176.3	57.4	0	0	0	112.1	V980 E981 K986 L987 T988 A1014 F1050	V980-L984 WeakPolarHBondContact O-CB 3.5Å; V980-L984 PolarHBondContact O-N 3.24Å; E981-L984 PolarHBondContact O-N 3.22Å; L984-K986 VanDerWaalsContact C-N 3.33Å; L984-K986 PolarHBondContact O-N 3.06Å; L984-L987 PolarHBondContact O-N 3.3Å; L984-T988 VanDerWaalsContact O-CB 3.32Å; L984-T988 WeakPolarHBondContact O-CB 3.32Å; L984-T988 PolarHBondContact O-N 3.41Å; L984-T988 PolarHBondContact O-OG1 2.91Å; L984-A1014 HydrophobicContact CD1-CB 4.07Å; L984-F1050 HydrophobicContact CB-CD2 4.12Å; L984-F1050 HydrophobicContact CB-CE2 3.71Å; L984-F1050 HydrophobicContact CB-CZ 4.45Å; L984-F1050 HydrophobicContact CD1-CE2 4.13Å; L984-F1050 HydrophobicContact CD1-CZ 4.04Å; L984-F1050 HydrophobicContact CD2-CE2 4.37Å; L984-F1050 HydrophobicContact CG-CE2 4.28Å
985	K	80.8	Confident	75.4	Confident	100 Å²	100	65.6 Å²	65.6	44%	0.435	33%	0.331	S	S	.	.	H	α-helix	trans	-60.4	-43.4	174.3	-69.5	159.8	-150.9	162.8	0	111.2	E981 D982 T988 Q989	E981-K985 WeakPolarHBondContact O-CD 3.32Å; E981-K985 WeakPolarHBondContact O-CE 3.27Å; E981-K985 WeakPolarHBondContact O-CG 3.37Å; E981-K985 PolarHBondContact O-N 3.24Å; D982-K985 IonicContact OD1-NZ 3.19Å; D982-K985 PolarHBondContact OD1-NZ 3.17Å; K985-T988 PolarHBondContact O-N 3.46Å; K985-Q989 WeakPolarHBondContact O-CB 3.38Å; K985-Q989 PolarHBondContact O-N 3.07Å
986	K	82.9	Confident	76.2	Confident	115 Å²	115	64.1 Å²	64.1	50%	0.5	34%	0.338	S	S	.	.	H	α-helix	trans	-64.6	-41.8	176.4	177.4	-168.6	177.6	-164.6	0	112.4	D982 E983 L984 W990	D982-K986 VanDerWaalsContact O-CB 3.23Å; D982-K986 WeakPolarHBondContact O-CB 3.37Å; D982-K986 PolarHBondContact O-N 3.47Å; E983-K986 PolarHBondContact O-N 3.5Å; E983-K986 VanDerWaalsContact OE1-CD 3.25Å; E983-K986 WeakPolarHBondContact OE1-CD 3.5Å; E983-K986 IonicContact OE1-NZ 3.9Å; E983-K986 PolarHBondContact OE1-NZ 3.28Å; E983-K986 WeakPolarHBondContact OE2-CD 3.44Å; E983-K986 IonicContact OE2-NZ 2.68Å; E983-K986 PolarHBondContact OE2-NZ 3.23Å; L984-K986 VanDerWaalsContact C-N 3.33Å; L984-K986 PolarHBondContact O-N 3.06Å; K986-W990 PolarHBondContact O-N 3.32Å; K986-W990 VanDerWaalsContact O-N 3.09Å
987	L	82.7	Confident	76.8	Confident	9 Å²	9	62.1 Å²	62.1	5%	0.047	33%	0.326	C	S	.	.	H	α-helix	trans	-62.5	-46.6	171.6	-177.5	64.6	0	0	0	110.7	E983 L984 Q989 W990 C991 F1043 R1046 R1047	E983-L987 WeakPolarHBondContact O-CB 3.49Å; E983-L987 PolarHBondContact O-N 2.81Å; L984-L987 PolarHBondContact O-N 3.3Å; L987-Q989 PolarHBondContact O-N 3.23Å; L987-W990 HydrophobicContact CD1-CE3 4.36Å; L987-W990 PolarHBondContact O-N 3.26Å; L987-C991 WeakPolarHBondContact O-CB 3.44Å; L987-C991 PolarHBondContact O-N 3.05Å; L987-C991 PolarHBondContact O-SG 3.17Å; L987-F1043 HydrophobicContact CD1-CD2 4.04Å; L987-F1043 HydrophobicContact CD1-CE2 3.98Å; L987-F1043 HydrophobicContact CD2-CE2 3.92Å; L987-F1043 HydrophobicContact CD2-CZ 4.35Å; L987-F1043 HydrophobicContact CG-CE2 4.09Å; L987-R1046 HydrophobicContact CD1-CB 3.86Å; L987-R1047 HydrophobicContact CD2-CB 4.4Å; L987-R1047 HydrophobicContact CD2-CG 4.06Å
988	T	83.3	Confident	77.2	Confident	27 Å²	27	59.6 Å²	59.6	17%	0.166	31%	0.312	C	S	.	.	H	α-helix	trans	-61	-44.4	178.3	-56.3	0	0	0	0	112.1	L984 K985 W990 C991 Q992 V1010	L984-T988 VanDerWaalsContact O-CB 3.32Å; L984-T988 WeakPolarHBondContact O-CB 3.32Å; L984-T988 PolarHBondContact O-N 3.41Å; L984-T988 PolarHBondContact O-OG1 2.91Å; K985-T988 PolarHBondContact O-N 3.46Å; T988-W990 PolarHBondContact O-N 3.1Å; T988-C991 PolarHBondContact O-N 3.3Å; T988-Q992 WeakPolarHBondContact O-CB 3.45Å; T988-Q992 VanDerWaalsContact O-CG 3.3Å; T988-Q992 WeakPolarHBondContact O-CG 3.5Å; T988-Q992 PolarHBondContact O-N 3.21Å; T988-V1010 HydrophobicContact CG2-CB 4.49Å; T988-V1010 HydrophobicContact CG2-CG1 4.42Å; T988-V1010 WeakPolarHBondContact OG1-CG1 3.4Å
989	Q	84.1	Confident	77.5	Confident	140 Å²	140	60.4 Å²	60.4	65%	0.654	33%	0.326	S	S	*	.	H	α-helix	trans	-62.9	-40.5	175.9	-170.4	-176.4	31.2	0	0	111.8	K985 L987 S993	K985-Q989 WeakPolarHBondContact O-CB 3.38Å; K985-Q989 PolarHBondContact O-N 3.07Å; L987-Q989 PolarHBondContact O-N 3.23Å; Q989-S993 WeakPolarHBondContact O-CB 3.32Å; Q989-S993 PolarHBondContact O-N 3.5Å
990	W	86.6	Confident	77.5	Confident	33 Å²	33	60.4 Å²	60.4	13%	0.125	32%	0.322	C	S	.	.	H	α-helix	trans	-65.9	-44	173.7	174.9	74.7	0	0	0	111.9	K986 L987 T988 Q992 S993 R994 F1039 D1042 F1043 R1046	K986-W990 PolarHBondContact O-N 3.32Å; K986-W990 VanDerWaalsContact O-N 3.09Å; L987-W990 HydrophobicContact CD1-CE3 4.36Å; L987-W990 PolarHBondContact O-N 3.26Å; T988-W990 PolarHBondContact O-N 3.1Å; W990-Q992 PolarHBondContact O-N 2.99Å; W990-S993 WeakPolarHBondContact O-CB 3.44Å; W990-S993 PolarHBondContact O-N 2.96Å; W990-R994 HydrophobicContact CH2-CB 4.47Å; W990-R994 HydrophobicContact CH2-CG 4.28Å; W990-R994 HydrophobicContact CZ2-CB 4.06Å; W990-R994 HydrophobicContact CZ2-CG 3.76Å; W990-R994 WeakPolarHBondContact O-CB 3.47Å; W990-R994 PolarHBondContact O-N 3.48Å; W990-F1039 AromaticContact CH2-CD2 3.71Å; W990-F1039 HydrophobicContact CH2-CD2 3.71Å; W990-F1039 AromaticContact CH2-CE2 3.67Å; W990-F1039 HydrophobicContact CH2-CE2 3.67Å; W990-F1039 HydrophobicContact CZ2-CD2 4.45Å; W990-F1039 HydrophobicContact CZ3-CD2 4.24Å; W990-F1039 AromaticContact CZ3-CE2 3.71Å; W990-F1039 HydrophobicContact CZ3-CE2 3.71Å; W990-F1039 HydrophobicContact CZ3-CZ 4.34Å; W990-D1042 HydrophobicContact CH2-CB 3.46Å; W990-D1042 VanDerWaalsContact CH2-CB 3.46Å; W990-D1042 HydrophobicContact CZ2-CB 3.45Å; W990-D1042 VanDerWaalsContact CZ2-CB 3.45Å; W990-F1043 HydrophobicContact CH2-CB 4.21Å; W990-F1043 HydrophobicContact CZ3-CB 3.9Å; W990-F1043 HydrophobicContact CZ3-CD2 4.1Å; W990-R1046 VanDerWaalsContact CD1-CZ 3.42Å; W990-R1046 VanDerWaalsContact CD1-NH1 3.27Å; W990-R1046 VanDerWaalsContact CE2-NE 3.33Å
991	C	83.6	Confident	77.1	Confident	0 Å²	0	68.8 Å²	68.8	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-60.9	-43.1	175.7	-71.8	0	0	0	0	111.7	L987 T988 S993 R994 L995 V1010	L987-C991 WeakPolarHBondContact O-CB 3.44Å; L987-C991 PolarHBondContact O-N 3.05Å; L987-C991 PolarHBondContact O-SG 3.17Å; T988-C991 PolarHBondContact O-N 3.3Å; C991-S993 PolarHBondContact O-N 2.87Å; C991-R994 PolarHBondContact O-N 3.05Å; C991-L995 HydrophobicContact CB-CD1 4.21Å; C991-L995 WeakPolarHBondContact O-CA 3.47Å; C991-L995 WeakPolarHBondContact O-CB 3.33Å; C991-L995 VanDerWaalsContact O-CG 3.26Å; C991-L995 WeakPolarHBondContact O-CG 3.3Å; C991-L995 PolarHBondContact O-N 3.38Å; C991-V1010 HydrophobicContact CB-CG2 3.25Å
992	Q	80.7	Confident	76.7	Confident	88 Å²	88	69.9 Å²	69.9	41%	0.411	36%	0.359	S	S	.	.	H	α-helix	trans	-58.1	-46.3	172.5	-73	171.2	3.6	0	0	112	T988 W990 R994 G996 I1006	T988-Q992 WeakPolarHBondContact O-CB 3.45Å; T988-Q992 VanDerWaalsContact O-CG 3.3Å; T988-Q992 WeakPolarHBondContact O-CG 3.5Å; T988-Q992 PolarHBondContact O-N 3.21Å; W990-Q992 PolarHBondContact O-N 2.99Å; Q992-R994 VanDerWaalsContact C-N 3.33Å; Q992-R994 PolarHBondContact O-N 3.19Å; Q992-G996 WeakPolarHBondContact O-CA 3.37Å; Q992-G996 PolarHBondContact O-N 2.87Å; Q992-I1006 HydrophobicContact CB-CG2 4.46Å; Q992-I1006 HydrophobicContact CG-CB 4.37Å; Q992-I1006 HydrophobicContact CG-CG2 3.76Å
993	S	82.2	Confident	76.1	Confident	93 Å²	93	76.6 Å²	76.6	65%	0.65	38%	0.384	S	S	*	.	H	α-helix	trans	-61.8	-37	176.5	-179.2	0	0	0	0	113	Q989 W990 C991	Q989-S993 WeakPolarHBondContact O-CB 3.32Å; Q989-S993 PolarHBondContact O-N 3.5Å; W990-S993 WeakPolarHBondContact O-CB 3.44Å; W990-S993 PolarHBondContact O-N 2.96Å; C991-S993 PolarHBondContact O-N 2.87Å
994	R	79	Confident	75.7	Confident	107 Å²	107	76 Å²	76	40%	0.404	38%	0.384	S	S	.	.	H	α-helix	trans	-86.1	-45.6	-176.4	-152.9	63.7	156	168	-5.1	112.7	W990 C991 Q992 S997 F1039 D1042	W990-R994 HydrophobicContact CH2-CB 4.47Å; W990-R994 HydrophobicContact CH2-CG 4.28Å; W990-R994 HydrophobicContact CZ2-CB 4.06Å; W990-R994 HydrophobicContact CZ2-CG 3.76Å; W990-R994 WeakPolarHBondContact O-CB 3.47Å; W990-R994 PolarHBondContact O-N 3.48Å; C991-R994 PolarHBondContact O-N 3.05Å; Q992-R994 VanDerWaalsContact C-N 3.33Å; Q992-R994 PolarHBondContact O-N 3.19Å; R994-S997 WeakPolarHBondContact O-CB 3.35Å; R994-S997 PolarHBondContact O-N 3.46Å; R994-S997 PolarHBondContact O-OG 3.04Å; R994-F1039 HydrophobicContact CB-CD2 4.07Å; R994-F1039 HydrophobicContact CB-CE2 4.08Å; R994-F1039 HydrophobicContact CG-CD2 3.71Å; R994-F1039 HydrophobicContact CG-CE2 4.24Å; R994-D1042 IonicContact CZ-OD2 3.73Å; R994-D1042 IonicContact NE-OD2 3.18Å; R994-D1042 IonicContact NH2-OD2 3.47Å; R994-D1042 PolarHBondContact NH2-OD2 2.7Å
