A0A3Q0KTF7_SCHMA Loading...

Zinc-finger domain containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KTF7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 885 aa.

						>A0A3Q0KTF7_SCHMA|A0A3Q0KTF7
MNSNHLMAYNSMTTWPELAHQFDIKTMKQYHNYNTNTNNTTTNNNNSSNTSDPYSLYPSNSFRTSKNSYQSNNVVNYQYDNNNNNKLEQYTKFDTIISDKLLKSNSYRKNNFKNLPMNQSVSNLTPSKFINYDQMMNDKQIDGERKLSSHSNDINSPKDLRLRKQSRLNSNPIRYNKHKLKQSCLKKENNKNTIEFSTIHNNLYSNINSSVSNCKIPSDIHLRNHFDYKSLSLSNSSSPSNNNDNSGNHVFNSTYNSLLSNPYMKQQPYPIFPLNNNTTEMISDHLINSANSQNNHFNQILSQTQLSSQFHQYWLQMINTPILSSGATTSTTTTTSTTPSFTMTTQDITPLQMTQSLTPSKMLPLNFISNELQTLSSLFYQTIKQLQMNHNLPVNISLLNHIYTTIYNENITSLHNQNHTTTTTNTTSSSSTTTTNTIVSSDNTYQMNRNHEHNGSDQQIGINQLKLKNKSIKLNKLSPSMKNNVNLHVTEHHNDPNNNKRRKYSNKEEDNPNDGKIMNGNNQLKVDVTNCYDNDDGDDVDDDDEDDDNNDDDDDVIVDDEEIILDPKQNPENIPMNIFKCNLCNKYFVTAHGLEVHVRRAHNNGKRPFECQLCQKTFGHATSLYQHESVHCQDRQFQCSQCGKTFKRSSTLSTHLLIHSDTRPYPCQYCGKRFHQKSDMKKHTYTHTGEKPYICLQCGKAFSQSSNLITHSRKHTGFKPFSCFHCLRAFQRKVDLRRHIETQHGTIDLYKKNYTLDNADNRKQSSLLHYDNKITLNSSSSSSLSPLPNILSSPKSIQLHNYSNSSDLMDSFHHFNGLDLSTTTNTTNNTTTNNNGTDNDNNNDYHDCDTINPKNYTLSSPNNIHGNNDEKLLPYSVENLLSSLT
					

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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	29.1	Very low	30.4	Very low	226 Å²	226	149.7 Å²	149.7	100%	1.113	80%	0.798	S	S	*	*				0	106.8	0	-64.7	176.7	178	0	0	105.4
2	N	32	Very low	30.2	Very low	148 Å²	148	151.9 Å²	151.9	79%	0.791	80%	0.804	S	S	*	*				67.5	131.1	60.3	-57.6	37.5	0	0	0	110.9
3	S	32.3	Very low	30.1	Very low	93 Å²	93	149.3 Å²	149.3	65%	0.65	80%	0.798	S	S	*	*			cis	-165.2	156.3	-13	-87.6	0	0	0	0	107.8
4	N	34.5	Very low	30.2	Very low	164 Å²	164	146.4 Å²	146.4	88%	0.877	79%	0.788	S	S	*	*				-178.2	134.7	117.2	-89.5	-14.6	0	0	0	112.8
5	H	31.3	Very low	30.3	Very low	154 Å²	154	150.8 Å²	150.8	71%	0.713	79%	0.789	S	S	*	*			trans	-73.4	139.9	167.6	-107.6	-126.5	0	0	0	110.1
6	L	31.6	Very low	30.6	Very low	167 Å²	167	147.8 Å²	147.8	87%	0.874	78%	0.782	S	S	*	*				-156.9	144.1	94.6	-151.3	65.5	0	0	0	110.1
7	M	31.9	Very low	30.4	Very low	145 Å²	145	148.5 Å²	148.5	71%	0.714	78%	0.78	S	S	*	*			trans	-102.5	151.2	-174.7	-67.1	-177.8	175.3	0	0	112.2
8	A	29.3	Very low	30.4	Very low	77 Å²	77	150.2 Å²	150.2	64%	0.636	79%	0.788	S	S	*	*				30.4	146.7	129.3	0	0	0	0	0	120
9	Y	31.1	Very low	30.4	Very low	206 Å²	206	147.5 Å²	147.5	81%	0.808	79%	0.79	S	S	*	*			cis	-145.7	140.1	38.3	-92	-97.4	0	0	0	114.7
10	N	24.5	Very low	30.3	Very low	160 Å²	160	149.1 Å²	149.1	86%	0.856	79%	0.792	S	S	*	*			trans	-166.8	136.4	134.4	-106.4	-29.2	0	0	0	111.1
11	S	26.3	Very low	30.1	Very low	107 Å²	107	149.9 Å²	149.9	75%	0.748	79%	0.791	S	S	*	*			trans	85.1	136.9	-167.9	77.9	0	0	0	0	114.6
12	M	29.1	Very low	30.1	Very low	176 Å²	176	149.4 Å²	149.4	87%	0.867	78%	0.783	S	S	*	*			cis	-143.6	160.2	49.6	-74.2	168.4	61.9	0	0	115.5
13	T	28.9	Very low	30	Very low	118 Å²	118	149.1 Å²	149.1	72%	0.724	78%	0.782	S	S	*	*			trans	-66.2	166.9	165.9	46.6	0	0	0	0	112.1
14	T	31.4	Very low	29.8	Very low	108 Å²	108	152.5 Å²	152.5	66%	0.663	79%	0.791	S	S	*	*				-166.5	138.6	56	47	0	0	0	0	116.7
15	W	30.7	Very low	29.4	Very low	213 Å²	213	153.5 Å²	153.5	81%	0.807	79%	0.788	S	S	*	*			trans	73.5	158.4	132.6	-75.4	48.3	0	0	0	121.3
16	P	36.1	Very low	29.3	Very low	103 Å²	103	152.7 Å²	152.7	67%	0.669	79%	0.794	S	S	*	*			cis	-134.2	176.5	-14.3	30	-7.7	0	0	0	117.7
17	E	26.2	Very low	29.1	Very low	160 Å²	160	154.1 Å²	154.1	75%	0.748	80%	0.798	S	S	*	*			trans	-15.8	139.2	162.6	-59.8	164.3	100.8	0	0	121.5
18	L	31.4	Very low	28.8	Very low	178 Å²	178	156 Å²	156	93%	0.932	80%	0.802	S	S	*	*				-169.8	175.2	118.4	-106.5	170.9	0	0	0	112.2
19	A	30.1	Very low	28.7	Very low	99 Å²	99	161.1 Å²	161.1	82%	0.818	81%	0.813	S	S	*	*			trans	70.4	83.8	173.3	0	0	0	0	0	117.9
20	H	27.3	Very low	28.6	Very low	180 Å²	180	163 Å²	163	83%	0.833	82%	0.82	S	S	*	*			trans	-83.6	168.9	161.8	-164.1	-115	0	0	0	110.9
21	Q	26.2	Very low	28.8	Very low	166 Å²	166	163.3 Å²	163.3	78%	0.776	82%	0.816	S	S	*	*			trans	65.1	117.5	175.8	-59.3	-177.3	-27.9	0	0	118.5
22	F	29	Very low	28.8	Very low	216 Å²	216	164 Å²	164	95%	0.947	81%	0.812	S	S	*	*				-142.3	126	125.8	-115	-76.8	0	0	0	109.7
23	D	29.8	Very low	28.8	Very low	141 Å²	141	167.2 Å²	167.2	75%	0.754	82%	0.816	S	S	*	*			trans	-96.7	146	-174.4	-167.3	7.9	0	0	0	111.4	K25	D23-K25 PolarHBondContact O-N 2.68Å
24	I	28.4	Very low	28.7	Very low	165 Å²	165	167.9 Å²	167.9	85%	0.846	82%	0.815	S	S	*	*	S	Bend	trans	-85.6	84.2	-170.4	-56.5	179.8	0	0	0	109.8
25	K	26.4	Very low	28.7	Very low	185 Å²	185	168.1 Å²	168.1	80%	0.804	82%	0.817	S	S	*	*			trans	-141.9	18.1	-179.8	-139.3	176.1	-178	174	0	119.1	D23	D23-K25 PolarHBondContact O-N 2.68Å
26	T	29.8	Very low	28.6	Very low	137 Å²	137	164.6 Å²	164.6	84%	0.84	81%	0.813	S	S	*	*			trans	-146.8	106.9	169.8	-0.1	0	0	0	0	113.4
27	M	26.2	Very low	28.4	Very low	196 Å²	196	165 Å²	165	97%	0.966	82%	0.815	S	S	*	*			trans	-137.2	50.9	161.5	-159.8	-178.5	-176.7	0	0	111.1
28	K	27	Very low	28.7	Very low	185 Å²	185	163.8 Å²	163.8	80%	0.804	81%	0.813	S	S	*	*	S	Bend	trans	-142.2	154.8	163.8	-71.7	-169.7	176.9	-179.5	0	107.8
29	Q	27.4	Very low	28.6	Very low	185 Å²	185	162 Å²	162	86%	0.864	81%	0.805	S	S	*	*			trans	67.6	85.2	-177	-59.7	177.8	-31.1	0	0	115.3
30	Y	27.3	Very low	28.5	Very low	245 Å²	245	163.5 Å²	163.5	96%	0.961	80%	0.804	S	S	*	*			trans	-126.9	97.1	134.2	-107.4	-85	0	0	0	108
31	H	29.6	Very low	28.8	Very low	167 Å²	167	161.2 Å²	161.2	77%	0.773	80%	0.802	S	S	*	*			trans	-153.9	122.2	169.8	-141.3	-43.4	0	0	0	107.6
32	N	27.3	Very low	29	Very low	122 Å²	122	158.5 Å²	158.5	65%	0.652	80%	0.797	S	S	*	*			trans	49.3	103.3	170.3	-58.7	9.8	0	0	0	117.6
33	Y	28.7	Very low	29.1	Very low	242 Å²	242	154.8 Å²	154.8	95%	0.949	79%	0.787	S	S	*	*				-115.7	155.5	119.4	-101.8	-90.8	0	0	0	108.9
34	N	26.5	Very low	29.1	Very low	132 Å²	132	154 Å²	154	71%	0.706	78%	0.783	S	S	*	*			trans	-146.8	174.2	-160	-169.6	12.9	0	0	0	110.1
35	T	30.6	Very low	29.1	Very low	114 Å²	114	152 Å²	152	70%	0.699	77%	0.774	S	S	*	*			trans	70.9	144.5	-178.6	76.6	0	0	0	0	113.7
36	N	30.2	Very low	29.3	Very low	138 Å²	138	149.9 Å²	149.9	74%	0.738	77%	0.771	S	S	*	*			cis	-156.1	161.9	-6.9	-113.5	3.3	0	0	0	107.3
37	T	31.3	Very low	29.4	Very low	113 Å²	113	148 Å²	148	69%	0.693	76%	0.764	S	S	*	*			cis	-146.1	-162.3	9.9	-10.7	0	0	0	0	107.1
38	N	31.3	Very low	29.6	Very low	133 Å²	133	142.9 Å²	142.9	71%	0.711	75%	0.748	S	S	*	*			cis	-157.1	-177	14.5	-149.3	-3.1	0	0	0	112.6
39	N	30.3	Very low	29.7	Very low	142 Å²	142	141 Å²	141	76%	0.759	75%	0.746	S	S	*	*			trans	89.5	132.5	160.2	-69.2	-2	0	0	0	118.3
40	T	27.7	Very low	29.9	Very low	130 Å²	130	138.3 Å²	138.3	80%	0.798	74%	0.743	S	S	*	*			trans	-135.9	132.9	-169.3	51.5	0	0	0	0	110.8
41	T	32.7	Very low	30.1	Very low	132 Å²	132	132 Å²	132	81%	0.81	73%	0.734	S	S	*	*			trans	-162.3	105.6	148.4	12.3	0	0	0	0	113
42	T	32.1	Very low	29.9	Very low	109 Å²	109	131.3 Å²	131.3	67%	0.669	74%	0.737	S	S	*	*				42.2	137.6	129.6	60.2	0	0	0	0	123.1
43	N	29.6	Very low	30.4	Very low	138 Å²	138	129.6 Å²	129.6	74%	0.738	73%	0.732	S	S	*	*			trans	76.8	151.5	143.3	-66.2	-7.8	0	0	0	119.6
44	N	29.7	Very low	30.5	Very low	123 Å²	123	128.8 Å²	128.8	66%	0.658	73%	0.729	S	S	*	*			cis	-167.7	154.9	-37.8	-124.8	-2.8	0	0	0	110.6
45	N	29.8	Very low	30.5	Very low	123 Å²	123	127.2 Å²	127.2	66%	0.658	73%	0.728	S	S	*	*			trans	63.2	132	147.2	-64.4	-9.5	0	0	0	123.2
46	N	30.4	Very low	30.4	Very low	141 Å²	141	129.5 Å²	129.5	75%	0.754	74%	0.735	S	S	*	*			trans	97.4	113.1	149.4	-60.3	-11.1	0	0	0	117.2
47	S	30.8	Very low	30.2	Very low	99 Å²	99	133.5 Å²	133.5	69%	0.692	74%	0.741	S	S	*	*			cis	85.7	146.2	49	86.7	0	0	0	0	112.8
48	S	31.2	Very low	30.4	Very low	88 Å²	88	133.4 Å²	133.4	62%	0.615	74%	0.743	S	S	*	*			cis	-152.6	177.6	16	-48	0	0	0	0	112.7
49	N	29.5	Very low	30.2	Very low	145 Å²	145	131.9 Å²	131.9	78%	0.775	74%	0.743	S	S	*	*			trans	80.2	136.4	155.3	-55.9	-17.5	0	0	0	117.1
50	T	32.1	Very low	30	Very low	128 Å²	128	132.2 Å²	132.2	79%	0.785	74%	0.744	S	S	*	*			cis	-162.4	163.4	-3.5	10.3	0	0	0	0	107.9
51	S	31.2	Very low	30	Very low	113 Å²	113	130.5 Å²	130.5	79%	0.79	74%	0.738	S	S	*	*			cis	-157.3	166.5	2.4	42.9	0	0	0	0	110.9
52	D	24.4	Very low	29.8	Very low	153 Å²	153	133.2 Å²	133.2	82%	0.818	74%	0.739	S	S	*	*			trans	-140.4	-171.4	173.3	-144.8	9.3	0	0	0	106
53	P	38.9	Very low	29.7	Very low	85 Å²	85	138.2 Å²	138.2	55%	0.552	75%	0.745	S	S	*	*			cis	-136	-176.5	-14.8	42.6	-25.3	0	0	0	114.6
54	Y	30	Very low	29.6	Very low	225 Å²	225	138.1 Å²	138.1	88%	0.882	75%	0.75	S	S	*	*			trans	167.8	93.4	137.2	-90.5	-62.5	0	0	0	107.8
55	S	27	Very low	29.5	Very low	99 Å²	99	137.8 Å²	137.8	69%	0.692	76%	0.757	S	S	*	*				93.5	141.9	59.6	-169	0	0	0	0	114.5
56	L	29.1	Very low	29.4	Very low	162 Å²	162	140.9 Å²	140.9	85%	0.848	77%	0.765	S	S	*	*			trans	91.6	102.8	171.1	-52.6	-177.2	0	0	0	120.8
57	Y	25.1	Very low	29.2	Very low	222 Å²	222	140.6 Å²	140.6	87%	0.871	76%	0.763	S	S	*	*			trans	-90.3	173.8	140.3	-90.7	-88.1	0	0	0	108.5
58	P	35.2	Very low	28.7	Very low	112 Å²	112	140.7 Å²	140.7	73%	0.727	76%	0.764	S	S	*	*			cis	-147.5	167.3	26.2	43.1	-22.4	0	0	0	120.5
59	S	27.3	Very low	28.5	Very low	101 Å²	101	146.1 Å²	146.1	71%	0.706	77%	0.772	S	S	*	*			trans	66.2	125.8	142.3	-64.6	0	0	0	0	125.3
60	N	26.4	Very low	28.4	Very low	148 Å²	148	147 Å²	147	79%	0.791	77%	0.772	S	S	*	*			trans	83.8	92.8	138.8	-71.7	-10.6	0	0	0	124
61	S	27.9	Very low	27.9	Very low	94 Å²	94	145.3 Å²	145.3	66%	0.657	77%	0.765	S	S	*	*				102.1	150.3	109.2	79.2	0	0	0	0	121.8
62	F	29.3	Very low	27.4	Very low	190 Å²	190	147 Å²	147	83%	0.833	77%	0.765	S	S	*	*			trans	69.9	138.7	179.1	-61.1	-72	0	0	0	116.7
63	R	28.2	Very low	27.4	Very low	213 Å²	213	147.7 Å²	147.7	80%	0.804	77%	0.769	S	S	*	*			cis	-149.3	139.3	9.5	-131.9	-179.5	-159.3	-167.9	5.2	112.3
64	T	28.4	Very low	26.6	Very low	137 Å²	137	149.5 Å²	149.5	84%	0.84	78%	0.778	S	S	*	*			trans	59.8	143.1	158.5	46.8	0	0	0	0	119.5
65	S	27.2	Very low	26.4	Very low	115 Å²	115	144.6 Å²	144.6	80%	0.804	77%	0.771	S	S	*	*			cis	-129.3	134.1	13.1	55.4	0	0	0	0	115.2
66	K	28	Very low	26.1	Very low	188 Å²	188	144.8 Å²	144.8	82%	0.817	76%	0.764	S	S	*	*			trans	-45.4	159.3	159.2	-79	178.7	178.1	-174.2	0	113.6
67	N	25.5	Very low	25.8	Very low	136 Å²	136	146.3 Å²	146.3	73%	0.727	76%	0.761	S	S	*	*			cis	-146.7	157.9	17.9	-109.3	-17.1	0	0	0	112.2
68	S	21.7	Very low	25.8	Very low	100 Å²	100	144.6 Å²	144.6	70%	0.699	76%	0.76	S	S	*	*			trans	-122.8	129	164.1	56.3	0	0	0	0	110.4
69	Y	27	Very low	25.2	Very low	202 Å²	202	148.5 Å²	148.5	79%	0.792	76%	0.762	S	S	*	*			trans	-160.1	112.4	153.4	-82.2	-68.3	0	0	0	106.4
70	Q	25.4	Very low	25.2	Very low	164 Å²	164	151.5 Å²	151.5	77%	0.766	77%	0.77	S	S	*	*				74.2	110.5	82.8	-99.5	-177.7	-24.1	0	0	115.4
71	S	21.9	Very low	25.1	Very low	92 Å²	92	150.4 Å²	150.4	64%	0.643	76%	0.764	S	S	*	*			trans	49.3	127.4	139.7	59.9	0	0	0	0	121.3
72	N	22	Very low	24.9	Very low	149 Å²	149	152.9 Å²	152.9	80%	0.797	77%	0.77	S	S	*	*			trans	63.6	113.7	149.8	-54.1	-8.3	0	0	0	117.4
73	N	24.5	Very low	24.8	Very low	167 Å²	167	151.5 Å²	151.5	89%	0.893	77%	0.771	S	S	*	*				-156.2	161.5	109.6	-112.8	-24.4	0	0	0	114
74	V	22	Very low	24.6	Very low	124 Å²	124	148 Å²	148	75%	0.752	77%	0.768	S	S	*	*			trans	-112.9	140	178.6	165.1	0	0	0	0	108.3
75	V	24.9	Very low	24.5	Very low	121 Å²	121	149.1 Å²	149.1	73%	0.733	77%	0.77	S	S	*	*			trans	78.2	138.4	158.8	157.6	0	0	0	0	120.5
76	N	21.7	Very low	24.5	Very low	103 Å²	103	153.8 Å²	153.8	55%	0.551	78%	0.775	S	S	*	*			trans	102.7	136.9	149.7	-90.1	-7.2	0	0	0	123.3
77	Y	22	Very low	24.3	Very low	195 Å²	195	152.4 Å²	152.4	77%	0.765	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-50	153.7	-178.8	-54.3	-92.9	0	0	0	116.4
78	Q	24.4	Very low	24.2	Very low	185 Å²	185	154 Å²	154	86%	0.864	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-104	128.2	136.5	-72	-177.6	-104	0	0	109.1
79	Y	23.8	Very low	24.3	Very low	195 Å²	195	156.9 Å²	156.9	77%	0.765	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-77.9	127.9	156.5	-102.2	-103.1	0	0	0	107.5	N81	Y79-N81 HydrophobicContact CD1-CB 4.37Å
