A0A5K4F6H3_SCHMA Loading...

Rho-GAP domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F6H3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 966 aa.

						>A0A5K4F6H3_SCHMA|A0A5K4F6H3
MVLINSNKPDSDGNLTGTIVHHLDSSSQSSVSSEELLIWSKEGNDYDWELFPISPPLNEELSRIQSSSIVECDSNFTSVTNNNLNDVNNGSKAITTTESNFSNSNSSNGTTIYSYNHHNSVTGQLSTSPLTLQSCSHYMNGSSIQPQLIHSTKTNMIGTTINELISSSSFSRTSSSSKKAINNSFSFDNLYDQINMNTLADDFIDLDIKTIPITSSRSSTSSYYPDFDYVGFPESPIQSLQNSASNKKLKPLNLFISNNGINVQKSSVVSQSPETEIIRQTSLNPHFHQMLSSVNEIPTTKIIVGYNNGDGNNNDDSFPNYTEYRCNQNGYNKNENSISFHCQSSELIDHLSSDNESSEDLPGYLFLSSSSASSCIHIPSTCNDNNHNDHKSYHVSHMENNTLSINTIHKIVNNQENANNCHHHHEYHKYKNRQYQRQDNTLISLKSCSSIPLPFMLIPTSELASGGSLTCTVVNILRCLGLLDRCGVEDLCAILYDFWNNNCHAPFLPDHSFFKSHVIYPTCWELSRMEESVVTRSSSFTSCTLVDSRRSTVPGEDYERNYQMLINCRESKPLNGSCLVSYLLSCSYMGTSFLASHPIYNLNNLSSPCCLRPSTSCCYFVMDRTNQISPYNTPAIYHPNLIQPISNSNMNWRRGCADNLVLMLTHHSSGSKNTSSVVDKLLTGCFFPGPTSWRSAWPFIHKNNSKCFNCTKPKNNMSDSLVLWFSAWLYCGAIPVLAQLCDSVYSNAKYSPPDILQPSCKSSRYPTQELVWSHRLVYGVTENNEVYLTNPNELVPVQYVLDQLSKKPEIRISKAQISNLWTKHYLHSKLCPDRDQIMEDKQRISCKSTFFTGESLTLLARHPDPRWASMNIIGQVLCTLRSLERWADTLELSNVVSLDCVNHQSALFPDTTSSTSCSRTDSTDMEQFSNSPAITVPSAQLPGISLFVEKSNWELVHTLLQTKCIE
					

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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	29.4	Very low	29.7	Very low	242 Å²	242	146.8 Å²	146.8	100%	1.192	81%	0.808	S	S	*	*				0	159.5	0	-74.4	171.9	171	0	0	108.8
2	V	28.3	Very low	29.8	Very low	136 Å²	136	147.8 Å²	147.8	82%	0.824	81%	0.811	S	S	*	*			trans	-11.7	131.1	160.9	-179.3	0	0	0	0	114.4
3	L	27	Very low	30	Very low	154 Å²	154	142.4 Å²	142.4	81%	0.806	81%	0.81	S	S	*	*			cis	171.9	138.3	-12.6	-116	163.4	0	0	0	103.7
4	I	25.7	Very low	29.9	Very low	165 Å²	165	143.7 Å²	143.7	85%	0.846	81%	0.813	S	S	*	*			trans	-82.5	126.4	165.1	-62.7	170.6	0	0	0	107.8
5	N	28.7	Very low	30.1	Very low	127 Å²	127	145.5 Å²	145.5	68%	0.679	82%	0.819	S	S	*	*			trans	-159.3	118.4	154.4	-153.4	-12.6	0	0	0	112.8	N7	N5-N7 PolarHBondContact OD1-N 3.22Å
6	S	30.4	Very low	30	Very low	121 Å²	121	144.8 Å²	144.8	85%	0.846	82%	0.819	S	S	*	*			trans	-141.6	43.1	171.8	-64.7	0	0	0	0	111.4	K8	S6-K8 PolarHBondContact O-N 2.76Å
7	N	28.9	Very low	30.1	Very low	145 Å²	145	140.4 Å²	140.4	78%	0.775	81%	0.813	S	S	*	*			trans	-80.8	105.6	174.5	-87.5	-16.6	0	0	0	111.8	N5	N5-N7 PolarHBondContact OD1-N 3.22Å
8	K	30.9	Very low	29.9	Very low	183 Å²	183	139.5 Å²	139.5	80%	0.796	81%	0.81	S	S	*	*			trans	-171.3	113.3	142.8	-112.6	-174.3	178.5	-155.4	0	113.3	S6	S6-K8 PolarHBondContact O-N 2.76Å
9	P	32.1	Very low	30	Very low	117 Å²	117	140.7 Å²	140.7	76%	0.76	81%	0.811	S	S	*	*			trans	-108.6	128.3	159.7	34.8	-24.4	0	0	0	111.6
10	D	33.2	Very low	29.9	Very low	131 Å²	131	138.9 Å²	138.9	70%	0.701	80%	0.803	S	S	*	*			trans	-148.6	121.7	161.4	-74.8	-58.3	0	0	0	104.8
11	S	31.8	Very low	29.8	Very low	94 Å²	94	139.6 Å²	139.6	66%	0.657	80%	0.798	S	S	*	*				61.3	123.8	99.2	144.2	0	0	0	0	113.4
12	D	31.1	Very low	29.8	Very low	159 Å²	159	135.5 Å²	135.5	85%	0.85	78%	0.776	S	S	*	*			cis	-149.5	160.9	0.8	-80.1	-59.1	0	0	0	111.2
13	G	32.4	Very low	29.8	Very low	77 Å²	77	134.8 Å²	134.8	79%	0.794	77%	0.767	S	S	*	*			trans	174.2	67.2	176.5	0	0	0	0	0	117.4
14	N	28.1	Very low	29.8	Very low	161 Å²	161	134.6 Å²	134.6	86%	0.861	77%	0.767	S	S	*	*			trans	-70.8	137.7	171.1	-81.5	-48.1	0	0	0	112.5
15	L	33.3	Very low	29.8	Very low	171 Å²	171	132.1 Å²	132.1	90%	0.895	76%	0.764	S	S	*	*				-172	150.2	123.6	-101.2	161.9	0	0	0	113.6
16	T	28.3	Very low	29.8	Very low	133 Å²	133	130.8 Å²	130.8	82%	0.816	77%	0.765	S	S	*	*			trans	-100.6	158.7	-163	48	0	0	0	0	115.6
17	G	31.6	Very low	29.6	Very low	70 Å²	70	129.6 Å²	129.6	72%	0.722	76%	0.756	S	S	*	*			trans	133.4	103.7	165.8	0	0	0	0	0	112.2
18	T	26.4	Very low	29.6	Very low	125 Å²	125	131.7 Å²	131.7	77%	0.767	76%	0.762	S	S	*	*			cis	85.3	134.5	36.2	-42.1	0	0	0	0	113.8
19	I	31.4	Very low	29.5	Very low	162 Å²	162	128.2 Å²	128.2	83%	0.831	76%	0.76	S	S	*	*			trans	106.4	106.6	-168.6	-63.7	158.1	0	0	0	110.4
20	V	28.7	Very low	29.2	Very low	105 Å²	105	127.8 Å²	127.8	64%	0.636	76%	0.76	S	S	*	*			cis	95.5	133.5	17.2	-166.2	0	0	0	0	115
21	H	28.2	Very low	28.9	Very low	154 Å²	154	128.1 Å²	128.1	71%	0.713	77%	0.766	S	S	*	*			trans	71.6	148.9	-176.4	-54.2	-70.3	0	0	0	114.9
22	H	28.3	Very low	28.6	Very low	155 Å²	155	129.1 Å²	129.1	72%	0.718	77%	0.774	S	S	*	*			cis	-168.4	179	-10.9	-107.7	-32.2	0	0	0	108.3
23	L	29.1	Very low	28.5	Very low	122 Å²	122	126.5 Å²	126.5	64%	0.639	77%	0.768	S	S	*	*			cis	-159.8	143.2	4	-125.8	169.9	0	0	0	109.7
24	D	27.4	Very low	28.2	Very low	149 Å²	149	130.2 Å²	130.2	80%	0.797	76%	0.764	S	S	*	*			trans	48.1	168.9	151.9	-69.7	1.1	0	0	0	125.6
25	S	25.2	Very low	28.1	Very low	114 Å²	114	129.3 Å²	129.3	80%	0.797	76%	0.755	S	S	*	*			trans	-92.8	179.8	-166.8	63.9	0	0	0	0	113.5
26	S	29	Very low	27.8	Very low	98 Å²	98	129.6 Å²	129.6	69%	0.685	76%	0.756	S	S	*	*			cis	-168.6	168.3	29.7	63.9	0	0	0	0	116.5
27	S	26.9	Very low	27.8	Very low	96 Å²	96	130.1 Å²	130.1	67%	0.671	75%	0.754	S	S	*	*			trans	97	143.5	142.1	83.5	0	0	0	0	121.5
28	Q	28.2	Very low	27.6	Very low	190 Å²	190	135 Å²	135	89%	0.888	76%	0.761	S	S	*	*			trans	68.3	145.4	170.7	-46.9	-171.7	25.8	0	0	115.9
29	S	29.1	Very low	27.7	Very low	109 Å²	109	137.7 Å²	137.7	76%	0.762	76%	0.757	S	S	*	*			cis	-141.5	173.9	4.6	62.1	0	0	0	0	113.1
30	S	25	Very low	27.6	Very low	108 Å²	108	136.2 Å²	136.2	76%	0.755	76%	0.761	S	S	*	*			trans	-62.9	143.2	-178.9	51	0	0	0	0	116.3
31	V	28	Very low	27.6	Very low	138 Å²	138	138.5 Å²	138.5	84%	0.836	76%	0.763	S	S	*	*			trans	-139.9	140	151.1	-177.1	0	0	0	0	109.2
32	S	24.2	Very low	27.7	Very low	116 Å²	116	137.7 Å²	137.7	81%	0.811	76%	0.759	S	S	*	*			trans	-141.9	104	169.9	57.8	0	0	0	0	109.9
33	S	29.1	Very low	27.7	Very low	104 Å²	104	134 Å²	134	73%	0.727	76%	0.763	S	S	*	*			trans	-152.4	148.4	171.7	-56.2	0	0	0	0	110.4
34	E	26.5	Very low	27.7	Very low	155 Å²	155	134.6 Å²	134.6	72%	0.724	77%	0.767	S	S	*	*			trans	-63.7	170.6	-167.5	-65.1	106.4	148.9	0	0	117.9
35	E	26.2	Very low	27.7	Very low	142 Å²	142	134 Å²	134	66%	0.664	76%	0.763	S	S	*	*			trans	57.7	97.1	153.3	-72.6	-174.3	-178.8	0	0	120.1
36	L	26.8	Very low	27.7	Very low	176 Å²	176	137 Å²	137	92%	0.921	76%	0.759	S	S	*	*			trans	-129.8	87	150	-116.6	174.7	0	0	0	110.5
37	L	27.7	Very low	27.8	Very low	145 Å²	145	138.9 Å²	138.9	76%	0.759	76%	0.761	S	S	*	*			trans	-139.1	99.5	171.1	-93.4	174.6	0	0	0	111.4
38	I	28.4	Very low	27.7	Very low	171 Å²	171	143.5 Å²	143.5	88%	0.877	76%	0.764	S	S	*	*			trans	-122.8	130	148.1	-66.4	-176.8	0	0	0	106.4
39	W	28.8	Very low	27.7	Very low	183 Å²	183	143.1 Å²	143.1	69%	0.693	76%	0.762	S	S	*	*			trans	-75.5	152.2	-168.3	-57.1	-32.7	0	0	0	113.6
40	S	28.4	Very low	27.7	Very low	131 Å²	131	146.5 Å²	146.5	92%	0.916	77%	0.771	S	S	*	*			trans	-80.7	130.9	142.4	-65.6	0	0	0	0	108.2
41	K	30	Very low	27.8	Very low	152 Å²	152	149.9 Å²	149.9	66%	0.661	77%	0.772	S	S	*	*			trans	-109	-178.4	-170	-166.7	175.1	165.7	-77.4	0	110.7
42	E	30.1	Very low	28	Very low	138 Å²	138	149.6 Å²	149.6	65%	0.645	77%	0.773	S	S	*	*			trans	80.4	116	175.8	-90.8	48.6	-104.9	0	0	116.2
43	G	27.2	Very low	28.2	Very low	77 Å²	77	150.8 Å²	150.8	79%	0.794	77%	0.769	S	S	*	*			trans	162.4	81.1	-172	0	0	0	0	0	107.3
44	N	29.3	Very low	28.1	Very low	134 Å²	134	150.6 Å²	150.6	72%	0.717	77%	0.768	S	S	*	*			trans	-73.3	163.6	-149.3	-69.1	6.5	0	0	0	116.4
45	D	26.6	Very low	28.2	Very low	136 Å²	136	149 Å²	149	73%	0.727	77%	0.771	S	S	*	*			trans	-56.9	177.3	175.8	-46.9	-88.3	0	0	0	115.9
46	Y	26.5	Very low	28.4	Very low	179 Å²	179	147.7 Å²	147.7	70%	0.702	78%	0.775	S	S	*	*			trans	109.6	153.7	161.9	-67.3	-77.2	0	0	0	118.3	W48	Y46-W48 AromaticContact CD1-CH2 3.52Å; Y46-W48 HydrophobicContact CD1-CH2 3.52Å; Y46-W48 AromaticContact CD1-CZ2 3.64Å; Y46-W48 HydrophobicContact CD1-CZ2 3.64Å; Y46-W48 HydrophobicContact CD1-CZ3 4.44Å; Y46-W48 AromaticContact CE1-CH2 3.77Å; Y46-W48 HydrophobicContact CE1-CH2 3.77Å; Y46-W48 AromaticContact CE1-CZ2 3.84Å; Y46-W48 HydrophobicContact CE1-CZ2 3.84Å
47	D	29.8	Very low	28.4	Very low	136 Å²	136	147.1 Å²	147.1	73%	0.727	77%	0.771	S	S	*	*			trans	69.6	71.2	171.9	-57.6	-8.8	0	0	0	117.8
48	W	26	Very low	28.5	Very low	193 Å²	193	147.9 Å²	147.9	73%	0.731	78%	0.777	S	S	*	*			trans	-48.2	171.6	139.1	-8.8	-91.7	0	0	0	112.6	Y46	Y46-W48 AromaticContact CD1-CH2 3.52Å; Y46-W48 HydrophobicContact CD1-CH2 3.52Å; Y46-W48 AromaticContact CD1-CZ2 3.64Å; Y46-W48 HydrophobicContact CD1-CZ2 3.64Å; Y46-W48 HydrophobicContact CD1-CZ3 4.44Å; Y46-W48 AromaticContact CE1-CH2 3.77Å; Y46-W48 HydrophobicContact CE1-CH2 3.77Å; Y46-W48 AromaticContact CE1-CZ2 3.84Å; Y46-W48 HydrophobicContact CE1-CZ2 3.84Å
49	E	26.9	Very low	28.6	Very low	182 Å²	182	148.3 Å²	148.3	85%	0.85	78%	0.775	S	S	*	*			trans	77.6	77.8	179.1	-53.3	-157.5	158.3	0	0	118.2
50	L	29.3	Very low	28.6	Very low	180 Å²	180	147.7 Å²	147.7	94%	0.942	78%	0.779	S	S	*	*			trans	-130.8	67.1	148.9	-81.1	-178.7	0	0	0	112.1
51	F	29	Very low	28.7	Very low	179 Å²	179	150.3 Å²	150.3	79%	0.785	78%	0.782	S	S	*	*			trans	-84.9	133.2	150.5	-85.6	-79.8	0	0	0	108.7	I53	F51-I53 PolarHBondContact O-N 3.43Å
52	P	30.3	Very low	28.7	Very low	132 Å²	132	146.7 Å²	146.7	86%	0.857	78%	0.776	S	S	*	*			trans	-72.1	94.5	174.3	29.4	-33.5	0	0	0	110.1
53	I	30.2	Very low	28.6	Very low	141 Å²	141	151.3 Å²	151.3	72%	0.723	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-88.5	132.8	166.4	-62.9	-180	0	0	0	108	F51	F51-I53 PolarHBondContact O-N 3.43Å
54	S	26.6	Very low	28.7	Very low	101 Å²	101	154.4 Å²	154.4	71%	0.706	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-55.7	143.1	179.8	-51.6	0	0	0	0	112
55	P	28.9	Very low	28.7	Very low	122 Å²	122	156.4 Å²	156.4	79%	0.792	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-63.4	134.4	179.8	26.8	-34.6	0	0	0	111
56	P	30.2	Very low	28.9	Very low	114 Å²	114	154.7 Å²	154.7	74%	0.74	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-70.9	150.3	173.6	30.2	-34.3	0	0	0	111.2	N58	P56-N58 PolarHBondContact O-N 3.03Å
57	L	26.7	Very low	29	Very low	163 Å²	163	151 Å²	151	85%	0.853	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-67.8	124.5	170.6	-71	132	0	0	0	109.8
58	N	28.9	Very low	29.1	Very low	162 Å²	162	149.9 Å²	149.9	87%	0.866	79%	0.791	S	S	*	*			trans	-98.5	97.1	162.5	-85.7	-16.4	0	0	0	108.7	P56	P56-N58 PolarHBondContact O-N 3.03Å
59	E	31	Very low	29	Very low	180 Å²	180	148.2 Å²	148.2	84%	0.841	80%	0.795	S	S	*	*			trans	-79.2	135.7	162.3	-71.3	-173.3	142.3	0	0	110.2
60	E	28.2	Very low	29.2	Very low	169 Å²	169	146.1 Å²	146.1	79%	0.79	80%	0.795	S	S	*	*			trans	13.6	105.2	166.7	-56.3	-159.6	105.9	0	0	120.3
61	L	31.1	Very low	29	Very low	187 Å²	187	145.5 Å²	145.5	98%	0.979	79%	0.787	S	S	*	*			trans	-110.2	110.6	130.7	-96	171	0	0	0	108.6
62	S	29.6	Very low	29	Very low	75 Å²	75	142.4 Å²	142.4	52%	0.524	79%	0.786	S	S	.	*			trans	-104.1	170.2	-167.4	54.7	0	0	0	0	113.5
63	R	28.8	Very low	28.9	Very low	236 Å²	236	143.1 Å²	143.1	89%	0.891	78%	0.782	S	S	*	*			trans	81.4	134.6	-166.7	-47.6	162.1	-152.9	-163.1	4.8	111
64	I	29.3	Very low	28.9	Very low	142 Å²	142	140.8 Å²	140.8	73%	0.728	78%	0.779	S	S	*	*	S	Bend	cis	-131.5	136.6	31.6	-68.4	167.9	0	0	0	111.7
65	Q	29.5	Very low	29.1	Very low	176 Å²	176	143.1 Å²	143.1	82%	0.822	78%	0.783	S	S	*	*			trans	63.5	129.1	163.1	-72.7	161.2	-4	0	0	117.7
66	S	29.2	Very low	29.1	Very low	99 Å²	99	147.6 Å²	147.6	69%	0.692	79%	0.791	S	S	*	*			cis	-155.3	153.5	1	-75.2	0	0	0	0	112.4
67	S	30.6	Very low	28.9	Very low	102 Å²	102	148.8 Å²	148.8	71%	0.713	80%	0.796	S	S	*	*			trans	32.8	103.7	152.6	56.2	0	0	0	0	119
68	S	31.1	Very low	28.9	Very low	113 Å²	113	146.4 Å²	146.4	79%	0.79	79%	0.793	S	S	*	*				95.2	128.6	59.6	66.4	0	0	0	0	114.3
69	I	24	Very low	29	Very low	157 Å²	157	145.2 Å²	145.2	81%	0.805	79%	0.791	S	S	*	*			trans	-73.5	140.3	-177.1	-61.9	160.2	0	0	0	112.3
70	V	31.3	Very low	28.8	Very low	139 Å²	139	142.2 Å²	142.2	84%	0.842	79%	0.785	S	S	*	*			trans	-140.2	139.7	150.9	-178.3	0	0	0	0	107.5
71	E	25.5	Very low	28.8	Very low	167 Å²	167	141.5 Å²	141.5	78%	0.78	79%	0.787	S	S	*	*			trans	-87.2	172.6	177.8	-67.6	179.4	108.4	0	0	112.9
72	C	28.4	Very low	28.6	Very low	114 Å²	114	139.9 Å²	139.9	77%	0.77	78%	0.78	S	S	*	*			trans	79.9	128.8	170.5	-56.4	0	0	0	0	119
73	D	27.2	Very low	28.7	Very low	146 Å²	146	143.3 Å²	143.3	78%	0.781	79%	0.792	S	S	*	*			trans	63.1	72	138.4	-55.3	-12.3	0	0	0	120.1
74	S	30.4	Very low	28.8	Very low	92 Å²	92	138.8 Å²	138.8	64%	0.643	79%	0.785	S	S	*	*				55.6	116.2	116.9	69.7	0	0	0	0	120.8
75	N	30.5	Very low	28.9	Very low	151 Å²	151	138.2 Å²	138.2	81%	0.807	78%	0.783	S	S	*	*			trans	82.6	134.1	135.2	-61.9	-14.6	0	0	0	120.6	T77	N75-T77 PolarHBondContact O-N 3.45Å
76	F	30	Very low	29	Very low	216 Å²	216	136.8 Å²	136.8	95%	0.947	78%	0.781	S	S	*	*			trans	-44.4	128.2	161	-86.1	-106.3	0	0	0	112.3
77	T	26.6	Very low	29	Very low	138 Å²	138	137.3 Å²	137.3	85%	0.847	78%	0.78	S	S	*	*			trans	-85.7	129.4	168.3	39.5	0	0	0	0	111.2	N75	N75-T77 PolarHBondContact O-N 3.45Å
78	S	26.8	Very low	29	Very low	113 Å²	113	138.7 Å²	138.7	79%	0.79	78%	0.779	S	S	*	*			trans	-120.1	83.2	153.1	66.9	0	0	0	0	109.4
79	V	29.4	Very low	29.1	Very low	137 Å²	137	140.9 Å²	140.9	83%	0.83	78%	0.782	S	S	*	*			trans	51.7	111.2	150.7	-172.1	0	0	0	0	118.2
80	T	26.8	Very low	29.4	Very low	117 Å²	117	136.7 Å²	136.7	72%	0.718	78%	0.777	S	S	*	*			trans	-73.1	142.5	158.2	51	0	0	0	0	111.9
81	N	28.9	Very low	29.6	Very low	155 Å²	155	135.1 Å²	135.1	83%	0.829	77%	0.773	S	S	*	*				-177.3	141.5	120.4	-92.1	-14.1	0	0	0	112.7
82	N	26.8	Very low	29.9	Very low	153 Å²	153	137.1 Å²	137.1	82%	0.818	78%	0.779	S	S	*	*			trans	-94.8	134.5	163	-77.7	-26.7	0	0	0	109.6
83	N	32.7	Very low	29.9	Very low	146 Å²	146	135.2 Å²	135.2	78%	0.781	77%	0.771	S	S	*	*				178.9	128	128.3	-92.9	-24.5	0	0	0	112.2
84	L	29.3	Very low	30.1	Very low	142 Å²	142	135.2 Å²	135.2	74%	0.743	77%	0.77	S	S	*	*			trans	44.5	107.6	146.5	-72.8	135.2	0	0	0	117.6
85	N	31.6	Very low	29.8	Very low	130 Å²	130	136.8 Å²	136.8	70%	0.695	78%	0.776	S	S	*	*				-164.8	159.5	64.6	-79	-36.3	0	0	0	113.1
86	D	31.2	Very low	29.7	Very low	145 Å²	145	136.4 Å²	136.4	78%	0.775	78%	0.779	S	S	*	*			trans	38.6	145	140.6	-62.7	-13.6	0	0	0	123.1
87	V	30.7	Very low	29.5	Very low	111 Å²	111	132.1 Å²	132.1	67%	0.673	77%	0.77	S	S	*	*			cis	-175.1	135.9	-25.5	116.1	0	0	0	0	107.5
88	N	31	Very low	29.4	Very low	131 Å²	131	133.9 Å²	133.9	70%	0.701	77%	0.769	S	S	*	*			trans	150.1	137.9	141.4	-87.4	-56	0	0	0	114.7
89	N	32.7	Very low	29.5	Very low	159 Å²	159	133 Å²	133	85%	0.85	76%	0.763	S	S	*	*			trans	54.6	130.9	159.9	-54.7	-29.4	0	0	0	117.8
90	G	30.6	Very low	29.3	Very low	68 Å²	68	133.5 Å²	133.5	70%	0.701	76%	0.761	S	S	*	*			cis	147.6	150.6	6.6	0	0	0	0	0	108.2
91	S	33.8	Very low	29.5	Very low	107 Å²	107	137.2 Å²	137.2	75%	0.748	77%	0.768	S	S	*	*			cis	-162.4	152	10	-49.7	0	0	0	0	111.7
92	K	32.3	Very low	29.5	Very low	209 Å²	209	134.1 Å²	134.1	91%	0.909	76%	0.758	S	S	*	*			trans	66.7	153.9	153.8	-67.7	176.3	178.9	179.6	0	119.2
93	A	28.7	Very low	29.6	Very low	73 Å²	73	134.1 Å²	134.1	60%	0.603	76%	0.758	S	S	*	*			cis	-175.6	151	-21.3	0	0	0	0	0	112.2
94	I	30.9	Very low	29.5	Very low	147 Å²	147	131.4 Å²	131.4	75%	0.754	75%	0.75	S	S	*	*			trans	61.9	126.2	145.4	-64.3	163.1	0	0	0	117.2
95	T	23.7	Very low	29.6	Very low	125 Å²	125	131.7 Å²	131.7	77%	0.767	75%	0.752	S	S	*	*			cis	82.9	99.2	17.5	-41.1	0	0	0	0	117.7
96	T	28.9	Very low	29.7	Very low	142 Å²	142	130.1 Å²	130.1	87%	0.871	75%	0.752	S	S	*	*			trans	-174.5	167.2	140.3	29.3	0	0	0	0	113.2
97	T	26.1	Very low	29.8	Very low	126 Å²	126	127.8 Å²	127.8	77%	0.773	75%	0.747	S	S	*	*			trans	-110.4	177.6	-178	44	0	0	0	0	113.9
98	E	25.2	Very low	29.9	Very low	176 Å²	176	130.4 Å²	130.4	82%	0.822	76%	0.757	S	S	*	*			trans	93.4	140.2	154.9	-69.5	-171.2	-169.4	0	0	123.3
99	S	27.8	Very low	29.9	Very low	95 Å²	95	127 Å²	127	66%	0.664	75%	0.753	S	S	*	*			trans	89.9	104.5	144.6	73.8	0	0	0	0	122.6
100	N	25.8	Very low	29.7	Very low	146 Å²	146	125.9 Å²	125.9	78%	0.781	75%	0.752	S	S	*	*				63.9	167.2	122	-64.7	-16.5	0	0	0	123.4
101	F	30.8	Very low	29.4	Very low	196 Å²	196	128.3 Å²	128.3	86%	0.86	75%	0.753	S	S	*	*			trans	75.4	146.2	179.8	-60.3	-82.8	0	0	0	117
102	S	28.5	Very low	29.2	Very low	89 Å²	89	130.7 Å²	130.7	62%	0.622	76%	0.756	S	S	*	*			cis	-178.3	150.8	-35.3	-108.8	0	0	0	0	110.2
103	N	28.9	Very low	29	Very low	154 Å²	154	129.8 Å²	129.8	82%	0.824	75%	0.748	S	S	*	*			trans	65.7	154.8	157	-66.6	1.4	0	0	0	118.4
104	S	30.4	Very low	28.7	Very low	88 Å²	88	131.2 Å²	131.2	62%	0.615	75%	0.754	S	S	*	*			cis	-165.1	175	-21.7	56.2	0	0	0	0	111.3
105	N	32.3	Very low	28.5	Very low	148 Å²	148	135.4 Å²	135.4	79%	0.791	76%	0.762	S	S	*	*			trans	90.9	134.2	168	-48.9	-4.2	0	0	0	116.2
106	S	33.8	Very low	28.5	Very low	98 Å²	98	135.8 Å²	135.8	69%	0.685	76%	0.759	S	S	*	*			cis	-171.5	139.3	-14.8	49	0	0	0	0	112.2
107	S	32.4	Very low	28.4	Very low	96 Å²	96	136.3 Å²	136.3	67%	0.671	75%	0.751	S	S	*	*			trans	38.1	135.1	142.8	59.2	0	0	0	0	121.1
108	N	32.7	Very low	28.6	Very low	165 Å²	165	137.2 Å²	137.2	88%	0.882	75%	0.746	S	S	*	*			cis	-157.3	169.9	11.4	-78.2	-36	0	0	0	108.2
109	G	30.7	Very low	28.8	Very low	59 Å²	59	135.2 Å²	135.2	61%	0.608	74%	0.741	S	S	*	*			cis	163.4	162.8	-3.4	0	0	0	0	0	111.3
110	T	30.5	Very low	28.9	Very low	136 Å²	136	135 Å²	135	83%	0.834	74%	0.74	S	S	*	*			trans	55.9	122.8	172.9	46.7	0	0	0	0	118.1
111	T	24	Very low	29	Very low	120 Å²	120	134.7 Å²	134.7	74%	0.736	74%	0.743	S	S	*	*			cis	78.8	116.3	23.7	-39.6	0	0	0	0	115.9
112	I	29.6	Very low	29	Very low	156 Å²	156	131.9 Å²	131.9	80%	0.8	74%	0.742	S	S	*	*			trans	-167.4	145.8	141.4	-100.9	153.4	0	0	0	111.9
113	Y	27.2	Very low	29.1	Very low	191 Å²	191	130.5 Å²	130.5	75%	0.749	74%	0.742	S	S	*	*			trans	-35.2	141.3	174.9	-56.5	-86.3	0	0	0	116.7
114	S	23.2	Very low	29	Very low	102 Å²	102	132 Å²	132	71%	0.713	74%	0.744	S	S	*	*				70.6	120	55.8	-53.3	0	0	0	0	115.1
115	Y	26.2	Very low	28.9	Very low	236 Å²	236	134.8 Å²	134.8	93%	0.925	75%	0.751	S	S	*	*			trans	-167.3	159.6	133.5	-114.1	-75.7	0	0	0	111.7
116	N	23.6	Very low	28.5	Very low	133 Å²	133	132.1 Å²	132.1	71%	0.711	74%	0.744	S	S	*	*			trans	-146.6	157.3	-179.8	-158.9	-1.8	0	0	0	109.8
117	H	27.2	Very low	28.2	Very low	152 Å²	152	133.2 Å²	133.2	70%	0.704	75%	0.747	S	S	*	*			trans	63.7	162.1	-170.9	-63.7	-75.3	0	0	0	115.3
118	H	29.8	Very low	27.8	Very low	145 Å²	145	133.7 Å²	133.7	67%	0.671	75%	0.75	S	S	*	*			cis	-151.5	155.1	12.9	-127.6	-60.8	0	0	0	111.3
119	N	28.9	Very low	27.5	Very low	135 Å²	135	131.9 Å²	131.9	72%	0.722	75%	0.747	S	S	*	*			trans	69.6	151.8	148.4	-71.2	-6.5	0	0	0	120.3
120	S	30.1	Very low	27.3	Very low	91 Å²	91	137.6 Å²	137.6	64%	0.636	76%	0.763	S	S	*	*			cis	-173.4	147	-10.1	46.7	0	0	0	0	113.8
121	V	28.3	Very low	27	Very low	139 Å²	139	136.8 Å²	136.8	84%	0.842	76%	0.758	S	S	*	*			trans	67.2	145.8	142.2	168.2	0	0	0	0	117.5
122	T	31.9	Very low	27	Very low	136 Å²	136	138.7 Å²	138.7	83%	0.834	76%	0.763	S	S	*	*			cis	-112.7	162.9	1.1	37.1	0	0	0	0	111.9
123	G	29	Very low	26.8	Very low	61 Å²	61	139.7 Å²	139.7	63%	0.629	76%	0.764	S	S	*	*			cis	160.1	161.7	-6.6	0	0	0	0	0	112.6
124	Q	28.4	Very low	26.7	Very low	185 Å²	185	135.1 Å²	135.1	86%	0.864	76%	0.76	S	S	*	*			trans	55.5	144	161.5	-61.6	-176.6	-15.7	0	0	119.7
125	L	27.8	Very low	26.9	Very low	146 Å²	146	135.8 Å²	135.8	76%	0.764	76%	0.763	S	S	*	*			cis	-158.8	173.9	-14.1	-117	168.4	0	0	0	109
126	S	23.4	Very low	26.9	Very low	92 Å²	92	128.8 Å²	128.8	64%	0.643	75%	0.749	S	S	*	*			trans	-45.4	146.2	173.1	52.6	0	0	0	0	114.5
127	T	27	Very low	27	Very low	122 Å²	122	129.4 Å²	129.4	75%	0.748	75%	0.748	S	S	*	*				-174.3	151	78.5	38.8	0	0	0	0	114.5
128	S	24.9	Very low	27.1	Very low	105 Å²	105	131.4 Å²	131.4	73%	0.734	75%	0.75	S	S	*	*			trans	57.9	145.6	143.1	-56.4	0	0	0	0	122.5
129	P	26.7	Very low	27.1	Very low	127 Å²	127	131.4 Å²	131.4	83%	0.825	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-77.9	140.8	172.1	33.3	-34.3	0	0	0	111.8
130	L	26.7	Very low	27.1	Very low	180 Å²	180	132.2 Å²	132.2	94%	0.942	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-101.1	120.7	177.1	-91	169	0	0	0	112.5
131	T	23.7	Very low	27	Very low	118 Å²	118	131.6 Å²	131.6	72%	0.724	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-97.4	136.8	165.7	48.9	0	0	0	0	111.5
132	L	23.7	Very low	27.1	Very low	161 Å²	161	130.9 Å²	130.9	84%	0.843	77%	0.766	S	S	*	*			trans	73.5	162	143.6	-88	162.3	0	0	0	121.6
133	Q	25.5	Very low	26.8	Very low	177 Å²	177	129.3 Å²	129.3	83%	0.827	76%	0.76	S	S	*	*			trans	71.7	133	161.3	-79.6	-173.6	-34.8	0	0	118.3
134	S	25.6	Very low	26.9	Very low	95 Å²	95	134.4 Å²	134.4	66%	0.664	77%	0.772	S	S	*	*			cis	-152	-178.4	-14.3	-41.9	0	0	0	0	107.9
135	C	25.9	Very low	26.6	Very low	115 Å²	115	134.1 Å²	134.1	78%	0.777	77%	0.77	S	S	*	*			cis	-154.3	159.6	5.5	-99.5	0	0	0	0	105.1
136	S	26	Very low	27	Very low	90 Å²	90	131.8 Å²	131.8	63%	0.629	76%	0.764	S	S	*	*			cis	-162.6	-140.8	-15.9	-78.2	0	0	0	0	104.8
137	H	27.8	Very low	27.2	Very low	146 Å²	146	136.8 Å²	136.8	68%	0.676	78%	0.777	S	S	*	*			cis	-163.1	130.3	-1.9	-130.5	-45.9	0	0	0	109
138	Y	27.8	Very low	27	Very low	193 Å²	193	137.7 Å²	137.7	76%	0.757	78%	0.777	S	S	*	*			trans	64	140.3	170.3	-66.2	-70.6	0	0	0	117.3
139	M	30.1	Very low	27.2	Very low	145 Å²	145	140.9 Å²	140.9	71%	0.714	78%	0.783	S	S	*	*			cis	-142.4	149.9	4.8	-109.3	-61.6	-172.8	0	0	112.1
140	N	28.5	Very low	27.2	Very low	152 Å²	152	142.4 Å²	142.4	81%	0.813	78%	0.779	S	S	*	*			trans	-13.7	147.4	166.5	-57.4	-15.5	0	0	0	122.3
141	G	28.9	Very low	27.2	Very low	78 Å²	78	139.6 Å²	139.6	80%	0.804	78%	0.775	S	S	*	*			trans	171.3	68.2	162.8	0	0	0	0	0	115.1
142	S	30.4	Very low	27.3	Very low	125 Å²	125	139.9 Å²	139.9	87%	0.874	78%	0.777	S	S	*	*			trans	-82.6	142.5	-166.6	-48.2	0	0	0	0	116.3
143	S	25.8	Very low	27.6	Very low	102 Å²	102	140.7 Å²	140.7	71%	0.713	77%	0.773	S	S	*	*			trans	-87.8	162.9	157.6	49.3	0	0	0	0	111
144	I	29.7	Very low	27.8	Very low	169 Å²	169	137.9 Å²	137.9	87%	0.867	77%	0.769	S	S	*	*				-174.8	168.8	93	-89.2	164.8	0	0	0	109.8
145	Q	23.7	Very low	27.8	Very low	178 Å²	178	140.2 Å²	140.2	83%	0.832	77%	0.774	S	S	*	*			trans	-101.1	-155	-164.6	-149.8	-163.6	-3.8	0	0	113.3
146	P	35.1	Very low	27.9	Very low	97 Å²	97	142.5 Å²	142.5	63%	0.63	78%	0.775	S	S	*	*				-119.8	-178.1	-116.4	43.7	-28.7	0	0	0	116.6
147	Q	27.6	Very low	28	Very low	197 Å²	197	145.9 Å²	145.9	92%	0.921	78%	0.784	S	S	*	*			trans	-156.2	155.2	149.7	-112.9	170.9	27.9	0	0	112.6
148	L	23.8	Very low	28	Very low	142 Å²	142	141.6 Å²	141.6	74%	0.743	78%	0.779	S	S	*	*			trans	-105.5	147.7	-179.2	-68.8	75.8	0	0	0	111.8
149	I	28.6	Very low	28.2	Very low	171 Å²	171	138.3 Å²	138.3	88%	0.877	78%	0.779	S	S	*	*			trans	-147.8	141.9	137.2	-66.6	-164.6	0	0	0	109
150	H	25.9	Very low	28	Very low	159 Å²	159	137.2 Å²	137.2	74%	0.736	78%	0.781	S	S	*	*			trans	-94.1	150.8	171.6	-74.6	-107	0	0	0	112.5
151	S	27.1	Very low	28	Very low	121 Å²	121	136.4 Å²	136.4	85%	0.846	78%	0.776	S	S	*	*				-178.2	146	120	-83.3	0	0	0	0	116.1
152	T	26.5	Very low	28	Very low	125 Å²	125	138.5 Å²	138.5	77%	0.767	77%	0.768	S	S	*	*			trans	-64.4	160.5	178.7	50.3	0	0	0	0	114.8
153	K	28.5	Very low	27.8	Very low	177 Å²	177	139.8 Å²	139.8	77%	0.77	76%	0.76	S	S	*	*				178.9	140.1	89.6	-101.7	-173.1	176.1	176.7	0	115.8
154	T	29.7	Very low	28	Very low	119 Å²	119	142.1 Å²	142.1	73%	0.73	76%	0.764	S	S	*	*			trans	53.6	157.6	139.7	57.7	0	0	0	0	123.1
155	N	25.6	Very low	27.8	Very low	144 Å²	144	141.4 Å²	141.4	77%	0.77	76%	0.76	S	S	*	*			cis	-177.9	173.6	-38.2	-126.6	2.8	0	0	0	109.4
156	M	28.2	Very low	27.9	Very low	163 Å²	163	137.8 Å²	137.8	80%	0.803	76%	0.755	S	S	*	*			trans	79.2	150.7	167.3	-50.4	-166.6	-60.1	0	0	117.7
157	I	28.5	Very low	27.5	Very low	160 Å²	160	138 Å²	138	82%	0.821	76%	0.758	S	S	*	*			cis	-159.9	153.7	-16.7	-108.8	165.9	0	0	0	108.6
158	G	29	Very low	27.5	Very low	56 Å²	56	133.4 Å²	133.4	58%	0.577	75%	0.748	S	S	*	*			trans	145.4	91.7	164.1	0	0	0	0	0	115.5
159	T	30.4	Very low	27.6	Very low	124 Å²	124	131.5 Å²	131.5	76%	0.761	75%	0.747	S	S	*	*				65.3	99.7	99.6	56.9	0	0	0	0	115.3
160	T	26.6	Very low	27.5	Very low	122 Å²	122	132.7 Å²	132.7	75%	0.748	75%	0.746	S	S	*	*				67.5	143.2	85.9	60.7	0	0	0	0	114.3
161	I	29.1	Very low	27.4	Very low	136 Å²	136	129 Å²	129	70%	0.697	74%	0.738	S	S	*	*			cis	-166	153.8	14.2	-126.7	164.8	0	0	0	110.3
162	N	29	Very low	27.4	Very low	121 Å²	121	134.1 Å²	134.1	65%	0.647	74%	0.739	S	S	*	*			trans	53.8	168.4	155.8	-65.2	25.1	0	0	0	120.2
163	E	26.1	Very low	27.5	Very low	152 Å²	152	133.4 Å²	133.4	71%	0.71	74%	0.735	S	S	*	*			cis	-165.5	172.8	-19.6	-107.8	171.9	134.1	0	0	109.6
164	L	30.4	Very low	27.4	Very low	151 Å²	151	129.8 Å²	129.8	79%	0.791	73%	0.731	S	S	*	*			trans	64.4	123.3	162	-63.8	149.7	0	0	0	117.5
165	I	25.4	Very low	27.5	Very low	154 Å²	154	129.6 Å²	129.6	79%	0.79	74%	0.735	S	S	*	*				57.9	117	54	-54.2	178.8	0	0	0	111.6
166	S	25.3	Very low	27.7	Very low	102 Å²	102	127.3 Å²	127.3	71%	0.713	73%	0.73	S	S	*	*			cis	-159	169.6	13.3	-146	0	0	0	0	115
167	S	25.8	Very low	27.8	Very low	101 Å²	101	123.9 Å²	123.9	71%	0.706	72%	0.722	S	S	*	*			trans	63.1	132	146.9	60.3	0	0	0	0	125.4
168	S	27.2	Very low	27.9	Very low	101 Å²	101	125.2 Å²	125.2	71%	0.706	72%	0.722	S	S	*	*			trans	75	90.4	135.9	66.3	0	0	0	0	124.5
169	S	26.7	Very low	28.1	Very low	103 Å²	103	132.3 Å²	132.3	72%	0.72	74%	0.737	S	S	*	*				71.4	159	119.3	73.9	0	0	0	0	123.6
170	F	26.4	Very low	28	Very low	196 Å²	196	130.6 Å²	130.6	86%	0.86	74%	0.735	S	S	*	*			trans	70	146.2	177.8	-82.9	-110.5	0	0	0	116.9
171	S	25	Very low	28.3	Very low	82 Å²	82	131.9 Å²	131.9	57%	0.573	74%	0.736	S	S	*	*			cis	-179.1	148.5	-25.6	-114.3	0	0	0	0	111.3
172	R	26.5	Very low	28.2	Very low	228 Å²	228	131.7 Å²	131.7	86%	0.86	74%	0.737	S	S	*	*			trans	64.4	169.9	149.6	-72.5	-174.7	170.6	-169.7	-2.1	116.5
173	T	27.5	Very low	28.1	Very low	110 Å²	110	132.6 Å²	132.6	68%	0.675	74%	0.742	S	S	*	*			cis	-159.2	135.9	-11.2	17.5	0	0	0	0	107
174	S	26.5	Very low	28.2	Very low	100 Å²	100	130 Å²	130	70%	0.699	74%	0.741	S	S	*	*				72.3	133.2	77.7	98.2	0	0	0	0	118.2
175	S	33.1	Very low	28.1	Very low	115 Å²	115	132.4 Å²	132.4	80%	0.804	75%	0.745	S	S	*	*			trans	-143.4	128	157.3	46.2	0	0	0	0	107.9
176	S	28.7	Very low	28.4	Very low	96 Å²	96	130.2 Å²	130.2	67%	0.671	74%	0.743	S	S	*	*			cis	72	144.8	14.6	124.7	0	0	0	0	114.8
177	S	31.5	Very low	28.6	Very low	91 Å²	91	133.8 Å²	133.8	64%	0.636	75%	0.746	S	S	*	*			cis	-159	-142.6	-8.2	37.9	0	0	0	0	108.6
178	K	30.9	Very low	28.7	Very low	188 Å²	188	135.1 Å²	135.1	82%	0.817	75%	0.745	S	S	*	*			cis	-172.7	124.8	10.5	-147.5	169.7	-165.1	171.1	0	111.9
179	K	31.7	Very low	28.7	Very low	205 Å²	205	136.4 Å²	136.4	89%	0.891	74%	0.744	S	S	*	*			trans	-175.1	107.1	152.6	-105.1	170.7	-174.8	-176.2	0	108.9
180	A	27.8	Very low	28.7	Very low	88 Å²	88	137.6 Å²	137.6	73%	0.727	74%	0.742	S	S	*	*				81.2	135.5	51.4	0	0	0	0	0	112.1
181	I	32.9	Very low	28.8	Very low	149 Å²	149	137.6 Å²	137.6	76%	0.764	74%	0.738	S	S	*	*			cis	-145.9	143.4	43.4	-72.6	163.6	0	0	0	113.2
182	N	27.9	Very low	28.9	Very low	132 Å²	132	140 Å²	140	71%	0.706	74%	0.744	S	S	*	*			trans	17.4	150.9	147.3	-53.6	8	0	0	0	121.3
183	N	27.2	Very low	28.8	Very low	141 Å²	141	137.5 Å²	137.5	75%	0.754	74%	0.742	S	S	*	*			cis	-165	155.6	-1.4	-96.3	-2.1	0	0	0	106
184	S	27.9	Very low	28.7	Very low	98 Å²	98	139 Å²	139	69%	0.685	75%	0.745	S	S	*	*			cis	180	167.5	46.8	45.9	0	0	0	0	112.7
185	F	29.2	Very low	28.5	Very low	200 Å²	200	140.9 Å²	140.9	88%	0.877	75%	0.747	S	S	*	*			trans	75	137.5	158.6	-76.6	-70.5	0	0	0	124.1
186	S	30.4	Very low	28	Very low	108 Å²	108	141 Å²	141	76%	0.755	74%	0.736	S	S	*	*			trans	95.4	96	157.8	-152.6	0	0	0	0	120.6
187	F	29.3	Very low	27.7	Very low	177 Å²	177	143 Å²	143	78%	0.776	74%	0.739	S	S	*	*			trans	-3.2	139.8	156.2	-65.1	-95.5	0	0	0	120.5
188	D	29.5	Very low	27.5	Very low	130 Å²	130	145.9 Å²	145.9	70%	0.695	75%	0.753	S	S	*	*			cis	81.4	144.8	42.6	-73.9	-51.8	0	0	0	114.6
189	N	26.3	Very low	27.2	Very low	128 Å²	128	144.9 Å²	144.9	68%	0.684	76%	0.756	S	S	*	*			cis	-171	164.6	-28.1	-135.6	-33.7	0	0	0	112
190	L	26.5	Very low	26.8	Very low	128 Å²	128	138.8 Å²	138.8	67%	0.67	74%	0.744	S	S	*	*			trans	61.1	149.2	145.6	-79	166.4	0	0	0	126.2
191	Y	28.5	Very low	26.8	Very low	196 Å²	196	141.5 Å²	141.5	77%	0.769	75%	0.746	S	S	*	*			trans	95.5	167.4	140.7	-88.3	-51.7	0	0	0	123.6
192	D	27.7	Very low	26.6	Very low	133 Å²	133	141.4 Å²	141.4	71%	0.711	75%	0.747	S	S	*	*			trans	-116.4	154.6	-141	-79.1	-58	0	0	0	115.7
193	Q	24.5	Very low	26.4	Very low	174 Å²	174	143.3 Å²	143.3	81%	0.813	75%	0.749	S	S	*	*			trans	31.3	127.1	135.5	-141.3	-176.6	35.9	0	0	121.3
194	I	24	Very low	26.4	Very low	142 Å²	142	143.5 Å²	143.5	73%	0.728	75%	0.749	S	S	*	*			trans	137	125.1	137.9	-71	174.4	0	0	0	115.6
195	N	23.5	Very low	26.3	Very low	139 Å²	139	145.4 Å²	145.4	74%	0.743	75%	0.751	S	S	*	*			trans	48.2	123.1	156.1	-76.8	-7.3	0	0	0	125.1
196	M	22.4	Very low	26	Very low	118 Å²	118	142.5 Å²	142.5	58%	0.581	74%	0.744	S	S	*	*				53.8	139.4	118	-53.9	-62.3	-52	0	0	122.5
197	N	22.3	Very low	25.9	Very low	137 Å²	137	143.1 Å²	143.1	73%	0.733	74%	0.739	S	S	*	*			trans	70.6	89.8	152.4	-64.9	9.1	0	0	0	119.2
198	T	28.2	Very low	25.6	Very low	153 Å²	153	141.2 Å²	141.2	94%	0.939	74%	0.736	S	S	*	*				-137.2	146.3	121.6	6.9	0	0	0	0	109.7
199	L	24.5	Very low	25.5	Very low	166 Å²	166	142.8 Å²	142.8	87%	0.869	74%	0.736	S	S	*	*			trans	-132	154.3	-176.6	-130.6	176.6	0	0	0	108
200	A	22.7	Very low	25.6	Very low	77 Å²	77	142.3 Å²	142.3	64%	0.636	74%	0.738	S	S	*	*			trans	69.2	167.1	168.7	0	0	0	0	0	118.1
201	D	26.7	Very low	25.4	Very low	146 Å²	146	143 Å²	143	78%	0.781	74%	0.741	S	S	*	*			trans	63.8	126.3	175	-47.7	-19.9	0	0	0	116.1
202	D	29.8	Very low	25.4	Very low	146 Å²	146	139.7 Å²	139.7	78%	0.781	74%	0.744	S	S	*	*			cis	-149.4	175.8	14.8	-137.2	-30.1	0	0	0	114.8
203	F	24.5	Very low	25.2	Very low	172 Å²	172	140.1 Å²	140.1	75%	0.754	75%	0.745	S	S	*	*			trans	-81.5	162.4	-166.4	-82.2	-106.5	0	0	0	117.7
204	I	25.5	Very low	25.3	Very low	146 Å²	146	138.4 Å²	138.4	75%	0.749	75%	0.746	S	S	*	*			trans	72.3	149.2	144.5	-76.5	163.5	0	0	0	116.2
205	D	27	Very low	25.5	Very low	137 Å²	137	137.4 Å²	137.4	73%	0.733	75%	0.752	S	S	*	*			cis	-143.1	-177.5	20.8	-145.9	-23.2	0	0	0	114.2
206	L	23.1	Very low	25.6	Very low	139 Å²	139	135.6 Å²	135.6	73%	0.728	75%	0.75	S	S	*	*			trans	-84.1	157.2	170.8	-67	79	0	0	0	113.2
207	D	27.4	Very low	25.8	Very low	122 Å²	122	141 Å²	141	65%	0.652	76%	0.764	S	S	*	*				-157.6	155.4	125.4	-158.3	9.1	0	0	0	112.5	K209	D207-K209 IonicContact OD2-NZ 2.59Å; D207-K209 PolarHBondContact OD2-NZ 3.11Å
208	I	22.5	Very low	25.9	Very low	136 Å²	136	139.2 Å²	139.2	70%	0.697	76%	0.762	S	S	*	*			trans	-125.2	124.3	174.9	-65.3	174.5	0	0	0	109.1
209	K	27.7	Very low	25.8	Very low	163 Å²	163	136.6 Å²	136.6	71%	0.709	75%	0.75	S	S	*	*			trans	-134.6	104.9	174.3	-85.3	-171.6	176.3	81.9	0	116.5	D207	D207-K209 IonicContact OD2-NZ 2.59Å; D207-K209 PolarHBondContact OD2-NZ 3.11Å
210	T	27.7	Very low	25.9	Very low	119 Å²	119	135 Å²	135	73%	0.73	75%	0.748	S	S	*	*				53.5	96.2	129.8	56.8	0	0	0	0	120.7
211	I	22.7	Very low	26.1	Very low	141 Å²	141	136.1 Å²	136.1	72%	0.723	75%	0.751	S	S	*	*				-10.8	139.6	130	-53.9	158.9	0	0	0	116.5	I213	I211-I213 HydrophobicContact CG2-CD1 4.33Å; I211-I213 HydrophobicContact CG2-CG1 3.53Å
212	P	28.6	Very low	26.1	Very low	128 Å²	128	133.5 Å²	133.5	83%	0.831	74%	0.744	S	S	*	*			trans	-104	144.2	143.6	35.2	-28.9	0	0	0	112.5
213	I	24.2	Very low	25.9	Very low	142 Å²	142	137.2 Å²	137.2	73%	0.728	75%	0.748	S	S	*	*			trans	-116.1	158	-179.4	-47.8	178.9	0	0	0	109.7	I211	I211-I213 HydrophobicContact CG2-CD1 4.33Å; I211-I213 HydrophobicContact CG2-CG1 3.53Å
214	T	26.1	Very low	26.1	Very low	137 Å²	137	138 Å²	138	84%	0.84	75%	0.748	S	S	*	*			trans	78.6	152.8	176.2	79.7	0	0	0	0	114.2
215	S	28.9	Very low	26.7	Very low	121 Å²	121	136.5 Å²	136.5	85%	0.846	75%	0.747	S	S	*	*			cis	-134.5	-168	17.6	65.5	0	0	0	0	114.5
216	S	25.9	Very low	26.6	Very low	102 Å²	102	135.7 Å²	135.7	71%	0.713	74%	0.743	S	S	*	*			trans	-117.2	173.9	-157.7	61.2	0	0	0	0	115.1
217	R	25.2	Very low	26.9	Very low	231 Å²	231	139.1 Å²	139.1	87%	0.872	75%	0.753	S	S	*	*			trans	76.1	116	163.8	-91.4	178.5	172.5	170	-3	116.6
218	S	25.8	Very low	26.9	Very low	100 Å²	100	140 Å²	140	70%	0.699	76%	0.757	S	S	*	*				91.8	142.6	76	72.7	0	0	0	0	112.8
219	S	25.1	Very low	27.2	Very low	97 Å²	97	143.6 Å²	143.6	68%	0.678	76%	0.763	S	S	*	*			cis	179.9	179.7	-0.9	41.1	0	0	0	0	111.3
220	T	26.2	Very low	27.4	Very low	133 Å²	133	141.2 Å²	141.2	82%	0.816	76%	0.762	S	S	*	*			trans	104.8	152.6	154.9	74.4	0	0	0	0	121.2
221	S	27.8	Very low	27.3	Very low	100 Å²	100	138.6 Å²	138.6	70%	0.699	76%	0.759	S	S	*	*			trans	68.9	112.4	167.4	173.1	0	0	0	0	117.6
222	S	26.1	Very low	27.7	Very low	92 Å²	92	141.5 Å²	141.5	64%	0.643	77%	0.766	S	S	*	*				77.5	127.7	61.2	76.3	0	0	0	0	113.7
223	Y	26.6	Very low	27.9	Very low	223 Å²	223	140.6 Å²	140.6	88%	0.875	76%	0.761	S	S	*	*				-153.4	167.7	61.9	-115.2	-100	0	0	0	115.5
224	Y	26.9	Very low	28.2	Very low	190 Å²	190	143 Å²	143	75%	0.745	77%	0.769	S	S	*	*			trans	-99.4	160.7	166.5	-118.7	-102.1	0	0	0	110.3	D226	Y224-D226 VanDerWaalsContact CD1-OD1 3.32Å; Y224-D226 WeakPolarHBondContact CD1-OD1 3.17Å
225	P	38.3	Very low	28.1	Very low	113 Å²	113	141.8 Å²	141.8	73%	0.734	77%	0.766	S	S	*	*				-151.6	-173.4	92.4	39.8	-21.8	0	0	0	115.2
226	D	25.8	Very low	28.5	Very low	120 Å²	120	141.2 Å²	141.2	64%	0.642	76%	0.759	S	S	*	*				-173.7	144.6	-50.9	-81.5	-37.2	0	0	0	108	Y224	Y224-D226 VanDerWaalsContact CD1-OD1 3.32Å; Y224-D226 WeakPolarHBondContact CD1-OD1 3.17Å
227	F	30.3	Very low	28.9	Very low	212 Å²	212	143.1 Å²	143.1	93%	0.93	76%	0.76	S	S	*	*			trans	-168	141.3	159.6	-111.5	-66.4	0	0	0	112.6
228	D	26	Very low	29.1	Very low	139 Å²	139	140.2 Å²	140.2	74%	0.743	76%	0.756	S	S	*	*			trans	-86	155.2	-173.2	-54	-86.7	0	0	0	115.6
229	Y	30.2	Very low	29.4	Very low	213 Å²	213	141 Å²	141	84%	0.835	76%	0.762	S	S	*	*				-176	140.6	106.1	-116.2	-108.5	0	0	0	114.5
230	V	30.9	Very low	29.6	Very low	112 Å²	112	142.8 Å²	142.8	68%	0.679	76%	0.763	S	S	*	*			trans	8.4	137.5	146.1	-174.1	0	0	0	0	118.7
231	G	26.7	Very low	29.8	Very low	64 Å²	64	145.8 Å²	145.8	66%	0.66	77%	0.768	S	S	*	*			cis	113.4	87.3	1.4	0	0	0	0	0	115.2
232	F	29.2	Very low	29.8	Very low	202 Å²	202	147.5 Å²	147.5	89%	0.886	77%	0.769	S	S	*	*			trans	-154.4	133.9	164.4	-107.9	-73.2	0	0	0	112.1
233	P	33.1	Very low	30.1	Very low	109 Å²	109	149.1 Å²	149.1	71%	0.708	78%	0.78	S	S	*	*			trans	-111.7	-164.5	172.7	39	-27.8	0	0	0	113
234	E	30.3	Very low	30	Very low	194 Å²	194	143.1 Å²	143.1	91%	0.907	78%	0.777	S	S	*	*			trans	100	154.8	167.7	-51.3	-160.5	142.5	0	0	119
235	S	25.5	Very low	30.2	Very low	110 Å²	110	139.9 Å²	139.9	77%	0.769	78%	0.782	S	S	*	*			trans	-123	-166.1	-174.7	66.2	0	0	0	0	107.3
236	P	37.6	Very low	29.7	Very low	110 Å²	110	141.7 Å²	141.7	71%	0.714	79%	0.785	S	S	*	*			cis	-126	-163.1	2	35.2	-12.4	0	0	0	113.3
237	I	32.7	Very low	29.9	Very low	141 Å²	141	145.8 Å²	145.8	72%	0.723	80%	0.798	S	S	*	*				-171.6	149	85.7	-86	167.7	0	0	0	111.1
238	Q	30.3	Very low	29.9	Very low	170 Å²	170	144.3 Å²	144.3	79%	0.794	79%	0.791	S	S	*	*			trans	-4.3	149.6	161.1	-60.5	150.6	-0.4	0	0	119.8
239	S	32.5	Very low	30	Very low	116 Å²	116	145 Å²	145	81%	0.811	79%	0.793	S	S	*	*			cis	-138.7	150.7	24.8	51.1	0	0	0	0	111.4
240	L	28.3	Very low	29.9	Very low	135 Å²	135	144.2 Å²	144.2	71%	0.707	79%	0.794	S	S	*	*			cis	86.9	83	26.7	-155.6	139.9	0	0	0	115.4
241	Q	31	Very low	30	Very low	197 Å²	197	144.2 Å²	144.2	92%	0.921	80%	0.797	S	S	*	*			trans	-139.5	136.2	138.2	-141	176.5	18.7	0	0	109.5
242	N	28.3	Very low	30	Very low	135 Å²	135	148.6 Å²	148.6	72%	0.722	80%	0.804	S	S	*	*			trans	-102.4	142.3	-169.1	-69.4	-49.5	0	0	0	112.3
243	S	31.2	Very low	30	Very low	126 Å²	126	145.3 Å²	145.3	88%	0.881	80%	0.796	S	S	*	*				-173	110.1	126.1	31.5	0	0	0	0	112.3
244	A	24.5	Very low	29.7	Very low	98 Å²	98	147.4 Å²	147.4	81%	0.81	80%	0.801	S	S	*	*			trans	-144.1	129	165.2	0	0	0	0	0	109.2
245	S	31.5	Very low	29.5	Very low	121 Å²	121	146.4 Å²	146.4	85%	0.846	79%	0.793	S	S	*	*			trans	-124.7	74.2	-172.9	48.5	0	0	0	0	113.4
246	N	27.4	Very low	29.6	Very low	151 Å²	151	147.5 Å²	147.5	81%	0.807	79%	0.789	S	S	*	*			trans	42.7	115.3	142.2	-69.7	-48.7	0	0	0	121
247	K	31.5	Very low	28.9	Very low	206 Å²	206	146.5 Å²	146.5	90%	0.896	79%	0.785	S	S	*	*				-160.5	94.1	126.9	-102.9	159.6	-172.1	178.4	0	108.6
248	K	29.4	Very low	28.5	Very low	182 Å²	182	146.6 Å²	146.6	79%	0.791	79%	0.787	S	S	*	*				76.1	115.6	91.6	-99.6	-167.5	172.1	-175.3	0	116
249	L	29	Very low	28.4	Very low	152 Å²	152	146.3 Å²	146.3	80%	0.796	79%	0.791	S	S	*	*			trans	74.5	95.2	145.3	-63.3	163.7	0	0	0	120.6
250	K	26.2	Very low	28.1	Very low	197 Å²	197	144.6 Å²	144.6	86%	0.857	79%	0.792	S	S	*	*				-88.1	161.9	129.2	-97.3	-178.5	179.2	-177	0	107.8
251	P	33.6	Very low	27.9	Very low	112 Å²	112	146 Å²	146	73%	0.727	80%	0.798	S	S	*	*				-150.6	164.5	52	42.1	-22.8	0	0	0	118.7
252	L	27.8	Very low	27.7	Very low	156 Å²	156	144.2 Å²	144.2	82%	0.817	80%	0.795	S	S	*	*				-168.5	160.7	123.8	-106.5	166.6	0	0	0	112.4
253	N	27.6	Very low	27.7	Very low	134 Å²	134	144 Å²	144	72%	0.717	80%	0.798	S	S	*	*			trans	-61.9	168.5	-175.8	-62.3	-23.1	0	0	0	114.6