995	L	76.9	Confident	75.6	Confident	7 Å²	7	80.1 Å²	80.1	4%	0.037	41%	0.406	C	S	.	.	H	α-helix	trans	-69.7	-35	177.6	-65.2	172.5	0	0	0	112	C991 S997 M998 I1006 L1030 F1039	C991-L995 HydrophobicContact CB-CD1 4.21Å; C991-L995 WeakPolarHBondContact O-CA 3.47Å; C991-L995 WeakPolarHBondContact O-CB 3.33Å; C991-L995 VanDerWaalsContact O-CG 3.26Å; C991-L995 WeakPolarHBondContact O-CG 3.3Å; C991-L995 PolarHBondContact O-N 3.38Å; L995-S997 PolarHBondContact O-N 3.04Å; L995-M998 PolarHBondContact O-N 3.28Å; L995-I1006 HydrophobicContact CB-CD1 4.2Å; L995-I1006 HydrophobicContact CB-CG1 4.44Å; L995-I1006 HydrophobicContact CB-CG2 4.36Å; L995-I1006 HydrophobicContact CD1-CG2 3.77Å; L995-L1030 HydrophobicContact CD2-CD1 3.96Å; L995-L1030 HydrophobicContact CD2-CD2 3.7Å; L995-L1030 HydrophobicContact CD2-CG 4.22Å; L995-F1039 HydrophobicContact CD1-CE2 4.49Å; L995-F1039 HydrophobicContact CD1-CZ 4.04Å; L995-F1039 HydrophobicContact CD2-CD1 4.45Å; L995-F1039 HydrophobicContact CD2-CD2 4.31Å; L995-F1039 HydrophobicContact CD2-CE1 3.98Å; L995-F1039 HydrophobicContact CD2-CE2 3.82Å; L995-F1039 HydrophobicContact CD2-CZ 3.64Å; L995-F1039 HydrophobicContact CG-CE2 3.87Å; L995-F1039 HydrophobicContact CG-CZ 3.83Å
996	G	71.1	Confident	75.3	Confident	63 Å²	63	77.4 Å²	77.4	65%	0.649	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-8.9	170.5	0	0	0	0	0	114.5	Q992	Q992-G996 WeakPolarHBondContact O-CA 3.37Å; Q992-G996 PolarHBondContact O-N 2.87Å
997	S	68.3	Low	74.9	Confident	54 Å²	54	75 Å²	75	38%	0.378	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	-0.8	173.7	80.3	0	0	0	0	114.2	R994 L995 R1035	R994-S997 WeakPolarHBondContact O-CB 3.35Å; R994-S997 PolarHBondContact O-N 3.46Å; R994-S997 PolarHBondContact O-OG 3.04Å; L995-S997 PolarHBondContact O-N 3.04Å; S997-R1035 VanDerWaalsContact CB-NH2 3.33Å; S997-R1035 PolarHBondContact O-NH1 3.27Å; S997-R1035 PolarHBondContact O-NH2 3.32Å; S997-R1035 PolarHBondContact OG-NH2 2.96Å
998	M	68.4	Low	74.8	Confident	24 Å²	24	78 Å²	78	12%	0.118	41%	0.411	C	S	.	.	S	Bend	trans	-125.4	143.2	-175.2	-67.7	-173.6	67.3	0	0	111.7	L995 M1000 L1030 R1035 F1039	L995-M998 PolarHBondContact O-N 3.28Å; M998-M1000 PolarHBondContact O-N 2.95Å; M998-L1030 HydrophobicContact CE-CD2 3.77Å; M998-L1030 HydrophobicContact SD-CD2 4.05Å; M998-R1035 HydrophobicContact CE-CB 3.96Å; M998-R1035 HydrophobicContact CE-CG 3.81Å; M998-R1035 HydrophobicContact CG-CG 4.49Å; M998-R1035 HydrophobicContact SD-CG 3.88Å; M998-F1039 HydrophobicContact SD-CB 4.4Å
999	P	66.5	Low	74.8	Confident	107 Å²	107	76.8 Å²	76.8	70%	0.695	40%	0.404	S	S	*	.			trans	-73.9	112.5	176.2	30	-32.7	0	0	0	110.2
1000	M	68	Low	74.6	Confident	54 Å²	54	70.1 Å²	70.1	27%	0.266	37%	0.373	S	S	.	.			trans	-77.1	134.9	169.8	-149.9	136.6	81	0	0	109.4	M998 V1004 I1006 V1009 F1029 L1030	M998-M1000 PolarHBondContact O-N 2.95Å; M1000-V1004 WeakPolarHBondContact CE-O 3.41Å; M1000-I1006 HydrophobicContact CE-CG1 4.4Å; M1000-V1009 HydrophobicContact CE-CG2 3.75Å; M1000-V1009 HydrophobicContact SD-CG2 4.19Å; M1000-F1029 HydrophobicContact CG-CB 4.34Å; M1000-F1029 WeakPolarHBondContact CG-O 3.49Å; M1000-F1029 HydrophobicContact SD-CB 4.5Å; M1000-L1030 HydrophobicContact CG-CD1 4.46Å; M1000-L1030 HydrophobicContact SD-CD1 4.2Å
1001	R	63.4	Low	74.3	Confident	179 Å²	179	74.8 Å²	74.8	68%	0.675	40%	0.396	S	S	*	.	S	Bend	trans	-77.1	-28.5	-177.7	-64.2	-173.1	171.1	-152	1.1	112.6	F1029 L1030 G1031	R1001-F1029 WeakPolarHBondContact CB-O 3.48Å; R1001-F1029 PolarHBondContact N-O 3.38Å; R1001-L1030 PolarHBondContact NE-O 3.31Å; R1001-G1031 VanDerWaalsContact CZ-CA 3.44Å
1002	E	67.8	Low	74.2	Confident	101 Å²	101	77.1 Å²	77.1	47%	0.472	41%	0.408	S	S	.	.	S	Bend	trans	-116.6	150.9	-174.7	-161.7	167.3	-167.3	0	0	111.2	V1004 F1029	E1002-V1004 HydrophobicContact CB-CG2 4.32Å; E1002-V1004 HydrophobicContact CG-CG2 3.99Å; E1002-V1004 PolarHBondContact O-N 3.3Å; E1002-F1029 HydrophobicContact CB-CD1 4.22Å; E1002-F1029 WeakPolarHBondContact OE2-CD1 3.33Å; E1002-F1029 VanDerWaalsContact OE2-CE1 3.31Å; E1002-F1029 WeakPolarHBondContact OE2-CE1 3.3Å
1003	K	65.7	Low	74.4	Confident	218 Å²	218	73 Å²	73	95%	0.948	39%	0.389	S	S	*	.			trans	-85.1	47.9	-174.6	-62.8	-176.3	179.1	179.6	0	112.6
1004	V	69.6	Low	74.1	Confident	41 Å²	41	69 Å²	69	25%	0.248	36%	0.361	C	S	.	.			trans	-94.3	144.1	174.6	-168.1	0	0	0	0	108.8	M1000 E1002 T1008 V1009 F1029	M1000-V1004 WeakPolarHBondContact CE-O 3.41Å; E1002-V1004 HydrophobicContact CB-CG2 4.32Å; E1002-V1004 HydrophobicContact CG-CG2 3.99Å; E1002-V1004 PolarHBondContact O-N 3.3Å; V1004-T1008 HydrophobicContact CG1-CG2 4.03Å; V1004-V1009 HydrophobicContact CB-CG2 3.73Å; V1004-V1009 HydrophobicContact CG1-CG2 3.56Å; V1004-F1029 HydrophobicContact CG2-CD1 4.33Å; V1004-F1029 HydrophobicContact CG2-CE1 3.87Å
1005	D	76.7	Confident	74.1	Confident	122 Å²	122	67.9 Å²	67.9	65%	0.652	37%	0.367	S	S	*	.			trans	-75.6	144.8	175	-77.6	-54.4	0	0	0	111.7	T1008 V1009	D1005-T1008 WeakPolarHBondContact O-CB 3.31Å; D1005-T1008 PolarHBondContact O-N 2.81Å; D1005-T1008 VanDerWaalsContact O-N 3.13Å; D1005-V1009 PolarHBondContact O-N 3.35Å
1006	I	73.8	Confident	74.2	Confident	44 Å²	44	69.4 Å²	69.4	23%	0.226	37%	0.374	C	S	.	.	H	α-helix	trans	-57.4	-43.5	-174.2	-60.8	171.6	0	0	0	113	Q992 L995 M1000 T1008 V1009 V1010	Q992-I1006 HydrophobicContact CB-CG2 4.46Å; Q992-I1006 HydrophobicContact CG-CB 4.37Å; Q992-I1006 HydrophobicContact CG-CG2 3.76Å; L995-I1006 HydrophobicContact CB-CD1 4.2Å; L995-I1006 HydrophobicContact CB-CG1 4.44Å; L995-I1006 HydrophobicContact CB-CG2 4.36Å; L995-I1006 HydrophobicContact CD1-CG2 3.77Å; M1000-I1006 HydrophobicContact CE-CG1 4.4Å; I1006-T1008 VanDerWaalsContact C-N 3.33Å; I1006-T1008 PolarHBondContact O-N 2.84Å; I1006-V1009 PolarHBondContact O-N 3.29Å; I1006-V1010 HydrophobicContact CG2-CG2 4.21Å; I1006-V1010 WeakPolarHBondContact O-CG2 3.19Å; I1006-V1010 PolarHBondContact O-N 3.35Å
1007	P	75.4	Confident	74.2	Confident	65 Å²	65	70 Å²	70	42%	0.422	36%	0.362	S	S	.	.	H	α-helix	trans	-56.1	-44.8	175.8	-25.5	35.8	0	0	0	112.9	V1009 V1010 E1011	P1007-V1009 PolarHBondContact O-N 3.48Å; P1007-V1010 PolarHBondContact O-N 3.15Å; P1007-V1010 VanDerWaalsContact O-N 3.08Å; P1007-E1011 WeakPolarHBondContact O-CB 3.44Å; P1007-E1011 PolarHBondContact O-N 3.48Å
1008	T	80.8	Confident	74.5	Confident	72 Å²	72	68 Å²	68	44%	0.442	35%	0.35	S	S	.	.	H	α-helix	trans	-63.8	-39.4	178.3	-49	0	0	0	0	111.9	V1004 D1005 I1006 V1010 L1012	V1004-T1008 HydrophobicContact CG1-CG2 4.03Å; D1005-T1008 WeakPolarHBondContact O-CB 3.31Å; D1005-T1008 PolarHBondContact O-N 2.81Å; D1005-T1008 VanDerWaalsContact O-N 3.13Å; I1006-T1008 VanDerWaalsContact C-N 3.33Å; I1006-T1008 PolarHBondContact O-N 2.84Å; T1008-V1010 VanDerWaalsContact C-N 3.33Å; T1008-L1012 VanDerWaalsContact O-CB 3.3Å; T1008-L1012 WeakPolarHBondContact O-CB 3.4Å; T1008-L1012 PolarHBondContact O-N 2.94Å
1009	V	81.6	Confident	74.9	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.006	35%	0.35	C	S	.	.	H	α-helix	trans	-63.8	-38.9	172.4	175.9	0	0	0	0	111.1	M1000 V1004 D1005 I1006 P1007 L1013 F1029	M1000-V1009 HydrophobicContact CE-CG2 3.75Å; M1000-V1009 HydrophobicContact SD-CG2 4.19Å; V1004-V1009 HydrophobicContact CB-CG2 3.73Å; V1004-V1009 HydrophobicContact CG1-CG2 3.56Å; D1005-V1009 PolarHBondContact O-N 3.35Å; I1006-V1009 PolarHBondContact O-N 3.29Å; P1007-V1009 PolarHBondContact O-N 3.48Å; V1009-L1013 HydrophobicContact CG1-CD1 3.66Å; V1009-L1013 HydrophobicContact CG1-CG 4.27Å; V1009-L1013 WeakPolarHBondContact O-CB 3.36Å; V1009-L1013 WeakPolarHBondContact O-CD1 3.39Å; V1009-L1013 WeakPolarHBondContact O-CG 3.35Å; V1009-L1013 PolarHBondContact O-N 3.36Å; V1009-F1029 HydrophobicContact CG1-CD2 3.84Å; V1009-F1029 HydrophobicContact CG1-CE2 4.2Å; V1009-F1029 HydrophobicContact CG2-CD2 4.23Å; V1009-F1029 HydrophobicContact CG2-CE2 4.26Å
1010	V	81.1	Confident	75.7	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-69.6	-42.6	177.7	176.8	0	0	0	0	112.3	T988 C991 I1006 P1007 T1008 L1013 A1014	T988-V1010 HydrophobicContact CG2-CB 4.49Å; T988-V1010 HydrophobicContact CG2-CG1 4.42Å; T988-V1010 WeakPolarHBondContact OG1-CG1 3.4Å; C991-V1010 HydrophobicContact CB-CG2 3.25Å; I1006-V1010 HydrophobicContact CG2-CG2 4.21Å; I1006-V1010 WeakPolarHBondContact O-CG2 3.19Å; I1006-V1010 PolarHBondContact O-N 3.35Å; P1007-V1010 PolarHBondContact O-N 3.15Å; P1007-V1010 VanDerWaalsContact O-N 3.08Å; T1008-V1010 VanDerWaalsContact C-N 3.33Å; V1010-L1013 CarbonylContact O-C 3.42Å; V1010-L1013 PolarHBondContact O-N 2.89Å; V1010-A1014 VanDerWaalsContact O-CB 3.31Å; V1010-A1014 WeakPolarHBondContact O-CB 3.43Å; V1010-A1014 PolarHBondContact O-N 3.02Å