80	D	26.2	Very low	24.3	Very low	164 Å²	164	157 Å²	157	88%	0.877	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-93.2	124.2	150.2	-86.2	-42.6	0	0	0	107.5
81	N	24.1	Very low	24.2	Very low	124 Å²	124	156.3 Å²	156.3	66%	0.663	79%	0.789	S	S	*	*			trans	-143.2	102.1	-178	-167.1	9.4	0	0	0	110.3	Y79	Y79-N81 HydrophobicContact CD1-CB 4.37Å
82	N	25.5	Very low	24.4	Very low	146 Å²	146	160.2 Å²	160.2	78%	0.781	79%	0.794	S	S	*	*			trans	-158.5	94	165	-134.1	-14.3	0	0	0	112.7
83	N	26.5	Very low	24.6	Very low	162 Å²	162	161.6 Å²	161.6	87%	0.866	79%	0.794	S	S	*	*			trans	-162.9	78.3	145.3	-109.3	-21.8	0	0	0	110.3	N85	N83-N85 PolarHBondContact O-N 3.04Å
84	N	24.1	Very low	24.6	Very low	138 Å²	138	161.5 Å²	161.5	74%	0.738	79%	0.793	S	S	*	*			trans	-75.3	106.6	169.6	-77.1	-25.5	0	0	0	109.9
85	N	26.1	Very low	24.7	Very low	162 Å²	162	161.8 Å²	161.8	87%	0.866	80%	0.796	S	S	*	*			trans	-172.8	69.9	145.9	-100.3	-24.7	0	0	0	113.9	N83	N83-N85 PolarHBondContact O-N 3.04Å
86	K	27.9	Very low	24.8	Very low	212 Å²	212	163.1 Å²	163.1	92%	0.922	80%	0.797	S	S	*	*				-163.5	115.1	129.7	-115.4	177.7	179.7	-176.9	0	111.3
87	L	22.8	Very low	25	Very low	160 Å²	160	166.2 Å²	166.2	84%	0.838	81%	0.812	S	S	*	*			trans	-89.5	169.3	165.2	-167.8	62.6	0	0	0	108.9
88	E	23	Very low	25.2	Very low	168 Å²	168	162.7 Å²	162.7	79%	0.785	82%	0.816	S	S	*	*			trans	79.1	150.1	170.6	-50.8	-169.2	157.2	0	0	117.9
89	Q	24	Very low	25.2	Very low	161 Å²	161	160.2 Å²	160.2	75%	0.752	81%	0.809	S	S	*	*			trans	67.5	87	179	-51.2	-173.4	27.8	0	0	116.4
90	Y	27.4	Very low	25.4	Very low	204 Å²	204	161.1 Å²	161.1	80%	0.8	82%	0.816	S	S	*	*				-173.7	58.6	112	-99.3	-63.3	0	0	0	114	K92	Y90-K92 VanDerWaalsContact C-N 3.32Å; Y90-K92 PolarHBondContact O-N 3.28Å; Y90-K92 VanDerWaalsContact O-N 3.13Å
91	T	23	Very low	25.3	Very low	150 Å²	150	160.8 Å²	160.8	92%	0.92	81%	0.814	S	S	*	*			trans	-84.3	63	170.4	39.2	0	0	0	0	112
92	K	25.9	Very low	25.4	Very low	174 Å²	174	163.1 Å²	163.1	76%	0.757	83%	0.825	S	S	*	*			trans	-157.9	62.8	-178.6	-149.8	171.1	-170.8	174.3	0	117.3	Y90	Y90-K92 VanDerWaalsContact C-N 3.32Å; Y90-K92 PolarHBondContact O-N 3.28Å; Y90-K92 VanDerWaalsContact O-N 3.13Å
93	F	26.6	Very low	25.6	Very low	178 Å²	178	164.8 Å²	164.8	78%	0.781	83%	0.825	S	S	*	*			trans	-138.4	8.5	164.3	-101	-67.1	0	0	0	117.5	T95	F93-T95 VanDerWaalsContact C-N 3.32Å; F93-T95 PolarHBondContact O-N 3.4Å
94	D	23.7	Very low	25.7	Very low	166 Å²	166	162 Å²	162	89%	0.888	82%	0.819	S	S	*	*	S	Bend	trans	-88.5	58.4	171.3	-72.4	-63.7	0	0	0	112.9
95	T	24.7	Very low	25.6	Very low	130 Å²	130	164.3 Å²	164.3	80%	0.798	83%	0.831	S	S	*	*			trans	-168.4	76.2	166	2.2	0	0	0	0	111.9	F93	F93-T95 VanDerWaalsContact C-N 3.32Å; F93-T95 PolarHBondContact O-N 3.4Å
96	I	26.5	Very low	25.6	Very low	149 Å²	149	160.7 Å²	160.7	76%	0.764	82%	0.819	S	S	*	*	S	Bend	trans	-158.4	11.3	163.7	-111.2	150.1	0	0	0	115.7
97	I	27	Very low	25.5	Very low	167 Å²	167	162 Å²	162	86%	0.856	82%	0.819	S	S	*	*	S	Bend	trans	-119	43.4	175.3	-39.3	-176.4	0	0	0	112.2
98	S	25.1	Very low	25.6	Very low	121 Å²	121	165.4 Å²	165.4	85%	0.846	82%	0.821	S	S	*	*	S	Bend	trans	-148.8	41.9	174.1	-66.2	0	0	0	0	113.9
99	D	25.3	Very low	25.9	Very low	134 Å²	134	165.8 Å²	165.8	72%	0.717	82%	0.82	S	S	*	*	S	Bend	trans	-156	31.4	177.1	-141.2	-7.3	0	0	0	116.3
100	K	28.3	Very low	26	Very low	213 Å²	213	164.6 Å²	164.6	93%	0.926	82%	0.819	S	S	*	*	S	Bend	trans	-133.8	17.6	176.2	-76.4	-167.1	177.8	177.5	0	115.8
101	L	24.9	Very low	26	Very low	158 Å²	158	162.5 Å²	162.5	83%	0.827	82%	0.822	S	S	*	*	S	Bend	trans	-121.1	144.3	163.8	-67.5	172.8	0	0	0	108.3
102	L	25.1	Very low	26	Very low	172 Å²	172	165.4 Å²	165.4	90%	0.901	82%	0.822	S	S	*	*			trans	62	79.5	-170.1	-62.2	111.3	0	0	0	116.4
103	K	29.8	Very low	26.2	Very low	181 Å²	181	166.4 Å²	166.4	79%	0.787	83%	0.827	S	S	*	*			trans	-142.5	131.8	141.6	-111.5	154.6	-167.7	157.1	0	111.9
104	S	28.3	Very low	26.3	Very low	105 Å²	105	165.3 Å²	165.3	73%	0.734	83%	0.829	S	S	*	*			trans	49.3	81.1	168.7	55.5	0	0	0	0	118.2	S106	S104-S106 PolarHBondContact O-N 2.75Å
105	N	22.6	Very low	26.3	Very low	185 Å²	185	164.5 Å²	164.5	99%	0.989	82%	0.823	S	S	*	*			trans	-69.7	70.4	145.2	-118.6	-21.6	0	0	0	109.5
106	S	25.9	Very low	26.5	Very low	87 Å²	87	164.5 Å²	164.5	61%	0.608	83%	0.826	S	S	*	*			trans	-166.2	113.1	168.2	-172.5	0	0	0	0	111.9	S104	S104-S106 PolarHBondContact O-N 2.75Å
107	Y	25.7	Very low	26.4	Very low	238 Å²	238	164.4 Å²	164.4	93%	0.933	82%	0.824	S	S	*	*			trans	-165.1	118.8	132.1	-109.4	-69.1	0	0	0	109.6
108	R	25.2	Very low	26.4	Very low	232 Å²	232	163.6 Å²	163.6	88%	0.875	82%	0.821	S	S	*	*			trans	-132.5	138	179.2	-166.4	-179.1	-174.3	-172.8	3.5	108.8
109	K	30	Very low	26.5	Very low	176 Å²	176	165.2 Å²	165.2	77%	0.765	82%	0.816	S	S	*	*			trans	85.3	116.6	-179.6	-56.8	179.6	177.1	178	0	116.8
110	N	25.1	Very low	26.4	Very low	137 Å²	137	164.1 Å²	164.1	73%	0.733	82%	0.818	S	S	*	*				54.9	124.6	127	-47.1	-3.3	0	0	0	118.6
111	N	28.1	Very low	26.4	Very low	160 Å²	160	159.9 Å²	159.9	86%	0.856	81%	0.81	S	S	*	*				-155	151.7	70.5	-90	-34.8	0	0	0	114.5
112	F	23.4	Very low	26.4	Very low	210 Å²	210	156.4 Å²	156.4	92%	0.921	80%	0.799	S	S	*	*			trans	-98.5	118.7	160.4	-99.7	-90.9	0	0	0	109
113	K	28.7	Very low	26.5	Very low	196 Å²	196	155.3 Å²	155.3	85%	0.852	79%	0.794	S	S	*	*			trans	-178.8	106.2	146.3	-106.8	172.8	-178.2	-175.2	0	110.3
114	N	29	Very low	26.4	Very low	154 Å²	154	154.8 Å²	154.8	82%	0.824	80%	0.799	S	S	*	*				176.7	123.9	120.2	-84.9	-10.2	0	0	0	109.1
115	L	24.1	Very low	26.1	Very low	149 Å²	149	155.9 Å²	155.9	78%	0.78	80%	0.801	S	S	*	*			trans	-82.4	168.8	154.3	-73.9	80.8	0	0	0	107.5	M117	L115-M117 HydrophobicContact CD2-CB 4.37Å
116	P	29.2	Very low	26.7	Very low	130 Å²	130	152.1 Å²	152.1	84%	0.844	79%	0.787	S	S	*	*				-125.2	161.6	98.7	36.3	-33.3	0	0	0	113.1
117	M	23.3	Very low	26.9	Very low	148 Å²	148	153.8 Å²	153.8	73%	0.729	80%	0.799	S	S	*	*			trans	-134.2	104.8	177.2	-145.4	-67.1	-178.3	0	0	108.2	L115	L115-M117 HydrophobicContact CD2-CB 4.37Å
118	N	27.1	Very low	27.1	Very low	149 Å²	149	150.6 Å²	150.6	80%	0.797	79%	0.79	S	S	*	*			trans	-135.1	113	166.7	-77.4	-26.9	0	0	0	104.4
119	Q	27.4	Very low	27.3	Very low	156 Å²	156	147.8 Å²	147.8	73%	0.729	78%	0.784	S	S	*	*				60.7	93.9	72.8	-65.2	-162.8	4.4	0	0	114.1
120	S	23.9	Very low	27.3	Very low	111 Å²	111	144.7 Å²	144.7	78%	0.776	78%	0.775	S	S	*	*			trans	62.6	159	157	62.9	0	0	0	0	117.5
121	V	27.6	Very low	27.4	Very low	123 Å²	123	145.1 Å²	145.1	75%	0.745	78%	0.777	S	S	*	*			cis	-142.3	152.1	12.8	-141.1	0	0	0	0	111.7
122	S	26.3	Very low	27.2	Very low	86 Å²	86	146.5 Å²	146.5	60%	0.601	77%	0.772	S	S	*	*			trans	25.2	136.1	145.6	64.5	0	0	0	0	123.6
123	N	25.6	Very low	27.3	Very low	148 Å²	148	143.4 Å²	143.4	79%	0.791	77%	0.765	S	S	*	*			trans	71.2	101.3	140.4	-56.6	-6.9	0	0	0	120.1
124	L	27.2	Very low	27.4	Very low	171 Å²	171	143.2 Å²	143.2	90%	0.895	77%	0.767	S	S	*	*				-179	140.1	96.9	-94.9	163.9	0	0	0	112.7
125	T	23.7	Very low	27.2	Very low	127 Å²	127	144.1 Å²	144.1	78%	0.779	77%	0.768	S	S	*	*			trans	-138.2	179.9	166.7	64.6	0	0	0	0	106.5
126	P	35.4	Very low	27.5	Very low	107 Å²	107	145.3 Å²	145.3	70%	0.695	77%	0.772	S	S	*	*			cis	-135.2	173	-0.2	41.7	-25.8	0	0	0	115.5
127	S	28.9	Very low	27.5	Very low	122 Å²	122	147.2 Å²	147.2	85%	0.853	78%	0.775	S	S	*	*			trans	-154.2	133.7	136.2	-89.2	0	0	0	0	114
128	K	30.5	Very low	27.6	Very low	171 Å²	171	147.8 Å²	147.8	74%	0.743	78%	0.781	S	S	*	*			trans	-37.1	156.5	171.7	-52.9	166.3	-173.3	176.5	0	113.9
129	F	28	Very low	27.9	Very low	173 Å²	173	149.4 Å²	149.4	76%	0.759	78%	0.781	S	S	*	*			cis	-148.9	134.1	45.8	-101.2	-94.1	0	0	0	116.2
130	I	30	Very low	28	Very low	111 Å²	111	150.4 Å²	150.4	57%	0.569	79%	0.785	S	S	*	*			trans	41.5	118.6	144.7	-58.8	-179.8	0	0	0	119.6	Y132	I130-Y132 HydrophobicContact CG2-CD2 3.48Å; I130-Y132 VanDerWaalsContact CG2-CD2 3.48Å; I130-Y132 HydrophobicContact CG2-CE2 3.7Å; I130-Y132 HydrophobicContact CG2-CG 4.15Å
131	N	27.1	Very low	28.3	Very low	146 Å²	146	153.2 Å²	153.2	78%	0.781	79%	0.79	S	S	*	*			trans	-99.9	140.1	147	-175.5	20.8	0	0	0	108.4
132	Y	25	Very low	28.3	Very low	189 Å²	189	154.4 Å²	154.4	74%	0.741	79%	0.792	S	S	*	*			trans	-104.3	99.9	179.3	-100.2	-77.4	0	0	0	110.2	I130	I130-Y132 HydrophobicContact CG2-CD2 3.48Å; I130-Y132 VanDerWaalsContact CG2-CD2 3.48Å; I130-Y132 HydrophobicContact CG2-CE2 3.7Å; I130-Y132 HydrophobicContact CG2-CG 4.15Å
133	D	26.2	Very low	28.5	Very low	144 Å²	144	153.5 Å²	153.5	77%	0.77	80%	0.796	S	S	*	*			trans	-155.4	50.9	173	-132.6	-13.1	0	0	0	112.3
134	Q	29.1	Very low	28.7	Very low	193 Å²	193	152.9 Å²	152.9	90%	0.902	79%	0.789	S	S	*	*			trans	-161.8	92.8	170.6	-115.2	162.6	20.3	0	0	112.4
135	M	26.3	Very low	28.9	Very low	172 Å²	172	154.3 Å²	154.3	85%	0.847	78%	0.782	S	S	*	*			trans	-138	83.6	163	-84.4	-169.5	63.8	0	0	110
136	M	30.1	Very low	29.3	Very low	174 Å²	174	156.7 Å²	156.7	86%	0.857	78%	0.782	S	S	*	*	S	Bend	trans	-174.2	91.2	151.4	-89.4	-41.6	168.2	0	0	108.6
137	N	28.6	Very low	29.1	Very low	171 Å²	171	158.8 Å²	158.8	91%	0.914	79%	0.786	S	S	*	*			trans	162.5	79.4	150.3	-86	-24.3	0	0	0	109.7
138	D	26.6	Very low	29.1	Very low	160 Å²	160	158.2 Å²	158.2	86%	0.856	78%	0.783	S	S	*	*			trans	-89.8	152.4	164.2	-103.2	-48.1	0	0	0	110.6
139	K	32.3	Very low	29.1	Very low	183 Å²	183	154.3 Å²	154.3	80%	0.796	78%	0.777	S	S	*	*			trans	78.7	137.8	176.4	-53.5	175	-175.9	177.8	0	117.2
140	Q	29.5	Very low	29.4	Very low	176 Å²	176	154.2 Å²	154.2	82%	0.822	78%	0.778	S	S	*	*			cis	-171.2	126.6	-28.8	-128.4	168.7	-13.6	0	0	110
141	I	30.2	Very low	29.4	Very low	170 Å²	170	153.3 Å²	153.3	87%	0.872	78%	0.782	S	S	*	*			trans	-157.9	130.2	167.4	-56.3	-177.9	0	0	0	105.8
142	D	27.8	Very low	29.6	Very low	149 Å²	149	153.6 Å²	153.6	80%	0.797	78%	0.783	S	S	*	*			cis	-147.4	-157.8	-23.1	-164.1	-93.1	0	0	0	106.3
143	G	30.1	Very low	29.8	Very low	66 Å²	66	151.4 Å²	151.4	68%	0.68	78%	0.784	S	S	*	*			trans	171.7	4.1	173	0	0	0	0	0	121.1
144	E	30.1	Very low	30	Very low	135 Å²	135	151.7 Å²	151.7	63%	0.631	78%	0.784	S	S	*	*			trans	58.7	157.1	170.4	-63.3	-165.2	147.5	0	0	122.4
145	R	30.6	Very low	30.2	Very low	201 Å²	201	150.1 Å²	150.1	76%	0.758	78%	0.782	S	S	*	*			trans	65.3	110.8	146.1	-89	-174.2	-94	-161.2	-3.5	118
146	K	32.7	Very low	30.2	Very low	177 Å²	177	147.4 Å²	147.4	77%	0.77	78%	0.78	S	S	*	*			cis	-166.6	142.3	47.3	-89.4	169.6	-177.5	174.3	0	115.6
147	L	30.4	Very low	30.5	Very low	151 Å²	151	143.6 Å²	143.6	79%	0.791	77%	0.768	S	S	*	*			trans	64.3	110.8	135.4	-60.9	170	0	0	0	123.8
148	S	29.4	Very low	30.6	Very low	111 Å²	111	144 Å²	144	78%	0.776	76%	0.762	S	S	*	*			trans	67.9	147.1	134.6	126.6	0	0	0	0	120.1
149	S	31.4	Very low	30.8	Very low	89 Å²	89	142.9 Å²	142.9	62%	0.622	76%	0.756	S	S	*	*			cis	-167	-175.3	-3.4	47.3	0	0	0	0	110.8
150	H	32.8	Very low	30.5	Very low	171 Å²	171	141.4 Å²	141.4	79%	0.792	76%	0.756	S	S	*	*			trans	87.3	75.8	171.6	-65.3	78.7	0	0	0	119.3
151	S	30.7	Very low	30.7	Very low	92 Å²	92	144.3 Å²	144.3	64%	0.643	76%	0.759	S	S	*	*			trans	-4.1	138.3	135.3	55.4	0	0	0	0	120.7
152	N	32.7	Very low	30.6	Very low	151 Å²	151	144 Å²	144	81%	0.807	76%	0.759	S	S	*	*				-167.6	155.9	100.4	-90.3	-8.9	0	0	0	112.3
153	D	27.8	Very low	30.6	Very low	143 Å²	143	149 Å²	149	77%	0.765	77%	0.767	S	S	*	*			trans	-79	161.8	-164.4	-48.9	-83.4	0	0	0	115.8
154	I	31.7	Very low	30.5	Very low	150 Å²	150	154.9 Å²	154.9	77%	0.769	77%	0.773	S	S	*	*				179.6	140.4	112.9	-90.9	157.7	0	0	0	111.6
155	N	32.8	Very low	30.4	Very low	161 Å²	161	157 Å²	157	86%	0.861	78%	0.783	S	S	*	*			trans	72.5	138.8	170.4	-67.2	-22.8	0	0	0	120.2
156	S	25.3	Very low	30.4	Very low	114 Å²	114	152.9 Å²	152.9	80%	0.797	79%	0.785	S	S	*	*			trans	-150.6	-160.1	-174.1	-148.4	0	0	0	0	105.7
157	P	36.7	Very low	30.1	Very low	95 Å²	95	155.7 Å²	155.7	62%	0.617	79%	0.791	S	S	*	*			cis	-138.7	-167.2	-11.3	26	0.8	0	0	0	114.4
158	K	31	Very low	29.9	Very low	178 Å²	178	156.3 Å²	156.3	77%	0.774	79%	0.794	S	S	*	*			trans	83	143.9	155	-51.9	-169	-176.4	174.9	0	118.4
159	D	30.9	Very low	29.7	Very low	137 Å²	137	158.8 Å²	158.8	73%	0.733	80%	0.798	S	S	*	*			cis	-158.3	154.6	-19.5	-111.5	-40.7	0	0	0	109.5