254	L	26.8	Very low	27.5	Very low	153 Å²	153	146.5 Å²	146.5	80%	0.801	80%	0.796	S	S	*	*			cis	-149.5	173	13.3	-156.9	72.9	0	0	0	112.7
255	F	27.2	Very low	27.6	Very low	172 Å²	172	150.4 Å²	150.4	75%	0.754	80%	0.795	S	S	*	*			trans	-66.1	178.4	170	-81.6	-118.7	0	0	0	114.7
256	I	26.8	Very low	27.5	Very low	134 Å²	134	149 Å²	149	69%	0.687	79%	0.785	S	S	*	*			cis	-176.4	146.4	-42.6	-125.7	168.7	0	0	0	108.7
257	S	24.1	Very low	27.5	Very low	89 Å²	89	147.4 Å²	147.4	62%	0.622	79%	0.785	S	S	*	*			trans	54	135.7	157.3	74.9	0	0	0	0	125
258	N	23.7	Very low	27.3	Very low	143 Å²	143	143.8 Å²	143.8	77%	0.765	78%	0.78	S	S	*	*			trans	87.1	145.9	132.1	-73.1	7.2	0	0	0	124.1
259	N	27.4	Very low	27.2	Very low	164 Å²	164	142.1 Å²	142.1	88%	0.877	79%	0.785	S	S	*	*			trans	78.5	144.3	160.9	-60	-15.2	0	0	0	119.5
260	G	26.3	Very low	27	Very low	80 Å²	80	139.6 Å²	139.6	83%	0.825	78%	0.78	S	S	*	*			trans	119.7	95	160.8	0	0	0	0	0	115.9
261	I	24.7	Very low	27.1	Very low	164 Å²	164	139.4 Å²	139.4	84%	0.841	78%	0.782	S	S	*	*			trans	-86.3	129.5	162.1	-66	168.9	0	0	0	108.5
262	N	26.3	Very low	26.7	Very low	160 Å²	160	139.3 Å²	139.3	86%	0.856	78%	0.784	S	S	*	*			trans	-172.9	141.9	138.1	-102.2	-21.5	0	0	0	112.1
263	V	28	Very low	26.9	Very low	130 Å²	130	136.9 Å²	136.9	79%	0.788	78%	0.778	S	S	*	*			trans	-144.5	118.6	176.3	178.4	0	0	0	0	110.9
264	Q	26.9	Very low	26.8	Very low	179 Å²	179	138.6 Å²	138.6	84%	0.836	78%	0.782	S	S	*	*			trans	-138.6	131.2	157.1	-69.4	-178.1	-24.8	0	0	106.1
265	K	27.6	Very low	26.9	Very low	180 Å²	180	138.5 Å²	138.5	78%	0.783	79%	0.787	S	S	*	*				72.1	141.3	51.7	-73.1	-170.8	175.8	-178.6	0	113.6
266	S	28.6	Very low	26.7	Very low	92 Å²	92	138.8 Å²	138.8	64%	0.643	79%	0.791	S	S	*	*			cis	179.2	138.3	-23.4	47.2	0	0	0	0	111.6
267	S	28.4	Very low	26.7	Very low	116 Å²	116	139 Å²	139	81%	0.811	79%	0.792	S	S	*	*			trans	-166.7	135.2	152.9	45.9	0	0	0	0	108.5
268	V	27.5	Very low	26.8	Very low	131 Å²	131	141.1 Å²	141.1	79%	0.794	80%	0.795	S	S	*	*			cis	99.9	105.5	28.8	174.4	0	0	0	0	113.2
269	V	26.8	Very low	27	Very low	147 Å²	147	146.3 Å²	146.3	89%	0.891	80%	0.804	S	S	*	*			trans	-134.7	145.7	142	176.9	0	0	0	0	106.5
270	S	25.3	Very low	26.9	Very low	98 Å²	98	146.1 Å²	146.1	69%	0.685	80%	0.798	S	S	*	*			trans	-93.5	155.6	-172.4	49.9	0	0	0	0	113.5
271	Q	28.5	Very low	27	Very low	193 Å²	193	149 Å²	149	90%	0.902	80%	0.8	S	S	*	*				-173	145.7	117.3	-100.9	172.4	12.2	0	0	112.5
272	S	24.5	Very low	27.1	Very low	110 Å²	110	146 Å²	146	77%	0.769	79%	0.793	S	S	*	*			trans	-139	143.1	161.4	-173.3	0	0	0	0	105
273	P	31.9	Very low	27.2	Very low	106 Å²	106	145.6 Å²	145.6	69%	0.688	79%	0.79	S	S	*	*				-145.7	161.3	97.5	39.2	-24.1	0	0	0	115.5
274	E	24.8	Very low	27.2	Very low	170 Å²	170	146.3 Å²	146.3	79%	0.794	79%	0.789	S	S	*	*			trans	21.4	116.2	136.6	-54.5	171.6	158.4	0	0	118.9
275	T	29.1	Very low	27.3	Very low	150 Å²	150	142.5 Å²	142.5	92%	0.92	78%	0.78	S	S	*	*				-162.2	150.6	112.5	4.6	0	0	0	0	112.9
276	E	23.1	Very low	27.1	Very low	179 Å²	179	142.4 Å²	142.4	84%	0.836	78%	0.782	S	S	*	*			trans	-87.4	-169.9	171.6	-166.5	171.2	-155	0	0	110.3
277	I	28	Very low	27	Very low	139 Å²	139	146.7 Å²	146.7	71%	0.713	79%	0.79	S	S	*	*			trans	90.6	97.7	163.6	-54	178.6	0	0	0	117.6
278	I	26	Very low	26.8	Very low	132 Å²	132	148.6 Å²	148.6	68%	0.677	79%	0.786	S	S	*	*			trans	58.5	113.3	137.7	-52.9	173.2	0	0	0	119.5	Q280	I278-Q280 HydrophobicContact CG2-CG 4.16Å
279	R	28.3	Very low	26.7	Very low	252 Å²	252	151.5 Å²	151.5	95%	0.951	79%	0.79	S	S	*	*				-127.9	133	121.8	-78.6	-163.4	174.7	-163.7	-1.1	110.9
280	Q	24.3	Very low	26.5	Very low	160 Å²	160	152 Å²	152	75%	0.748	79%	0.785	S	S	*	*			trans	-84.6	178.6	172.8	-68.3	175.2	-33.7	0	0	111.2	I278	I278-Q280 HydrophobicContact CG2-CG 4.16Å
281	T	27.5	Very low	26.5	Very low	141 Å²	141	155 Å²	155	87%	0.865	79%	0.792	S	S	*	*			trans	76.3	132.4	175.3	75	0	0	0	0	114.3
282	S	28.1	Very low	26.2	Very low	100 Å²	100	151 Å²	151	70%	0.699	79%	0.785	S	S	*	*			cis	-151.9	162	7.6	65.5	0	0	0	0	114.4
283	L	28.1	Very low	26.2	Very low	153 Å²	153	151.6 Å²	151.6	80%	0.801	79%	0.79	S	S	*	*			trans	61	95.9	150.6	-69.9	160.6	0	0	0	119.6
284	N	27.3	Very low	25.8	Very low	144 Å²	144	151.7 Å²	151.7	77%	0.77	79%	0.788	S	S	*	*				-121.4	138.6	125.9	-172.7	-7.1	0	0	0	106.4	H286	N284-H286 PolarHBondContact OD1-N 3.37Å
285	P	29.5	Very low	25.9	Very low	99 Å²	99	151.4 Å²	151.4	64%	0.643	79%	0.792	S	S	*	*				-144.5	119.7	124.3	34.2	-18.2	0	0	0	114.4
286	H	24.4	Very low	25.6	Very low	178 Å²	178	151 Å²	151	82%	0.824	78%	0.78	S	S	*	*			trans	-134.3	101.9	131	-109.2	-72.6	0	0	0	109.7	N284	N284-H286 PolarHBondContact OD1-N 3.37Å
287	F	24.8	Very low	25.6	Very low	183 Å²	183	147.8 Å²	147.8	80%	0.803	77%	0.767	S	S	*	*			trans	-158	123.5	170.5	-125.3	-83.2	0	0	0	108.3
288	H	25.3	Very low	25.5	Very low	156 Å²	156	147.4 Å²	147.4	72%	0.722	77%	0.774	S	S	*	*				167.3	97.5	129.3	-100.1	-78.7	0	0	0	113
289	Q	25.9	Very low	25.4	Very low	192 Å²	192	146 Å²	146	90%	0.897	77%	0.772	S	S	*	*				-162.2	105.2	128	-104.9	172.8	-4.3	0	0	104.3
290	M	21.8	Very low	25.2	Very low	156 Å²	156	140.7 Å²	140.7	77%	0.768	77%	0.767	S	S	*	*			cis	66.6	72	48.8	-162.8	-179.8	176.4	0	0	112.7
291	L	24.7	Very low	25.2	Very low	162 Å²	162	141.8 Å²	141.8	85%	0.848	77%	0.77	S	S	*	*			trans	-164.2	142.6	143.3	-107.1	164.1	0	0	0	111.3
292	S	23.2	Very low	24.9	Very low	108 Å²	108	142.3 Å²	142.3	76%	0.755	77%	0.765	S	S	*	*			trans	39.8	98.7	159.6	58.8	0	0	0	0	120.2
293	S	25.1	Very low	24.7	Very low	123 Å²	123	145.2 Å²	145.2	86%	0.86	77%	0.771	S	S	*	*			trans	-144	61.2	147.8	71.1	0	0	0	0	111.3
294	V	23.2	Very low	24.5	Very low	109 Å²	109	142.4 Å²	142.4	66%	0.661	76%	0.76	S	S	*	*			trans	-124.6	105.6	171	178.1	0	0	0	0	108.2	E296	V294-E296 HydrophobicContact CG1-CB 4.39Å; V294-E296 HydrophobicContact CG1-CG 3.95Å
295	N	25.5	Very low	24.4	Very low	164 Å²	164	138.8 Å²	138.8	88%	0.877	76%	0.757	S	S	*	*			trans	-136.9	111.9	158.7	-71.8	-20.7	0	0	0	102.2
296	E	23	Very low	24.2	Very low	142 Å²	142	143.8 Å²	143.8	66%	0.664	77%	0.765	S	S	*	*			cis	58.8	107.5	30.1	-76.5	-161	168.2	0	0	115	V294	V294-E296 HydrophobicContact CG1-CB 4.39Å; V294-E296 HydrophobicContact CG1-CG 3.95Å
297	I	23.9	Very low	24.2	Very low	110 Å²	110	142.4 Å²	142.4	56%	0.564	76%	0.763	S	S	*	*				65.3	104.2	129.8	-57.6	165.9	0	0	0	117.8	T299	I297-T299 HydrophobicContact CG2-CG2 3.48Å; I297-T299 VanDerWaalsContact CG2-CG2 3.48Å; I297-T299 VanDerWaalsContact CG2-N 3.33Å; I297-T299 WeakPolarHBondContact CG2-OG1 3.48Å; I297-T299 PolarHBondContact O-N 3.13Å
298	P	26	Very low	24.4	Very low	131 Å²	131	141.8 Å²	141.8	85%	0.851	77%	0.769	S	S	*	*			trans	-87	77.5	150.9	35	-30.4	0	0	0	110.4	T300	P298-T300 PolarHBondContact O-N 3.09Å
299	T	23.5	Very low	24.5	Very low	104 Å²	104	138 Å²	138	64%	0.638	77%	0.772	S	S	*	*			trans	-80.8	110.6	162.9	38.5	0	0	0	0	108.8	I297 K301	I297-T299 HydrophobicContact CG2-CG2 3.48Å; I297-T299 VanDerWaalsContact CG2-CG2 3.48Å; I297-T299 VanDerWaalsContact CG2-N 3.33Å; I297-T299 WeakPolarHBondContact CG2-OG1 3.48Å; I297-T299 PolarHBondContact O-N 3.13Å; T299-K301 VanDerWaalsContact C-N 3.26Å; T299-K301 PolarHBondContact O-N 3.18Å
300	T	24	Very low	24.6	Very low	140 Å²	140	137.3 Å²	137.3	86%	0.859	77%	0.774	S	S	*	*			trans	-67.9	81.8	174.9	-41.6	0	0	0	0	110.5	P298 I302	P298-T300 PolarHBondContact O-N 3.09Å; T300-I302 PolarHBondContact O-N 3.19Å
301	K	24.4	Very low	25	Very low	182 Å²	182	133.1 Å²	133.1	79%	0.791	77%	0.771	S	S	*	*			trans	-70.4	128.8	172.1	-92.1	-175.9	174.7	176	0	109.8	T299 I303	T299-K301 VanDerWaalsContact C-N 3.26Å; T299-K301 PolarHBondContact O-N 3.18Å; K301-I303 PolarHBondContact O-N 3.37Å
302	I	21.9	Very low	25.1	Very low	152 Å²	152	132.6 Å²	132.6	78%	0.779	77%	0.769	S	S	*	*			trans	-56.3	119.3	176.3	-56.5	163.2	0	0	0	109.2	T300 V304	T300-I302 PolarHBondContact O-N 3.19Å; I302-V304 HydrophobicContact CG2-CG2 3.76Å; I302-V304 PolarHBondContact O-N 3.35Å
303	I	24.2	Very low	25.6	Very low	161 Å²	161	133.7 Å²	133.7	83%	0.826	77%	0.766	S	S	*	*			trans	-84.3	97.6	165.1	-61.9	179.1	0	0	0	107.2	K301 G305	K301-I303 PolarHBondContact O-N 3.37Å; I303-G305 PolarHBondContact O-N 3.5Å
304	V	24	Very low	25.8	Very low	94 Å²	94	134.1 Å²	134.1	57%	0.57	76%	0.759	S	S	*	*			trans	-78.5	101.5	165.5	-175.6	0	0	0	0	107.5	I302 Y306	I302-V304 HydrophobicContact CG2-CG2 3.76Å; I302-V304 PolarHBondContact O-N 3.35Å; V304-Y306 HydrophobicContact CB-CD2 4.41Å; V304-Y306 HydrophobicContact CB-CE2 4.46Å; V304-Y306 HydrophobicContact CG1-CD2 3.67Å; V304-Y306 HydrophobicContact CG1-CE2 3.54Å; V304-Y306 PolarHBondContact O-N 3Å
305	G	23.8	Very low	26	Very low	68 Å²	68	135.3 Å²	135.3	70%	0.701	76%	0.762	S	S	*	*			trans	-70.3	87.8	175.2	0	0	0	0	0	111.9	I303 N307	I303-G305 PolarHBondContact O-N 3.5Å; G305-N307 PolarHBondContact O-N 2.72Å
306	Y	26.7	Very low	26.3	Very low	205 Å²	205	134.4 Å²	134.4	80%	0.804	76%	0.757	S	S	*	*			trans	-80	108.8	166.4	-87.3	-78.3	0	0	0	110.1	V304	V304-Y306 HydrophobicContact CB-CD2 4.41Å; V304-Y306 HydrophobicContact CB-CE2 4.46Å; V304-Y306 HydrophobicContact CG1-CD2 3.67Å; V304-Y306 HydrophobicContact CG1-CE2 3.54Å; V304-Y306 PolarHBondContact O-N 3Å
307	N	23.8	Very low	26.6	Very low	148 Å²	148	131.9 Å²	131.9	79%	0.791	76%	0.755	S	S	*	*			trans	-71.1	125.7	161.8	-74.4	-22.3	0	0	0	109.5	G305	G305-N307 PolarHBondContact O-N 2.72Å
308	N	27.9	Very low	26.7	Very low	171 Å²	171	136.1 Å²	136.1	91%	0.914	77%	0.77	S	S	*	*			trans	174.9	136.9	150.2	-90.2	-22.3	0	0	0	109.3
309	G	28.7	Very low	27.4	Very low	76 Å²	76	134.4 Å²	134.4	78%	0.784	76%	0.758	S	S	*	*			trans	138.3	102.8	169.7	0	0	0	0	0	115
310	D	27.4	Very low	27.6	Very low	177 Å²	177	134.6 Å²	134.6	95%	0.947	76%	0.756	S	S	*	*			trans	-75.6	167.7	177.9	-51.8	-89.5	0	0	0	114.7
311	G	30.3	Very low	27.9	Very low	69 Å²	69	137.1 Å²	137.1	71%	0.711	75%	0.751	S	S	*	*			trans	119.8	89.6	173	0	0	0	0	0	112.5
312	N	27	Very low	28.1	Very low	151 Å²	151	133.2 Å²	133.2	81%	0.807	74%	0.742	S	S	*	*			cis	75.3	128.6	40.6	-142.7	29	0	0	0	114
313	N	33.3	Very low	28.4	Very low	130 Å²	130	134.3 Å²	134.3	70%	0.695	74%	0.744	S	S	*	*			trans	79.3	93.7	173	-54.1	-11.7	0	0	0	119.8
314	N	28.1	Very low	28.6	Very low	132 Å²	132	135.9 Å²	135.9	71%	0.706	74%	0.741	S	S	*	*				44	136.5	108.6	-82.3	58.7	0	0	0	123.7
315	D	29.1	Very low	28.6	Very low	135 Å²	135	143.1 Å²	143.1	72%	0.722	76%	0.758	S	S	*	*			trans	64.1	142.2	143.2	-45.5	-28.2	0	0	0	118.4
316	D	30.5	Very low	28.7	Very low	145 Å²	145	145.1 Å²	145.1	78%	0.775	76%	0.76	S	S	*	*			cis	-159.4	170.8	23.1	-147.4	-24.1	0	0	0	113.5
317	S	29.7	Very low	28.7	Very low	88 Å²	88	141.7 Å²	141.7	62%	0.615	76%	0.756	S	S	*	*			trans	14.3	137.5	166.1	64.3	0	0	0	0	122.9
318	F	25.8	Very low	28.8	Very low	199 Å²	199	142 Å²	142	87%	0.873	75%	0.752	S	S	*	*			cis	63.4	158.4	45.8	-78	-76.3	0	0	0	115.9
319	P	40.8	Very low	28.9	Very low	95 Å²	95	140.4 Å²	140.4	62%	0.617	74%	0.744	S	S	*	*			cis	-137.2	-161	0.8	33.5	-9.6	0	0	0	116.3
320	N	28.4	Very low	28.8	Very low	108 Å²	108	140.5 Å²	140.5	58%	0.578	75%	0.745	S	S	*	*			trans	101.1	146.8	156.5	-60	-30	0	0	0	116.5
321	Y	29.9	Very low	28.9	Very low	194 Å²	194	142.1 Å²	142.1	76%	0.761	74%	0.739	S	S	*	*			cis	-161.3	155.1	-6.6	-108	-28.2	0	0	0	108.7
322	T	28.9	Very low	28.9	Very low	100 Å²	100	144.7 Å²	144.7	61%	0.613	74%	0.737	S	S	*	*			cis	-126.1	-114.8	-9.9	-40.6	0	0	0	0	109.6
323	E	28.1	Very low	29.2	Very low	175 Å²	175	145.5 Å²	145.5	82%	0.818	73%	0.733	S	S	*	*			cis	-143.3	171	-8.1	-157.4	161.1	-98.1	0	0	112.5
324	Y	27.3	Very low	29	Very low	194 Å²	194	145.2 Å²	145.2	76%	0.761	73%	0.731	S	S	*	*			trans	-72.1	132.7	-161.1	-73.2	-102.2	0	0	0	117.4
325	R	25.2	Very low	29.2	Very low	246 Å²	246	145.8 Å²	145.8	93%	0.928	73%	0.73	S	S	*	*				-159.6	145.4	101.2	-111.3	-178.1	-178.7	-170.8	1.1	112.2
326	C	25	Very low	29.2	Very low	109 Å²	109	145.5 Å²	145.5	74%	0.736	73%	0.728	S	S	*	*			trans	-138.8	155.7	-175.6	-70.2	0	0	0	0	113
327	N	26.6	Very low	29.2	Very low	134 Å²	134	143.2 Å²	143.2	72%	0.717	72%	0.724	S	S	*	*			trans	69.7	112.9	146.2	-76.7	-4.5	0	0	0	122.4
328	Q	26.8	Very low	29.1	Very low	153 Å²	153	146.2 Å²	146.2	72%	0.715	73%	0.731	S	S	*	*				106	142.7	107.9	-83.6	179.9	2.6	0	0	122.3
329	N	28.9	Very low	29	Very low	139 Å²	139	141.4 Å²	141.4	74%	0.743	72%	0.722	S	S	*	*			trans	86.2	105.4	152.3	-61.8	-23.5	0	0	0	120.3
330	G	28.5	Very low	28.2	Very low	78 Å²	78	147.1 Å²	147.1	80%	0.804	74%	0.738	S	S	*	*			trans	-159.2	112.8	159	0	0	0	0	0	109.7
331	Y	29.6	Very low	28	Very low	210 Å²	210	150.8 Å²	150.8	82%	0.824	75%	0.751	S	S	*	*			trans	-72.2	163.4	177.3	-80.1	-112.4	0	0	0	110.4
332	N	30.5	Very low	27.6	Very low	124 Å²	124	146.9 Å²	146.9	66%	0.663	75%	0.751	S	S	*	*			cis	-168.4	145.6	42	-131.6	-22.7	0	0	0	113.9
333	K	31.8	Very low	27.4	Very low	167 Å²	167	150.8 Å²	150.8	73%	0.726	76%	0.762	S	S	*	*			trans	61.2	126.8	146.2	-75.6	174.1	-179.9	-171.7	0	124.6
334	N	29.3	Very low	27.2	Very low	124 Å²	124	147.2 Å²	147.2	66%	0.663	76%	0.756	S	S	*	*			trans	68	142.1	138.8	-63.6	37.4	0	0	0	118.7
335	E	31.8	Very low	27.2	Very low	145 Å²	145	143 Å²	143	68%	0.678	76%	0.755	S	S	*	*			cis	-155.7	165.6	9.2	-131.3	161.8	-108.9	0	0	113.6
336	N	30.3	Very low	27.2	Very low	129 Å²	129	139.6 Å²	139.6	69%	0.69	75%	0.75	S	S	*	*			trans	66.5	65.1	157.1	-56.3	-28.7	0	0	0	121.9
337	S	30.5	Very low	27.3	Very low	96 Å²	96	140.8 Å²	140.8	67%	0.671	75%	0.748	S	S	*	*				24.6	132.2	123.1	62.3	0	0	0	0	124
338	I	28.2	Very low	27.3	Very low	152 Å²	152	140.6 Å²	140.6	78%	0.779	75%	0.746	S	S	*	*				60.6	96.5	126	-58.4	172.2	0	0	0	116.3
339	S	23	Very low	27.4	Very low	98 Å²	98	139.4 Å²	139.4	69%	0.685	75%	0.745	S	S	*	*				79.9	139.9	68.8	83	0	0	0	0	116.3
340	F	24.7	Very low	27.5	Very low	215 Å²	215	139.8 Å²	139.8	94%	0.943	74%	0.742	S	S	*	*			trans	-147.7	146.4	157.3	-99.2	-74.2	0	0	0	111.6
341	H	23.6	Very low	27.6	Very low	184 Å²	184	143.4 Å²	143.4	85%	0.852	74%	0.742	S	S	*	*			trans	-129.8	152.7	172	-143	-70.5	0	0	0	108.1
342	C	21.2	Very low	27.7	Very low	113 Å²	113	138.6 Å²	138.6	76%	0.764	74%	0.739	S	S	*	*			trans	-70.2	142.4	-170.4	-47.3	0	0	0	0	114.4
343	Q	25.5	Very low	27.8	Very low	182 Å²	182	137.1 Å²	137.1	85%	0.85	74%	0.738	S	S	*	*				-173.8	120.7	119.1	-104.1	171.6	-6.2	0	0	115.3
344	S	23.3	Very low	27.9	Very low	99 Å²	99	135.6 Å²	135.6	69%	0.692	74%	0.738	S	S	*	*			trans	36.8	146	140.3	50.5	0	0	0	0	125.3
345	S	27	Very low	28.1	Very low	105 Å²	105	136.2 Å²	136.2	73%	0.734	74%	0.741	S	S	*	*			trans	72.3	113.1	157.6	32.8	0	0	0	0	118.4
346	E	24.5	Very low	28	Very low	175 Å²	175	138.1 Å²	138.1	82%	0.818	75%	0.75	S	S	*	*				91.2	132.1	74.6	-117.1	172	-137.7	0	0	111
347	L	26.7	Very low	28.2	Very low	135 Å²	135	136.8 Å²	136.8	71%	0.707	75%	0.751	S	S	*	*			cis	-163	153.7	46.6	-98	165.1	0	0	0	114
348	I	27.5	Very low	28.3	Very low	130 Å²	130	137.3 Å²	137.3	67%	0.667	76%	0.755	S	S	*	*			trans	29.9	139	155.5	-18.6	171.7	0	0	0	124.3
349	D	28.8	Very low	28.5	Very low	128 Å²	128	139 Å²	139	68%	0.684	76%	0.759	S	S	*	*				148.2	134.7	127.4	-80.1	0.5	0	0	0	111.9
350	H	30.9	Very low	29	Very low	147 Å²	147	141 Å²	141	68%	0.681	76%	0.763	S	S	*	*			cis	-153.6	158.1	-22.4	-85.3	-38.1	0	0	0	105.7
351	L	31.3	Very low	29.3	Very low	153 Å²	153	137.9 Å²	137.9	80%	0.801	76%	0.755	S	S	*	*				179.4	143.1	76.2	-87.7	169.3	0	0	0	110.8
352	S	30.7	Very low	30	Very low	110 Å²	110	135.1 Å²	135.1	77%	0.769	75%	0.753	S	S	*	*			trans	52.9	142	147.8	-56.2	0	0	0	0	120.8
353	S	34	Very low	30.4	Very low	92 Å²	92	132.5 Å²	132.5	64%	0.643	75%	0.746	S	S	*	*			cis	-153.2	136	18.4	52.6	0	0	0	0	113.5
354	D	33.3	Very low	30.6	Very low	136 Å²	136	134.5 Å²	134.5	73%	0.727	75%	0.747	S	S	*	*				64	132	129.5	-48.1	-4.7	0	0	0	119.5
355	N	33.4	Very low	30.8	Very low	136 Å²	136	136.5 Å²	136.5	73%	0.727	75%	0.749	S	S	*	*			cis	-143.5	152.1	11.8	-78.6	-58.1	0	0	0	114.1
356	E	30.6	Very low	30.8	Very low	185 Å²	185	139.6 Å²	139.6	86%	0.864	75%	0.75	S	S	*	*			trans	11.9	145.2	133.5	-48.3	-179.8	146.8	0	0	119.5
357	S	34.2	Very low	31	Very low	102 Å²	102	138.2 Å²	138.2	71%	0.713	75%	0.747	S	S	*	*			cis	-150.8	142	25.6	35.4	0	0	0	0	109.4
358	S	32	Very low	31	Very low	107 Å²	107	136.3 Å²	136.3	75%	0.748	75%	0.745	S	S	*	*				63.3	135.1	63.5	81.3	0	0	0	0	113.9
359	E	32.4	Very low	30.9	Very low	187 Å²	187	135 Å²	135	87%	0.874	75%	0.747	S	S	*	*			cis	-124.5	-166.1	3	-60.3	171.1	113.2	0	0	108.9
360	D	34	Very low	30.7	Very low	141 Å²	141	134.2 Å²	134.2	75%	0.754	75%	0.752	S	S	*	*			cis	-153.4	-169.5	6.1	-172.6	15.5	0	0	0	109.3
361	L	30.5	Very low	30.4	Very low	148 Å²	148	132.7 Å²	132.7	78%	0.775	76%	0.758	S	S	*	*			trans	-119.6	-154.8	-173.7	-66.4	99.6	0	0	0	114
362	P	37.9	Very low	30	Very low	126 Å²	126	129.7 Å²	129.7	82%	0.818	76%	0.755	S	S	*	*				-130.8	178.1	-88.4	41.1	-26.1	0	0	0	115.7
363	G	29.4	Very low	29.7	Very low	59 Å²	59	129.3 Å²	129.3	61%	0.608	75%	0.753	S	S	*	*			trans	179.2	123.4	160.4	0	0	0	0	0	117.9
364	Y	30.2	Very low	29.2	Very low	224 Å²	224	130 Å²	130	88%	0.878	76%	0.758	S	S	*	*			trans	59.3	128.9	165.6	-56.1	-89	0	0	0	117.9
365	L	27.4	Very low	28.8	Very low	140 Å²	140	128.8 Å²	128.8	73%	0.733	76%	0.758	S	S	*	*			cis	105.9	138.7	24.9	-78.5	173.6	0	0	0	114.8
366	F	27.9	Very low	28.3	Very low	171 Å²	171	129.1 Å²	129.1	75%	0.75	76%	0.758	S	S	*	*			trans	73.3	88.4	167.4	-74	-77.1	0	0	0	121.7
367	L	28.7	Very low	28.2	Very low	145 Å²	145	128.3 Å²	128.3	76%	0.759	75%	0.754	S	S	*	*				48.1	113	115.8	-69.1	169.5	0	0	0	122.1
368	S	25.7	Very low	28.1	Very low	96 Å²	96	130.6 Å²	130.6	67%	0.671	76%	0.757	S	S	*	*				85.3	132.2	115.8	-61.9	0	0	0	0	124.7
369	S	25.6	Very low	28	Very low	102 Å²	102	130.9 Å²	130.9	71%	0.713	76%	0.756	S	S	*	*			trans	74	106.7	134.3	59.7	0	0	0	0	122.9
370	S	24.5	Very low	27.8	Very low	111 Å²	111	126.6 Å²	126.6	78%	0.776	75%	0.747	S	S	*	*				84.9	132.3	115.9	-57.3	0	0	0	0	122.8
371	S	25.1	Very low	27.7	Very low	115 Å²	115	126.1 Å²	126.1	80%	0.804	75%	0.749	S	S	*	*			trans	84.2	106.5	143	-62	0	0	0	0	122.2
372	A	23.3	Very low	27.5	Very low	90 Å²	90	124.4 Å²	124.4	74%	0.744	75%	0.748	S	S	*	*				79.8	139.1	125.7	0	0	0	0	0	122.9
373	S	23.9	Very low	27.2	Very low	103 Å²	103	124.2 Å²	124.2	72%	0.72	74%	0.74	S	S	*	*			trans	60.2	85.5	150.6	48.9	0	0	0	0	121
374	S	23.4	Very low	27.1	Very low	107 Å²	107	126.8 Å²	126.8	75%	0.748	74%	0.74	S	S	*	*				78.6	146.3	115.6	70.4	0	0	0	0	122.7
375	C	24.4	Very low	27.4	Very low	110 Å²	110	123.6 Å²	123.6	74%	0.743	74%	0.739	S	S	*	*			trans	95.6	100	151.8	-67	0	0	0	0	121.4
376	I	24.2	Very low	27.5	Very low	142 Å²	142	122.2 Å²	122.2	73%	0.728	73%	0.732	S	S	*	*			trans	55.9	97.3	133.7	-36.5	174.6	0	0	0	118.9
377	H	27.2	Very low	27.8	Very low	169 Å²	169	120.6 Å²	120.6	78%	0.782	73%	0.726	S	S	*	*				-173.5	149.5	102.8	-111.1	-74.5	0	0	0	112.7
378	I	33	Very low	27.9	Very low	150 Å²	150	119.5 Å²	119.5	77%	0.769	72%	0.721	S	S	*	*			trans	-135	135.3	164	-61.6	176	0	0	0	107.6
379	P	28.9	Very low	28.2	Very low	112 Å²	112	120.7 Å²	120.7	73%	0.727	72%	0.72	S	S	*	*			trans	-132.9	131.8	130	34.3	-23.3	0	0	0	110.7
380	S	28.7	Very low	28.6	Very low	98 Å²	98	122.1 Å²	122.1	69%	0.685	72%	0.715	S	S	*	*			cis	91.1	98.6	36.1	78.2	0	0	0	0	115.3
381	T	31.1	Very low	28.9	Very low	131 Å²	131	123.1 Å²	123.1	80%	0.804	71%	0.706	S	S	*	*			trans	-160.5	124.2	154.2	25.5	0	0	0	0	106.7
382	C	27	Very low	29.3	Very low	111 Å²	111	122.5 Å²	122.5	75%	0.75	70%	0.701	S	S	*	*				71.4	136.1	80	-64.9	0	0	0	0	112.8
383	N	31.1	Very low	29.6	Very low	122 Å²	122	125.7 Å²	125.7	65%	0.652	70%	0.695	S	S	*	*			cis	-157.1	138	7.7	-122.8	40.5	0	0	0	110.4
384	D	28.8	Very low	30	Very low	114 Å²	114	128.9 Å²	128.9	61%	0.61	70%	0.698	S	S	*	*				84.1	132.5	96.5	-83.9	-1.7	0	0	0	118.5
385	N	35.5	Very low	30.4	Very low	157 Å²	157	128.9 Å²	128.9	84%	0.84	69%	0.694	S	S	*	*			trans	172.8	114.9	141	-86.8	-41.1	0	0	0	107.7
386	N	30.1	Very low	30.5	Very low	110 Å²	110	128 Å²	128	59%	0.588	69%	0.689	S	S	*	*				66.6	136.9	53.2	-68.5	-21.8	0	0	0	114.1
387	H	33.3	Very low	30.8	Very low	138 Å²	138	129.3 Å²	129.3	64%	0.639	69%	0.691	S	S	*	*			cis	-164.2	152	5.4	-115.9	-38.1	0	0	0	112.1
388	N	31.7	Very low	31	Very low	122 Å²	122	128.5 Å²	128.5	65%	0.652	69%	0.689	S	S	*	*			trans	69.3	157.7	135.8	-68.4	14.5	0	0	0	121.7
389	D	32.1	Very low	30.8	Very low	121 Å²	121	127.9 Å²	127.9	65%	0.647	68%	0.684	S	S	*	*			cis	-162.6	179.8	0.6	-133.5	-48.6	0	0	0	116
390	H	32.8	Very low	30.8	Very low	132 Å²	132	128 Å²	128	61%	0.611	68%	0.678	S	S	*	*			trans	92.4	139.8	158.8	-65.8	-4.2	0	0	0	119.2
391	K	32.4	Very low	30.8	Very low	132 Å²	132	129.6 Å²	129.6	57%	0.574	68%	0.679	S	S	*	*			cis	-159.2	147.7	-11.4	-112.1	159.2	179	154.8	0	106.7	Y393	K391-Y393 HydrophobicContact CD-CE2 4.31Å; K391-Y393 WeakPolarHBondContact CE-OH 3.49Å; K391-Y393 HydrophobicContact CG-CE2 4.07Å
392	S	32.9	Very low	30.6	Very low	101 Å²	101	129.1 Å²	129.1	71%	0.706	68%	0.676	S	S	*	*				-177.4	132.5	75.4	174.6	0	0	0	0	113
393	Y	29.2	Very low	30.6	Very low	158 Å²	158	131.9 Å²	131.9	62%	0.62	68%	0.682	S	S	*	*			trans	4	148	152.5	-44.4	-75.4	0	0	0	121.1	K391 V395	K391-Y393 HydrophobicContact CD-CE2 4.31Å; K391-Y393 WeakPolarHBondContact CE-OH 3.49Å; K391-Y393 HydrophobicContact CG-CE2 4.07Å; Y393-V395 HydrophobicContact CD1-CG2 4.48Å
394	H	32.4	Very low	30.3	Very low	169 Å²	169	130.9 Å²	130.9	78%	0.782	69%	0.685	S	S	*	*			cis	-130.5	139.2	27	-91.1	-104	0	0	0	112.2
395	V	31.7	Very low	30.1	Very low	108 Å²	108	133.4 Å²	133.4	66%	0.655	70%	0.697	S	S	*	*				70.2	125	70.3	173.9	0	0	0	0	113.7	Y393	Y393-V395 HydrophobicContact CD1-CG2 4.48Å
396	S	26.2	Very low	29.6	Very low	91 Å²	91	133 Å²	133	64%	0.636	70%	0.695	S	S	*	*			cis	-172.9	137	-20	54.2	0	0	0	0	111.7
397	H	31.7	Very low	29.5	Very low	170 Å²	170	134.6 Å²	134.6	79%	0.787	71%	0.708	S	S	*	*			trans	-175	120.3	141.7	-95.3	-67.7	0	0	0	106
398	M	30.3	Very low	29.3	Very low	151 Å²	151	134.8 Å²	134.8	74%	0.744	71%	0.712	S	S	*	*				56.1	123.4	86.4	-81.3	-179.3	154.4	0	0	113.9
399	E	28.3	Very low	29	Very low	138 Å²	138	136.6 Å²	136.6	65%	0.645	72%	0.717	S	S	*	*			cis	-166.3	166.8	-6.9	-143.5	174.5	-126	0	0	111.4
400	N	29.8	Very low	28.7	Very low	114 Å²	114	139.3 Å²	139.3	61%	0.61	72%	0.723	S	S	*	*			trans	69.9	119	157.8	-58.5	-42.5	0	0	0	121.5
401	N	28.5	Very low	28.4	Very low	131 Å²	131	140 Å²	140	70%	0.701	73%	0.729	S	S	*	*			trans	79.2	82.3	131.8	-59.2	-4.4	0	0	0	121.6
402	T	27	Very low	28.2	Very low	121 Å²	121	139 Å²	139	74%	0.742	74%	0.735	S	S	*	*				46.7	132.9	112.1	59.6	0	0	0	0	122.5
403	L	25.9	Very low	27.9	Very low	169 Å²	169	139.6 Å²	139.6	89%	0.885	73%	0.729	S	S	*	*			trans	91	147.5	137.8	-86.5	165.5	0	0	0	120.4
404	S	24.9	Very low	27.9	Very low	101 Å²	101	140.4 Å²	140.4	71%	0.706	75%	0.745	S	S	*	*			trans	-111.4	148.6	-167	-39.2	0	0	0	0	110.6
405	I	25.1	Very low	27.8	Very low	168 Å²	168	139.4 Å²	139.4	86%	0.862	74%	0.74	S	S	*	*				167.1	147	128.6	-87.8	156.3	0	0	0	109.9
406	N	25.8	Very low	27.8	Very low	149 Å²	149	142.4 Å²	142.4	80%	0.797	75%	0.747	S	S	*	*			trans	-69.6	148.6	177.6	-55.3	-48.1	0	0	0	112.2
407	T	27.6	Very low	28	Very low	143 Å²	143	146.4 Å²	146.4	88%	0.877	76%	0.761	S	S	*	*				-160.1	143.8	123.3	-77.9	0	0	0	0	111.3
408	I	28.5	Very low	27.8	Very low	141 Å²	141	141.8 Å²	141.8	72%	0.723	75%	0.753	S	S	*	*			trans	-76	135.2	-172.3	-62.4	149.9	0	0	0	111.9
409	H	26	Very low	27.6	Very low	161 Å²	161	141.6 Å²	141.6	75%	0.745	76%	0.755	S	S	*	*				179.8	143.8	121.2	-108.5	-68.7	0	0	0	115.8
410	K	26.4	Very low	27.7	Very low	178 Å²	178	142.7 Å²	142.7	77%	0.774	77%	0.765	S	S	*	*			trans	65.7	162.2	154.6	-71.7	-176.3	176.3	178.4	0	118
411	I	26	Very low	27.7	Very low	145 Å²	145	143 Å²	143	74%	0.744	77%	0.774	S	S	*	*			cis	-168.4	154	-44.9	-131.7	167.1	0	0	0	107.3
412	V	27.2	Very low	27.5	Very low	113 Å²	113	145.5 Å²	145.5	69%	0.685	78%	0.782	S	S	*	*			trans	71.1	110.6	165.2	162.2	0	0	0	0	118.9
413	N	26.6	Very low	27.5	Very low	112 Å²	112	148.2 Å²	148.2	60%	0.599	79%	0.786	S	S	*	*			trans	50.8	130.8	134.2	-49.3	5.9	0	0	0	121.9
414	N	30.6	Very low	27.6	Very low	176 Å²	176	148.4 Å²	148.4	94%	0.941	78%	0.782	S	S	*	*				-124.9	154.5	102.5	-103.5	-31.2	0	0	0	109.5
415	Q	30	Very low	27.6	Very low	148 Å²	148	153 Å²	153	69%	0.692	79%	0.792	S	S	*	*			trans	-129.1	177	-168.8	-169.6	169.5	-40.3	0	0	110.1
416	E	31.5	Very low	27.7	Very low	171 Å²	171	153.4 Å²	153.4	80%	0.799	79%	0.79	S	S	*	*			trans	77.3	94.5	168.1	-50.9	-167.4	151.5	0	0	116.9
417	N	29.8	Very low	27.8	Very low	174 Å²	174	156.7 Å²	156.7	93%	0.93	79%	0.793	S	S	*	*				-139.1	155.6	102.3	-129.8	-40.6	0	0	0	110.5
418	A	27.6	Very low	27.8	Very low	74 Å²	74	157.6 Å²	157.6	61%	0.612	79%	0.787	S	S	*	*			trans	-108.1	167.6	-155.8	0	0	0	0	0	115.5
419	N	27.3	Very low	27.8	Very low	146 Å²	146	160 Å²	160	78%	0.781	79%	0.792	S	S	*	*			trans	65.1	91.1	158.2	-56.2	-23.1	0	0	0	118.2
420	N	29.9	Very low	27.9	Very low	162 Å²	162	163.3 Å²	163.3	87%	0.866	80%	0.799	S	S	*	*				-166.4	163.2	115.2	-104	-36.2	0	0	0	113.9
421	C	29	Very low	27.9	Very low	119 Å²	119	162.7 Å²	162.7	80%	0.804	80%	0.797	S	S	*	*			trans	61.3	88.5	168.6	-61.3	0	0	0	0	117.9
422	H	24.6	Very low	27.8	Very low	184 Å²	184	163.1 Å²	163.1	85%	0.852	80%	0.8	S	S	*	*			trans	-60.3	135.6	147.8	-74.9	-11.6	0	0	0	110.8
423	H	27.1	Very low	27.7	Very low	179 Å²	179	169.1 Å²	169.1	83%	0.829	81%	0.811	S	S	*	*			trans	150.8	99.2	141.9	-82.4	-14.8	0	0	0	110.6
424	H	28.3	Very low	27.7	Very low	173 Å²	173	171.9 Å²	171.9	80%	0.801	82%	0.82	S	S	*	*			trans	-175.2	11.2	141.1	-112.9	-66.8	0	0	0	115.9
425	H	25	Very low	27.5	Very low	198 Å²	198	174 Å²	174	92%	0.917	82%	0.816	S	S	*	*	S	Bend	trans	-101.9	26.5	-161.8	-127.8	-60.6	0	0	0	117.9
426	E	27.5	Very low	27.4	Very low	176 Å²	176	176.4 Å²	176.4	82%	0.822	83%	0.828	S	S	*	*	S	Bend	trans	-130.8	-1	179.4	-154.9	151.3	-142.6	0	0	116.3	H428	E426-H428 PolarHBondContact O-N 3.01Å
427	Y	27.2	Very low	27.4	Very low	217 Å²	217	175.4 Å²	175.4	85%	0.851	82%	0.817	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	5.2	-176.8	-103.5	-85.5	0	0	0	116.6
428	H	28.6	Very low	27.4	Very low	163 Å²	163	175.1 Å²	175.1	76%	0.755	81%	0.81	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-2.9	-175	-92.1	-80.3	0	0	0	115.9	E426	E426-H428 PolarHBondContact O-N 3.01Å
429	K	27.9	Very low	27.4	Very low	191 Å²	191	178.3 Å²	178.3	83%	0.83	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-10.6	-168.8	-130.9	173.2	-174.4	175.8	0	116
430	Y	27.5	Very low	27.6	Very low	230 Å²	230	175.9 Å²	175.9	90%	0.902	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	4.6	-179.7	-85.5	-84.8	0	0	0	115
431	K	27.4	Very low	27.4	Very low	165 Å²	165	173.4 Å²	173.4	72%	0.717	79%	0.794	S	S	*	*	S	Bend	trans	-85.6	-9.5	-172.6	-141.5	-179.5	-179.5	-171.7	0	115.8
432	N	24.5	Very low	27.6	Very low	154 Å²	154	173.9 Å²	173.9	82%	0.824	79%	0.788	S	S	*	*	S	Bend	trans	-112	50.7	-170.8	-71	7.3	0	0	0	113.9
433	R	24.4	Very low	27.7	Very low	240 Å²	240	168.9 Å²	168.9	91%	0.906	77%	0.767	S	S	*	*			trans	-136.2	19.6	164.6	-88.9	-160.4	-179	-169	2.3	114.3
434	Q	26.8	Very low	27.8	Very low	169 Å²	169	162.8 Å²	162.8	79%	0.79	74%	0.744	S	S	*	*	S	Bend	trans	-71.9	141.3	156.1	-68.4	-158.3	-54.3	0	0	109
435	Y	26.5	Very low	28	Very low	221 Å²	221	156.3 Å²	156.3	87%	0.867	72%	0.715	S	S	*	*			trans	-60.3	156.7	172.4	-81	-91.1	0	0	0	110.7	R437	Y435-R437 PolarHBondContact O-N 3.28Å
436	Q	28	Very low	28.1	Very low	199 Å²	199	155.5 Å²	155.5	93%	0.93	71%	0.709	S	S	*	*			trans	-73.8	50.1	-175.4	-158	173.2	12.2	0	0	113.2	Q438	Q436-Q438 PolarHBondContact O-N 3.31Å
437	R	30.4	Very low	28.2	Very low	150 Å²	150	151.1 Å²	151.1	57%	0.566	70%	0.698	S	S	*	*			trans	-50.6	133.7	146.2	-77.4	-175	168.8	-161.5	-8.9	106	Y435 D439 C479 L480	Y435-R437 PolarHBondContact O-N 3.28Å; R437-D439 PolarHBondContact O-N 3.17Å; R437-C479 PolarHBondContact NH2-O 3.01Å; R437-L480 PolarHBondContact NH1-O 3.45Å
438	Q	29.8	Very low	28.3	Very low	167 Å²	167	142.9 Å²	142.9	78%	0.78	67%	0.672	S	S	*	*			trans	-56.8	129.3	168.5	-73.4	176.4	-36.1	0	0	107.6	Q436 N440	Q436-Q438 PolarHBondContact O-N 3.31Å; Q438-N440 PolarHBondContact O-N 2.71Å
439	D	27.8	Very low	28.9	Very low	141 Å²	141	140.7 Å²	140.7	75%	0.754	68%	0.675	S	S	*	*			trans	-61.9	93.2	167.6	-92.7	-50.8	0	0	0	107.6	R437 T441	R437-D439 PolarHBondContact O-N 3.17Å; D439-T441 PolarHBondContact O-N 3.08Å; D439-T441 PolarHBondContact O-OG1 3.28Å
440	N	31.5	Very low	30.1	Very low	96 Å²	96	135.7 Å²	135.7	51%	0.513	66%	0.664	S	S	.	*			trans	-70.7	57.5	162.9	-78	-12.7	0	0	0	108.9	Q438 L442	Q438-N440 PolarHBondContact O-N 2.71Å; N440-L442 PolarHBondContact O-N 2.9Å; N440-L442 VanDerWaalsContact O-N 3.14Å
441	T	27	Very low	31.9	Very low	109 Å²	109	126.6 Å²	126.6	67%	0.669	63%	0.63	S	S	*	*	S	Bend	trans	-46.7	116.9	138.8	49.1	0	0	0	0	105.1	D439 I443	D439-T441 PolarHBondContact O-N 3.08Å; D439-T441 PolarHBondContact O-OG1 3.28Å; T441-I443 PolarHBondContact O-N 3.37Å
442	L	32.2	Very low	33.6	Very low	129 Å²	129	121 Å²	121	68%	0.675	61%	0.611	S	S	*	*			trans	-45.4	103.8	-163.3	-85.7	73.3	0	0	0	110.2	N440 S444	N440-L442 PolarHBondContact O-N 2.9Å; N440-L442 VanDerWaalsContact O-N 3.14Å; L442-S444 VanDerWaalsContact C-N 3.31Å; L442-S444 PolarHBondContact O-N 3.44Å
443	I	27.1	Very low	35.8	Very low	79 Å²	79	116.6 Å²	116.6	41%	0.405	59%	0.587	S	S	.	*			trans	-66.9	101.4	-178.9	-62.7	179.6	0	0	0	104.6	T441 L445	T441-I443 PolarHBondContact O-N 3.37Å; I443-L445 PolarHBondContact O-N 3.05Å
444	S	29	Very low	38.1	Very low	51 Å²	51	109 Å²	109	36%	0.357	57%	0.569	S	S	.	*			trans	-57.7	118.2	-168.2	-170.7	0	0	0	0	108	L442 K446 S447	L442-S444 VanDerWaalsContact C-N 3.31Å; L442-S444 PolarHBondContact O-N 3.44Å; S444-K446 PolarHBondContact O-N 3.3Å; S444-S447 PolarHBondContact O-N 3.31Å
445	L	32.5	Very low	40.7	Very low	37 Å²	37	103.2 Å²	103.2	19%	0.194	54%	0.541	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	7	-172.9	-80.2	158	0	0	0	114.7	I443 S447 I700	I443-L445 PolarHBondContact O-N 3.05Å; L445-S447 PolarHBondContact O-N 3.33Å; L445-I700 HydrophobicContact CD1-CB 3.59Å; L445-I700 HydrophobicContact CD1-CD1 4.02Å; L445-I700 HydrophobicContact CD1-CG1 4.38Å; L445-I700 HydrophobicContact CD1-CG2 3.65Å
446	K	27.9	Very low	43.3	Very low	181 Å²	181	96.7 Å²	96.7	79%	0.787	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-18	165.7	-62.8	178	-178.9	177.1	0	114	S444	S444-K446 PolarHBondContact O-N 3.3Å
447	S	28.3	Very low	46	Very low	84 Å²	84	89.1 Å²	89.1	59%	0.587	49%	0.485	S	S	*	.	S	Bend	trans	-112.2	-27.8	-176.6	58.1	0	0	0	0	116.3	S444 L445 S449	S444-S447 PolarHBondContact O-N 3.31Å; L445-S447 PolarHBondContact O-N 3.33Å; S447-S449 PolarHBondContact O-N 2.97Å
448	C	30.4	Very low	48.6	Very low	44 Å²	44	82.5 Å²	82.5	30%	0.297	46%	0.461	S	S	.	.			trans	-84.3	92.5	-178.5	-65.2	0	0	0	0	111.6	S450	C448-S450 PolarHBondContact O-N 3.26Å
449	S	39.7	Very low	51.1	Low	118 Å²	118	77.2 Å²	77.2	83%	0.825	44%	0.441	S	S	*	.	S	Bend	trans	-72.5	-7.6	174.1	52	0	0	0	0	114.6	S447	S447-S449 PolarHBondContact O-N 2.97Å
450	S	53	Low	53.7	Low	85 Å²	85	73.2 Å²	73.2	59%	0.594	42%	0.422	S	S	*	.	S	Bend	trans	-142.2	143.6	176.7	44.7	0	0	0	0	110	C448	C448-S450 PolarHBondContact O-N 3.26Å
451	I	65.4	Low	56.1	Low	39 Å²	39	74 Å²	74	20%	0.2	44%	0.435	C	S	.	.			trans	-71	133.6	165.8	-65	155	0	0	0	106.7	L453 L723 A727	I451-L453 PolarHBondContact O-N 3.18Å; I451-L723 HydrophobicContact CD1-CD1 3.84Å; I451-L723 HydrophobicContact CD1-CG 3.99Å; I451-A727 HydrophobicContact CD1-CB 3.82Å
452	P	64.6	Low	58.7	Low	48 Å²	48	73 Å²	73	31%	0.312	42%	0.423	S	S	.	.			trans	-66.3	126.6	176.9	26.5	-33.1	0	0	0	110.8	F455 Y730	P452-F455 HydrophobicContact CG-CD2 4.17Å; P452-Y730 HydrophobicContact CG-CD2 3.38Å; P452-Y730 HydrophobicContact CG-CE2 3.61Å; P452-Y730 HydrophobicContact CG-CG 4.13Å
453	L	69.1	Low	61.2	Low	62 Å²	62	67.4 Å²	67.4	33%	0.325	39%	0.393	S	S	.	.	S	Bend	trans	-121.8	137.1	162.8	-79.8	159.8	0	0	0	105.6	I451 V722 S726 V780 E782	I451-L453 PolarHBondContact O-N 3.18Å; L453-V722 HydrophobicContact CD1-CG1 4.37Å; L453-V722 HydrophobicContact CD2-CG1 4.04Å; L453-S726 VanDerWaalsContact CD2-OG 3.26Å; L453-S726 WeakPolarHBondContact CD2-OG 3.49Å; L453-V780 HydrophobicContact CD2-CB 4.39Å; L453-V780 HydrophobicContact CD2-CG1 3.88Å; L453-E782 HydrophobicContact CB-CG 4.35Å
454	P	74	Confident	63.6	Low	79 Å²	79	64.9 Å²	64.9	51%	0.513	38%	0.384	S	S	.	.	S	Bend	cis	-70.9	163.9	-8.4	35.6	-35.7	0	0	0	111.3	V780 E782	P454-V780 WeakPolarHBondContact CA-O 3.04Å; P454-V780 WeakPolarHBondContact CB-O 3.32Å; P454-E782 HydrophobicContact CB-CG 4.43Å; P454-E782 WeakPolarHBondContact CD-OE1 3.31Å; P454-E782 HydrophobicContact CG-CG 4.49Å
455	F	79.9	Confident	65.6	Low	49 Å²	49	67.6 Å²	67.6	22%	0.215	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	141.9	173.9	-172.1	-90.9	0	0	0	111.3	P452 L457 L729 Y730 G779 V780	P452-F455 HydrophobicContact CG-CD2 4.17Å; F455-L457 HydrophobicContact CE1-CD2 3.91Å; F455-L457 HydrophobicContact CE1-CG 4.11Å; F455-L457 HydrophobicContact CZ-CD2 4.41Å; F455-L729 HydrophobicContact CD1-CB 3.6Å; F455-L729 VanDerWaalsContact CE1-C 3.46Å; F455-L729 HydrophobicContact CE1-CB 3.7Å; F455-L729 WeakPolarHBondContact CE1-O 3.43Å; F455-Y730 HydrophobicContact CD2-CD2 4.18Å; F455-Y730 AromaticContact CE2-CD2 3.83Å; F455-Y730 HydrophobicContact CE2-CD2 3.83Å; F455-G779 CarbonylContact O-C 3.57Å; F455-G779 WeakPolarHBondContact O-CA 3.37Å; F455-V780 PolarHBondContact N-O 3.4Å; F455-V780 PolarHBondContact O-N 3.35Å
456	M	82.3	Confident	67.1	Low	84 Å²	84	67.2 Å²	67.2	41%	0.414	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	128.1	177.2	-160.7	166.3	81.5	0	0	110.3	I458 Y778 Y787	M456-I458 WeakPolarHBondContact CE-O 3.35Å; M456-Y778 CarbonylContact C-O 3.43Å; M456-Y778 WeakPolarHBondContact CA-O 3.44Å; M456-Y778 HydrophobicContact CG-CD2 3.86Å; M456-Y778 HydrophobicContact CG-CE2 4.22Å; M456-Y778 HydrophobicContact SD-CD2 4.16Å; M456-Y778 HydrophobicContact SD-CE2 3.89Å; M456-Y787 HydrophobicContact SD-CD2 4.35Å; M456-Y787 HydrophobicContact SD-CE2 4.33Å
457	L	84.3	Confident	68.5	Low	39 Å²	39	62.3 Å²	62.3	20%	0.204	41%	0.409	C	S	.	.	S	Bend	trans	-70.4	-34.8	-176.1	-81.2	174.1	0	0	0	113.5	F455 C479 L729 I734 Y778	F455-L457 HydrophobicContact CE1-CD2 3.91Å; F455-L457 HydrophobicContact CE1-CG 4.11Å; F455-L457 HydrophobicContact CZ-CD2 4.41Å; L457-C479 HydrophobicContact CD1-CB 4.36Å; L457-L729 HydrophobicContact CD1-CD2 3.48Å; L457-L729 VanDerWaalsContact CD1-CD2 3.48Å; L457-L729 HydrophobicContact CG-CD2 3.91Å; L457-I734 HydrophobicContact CD1-CG1 4.14Å; L457-Y778 PolarHBondContact N-O 2.85Å
458	I	84.7	Confident	70	Confident	11 Å²	11	60.8 Å²	60.8	6%	0.056	40%	0.398	C	S	.	.	S	Bend	trans	-158.2	146.2	-169.6	-158.4	172.3	0	0	0	110.5	M456 E462 L463 R478	M456-I458 WeakPolarHBondContact CE-O 3.35Å; I458-E462 HydrophobicContact CD1-CB 3.77Å; I458-E462 WeakPolarHBondContact CD1-OE2 3.39Å; I458-E462 HydrophobicContact CG1-CB 3.89Å; I458-E462 WeakPolarHBondContact CG1-OE2 3.47Å; I458-L463 HydrophobicContact CG2-CD1 4.49Å; I458-L463 HydrophobicContact CG2-CD2 3.7Å; I458-L463 HydrophobicContact CG2-CG 3.98Å; I458-R478 HydrophobicContact CD1-CG 3.64Å
459	P	82.4	Confident	71.5	Confident	57 Å²	57	60.7 Å²	60.7	37%	0.37	39%	0.394	S	S	.	.			trans	-56.8	138.5	170.3	-28.1	37.7	0	0	0	113	S461 E462	P459-S461 PolarHBondContact O-N 3.22Å; P459-E462 HydrophobicContact CB-CG 4.42Å; P459-E462 WeakPolarHBondContact CD-OE1 3.47Å; P459-E462 WeakPolarHBondContact CG-OE1 3.48Å; P459-E462 PolarHBondContact O-N 3.16Å
460	T	82.6	Confident	72.5	Confident	57 Å²	57	57.4 Å²	57.4	35%	0.35	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-58	-25.3	178.9	-48.9	0	0	0	0	113.2	E462 L463 Y778 N792	T460-E462 VanDerWaalsContact C-N 3.28Å; T460-E462 PolarHBondContact O-N 2.9Å; T460-L463 PolarHBondContact O-N 3Å; T460-Y778 VanDerWaalsContact CG2-OH 3.32Å; T460-Y778 WeakPolarHBondContact CG2-OH 3.41Å; T460-Y778 WeakPolarHBondContact OG1-CE2 3.49Å; T460-Y778 PolarHBondContact OG1-OH 3.38Å; T460-Y778 VanDerWaalsContact OG1-OH 3.05Å; T460-N792 HydrophobicContact CG2-CB 3.96Å
461	S	81.1	Confident	73.2	Confident	111 Å²	111	54.3 Å²	54.3	78%	0.776	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	-68.8	-18.9	174.9	49	0	0	0	0	114.7	P459	P459-S461 PolarHBondContact O-N 3.22Å
462	E	82.5	Confident	73.4	Confident	90 Å²	90	52.6 Å²	52.6	42%	0.421	34%	0.339	S	S	.	.	G	3₁₀ helix	trans	-95	-8	178.9	-66.4	175	-141.3	0	0	112.5	I458 P459 T460 R478	I458-E462 HydrophobicContact CD1-CB 3.77Å; I458-E462 WeakPolarHBondContact CD1-OE2 3.39Å; I458-E462 HydrophobicContact CG1-CB 3.89Å; I458-E462 WeakPolarHBondContact CG1-OE2 3.47Å; P459-E462 HydrophobicContact CB-CG 4.42Å; P459-E462 WeakPolarHBondContact CD-OE1 3.47Å; P459-E462 WeakPolarHBondContact CG-OE1 3.48Å; P459-E462 PolarHBondContact O-N 3.16Å; T460-E462 VanDerWaalsContact C-N 3.28Å; T460-E462 PolarHBondContact O-N 2.9Å; E462-R478 WeakPolarHBondContact O-CD 3.3Å; E462-R478 PolarHBondContact O-NH1 3.29Å
463	L	84	Confident	73.6	Confident	11 Å²	11	50.4 Å²	50.4	6%	0.058	33%	0.325	C	S	.	.	S	Bend	trans	-77.9	134	177.5	-66.9	169.4	0	0	0	111.1	I458 T460 S465 N475 Y778 T789	I458-L463 HydrophobicContact CG2-CD1 4.49Å; I458-L463 HydrophobicContact CG2-CD2 3.7Å; I458-L463 HydrophobicContact CG2-CG 3.98Å; T460-L463 PolarHBondContact O-N 3Å; L463-S465 PolarHBondContact O-N 3.2Å; L463-N475 WeakPolarHBondContact CA-OD1 3.49Å; L463-N475 HydrophobicContact CD2-CB 4.1Å; L463-Y778 HydrophobicContact CD1-CD1 3.71Å; L463-Y778 HydrophobicContact CD1-CD2 3.89Å; L463-Y778 HydrophobicContact CD1-CE1 3.59Å; L463-Y778 HydrophobicContact CD1-CE2 3.79Å; L463-Y778 HydrophobicContact CD1-CG 3.85Å; L463-T789 HydrophobicContact CD1-CG2 4.01Å; L463-T789 HydrophobicContact CD2-CG2 4.39Å