1011	E	78.9	Confident	76.4	Confident	130 Å²	130	71.5 Å²	71.5	61%	0.607	35%	0.352	S	S	*	.	H	α-helix	trans	-61.8	-45.4	177.5	-174.5	179.1	-177.6	0	0	111.3	P1007 A1014 T1015	P1007-E1011 WeakPolarHBondContact O-CB 3.44Å; P1007-E1011 PolarHBondContact O-N 3.48Å; E1011-A1014 PolarHBondContact O-N 3.02Å; E1011-A1014 VanDerWaalsContact O-N 3.14Å; E1011-T1015 WeakPolarHBondContact O-CG2 3.34Å; E1011-T1015 PolarHBondContact O-N 3.32Å; E1011-T1015 PolarHBondContact O-OG1 2.92Å
1012	L	83.3	Confident	77.4	Confident	50 Å²	50	63 Å²	63	26%	0.262	32%	0.32	S	S	.	.	H	α-helix	trans	-64.7	-39.6	173.6	-162	64.4	0	0	0	111.4	T1008 A1014 T1015 L1016 M1025 F1029	T1008-L1012 VanDerWaalsContact O-CB 3.3Å; T1008-L1012 WeakPolarHBondContact O-CB 3.4Å; T1008-L1012 PolarHBondContact O-N 2.94Å; L1012-A1014 VanDerWaalsContact C-N 3.28Å; L1012-A1014 PolarHBondContact O-N 2.92Å; L1012-T1015 WeakPolarHBondContact CA-OG1 3.46Å; L1012-T1015 PolarHBondContact O-OG1 3.33Å; L1012-T1015 VanDerWaalsContact O-OG1 3.04Å; L1012-L1016 WeakPolarHBondContact O-CG 3.47Å; L1012-L1016 PolarHBondContact O-N 3.16Å; L1012-M1025 HydrophobicContact CB-CE 3.91Å; L1012-M1025 HydrophobicContact CD2-CE 3.93Å; L1012-M1025 HydrophobicContact CD2-SD 3.44Å; L1012-M1025 WeakPolarHBondContact CD2-SD 3.33Å; L1012-M1025 HydrophobicContact CG-CE 3.59Å; L1012-M1025 HydrophobicContact CG-SD 3.62Å; L1012-F1029 HydrophobicContact CD2-CE2 4.17Å; L1012-F1029 HydrophobicContact CD2-CZ 4.03Å
1013	L	83.2	Confident	78.2	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-71.6	-16.8	173.4	-72.5	169.5	0	0	0	114	V1009 V1010 V1022 M1025 V1026 F1043 R1047	V1009-L1013 HydrophobicContact CG1-CD1 3.66Å; V1009-L1013 HydrophobicContact CG1-CG 4.27Å; V1009-L1013 WeakPolarHBondContact O-CB 3.36Å; V1009-L1013 WeakPolarHBondContact O-CD1 3.39Å; V1009-L1013 WeakPolarHBondContact O-CG 3.35Å; V1009-L1013 PolarHBondContact O-N 3.36Å; V1010-L1013 CarbonylContact O-C 3.42Å; V1010-L1013 PolarHBondContact O-N 2.89Å; L1013-V1022 HydrophobicContact CD2-CG1 3.94Å; L1013-M1025 HydrophobicContact CB-CE 4.35Å; L1013-M1025 HydrophobicContact CD2-CE 3.47Å; L1013-M1025 VanDerWaalsContact CD2-CE 3.47Å; L1013-M1025 HydrophobicContact CG-CE 3.7Å; L1013-V1026 HydrophobicContact CD1-CG2 3.9Å; L1013-V1026 HydrophobicContact CD2-CG2 3.41Å; L1013-V1026 VanDerWaalsContact CD2-CG2 3.41Å; L1013-V1026 HydrophobicContact CG-CG2 4.33Å; L1013-F1043 HydrophobicContact CB-CE1 3.91Å; L1013-F1043 HydrophobicContact CB-CE2 4.2Å; L1013-F1043 HydrophobicContact CB-CZ 3.52Å; L1013-F1043 WeakPolarHBondContact O-CE1 3.4Å; L1013-F1043 WeakPolarHBondContact O-CZ 3.49Å; L1013-R1047 PolarHBondContact O-NH1 3.03Å
1014	A	75.7	Confident	79	Confident	8 Å²	8	59.7 Å²	59.7	7%	0.066	30%	0.3	C	S	.	.	H	α-helix	trans	-85.1	-35.4	176	0	0	0	0	0	111.8	L984 V1010 E1011 L1012 F1050 W1051	L984-A1014 HydrophobicContact CD1-CB 4.07Å; V1010-A1014 VanDerWaalsContact O-CB 3.31Å; V1010-A1014 WeakPolarHBondContact O-CB 3.43Å; V1010-A1014 PolarHBondContact O-N 3.02Å; E1011-A1014 PolarHBondContact O-N 3.02Å; E1011-A1014 VanDerWaalsContact O-N 3.14Å; L1012-A1014 VanDerWaalsContact C-N 3.28Å; L1012-A1014 PolarHBondContact O-N 2.92Å; A1014-F1050 HydrophobicContact CB-CE1 4.27Å; A1014-W1051 PolarHBondContact O-NE1 3.29Å
1015	T	79	Confident	79.7	Confident	85 Å²	85	59.1 Å²	59.1	52%	0.521	30%	0.295	S	S	.	.	H	α-helix	trans	-78.8	-27.5	-178.1	45.7	0	0	0	0	114.5	E1011 L1012 D1017	E1011-T1015 WeakPolarHBondContact O-CG2 3.34Å; E1011-T1015 PolarHBondContact O-N 3.32Å; E1011-T1015 PolarHBondContact O-OG1 2.92Å; L1012-T1015 WeakPolarHBondContact CA-OG1 3.46Å; L1012-T1015 PolarHBondContact O-OG1 3.33Å; L1012-T1015 VanDerWaalsContact O-OG1 3.04Å; T1015-D1017 PolarHBondContact O-N 3.26Å
1016	L	80.4	Confident	80	Confident	39 Å²	39	53.3 Å²	53.3	20%	0.204	26%	0.264	C	S	.	.			trans	-63.1	126.3	176.7	-74.8	-179.6	0	0	0	112.8	L1012 E1021 V1022 M1025 R1047	L1012-L1016 WeakPolarHBondContact O-CG 3.47Å; L1012-L1016 PolarHBondContact O-N 3.16Å; L1016-E1021 HydrophobicContact CB-CB 4.47Å; L1016-E1021 HydrophobicContact CD1-CB 3.9Å; L1016-E1021 HydrophobicContact CD2-CB 4.14Å; L1016-E1021 HydrophobicContact CG-CB 4.42Å; L1016-V1022 HydrophobicContact CB-CG2 3.9Å; L1016-V1022 HydrophobicContact CD1-CG2 4.31Å; L1016-M1025 HydrophobicContact CD1-CB 4.05Å; L1016-M1025 HydrophobicContact CD1-CE 3.34Å; L1016-M1025 HydrophobicContact CD1-SD 3.74Å; L1016-M1025 HydrophobicContact CG-CE 4.08Å; L1016-R1047 VanDerWaalsContact O-CZ 3.24Å; L1016-R1047 PolarHBondContact O-NH1 3Å; L1016-R1047 PolarHBondContact O-NH2 3.15Å
1017	D	70	Confident	80.5	Confident	74 Å²	74	54.4 Å²	54.4	40%	0.396	27%	0.268	S	S	.	.			trans	-74.4	-43	-178.1	-81.3	-9	0	0	0	112.4	T1015 W1051 R1058	T1015-D1017 PolarHBondContact O-N 3.26Å; D1017-W1051 HydrophobicContact CB-CH2 3.96Å; D1017-W1051 HydrophobicContact CB-CZ2 4.19Å; D1017-W1051 VanDerWaalsContact OD1-CH2 3.29Å; D1017-W1051 WeakPolarHBondContact OD1-CH2 3.34Å; D1017-W1051 WeakPolarHBondContact OD1-CZ2 3.31Å; D1017-R1058 IonicContact OD1-CZ 2.71Å; D1017-R1058 IonicContact OD1-NH2 2.62Å; D1017-R1058 PolarHBondContact OD1-NH2 2.83Å; D1017-R1058 IonicContact OD2-CZ 3.11Å; D1017-R1058 IonicContact OD2-NH1 2.7Å; D1017-R1058 IonicContact OD2-NH2 2.72Å; D1017-R1058 PolarHBondContact OD2-NH2 3.09Å
1018	A	74.7	Confident	80.9	Confident	14 Å²	14	55 Å²	55	12%	0.116	27%	0.271	C	S	.	.			trans	-93.6	136.9	-172.9	0	0	0	0	0	113.8	Y405 Y1020 E1021 V1022	Y405-A1018 HydrophobicContact CE1-CB 3.89Å; A1018-Y1020 VanDerWaalsContact C-N 3.3Å; A1018-Y1020 PolarHBondContact O-N 3.37Å; A1018-E1021 HydrophobicContact CB-CB 4.31Å; A1018-E1021 HydrophobicContact CB-CG 3.86Å; A1018-E1021 WeakPolarHBondContact CB-OE2 3.43Å; A1018-E1021 PolarHBondContact N-OE2 2.73Å; A1018-E1021 VanDerWaalsContact N-OE2 3.1Å; A1018-E1021 WeakPolarHBondContact O-CB 3.26Å; A1018-E1021 PolarHBondContact O-N 2.89Å; A1018-V1022 PolarHBondContact O-N 3.15Å
1019	P	77.7	Confident	80.8	Confident	19 Å²	19	52.3 Å²	52.3	12%	0.123	25%	0.253	C	S	.	.	H	α-helix	trans	-66.9	-25.9	176.8	26.8	-34.2	0	0	0	113.5	I404 E1021 V1022 E1023 L1044	I404-P1019 HydrophobicContact CB-CG 4.31Å; I404-P1019 HydrophobicContact CD1-CG 3.61Å; I404-P1019 HydrophobicContact CG1-CG 3.85Å; I404-P1019 HydrophobicContact CG2-CG 3.46Å; I404-P1019 VanDerWaalsContact CG2-CG 3.46Å; P1019-E1021 VanDerWaalsContact C-N 3.35Å; P1019-V1022 PolarHBondContact O-N 3.3Å; P1019-E1023 VanDerWaalsContact O-CB 3.3Å; P1019-E1023 WeakPolarHBondContact O-CB 3.48Å; P1019-E1023 PolarHBondContact O-N 2.95Å; P1019-L1044 HydrophobicContact CB-CD1 3.69Å; P1019-L1044 HydrophobicContact CB-CD2 3.72Å; P1019-L1044 HydrophobicContact CB-CG 4.39Å
1020	Y	82.6	Confident	80.8	Confident	143 Å²	143	52.7 Å²	52.7	56%	0.561	26%	0.255	S	S	*	.	H	α-helix	trans	-70.2	-30.1	169.8	-59.2	-34.8	0	0	0	112.5	Y405 A1018 R1024	Y405-Y1020 AromaticContact CE2-CD2 3.94Å; Y405-Y1020 HydrophobicContact CE2-CD2 3.94Å; Y405-Y1020 AromaticContact CE2-CE2 3.51Å; Y405-Y1020 HydrophobicContact CE2-CE2 3.51Å; Y405-Y1020 AromaticContact CZ-CD2 3.66Å; Y405-Y1020 AromaticContact CZ-CE2 3.76Å; Y405-Y1020 WeakPolarHBondContact OH-CD2 3.42Å; Y405-Y1020 WeakPolarHBondContact OH-CE2 3.45Å; A1018-Y1020 VanDerWaalsContact C-N 3.3Å; A1018-Y1020 PolarHBondContact O-N 3.37Å; Y1020-R1024 WeakPolarHBondContact O-CB 3.39Å; Y1020-R1024 PolarHBondContact O-N 3.4Å
1021	E	83.6	Confident	80.8	Confident	96 Å²	96	52.8 Å²	52.8	45%	0.449	26%	0.256	S	S	.	.	H	α-helix	trans	-71.4	-44.7	172.2	-63.6	167	154.3	0	0	110	L1016 A1018 P1019 E1023 R1024 M1025	L1016-E1021 HydrophobicContact CB-CB 4.47Å; L1016-E1021 HydrophobicContact CD1-CB 3.9Å; L1016-E1021 HydrophobicContact CD2-CB 4.14Å; L1016-E1021 HydrophobicContact CG-CB 4.42Å; A1018-E1021 HydrophobicContact CB-CB 4.31Å; A1018-E1021 HydrophobicContact CB-CG 3.86Å; A1018-E1021 WeakPolarHBondContact CB-OE2 3.43Å; A1018-E1021 PolarHBondContact N-OE2 2.73Å; A1018-E1021 VanDerWaalsContact N-OE2 3.1Å; A1018-E1021 WeakPolarHBondContact O-CB 3.26Å; A1018-E1021 PolarHBondContact O-N 2.89Å; P1019-E1021 VanDerWaalsContact C-N 3.35Å; E1021-E1023 VanDerWaalsContact C-N 3.35Å; E1021-E1023 PolarHBondContact O-N 3.45Å; E1021-R1024 PolarHBondContact O-N 2.91Å; E1021-M1025 VanDerWaalsContact O-CB 3.23Å; E1021-M1025 WeakPolarHBondContact O-CB 3.38Å; E1021-M1025 PolarHBondContact O-N 3.29Å
1022	V	84.6	Confident	81	Confident	0 Å²	0	54 Å²	54	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-54.3	-51.7	171.6	171.4	0	0	0	0	110	L1013 L1016 A1018 P1019 M1025 V1026 F1043 L1044	L1013-V1022 HydrophobicContact CD2-CG1 3.94Å; L1016-V1022 HydrophobicContact CB-CG2 3.9Å; L1016-V1022 HydrophobicContact CD1-CG2 4.31Å; A1018-V1022 PolarHBondContact O-N 3.15Å; P1019-V1022 PolarHBondContact O-N 3.3Å; V1022-M1025 PolarHBondContact O-N 2.75Å; V1022-V1026 HydrophobicContact CG1-CG2 4.46Å; V1022-V1026 WeakPolarHBondContact O-CB 3.32Å; V1022-V1026 VanDerWaalsContact O-CG2 3.26Å; V1022-V1026 WeakPolarHBondContact O-CG2 3.18Å; V1022-V1026 PolarHBondContact O-N 2.99Å; V1022-F1043 HydrophobicContact CG1-CD1 3.7Å; V1022-F1043 HydrophobicContact CG1-CE1 3.72Å; V1022-L1044 HydrophobicContact CB-CD2 4.25Å; V1022-L1044 HydrophobicContact CG1-CD2 3.91Å; V1022-L1044 HydrophobicContact CG1-CG 4.42Å; V1022-L1044 HydrophobicContact CG2-CD2 4.43Å