160	L	27.2	Very low	29.7	Very low	152 Å²	152	159.9 Å²	159.9	80%	0.796	81%	0.806	S	S	*	*			trans	-139.4	105.8	174.3	-154.8	171.2	0	0	0	110.6
161	R	32.2	Very low	29.4	Very low	238 Å²	238	159.8 Å²	159.8	90%	0.898	81%	0.811	S	S	*	*			trans	-146.3	137.9	173.2	-110.3	174.2	179.4	145.7	1.5	112.3
162	L	29.3	Very low	29.5	Very low	164 Å²	164	160.8 Å²	160.8	86%	0.859	82%	0.816	S	S	*	*			trans	-83	145.4	-173.4	-54.9	87.1	0	0	0	112.6
163	R	28	Very low	29.2	Very low	254 Å²	254	161.3 Å²	161.3	96%	0.958	82%	0.817	S	S	*	*			trans	-147.7	154.5	138	-150.6	161.4	-178.5	148.9	-0.5	111.5
164	K	28	Very low	29.3	Very low	188 Å²	188	164.8 Å²	164.8	82%	0.817	82%	0.819	S	S	*	*			trans	-92.6	155.4	-173.8	-56.1	171	-179.9	176.4	0	111.7
165	Q	27.3	Very low	29	Very low	181 Å²	181	168.1 Å²	168.1	85%	0.846	82%	0.824	S	S	*	*			trans	133	162.2	140.4	-71.7	-179.3	-3.2	0	0	115.3
166	S	29.9	Very low	28.7	Very low	113 Å²	113	166.7 Å²	166.7	79%	0.79	82%	0.816	S	S	*	*			trans	58.2	119.5	-164.5	27	0	0	0	0	114.2
167	R	26.4	Very low	28.8	Very low	236 Å²	236	170.8 Å²	170.8	89%	0.891	82%	0.82	S	S	*	*			cis	79.6	133.8	45	-71.1	-170.7	168.8	177.9	-2.8	113.9
168	L	26.5	Very low	28.5	Very low	165 Å²	165	174.6 Å²	174.6	86%	0.864	83%	0.829	S	S	*	*			trans	81.9	147.7	177.2	-52.9	177.6	0	0	0	116.6
169	N	25.6	Very low	28.5	Very low	162 Å²	162	175 Å²	175	87%	0.866	83%	0.831	S	S	*	*			trans	60.9	74.5	169	-62	-1.1	0	0	0	119.5
170	S	30.5	Very low	28.4	Very low	113 Å²	113	176.3 Å²	176.3	79%	0.79	84%	0.837	S	S	*	*				-157	125.6	125.6	46.2	0	0	0	0	111.3	P172	S170-P172 VanDerWaalsContact O-CD 3.32Å; S170-P172 WeakPolarHBondContact O-CD 3.29Å
171	N	27.2	Very low	28.6	Very low	168 Å²	168	177.4 Å²	177.4	90%	0.898	84%	0.835	S	S	*	*			trans	-95.2	105.2	166.5	-90.2	-24	0	0	0	108.2	I173	N171-I173 PolarHBondContact O-N 2.64Å
172	P	32.3	Very low	28.3	Very low	113 Å²	113	175.6 Å²	175.6	73%	0.734	84%	0.837	S	S	*	*			trans	-73.2	122.6	166.9	29.5	-31.2	0	0	0	108.7	S170 R174	S170-P172 VanDerWaalsContact O-CD 3.32Å; S170-P172 WeakPolarHBondContact O-CD 3.29Å; P172-R174 VanDerWaalsContact C-N 3.35Å; P172-R174 PolarHBondContact O-N 3.41Å
173	I	27.8	Very low	28.2	Very low	163 Å²	163	172.6 Å²	172.6	84%	0.836	83%	0.829	S	S	*	*			trans	-64.3	97.9	172.6	-64.3	176.1	0	0	0	107.8	N171 Y175	N171-I173 PolarHBondContact O-N 2.64Å; I173-Y175 PolarHBondContact O-N 2.71Å; I173-Y175 VanDerWaalsContact O-N 3.1Å
174	R	29.2	Very low	28	Very low	215 Å²	215	166.2 Å²	166.2	81%	0.811	82%	0.822	S	S	*	*			trans	-73.5	105.8	-176.3	-163.2	178.3	-159.2	164.2	5.6	108.6	P172 N176	P172-R174 VanDerWaalsContact C-N 3.35Å; P172-R174 PolarHBondContact O-N 3.41Å; R174-N176 VanDerWaalsContact C-N 3.28Å; R174-N176 PolarHBondContact O-N 3.02Å
175	Y	24.8	Very low	27.9	Very low	221 Å²	221	164.6 Å²	164.6	87%	0.867	82%	0.822	S	S	*	*			trans	-60.8	87.4	177.4	-128	-91.2	0	0	0	110.3	I173 K177	I173-Y175 PolarHBondContact O-N 2.71Å; I173-Y175 VanDerWaalsContact O-N 3.1Å; Y175-K177 VanDerWaalsContact C-N 3.34Å; Y175-K177 PolarHBondContact O-N 2.92Å
176	N	27.6	Very low	27.9	Very low	130 Å²	130	165.3 Å²	165.3	70%	0.695	82%	0.822	S	S	*	*			trans	-72.8	93.3	-179.8	-97	-14.7	0	0	0	108.7	R174 H178	R174-N176 VanDerWaalsContact C-N 3.28Å; R174-N176 PolarHBondContact O-N 3.02Å; N176-H178 PolarHBondContact O-N 3.49Å
177	K	26.8	Very low	27.7	Very low	200 Å²	200	169.2 Å²	169.2	87%	0.87	83%	0.825	S	S	*	*			trans	-57.8	79.3	175.7	-172.3	171.9	-173.5	167.2	0	110.4	Y175 K179	Y175-K177 VanDerWaalsContact C-N 3.34Å; Y175-K177 PolarHBondContact O-N 2.92Å; K177-K179 PolarHBondContact O-N 3.35Å
178	H	30.2	Very low	27.6	Very low	175 Å²	175	166.2 Å²	166.2	81%	0.81	82%	0.821	S	S	*	*			trans	-71.8	93	-172.1	-136.5	-88.6	0	0	0	110.1	N176 L180	N176-H178 PolarHBondContact O-N 3.49Å; H178-L180 VanDerWaalsContact C-N 3.29Å; H178-L180 PolarHBondContact O-N 3.05Å
179	K	30.1	Very low	27.7	Very low	188 Å²	188	165.1 Å²	165.1	82%	0.817	82%	0.816	S	S	*	*			trans	-67.6	84.1	-177.4	-172.9	177.8	-175.9	176.6	0	109.2	K177 K181	K177-K179 PolarHBondContact O-N 3.35Å; K179-K181 PolarHBondContact O-N 3.02Å
180	L	29.4	Very low	27.6	Very low	164 Å²	164	164.4 Å²	164.4	86%	0.859	81%	0.812	S	S	*	*			trans	-52.8	102.8	171.7	-97.3	165.8	0	0	0	108.7	H178 Q182	H178-L180 VanDerWaalsContact C-N 3.29Å; H178-L180 PolarHBondContact O-N 3.05Å; L180-Q182 PolarHBondContact O-N 3.45Å
181	K	30.9	Very low	27.6	Very low	174 Å²	174	167.6 Å²	167.6	76%	0.757	81%	0.812	S	S	*	*			trans	-67.4	120.1	176.7	-91.8	-176.5	172	179.9	0	108.2	K179 S183	K179-K181 PolarHBondContact O-N 3.02Å; K181-S183 PolarHBondContact O-N 3.29Å; K181-S183 VanDerWaalsContact O-N 3.11Å
182	Q	26.7	Very low	27.5	Very low	201 Å²	201	167.1 Å²	167.1	94%	0.939	81%	0.809	S	S	*	*			trans	-59.3	109.7	149.4	-67	170.5	-12.6	0	0	107.1	L180	L180-Q182 PolarHBondContact O-N 3.45Å
183	S	26.4	Very low	27.3	Very low	100 Å²	100	168.3 Å²	168.3	70%	0.699	82%	0.815	S	S	*	*			trans	-140.1	45.2	177	63.3	0	0	0	0	112.2	K181	K181-S183 PolarHBondContact O-N 3.29Å; K181-S183 VanDerWaalsContact O-N 3.11Å
184	C	24.5	Very low	27.3	Very low	120 Å²	120	167.5 Å²	167.5	81%	0.811	81%	0.81	S	S	*	*			trans	-119	145.6	157.9	-63.1	0	0	0	0	108.5
185	L	25.9	Very low	27.1	Very low	155 Å²	155	164.9 Å²	164.9	81%	0.812	81%	0.807	S	S	*	*	S	Bend	trans	75.1	106.3	-179.8	-51.4	176.2	0	0	0	117.3
186	K	26.7	Very low	27.2	Very low	195 Å²	195	162.9 Å²	162.9	85%	0.848	80%	0.804	S	S	*	*			trans	71.8	122.8	158.5	-51.7	164.1	-174.5	169.3	0	114.6
187	K	26.1	Very low	27.2	Very low	195 Å²	195	161 Å²	161	85%	0.848	80%	0.801	S	S	*	*			cis	-147.1	148.8	24.7	-59.5	165.9	-176.7	167.2	0	110.6
188	E	25.6	Very low	27.3	Very low	174 Å²	174	157.4 Å²	157.4	81%	0.813	80%	0.796	S	S	*	*			trans	169	142.2	149.6	-97.6	-177	-122.9	0	0	105.7
189	N	27.5	Very low	27.3	Very low	141 Å²	141	156.4 Å²	156.4	75%	0.754	79%	0.794	S	S	*	*			cis	-126.3	160.3	-11.1	-90.4	-58.8	0	0	0	109.9
190	N	24.1	Very low	27.1	Very low	148 Å²	148	155 Å²	155	79%	0.791	79%	0.79	S	S	*	*			trans	-154.1	146.3	173.4	-162.5	6.5	0	0	0	110.6
191	K	30.9	Very low	27.1	Very low	180 Å²	180	152.7 Å²	152.7	78%	0.783	78%	0.779	S	S	*	*			trans	75.5	122.8	-157.6	-50.8	170.1	-177.7	-177.6	0	110.9
192	N	24.9	Very low	26.8	Very low	157 Å²	157	150.1 Å²	150.1	84%	0.84	77%	0.774	S	S	*	*			cis	62.9	83.3	46	-55.6	14.1	0	0	0	111.5
193	T	27.3	Very low	26.9	Very low	139 Å²	139	148 Å²	148	85%	0.853	77%	0.768	S	S	*	*			trans	-92.2	109.7	166.7	47.2	0	0	0	0	110.2
194	I	28.6	Very low	26.9	Very low	145 Å²	145	152.2 Å²	152.2	74%	0.744	77%	0.77	S	S	*	*			trans	-117.3	116.7	144	-68.7	178.8	0	0	0	104.2
195	E	23.4	Very low	26.9	Very low	160 Å²	160	150 Å²	150	75%	0.748	76%	0.755	S	S	*	*			trans	60.5	131	169.3	-58.8	160.5	-167.5	0	0	115.5
196	F	27.9	Very low	27	Very low	180 Å²	180	150 Å²	150	79%	0.789	76%	0.757	S	S	*	*			cis	-144.5	138.5	40.1	-106.8	-102.2	0	0	0	113.4
197	S	26.7	Very low	27.1	Very low	90 Å²	90	146.5 Å²	146.5	63%	0.629	75%	0.746	S	S	*	*			trans	47.6	130.2	138.2	-55.1	0	0	0	0	124.8
198	T	29.6	Very low	27	Very low	125 Å²	125	144.3 Å²	144.3	77%	0.767	74%	0.744	S	S	*	*			trans	87.8	114.9	133.1	41.3	0	0	0	0	123.8
199	I	29.8	Very low	27.1	Very low	153 Å²	153	140.8 Å²	140.8	79%	0.785	74%	0.738	S	S	*	*			trans	88.2	88	138.8	-57.7	162.1	0	0	0	119.4
200	H	26.3	Very low	27.2	Very low	158 Å²	158	140 Å²	140	73%	0.731	74%	0.743	S	S	*	*				42.1	120.7	116.4	-110.5	-135.7	0	0	0	121.7
201	N	28.5	Very low	27.3	Very low	116 Å²	116	139.7 Å²	139.7	62%	0.62	75%	0.746	S	S	*	*				51.1	142.4	109.3	-65.3	-19.5	0	0	0	120.2
202	N	26.4	Very low	27.2	Very low	121 Å²	121	136.1 Å²	136.1	65%	0.647	74%	0.744	S	S	*	*			cis	-166.2	-169.5	8.3	-130.3	-31.3	0	0	0	112.3
203	L	28	Very low	27.4	Very low	155 Å²	155	135.6 Å²	135.6	81%	0.812	74%	0.742	S	S	*	*			trans	98.7	141.5	159	-53.5	172.2	0	0	0	118.6
204	Y	25.4	Very low	27.3	Very low	189 Å²	189	135.4 Å²	135.4	74%	0.741	74%	0.744	S	S	*	*			cis	-168.1	172.2	-41.3	-135.3	-99.1	0	0	0	109.5
205	S	25.7	Very low	27.3	Very low	73 Å²	73	137.4 Å²	137.4	51%	0.51	75%	0.748	S	S	.	*			trans	63.5	106.8	159	-61.3	0	0	0	0	121.7
206	N	27.1	Very low	27.4	Very low	157 Å²	157	136.2 Å²	136.2	84%	0.84	75%	0.745	S	S	*	*				175.9	101.9	115.2	-87.4	-11.9	0	0	0	107.8
207	I	28.4	Very low	27.5	Very low	121 Å²	121	134.2 Å²	134.2	62%	0.621	75%	0.75	S	S	*	*				80.2	105.8	50.4	-56.5	173.3	0	0	0	113
208	N	25.4	Very low	27.4	Very low	149 Å²	149	134.1 Å²	134.1	80%	0.797	75%	0.749	S	S	*	*			trans	64.8	149.4	154.5	-65.2	-2.6	0	0	0	119.8
209	S	27.4	Very low	27.3	Very low	100 Å²	100	135.3 Å²	135.3	70%	0.699	75%	0.751	S	S	*	*			cis	-168.8	134.6	-15.7	46.6	0	0	0	0	112.1
210	S	30.4	Very low	27.3	Very low	123 Å²	123	136.1 Å²	136.1	86%	0.86	76%	0.755	S	S	*	*			trans	-163.2	120.1	152.5	-69.6	0	0	0	0	108.8
211	V	25.5	Very low	27.3	Very low	142 Å²	142	134.9 Å²	134.9	86%	0.861	75%	0.749	S	S	*	*			trans	-141.5	112.3	176.9	177.4	0	0	0	0	110.6
212	S	29.3	Very low	27.4	Very low	106 Å²	106	138.1 Å²	138.1	74%	0.741	77%	0.766	S	S	*	*			trans	-176.1	151.4	156.5	52.2	0	0	0	0	109.1
213	N	27.7	Very low	27.5	Very low	146 Å²	146	140.7 Å²	140.7	78%	0.781	77%	0.766	S	S	*	*			cis	-158	128.5	-26.1	-111.1	-20.1	0	0	0	108.3
214	C	25.2	Very low	27.4	Very low	134 Å²	134	141.3 Å²	141.3	91%	0.905	77%	0.771	S	S	*	*			trans	-167.3	110.1	144.7	-123.9	0	0	0	0	110.4
215	K	28.2	Very low	27.5	Very low	188 Å²	188	139.4 Å²	139.4	82%	0.817	77%	0.768	S	S	*	*			trans	-93.3	135.3	168.6	-84.4	-178.4	175.9	177.9	0	109.4
216	I	26.1	Very low	27.6	Very low	135 Å²	135	145.1 Å²	145.1	69%	0.692	78%	0.784	S	S	*	*			trans	1.7	147.7	135.6	6.3	173.9	0	0	0	116.7
217	P	30	Very low	27.6	Very low	137 Å²	137	143.3 Å²	143.3	89%	0.89	77%	0.774	S	S	*	*				-128.4	139.2	94.5	35.9	-29.9	0	0	0	114
218	S	23.8	Very low	27.6	Very low	88 Å²	88	146.9 Å²	146.9	62%	0.615	78%	0.781	S	S	*	*			trans	-124.3	115.2	170	55.8	0	0	0	0	108
219	D	28.6	Very low	27.9	Very low	150 Å²	150	146.6 Å²	146.6	80%	0.802	77%	0.773	S	S	*	*			trans	-160.5	121.2	162.8	-102.9	-38.8	0	0	0	110.9
220	I	28.9	Very low	28.1	Very low	170 Å²	170	147.2 Å²	147.2	87%	0.872	78%	0.777	S	S	*	*				-158.4	133.9	127.8	-101.2	161.1	0	0	0	107.1
221	H	28.2	Very low	28.1	Very low	132 Å²	132	148.1 Å²	148.1	61%	0.611	77%	0.772	S	S	*	*			trans	-57	142.6	-175.1	-68.2	-72	0	0	0	114.7
222	L	28.9	Very low	28.4	Very low	185 Å²	185	145.3 Å²	145.3	97%	0.969	76%	0.758	S	S	*	*				-127.3	126.6	107.9	-93.8	173.6	0	0	0	109
223	R	28.4	Very low	28.5	Very low	174 Å²	174	148 Å²	148	66%	0.657	76%	0.764	S	S	*	*			trans	-120.2	123.6	-171	179	178.6	-179.5	166.5	-0.3	109.4
224	N	26.4	Very low	28.8	Very low	169 Å²	169	145.9 Å²	145.9	90%	0.904	76%	0.76	S	S	*	*			trans	-136.5	108.2	158.7	-97.2	-32.1	0	0	0	107.4
225	H	27.6	Very low	29	Very low	149 Å²	149	146.2 Å²	146.2	69%	0.69	75%	0.753	S	S	*	*			trans	-144.8	134.4	178.1	-145	-67.5	0	0	0	106.3
226	F	28.4	Very low	29.1	Very low	193 Å²	193	141.3 Å²	141.3	85%	0.846	74%	0.743	S	S	*	*			trans	-105.6	151.8	167.9	-104	-84.3	0	0	0	109.6
227	D	27.6	Very low	29.4	Very low	118 Å²	118	140.4 Å²	140.4	63%	0.631	75%	0.748	S	S	*	*			trans	-99.7	179.7	-167	-51.1	-77.9	0	0	0	113.7
228	Y	28.2	Very low	29.2	Very low	196 Å²	196	139.4 Å²	139.4	77%	0.769	75%	0.745	S	S	*	*			trans	139.4	151.5	152.5	-78.6	-47.3	0	0	0	112
229	K	31.3	Very low	30.1	Very low	143 Å²	143	141 Å²	141	62%	0.622	75%	0.752	S	S	*	*			cis	-159.2	161.7	-0.5	-138.6	147.3	-169.9	156.3	0	111.4
230	S	31.6	Very low	30.1	Very low	113 Å²	113	139 Å²	139	79%	0.79	75%	0.75	S	S	*	*			trans	-152.9	100.9	149.8	53.6	0	0	0	0	107.9
231	L	30.9	Very low	30.2	Very low	142 Å²	142	137.2 Å²	137.2	74%	0.743	74%	0.743	S	S	*	*				74.2	127.7	64.9	-64.9	173.6	0	0	0	113.6
232	S	31.2	Very low	30.2	Very low	83 Å²	83	136.7 Å²	136.7	58%	0.58	75%	0.745	S	S	*	*			cis	178.3	156.1	-19.1	38.5	0	0	0	0	112.8
233	L	31.3	Very low	30.3	Very low	163 Å²	163	134.2 Å²	134.2	85%	0.853	73%	0.732	S	S	*	*			trans	72.1	149.1	159.1	-60.6	140.6	0	0	0	117.5
234	S	33.6	Very low	30.5	Very low	101 Å²	101	132 Å²	132	71%	0.706	73%	0.733	S	S	*	*			cis	-173.3	-180	-17.9	62.5	0	0	0	0	108.4