464	A	77.4	Confident	73.8	Confident	25 Å²	25	48.8 Å²	48.8	21%	0.207	32%	0.317	C	S	.	.			trans	-63.9	123	170.5	0	0	0	0	0	110.1	V474 N475	A464-V474 HydrophobicContact CB-CB 4.23Å; A464-V474 HydrophobicContact CB-CG1 3.76Å; A464-N475 WeakPolarHBondContact CB-OD1 3.26Å; A464-N475 PolarHBondContact N-OD1 2.92Å; A464-N475 PolarHBondContact O-ND2 3.35Å
465	S	71.2	Confident	74.1	Confident	109 Å²	109	45 Å²	45	76%	0.762	29%	0.293	S	S	*	.			trans	-90.4	114.3	-175.2	48.9	0	0	0	0	112.1	L463	L463-S465 PolarHBondContact O-N 3.2Å
466	G	64.3	Low	74.1	Confident	28 Å²	28	42.7 Å²	42.7	29%	0.289	28%	0.283	S	S	.	.	S	Bend	trans	162.9	145.9	168.7	0	0	0	0	0	113.6	S468 C471 N790	G466-S468 PolarHBondContact O-N 3.2Å; G466-C471 WeakPolarHBondContact O-CB 2.98Å; G466-N790 PolarHBondContact O-ND2 3.45Å; G466-N790 PolarHBondContact O-OD1 2.93Å
467	G	57.6	Low	73.9	Confident	79 Å²	79	38.8 Å²	38.8	81%	0.814	26%	0.263	S	S	*	.	S	Bend	trans	-70.6	13.4	179.8	0	0	0	0	0	115.7
468	S	59.2	Low	73.9	Confident	52 Å²	52	41.5 Å²	41.5	36%	0.364	27%	0.271	S	S	.	.	S	Bend	trans	-88.9	152.8	-176.3	82.8	0	0	0	0	112.2	G466 T470 C471 T472	G466-S468 PolarHBondContact O-N 3.2Å; S468-T470 PolarHBondContact O-N 3.22Å; S468-T470 PolarHBondContact OG-N 2.95Å; S468-C471 WeakPolarHBondContact O-CB 3.25Å; S468-C471 PolarHBondContact O-N 3.44Å; S468-C471 VanDerWaalsContact O-N 3.11Å; S468-C471 PolarHBondContact OG-N 3.47Å; S468-C471 VanDerWaalsContact OG-N 3.14Å; S468-C471 PolarHBondContact OG-SG 3.21Å; S468-T472 PolarHBondContact O-N 2.89Å
469	L	62.4	Low	74	Confident	41 Å²	41	41.2 Å²	41.2	22%	0.215	27%	0.27	C	S	.	.	H	α-helix	trans	-57.7	-37.6	173.2	-174	64.5	0	0	0	112	C471 T472 V473 L583 L584	L469-C471 VanDerWaalsContact C-N 3.33Å; L469-C471 PolarHBondContact O-N 3.42Å; L469-T472 WeakPolarHBondContact O-CB 3.46Å; L469-T472 PolarHBondContact O-N 3.25Å; L469-T472 VanDerWaalsContact O-N 3.13Å; L469-V473 WeakPolarHBondContact O-CG2 3.42Å; L469-V473 PolarHBondContact O-N 3.04Å; L469-L583 HydrophobicContact CD1-CB 3.76Å; L469-L583 HydrophobicContact CD1-CD1 3.63Å; L469-L583 HydrophobicContact CD1-CG 4.25Å; L469-L583 HydrophobicContact CD2-CB 4.38Å; L469-L583 HydrophobicContact CG-CD1 4.41Å; L469-L584 HydrophobicContact CD2-CD1 3.91Å; L469-L584 HydrophobicContact CD2-CD2 3.87Å; L469-L584 HydrophobicContact CD2-CG 3.6Å
470	T	60.2	Low	74.1	Confident	49 Å²	49	39.2 Å²	39.2	30%	0.301	26%	0.256	S	S	.	.	H	α-helix	trans	-56.8	-44.7	175	-55.6	0	0	0	0	111.7	S468 T472 V473 V474 L495	S468-T470 PolarHBondContact O-N 3.22Å; S468-T470 PolarHBondContact OG-N 2.95Å; T470-T472 VanDerWaalsContact C-N 3.34Å; T470-T472 PolarHBondContact O-N 3.19Å; T470-V473 PolarHBondContact O-N 2.78Å; T470-V474 HydrophobicContact CG2-CG2 4.49Å; T470-V474 WeakPolarHBondContact O-CG2 3.47Å; T470-V474 PolarHBondContact O-N 2.77Å; T470-L495 HydrophobicContact CG2-CD1 3.68Å
471	C	67.3	Low	74	Confident	21 Å²	21	37.3 Å²	37.3	14%	0.142	25%	0.248	C	C	.	.	H	α-helix	trans	-62.6	-40.3	176.1	-60.6	0	0	0	0	111.5	G466 S468 L469 N475	G466-C471 WeakPolarHBondContact O-CB 2.98Å; S468-C471 WeakPolarHBondContact O-CB 3.25Å; S468-C471 PolarHBondContact O-N 3.44Å; S468-C471 VanDerWaalsContact O-N 3.11Å; S468-C471 PolarHBondContact OG-N 3.47Å; S468-C471 VanDerWaalsContact OG-N 3.14Å; S468-C471 PolarHBondContact OG-SG 3.21Å; L469-C471 VanDerWaalsContact C-N 3.33Å; L469-C471 PolarHBondContact O-N 3.42Å; C471-N475 WeakPolarHBondContact O-CB 3.32Å; C471-N475 PolarHBondContact O-N 3.2Å; C471-N475 PolarHBondContact O-ND2 2.7Å
472	T	70.9	Confident	73.7	Confident	3 Å²	3	32 Å²	32	2%	0.018	21%	0.211	C	C	.	.	H	α-helix	trans	-61.6	-45.2	173.7	-53.8	0	0	0	0	111.6	S468 L469 T470 N475 I476 V736 H774 N790	S468-T472 PolarHBondContact O-N 2.89Å; L469-T472 WeakPolarHBondContact O-CB 3.46Å; L469-T472 PolarHBondContact O-N 3.25Å; L469-T472 VanDerWaalsContact O-N 3.13Å; T470-T472 VanDerWaalsContact C-N 3.34Å; T470-T472 PolarHBondContact O-N 3.19Å; T472-N475 PolarHBondContact O-N 3.28Å; T472-I476 HydrophobicContact CG2-CD1 4.26Å; T472-I476 WeakPolarHBondContact O-CG1 3.28Å; T472-I476 PolarHBondContact O-N 3.11Å; T472-V736 HydrophobicContact CG2-CG1 4.13Å; T472-H774 HydrophobicContact CG2-CB 3.98Å; T472-H774 WeakPolarHBondContact CG2-O 3.44Å; T472-H774 PolarHBondContact OG1-O 2.79Å; T472-N790 PolarHBondContact OG1-ND2 3.45Å
473	V	69	Low	73.2	Confident	2 Å²	2	28.9 Å²	28.9	1%	0.012	20%	0.197	C	C	.	.	H	α-helix	trans	-64.8	-43.6	178.6	176.8	0	0	0	0	112.1	L469 T470 N475 I476 L477 L491 L579 L583	L469-V473 WeakPolarHBondContact O-CG2 3.42Å; L469-V473 PolarHBondContact O-N 3.04Å; T470-V473 PolarHBondContact O-N 2.78Å; V473-N475 VanDerWaalsContact C-N 3.3Å; V473-N475 PolarHBondContact O-N 3Å; V473-I476 PolarHBondContact O-N 3.24Å; V473-L477 HydrophobicContact CG1-CD1 4.05Å; V473-L477 WeakPolarHBondContact O-CG 3.43Å; V473-L477 PolarHBondContact O-N 3.07Å; V473-L491 HydrophobicContact CG1-CD1 3.9Å; V473-L579 HydrophobicContact CG1-CD2 3.99Å; V473-L579 HydrophobicContact CG2-CD2 3.95Å; V473-L583 HydrophobicContact CG2-CD1 3.65Å
474	V	71.6	Confident	72.4	Confident	27 Å²	27	35.3 Å²	35.3	16%	0.164	23%	0.231	C	C	.	.	H	α-helix	trans	-58.1	-43.4	173.7	170.8	0	0	0	0	110.8	A464 T470 L477 R478 L483 L491	A464-V474 HydrophobicContact CB-CB 4.23Å; A464-V474 HydrophobicContact CB-CG1 3.76Å; T470-V474 HydrophobicContact CG2-CG2 4.49Å; T470-V474 WeakPolarHBondContact O-CG2 3.47Å; T470-V474 PolarHBondContact O-N 2.77Å; V474-L477 PolarHBondContact O-N 3.09Å; V474-R478 WeakPolarHBondContact O-CB 3.34Å; V474-R478 PolarHBondContact O-N 3.41Å; V474-L483 HydrophobicContact CG1-CD1 4.31Å; V474-L491 HydrophobicContact CG2-CD2 3.6Å
475	N	81	Confident	71.7	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-68.8	-35.9	179.9	-71.1	-24.8	0	0	0	112.8	L463 A464 C471 T472 V473 C479 L776	L463-N475 WeakPolarHBondContact CA-OD1 3.49Å; L463-N475 HydrophobicContact CD2-CB 4.1Å; A464-N475 WeakPolarHBondContact CB-OD1 3.26Å; A464-N475 PolarHBondContact N-OD1 2.92Å; A464-N475 PolarHBondContact O-ND2 3.35Å; C471-N475 WeakPolarHBondContact O-CB 3.32Å; C471-N475 PolarHBondContact O-N 3.2Å; C471-N475 PolarHBondContact O-ND2 2.7Å; T472-N475 PolarHBondContact O-N 3.28Å; V473-N475 VanDerWaalsContact C-N 3.3Å; V473-N475 PolarHBondContact O-N 3Å; N475-C479 VanDerWaalsContact O-CB 3.28Å; N475-C479 WeakPolarHBondContact O-CB 3.38Å; N475-C479 PolarHBondContact O-N 2.99Å; N475-C479 PolarHBondContact O-SG 3.32Å; N475-L776 HydrophobicContact CB-CD1 4.01Å
476	I	80.1	Confident	71.1	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-59.3	-52	170.4	-66.3	164.4	0	0	0	110	T472 V473 C479 L480 L583 L682 I734 V736 L776 F947	T472-I476 HydrophobicContact CG2-CD1 4.26Å; T472-I476 WeakPolarHBondContact O-CG1 3.28Å; T472-I476 PolarHBondContact O-N 3.11Å; V473-I476 PolarHBondContact O-N 3.24Å; I476-C479 PolarHBondContact O-N 3.33Å; I476-L480 PolarHBondContact O-N 3.22Å; I476-L480 VanDerWaalsContact O-N 3.14Å; I476-L583 HydrophobicContact CD1-CD1 4.49Å; I476-L682 HydrophobicContact CG2-CD2 3.84Å; I476-I734 HydrophobicContact CG2-CD1 4.27Å; I476-I734 WeakPolarHBondContact O-CD1 3.44Å; I476-V736 HydrophobicContact CD1-CG2 4.13Å; I476-V736 HydrophobicContact CG1-CG2 4.1Å; I476-L776 HydrophobicContact CB-CD1 4.41Å; I476-L776 HydrophobicContact CG1-CD1 3.74Å; I476-F947 HydrophobicContact CD1-CD2 4.15Å; I476-F947 HydrophobicContact CD1-CE2 3.76Å; I476-F947 HydrophobicContact CD1-CZ 4.09Å; I476-F947 HydrophobicContact CG2-CG 4.46Å
477	L	78.8	Confident	70.6	Confident	1 Å²	1	35 Å²	35	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-65.3	-40.6	-177.3	-71.3	169.2	0	0	0	112.6	V473 V474 G481 L482 L483 L491 V678 L682	V473-L477 HydrophobicContact CG1-CD1 4.05Å; V473-L477 WeakPolarHBondContact O-CG 3.43Å; V473-L477 PolarHBondContact O-N 3.07Å; V474-L477 PolarHBondContact O-N 3.09Å; L477-G481 PolarHBondContact O-N 3.06Å; L477-L482 HydrophobicContact CD2-CB 3.85Å; L477-L482 HydrophobicContact CD2-CD1 4.3Å; L477-L482 PolarHBondContact O-N 3.33Å; L477-L483 HydrophobicContact CB-CB 4.45Å; L477-L483 HydrophobicContact CB-CD1 3.74Å; L477-L483 HydrophobicContact CD1-CD1 4.36Å; L477-L483 PolarHBondContact O-N 3.25Å; L477-L491 HydrophobicContact CD1-CD1 3.8Å; L477-L491 HydrophobicContact CD1-CD2 3.91Å; L477-L491 HydrophobicContact CD1-CG 4.44Å; L477-V678 HydrophobicContact CD1-CG2 4.2Å; L477-V678 HydrophobicContact CD2-CG1 4.31Å; L477-V678 HydrophobicContact CD2-CG2 4.28Å; L477-L682 HydrophobicContact CD2-CD1 3.85Å
478	R	84.4	Confident	70.4	Confident	96 Å²	96	35.3 Å²	35.3	36%	0.362	19%	0.193	S	C	.	.	H	α-helix	trans	-67.4	-45.3	177.8	-179.8	170.3	-92.5	160.1	-1.7	111.9	I458 E462 V474 L480 G481 L483	I458-R478 HydrophobicContact CD1-CG 3.64Å; E462-R478 WeakPolarHBondContact O-CD 3.3Å; E462-R478 PolarHBondContact O-NH1 3.29Å; V474-R478 WeakPolarHBondContact O-CB 3.34Å; V474-R478 PolarHBondContact O-N 3.41Å; R478-L480 PolarHBondContact O-N 3.3Å; R478-G481 PolarHBondContact O-N 2.69Å; R478-L483 HydrophobicContact CB-CB 4.4Å; R478-L483 HydrophobicContact CB-CD2 4.35Å
479	C	86	Confident	70.2	Confident	5 Å²	5	39.8 Å²	39.8	3%	0.034	21%	0.208	C	C	.	.	H	α-helix	trans	-62.4	-41.6	178.8	-71.1	0	0	0	0	112	R437 L457 N475 I476 G481 I734	R437-C479 PolarHBondContact NH2-O 3.01Å; L457-C479 HydrophobicContact CD1-CB 4.36Å; N475-C479 VanDerWaalsContact O-CB 3.28Å; N475-C479 WeakPolarHBondContact O-CB 3.38Å; N475-C479 PolarHBondContact O-N 2.99Å; N475-C479 PolarHBondContact O-SG 3.32Å; I476-C479 PolarHBondContact O-N 3.33Å; C479-G481 PolarHBondContact O-N 3.27Å; C479-I734 HydrophobicContact CB-CD1 3.37Å; C479-I734 HydrophobicContact CB-CG1 4.2Å
480	L	83.5	Confident	69.7	Low	15 Å²	15	41.3 Å²	41.3	8%	0.079	22%	0.216	C	C	.	.	H	α-helix	trans	-66.8	-19.7	173	-68	-178.5	0	0	0	113.4	R437 I476 R478 L482 L682 G732 I734	R437-L480 PolarHBondContact NH1-O 3.45Å; I476-L480 PolarHBondContact O-N 3.22Å; I476-L480 VanDerWaalsContact O-N 3.14Å; R478-L480 PolarHBondContact O-N 3.3Å; L480-L482 HydrophobicContact CB-CB 4.46Å; L480-L482 HydrophobicContact CB-CD1 3.93Å; L480-L482 HydrophobicContact CB-CG 3.85Å; L480-L482 HydrophobicContact CD1-CD1 3.68Å; L480-L482 HydrophobicContact CG-CD1 4.46Å; L480-L682 HydrophobicContact CD1-CD1 4.31Å; L480-L682 HydrophobicContact CD1-CD2 3.52Å; L480-L682 HydrophobicContact CD1-CG 3.82Å; L480-G732 VanDerWaalsContact CD2-O 3.31Å; L480-G732 WeakPolarHBondContact CD2-O 2.98Å; L480-I734 HydrophobicContact CD2-CD1 3.87Å; L480-I734 HydrophobicContact CD2-CG1 3.97Å; L480-I734 HydrophobicContact CG-CD1 3.63Å; L480-I734 HydrophobicContact CG-CG1 4.29Å
481	G	80.9	Confident	69.3	Low	17 Å²	17	39.2 Å²	39.2	18%	0.175	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.6	28.5	-170	0	0	0	0	0	112.8	L477 R478 C479	L477-G481 PolarHBondContact O-N 3.06Å; R478-G481 PolarHBondContact O-N 2.69Å; C479-G481 PolarHBondContact O-N 3.27Å
482	L	75.7	Confident	68.3	Low	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.213	C	C	.	.			trans	-96.6	-14	176	-67.4	177.4	0	0	0	113.1	L477 L480 D484 R485 C486 L681 L682 E949	L477-L482 HydrophobicContact CD2-CB 3.85Å; L477-L482 HydrophobicContact CD2-CD1 4.3Å; L477-L482 PolarHBondContact O-N 3.33Å; L480-L482 HydrophobicContact CB-CB 4.46Å; L480-L482 HydrophobicContact CB-CD1 3.93Å; L480-L482 HydrophobicContact CB-CG 3.85Å; L480-L482 HydrophobicContact CD1-CD1 3.68Å; L480-L482 HydrophobicContact CG-CD1 4.46Å; L482-D484 PolarHBondContact O-N 3.42Å; L482-R485 WeakPolarHBondContact O-CA 3.33Å; L482-R485 PolarHBondContact O-N 2.73Å; L482-C486 PolarHBondContact O-N 3Å; L482-L681 HydrophobicContact CD1-CB 3.93Å; L482-L681 HydrophobicContact CD2-CB 4.28Å; L482-L681 HydrophobicContact CD2-CD1 4.31Å; L482-L681 HydrophobicContact CD2-CD2 4.23Å; L482-L682 HydrophobicContact CD1-CD1 3.65Å; L482-L682 HydrophobicContact CD1-CG 4.11Å; L482-E949 HydrophobicContact CD1-CG 4.32Å; L482-E949 HydrophobicContact CD2-CG 4.03Å
483	L	72.6	Confident	67.1	Low	25 Å²	25	42.9 Å²	42.9	13%	0.131	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-22.7	175.1	-150.5	83	0	0	0	112.7	V474 L477 R478 R485 L491	V474-L483 HydrophobicContact CG1-CD1 4.31Å; L477-L483 HydrophobicContact CB-CB 4.45Å; L477-L483 HydrophobicContact CB-CD1 3.74Å; L477-L483 HydrophobicContact CD1-CD1 4.36Å; L477-L483 PolarHBondContact O-N 3.25Å; R478-L483 HydrophobicContact CB-CB 4.4Å; R478-L483 HydrophobicContact CB-CD2 4.35Å; L483-R485 PolarHBondContact O-N 3.45Å; L483-L491 HydrophobicContact CD1-CD2 4.42Å
484	D	66.6	Low	66.2	Low	146 Å²	146	43.8 Å²	43.8	78%	0.781	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-8.6	172.6	-59.3	-9.3	0	0	0	112.5	L482	L482-D484 PolarHBondContact O-N 3.42Å
485	R	62.1	Low	64.9	Low	131 Å²	131	43.9 Å²	43.9	49%	0.494	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-113.1	-19.5	-177.6	-51.6	-168.4	-155.9	157.4	13.6	114.2	L482 L483 E949	L482-R485 WeakPolarHBondContact O-CA 3.33Å; L482-R485 PolarHBondContact O-N 2.73Å; L483-R485 PolarHBondContact O-N 3.45Å; R485-E949 IonicContact CZ-OE1 2.7Å; R485-E949 VanDerWaalsContact CZ-OE1 3.25Å; R485-E949 IonicContact CZ-OE2 3.06Å; R485-E949 IonicContact NH1-OE1 3.27Å; R485-E949 PolarHBondContact NH1-OE1 2.91Å; R485-E949 IonicContact NH1-OE2 3.01Å; R485-E949 VanDerWaalsContact NH2-CD 3.33Å; R485-E949 IonicContact NH2-OE1 3.98Å; R485-E949 PolarHBondContact NH2-OE1 3.05Å; R485-E949 IonicContact NH2-OE2 2.7Å; R485-E949 PolarHBondContact NH2-OE2 3.39Å
486	C	58.9	Low	63	Low	2 Å²	2	50.7 Å²	50.7	1%	0.014	26%	0.262	C	S	.	.	S	Bend	trans	-115.7	116.2	167.2	-66.9	0	0	0	0	107.1	L482 V677 L681	L482-C486 PolarHBondContact O-N 3Å; C486-V677 VanDerWaalsContact SG-CG1 3.55Å; C486-L681 VanDerWaalsContact SG-CD1 3.54Å
487	G	54.9	Low	61.1	Low	23 Å²	23	55.1 Å²	55.1	24%	0.237	29%	0.286	C	S	.	.			trans	-56.2	157.2	175.1	0	0	0	0	0	111.6	E489 D490 L491	G487-E489 PolarHBondContact O-N 3.17Å; G487-D490 PolarHBondContact N-OD2 2.87Å; G487-D490 WeakPolarHBondContact O-CB 3.29Å; G487-D490 PolarHBondContact O-N 3.17Å; G487-D490 VanDerWaalsContact O-N 3.12Å; G487-L491 PolarHBondContact O-N 3.28Å
488	V	53.2	Low	59.3	Low	85 Å²	85	56.7 Å²	56.7	52%	0.515	29%	0.293	S	S	.	.	H	α-helix	trans	-62.5	-29.5	171.5	-179	0	0	0	0	109.3	L491 C492	V488-L491 PolarHBondContact O-N 2.95Å; V488-C492 VanDerWaalsContact O-CB 3.23Å; V488-C492 WeakPolarHBondContact O-CB 3.36Å; V488-C492 PolarHBondContact O-N 2.88Å; V488-C492 PolarHBondContact O-SG 3.01Å
489	E	53.4	Low	56.9	Low	146 Å²	146	60 Å²	60	68%	0.682	31%	0.305	S	S	*	.	H	α-helix	trans	-61.8	-50.1	170.9	-56	70.5	-155.1	0	0	111.6	G487 L491 C492 A493	G487-E489 PolarHBondContact O-N 3.17Å; E489-L491 VanDerWaalsContact C-N 3.32Å; E489-L491 PolarHBondContact O-N 2.92Å; E489-C492 PolarHBondContact O-N 3.26Å; E489-A493 WeakPolarHBondContact O-CB 3.49Å; E489-A493 PolarHBondContact O-N 3.02Å
490	D	51.8	Low	54.5	Low	72 Å²	72	61.9 Å²	61.9	39%	0.385	32%	0.315	S	S	.	.	H	α-helix	trans	-60.7	-43.2	175.9	-65.3	-47.2	0	0	0	111	G487 A493 I494	G487-D490 PolarHBondContact N-OD2 2.87Å; G487-D490 WeakPolarHBondContact O-CB 3.29Å; G487-D490 PolarHBondContact O-N 3.17Å; G487-D490 VanDerWaalsContact O-N 3.12Å; D490-A493 PolarHBondContact O-N 3.07Å; D490-I494 WeakPolarHBondContact O-CB 3.48Å; D490-I494 WeakPolarHBondContact O-CD1 3.39Å; D490-I494 WeakPolarHBondContact O-CG1 3.36Å; D490-I494 PolarHBondContact O-N 3.43Å
491	L	53.5	Low	52.1	Low	6 Å²	6	66.1 Å²	66.1	3%	0.031	34%	0.338	C	S	.	.	H	α-helix	trans	-67.2	-42.5	179.9	-176.9	59.6	0	0	0	111.5	V473 V474 L477 L483 G487 V488 E489 I494 L495	V473-L491 HydrophobicContact CG1-CD1 3.9Å; V474-L491 HydrophobicContact CG2-CD2 3.6Å; L477-L491 HydrophobicContact CD1-CD1 3.8Å; L477-L491 HydrophobicContact CD1-CD2 3.91Å; L477-L491 HydrophobicContact CD1-CG 4.44Å; L483-L491 HydrophobicContact CD1-CD2 4.42Å; G487-L491 PolarHBondContact O-N 3.28Å; V488-L491 PolarHBondContact O-N 2.95Å; E489-L491 VanDerWaalsContact C-N 3.32Å; E489-L491 PolarHBondContact O-N 2.92Å; L491-I494 PolarHBondContact O-N 3Å; L491-L495 HydrophobicContact CD1-CD1 4.23Å; L491-L495 HydrophobicContact CG-CD1 4.03Å; L491-L495 WeakPolarHBondContact O-CB 3.37Å; L491-L495 WeakPolarHBondContact O-CD1 3.26Å; L491-L495 VanDerWaalsContact O-CG 3.27Å; L491-L495 WeakPolarHBondContact O-CG 3.13Å; L491-L495 PolarHBondContact O-N 3.2Å
492	C	46.6	Very low	49.8	Very low	53 Å²	53	70.1 Å²	70.1	36%	0.358	36%	0.355	S	S	.	.	H	α-helix	trans	-63.4	-41	173.3	-78.4	0	0	0	0	111.7	V488 E489 L495 Y496	V488-C492 VanDerWaalsContact O-CB 3.23Å; V488-C492 WeakPolarHBondContact O-CB 3.36Å; V488-C492 PolarHBondContact O-N 2.88Å; V488-C492 PolarHBondContact O-SG 3.01Å; E489-C492 PolarHBondContact O-N 3.26Å; C492-L495 PolarHBondContact O-N 3.3Å; C492-Y496 WeakPolarHBondContact O-CB 3.4Å; C492-Y496 PolarHBondContact O-N 3.24Å
493	A	45.5	Very low	47.6	Very low	48 Å²	48	73.6 Å²	73.6	40%	0.397	38%	0.379	S	S	.	.	H	α-helix	trans	-61.6	-48.5	174.3	0	0	0	0	0	111.3	E489 D490 L495 Y496 D497	E489-A493 WeakPolarHBondContact O-CB 3.49Å; E489-A493 PolarHBondContact O-N 3.02Å; D490-A493 PolarHBondContact O-N 3.07Å; A493-L495 VanDerWaalsContact C-N 3.3Å; A493-L495 PolarHBondContact O-N 3.43Å; A493-Y496 PolarHBondContact O-N 3.11Å; A493-D497 VanDerWaalsContact O-CB 3.32Å; A493-D497 WeakPolarHBondContact O-CB 3.4Å; A493-D497 PolarHBondContact O-N 2.83Å
494	I	49.1	Very low	45.4	Very low	21 Å²	21	79.1 Å²	79.1	11%	0.108	40%	0.403	C	S	.	.	H	α-helix	trans	-58.9	-39.9	176.8	-69.2	162.6	0	0	0	111.7	D490 L491 F498 V677 V678	D490-I494 WeakPolarHBondContact O-CB 3.48Å; D490-I494 WeakPolarHBondContact O-CD1 3.39Å; D490-I494 WeakPolarHBondContact O-CG1 3.36Å; D490-I494 PolarHBondContact O-N 3.43Å; L491-I494 PolarHBondContact O-N 3Å; I494-F498 VanDerWaalsContact O-CB 3.31Å; I494-F498 WeakPolarHBondContact O-CB 3.32Å; I494-F498 PolarHBondContact O-N 3.37Å; I494-F498 VanDerWaalsContact O-N 3.13Å; I494-V677 HydrophobicContact CD1-CB 4.38Å; I494-V677 HydrophobicContact CD1-CG2 4.47Å; I494-V678 HydrophobicContact CD1-CG2 4.15Å
495	L	44.7	Very low	43.6	Very low	28 Å²	28	74.6 Å²	74.6	15%	0.147	39%	0.386	C	S	.	.	H	α-helix	trans	-73.5	-34.7	177.2	-73.5	164.2	0	0	0	113	T470 L491 C492 A493 W499 V580	T470-L495 HydrophobicContact CG2-CD1 3.68Å; L491-L495 HydrophobicContact CD1-CD1 4.23Å; L491-L495 HydrophobicContact CG-CD1 4.03Å; L491-L495 WeakPolarHBondContact O-CB 3.37Å; L491-L495 WeakPolarHBondContact O-CD1 3.26Å; L491-L495 VanDerWaalsContact O-CG 3.27Å; L491-L495 WeakPolarHBondContact O-CG 3.13Å; L491-L495 PolarHBondContact O-N 3.2Å; C492-L495 PolarHBondContact O-N 3.3Å; A493-L495 VanDerWaalsContact C-N 3.3Å; A493-L495 PolarHBondContact O-N 3.43Å; L495-W499 PolarHBondContact O-N 3.02Å; L495-V580 HydrophobicContact CD2-CG1 4.28Å; L495-V580 HydrophobicContact CD2-CG2 3.74Å
496	Y	40.7	Very low	41.8	Very low	143 Å²	143	73.5 Å²	73.5	56%	0.561	40%	0.396	S	S	*	.	H	α-helix	trans	-78	-41.3	-179.1	-170.1	-107.4	0	0	0	111.8	C492 A493 F498 W499 N500	C492-Y496 WeakPolarHBondContact O-CB 3.4Å; C492-Y496 PolarHBondContact O-N 3.24Å; A493-Y496 PolarHBondContact O-N 3.11Å; Y496-F498 VanDerWaalsContact C-N 3.3Å; Y496-F498 PolarHBondContact O-N 2.77Å; Y496-W499 PolarHBondContact O-N 3.25Å; Y496-W499 VanDerWaalsContact O-N 3.12Å; Y496-N500 WeakPolarHBondContact CE1-ND2 3.38Å; Y496-N500 PolarHBondContact O-N 2.9Å
497	D	41.1	Very low	40.1	Very low	95 Å²	95	83.5 Å²	83.5	51%	0.508	44%	0.44	S	S	.	.	H	α-helix	trans	-57.4	-45.1	167.5	-78.6	-13.6	0	0	0	110.5	A493 W499 N501	A493-D497 VanDerWaalsContact O-CB 3.32Å; A493-D497 WeakPolarHBondContact O-CB 3.4Å; A493-D497 PolarHBondContact O-N 2.83Å; D497-W499 VanDerWaalsContact C-N 3.3Å; D497-W499 PolarHBondContact O-N 2.71Å; D497-N501 VanDerWaalsContact O-CB 3.28Å; D497-N501 WeakPolarHBondContact O-CB 3.42Å; D497-N501 PolarHBondContact O-N 3.12Å; D497-N501 PolarHBondContact O-ND2 3.09Å
498	F	40.9	Very low	38.9	Very low	34 Å²	34	88.4 Å²	88.4	15%	0.149	46%	0.46	C	S	.	.	H	α-helix	trans	-58.4	-42.5	174.4	175.5	-93.8	0	0	0	111.8	I494 Y496 N502 S577 V580 L584	I494-F498 VanDerWaalsContact O-CB 3.31Å; I494-F498 WeakPolarHBondContact O-CB 3.32Å; I494-F498 PolarHBondContact O-N 3.37Å; I494-F498 VanDerWaalsContact O-N 3.13Å; Y496-F498 VanDerWaalsContact C-N 3.3Å; Y496-F498 PolarHBondContact O-N 2.77Å; F498-N502 WeakPolarHBondContact CE2-ND2 3.48Å; F498-N502 WeakPolarHBondContact CZ-ND2 3.45Å; F498-N502 PolarHBondContact O-N 3.34Å; F498-N502 PolarHBondContact O-ND2 2.88Å; F498-S577 WeakPolarHBondContact CD2-OG 3.16Å; F498-V580 HydrophobicContact CB-CG1 4.43Å; F498-V580 HydrophobicContact CD1-CG1 3.63Å; F498-V580 HydrophobicContact CD2-CB 4.33Å; F498-V580 HydrophobicContact CD2-CG1 3.97Å; F498-V580 HydrophobicContact CE1-CG1 3.86Å; F498-V580 HydrophobicContact CE2-CG1 4.16Å; F498-V580 HydrophobicContact CG-CB 4.32Å; F498-V580 HydrophobicContact CG-CG1 3.7Å; F498-V580 HydrophobicContact CZ-CG1 4.13Å; F498-L584 HydrophobicContact CD1-CD1 4.43Å; F498-L584 HydrophobicContact CE1-CD1 3.33Å; F498-L584 HydrophobicContact CE2-CD1 4.37Å; F498-L584 HydrophobicContact CZ-CD1 3.29Å
499	W	33	Very low	37.6	Very low	165 Å²	165	89.7 Å²	89.7	63%	0.625	47%	0.47	S	S	*	.	H	α-helix	trans	-69.2	-51	-179.3	-145.2	63.4	0	0	0	111.9	L495 Y496 D497 N501 N502 C503	L495-W499 PolarHBondContact O-N 3.02Å; Y496-W499 PolarHBondContact O-N 3.25Å; Y496-W499 VanDerWaalsContact O-N 3.12Å; D497-W499 VanDerWaalsContact C-N 3.3Å; D497-W499 PolarHBondContact O-N 2.71Å; W499-N501 PolarHBondContact O-N 3Å; W499-N502 PolarHBondContact O-N 3.01Å; W499-C503 PolarHBondContact O-N 3.48Å; W499-C503 PolarHBondContact O-SG 3.3Å; W499-C503 VanDerWaalsContact O-SG 3.39Å
500	N	35.2	Very low	36.2	Very low	44 Å²	44	89.5 Å²	89.5	24%	0.235	47%	0.474	C	S	.	.	H	α-helix	trans	-62.3	-40.1	-179.6	-77.9	-3.4	0	0	0	112.6	Y496 N502 C503 H504	Y496-N500 WeakPolarHBondContact CE1-ND2 3.38Å; Y496-N500 PolarHBondContact O-N 2.9Å; N500-N502 PolarHBondContact O-N 2.94Å; N500-C503 PolarHBondContact O-N 3.14Å; N500-C503 VanDerWaalsContact O-N 3.16Å; N500-H504 PolarHBondContact O-CD2 3.33Å; N500-H504 PolarHBondContact O-N 3.38Å
501	N	35	Very low	34.8	Very low	105 Å²	105	94.6 Å²	94.6	56%	0.561	50%	0.495	S	S	*	.	H	α-helix	trans	-67.1	-18.2	176.4	-76	-67.3	0	0	0	113.5	D497 W499	D497-N501 VanDerWaalsContact O-CB 3.28Å; D497-N501 WeakPolarHBondContact O-CB 3.42Å; D497-N501 PolarHBondContact O-N 3.12Å; D497-N501 PolarHBondContact O-ND2 3.09Å; W499-N501 PolarHBondContact O-N 3Å
502	N	31.6	Very low	33.5	Very low	100 Å²	100	98.6 Å²	98.6	54%	0.535	52%	0.523	S	S	.	.	H	α-helix	trans	-93.5	-26.3	170.4	-76.5	-76.6	0	0	0	113.1	F498 W499 N500	F498-N502 WeakPolarHBondContact CE2-ND2 3.48Å; F498-N502 WeakPolarHBondContact CZ-ND2 3.45Å; F498-N502 PolarHBondContact O-N 3.34Å; F498-N502 PolarHBondContact O-ND2 2.88Å; W499-N502 PolarHBondContact O-N 3.01Å; N500-N502 PolarHBondContact O-N 2.94Å
503	C	28.6	Very low	32.5	Very low	74 Å²	74	103 Å²	103	50%	0.5	54%	0.537	S	S	.	.	H	α-helix	trans	-79.9	-28.3	176.9	-69.9	0	0	0	0	113.7	W499 N500 A505	W499-C503 PolarHBondContact O-N 3.48Å; W499-C503 PolarHBondContact O-SG 3.3Å; W499-C503 VanDerWaalsContact O-SG 3.39Å; N500-C503 PolarHBondContact O-N 3.14Å; N500-C503 VanDerWaalsContact O-N 3.16Å; C503-A505 VanDerWaalsContact C-N 3.26Å; C503-A505 PolarHBondContact O-N 3.11Å
504	H	27.3	Very low	31.5	Very low	140 Å²	140	110 Å²	110	65%	0.648	56%	0.559	S	S	*	*			trans	-77.6	71.2	175.9	-73.4	-59.2	0	0	0	112.8	N500 P506	N500-H504 PolarHBondContact O-CD2 3.33Å; N500-H504 PolarHBondContact O-N 3.38Å; H504-P506 WeakPolarHBondContact O-CD 3.4Å
505	A	27.9	Very low	30.3	Very low	51 Å²	51	118.1 Å²	118.1	42%	0.421	59%	0.593	S	S	.	*			trans	-57.4	124.2	162.1	0	0	0	0	0	109.5	C503 F507	C503-A505 VanDerWaalsContact C-N 3.26Å; C503-A505 PolarHBondContact O-N 3.11Å; A505-F507 PolarHBondContact O-N 3.5Å; A505-F507 VanDerWaalsContact O-N 3.11Å
506	P	24.6	Very low	29.3	Very low	108 Å²	108	119.1 Å²	119.1	70%	0.701	60%	0.602	S	S	*	*			trans	-68	115.4	-179.1	25.6	-33	0	0	0	110.1	H504 L508	H504-P506 WeakPolarHBondContact O-CD 3.4Å; P506-L508 PolarHBondContact O-N 2.92Å
507	F	24.2	Very low	28.6	Very low	212 Å²	212	116.9 Å²	116.9	93%	0.93	60%	0.597	S	S	*	*			trans	-69.3	68.9	165.5	-85.2	-94.2	0	0	0	110	A505	A505-F507 PolarHBondContact O-N 3.5Å; A505-F507 VanDerWaalsContact O-N 3.11Å
508	L	28.5	Very low	27.9	Very low	127 Å²	127	117 Å²	117	67%	0.665	60%	0.601	S	S	*	*			trans	-65.8	126.4	168.9	-91.4	155.4	0	0	0	109.1	P506	P506-L508 PolarHBondContact O-N 2.92Å
509	P	25.6	Very low	27.1	Very low	111 Å²	111	121.7 Å²	121.7	72%	0.721	63%	0.626	S	S	*	*			trans	-66	167.6	174.7	29.4	-35.3	0	0	0	111.3	H511	P509-H511 PolarHBondContact O-N 3.49Å
510	D	25	Very low	26.6	Very low	143 Å²	143	120.6 Å²	120.6	77%	0.765	62%	0.623	S	S	*	*	S	Bend	trans	-66.1	95.6	-167.1	-66.5	-65.7	0	0	0	114.8
511	H	23.1	Very low	26	Very low	179 Å²	179	122.3 Å²	122.3	83%	0.829	64%	0.636	S	S	*	*			trans	-147.4	102.9	147.1	-91.6	-60.7	0	0	0	112.9	P509	P509-H511 PolarHBondContact O-N 3.49Å
512	S	26.1	Very low	25.4	Very low	89 Å²	89	123.8 Å²	123.8	62%	0.622	65%	0.649	S	S	*	*			trans	29.3	106.6	143.1	57.4	0	0	0	0	119.5
513	F	24.8	Very low	25	Very low	146 Å²	146	124.6 Å²	124.6	64%	0.64	66%	0.662	S	S	*	*	S	Bend		174.5	-23.2	103	-103.7	-76	0	0	0	114.4
514	F	25.6	Very low	24.9	Very low	196 Å²	196	131.8 Å²	131.8	86%	0.86	68%	0.678	S	S	*	*			trans	-122.3	34.5	-169.7	-83.5	-82.3	0	0	0	115.7	S516	F514-S516 PolarHBondContact O-N 2.8Å; F514-S516 VanDerWaalsContact O-N 3.12Å
515	K	23.3	Very low	24.6	Very low	191 Å²	191	133.9 Å²	133.9	83%	0.83	69%	0.688	S	S	*	*			trans	-87.3	41.4	-178.5	-149.3	165.2	-174	170	0	113.7
516	S	23.8	Very low	24.5	Very low	49 Å²	49	139 Å²	139	34%	0.343	71%	0.708	S	S	.	*			trans	-149.1	162.9	174.6	65.8	0	0	0	0	110.6	F514	F514-S516 PolarHBondContact O-N 2.8Å; F514-S516 VanDerWaalsContact O-N 3.12Å
517	H	26.3	Very low	24.4	Very low	95 Å²	95	139 Å²	139	44%	0.44	71%	0.71	S	S	.	*			trans	81	24.9	-176.5	-49	85.5	0	0	0	117.7	M870	H517-M870 WeakPolarHBondContact NE2-CE 3.2Å
518	V	25.3	Very low	24.4	Very low	98 Å²	98	140.1 Å²	140.1	59%	0.594	71%	0.708	S	S	*	*			trans	-113.4	103.9	146.6	-174.1	0	0	0	0	107.3	Y520	V518-Y520 HydrophobicContact CB-CD2 4.35Å; V518-Y520 HydrophobicContact CB-CE2 4.13Å; V518-Y520 HydrophobicContact CG1-CD2 3.64Å; V518-Y520 HydrophobicContact CG1-CE1 4.4Å; V518-Y520 HydrophobicContact CG1-CE2 3.5Å; V518-Y520 HydrophobicContact CG1-CG 4.16Å; V518-Y520 PolarHBondContact O-N 2.81Å
519	I	23.8	Very low	24.4	Very low	132 Å²	132	141.1 Å²	141.1	68%	0.677	71%	0.711	S	S	*	*			trans	-86	91.9	165	-61	177.9	0	0	0	105.3	L820	I519-L820 HydrophobicContact CD1-CD2 4.47Å
520	Y	22.7	Very low	24.3	Very low	142 Å²	142	143.9 Å²	143.9	56%	0.557	72%	0.715	S	S	*	*			trans	-59.8	150.6	160.3	-72.2	-86.1	0	0	0	108.9	V518 T522	V518-Y520 HydrophobicContact CB-CD2 4.35Å; V518-Y520 HydrophobicContact CB-CE2 4.13Å; V518-Y520 HydrophobicContact CG1-CD2 3.64Å; V518-Y520 HydrophobicContact CG1-CE1 4.4Å; V518-Y520 HydrophobicContact CG1-CE2 3.5Å; V518-Y520 HydrophobicContact CG1-CG 4.16Å; V518-Y520 PolarHBondContact O-N 2.81Å; Y520-T522 PolarHBondContact O-N 2.84Å
521	P	22.6	Very low	24.2	Very low	80 Å²	80	146.8 Å²	146.8	52%	0.519	72%	0.723	S	S	.	*			trans	-59	103.7	166.8	-22.1	33.8	0	0	0	109.5	C523	P521-C523 PolarHBondContact O-N 2.97Å
522	T	22.2	Very low	24.2	Very low	137 Å²	137	142.2 Å²	142.2	84%	0.84	71%	0.712	S	S	*	*	S	Bend	trans	-75.3	68.9	177.6	51.5	0	0	0	0	110.2	Y520	Y520-T522 PolarHBondContact O-N 2.84Å
523	C	23.5	Very low	24.1	Very low	117 Å²	117	143.7 Å²	143.7	79%	0.791	72%	0.717	S	S	*	*			trans	-129.6	17.5	170	-145.6	0	0	0	0	111.4	P521	P521-C523 PolarHBondContact O-N 2.97Å
524	W	26.2	Very low	24.1	Very low	225 Å²	225	143.4 Å²	143.4	85%	0.852	73%	0.727	S	S	*	*			trans	-119.5	59	168	-68.4	74.8	0	0	0	108.4	L526	W524-L526 VanDerWaalsContact C-N 3.27Å; W524-L526 PolarHBondContact O-N 2.87Å
525	E	22.2	Very low	23.9	Very low	184 Å²	184	140 Å²	140	86%	0.86	72%	0.722	S	S	*	*			trans	-75.2	83.2	176.4	-169.5	160.7	-135.1	0	0	108.7	S527	E525-S527 VanDerWaalsContact C-N 3.28Å; E525-S527 PolarHBondContact O-N 3.24Å
526	L	25.6	Very low	24	Very low	159 Å²	159	141.8 Å²	141.8	83%	0.832	72%	0.723	S	S	*	*			trans	-73.4	74.2	-167.9	-163.2	77.9	0	0	0	112.3	W524 R528	W524-L526 VanDerWaalsContact C-N 3.27Å; W524-L526 PolarHBondContact O-N 2.87Å; L526-R528 PolarHBondContact O-N 3.29Å
527	S	22.9	Very low	24	Very low	106 Å²	106	144.4 Å²	144.4	74%	0.741	74%	0.742	S	S	*	*			trans	-74.2	86.8	177.6	62.8	0	0	0	0	111.9	E525	E525-S527 VanDerWaalsContact C-N 3.28Å; E525-S527 PolarHBondContact O-N 3.24Å
528	R	24	Very low	23.8	Very low	236 Å²	236	144.9 Å²	144.9	89%	0.891	76%	0.756	S	S	*	*			trans	34.9	89	160.1	-65	-176.2	178.3	-176	-1.4	116.8	L526	L526-R528 PolarHBondContact O-N 3.29Å
529	M	26.9	Very low	23.9	Very low	148 Å²	148	145 Å²	145	73%	0.729	76%	0.761	S	S	*	*			trans	-128	124.2	131.9	-61.2	-164	76	0	0	105.2
530	E	23.6	Very low	24	Very low	170 Å²	170	146.7 Å²	146.7	79%	0.794	76%	0.764	S	S	*	*				71	124.1	51.6	-160.4	168.4	-110.3	0	0	111.2	S532	E530-S532 PolarHBondContact O-N 3.25Å; E530-S532 PolarHBondContact O-OG 3.32Å
531	E	23.7	Very low	24	Very low	203 Å²	203	145.1 Å²	145.1	95%	0.949	77%	0.769	S	S	*	*	S	Bend	trans	-65.5	102.6	-156.7	-65.4	169	115.3	0	0	112.7
532	S	23.1	Very low	24	Very low	84 Å²	84	146.7 Å²	146.7	59%	0.587	78%	0.782	S	S	*	*			trans	-153.8	120.9	172.1	47.8	0	0	0	0	113.1	E530	E530-S532 PolarHBondContact O-N 3.25Å; E530-S532 PolarHBondContact O-OG 3.32Å
533	V	23.7	Very low	24	Very low	120 Å²	120	145.7 Å²	145.7	73%	0.727	78%	0.78	S	S	*	*			trans	45.9	111	156.6	-169.6	0	0	0	0	117.5	T535	V533-T535 VanDerWaalsContact C-N 3.31Å; V533-T535 HydrophobicContact CG1-CG2 4.15Å; V533-T535 PolarHBondContact O-N 2.97Å
534	V	24.9	Very low	24	Very low	140 Å²	140	146 Å²	146	85%	0.848	78%	0.778	S	S	*	*			trans	-66.3	87.9	162.3	-179	0	0	0	0	110	R536	V534-R536 PolarHBondContact O-N 2.87Å; V534-R536 VanDerWaalsContact O-N 3.17Å
535	T	22.4	Very low	24.1	Very low	123 Å²	123	142.1 Å²	142.1	76%	0.755	77%	0.773	S	S	*	*			trans	-73	101.5	167.9	31.5	0	0	0	0	109.5	V533 S537	V533-T535 VanDerWaalsContact C-N 3.31Å; V533-T535 HydrophobicContact CG1-CG2 4.15Å; V533-T535 PolarHBondContact O-N 2.97Å; T535-S537 PolarHBondContact O-N 3.37Å
536	R	24.2	Very low	24.2	Very low	229 Å²	229	139.3 Å²	139.3	86%	0.864	77%	0.768	S	S	*	*			trans	-46.7	129.2	171	-72.9	173.1	162.4	173.9	-7.7	110.7	V534 S538	V534-R536 PolarHBondContact O-N 2.87Å; V534-R536 VanDerWaalsContact O-N 3.17Å; R536-S538 PolarHBondContact O-N 3.39Å
537	S	24	Very low	24.1	Very low	105 Å²	105	136.9 Å²	136.9	73%	0.734	76%	0.756	S	S	*	*			trans	-57.6	111.4	167.1	-66.6	0	0	0	0	109.7	T535 S539	T535-S537 PolarHBondContact O-N 3.37Å; S537-S539 PolarHBondContact O-N 2.94Å
538	S	22.8	Very low	24.3	Very low	105 Å²	105	137.1 Å²	137.1	73%	0.734	76%	0.758	S	S	*	*	S	Bend	trans	-77.6	23.3	-169.3	48.1	0	0	0	0	114.7	R536	R536-S538 PolarHBondContact O-N 3.39Å
539	S	26.3	Very low	24.3	Very low	100 Å²	100	135.4 Å²	135.4	70%	0.699	75%	0.751	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	10.4	-179.4	54	0	0	0	0	114.4	S537	S537-S539 PolarHBondContact O-N 2.94Å
540	F	26.4	Very low	24.3	Very low	167 Å²	167	138.5 Å²	138.5	73%	0.732	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	9.9	-178.5	-98.1	-80.9	0	0	0	114.5
541	T	22.5	Very low	24.5	Very low	109 Å²	109	135.4 Å²	135.4	67%	0.669	75%	0.752	S	S	*	*			trans	-102.1	128.1	177.8	48.8	0	0	0	0	111.8
542	S	22.7	Very low	24.5	Very low	114 Å²	114	132 Å²	132	80%	0.797	75%	0.746	S	S	*	*			trans	81.5	124.9	-166.3	-36.4	0	0	0	0	112.4
543	C	22.9	Very low	24.7	Very low	116 Å²	116	133.6 Å²	133.6	78%	0.784	75%	0.751	S	S	*	*	S	Bend	cis	-120.1	136.1	17	-63.9	0	0	0	0	114.6
544	T	23.2	Very low	24.8	Very low	124 Å²	124	133.2 Å²	133.2	76%	0.761	75%	0.751	S	S	*	*			trans	57.3	113.6	149.3	52.6	0	0	0	0	121.2
545	L	27.4	Very low	24.9	Very low	143 Å²	143	130.2 Å²	130.2	75%	0.749	75%	0.749	S	S	*	*			trans	67.4	105.7	155.6	-49.8	179	0	0	0	116.1
546	V	25.2	Very low	25.1	Very low	124 Å²	124	132.6 Å²	132.6	75%	0.752	75%	0.751	S	S	*	*			cis	78.8	100.9	43.6	-173.5	0	0	0	0	114.1
547	D	23.3	Very low	25.1	Very low	108 Å²	108	129.1 Å²	129.1	58%	0.578	75%	0.75	S	S	*	*				-139	142.5	104.5	177.8	15.3	0	0	0	108.2	R549	D547-R549 PolarHBondContact OD1-N 3.48Å
548	S	26.6	Very low	25.2	Very low	112 Å²	112	135.7 Å²	135.7	78%	0.783	76%	0.76	S	S	*	*			trans	-105.8	24.8	-175.8	-61.5	0	0	0	0	113.7
549	R	24.7	Very low	25.3	Very low	199 Å²	199	139 Å²	139	75%	0.751	76%	0.764	S	S	*	*			trans	-118.7	13.1	-170.1	-70	-175	167.1	173	0.7	117.4	D547	D547-R549 PolarHBondContact OD1-N 3.48Å
550	R	26	Very low	25.3	Very low	213 Å²	213	143.2 Å²	143.2	80%	0.804	77%	0.765	S	S	*	*			trans	-127.5	55.6	171.1	-77.5	-167.7	167.6	-156.7	-4.3	114.6	T552	R550-T552 PolarHBondContact O-N 2.88Å
551	S	28.4	Very low	25.2	Very low	105 Å²	105	141.2 Å²	141.2	73%	0.734	76%	0.762	S	S	*	*			trans	-85.9	77.3	164.6	176.5	0	0	0	0	110.9	V553	S551-V553 VanDerWaalsContact C-N 3.27Å; S551-V553 PolarHBondContact O-N 3.22Å
552	T	23.8	Very low	25.4	Very low	133 Å²	133	146.8 Å²	146.8	82%	0.816	77%	0.772	S	S	*	*			trans	-89.6	58.9	172.3	54.8	0	0	0	0	111.6	R550	R550-T552 PolarHBondContact O-N 2.88Å
553	V	27	Very low	25.4	Very low	117 Å²	117	149.9 Å²	149.9	71%	0.709	77%	0.774	S	S	*	*			trans	-87	126.3	159.2	179.6	0	0	0	0	106.6	S551 G555	S551-V553 VanDerWaalsContact C-N 3.27Å; S551-V553 PolarHBondContact O-N 3.22Å; V553-G555 PolarHBondContact O-N 3.47Å; V553-G555 VanDerWaalsContact O-N 3.12Å
554	P	27.1	Very low	25.5	Very low	111 Å²	111	151.6 Å²	151.6	72%	0.721	77%	0.773	S	S	*	*			trans	-62.2	114.7	176.2	-22.5	34	0	0	0	110.9	E556	P554-E556 PolarHBondContact O-N 3.02Å
555	G	26	Very low	25.6	Very low	78 Å²	78	152.3 Å²	152.3	80%	0.804	77%	0.771	S	S	*	*			trans	-91.2	83.1	171.4	0	0	0	0	0	109.9	V553	V553-G555 PolarHBondContact O-N 3.47Å; V553-G555 VanDerWaalsContact O-N 3.12Å
556	E	25.7	Very low	25.6	Very low	172 Å²	172	152.7 Å²	152.7	80%	0.804	77%	0.772	S	S	*	*			trans	-123.2	106.8	178.5	-68.9	-174.6	-177.7	0	0	111.4	P554	P554-E556 PolarHBondContact O-N 3.02Å
557	D	25.4	Very low	25.5	Very low	156 Å²	156	153.7 Å²	153.7	83%	0.834	77%	0.773	S	S	*	*			trans	40.7	86	149.1	-59.9	-10.7	0	0	0	118.9	E559	D557-E559 PolarHBondContact O-N 2.78Å
558	Y	25.4	Very low	25.5	Very low	243 Å²	243	153.8 Å²	153.8	95%	0.953	78%	0.781	S	S	*	*			trans	-76.5	49.3	171.9	-122.7	-86.1	0	0	0	113.7
559	E	25.5	Very low	25.3	Very low	174 Å²	174	160.1 Å²	160.1	81%	0.813	79%	0.788	S	S	*	*			trans	-141.6	150.4	174.5	-134.7	180	-153.9	0	0	114.9	D557	D557-E559 PolarHBondContact O-N 2.78Å
560	R	25.2	Very low	25.2	Very low	189 Å²	189	159.2 Å²	159.2	71%	0.713	79%	0.792	S	S	*	*	S	Bend	trans	58.7	72.6	169.7	-164.5	-169.7	-67.2	-143.7	-6.6	117.3
561	N	25.4	Very low	25.1	Very low	126 Å²	126	152.7 Å²	152.7	67%	0.674	78%	0.779	S	S	*	*			trans	-150.5	36.2	152.5	-121	-38.9	0	0	0	116.6	Q563	N561-Q563 PolarHBondContact O-N 3.49Å
562	Y	25.5	Very low	24.9	Very low	226 Å²	226	157 Å²	157	89%	0.886	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.9	8.5	-173.8	-115.8	-81.7	0	0	0	116.7
563	Q	24.6	Very low	25	Very low	178 Å²	178	155.2 Å²	155.2	83%	0.832	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.2	-2	-170	-78.1	-179.9	-21.6	0	0	116.5	N561	N561-Q563 PolarHBondContact O-N 3.49Å
564	M	24.9	Very low	25.1	Very low	153 Å²	153	156.9 Å²	156.9	75%	0.754	78%	0.779	S	S	*	*	S	Bend	trans	-89.6	-4.9	173.6	-71.2	-147.8	73.4	0	0	115	I566	M564-I566 VanDerWaalsContact C-N 3.26Å; M564-I566 PolarHBondContact O-N 2.92Å; M564-I566 VanDerWaalsContact O-N 3.11Å
565	L	25.4	Very low	25.1	Very low	139 Å²	139	154.7 Å²	154.7	73%	0.728	76%	0.762	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	8.1	-169.6	-97.7	166	0	0	0	116.6
566	I	25.8	Very low	25.1	Very low	150 Å²	150	152.9 Å²	152.9	77%	0.769	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-21.6	-174.2	-68.1	175.9	0	0	0	113.5	M564	M564-I566 VanDerWaalsContact C-N 3.26Å; M564-I566 PolarHBondContact O-N 2.92Å; M564-I566 VanDerWaalsContact O-N 3.11Å
567	N	22.7	Very low	25.4	Very low	145 Å²	145	145.3 Å²	145.3	78%	0.775	71%	0.709	S	S	*	*			trans	-101.9	3.8	-170.7	-79.4	-8.9	0	0	0	116.3	R569	N567-R569 PolarHBondContact O-N 2.86Å
568	C	23.9	Very low	26.3	Very low	111 Å²	111	138.5 Å²	138.5	75%	0.75	67%	0.673	S	S	*	*			trans	-77.6	65.4	177.9	-74.1	0	0	0	0	112.6	E570	C568-E570 PolarHBondContact O-N 3.15Å; C568-E570 VanDerWaalsContact O-N 3.09Å
569	R	22.3	Very low	27	Very low	245 Å²	245	127.3 Å²	127.3	93%	0.925	63%	0.63	S	S	*	*			trans	-85.1	43.3	-177.4	-152.9	-175.5	-166.6	-175	5.1	113.3	N567	N567-R569 PolarHBondContact O-N 2.86Å
570	E	23.6	Very low	27.6	Very low	179 Å²	179	119.3 Å²	119.3	84%	0.836	59%	0.593	S	S	*	*	S	Bend	trans	-146.7	124	178.1	-114.1	167.4	-142.4	0	0	110.6	C568 K572	C568-E570 PolarHBondContact O-N 3.15Å; C568-E570 VanDerWaalsContact O-N 3.09Å; E570-K572 PolarHBondContact O-N 3.21Å; E570-K572 VanDerWaalsContact O-N 3.08Å