1023	E	83.7	Confident	81	Confident	65 Å²	65	54.7 Å²	54.7	30%	0.304	27%	0.268	S	S	.	.	H	α-helix	trans	-59	-52.3	177.9	177.5	162.2	-156.5	0	0	111.8	P1019 E1021 M1025 V1026 Q1027 V1040	P1019-E1023 VanDerWaalsContact O-CB 3.3Å; P1019-E1023 WeakPolarHBondContact O-CB 3.48Å; P1019-E1023 PolarHBondContact O-N 2.95Å; E1021-E1023 VanDerWaalsContact C-N 3.35Å; E1021-E1023 PolarHBondContact O-N 3.45Å; E1023-M1025 VanDerWaalsContact C-N 3.28Å; E1023-M1025 PolarHBondContact O-N 2.64Å; E1023-V1026 PolarHBondContact O-N 3.3Å; E1023-Q1027 HydrophobicContact CG-CG 4.19Å; E1023-Q1027 WeakPolarHBondContact O-CB 3.32Å; E1023-Q1027 VanDerWaalsContact O-CG 3.23Å; E1023-Q1027 WeakPolarHBondContact O-CG 3.44Å; E1023-Q1027 PolarHBondContact O-N 2.76Å; E1023-Q1027 PolarHBondContact OE1-NE2 3.38Å; E1023-V1040 HydrophobicContact CB-CG1 3.93Å; E1023-V1040 HydrophobicContact CG-CG1 4.27Å; E1023-V1040 HydrophobicContact CG-CG2 4.44Å
1024	R	83.4	Confident	81	Confident	184 Å²	184	58.9 Å²	58.9	69%	0.694	30%	0.303	S	S	*	.	H	α-helix	trans	-58.9	-38.4	179.3	-175.6	177.1	-175	-101.2	2.3	112.2	Y1020 E1021 T1028	Y1020-R1024 WeakPolarHBondContact O-CB 3.39Å; Y1020-R1024 PolarHBondContact O-N 3.4Å; E1021-R1024 PolarHBondContact O-N 2.91Å; R1024-T1028 PolarHBondContact O-N 3.49Å; R1024-T1028 PolarHBondContact O-OG1 3.14Å
1025	M	82.5	Confident	81.4	Confident	30 Å²	30	64.6 Å²	64.6	15%	0.148	32%	0.323	C	S	.	.	H	α-helix	trans	-75.8	-39.1	-179.8	-169.8	170.3	75	0	0	112.2	L1012 L1013 L1016 E1021 V1022 E1023 T1028 F1029	L1012-M1025 HydrophobicContact CB-CE 3.91Å; L1012-M1025 HydrophobicContact CD2-CE 3.93Å; L1012-M1025 HydrophobicContact CD2-SD 3.44Å; L1012-M1025 WeakPolarHBondContact CD2-SD 3.33Å; L1012-M1025 HydrophobicContact CG-CE 3.59Å; L1012-M1025 HydrophobicContact CG-SD 3.62Å; L1013-M1025 HydrophobicContact CB-CE 4.35Å; L1013-M1025 HydrophobicContact CD2-CE 3.47Å; L1013-M1025 VanDerWaalsContact CD2-CE 3.47Å; L1013-M1025 HydrophobicContact CG-CE 3.7Å; L1016-M1025 HydrophobicContact CD1-CB 4.05Å; L1016-M1025 HydrophobicContact CD1-CE 3.34Å; L1016-M1025 HydrophobicContact CD1-SD 3.74Å; L1016-M1025 HydrophobicContact CG-CE 4.08Å; E1021-M1025 VanDerWaalsContact O-CB 3.23Å; E1021-M1025 WeakPolarHBondContact O-CB 3.38Å; E1021-M1025 PolarHBondContact O-N 3.29Å; V1022-M1025 PolarHBondContact O-N 2.75Å; E1023-M1025 VanDerWaalsContact C-N 3.28Å; E1023-M1025 PolarHBondContact O-N 2.64Å; M1025-T1028 WeakPolarHBondContact O-CB 3.45Å; M1025-T1028 PolarHBondContact O-N 3.24Å; M1025-T1028 VanDerWaalsContact O-N 3.16Å; M1025-F1029 HydrophobicContact CE-CE2 4.19Å; M1025-F1029 HydrophobicContact CG-CD2 3.83Å; M1025-F1029 HydrophobicContact CG-CE2 3.41Å; M1025-F1029 VanDerWaalsContact CG-CE2 3.41Å; M1025-F1029 HydrophobicContact CG-CZ 4.15Å; M1025-F1029 WeakPolarHBondContact O-CD2 3.42Å; M1025-F1029 PolarHBondContact O-N 2.74Å; M1025-F1029 HydrophobicContact SD-CE2 3.84Å; M1025-F1029 HydrophobicContact SD-CZ 4.41Å
1026	V	84	Confident	81.6	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.2	-42.8	169.3	178.1	0	0	0	0	110.5	L1013 V1022 E1023 T1028 F1029 L1030 T1036 F1039 V1040	L1013-V1026 HydrophobicContact CD1-CG2 3.9Å; L1013-V1026 HydrophobicContact CD2-CG2 3.41Å; L1013-V1026 VanDerWaalsContact CD2-CG2 3.41Å; L1013-V1026 HydrophobicContact CG-CG2 4.33Å; V1022-V1026 HydrophobicContact CG1-CG2 4.46Å; V1022-V1026 WeakPolarHBondContact O-CB 3.32Å; V1022-V1026 VanDerWaalsContact O-CG2 3.26Å; V1022-V1026 WeakPolarHBondContact O-CG2 3.18Å; V1022-V1026 PolarHBondContact O-N 2.99Å; E1023-V1026 PolarHBondContact O-N 3.3Å; V1026-T1028 PolarHBondContact O-N 2.79Å; V1026-F1029 PolarHBondContact O-N 3.2Å; V1026-L1030 HydrophobicContact CG1-CB 4.48Å; V1026-L1030 HydrophobicContact CG1-CD1 4.07Å; V1026-L1030 HydrophobicContact CG1-CD2 3.88Å; V1026-L1030 HydrophobicContact CG1-CG 4.37Å; V1026-L1030 WeakPolarHBondContact O-CB 3.21Å; V1026-L1030 PolarHBondContact O-N 2.79Å; V1026-T1036 HydrophobicContact CG1-CG2 3.5Å; V1026-T1036 VanDerWaalsContact CG1-CG2 3.5Å; V1026-F1039 HydrophobicContact CG1-CD1 3.69Å; V1026-F1039 HydrophobicContact CG1-CE1 4.01Å; V1026-F1039 HydrophobicContact CG2-CD1 4.39Å; V1026-F1039 HydrophobicContact CG2-CE1 4.05Å; V1026-V1040 HydrophobicContact CB-CG2 3.76Å; V1026-V1040 HydrophobicContact CG1-CG2 3.71Å; V1026-V1040 HydrophobicContact CG2-CG2 4.13Å
1027	Q	84.4	Confident	81.8	Confident	66 Å²	66	61.2 Å²	61.2	31%	0.308	31%	0.309	S	S	.	.	H	α-helix	trans	-61.3	-29.6	173.9	-73.3	175	2.1	0	0	111.9	E1023 G1031 E1032	E1023-Q1027 HydrophobicContact CG-CG 4.19Å; E1023-Q1027 WeakPolarHBondContact O-CB 3.32Å; E1023-Q1027 VanDerWaalsContact O-CG 3.23Å; E1023-Q1027 WeakPolarHBondContact O-CG 3.44Å; E1023-Q1027 PolarHBondContact O-N 2.76Å; E1023-Q1027 PolarHBondContact OE1-NE2 3.38Å; Q1027-G1031 CarbonylContact O-C 3.58Å; Q1027-G1031 WeakPolarHBondContact O-CA 3.38Å; Q1027-G1031 PolarHBondContact O-N 3.05Å; Q1027-E1032 HydrophobicContact CB-CG 4.38Å; Q1027-E1032 HydrophobicContact CG-CG 4.15Å
1028	T	83.4	Confident	82.5	Confident	79 Å²	79	62.1 Å²	62.1	49%	0.485	31%	0.311	S	S	.	.	H	α-helix	trans	-70.4	-54.6	172.3	-56.4	0	0	0	0	110.9	R1024 M1025 V1026	R1024-T1028 PolarHBondContact O-N 3.49Å; R1024-T1028 PolarHBondContact O-OG1 3.14Å; M1025-T1028 WeakPolarHBondContact O-CB 3.45Å; M1025-T1028 PolarHBondContact O-N 3.24Å; M1025-T1028 VanDerWaalsContact O-N 3.16Å; V1026-T1028 PolarHBondContact O-N 2.79Å
1029	F	79.6	Confident	83.1	Confident	15 Å²	15	61.5 Å²	61.5	7%	0.066	31%	0.306	C	S	.	.	H	α-helix	trans	-71.1	-35.4	-175.9	-66.9	-46.7	0	0	0	114.5	M1000 R1001 E1002 V1004 V1009 L1012 M1025 V1026	M1000-F1029 HydrophobicContact CG-CB 4.34Å; M1000-F1029 WeakPolarHBondContact CG-O 3.49Å; M1000-F1029 HydrophobicContact SD-CB 4.5Å; R1001-F1029 WeakPolarHBondContact CB-O 3.48Å; R1001-F1029 PolarHBondContact N-O 3.38Å; E1002-F1029 HydrophobicContact CB-CD1 4.22Å; E1002-F1029 WeakPolarHBondContact OE2-CD1 3.33Å; E1002-F1029 VanDerWaalsContact OE2-CE1 3.31Å; E1002-F1029 WeakPolarHBondContact OE2-CE1 3.3Å; V1004-F1029 HydrophobicContact CG2-CD1 4.33Å; V1004-F1029 HydrophobicContact CG2-CE1 3.87Å; V1009-F1029 HydrophobicContact CG1-CD2 3.84Å; V1009-F1029 HydrophobicContact CG1-CE2 4.2Å; V1009-F1029 HydrophobicContact CG2-CD2 4.23Å; V1009-F1029 HydrophobicContact CG2-CE2 4.26Å; L1012-F1029 HydrophobicContact CD2-CE2 4.17Å; L1012-F1029 HydrophobicContact CD2-CZ 4.03Å; M1025-F1029 HydrophobicContact CE-CE2 4.19Å; M1025-F1029 HydrophobicContact CG-CD2 3.83Å; M1025-F1029 HydrophobicContact CG-CE2 3.41Å; M1025-F1029 VanDerWaalsContact CG-CE2 3.41Å; M1025-F1029 HydrophobicContact CG-CZ 4.15Å; M1025-F1029 WeakPolarHBondContact O-CD2 3.42Å; M1025-F1029 PolarHBondContact O-N 2.74Å; M1025-F1029 HydrophobicContact SD-CE2 3.84Å; M1025-F1029 HydrophobicContact SD-CZ 4.41Å; V1026-F1029 PolarHBondContact O-N 3.2Å
1030	L	81.1	Confident	83.6	Confident	9 Å²	9	61 Å²	61	5%	0.047	30%	0.302	C	S	.	.	H	α-helix	trans	-105.5	-25.8	-177.1	-74.9	64.1	0	0	0	112.6	L995 M998 M1000 R1001 V1026 T1036 F1039	L995-L1030 HydrophobicContact CD2-CD1 3.96Å; L995-L1030 HydrophobicContact CD2-CD2 3.7Å; L995-L1030 HydrophobicContact CD2-CG 4.22Å; M998-L1030 HydrophobicContact CE-CD2 3.77Å; M998-L1030 HydrophobicContact SD-CD2 4.05Å; M1000-L1030 HydrophobicContact CG-CD1 4.46Å; M1000-L1030 HydrophobicContact SD-CD1 4.2Å; R1001-L1030 PolarHBondContact NE-O 3.31Å; V1026-L1030 HydrophobicContact CG1-CB 4.48Å; V1026-L1030 HydrophobicContact CG1-CD1 4.07Å; V1026-L1030 HydrophobicContact CG1-CD2 3.88Å; V1026-L1030 HydrophobicContact CG1-CG 4.37Å; V1026-L1030 WeakPolarHBondContact O-CB 3.21Å; V1026-L1030 PolarHBondContact O-N 2.79Å; L1030-T1036 HydrophobicContact CB-CG2 3.83Å; L1030-T1036 HydrophobicContact CD2-CG2 4.06Å; L1030-F1039 HydrophobicContact CD2-CD1 4.18Å
1031	G	81.1	Confident	83.7	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.01	30%	0.299	C	S	.	.			trans	87.3	151.7	-167.4	0	0	0	0	0	113.8	R1001 Q1027 T1033 T1036	R1001-G1031 VanDerWaalsContact CZ-CA 3.44Å; Q1027-G1031 CarbonylContact O-C 3.58Å; Q1027-G1031 WeakPolarHBondContact O-CA 3.38Å; Q1027-G1031 PolarHBondContact O-N 3.05Å; G1031-T1033 PolarHBondContact O-N 2.93Å; G1031-T1033 VanDerWaalsContact O-N 3.08Å; G1031-T1036 VanDerWaalsContact O-CB 3.24Å; G1031-T1036 WeakPolarHBondContact O-CB 3.49Å; G1031-T1036 VanDerWaalsContact O-CG2 3.29Å; G1031-T1036 WeakPolarHBondContact O-CG2 3.28Å; G1031-T1036 PolarHBondContact O-OG1 3.06Å