235	N	29.2	Very low	30.7	Very low	141 Å²	141	130.8 Å²	130.8	75%	0.754	73%	0.727	S	S	*	*			cis	-161	174.5	4.3	-156.9	8.5	0	0	0	112.3
236	S	31.8	Very low	30.9	Very low	86 Å²	86	129.2 Å²	129.2	60%	0.601	73%	0.733	S	S	*	*			trans	24.2	139	144.1	67.9	0	0	0	0	122.5
237	S	32.7	Very low	30.8	Very low	116 Å²	116	123.5 Å²	123.5	81%	0.811	73%	0.728	S	S	*	*			cis	-154.7	165.7	25.3	-64.2	0	0	0	0	114.5
238	S	25.5	Very low	30.8	Very low	116 Å²	116	124.9 Å²	124.9	81%	0.811	74%	0.736	S	S	*	*			trans	-101.4	-165	-176.9	-24.6	0	0	0	0	113.1
239	P	41.4	Very low	30.8	Very low	120 Å²	120	123.7 Å²	123.7	78%	0.779	74%	0.737	S	S	*	*			cis	-146.1	179.8	18.6	45.2	-25	0	0	0	119.9
240	S	30	Very low	30.7	Very low	108 Å²	108	123.2 Å²	123.2	76%	0.755	75%	0.745	S	S	*	*			trans	74	141.7	155.5	-127.1	0	0	0	0	118.9
241	N	29.6	Very low	30.5	Very low	134 Å²	134	126.5 Å²	126.5	72%	0.717	75%	0.746	S	S	*	*			cis	-155.6	165.7	2.1	-147.2	8	0	0	0	113.3
242	N	29.4	Very low	30.2	Very low	121 Å²	121	126.7 Å²	126.7	65%	0.647	75%	0.747	S	S	*	*			trans	72.2	122.8	163.4	-60.9	-1	0	0	0	121.5
243	N	29.9	Very low	30	Very low	133 Å²	133	127.3 Å²	127.3	71%	0.711	75%	0.752	S	S	*	*			trans	64.1	132	142.5	-67.8	53.5	0	0	0	120
244	D	32.4	Very low	29.8	Very low	126 Å²	126	125.5 Å²	125.5	67%	0.674	75%	0.748	S	S	*	*			cis	-146.9	163.1	4.6	-89	-41.6	0	0	0	113.5
245	N	32.3	Very low	29.6	Very low	144 Å²	144	130 Å²	130	77%	0.77	75%	0.751	S	S	*	*			trans	61.8	72.5	160	-65.6	-21.6	0	0	0	120.3
246	S	30.9	Very low	29.6	Very low	116 Å²	116	129.7 Å²	129.7	81%	0.811	75%	0.749	S	S	*	*				46.7	122.3	121.8	64.5	0	0	0	0	121.4
247	G	26.6	Very low	29.5	Very low	73 Å²	73	129.9 Å²	129.9	75%	0.753	75%	0.75	S	S	*	*			trans	-120	-179.6	152.1	0	0	0	0	0	112.3
248	N	28	Very low	29.3	Very low	148 Å²	148	132 Å²	132	79%	0.791	75%	0.751	S	S	*	*			trans	-6.2	140.6	162	-60.9	-16.4	0	0	0	117.7
249	H	27.2	Very low	29.4	Very low	171 Å²	171	133.6 Å²	133.6	79%	0.792	75%	0.75	S	S	*	*			cis	-165	156.1	25.5	-118	-55.4	0	0	0	110
250	V	30	Very low	29	Very low	132 Å²	132	133.6 Å²	133.6	80%	0.8	75%	0.753	S	S	*	*			trans	171.4	152.5	132.3	150.3	0	0	0	0	111.1
251	F	26.4	Very low	28.8	Very low	183 Å²	183	135.6 Å²	135.6	80%	0.803	76%	0.755	S	S	*	*			trans	-50.4	129	-174.9	-73.2	-110.4	0	0	0	117.3
252	N	25.2	Very low	29.6	Very low	145 Å²	145	134.3 Å²	134.3	78%	0.775	75%	0.754	S	S	*	*				175.7	150.1	104.1	-95.2	-30.8	0	0	0	116
253	S	27.3	Very low	29.6	Very low	96 Å²	96	138.2 Å²	138.2	67%	0.671	76%	0.761	S	S	*	*			trans	48.5	112.9	150.2	63.4	0	0	0	0	124.9
254	T	27.6	Very low	29.5	Very low	125 Å²	125	138.1 Å²	138.1	77%	0.767	76%	0.758	S	S	*	*			trans	71.7	155.2	131.1	55.3	0	0	0	0	125
255	Y	27.9	Very low	29.3	Very low	197 Å²	197	140.2 Å²	140.2	77%	0.773	76%	0.761	S	S	*	*			trans	96.3	114.9	158.2	-85.4	-85.3	0	0	0	122.9
256	N	28.7	Very low	29.1	Very low	134 Å²	134	141.1 Å²	141.1	72%	0.717	76%	0.761	S	S	*	*			trans	45.6	161.5	134.3	-69.1	17	0	0	0	123.9
257	S	30.7	Very low	28.9	Very low	90 Å²	90	142 Å²	142	63%	0.629	75%	0.752	S	S	*	*			cis	-176.8	175.7	-23.2	-85.3	0	0	0	0	110.9
258	L	29.3	Very low	29	Very low	159 Å²	159	144.3 Å²	144.3	83%	0.832	75%	0.754	S	S	*	*			trans	80.3	161.7	160	-51.1	-179.8	0	0	0	119.7
259	L	27.7	Very low	28.9	Very low	151 Å²	151	146.6 Å²	146.6	79%	0.791	75%	0.753	S	S	*	*			cis	-175	143	-44.9	-155	82	0	0	0	110.8
260	S	31.3	Very low	28.9	Very low	119 Å²	119	143.7 Å²	143.7	83%	0.832	75%	0.749	S	S	*	*			trans	162.7	152.8	145	-79.1	0	0	0	0	113.6
261	N	26.8	Very low	28.7	Very low	151 Å²	151	145.1 Å²	145.1	81%	0.807	75%	0.75	S	S	*	*			trans	-161.7	145.4	-169.1	-162.5	14.3	0	0	0	115.7
262	P	45.6	Very low	28.8	Very low	107 Å²	107	145.3 Å²	145.3	70%	0.695	75%	0.751	S	S	*	*			trans	-140.3	152.2	149.5	37	-21.8	0	0	0	113.5
263	Y	28.8	Very low	29.1	Very low	203 Å²	203	143.5 Å²	143.5	80%	0.796	75%	0.748	S	S	*	*			cis	-164.2	174.7	-8.5	-135.5	-79	0	0	0	109.2
264	M	29.3	Very low	29	Very low	131 Å²	131	146 Å²	146	65%	0.645	75%	0.752	S	S	*	*			trans	68.3	98.1	160.8	-73.8	-60.6	166.2	0	0	121.3
265	K	28.6	Very low	28.8	Very low	169 Å²	169	145.9 Å²	145.9	74%	0.735	75%	0.747	S	S	*	*			trans	68.4	129.2	143.7	-59.5	179.6	-176.9	177.2	0	118.5
266	Q	27.7	Very low	28.7	Very low	163 Å²	163	142.2 Å²	142.2	76%	0.762	74%	0.741	S	S	*	*			cis	-154.8	118	-4.1	-128.4	165.3	7.5	0	0	112.2
267	Q	26.8	Very low	28.6	Very low	135 Å²	135	142 Å²	142	63%	0.631	74%	0.74	S	S	*	*			trans	50	93.4	148.4	-62.3	-64.5	-9.6	0	0	120.3
268	P	28.3	Very low	28.3	Very low	121 Å²	121	144 Å²	144	79%	0.786	75%	0.749	S	S	*	*			trans	-121.7	150.6	138.4	36.7	-28.9	0	0	0	112.7
269	Y	24.8	Very low	28.3	Very low	197 Å²	197	142 Å²	142	77%	0.773	74%	0.743	S	S	*	*			trans	-126.7	145.1	170.8	-74.4	-64.9	0	0	0	108.1
270	P	28.5	Very low	28.2	Very low	110 Å²	110	143.1 Å²	143.1	71%	0.714	74%	0.744	S	S	*	*				-144.3	176.1	57.7	38.3	-19.2	0	0	0	116.5
271	I	25.6	Very low	28	Very low	161 Å²	161	146.5 Å²	146.5	83%	0.826	75%	0.749	S	S	*	*			trans	166.9	149.2	130.9	-85	157.7	0	0	0	112
272	F	28	Very low	27.9	Very low	188 Å²	188	146.7 Å²	146.7	83%	0.825	75%	0.748	S	S	*	*			trans	-79.7	-177.7	-178.5	-84.9	-84.4	0	0	0	112.6
273	P	31.8	Very low	26.9	Very low	107 Å²	107	146.5 Å²	146.5	70%	0.695	75%	0.75	S	S	*	*			cis	-155.7	167.3	32.2	45.6	-23.3	0	0	0	122.2
274	L	24.4	Very low	26.7	Very low	147 Å²	147	143.7 Å²	143.7	77%	0.77	75%	0.748	S	S	*	*			trans	39.9	154.9	131.3	-55.7	170.1	0	0	0	121.8
275	N	25.2	Very low	26.5	Very low	123 Å²	123	146 Å²	146	66%	0.658	76%	0.757	S	S	*	*			cis	-161.8	176.6	24.7	-148.1	1.8	0	0	0	115.3
276	N	25.6	Very low	26.2	Very low	121 Å²	121	146.3 Å²	146.3	65%	0.647	77%	0.766	S	S	*	*			trans	73.8	142.6	163.2	-59.1	-1.1	0	0	0	117.1
277	N	25.3	Very low	26.2	Very low	128 Å²	128	144.6 Å²	144.6	68%	0.684	76%	0.761	S	S	*	*			cis	-158.8	153.2	-2.1	-111.9	-3.1	0	0	0	111.1
278	T	25.8	Very low	26.2	Very low	133 Å²	133	145.1 Å²	145.1	82%	0.816	77%	0.768	S	S	*	*			trans	60.7	147.5	164.2	51.7	0	0	0	0	117.2
279	T	28.9	Very low	26.2	Very low	116 Å²	116	144.9 Å²	144.9	71%	0.712	77%	0.769	S	S	*	*			cis	-146.4	163.1	11.3	-31.9	0	0	0	0	110.5
280	E	25.7	Very low	26.2	Very low	175 Å²	175	137.7 Å²	137.7	82%	0.818	75%	0.751	S	S	*	*			trans	15.3	114.1	156.9	-71.7	166.7	178.8	0	0	120.7
281	M	26.5	Very low	26.1	Very low	190 Å²	190	138 Å²	138	94%	0.936	75%	0.746	S	S	*	*				-148.4	154	113.4	-81.8	-146	76.6	0	0	109.5
282	I	24.3	Very low	26.4	Very low	155 Å²	155	135.2 Å²	135.2	80%	0.795	74%	0.741	S	S	*	*			trans	-111.4	143.8	-176.9	-62.7	171.2	0	0	0	109.3
283	S	24.5	Very low	26.6	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	74%	0.737	S	S	*	*			trans	112.8	161.6	169.2	-47.9	0	0	0	0	115.4
284	D	24.5	Very low	26.5	Very low	144 Å²	144	132.2 Å²	132.2	77%	0.77	72%	0.723	S	S	*	*			trans	64.1	75.8	164.3	-60.1	-11.3	0	0	0	119.5
285	H	25.3	Very low	26.9	Very low	179 Å²	179	130.7 Å²	130.7	83%	0.829	72%	0.715	S	S	*	*			trans	-148	39.8	140	-117.4	-59.2	0	0	0	115
286	L	23.7	Very low	27.2	Very low	176 Å²	176	130.9 Å²	130.9	92%	0.921	71%	0.712	S	S	*	*			trans	-107	18.9	175.3	-96.6	174.4	0	0	0	115
287	I	26.2	Very low	27.3	Very low	128 Å²	128	130.9 Å²	130.9	66%	0.656	71%	0.707	S	S	*	*			trans	-126.2	98.3	174.6	-54.7	178.9	0	0	0	110.1
288	N	26.6	Very low	27.5	Very low	145 Å²	145	129.1 Å²	129.1	78%	0.775	70%	0.697	S	S	*	*	S	Bend	trans	-168.3	37.8	149.9	-102.2	-28.8	0	0	0	113.3
289	S	28.6	Very low	27.9	Very low	117 Å²	117	128.7 Å²	128.7	82%	0.818	69%	0.686	S	S	*	*	S	Bend	trans	-127.2	-6	175.9	-160.6	0	0	0	0	113.8
290	A	25.2	Very low	28.1	Very low	46 Å²	46	127 Å²	127	38%	0.38	67%	0.671	S	S	.	*			trans	-86.8	-18.8	-170.9	0	0	0	0	0	115.3	S292 Q293	A290-S292 VanDerWaalsContact C-N 3.26Å; A290-S292 PolarHBondContact O-N 3.26Å; A290-S292 VanDerWaalsContact O-N 3.13Å; A290-Q293 PolarHBondContact O-N 3.47Å
291	N	27.2	Very low	28.2	Very low	117 Å²	117	122 Å²	122	63%	0.626	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.7	7.7	-163.9	-68.9	-13.8	0	0	0	115.7
292	S	31.3	Very low	28.5	Very low	102 Å²	102	115.6 Å²	115.6	71%	0.713	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	-37.5	169.4	-174	0	0	0	0	112.3	A290	A290-S292 VanDerWaalsContact C-N 3.26Å; A290-S292 PolarHBondContact O-N 3.26Å; A290-S292 VanDerWaalsContact O-N 3.13Å
293	Q	31.3	Very low	29	Very low	156 Å²	156	114.1 Å²	114.1	73%	0.729	61%	0.614	S	S	*	*	H	α-helix	trans	-81	-29.4	-176	-69	-177.9	-20.1	0	0	113.3	A290 N295 H296 F297	A290-Q293 PolarHBondContact O-N 3.47Å; Q293-N295 PolarHBondContact O-N 3.18Å; Q293-H296 PolarHBondContact O-N 2.82Å; Q293-H296 VanDerWaalsContact O-N 3.09Å; Q293-F297 PolarHBondContact O-N 3.21Å
294	N	30	Very low	29.4	Very low	76 Å²	76	112.6 Å²	112.6	41%	0.406	60%	0.6	S	S	.	*	H	α-helix	trans	-60.8	-28.5	-179.3	-75.5	-19.7	0	0	0	114	F297 N298	N294-F297 PolarHBondContact O-N 3.39Å; N294-N298 WeakPolarHBondContact O-CB 3.06Å; N294-N298 VanDerWaalsContact O-CG 3.26Å; N294-N298 PolarHBondContact O-N 2.99Å; N294-N298 PolarHBondContact O-ND2 2.8Å
295	N	32.3	Very low	29.9	Very low	115 Å²	115	111.8 Å²	111.8	62%	0.615	59%	0.592	S	S	*	*	H	α-helix	trans	-68.6	-37.1	175.7	-74.1	-18.1	0	0	0	112.3	Q293 Q299	Q293-N295 PolarHBondContact O-N 3.18Å; N295-Q299 PolarHBondContact O-N 2.83Å
296	H	32.3	Very low	30.3	Very low	126 Å²	126	108.9 Å²	108.9	58%	0.583	58%	0.581	S	S	*	*	H	α-helix	trans	-73.5	-36.3	174.7	-159.9	-25.6	0	0	0	111.3	Q293 Q299 I300	Q293-H296 PolarHBondContact O-N 2.82Å; Q293-H296 VanDerWaalsContact O-N 3.09Å; H296-Q299 PolarHBondContact O-N 3.32Å; H296-I300 WeakPolarHBondContact O-CG1 3.39Å; H296-I300 PolarHBondContact O-N 3.26Å; H296-I300 VanDerWaalsContact O-N 3.09Å
297	F	27.8	Very low	30.9	Very low	122 Å²	122	103.9 Å²	103.9	54%	0.535	56%	0.562	S	S	.	*	H	α-helix	trans	-65.6	-40.7	176.2	-158.7	-102.3	0	0	0	112	Q293 N294 I300 L301	Q293-F297 PolarHBondContact O-N 3.21Å; N294-F297 PolarHBondContact O-N 3.39Å; F297-I300 PolarHBondContact O-N 3.31Å; F297-L301 HydrophobicContact CD1-CD1 3.99Å; F297-L301 HydrophobicContact CE1-CD1 3.59Å; F297-L301 HydrophobicContact CZ-CD1 4.12Å; F297-L301 PolarHBondContact O-N 3.18Å
298	N	30	Very low	31.5	Very low	91 Å²	91	101 Å²	101	49%	0.487	55%	0.553	S	S	.	*	H	α-helix	trans	-70.5	-30.5	176.3	-71.8	-23.6	0	0	0	113.3	N294 I300 S302	N294-N298 WeakPolarHBondContact O-CB 3.06Å; N294-N298 VanDerWaalsContact O-CG 3.26Å; N294-N298 PolarHBondContact O-N 2.99Å; N294-N298 PolarHBondContact O-ND2 2.8Å; N298-I300 VanDerWaalsContact C-N 3.34Å; N298-S302 PolarHBondContact O-N 3.38Å; N298-S302 PolarHBondContact O-OG 3.05Å
299	Q	34.1	Very low	32.1	Very low	124 Å²	124	100.7 Å²	100.7	58%	0.579	55%	0.547	S	S	*	.	H	α-helix	trans	-67.1	-33.2	168.3	-81.5	-172.3	-23.7	0	0	112.9	N295 H296 S302 Q303	N295-Q299 PolarHBondContact O-N 2.83Å; H296-Q299 PolarHBondContact O-N 3.32Å; Q299-S302 PolarHBondContact O-OG 2.12Å; Q299-Q303 WeakPolarHBondContact O-CG 3.32Å; Q299-Q303 PolarHBondContact O-N 2.41Å
300	I	31.9	Very low	32.5	Very low	79 Å²	79	100.9 Å²	100.9	41%	0.405	53%	0.533	S	S	.	.	H	α-helix	trans	-73.1	-44.3	173.1	-67.4	164.9	0	0	0	110.3	H296 F297 N298 S302 Q303 T304	H296-I300 WeakPolarHBondContact O-CG1 3.39Å; H296-I300 PolarHBondContact O-N 3.26Å; H296-I300 VanDerWaalsContact O-N 3.09Å; F297-I300 PolarHBondContact O-N 3.31Å; N298-I300 VanDerWaalsContact C-N 3.34Å; I300-S302 PolarHBondContact O-N 3.3Å; I300-Q303 PolarHBondContact O-N 2.98Å; I300-Q303 VanDerWaalsContact O-N 3.16Å; I300-T304 HydrophobicContact CG2-CG2 4.4Å; I300-T304 WeakPolarHBondContact O-CG2 3.4Å; I300-T304 PolarHBondContact O-N 2.92Å; I300-T304 PolarHBondContact O-OG1 2.94Å
301	L	27.8	Very low	33.2	Very low	71 Å²	71	103.5 Å²	103.5	37%	0.372	54%	0.537	S	S	.	.	H	α-helix	trans	-58.6	-46.8	179.7	-119.7	68.9	0	0	0	112.1	F297 Q303 T304 Q305	F297-L301 HydrophobicContact CD1-CD1 3.99Å; F297-L301 HydrophobicContact CE1-CD1 3.59Å; F297-L301 HydrophobicContact CZ-CD1 4.12Å; F297-L301 PolarHBondContact O-N 3.18Å; L301-Q303 VanDerWaalsContact C-N 3.33Å; L301-Q303 PolarHBondContact O-N 3.1Å; L301-T304 WeakPolarHBondContact CA-OG1 3.26Å; L301-T304 PolarHBondContact O-N 2.69Å; L301-T304 VanDerWaalsContact O-N 3.12Å; L301-T304 PolarHBondContact O-OG1 2.99Å; L301-Q305 PolarHBondContact O-N 3.07Å