571	S	24.2	Very low	28.2	Very low	76 Å²	76	111.7 Å²	111.7	53%	0.531	57%	0.569	S	S	.	*			trans	-80	89.6	-176.9	54.3	0	0	0	0	111.2	P573 N649	S571-P573 WeakPolarHBondContact O-CD 3.03Å; S571-N649 PolarHBondContact OG-ND2 3.21Å; S571-N649 PolarHBondContact OG-OD1 3.39Å
572	K	23.9	Very low	28.9	Very low	197 Å²	197	106.1 Å²	106.1	86%	0.857	54%	0.538	S	S	*	.			trans	-56	123.7	168.1	-72.2	-177.2	177.9	177.7	0	109.6	E570	E570-K572 PolarHBondContact O-N 3.21Å; E570-K572 VanDerWaalsContact O-N 3.08Å
573	P	26.4	Very low	29.6	Very low	94 Å²	94	95.3 Å²	95.3	61%	0.61	50%	0.496	S	S	*	.			trans	-68.9	151.7	174	29.2	-34.3	0	0	0	110.9	S571 N575	S571-P573 WeakPolarHBondContact O-CD 3.03Å; P573-N575 PolarHBondContact O-N 3.31Å
574	L	27.9	Very low	30.3	Very low	152 Å²	152	90 Å²	90	80%	0.796	47%	0.473	S	S	*	.			trans	-72.1	84.3	177.7	-78.8	153.9	0	0	0	110.9
575	N	28.1	Very low	30.9	Very low	66 Å²	66	85.4 Å²	85.4	35%	0.353	46%	0.456	S	S	.	.			trans	-87.1	106.3	169.5	-68.2	-1.9	0	0	0	109.4	P573 S671 T674	P573-N575 PolarHBondContact O-N 3.31Å; N575-S671 PolarHBondContact ND2-OG 3.23Å; N575-T674 VanDerWaalsContact CB-OG1 3.26Å; N575-T674 WeakPolarHBondContact CB-OG1 3.39Å
576	G	26.2	Very low	31.3	Very low	39 Å²	39	79.7 Å²	79.7	40%	0.402	43%	0.427	S	S	.	.			trans	-167.6	108	179.1	0	0	0	0	0	114.3	S581	G576-S581 PolarHBondContact O-OG 3.28Å
577	S	31.5	Very low	31.7	Very low	14 Å²	14	73.5 Å²	73.5	10%	0.098	40%	0.397	C	S	.	.			trans	53.3	91.1	170.6	64.8	0	0	0	0	116.2	F498 S581	F498-S577 WeakPolarHBondContact CD2-OG 3.16Å; S577-S581 WeakPolarHBondContact O-CB 3.49Å; S577-S581 PolarHBondContact O-N 3.27Å; S577-S581 PolarHBondContact O-OG 3.14Å
578	C	43.4	Very low	32.2	Very low	12 Å²	12	74.5 Å²	74.5	8%	0.081	39%	0.391	C	S	.	.	H	α-helix	trans	-71.6	-36.6	-176.7	-174.5	0	0	0	0	113.3	Y582 M663 L664 D679	C578-Y582 WeakPolarHBondContact O-CA 3.36Å; C578-Y582 WeakPolarHBondContact O-CB 3.48Å; C578-Y582 PolarHBondContact O-N 2.93Å; C578-M663 WeakPolarHBondContact SG-CE 3.16Å; C578-L664 HydrophobicContact CB-CD2 4.17Å; C578-L664 VanDerWaalsContact SG-CD2 3.58Å; C578-D679 WeakPolarHBondContact CA-OD1 3.47Å; C578-D679 HydrophobicContact CB-CB 4.26Å; C578-D679 VanDerWaalsContact CB-CG 3.41Å; C578-D679 VanDerWaalsContact CB-OD1 3.26Å; C578-D679 WeakPolarHBondContact CB-OD1 3.36Å; C578-D679 PolarHBondContact N-OD1 2.86Å; C578-D679 PolarHBondContact N-OD2 2.71Å
579	L	41.3	Very low	32.5	Very low	8 Å²	8	71.4 Å²	71.4	4%	0.042	37%	0.367	C	S	.	.	H	α-helix	trans	-72.3	-36.5	-177	-169.1	133.2	0	0	0	114.3	V473 Y582 L583 V678 D679 L682 F947	V473-L579 HydrophobicContact CG1-CD2 3.99Å; V473-L579 HydrophobicContact CG2-CD2 3.95Å; L579-Y582 WeakPolarHBondContact O-CB 3.34Å; L579-Y582 PolarHBondContact O-N 3.19Å; L579-L583 HydrophobicContact CD2-CD1 4.29Å; L579-L583 PolarHBondContact O-N 3.15Å; L579-L583 VanDerWaalsContact O-N 3.11Å; L579-V678 HydrophobicContact CB-CG1 3.8Å; L579-V678 HydrophobicContact CD1-CG1 3.77Å; L579-V678 HydrophobicContact CD2-CG1 4.2Å; L579-V678 HydrophobicContact CG-CG1 4.12Å; L579-D679 PolarHBondContact N-OD1 3.12Å; L579-L682 HydrophobicContact CD1-CB 4.29Å; L579-L682 HydrophobicContact CD1-CD1 4.31Å; L579-L682 HydrophobicContact CD1-CD2 4.12Å; L579-L682 HydrophobicContact CD1-CG 4.49Å; L579-F947 HydrophobicContact CD1-CD1 4.24Å; L579-F947 HydrophobicContact CD1-CE1 3.76Å; L579-F947 HydrophobicContact CG-CE1 4.42Å
580	V	37.9	Very low	32.9	Very low	6 Å²	6	60 Å²	60	4%	0.036	32%	0.324	C	S	.	.	H	α-helix	trans	-73.4	-43.6	175.5	-179.5	0	0	0	0	109.9	L495 F498 Y582 L583 L584	L495-V580 HydrophobicContact CD2-CG1 4.28Å; L495-V580 HydrophobicContact CD2-CG2 3.74Å; F498-V580 HydrophobicContact CB-CG1 4.43Å; F498-V580 HydrophobicContact CD1-CG1 3.63Å; F498-V580 HydrophobicContact CD2-CB 4.33Å; F498-V580 HydrophobicContact CD2-CG1 3.97Å; F498-V580 HydrophobicContact CE1-CG1 3.86Å; F498-V580 HydrophobicContact CE2-CG1 4.16Å; F498-V580 HydrophobicContact CG-CB 4.32Å; F498-V580 HydrophobicContact CG-CG1 3.7Å; F498-V580 HydrophobicContact CZ-CG1 4.13Å; V580-Y582 PolarHBondContact O-N 3.17Å; V580-L583 PolarHBondContact O-N 3.01Å; V580-L584 HydrophobicContact CG1-CD1 4.03Å; V580-L584 WeakPolarHBondContact O-CB 3.36Å; V580-L584 PolarHBondContact O-N 2.94Å
581	S	36.4	Very low	33.2	Very low	30 Å²	30	53.4 Å²	53.4	21%	0.21	30%	0.297	C	S	.	.	H	α-helix	trans	-61	-30.7	170.2	-59	0	0	0	0	112.7	G576 S577 S585	G576-S581 PolarHBondContact O-OG 3.28Å; S577-S581 WeakPolarHBondContact O-CB 3.49Å; S577-S581 PolarHBondContact O-N 3.27Å; S577-S581 PolarHBondContact O-OG 3.14Å; S581-S585 WeakPolarHBondContact O-CA 3.46Å; S581-S585 WeakPolarHBondContact O-CB 3.19Å; S581-S585 PolarHBondContact O-N 3.42Å; S581-S585 PolarHBondContact O-OG 3.22Å
582	Y	40.3	Very low	33.3	Very low	8 Å²	8	50.3 Å²	50.3	3%	0.031	28%	0.275	C	S	.	.	H	α-helix	trans	-65.3	-56.3	173.9	163.8	-87.5	0	0	0	110.6	C578 L579 V580 L584 S585 C586 L660 S945 F947	C578-Y582 WeakPolarHBondContact O-CA 3.36Å; C578-Y582 WeakPolarHBondContact O-CB 3.48Å; C578-Y582 PolarHBondContact O-N 2.93Å; L579-Y582 WeakPolarHBondContact O-CB 3.34Å; L579-Y582 PolarHBondContact O-N 3.19Å; V580-Y582 PolarHBondContact O-N 3.17Å; Y582-L584 VanDerWaalsContact C-N 3.29Å; Y582-L584 PolarHBondContact O-N 3.02Å; Y582-S585 PolarHBondContact O-N 2.92Å; Y582-C586 WeakPolarHBondContact O-CB 3.41Å; Y582-C586 PolarHBondContact O-N 2.9Å; Y582-C586 PolarHBondContact O-SG 2.61Å; Y582-L660 HydrophobicContact CD2-CD1 3.54Å; Y582-L660 HydrophobicContact CD2-CD2 3.58Å; Y582-L660 HydrophobicContact CD2-CG 3.65Å; Y582-L660 HydrophobicContact CE2-CD1 3.46Å; Y582-L660 VanDerWaalsContact CE2-CD1 3.46Å; Y582-L660 HydrophobicContact CE2-CD2 3.44Å; Y582-L660 VanDerWaalsContact CE2-CD2 3.44Å; Y582-L660 HydrophobicContact CE2-CG 3.82Å; Y582-S945 WeakPolarHBondContact OH-CB 3.49Å; Y582-S945 PolarHBondContact OH-OG 3.09Å; Y582-F947 HydrophobicContact CD1-CE1 4.21Å; Y582-F947 AromaticContact CD1-CZ 3.95Å; Y582-F947 HydrophobicContact CD1-CZ 3.95Å; Y582-F947 AromaticContact CE1-CE1 3.88Å; Y582-F947 HydrophobicContact CE1-CE1 3.88Å; Y582-F947 HydrophobicContact CE1-CE2 4.35Å; Y582-F947 AromaticContact CE1-CZ 3.41Å; Y582-F947 HydrophobicContact CE1-CZ 3.41Å; Y582-F947 VanDerWaalsContact CE1-CZ 3.41Å
583	L	40.7	Very low	33.4	Very low	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.3	-38.5	-177.6	-68.4	172.5	0	0	0	111.3	L469 V473 I476 L579 V580 S587 F947	L469-L583 HydrophobicContact CD1-CB 3.76Å; L469-L583 HydrophobicContact CD1-CD1 3.63Å; L469-L583 HydrophobicContact CD1-CG 4.25Å; L469-L583 HydrophobicContact CD2-CB 4.38Å; L469-L583 HydrophobicContact CG-CD1 4.41Å; V473-L583 HydrophobicContact CG2-CD1 3.65Å; I476-L583 HydrophobicContact CD1-CD1 4.49Å; L579-L583 HydrophobicContact CD2-CD1 4.29Å; L579-L583 PolarHBondContact O-N 3.15Å; L579-L583 VanDerWaalsContact O-N 3.11Å; V580-L583 PolarHBondContact O-N 3.01Å; L583-S587 WeakPolarHBondContact O-CB 2.93Å; L583-S587 PolarHBondContact O-N 3.08Å; L583-S587 PolarHBondContact O-OG 3.23Å; L583-F947 HydrophobicContact CD2-CZ 4.07Å
584	L	39.2	Very low	33.3	Very low	65 Å²	65	47.8 Å²	47.8	34%	0.34	26%	0.26	S	S	.	.	H	α-helix	trans	-74.5	-31	176.1	-72.7	167.4	0	0	0	113.2	L469 F498 V580 Y582 S587 Y588	L469-L584 HydrophobicContact CD2-CD1 3.91Å; L469-L584 HydrophobicContact CD2-CD2 3.87Å; L469-L584 HydrophobicContact CD2-CG 3.6Å; F498-L584 HydrophobicContact CD1-CD1 4.43Å; F498-L584 HydrophobicContact CE1-CD1 3.33Å; F498-L584 HydrophobicContact CE2-CD1 4.37Å; F498-L584 HydrophobicContact CZ-CD1 3.29Å; V580-L584 HydrophobicContact CG1-CD1 4.03Å; V580-L584 WeakPolarHBondContact O-CB 3.36Å; V580-L584 PolarHBondContact O-N 2.94Å; Y582-L584 VanDerWaalsContact C-N 3.29Å; Y582-L584 PolarHBondContact O-N 3.02Å; L584-S587 PolarHBondContact O-N 3.27Å; L584-Y588 WeakPolarHBondContact O-CB 3.45Å; L584-Y588 PolarHBondContact O-N 3.35Å
585	S	37	Very low	33.2	Very low	57 Å²	57	44.4 Å²	44.4	40%	0.399	25%	0.254	S	S	.	.	H	α-helix	trans	-71.3	-37.5	170.9	-62.4	0	0	0	0	112	S581 Y582 S587 Y588 M589	S581-S585 WeakPolarHBondContact O-CA 3.46Å; S581-S585 WeakPolarHBondContact O-CB 3.19Å; S581-S585 PolarHBondContact O-N 3.42Å; S581-S585 PolarHBondContact O-OG 3.22Å; Y582-S585 PolarHBondContact O-N 2.92Å; S585-S587 VanDerWaalsContact C-N 3.29Å; S585-S587 PolarHBondContact O-N 3.09Å; S585-Y588 PolarHBondContact O-N 3.47Å; S585-M589 WeakPolarHBondContact O-CA 3.37Å; S585-M589 VanDerWaalsContact O-CB 3.3Å; S585-M589 WeakPolarHBondContact O-CB 3.18Å; S585-M589 PolarHBondContact O-N 3.43Å
586	C	35.5	Very low	32.9	Very low	20 Å²	20	45.8 Å²	45.8	14%	0.135	27%	0.269	C	S	.	.	H	α-helix	trans	-63.1	-37.4	171.9	-70.5	0	0	0	0	111.5	Y582 G590	Y582-C586 WeakPolarHBondContact O-CB 3.41Å; Y582-C586 PolarHBondContact O-N 2.9Å; Y582-C586 PolarHBondContact O-SG 2.61Å; C586-G590 WeakPolarHBondContact O-CA 3.39Å; C586-G590 PolarHBondContact O-N 3.41Å
587	S	34.2	Very low	32.8	Very low	19 Å²	19	49.3 Å²	49.3	13%	0.133	28%	0.275	C	S	.	.	H	α-helix	trans	-67.9	-50	172.3	-50.6	0	0	0	0	112.4	L583 L584 S585 W772 H774	L583-S587 WeakPolarHBondContact O-CB 2.93Å; L583-S587 PolarHBondContact O-N 3.08Å; L583-S587 PolarHBondContact O-OG 3.23Å; L584-S587 PolarHBondContact O-N 3.27Å; S585-S587 VanDerWaalsContact C-N 3.29Å; S585-S587 PolarHBondContact O-N 3.09Å; S587-W772 PolarHBondContact O-NE1 3.15Å; S587-W772 VanDerWaalsContact O-NE1 3.1Å; S587-H774 PolarHBondContact OG-NE2 3.13Å
588	Y	31.5	Very low	32.5	Very low	167 Å²	167	54.6 Å²	54.6	66%	0.655	31%	0.309	S	S	*	.	H	α-helix	trans	-85.1	-28.9	-167.3	-170.7	-103.1	0	0	0	113.3	L584 S585 Q940	L584-Y588 WeakPolarHBondContact O-CB 3.45Å; L584-Y588 PolarHBondContact O-N 3.35Å; S585-Y588 PolarHBondContact O-N 3.47Å; Y588-Q940 PolarHBondContact O-NE2 2.81Å
589	M	31.8	Very low	31.7	Very low	46 Å²	46	57.7 Å²	57.7	23%	0.227	32%	0.323	C	S	.	.	H	α-helix	trans	-118.9	6.1	-174	-55.5	-160.5	74	0	0	114.7	S585 T591 S592	S585-M589 WeakPolarHBondContact O-CA 3.37Å; S585-M589 VanDerWaalsContact O-CB 3.3Å; S585-M589 WeakPolarHBondContact O-CB 3.18Å; S585-M589 PolarHBondContact O-N 3.43Å; M589-T591 PolarHBondContact O-N 3.42Å; M589-S592 WeakPolarHBondContact O-CB 3.14Å; M589-S592 PolarHBondContact O-N 2.94Å; M589-S592 VanDerWaalsContact O-N 3.15Å; M589-S592 PolarHBondContact O-OG 3.33Å
590	G	31.1	Very low	30.9	Very low	4 Å²	4	67.7 Å²	67.7	4%	0.041	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-30.3	123.9	-166.3	0	0	0	0	0	114.6	C586 S592 Q940	C586-G590 WeakPolarHBondContact O-CA 3.39Å; C586-G590 PolarHBondContact O-N 3.41Å; G590-S592 PolarHBondContact O-N 3.17Å; G590-Q940 WeakPolarHBondContact O-CA 3.44Å; G590-Q940 WeakPolarHBondContact O-CB 3.49Å; G590-Q940 VanDerWaalsContact O-CG 3.25Å; G590-Q940 WeakPolarHBondContact O-CG 3.5Å
591	T	29.5	Very low	30.2	Very low	42 Å²	42	74.5 Å²	74.5	26%	0.258	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.9	13.6	176.3	54	0	0	0	0	119.3	M589 F593 F686 P688 A939 Q940 L941	M589-T591 PolarHBondContact O-N 3.42Å; T591-F593 PolarHBondContact O-N 3.49Å; T591-F686 HydrophobicContact CG2-CE1 3.94Å; T591-P688 HydrophobicContact CG2-CB 3.47Å; T591-P688 VanDerWaalsContact CG2-CB 3.47Å; T591-P688 HydrophobicContact CG2-CG 4.13Å; T591-A939 CarbonylContact C-O 3.58Å; T591-A939 WeakPolarHBondContact CB-O 3.31Å; T591-A939 PolarHBondContact OG1-O 3.1Å; T591-Q940 WeakPolarHBondContact OG1-CA 3.38Å; T591-L941 HydrophobicContact CG2-CB 4.15Å; T591-L941 PolarHBondContact OG1-N 3.03Å
592	S	26.4	Very low	29.7	Very low	11 Å²	11	80.9 Å²	80.9	8%	0.077	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	42.7	-165.6	63.1	0	0	0	0	115.3	M589 G590	M589-S592 WeakPolarHBondContact O-CB 3.14Å; M589-S592 PolarHBondContact O-N 2.94Å; M589-S592 VanDerWaalsContact O-N 3.15Å; M589-S592 PolarHBondContact O-OG 3.33Å; G590-S592 PolarHBondContact O-N 3.17Å
593	F	26.2	Very low	28.9	Very low	109 Å²	109	87.1 Å²	87.1	48%	0.478	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-158.3	51.3	170.1	-110.2	-64.3	0	0	0	115.4	T591	T591-F593 PolarHBondContact O-N 3.49Å
594	L	23.6	Very low	28.1	Very low	129 Å²	129	94 Å²	94	68%	0.675	50%	0.5	S	S	*	.			trans	-128.4	61.5	165.1	-77.9	-179.6	0	0	0	113
595	A	24.7	Very low	27.4	Very low	80 Å²	80	98.1 Å²	98.1	66%	0.661	52%	0.522	S	S	*	.			trans	-148.2	83	168.2	0	0	0	0	0	111.3	H597	A595-H597 PolarHBondContact O-N 3.46Å; A595-H597 VanDerWaalsContact O-N 3.1Å
596	S	23.4	Very low	26.8	Very low	95 Å²	95	100.6 Å²	100.6	66%	0.664	54%	0.539	S	S	*	.			trans	-69.7	98.7	164.6	51.6	0	0	0	0	109.3	P598	S596-P598 WeakPolarHBondContact O-CD 3.35Å
597	H	24.3	Very low	26.3	Very low	113 Å²	113	104.9 Å²	104.9	52%	0.523	57%	0.569	S	S	.	*			trans	-62.6	114.9	177.4	-88.7	-30.9	0	0	0	111.5	A595 I599 C878	A595-H597 PolarHBondContact O-N 3.46Å; A595-H597 VanDerWaalsContact O-N 3.1Å; H597-I599 HydrophobicContact CB-CD1 4.15Å; H597-I599 HydrophobicContact CB-CG1 4.2Å; H597-I599 PolarHBondContact O-N 2.93Å; H597-C878 PolarHBondContact NE2-SG 2.66Å; H597-C878 VanDerWaalsContact NE2-SG 3.43Å
598	P	24.2	Very low	25.8	Very low	125 Å²	125	110.1 Å²	110.1	81%	0.812	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	60.9	178.2	36.6	-33.6	0	0	0	110	S596	S596-P598 WeakPolarHBondContact O-CD 3.35Å
599	I	25.8	Very low	25.4	Very low	77 Å²	77	107.6 Å²	107.6	40%	0.395	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-112.5	-8.9	-172.2	-62.7	-179.6	0	0	0	112.3	H597	H597-I599 HydrophobicContact CB-CD1 4.15Å; H597-I599 HydrophobicContact CB-CG1 4.2Å; H597-I599 PolarHBondContact O-N 2.93Å
600	Y	25.1	Very low	25	Very low	219 Å²	219	111.5 Å²	111.5	86%	0.859	64%	0.638	S	S	*	*	S	Bend	trans	-128.3	39.6	-179.8	-73.8	-73.3	0	0	0	114.8
601	N	24.5	Very low	24.6	Very low	149 Å²	149	120.1 Å²	120.1	80%	0.797	68%	0.683	S	S	*	*			trans	-157.7	66.3	147.3	-138.8	-3.1	0	0	0	113.2
602	L	24.5	Very low	24.3	Very low	163 Å²	163	128.9 Å²	128.9	85%	0.853	71%	0.711	S	S	*	*			trans	-101.5	73	169	-167.5	76.1	0	0	0	110.2
603	N	23	Very low	24.1	Very low	140 Å²	140	134 Å²	134	75%	0.749	74%	0.744	S	S	*	*			trans	-146.7	136	164.1	-92.1	-44.3	0	0	0	109.6
604	N	24.3	Very low	24	Very low	145 Å²	145	134.9 Å²	134.9	78%	0.775	76%	0.764	S	S	*	*	S	Bend	trans	74.7	109.3	171.3	-63.7	-15.4	0	0	0	120.2
605	L	25	Very low	24	Very low	151 Å²	151	133.4 Å²	133.4	79%	0.791	76%	0.76	S	S	*	*			trans	69.7	91.2	144.6	-73.7	92.3	0	0	0	121.3
606	S	23.7	Very low	23.9	Very low	109 Å²	109	132.8 Å²	132.8	76%	0.762	75%	0.751	S	S	*	*				49.7	104.8	118.3	63.8	0	0	0	0	121.2
607	S	25.1	Very low	23.8	Very low	110 Å²	110	131.7 Å²	131.7	77%	0.769	74%	0.743	S	S	*	*			trans	-159.6	133.2	137.8	-170	0	0	0	0	111.5
608	P	25.3	Very low	23.7	Very low	128 Å²	128	130.2 Å²	130.2	83%	0.831	74%	0.744	S	S	*	*			trans	-99.8	79.3	-176.5	37.3	-32.9	0	0	0	113.1
609	C	22.1	Very low	23.5	Very low	114 Å²	114	133.3 Å²	133.3	77%	0.77	74%	0.741	S	S	*	*			trans	-152.4	112	173.5	-102.5	0	0	0	0	113
610	C	24.2	Very low	23.4	Very low	128 Å²	128	138.7 Å²	138.7	87%	0.865	76%	0.762	S	S	*	*			trans	167.8	107.9	133.1	-94.7	0	0	0	0	112.3
611	L	22.1	Very low	23.2	Very low	186 Å²	186	134.3 Å²	134.3	97%	0.974	76%	0.758	S	S	*	*			trans	-86.8	99.7	163.1	-80.3	152.2	0	0	0	109.3
612	R	22.5	Very low	23.1	Very low	225 Å²	225	135.1 Å²	135.1	85%	0.849	76%	0.758	S	S	*	*			trans	-149.1	149.6	165.9	-97	-170.5	174	-172.1	-3.3	110.8
613	P	23.4	Very low	23	Very low	118 Å²	118	133.1 Å²	133.1	77%	0.766	75%	0.749	S	S	*	*			trans	-70.9	146.2	175.5	31	-34.8	0	0	0	111.2	T615	P613-T615 PolarHBondContact O-N 2.93Å
614	S	22.9	Very low	23	Very low	128 Å²	128	137.7 Å²	137.7	90%	0.895	76%	0.755	S	S	*	*			trans	-82.7	76.4	-164.6	-48.4	0	0	0	0	114.9
615	T	24	Very low	23.1	Very low	99 Å²	99	135.8 Å²	135.8	61%	0.607	75%	0.749	S	S	*	*			trans	-88.8	105	155.3	47.5	0	0	0	0	109.8	P613 C617 E966	P613-T615 PolarHBondContact O-N 2.93Å; T615-C617 VanDerWaalsContact C-N 3.31Å; T615-C617 PolarHBondContact O-N 3.35Å; T615-E966 PolarHBondContact OG1-OE2 2.59Å
616	S	22	Very low	23.1	Very low	67 Å²	67	136.2 Å²	136.2	47%	0.469	75%	0.752	S	S	.	*			trans	-80.6	73.6	179.6	179	0	0	0	0	111.3	C618	S616-C618 PolarHBondContact O-N 2.74Å
617	C	22	Very low	23.2	Very low	72 Å²	72	139.1 Å²	139.1	49%	0.486	75%	0.754	S	S	.	*			trans	-69.6	126.3	174.4	-163.1	0	0	0	0	110.9	T615 Y619	T615-C617 VanDerWaalsContact C-N 3.31Å; T615-C617 PolarHBondContact O-N 3.35Å; C617-Y619 PolarHBondContact O-N 3.11Å
618	C	22.3	Very low	23.2	Very low	81 Å²	81	141.8 Å²	141.8	55%	0.547	76%	0.758	S	S	.	*			trans	-89.5	101.2	-177	-72.7	0	0	0	0	111.4	S616 F620	S616-C618 PolarHBondContact O-N 2.74Å; C618-F620 PolarHBondContact O-N 2.99Å
619	Y	20.2	Very low	23.2	Very low	190 Å²	190	140 Å²	140	75%	0.745	75%	0.749	S	S	*	*			trans	-60.3	118.2	170.4	-93.1	-108.3	0	0	0	111.4	C617	C617-Y619 PolarHBondContact O-N 3.11Å
620	F	22.8	Very low	23.5	Very low	190 Å²	190	140.5 Å²	140.5	83%	0.833	75%	0.75	S	S	*	*			trans	-108.5	122.1	155	-88.3	-83.5	0	0	0	109.1	C618 M622	C618-F620 PolarHBondContact O-N 2.99Å; F620-M622 PolarHBondContact O-N 3.47Å; F620-M622 VanDerWaalsContact O-N 3.1Å
621	V	20.8	Very low	23.5	Very low	128 Å²	128	144.4 Å²	144.4	78%	0.776	75%	0.748	S	S	*	*			trans	-67.3	108.9	171.7	176.6	0	0	0	0	108	D623	V621-D623 PolarHBondContact O-N 3.42Å; V621-D623 VanDerWaalsContact O-N 3.13Å
622	M	22.3	Very low	23.8	Very low	165 Å²	165	142.6 Å²	142.6	81%	0.813	74%	0.739	S	S	*	*			trans	-62.2	109	160.7	-90.5	-73.1	-161.6	0	0	107.9	F620 R624	F620-M622 PolarHBondContact O-N 3.47Å; F620-M622 VanDerWaalsContact O-N 3.1Å; M622-R624 VanDerWaalsContact C-N 3.32Å; M622-R624 PolarHBondContact O-N 3.07Å
623	D	23.8	Very low	23.9	Very low	121 Å²	121	138.5 Å²	138.5	65%	0.647	74%	0.739	S	S	*	*			trans	-73.2	83.9	-173	-160	-12	0	0	0	111.3	V621 T625	V621-D623 PolarHBondContact O-N 3.42Å; V621-D623 VanDerWaalsContact O-N 3.13Å; D623-T625 VanDerWaalsContact CG-OG1 3.26Å; D623-T625 PolarHBondContact O-N 2.87Å; D623-T625 WeakPolarHBondContact OD1-CB 3.25Å; D623-T625 WeakPolarHBondContact OD1-CG2 3.44Å; D623-T625 PolarHBondContact OD1-OG1 3.05Å
624	R	23.2	Very low	24.1	Very low	236 Å²	236	138.7 Å²	138.7	89%	0.891	74%	0.741	S	S	*	*			trans	-76.9	49.4	176.3	-77.5	-172.6	167.5	-170.9	-1.6	111.9	M622	M622-R624 VanDerWaalsContact C-N 3.32Å; M622-R624 PolarHBondContact O-N 3.07Å
625	T	25.2	Very low	24.3	Very low	105 Å²	105	136.3 Å²	136.3	64%	0.644	73%	0.729	S	S	*	*			trans	-104.4	57.1	179.7	50.9	0	0	0	0	112.9	D623	D623-T625 VanDerWaalsContact CG-OG1 3.26Å; D623-T625 PolarHBondContact O-N 2.87Å; D623-T625 WeakPolarHBondContact OD1-CB 3.25Å; D623-T625 WeakPolarHBondContact OD1-CG2 3.44Å; D623-T625 PolarHBondContact OD1-OG1 3.05Å
626	N	25.4	Very low	24.3	Very low	160 Å²	160	139 Å²	139	86%	0.856	74%	0.738	S	S	*	*	S	Bend	trans	-136.8	37.8	161	-118.7	-25.5	0	0	0	112.9
627	Q	25.9	Very low	24.4	Very low	171 Å²	171	146.5 Å²	146.5	80%	0.799	76%	0.758	S	S	*	*	S	Bend	trans	-157.8	118.1	159.6	-117.6	159.2	70.9	0	0	111.9
628	I	25.2	Very low	24.5	Very low	165 Å²	165	150.8 Å²	150.8	85%	0.846	77%	0.77	S	S	*	*			trans	76.3	146.5	163.1	-52.2	169.8	0	0	0	115.8
629	S	24.2	Very low	24.5	Very low	92 Å²	92	152 Å²	152	64%	0.643	78%	0.777	S	S	*	*			trans	-88.2	147.9	-160.4	54	0	0	0	0	116
630	P	28.1	Very low	24.7	Very low	123 Å²	123	150 Å²	150	80%	0.799	78%	0.779	S	S	*	*			trans	-85.2	152.9	163.2	35.7	-33.3	0	0	0	112.4
631	Y	25.6	Very low	24.8	Very low	211 Å²	211	149.4 Å²	149.4	83%	0.827	78%	0.784	S	S	*	*			trans	-119.9	140.8	160.3	-104.7	-85.1	0	0	0	109.4
632	N	27.1	Very low	24.9	Very low	147 Å²	147	150.6 Å²	150.6	79%	0.786	78%	0.784	S	S	*	*			trans	69.4	84.2	165.4	-54.8	-16.3	0	0	0	119
633	T	24.7	Very low	25	Very low	139 Å²	139	150.8 Å²	150.8	85%	0.853	78%	0.783	S	S	*	*			trans	-61.6	167.1	138.6	17	0	0	0	0	111
634	P	29.3	Very low	24.9	Very low	123 Å²	123	150.8 Å²	150.8	80%	0.799	79%	0.79	S	S	*	*			cis	-134.9	-173.1	39.2	42.7	-22.3	0	0	0	113.9
635	A	25.9	Very low	25	Very low	78 Å²	78	145.7 Å²	145.7	65%	0.645	78%	0.779	S	S	*	*			cis	-152.7	140.8	20.6	0	0	0	0	0	116.4
636	I	24.3	Very low	25.1	Very low	155 Å²	155	146.3 Å²	146.3	80%	0.795	79%	0.788	S	S	*	*			trans	48.5	102.9	139	-50.7	165.8	0	0	0	118.5
637	Y	23.5	Very low	25	Very low	225 Å²	225	144.6 Å²	144.6	88%	0.882	78%	0.778	S	S	*	*			trans	-143.5	130	132.3	-101.2	-79.7	0	0	0	110.2
638	H	23.8	Very low	25.1	Very low	161 Å²	161	141.1 Å²	141.1	75%	0.745	77%	0.773	S	S	*	*			trans	15	106.2	176	-92.2	-79.6	0	0	0	121.1	N640	H638-N640 PolarHBondContact O-N 3.03Å
639	P	23.7	Very low	25.3	Very low	107 Å²	107	138 Å²	138	70%	0.695	76%	0.758	S	S	*	*			trans	-82.2	108.1	160.6	32.6	-29.7	0	0	0	110.7
640	N	23.2	Very low	25.3	Very low	148 Å²	148	141 Å²	141	79%	0.791	76%	0.763	S	S	*	*			trans	-153.4	22.1	167.1	-117.5	-7.7	0	0	0	113.9	H638	H638-N640 PolarHBondContact O-N 3.03Å
641	L	25.9	Very low	25.2	Very low	177 Å²	177	140.2 Å²	140.2	93%	0.927	75%	0.753	S	S	*	*			trans	-129.1	55.7	177.2	-77.7	170.7	0	0	0	110.7
642	I	22.7	Very low	25.4	Very low	153 Å²	153	138.6 Å²	138.6	79%	0.785	75%	0.745	S	S	*	*			trans	-123.4	75.1	170.9	-50.5	-179.1	0	0	0	109.3
643	Q	23.6	Very low	25.3	Very low	170 Å²	170	139 Å²	139	79%	0.794	74%	0.736	S	S	*	*			trans	-136.7	123.8	149.3	-77.5	-165.3	-13.5	0	0	108	I645	Q643-I645 PolarHBondContact O-N 2.84Å; Q643-I645 VanDerWaalsContact O-N 3.08Å
644	P	22.7	Very low	25.4	Very low	120 Å²	120	141 Å²	141	78%	0.779	73%	0.728	S	S	*	*			trans	-71.2	104.1	170.8	29.4	-31.5	0	0	0	108	S646	P644-S646 VanDerWaalsContact C-N 3.3Å; P644-S646 PolarHBondContact O-N 2.74Å
645	I	26.2	Very low	25.2	Very low	129 Å²	129	136.5 Å²	136.5	66%	0.662	70%	0.704	S	S	*	*			trans	-71.2	91.8	175.1	-59.1	176.8	0	0	0	107.7	Q643 N647	Q643-I645 PolarHBondContact O-N 2.84Å; Q643-I645 VanDerWaalsContact O-N 3.08Å; I645-N647 HydrophobicContact CG2-CB 3.99Å; I645-N647 PolarHBondContact O-N 3Å
646	S	25.5	Very low	25.2	Very low	119 Å²	119	135.5 Å²	135.5	83%	0.832	69%	0.691	S	S	*	*	S	Bend	trans	-69	37	171.6	51.2	0	0	0	0	112.6	P644	P644-S646 VanDerWaalsContact C-N 3.3Å; P644-S646 PolarHBondContact O-N 2.74Å
647	N	24.7	Very low	25.4	Very low	123 Å²	123	130.5 Å²	130.5	66%	0.658	67%	0.673	S	S	*	*			trans	-156.1	36.2	-172.1	-128.9	-25	0	0	0	110.1	I645 N649	I645-N647 HydrophobicContact CG2-CB 3.99Å; I645-N647 PolarHBondContact O-N 3Å; N647-N649 PolarHBondContact O-N 3.45Å
648	S	28.4	Very low	25.7	Very low	98 Å²	98	124 Å²	124	69%	0.685	65%	0.654	S	S	*	*			trans	-72.4	70.5	178	51.3	0	0	0	0	111.3	M650	S648-M650 PolarHBondContact O-N 2.71Å
649	N	27.5	Very low	26.1	Very low	99 Å²	99	120 Å²	120	53%	0.529	64%	0.638	S	S	.	*			trans	-52.2	104.7	167.1	-100.4	-40.4	0	0	0	108.9	S571 N647 N651	S571-N649 PolarHBondContact OG-ND2 3.21Å; S571-N649 PolarHBondContact OG-OD1 3.39Å; N647-N649 PolarHBondContact O-N 3.45Å; N649-N651 PolarHBondContact O-N 2.76Å
650	M	25.3	Very low	26.5	Very low	155 Å²	155	116.2 Å²	116.2	76%	0.764	61%	0.612	S	S	*	*			trans	-59	101.3	-177	-88.2	-70.5	-169.5	0	0	109.5	S648 W652	S648-M650 PolarHBondContact O-N 2.71Å; M650-W652 VanDerWaalsContact C-N 3.26Å; M650-W652 PolarHBondContact O-N 3.26Å
651	N	26.1	Very low	27	Very low	108 Å²	108	110.4 Å²	110.4	58%	0.578	58%	0.581	S	S	*	*			trans	-82.2	78.9	-171	-157.9	-22.6	0	0	0	109.5	N649 R653 R654	N649-N651 PolarHBondContact O-N 2.76Å; N651-R653 PolarHBondContact O-N 2.78Å; N651-R654 PolarHBondContact O-N 2.79Å
652	W	28.7	Very low	27.3	Very low	177 Å²	177	105.9 Å²	105.9	67%	0.67	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-47	-16	-177.4	54.1	-97.1	0	0	0	115.4	M650 R654	M650-W652 VanDerWaalsContact C-N 3.26Å; M650-W652 PolarHBondContact O-N 3.26Å; W652-R654 PolarHBondContact O-N 3.14Å; W652-R654 VanDerWaalsContact O-N 3.11Å
653	R	25.7	Very low	27.8	Very low	154 Å²	154	103.9 Å²	103.9	58%	0.581	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-10.6	170.3	-62.6	-176.3	172.8	-149.3	-2.8	114.3	N651	N651-R653 PolarHBondContact O-N 2.78Å
654	R	26.3	Very low	28.1	Very low	183 Å²	183	96.6 Å²	96.6	69%	0.691	51%	0.513	S	S	*	.	S	Bend	trans	-96.4	89	169.1	-66.9	-172.4	178.9	-165.9	0	110.8	N651 W652 C656 N659	N651-R654 PolarHBondContact O-N 2.79Å; W652-R654 PolarHBondContact O-N 3.14Å; W652-R654 VanDerWaalsContact O-N 3.11Å; R654-C656 PolarHBondContact O-N 3.42Å; R654-N659 PolarHBondContact O-ND2 3.09Å
655	G	25.6	Very low	28.5	Very low	28 Å²	28	93.8 Å²	93.8	29%	0.289	49%	0.494	S	S	.	.			trans	-75.3	96.2	177.2	0	0	0	0	0	112.6
656	C	26.6	Very low	28.7	Very low	56 Å²	56	93.6 Å²	93.6	38%	0.378	49%	0.489	S	S	.	.			trans	-115.9	142.9	171.9	-61.7	0	0	0	0	110.8	R654 D658 N659	R654-C656 PolarHBondContact O-N 3.42Å; C656-D658 PolarHBondContact O-N 2.82Å; C656-N659 PolarHBondContact O-N 2.93Å
657	A	28.1	Very low	28.9	Very low	51 Å²	51	95.5 Å²	95.5	42%	0.421	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	5.4	178.9	0	0	0	0	0	114.4	L660 K963	A657-L660 WeakPolarHBondContact O-CB 3.08Å; A657-K963 PolarHBondContact O-NZ 3.37Å
658	D	30.2	Very low	29.1	Very low	88 Å²	88	92.9 Å²	92.9	47%	0.471	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-34.4	-178.8	-51.9	-60	0	0	0	111.8	C656 L660 V661 L662 K963	C656-D658 PolarHBondContact O-N 2.82Å; D658-L660 PolarHBondContact O-N 2.95Å; D658-L660 VanDerWaalsContact O-N 3.1Å; D658-V661 PolarHBondContact O-N 2.98Å; D658-L662 WeakPolarHBondContact O-CD1 3.18Å; D658-L662 PolarHBondContact O-N 3.34Å; D658-K963 IonicContact OD1-NZ 2.71Å; D658-K963 PolarHBondContact OD1-NZ 3.41Å
659	N	31.9	Very low	29.2	Very low	78 Å²	78	94.7 Å²	94.7	42%	0.417	49%	0.489	S	S	.	.	H	α-helix	trans	-55	-25.3	161.4	-71.3	-18.2	0	0	0	111.3	R654 C656 M663	R654-N659 PolarHBondContact O-ND2 3.09Å; C656-N659 PolarHBondContact O-N 2.93Å; N659-M663 WeakPolarHBondContact O-CB 3.2Å; N659-M663 PolarHBondContact O-N 3.08Å
660	L	32.7	Very low	29.4	Very low	27 Å²	27	93.8 Å²	93.8	14%	0.141	50%	0.503	C	S	.	.	H	α-helix	trans	-69.6	-44.4	-178.4	-158.4	151.3	0	0	0	112.4	Y582 A657 D658 L664	Y582-L660 HydrophobicContact CD2-CD1 3.54Å; Y582-L660 HydrophobicContact CD2-CD2 3.58Å; Y582-L660 HydrophobicContact CD2-CG 3.65Å; Y582-L660 HydrophobicContact CE2-CD1 3.46Å; Y582-L660 VanDerWaalsContact CE2-CD1 3.46Å; Y582-L660 HydrophobicContact CE2-CD2 3.44Å; Y582-L660 VanDerWaalsContact CE2-CD2 3.44Å; Y582-L660 HydrophobicContact CE2-CG 3.82Å; A657-L660 WeakPolarHBondContact O-CB 3.08Å; D658-L660 PolarHBondContact O-N 2.95Å; D658-L660 VanDerWaalsContact O-N 3.1Å; L660-L664 HydrophobicContact CD2-CD1 4.01Å; L660-L664 WeakPolarHBondContact O-CG 3.33Å; L660-L664 PolarHBondContact O-N 2.71Å
661	V	32.5	Very low	29.7	Very low	26 Å²	26	88.6 Å²	88.6	16%	0.158	48%	0.482	C	S	.	.	H	α-helix	trans	-67.4	-48.2	172.2	176	0	0	0	0	109	D658 M663 L664 T665 L960	D658-V661 PolarHBondContact O-N 2.98Å; V661-M663 VanDerWaalsContact C-N 3.32Å; V661-M663 PolarHBondContact O-N 2.97Å; V661-L664 CarbonylContact O-C 3.57Å; V661-L664 PolarHBondContact O-N 3.21Å; V661-L664 VanDerWaalsContact O-N 3.13Å; V661-T665 HydrophobicContact CG1-CG2 4.06Å; V661-T665 WeakPolarHBondContact O-CG2 3.49Å; V661-T665 PolarHBondContact O-N 3.47Å; V661-T665 PolarHBondContact O-OG1 2.87Å; V661-L960 HydrophobicContact CG1-CD2 3.66Å; V661-L960 HydrophobicContact CG2-CD2 4.38Å
662	L	32.4	Very low	30	Very low	81 Å²	81	92.5 Å²	92.5	42%	0.424	49%	0.494	S	S	.	.	H	α-helix	trans	-58.3	-40.9	178.8	-88.1	89.9	0	0	0	112.8	D658 L664 T665 H666	D658-L662 WeakPolarHBondContact O-CD1 3.18Å; D658-L662 PolarHBondContact O-N 3.34Å; L662-L664 VanDerWaalsContact C-N 3.31Å; L662-L664 PolarHBondContact O-N 2.81Å; L662-T665 PolarHBondContact O-N 3.28Å; L662-H666 VanDerWaalsContact O-CB 3.23Å; L662-H666 WeakPolarHBondContact O-CB 3.37Å; L662-H666 PolarHBondContact O-N 3.19Å
663	M	32.3	Very low	30.2	Very low	112 Å²	112	90 Å²	90	55%	0.552	49%	0.494	S	S	*	.	H	α-helix	trans	-72.6	-23.6	-179.7	-167.8	165.8	71.7	0	0	112.8	C578 N659 V661	C578-M663 WeakPolarHBondContact SG-CE 3.16Å; N659-M663 WeakPolarHBondContact O-CB 3.2Å; N659-M663 PolarHBondContact O-N 3.08Å; V661-M663 VanDerWaalsContact C-N 3.32Å; V661-M663 PolarHBondContact O-N 2.97Å
664	L	30.7	Very low	30.7	Very low	16 Å²	16	86.8 Å²	86.8	8%	0.084	49%	0.491	C	S	.	.	H	α-helix	trans	-86.3	-23.4	170.6	-73.7	171.7	0	0	0	113.5	C578 L660 V661 L662 K950	C578-L664 HydrophobicContact CB-CD2 4.17Å; C578-L664 VanDerWaalsContact SG-CD2 3.58Å; L660-L664 HydrophobicContact CD2-CD1 4.01Å; L660-L664 WeakPolarHBondContact O-CG 3.33Å; L660-L664 PolarHBondContact O-N 2.71Å; V661-L664 CarbonylContact O-C 3.57Å; V661-L664 PolarHBondContact O-N 3.21Å; V661-L664 VanDerWaalsContact O-N 3.13Å; L662-L664 VanDerWaalsContact C-N 3.31Å; L662-L664 PolarHBondContact O-N 2.81Å; L664-K950 PolarHBondContact O-NZ 3.25Å
665	T	32	Very low	31.5	Very low	62 Å²	62	80.7 Å²	80.7	38%	0.38	48%	0.477	S	S	.	.	H	α-helix	trans	-112	-22.8	-174.1	64.2	0	0	0	0	115.4	V661 L662 H667	V661-T665 HydrophobicContact CG1-CG2 4.06Å; V661-T665 WeakPolarHBondContact O-CG2 3.49Å; V661-T665 PolarHBondContact O-N 3.47Å; V661-T665 PolarHBondContact O-OG1 2.87Å; L662-T665 PolarHBondContact O-N 3.28Å; T665-H667 PolarHBondContact O-N 3.24Å
666	H	28.7	Very low	32.6	Very low	124 Å²	124	80 Å²	80	57%	0.574	47%	0.468	S	S	*	.			trans	-81.5	110.1	176.2	-80.9	-112.2	0	0	0	111.5	L662 S668	L662-H666 VanDerWaalsContact O-CB 3.23Å; L662-H666 WeakPolarHBondContact O-CB 3.37Å; L662-H666 PolarHBondContact O-N 3.19Å; H666-S668 PolarHBondContact O-N 2.73Å; H666-S668 VanDerWaalsContact O-N 3.13Å
667	H	31.1	Very low	33.7	Very low	159 Å²	159	80.1 Å²	80.1	74%	0.736	47%	0.466	S	S	*	.			trans	-63.6	106.9	150.3	-55.9	-63.4	0	0	0	108.2	T665 S669	T665-H667 PolarHBondContact O-N 3.24Å; H667-S669 PolarHBondContact O-N 2.72Å; H667-S669 VanDerWaalsContact O-N 3.1Å
668	S	28.5	Very low	34.7	Very low	68 Å²	68	77.9 Å²	77.9	48%	0.476	45%	0.447	S	S	.	.			trans	-68.8	106.8	174.5	47	0	0	0	0	108.9	H666 G670 S671	H666-S668 PolarHBondContact O-N 2.73Å; H666-S668 VanDerWaalsContact O-N 3.13Å; S668-G670 PolarHBondContact O-N 2.83Å; S668-S671 PolarHBondContact O-N 3.39Å; S668-S671 WeakPolarHBondContact OG-CB 3.36Å
669	S	31	Very low	35.9	Very low	136 Å²	136	74.2 Å²	74.2	95%	0.951	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	4.1	-166.9	45.8	0	0	0	0	116.2	H667	H667-S669 PolarHBondContact O-N 2.72Å; H667-S669 VanDerWaalsContact O-N 3.1Å
670	G	30	Very low	37	Very low	80 Å²	80	76.5 Å²	76.5	83%	0.825	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	-2.2	169.5	0	0	0	0	0	115.2	S668	S668-G670 PolarHBondContact O-N 2.83Å
671	S	33.3	Very low	38.4	Very low	47 Å²	47	76.8 Å²	76.8	33%	0.329	44%	0.435	S	S	.	.			trans	-110.3	98.7	-177	-148.2	0	0	0	0	111.5	N575 S668 N673	N575-S671 PolarHBondContact ND2-OG 3.23Å; S668-S671 PolarHBondContact O-N 3.39Å; S668-S671 WeakPolarHBondContact OG-CB 3.36Å; S671-N673 PolarHBondContact O-N 3.26Å; S671-N673 PolarHBondContact OG-O 3.35Å
672	K	32.5	Very low	40.1	Very low	189 Å²	189	75.6 Å²	75.6	82%	0.822	43%	0.428	S	S	*	.	S	Bend	trans	-68.8	-17.7	177.4	-73.2	-171.6	174.1	-175.5	0	113.6
673	N	32.6	Very low	41.7	Very low	125 Å²	125	72 Å²	72	67%	0.668	41%	0.41	S	S	*	.	S	Bend	trans	-121.6	165.9	-176.7	-60.7	4.4	0	0	0	110.8	S671	S671-N673 PolarHBondContact O-N 3.26Å; S671-N673 PolarHBondContact OG-O 3.35Å
674	T	36.6	Very low	43.4	Very low	86 Å²	86	66.8 Å²	66.8	53%	0.528	38%	0.384	S	S	.	.			trans	67.7	47.1	163	60	0	0	0	0	119	N575	N575-T674 VanDerWaalsContact CB-OG1 3.26Å; N575-T674 WeakPolarHBondContact CB-OG1 3.39Å
675	S	41.6	Very low	45.2	Very low	55 Å²	55	66.5 Å²	66.5	39%	0.385	38%	0.384	S	S	.	.			trans	-100.2	133.2	134.9	50	0	0	0	0	107.3	K680	S675-K680 WeakPolarHBondContact OG-CE 3.41Å
676	S	49.8	Very low	47.2	Very low	15 Å²	15	65 Å²	65	11%	0.105	37%	0.372	C	S	.	.			trans	-69.1	157.6	-179.2	77.9	0	0	0	0	110.5	V678 D679 K680	S676-V678 PolarHBondContact O-N 2.82Å; S676-D679 WeakPolarHBondContact CA-OD2 3.49Å; S676-D679 VanDerWaalsContact CB-OD2 3.25Å; S676-D679 WeakPolarHBondContact CB-OD2 3.32Å; S676-D679 PolarHBondContact N-OD2 2.87Å; S676-D679 WeakPolarHBondContact O-CB 3.4Å; S676-D679 PolarHBondContact O-N 2.75Å; S676-D679 PolarHBondContact OG-N 2.83Å; S676-D679 PolarHBondContact OG-OD1 3.28Å; S676-D679 PolarHBondContact OG-OD2 3.45Å; S676-K680 PolarHBondContact O-N 3.36Å
677	V	50.2	Low	49.5	Very low	57 Å²	57	59.7 Å²	59.7	35%	0.345	35%	0.347	S	S	.	.	H	α-helix	trans	-58	-39.6	-178.5	-169.7	0	0	0	0	110.6	C486 I494 D679 K680 L681	C486-V677 VanDerWaalsContact SG-CG1 3.55Å; I494-V677 HydrophobicContact CD1-CB 4.38Å; I494-V677 HydrophobicContact CD1-CG2 4.47Å; V677-D679 VanDerWaalsContact C-N 3.34Å; V677-D679 PolarHBondContact O-N 3.27Å; V677-K680 WeakPolarHBondContact O-CB 3.35Å; V677-K680 PolarHBondContact O-N 3.11Å; V677-K680 VanDerWaalsContact O-N 3.14Å; V677-L681 HydrophobicContact CG1-CD1 4.09Å; V677-L681 WeakPolarHBondContact O-CG 3.33Å; V677-L681 PolarHBondContact O-N 2.91Å
678	V	48.9	Very low	51.4	Low	4 Å²	4	53.7 Å²	53.7	2%	0.024	32%	0.323	C	S	.	.	H	α-helix	trans	-57.7	-43.1	174	179.5	0	0	0	0	112	L477 I494 L579 S676 K680 L681 L682	L477-V678 HydrophobicContact CD1-CG2 4.2Å; L477-V678 HydrophobicContact CD2-CG1 4.31Å; L477-V678 HydrophobicContact CD2-CG2 4.28Å; I494-V678 HydrophobicContact CD1-CG2 4.15Å; L579-V678 HydrophobicContact CB-CG1 3.8Å; L579-V678 HydrophobicContact CD1-CG1 3.77Å; L579-V678 HydrophobicContact CD2-CG1 4.2Å; L579-V678 HydrophobicContact CG-CG1 4.12Å; S676-V678 PolarHBondContact O-N 2.82Å; V678-K680 PolarHBondContact O-N 2.83Å; V678-L681 PolarHBondContact O-N 3.06Å; V678-L682 HydrophobicContact CG1-CD1 3.74Å; V678-L682 PolarHBondContact O-N 2.77Å
679	D	53.8	Low	53.6	Low	11 Å²	11	50.7 Å²	50.7	6%	0.059	30%	0.303	C	S	.	.	H	α-helix	trans	-66.2	-25.7	-179.9	-50.9	-37	0	0	0	112.1	C578 L579 S676 V677 L681 K950	C578-D679 WeakPolarHBondContact CA-OD1 3.47Å; C578-D679 HydrophobicContact CB-CB 4.26Å; C578-D679 VanDerWaalsContact CB-CG 3.41Å; C578-D679 VanDerWaalsContact CB-OD1 3.26Å; C578-D679 WeakPolarHBondContact CB-OD1 3.36Å; C578-D679 PolarHBondContact N-OD1 2.86Å; C578-D679 PolarHBondContact N-OD2 2.71Å; L579-D679 PolarHBondContact N-OD1 3.12Å; S676-D679 WeakPolarHBondContact CA-OD2 3.49Å; S676-D679 VanDerWaalsContact CB-OD2 3.25Å; S676-D679 WeakPolarHBondContact CB-OD2 3.32Å; S676-D679 PolarHBondContact N-OD2 2.87Å; S676-D679 WeakPolarHBondContact O-CB 3.4Å; S676-D679 PolarHBondContact O-N 2.75Å; S676-D679 PolarHBondContact OG-N 2.83Å; S676-D679 PolarHBondContact OG-OD1 3.28Å; S676-D679 PolarHBondContact OG-OD2 3.45Å; V677-D679 VanDerWaalsContact C-N 3.34Å; V677-D679 PolarHBondContact O-N 3.27Å; D679-L681 VanDerWaalsContact C-N 3.35Å; D679-K950 PolarHBondContact O-NZ 3.16Å
680	K	56.4	Low	56	Low	127 Å²	127	46.4 Å²	46.4	55%	0.552	27%	0.271	S	S	*	.	H	α-helix	trans	-77.5	-20.7	173.2	-60.3	-179.8	-174.7	177.9	0	112.8	S675 S676 V677 V678 K950	S675-K680 WeakPolarHBondContact OG-CE 3.41Å; S676-K680 PolarHBondContact O-N 3.36Å; V677-K680 WeakPolarHBondContact O-CB 3.35Å; V677-K680 PolarHBondContact O-N 3.11Å; V677-K680 VanDerWaalsContact O-N 3.14Å; V678-K680 PolarHBondContact O-N 2.83Å; K680-K950 VanDerWaalsContact O-CD 3.27Å; K680-K950 WeakPolarHBondContact O-CD 3.36Å
681	L	61	Low	58.4	Low	32 Å²	32	46.3 Å²	46.3	17%	0.168	26%	0.255	C	S	.	.	H	α-helix	trans	-103.3	-22.5	-172.8	-65.8	168.2	0	0	0	114.3	L482 C486 V677 V678 D679 E949 K950	L482-L681 HydrophobicContact CD1-CB 3.93Å; L482-L681 HydrophobicContact CD2-CB 4.28Å; L482-L681 HydrophobicContact CD2-CD1 4.31Å; L482-L681 HydrophobicContact CD2-CD2 4.23Å; C486-L681 VanDerWaalsContact SG-CD1 3.54Å; V677-L681 HydrophobicContact CG1-CD1 4.09Å; V677-L681 WeakPolarHBondContact O-CG 3.33Å; V677-L681 PolarHBondContact O-N 2.91Å; V678-L681 PolarHBondContact O-N 3.06Å; D679-L681 VanDerWaalsContact C-N 3.35Å; L681-E949 WeakPolarHBondContact O-CA 3.31Å; L681-K950 PolarHBondContact O-N 2.94Å
682	L	67.9	Low	60.4	Low	2 Å²	2	46.1 Å²	46.1	1%	0.01	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	148.6	-177.5	-83.9	110.9	0	0	0	114.6	I476 L477 L480 L482 L579 V678 F947 K950	I476-L682 HydrophobicContact CG2-CD2 3.84Å; L477-L682 HydrophobicContact CD2-CD1 3.85Å; L480-L682 HydrophobicContact CD1-CD1 4.31Å; L480-L682 HydrophobicContact CD1-CD2 3.52Å; L480-L682 HydrophobicContact CD1-CG 3.82Å; L482-L682 HydrophobicContact CD1-CD1 3.65Å; L482-L682 HydrophobicContact CD1-CG 4.11Å; L579-L682 HydrophobicContact CD1-CB 4.29Å; L579-L682 HydrophobicContact CD1-CD1 4.31Å; L579-L682 HydrophobicContact CD1-CD2 4.12Å; L579-L682 HydrophobicContact CD1-CG 4.49Å; V678-L682 HydrophobicContact CG1-CD1 3.74Å; V678-L682 PolarHBondContact O-N 2.77Å; L682-F947 HydrophobicContact CD2-CB 3.91Å; L682-F947 HydrophobicContact CD2-CD1 3.79Å; L682-F947 HydrophobicContact CD2-CG 4.19Å; L682-K950 WeakPolarHBondContact O-CD 3.37Å; L682-K950 WeakPolarHBondContact O-CE 3.49Å; L682-K950 PolarHBondContact O-NZ 2.94Å
683	T	66.1	Low	62.6	Low	5 Å²	5	37.1 Å²	37.1	3%	0.031	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	147.6	159.8	-62.1	0	0	0	0	108.4	V948 K950 V956 L959	T683-V948 PolarHBondContact N-O 2.98Å; T683-V948 PolarHBondContact O-N 3.47Å; T683-K950 VanDerWaalsContact OG1-CE 3.23Å; T683-K950 WeakPolarHBondContact OG1-CE 3.11Å; T683-K950 WeakPolarHBondContact OG1-CG 3.35Å; T683-V956 HydrophobicContact CG2-CG1 4.34Å; T683-L959 HydrophobicContact CG2-CD2 4.03Å
684	G	68.2	Low	64.9	Low	2 Å²	2	36.2 Å²	36.2	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	160.5	173.5	0	0	0	0	0	114.4	L946	G684-L946 CarbonylContact C-O 3.5Å; G684-L946 WeakPolarHBondContact CA-O 3.39Å