1032	E	83.1	Confident	83.8	Confident	155 Å²	155	56.5 Å²	56.5	72%	0.724	29%	0.285	S	S	*	.	S	Bend	trans	-56.8	109.5	166.4	-67.3	164.9	-130.3	0	0	111	Q1027	Q1027-E1032 HydrophobicContact CB-CG 4.38Å; Q1027-E1032 HydrophobicContact CG-CG 4.15Å
1033	T	83.9	Confident	83.9	Confident	65 Å²	65	56.5 Å²	56.5	40%	0.399	29%	0.285	S	S	.	.			trans	-146.2	156.8	167.1	80.8	0	0	0	0	109.1	G1031 R1035 T1036 A1037	G1031-T1033 PolarHBondContact O-N 2.93Å; G1031-T1033 VanDerWaalsContact O-N 3.08Å; T1033-R1035 PolarHBondContact O-N 3.43Å; T1033-R1035 PolarHBondContact OG1-N 3.45Å; T1033-T1036 PolarHBondContact N-OG1 3.1Å; T1033-T1036 WeakPolarHBondContact O-CA 3.49Å; T1033-T1036 VanDerWaalsContact O-CB 3.29Å; T1033-T1036 WeakPolarHBondContact O-CB 3.38Å; T1033-T1036 PolarHBondContact O-N 3.28Å; T1033-T1036 PolarHBondContact OG1-N 2.89Å; T1033-T1036 PolarHBondContact OG1-OG1 2.71Å; T1033-A1037 PolarHBondContact O-N 3.27Å
1034	A	83.5	Confident	84	Confident	90 Å²	90	55.2 Å²	55.2	74%	0.744	28%	0.28	S	S	*	.	H	α-helix	trans	-58.4	-30	173.9	0	0	0	0	0	112.8	Q1038	A1034-Q1038 PolarHBondContact O-N 2.81Å; A1034-Q1038 VanDerWaalsContact O-N 3.09Å
1035	R	82.2	Confident	84	Confident	127 Å²	127	49.5 Å²	49.5	48%	0.479	26%	0.264	S	S	.	.	H	α-helix	trans	-73.8	-32.4	174.9	-165.3	179.7	-179.2	-160.9	-2.9	111.9	S997 M998 T1033 F1039	S997-R1035 VanDerWaalsContact CB-NH2 3.33Å; S997-R1035 PolarHBondContact O-NH1 3.27Å; S997-R1035 PolarHBondContact O-NH2 3.32Å; S997-R1035 PolarHBondContact OG-NH2 2.96Å; M998-R1035 HydrophobicContact CE-CB 3.96Å; M998-R1035 HydrophobicContact CE-CG 3.81Å; M998-R1035 HydrophobicContact CG-CG 4.49Å; M998-R1035 HydrophobicContact SD-CG 3.88Å; T1033-R1035 PolarHBondContact O-N 3.43Å; T1033-R1035 PolarHBondContact OG1-N 3.45Å; R1035-F1039 PolarHBondContact O-N 3.19Å
1036	T	85.1	Confident	83.9	Confident	2 Å²	2	54.2 Å²	54.2	1%	0.012	28%	0.28	C	S	.	.	H	α-helix	trans	-67.9	-46.7	172.3	-47.5	0	0	0	0	110.7	V1026 L1030 G1031 T1033 Q1038 F1039 V1040	V1026-T1036 HydrophobicContact CG1-CG2 3.5Å; V1026-T1036 VanDerWaalsContact CG1-CG2 3.5Å; L1030-T1036 HydrophobicContact CB-CG2 3.83Å; L1030-T1036 HydrophobicContact CD2-CG2 4.06Å; G1031-T1036 VanDerWaalsContact O-CB 3.24Å; G1031-T1036 WeakPolarHBondContact O-CB 3.49Å; G1031-T1036 VanDerWaalsContact O-CG2 3.29Å; G1031-T1036 WeakPolarHBondContact O-CG2 3.28Å; G1031-T1036 PolarHBondContact O-OG1 3.06Å; T1033-T1036 PolarHBondContact N-OG1 3.1Å; T1033-T1036 WeakPolarHBondContact O-CA 3.49Å; T1033-T1036 VanDerWaalsContact O-CB 3.29Å; T1033-T1036 WeakPolarHBondContact O-CB 3.38Å; T1033-T1036 PolarHBondContact O-N 3.28Å; T1033-T1036 PolarHBondContact OG1-N 2.89Å; T1033-T1036 PolarHBondContact OG1-OG1 2.71Å; T1036-Q1038 VanDerWaalsContact C-N 3.3Å; T1036-Q1038 PolarHBondContact O-N 2.99Å; T1036-F1039 CarbonylContact O-C 3.59Å; T1036-F1039 WeakPolarHBondContact O-CA 3.37Å; T1036-F1039 WeakPolarHBondContact O-CB 3.39Å; T1036-F1039 PolarHBondContact O-N 3.31Å; T1036-V1040 WeakPolarHBondContact O-CG2 3.39Å; T1036-V1040 PolarHBondContact O-N 2.72Å
1037	A	84.4	Confident	83.5	Confident	52 Å²	52	54.7 Å²	54.7	43%	0.43	28%	0.282	S	S	.	.	H	α-helix	trans	-59.5	-40.8	175.5	0	0	0	0	0	111.9	T1033 V1040 K1041	T1033-A1037 PolarHBondContact O-N 3.27Å; A1037-V1040 PolarHBondContact O-N 3.29Å; A1037-K1041 PolarHBondContact O-N 3.26Å
1038	Q	84.5	Confident	83.1	Confident	92 Å²	92	58.2 Å²	58.2	43%	0.43	29%	0.292	S	S	.	.	H	α-helix	trans	-64.6	-39.5	172	-170.8	63.5	51	0	0	112.3	A1034 T1036 K1041 D1042	A1034-Q1038 PolarHBondContact O-N 2.81Å; A1034-Q1038 VanDerWaalsContact O-N 3.09Å; T1036-Q1038 VanDerWaalsContact C-N 3.3Å; T1036-Q1038 PolarHBondContact O-N 2.99Å; Q1038-K1041 PolarHBondContact O-N 2.79Å; Q1038-D1042 PolarHBondContact NE2-OD1 3.17Å; Q1038-D1042 WeakPolarHBondContact O-CB 3.3Å; Q1038-D1042 PolarHBondContact O-N 3.47Å
1039	F	87	Confident	82.4	Confident	2 Å²	2	57.6 Å²	57.6	1%	0.009	29%	0.289	C	S	.	.	H	α-helix	trans	-63.8	-42	173.9	173	-92.4	0	0	0	112.3	W990 R994 L995 M998 V1026 L1030 R1035 T1036 K1041 D1042 F1043	W990-F1039 AromaticContact CH2-CD2 3.71Å; W990-F1039 HydrophobicContact CH2-CD2 3.71Å; W990-F1039 AromaticContact CH2-CE2 3.67Å; W990-F1039 HydrophobicContact CH2-CE2 3.67Å; W990-F1039 HydrophobicContact CZ2-CD2 4.45Å; W990-F1039 HydrophobicContact CZ3-CD2 4.24Å; W990-F1039 AromaticContact CZ3-CE2 3.71Å; W990-F1039 HydrophobicContact CZ3-CE2 3.71Å; W990-F1039 HydrophobicContact CZ3-CZ 4.34Å; R994-F1039 HydrophobicContact CB-CD2 4.07Å; R994-F1039 HydrophobicContact CB-CE2 4.08Å; R994-F1039 HydrophobicContact CG-CD2 3.71Å; R994-F1039 HydrophobicContact CG-CE2 4.24Å; L995-F1039 HydrophobicContact CD1-CE2 4.49Å; L995-F1039 HydrophobicContact CD1-CZ 4.04Å; L995-F1039 HydrophobicContact CD2-CD1 4.45Å; L995-F1039 HydrophobicContact CD2-CD2 4.31Å; L995-F1039 HydrophobicContact CD2-CE1 3.98Å; L995-F1039 HydrophobicContact CD2-CE2 3.82Å; L995-F1039 HydrophobicContact CD2-CZ 3.64Å; L995-F1039 HydrophobicContact CG-CE2 3.87Å; L995-F1039 HydrophobicContact CG-CZ 3.83Å; M998-F1039 HydrophobicContact SD-CB 4.4Å; V1026-F1039 HydrophobicContact CG1-CD1 3.69Å; V1026-F1039 HydrophobicContact CG1-CE1 4.01Å; V1026-F1039 HydrophobicContact CG2-CD1 4.39Å; V1026-F1039 HydrophobicContact CG2-CE1 4.05Å; L1030-F1039 HydrophobicContact CD2-CD1 4.18Å; R1035-F1039 PolarHBondContact O-N 3.19Å; T1036-F1039 CarbonylContact O-C 3.59Å; T1036-F1039 WeakPolarHBondContact O-CA 3.37Å; T1036-F1039 WeakPolarHBondContact O-CB 3.39Å; T1036-F1039 PolarHBondContact O-N 3.31Å; F1039-K1041 VanDerWaalsContact C-N 3.34Å; F1039-K1041 PolarHBondContact O-N 3.24Å; F1039-D1042 PolarHBondContact O-N 2.87Å; F1039-F1043 HydrophobicContact CE1-CB 4.3Å; F1039-F1043 HydrophobicContact CZ-CB 4.34Å; F1039-F1043 HydrophobicContact CZ-CD2 4.42Å; F1039-F1043 WeakPolarHBondContact O-CB 3.2Å; F1039-F1043 PolarHBondContact O-N 3.46Å
1040	V	87.2	Confident	82	Confident	8 Å²	8	57.4 Å²	57.4	5%	0.048	29%	0.288	C	S	.	.	H	α-helix	trans	-58.6	-47.1	174.8	172	0	0	0	0	110.2	E1023 V1026 T1036 A1037 F1043 L1044	E1023-V1040 HydrophobicContact CB-CG1 3.93Å; E1023-V1040 HydrophobicContact CG-CG1 4.27Å; E1023-V1040 HydrophobicContact CG-CG2 4.44Å; V1026-V1040 HydrophobicContact CB-CG2 3.76Å; V1026-V1040 HydrophobicContact CG1-CG2 3.71Å; V1026-V1040 HydrophobicContact CG2-CG2 4.13Å; T1036-V1040 WeakPolarHBondContact O-CG2 3.39Å; T1036-V1040 PolarHBondContact O-N 2.72Å; A1037-V1040 PolarHBondContact O-N 3.29Å; V1040-F1043 PolarHBondContact O-N 2.81Å; V1040-L1044 HydrophobicContact CG1-CD1 3.86Å; V1040-L1044 HydrophobicContact CG1-CG 4.34Å; V1040-L1044 WeakPolarHBondContact O-CB 3.46Å; V1040-L1044 VanDerWaalsContact O-CG 3.29Å; V1040-L1044 WeakPolarHBondContact O-CG 3.38Å; V1040-L1044 PolarHBondContact O-N 2.86Å
1041	K	85.2	Confident	81.7	Confident	113 Å²	113	58.5 Å²	58.5	49%	0.491	29%	0.292	S	S	.	.	H	α-helix	trans	-60.8	-54.8	175.6	-173.1	-175.2	176.3	-174.5	0	111.8	A1037 Q1038 F1039 F1043 L1044 D1045	A1037-K1041 PolarHBondContact O-N 3.26Å; Q1038-K1041 PolarHBondContact O-N 2.79Å; F1039-K1041 VanDerWaalsContact C-N 3.34Å; F1039-K1041 PolarHBondContact O-N 3.24Å; K1041-F1043 PolarHBondContact O-N 2.73Å; K1041-L1044 PolarHBondContact O-N 3.48Å; K1041-D1045 PolarHBondContact O-N 2.99Å
1042	D	86.2	Confident	81.4	Confident	31 Å²	31	65.3 Å²	65.3	17%	0.166	32%	0.324	C	S	.	.	H	α-helix	trans	-55.1	-38.6	179.1	-70.4	-2.9	0	0	0	111	W990 R994 Q1038 F1039 R1046	W990-D1042 HydrophobicContact CH2-CB 3.46Å; W990-D1042 VanDerWaalsContact CH2-CB 3.46Å; W990-D1042 HydrophobicContact CZ2-CB 3.45Å; W990-D1042 VanDerWaalsContact CZ2-CB 3.45Å; R994-D1042 IonicContact CZ-OD2 3.73Å; R994-D1042 IonicContact NE-OD2 3.18Å; R994-D1042 IonicContact NH2-OD2 3.47Å; R994-D1042 PolarHBondContact NH2-OD2 2.7Å; Q1038-D1042 PolarHBondContact NE2-OD1 3.17Å; Q1038-D1042 WeakPolarHBondContact O-CB 3.3Å; Q1038-D1042 PolarHBondContact O-N 3.47Å; F1039-D1042 PolarHBondContact O-N 2.87Å; D1042-R1046 WeakPolarHBondContact O-CB 3Å; D1042-R1046 VanDerWaalsContact O-CD 3.28Å; D1042-R1046 WeakPolarHBondContact O-CD 3.37Å; D1042-R1046 WeakPolarHBondContact O-CG 3.27Å; D1042-R1046 PolarHBondContact O-N 2.74Å