302	S	33.5	Very low	33.9	Very low	55 Å²	55	103.7 Å²	103.7	39%	0.385	53%	0.534	S	S	.	.	H	α-helix	trans	-62.3	-37.1	176.8	46.4	0	0	0	0	112.9	N298 Q299 I300 Q305 L306	N298-S302 PolarHBondContact O-N 3.38Å; N298-S302 PolarHBondContact O-OG 3.05Å; Q299-S302 PolarHBondContact O-OG 2.12Å; I300-S302 PolarHBondContact O-N 3.3Å; S302-Q305 PolarHBondContact O-N 3.37Å; S302-L306 WeakPolarHBondContact O-CG 3.41Å; S302-L306 PolarHBondContact O-N 3.06Å
303	Q	34.1	Very low	34.3	Very low	125 Å²	125	106.2 Å²	106.2	58%	0.584	53%	0.529	S	S	*	.	H	α-helix	trans	-65.4	-40.2	171.2	-71.2	176	32.9	0	0	112.4	Q299 I300 L301 L306 S307	Q299-Q303 WeakPolarHBondContact O-CG 3.32Å; Q299-Q303 PolarHBondContact O-N 2.41Å; I300-Q303 PolarHBondContact O-N 2.98Å; I300-Q303 VanDerWaalsContact O-N 3.16Å; L301-Q303 VanDerWaalsContact C-N 3.33Å; L301-Q303 PolarHBondContact O-N 3.1Å; Q303-L306 PolarHBondContact O-N 3.3Å; Q303-S307 PolarHBondContact O-N 3Å
304	T	34	Very low	34.6	Very low	70 Å²	70	102.6 Å²	102.6	43%	0.429	51%	0.509	S	S	.	.	H	α-helix	trans	-70.6	-30.4	176.6	60.3	0	0	0	0	113.8	I300 L301 S307 S308	I300-T304 HydrophobicContact CG2-CG2 4.4Å; I300-T304 WeakPolarHBondContact O-CG2 3.4Å; I300-T304 PolarHBondContact O-N 2.92Å; I300-T304 PolarHBondContact O-OG1 2.94Å; L301-T304 WeakPolarHBondContact CA-OG1 3.26Å; L301-T304 PolarHBondContact O-N 2.69Å; L301-T304 VanDerWaalsContact O-N 3.12Å; L301-T304 PolarHBondContact O-OG1 2.99Å; T304-S307 WeakPolarHBondContact CA-OG 3.32Å; T304-S307 PolarHBondContact O-OG 3.38Å; T304-S308 VanDerWaalsContact O-CB 3.3Å; T304-S308 WeakPolarHBondContact O-CB 3.48Å; T304-S308 PolarHBondContact O-N 3.09Å
305	Q	35.2	Very low	35.1	Very low	128 Å²	128	102 Å²	102	60%	0.598	51%	0.505	S	S	*	.	H	α-helix	trans	-70.3	-40.7	172.7	-74.3	-178.8	-56.9	0	0	111.3	L301 S302 S308 Q309	L301-Q305 PolarHBondContact O-N 3.07Å; S302-Q305 PolarHBondContact O-N 3.37Å; Q305-S308 PolarHBondContact O-N 2.83Å; Q305-Q309 PolarHBondContact O-N 3.34Å
306	L	33.6	Very low	35.5	Very low	117 Å²	117	102.8 Å²	102.8	61%	0.613	51%	0.505	S	S	*	.	H	α-helix	trans	-62.6	-43.6	172.5	-78	165	0	0	0	111.9	S302 Q303 S308 Q309 F310	S302-L306 WeakPolarHBondContact O-CG 3.41Å; S302-L306 PolarHBondContact O-N 3.06Å; Q303-L306 PolarHBondContact O-N 3.3Å; L306-S308 VanDerWaalsContact C-N 3.34Å; L306-S308 PolarHBondContact O-N 2.82Å; L306-Q309 PolarHBondContact O-N 2.9Å; L306-F310 WeakPolarHBondContact O-CB 3.25Å; L306-F310 PolarHBondContact O-N 3.02Å
307	S	35.5	Very low	35.6	Very low	72 Å²	72	102.2 Å²	102.2	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-65.8	-36.8	176.1	69.7	0	0	0	0	112.5	Q303 T304 F310 H311	Q303-S307 PolarHBondContact O-N 3Å; T304-S307 WeakPolarHBondContact CA-OG 3.32Å; T304-S307 PolarHBondContact O-OG 3.38Å; S307-F310 PolarHBondContact O-N 2.82Å; S307-H311 WeakPolarHBondContact O-CB 3.43Å; S307-H311 PolarHBondContact O-N 3.26Å
308	S	39.8	Very low	36	Very low	67 Å²	67	101.1 Å²	101.1	47%	0.469	50%	0.503	S	S	.	.	H	α-helix	trans	-64.4	-45.2	175.6	-175.2	0	0	0	0	112.1	T304 Q305 L306 F310 H311 Q312	T304-S308 VanDerWaalsContact O-CB 3.3Å; T304-S308 WeakPolarHBondContact O-CB 3.48Å; T304-S308 PolarHBondContact O-N 3.09Å; Q305-S308 PolarHBondContact O-N 2.83Å; L306-S308 VanDerWaalsContact C-N 3.34Å; L306-S308 PolarHBondContact O-N 2.82Å; S308-F310 PolarHBondContact O-N 2.94Å; S308-H311 PolarHBondContact O-N 3.43Å; S308-Q312 WeakPolarHBondContact O-CG 3.42Å; S308-Q312 PolarHBondContact O-N 3.26Å
309	Q	39.4	Very low	36.1	Very low	139 Å²	139	102.7 Å²	102.7	65%	0.65	51%	0.512	S	S	*	.	H	α-helix	trans	-63.4	-41.1	174	-73.5	-174.8	-6.5	0	0	112.1	Q305 L306 H311 Q312 Y313	Q305-Q309 PolarHBondContact O-N 3.34Å; L306-Q309 PolarHBondContact O-N 2.9Å; Q309-H311 VanDerWaalsContact C-N 3.34Å; Q309-H311 PolarHBondContact O-N 3.33Å; Q309-Q312 PolarHBondContact O-N 2.87Å; Q309-Y313 WeakPolarHBondContact O-CB 3.43Å; Q309-Y313 PolarHBondContact O-N 3.17Å
310	F	36.9	Very low	35.9	Very low	120 Å²	120	100.6 Å²	100.6	53%	0.526	51%	0.507	S	S	.	.	H	α-helix	trans	-64.1	-39.4	176.8	-148.7	-87.3	0	0	0	111.9	L306 S307 S308 Y313 W314	L306-F310 WeakPolarHBondContact O-CB 3.25Å; L306-F310 PolarHBondContact O-N 3.02Å; S307-F310 PolarHBondContact O-N 2.82Å; S308-F310 PolarHBondContact O-N 2.94Å; F310-Y313 PolarHBondContact O-N 3.14Å; F310-W314 VanDerWaalsContact O-CB 3.28Å; F310-W314 WeakPolarHBondContact O-CB 3.14Å; F310-W314 PolarHBondContact O-N 3.06Å
311	H	39	Very low	35.7	Very low	101 Å²	101	102.4 Å²	102.4	47%	0.468	52%	0.524	S	S	.	.	H	α-helix	trans	-67.6	-40.7	176.2	-167.8	79.6	0	0	0	112.2	S307 S308 Q309 W314 L315	S307-H311 WeakPolarHBondContact O-CB 3.43Å; S307-H311 PolarHBondContact O-N 3.26Å; S308-H311 PolarHBondContact O-N 3.43Å; Q309-H311 VanDerWaalsContact C-N 3.34Å; Q309-H311 PolarHBondContact O-N 3.33Å; H311-W314 PolarHBondContact O-N 2.88Å; H311-L315 WeakPolarHBondContact O-CB 3.22Å; H311-L315 VanDerWaalsContact O-CG 3.31Å; H311-L315 WeakPolarHBondContact O-CG 3.45Å; H311-L315 PolarHBondContact O-N 2.62Å
312	Q	41.5	Very low	35.8	Very low	121 Å²	121	105.9 Å²	105.9	57%	0.565	54%	0.542	S	S	*	.	H	α-helix	trans	-60.5	-43.7	172.1	-72.3	-74.3	-25.1	0	0	112	S308 Q309 L315 Q316	S308-Q312 WeakPolarHBondContact O-CG 3.42Å; S308-Q312 PolarHBondContact O-N 3.26Å; Q309-Q312 PolarHBondContact O-N 2.87Å; Q312-L315 PolarHBondContact O-N 3.09Å; Q312-Q316 PolarHBondContact O-N 2.83Å
313	Y	40.4	Very low	35.4	Very low	156 Å²	156	111 Å²	111	61%	0.612	56%	0.564	S	S	*	*	H	α-helix	trans	-68.3	-36.3	178.3	-147.2	-90.8	0	0	0	112.3	Q309 F310 Q316 M317	Q309-Y313 WeakPolarHBondContact O-CB 3.43Å; Q309-Y313 PolarHBondContact O-N 3.17Å; F310-Y313 PolarHBondContact O-N 3.14Å; Y313-Q316 PolarHBondContact O-N 2.93Å; Y313-M317 HydrophobicContact CD1-CG 4.43Å; Y313-M317 VanDerWaalsContact O-CG 3.28Å; Y313-M317 WeakPolarHBondContact O-CG 3.49Å; Y313-M317 PolarHBondContact O-N 2.76Å
314	W	38	Very low	35.1	Very low	79 Å²	79	110.4 Å²	110.4	30%	0.299	57%	0.573	S	S	.	*	H	α-helix	trans	-66.6	-42	174.4	-171.1	78.6	0	0	0	112	F310 H311 Q316 M317 I318 I406	F310-W314 VanDerWaalsContact O-CB 3.28Å; F310-W314 WeakPolarHBondContact O-CB 3.14Å; F310-W314 PolarHBondContact O-N 3.06Å; H311-W314 PolarHBondContact O-N 2.88Å; W314-Q316 VanDerWaalsContact C-N 3.33Å; W314-Q316 PolarHBondContact O-N 2.93Å; W314-M317 PolarHBondContact O-N 3.21Å; W314-I318 HydrophobicContact CD2-CD1 3.65Å; W314-I318 HydrophobicContact CE3-CD1 3.6Å; W314-I318 HydrophobicContact CG-CD1 4.47Å; W314-I318 HydrophobicContact CH2-CD1 3.58Å; W314-I318 HydrophobicContact CZ2-CD1 3.62Å; W314-I318 HydrophobicContact CZ3-CD1 3.56Å; W314-I318 WeakPolarHBondContact O-CG1 3.34Å; W314-I318 PolarHBondContact O-N 3.19Å; W314-I406 HydrophobicContact CZ2-CG2 4.28Å
315	L	40.7	Very low	34.9	Very low	64 Å²	64	113.3 Å²	113.3	34%	0.335	60%	0.596	S	S	.	*	H	α-helix	trans	-63.7	-35.7	171.4	-71.9	171.7	0	0	0	112.3	H311 Q312 N319	H311-L315 WeakPolarHBondContact O-CB 3.22Å; H311-L315 VanDerWaalsContact O-CG 3.31Å; H311-L315 WeakPolarHBondContact O-CG 3.45Å; H311-L315 PolarHBondContact O-N 2.62Å; Q312-L315 PolarHBondContact O-N 3.09Å; L315-N319 PolarHBondContact O-N 3Å; L315-N319 PolarHBondContact O-ND2 2.99Å
316	Q	40	Very low	34.7	Very low	131 Å²	131	110.6 Å²	110.6	61%	0.612	60%	0.603	S	S	*	*	H	α-helix	trans	-63.6	-43.8	171.3	-80.9	-172.3	-27.5	0	0	112.1	Q312 Y313 W314 I318 N319	Q312-Q316 PolarHBondContact O-N 2.83Å; Y313-Q316 PolarHBondContact O-N 2.93Å; W314-Q316 VanDerWaalsContact C-N 3.33Å; W314-Q316 PolarHBondContact O-N 2.93Å; Q316-I318 PolarHBondContact O-N 3.31Å; Q316-N319 PolarHBondContact O-N 3.33Å
317	M	35.5	Very low	34.4	Very low	114 Å²	114	109.4 Å²	109.4	56%	0.562	61%	0.61	S	S	*	*	H	α-helix	trans	-60.4	-46.1	178.1	-65.8	-99.6	71.9	0	0	111.8	Y313 W314 N319 T320	Y313-M317 HydrophobicContact CD1-CG 4.43Å; Y313-M317 VanDerWaalsContact O-CG 3.28Å; Y313-M317 WeakPolarHBondContact O-CG 3.49Å; Y313-M317 PolarHBondContact O-N 2.76Å; W314-M317 PolarHBondContact O-N 3.21Å; M317-N319 VanDerWaalsContact C-N 3.31Å; M317-N319 PolarHBondContact O-N 3.42Å; M317-T320 PolarHBondContact O-N 3.06Å; M317-T320 PolarHBondContact O-OG1 2.68Å
318	I	35.3	Very low	33.9	Very low	100 Å²	100	112.2 Å²	112.2	51%	0.513	62%	0.624	S	S	.	*	H	α-helix	trans	-64.7	-32.4	-179.7	-69.6	170.3	0	0	0	112.5	W314 Q316 T320	W314-I318 HydrophobicContact CD2-CD1 3.65Å; W314-I318 HydrophobicContact CE3-CD1 3.6Å; W314-I318 HydrophobicContact CG-CD1 4.47Å; W314-I318 HydrophobicContact CH2-CD1 3.58Å; W314-I318 HydrophobicContact CZ2-CD1 3.62Å; W314-I318 HydrophobicContact CZ3-CD1 3.56Å; W314-I318 WeakPolarHBondContact O-CG1 3.34Å; W314-I318 PolarHBondContact O-N 3.19Å; Q316-I318 PolarHBondContact O-N 3.31Å; I318-T320 VanDerWaalsContact C-N 3.28Å; I318-T320 PolarHBondContact O-N 2.65Å
319	N	32.1	Very low	33.4	Very low	124 Å²	124	115.7 Å²	115.7	66%	0.663	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	14.6	-179.9	-73.1	-72.9	0	0	0	114.1	L315 Q316 M317	L315-N319 PolarHBondContact O-N 3Å; L315-N319 PolarHBondContact O-ND2 2.99Å; Q316-N319 PolarHBondContact O-N 3.33Å; M317-N319 VanDerWaalsContact C-N 3.31Å; M317-N319 PolarHBondContact O-N 3.42Å
320	T	30.1	Very low	32.8	Very low	79 Å²	79	113.8 Å²	113.8	49%	0.485	65%	0.645	S	S	.	*	S	Bend	trans	-89.5	120.5	171.3	57.2	0	0	0	0	111.6	M317 I318 I322	M317-T320 PolarHBondContact O-N 3.06Å; M317-T320 PolarHBondContact O-OG1 2.68Å; I318-T320 VanDerWaalsContact C-N 3.28Å; I318-T320 PolarHBondContact O-N 2.65Å; T320-I322 PolarHBondContact O-N 2.86Å
321	P	28.2	Very low	32.2	Very low	117 Å²	117	114 Å²	114	76%	0.76	66%	0.656	S	S	*	*			trans	-74.5	109.9	178.4	28.6	-32.9	0	0	0	110.7	L323	P321-L323 PolarHBondContact O-N 3.01Å
322	I	28.2	Very low	31.8	Very low	145 Å²	145	114.8 Å²	114.8	74%	0.744	67%	0.668	S	S	*	*			trans	-72.3	92	179.4	-55.3	177.4	0	0	0	110.2	T320 S324	T320-I322 PolarHBondContact O-N 2.86Å; I322-S324 PolarHBondContact O-N 3.39Å
323	L	25.8	Very low	31.2	Very low	163 Å²	163	114.5 Å²	114.5	85%	0.853	68%	0.675	S	S	*	*			trans	-73.1	115.8	165.3	-81.7	164.7	0	0	0	109.9	P321	P321-L323 PolarHBondContact O-N 3.01Å
324	S	27.2	Very low	30.5	Very low	112 Å²	112	113 Å²	113	78%	0.783	68%	0.682	S	S	*	*			trans	-152.6	92.3	171.3	-84.7	0	0	0	0	113.8	I322	I322-S324 PolarHBondContact O-N 3.39Å
325	S	30.9	Very low	30.2	Very low	130 Å²	130	115.3 Å²	115.3	91%	0.909	71%	0.705	S	S	*	*			trans	-156.7	140.6	153.9	57	0	0	0	0	108.3
326	G	29.8	Very low	29.5	Very low	72 Å²	72	117.2 Å²	117.2	74%	0.742	72%	0.724	S	S	*	*			cis	-178.3	175.7	-9.4	0	0	0	0	0	111
327	A	27.3	Very low	29.1	Very low	92 Å²	92	117.9 Å²	117.9	76%	0.76	74%	0.737	S	S	*	*			trans	39.1	103.2	158.4	0	0	0	0	0	120.5
328	T	25.8	Very low	28.7	Very low	130 Å²	130	118.8 Å²	118.8	80%	0.798	75%	0.749	S	S	*	*				21.2	119.5	128.5	56	0	0	0	0	120.4
329	T	30.1	Very low	28.9	Very low	141 Å²	141	119.3 Å²	119.3	87%	0.865	76%	0.759	S	S	*	*				-159.6	133.9	115.3	21.9	0	0	0	0	113.6
330	S	25.3	Very low	28.6	Very low	98 Å²	98	118 Å²	118	69%	0.685	76%	0.76	S	S	*	*			trans	15.2	122.3	143.4	-44.4	0	0	0	0	122.6
331	T	26	Very low	28.4	Very low	125 Å²	125	124.5 Å²	124.5	77%	0.767	78%	0.782	S	S	*	*				74.6	143.8	126.9	54.1	0	0	0	0	123.8
332	T	28.7	Very low	28.2	Very low	118 Å²	118	124.2 Å²	124.2	72%	0.724	78%	0.778	S	S	*	*			trans	80.2	101.5	149.6	38	0	0	0	0	121.6
333	T	29.2	Very low	28	Very low	115 Å²	115	125.1 Å²	125.1	71%	0.706	78%	0.781	S	S	*	*				78.8	100	126.3	52.9	0	0	0	0	122.7
334	T	27	Very low	28.1	Very low	123 Å²	123	122.5 Å²	122.5	76%	0.755	77%	0.772	S	S	*	*				76.9	149.8	122.8	56.2	0	0	0	0	122.3
335	T	31	Very low	28	Very low	129 Å²	129	122.4 Å²	122.4	79%	0.791	77%	0.767	S	S	*	*			trans	58.1	106.5	171.1	53	0	0	0	0	116.5
336	S	26.6	Very low	27.8	Very low	103 Å²	103	123.6 Å²	123.6	72%	0.72	76%	0.758	S	S	*	*			cis	99.2	90.9	34.8	75.5	0	0	0	0	114.6
337	T	30.4	Very low	27.5	Very low	145 Å²	145	126 Å²	126	89%	0.89	75%	0.754	S	S	*	*			trans	-154.2	138.2	144.6	19.4	0	0	0	0	110
338	T	28.4	Very low	27.6	Very low	133 Å²	133	129.5 Å²	129.5	82%	0.816	76%	0.758	S	S	*	*			trans	-154.2	163	-177.9	49.7	0	0	0	0	108.1