685	C	69.9	Low	66.6	Low	11 Å²	11	34.8 Å²	34.8	7%	0.074	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	153.1	178	-171.5	0	0	0	0	110.2	F687 S945 L946 L959	C685-F687 HydrophobicContact CB-CE2 4.18Å; C685-F687 HydrophobicContact CB-CZ 4.19Å; C685-S945 CarbonylContact O-C 3.55Å; C685-S945 WeakPolarHBondContact O-CA 3.25Å; C685-L946 PolarHBondContact N-O 3.42Å; C685-L946 PolarHBondContact O-N 3.12Å; C685-L959 HydrophobicContact CB-CD1 4.05Å; C685-L959 HydrophobicContact CB-CD2 3.81Å; C685-L959 HydrophobicContact CB-CG 3.84Å
686	F	73.5	Confident	68.2	Low	31 Å²	31	32.1 Å²	32.1	14%	0.136	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	132.7	-180	-177.3	-110.3	0	0	0	111.4	T591 P688 A738 S945	T591-F686 HydrophobicContact CG2-CE1 3.94Å; F686-P688 HydrophobicContact CD1-CB 4.41Å; F686-P688 HydrophobicContact CE1-CB 3.9Å; F686-A738 HydrophobicContact CE2-CB 4.06Å; F686-S945 WeakPolarHBondContact CD2-OG 3.37Å
687	F	76.8	Confident	69.7	Low	11 Å²	11	33.2 Å²	33.2	5%	0.048	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	103.6	-178.6	-60	-79.5	0	0	0	109.8	C685 S692 W693 A696 G943 I944 L946 L959	C685-F687 HydrophobicContact CB-CE2 4.18Å; C685-F687 HydrophobicContact CB-CZ 4.19Å; F687-S692 WeakPolarHBondContact CD1-O 3.44Å; F687-W693 HydrophobicContact CB-CB 4.18Å; F687-W693 HydrophobicContact CG-CB 4.48Å; F687-A696 HydrophobicContact CE1-CB 3.54Å; F687-A696 HydrophobicContact CE2-CB 4.38Å; F687-A696 HydrophobicContact CZ-CB 3.4Å; F687-A696 VanDerWaalsContact CZ-CB 3.4Å; F687-G943 CarbonylContact O-C 2.96Å; F687-G943 WeakPolarHBondContact O-CA 3.16Å; F687-I944 PolarHBondContact N-O 2.77Å; F687-I944 PolarHBondContact O-N 3.26Å; F687-L946 HydrophobicContact CD2-CB 4.4Å; F687-L946 HydrophobicContact CE2-CB 3.93Å; F687-L946 HydrophobicContact CE2-CD2 4.13Å; F687-L959 HydrophobicContact CZ-CD1 4.45Å
688	P	71.7	Confident	70.7	Confident	34 Å²	34	31.6 Å²	31.6	22%	0.221	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	144.2	-173.1	32	-35.5	0	0	0	113.6	T591 F686 S692 L941	T591-P688 HydrophobicContact CG2-CB 3.47Å; T591-P688 VanDerWaalsContact CG2-CB 3.47Å; T591-P688 HydrophobicContact CG2-CG 4.13Å; F686-P688 HydrophobicContact CD1-CB 4.41Å; F686-P688 HydrophobicContact CE1-CB 3.9Å; P688-S692 WeakPolarHBondContact O-CB 3.4Å; P688-S692 PolarHBondContact O-OG 2.68Å; P688-L941 HydrophobicContact CB-CB 4.42Å; P688-L941 HydrophobicContact CB-CD1 4.44Å
689	G	74.8	Confident	71.4	Confident	5 Å²	5	36.7 Å²	36.7	5%	0.052	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.4	-173.2	174.4	0	0	0	0	0	114.9	T691 P942	G689-T691 VanDerWaalsContact C-N 3.34Å; G689-T691 PolarHBondContact O-N 3.3Å; G689-P942 PolarHBondContact N-O 3.44Å
690	P	81.1	Confident	71.4	Confident	46 Å²	46	38.1 Å²	38.1	30%	0.299	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-10.6	-165.9	31.5	-36	0	0	0	114.6	W693 M717 L804	P690-W693 PolarHBondContact O-NE1 2.96Å; P690-M717 HydrophobicContact CB-CE 4.38Å; P690-M717 WeakPolarHBondContact O-CE 3.25Å; P690-L804 HydrophobicContact CB-CB 4.31Å; P690-L804 WeakPolarHBondContact CD-O 3.44Å
691	T	79.4	Confident	70.6	Confident	77 Å²	77	35.8 Å²	35.8	47%	0.472	19%	0.189	S	C	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-29.3	-173.3	44.7	0	0	0	0	115	G689 W693 R694 M717	G689-T691 VanDerWaalsContact C-N 3.34Å; G689-T691 PolarHBondContact O-N 3.3Å; T691-W693 VanDerWaalsContact C-N 3.25Å; T691-W693 PolarHBondContact O-N 2.72Å; T691-W693 VanDerWaalsContact O-N 3.12Å; T691-R694 VanDerWaalsContact O-CB 3.26Å; T691-R694 WeakPolarHBondContact O-CB 3.47Å; T691-R694 VanDerWaalsContact O-CG 3.32Å; T691-R694 WeakPolarHBondContact O-CG 3.37Å; T691-R694 PolarHBondContact O-N 2.66Å; T691-M717 HydrophobicContact CG2-CE 3.93Å
692	S	75.1	Confident	69.6	Low	43 Å²	43	44.2 Å²	44.2	30%	0.301	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-66.1	-21.7	-162.7	-53	0	0	0	0	115.1	F687 P688 R694 S695	F687-S692 WeakPolarHBondContact CD1-O 3.44Å; P688-S692 WeakPolarHBondContact O-CB 3.4Å; P688-S692 PolarHBondContact O-OG 2.68Å; S692-R694 PolarHBondContact O-N 2.78Å; S692-S695 PolarHBondContact O-N 3.2Å; S692-S695 PolarHBondContact O-OG 2.94Å
693	W	79.9	Confident	68.1	Low	1 Å²	1	50.6 Å²	50.6	0%	0.004	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-61.3	-24.5	173.7	52.2	-93.6	0	0	0	112.7	F687 P690 T691 S695 A696 M717 L721 W724 I944	F687-W693 HydrophobicContact CB-CB 4.18Å; F687-W693 HydrophobicContact CG-CB 4.48Å; P690-W693 PolarHBondContact O-NE1 2.96Å; T691-W693 VanDerWaalsContact C-N 3.25Å; T691-W693 PolarHBondContact O-N 2.72Å; T691-W693 VanDerWaalsContact O-N 3.12Å; W693-S695 PolarHBondContact O-N 2.93Å; W693-A696 PolarHBondContact O-N 2.68Å; W693-M717 HydrophobicContact CZ2-CE 4.41Å; W693-L721 HydrophobicContact CD2-CD1 3.87Å; W693-L721 HydrophobicContact CE3-CD1 4.06Å; W693-L721 HydrophobicContact CG-CD1 4.37Å; W693-L721 HydrophobicContact CH2-CB 3.72Å; W693-L721 HydrophobicContact CH2-CD1 4.26Å; W693-L721 HydrophobicContact CZ2-CB 3.83Å; W693-L721 HydrophobicContact CZ2-CD1 4.1Å; W693-L721 HydrophobicContact CZ2-CG 4.37Å; W693-L721 HydrophobicContact CZ3-CB 4.31Å; W693-L721 HydrophobicContact CZ3-CD1 4.24Å; W693-W724 HydrophobicContact CB-CD2 4.38Å; W693-W724 HydrophobicContact CB-CH2 4.32Å; W693-W724 HydrophobicContact CB-CZ2 3.87Å; W693-W724 HydrophobicContact CE3-CB 3.91Å; W693-W724 AromaticContact CE3-CD1 3.63Å; W693-W724 HydrophobicContact CE3-CD2 4Å; W693-W724 AromaticContact CE3-CG 3.57Å; W693-W724 HydrophobicContact CE3-CG 3.57Å; W693-W724 HydrophobicContact CZ3-CB 3.82Å; W693-W724 AromaticContact CZ3-CG 3.99Å; W693-W724 HydrophobicContact CZ3-CG 3.99Å; W693-W724 PolarHBondContact O-NE1 3.19Å; W693-I944 HydrophobicContact CB-CD1 4.15Å; W693-I944 HydrophobicContact CG-CD1 4.18Å
694	R	80.5	Confident	66.9	Low	106 Å²	106	53 Å²	53	40%	0.4	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-63.5	-20.5	-178.4	-68.2	177.3	167.6	-152.9	-11.9	114.3	T691 S692 A696 W697 M717	T691-R694 VanDerWaalsContact O-CB 3.26Å; T691-R694 WeakPolarHBondContact O-CB 3.47Å; T691-R694 VanDerWaalsContact O-CG 3.32Å; T691-R694 WeakPolarHBondContact O-CG 3.37Å; T691-R694 PolarHBondContact O-N 2.66Å; S692-R694 PolarHBondContact O-N 2.78Å; R694-A696 VanDerWaalsContact C-N 3.31Å; R694-W697 PolarHBondContact O-NE1 3.12Å; R694-M717 PolarHBondContact NH2-SD 3.29Å
695	S	71.8	Confident	65.5	Low	55 Å²	55	56.9 Å²	56.9	39%	0.385	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-74.2	-19.9	178.3	63.7	0	0	0	0	113.5	S692 W693 T962	S692-S695 PolarHBondContact O-N 3.2Å; S692-S695 PolarHBondContact O-OG 2.94Å; W693-S695 PolarHBondContact O-N 2.93Å; S695-T962 WeakPolarHBondContact O-CG2 3.18Å
696	A	75.1	Confident	64	Low	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.332	C	S	.	.			trans	-121.6	120.5	-173.5	0	0	0	0	0	113.5	F687 W693 R694 W724 W728 T962	F687-A696 HydrophobicContact CE1-CB 3.54Å; F687-A696 HydrophobicContact CE2-CB 4.38Å; F687-A696 HydrophobicContact CZ-CB 3.4Å; F687-A696 VanDerWaalsContact CZ-CB 3.4Å; W693-A696 PolarHBondContact O-N 2.68Å; R694-A696 VanDerWaalsContact C-N 3.31Å; A696-W724 PolarHBondContact O-NE1 2.82Å; A696-W728 HydrophobicContact CB-CZ2 4.34Å; A696-W728 PolarHBondContact O-NE1 2.95Å; A696-W728 VanDerWaalsContact O-NE1 3.14Å; A696-T962 HydrophobicContact CB-CG2 3.95Å
697	W	81.1	Confident	62.4	Low	37 Å²	37	66 Å²	66	14%	0.14	34%	0.343	C	S	.	.			trans	-136.9	153.3	179.2	-73.6	81.9	0	0	0	110.3	R694 F699 F708 L723 W724 A727 T958	R694-W697 PolarHBondContact O-NE1 3.12Å; W697-F699 VanDerWaalsContact C-N 3.33Å; W697-F699 HydrophobicContact CB-CD2 4.24Å; W697-F699 HydrophobicContact CB-CE2 3.94Å; W697-F699 HydrophobicContact CB-CZ 4.22Å; W697-F699 WeakPolarHBondContact O-CD2 3.48Å; W697-F699 PolarHBondContact O-N 2.84Å; W697-F708 HydrophobicContact CB-CE2 4.5Å; W697-F708 HydrophobicContact CB-CZ 3.7Å; W697-F708 AromaticContact CD1-CE1 3.78Å; W697-F708 AromaticContact CD1-CZ 3.71Å; W697-F708 HydrophobicContact CD2-CE1 4.35Å; W697-F708 AromaticContact CD2-CZ 3.91Å; W697-F708 HydrophobicContact CD2-CZ 3.91Å; W697-F708 HydrophobicContact CG-CE1 4.02Å; W697-F708 HydrophobicContact CG-CE2 4.5Å; W697-F708 AromaticContact CG-CZ 3.49Å; W697-F708 HydrophobicContact CG-CZ 3.49Å; W697-F708 VanDerWaalsContact CG-CZ 3.49Å; W697-F708 AromaticContact NE1-CE1 3.97Å; W697-L723 HydrophobicContact CH2-CB 4.32Å; W697-L723 HydrophobicContact CH2-CD2 4.17Å; W697-L723 HydrophobicContact CH2-CG 4.37Å; W697-L723 HydrophobicContact CZ3-CD2 4.36Å; W697-L723 HydrophobicContact CZ3-CG 4.36Å; W697-W724 AromaticContact CD2-CD1 3.9Å; W697-W724 AromaticContact CE2-CD1 3.69Å; W697-W724 HydrophobicContact CH2-CB 3.84Å; W697-W724 HydrophobicContact CH2-CG 4.48Å; W697-W724 HydrophobicContact CZ2-CB 4.14Å; W697-W724 AromaticContact CZ2-CD1 3.86Å; W697-W724 HydrophobicContact CZ2-CG 4.45Å; W697-W724 HydrophobicContact CZ3-CB 4.23Å; W697-A727 HydrophobicContact CE3-CB 4.25Å; W697-A727 HydrophobicContact CZ3-CB 4.21Å; W697-T958 WeakPolarHBondContact O-CG2 3.12Å
698	P	72.9	Confident	60.8	Low	24 Å²	24	68.6 Å²	68.6	16%	0.156	35%	0.354	C	S	.	.			trans	-74.1	79.3	179.7	30.3	-33.5	0	0	0	112.2	I700 A727 W728 C731 L955	P698-I700 PolarHBondContact O-N 3.1Å; P698-A727 HydrophobicContact CG-CB 3.82Å; P698-W728 HydrophobicContact CB-CD2 4.33Å; P698-W728 HydrophobicContact CB-CE3 4.06Å; P698-W728 HydrophobicContact CB-CH2 4.41Å; P698-W728 HydrophobicContact CB-CZ3 4.13Å; P698-W728 HydrophobicContact CG-CD2 4.23Å; P698-W728 HydrophobicContact CG-CE3 4.42Å; P698-C731 HydrophobicContact CB-CB 4.42Å; P698-L955 HydrophobicContact CB-CD2 3.86Å
699	F	63.1	Low	59.2	Low	110 Å²	110	72 Å²	72	48%	0.482	37%	0.371	S	S	.	.			trans	-74.3	50.9	179.9	-69.3	-75.5	0	0	0	114.4	W697 H701 F708 T958	W697-F699 VanDerWaalsContact C-N 3.33Å; W697-F699 HydrophobicContact CB-CD2 4.24Å; W697-F699 HydrophobicContact CB-CE2 3.94Å; W697-F699 HydrophobicContact CB-CZ 4.22Å; W697-F699 WeakPolarHBondContact O-CD2 3.48Å; W697-F699 PolarHBondContact O-N 2.84Å; F699-H701 VanDerWaalsContact C-N 3.27Å; F699-H701 PolarHBondContact O-N 3.21Å; F699-F708 HydrophobicContact CD1-CE2 4.07Å; F699-F708 HydrophobicContact CD1-CZ 4.25Å; F699-F708 HydrophobicContact CE1-CD2 4.18Å; F699-F708 HydrophobicContact CE1-CE1 4.09Å; F699-F708 AromaticContact CE1-CE2 3.31Å; F699-F708 HydrophobicContact CE1-CE2 3.31Å; F699-F708 AromaticContact CE1-CZ 3.26Å; F699-F708 HydrophobicContact CE1-CZ 3.26Å; F699-F708 HydrophobicContact CE2-CZ 4.25Å; F699-F708 AromaticContact CZ-CE1 3.83Å; F699-F708 HydrophobicContact CZ-CE1 3.83Å; F699-F708 AromaticContact CZ-CE2 3.86Å; F699-F708 HydrophobicContact CZ-CE2 3.86Å; F699-F708 AromaticContact CZ-CZ 3.26Å; F699-F708 HydrophobicContact CZ-CZ 3.26Å; F699-T958 HydrophobicContact CB-CG2 4.21Å; F699-T958 HydrophobicContact CD2-CG2 4.23Å
700	I	52.4	Low	57.4	Low	41 Å²	41	74 Å²	74	21%	0.21	38%	0.383	C	S	.	.			trans	-58	-36	-174.8	-66.2	167.7	0	0	0	112.3	L445 P698 C731 E954 L955	L445-I700 HydrophobicContact CD1-CB 3.59Å; L445-I700 HydrophobicContact CD1-CD1 4.02Å; L445-I700 HydrophobicContact CD1-CG1 4.38Å; L445-I700 HydrophobicContact CD1-CG2 3.65Å; P698-I700 PolarHBondContact O-N 3.1Å; I700-C731 HydrophobicContact CD1-CB 4.48Å; I700-E954 WeakPolarHBondContact CG2-OE2 3.38Å; I700-L955 HydrophobicContact CD1-CD2 4.08Å; I700-L955 HydrophobicContact CG1-CD2 4.16Å
701	H	40.4	Very low	55.3	Low	78 Å²	78	77.2 Å²	77.2	36%	0.361	40%	0.402	S	S	.	.	S	Bend	trans	-137.9	141.4	176.1	-75.1	-10	0	0	0	114.3	F699 N703 N704	F699-H701 VanDerWaalsContact C-N 3.27Å; F699-H701 PolarHBondContact O-N 3.21Å; H701-N703 PolarHBondContact O-N 3.24Å; H701-N704 PolarHBondContact O-N 2.74Å
702	K	39.3	Very low	53.3	Low	209 Å²	209	80.2 Å²	80.2	91%	0.909	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-18.1	-179.9	-75	-175.6	174.7	179.5	0	116
703	N	37.6	Very low	51.8	Low	137 Å²	137	84.7 Å²	84.7	73%	0.733	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-11.8	-175.6	-69.8	5	0	0	0	113.8	H701 S705	H701-N703 PolarHBondContact O-N 3.24Å; N703-S705 PolarHBondContact O-N 2.9Å; N703-S705 VanDerWaalsContact O-N 3.16Å
704	N	39.9	Very low	50	Low	55 Å²	55	94.3 Å²	94.3	29%	0.294	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-85.5	22	-173.5	-71.8	12.7	0	0	0	114.2	H701 K706 C707	H701-N704 PolarHBondContact O-N 2.74Å; N704-K706 PolarHBondContact O-N 3.47Å; N704-K706 VanDerWaalsContact O-N 3.11Å; N704-C707 PolarHBondContact O-N 2.68Å
705	S	40	Very low	48.6	Very low	84 Å²	84	92.6 Å²	92.6	59%	0.587	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-57.7	-22.1	172.6	57.8	0	0	0	0	113.6	N703 C707 F708	N703-S705 PolarHBondContact O-N 2.9Å; N703-S705 VanDerWaalsContact O-N 3.16Å; S705-C707 VanDerWaalsContact C-N 3.31Å; S705-C707 PolarHBondContact O-N 2.91Å; S705-F708 WeakPolarHBondContact O-CB 3.4Å; S705-F708 PolarHBondContact O-N 3.35Å; S705-F708 VanDerWaalsContact O-N 3.13Å
706	K	38	Very low	48.7	Very low	178 Å²	178	94.6 Å²	94.6	77%	0.774	48%	0.484	S	S	*	.	G	3₁₀ helix	trans	-63.5	-30.5	177	-70.3	-173.1	176.5	-178.4	0	113.9	N704 F708	N704-K706 PolarHBondContact O-N 3.47Å; N704-K706 VanDerWaalsContact O-N 3.11Å; K706-F708 PolarHBondContact O-N 3.45Å
707	C	40.2	Very low	49	Very low	56 Å²	56	97.2 Å²	97.2	38%	0.378	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-69.3	-20	175.8	-61.5	0	0	0	0	112.7	N704 S705 N709	N704-C707 PolarHBondContact O-N 2.68Å; S705-C707 VanDerWaalsContact C-N 3.31Å; S705-C707 PolarHBondContact O-N 2.91Å; C707-N709 VanDerWaalsContact C-N 3.3Å; C707-N709 PolarHBondContact O-N 2.81Å
708	F	42.2	Very low	49.3	Very low	64 Å²	64	95.9 Å²	95.9	28%	0.281	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-81.5	-0.3	-177.1	-84.1	-94.5	0	0	0	115	W697 F699 S705 K706 C710 T711	W697-F708 HydrophobicContact CB-CE2 4.5Å; W697-F708 HydrophobicContact CB-CZ 3.7Å; W697-F708 AromaticContact CD1-CE1 3.78Å; W697-F708 AromaticContact CD1-CZ 3.71Å; W697-F708 HydrophobicContact CD2-CE1 4.35Å; W697-F708 AromaticContact CD2-CZ 3.91Å; W697-F708 HydrophobicContact CD2-CZ 3.91Å; W697-F708 HydrophobicContact CG-CE1 4.02Å; W697-F708 HydrophobicContact CG-CE2 4.5Å; W697-F708 AromaticContact CG-CZ 3.49Å; W697-F708 HydrophobicContact CG-CZ 3.49Å; W697-F708 VanDerWaalsContact CG-CZ 3.49Å; W697-F708 AromaticContact NE1-CE1 3.97Å; F699-F708 HydrophobicContact CD1-CE2 4.07Å; F699-F708 HydrophobicContact CD1-CZ 4.25Å; F699-F708 HydrophobicContact CE1-CD2 4.18Å; F699-F708 HydrophobicContact CE1-CE1 4.09Å; F699-F708 AromaticContact CE1-CE2 3.31Å; F699-F708 HydrophobicContact CE1-CE2 3.31Å; F699-F708 AromaticContact CE1-CZ 3.26Å; F699-F708 HydrophobicContact CE1-CZ 3.26Å; F699-F708 HydrophobicContact CE2-CZ 4.25Å; F699-F708 AromaticContact CZ-CE1 3.83Å; F699-F708 HydrophobicContact CZ-CE1 3.83Å; F699-F708 AromaticContact CZ-CE2 3.86Å; F699-F708 HydrophobicContact CZ-CE2 3.86Å; F699-F708 AromaticContact CZ-CZ 3.26Å; F699-F708 HydrophobicContact CZ-CZ 3.26Å; S705-F708 WeakPolarHBondContact O-CB 3.4Å; S705-F708 PolarHBondContact O-N 3.35Å; S705-F708 VanDerWaalsContact O-N 3.13Å; K706-F708 PolarHBondContact O-N 3.45Å; F708-C710 PolarHBondContact O-N 2.9Å; F708-C710 VanDerWaalsContact O-N 3.09Å; F708-T711 WeakPolarHBondContact O-CB 3.5Å; F708-T711 WeakPolarHBondContact O-CG2 3.35Å; F708-T711 PolarHBondContact O-N 3.13Å; F708-T711 PolarHBondContact O-OG1 3.45Å
709	N	39.3	Very low	49.8	Very low	107 Å²	107	97.5 Å²	97.5	57%	0.572	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-67	-6	174.2	-84.6	-35.9	0	0	0	114.1	C707 T711 K712	C707-N709 VanDerWaalsContact C-N 3.3Å; C707-N709 PolarHBondContact O-N 2.81Å; N709-T711 PolarHBondContact O-N 3.43Å; N709-K712 WeakPolarHBondContact O-CG 3.41Å; N709-K712 PolarHBondContact O-N 3.14Å
710	C	37.1	Very low	50.8	Low	46 Å²	46	92.9 Å²	92.9	31%	0.311	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-63.6	-7.4	163.6	-62.1	0	0	0	0	113.7	F708 K712 N715	F708-C710 PolarHBondContact O-N 2.9Å; F708-C710 VanDerWaalsContact O-N 3.09Å; C710-K712 PolarHBondContact O-N 2.87Å; C710-N715 PolarHBondContact SG-ND2 2.7Å
711	T	36.3	Very low	52.5	Low	113 Å²	113	91 Å²	91	69%	0.693	47%	0.472	S	S	*	.	G	3₁₀ helix	trans	-67.2	-6.8	166.7	49.4	0	0	0	0	114.1	F708 N709	F708-T711 WeakPolarHBondContact O-CB 3.5Å; F708-T711 WeakPolarHBondContact O-CG2 3.35Å; F708-T711 PolarHBondContact O-N 3.13Å; F708-T711 PolarHBondContact O-OG1 3.45Å; N709-T711 PolarHBondContact O-N 3.43Å
712	K	38	Very low	54.9	Low	140 Å²	140	87.4 Å²	87.4	61%	0.609	46%	0.456	S	S	*	.	S	Bend	trans	-59.1	126.6	164.6	-76.6	179.9	176.5	-180	0	109.8	N709 C710 K714 N715	N709-K712 WeakPolarHBondContact O-CG 3.41Å; N709-K712 PolarHBondContact O-N 3.14Å; C710-K712 PolarHBondContact O-N 2.87Å; K712-K714 PolarHBondContact O-N 2.78Å; K712-N715 PolarHBondContact O-N 2.89Å
713	P	42	Very low	57.1	Low	138 Å²	138	79.3 Å²	79.3	90%	0.896	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	33.8	-173.9	32.8	-38.3	0	0	0	114.2
714	K	42.6	Very low	59.5	Low	202 Å²	202	72.8 Å²	72.8	88%	0.878	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.6	-11.4	174.4	-75	-166.1	172.9	-170.4	0	113.7	K712	K712-K714 PolarHBondContact O-N 2.78Å
715	N	52.4	Low	62	Low	71 Å²	71	70.2 Å²	70.2	38%	0.38	37%	0.374	S	S	.	.	S	Bend	trans	-72.6	139.8	172.6	-78.2	43.4	0	0	0	109.5	C710 K712	C710-N715 PolarHBondContact SG-ND2 2.7Å; K712-N715 PolarHBondContact O-N 2.89Å
716	N	73.1	Confident	64.3	Low	97 Å²	97	66.2 Å²	66.2	52%	0.519	35%	0.346	S	S	.	.			trans	-70.9	152.2	-173.2	-147.2	-9.7	0	0	0	110.4	S718 D719 S720	N716-S718 PolarHBondContact O-N 2.75Å; N716-D719 WeakPolarHBondContact CA-OD2 3.46Å; N716-D719 WeakPolarHBondContact CB-OD2 3.18Å; N716-D719 PolarHBondContact N-OD2 3.21Å; N716-D719 PolarHBondContact O-N 2.78Å; N716-S720 PolarHBondContact O-N 3.18Å; N716-S720 PolarHBondContact O-OG 2.91Å
717	M	82.6	Confident	66.6	Low	55 Å²	55	58 Å²	58	27%	0.271	31%	0.311	S	S	.	.	H	α-helix	trans	-56.8	-39.3	178.6	-167.9	84.5	176.3	0	0	110.4	P690 T691 W693 R694 S720 L721 L801	P690-M717 HydrophobicContact CB-CE 4.38Å; P690-M717 WeakPolarHBondContact O-CE 3.25Å; T691-M717 HydrophobicContact CG2-CE 3.93Å; W693-M717 HydrophobicContact CZ2-CE 4.41Å; R694-M717 PolarHBondContact NH2-SD 3.29Å; M717-S720 WeakPolarHBondContact O-CB 3.42Å; M717-L721 PolarHBondContact O-N 3.27Å; M717-L801 HydrophobicContact CB-CD1 3.84Å; M717-L801 HydrophobicContact CE-CD2 4.26Å; M717-L801 HydrophobicContact CG-CD1 3.62Å; M717-L801 HydrophobicContact CG-CD2 3.77Å; M717-L801 HydrophobicContact CG-CG 4.36Å
718	S	86.6	Confident	68.9	Low	9 Å²	9	55.4 Å²	55.4	6%	0.063	29%	0.293	C	S	.	.	H	α-helix	trans	-61.2	-57.8	178.5	-49.2	0	0	0	0	112.9	N716 S720 L721 V722 V797 Q798	N716-S718 PolarHBondContact O-N 2.75Å; S718-S720 PolarHBondContact O-N 3.29Å; S718-L721 PolarHBondContact O-N 3.22Å; S718-V722 PolarHBondContact O-N 2.76Å; S718-V797 VanDerWaalsContact CB-CG1 3.48Å; S718-Q798 PolarHBondContact OG-OE1 3.05Å
719	D	83	Confident	71.1	Confident	58 Å²	58	52.3 Å²	52.3	31%	0.31	28%	0.28	S	S	.	.	H	α-helix	trans	-56.5	-38.1	178.9	-36.3	-32.9	0	0	0	111.3	N716 L721 V722 L723 N784	N716-D719 WeakPolarHBondContact CA-OD2 3.46Å; N716-D719 WeakPolarHBondContact CB-OD2 3.18Å; N716-D719 PolarHBondContact N-OD2 3.21Å; N716-D719 PolarHBondContact O-N 2.78Å; D719-L721 VanDerWaalsContact C-N 3.34Å; D719-L721 PolarHBondContact O-N 3.34Å; D719-V722 PolarHBondContact O-N 2.98Å; D719-L723 WeakPolarHBondContact O-CB 3.2Å; D719-L723 PolarHBondContact O-N 3.25Å; D719-N784 PolarHBondContact OD1-ND2 3.17Å
720	S	84	Confident	73.4	Confident	13 Å²	13	49.9 Å²	49.9	9%	0.091	26%	0.263	C	S	.	.	H	α-helix	trans	-66	-35.3	179.4	-54.1	0	0	0	0	112.3	N716 M717 S718 W724	N716-S720 PolarHBondContact O-N 3.18Å; N716-S720 PolarHBondContact O-OG 2.91Å; M717-S720 WeakPolarHBondContact O-CB 3.42Å; S718-S720 PolarHBondContact O-N 3.29Å; S720-W724 WeakPolarHBondContact O-CB 3.27Å; S720-W724 PolarHBondContact O-N 3.05Å
721	L	89.2	Confident	75.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-80	-34.7	177.6	-178.9	54.5	0	0	0	111.8	W693 M717 S718 D719 W724 F725 V797 V800 L801 L804 I944	W693-L721 HydrophobicContact CD2-CD1 3.87Å; W693-L721 HydrophobicContact CE3-CD1 4.06Å; W693-L721 HydrophobicContact CG-CD1 4.37Å; W693-L721 HydrophobicContact CH2-CB 3.72Å; W693-L721 HydrophobicContact CH2-CD1 4.26Å; W693-L721 HydrophobicContact CZ2-CB 3.83Å; W693-L721 HydrophobicContact CZ2-CD1 4.1Å; W693-L721 HydrophobicContact CZ2-CG 4.37Å; W693-L721 HydrophobicContact CZ3-CB 4.31Å; W693-L721 HydrophobicContact CZ3-CD1 4.24Å; M717-L721 PolarHBondContact O-N 3.27Å; S718-L721 PolarHBondContact O-N 3.22Å; D719-L721 VanDerWaalsContact C-N 3.34Å; D719-L721 PolarHBondContact O-N 3.34Å; L721-W724 HydrophobicContact CD1-CE3 4.03Å; L721-W724 WeakPolarHBondContact O-CB 3.2Å; L721-W724 PolarHBondContact O-N 3.29Å; L721-F725 HydrophobicContact CD1-CD2 4.01Å; L721-F725 HydrophobicContact CD1-CE1 4.28Å; L721-F725 HydrophobicContact CD1-CE2 3.68Å; L721-F725 HydrophobicContact CD1-CG 4.44Å; L721-F725 HydrophobicContact CD1-CZ 3.82Å; L721-F725 HydrophobicContact CD2-CE2 3.95Å; L721-F725 HydrophobicContact CD2-CZ 4.37Å; L721-F725 HydrophobicContact CG-CD2 3.91Å; L721-F725 HydrophobicContact CG-CE2 3.55Å; L721-F725 HydrophobicContact CG-CZ 4.15Å; L721-F725 WeakPolarHBondContact O-CD2 3.4Å; L721-F725 PolarHBondContact O-N 3.23Å; L721-V797 HydrophobicContact CB-CG2 4.07Å; L721-V797 HydrophobicContact CD2-CG2 3.79Å; L721-V797 HydrophobicContact CG-CG2 3.85Å; L721-V800 HydrophobicContact CD2-CG1 4.11Å; L721-L801 HydrophobicContact CD2-CD2 3.62Å; L721-L801 HydrophobicContact CD2-CG 3.95Å; L721-L804 HydrophobicContact CD2-CD1 4.32Å; L721-I944 HydrophobicContact CD1-CD1 4.06Å
722	V	89.1	Confident	77.9	Confident	3 Å²	3	45.3 Å²	45.3	2%	0.018	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-47.5	171	160.4	0	0	0	0	111.2	L453 S718 D719 W724 S726 V780 N784 V797	L453-V722 HydrophobicContact CD1-CG1 4.37Å; L453-V722 HydrophobicContact CD2-CG1 4.04Å; S718-V722 PolarHBondContact O-N 2.76Å; D719-V722 PolarHBondContact O-N 2.98Å; V722-W724 VanDerWaalsContact C-N 3.31Å; V722-W724 PolarHBondContact O-N 3.42Å; V722-S726 WeakPolarHBondContact O-CB 3.1Å; V722-S726 PolarHBondContact O-N 3.06Å; V722-S726 PolarHBondContact O-OG 2.95Å; V722-V780 HydrophobicContact CB-CG1 4.39Å; V722-V780 HydrophobicContact CG1-CG1 3.8Å; V722-V780 HydrophobicContact CG2-CG1 4.32Å; V722-N784 WeakPolarHBondContact CG1-OD1 3.39Å; V722-N784 HydrophobicContact CG2-CB 3.9Å; V722-N784 WeakPolarHBondContact CG2-OD1 3.32Å; V722-V797 HydrophobicContact CG2-CB 3.83Å; V722-V797 HydrophobicContact CG2-CG1 3.74Å; V722-V797 HydrophobicContact CG2-CG2 4.01Å
723	L	85.3	Confident	80.2	Confident	40 Å²	40	38.7 Å²	38.7	21%	0.209	21%	0.212	C	C	.	.	H	α-helix	trans	-63.6	-37.7	176.1	-163.5	76.1	0	0	0	111.7	I451 W697 D719 A727	I451-L723 HydrophobicContact CD1-CD1 3.84Å; I451-L723 HydrophobicContact CD1-CG 3.99Å; W697-L723 HydrophobicContact CH2-CB 4.32Å; W697-L723 HydrophobicContact CH2-CD2 4.17Å; W697-L723 HydrophobicContact CH2-CG 4.37Å; W697-L723 HydrophobicContact CZ3-CD2 4.36Å; W697-L723 HydrophobicContact CZ3-CG 4.36Å; D719-L723 WeakPolarHBondContact O-CB 3.2Å; D719-L723 PolarHBondContact O-N 3.25Å; L723-A727 VanDerWaalsContact O-CB 3.29Å; L723-A727 WeakPolarHBondContact O-CB 3.07Å; L723-A727 PolarHBondContact O-N 3.05Å
724	W	88.7	Confident	82.4	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-65.8	-50.1	177.6	-175.2	90.8	0	0	0	112.6	W693 A696 W697 S720 L721 V722 S726 A727 W728 P735 I944 L946	W693-W724 HydrophobicContact CB-CD2 4.38Å; W693-W724 HydrophobicContact CB-CH2 4.32Å; W693-W724 HydrophobicContact CB-CZ2 3.87Å; W693-W724 HydrophobicContact CE3-CB 3.91Å; W693-W724 AromaticContact CE3-CD1 3.63Å; W693-W724 HydrophobicContact CE3-CD2 4Å; W693-W724 AromaticContact CE3-CG 3.57Å; W693-W724 HydrophobicContact CE3-CG 3.57Å; W693-W724 HydrophobicContact CZ3-CB 3.82Å; W693-W724 AromaticContact CZ3-CG 3.99Å; W693-W724 HydrophobicContact CZ3-CG 3.99Å; W693-W724 PolarHBondContact O-NE1 3.19Å; A696-W724 PolarHBondContact O-NE1 2.82Å; W697-W724 AromaticContact CD2-CD1 3.9Å; W697-W724 AromaticContact CE2-CD1 3.69Å; W697-W724 HydrophobicContact CH2-CB 3.84Å; W697-W724 HydrophobicContact CH2-CG 4.48Å; W697-W724 HydrophobicContact CZ2-CB 4.14Å; W697-W724 AromaticContact CZ2-CD1 3.86Å; W697-W724 HydrophobicContact CZ2-CG 4.45Å; W697-W724 HydrophobicContact CZ3-CB 4.23Å; S720-W724 WeakPolarHBondContact O-CB 3.27Å; S720-W724 PolarHBondContact O-N 3.05Å; L721-W724 HydrophobicContact CD1-CE3 4.03Å; L721-W724 WeakPolarHBondContact O-CB 3.2Å; L721-W724 PolarHBondContact O-N 3.29Å; V722-W724 VanDerWaalsContact C-N 3.31Å; V722-W724 PolarHBondContact O-N 3.42Å; W724-S726 VanDerWaalsContact C-N 3.35Å; W724-S726 PolarHBondContact O-N 2.88Å; W724-A727 PolarHBondContact O-N 3.02Å; W724-W728 AromaticContact CD2-CD1 3.67Å; W724-W728 AromaticContact CE2-CD1 3.37Å; W724-W728 AromaticContact CE2-NE1 3.35Å; W724-W728 VanDerWaalsContact CE2-NE1 3.35Å; W724-W728 AromaticContact CH2-CD1 3.99Å; W724-W728 AromaticContact CZ2-CD1 3.57Å; W724-W728 AromaticContact CZ2-NE1 3.47Å; W724-W728 AromaticContact NE1-CD1 3.72Å; W724-W728 AromaticContact NE1-NE1 3.36Å; W724-W728 PolarHBondContact O-N 2.99Å; W724-W728 VanDerWaalsContact O-N 3.15Å; W724-P735 HydrophobicContact CZ3-CB 4.27Å; W724-P735 HydrophobicContact CZ3-CG 4.49Å; W724-I944 HydrophobicContact CH2-CD1 4.38Å; W724-I944 HydrophobicContact CH2-CG2 3.86Å; W724-I944 HydrophobicContact CZ3-CD1 3.98Å; W724-I944 HydrophobicContact CZ3-CG2 3.97Å; W724-L946 HydrophobicContact CH2-CD1 4.41Å; W724-L946 HydrophobicContact CH2-CD2 4.22Å; W724-L946 HydrophobicContact CZ2-CD2 4.16Å
725	F	91.7	Very high	84.7	Confident	1 Å²	1	22.5 Å²	22.5	0%	0.004	13%	0.128	C	C	.	.	H	α-helix	trans	-58.5	-49	175.2	-75.9	-47	0	0	0	110.5	L721 A727 W728 L729 P735 V777 V780 V786 V797 V800 I944	L721-F725 HydrophobicContact CD1-CD2 4.01Å; L721-F725 HydrophobicContact CD1-CE1 4.28Å; L721-F725 HydrophobicContact CD1-CE2 3.68Å; L721-F725 HydrophobicContact CD1-CG 4.44Å; L721-F725 HydrophobicContact CD1-CZ 3.82Å; L721-F725 HydrophobicContact CD2-CE2 3.95Å; L721-F725 HydrophobicContact CD2-CZ 4.37Å; L721-F725 HydrophobicContact CG-CD2 3.91Å; L721-F725 HydrophobicContact CG-CE2 3.55Å; L721-F725 HydrophobicContact CG-CZ 4.15Å; L721-F725 WeakPolarHBondContact O-CD2 3.4Å; L721-F725 PolarHBondContact O-N 3.23Å; F725-A727 VanDerWaalsContact C-N 3.33Å; F725-A727 PolarHBondContact O-N 3.18Å; F725-W728 PolarHBondContact O-N 2.92Å; F725-L729 HydrophobicContact CB-CD1 4.35Å; F725-L729 WeakPolarHBondContact O-CB 2.96Å; F725-L729 WeakPolarHBondContact O-CD1 3.47Å; F725-L729 WeakPolarHBondContact O-CG 3.35Å; F725-L729 PolarHBondContact O-N 2.87Å; F725-P735 HydrophobicContact CD1-CB 3.77Å; F725-P735 HydrophobicContact CD1-CG 3.64Å; F725-P735 HydrophobicContact CE1-CB 3.69Å; F725-P735 HydrophobicContact CE1-CG 4.12Å; F725-V777 HydrophobicContact CD1-CG1 4.17Å; F725-V777 HydrophobicContact CD1-CG2 4.38Å; F725-V777 HydrophobicContact CE1-CG1 4.49Å; F725-V777 HydrophobicContact CE1-CG2 3.89Å; F725-V777 HydrophobicContact CG-CG1 4.32Å; F725-V777 HydrophobicContact CZ-CG2 4.06Å; F725-V780 HydrophobicContact CB-CG2 3.72Å; F725-V786 HydrophobicContact CD2-CG1 4.45Å; F725-V786 HydrophobicContact CD2-CG2 4.07Å; F725-V786 HydrophobicContact CE2-CG1 4.38Å; F725-V786 HydrophobicContact CE2-CG2 4.16Å; F725-V797 HydrophobicContact CE2-CG2 4.37Å; F725-V800 HydrophobicContact CE2-CG1 4.23Å; F725-V800 HydrophobicContact CZ-CG1 4.1Å; F725-I944 HydrophobicContact CE1-CD1 3.92Å; F725-I944 HydrophobicContact CE1-CG2 4.49Å; F725-I944 HydrophobicContact CZ-CD1 3.95Å
726	S	88.7	Confident	86.3	Confident	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-62.5	-38.6	-177.8	-52.2	0	0	0	0	112.3	L453 V722 W724 Y730	L453-S726 VanDerWaalsContact CD2-OG 3.26Å; L453-S726 WeakPolarHBondContact CD2-OG 3.49Å; V722-S726 WeakPolarHBondContact O-CB 3.1Å; V722-S726 PolarHBondContact O-N 3.06Å; V722-S726 PolarHBondContact O-OG 2.95Å; W724-S726 VanDerWaalsContact C-N 3.35Å; W724-S726 PolarHBondContact O-N 2.88Å; S726-Y730 WeakPolarHBondContact O-CB 3.31Å; S726-Y730 PolarHBondContact O-N 2.88Å
727	A	86	Confident	87	Confident	6 Å²	6	14.6 Å²	14.6	5%	0.05	9%	0.086	C	C	.	.	H	α-helix	trans	-60.9	-48.7	174.6	0	0	0	0	0	112.1	I451 W697 P698 L723 W724 F725 C731	I451-A727 HydrophobicContact CD1-CB 3.82Å; W697-A727 HydrophobicContact CE3-CB 4.25Å; W697-A727 HydrophobicContact CZ3-CB 4.21Å; P698-A727 HydrophobicContact CG-CB 3.82Å; L723-A727 VanDerWaalsContact O-CB 3.29Å; L723-A727 WeakPolarHBondContact O-CB 3.07Å; L723-A727 PolarHBondContact O-N 3.05Å; W724-A727 PolarHBondContact O-N 3.02Å; F725-A727 VanDerWaalsContact C-N 3.33Å; F725-A727 PolarHBondContact O-N 3.18Å; A727-C731 PolarHBondContact O-N 2.8Å; A727-C731 PolarHBondContact O-SG 3.27Å
728	W	88.4	Confident	86.9	Confident	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-70.4	-42	-178.8	-80.1	113.5	0	0	0	112.8	A696 P698 W724 F725 C731 G732 A733 L946 L955 T958 L959	A696-W728 HydrophobicContact CB-CZ2 4.34Å; A696-W728 PolarHBondContact O-NE1 2.95Å; A696-W728 VanDerWaalsContact O-NE1 3.14Å; P698-W728 HydrophobicContact CB-CD2 4.33Å; P698-W728 HydrophobicContact CB-CE3 4.06Å; P698-W728 HydrophobicContact CB-CH2 4.41Å; P698-W728 HydrophobicContact CB-CZ3 4.13Å; P698-W728 HydrophobicContact CG-CD2 4.23Å; P698-W728 HydrophobicContact CG-CE3 4.42Å; W724-W728 AromaticContact CD2-CD1 3.67Å; W724-W728 AromaticContact CE2-CD1 3.37Å; W724-W728 AromaticContact CE2-NE1 3.35Å; W724-W728 VanDerWaalsContact CE2-NE1 3.35Å; W724-W728 AromaticContact CH2-CD1 3.99Å; W724-W728 AromaticContact CZ2-CD1 3.57Å; W724-W728 AromaticContact CZ2-NE1 3.47Å; W724-W728 AromaticContact NE1-CD1 3.72Å; W724-W728 AromaticContact NE1-NE1 3.36Å; W724-W728 PolarHBondContact O-N 2.99Å; W724-W728 VanDerWaalsContact O-N 3.15Å; F725-W728 PolarHBondContact O-N 2.92Å; W728-C731 PolarHBondContact O-N 3.27Å; W728-G732 PolarHBondContact O-N 3.28Å; W728-A733 HydrophobicContact CB-CB 4.19Å; W728-A733 HydrophobicContact CD2-CB 4.45Å; W728-A733 HydrophobicContact CE3-CB 3.66Å; W728-A733 HydrophobicContact CZ3-CB 4.42Å; W728-A733 WeakPolarHBondContact O-CB 3.39Å; W728-A733 PolarHBondContact O-N 2.89Å; W728-L946 HydrophobicContact CB-CD1 4.17Å; W728-L946 HydrophobicContact CD2-CD1 4.22Å; W728-L946 HydrophobicContact CD2-CD2 3.51Å; W728-L946 HydrophobicContact CD2-CG 4.45Å; W728-L946 HydrophobicContact CE3-CD1 4.44Å; W728-L946 HydrophobicContact CE3-CD2 3.84Å; W728-L946 HydrophobicContact CG-CD1 4.13Å; W728-L946 HydrophobicContact CG-CD2 4.02Å; W728-L946 HydrophobicContact CH2-CD2 3.92Å; W728-L946 HydrophobicContact CZ2-CD2 3.62Å; W728-L946 HydrophobicContact CZ3-CD2 4.02Å; W728-L955 HydrophobicContact CE3-CD2 4.5Å; W728-L955 HydrophobicContact CZ3-CD2 3.97Å; W728-T958 HydrophobicContact CH2-CG2 4.31Å; W728-L959 HydrophobicContact CH2-CD1 4.15Å
729	L	90.2	Very high	86.4	Confident	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-61.7	-43.9	175.8	-67	166.8	0	0	0	111.5	F455 L457 F725 C731 G732 P735 V777 V780	F455-L729 HydrophobicContact CD1-CB 3.6Å; F455-L729 VanDerWaalsContact CE1-C 3.46Å; F455-L729 HydrophobicContact CE1-CB 3.7Å; F455-L729 WeakPolarHBondContact CE1-O 3.43Å; L457-L729 HydrophobicContact CD1-CD2 3.48Å; L457-L729 VanDerWaalsContact CD1-CD2 3.48Å; L457-L729 HydrophobicContact CG-CD2 3.91Å; F725-L729 HydrophobicContact CB-CD1 4.35Å; F725-L729 WeakPolarHBondContact O-CB 2.96Å; F725-L729 WeakPolarHBondContact O-CD1 3.47Å; F725-L729 WeakPolarHBondContact O-CG 3.35Å; F725-L729 PolarHBondContact O-N 2.87Å; L729-C731 PolarHBondContact O-N 2.87Å; L729-G732 PolarHBondContact O-N 2.99Å; L729-P735 HydrophobicContact CD2-CG 4.18Å; L729-P735 HydrophobicContact CG-CG 4.38Å; L729-V777 HydrophobicContact CD1-CG1 4.11Å; L729-V777 HydrophobicContact CD2-CG1 4.47Å; L729-V780 HydrophobicContact CD1-CG2 3.7Å
730	Y	86	Confident	85.8	Confident	56 Å²	56	11.1 Å²	11.1	22%	0.22	7%	0.067	C	C	.	.	H	α-helix	trans	-60.8	-33.5	177.1	180	-107.5	0	0	0	112.6	P452 F455 S726 G732	P452-Y730 HydrophobicContact CG-CD2 3.38Å; P452-Y730 HydrophobicContact CG-CE2 3.61Å; P452-Y730 HydrophobicContact CG-CG 4.13Å; F455-Y730 HydrophobicContact CD2-CD2 4.18Å; F455-Y730 AromaticContact CE2-CD2 3.83Å; F455-Y730 HydrophobicContact CE2-CD2 3.83Å; S726-Y730 WeakPolarHBondContact O-CB 3.31Å; S726-Y730 PolarHBondContact O-N 2.88Å; Y730-G732 VanDerWaalsContact C-N 3.25Å; Y730-G732 PolarHBondContact O-N 3.01Å
731	C	83.6	Confident	85.1	Confident	29 Å²	29	12.5 Å²	12.5	20%	0.196	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-3.8	173.9	-62	0	0	0	0	114.2	P698 I700 A727 W728 L729 L955	P698-C731 HydrophobicContact CB-CB 4.42Å; I700-C731 HydrophobicContact CD1-CB 4.48Å; A727-C731 PolarHBondContact O-N 2.8Å; A727-C731 PolarHBondContact O-SG 3.27Å; W728-C731 PolarHBondContact O-N 3.27Å; L729-C731 PolarHBondContact O-N 2.87Å; C731-L955 HydrophobicContact CB-CD1 3.81Å; C731-L955 HydrophobicContact CB-CD2 3.91Å; C731-L955 HydrophobicContact CB-CG 4.45Å; C731-L955 WeakPolarHBondContact O-CD1 3.46Å
732	G	84	Confident	83.7	Confident	34 Å²	34	16.3 Å²	16.3	35%	0.351	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.2	19	-177.9	0	0	0	0	0	114.7	L480 W728 L729 Y730	L480-G732 VanDerWaalsContact CD2-O 3.31Å; L480-G732 WeakPolarHBondContact CD2-O 2.98Å; W728-G732 PolarHBondContact O-N 3.28Å; L729-G732 PolarHBondContact O-N 2.99Å; Y730-G732 VanDerWaalsContact C-N 3.25Å; Y730-G732 PolarHBondContact O-N 3.01Å
733	A	87.4	Confident	81.5	Confident	0 Å²	0	19.9 Å²	19.9	0%	0	12%	0.122	C	C	.	.			trans	-89	156.5	169.8	0	0	0	0	0	111.4	W728 L946 F947 V948	W728-A733 HydrophobicContact CB-CB 4.19Å; W728-A733 HydrophobicContact CD2-CB 4.45Å; W728-A733 HydrophobicContact CE3-CB 3.66Å; W728-A733 HydrophobicContact CZ3-CB 4.42Å; W728-A733 WeakPolarHBondContact O-CB 3.39Å; W728-A733 PolarHBondContact O-N 2.89Å; A733-L946 HydrophobicContact CB-CD1 3.9Å; A733-F947 WeakPolarHBondContact CA-O 3.45Å; A733-V948 HydrophobicContact CB-CG1 3.47Å; A733-V948 VanDerWaalsContact CB-CG1 3.47Å
734	I	88.8	Confident	79.2	Confident	1 Å²	1	23.4 Å²	23.4	1%	0.005	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	113.6	-178.7	-60.3	-179.9	0	0	0	110.5	L457 I476 C479 L480 V736 L776 F947	L457-I734 HydrophobicContact CD1-CG1 4.14Å; I476-I734 HydrophobicContact CG2-CD1 4.27Å; I476-I734 WeakPolarHBondContact O-CD1 3.44Å; C479-I734 HydrophobicContact CB-CD1 3.37Å; C479-I734 HydrophobicContact CB-CG1 4.2Å; L480-I734 HydrophobicContact CD2-CD1 3.87Å; L480-I734 HydrophobicContact CD2-CG1 3.97Å; L480-I734 HydrophobicContact CG-CD1 3.63Å; L480-I734 HydrophobicContact CG-CG1 4.29Å; I734-V736 HydrophobicContact CG2-CG2 4Å; I734-L776 HydrophobicContact CG2-CD1 3.46Å; I734-L776 VanDerWaalsContact CG2-CD1 3.46Å; I734-L776 HydrophobicContact CG2-CD2 4.37Å; I734-L776 HydrophobicContact CG2-CG 3.63Å; I734-F947 HydrophobicContact CB-CB 4.36Å; I734-F947 PolarHBondContact N-O 2.78Å; I734-F947 PolarHBondContact O-N 3Å
735	P	90.3	Very high	76.7	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	139.4	164.4	-1.8	19.3	0	0	0	111	W724 F725 L729 V777 I944 S945 L946	W724-P735 HydrophobicContact CZ3-CB 4.27Å; W724-P735 HydrophobicContact CZ3-CG 4.49Å; F725-P735 HydrophobicContact CD1-CB 3.77Å; F725-P735 HydrophobicContact CD1-CG 3.64Å; F725-P735 HydrophobicContact CE1-CB 3.69Å; F725-P735 HydrophobicContact CE1-CG 4.12Å; L729-P735 HydrophobicContact CD2-CG 4.18Å; L729-P735 HydrophobicContact CG-CG 4.38Å; P735-V777 HydrophobicContact CB-CB 3.98Å; P735-V777 HydrophobicContact CB-CG2 4.17Å; P735-V777 HydrophobicContact CG-CB 4.04Å; P735-V777 HydrophobicContact CG-CG1 4.27Å; P735-V777 PolarHBondContact O-N 3.04Å; P735-I944 HydrophobicContact CB-CG2 3.96Å; P735-S945 CarbonylContact C-O 3.56Å; P735-S945 WeakPolarHBondContact CA-O 3.2Å; P735-L946 HydrophobicContact CG-CD1 4.41Å
736	V	86.6	Confident	73.7	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	119.2	172.2	-179.1	0	0	0	0	108.1	T472 I476 I734 H774 R775 L776 S945 F947	T472-V736 HydrophobicContact CG2-CG1 4.13Å; I476-V736 HydrophobicContact CD1-CG2 4.13Å; I476-V736 HydrophobicContact CG1-CG2 4.1Å; I734-V736 HydrophobicContact CG2-CG2 4Å; V736-H774 HydrophobicContact CG1-CB 3.99Å; V736-R775 CarbonylContact C-O 3.57Å; V736-R775 WeakPolarHBondContact CA-O 3.19Å; V736-L776 HydrophobicContact CG2-CB 4.19Å; V736-L776 HydrophobicContact CG2-CD1 4.39Å; V736-L776 HydrophobicContact CG2-CG 4.27Å; V736-S945 PolarHBondContact N-O 3.4Å; V736-S945 PolarHBondContact O-N 2.86Å; V736-F947 HydrophobicContact CB-CE2 4.2Å; V736-F947 HydrophobicContact CG2-CD2 3.89Å; V736-F947 HydrophobicContact CG2-CE2 3.82Å
737	L	86.5	Confident	70.7	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.01	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	117.2	177.3	178.9	64.2	0	0	0	109.6	Q739 H774 R775 L788 V800 L804	L737-Q739 HydrophobicContact CD2-CB 4.5Å; L737-Q739 VanDerWaalsContact CD2-OE1 3.23Å; L737-Q739 HydrophobicContact CG-CB 4.24Å; L737-H774 WeakPolarHBondContact O-CA 3.36Å; L737-R775 PolarHBondContact N-O 2.86Å; L737-R775 PolarHBondContact O-N 2.83Å; L737-L788 HydrophobicContact CD2-CD1 4.32Å; L737-V800 HydrophobicContact CD1-CG1 4.17Å; L737-V800 HydrophobicContact CD2-CG1 4.04Å; L737-V800 HydrophobicContact CD2-CG2 4.43Å; L737-L804 HydrophobicContact CD1-CD2 3.7Å; L737-L804 HydrophobicContact CD1-CG 3.96Å