1043	F	86.7	Confident	80.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-71.6	-50.2	179.4	175.8	-99.1	0	0	0	112.1	L987 W990 L1013 V1022 F1039 V1040 K1041 D1045 R1046 R1047	L987-F1043 HydrophobicContact CD1-CD2 4.04Å; L987-F1043 HydrophobicContact CD1-CE2 3.98Å; L987-F1043 HydrophobicContact CD2-CE2 3.92Å; L987-F1043 HydrophobicContact CD2-CZ 4.35Å; L987-F1043 HydrophobicContact CG-CE2 4.09Å; W990-F1043 HydrophobicContact CH2-CB 4.21Å; W990-F1043 HydrophobicContact CZ3-CB 3.9Å; W990-F1043 HydrophobicContact CZ3-CD2 4.1Å; L1013-F1043 HydrophobicContact CB-CE1 3.91Å; L1013-F1043 HydrophobicContact CB-CE2 4.2Å; L1013-F1043 HydrophobicContact CB-CZ 3.52Å; L1013-F1043 WeakPolarHBondContact O-CE1 3.4Å; L1013-F1043 WeakPolarHBondContact O-CZ 3.49Å; V1022-F1043 HydrophobicContact CG1-CD1 3.7Å; V1022-F1043 HydrophobicContact CG1-CE1 3.72Å; F1039-F1043 HydrophobicContact CE1-CB 4.3Å; F1039-F1043 HydrophobicContact CZ-CB 4.34Å; F1039-F1043 HydrophobicContact CZ-CD2 4.42Å; F1039-F1043 WeakPolarHBondContact O-CB 3.2Å; F1039-F1043 PolarHBondContact O-N 3.46Å; V1040-F1043 PolarHBondContact O-N 2.81Å; K1041-F1043 PolarHBondContact O-N 2.73Å; F1043-D1045 VanDerWaalsContact C-N 3.35Å; F1043-D1045 PolarHBondContact O-N 3.49Å; F1043-R1046 CarbonylContact O-C 3.51Å; F1043-R1046 PolarHBondContact O-N 3.28Å; F1043-R1047 HydrophobicContact CE1-CB 4.49Å; F1043-R1047 HydrophobicContact CZ-CG 4.4Å; F1043-R1047 WeakPolarHBondContact O-CB 3.47Å; F1043-R1047 PolarHBondContact O-N 2.81Å
1044	L	84.9	Confident	80.5	Confident	38 Å²	38	59.9 Å²	59.9	20%	0.199	30%	0.295	C	S	.	.	H	α-helix	trans	-58.9	-47.4	179.1	-73.4	174.6	0	0	0	110.8	P1019 V1022 V1040 K1041 R1046 R1047 R1048	P1019-L1044 HydrophobicContact CB-CD1 3.69Å; P1019-L1044 HydrophobicContact CB-CD2 3.72Å; P1019-L1044 HydrophobicContact CB-CG 4.39Å; V1022-L1044 HydrophobicContact CB-CD2 4.25Å; V1022-L1044 HydrophobicContact CG1-CD2 3.91Å; V1022-L1044 HydrophobicContact CG1-CG 4.42Å; V1022-L1044 HydrophobicContact CG2-CD2 4.43Å; V1040-L1044 HydrophobicContact CG1-CD1 3.86Å; V1040-L1044 HydrophobicContact CG1-CG 4.34Å; V1040-L1044 WeakPolarHBondContact O-CB 3.46Å; V1040-L1044 VanDerWaalsContact O-CG 3.29Å; V1040-L1044 WeakPolarHBondContact O-CG 3.38Å; V1040-L1044 PolarHBondContact O-N 2.86Å; K1041-L1044 PolarHBondContact O-N 3.48Å; L1044-R1046 VanDerWaalsContact C-N 3.31Å; L1044-R1046 PolarHBondContact O-N 2.77Å; L1044-R1047 PolarHBondContact O-N 2.77Å; L1044-R1047 VanDerWaalsContact O-N 3.13Å; L1044-R1048 WeakPolarHBondContact O-CG 3.35Å; L1044-R1048 PolarHBondContact O-N 3.39Å
1045	D	83.6	Confident	80	Confident	64 Å²	64	59.8 Å²	59.8	34%	0.342	28%	0.276	S	S	.	.	H	α-helix	trans	-63.9	-34	179	-70.9	-26.1	0	0	0	112.5	K1041 F1043 R1048	K1041-D1045 PolarHBondContact O-N 2.99Å; F1043-D1045 VanDerWaalsContact C-N 3.35Å; F1043-D1045 PolarHBondContact O-N 3.49Å; D1045-R1048 IonicContact OD1-CZ 3.75Å; D1045-R1048 IonicContact OD1-NE 2.83Å; D1045-R1048 PolarHBondContact OD1-NE 3.4Å; D1045-R1048 IonicContact OD1-NH2 3.78Å; D1045-R1048 PolarHBondContact OD1-NH2 2.92Å
1046	R	79.8	Confident	79.7	Confident	130 Å²	130	59.3 Å²	59.3	49%	0.491	28%	0.277	S	S	.	.	H	α-helix	trans	-76.1	-28.7	172.4	-73.8	169.7	-178.1	-94.6	-5.8	113.9	L987 W990 D1042 F1043 L1044 P1049	L987-R1046 HydrophobicContact CD1-CB 3.86Å; W990-R1046 VanDerWaalsContact CD1-CZ 3.42Å; W990-R1046 VanDerWaalsContact CD1-NH1 3.27Å; W990-R1046 VanDerWaalsContact CE2-NE 3.33Å; D1042-R1046 WeakPolarHBondContact O-CB 3Å; D1042-R1046 VanDerWaalsContact O-CD 3.28Å; D1042-R1046 WeakPolarHBondContact O-CD 3.37Å; D1042-R1046 WeakPolarHBondContact O-CG 3.27Å; D1042-R1046 PolarHBondContact O-N 2.74Å; F1043-R1046 CarbonylContact O-C 3.51Å; F1043-R1046 PolarHBondContact O-N 3.28Å; L1044-R1046 VanDerWaalsContact C-N 3.31Å; L1044-R1046 PolarHBondContact O-N 2.77Å; R1046-P1049 WeakPolarHBondContact O-CD 3.43Å
1047	R	77.1	Confident	79.2	Confident	10 Å²	10	62.8 Å²	62.8	4%	0.038	29%	0.29	C	S	.	.	H	α-helix	trans	-72.8	-35.3	177.4	-158.3	-179.2	85	167.1	8	111	L987 L1013 L1016 F1043 L1044 P1049 F1050 W1051	L987-R1047 HydrophobicContact CD2-CB 4.4Å; L987-R1047 HydrophobicContact CD2-CG 4.06Å; L1013-R1047 PolarHBondContact O-NH1 3.03Å; L1016-R1047 VanDerWaalsContact O-CZ 3.24Å; L1016-R1047 PolarHBondContact O-NH1 3Å; L1016-R1047 PolarHBondContact O-NH2 3.15Å; F1043-R1047 HydrophobicContact CE1-CB 4.49Å; F1043-R1047 HydrophobicContact CZ-CG 4.4Å; F1043-R1047 WeakPolarHBondContact O-CB 3.47Å; F1043-R1047 PolarHBondContact O-N 2.81Å; L1044-R1047 PolarHBondContact O-N 2.77Å; L1044-R1047 VanDerWaalsContact O-N 3.13Å; R1047-P1049 VanDerWaalsContact O-N 3.15Å; R1047-F1050 HydrophobicContact CG-CD1 4.09Å; R1047-F1050 PolarHBondContact O-N 2.59Å; R1047-W1051 HydrophobicContact CG-CB 4.27Å; R1047-W1051 HydrophobicContact CG-CG 4.25Å; R1047-W1051 VanDerWaalsContact CZ-NE1 3.31Å; R1047-W1051 WeakPolarHBondContact O-CB 3.49Å; R1047-W1051 PolarHBondContact O-N 3.45Å
1048	R	75.1	Confident	78.6	Confident	140 Å²	140	65.5 Å²	65.5	53%	0.528	29%	0.289	S	S	.	.	H	α-helix	trans	-35.4	-56.9	-177.5	-74.2	178.7	-159	-88.6	1.9	115.4	L1044 D1045 W1051 Q1052	L1044-R1048 WeakPolarHBondContact O-CG 3.35Å; L1044-R1048 PolarHBondContact O-N 3.39Å; D1045-R1048 IonicContact OD1-CZ 3.75Å; D1045-R1048 IonicContact OD1-NE 2.83Å; D1045-R1048 PolarHBondContact OD1-NE 3.4Å; D1045-R1048 IonicContact OD1-NH2 3.78Å; D1045-R1048 PolarHBondContact OD1-NH2 2.92Å; R1048-W1051 PolarHBondContact O-N 3.22Å; R1048-Q1052 WeakPolarHBondContact O-CG 3.4Å; R1048-Q1052 PolarHBondContact O-N 3.11Å
1049	P	69.8	Low	77.9	Confident	65 Å²	65	66.1 Å²	66.1	42%	0.422	29%	0.292	S	S	.	.	H	α-helix	trans	-65.4	-49.3	-177.1	24.3	-34.6	0	0	0	113.4	R1046 R1047 W1051 Q1052 L1053	R1046-P1049 WeakPolarHBondContact O-CD 3.43Å; R1047-P1049 VanDerWaalsContact O-N 3.15Å; P1049-W1051 PolarHBondContact O-N 3.42Å; P1049-Q1052 PolarHBondContact O-N 3.28Å; P1049-L1053 PolarHBondContact O-N 2.95Å
1050	F	70.7	Confident	76.7	Confident	11 Å²	11	71 Å²	71	5%	0.048	31%	0.314	C	S	.	.	H	α-helix	trans	-53.4	-41.9	171.3	162.8	-93.3	0	0	0	110.7	V980 E983 L984 A1014 R1047 L1053 H1054	V980-F1050 HydrophobicContact CG1-CD2 3.83Å; V980-F1050 HydrophobicContact CG1-CE2 3.4Å; V980-F1050 HydrophobicContact CG1-CZ 4.31Å; V980-F1050 WeakPolarHBondContact O-CD2 3.48Å; E983-F1050 HydrophobicContact CB-CB 4.15Å; E983-F1050 HydrophobicContact CB-CD2 4.44Å; L984-F1050 HydrophobicContact CB-CD2 4.12Å; L984-F1050 HydrophobicContact CB-CE2 3.71Å; L984-F1050 HydrophobicContact CB-CZ 4.45Å; L984-F1050 HydrophobicContact CD1-CE2 4.13Å; L984-F1050 HydrophobicContact CD1-CZ 4.04Å; L984-F1050 HydrophobicContact CD2-CE2 4.37Å; L984-F1050 HydrophobicContact CG-CE2 4.28Å; A1014-F1050 HydrophobicContact CB-CE1 4.27Å; R1047-F1050 HydrophobicContact CG-CD1 4.09Å; R1047-F1050 PolarHBondContact O-N 2.59Å; F1050-L1053 PolarHBondContact O-N 3.41Å; F1050-H1054 HydrophobicContact CE1-CB 4.49Å; F1050-H1054 WeakPolarHBondContact O-CB 3.24Å; F1050-H1054 PolarHBondContact O-N 3.44Å
1051	W	74.2	Confident	75.4	Confident	33 Å²	33	75.3 Å²	75.3	13%	0.125	33%	0.334	C	S	.	.	H	α-helix	trans	-74.5	-34.6	-173.9	-132.9	69.1	0	0	0	114.3	A1014 D1017 R1047 R1048 P1049 L1053 R1055	A1014-W1051 PolarHBondContact O-NE1 3.29Å; D1017-W1051 HydrophobicContact CB-CH2 3.96Å; D1017-W1051 HydrophobicContact CB-CZ2 4.19Å; D1017-W1051 VanDerWaalsContact OD1-CH2 3.29Å; D1017-W1051 WeakPolarHBondContact OD1-CH2 3.34Å; D1017-W1051 WeakPolarHBondContact OD1-CZ2 3.31Å; R1047-W1051 HydrophobicContact CG-CB 4.27Å; R1047-W1051 HydrophobicContact CG-CG 4.25Å; R1047-W1051 VanDerWaalsContact CZ-NE1 3.31Å; R1047-W1051 WeakPolarHBondContact O-CB 3.49Å; R1047-W1051 PolarHBondContact O-N 3.45Å; R1048-W1051 PolarHBondContact O-N 3.22Å; P1049-W1051 PolarHBondContact O-N 3.42Å; W1051-L1053 VanDerWaalsContact C-N 3.31Å; W1051-R1055 VanDerWaalsContact O-CB 3.28Å; W1051-R1055 WeakPolarHBondContact O-CB 3.25Å; W1051-R1055 PolarHBondContact O-N 3.24Å
1052	Q	74.4	Confident	74	Confident	143 Å²	143	73.4 Å²	73.4	67%	0.668	34%	0.335	S	S	*	.	H	α-helix	trans	-61.8	-41.5	169.9	-74.2	171.6	-7.7	0	0	111.1	R1048 P1049 K1056	R1048-Q1052 WeakPolarHBondContact O-CG 3.4Å; R1048-Q1052 PolarHBondContact O-N 3.11Å; P1049-Q1052 PolarHBondContact O-N 3.28Å; Q1052-K1056 WeakPolarHBondContact O-CB 3.34Å; Q1052-K1056 PolarHBondContact O-N 3.04Å
1053	L	73.8	Confident	72.8	Confident	59 Å²	59	75.5 Å²	75.5	31%	0.309	35%	0.349	S	S	.	.	H	α-helix	trans	-71.3	-40.2	179	-165.4	58	0	0	0	112.1	T979 V980 P1049 F1050 W1051 K1056 R1057	T979-L1053 HydrophobicContact CG2-CD2 3.95Å; V980-L1053 HydrophobicContact CG2-CB 4.15Å; V980-L1053 HydrophobicContact CG2-CD2 3.49Å; V980-L1053 VanDerWaalsContact CG2-CD2 3.49Å; V980-L1053 HydrophobicContact CG2-CG 3.54Å; P1049-L1053 PolarHBondContact O-N 2.95Å; F1050-L1053 PolarHBondContact O-N 3.41Å; W1051-L1053 VanDerWaalsContact C-N 3.31Å; L1053-K1056 PolarHBondContact O-N 2.77Å; L1053-R1057 PolarHBondContact O-N 2.72Å
1054	H	74.9	Confident	71.4	Confident	47 Å²	47	80.4 Å²	80.4	22%	0.218	38%	0.375	C	S	.	.	H	α-helix	trans	-65.3	-40.5	173.9	-176.5	-107.7	0	0	0	112.7	F1050 R1057 R1058	F1050-H1054 HydrophobicContact CE1-CB 4.49Å; F1050-H1054 WeakPolarHBondContact O-CB 3.24Å; F1050-H1054 PolarHBondContact O-N 3.44Å; H1054-R1057 WeakPolarHBondContact O-CB 3.41Å; H1054-R1057 PolarHBondContact O-N 3.42Å; H1054-R1058 PolarHBondContact O-N 2.8Å; H1054-R1058 VanDerWaalsContact O-N 3.08Å