339	P	37.8	Very low	27.5	Very low	112 Å²	112	129.5 Å²	129.5	73%	0.727	76%	0.758	S	S	*	*			cis	-136.3	-153.5	-35.4	35.1	-14.5	0	0	0	110.8
340	S	26	Very low	27.6	Very low	97 Å²	97	128.3 Å²	128.3	68%	0.678	75%	0.753	S	S	*	*			trans	84.6	112	154	-57.7	0	0	0	0	119.9
341	F	26.1	Very low	27.7	Very low	214 Å²	214	131.7 Å²	131.7	94%	0.939	76%	0.762	S	S	*	*			trans	-130	155.1	131.3	-111.4	-87.9	0	0	0	108.4
342	T	24.3	Very low	27.5	Very low	111 Å²	111	134 Å²	134	68%	0.681	76%	0.764	S	S	*	*			trans	-137.2	154.2	-170.4	46.1	0	0	0	0	111.9
343	M	23.5	Very low	27.3	Very low	164 Å²	164	136.2 Å²	136.2	81%	0.808	77%	0.768	S	S	*	*			trans	68.2	156.9	175.1	-54.4	-74.3	91.5	0	0	114.5
344	T	28	Very low	27	Very low	108 Å²	108	135.4 Å²	135.4	66%	0.663	76%	0.763	S	S	*	*			cis	-151.1	144.7	8.2	-18.1	0	0	0	0	111.7
345	T	25.1	Very low	26.8	Very low	111 Å²	111	138.1 Å²	138.1	68%	0.681	77%	0.768	S	S	*	*			trans	39.2	135.9	143.1	49.5	0	0	0	0	125.2
346	Q	28.1	Very low	26.4	Very low	155 Å²	155	137.6 Å²	137.6	72%	0.724	77%	0.769	S	S	*	*			trans	96.2	112	133.8	-79.1	-179.4	-76.2	0	0	123.1
347	D	23.5	Very low	26.2	Very low	123 Å²	123	141 Å²	141	66%	0.658	78%	0.778	S	S	*	*				96.2	140.1	119.4	-65.3	-10.6	0	0	0	124.4
348	I	28.4	Very low	25.8	Very low	165 Å²	165	139.6 Å²	139.6	85%	0.846	77%	0.77	S	S	*	*			trans	77	105.2	160.8	-61.6	149.2	0	0	0	119.1
349	T	23.5	Very low	25.6	Very low	129 Å²	129	139.6 Å²	139.6	79%	0.791	77%	0.772	S	S	*	*			trans	-103.5	174.5	145.3	62.3	0	0	0	0	108.8
350	P	33.2	Very low	24.9	Very low	116 Å²	116	138.8 Å²	138.8	75%	0.753	77%	0.769	S	S	*	*			cis	-132.1	179.9	-1	42.4	-27.3	0	0	0	114.2
351	L	26	Very low	25	Very low	169 Å²	169	143.4 Å²	143.4	89%	0.885	78%	0.777	S	S	*	*			trans	-151.3	158.1	146.1	-117	174.7	0	0	0	111.3
352	Q	22.9	Very low	24.8	Very low	175 Å²	175	141.7 Å²	141.7	82%	0.818	77%	0.774	S	S	*	*			trans	-93	154.8	-177.4	-56.6	168.7	-67.8	0	0	110.7
353	M	24.3	Very low	24.8	Very low	164 Å²	164	141.9 Å²	141.9	81%	0.808	77%	0.77	S	S	*	*				179.1	114.7	113.4	-95.4	-177.1	81.6	0	0	114.3
354	T	22.4	Very low	25	Very low	97 Å²	97	138.1 Å²	138.1	60%	0.595	76%	0.758	S	S	*	*			trans	57.6	125.5	135.6	57.7	0	0	0	0	123.2
355	Q	23.9	Very low	25.1	Very low	181 Å²	181	140.1 Å²	140.1	85%	0.846	76%	0.764	S	S	*	*			trans	70.4	85.5	136.1	-63.6	173.3	54	0	0	119.6
356	S	22.3	Very low	25.4	Very low	117 Å²	117	139.6 Å²	139.6	82%	0.818	76%	0.757	S	S	*	*				-174.1	112.2	115.9	55	0	0	0	0	111.8
357	L	21.5	Very low	25.5	Very low	174 Å²	174	137.6 Å²	137.6	91%	0.911	75%	0.746	S	S	*	*			trans	-135.7	111.5	164.7	-83.3	174.2	0	0	0	109.4
358	T	23.3	Very low	26	Very low	117 Å²	117	135.7 Å²	135.7	72%	0.718	74%	0.735	S	S	*	*			trans	-85.7	127.6	172.3	45.9	0	0	0	0	109.2	S360	T358-S360 PolarHBondContact O-N 3.15Å
359	P	24.1	Very low	26.5	Very low	133 Å²	133	131.4 Å²	131.4	86%	0.864	72%	0.719	S	S	*	*			trans	-76.5	73	178.7	31.1	-34.8	0	0	0	111.1
360	S	23.6	Very low	27.2	Very low	94 Å²	94	130.3 Å²	130.3	66%	0.657	71%	0.709	S	S	*	*			trans	-87.4	129.7	170.6	-66.2	0	0	0	0	110.4	T358	T358-S360 PolarHBondContact O-N 3.15Å
361	K	26.3	Very low	27.6	Very low	194 Å²	194	129.3 Å²	129.3	84%	0.843	69%	0.694	S	S	*	*			trans	71.7	86.1	-174.9	-52.9	175.8	-178.5	175.3	0	114.6
362	M	23.3	Very low	28.5	Very low	179 Å²	179	124.5 Å²	124.5	88%	0.882	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-65.2	129.4	145.7	-58.2	-137	82.1	0	0	108.3
363	L	24.7	Very low	29.6	Very low	114 Å²	114	122.3 Å²	122.3	60%	0.597	66%	0.658	S	S	*	*	P	Polyproline II helix	trans	-74.9	148.8	168.8	-88.6	72.1	0	0	0	109.7	F367	L363-F367 HydrophobicContact CD2-CB 4.47Å; L363-F367 HydrophobicContact CD2-CD1 4.36Å; L363-F367 HydrophobicContact CD2-CD2 4.49Å; L363-F367 HydrophobicContact CD2-CG 4.18Å
364	P	26.7	Very low	30.9	Very low	86 Å²	86	118.4 Å²	118.4	56%	0.558	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-69.2	145.1	176.4	29.5	-34.7	0	0	0	111.3	N366 F367	P364-N366 PolarHBondContact O-N 3.18Å; P364-F367 PolarHBondContact O-N 2.87Å; P364-F367 VanDerWaalsContact O-N 3.08Å
365	L	29.6	Very low	32.2	Very low	149 Å²	149	119 Å²	119	78%	0.78	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.8	-23.2	-177.3	-87.3	67.8	0	0	0	114.7	F367 I368	L365-F367 PolarHBondContact O-N 2.92Å; L365-I368 PolarHBondContact O-N 3.32Å
366	N	31.7	Very low	33.5	Very low	100 Å²	100	111.5 Å²	111.5	54%	0.535	61%	0.61	S	S	.	*	H	α-helix	trans	-61.9	-18.6	178.1	-64.1	-13.6	0	0	0	114.1	P364	P364-N366 PolarHBondContact O-N 3.18Å
367	F	30.1	Very low	35.1	Very low	114 Å²	114	109 Å²	109	50%	0.5	59%	0.593	S	S	.	*	H	α-helix	trans	-73.8	-50.6	178.5	-124.5	-94.5	0	0	0	112.1	L363 P364 L365 S369 N370 E371	L363-F367 HydrophobicContact CD2-CB 4.47Å; L363-F367 HydrophobicContact CD2-CD1 4.36Å; L363-F367 HydrophobicContact CD2-CD2 4.49Å; L363-F367 HydrophobicContact CD2-CG 4.18Å; P364-F367 PolarHBondContact O-N 2.87Å; P364-F367 VanDerWaalsContact O-N 3.08Å; L365-F367 PolarHBondContact O-N 2.92Å; F367-S369 PolarHBondContact O-N 3.3Å; F367-N370 PolarHBondContact O-N 2.71Å; F367-E371 PolarHBondContact O-N 2.91Å
368	I	34.5	Very low	36.6	Very low	82 Å²	82	105.4 Å²	105.4	42%	0.421	57%	0.574	S	S	.	*	H	α-helix	trans	-60.3	-35.5	-178.2	-59.8	171.2	0	0	0	111.1	L365 N370 E371 L372	L365-I368 PolarHBondContact O-N 3.32Å; I368-N370 VanDerWaalsContact C-N 3.29Å; I368-N370 PolarHBondContact O-N 3.4Å; I368-E371 PolarHBondContact O-N 3.24Å; I368-L372 HydrophobicContact CG2-CD1 3.65Å; I368-L372 WeakPolarHBondContact O-CD1 3.42Å; I368-L372 PolarHBondContact O-N 3.29Å
369	S	39.4	Very low	38.3	Very low	75 Å²	75	101.9 Å²	101.9	52%	0.524	55%	0.549	S	S	.	.	H	α-helix	trans	-61.8	-34.1	176.4	-169.2	0	0	0	0	113.2	F367 Q373	F367-S369 PolarHBondContact O-N 3.3Å; S369-Q373 WeakPolarHBondContact O-CB 3.18Å; S369-Q373 PolarHBondContact O-N 2.87Å
370	N	38.3	Very low	39.6	Very low	106 Å²	106	101.2 Å²	101.2	57%	0.567	53%	0.53	S	S	*	.	H	α-helix	trans	-75.2	-36.1	177.6	-74.8	-30.1	0	0	0	111.4	F367 I368 Q373 T374	F367-N370 PolarHBondContact O-N 2.71Å; I368-N370 VanDerWaalsContact C-N 3.29Å; I368-N370 PolarHBondContact O-N 3.4Å; N370-Q373 WeakPolarHBondContact O-CB 3.29Å; N370-Q373 PolarHBondContact O-N 3.16Å; N370-T374 PolarHBondContact O-N 2.9Å; N370-T374 PolarHBondContact O-OG1 3.05Å
371	E	41.7	Very low	41.2	Very low	96 Å²	96	102 Å²	102	45%	0.449	52%	0.524	S	S	.	.	H	α-helix	trans	-70	-39.8	178.9	-69.5	170.6	170	0	0	111.9	F367 I368 Q373 T374 L375	F367-E371 PolarHBondContact O-N 2.91Å; I368-E371 PolarHBondContact O-N 3.24Å; E371-Q373 VanDerWaalsContact C-N 3.31Å; E371-Q373 PolarHBondContact O-N 3.41Å; E371-T374 PolarHBondContact O-N 2.77Å; E371-T374 PolarHBondContact O-OG1 3.23Å; E371-T374 VanDerWaalsContact O-OG1 3.05Å; E371-L375 WeakPolarHBondContact O-CB 3.4Å; E371-L375 VanDerWaalsContact O-CG 3.24Å; E371-L375 WeakPolarHBondContact O-CG 3.22Å; E371-L375 PolarHBondContact O-N 3.34Å
372	L	44.5	Very low	42.6	Very low	68 Å²	68	96 Å²	96	36%	0.356	50%	0.503	S	S	.	.	H	α-helix	trans	-65.3	-34.2	168.4	-88.8	94.1	0	0	0	112.4	I368 S376	I368-L372 HydrophobicContact CG2-CD1 3.65Å; I368-L372 WeakPolarHBondContact O-CD1 3.42Å; I368-L372 PolarHBondContact O-N 3.29Å; L372-S376 WeakPolarHBondContact O-CB 3.48Å; L372-S376 PolarHBondContact O-N 3.28Å
373	Q	45.4	Very low	44.2	Very low	128 Å²	128	88.4 Å²	88.4	60%	0.598	47%	0.466	S	S	*	.	H	α-helix	trans	-68.5	-38.6	177.4	-160.9	70.4	45.3	0	0	111.9	S369 N370 E371 S377	S369-Q373 WeakPolarHBondContact O-CB 3.18Å; S369-Q373 PolarHBondContact O-N 2.87Å; N370-Q373 WeakPolarHBondContact O-CB 3.29Å; N370-Q373 PolarHBondContact O-N 3.16Å; E371-Q373 VanDerWaalsContact C-N 3.31Å; E371-Q373 PolarHBondContact O-N 3.41Å; Q373-S377 WeakPolarHBondContact O-CB 3.42Å; Q373-S377 PolarHBondContact O-N 3.3Å
374	T	52.8	Low	45.5	Very low	82 Å²	82	89.2 Å²	89.2	50%	0.503	46%	0.464	S	S	.	.	H	α-helix	trans	-73.5	-38.2	175.1	53.8	0	0	0	0	112.2	N370 E371 S377 L378	N370-T374 PolarHBondContact O-N 2.9Å; N370-T374 PolarHBondContact O-OG1 3.05Å; E371-T374 PolarHBondContact O-N 2.77Å; E371-T374 PolarHBondContact O-OG1 3.23Å; E371-T374 VanDerWaalsContact O-OG1 3.05Å; T374-S377 WeakPolarHBondContact O-CB 3.49Å; T374-S377 PolarHBondContact O-N 2.89Å; T374-L378 WeakPolarHBondContact O-CB 3.35Å; T374-L378 WeakPolarHBondContact O-CG 3.37Å; T374-L378 PolarHBondContact O-N 3.49Å
375	L	48.1	Very low	46.7	Very low	110 Å²	110	90.8 Å²	90.8	58%	0.576	47%	0.465	S	S	*	.	H	α-helix	trans	-63.3	-39.9	172.4	-72.7	170	0	0	0	112	E371 L378 F379	E371-L375 WeakPolarHBondContact O-CB 3.4Å; E371-L375 VanDerWaalsContact O-CG 3.24Å; E371-L375 WeakPolarHBondContact O-CG 3.22Å; E371-L375 PolarHBondContact O-N 3.34Å; L375-L378 PolarHBondContact O-N 3.26Å; L375-F379 VanDerWaalsContact O-CB 3.31Å; L375-F379 WeakPolarHBondContact O-CB 3.09Å; L375-F379 PolarHBondContact O-N 3.43Å
376	S	52	Low	47.5	Very low	23 Å²	23	87.8 Å²	87.8	16%	0.161	45%	0.449	C	S	.	.	H	α-helix	trans	-61.2	-47.5	171.1	179.3	0	0	0	0	111.6	L372 L378 F379 Y380	L372-S376 WeakPolarHBondContact O-CB 3.48Å; L372-S376 PolarHBondContact O-N 3.28Å; S376-L378 PolarHBondContact O-N 3.49Å; S376-F379 PolarHBondContact O-N 2.98Å; S376-Y380 WeakPolarHBondContact O-CD2 3.49Å; S376-Y380 PolarHBondContact O-N 3.21Å
377	S	55.2	Low	48.2	Very low	66 Å²	66	88.2 Å²	88.2	46%	0.462	45%	0.447	S	S	.	.	H	α-helix	trans	-57.7	-47	175.3	-172	0	0	0	0	112.2	Q373 T374 Q381	Q373-S377 WeakPolarHBondContact O-CB 3.42Å; Q373-S377 PolarHBondContact O-N 3.3Å; T374-S377 WeakPolarHBondContact O-CB 3.49Å; T374-S377 PolarHBondContact O-N 2.89Å; S377-Q381 WeakPolarHBondContact O-CB 3.43Å; S377-Q381 PolarHBondContact O-N 3.18Å
378	L	52.7	Low	48.9	Very low	97 Å²	97	89.6 Å²	89.6	51%	0.508	46%	0.457	S	S	.	.	H	α-helix	trans	-62.4	-46.6	177.7	-79.1	161.7	0	0	0	111.4	T374 L375 S376 Y380 Q381 T382	T374-L378 WeakPolarHBondContact O-CB 3.35Å; T374-L378 WeakPolarHBondContact O-CG 3.37Å; T374-L378 PolarHBondContact O-N 3.49Å; L375-L378 PolarHBondContact O-N 3.26Å; S376-L378 PolarHBondContact O-N 3.49Å; L378-Y380 PolarHBondContact O-N 3.18Å; L378-Q381 PolarHBondContact O-N 3.3Å; L378-Q381 VanDerWaalsContact O-N 3.14Å; L378-T382 PolarHBondContact O-N 3.27Å; L378-T382 PolarHBondContact O-OG1 2.88Å
379	F	58.8	Low	49.3	Very low	44 Å²	44	91.1 Å²	91.1	19%	0.193	47%	0.466	C	S	.	.	H	α-helix	trans	-55.3	-54	177	-177	-112.5	0	0	0	111.3	L375 S376 Q381 T382 I383 L399 I402	L375-F379 VanDerWaalsContact O-CB 3.31Å; L375-F379 WeakPolarHBondContact O-CB 3.09Å; L375-F379 PolarHBondContact O-N 3.43Å; S376-F379 PolarHBondContact O-N 2.98Å; F379-Q381 VanDerWaalsContact C-N 3.29Å; F379-Q381 PolarHBondContact O-N 2.82Å; F379-T382 PolarHBondContact O-N 3.1Å; F379-I383 HydrophobicContact CD1-CD1 3.55Å; F379-I383 HydrophobicContact CD2-CD1 4.11Å; F379-I383 HydrophobicContact CE1-CD1 3.47Å; F379-I383 VanDerWaalsContact CE1-CD1 3.47Å; F379-I383 HydrophobicContact CE2-CD1 4.03Å; F379-I383 HydrophobicContact CG-CD1 3.89Å; F379-I383 HydrophobicContact CZ-CD1 3.73Å; F379-I383 VanDerWaalsContact O-CD1 3.26Å; F379-I383 WeakPolarHBondContact O-CD1 3.36Å; F379-I383 VanDerWaalsContact O-CG1 3.26Å; F379-I383 WeakPolarHBondContact O-CG1 3.32Å; F379-I383 PolarHBondContact O-N 3.36Å; F379-L399 HydrophobicContact CZ-CD1 4.28Å; F379-I402 HydrophobicContact CE2-CG2 4.22Å; F379-I402 HydrophobicContact CZ-CG2 3.86Å
380	Y	52.5	Low	49.2	Very low	119 Å²	119	93.4 Å²	93.4	47%	0.467	47%	0.468	S	S	.	.	H	α-helix	trans	-60.5	-35.7	176.2	-85.4	-72.2	0	0	0	113.2	S376 L378 K384	S376-Y380 WeakPolarHBondContact O-CD2 3.49Å; S376-Y380 PolarHBondContact O-N 3.21Å; L378-Y380 PolarHBondContact O-N 3.18Å; Y380-K384 WeakPolarHBondContact O-CB 3.39Å; Y380-K384 PolarHBondContact O-N 3.32Å
381	Q	57.8	Low	49.3	Very low	111 Å²	111	96 Å²	96	52%	0.519	48%	0.482	S	S	.	.	H	α-helix	trans	-71.1	-39.8	179.2	-169.3	164.5	-7.4	0	0	112.1	S377 L378 F379 K384 Q385	S377-Q381 WeakPolarHBondContact O-CB 3.43Å; S377-Q381 PolarHBondContact O-N 3.18Å; L378-Q381 PolarHBondContact O-N 3.3Å; L378-Q381 VanDerWaalsContact O-N 3.14Å; F379-Q381 VanDerWaalsContact C-N 3.29Å; F379-Q381 PolarHBondContact O-N 2.82Å; Q381-K384 PolarHBondContact O-N 2.88Å; Q381-Q385 PolarHBondContact O-N 3.36Å