738	A	80.3	Confident	67.8	Low	4 Å²	4	47.9 Å²	47.9	3%	0.033	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	107	166.9	0	0	0	0	0	108.4	F686 S773 P942 G943	F686-A738 HydrophobicContact CE2-CB 4.06Å; A738-S773 WeakPolarHBondContact CA-O 3.46Å; A738-P942 VanDerWaalsContact O-CA 3.27Å; A738-P942 WeakPolarHBondContact O-CA 3.27Å; A738-P942 WeakPolarHBondContact O-CB 3.4Å; A738-G943 PolarHBondContact N-O 3.06Å; A738-G943 PolarHBondContact O-N 3.34Å
739	Q	77.6	Confident	64.7	Low	10 Å²	10	57 Å²	57	5%	0.047	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	152	-179.8	70.9	176.4	37.9	0	0	111.5	L737 W772 S773 Y799 Q803	L737-Q739 HydrophobicContact CD2-CB 4.5Å; L737-Q739 VanDerWaalsContact CD2-OE1 3.23Å; L737-Q739 HydrophobicContact CG-CB 4.24Å; Q739-W772 VanDerWaalsContact C-CE3 3.41Å; Q739-S773 WeakPolarHBondContact CG-OG 3.45Å; Q739-S773 PolarHBondContact N-O 3Å; Q739-S773 PolarHBondContact O-N 3.36Å; Q739-S773 PolarHBondContact O-OG 2.97Å; Q739-S773 VanDerWaalsContact O-OG 3.06Å; Q739-Y799 PolarHBondContact NE2-OH 3.31Å; Q739-Y799 VanDerWaalsContact NE2-OH 3.12Å; Q739-Q803 HydrophobicContact CB-CB 4.31Å
740	L	70.2	Confident	61.6	Low	34 Å²	34	67.2 Å²	67.2	18%	0.178	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	137.7	177.6	-158.4	75.6	0	0	0	110.3	D742 L770 W772 P808	L740-D742 PolarHBondContact O-N 3.48Å; L740-L770 HydrophobicContact CD1-CB 3.87Å; L740-L770 HydrophobicContact CD1-CD2 3.82Å; L740-L770 HydrophobicContact CD1-CG 4.38Å; L740-L770 HydrophobicContact CD2-CD2 4.14Å; L740-W772 HydrophobicContact CB-CZ3 4.38Å; L740-W772 HydrophobicContact CD1-CD2 4.08Å; L740-W772 HydrophobicContact CD1-CE3 4.43Å; L740-W772 HydrophobicContact CD1-CH2 4.24Å; L740-W772 HydrophobicContact CD1-CZ2 3.88Å; L740-W772 HydrophobicContact CD1-CZ3 4.5Å; L740-P808 HydrophobicContact CD2-CB 4.25Å
741	C	68.3	Low	58.5	Low	43 Å²	43	70.1 Å²	70.1	29%	0.291	39%	0.389	S	S	.	.			trans	-70	117.1	173.6	-72.1	0	0	0	0	110.4	S743 V771 S773	C741-S743 PolarHBondContact O-N 2.98Å; C741-V771 HydrophobicContact CB-CB 4.11Å; C741-V771 HydrophobicContact CB-CG1 4.08Å; C741-V771 WeakPolarHBondContact CB-O 3.47Å; C741-V771 PolarHBondContact N-O 2.7Å; C741-S773 VanDerWaalsContact SG-CB 3.6Å
742	D	59.2	Low	55.7	Low	79 Å²	79	73.9 Å²	73.9	42%	0.422	41%	0.413	S	S	.	.			trans	-72.4	71.2	172	-68.7	-40.5	0	0	0	110.5	L740 V744 Y745 Q803 K806	L740-D742 PolarHBondContact O-N 3.48Å; D742-V744 PolarHBondContact O-N 2.94Å; D742-Y745 PolarHBondContact O-N 3.32Å; D742-Q803 PolarHBondContact OD2-NE2 2.97Å; D742-K806 IonicContact OD1-NZ 2.74Å; D742-K806 PolarHBondContact OD1-NZ 2.96Å; D742-K806 IonicContact OD2-NZ 3.16Å; D742-K806 PolarHBondContact OD2-NZ 3.3Å
743	S	44.3	Very low	53.1	Low	79 Å²	79	78.7 Å²	78.7	55%	0.552	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	11.6	-173	57.7	0	0	0	0	115.6	C741	C741-S743 PolarHBondContact O-N 2.98Å
744	V	37.2	Very low	50.1	Low	113 Å²	113	86 Å²	86	69%	0.685	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-25.8	174.4	-177.9	0	0	0	0	111.7	D742	D742-V744 PolarHBondContact O-N 2.94Å
745	Y	35.2	Very low	47.1	Very low	184 Å²	184	93.4 Å²	93.4	72%	0.722	52%	0.515	S	S	*	.	S	Bend	trans	-107.9	-13.7	-167.6	-81.6	-80.1	0	0	0	116.8	D742 N747 A748	D742-Y745 PolarHBondContact O-N 3.32Å; Y745-N747 PolarHBondContact O-N 2.83Å; Y745-A748 PolarHBondContact O-N 2.85Å
746	S	28.7	Very low	44	Very low	102 Å²	102	101.1 Å²	101.1	71%	0.713	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	6.6	-169.1	56.7	0	0	0	0	116.6
747	N	25.5	Very low	41.2	Very low	163 Å²	163	109.8 Å²	109.8	87%	0.872	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.9	6.2	175.5	-98.7	-44.6	0	0	0	115.1	Y745 K749	Y745-N747 PolarHBondContact O-N 2.83Å; N747-K749 PolarHBondContact O-N 2.83Å
748	A	25.9	Very low	38.4	Very low	73 Å²	73	115.8 Å²	115.8	60%	0.603	64%	0.635	S	S	*	*			trans	-94.2	75.6	-174.1	0	0	0	0	0	113	Y745 Y750	Y745-A748 PolarHBondContact O-N 2.85Å; A748-Y750 PolarHBondContact O-N 2.79Å
749	K	23.1	Very low	35.7	Very low	192 Å²	192	121 Å²	121	84%	0.835	67%	0.671	S	S	*	*			trans	-70	113	166.1	-95.6	-176.1	176.7	177.9	0	110.1	N747	N747-K749 PolarHBondContact O-N 2.83Å
750	Y	24.2	Very low	33.3	Very low	214 Å²	214	126.5 Å²	126.5	84%	0.839	71%	0.709	S	S	*	*	S	Bend	trans	60.7	106.1	169.1	-65.7	-89.9	0	0	0	118	A748	A748-Y750 PolarHBondContact O-N 2.79Å
751	S	21.1	Very low	31.1	Very low	116 Å²	116	134.9 Å²	134.9	81%	0.811	75%	0.745	S	S	*	*				-171.2	143.5	125.2	-78.6	0	0	0	0	110.5
752	P	26.2	Very low	29.2	Very low	108 Å²	108	136.5 Å²	136.5	70%	0.701	76%	0.756	S	S	*	*			trans	-75.1	162.9	173.7	32.8	-35.1	0	0	0	112	D754	P752-D754 PolarHBondContact O-N 3.25Å; P752-D754 VanDerWaalsContact O-N 3.09Å
753	P	29.1	Very low	27.6	Very low	135 Å²	135	138.7 Å²	138.7	88%	0.877	78%	0.778	S	S	*	*			trans	-83.9	85.3	-171.8	33.8	-35.8	0	0	0	112.6
754	D	23.4	Very low	27.1	Very low	153 Å²	153	145.2 Å²	145.2	82%	0.818	79%	0.79	S	S	*	*			trans	-85.8	142.9	168.4	-110.5	-40.7	0	0	0	112.8	P752 L756	P752-D754 PolarHBondContact O-N 3.25Å; P752-D754 VanDerWaalsContact O-N 3.09Å; D754-L756 PolarHBondContact O-N 3.1Å
755	I	27.2	Very low	27	Very low	158 Å²	158	147.8 Å²	147.8	81%	0.81	79%	0.789	S	S	*	*			trans	-67.3	119.6	-167.8	-62.6	155.1	0	0	0	111.8
756	L	25.4	Very low	27.1	Very low	161 Å²	161	144.1 Å²	144.1	84%	0.843	79%	0.787	S	S	*	*			trans	-171.5	136.2	145.8	-105.7	162.5	0	0	0	111.9	D754 P758	D754-L756 PolarHBondContact O-N 3.1Å; L756-P758 WeakPolarHBondContact O-CD 3.32Å
757	Q	27.3	Very low	27.6	Very low	182 Å²	182	142.1 Å²	142.1	85%	0.85	77%	0.771	S	S	*	*			trans	-72.6	126.4	176.8	-71.7	178.2	-24.6	0	0	111.8	S759	Q757-S759 PolarHBondContact O-N 3.18Å
758	P	27.2	Very low	28.8	Very low	129 Å²	129	139.3 Å²	139.3	84%	0.838	75%	0.752	S	S	*	*			trans	-75.8	114.1	168.9	-12.1	28.7	0	0	0	110.3	L756	L756-P758 WeakPolarHBondContact O-CD 3.32Å
759	S	23.3	Very low	29.9	Very low	113 Å²	113	141.3 Å²	141.3	79%	0.79	75%	0.749	S	S	*	*			trans	-69.9	154.8	176.8	56.4	0	0	0	0	112.6	Q757 K761	Q757-S759 PolarHBondContact O-N 3.18Å; S759-K761 PolarHBondContact O-N 3.37Å; S759-K761 VanDerWaalsContact O-N 3.12Å
760	C	26.8	Very low	31.5	Very low	125 Å²	125	133.4 Å²	133.4	85%	0.845	72%	0.716	S	S	*	*	S	Bend	trans	-55.9	114.3	-176.7	-70.9	0	0	0	0	113.7
761	K	24.4	Very low	33.1	Very low	211 Å²	211	126.9 Å²	126.9	92%	0.917	70%	0.698	S	S	*	*			trans	-176.6	73.8	145.9	-98.6	148.9	-169	175	0	113.4	S759	S759-K761 PolarHBondContact O-N 3.37Å; S759-K761 VanDerWaalsContact O-N 3.12Å
762	S	28.1	Very low	35.2	Very low	77 Å²	77	122.6 Å²	122.6	54%	0.538	67%	0.665	S	S	.	*			trans	-153.7	113.9	155.7	-174	0	0	0	0	111.7	R764	S762-R764 VanDerWaalsContact C-N 3.26Å; S762-R764 PolarHBondContact O-N 3.45Å
763	S	26.2	Very low	37.4	Very low	124 Å²	124	118.7 Å²	118.7	87%	0.867	64%	0.64	S	S	*	*			trans	-89.7	25	176.5	48.5	0	0	0	0	113
764	R	33	Very low	39.7	Very low	216 Å²	216	112.9 Å²	112.9	82%	0.815	60%	0.601	S	S	*	*			trans	-109.4	43.2	-176.5	-62.8	-166.8	-173.8	-178.2	3.3	114.2	S762 P766	S762-R764 VanDerWaalsContact C-N 3.26Å; S762-R764 PolarHBondContact O-N 3.45Å; R764-P766 VanDerWaalsContact O-CD 3.25Å; R764-P766 WeakPolarHBondContact O-CD 3.46Å
765	Y	36.1	Very low	42.6	Very low	168 Å²	168	105.9 Å²	105.9	66%	0.659	56%	0.563	S	S	*	*			trans	-94.7	100.6	159.8	-68.7	-73.5	0	0	0	107.9
766	P	36.1	Very low	45.5	Very low	107 Å²	107	98.4 Å²	98.4	70%	0.695	52%	0.524	S	S	*	.			trans	-60.7	159.7	168.2	28.9	-34.5	0	0	0	109.4	R764 Q768	R764-P766 VanDerWaalsContact O-CD 3.25Å; R764-P766 WeakPolarHBondContact O-CD 3.46Å; P766-Q768 PolarHBondContact O-N 3.43Å
767	T	39.5	Very low	48.7	Very low	59 Å²	59	90.7 Å²	90.7	36%	0.362	48%	0.484	S	S	.	.			trans	-47.9	116.8	170.1	23.2	0	0	0	0	109.9	E769 R811 Q816	T767-E769 PolarHBondContact O-N 3.04Å; T767-R811 WeakPolarHBondContact CG2-O 3.3Å; T767-Q816 VanDerWaalsContact CG2-OE1 3.22Å; T767-Q816 PolarHBondContact OG1-NE2 3.1Å; T767-Q816 VanDerWaalsContact OG1-NE2 3.16Å
768	Q	50.7	Low	51.8	Low	104 Å²	104	82.2 Å²	82.2	49%	0.486	45%	0.445	S	S	.	.			trans	-70.9	100.7	175.4	-75.2	174.4	-67.2	0	0	108.1	P766	P766-Q768 PolarHBondContact O-N 3.43Å
769	E	49.1	Very low	54.9	Low	116 Å²	116	76.1 Å²	76.1	54%	0.542	41%	0.405	S	S	.	.			trans	-63.6	136.7	168.3	-174.6	166.8	-167.2	0	0	109	T767 V771	T767-E769 PolarHBondContact O-N 3.04Å; E769-V771 VanDerWaalsContact C-N 3.33Å; E769-V771 PolarHBondContact O-N 3.17Å
770	L	56.3	Low	58.1	Low	26 Å²	26	70.7 Å²	70.7	14%	0.136	37%	0.367	C	S	.	.			trans	-75.8	88.5	178.5	-65.2	178.5	0	0	0	108.7	L740 W772 P808 I810 S938 Q940	L740-L770 HydrophobicContact CD1-CB 3.87Å; L740-L770 HydrophobicContact CD1-CD2 3.82Å; L740-L770 HydrophobicContact CD1-CG 4.38Å; L740-L770 HydrophobicContact CD2-CD2 4.14Å; L770-W772 PolarHBondContact O-NE1 2.7Å; L770-P808 HydrophobicContact CD1-CB 4.24Å; L770-P808 HydrophobicContact CD2-CB 4.03Å; L770-I810 HydrophobicContact CD1-CD1 3.98Å; L770-I810 HydrophobicContact CD1-CG1 3.7Å; L770-I810 HydrophobicContact CG-CG1 4.07Å; L770-S938 VanDerWaalsContact CD1-OG 3.3Å; L770-S938 WeakPolarHBondContact CD1-OG 3.27Å; L770-Q940 HydrophobicContact CD1-CB 4.29Å; L770-Q940 HydrophobicContact CD1-CG 4.2Å
771	V	58	Low	61.1	Low	77 Å²	77	65.4 Å²	65.4	47%	0.467	33%	0.331	S	S	.	.			trans	-77.3	124.8	174.7	-173.8	0	0	0	0	108.8	C741 E769	C741-V771 HydrophobicContact CB-CB 4.11Å; C741-V771 HydrophobicContact CB-CG1 4.08Å; C741-V771 WeakPolarHBondContact CB-O 3.47Å; C741-V771 PolarHBondContact N-O 2.7Å; E769-V771 VanDerWaalsContact C-N 3.33Å; E769-V771 PolarHBondContact O-N 3.17Å
772	W	67	Low	63.9	Low	26 Å²	26	62 Å²	62	10%	0.098	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	146.6	-179.1	-67.6	88.9	0	0	0	111.9	S587 Q739 L740 L770 P808 Q940 P942	S587-W772 PolarHBondContact O-NE1 3.15Å; S587-W772 VanDerWaalsContact O-NE1 3.1Å; Q739-W772 VanDerWaalsContact C-CE3 3.41Å; L740-W772 HydrophobicContact CB-CZ3 4.38Å; L740-W772 HydrophobicContact CD1-CD2 4.08Å; L740-W772 HydrophobicContact CD1-CE3 4.43Å; L740-W772 HydrophobicContact CD1-CH2 4.24Å; L740-W772 HydrophobicContact CD1-CZ2 3.88Å; L740-W772 HydrophobicContact CD1-CZ3 4.5Å; L770-W772 PolarHBondContact O-NE1 2.7Å; W772-P808 HydrophobicContact CH2-CG 4.31Å; W772-P808 HydrophobicContact CZ2-CG 4.35Å; W772-Q940 HydrophobicContact CZ2-CB 3.82Å; W772-P942 HydrophobicContact CH2-CB 4.49Å; W772-P942 HydrophobicContact CH2-CG 3.96Å; W772-P942 HydrophobicContact CZ3-CB 4.05Å; W772-P942 HydrophobicContact CZ3-CG 3.88Å
773	S	71.7	Confident	66.6	Low	26 Å²	26	64.3 Å²	64.3	18%	0.182	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	140.5	171.6	55	0	0	0	0	110.3	A738 Q739 C741	A738-S773 WeakPolarHBondContact CA-O 3.46Å; Q739-S773 WeakPolarHBondContact CG-OG 3.45Å; Q739-S773 PolarHBondContact N-O 3Å; Q739-S773 PolarHBondContact O-N 3.36Å; Q739-S773 PolarHBondContact O-OG 2.97Å; Q739-S773 VanDerWaalsContact O-OG 3.06Å; C741-S773 VanDerWaalsContact SG-CB 3.6Å
774	H	77.3	Confident	69.4	Low	13 Å²	13	60.9 Å²	60.9	6%	0.06	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	102.1	-179.1	-66.2	-87	0	0	0	109.2	T472 S587 V736 L737	T472-H774 HydrophobicContact CG2-CB 3.98Å; T472-H774 WeakPolarHBondContact CG2-O 3.44Å; T472-H774 PolarHBondContact OG1-O 2.79Å; S587-H774 PolarHBondContact OG-NE2 3.13Å; V736-H774 HydrophobicContact CG1-CB 3.99Å; L737-H774 WeakPolarHBondContact O-CA 3.36Å
775	R	83.8	Confident	72.2	Confident	6 Å²	6	53 Å²	53	2%	0.023	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	115.4	-171.8	-55.7	-167.8	67.9	-169.6	0.6	109.4	V736 L737 L788 T789 N790 P791 E793	V736-R775 CarbonylContact C-O 3.57Å; V736-R775 WeakPolarHBondContact CA-O 3.19Å; L737-R775 PolarHBondContact N-O 2.86Å; L737-R775 PolarHBondContact O-N 2.83Å; R775-L788 HydrophobicContact CB-CD2 4.36Å; R775-T789 WeakPolarHBondContact CB-O 3.5Å; R775-T789 PolarHBondContact NE-O 3.17Å; R775-T789 PolarHBondContact NH2-O 2.6Å; R775-N790 PolarHBondContact NE-O 2.98Å; R775-P791 PolarHBondContact NH2-O 3.47Å; R775-E793 IonicContact CZ-OE1 3.99Å; R775-E793 IonicContact NH1-OE1 3.25Å; R775-E793 PolarHBondContact NH1-OE1 2.87Å; R775-E793 VanDerWaalsContact NH2-CG 3.32Å; R775-E793 IonicContact NH2-OE1 2.9Å; R775-E793 PolarHBondContact NH2-OE1 2.73Å
776	L	88.9	Confident	74.9	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77	134.4	-177.5	178.1	151.8	0	0	0	109.7	N475 I476 I734 V736 Y778 L788 T789	N475-L776 HydrophobicContact CB-CD1 4.01Å; I476-L776 HydrophobicContact CB-CD1 4.41Å; I476-L776 HydrophobicContact CG1-CD1 3.74Å; I734-L776 HydrophobicContact CG2-CD1 3.46Å; I734-L776 VanDerWaalsContact CG2-CD1 3.46Å; I734-L776 HydrophobicContact CG2-CD2 4.37Å; I734-L776 HydrophobicContact CG2-CG 3.63Å; V736-L776 HydrophobicContact CG2-CB 4.19Å; V736-L776 HydrophobicContact CG2-CD1 4.39Å; V736-L776 HydrophobicContact CG2-CG 4.27Å; L776-Y778 HydrophobicContact CD2-CD1 4.5Å; L776-L788 CarbonylContact O-C 3.57Å; L776-L788 WeakPolarHBondContact O-CA 3.41Å; L776-T789 HydrophobicContact CB-CG2 3.87Å; L776-T789 HydrophobicContact CD2-CG2 3.93Å; L776-T789 PolarHBondContact N-OG1 2.86Å; L776-T789 PolarHBondContact O-N 3.41Å
777	V	92.8	Very high	77.7	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	116.7	170.8	175.5	0	0	0	0	107.5	F725 L729 P735 V786 Y787 L788	F725-V777 HydrophobicContact CD1-CG1 4.17Å; F725-V777 HydrophobicContact CD1-CG2 4.38Å; F725-V777 HydrophobicContact CE1-CG1 4.49Å; F725-V777 HydrophobicContact CE1-CG2 3.89Å; F725-V777 HydrophobicContact CG-CG1 4.32Å; F725-V777 HydrophobicContact CZ-CG2 4.06Å; L729-V777 HydrophobicContact CD1-CG1 4.11Å; L729-V777 HydrophobicContact CD2-CG1 4.47Å; P735-V777 HydrophobicContact CB-CB 3.98Å; P735-V777 HydrophobicContact CB-CG2 4.17Å; P735-V777 HydrophobicContact CG-CB 4.04Å; P735-V777 HydrophobicContact CG-CG1 4.27Å; P735-V777 PolarHBondContact O-N 3.04Å; V777-V786 HydrophobicContact CB-CG1 4.39Å; V777-V786 HydrophobicContact CG1-CG1 3.61Å; V777-V786 HydrophobicContact CG2-CG1 4.02Å; V777-Y787 WeakPolarHBondContact CA-O 3.48Å; V777-L788 HydrophobicContact CG2-CD2 3.65Å
778	Y	92	Very high	80.1	Confident	4 Å²	4	40.2 Å²	40.2	2%	0.016	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	-5.5	179.4	67.3	-83.9	0	0	0	114.4	M456 L457 T460 L463 L776 Y787 T789	M456-Y778 CarbonylContact C-O 3.43Å; M456-Y778 WeakPolarHBondContact CA-O 3.44Å; M456-Y778 HydrophobicContact CG-CD2 3.86Å; M456-Y778 HydrophobicContact CG-CE2 4.22Å; M456-Y778 HydrophobicContact SD-CD2 4.16Å; M456-Y778 HydrophobicContact SD-CE2 3.89Å; L457-Y778 PolarHBondContact N-O 2.85Å; T460-Y778 VanDerWaalsContact CG2-OH 3.32Å; T460-Y778 WeakPolarHBondContact CG2-OH 3.41Å; T460-Y778 WeakPolarHBondContact OG1-CE2 3.49Å; T460-Y778 PolarHBondContact OG1-OH 3.38Å; T460-Y778 VanDerWaalsContact OG1-OH 3.05Å; L463-Y778 HydrophobicContact CD1-CD1 3.71Å; L463-Y778 HydrophobicContact CD1-CD2 3.89Å; L463-Y778 HydrophobicContact CD1-CE1 3.59Å; L463-Y778 HydrophobicContact CD1-CE2 3.79Å; L463-Y778 HydrophobicContact CD1-CG 3.85Å; L776-Y778 HydrophobicContact CD2-CD1 4.5Å; Y778-Y787 WeakPolarHBondContact CD1-O 3.09Å; Y778-Y787 HydrophobicContact CE2-CD1 4.44Å; Y778-Y787 HydrophobicContact CE2-CG 4.27Å; Y778-Y787 PolarHBondContact N-O 3.31Å; Y778-Y787 VanDerWaalsContact N-O 3.09Å; Y778-T789 HydrophobicContact CD1-CG2 3.74Å; Y778-T789 HydrophobicContact CE1-CG2 4.06Å
779	G	91.2	Very high	81.7	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172.1	169	176.5	0	0	0	0	0	114	F455 Y787	F455-G779 CarbonylContact O-C 3.57Å; F455-G779 WeakPolarHBondContact O-CA 3.37Å; G779-Y787 PolarHBondContact O-N 2.9Å
780	V	91.9	Very high	82.8	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	137.3	-176.7	-174.7	0	0	0	0	109.4	L453 P454 F455 V722 F725 L729 E785	L453-V780 HydrophobicContact CD2-CB 4.39Å; L453-V780 HydrophobicContact CD2-CG1 3.88Å; P454-V780 WeakPolarHBondContact CA-O 3.04Å; P454-V780 WeakPolarHBondContact CB-O 3.32Å; F455-V780 PolarHBondContact N-O 3.4Å; F455-V780 PolarHBondContact O-N 3.35Å; V722-V780 HydrophobicContact CB-CG1 4.39Å; V722-V780 HydrophobicContact CG1-CG1 3.8Å; V722-V780 HydrophobicContact CG2-CG1 4.32Å; F725-V780 HydrophobicContact CB-CG2 3.72Å; L729-V780 HydrophobicContact CD1-CG2 3.7Å; V780-E785 CarbonylContact C-O 3.54Å; V780-E785 WeakPolarHBondContact CA-O 3.34Å
781	T	88.9	Confident	83.7	Confident	14 Å²	14	33.4 Å²	33.4	9%	0.086	18%	0.175	C	C	.	.			trans	-96.1	165.1	178.5	73	0	0	0	0	112.3	N783 E785 Y787 L794	T781-N783 PolarHBondContact O-N 3.31Å; T781-N783 PolarHBondContact OG1-N 3.3Å; T781-E785 HydrophobicContact CG2-CB 4.29Å; T781-E785 PolarHBondContact N-O 2.86Å; T781-E785 VanDerWaalsContact OG1-CB 3.28Å; T781-E785 WeakPolarHBondContact OG1-CB 3.48Å; T781-E785 PolarHBondContact OG1-N 2.87Å; T781-E785 PolarHBondContact OG1-OE2 3.2Å; T781-E785 VanDerWaalsContact OG1-OE2 3.06Å; T781-Y787 HydrophobicContact CG2-CD2 4.44Å; T781-Y787 HydrophobicContact CG2-CE2 3.65Å; T781-L794 HydrophobicContact CG2-CD1 3.87Å; T781-L794 HydrophobicContact CG2-CD2 4.17Å
782	E	83	Confident	84.9	Confident	138 Å²	138	32.3 Å²	32.3	65%	0.645	17%	0.166	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-24.3	170.4	-60.1	179.6	159.6	0	0	112.6	L453 P454 N784	L453-E782 HydrophobicContact CB-CG 4.35Å; P454-E782 HydrophobicContact CB-CG 4.43Å; P454-E782 WeakPolarHBondContact CD-OE1 3.31Å; P454-E782 HydrophobicContact CG-CG 4.49Å; E782-N784 PolarHBondContact O-N 2.78Å
783	N	84.6	Confident	86	Confident	127 Å²	127	34.4 Å²	34.4	68%	0.679	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.7	18.1	-176.2	-62.8	-27.4	0	0	0	113.9	T781 E785	T781-N783 PolarHBondContact O-N 3.31Å; T781-N783 PolarHBondContact OG1-N 3.3Å; N783-E785 VanDerWaalsContact C-N 3.3Å; N783-E785 HydrophobicContact CB-CG 4.16Å; N783-E785 WeakPolarHBondContact CB-OE2 3.47Å; N783-E785 PolarHBondContact O-N 3.28Å
784	N	86.3	Confident	86.9	Confident	51 Å²	51	36.2 Å²	36.2	27%	0.273	19%	0.185	S	C	.	.	S	Bend	trans	59	32.7	-171.4	-73.4	-20.4	0	0	0	114.2	D719 V722 E782 V797	D719-N784 PolarHBondContact OD1-ND2 3.17Å; V722-N784 WeakPolarHBondContact CG1-OD1 3.39Å; V722-N784 HydrophobicContact CG2-CB 3.9Å; V722-N784 WeakPolarHBondContact CG2-OD1 3.32Å; E782-N784 PolarHBondContact O-N 2.78Å; N784-V797 HydrophobicContact CB-CG1 4.14Å; N784-V797 WeakPolarHBondContact O-CB 3.2Å; N784-V797 WeakPolarHBondContact O-CG1 3.28Å; N784-V797 PolarHBondContact O-N 3.11Å
785	E	91.7	Very high	87.7	Confident	50 Å²	50	36.2 Å²	36.2	23%	0.234	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	154.3	175.2	-49.6	161.6	112	0	0	111.4	V780 T781 N783 L794 V795	V780-E785 CarbonylContact C-O 3.54Å; V780-E785 WeakPolarHBondContact CA-O 3.34Å; T781-E785 HydrophobicContact CG2-CB 4.29Å; T781-E785 PolarHBondContact N-O 2.86Å; T781-E785 VanDerWaalsContact OG1-CB 3.28Å; T781-E785 WeakPolarHBondContact OG1-CB 3.48Å; T781-E785 PolarHBondContact OG1-N 2.87Å; T781-E785 PolarHBondContact OG1-OE2 3.2Å; T781-E785 VanDerWaalsContact OG1-OE2 3.06Å; N783-E785 VanDerWaalsContact C-N 3.3Å; N783-E785 HydrophobicContact CB-CG 4.16Å; N783-E785 WeakPolarHBondContact CB-OE2 3.47Å; N783-E785 PolarHBondContact O-N 3.28Å; E785-L794 HydrophobicContact CB-CD1 3.5Å; E785-L794 VanDerWaalsContact CB-CD1 3.5Å; E785-L794 HydrophobicContact CB-CD2 4.34Å; E785-L794 HydrophobicContact CB-CG 3.82Å; E785-V795 CarbonylContact C-O 3.37Å; E785-V795 VanDerWaalsContact CA-O 3.3Å; E785-V795 WeakPolarHBondContact CA-O 3.43Å
786	V	93.1	Very high	88.1	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	129.3	-172.6	-176	0	0	0	0	109.8	F725 V777 L788 V795 V797	F725-V786 HydrophobicContact CD2-CG1 4.45Å; F725-V786 HydrophobicContact CD2-CG2 4.07Å; F725-V786 HydrophobicContact CE2-CG1 4.38Å; F725-V786 HydrophobicContact CE2-CG2 4.16Å; V777-V786 HydrophobicContact CB-CG1 4.39Å; V777-V786 HydrophobicContact CG1-CG1 3.61Å; V777-V786 HydrophobicContact CG2-CG1 4.02Å; V786-L788 HydrophobicContact CG1-CD2 4.28Å; V786-L788 PolarHBondContact O-N 3.17Å; V786-V795 PolarHBondContact N-O 2.85Å; V786-V795 PolarHBondContact O-N 3.5Å; V786-V797 HydrophobicContact CG2-CB 3.95Å; V786-V797 HydrophobicContact CG2-CG2 3.94Å
787	Y	93.3	Very high	88.2	Confident	66 Å²	66	39.7 Å²	39.7	26%	0.259	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	113.1	173.7	-72.2	-78.1	0	0	0	110.1	M456 V777 Y778 G779 T781 L794	M456-Y787 HydrophobicContact SD-CD2 4.35Å; M456-Y787 HydrophobicContact SD-CE2 4.33Å; V777-Y787 WeakPolarHBondContact CA-O 3.48Å; Y778-Y787 WeakPolarHBondContact CD1-O 3.09Å; Y778-Y787 HydrophobicContact CE2-CD1 4.44Å; Y778-Y787 HydrophobicContact CE2-CG 4.27Å; Y778-Y787 PolarHBondContact N-O 3.31Å; Y778-Y787 VanDerWaalsContact N-O 3.09Å; G779-Y787 PolarHBondContact O-N 2.9Å; T781-Y787 HydrophobicContact CG2-CD2 4.44Å; T781-Y787 HydrophobicContact CG2-CE2 3.65Å; Y787-L794 HydrophobicContact CD1-CB 4.2Å; Y787-L794 HydrophobicContact CD1-CD1 3.86Å; Y787-L794 HydrophobicContact CD2-CD1 4.01Å; Y787-L794 HydrophobicContact CE1-CB 4.08Å; Y787-L794 HydrophobicContact CE1-CD1 3.84Å; Y787-L794 HydrophobicContact CE1-CD2 4.21Å; Y787-L794 HydrophobicContact CE1-CG 4.28Å; Y787-L794 HydrophobicContact CE2-CD1 4Å; Y787-L794 HydrophobicContact CG-CD1 3.94Å
788	L	91	Very high	88.1	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	148.1	177	-68.3	-178.7	0	0	0	111.2	L737 R775 L776 V777 V786 P791 N792 E793 V795 Y799	L737-L788 HydrophobicContact CD2-CD1 4.32Å; R775-L788 HydrophobicContact CB-CD2 4.36Å; L776-L788 CarbonylContact O-C 3.57Å; L776-L788 WeakPolarHBondContact O-CA 3.41Å; V777-L788 HydrophobicContact CG2-CD2 3.65Å; V786-L788 HydrophobicContact CG1-CD2 4.28Å; V786-L788 PolarHBondContact O-N 3.17Å; L788-P791 VanDerWaalsContact O-O 3.11Å; L788-N792 WeakPolarHBondContact O-CA 3.44Å; L788-E793 PolarHBondContact N-O 3.24Å; L788-E793 PolarHBondContact O-N 3.44Å; L788-E793 VanDerWaalsContact O-N 3.08Å; L788-V795 HydrophobicContact CD1-CG2 3.58Å; L788-V795 HydrophobicContact CG-CG2 3.96Å; L788-Y799 HydrophobicContact CD1-CE1 4.3Å
789	T	84.3	Confident	88.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	166	166.2	74.2	0	0	0	0	112.3	L463 R775 L776 Y778 P791 N792	L463-T789 HydrophobicContact CD1-CG2 4.01Å; L463-T789 HydrophobicContact CD2-CG2 4.39Å; R775-T789 WeakPolarHBondContact CB-O 3.5Å; R775-T789 PolarHBondContact NE-O 3.17Å; R775-T789 PolarHBondContact NH2-O 2.6Å; L776-T789 HydrophobicContact CB-CG2 3.87Å; L776-T789 HydrophobicContact CD2-CG2 3.93Å; L776-T789 PolarHBondContact N-OG1 2.86Å; L776-T789 PolarHBondContact O-N 3.41Å; Y778-T789 HydrophobicContact CD1-CG2 3.74Å; Y778-T789 HydrophobicContact CE1-CG2 4.06Å; T789-P791 VanDerWaalsContact C-C 3.44Å; T789-P791 CarbonylContact C-O 3.5Å; T789-N792 WeakPolarHBondContact CA-OD1 3.2Å
790	N	71.6	Confident	88.1	Confident	20 Å²	20	47 Å²	47	11%	0.107	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	55	69	166.8	-56.7	-8.5	0	0	0	114.9	G466 T472 R775	G466-N790 PolarHBondContact O-ND2 3.45Å; G466-N790 PolarHBondContact O-OD1 2.93Å; T472-N790 PolarHBondContact OG1-ND2 3.45Å; R775-N790 PolarHBondContact NE-O 2.98Å
791	P	76.2	Confident	88.1	Confident	83 Å²	83	47.4 Å²	47.4	54%	0.539	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	cis	-75.2	162.2	-3.3	33.1	-37.8	0	0	0	112.4	R775 L788 T789 E793	R775-P791 PolarHBondContact NH2-O 3.47Å; L788-P791 VanDerWaalsContact O-O 3.11Å; T789-P791 VanDerWaalsContact C-C 3.44Å; T789-P791 CarbonylContact C-O 3.5Å; P791-E793 HydrophobicContact CG-CG 4.49Å; P791-E793 PolarHBondContact O-N 2.99Å
792	N	83.4	Confident	88.1	Confident	55 Å²	55	50.4 Å²	50.4	29%	0.294	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	104.2	174.4	-70.1	2.6	0	0	0	109	T460 L788 T789	T460-N792 HydrophobicContact CG2-CB 3.96Å; L788-N792 WeakPolarHBondContact O-CA 3.44Å; T789-N792 WeakPolarHBondContact CA-OD1 3.2Å
793	E	89.7	Confident	88.3	Confident	70 Å²	70	44.3 Å²	44.3	33%	0.327	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	166.3	-176.4	68.7	-174.1	-177.6	0	0	111.4	R775 L788 P791 V795	R775-E793 IonicContact CZ-OE1 3.99Å; R775-E793 IonicContact NH1-OE1 3.25Å; R775-E793 PolarHBondContact NH1-OE1 2.87Å; R775-E793 VanDerWaalsContact NH2-CG 3.32Å; R775-E793 IonicContact NH2-OE1 2.9Å; R775-E793 PolarHBondContact NH2-OE1 2.73Å; L788-E793 PolarHBondContact N-O 3.24Å; L788-E793 PolarHBondContact O-N 3.44Å; L788-E793 VanDerWaalsContact O-N 3.08Å; P791-E793 HydrophobicContact CG-CG 4.49Å; P791-E793 PolarHBondContact O-N 2.99Å; E793-V795 HydrophobicContact CG-CG1 4.03Å
794	L	91	Very high	88.4	Confident	64 Å²	64	38.3 Å²	38.3	34%	0.335	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	123.6	173.4	-177.1	59.5	0	0	0	108.2	T781 E785 Y787	T781-L794 HydrophobicContact CG2-CD1 3.87Å; T781-L794 HydrophobicContact CG2-CD2 4.17Å; E785-L794 HydrophobicContact CB-CD1 3.5Å; E785-L794 VanDerWaalsContact CB-CD1 3.5Å; E785-L794 HydrophobicContact CB-CD2 4.34Å; E785-L794 HydrophobicContact CB-CG 3.82Å; Y787-L794 HydrophobicContact CD1-CB 4.2Å; Y787-L794 HydrophobicContact CD1-CD1 3.86Å; Y787-L794 HydrophobicContact CD2-CD1 4.01Å; Y787-L794 HydrophobicContact CE1-CB 4.08Å; Y787-L794 HydrophobicContact CE1-CD1 3.84Å; Y787-L794 HydrophobicContact CE1-CD2 4.21Å; Y787-L794 HydrophobicContact CE1-CG 4.28Å; Y787-L794 HydrophobicContact CE2-CD1 4Å; Y787-L794 HydrophobicContact CG-CD1 3.94Å
795	V	92.3	Very high	88.4	Confident	13 Å²	13	39 Å²	39	8%	0.079	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	144.7	179	-67.3	0	0	0	0	111.5	E785 V786 L788 E793 V797 Y799 V800	E785-V795 CarbonylContact C-O 3.37Å; E785-V795 VanDerWaalsContact CA-O 3.3Å; E785-V795 WeakPolarHBondContact CA-O 3.43Å; V786-V795 PolarHBondContact N-O 2.85Å; V786-V795 PolarHBondContact O-N 3.5Å; L788-V795 HydrophobicContact CD1-CG2 3.58Å; L788-V795 HydrophobicContact CG-CG2 3.96Å; E793-V795 HydrophobicContact CG-CG1 4.03Å; V795-V797 PolarHBondContact O-N 3.33Å; V795-Y799 HydrophobicContact CB-CD1 4.09Å; V795-Y799 HydrophobicContact CB-CG 4.37Å; V795-Y799 HydrophobicContact CG1-CD1 4.19Å; V795-Y799 HydrophobicContact CG1-CE1 4.46Å; V795-Y799 HydrophobicContact CG2-CD1 3.94Å; V795-V800 HydrophobicContact CG2-CG2 4.19Å
796	P	92.8	Very high	87.9	Confident	75 Å²	75	39.5 Å²	39.5	49%	0.487	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	139.4	168	-22.2	33.3	0	0	0	110.4	Q798 Y799	P796-Q798 PolarHBondContact O-N 2.9Å; P796-Y799 WeakPolarHBondContact O-CB 3.47Å; P796-Y799 PolarHBondContact O-N 3.14Å
797	V	91.5	Very high	87.1	Confident	3 Å²	3	48 Å²	48	2%	0.018	25%	0.245	C	C	.	.	H	α-helix	trans	-59.7	-20.8	179.5	74.6	0	0	0	0	112.8	S718 L721 V722 F725 N784 V786 V795 Y799 V800 L801	S718-V797 VanDerWaalsContact CB-CG1 3.48Å; L721-V797 HydrophobicContact CB-CG2 4.07Å; L721-V797 HydrophobicContact CD2-CG2 3.79Å; L721-V797 HydrophobicContact CG-CG2 3.85Å; V722-V797 HydrophobicContact CG2-CB 3.83Å; V722-V797 HydrophobicContact CG2-CG1 3.74Å; V722-V797 HydrophobicContact CG2-CG2 4.01Å; F725-V797 HydrophobicContact CE2-CG2 4.37Å; N784-V797 HydrophobicContact CB-CG1 4.14Å; N784-V797 WeakPolarHBondContact O-CB 3.2Å; N784-V797 WeakPolarHBondContact O-CG1 3.28Å; N784-V797 PolarHBondContact O-N 3.11Å; V786-V797 HydrophobicContact CG2-CB 3.95Å; V786-V797 HydrophobicContact CG2-CG2 3.94Å; V795-V797 PolarHBondContact O-N 3.33Å; V797-Y799 VanDerWaalsContact C-N 3.31Å; V797-Y799 PolarHBondContact O-N 3.45Å; V797-V800 WeakPolarHBondContact O-CB 3.42Å; V797-V800 PolarHBondContact O-N 2.59Å; V797-L801 PolarHBondContact O-N 3.06Å
798	Q	90.8	Very high	86	Confident	86 Å²	86	45.3 Å²	45.3	40%	0.402	24%	0.235	S	C	.	.	H	α-helix	trans	-58	-41.5	171.5	-170.7	59.6	48.5	0	0	112	S718 P796 V800 L801 D802	S718-Q798 PolarHBondContact OG-OE1 3.05Å; P796-Q798 PolarHBondContact O-N 2.9Å; Q798-V800 PolarHBondContact O-N 2.7Å; Q798-L801 WeakPolarHBondContact O-CB 3.33Å; Q798-L801 PolarHBondContact O-N 2.84Å; Q798-L801 VanDerWaalsContact O-N 3.11Å; Q798-D802 PolarHBondContact NE2-OD1 3.2Å; Q798-D802 PolarHBondContact O-N 3.33Å
799	Y	92.1	Very high	84.8	Confident	70 Å²	70	50.6 Å²	50.6	28%	0.275	26%	0.26	S	S	.	.	H	α-helix	trans	-58.1	-39.5	174	168.9	-87.2	0	0	0	111.2	Q739 L788 V795 P796 V797 D802 Q803	Q739-Y799 PolarHBondContact NE2-OH 3.31Å; Q739-Y799 VanDerWaalsContact NE2-OH 3.12Å; L788-Y799 HydrophobicContact CD1-CE1 4.3Å; V795-Y799 HydrophobicContact CB-CD1 4.09Å; V795-Y799 HydrophobicContact CB-CG 4.37Å; V795-Y799 HydrophobicContact CG1-CD1 4.19Å; V795-Y799 HydrophobicContact CG1-CE1 4.46Å; V795-Y799 HydrophobicContact CG2-CD1 3.94Å; P796-Y799 WeakPolarHBondContact O-CB 3.47Å; P796-Y799 PolarHBondContact O-N 3.14Å; V797-Y799 VanDerWaalsContact C-N 3.31Å; V797-Y799 PolarHBondContact O-N 3.45Å; Y799-D802 PolarHBondContact O-N 3.03Å; Y799-Q803 HydrophobicContact CD1-CG 4.07Å; Y799-Q803 HydrophobicContact CD2-CG 4.42Å; Y799-Q803 HydrophobicContact CE1-CG 3.72Å; Y799-Q803 HydrophobicContact CE2-CG 4.12Å; Y799-Q803 HydrophobicContact CG-CG 4.4Å; Y799-Q803 WeakPolarHBondContact O-CB 3.42Å; Y799-Q803 WeakPolarHBondContact O-CG 3.48Å; Y799-Q803 PolarHBondContact O-N 3.5Å; Y799-Q803 PolarHBondContact OH-NE2 2.77Å
800	V	91.4	Very high	83.8	Confident	1 Å²	1	52 Å²	52	1%	0.006	27%	0.267	C	S	.	.	H	α-helix	trans	-65.8	-42.1	177.3	-178.8	0	0	0	0	110.9	L721 F725 L737 V795 V797 Q798 L804	L721-V800 HydrophobicContact CD2-CG1 4.11Å; F725-V800 HydrophobicContact CE2-CG1 4.23Å; F725-V800 HydrophobicContact CZ-CG1 4.1Å; L737-V800 HydrophobicContact CD1-CG1 4.17Å; L737-V800 HydrophobicContact CD2-CG1 4.04Å; L737-V800 HydrophobicContact CD2-CG2 4.43Å; V795-V800 HydrophobicContact CG2-CG2 4.19Å; V797-V800 WeakPolarHBondContact O-CB 3.42Å; V797-V800 PolarHBondContact O-N 2.59Å; Q798-V800 PolarHBondContact O-N 2.7Å; V800-L804 HydrophobicContact CG1-CD1 4.02Å; V800-L804 HydrophobicContact CG1-CG 4.49Å; V800-L804 WeakPolarHBondContact O-CB 3.38Å; V800-L804 WeakPolarHBondContact O-CG 3.39Å; V800-L804 PolarHBondContact O-N 3Å
801	L	90.8	Very high	83.4	Confident	9 Å²	9	55.3 Å²	55.3	5%	0.047	28%	0.278	C	S	.	.	H	α-helix	trans	-63.8	-42.1	174	-71.3	172.4	0	0	0	112.4	M717 L721 V797 Q798 L804 S805	M717-L801 HydrophobicContact CB-CD1 3.84Å; M717-L801 HydrophobicContact CE-CD2 4.26Å; M717-L801 HydrophobicContact CG-CD1 3.62Å; M717-L801 HydrophobicContact CG-CD2 3.77Å; M717-L801 HydrophobicContact CG-CG 4.36Å; L721-L801 HydrophobicContact CD2-CD2 3.62Å; L721-L801 HydrophobicContact CD2-CG 3.95Å; V797-L801 PolarHBondContact O-N 3.06Å; Q798-L801 WeakPolarHBondContact O-CB 3.33Å; Q798-L801 PolarHBondContact O-N 2.84Å; Q798-L801 VanDerWaalsContact O-N 3.11Å; L801-L804 CarbonylContact O-C 3.56Å; L801-L804 PolarHBondContact O-N 3.2Å; L801-S805 WeakPolarHBondContact O-CB 3.32Å; L801-S805 PolarHBondContact O-N 2.84Å
802	D	89	Confident	82.9	Confident	78 Å²	78	52.1 Å²	52.1	42%	0.417	26%	0.256	S	S	.	.	H	α-helix	trans	-63.9	-45.6	178.9	-61.5	-19.6	0	0	0	110.4	Q798 Y799 L804 S805 K806	Q798-D802 PolarHBondContact NE2-OD1 3.2Å; Q798-D802 PolarHBondContact O-N 3.33Å; Y799-D802 PolarHBondContact O-N 3.03Å; D802-L804 PolarHBondContact O-N 3.01Å; D802-S805 PolarHBondContact O-N 3.19Å; D802-S805 VanDerWaalsContact O-N 3.09Å; D802-S805 PolarHBondContact O-OG 3.02Å; D802-K806 PolarHBondContact O-N 3.41Å
803	Q	87.6	Confident	82	Confident	9 Å²	9	51.1 Å²	51.1	4%	0.042	25%	0.254	C	S	.	.	H	α-helix	trans	-61.5	-40	173.3	-67.6	-73.8	-11.2	0	0	112.1	Q739 D742 Y799 S805 K806 P942	Q739-Q803 HydrophobicContact CB-CB 4.31Å; D742-Q803 PolarHBondContact OD2-NE2 2.97Å; Y799-Q803 HydrophobicContact CD1-CG 4.07Å; Y799-Q803 HydrophobicContact CD2-CG 4.42Å; Y799-Q803 HydrophobicContact CE1-CG 3.72Å; Y799-Q803 HydrophobicContact CE2-CG 4.12Å; Y799-Q803 HydrophobicContact CG-CG 4.4Å; Y799-Q803 WeakPolarHBondContact O-CB 3.42Å; Y799-Q803 WeakPolarHBondContact O-CG 3.48Å; Y799-Q803 PolarHBondContact O-N 3.5Å; Y799-Q803 PolarHBondContact OH-NE2 2.77Å; Q803-S805 VanDerWaalsContact C-N 3.26Å; Q803-S805 PolarHBondContact O-N 2.84Å; Q803-K806 VanDerWaalsContact CD-NZ 3.34Å; Q803-K806 PolarHBondContact O-N 3.27Å; Q803-K806 VanDerWaalsContact OE1-CE 3.23Å; Q803-P942 WeakPolarHBondContact O-CB 3.25Å; Q803-P942 VanDerWaalsContact O-CG 3.31Å; Q803-P942 WeakPolarHBondContact O-CG 3.35Å
804	L	86.1	Confident	81	Confident	2 Å²	2	48.9 Å²	48.9	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-68.5	-22.2	173.9	-72.1	170	0	0	0	113.5	P690 L721 L737 V800 L801 D802 G943 I944	P690-L804 HydrophobicContact CB-CB 4.31Å; P690-L804 WeakPolarHBondContact CD-O 3.44Å; L721-L804 HydrophobicContact CD2-CD1 4.32Å; L737-L804 HydrophobicContact CD1-CD2 3.7Å; L737-L804 HydrophobicContact CD1-CG 3.96Å; V800-L804 HydrophobicContact CG1-CD1 4.02Å; V800-L804 HydrophobicContact CG1-CG 4.49Å; V800-L804 WeakPolarHBondContact O-CB 3.38Å; V800-L804 WeakPolarHBondContact O-CG 3.39Å; V800-L804 PolarHBondContact O-N 3Å; L801-L804 CarbonylContact O-C 3.56Å; L801-L804 PolarHBondContact O-N 3.2Å; D802-L804 PolarHBondContact O-N 3.01Å; L804-G943 VanDerWaalsContact CD2-CA 3.43Å; L804-I944 HydrophobicContact CD1-CD1 4.09Å; L804-I944 HydrophobicContact CD1-CG1 4.2Å; L804-I944 HydrophobicContact CD2-CG1 4.13Å
805	S	86	Confident	79.8	Confident	66 Å²	66	49.3 Å²	49.3	46%	0.462	26%	0.255	S	S	.	.	H	α-helix	trans	-85.9	-16.5	178.3	81.9	0	0	0	0	114.1	L801 D802 Q803 K807	L801-S805 WeakPolarHBondContact O-CB 3.32Å; L801-S805 PolarHBondContact O-N 2.84Å; D802-S805 PolarHBondContact O-N 3.19Å; D802-S805 VanDerWaalsContact O-N 3.09Å; D802-S805 PolarHBondContact O-OG 3.02Å; Q803-S805 VanDerWaalsContact C-N 3.26Å; Q803-S805 PolarHBondContact O-N 2.84Å; S805-K807 PolarHBondContact O-N 2.99Å
806	K	81.4	Confident	78.3	Confident	60 Å²	60	52.3 Å²	52.3	26%	0.261	27%	0.268	S	S	.	.			trans	-57.5	125.1	-179.7	-75.7	-178.3	176.4	175.6	0	110.9	D742 D802 Q803 P808 P942	D742-K806 IonicContact OD1-NZ 2.74Å; D742-K806 PolarHBondContact OD1-NZ 2.96Å; D742-K806 IonicContact OD2-NZ 3.16Å; D742-K806 PolarHBondContact OD2-NZ 3.3Å; D802-K806 PolarHBondContact O-N 3.41Å; Q803-K806 VanDerWaalsContact CD-NZ 3.34Å; Q803-K806 PolarHBondContact O-N 3.27Å; Q803-K806 VanDerWaalsContact OE1-CE 3.23Å; K806-P808 WeakPolarHBondContact O-CD 3.3Å; K806-P942 HydrophobicContact CB-CG 4.24Å; K806-P942 VanDerWaalsContact O-CD 3.25Å; K806-P942 WeakPolarHBondContact O-CD 3.4Å
807	K	77.8	Confident	76.9	Confident	179 Å²	179	49 Å²	49	78%	0.778	25%	0.247	S	C	*	.			trans	-89.2	110.2	166.1	-62.5	175.5	-176.6	174.5	0	107.8	S805	S805-K807 PolarHBondContact O-N 2.99Å
808	P	68.3	Low	75.4	Confident	8 Å²	8	50.4 Å²	50.4	5%	0.052	26%	0.256	C	S	.	.			trans	-76.3	146.1	177.3	28.9	-29.7	0	0	0	110.6	L740 L770 W772 K806 S938 Q940	L740-P808 HydrophobicContact CD2-CB 4.25Å; L770-P808 HydrophobicContact CD1-CB 4.24Å; L770-P808 HydrophobicContact CD2-CB 4.03Å; W772-P808 HydrophobicContact CH2-CG 4.31Å; W772-P808 HydrophobicContact CZ2-CG 4.35Å; K806-P808 WeakPolarHBondContact O-CD 3.3Å; P808-S938 WeakPolarHBondContact O-CB 3.33Å; P808-S938 PolarHBondContact O-N 3.3Å; P808-Q940 WeakPolarHBondContact CD-O 3.35Å; P808-Q940 HydrophobicContact CG-CB 4.25Å; P808-Q940 WeakPolarHBondContact CG-O 3.4Å
809	E	66.8	Low	73.9	Confident	112 Å²	112	50.2 Å²	50.2	52%	0.523	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	140.6	-177.9	-58.4	-174.9	155.3	0	0	109.6	T935 V936	E809-T935 HydrophobicContact CB-CG2 3.69Å; E809-T935 HydrophobicContact CG-CG2 4.33Å; E809-T935 WeakPolarHBondContact OE2-CG2 3.35Å; E809-V936 CarbonylContact C-O 3.53Å; E809-V936 WeakPolarHBondContact CA-O 3.12Å
810	I	63.6	Low	72.3	Confident	29 Å²	29	48.8 Å²	48.8	15%	0.149	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	118.8	-180	-53.2	176.7	0	0	0	108.5	L770 I812 V936	L770-I810 HydrophobicContact CD1-CD1 3.98Å; L770-I810 HydrophobicContact CD1-CG1 3.7Å; L770-I810 HydrophobicContact CG-CG1 4.07Å; I810-I812 HydrophobicContact CB-CG1 4.48Å; I810-I812 HydrophobicContact CG2-CD1 4.1Å; I810-I812 HydrophobicContact CG2-CG1 3.7Å; I810-V936 PolarHBondContact N-O 2.84Å; I810-V936 PolarHBondContact O-N 3.36Å
811	R	63.7	Low	70.8	Confident	90 Å²	90	50.4 Å²	50.4	34%	0.34	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	112.6	176.1	-164.5	177.7	-171.5	-169.9	3.7	110.7	T767 A933 I934	T767-R811 WeakPolarHBondContact CG2-O 3.3Å; R811-A933 HydrophobicContact CG-CB 3.99Å; R811-I934 CarbonylContact C-O 3.56Å; R811-I934 WeakPolarHBondContact CA-O 3.25Å
812	I	64	Low	69.3	Low	15 Å²	15	53.3 Å²	53.3	8%	0.077	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	128.5	-172.8	-50.5	176.1	0	0	0	109.9	I810 I817 I872 V876 A933 I934 V936	I810-I812 HydrophobicContact CB-CG1 4.48Å; I810-I812 HydrophobicContact CG2-CD1 4.1Å; I810-I812 HydrophobicContact CG2-CG1 3.7Å; I812-I817 HydrophobicContact CB-CD1 4.27Å; I812-I817 HydrophobicContact CG2-CD1 3.83Å; I812-I817 HydrophobicContact CG2-CG1 3.69Å; I812-I872 HydrophobicContact CD1-CG2 3.7Å; I812-V876 HydrophobicContact CD1-CG2 3.7Å; I812-A933 CarbonylContact O-C 3.53Å; I812-A933 VanDerWaalsContact O-CA 3.26Å; I812-A933 WeakPolarHBondContact O-CA 3.39Å; I812-A933 WeakPolarHBondContact O-CB 3.4Å; I812-I934 PolarHBondContact N-O 3.45Å; I812-I934 PolarHBondContact O-N 2.82Å; I812-V936 HydrophobicContact CD1-CG2 4.31Å