1055	R	72.6	Confident	70	Confident	89 Å²	89	85.3 Å²	85.3	34%	0.336	40%	0.397	S	S	.	.	H	α-helix	trans	-61.5	-48.7	174.2	-158.5	-170	-153.7	149.1	10.3	110.8	W1051 R1057 R1058 E1059	W1051-R1055 VanDerWaalsContact O-CB 3.28Å; W1051-R1055 WeakPolarHBondContact O-CB 3.25Å; W1051-R1055 PolarHBondContact O-N 3.24Å; R1055-R1057 PolarHBondContact O-N 3.47Å; R1055-R1058 PolarHBondContact O-N 3.01Å; R1055-R1058 VanDerWaalsContact O-N 3.14Å; R1055-E1059 WeakPolarHBondContact CG-OE1 3.48Å; R1055-E1059 IonicContact NE-OE1 2.82Å; R1055-E1059 WeakPolarHBondContact O-CG 3.49Å; R1055-E1059 PolarHBondContact O-N 2.68Å
1056	K	77.2	Confident	68.4	Low	117 Å²	117	86.5 Å²	86.5	51%	0.509	42%	0.415	S	S	.	.	H	α-helix	trans	-57.7	-34.8	175.4	-173	178.3	-179.9	-177.6	0	112.6	Q1052 L1053 Q1060	Q1052-K1056 WeakPolarHBondContact O-CB 3.34Å; Q1052-K1056 PolarHBondContact O-N 3.04Å; L1053-K1056 PolarHBondContact O-N 2.77Å; K1056-Q1060 WeakPolarHBondContact O-CG 3.26Å; K1056-Q1060 PolarHBondContact O-N 3.43Å; K1056-Q1060 VanDerWaalsContact O-N 3.09Å
1057	R	74.4	Confident	67	Low	75 Å²	75	84.2 Å²	84.2	28%	0.283	42%	0.419	S	S	.	.	H	α-helix	trans	-65.1	-51.9	172.8	-170.5	-169	-62.2	-161.4	-2	111.9	P976 D977 V980 L1053 H1054 R1055 E1059 Q1060 E1061	P976-R1057 PolarHBondContact O-NH2 2.69Å; D977-R1057 VanDerWaalsContact CA-NH2 3.35Å; D977-R1057 IonicContact OD1-CZ 2.74Å; D977-R1057 IonicContact OD1-NH1 2.75Å; D977-R1057 PolarHBondContact OD1-NH1 2.75Å; D977-R1057 IonicContact OD1-NH2 2.58Å; D977-R1057 PolarHBondContact OD1-NH2 3.14Å; D977-R1057 IonicContact OD2-NH1 2.66Å; V980-R1057 VanDerWaalsContact CG2-NH2 3.3Å; L1053-R1057 PolarHBondContact O-N 2.72Å; H1054-R1057 WeakPolarHBondContact O-CB 3.41Å; H1054-R1057 PolarHBondContact O-N 3.42Å; R1055-R1057 PolarHBondContact O-N 3.47Å; R1057-E1059 VanDerWaalsContact C-N 3.26Å; R1057-E1059 PolarHBondContact O-N 2.83Å; R1057-Q1060 PolarHBondContact O-N 3.46Å; R1057-E1061 PolarHBondContact O-N 3.45Å
1058	R	71.6	Confident	65.7	Low	109 Å²	109	88.8 Å²	88.8	41%	0.411	45%	0.448	S	S	.	.	H	α-helix	trans	-62.5	-32.1	178.5	-71.1	-156.2	-66.1	159.2	-2.3	112.8	D1017 H1054 R1055 S1062	D1017-R1058 IonicContact OD1-CZ 2.71Å; D1017-R1058 IonicContact OD1-NH2 2.62Å; D1017-R1058 PolarHBondContact OD1-NH2 2.83Å; D1017-R1058 IonicContact OD2-CZ 3.11Å; D1017-R1058 IonicContact OD2-NH1 2.7Å; D1017-R1058 IonicContact OD2-NH2 2.72Å; D1017-R1058 PolarHBondContact OD2-NH2 3.09Å; H1054-R1058 PolarHBondContact O-N 2.8Å; H1054-R1058 VanDerWaalsContact O-N 3.08Å; R1055-R1058 PolarHBondContact O-N 3.01Å; R1055-R1058 VanDerWaalsContact O-N 3.14Å; R1058-S1062 WeakPolarHBondContact O-CB 3.14Å; R1058-S1062 PolarHBondContact O-N 2.92Å; R1058-S1062 PolarHBondContact O-OG 2.91Å
1059	E	69.1	Low	64	Low	105 Å²	105	85.5 Å²	85.5	49%	0.491	46%	0.458	S	S	.	.	H	α-helix	trans	-67.2	-36.1	172.8	-71.5	164.6	-178.5	0	0	112.2	R1055 R1057 S1062 T1063	R1055-E1059 WeakPolarHBondContact CG-OE1 3.48Å; R1055-E1059 IonicContact NE-OE1 2.82Å; R1055-E1059 WeakPolarHBondContact O-CG 3.49Å; R1055-E1059 PolarHBondContact O-N 2.68Å; R1057-E1059 VanDerWaalsContact C-N 3.26Å; R1057-E1059 PolarHBondContact O-N 2.83Å; E1059-S1062 PolarHBondContact O-OG 2.81Å; E1059-T1063 PolarHBondContact O-N 3.41Å; E1059-T1063 PolarHBondContact O-OG1 3.02Å
1060	Q	63	Low	62.6	Low	103 Å²	103	90.6 Å²	90.6	48%	0.481	48%	0.476	S	S	.	.	H	α-helix	trans	-73.3	-42.7	172.3	-73.6	-180	-9.4	0	0	112.6	K1056 R1057 T1063 I1064	K1056-Q1060 WeakPolarHBondContact O-CG 3.26Å; K1056-Q1060 PolarHBondContact O-N 3.43Å; K1056-Q1060 VanDerWaalsContact O-N 3.09Å; R1057-Q1060 PolarHBondContact O-N 3.46Å; Q1060-T1063 WeakPolarHBondContact O-CB 3.28Å; Q1060-T1063 PolarHBondContact O-N 3.31Å; Q1060-T1063 VanDerWaalsContact O-N 3.13Å; Q1060-I1064 WeakPolarHBondContact O-CG1 3.42Å; Q1060-I1064 PolarHBondContact O-N 3.33Å
1061	E	59.7	Low	60.8	Low	99 Å²	99	97.9 Å²	97.9	46%	0.463	52%	0.516	S	S	.	.	H	α-helix	trans	-64.5	-43.4	-178.1	-169.7	178.1	175.4	0	0	112.2	R1057 T1063 I1064 Q1065	R1057-E1061 PolarHBondContact O-N 3.45Å; E1061-T1063 VanDerWaalsContact C-N 3.25Å; E1061-T1063 PolarHBondContact O-N 2.97Å; E1061-I1064 PolarHBondContact O-N 3.19Å; E1061-I1064 VanDerWaalsContact O-N 3.12Å; E1061-Q1065 PolarHBondContact O-N 2.93Å
1062	S	55.9	Low	59.1	Low	74 Å²	74	102.4 Å²	102.4	52%	0.517	55%	0.552	S	S	.	*	H	α-helix	trans	-62.1	-31.5	173.2	49.9	0	0	0	0	112.9	R1058 E1059 A1066	R1058-S1062 WeakPolarHBondContact O-CB 3.14Å; R1058-S1062 PolarHBondContact O-N 2.92Å; R1058-S1062 PolarHBondContact O-OG 2.91Å; E1059-S1062 PolarHBondContact O-OG 2.81Å; S1062-A1066 WeakPolarHBondContact O-CB 3.45Å; S1062-A1066 PolarHBondContact O-N 3.39Å
1063	T	59.2	Low	57.2	Low	75 Å²	75	100.8 Å²	100.8	46%	0.46	56%	0.557	S	S	.	*	H	α-helix	trans	-71.9	-33.1	174	-55.9	0	0	0	0	112.5	E1059 Q1060 E1061 S1067	E1059-T1063 PolarHBondContact O-N 3.41Å; E1059-T1063 PolarHBondContact O-OG1 3.02Å; Q1060-T1063 WeakPolarHBondContact O-CB 3.28Å; Q1060-T1063 PolarHBondContact O-N 3.31Å; Q1060-T1063 VanDerWaalsContact O-N 3.13Å; E1061-T1063 VanDerWaalsContact C-N 3.25Å; E1061-T1063 PolarHBondContact O-N 2.97Å; T1063-S1067 PolarHBondContact O-OG 3.33Å
1064	I	57.9	Low	55.7	Low	103 Å²	103	105.2 Å²	105.2	53%	0.528	58%	0.581	S	S	.	*	H	α-helix	trans	-77.9	-38.5	179.1	-67.2	166.3	0	0	0	111.4	Q1060 E1061 A1066 S1067 T1068	Q1060-I1064 WeakPolarHBondContact O-CG1 3.42Å; Q1060-I1064 PolarHBondContact O-N 3.33Å; E1061-I1064 PolarHBondContact O-N 3.19Å; E1061-I1064 VanDerWaalsContact O-N 3.12Å; I1064-A1066 VanDerWaalsContact C-N 3.27Å; I1064-A1066 PolarHBondContact O-N 2.76Å; I1064-S1067 WeakPolarHBondContact CA-OG 3.43Å; I1064-S1067 PolarHBondContact O-N 3.06Å; I1064-S1067 VanDerWaalsContact O-N 3.13Å; I1064-S1067 PolarHBondContact O-OG 3.49Å; I1064-T1068 PolarHBondContact O-N 3.07Å; I1064-T1068 PolarHBondContact O-OG1 3.47Å
1065	Q	55.4	Low	53.9	Low	141 Å²	141	110.9 Å²	110.9	66%	0.659	61%	0.607	S	S	*	*	H	α-helix	trans	-64.2	-33.3	173.2	-67.4	-172.8	18.2	0	0	111.9	E1061 S1067	E1061-Q1065 PolarHBondContact O-N 2.93Å; Q1065-S1067 VanDerWaalsContact C-N 3.26Å; Q1065-S1067 PolarHBondContact O-N 2.98Å
1066	A	50.4	Low	52.2	Low	88 Å²	88	112.9 Å²	112.9	73%	0.727	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-18.3	173.9	0	0	0	0	0	114.6	S1062 I1064	S1062-A1066 WeakPolarHBondContact O-CB 3.45Å; S1062-A1066 PolarHBondContact O-N 3.39Å; I1064-A1066 VanDerWaalsContact C-N 3.27Å; I1064-A1066 PolarHBondContact O-N 2.76Å
1067	S	50	Low	50.1	Low	82 Å²	82	112.7 Å²	112.7	57%	0.573	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.1	-15.7	-175.2	44.7	0	0	0	0	114.6	T1063 I1064 Q1065 G1069	T1063-S1067 PolarHBondContact O-OG 3.33Å; I1064-S1067 WeakPolarHBondContact CA-OG 3.43Å; I1064-S1067 PolarHBondContact O-N 3.06Å; I1064-S1067 VanDerWaalsContact O-N 3.13Å; I1064-S1067 PolarHBondContact O-OG 3.49Å; Q1065-S1067 VanDerWaalsContact C-N 3.26Å; Q1065-S1067 PolarHBondContact O-N 2.98Å; S1067-G1069 VanDerWaalsContact C-N 3.29Å; S1067-G1069 PolarHBondContact O-N 2.8Å
1068	T	49.4	Very low	48.4	Very low	106 Å²	106	114.2 Å²	114.2	65%	0.65	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-4.7	-178.8	-51.9	0	0	0	0	113.5	I1064 Q1070	I1064-T1068 PolarHBondContact O-N 3.07Å; I1064-T1068 PolarHBondContact O-OG1 3.47Å; T1068-Q1070 VanDerWaalsContact C-N 3.28Å; T1068-Q1070 PolarHBondContact O-N 3.48Å
1069	G	41.3	Very low	46.7	Very low	72 Å²	72	115 Å²	115	74%	0.742	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	1.7	-179.2	0	0	0	0	0	116.8	S1067	S1067-G1069 VanDerWaalsContact C-N 3.29Å; S1067-G1069 PolarHBondContact O-N 2.8Å
1070	Q	40.1	Very low	45.3	Very low	172 Å²	172	115.2 Å²	115.2	80%	0.804	69%	0.688	S	S	*	*	S	Bend	trans	-141.9	73.7	-173	-66	-171.9	-9	0	0	113.8	T1068	T1068-Q1070 VanDerWaalsContact C-N 3.28Å; T1068-Q1070 PolarHBondContact O-N 3.48Å
1071	N	32.5	Very low	43.8	Very low	164 Å²	164	120.6 Å²	120.6	88%	0.877	70%	0.704	S	S	*	*			trans	175.6	89.8	146.1	-94.7	-42.4	0	0	0	113.5
1072	S	37.5	Very low	42.8	Very low	127 Å²	127	120.2 Å²	120.2	89%	0.888	71%	0.712	S	S	*	*			trans	164.9	149	162.1	-83.7	0	0	0	0	108.4
1073	S	35.8	Very low	42.1	Very low	109 Å²	109	123 Å²	123	76%	0.762	73%	0.726	S	S	*	*			cis	-147.4	177.2	-1.4	-174.2	0	0	0	0	110.2
1074	N	41.2	Very low	41	Very low	153 Å²	153	125.7 Å²	125.7	82%	0.818	73%	0.734	S	S	*	*			trans	-69.7	167.2	-170.4	-61.3	-64.6	0	0	0	116.3
1075	Q	38.1	Very low	40.1	Very low	165 Å²	165	128.7 Å²	128.7	77%	0.771	74%	0.743	S	S	*	*			trans	-59.3	162.1	170.8	-63.7	-177.2	-8.1	0	0	113.9