382	T	54.2	Low	49.2	Very low	66 Å²	66	97.3 Å²	97.3	41%	0.405	49%	0.492	S	S	.	.	H	α-helix	trans	-64.6	-44.1	172.5	-55.2	0	0	0	0	111.4	L378 F379 K384 Q385 L386	L378-T382 PolarHBondContact O-N 3.27Å; L378-T382 PolarHBondContact O-OG1 2.88Å; F379-T382 PolarHBondContact O-N 3.1Å; T382-K384 VanDerWaalsContact C-N 3.29Å; T382-K384 PolarHBondContact O-N 3.36Å; T382-Q385 PolarHBondContact O-N 3.41Å; T382-Q385 VanDerWaalsContact O-N 3.14Å; T382-L386 HydrophobicContact CG2-CD1 4.35Å; T382-L386 WeakPolarHBondContact O-CG 3.4Å; T382-L386 PolarHBondContact O-N 2.89Å
383	I	57.4	Low	48.8	Very low	20 Å²	20	100 Å²	100	10%	0.103	51%	0.513	C	S	.	.	H	α-helix	trans	-60.5	-41	175.5	-67.4	155	0	0	0	110.8	F379 Q385 L386 Q387 L399	F379-I383 HydrophobicContact CD1-CD1 3.55Å; F379-I383 HydrophobicContact CD2-CD1 4.11Å; F379-I383 HydrophobicContact CE1-CD1 3.47Å; F379-I383 VanDerWaalsContact CE1-CD1 3.47Å; F379-I383 HydrophobicContact CE2-CD1 4.03Å; F379-I383 HydrophobicContact CG-CD1 3.89Å; F379-I383 HydrophobicContact CZ-CD1 3.73Å; F379-I383 VanDerWaalsContact O-CD1 3.26Å; F379-I383 WeakPolarHBondContact O-CD1 3.36Å; F379-I383 VanDerWaalsContact O-CG1 3.26Å; F379-I383 WeakPolarHBondContact O-CG1 3.32Å; F379-I383 PolarHBondContact O-N 3.36Å; I383-Q385 VanDerWaalsContact C-N 3.32Å; I383-Q385 PolarHBondContact O-N 3.18Å; I383-L386 PolarHBondContact O-N 3.2Å; I383-Q387 WeakPolarHBondContact O-CG 3.42Å; I383-Q387 PolarHBondContact O-N 3.39Å; I383-L399 HydrophobicContact CD1-CD1 3.64Å; I383-L399 HydrophobicContact CD1-CD2 4.12Å; I383-L399 HydrophobicContact CD1-CG 4.12Å; I383-L399 HydrophobicContact CG1-CD1 4.16Å; I383-L399 HydrophobicContact CG2-CD2 4.3Å
384	K	53.1	Low	48.8	Very low	131 Å²	131	96.8 Å²	96.8	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-66.1	-31.9	176.6	-167.4	173.4	-177.5	178.9	0	112.8	Y380 Q381 T382 M388	Y380-K384 WeakPolarHBondContact O-CB 3.39Å; Y380-K384 PolarHBondContact O-N 3.32Å; Q381-K384 PolarHBondContact O-N 2.88Å; T382-K384 VanDerWaalsContact C-N 3.29Å; T382-K384 PolarHBondContact O-N 3.36Å; K384-M388 VanDerWaalsContact O-CG 3.24Å; K384-M388 WeakPolarHBondContact O-CG 3.32Å; K384-M388 PolarHBondContact O-N 3.24Å
385	Q	51.3	Low	48.6	Very low	120 Å²	120	97.9 Å²	97.9	56%	0.561	51%	0.505	S	S	*	.	H	α-helix	trans	-72.2	-40.2	170.7	-72.4	-173.2	-4.8	0	0	112.3	Q381 T382 I383 Q387 M388 N389	Q381-Q385 PolarHBondContact O-N 3.36Å; T382-Q385 PolarHBondContact O-N 3.41Å; T382-Q385 VanDerWaalsContact O-N 3.14Å; I383-Q385 VanDerWaalsContact C-N 3.32Å; I383-Q385 PolarHBondContact O-N 3.18Å; Q385-Q387 VanDerWaalsContact C-N 3.29Å; Q385-Q387 PolarHBondContact O-N 2.97Å; Q385-M388 PolarHBondContact O-N 3.49Å; Q385-M388 VanDerWaalsContact O-N 3.14Å; Q385-N389 PolarHBondContact O-N 2.83Å
386	L	45.9	Very low	48.7	Very low	85 Å²	85	98.4 Å²	98.4	45%	0.445	51%	0.507	S	S	.	.	H	α-helix	trans	-61.7	-37	174.7	-70.5	168.4	0	0	0	112.2	T382 I383 H390	T382-L386 HydrophobicContact CG2-CD1 4.35Å; T382-L386 WeakPolarHBondContact O-CG 3.4Å; T382-L386 PolarHBondContact O-N 2.89Å; I383-L386 PolarHBondContact O-N 3.2Å; L386-H390 PolarHBondContact O-N 2.83Å
387	Q	47.7	Very low	48.4	Very low	109 Å²	109	100.9 Å²	100.9	51%	0.509	53%	0.525	S	S	.	.	H	α-helix	trans	-62.6	-42.6	171.7	-76	-179.9	-34.6	0	0	112.7	I383 Q385	I383-Q387 WeakPolarHBondContact O-CG 3.42Å; I383-Q387 PolarHBondContact O-N 3.39Å; Q385-Q387 VanDerWaalsContact C-N 3.29Å; Q385-Q387 PolarHBondContact O-N 2.97Å
388	M	44.4	Very low	48.2	Very low	143 Å²	143	102.4 Å²	102.4	70%	0.704	53%	0.527	S	S	*	.	H	α-helix	trans	-67	-35.3	179.4	-69.2	-78.5	-175.4	0	0	112.8	K384 Q385	K384-M388 VanDerWaalsContact O-CG 3.24Å; K384-M388 WeakPolarHBondContact O-CG 3.32Å; K384-M388 PolarHBondContact O-N 3.24Å; Q385-M388 PolarHBondContact O-N 3.49Å; Q385-M388 VanDerWaalsContact O-N 3.14Å
389	N	41.3	Very low	48.1	Very low	115 Å²	115	99.2 Å²	99.2	62%	0.615	51%	0.51	S	S	*	.	H	α-helix	trans	-92.9	-19.4	-166.7	-69	-1.1	0	0	0	115.1	Q385	Q385-N389 PolarHBondContact O-N 2.83Å
390	H	38.6	Very low	47.6	Very low	122 Å²	122	101.3 Å²	101.3	57%	0.565	52%	0.523	S	S	*	.	H	α-helix	trans	-133	-4	-166.8	-71	-63.8	0	0	0	118	L386 L392	L386-H390 PolarHBondContact O-N 2.83Å; H390-L392 HydrophobicContact CB-CD1 4.13Å; H390-L392 HydrophobicContact CB-CG 4.34Å; H390-L392 PolarHBondContact O-N 2.91Å
391	N	39.9	Very low	47.6	Very low	161 Å²	161	101.1 Å²	101.1	86%	0.861	53%	0.527	S	S	*	.			trans	52.8	22.2	-179.8	-83.7	-17.6	0	0	0	115.4
392	L	38.9	Very low	47.5	Very low	124 Å²	124	99.1 Å²	99.1	65%	0.649	52%	0.519	S	S	*	.			trans	-87.4	136.7	-178.2	-77.8	167.9	0	0	0	112	H390 V394	H390-L392 HydrophobicContact CB-CD1 4.13Å; H390-L392 HydrophobicContact CB-CG 4.34Å; H390-L392 PolarHBondContact O-N 2.91Å; L392-V394 PolarHBondContact O-N 2.9Å; L392-V394 VanDerWaalsContact O-N 3.08Å
393	P	36.2	Very low	47.4	Very low	123 Å²	123	100.6 Å²	100.6	80%	0.799	52%	0.518	S	S	*	.			trans	-75.1	98.2	177.9	30.2	-33.7	0	0	0	111.1	N395	P393-N395 PolarHBondContact O-N 3.47Å
394	V	45.5	Very low	47.5	Very low	62 Å²	62	102.8 Å²	102.8	38%	0.376	53%	0.532	S	S	.	.			trans	-73	119.7	176.4	-179.3	0	0	0	0	110.2	L392 I396 L399	L392-V394 PolarHBondContact O-N 2.9Å; L392-V394 VanDerWaalsContact O-N 3.08Å; V394-I396 PolarHBondContact O-N 2.86Å; V394-L399 HydrophobicContact CG1-CD1 4.18Å
395	N	49.3	Very low	47.7	Very low	104 Å²	104	99 Å²	99	56%	0.556	52%	0.519	S	S	*	.			trans	-72.1	109.2	176.3	-175	-18.4	0	0	0	110.8	P393 S397 L398 L399	P393-N395 PolarHBondContact O-N 3.47Å; N395-S397 PolarHBondContact O-N 3.01Å; N395-S397 WeakPolarHBondContact OD1-CB 3.46Å; N395-S397 PolarHBondContact OD1-N 3.21Å; N395-L398 HydrophobicContact CB-CB 4.39Å; N395-L398 PolarHBondContact O-N 2.88Å; N395-L399 PolarHBondContact O-N 2.81Å
396	I	50.9	Low	47.8	Very low	121 Å²	121	95.7 Å²	95.7	62%	0.621	51%	0.505	S	S	*	.	H	α-helix	trans	-59.8	-30.4	-177.8	-61	173.2	0	0	0	112.1	V394 L399 N400	V394-I396 PolarHBondContact O-N 2.86Å; I396-L399 WeakPolarHBondContact O-CB 3.45Å; I396-L399 PolarHBondContact O-N 3.36Å; I396-N400 PolarHBondContact O-N 3.45Å
397	S	45	Very low	48.2	Very low	76 Å²	76	97 Å²	97	53%	0.531	51%	0.505	S	S	.	.	H	α-helix	trans	-65.6	-44.6	177.5	-170.5	0	0	0	0	111.7	N395 L399 N400 H401	N395-S397 PolarHBondContact O-N 3.01Å; N395-S397 WeakPolarHBondContact OD1-CB 3.46Å; N395-S397 PolarHBondContact OD1-N 3.21Å; S397-L399 VanDerWaalsContact C-N 3.26Å; S397-L399 PolarHBondContact O-N 3.02Å; S397-N400 PolarHBondContact O-N 3.47Å; S397-H401 WeakPolarHBondContact O-CB 3.44Å; S397-H401 PolarHBondContact O-N 3.19Å
398	L	51.2	Low	48.3	Very low	97 Å²	97	96.1 Å²	96.1	51%	0.508	50%	0.504	S	S	.	.	H	α-helix	trans	-62.5	-35.9	174.5	-178.4	62.4	0	0	0	111.5	N395 H401 I402	N395-L398 HydrophobicContact CB-CB 4.39Å; N395-L398 PolarHBondContact O-N 2.88Å; L398-H401 PolarHBondContact O-N 3.31Å; L398-I402 HydrophobicContact CD1-CD1 4.3Å; L398-I402 HydrophobicContact CD1-CG1 4.46Å; L398-I402 HydrophobicContact CG-CD1 4.02Å; L398-I402 VanDerWaalsContact O-CG1 3.3Å; L398-I402 WeakPolarHBondContact O-CG1 3.46Å; L398-I402 PolarHBondContact O-N 3.42Å
399	L	49.8	Very low	48.6	Very low	31 Å²	31	94.3 Å²	94.3	16%	0.162	49%	0.494	C	S	.	.	H	α-helix	trans	-64.8	-46.4	177.7	-150.3	70.6	0	0	0	112.3	F379 I383 V394 N395 I396 S397 H401 I402 Y403	F379-L399 HydrophobicContact CZ-CD1 4.28Å; I383-L399 HydrophobicContact CD1-CD1 3.64Å; I383-L399 HydrophobicContact CD1-CD2 4.12Å; I383-L399 HydrophobicContact CD1-CG 4.12Å; I383-L399 HydrophobicContact CG1-CD1 4.16Å; I383-L399 HydrophobicContact CG2-CD2 4.3Å; V394-L399 HydrophobicContact CG1-CD1 4.18Å; N395-L399 PolarHBondContact O-N 2.81Å; I396-L399 WeakPolarHBondContact O-CB 3.45Å; I396-L399 PolarHBondContact O-N 3.36Å; S397-L399 VanDerWaalsContact C-N 3.26Å; S397-L399 PolarHBondContact O-N 3.02Å; L399-H401 VanDerWaalsContact C-N 3.32Å; L399-I402 PolarHBondContact O-N 3.43Å; L399-Y403 PolarHBondContact O-N 3.37Å
400	N	49.5	Very low	48.8	Very low	87 Å²	87	92 Å²	92	47%	0.465	48%	0.481	S	S	.	.	H	α-helix	trans	-66.3	-34.6	174.7	-72.7	-13.1	0	0	0	111.8	I396 S397 T404	I396-N400 PolarHBondContact O-N 3.45Å; S397-N400 PolarHBondContact O-N 3.47Å; N400-T404 PolarHBondContact O-N 2.79Å; N400-T404 PolarHBondContact O-OG1 3.45Å
401	H	52.8	Low	49	Very low	116 Å²	116	89.7 Å²	89.7	54%	0.537	47%	0.473	S	S	.	.	H	α-helix	trans	-66.5	-46.2	174.9	-167.1	-10.9	0	0	0	111.4	S397 L398 L399 Y403 T404 T405	S397-H401 WeakPolarHBondContact O-CB 3.44Å; S397-H401 PolarHBondContact O-N 3.19Å; L398-H401 PolarHBondContact O-N 3.31Å; L399-H401 VanDerWaalsContact C-N 3.32Å; H401-Y403 VanDerWaalsContact C-N 3.33Å; H401-Y403 PolarHBondContact O-N 3.38Å; H401-T404 WeakPolarHBondContact CA-OG1 3.45Å; H401-T404 PolarHBondContact O-N 2.77Å; H401-T404 PolarHBondContact O-OG1 2.69Å; H401-T404 VanDerWaalsContact O-OG1 3.11Å; H401-T405 PolarHBondContact CE1-OG1 3.36Å; H401-T405 PolarHBondContact ND1-OG1 3.46Å; H401-T405 VanDerWaalsContact ND1-OG1 3.14Å; H401-T405 WeakPolarHBondContact O-CB 3.44Å; H401-T405 PolarHBondContact O-N 3.16Å; H401-T405 PolarHBondContact O-OG1 3.5Å
402	I	54.3	Low	49.3	Very low	68 Å²	68	85.9 Å²	85.9	35%	0.349	46%	0.455	S	S	.	.	H	α-helix	trans	-59.5	-45	175.5	-70.7	164.9	0	0	0	110.6	F379 L398 L399 T404 T405 I406	F379-I402 HydrophobicContact CE2-CG2 4.22Å; F379-I402 HydrophobicContact CZ-CG2 3.86Å; L398-I402 HydrophobicContact CD1-CD1 4.3Å; L398-I402 HydrophobicContact CD1-CG1 4.46Å; L398-I402 HydrophobicContact CG-CD1 4.02Å; L398-I402 VanDerWaalsContact O-CG1 3.3Å; L398-I402 WeakPolarHBondContact O-CG1 3.46Å; L398-I402 PolarHBondContact O-N 3.42Å; L399-I402 PolarHBondContact O-N 3.43Å; I402-T404 PolarHBondContact O-N 2.89Å; I402-T405 PolarHBondContact O-N 3.32Å; I402-I406 HydrophobicContact CG2-CD1 3.7Å; I402-I406 HydrophobicContact CG2-CG1 4.47Å; I402-I406 WeakPolarHBondContact O-CB 3.32Å; I402-I406 VanDerWaalsContact O-CG1 3.3Å; I402-I406 WeakPolarHBondContact O-CG1 3.38Å; I402-I406 PolarHBondContact O-N 2.9Å
403	Y	51.9	Low	49.4	Very low	98 Å²	98	82.6 Å²	82.6	38%	0.384	44%	0.443	S	S	.	.	H	α-helix	trans	-61	-45	177.2	-178.1	-95.9	0	0	0	112.6	L399 H401 Y407	L399-Y403 PolarHBondContact O-N 3.37Å; H401-Y403 VanDerWaalsContact C-N 3.33Å; H401-Y403 PolarHBondContact O-N 3.38Å; Y403-Y407 VanDerWaalsContact O-CB 3.32Å; Y403-Y407 WeakPolarHBondContact O-CB 3.3Å; Y403-Y407 PolarHBondContact O-N 2.73Å
404	T	59.3	Low	49.4	Very low	66 Å²	66	80.7 Å²	80.7	41%	0.405	43%	0.425	S	S	.	.	H	α-helix	trans	-70.7	-35.7	178	44	0	0	0	0	113.1	N400 H401 I402 Y407 N408	N400-T404 PolarHBondContact O-N 2.79Å; N400-T404 PolarHBondContact O-OG1 3.45Å; H401-T404 WeakPolarHBondContact CA-OG1 3.45Å; H401-T404 PolarHBondContact O-N 2.77Å; H401-T404 PolarHBondContact O-OG1 2.69Å; H401-T404 VanDerWaalsContact O-OG1 3.11Å; I402-T404 PolarHBondContact O-N 2.89Å; T404-Y407 PolarHBondContact O-N 3.05Å; T404-N408 VanDerWaalsContact O-CB 3.26Å; T404-N408 WeakPolarHBondContact O-CB 3.5Å; T404-N408 PolarHBondContact O-N 3.35Å; T404-N408 PolarHBondContact O-ND2 3.28Å; T404-N408 VanDerWaalsContact O-ND2 3.09Å
405	T	57.8	Low	49	Very low	50 Å²	50	83.3 Å²	83.3	31%	0.307	43%	0.433	S	S	.	.	H	α-helix	trans	-62.4	-50.5	172.9	-56.9	0	0	0	0	110.6	H401 I402 Y407 N408 E409	H401-T405 PolarHBondContact CE1-OG1 3.36Å; H401-T405 PolarHBondContact ND1-OG1 3.46Å; H401-T405 VanDerWaalsContact ND1-OG1 3.14Å; H401-T405 WeakPolarHBondContact O-CB 3.44Å; H401-T405 PolarHBondContact O-N 3.16Å; H401-T405 PolarHBondContact O-OG1 3.5Å; I402-T405 PolarHBondContact O-N 3.32Å; T405-Y407 VanDerWaalsContact C-N 3.32Å; T405-Y407 PolarHBondContact O-N 2.58Å; T405-N408 PolarHBondContact O-N 3.42Å; T405-E409 HydrophobicContact CG2-CG 4.21Å; T405-E409 WeakPolarHBondContact O-CB 3.41Å; T405-E409 WeakPolarHBondContact O-CG 3.27Å; T405-E409 PolarHBondContact O-N 3.37Å
406	I	53.5	Low	48.5	Very low	51 Å²	51	83.3 Å²	83.3	26%	0.262	43%	0.433	S	S	.	.	H	α-helix	trans	-59.8	-41.7	177.8	-68.4	169.9	0	0	0	111.2	W314 I402 N410	W314-I406 HydrophobicContact CZ2-CG2 4.28Å; I402-I406 HydrophobicContact CG2-CD1 3.7Å; I402-I406 HydrophobicContact CG2-CG1 4.47Å; I402-I406 WeakPolarHBondContact O-CB 3.32Å; I402-I406 VanDerWaalsContact O-CG1 3.3Å; I402-I406 WeakPolarHBondContact O-CG1 3.38Å; I402-I406 PolarHBondContact O-N 2.9Å; I406-N410 WeakPolarHBondContact O-CB 3.35Å; I406-N410 PolarHBondContact O-N 3.4Å; I406-N410 PolarHBondContact O-ND2 3.02Å