813	S	66.4	Low	67.7	Low	34 Å²	34	54.7 Å²	54.7	24%	0.238	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	142.6	178.2	74.8	0	0	0	0	112.3	A815 Q816 I817 P932	S813-A815 PolarHBondContact O-N 3.13Å; S813-Q816 PolarHBondContact O-N 3.02Å; S813-Q816 VanDerWaalsContact O-N 3.13Å; S813-Q816 WeakPolarHBondContact OG-CB 3.49Å; S813-Q816 VanDerWaalsContact OG-CD 3.26Å; S813-Q816 VanDerWaalsContact OG-CG 3.27Å; S813-Q816 WeakPolarHBondContact OG-CG 3.26Å; S813-Q816 PolarHBondContact OG-N 2.95Å; S813-Q816 VanDerWaalsContact OG-N 3.13Å; S813-Q816 PolarHBondContact OG-OE1 3.35Å; S813-I817 PolarHBondContact O-N 3.33Å; S813-P932 WeakPolarHBondContact CA-O 3.49Å
814	K	68.1	Low	66	Low	24 Å²	24	55.9 Å²	55.9	10%	0.104	29%	0.287	C	S	.	.	H	α-helix	trans	-57.8	-32.8	173.3	-69.2	-178.6	173.8	162.8	0	111.6	I817 S818 L856 F928 S929 S931 P932 I934	K814-I817 PolarHBondContact O-N 2.96Å; K814-S818 WeakPolarHBondContact O-CB 3.42Å; K814-S818 PolarHBondContact O-N 3.45Å; K814-L856 HydrophobicContact CD-CD1 4.36Å; K814-L856 HydrophobicContact CG-CD1 4.22Å; K814-F928 WeakPolarHBondContact CE-O 3.26Å; K814-F928 PolarHBondContact NZ-O 3.04Å; K814-S929 PolarHBondContact NZ-O 3.29Å; K814-S931 WeakPolarHBondContact CD-O 3.48Å; K814-S931 WeakPolarHBondContact CE-O 3.39Å; K814-S931 PolarHBondContact NZ-O 3.48Å; K814-P932 PolarHBondContact N-O 3.25Å; K814-I934 HydrophobicContact CG-CG1 4.42Å
815	A	64.5	Low	64.4	Low	72 Å²	72	60 Å²	60	60%	0.595	30%	0.303	S	S	*	.	H	α-helix	trans	-64.2	-43.2	175.7	0	0	0	0	0	113	S813 S818 N819	S813-A815 PolarHBondContact O-N 3.13Å; A815-S818 PolarHBondContact O-N 3.13Å; A815-N819 WeakPolarHBondContact O-CB 3.1Å; A815-N819 PolarHBondContact O-N 2.97Å
816	Q	61.7	Low	62.5	Low	76 Å²	76	62 Å²	62	36%	0.355	31%	0.308	S	S	.	.	H	α-helix	trans	-64.8	-41	174.8	-75.6	158.6	-51.7	0	0	111.5	T767 S813 N819 L820	T767-Q816 VanDerWaalsContact CG2-OE1 3.22Å; T767-Q816 PolarHBondContact OG1-NE2 3.1Å; T767-Q816 VanDerWaalsContact OG1-NE2 3.16Å; S813-Q816 PolarHBondContact O-N 3.02Å; S813-Q816 VanDerWaalsContact O-N 3.13Å; S813-Q816 WeakPolarHBondContact OG-CB 3.49Å; S813-Q816 VanDerWaalsContact OG-CD 3.26Å; S813-Q816 VanDerWaalsContact OG-CG 3.27Å; S813-Q816 WeakPolarHBondContact OG-CG 3.26Å; S813-Q816 PolarHBondContact OG-N 2.95Å; S813-Q816 VanDerWaalsContact OG-N 3.13Å; S813-Q816 PolarHBondContact OG-OE1 3.35Å; Q816-N819 PolarHBondContact O-N 2.68Å; Q816-L820 WeakPolarHBondContact O-CB 3.14Å; Q816-L820 WeakPolarHBondContact O-CG 3.32Å; Q816-L820 PolarHBondContact O-N 2.71Å
817	I	64	Low	60.7	Low	7 Å²	7	63.3 Å²	63.3	4%	0.036	32%	0.315	C	S	.	.	H	α-helix	trans	-63.6	-46.1	177.4	-65.2	166.2	0	0	0	110.8	I812 S813 K814 N819 L820 W821 L859 V876 I934	I812-I817 HydrophobicContact CB-CD1 4.27Å; I812-I817 HydrophobicContact CG2-CD1 3.83Å; I812-I817 HydrophobicContact CG2-CG1 3.69Å; S813-I817 PolarHBondContact O-N 3.33Å; K814-I817 PolarHBondContact O-N 2.96Å; I817-N819 VanDerWaalsContact C-N 3.32Å; I817-N819 PolarHBondContact O-N 3.3Å; I817-L820 PolarHBondContact O-N 2.86Å; I817-W821 WeakPolarHBondContact O-CB 3.38Å; I817-W821 PolarHBondContact O-N 3.19Å; I817-L859 HydrophobicContact CG2-CD1 4.48Å; I817-L859 HydrophobicContact CG2-CD2 3.82Å; I817-V876 HydrophobicContact CD1-CG1 4.13Å; I817-I934 HydrophobicContact CD1-CD1 3.33Å; I817-I934 HydrophobicContact CD1-CG1 4.04Å
818	S	59.7	Low	59.3	Low	31 Å²	31	57.2 Å²	57.2	22%	0.217	30%	0.295	C	S	.	.	H	α-helix	trans	-60.9	-38	175	-179.2	0	0	0	0	112.6	K814 A815 T822	K814-S818 WeakPolarHBondContact O-CB 3.42Å; K814-S818 PolarHBondContact O-N 3.45Å; A815-S818 PolarHBondContact O-N 3.13Å; S818-T822 VanDerWaalsContact O-CB 3.3Å; S818-T822 WeakPolarHBondContact O-CB 3.31Å; S818-T822 PolarHBondContact O-N 3.34Å; S818-T822 PolarHBondContact O-OG1 3Å
819	N	59.4	Low	58.2	Low	82 Å²	82	62.7 Å²	62.7	44%	0.439	32%	0.318	S	S	.	.	H	α-helix	trans	-66.9	-46.1	176	-168.8	-43.1	0	0	0	112	A815 Q816 I817 T822 K823	A815-N819 WeakPolarHBondContact O-CB 3.1Å; A815-N819 PolarHBondContact O-N 2.97Å; Q816-N819 PolarHBondContact O-N 2.68Å; I817-N819 VanDerWaalsContact C-N 3.32Å; I817-N819 PolarHBondContact O-N 3.3Å; N819-T822 PolarHBondContact O-N 2.69Å; N819-K823 WeakPolarHBondContact O-CG 3.3Å; N819-K823 PolarHBondContact O-N 3.35Å; N819-K823 WeakPolarHBondContact OD1-CD 3.37Å; N819-K823 WeakPolarHBondContact OD1-CE 3.03Å; N819-K823 PolarHBondContact OD1-NZ 3.32Å
820	L	58.7	Low	57	Low	41 Å²	41	63.3 Å²	63.3	22%	0.215	32%	0.324	C	S	.	.	H	α-helix	trans	-60	-46.1	173.5	-76	161.9	0	0	0	111.6	I519 Q816 I817 K823 H824 I873	I519-L820 HydrophobicContact CD1-CD2 4.47Å; Q816-L820 WeakPolarHBondContact O-CB 3.14Å; Q816-L820 WeakPolarHBondContact O-CG 3.32Å; Q816-L820 PolarHBondContact O-N 2.71Å; I817-L820 PolarHBondContact O-N 2.86Å; L820-K823 PolarHBondContact O-N 3.11Å; L820-H824 PolarHBondContact O-N 2.82Å; L820-I873 HydrophobicContact CB-CD1 3.92Å; L820-I873 HydrophobicContact CD1-CD1 4.03Å; L820-I873 HydrophobicContact CD2-CD1 4.42Å; L820-I873 HydrophobicContact CG-CD1 4.35Å
821	W	59.6	Low	55.5	Low	35 Å²	35	66.4 Å²	66.4	13%	0.133	35%	0.347	C	S	.	.	H	α-helix	trans	-60.1	-48.7	176.5	-175.9	-96.2	0	0	0	112.3	I817 K823 H824 Y825 F851 L859 H862 W867	I817-W821 WeakPolarHBondContact O-CB 3.38Å; I817-W821 PolarHBondContact O-N 3.19Å; W821-K823 VanDerWaalsContact C-N 3.31Å; W821-K823 PolarHBondContact O-N 2.8Å; W821-H824 PolarHBondContact O-N 2.78Å; W821-Y825 WeakPolarHBondContact O-CB 3.4Å; W821-Y825 PolarHBondContact O-N 3.47Å; W821-F851 AromaticContact CD1-CE2 3.82Å; W821-F851 HydrophobicContact CG-CE2 4.11Å; W821-L859 HydrophobicContact CB-CD1 4.22Å; W821-L859 HydrophobicContact CD2-CD1 3.47Å; W821-L859 VanDerWaalsContact CD2-CD1 3.47Å; W821-L859 HydrophobicContact CE3-CD1 3.3Å; W821-L859 HydrophobicContact CE3-CG 4Å; W821-L859 HydrophobicContact CG-CD1 3.87Å; W821-L859 HydrophobicContact CH2-CD1 4.47Å; W821-L859 HydrophobicContact CZ3-CD1 3.83Å; W821-L859 HydrophobicContact CZ3-CG 4.1Å; W821-H862 HydrophobicContact CH2-CB 3.85Å; W821-H862 AromaticContact CH2-CD2 3.73Å; W821-H862 AromaticContact CH2-CG 3.54Å; W821-H862 AromaticContact CH2-ND1 3.77Å; W821-H862 AromaticContact CZ2-CD2 3.98Å; W821-W867 HydrophobicContact CD2-CH2 4.14Å; W821-W867 HydrophobicContact CD2-CZ2 4.23Å; W821-W867 AromaticContact CE3-CH2 3.25Å; W821-W867 HydrophobicContact CE3-CH2 3.25Å; W821-W867 AromaticContact CE3-CZ2 3.36Å; W821-W867 HydrophobicContact CE3-CZ2 3.36Å; W821-W867 AromaticContact CE3-CZ3 3.88Å; W821-W867 HydrophobicContact CE3-CZ3 3.88Å; W821-W867 AromaticContact CH2-CZ2 3.87Å; W821-W867 HydrophobicContact CH2-CZ2 3.87Å; W821-W867 HydrophobicContact CZ3-CD2 4.03Å; W821-W867 AromaticContact CZ3-CE2 3.43Å; W821-W867 VanDerWaalsContact CZ3-CE2 3.43Å; W821-W867 HydrophobicContact CZ3-CE3 4.32Å; W821-W867 AromaticContact CZ3-CH2 3.55Å; W821-W867 HydrophobicContact CZ3-CH2 3.55Å; W821-W867 AromaticContact CZ3-CZ2 3.16Å; W821-W867 HydrophobicContact CZ3-CZ2 3.16Å; W821-W867 HydrophobicContact CZ3-CZ3 4.11Å; W821-W867 AromaticContact CZ3-NE1 4Å
822	T	58.4	Low	54.1	Low	69 Å²	69	67.5 Å²	67.5	42%	0.423	37%	0.366	S	S	.	.	H	α-helix	trans	-61	-41	-179.8	-59	0	0	0	0	111.2	S818 N819 Y825 L826	S818-T822 VanDerWaalsContact O-CB 3.3Å; S818-T822 WeakPolarHBondContact O-CB 3.31Å; S818-T822 PolarHBondContact O-N 3.34Å; S818-T822 PolarHBondContact O-OG1 3Å; N819-T822 PolarHBondContact O-N 2.69Å; T822-Y825 PolarHBondContact O-N 2.8Å; T822-L826 HydrophobicContact CG2-CD1 4.06Å; T822-L826 WeakPolarHBondContact O-CB 3.45Å; T822-L826 VanDerWaalsContact O-CG 3.27Å; T822-L826 WeakPolarHBondContact O-CG 3.46Å; T822-L826 PolarHBondContact O-N 3.18Å
823	K	55.3	Low	52.7	Low	108 Å²	108	74.1 Å²	74.1	47%	0.47	40%	0.402	S	S	.	.	H	α-helix	trans	-60.8	-47.7	173.5	-77.2	166.8	172.9	159.1	0	112.1	N819 L820 W821 L826 H827	N819-K823 WeakPolarHBondContact O-CG 3.3Å; N819-K823 PolarHBondContact O-N 3.35Å; N819-K823 WeakPolarHBondContact OD1-CD 3.37Å; N819-K823 WeakPolarHBondContact OD1-CE 3.03Å; N819-K823 PolarHBondContact OD1-NZ 3.32Å; L820-K823 PolarHBondContact O-N 3.11Å; W821-K823 VanDerWaalsContact C-N 3.31Å; W821-K823 PolarHBondContact O-N 2.8Å; K823-L826 PolarHBondContact O-N 2.78Å; K823-H827 PolarHBondContact O-CD2 3.39Å; K823-H827 VanDerWaalsContact O-CD2 3.32Å; K823-H827 PolarHBondContact O-N 3.39Å
824	H	52.9	Low	51	Low	34 Å²	34	82.9 Å²	82.9	16%	0.157	43%	0.43	C	S	.	.	H	α-helix	trans	-63.2	-43	177.6	-172.4	-74.7	0	0	0	112.3	L820 W821 L826 H827 S828 W867	L820-H824 PolarHBondContact O-N 2.82Å; W821-H824 PolarHBondContact O-N 2.78Å; H824-L826 PolarHBondContact O-N 2.78Å; H824-H827 PolarHBondContact O-N 2.81Å; H824-S828 PolarHBondContact O-N 3.42Å; H824-W867 HydrophobicContact CB-CH2 3.51Å; H824-W867 HydrophobicContact CB-CZ2 3.83Å; H824-W867 AromaticContact CD2-CH2 3.88Å; H824-W867 AromaticContact CD2-CZ2 3.82Å; H824-W867 AromaticContact CE1-CE2 3.98Å; H824-W867 AromaticContact CE1-CZ2 3.71Å; H824-W867 AromaticContact CG-CH2 3.5Å; H824-W867 VanDerWaalsContact CG-CH2 3.5Å; H824-W867 AromaticContact CG-CZ2 3.39Å; H824-W867 AromaticContact ND1-CH2 3.94Å; H824-W867 AromaticContact ND1-CZ2 3.31Å; H824-W867 VanDerWaalsContact ND1-CZ2 3.31Å; H824-W867 WeakPolarHBondContact ND1-CZ2 3.05Å
825	Y	51.8	Low	49.2	Very low	88 Å²	88	88.6 Å²	88.6	35%	0.345	46%	0.461	S	S	.	.	H	α-helix	trans	-62.4	-43.2	178.3	-173.2	-103.4	0	0	0	111.9	W821 T822 S828 K829	W821-Y825 WeakPolarHBondContact O-CB 3.4Å; W821-Y825 PolarHBondContact O-N 3.47Å; T822-Y825 PolarHBondContact O-N 2.8Å; Y825-S828 PolarHBondContact O-N 3.01Å; Y825-S828 PolarHBondContact O-OG 3.41Å; Y825-K829 HydrophobicContact CE1-CD 4.23Å; Y825-K829 PolarHBondContact O-N 3.11Å; Y825-K829 VanDerWaalsContact OH-CE 3.24Å; Y825-K829 WeakPolarHBondContact OH-CE 3.5Å; Y825-K829 PolarHBondContact OH-NZ 2.64Å
826	L	46.1	Very low	47.7	Very low	107 Å²	107	94 Å²	94	56%	0.56	47%	0.474	S	S	*	.	H	α-helix	trans	-61.7	-44.6	174.1	-72.8	168.8	0	0	0	112.1	T822 K823 H824 S828 K829	T822-L826 HydrophobicContact CG2-CD1 4.06Å; T822-L826 WeakPolarHBondContact O-CB 3.45Å; T822-L826 VanDerWaalsContact O-CG 3.27Å; T822-L826 WeakPolarHBondContact O-CG 3.46Å; T822-L826 PolarHBondContact O-N 3.18Å; K823-L826 PolarHBondContact O-N 2.78Å; H824-L826 PolarHBondContact O-N 2.78Å; L826-S828 VanDerWaalsContact C-N 3.32Å; L826-S828 PolarHBondContact O-N 3.06Å; L826-K829 PolarHBondContact O-N 3.05Å
827	H	44.9	Very low	46.3	Very low	88 Å²	88	97.7 Å²	97.7	41%	0.407	50%	0.495	S	S	.	.	H	α-helix	trans	-60.2	-39.7	173.6	-89	-78.7	0	0	0	112.5	K823 H824 K829 L830	K823-H827 PolarHBondContact O-CD2 3.39Å; K823-H827 VanDerWaalsContact O-CD2 3.32Å; K823-H827 PolarHBondContact O-N 3.39Å; H824-H827 PolarHBondContact O-N 2.81Å; H827-K829 VanDerWaalsContact C-N 3.27Å; H827-K829 PolarHBondContact O-N 2.94Å; H827-L830 PolarHBondContact O-N 3.16Å; H827-L830 VanDerWaalsContact O-N 3.12Å
828	S	46.7	Very low	44.7	Very low	52 Å²	52	105.1 Å²	105.1	36%	0.364	53%	0.531	S	S	.	.	H	α-helix	trans	-65	-26.4	-179.1	74.4	0	0	0	0	114.2	H824 Y825 L826	H824-S828 PolarHBondContact O-N 3.42Å; Y825-S828 PolarHBondContact O-N 3.01Å; Y825-S828 PolarHBondContact O-OG 3.41Å; L826-S828 VanDerWaalsContact C-N 3.32Å; L826-S828 PolarHBondContact O-N 3.06Å
829	K	46.3	Very low	43.3	Very low	122 Å²	122	112.2 Å²	112.2	53%	0.53	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.7	-3	175.8	-76.1	-169.4	171.5	-179.5	0	114.3	Y825 L826 H827	Y825-K829 HydrophobicContact CE1-CD 4.23Å; Y825-K829 PolarHBondContact O-N 3.11Å; Y825-K829 VanDerWaalsContact OH-CE 3.24Å; Y825-K829 WeakPolarHBondContact OH-CE 3.5Å; Y825-K829 PolarHBondContact OH-NZ 2.64Å; L826-K829 PolarHBondContact O-N 3.05Å; H827-K829 VanDerWaalsContact C-N 3.27Å; H827-K829 PolarHBondContact O-N 2.94Å
830	L	40.7	Very low	42	Very low	126 Å²	126	112.2 Å²	112.2	66%	0.66	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-0	178.2	-79.3	164.3	0	0	0	113.8	H827 P832	H827-L830 PolarHBondContact O-N 3.16Å; H827-L830 VanDerWaalsContact O-N 3.12Å; L830-P832 VanDerWaalsContact O-CD 3.26Å; L830-P832 WeakPolarHBondContact O-CD 3.34Å
831	C	31.8	Very low	40.7	Very low	93 Å²	93	120.4 Å²	120.4	63%	0.628	60%	0.595	S	S	*	*	S	Bend	trans	-94.6	101.2	156.5	-70.2	0	0	0	0	108.5	D833	C831-D833 PolarHBondContact O-N 2.95Å
832	P	35.9	Very low	39.6	Very low	114 Å²	114	126.6 Å²	126.6	74%	0.74	63%	0.625	S	S	*	*			trans	-74.9	92.7	170.1	31.2	-32.7	0	0	0	108.7	L830 R834	L830-P832 VanDerWaalsContact O-CD 3.26Å; L830-P832 WeakPolarHBondContact O-CD 3.34Å; P832-R834 PolarHBondContact O-N 3.21Å
833	D	33.2	Very low	38.2	Very low	154 Å²	154	131.2 Å²	131.2	82%	0.824	64%	0.635	S	S	*	*			trans	-61.6	124.4	161.2	-155.9	-8.2	0	0	0	107.6	C831 D835	C831-D833 PolarHBondContact O-N 2.95Å; D833-D835 VanDerWaalsContact C-N 3.33Å; D833-D835 PolarHBondContact O-N 2.79Å
834	R	30.4	Very low	37.1	Very low	217 Å²	217	132.7 Å²	132.7	82%	0.819	65%	0.647	S	S	*	*	S	Bend	trans	-83	-13.1	-144.7	-145.7	179.9	-172.1	-165.7	1.8	114.3	P832	P832-R834 PolarHBondContact O-N 3.21Å
835	D	30.8	Very low	36.1	Very low	144 Å²	144	135.7 Å²	135.7	77%	0.77	67%	0.672	S	S	*	*			trans	-121.2	54	-161.7	-62.2	-57.2	0	0	0	112.9	D833	D833-D835 VanDerWaalsContact C-N 3.33Å; D833-D835 PolarHBondContact O-N 2.79Å
836	Q	34.5	Very low	35.2	Very low	186 Å²	186	133.8 Å²	133.8	87%	0.869	67%	0.67	S	S	*	*			trans	-135.6	74.8	164	-123.4	165.1	70.6	0	0	111.2
837	I	30.4	Very low	34.6	Very low	154 Å²	154	136.3 Å²	136.3	79%	0.79	68%	0.677	S	S	*	*			trans	-90.2	138.9	169.8	-60.1	176.3	0	0	0	108.4
838	M	31.6	Very low	34.2	Very low	162 Å²	162	138.2 Å²	138.2	80%	0.798	70%	0.7	S	S	*	*	S	Bend	trans	85.4	149.7	-176.9	-52.6	-152	63.6	0	0	116.7
839	E	29.7	Very low	33.6	Very low	181 Å²	181	139.7 Å²	139.7	85%	0.846	71%	0.707	S	S	*	*			trans	58	72.4	168.7	-56.1	-166.4	174.1	0	0	119
840	D	31.9	Very low	33.3	Very low	81 Å²	81	139.3 Å²	139.3	43%	0.433	71%	0.706	S	S	.	*				-162.4	97.3	121.7	-138	-35.1	0	0	0	114.5	Q842 R843	D840-Q842 VanDerWaalsContact C-N 3.26Å; D840-Q842 PolarHBondContact O-N 3.39Å; D840-Q842 PolarHBondContact OD1-N 3.18Å; D840-R843 HydrophobicContact CB-CG 3.92Å; D840-R843 IonicContact OD2-CZ 2.72Å; D840-R843 IonicContact OD2-NE 2.68Å; D840-R843 PolarHBondContact OD2-NE 3.13Å; D840-R843 IonicContact OD2-NH2 2.72Å; D840-R843 PolarHBondContact OD2-NH2 3.13Å
841	K	32.6	Very low	33.4	Very low	214 Å²	214	135.6 Å²	135.6	93%	0.93	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.5	0.4	177.8	-91.6	-176.1	177	177	0	114.4
842	Q	35	Very low	33.8	Very low	165 Å²	165	136.6 Å²	136.6	77%	0.771	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.1	-15.3	178.8	-70.8	-173.2	-15.4	0	0	115	D840 I844	D840-Q842 VanDerWaalsContact C-N 3.26Å; D840-Q842 PolarHBondContact O-N 3.39Å; D840-Q842 PolarHBondContact OD1-N 3.18Å; Q842-I844 PolarHBondContact O-N 3.23Å
843	R	30.2	Very low	34	Very low	165 Å²	165	133.7 Å²	133.7	62%	0.623	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	21.4	-167.9	-64.7	-171.7	-169.7	-173	12.4	117.1	D840	D840-R843 HydrophobicContact CB-CG 3.92Å; D840-R843 IonicContact OD2-CZ 2.72Å; D840-R843 IonicContact OD2-NE 2.68Å; D840-R843 PolarHBondContact OD2-NE 3.13Å; D840-R843 IonicContact OD2-NH2 2.72Å; D840-R843 PolarHBondContact OD2-NH2 3.13Å
844	I	32.3	Very low	34.7	Very low	140 Å²	140	132.7 Å²	132.7	72%	0.718	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-20	-179.4	-62.5	179.2	0	0	0	112.8	Q842 C846	Q842-I844 PolarHBondContact O-N 3.23Å; I844-C846 PolarHBondContact O-N 2.64Å
845	S	32.2	Very low	35.6	Very low	97 Å²	97	125.7 Å²	125.7	68%	0.678	65%	0.653	S	S	*	*			trans	-71.9	-6.8	177.5	60.9	0	0	0	0	114.6	K847	S845-K847 PolarHBondContact O-N 2.96Å
846	C	33	Very low	36.8	Very low	47 Å²	47	119.8 Å²	119.8	32%	0.318	62%	0.622	S	S	.	*			trans	-71.6	33.2	180	-67.6	0	0	0	0	114.5	I844 F850	I844-C846 PolarHBondContact O-N 2.64Å; C846-F850 HydrophobicContact CB-CE2 3.91Å
847	K	31.9	Very low	37.7	Very low	160 Å²	160	113.7 Å²	113.7	70%	0.696	60%	0.597	S	S	*	*	S	Bend	trans	-96.6	124.2	173.3	-75.7	-175.9	174.6	-179.4	0	110.3	S845 T849	S845-K847 PolarHBondContact O-N 2.96Å; K847-T849 VanDerWaalsContact C-N 3.34Å; K847-T849 PolarHBondContact O-N 2.85Å
848	S	36.8	Very low	38.8	Very low	129 Å²	129	111.6 Å²	111.6	90%	0.902	59%	0.587	S	S	*	*	S	Bend	trans	63.6	-4.7	161.6	49.2	0	0	0	0	121.2
849	T	35	Very low	39.9	Very low	83 Å²	83	103.9 Å²	103.9	51%	0.509	55%	0.549	S	S	.	.			trans	-103.1	-5.4	-171.8	48	0	0	0	0	117.5	K847 F851	K847-T849 VanDerWaalsContact C-N 3.34Å; K847-T849 PolarHBondContact O-N 2.85Å; T849-F851 PolarHBondContact O-N 3.33Å
850	F	40.2	Very low	41.1	Very low	114 Å²	114	95.4 Å²	95.4	50%	0.5	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-9.7	-171.4	-82	-74.6	0	0	0	116.9	C846 L858	C846-F850 HydrophobicContact CB-CE2 3.91Å; F850-L858 HydrophobicContact CD1-CD1 4.44Å
851	F	42.5	Very low	42	Very low	48 Å²	48	99.8 Å²	99.8	21%	0.211	52%	0.52	C	S	.	.	T	Hydrogen-bonded Turn	trans	-135.3	63.7	173.5	-70.9	-65.1	0	0	0	111.8	W821 T849 G853 L856 L859	W821-F851 AromaticContact CD1-CE2 3.82Å; W821-F851 HydrophobicContact CG-CE2 4.11Å; T849-F851 PolarHBondContact O-N 3.33Å; F851-G853 VanDerWaalsContact C-N 3.28Å; F851-G853 PolarHBondContact O-N 3.41Å; F851-L856 HydrophobicContact CD1-CD2 4.36Å; F851-L856 HydrophobicContact CE1-CD2 4.11Å; F851-L859 HydrophobicContact CE1-CD1 4.41Å; F851-L859 HydrophobicContact CE2-CD1 3.88Å; F851-L859 HydrophobicContact CZ-CB 4.21Å; F851-L859 HydrophobicContact CZ-CD1 3.45Å; F851-L859 VanDerWaalsContact CZ-CD1 3.45Å; F851-L859 HydrophobicContact CZ-CG 4.46Å
852	T	39.6	Very low	43.1	Very low	113 Å²	113	92.7 Å²	92.7	69%	0.693	49%	0.49	S	S	*	.			trans	-70.7	82.8	163.8	48	0	0	0	0	110.5	E854	T852-E854 VanDerWaalsContact C-N 3.34Å; T852-E854 PolarHBondContact O-N 2.91Å
853	G	40.6	Very low	43.7	Very low	54 Å²	54	90 Å²	90	56%	0.557	49%	0.488	S	S	*	.	S	Bend	trans	75.1	-61.6	163.7	0	0	0	0	0	117.6	F851	F851-G853 VanDerWaalsContact C-N 3.28Å; F851-G853 PolarHBondContact O-N 3.41Å
854	E	46.8	Very low	44.5	Very low	133 Å²	133	83.5 Å²	83.5	62%	0.621	47%	0.465	S	S	*	.	S	Bend	trans	-108.4	-27.9	-140.2	-70.6	161.3	-170.4	0	0	115.5	T852 S929	T852-E854 VanDerWaalsContact C-N 3.34Å; T852-E854 PolarHBondContact O-N 2.91Å; E854-S929 WeakPolarHBondContact O-CA 3.44Å
855	S	50.7	Low	45.1	Very low	70 Å²	70	82 Å²	82	49%	0.49	46%	0.464	S	S	.	.			trans	-130.4	143.6	-175	-164.5	0	0	0	0	114.9	T857	S855-T857 PolarHBondContact OG-OG1 3.49Å
856	L	54.9	Low	45.6	Very low	19 Å²	19	84.1 Å²	84.1	10%	0.099	46%	0.457	C	S	.	.			trans	-117.6	4.2	-178.5	-70.6	159.8	0	0	0	112.9	K814 F851 L858 L859 A860 L880 I934	K814-L856 HydrophobicContact CD-CD1 4.36Å; K814-L856 HydrophobicContact CG-CD1 4.22Å; F851-L856 HydrophobicContact CD1-CD2 4.36Å; F851-L856 HydrophobicContact CE1-CD2 4.11Å; L856-L858 VanDerWaalsContact C-N 3.26Å; L856-L858 PolarHBondContact O-N 3.06Å; L856-L859 WeakPolarHBondContact O-CA 3.4Å; L856-L859 WeakPolarHBondContact O-CB 3.33Å; L856-L859 PolarHBondContact O-N 3.01Å; L856-A860 PolarHBondContact O-N 3.06Å; L856-L880 HydrophobicContact CB-CD1 4.03Å; L856-L880 HydrophobicContact CB-CD2 4.03Å; L856-L880 HydrophobicContact CD1-CD1 4.43Å; L856-L880 HydrophobicContact CD1-CD2 4.02Å; L856-I934 HydrophobicContact CD1-CD1 3.41Å; L856-I934 VanDerWaalsContact CD1-CD1 3.41Å; L856-I934 HydrophobicContact CD1-CG1 3.79Å
857	T	53.5	Low	46.2	Very low	59 Å²	59	82.1 Å²	82.1	36%	0.362	44%	0.443	S	S	.	.	H	α-helix	trans	-57	-37	-179.1	51.5	0	0	0	0	112.6	S855 L859 A860 R861	S855-T857 PolarHBondContact OG-OG1 3.49Å; T857-L859 PolarHBondContact O-N 2.94Å; T857-A860 PolarHBondContact O-N 2.78Å; T857-R861 WeakPolarHBondContact O-CB 3.37Å; T857-R861 WeakPolarHBondContact O-CG 3.47Å; T857-R861 PolarHBondContact O-N 3.28Å
858	L	53.1	Low	46.7	Very low	110 Å²	110	78.2 Å²	78.2	58%	0.576	44%	0.441	S	S	*	.	H	α-helix	trans	-60.9	-29.1	173.4	-70.3	173.7	0	0	0	113.4	F850 L856	F850-L858 HydrophobicContact CD1-CD1 4.44Å; L856-L858 VanDerWaalsContact C-N 3.26Å; L856-L858 PolarHBondContact O-N 3.06Å
859	L	55.5	Low	46.7	Very low	0 Å²	0	76.9 Å²	76.9	0%	0	43%	0.431	C	S	.	.	H	α-helix	trans	-74.4	-50.3	173.8	-147.9	94.2	0	0	0	109.6	I817 W821 F851 L856 T857 R861 H862 L877 L880	I817-L859 HydrophobicContact CG2-CD1 4.48Å; I817-L859 HydrophobicContact CG2-CD2 3.82Å; W821-L859 HydrophobicContact CB-CD1 4.22Å; W821-L859 HydrophobicContact CD2-CD1 3.47Å; W821-L859 VanDerWaalsContact CD2-CD1 3.47Å; W821-L859 HydrophobicContact CE3-CD1 3.3Å; W821-L859 HydrophobicContact CE3-CG 4Å; W821-L859 HydrophobicContact CG-CD1 3.87Å; W821-L859 HydrophobicContact CH2-CD1 4.47Å; W821-L859 HydrophobicContact CZ3-CD1 3.83Å; W821-L859 HydrophobicContact CZ3-CG 4.1Å; F851-L859 HydrophobicContact CE1-CD1 4.41Å; F851-L859 HydrophobicContact CE2-CD1 3.88Å; F851-L859 HydrophobicContact CZ-CB 4.21Å; F851-L859 HydrophobicContact CZ-CD1 3.45Å; F851-L859 VanDerWaalsContact CZ-CD1 3.45Å; F851-L859 HydrophobicContact CZ-CG 4.46Å; L856-L859 WeakPolarHBondContact O-CA 3.4Å; L856-L859 WeakPolarHBondContact O-CB 3.33Å; L856-L859 PolarHBondContact O-N 3.01Å; T857-L859 PolarHBondContact O-N 2.94Å; L859-R861 VanDerWaalsContact C-N 3.32Å; L859-R861 PolarHBondContact O-N 3.07Å; L859-H862 WeakPolarHBondContact O-CB 3.48Å; L859-H862 PolarHBondContact O-N 2.7Å; L859-H862 VanDerWaalsContact O-N 3.17Å; L859-L877 VanDerWaalsContact C-CD2 3.46Å; L859-L877 HydrophobicContact CB-CD2 4.19Å; L859-L877 HydrophobicContact CD2-CD2 3.76Å; L859-L877 HydrophobicContact CD2-CG 4.3Å; L859-L877 HydrophobicContact CG-CD2 3.84Å; L859-L877 WeakPolarHBondContact O-CD2 3.4Å; L859-L880 HydrophobicContact CD2-CD1 4.13Å
860	A	54.2	Low	47.1	Very low	3 Å²	3	74.8 Å²	74.8	3%	0.025	42%	0.416	C	S	.	.	H	α-helix	trans	-56.4	-43.9	-178.3	0	0	0	0	0	112.4	L856 T857 H862 L880 R881 E884	L856-A860 PolarHBondContact O-N 3.06Å; T857-A860 PolarHBondContact O-N 2.78Å; A860-H862 VanDerWaalsContact C-N 3.25Å; A860-H862 PolarHBondContact O-N 3.02Å; A860-L880 HydrophobicContact CB-CB 4.03Å; A860-R881 HydrophobicContact CB-CG 4.2Å; A860-R881 PolarHBondContact O-NE 3.39Å; A860-R881 PolarHBondContact O-NH2 3.03Å; A860-E884 WeakPolarHBondContact CB-OE2 3.38Å
861	R	51.4	Low	47.5	Very low	172 Å²	172	72.1 Å²	72.1	65%	0.649	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-4.2	-178.4	-65.9	177.3	-172.5	-155.7	-5.2	115	T857 L859 P863 E884	T857-R861 WeakPolarHBondContact O-CB 3.37Å; T857-R861 WeakPolarHBondContact O-CG 3.47Å; T857-R861 PolarHBondContact O-N 3.28Å; L859-R861 VanDerWaalsContact C-N 3.32Å; L859-R861 PolarHBondContact O-N 3.07Å; R861-P863 WeakPolarHBondContact O-CD 3.33Å; R861-E884 IonicContact CZ-OE1 2.68Å; R861-E884 IonicContact NE-OE1 3.89Å; R861-E884 PolarHBondContact NE-OE1 3.38Å; R861-E884 IonicContact NH2-OE1 3.06Å; R861-E884 PolarHBondContact NH2-OE1 2.99Å
862	H	55.4	Low	47.8	Very low	65 Å²	65	74.5 Å²	74.5	30%	0.301	42%	0.421	S	S	.	.			trans	-75.1	120.9	-176.1	-168.4	-95.4	0	0	0	112.9	W821 L859 A860 D864 W867 R881	W821-H862 HydrophobicContact CH2-CB 3.85Å; W821-H862 AromaticContact CH2-CD2 3.73Å; W821-H862 AromaticContact CH2-CG 3.54Å; W821-H862 AromaticContact CH2-ND1 3.77Å; W821-H862 AromaticContact CZ2-CD2 3.98Å; L859-H862 WeakPolarHBondContact O-CB 3.48Å; L859-H862 PolarHBondContact O-N 2.7Å; L859-H862 VanDerWaalsContact O-N 3.17Å; A860-H862 VanDerWaalsContact C-N 3.25Å; A860-H862 PolarHBondContact O-N 3.02Å; H862-D864 VanDerWaalsContact CE1-CB 3.4Å; H862-D864 WeakPolarHBondContact CE1-CB 3.42Å; H862-D864 PolarHBondContact O-N 2.93Å; H862-W867 AromaticContact CE1-NE1 3.88Å; H862-W867 AromaticContact ND1-CD1 3.96Å; H862-W867 AromaticContact ND1-NE1 3.7Å; H862-R881 PolarHBondContact O-NH2 3.43Å
863	P	47.6	Very low	48.3	Very low	110 Å²	110	69.9 Å²	69.9	71%	0.714	39%	0.392	S	S	*	.			trans	-83.6	-8.5	-164.7	32.5	-37.6	0	0	0	115.8	R861 P865	R861-P863 WeakPolarHBondContact O-CD 3.33Å; P863-P865 WeakPolarHBondContact O-CD 3.45Å
864	D	47.3	Very low	49	Very low	28 Å²	28	67.6 Å²	67.6	15%	0.15	37%	0.369	C	S	.	.			trans	-61.2	118.2	-173.8	178.3	-6.8	0	0	0	112.4	H862 R866 W867	H862-D864 VanDerWaalsContact CE1-CB 3.4Å; H862-D864 WeakPolarHBondContact CE1-CB 3.42Å; H862-D864 PolarHBondContact O-N 2.93Å; D864-R866 PolarHBondContact O-N 3Å; D864-R866 VanDerWaalsContact OD1-CB 3.24Å; D864-R866 WeakPolarHBondContact OD1-CB 3.15Å; D864-R866 VanDerWaalsContact OD1-CG 3.27Å; D864-R866 WeakPolarHBondContact OD1-CG 3.23Å; D864-R866 IonicContact OD1-CZ 2.78Å; D864-R866 PolarHBondContact OD1-N 2.9Å; D864-R866 IonicContact OD1-NE 3.18Å; D864-R866 PolarHBondContact OD1-NE 2.94Å; D864-R866 IonicContact OD2-CZ 2.68Å; D864-R866 VanDerWaalsContact OD2-CZ 3.27Å; D864-R866 IonicContact OD2-NE 2.73Å; D864-R866 PolarHBondContact OD2-NE 3.24Å; D864-R866 IonicContact OD2-NH2 3.15Å; D864-R866 PolarHBondContact OD2-NH2 3.42Å; D864-W867 PolarHBondContact O-N 3.36Å
865	P	45.6	Very low	49.3	Very low	108 Å²	108	63 Å²	63	70%	0.701	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-70.2	-16	-175.3	28.9	-35.9	0	0	0	113.5	P863 W867 A868	P863-P865 WeakPolarHBondContact O-CD 3.45Å; P865-W867 PolarHBondContact O-N 3.14Å; P865-W867 VanDerWaalsContact O-N 3.17Å; P865-A868 WeakPolarHBondContact O-CB 3.27Å; P865-A868 PolarHBondContact O-N 3.43Å; P865-A868 VanDerWaalsContact O-N 3.11Å
866	R	42.1	Very low	49.5	Very low	141 Å²	141	59.8 Å²	59.8	53%	0.532	33%	0.325	S	S	.	.	G	3₁₀ helix	trans	-60.9	-26.9	179.7	-64.7	178.4	-66	-176.4	1.1	112.6	D864 A868 S869	D864-R866 PolarHBondContact O-N 3Å; D864-R866 VanDerWaalsContact OD1-CB 3.24Å; D864-R866 WeakPolarHBondContact OD1-CB 3.15Å; D864-R866 VanDerWaalsContact OD1-CG 3.27Å; D864-R866 WeakPolarHBondContact OD1-CG 3.23Å; D864-R866 IonicContact OD1-CZ 2.78Å; D864-R866 PolarHBondContact OD1-N 2.9Å; D864-R866 IonicContact OD1-NE 3.18Å; D864-R866 PolarHBondContact OD1-NE 2.94Å; D864-R866 IonicContact OD2-CZ 2.68Å; D864-R866 VanDerWaalsContact OD2-CZ 3.27Å; D864-R866 IonicContact OD2-NE 2.73Å; D864-R866 PolarHBondContact OD2-NE 3.24Å; D864-R866 IonicContact OD2-NH2 3.15Å; D864-R866 PolarHBondContact OD2-NH2 3.42Å; R866-A868 PolarHBondContact O-N 3.14Å; R866-S869 WeakPolarHBondContact O-CB 3.4Å; R866-S869 PolarHBondContact O-N 3.31Å; R866-S869 PolarHBondContact O-OG 3.29Å
867	W	45.1	Very low	49.6	Very low	6 Å²	6	59 Å²	59	2%	0.023	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-65.3	-25.8	178.2	-67.7	91.4	0	0	0	113.4	W821 H824 H862 D864 P865 S869 M870 I873 G874 L877	W821-W867 HydrophobicContact CD2-CH2 4.14Å; W821-W867 HydrophobicContact CD2-CZ2 4.23Å; W821-W867 AromaticContact CE3-CH2 3.25Å; W821-W867 HydrophobicContact CE3-CH2 3.25Å; W821-W867 AromaticContact CE3-CZ2 3.36Å; W821-W867 HydrophobicContact CE3-CZ2 3.36Å; W821-W867 AromaticContact CE3-CZ3 3.88Å; W821-W867 HydrophobicContact CE3-CZ3 3.88Å; W821-W867 AromaticContact CH2-CZ2 3.87Å; W821-W867 HydrophobicContact CH2-CZ2 3.87Å; W821-W867 HydrophobicContact CZ3-CD2 4.03Å; W821-W867 AromaticContact CZ3-CE2 3.43Å; W821-W867 VanDerWaalsContact CZ3-CE2 3.43Å; W821-W867 HydrophobicContact CZ3-CE3 4.32Å; W821-W867 AromaticContact CZ3-CH2 3.55Å; W821-W867 HydrophobicContact CZ3-CH2 3.55Å; W821-W867 AromaticContact CZ3-CZ2 3.16Å; W821-W867 HydrophobicContact CZ3-CZ2 3.16Å; W821-W867 HydrophobicContact CZ3-CZ3 4.11Å; W821-W867 AromaticContact CZ3-NE1 4Å; H824-W867 HydrophobicContact CB-CH2 3.51Å; H824-W867 HydrophobicContact CB-CZ2 3.83Å; H824-W867 AromaticContact CD2-CH2 3.88Å; H824-W867 AromaticContact CD2-CZ2 3.82Å; H824-W867 AromaticContact CE1-CE2 3.98Å; H824-W867 AromaticContact CE1-CZ2 3.71Å; H824-W867 AromaticContact CG-CH2 3.5Å; H824-W867 VanDerWaalsContact CG-CH2 3.5Å; H824-W867 AromaticContact CG-CZ2 3.39Å; H824-W867 AromaticContact ND1-CH2 3.94Å; H824-W867 AromaticContact ND1-CZ2 3.31Å; H824-W867 VanDerWaalsContact ND1-CZ2 3.31Å; H824-W867 WeakPolarHBondContact ND1-CZ2 3.05Å; H862-W867 AromaticContact CE1-NE1 3.88Å; H862-W867 AromaticContact ND1-CD1 3.96Å; H862-W867 AromaticContact ND1-NE1 3.7Å; D864-W867 PolarHBondContact O-N 3.36Å; P865-W867 PolarHBondContact O-N 3.14Å; P865-W867 VanDerWaalsContact O-N 3.17Å; W867-S869 PolarHBondContact O-N 3.12Å; W867-M870 HydrophobicContact CE3-SD 3.87Å; W867-M870 HydrophobicContact CZ3-SD 3.88Å; W867-M870 PolarHBondContact O-N 3.11Å; W867-I873 HydrophobicContact CE3-CB 4.16Å; W867-I873 HydrophobicContact CE3-CD1 4.46Å; W867-I873 HydrophobicContact CE3-CG2 3.63Å; W867-I873 HydrophobicContact CZ3-CB 4.37Å; W867-I873 HydrophobicContact CZ3-CD1 3.88Å; W867-I873 HydrophobicContact CZ3-CG2 3.77Å; W867-G874 VanDerWaalsContact O-CA 3.31Å; W867-G874 WeakPolarHBondContact O-CA 3.43Å; W867-G874 PolarHBondContact O-N 2.84Å; W867-L877 HydrophobicContact CB-CD1 3.53Å; W867-L877 HydrophobicContact CD2-CD1 4.17Å; W867-L877 HydrophobicContact CE3-CD1 4.19Å; W867-L877 HydrophobicContact CG-CD1 3.92Å
868	A	42.5	Very low	49.7	Very low	78 Å²	78	57.7 Å²	57.7	65%	0.645	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-66.3	-19.2	171.7	0	0	0	0	0	112.9	P865 R866	P865-A868 WeakPolarHBondContact O-CB 3.27Å; P865-A868 PolarHBondContact O-N 3.43Å; P865-A868 VanDerWaalsContact O-N 3.11Å; R866-A868 PolarHBondContact O-N 3.14Å
869	S	37.8	Very low	49.8	Very low	100 Å²	100	53.5 Å²	53.5	70%	0.699	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-84.7	-15.6	174.6	77.4	0	0	0	0	114	R866 W867 N871	R866-S869 WeakPolarHBondContact O-CB 3.4Å; R866-S869 PolarHBondContact O-N 3.31Å; R866-S869 PolarHBondContact O-OG 3.29Å; W867-S869 PolarHBondContact O-N 3.12Å; S869-N871 PolarHBondContact O-N 3.47Å
870	M	42.3	Very low	49.8	Very low	40 Å²	40	54.5 Å²	54.5	20%	0.197	30%	0.298	C	S	.	.	S	Bend	trans	-88.8	78.4	177.4	-66.5	-171.4	75.3	0	0	109.8	H517 W867 I872 I873 G874	H517-M870 WeakPolarHBondContact NE2-CE 3.2Å; W867-M870 HydrophobicContact CE3-SD 3.87Å; W867-M870 HydrophobicContact CZ3-SD 3.88Å; W867-M870 PolarHBondContact O-N 3.11Å; M870-I872 VanDerWaalsContact C-N 3.35Å; M870-I872 CarbonylContact O-C 3.54Å; M870-I872 PolarHBondContact O-N 3.2Å; M870-I873 HydrophobicContact CB-CB 4.32Å; M870-I873 HydrophobicContact CE-CD1 3.72Å; M870-I873 PolarHBondContact O-N 3.28Å; M870-I873 HydrophobicContact SD-CD1 4.35Å; M870-G874 PolarHBondContact O-N 3.18Å
871	N	49.9	Very low	49.9	Very low	57 Å²	57	58.5 Å²	58.5	31%	0.305	31%	0.312	S	S	.	.	H	α-helix	trans	-30.4	-58.1	-164.2	-155.2	2.4	0	0	0	115.6	S869 Q875	S869-N871 PolarHBondContact O-N 3.47Å; N871-Q875 VanDerWaalsContact O-CG 3.25Å; N871-Q875 WeakPolarHBondContact O-CG 3.44Å; N871-Q875 PolarHBondContact O-N 3Å; N871-Q875 PolarHBondContact OD1-NE2 2.89Å
872	I	48.8	Very low	50.2	Low	98 Å²	98	53.4 Å²	53.4	50%	0.503	30%	0.303	S	S	.	.	H	α-helix	trans	-66.8	-44.4	179.4	-60.8	174	0	0	0	113.1	I812 M870 Q875 V876	I812-I872 HydrophobicContact CD1-CG2 3.7Å; M870-I872 VanDerWaalsContact C-N 3.35Å; M870-I872 CarbonylContact O-C 3.54Å; M870-I872 PolarHBondContact O-N 3.2Å; I872-Q875 PolarHBondContact O-N 3.39Å; I872-V876 VanDerWaalsContact O-CG2 3.3Å; I872-V876 WeakPolarHBondContact O-CG2 3.44Å; I872-V876 PolarHBondContact O-N 2.8Å
873	I	50.6	Low	50.2	Low	16 Å²	16	52.7 Å²	52.7	8%	0.082	30%	0.301	C	S	.	.	H	α-helix	trans	-76.1	-29.9	-177.9	-45.9	-179.6	0	0	0	111	L820 W867 M870 V876 L877	L820-I873 HydrophobicContact CB-CD1 3.92Å; L820-I873 HydrophobicContact CD1-CD1 4.03Å; L820-I873 HydrophobicContact CD2-CD1 4.42Å; L820-I873 HydrophobicContact CG-CD1 4.35Å; W867-I873 HydrophobicContact CE3-CB 4.16Å; W867-I873 HydrophobicContact CE3-CD1 4.46Å; W867-I873 HydrophobicContact CE3-CG2 3.63Å; W867-I873 HydrophobicContact CZ3-CB 4.37Å; W867-I873 HydrophobicContact CZ3-CD1 3.88Å; W867-I873 HydrophobicContact CZ3-CG2 3.77Å; M870-I873 HydrophobicContact CB-CB 4.32Å; M870-I873 HydrophobicContact CE-CD1 3.72Å; M870-I873 PolarHBondContact O-N 3.28Å; M870-I873 HydrophobicContact SD-CD1 4.35Å; I873-V876 PolarHBondContact O-N 3.22Å; I873-L877 HydrophobicContact CG2-CD1 4.12Å; I873-L877 HydrophobicContact CG2-CG 4.4Å; I873-L877 VanDerWaalsContact O-CB 3.32Å; I873-L877 WeakPolarHBondContact O-CB 3.48Å; I873-L877 VanDerWaalsContact O-CG 3.3Å; I873-L877 WeakPolarHBondContact O-CG 3.3Å; I873-L877 PolarHBondContact O-N 3.1Å
874	G	54.4	Low	50.5	Low	7 Å²	7	49 Å²	49	7%	0.072	27%	0.274	C	S	.	.	H	α-helix	trans	-58.8	-47.4	166.6	0	0	0	0	0	111.6	W867 M870 L877 C878	W867-G874 VanDerWaalsContact O-CA 3.31Å; W867-G874 WeakPolarHBondContact O-CA 3.43Å; W867-G874 PolarHBondContact O-N 2.84Å; M870-G874 PolarHBondContact O-N 3.18Å; G874-L877 PolarHBondContact O-N 3.41Å; G874-C878 WeakPolarHBondContact O-CB 3.08Å; G874-C878 PolarHBondContact O-N 3.13Å; G874-C878 PolarHBondContact O-SG 2.88Å
875	Q	53.3	Low	50.7	Low	36 Å²	36	54.9 Å²	54.9	17%	0.168	29%	0.294	C	S	.	.	H	α-helix	trans	-62.4	-43.7	174.5	-70.5	169.8	33.1	0	0	112.2	N871 I872 L877 C878 T879 V936	N871-Q875 VanDerWaalsContact O-CG 3.25Å; N871-Q875 WeakPolarHBondContact O-CG 3.44Å; N871-Q875 PolarHBondContact O-N 3Å; N871-Q875 PolarHBondContact OD1-NE2 2.89Å; I872-Q875 PolarHBondContact O-N 3.39Å; Q875-L877 PolarHBondContact O-N 2.72Å; Q875-C878 PolarHBondContact O-N 3.34Å; Q875-T879 VanDerWaalsContact O-CB 3.31Å; Q875-T879 WeakPolarHBondContact O-CB 3.49Å; Q875-T879 PolarHBondContact O-N 2.89Å; Q875-T879 PolarHBondContact O-OG1 2.81Å; Q875-V936 HydrophobicContact CB-CG1 4.37Å
876	V	55.3	Low	50.7	Low	2 Å²	2	58.3 Å²	58.3	1%	0.012	29%	0.293	C	S	.	.	H	α-helix	trans	-56	-49.3	172.3	169	0	0	0	0	111.2	I812 I817 I872 I873 T879 L880 I934 V936	I812-V876 HydrophobicContact CD1-CG2 3.7Å; I817-V876 HydrophobicContact CD1-CG1 4.13Å; I872-V876 VanDerWaalsContact O-CG2 3.3Å; I872-V876 WeakPolarHBondContact O-CG2 3.44Å; I872-V876 PolarHBondContact O-N 2.8Å; I873-V876 PolarHBondContact O-N 3.22Å; V876-T879 PolarHBondContact O-N 2.87Å; V876-L880 HydrophobicContact CG1-CD1 3.81Å; V876-L880 HydrophobicContact CG1-CG 4.42Å; V876-L880 WeakPolarHBondContact O-CB 3.42Å; V876-L880 VanDerWaalsContact O-CG 3.32Å; V876-L880 WeakPolarHBondContact O-CG 3.1Å; V876-L880 PolarHBondContact O-N 2.92Å; V876-I934 HydrophobicContact CG1-CD1 4.1Å; V876-V936 HydrophobicContact CG2-CG2 3.97Å
877	L	55.6	Low	50.7	Low	4 Å²	4	53.2 Å²	53.2	2%	0.021	28%	0.281	C	S	.	.	H	α-helix	trans	-67.7	-39.4	-177.6	-78.3	165.2	0	0	0	112.7	L859 W867 I873 G874 Q875 T879 L880 R881	L859-L877 VanDerWaalsContact C-CD2 3.46Å; L859-L877 HydrophobicContact CB-CD2 4.19Å; L859-L877 HydrophobicContact CD2-CD2 3.76Å; L859-L877 HydrophobicContact CD2-CG 4.3Å; L859-L877 HydrophobicContact CG-CD2 3.84Å; L859-L877 WeakPolarHBondContact O-CD2 3.4Å; W867-L877 HydrophobicContact CB-CD1 3.53Å; W867-L877 HydrophobicContact CD2-CD1 4.17Å; W867-L877 HydrophobicContact CE3-CD1 4.19Å; W867-L877 HydrophobicContact CG-CD1 3.92Å; I873-L877 HydrophobicContact CG2-CD1 4.12Å; I873-L877 HydrophobicContact CG2-CG 4.4Å; I873-L877 VanDerWaalsContact O-CB 3.32Å; I873-L877 WeakPolarHBondContact O-CB 3.48Å; I873-L877 VanDerWaalsContact O-CG 3.3Å; I873-L877 WeakPolarHBondContact O-CG 3.3Å; I873-L877 PolarHBondContact O-N 3.1Å; G874-L877 PolarHBondContact O-N 3.41Å; Q875-L877 PolarHBondContact O-N 2.72Å; L877-T879 VanDerWaalsContact C-N 3.34Å; L877-L880 PolarHBondContact O-N 3.3Å; L877-R881 WeakPolarHBondContact O-CB 3.25Å; L877-R881 WeakPolarHBondContact O-CD 3.1Å; L877-R881 WeakPolarHBondContact O-CG 3.23Å; L877-R881 PolarHBondContact O-N 3.08Å
878	C	56.3	Low	50.5	Low	31 Å²	31	57.1 Å²	57.1	21%	0.209	30%	0.302	C	S	.	.	H	α-helix	trans	-70.1	-33.8	176.1	-61.6	0	0	0	0	111.6	H597 G874 Q875 S882	H597-C878 PolarHBondContact NE2-SG 2.66Å; H597-C878 VanDerWaalsContact NE2-SG 3.43Å; G874-C878 WeakPolarHBondContact O-CB 3.08Å; G874-C878 PolarHBondContact O-N 3.13Å; G874-C878 PolarHBondContact O-SG 2.88Å; Q875-C878 PolarHBondContact O-N 3.34Å; C878-S882 WeakPolarHBondContact O-CB 3.38Å; C878-S882 PolarHBondContact O-N 2.73Å; C878-S882 PolarHBondContact O-OG 2.87Å
879	T	55.5	Low	50.6	Low	22 Å²	22	57.9 Å²	57.9	14%	0.135	30%	0.3	C	S	.	.	H	α-helix	trans	-64.9	-49.5	171.3	-57.4	0	0	0	0	110.7	Q875 V876 L877 R881 S882 L883	Q875-T879 VanDerWaalsContact O-CB 3.31Å; Q875-T879 WeakPolarHBondContact O-CB 3.49Å; Q875-T879 PolarHBondContact O-N 2.89Å; Q875-T879 PolarHBondContact O-OG1 2.81Å; V876-T879 PolarHBondContact O-N 2.87Å; L877-T879 VanDerWaalsContact C-N 3.34Å; T879-R881 PolarHBondContact O-N 2.83Å; T879-S882 PolarHBondContact O-N 2.88Å; T879-S882 VanDerWaalsContact O-N 3.11Å; T879-L883 HydrophobicContact CG2-CD1 4.28Å; T879-L883 PolarHBondContact O-N 3.29Å
880	L	54.4	Low	50.8	Low	21 Å²	21	56.3 Å²	56.3	11%	0.11	28%	0.283	C	S	.	.	H	α-helix	trans	-60.5	-42	177.5	-73.7	169.8	0	0	0	112.5	L856 L859 A860 V876 L877 S882 L883 E884 I934	L856-L880 HydrophobicContact CB-CD1 4.03Å; L856-L880 HydrophobicContact CB-CD2 4.03Å; L856-L880 HydrophobicContact CD1-CD1 4.43Å; L856-L880 HydrophobicContact CD1-CD2 4.02Å; L859-L880 HydrophobicContact CD2-CD1 4.13Å; A860-L880 HydrophobicContact CB-CB 4.03Å; V876-L880 HydrophobicContact CG1-CD1 3.81Å; V876-L880 HydrophobicContact CG1-CG 4.42Å; V876-L880 WeakPolarHBondContact O-CB 3.42Å; V876-L880 VanDerWaalsContact O-CG 3.32Å; V876-L880 WeakPolarHBondContact O-CG 3.1Å; V876-L880 PolarHBondContact O-N 2.92Å; L877-L880 PolarHBondContact O-N 3.3Å; L880-S882 VanDerWaalsContact C-N 3.32Å; L880-S882 PolarHBondContact O-N 2.99Å; L880-L883 PolarHBondContact O-N 3.49Å; L880-E884 WeakPolarHBondContact O-CB 3.1Å; L880-E884 PolarHBondContact O-N 3.17Å; L880-I934 HydrophobicContact CD1-CD1 4.39Å; L880-I934 HydrophobicContact CD2-CD1 4.34Å