1076	P	37.3	Very low	39.3	Very low	132 Å²	132	130.9 Å²	130.9	86%	0.857	75%	0.75	S	S	*	*				-135.9	173.7	112.8	37.5	-27.4	0	0	0	115.2
1077	T	32.9	Very low	38.6	Very low	113 Å²	113	134.7 Å²	134.7	69%	0.693	75%	0.75	S	S	*	*			trans	-122	139	-164.4	55.8	0	0	0	0	115.5
1078	S	38	Very low	38.1	Very low	107 Å²	107	140.8 Å²	140.8	75%	0.748	76%	0.761	S	S	*	*			trans	-174.4	127.5	139.3	43.7	0	0	0	0	111.6
1079	T	35.9	Very low	37.8	Very low	126 Å²	126	141.7 Å²	141.7	77%	0.773	77%	0.766	S	S	*	*				59.7	117.4	86.9	-25.6	0	0	0	0	112.5
1080	V	39	Very low	37.6	Very low	109 Å²	109	145 Å²	145	66%	0.661	77%	0.767	S	S	*	*				-167.3	136.6	71.2	160.1	0	0	0	0	112
1081	R	33.1	Very low	37.8	Very low	216 Å²	216	141.7 Å²	141.7	82%	0.815	76%	0.76	S	S	*	*			trans	24.8	141.3	145.4	-46.8	168.9	-160.8	163.3	5.7	119.3
1082	S	39.1	Very low	38	Very low	91 Å²	91	140.8 Å²	140.8	64%	0.636	76%	0.756	S	S	*	*				-172.6	150.9	63.4	-63.8	0	0	0	0	115.1
1083	T	39.2	Very low	38.3	Very low	131 Å²	131	141.7 Å²	141.7	80%	0.804	75%	0.75	S	S	*	*			trans	61.6	140.9	150.7	50.8	0	0	0	0	119.4
1084	E	37.4	Very low	38.6	Very low	133 Å²	133	141.9 Å²	141.9	62%	0.621	75%	0.747	S	S	*	*			cis	-161.3	152.6	6.5	-132	-169.5	161.9	0	0	113.3
1085	K	38.7	Very low	38.7	Very low	165 Å²	165	138.4 Å²	138.4	72%	0.717	74%	0.74	S	S	*	*			trans	65.6	148.7	157.1	-71.7	155.2	-177.3	153.5	0	116.5
1086	K	38.2	Very low	39	Very low	188 Å²	188	137.3 Å²	137.3	82%	0.817	74%	0.738	S	S	*	*			cis	174.7	128.1	0.4	158.5	-170.5	-180	-175.2	0	106.7
1087	K	36.6	Very low	39.3	Very low	167 Å²	167	137.2 Å²	137.2	73%	0.726	73%	0.73	S	S	*	*			cis	-167.2	169.1	12.7	76.2	-146.2	-172.9	-152.1	0	110.9
1088	R	39.1	Very low	39.4	Very low	211 Å²	211	137.9 Å²	137.9	80%	0.796	73%	0.729	S	S	*	*			trans	68.4	112.6	155.5	-81.7	-176.3	-173	178.5	0.9	119.6
1089	T	43.6	Very low	39.3	Very low	124 Å²	124	138.2 Å²	138.2	76%	0.761	73%	0.727	S	S	*	*				92.1	140.9	72.1	51.3	0	0	0	0	113.8
1090	N	36.6	Very low	39.4	Very low	143 Å²	143	140.1 Å²	140.1	77%	0.765	73%	0.727	S	S	*	*			cis	-166.5	144.6	-8.8	-175.6	72.4	0	0	0	110.2
1091	P	43.3	Very low	39.2	Very low	101 Å²	101	144 Å²	144	66%	0.656	73%	0.73	S	S	*	*			trans	-108.7	164.1	175.3	39.9	-32.8	0	0	0	114.4
1092	N	38	Very low	39.5	Very low	146 Å²	146	140.1 Å²	140.1	78%	0.781	72%	0.721	S	S	*	*			trans	179.7	176.6	148.1	-110.2	12.8	0	0	0	114.4
1093	D	43.6	Very low	39.3	Very low	145 Å²	145	142.4 Å²	142.4	78%	0.775	73%	0.726	S	S	*	*			trans	73	144.9	163.3	-56.2	-20.7	0	0	0	118.2
1094	T	42.5	Very low	39.2	Very low	113 Å²	113	140.9 Å²	140.9	69%	0.693	72%	0.721	S	S	*	*			cis	-163.1	117.5	-18.5	-80.4	0	0	0	0	105
1095	A	41.5	Very low	39.5	Very low	81 Å²	81	139.7 Å²	139.7	67%	0.669	73%	0.727	S	S	*	*				81.9	138	70.9	0	0	0	0	0	117.3
1096	I	46.4	Very low	39.3	Very low	141 Å²	141	139.4 Å²	139.4	72%	0.723	73%	0.732	S	S	*	*			trans	66.5	145	162.4	-9.6	100.2	0	0	0	122.6
1097	N	41.7	Very low	39.1	Very low	130 Å²	130	135.1 Å²	135.1	70%	0.695	73%	0.725	S	S	*	*			trans	87.6	150.5	151	-67.5	-44.8	0	0	0	121.3
1098	N	35.3	Very low	39	Very low	127 Å²	127	134.8 Å²	134.8	68%	0.679	73%	0.731	S	S	*	*			cis	-170.7	140.6	-39.2	-135.5	-40.5	0	0	0	113.2
1099	T	36.4	Very low	38.8	Very low	114 Å²	114	128.1 Å²	128.1	70%	0.699	73%	0.727	S	S	*	*			trans	64.2	163	150.6	-60.2	0	0	0	0	120.2
1100	Q	37.7	Very low	38.3	Very low	167 Å²	167	130 Å²	130	78%	0.78	73%	0.732	S	S	*	*			trans	84.1	131.8	158.9	-148.5	151.1	-53.8	0	0	117.4
1101	R	35.5	Very low	38	Very low	190 Å²	190	127.7 Å²	127.7	72%	0.717	73%	0.727	S	S	*	*			cis	-168.6	159.1	-12.7	-126.2	-178.2	-176.7	-155.6	10.1	112.3
1102	Q	39.7	Very low	37.5	Very low	135 Å²	135	132.8 Å²	132.8	63%	0.631	73%	0.733	S	S	*	*			trans	71.9	137.7	141.7	-86.1	176.6	-40.9	0	0	124.6
1103	N	34.1	Very low	37.2	Very low	138 Å²	138	131.5 Å²	131.5	74%	0.738	73%	0.726	S	S	*	*			trans	72	145.5	147.5	-57.1	-7	0	0	0	119.7
1104	S	38	Very low	36.7	Very low	99 Å²	99	133.8 Å²	133.8	69%	0.692	73%	0.729	S	S	*	*			cis	-174.6	158.8	-17	49.8	0	0	0	0	111.5
1105	S	42	Very low	36.4	Very low	108 Å²	108	132.6 Å²	132.6	76%	0.755	73%	0.726	S	S	*	*			trans	69.7	148.9	166.1	76	0	0	0	0	117.8
1106	I	35.9	Very low	36	Very low	159 Å²	159	133.3 Å²	133.3	82%	0.815	72%	0.718	S	S	*	*			cis	-150.7	169.1	-4.3	-123.9	163.5	0	0	0	111.7
1107	C	32.5	Very low	35.3	Very low	99 Å²	99	131.6 Å²	131.6	67%	0.669	72%	0.719	S	S	*	*			trans	-59.9	170.6	-174.2	-32.8	0	0	0	0	115.8
1108	N	35.6	Very low	35.1	Very low	160 Å²	160	129.9 Å²	129.9	86%	0.856	71%	0.713	S	S	*	*			cis	-136.5	168.1	16.6	-65.2	-67.2	0	0	0	109.5
1109	G	34	Very low	35.1	Very low	70 Å²	70	131.3 Å²	131.3	72%	0.722	72%	0.716	S	S	*	*			cis	102.9	128.2	35	0	0	0	0	0	109.1
1110	L	33.1	Very low	35	Very low	165 Å²	165	132.4 Å²	132.4	86%	0.864	72%	0.716	S	S	*	*			cis	-142.5	167.8	28	-75.6	164.8	0	0	0	114
1111	S	32.2	Very low	34.9	Very low	93 Å²	93	129.4 Å²	129.4	65%	0.65	71%	0.714	S	S	*	*			trans	-146	137.7	172.2	178.6	0	0	0	0	111.5
1112	W	31	Very low	34.7	Very low	208 Å²	208	127.8 Å²	127.8	79%	0.788	72%	0.72	S	S	*	*			trans	-153.6	117.2	165.8	-56.5	90.3	0	0	0	106
1113	N	33.3	Very low	34.5	Very low	120 Å²	120	127.4 Å²	127.4	64%	0.642	73%	0.726	S	S	*	*			cis	86.9	94.9	9.6	-134.9	-3.2	0	0	0	116.3
1114	K	33.4	Very low	34.5	Very low	192 Å²	192	127.7 Å²	127.7	84%	0.835	72%	0.723	S	S	*	*			trans	41.3	130	149.4	-64.2	-178.1	178.1	-173.5	0	121.3
1115	S	34.2	Very low	34.2	Very low	89 Å²	89	130.2 Å²	130.2	62%	0.622	72%	0.724	S	S	*	*				-167.8	164.3	99.9	-78.7	0	0	0	0	108
1116	D	33.5	Very low	34	Very low	96 Å²	96	133.1 Å²	133.1	51%	0.513	73%	0.729	S	S	.	*			cis	-148.7	-179.8	35.7	-103.5	-66.3	0	0	0	115.4	S787	S787-D1116 VanDerWaalsContact CA-CG 3.45Å; S787-D1116 WeakPolarHBondContact CA-OD1 3.32Å; S787-D1116 WeakPolarHBondContact CA-OD2 3.44Å; S787-D1116 WeakPolarHBondContact CB-OD1 3.48Å; S787-D1116 PolarHBondContact N-OD2 3.44Å; S787-D1116 VanDerWaalsContact N-OD2 3.08Å
1117	S	33.3	Very low	33.9	Very low	104 Å²	104	132.2 Å²	132.2	73%	0.727	72%	0.721	S	S	*	*			trans	-148.8	138.2	-176.8	-63.2	0	0	0	0	115.5
1118	T	37.2	Very low	34.1	Very low	95 Å²	95	134 Å²	134	58%	0.583	72%	0.724	S	S	*	*			trans	-150.3	113.8	158.2	52	0	0	0	0	107.2	L789	L789-T1118 HydrophobicContact CD1-CG2 3.76Å
1119	H	35.5	Very low	34.1	Very low	157 Å²	157	131.8 Å²	131.8	73%	0.727	71%	0.713	S	S	*	*			cis	83.1	141.9	49.2	-165.2	-102.4	0	0	0	114
1120	L	33.5	Very low	34.2	Very low	136 Å²	136	137 Å²	137	71%	0.712	72%	0.718	S	S	*	*			trans	76.5	139.9	-171.4	-51.8	173.9	0	0	0	115.7
1121	S	35.3	Very low	34.5	Very low	105 Å²	105	135.7 Å²	135.7	73%	0.734	72%	0.717	S	S	*	*			cis	-165.7	160.1	-19.7	47.8	0	0	0	0	111.6
1122	N	31.4	Very low	34.7	Very low	156 Å²	156	134.8 Å²	134.8	83%	0.834	72%	0.722	S	S	*	*			trans	-51.7	163.4	175.7	-45.3	-14.9	0	0	0	115.2
1123	V	35.9	Very low	35.1	Very low	126 Å²	126	132.2 Å²	132.2	76%	0.764	72%	0.722	S	S	*	*				-168.2	156	119.9	139.1	0	0	0	0	111.3
1124	E	34	Very low	35.2	Very low	144 Å²	144	134.7 Å²	134.7	67%	0.673	73%	0.734	S	S	*	*			trans	-18.8	137.9	177.5	-77	106.5	108.4	0	0	120
1125	Q	32	Very low	35.3	Very low	152 Å²	152	130.4 Å²	130.4	71%	0.71	73%	0.729	S	S	*	*				70.3	94.6	59.8	-173.7	-165.7	-13.1	0	0	113.9
1126	I	36.7	Very low	35.6	Very low	170 Å²	170	137.1 Å²	137.1	87%	0.872	76%	0.755	S	S	*	*			trans	-133.1	133.2	151.7	-65.1	-176.2	0	0	0	107.8
1127	Q	34.6	Very low	35.7	Very low	140 Å²	140	139.2 Å²	139.2	65%	0.654	77%	0.767	S	S	*	*			trans	-85.7	151.4	174	-71.6	148.2	-122.1	0	0	110.3
1128	D	36.7	Very low	35.8	Very low	135 Å²	135	141.1 Å²	141.1	72%	0.722	77%	0.769	S	S	*	*				-174.5	147.4	114.1	-102.6	-15.3	0	0	0	115.3
1129	N	35.2	Very low	35.7	Very low	115 Å²	115	143.6 Å²	143.6	62%	0.615	78%	0.78	S	S	*	*			trans	41.6	107	151.9	-55.3	-48.5	0	0	0	119.1
1130	Q	36.4	Very low	35.7	Very low	179 Å²	179	142.8 Å²	142.8	84%	0.836	78%	0.783	S	S	*	*				51.5	96.3	83.2	-70.9	-164.5	71.5	0	0	115.5
1131	V	39.9	Very low	35.9	Very low	138 Å²	138	143.3 Å²	143.3	84%	0.836	79%	0.787	S	S	*	*				-142.4	132.6	114.8	179.3	0	0	0	0	106.9
1132	G	36.4	Very low	35.9	Very low	74 Å²	74	145.8 Å²	145.8	76%	0.763	79%	0.791	S	S	*	*			trans	-100.7	138.6	171.4	0	0	0	0	0	111.2
1133	I	38.8	Very low	36.2	Very low	153 Å²	153	145.1 Å²	145.1	79%	0.785	79%	0.788	S	S	*	*			trans	-124.4	107.9	164.3	-63.1	-178.5	0	0	0	107.8
1134	L	34.4	Very low	36.3	Very low	173 Å²	173	146.5 Å²	146.5	91%	0.906	79%	0.79	S	S	*	*			trans	-82.8	131.5	155.5	-76.3	161.9	0	0	0	107.3
1135	S	35.8	Very low	36.5	Very low	102 Å²	102	146.8 Å²	146.8	71%	0.713	80%	0.799	S	S	*	*			trans	-165.3	117.6	154.7	-96.3	0	0	0	0	111.1
1136	I	40.7	Very low	36.9	Very low	230 Å²	230	146.3 Å²	146.3	100%	1.179	81%	0.807	S	S	*	*			trans	62.2	0	155	-45.6	179	0	0	0	115.5

Retrieved 1,136 of 1,136 residues in 221.9 ms (Link to these results)

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