881	R	58.1	Low	50.6	Low	87 Å²	87	61.2 Å²	61.2	33%	0.328	31%	0.305	S	S	.	.	H	α-helix	trans	-65.8	-32	174.4	-73.5	167	-179.9	168.2	2.7	113.2	A860 H862 L877 T879 R885	A860-R881 HydrophobicContact CB-CG 4.2Å; A860-R881 PolarHBondContact O-NE 3.39Å; A860-R881 PolarHBondContact O-NH2 3.03Å; H862-R881 PolarHBondContact O-NH2 3.43Å; L877-R881 WeakPolarHBondContact O-CB 3.25Å; L877-R881 WeakPolarHBondContact O-CD 3.1Å; L877-R881 WeakPolarHBondContact O-CG 3.23Å; L877-R881 PolarHBondContact O-N 3.08Å; T879-R881 PolarHBondContact O-N 2.83Å; R881-R885 WeakPolarHBondContact O-CB 3.46Å; R881-R885 WeakPolarHBondContact O-CG 3.27Å; R881-R885 PolarHBondContact O-N 3.04Å
882	S	57.2	Low	50	Low	65 Å²	65	64.2 Å²	64.2	46%	0.455	32%	0.321	S	S	.	.	H	α-helix	trans	-73.3	-38.1	175.7	-58.7	0	0	0	0	111.3	C878 T879 L880 W886	C878-S882 WeakPolarHBondContact O-CB 3.38Å; C878-S882 PolarHBondContact O-N 2.73Å; C878-S882 PolarHBondContact O-OG 2.87Å; T879-S882 PolarHBondContact O-N 2.88Å; T879-S882 VanDerWaalsContact O-N 3.11Å; L880-S882 VanDerWaalsContact C-N 3.32Å; L880-S882 PolarHBondContact O-N 2.99Å; S882-W886 PolarHBondContact O-N 3.46Å; S882-W886 VanDerWaalsContact O-N 3.09Å
883	L	54.6	Low	49.5	Very low	49 Å²	49	63.2 Å²	63.2	26%	0.257	32%	0.323	S	S	.	.	H	α-helix	trans	-63.3	-45.4	169.8	-101.1	71.7	0	0	0	111.9	T879 L880 R885 W886 A887 M925 F928	T879-L883 HydrophobicContact CG2-CD1 4.28Å; T879-L883 PolarHBondContact O-N 3.29Å; L880-L883 PolarHBondContact O-N 3.49Å; L883-R885 PolarHBondContact O-N 2.89Å; L883-W886 WeakPolarHBondContact O-CB 3.27Å; L883-W886 PolarHBondContact O-N 2.71Å; L883-W886 VanDerWaalsContact O-N 3.11Å; L883-A887 PolarHBondContact O-N 3.23Å; L883-M925 HydrophobicContact CB-CE 4.03Å; L883-M925 HydrophobicContact CD2-CE 4.2Å; L883-M925 HydrophobicContact CD2-SD 4.49Å; L883-M925 HydrophobicContact CG-CE 3.92Å; L883-M925 WeakPolarHBondContact O-CE 3.34Å; L883-F928 HydrophobicContact CD2-CD2 4Å; L883-F928 HydrophobicContact CD2-CE2 4.35Å; L883-F928 HydrophobicContact CD2-CG 4.24Å
884	E	53.8	Low	48.7	Very low	34 Å²	34	68.6 Å²	68.6	16%	0.159	35%	0.351	C	S	.	.	H	α-helix	trans	-60.6	-46.5	179.6	-171.7	165.4	-147.3	0	0	111.1	A860 R861 L880 W886 A887 D888	A860-E884 WeakPolarHBondContact CB-OE2 3.38Å; R861-E884 IonicContact CZ-OE1 2.68Å; R861-E884 IonicContact NE-OE1 3.89Å; R861-E884 PolarHBondContact NE-OE1 3.38Å; R861-E884 IonicContact NH2-OE1 3.06Å; R861-E884 PolarHBondContact NH2-OE1 2.99Å; L880-E884 WeakPolarHBondContact O-CB 3.1Å; L880-E884 PolarHBondContact O-N 3.17Å; E884-W886 VanDerWaalsContact C-N 3.29Å; E884-W886 PolarHBondContact O-N 3.05Å; E884-A887 WeakPolarHBondContact O-CB 3.24Å; E884-A887 PolarHBondContact O-N 2.68Å; E884-A887 VanDerWaalsContact O-N 3.14Å; E884-D888 VanDerWaalsContact O-CG 3.3Å; E884-D888 PolarHBondContact O-N 2.95Å
885	R	51.4	Low	47.8	Very low	151 Å²	151	73.8 Å²	73.8	57%	0.57	38%	0.382	S	S	*	.	H	α-helix	trans	-62.1	-32.2	173	-73.8	174.9	174.9	-167.6	-3.2	113.8	R881 L883 T889	R881-R885 WeakPolarHBondContact O-CB 3.46Å; R881-R885 WeakPolarHBondContact O-CG 3.27Å; R881-R885 PolarHBondContact O-N 3.04Å; L883-R885 PolarHBondContact O-N 2.89Å; R885-T889 WeakPolarHBondContact O-CB 3.4Å; R885-T889 PolarHBondContact O-N 3.34Å; R885-T889 VanDerWaalsContact O-N 3.07Å; R885-T889 PolarHBondContact O-OG1 3.48Å
886	W	46.9	Very low	46.8	Very low	180 Å²	180	77.8 Å²	77.8	68%	0.682	41%	0.408	S	S	*	.	H	α-helix	trans	-68.6	-40.2	173.7	-103	75.1	0	0	0	111.7	S882 L883 E884 T889 L890	S882-W886 PolarHBondContact O-N 3.46Å; S882-W886 VanDerWaalsContact O-N 3.09Å; L883-W886 WeakPolarHBondContact O-CB 3.27Å; L883-W886 PolarHBondContact O-N 2.71Å; L883-W886 VanDerWaalsContact O-N 3.11Å; E884-W886 VanDerWaalsContact C-N 3.29Å; E884-W886 PolarHBondContact O-N 3.05Å; W886-T889 PolarHBondContact O-N 3.01Å; W886-L890 HydrophobicContact CE3-CD1 4.38Å; W886-L890 WeakPolarHBondContact O-CG 3.49Å; W886-L890 PolarHBondContact O-N 2.82Å
887	A	41	Very low	45.5	Very low	33 Å²	33	82.6 Å²	82.6	27%	0.273	44%	0.442	S	S	.	.	H	α-helix	trans	-63	-47.7	172.9	0	0	0	0	0	111.6	L883 E884 T889 L890 E891 M925	L883-A887 PolarHBondContact O-N 3.23Å; E884-A887 WeakPolarHBondContact O-CB 3.24Å; E884-A887 PolarHBondContact O-N 2.68Å; E884-A887 VanDerWaalsContact O-N 3.14Å; A887-T889 PolarHBondContact O-N 3.43Å; A887-L890 PolarHBondContact O-N 3.27Å; A887-L890 VanDerWaalsContact O-N 3.11Å; A887-E891 PolarHBondContact O-N 3.12Å; A887-M925 HydrophobicContact CB-CE 4.25Å
888	D	42.1	Very low	44.2	Very low	88 Å²	88	89.8 Å²	89.8	47%	0.471	48%	0.48	S	S	.	.	H	α-helix	trans	-55.4	-39.4	175.5	-63.1	-30.4	0	0	0	111.7	E884 L892	E884-D888 VanDerWaalsContact O-CG 3.3Å; E884-D888 PolarHBondContact O-N 2.95Å; D888-L892 WeakPolarHBondContact O-CB 3.31Å; D888-L892 PolarHBondContact O-N 3.47Å; D888-L892 VanDerWaalsContact O-N 3.09Å
889	T	44.5	Very low	42.7	Very low	95 Å²	95	94.9 Å²	94.9	58%	0.583	50%	0.504	S	S	*	.	H	α-helix	trans	-71	-38.2	179.2	-53.9	0	0	0	0	111.9	R885 W886 A887 S893	R885-T889 WeakPolarHBondContact O-CB 3.4Å; R885-T889 PolarHBondContact O-N 3.34Å; R885-T889 VanDerWaalsContact O-N 3.07Å; R885-T889 PolarHBondContact O-OG1 3.48Å; W886-T889 PolarHBondContact O-N 3.01Å; A887-T889 PolarHBondContact O-N 3.43Å; T889-S893 PolarHBondContact O-N 2.83Å; T889-S893 VanDerWaalsContact O-N 3.08Å
890	L	40.5	Very low	41.5	Very low	66 Å²	66	99.9 Å²	99.9	35%	0.346	54%	0.539	S	S	.	.	H	α-helix	trans	-69.1	-41	176.3	-78.9	163.8	0	0	0	112.1	W886 A887 S893 N894	W886-L890 HydrophobicContact CE3-CD1 4.38Å; W886-L890 WeakPolarHBondContact O-CG 3.49Å; W886-L890 PolarHBondContact O-N 2.82Å; A887-L890 PolarHBondContact O-N 3.27Å; A887-L890 VanDerWaalsContact O-N 3.11Å; L890-S893 PolarHBondContact O-N 3.27Å; L890-S893 PolarHBondContact O-OG 2.97Å; L890-N894 PolarHBondContact O-N 3.43Å; L890-N894 PolarHBondContact O-ND2 3.13Å
891	E	37.8	Very low	40.1	Very low	143 Å²	143	104.7 Å²	104.7	67%	0.668	57%	0.569	S	S	*	*	H	α-helix	trans	-63.8	-45.2	174.1	-71.7	-165.5	174	0	0	111.3	A887 S893 N894 V895	A887-E891 PolarHBondContact O-N 3.12Å; E891-S893 VanDerWaalsContact C-N 3.26Å; E891-S893 PolarHBondContact O-N 3.45Å; E891-N894 PolarHBondContact O-N 2.63Å; E891-V895 WeakPolarHBondContact O-CG2 3.33Å; E891-V895 PolarHBondContact O-N 3.36Å
892	L	37.7	Very low	38.4	Very low	120 Å²	120	107.2 Å²	107.2	63%	0.628	59%	0.589	S	S	*	*	H	α-helix	trans	-60.3	-36.2	177.8	-162.2	71.1	0	0	0	112.2	D888 N894 V895 V896	D888-L892 WeakPolarHBondContact O-CB 3.31Å; D888-L892 PolarHBondContact O-N 3.47Å; D888-L892 VanDerWaalsContact O-N 3.09Å; L892-N894 PolarHBondContact O-N 2.89Å; L892-V895 PolarHBondContact O-N 2.97Å; L892-V896 PolarHBondContact O-N 3.32Å
893	S	38.4	Very low	37.1	Very low	78 Å²	78	113.2 Å²	113.2	55%	0.545	61%	0.609	S	S	.	*	H	α-helix	trans	-64.3	-24.7	176.6	78.6	0	0	0	0	114.3	T889 L890 E891	T889-S893 PolarHBondContact O-N 2.83Å; T889-S893 VanDerWaalsContact O-N 3.08Å; L890-S893 PolarHBondContact O-N 3.27Å; L890-S893 PolarHBondContact O-OG 2.97Å; E891-S893 VanDerWaalsContact C-N 3.26Å; E891-S893 PolarHBondContact O-N 3.45Å
894	N	35	Very low	35.7	Very low	129 Å²	129	119.4 Å²	119.4	69%	0.69	64%	0.637	S	S	*	*	H	α-helix	trans	-95	-9.1	-179.9	-72.9	-67.5	0	0	0	113.7	L890 E891 L892	L890-N894 PolarHBondContact O-N 3.43Å; L890-N894 PolarHBondContact O-ND2 3.13Å; E891-N894 PolarHBondContact O-N 2.63Å; L892-N894 PolarHBondContact O-N 2.89Å
895	V	35.6	Very low	34.5	Very low	116 Å²	116	123.3 Å²	123.3	70%	0.703	67%	0.668	S	S	*	*	H	α-helix	trans	-99.7	-25.1	-178.9	175.4	0	0	0	0	112.5	E891 L892 S897	E891-V895 WeakPolarHBondContact O-CG2 3.33Å; E891-V895 PolarHBondContact O-N 3.36Å; L892-V895 PolarHBondContact O-N 2.97Å; V895-S897 VanDerWaalsContact C-N 3.27Å; V895-S897 PolarHBondContact O-N 3.36Å
896	V	30.7	Very low	33.2	Very low	120 Å²	120	119.9 Å²	119.9	73%	0.727	67%	0.672	S	S	*	*			trans	-86	63.3	177.7	-169.2	0	0	0	0	111.3	L892	L892-V896 PolarHBondContact O-N 3.32Å
897	S	29.3	Very low	32.3	Very low	103 Å²	103	119.2 Å²	119.2	72%	0.72	68%	0.681	S	S	*	*			trans	-147.9	45.7	173.3	-173.8	0	0	0	0	113.4	V895	V895-S897 VanDerWaalsContact C-N 3.27Å; V895-S897 PolarHBondContact O-N 3.36Å
898	L	27.4	Very low	31.7	Very low	155 Å²	155	126.5 Å²	126.5	81%	0.812	71%	0.707	S	S	*	*	S	Bend	trans	-146.7	116.9	162.9	-149.9	67.9	0	0	0	111.9
899	D	25	Very low	31.1	Very low	137 Å²	137	126.8 Å²	126.8	73%	0.733	71%	0.714	S	S	*	*			trans	43.3	90.1	158.8	-57.2	-24	0	0	0	121.1
900	C	29.7	Very low	30.1	Very low	128 Å²	128	128.8 Å²	128.8	87%	0.865	72%	0.721	S	S	*	*			trans	-175.7	83.7	140.8	-97.5	0	0	0	0	109.4
901	V	24.6	Very low	29.4	Very low	121 Å²	121	131 Å²	131	73%	0.733	74%	0.737	S	S	*	*				58.9	105.2	87.9	-176	0	0	0	0	113.9
902	N	24.3	Very low	28.8	Very low	140 Å²	140	130.9 Å²	130.9	75%	0.749	75%	0.746	S	S	*	*			trans	55.8	110	157.3	-59.9	-16.4	0	0	0	119.7
903	H	29.8	Very low	28.4	Very low	191 Å²	191	130.2 Å²	130.2	88%	0.884	75%	0.752	S	S	*	*				-156	148.4	99.7	-102.3	-71.3	0	0	0	111.8
904	Q	24.1	Very low	27.7	Very low	179 Å²	179	132.3 Å²	132.3	84%	0.836	77%	0.766	S	S	*	*			trans	-87.6	137	-175.8	-61.8	150.7	-66.7	0	0	112.1
905	S	28	Very low	27.3	Very low	117 Å²	117	132.4 Å²	132.4	82%	0.818	77%	0.772	S	S	*	*			trans	166.7	93.2	134	-75.1	0	0	0	0	108.9
906	A	25	Very low	26.8	Very low	79 Å²	79	132 Å²	132	65%	0.653	78%	0.775	S	S	*	*				75.1	87.4	72.1	0	0	0	0	0	114.3	F908	A906-F908 HydrophobicContact CB-CE2 4.46Å
907	L	27.7	Very low	26.5	Very low	166 Å²	166	132.4 Å²	132.4	87%	0.869	78%	0.781	S	S	*	*			trans	-148.8	40.7	151.8	-120.9	171.1	0	0	0	114.4
908	F	27.9	Very low	26.4	Very low	185 Å²	185	132 Å²	132	81%	0.811	78%	0.778	S	S	*	*			trans	61	155.6	151.4	-66.9	-80.6	0	0	0	121.2	A906	A906-F908 HydrophobicContact CB-CE2 4.46Å
909	P	30.1	Very low	26.4	Very low	94 Å²	94	135.9 Å²	135.9	61%	0.61	78%	0.782	S	S	*	*			trans	-140.5	-153.9	-144.9	39.8	-15.3	0	0	0	113.7
910	D	22.9	Very low	26.9	Very low	137 Å²	137	132.3 Å²	132.3	73%	0.733	77%	0.765	S	S	*	*			trans	41.8	142.1	139.3	-60.2	-18.4	0	0	0	122.1
911	T	25.9	Very low	27	Very low	113 Å²	113	131.8 Å²	131.8	69%	0.693	75%	0.753	S	S	*	*			cis	-164.5	170.4	-0.4	19.2	0	0	0	0	111.6
912	T	25.6	Very low	27.4	Very low	140 Å²	140	130.2 Å²	130.2	86%	0.859	75%	0.748	S	S	*	*			trans	79.6	147.7	164.4	76	0	0	0	0	117.6
913	S	28.8	Very low	27.9	Very low	107 Å²	107	126.7 Å²	126.7	75%	0.748	73%	0.732	S	S	*	*			cis	-120	142.5	3.6	60.4	0	0	0	0	113.6
914	S	23.6	Very low	28.2	Very low	121 Å²	121	120.7 Å²	120.7	85%	0.846	71%	0.706	S	S	*	*			trans	-60.4	128.7	175.9	51.7	0	0	0	0	114.3
915	T	27.9	Very low	28.7	Very low	132 Å²	132	116 Å²	116	81%	0.81	69%	0.685	S	S	*	*			trans	-118.5	134.5	147.6	-56.9	0	0	0	0	107.2	C917	T915-C917 PolarHBondContact O-N 2.85Å
916	S	24.1	Very low	29	Very low	108 Å²	108	116.7 Å²	116.7	76%	0.755	68%	0.676	S	S	*	*			trans	-63.2	114.9	-165.5	52.5	0	0	0	0	114.2	S918	S916-S918 PolarHBondContact O-N 2.9Å; S916-S918 VanDerWaalsContact O-N 3.17Å
917	C	24.3	Very low	29.7	Very low	127 Å²	127	119 Å²	119	86%	0.858	67%	0.673	S	S	*	*			trans	-64	108.6	148.7	-72.9	0	0	0	0	108	T915 R919	T915-C917 PolarHBondContact O-N 2.85Å; C917-R919 PolarHBondContact O-N 3Å
918	S	27.7	Very low	30.4	Very low	94 Å²	94	114.9 Å²	114.9	66%	0.657	65%	0.648	S	S	*	*			trans	-68.2	123.7	170.3	50.7	0	0	0	0	109.4	S916 T920	S916-S918 PolarHBondContact O-N 2.9Å; S916-S918 VanDerWaalsContact O-N 3.17Å; S918-T920 PolarHBondContact O-N 2.9Å
919	R	27.9	Very low	31.3	Very low	238 Å²	238	108.2 Å²	108.2	90%	0.898	62%	0.624	S	S	*	*			trans	-54.9	105.4	179.2	-72.4	159.3	56.9	-179.4	-0.6	112	C917 D921	C917-R919 PolarHBondContact O-N 3Å; R919-D921 WeakPolarHBondContact CA-OD2 3.46Å
920	T	34.3	Very low	32.1	Very low	62 Å²	62	109.2 Å²	109.2	38%	0.38	63%	0.625	S	S	.	*			trans	-114.7	4.7	160.3	71.4	0	0	0	0	112	S918 S922 T923 D924	S918-T920 PolarHBondContact O-N 2.9Å; T920-S922 PolarHBondContact O-N 2.87Å; T920-T923 PolarHBondContact O-N 2.79Å; T920-T923 PolarHBondContact O-OG1 3.3Å; T920-D924 VanDerWaalsContact CB-OD2 3.25Å; T920-D924 WeakPolarHBondContact CB-OD2 3.38Å; T920-D924 PolarHBondContact OG1-OD2 3.34Å
921	D	32.7	Very low	33.8	Very low	116 Å²	116	104 Å²	104	62%	0.62	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	25.9	-167.2	-44.2	-88.9	0	0	0	116	R919	R919-D921 WeakPolarHBondContact CA-OD2 3.46Å
922	S	33.2	Very low	35.6	Very low	89 Å²	89	103.2 Å²	103.2	62%	0.622	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-151.1	-36.3	166.7	65.7	0	0	0	0	112.8	T920 D924 M925	T920-S922 PolarHBondContact O-N 2.87Å; S922-D924 VanDerWaalsContact C-N 3.26Å; S922-D924 PolarHBondContact O-N 3.32Å; S922-M925 PolarHBondContact O-N 3.01Å
923	T	34.2	Very low	37.5	Very low	66 Å²	66	97.1 Å²	97.1	41%	0.405	56%	0.559	S	S	.	*	H	α-helix	trans	-63.4	-31.9	-178.4	47	0	0	0	0	113.1	T920 E926 Q927	T920-T923 PolarHBondContact O-N 2.79Å; T920-T923 PolarHBondContact O-OG1 3.3Å; T923-E926 PolarHBondContact O-N 2.83Å; T923-Q927 WeakPolarHBondContact O-CG 3.48Å; T923-Q927 PolarHBondContact O-N 2.79Å
924	D	37.3	Very low	39.2	Very low	64 Å²	64	92.3 Å²	92.3	34%	0.342	53%	0.525	S	S	.	.	H	α-helix	trans	-73.3	-34.5	-172	-59.4	-11.1	0	0	0	110.7	T920 S922 Q927 F928	T920-D924 VanDerWaalsContact CB-OD2 3.25Å; T920-D924 WeakPolarHBondContact CB-OD2 3.38Å; T920-D924 PolarHBondContact OG1-OD2 3.34Å; S922-D924 VanDerWaalsContact C-N 3.26Å; S922-D924 PolarHBondContact O-N 3.32Å; D924-Q927 PolarHBondContact O-N 3.23Å; D924-F928 WeakPolarHBondContact O-CD2 3.4Å; D924-F928 PolarHBondContact O-N 3.34Å
925	M	34.6	Very low	41.2	Very low	80 Å²	80	88.8 Å²	88.8	39%	0.394	50%	0.499	S	S	.	.	H	α-helix	trans	-66.8	-42.3	172.2	-82.7	-68.3	176.7	0	0	112.6	L883 A887 S922 Q927 F928 S929	L883-M925 HydrophobicContact CB-CE 4.03Å; L883-M925 HydrophobicContact CD2-CE 4.2Å; L883-M925 HydrophobicContact CD2-SD 4.49Å; L883-M925 HydrophobicContact CG-CE 3.92Å; L883-M925 WeakPolarHBondContact O-CE 3.34Å; A887-M925 HydrophobicContact CB-CE 4.25Å; S922-M925 PolarHBondContact O-N 3.01Å; M925-Q927 VanDerWaalsContact C-N 3.3Å; M925-Q927 PolarHBondContact O-N 3.29Å; M925-F928 PolarHBondContact O-N 3.33Å; M925-S929 PolarHBondContact O-N 3.43Å
926	E	32.6	Very low	42.8	Very low	133 Å²	133	82.6 Å²	82.6	62%	0.621	46%	0.461	S	S	*	.	H	α-helix	trans	-67.3	-30	173.4	-71.6	-163.1	141.2	0	0	112.6	T923 S929 N930	T923-E926 PolarHBondContact O-N 2.83Å; E926-S929 WeakPolarHBondContact CA-OG 3.48Å; E926-S929 PolarHBondContact O-OG 3.24Å; E926-S929 VanDerWaalsContact O-OG 3.05Å; E926-N930 VanDerWaalsContact O-CB 3.32Å; E926-N930 WeakPolarHBondContact O-CB 3.44Å; E926-N930 PolarHBondContact O-N 3.12Å; E926-N930 PolarHBondContact O-ND2 3.43Å
927	Q	39.6	Very low	44.5	Very low	127 Å²	127	81.1 Å²	81.1	59%	0.593	45%	0.448	S	S	*	.	H	α-helix	trans	-68.6	-37.6	170.1	-75.6	-175.1	54.2	0	0	111.7	T923 D924 M925 S931	T923-Q927 WeakPolarHBondContact O-CG 3.48Å; T923-Q927 PolarHBondContact O-N 2.79Å; D924-Q927 PolarHBondContact O-N 3.23Å; M925-Q927 VanDerWaalsContact C-N 3.3Å; M925-Q927 PolarHBondContact O-N 3.29Å; Q927-S931 WeakPolarHBondContact O-CA 3.5Å; Q927-S931 WeakPolarHBondContact O-CB 3.17Å; Q927-S931 PolarHBondContact O-N 2.84Å
928	F	42.7	Very low	46.3	Very low	80 Å²	80	75.8 Å²	75.8	35%	0.351	41%	0.413	S	S	.	.	H	α-helix	trans	-70.2	-32.8	175.5	-78.3	-62.6	0	0	0	113.6	K814 L883 D924 M925	K814-F928 WeakPolarHBondContact CE-O 3.26Å; K814-F928 PolarHBondContact NZ-O 3.04Å; L883-F928 HydrophobicContact CD2-CD2 4Å; L883-F928 HydrophobicContact CD2-CE2 4.35Å; L883-F928 HydrophobicContact CD2-CG 4.24Å; D924-F928 WeakPolarHBondContact O-CD2 3.4Å; D924-F928 PolarHBondContact O-N 3.34Å; M925-F928 PolarHBondContact O-N 3.33Å
929	S	47	Very low	47.6	Very low	45 Å²	45	73.1 Å²	73.1	32%	0.315	40%	0.397	S	S	.	.	H	α-helix	trans	-72.3	-42.5	173	63.4	0	0	0	0	112.4	K814 E854 M925 E926	K814-S929 PolarHBondContact NZ-O 3.29Å; E854-S929 WeakPolarHBondContact O-CA 3.44Å; M925-S929 PolarHBondContact O-N 3.43Å; E926-S929 WeakPolarHBondContact CA-OG 3.48Å; E926-S929 PolarHBondContact O-OG 3.24Å; E926-S929 VanDerWaalsContact O-OG 3.05Å
930	N	47.7	Very low	49.3	Very low	115 Å²	115	62.8 Å²	62.8	62%	0.615	36%	0.358	S	S	*	.	H	α-helix	trans	-86.4	-21.3	-176.8	-67.6	-64.6	0	0	0	115	E926	E926-N930 VanDerWaalsContact O-CB 3.32Å; E926-N930 WeakPolarHBondContact O-CB 3.44Å; E926-N930 PolarHBondContact O-N 3.12Å; E926-N930 PolarHBondContact O-ND2 3.43Å
931	S	57.9	Low	50.8	Low	28 Å²	28	63.1 Å²	63.1	20%	0.196	36%	0.357	C	S	.	.	S	Bend	trans	-66.1	137.6	177.4	172	0	0	0	0	111.5	K814 Q927 A933	K814-S931 WeakPolarHBondContact CD-O 3.48Å; K814-S931 WeakPolarHBondContact CE-O 3.39Å; K814-S931 PolarHBondContact NZ-O 3.48Å; Q927-S931 WeakPolarHBondContact O-CA 3.5Å; Q927-S931 WeakPolarHBondContact O-CB 3.17Å; Q927-S931 PolarHBondContact O-N 2.84Å; S931-A933 WeakPolarHBondContact CB-O 3.3Å; S931-A933 PolarHBondContact O-N 2.9Å; S931-A933 PolarHBondContact OG-N 2.96Å; S931-A933 VanDerWaalsContact OG-N 3.13Å; S931-A933 PolarHBondContact OG-O 3.37Å
932	P	64.3	Low	52.9	Low	95 Å²	95	57.6 Å²	57.6	62%	0.617	33%	0.328	S	S	*	.	S	Bend	trans	-71.9	-3.9	173.4	31.2	-36.3	0	0	0	113.6	S813 K814	S813-P932 WeakPolarHBondContact CA-O 3.49Å; K814-P932 PolarHBondContact N-O 3.25Å
933	A	64.3	Low	55.2	Low	12 Å²	12	53.4 Å²	53.4	10%	0.099	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	146.7	-180	0	0	0	0	0	112.7	R811 I812 S931	R811-A933 HydrophobicContact CG-CB 3.99Å; I812-A933 CarbonylContact O-C 3.53Å; I812-A933 VanDerWaalsContact O-CA 3.26Å; I812-A933 WeakPolarHBondContact O-CA 3.39Å; I812-A933 WeakPolarHBondContact O-CB 3.4Å; S931-A933 WeakPolarHBondContact CB-O 3.3Å; S931-A933 PolarHBondContact O-N 2.9Å; S931-A933 PolarHBondContact OG-N 2.96Å; S931-A933 VanDerWaalsContact OG-N 3.13Å; S931-A933 PolarHBondContact OG-O 3.37Å
934	I	64.4	Low	57.6	Low	6 Å²	6	50.2 Å²	50.2	3%	0.031	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	142.6	169.8	-37.5	173.7	0	0	0	108	R811 I812 K814 I817 L856 V876 L880 V936	R811-I934 CarbonylContact C-O 3.56Å; R811-I934 WeakPolarHBondContact CA-O 3.25Å; I812-I934 PolarHBondContact N-O 3.45Å; I812-I934 PolarHBondContact O-N 2.82Å; K814-I934 HydrophobicContact CG-CG1 4.42Å; I817-I934 HydrophobicContact CD1-CD1 3.33Å; I817-I934 HydrophobicContact CD1-CG1 4.04Å; L856-I934 HydrophobicContact CD1-CD1 3.41Å; L856-I934 VanDerWaalsContact CD1-CD1 3.41Å; L856-I934 HydrophobicContact CD1-CG1 3.79Å; V876-I934 HydrophobicContact CG1-CD1 4.1Å; L880-I934 HydrophobicContact CD1-CD1 4.39Å; L880-I934 HydrophobicContact CD2-CD1 4.34Å; I934-V936 HydrophobicContact CB-CG2 4.39Å; I934-V936 HydrophobicContact CG2-CG2 4.1Å
935	T	66.6	Low	59.6	Low	47 Å²	47	47.2 Å²	47.2	29%	0.288	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	127.5	162.7	-56.5	0	0	0	0	108.2	E809	E809-T935 HydrophobicContact CB-CG2 3.69Å; E809-T935 HydrophobicContact CG-CG2 4.33Å; E809-T935 WeakPolarHBondContact OE2-CG2 3.35Å
936	V	61.5	Low	61.9	Low	3 Å²	3	43.4 Å²	43.4	2%	0.018	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	126.2	-175.4	177.4	0	0	0	0	108.6	E809 I810 I812 Q875 V876 I934 S938	E809-V936 CarbonylContact C-O 3.53Å; E809-V936 WeakPolarHBondContact CA-O 3.12Å; I810-V936 PolarHBondContact N-O 2.84Å; I810-V936 PolarHBondContact O-N 3.36Å; I812-V936 HydrophobicContact CD1-CG2 4.31Å; Q875-V936 HydrophobicContact CB-CG1 4.37Å; V876-V936 HydrophobicContact CG2-CG2 3.97Å; I934-V936 HydrophobicContact CB-CG2 4.39Å; I934-V936 HydrophobicContact CG2-CG2 4.1Å; V936-S938 PolarHBondContact O-N 3.03Å
937	P	60.2	Low	64.2	Low	76 Å²	76	37.2 Å²	37.2	49%	0.494	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	125	174.7	27.1	-33.5	0	0	0	109
938	S	61.3	Low	66.2	Low	16 Å²	16	31.2 Å²	31.2	11%	0.112	19%	0.187	C	C	.	.			trans	-76	142.7	-178.7	-166.9	0	0	0	0	110.1	L770 P808 V936 Q940	L770-S938 VanDerWaalsContact CD1-OG 3.3Å; L770-S938 WeakPolarHBondContact CD1-OG 3.27Å; P808-S938 WeakPolarHBondContact O-CB 3.33Å; P808-S938 PolarHBondContact O-N 3.3Å; V936-S938 PolarHBondContact O-N 3.03Å; S938-Q940 PolarHBondContact O-N 2.8Å; S938-Q940 WeakPolarHBondContact OG-CB 3.24Å; S938-Q940 WeakPolarHBondContact OG-CG 3.44Å; S938-Q940 PolarHBondContact OG-N 3.17Å
939	A	55.9	Low	67.9	Low	38 Å²	38	28.8 Å²	28.8	31%	0.314	18%	0.177	S	C	.	.	S	Bend	trans	-72.7	-2.9	166.1	0	0	0	0	0	112.8	T591	T591-A939 CarbonylContact C-O 3.58Å; T591-A939 WeakPolarHBondContact CB-O 3.31Å; T591-A939 PolarHBondContact OG1-O 3.1Å
940	Q	62.4	Low	69.2	Low	21 Å²	21	29.5 Å²	29.5	10%	0.098	17%	0.174	C	C	.	.			trans	-78.1	147	173.4	-50.2	-166.2	-18.7	0	0	112.3	Y588 G590 T591 L770 W772 P808 S938	Y588-Q940 PolarHBondContact O-NE2 2.81Å; G590-Q940 WeakPolarHBondContact O-CA 3.44Å; G590-Q940 WeakPolarHBondContact O-CB 3.49Å; G590-Q940 VanDerWaalsContact O-CG 3.25Å; G590-Q940 WeakPolarHBondContact O-CG 3.5Å; T591-Q940 WeakPolarHBondContact OG1-CA 3.38Å; L770-Q940 HydrophobicContact CD1-CB 4.29Å; L770-Q940 HydrophobicContact CD1-CG 4.2Å; W772-Q940 HydrophobicContact CZ2-CB 3.82Å; P808-Q940 WeakPolarHBondContact CD-O 3.35Å; P808-Q940 HydrophobicContact CG-CB 4.25Å; P808-Q940 WeakPolarHBondContact CG-O 3.4Å; S938-Q940 PolarHBondContact O-N 2.8Å; S938-Q940 WeakPolarHBondContact OG-CB 3.24Å; S938-Q940 WeakPolarHBondContact OG-CG 3.44Å; S938-Q940 PolarHBondContact OG-N 3.17Å
941	L	66.9	Low	70.5	Confident	68 Å²	68	27.9 Å²	27.9	36%	0.356	17%	0.172	S	C	.	.			trans	-141.5	138.3	179	-69.1	174	0	0	0	109.9	T591 P688	T591-L941 HydrophobicContact CG2-CB 4.15Å; T591-L941 PolarHBondContact OG1-N 3.03Å; P688-L941 HydrophobicContact CB-CB 4.42Å; P688-L941 HydrophobicContact CB-CD1 4.44Å
942	P	77.6	Confident	71.5	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.006	18%	0.177	C	C	.	.			trans	-57	158	164.3	-21.8	34.2	0	0	0	111.5	G689 A738 W772 Q803 K806	G689-P942 PolarHBondContact N-O 3.44Å; A738-P942 VanDerWaalsContact O-CA 3.27Å; A738-P942 WeakPolarHBondContact O-CA 3.27Å; A738-P942 WeakPolarHBondContact O-CB 3.4Å; W772-P942 HydrophobicContact CH2-CB 4.49Å; W772-P942 HydrophobicContact CH2-CG 3.96Å; W772-P942 HydrophobicContact CZ3-CB 4.05Å; W772-P942 HydrophobicContact CZ3-CG 3.88Å; Q803-P942 WeakPolarHBondContact O-CB 3.25Å; Q803-P942 VanDerWaalsContact O-CG 3.31Å; Q803-P942 WeakPolarHBondContact O-CG 3.35Å; K806-P942 HydrophobicContact CB-CG 4.24Å; K806-P942 VanDerWaalsContact O-CD 3.25Å; K806-P942 WeakPolarHBondContact O-CD 3.4Å
943	G	81.2	Confident	71.9	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.5	177.9	-177.4	0	0	0	0	0	114	F687 A738 L804	F687-G943 CarbonylContact O-C 2.96Å; F687-G943 WeakPolarHBondContact O-CA 3.16Å; A738-G943 PolarHBondContact N-O 3.06Å; A738-G943 PolarHBondContact O-N 3.34Å; L804-G943 VanDerWaalsContact CD2-CA 3.43Å
944	I	83.8	Confident	72.5	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	117.5	177.5	-53.8	175.1	0	0	0	108.9	F687 W693 L721 W724 F725 P735 L804	F687-I944 PolarHBondContact N-O 2.77Å; F687-I944 PolarHBondContact O-N 3.26Å; W693-I944 HydrophobicContact CB-CD1 4.15Å; W693-I944 HydrophobicContact CG-CD1 4.18Å; L721-I944 HydrophobicContact CD1-CD1 4.06Å; W724-I944 HydrophobicContact CH2-CD1 4.38Å; W724-I944 HydrophobicContact CH2-CG2 3.86Å; W724-I944 HydrophobicContact CZ3-CD1 3.98Å; W724-I944 HydrophobicContact CZ3-CG2 3.97Å; F725-I944 HydrophobicContact CE1-CD1 3.92Å; F725-I944 HydrophobicContact CE1-CG2 4.49Å; F725-I944 HydrophobicContact CZ-CD1 3.95Å; P735-I944 HydrophobicContact CB-CG2 3.96Å; L804-I944 HydrophobicContact CD1-CD1 4.09Å; L804-I944 HydrophobicContact CD1-CG1 4.2Å; L804-I944 HydrophobicContact CD2-CG1 4.13Å
945	S	79.5	Confident	73.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	132.4	161.1	-58.2	0	0	0	0	108.8	Y582 C685 F686 P735 V736	Y582-S945 WeakPolarHBondContact OH-CB 3.49Å; Y582-S945 PolarHBondContact OH-OG 3.09Å; C685-S945 CarbonylContact O-C 3.55Å; C685-S945 WeakPolarHBondContact O-CA 3.25Å; F686-S945 WeakPolarHBondContact CD2-OG 3.37Å; P735-S945 CarbonylContact C-O 3.56Å; P735-S945 WeakPolarHBondContact CA-O 3.2Å; V736-S945 PolarHBondContact N-O 3.4Å; V736-S945 PolarHBondContact O-N 2.86Å
946	L	81.7	Confident	73.4	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.4	176.5	-178.4	63.1	0	0	0	109.2	G684 C685 F687 W724 W728 A733 P735 L959	G684-L946 CarbonylContact C-O 3.5Å; G684-L946 WeakPolarHBondContact CA-O 3.39Å; C685-L946 PolarHBondContact N-O 3.42Å; C685-L946 PolarHBondContact O-N 3.12Å; F687-L946 HydrophobicContact CD2-CB 4.4Å; F687-L946 HydrophobicContact CE2-CB 3.93Å; F687-L946 HydrophobicContact CE2-CD2 4.13Å; W724-L946 HydrophobicContact CH2-CD1 4.41Å; W724-L946 HydrophobicContact CH2-CD2 4.22Å; W724-L946 HydrophobicContact CZ2-CD2 4.16Å; W728-L946 HydrophobicContact CB-CD1 4.17Å; W728-L946 HydrophobicContact CD2-CD1 4.22Å; W728-L946 HydrophobicContact CD2-CD2 3.51Å; W728-L946 HydrophobicContact CD2-CG 4.45Å; W728-L946 HydrophobicContact CE3-CD1 4.44Å; W728-L946 HydrophobicContact CE3-CD2 3.84Å; W728-L946 HydrophobicContact CG-CD1 4.13Å; W728-L946 HydrophobicContact CG-CD2 4.02Å; W728-L946 HydrophobicContact CH2-CD2 3.92Å; W728-L946 HydrophobicContact CZ2-CD2 3.62Å; W728-L946 HydrophobicContact CZ3-CD2 4.02Å; A733-L946 HydrophobicContact CB-CD1 3.9Å; P735-L946 HydrophobicContact CG-CD1 4.41Å; L946-L959 HydrophobicContact CB-CD1 4.44Å; L946-L959 HydrophobicContact CD2-CD1 3.59Å; L946-L959 HydrophobicContact CG-CD1 4.11Å
947	F	81.4	Confident	73.8	Confident	4 Å²	4	37 Å²	37	2%	0.018	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	142.4	-174.6	-68.3	-80.9	0	0	0	112	I476 L579 Y582 L583 L682 A733 I734 V736	I476-F947 HydrophobicContact CD1-CD2 4.15Å; I476-F947 HydrophobicContact CD1-CE2 3.76Å; I476-F947 HydrophobicContact CD1-CZ 4.09Å; I476-F947 HydrophobicContact CG2-CG 4.46Å; L579-F947 HydrophobicContact CD1-CD1 4.24Å; L579-F947 HydrophobicContact CD1-CE1 3.76Å; L579-F947 HydrophobicContact CG-CE1 4.42Å; Y582-F947 HydrophobicContact CD1-CE1 4.21Å; Y582-F947 AromaticContact CD1-CZ 3.95Å; Y582-F947 HydrophobicContact CD1-CZ 3.95Å; Y582-F947 AromaticContact CE1-CE1 3.88Å; Y582-F947 HydrophobicContact CE1-CE1 3.88Å; Y582-F947 HydrophobicContact CE1-CE2 4.35Å; Y582-F947 AromaticContact CE1-CZ 3.41Å; Y582-F947 HydrophobicContact CE1-CZ 3.41Å; Y582-F947 VanDerWaalsContact CE1-CZ 3.41Å; L583-F947 HydrophobicContact CD2-CZ 4.07Å; L682-F947 HydrophobicContact CD2-CB 3.91Å; L682-F947 HydrophobicContact CD2-CD1 3.79Å; L682-F947 HydrophobicContact CD2-CG 4.19Å; A733-F947 WeakPolarHBondContact CA-O 3.45Å; I734-F947 HydrophobicContact CB-CB 4.36Å; I734-F947 PolarHBondContact N-O 2.78Å; I734-F947 PolarHBondContact O-N 3Å; V736-F947 HydrophobicContact CB-CE2 4.2Å; V736-F947 HydrophobicContact CG2-CD2 3.89Å; V736-F947 HydrophobicContact CG2-CE2 3.82Å
948	V	81.2	Confident	74.4	Confident	1 Å²	1	33.7 Å²	33.7	1%	0.006	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	149	177	-74.7	0	0	0	0	111.4	T683 A733 L955 V956 L959	T683-V948 PolarHBondContact N-O 2.98Å; T683-V948 PolarHBondContact O-N 3.47Å; A733-V948 HydrophobicContact CB-CG1 3.47Å; A733-V948 VanDerWaalsContact CB-CG1 3.47Å; V948-L955 HydrophobicContact CG1-CB 4.02Å; V948-L955 HydrophobicContact CG1-CD1 3.97Å; V948-V956 HydrophobicContact CG2-CG2 3.81Å; V948-L959 HydrophobicContact CG2-CD2 4.28Å
949	E	80.3	Confident	74.8	Confident	29 Å²	29	33.2 Å²	33.2	14%	0.136	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	133.7	170.6	-170.1	-174.7	147.7	0	0	110.4	L482 R485 L681 S951 N952	L482-E949 HydrophobicContact CD1-CG 4.32Å; L482-E949 HydrophobicContact CD2-CG 4.03Å; R485-E949 IonicContact CZ-OE1 2.7Å; R485-E949 VanDerWaalsContact CZ-OE1 3.25Å; R485-E949 IonicContact CZ-OE2 3.06Å; R485-E949 IonicContact NH1-OE1 3.27Å; R485-E949 PolarHBondContact NH1-OE1 2.91Å; R485-E949 IonicContact NH1-OE2 3.01Å; R485-E949 VanDerWaalsContact NH2-CD 3.33Å; R485-E949 IonicContact NH2-OE1 3.98Å; R485-E949 PolarHBondContact NH2-OE1 3.05Å; R485-E949 IonicContact NH2-OE2 2.7Å; R485-E949 PolarHBondContact NH2-OE2 3.39Å; L681-E949 WeakPolarHBondContact O-CA 3.31Å; E949-S951 WeakPolarHBondContact CG-OG 3.23Å; E949-S951 PolarHBondContact O-N 3.39Å; E949-S951 WeakPolarHBondContact OE1-CB 3.45Å; E949-S951 PolarHBondContact OE1-OG 3.08Å; E949-N952 PolarHBondContact O-N 3.22Å
950	K	72.9	Confident	75.2	Confident	60 Å²	60	34.1 Å²	34.1	26%	0.261	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-20	-179.2	-91.6	173.7	166.6	171	0	115.3	L664 D679 K680 L681 L682 T683 N952	L664-K950 PolarHBondContact O-NZ 3.25Å; D679-K950 PolarHBondContact O-NZ 3.16Å; K680-K950 VanDerWaalsContact O-CD 3.27Å; K680-K950 WeakPolarHBondContact O-CD 3.36Å; L681-K950 PolarHBondContact O-N 2.94Å; L682-K950 WeakPolarHBondContact O-CD 3.37Å; L682-K950 WeakPolarHBondContact O-CE 3.49Å; L682-K950 PolarHBondContact O-NZ 2.94Å; T683-K950 VanDerWaalsContact OG1-CE 3.23Å; T683-K950 WeakPolarHBondContact OG1-CE 3.11Å; T683-K950 WeakPolarHBondContact OG1-CG 3.35Å; K950-N952 VanDerWaalsContact C-N 3.29Å
951	S	75.5	Confident	75	Confident	81 Å²	81	37.5 Å²	37.5	57%	0.566	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70	-26.9	173	64.4	0	0	0	0	112.5	E949 W953	E949-S951 WeakPolarHBondContact CG-OG 3.23Å; E949-S951 PolarHBondContact O-N 3.39Å; E949-S951 WeakPolarHBondContact OE1-CB 3.45Å; E949-S951 PolarHBondContact OE1-OG 3.08Å; S951-W953 PolarHBondContact O-N 3.33Å
952	N	79	Confident	74.3	Confident	57 Å²	57	35.6 Å²	35.6	31%	0.305	17%	0.174	S	C	.	.			trans	-82.4	72.1	176.2	-166.7	-26.7	0	0	0	110.2	E949 K950 E954 L955 V956	E949-N952 PolarHBondContact O-N 3.22Å; K950-N952 VanDerWaalsContact C-N 3.29Å; N952-E954 PolarHBondContact O-N 2.93Å; N952-L955 VanDerWaalsContact ND2-CD1 3.33Å; N952-L955 WeakPolarHBondContact ND2-CD1 3.4Å; N952-L955 PolarHBondContact O-N 2.9Å; N952-L955 WeakPolarHBondContact OD1-CG 3.32Å; N952-L955 PolarHBondContact OD1-N 2.81Å; N952-V956 WeakPolarHBondContact O-CG2 3.36Å; N952-V956 PolarHBondContact O-N 3.12Å
953	W	73.1	Confident	72.6	Confident	168 Å²	168	39 Å²	39	64%	0.636	19%	0.189	S	C	*	.	H	α-helix	trans	-59.5	-29.1	-175.5	76.1	-88.9	0	0	0	113	S951 V956 H957	S951-W953 PolarHBondContact O-N 3.33Å; W953-V956 PolarHBondContact O-N 3.33Å; W953-H957 HydrophobicContact CE3-CB 4.43Å; W953-H957 WeakPolarHBondContact O-CB 3.2Å; W953-H957 PolarHBondContact O-N 3.17Å
954	E	77.1	Confident	70.1	Confident	45 Å²	45	43.9 Å²	43.9	21%	0.21	22%	0.222	C	C	.	.	H	α-helix	trans	-66	-46.1	178.7	-63.7	-172.8	163.8	0	0	111.2	I700 N952 T958	I700-E954 WeakPolarHBondContact CG2-OE2 3.38Å; N952-E954 PolarHBondContact O-N 2.93Å; E954-T958 WeakPolarHBondContact O-CB 3.45Å; E954-T958 PolarHBondContact O-N 3.19Å; E954-T958 PolarHBondContact O-OG1 2.94Å
955	L	78.3	Confident	67.5	Low	1 Å²	1	50.7 Å²	50.7	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-69.7	-39.2	174.6	-66	-175.5	0	0	0	112.3	P698 I700 W728 C731 V948 N952 T958 L959	P698-L955 HydrophobicContact CB-CD2 3.86Å; I700-L955 HydrophobicContact CD1-CD2 4.08Å; I700-L955 HydrophobicContact CG1-CD2 4.16Å; W728-L955 HydrophobicContact CE3-CD2 4.5Å; W728-L955 HydrophobicContact CZ3-CD2 3.97Å; C731-L955 HydrophobicContact CB-CD1 3.81Å; C731-L955 HydrophobicContact CB-CD2 3.91Å; C731-L955 HydrophobicContact CB-CG 4.45Å; C731-L955 WeakPolarHBondContact O-CD1 3.46Å; V948-L955 HydrophobicContact CG1-CB 4.02Å; V948-L955 HydrophobicContact CG1-CD1 3.97Å; N952-L955 VanDerWaalsContact ND2-CD1 3.33Å; N952-L955 WeakPolarHBondContact ND2-CD1 3.4Å; N952-L955 PolarHBondContact O-N 2.9Å; N952-L955 WeakPolarHBondContact OD1-CG 3.32Å; N952-L955 PolarHBondContact OD1-N 2.81Å; L955-T958 WeakPolarHBondContact O-CB 3.49Å; L955-T958 PolarHBondContact O-N 3.28Å; L955-L959 WeakPolarHBondContact O-CB 3.5Å; L955-L959 PolarHBondContact O-N 2.93Å
956	V	70.8	Confident	65	Low	22 Å²	22	56.8 Å²	56.8	13%	0.133	29%	0.285	C	S	.	.	H	α-helix	trans	-60.7	-46.5	175.1	171.4	0	0	0	0	110.8	T683 V948 N952 W953 T958 L959 L960	T683-V956 HydrophobicContact CG2-CG1 4.34Å; V948-V956 HydrophobicContact CG2-CG2 3.81Å; N952-V956 WeakPolarHBondContact O-CG2 3.36Å; N952-V956 PolarHBondContact O-N 3.12Å; W953-V956 PolarHBondContact O-N 3.33Å; V956-T958 VanDerWaalsContact C-N 3.32Å; V956-T958 PolarHBondContact O-N 3.29Å; V956-L959 PolarHBondContact O-N 3.23Å; V956-L960 HydrophobicContact CG1-CD1 3.95Å; V956-L960 VanDerWaalsContact O-CG 3.25Å; V956-L960 WeakPolarHBondContact O-CG 3.14Å; V956-L960 PolarHBondContact O-N 3.11Å; V956-L960 VanDerWaalsContact O-N 3.11Å
957	H	70.9	Confident	64.2	Low	90 Å²	90	59.6 Å²	59.6	42%	0.417	30%	0.3	S	S	.	.	H	α-helix	trans	-62.5	-40.4	176.5	-174.2	-98	0	0	0	111.4	W953 L960 Q961	W953-H957 HydrophobicContact CE3-CB 4.43Å; W953-H957 WeakPolarHBondContact O-CB 3.2Å; W953-H957 PolarHBondContact O-N 3.17Å; H957-L960 PolarHBondContact O-N 3.09Å; H957-Q961 PolarHBondContact CE1-OE1 3.37Å; H957-Q961 PolarHBondContact ND1-OE1 3.41Å; H957-Q961 WeakPolarHBondContact O-CB 3.26Å; H957-Q961 WeakPolarHBondContact O-CG 3.28Å; H957-Q961 PolarHBondContact O-N 2.8Å
958	T	71.5	Confident	63.3	Low	6 Å²	6	62.5 Å²	62.5	4%	0.037	31%	0.314	C	S	.	.	H	α-helix	trans	-61.4	-48.2	175.5	-58.8	0	0	0	0	112	W697 F699 W728 E954 L955 V956 L960 Q961 T962	W697-T958 WeakPolarHBondContact O-CG2 3.12Å; F699-T958 HydrophobicContact CB-CG2 4.21Å; F699-T958 HydrophobicContact CD2-CG2 4.23Å; W728-T958 HydrophobicContact CH2-CG2 4.31Å; E954-T958 WeakPolarHBondContact O-CB 3.45Å; E954-T958 PolarHBondContact O-N 3.19Å; E954-T958 PolarHBondContact O-OG1 2.94Å; L955-T958 WeakPolarHBondContact O-CB 3.49Å; L955-T958 PolarHBondContact O-N 3.28Å; V956-T958 VanDerWaalsContact C-N 3.32Å; V956-T958 PolarHBondContact O-N 3.29Å; T958-L960 PolarHBondContact O-N 2.85Å; T958-Q961 PolarHBondContact O-N 3.44Å; T958-T962 WeakPolarHBondContact O-CG2 3.26Å; T958-T962 PolarHBondContact O-N 2.98Å; T958-T962 PolarHBondContact O-OG1 2.85Å
959	L	69.7	Low	62.3	Low	5 Å²	5	65.9 Å²	65.9	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-60	-27.7	177.5	-162	82.6	0	0	0	112.7	T683 C685 F687 W728 L946 V948 L955 V956 T962	T683-L959 HydrophobicContact CG2-CD2 4.03Å; C685-L959 HydrophobicContact CB-CD1 4.05Å; C685-L959 HydrophobicContact CB-CD2 3.81Å; C685-L959 HydrophobicContact CB-CG 3.84Å; F687-L959 HydrophobicContact CZ-CD1 4.45Å; W728-L959 HydrophobicContact CH2-CD1 4.15Å; L946-L959 HydrophobicContact CB-CD1 4.44Å; L946-L959 HydrophobicContact CD2-CD1 3.59Å; L946-L959 HydrophobicContact CG-CD1 4.11Å; V948-L959 HydrophobicContact CG2-CD2 4.28Å; L955-L959 WeakPolarHBondContact O-CB 3.5Å; L955-L959 PolarHBondContact O-N 2.93Å; V956-L959 PolarHBondContact O-N 3.23Å; L959-T962 PolarHBondContact O-OG1 3.11Å; L959-T962 VanDerWaalsContact O-OG1 3.08Å
960	L	64.2	Low	61.2	Low	57 Å²	57	68.1 Å²	68.1	30%	0.298	34%	0.343	S	S	.	.	H	α-helix	trans	-87.3	-41.8	177.4	-68	169.7	0	0	0	112.5	V661 V956 H957 T958 T962 K963	V661-L960 HydrophobicContact CG1-CD2 3.66Å; V661-L960 HydrophobicContact CG2-CD2 4.38Å; V956-L960 HydrophobicContact CG1-CD1 3.95Å; V956-L960 VanDerWaalsContact O-CG 3.25Å; V956-L960 WeakPolarHBondContact O-CG 3.14Å; V956-L960 PolarHBondContact O-N 3.11Å; V956-L960 VanDerWaalsContact O-N 3.11Å; H957-L960 PolarHBondContact O-N 3.09Å; T958-L960 PolarHBondContact O-N 2.85Å; L960-T962 PolarHBondContact O-N 3.03Å; L960-K963 WeakPolarHBondContact O-CB 3.32Å; L960-K963 PolarHBondContact O-N 2.94Å
961	Q	58.2	Low	60.5	Low	93 Å²	93	68.6 Å²	68.6	44%	0.435	35%	0.348	S	S	.	.	H	α-helix	trans	-60.7	-30.3	178.6	-79.2	-164.3	-66.6	0	0	112.7	H957 T958 K963 C964	H957-Q961 PolarHBondContact CE1-OE1 3.37Å; H957-Q961 PolarHBondContact ND1-OE1 3.41Å; H957-Q961 WeakPolarHBondContact O-CB 3.26Å; H957-Q961 WeakPolarHBondContact O-CG 3.28Å; H957-Q961 PolarHBondContact O-N 2.8Å; T958-Q961 PolarHBondContact O-N 3.44Å; Q961-K963 PolarHBondContact O-N 2.94Å; Q961-K963 VanDerWaalsContact O-N 3.15Å; Q961-C964 PolarHBondContact O-N 3.12Å
962	T	51.9	Low	59.5	Low	27 Å²	27	67.8 Å²	67.8	17%	0.166	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-5	177	52.8	0	0	0	0	113.5	S695 A696 T958 L959 L960	S695-T962 WeakPolarHBondContact O-CG2 3.18Å; A696-T962 HydrophobicContact CB-CG2 3.95Å; T958-T962 WeakPolarHBondContact O-CG2 3.26Å; T958-T962 PolarHBondContact O-N 2.98Å; T958-T962 PolarHBondContact O-OG1 2.85Å; L959-T962 PolarHBondContact O-OG1 3.11Å; L959-T962 VanDerWaalsContact O-OG1 3.08Å; L960-T962 PolarHBondContact O-N 3.03Å
963	K	42.5	Very low	58.1	Low	74 Å²	74	68.6 Å²	68.6	32%	0.322	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-1.3	166	-76	-163.1	168.5	-162.5	0	114.5	A657 D658 L960 Q961	A657-K963 PolarHBondContact O-NZ 3.37Å; D658-K963 IonicContact OD1-NZ 2.71Å; D658-K963 PolarHBondContact OD1-NZ 3.41Å; L960-K963 WeakPolarHBondContact O-CB 3.32Å; L960-K963 PolarHBondContact O-N 2.94Å; Q961-K963 PolarHBondContact O-N 2.94Å; Q961-K963 VanDerWaalsContact O-N 3.15Å
964	C	29	Very low	56.9	Low	102 Å²	102	60.9 Å²	60.9	69%	0.689	31%	0.313	S	S	*	.	S	Bend	trans	-119.4	16.3	-170.7	-60.3	0	0	0	0	114.4	Q961	Q961-C964 PolarHBondContact O-N 3.12Å
965	I	29.2	Very low	55.2	Low	142 Å²	142	62.3 Å²	62.3	73%	0.728	32%	0.321	S	S	*	.			trans	-126.9	-0.8	-174	-59.1	177.9	0	0	0	112
966	E	26.7	Very low	53.1	Low	128 Å²	128	67.8 Å²	67.8	60%	0.598	35%	0.35	S	S	*	.			trans	-105.8	0	160.5	-69.8	-168	-166.5	0	0	110.2	T615	T615-E966 PolarHBondContact OG1-OE2 2.59Å

Retrieved 966 of 966 residues in 560.2 ms (Link to these results)

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