407	Y	55.2	Low	47.7	Very low	113 Å²	113	83.8 Å²	83.8	44%	0.443	43%	0.433	S	S	.	.	H	α-helix	trans	-63.4	-45.4	177.1	-171.7	-96	0	0	0	112.1	Y403 T404 T405 I411	Y403-Y407 VanDerWaalsContact O-CB 3.32Å; Y403-Y407 WeakPolarHBondContact O-CB 3.3Å; Y403-Y407 PolarHBondContact O-N 2.73Å; T404-Y407 PolarHBondContact O-N 3.05Å; T405-Y407 VanDerWaalsContact C-N 3.32Å; T405-Y407 PolarHBondContact O-N 2.58Å; Y407-I411 HydrophobicContact CD1-CD1 4Å; Y407-I411 HydrophobicContact CE1-CD1 3.41Å; Y407-I411 VanDerWaalsContact CE1-CD1 3.41Å; Y407-I411 PolarHBondContact O-N 2.7Å; Y407-I411 VanDerWaalsContact O-N 3.17Å
408	N	48.6	Very low	47.2	Very low	90 Å²	90	85.7 Å²	85.7	48%	0.481	44%	0.437	S	S	.	.	H	α-helix	trans	-71.9	-39.4	-177.9	-68.8	-24.2	0	0	0	112.8	T404 T405 I411 T412	T404-N408 VanDerWaalsContact O-CB 3.26Å; T404-N408 WeakPolarHBondContact O-CB 3.5Å; T404-N408 PolarHBondContact O-N 3.35Å; T404-N408 PolarHBondContact O-ND2 3.28Å; T404-N408 VanDerWaalsContact O-ND2 3.09Å; T405-N408 PolarHBondContact O-N 3.42Å; N408-I411 PolarHBondContact O-N 3.36Å; N408-T412 WeakPolarHBondContact O-CB 3.48Å; N408-T412 PolarHBondContact O-N 3.37Å; N408-T412 PolarHBondContact O-OG1 2.8Å
409	E	50.3	Low	46.1	Very low	106 Å²	106	88.1 Å²	88.1	50%	0.495	45%	0.445	S	S	.	.	H	α-helix	trans	-62.9	-42.7	175.6	-75.4	-179.2	160.1	0	0	111.2	T405 T412 S413	T405-E409 HydrophobicContact CG2-CG 4.21Å; T405-E409 WeakPolarHBondContact O-CB 3.41Å; T405-E409 WeakPolarHBondContact O-CG 3.27Å; T405-E409 PolarHBondContact O-N 3.37Å; E409-T412 PolarHBondContact O-N 2.65Å; E409-S413 WeakPolarHBondContact O-CB 3.4Å; E409-S413 PolarHBondContact O-N 2.88Å
410	N	46.1	Very low	45.1	Very low	65 Å²	65	92 Å²	92	35%	0.348	47%	0.471	S	S	.	.	H	α-helix	trans	-64.9	-41	176.9	-80.2	-67.7	0	0	0	112.7	I406 S413 L414	I406-N410 WeakPolarHBondContact O-CB 3.35Å; I406-N410 PolarHBondContact O-N 3.4Å; I406-N410 PolarHBondContact O-ND2 3.02Å; N410-S413 PolarHBondContact O-N 3.08Å; N410-L414 PolarHBondContact O-N 3.36Å
411	I	44.1	Very low	44	Very low	75 Å²	75	93.3 Å²	93.3	39%	0.385	48%	0.482	S	S	.	.	H	α-helix	trans	-66.6	-37.5	174.2	-71.8	-178	0	0	0	111.9	Y407 N408 L414 H415	Y407-I411 HydrophobicContact CD1-CD1 4Å; Y407-I411 HydrophobicContact CE1-CD1 3.41Å; Y407-I411 VanDerWaalsContact CE1-CD1 3.41Å; Y407-I411 PolarHBondContact O-N 2.7Å; Y407-I411 VanDerWaalsContact O-N 3.17Å; N408-I411 PolarHBondContact O-N 3.36Å; I411-L414 PolarHBondContact O-N 3.29Å; I411-H415 PolarHBondContact O-N 3.08Å
412	T	44.1	Very low	42.7	Very low	80 Å²	80	94.8 Å²	94.8	49%	0.491	50%	0.499	S	S	.	.	H	α-helix	trans	-69	-39.3	178.3	-53.1	0	0	0	0	111.3	N408 E409 H415 N416	N408-T412 WeakPolarHBondContact O-CB 3.48Å; N408-T412 PolarHBondContact O-N 3.37Å; N408-T412 PolarHBondContact O-OG1 2.8Å; E409-T412 PolarHBondContact O-N 2.65Å; T412-H415 PolarHBondContact O-N 3.17Å; T412-N416 PolarHBondContact O-N 2.89Å; T412-N416 PolarHBondContact O-ND2 3.29Å
413	S	41.3	Very low	41.3	Very low	56 Å²	56	97.3 Å²	97.3	39%	0.392	52%	0.518	S	S	.	.	H	α-helix	trans	-62	-44.5	172	-168.3	0	0	0	0	111.4	E409 N410 H415 N416 Q417	E409-S413 WeakPolarHBondContact O-CB 3.4Å; E409-S413 PolarHBondContact O-N 2.88Å; N410-S413 PolarHBondContact O-N 3.08Å; S413-H415 VanDerWaalsContact C-N 3.34Å; S413-H415 PolarHBondContact O-N 3.4Å; S413-N416 PolarHBondContact O-N 3.48Å; S413-Q417 WeakPolarHBondContact O-CG 3.4Å; S413-Q417 PolarHBondContact O-N 3.08Å
414	L	36.9	Very low	40	Very low	83 Å²	83	98 Å²	98	44%	0.435	53%	0.533	S	S	.	.	H	α-helix	trans	-60.5	-39.2	175	-118.1	71.9	0	0	0	112.8	N410 I411 N418	N410-L414 PolarHBondContact O-N 3.36Å; I411-L414 PolarHBondContact O-N 3.29Å; L414-N418 PolarHBondContact O-N 2.63Å; L414-N418 PolarHBondContact O-ND2 3.01Å
415	H	37	Very low	38.5	Very low	117 Å²	117	101.6 Å²	101.6	54%	0.542	55%	0.549	S	S	.	.	H	α-helix	trans	-65.9	-43.9	174.9	-103.8	82.3	0	0	0	112.1	I411 T412 S413 Q417 N418 H419	I411-H415 PolarHBondContact O-N 3.08Å; T412-H415 PolarHBondContact O-N 3.17Å; S413-H415 VanDerWaalsContact C-N 3.34Å; S413-H415 PolarHBondContact O-N 3.4Å; H415-Q417 VanDerWaalsContact C-N 3.35Å; H415-Q417 PolarHBondContact O-N 2.77Å; H415-N418 PolarHBondContact O-N 3.36Å; H415-N418 VanDerWaalsContact O-N 3.17Å; H415-H419 PolarHBondContact O-CD2 3.33Å; H415-H419 PolarHBondContact O-N 3.17Å
416	N	38.1	Very low	37	Very low	103 Å²	103	104.7 Å²	104.7	55%	0.551	57%	0.568	S	S	*	*	H	α-helix	trans	-68.9	-31	-178.7	-71.9	-22.9	0	0	0	113.1	T412 S413 N418 H419 T420	T412-N416 PolarHBondContact O-N 2.89Å; T412-N416 PolarHBondContact O-ND2 3.29Å; S413-N416 PolarHBondContact O-N 3.48Å; N416-N418 VanDerWaalsContact C-N 3.33Å; N416-H419 PolarHBondContact O-N 3.24Å; N416-T420 PolarHBondContact O-OG1 3.18Å
417	Q	35.9	Very low	35.6	Very low	131 Å²	131	108 Å²	108	61%	0.612	59%	0.591	S	S	*	*	H	α-helix	trans	-70.9	-26.2	172.5	-70.2	-176.9	9.8	0	0	113.1	S413 H415 T420	S413-Q417 WeakPolarHBondContact O-CG 3.4Å; S413-Q417 PolarHBondContact O-N 3.08Å; H415-Q417 VanDerWaalsContact C-N 3.35Å; H415-Q417 PolarHBondContact O-N 2.77Å; Q417-T420 PolarHBondContact O-OG1 2.99Å
418	N	32.6	Very low	34.3	Very low	116 Å²	116	108 Å²	108	62%	0.62	61%	0.608	S	S	*	*	H	α-helix	trans	-86.2	-5.7	177	-76.2	-69.2	0	0	0	114.3	L414 H415 N416	L414-N418 PolarHBondContact O-N 2.63Å; L414-N418 PolarHBondContact O-ND2 3.01Å; H415-N418 PolarHBondContact O-N 3.36Å; H415-N418 VanDerWaalsContact O-N 3.17Å; N416-N418 VanDerWaalsContact C-N 3.33Å
419	H	29.9	Very low	33.2	Very low	148 Å²	148	108.5 Å²	108.5	69%	0.685	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	9.9	-179.5	-85.2	-62.7	0	0	0	115.2	H415 N416	H415-H419 PolarHBondContact O-CD2 3.33Å; H415-H419 PolarHBondContact O-N 3.17Å; N416-H419 PolarHBondContact O-N 3.24Å
420	T	27	Very low	32	Very low	113 Å²	113	108.7 Å²	108.7	69%	0.693	63%	0.631	S	S	*	*	S	Bend	trans	-110.6	20.9	-174.9	43.5	0	0	0	0	114.8	N416 Q417	N416-T420 PolarHBondContact O-OG1 3.18Å; Q417-T420 PolarHBondContact O-OG1 2.99Å
421	T	26.6	Very low	31	Very low	114 Å²	114	110.4 Å²	110.4	70%	0.699	65%	0.648	S	S	*	*	S	Bend	trans	-136.7	47.9	-175.3	47.8	0	0	0	0	116
422	T	26.4	Very low	30.1	Very low	148 Å²	148	113 Å²	113	91%	0.908	67%	0.667	S	S	*	*			trans	-157.8	137	148.6	-5.8	0	0	0	0	113
423	T	23.9	Very low	29.2	Very low	121 Å²	121	115.3 Å²	115.3	74%	0.742	68%	0.682	S	S	*	*			trans	-119.1	156.5	178.6	49.8	0	0	0	0	111.7
424	T	25.6	Very low	28.3	Very low	113 Å²	113	118.3 Å²	118.3	69%	0.693	70%	0.698	S	S	*	*			trans	57.1	112.9	155.5	50.9	0	0	0	0	117.4
425	N	26.5	Very low	27.6	Very low	140 Å²	140	120.2 Å²	120.2	75%	0.749	71%	0.713	S	S	*	*				-174	163.9	72.5	-95.9	-39.9	0	0	0	114.8
426	T	27.2	Very low	27.2	Very low	116 Å²	116	122 Å²	122	71%	0.712	73%	0.727	S	S	*	*			trans	50.7	113.3	158.1	52.4	0	0	0	0	119.3
427	T	24.6	Very low	26.5	Very low	121 Å²	121	123 Å²	123	74%	0.742	74%	0.737	S	S	*	*				76.1	130.5	55.4	68	0	0	0	0	116.7
428	S	26.5	Very low	26	Very low	113 Å²	113	124.5 Å²	124.5	79%	0.79	75%	0.747	S	S	*	*			trans	64.9	146.6	166.6	34.7	0	0	0	0	118.6
429	S	26.9	Very low	25.8	Very low	100 Å²	100	124.9 Å²	124.9	70%	0.699	75%	0.753	S	S	*	*			cis	-172.6	143.9	-13.1	48.7	0	0	0	0	113.9
430	S	24	Very low	25.5	Very low	109 Å²	109	122.8 Å²	122.8	76%	0.762	76%	0.756	S	S	*	*			trans	70.1	152	142.5	-59.2	0	0	0	0	123.7
431	S	26.1	Very low	25.4	Very low	101 Å²	101	122.2 Å²	122.2	71%	0.706	76%	0.756	S	S	*	*			trans	64.6	130.5	168	48.4	0	0	0	0	117.5
432	T	23.8	Very low	25.4	Very low	129 Å²	129	124.2 Å²	124.2	79%	0.791	76%	0.763	S	S	*	*			cis	66.4	136.8	42.9	77.1	0	0	0	0	112.9
433	T	25.8	Very low	25.3	Very low	130 Å²	130	124.6 Å²	124.6	80%	0.798	76%	0.759	S	S	*	*			cis	-151.5	161.3	33.3	-47.4	0	0	0	0	111.5
434	T	21.9	Very low	25.3	Very low	118 Å²	118	124.5 Å²	124.5	72%	0.724	76%	0.758	S	S	*	*			trans	-92.5	165.9	173.6	36.1	0	0	0	0	113.6
435	T	24.2	Very low	25.3	Very low	124 Å²	124	128.3 Å²	128.3	76%	0.761	76%	0.761	S	S	*	*			trans	73.2	146.9	178.9	78.8	0	0	0	0	114.3
436	N	27.1	Very low	25.4	Very low	153 Å²	153	130.6 Å²	130.6	82%	0.818	77%	0.768	S	S	*	*			cis	-133.1	168.3	14.3	-100.6	-51.5	0	0	0	114.1
437	T	23.5	Very low	25.3	Very low	125 Å²	125	131 Å²	131	77%	0.767	76%	0.763	S	S	*	*			trans	-89.6	141.8	-178.7	50.1	0	0	0	0	114.3
438	I	26.3	Very low	25.4	Very low	163 Å²	163	133 Å²	133	84%	0.836	77%	0.769	S	S	*	*			trans	-136.5	118	148.3	-64.8	-172.8	0	0	0	110.4
439	V	28.5	Very low	25.5	Very low	123 Å²	123	137.7 Å²	137.7	75%	0.745	77%	0.769	S	S	*	*			trans	25.9	134.6	142.9	-164	0	0	0	0	121.4
440	S	23.8	Very low	25.4	Very low	105 Å²	105	139.9 Å²	139.9	73%	0.734	77%	0.774	S	S	*	*			trans	-11.8	154.4	142.9	-48.7	0	0	0	0	118.3
441	S	24.9	Very low	25.7	Very low	101 Å²	101	142.5 Å²	142.5	71%	0.706	77%	0.773	S	S	*	*			cis	-172.5	160.9	-1.2	38.2	0	0	0	0	108.5
442	D	26.8	Very low	25.6	Very low	156 Å²	156	144.5 Å²	144.5	83%	0.834	77%	0.772	S	S	*	*			trans	-165.1	145.1	131.6	-103.4	-24.4	0	0	0	112.9
443	N	22.8	Very low	25.9	Very low	156 Å²	156	145.2 Å²	145.2	83%	0.834	77%	0.765	S	S	*	*			trans	-111	125.8	165.3	-93.5	-40.7	0	0	0	107.5
444	T	25.3	Very low	25.8	Very low	118 Å²	118	146 Å²	146	72%	0.724	77%	0.765	S	S	*	*			trans	-165.5	143.9	147.6	10.3	0	0	0	0	113.3
445	Y	24.4	Very low	26.1	Very low	193 Å²	193	143.5 Å²	143.5	76%	0.757	76%	0.762	S	S	*	*			trans	28.5	118.4	159.8	-60.6	-70.5	0	0	0	120.8
446	Q	29.9	Very low	26.3	Very low	188 Å²	188	142.7 Å²	142.7	88%	0.879	76%	0.762	S	S	*	*				-145.6	151.3	93.3	-106.7	179.2	36.4	0	0	111.8
447	M	23.6	Very low	26.4	Very low	124 Å²	124	142.4 Å²	142.4	61%	0.611	76%	0.761	S	S	*	*			trans	-99.1	162.7	169.3	-63.6	-171	-175.5	0	0	109.5
448	N	27.9	Very low	27	Very low	163 Å²	163	146 Å²	146	87%	0.872	77%	0.768	S	S	*	*			trans	-144.4	152.6	135.9	-107.1	-38.2	0	0	0	111.2
449	R	28.3	Very low	27.1	Very low	212 Å²	212	147.1 Å²	147.1	80%	0.8	77%	0.77	S	S	*	*			trans	-117.6	169.6	178.7	-63.9	-172.6	-173.6	-172	3.8	110.1
450	N	23.7	Very low	27.3	Very low	147 Å²	147	149.4 Å²	149.4	79%	0.786	78%	0.777	S	S	*	*			trans	-75.6	-179.6	178.9	-57.2	-33.6	0	0	0	112.9
451	H	30.4	Very low	27.5	Very low	163 Å²	163	147.2 Å²	147.2	76%	0.755	77%	0.77	S	S	*	*			trans	88.9	133.3	177.3	-60.9	-92.4	0	0	0	115.7
452	E	25.7	Very low	27.9	Very low	144 Å²	144	149.8 Å²	149.8	67%	0.673	77%	0.774	S	S	*	*			cis	-165.8	169.5	-18.1	-130.9	179.6	139.4	0	0	113
453	H	29.4	Very low	28	Very low	143 Å²	143	147.7 Å²	147.7	66%	0.662	76%	0.763	S	S	*	*			trans	69.5	99.5	151.9	-89.4	60.2	0	0	0	123.1
454	N	23.9	Very low	28.4	Very low	147 Å²	147	146.5 Å²	146.5	79%	0.786	75%	0.753	S	S	*	*				59.7	123.8	115	-61.2	-23.4	0	0	0	124.2
455	G	27.8	Very low	28.6	Very low	65 Å²	65	147.1 Å²	147.1	67%	0.67	75%	0.751	S	S	*	*			trans	153.4	106.3	152.6	0	0	0	0	0	111.5
456	S	28.3	Very low	28.8	Very low	107 Å²	107	144.8 Å²	144.8	75%	0.748	75%	0.745	S	S	*	*				59.6	120.6	66.8	74.9	0	0	0	0	113.7
457	D	29.4	Very low	28.8	Very low	148 Å²	148	142 Å²	142	79%	0.791	74%	0.735	S	S	*	*			cis	-155.8	160.2	3.4	-80.3	-41.3	0	0	0	110.7
458	Q	36	Very low	29.1	Very low	199 Å²	199	144 Å²	144	93%	0.93	74%	0.74	S	S	*	*				172.4	159.1	117.1	-91.6	-173.5	25.5	0	0	112.7
459	Q	28	Very low	28.9	Very low	187 Å²	187	142.8 Å²	142.8	87%	0.874	73%	0.734	S	S	*	*			trans	-156.4	131.4	-156.9	-175.9	178.4	27.5	0	0	113.9
460	I	32.1	Very low	29	Very low	172 Å²	172	141 Å²	141	88%	0.882	73%	0.732	S	S	*	*			trans	-144.7	136.4	161.7	-52.1	178.3	0	0	0	106.8
461	G	28.3	Very low	28.9	Very low	58 Å²	58	139.7 Å²	139.7	60%	0.598	73%	0.734	S	S	*	*			cis	154.6	158.5	-4.9	0	0	0	0	0	111.3
462	I	33.1	Very low	28.9	Very low	155 Å²	155	139.6 Å²	139.6	80%	0.795	74%	0.738	S	S	*	*			trans	71.5	126.1	170.1	-63.6	171.6	0	0	0	115.3
463	N	28.8	Very low	28.9	Very low	113 Å²	113	141.5 Å²	141.5	60%	0.604	74%	0.744	S	S	*	*			cis	-156.3	132.3	-10.9	-110.4	-13.7	0	0	0	110.2
464	Q	30.9	Very low	28.7	Very low	130 Å²	130	141 Å²	141	61%	0.607	75%	0.745	S	S	*	*				66.5	135.9	99.3	-81.3	-168.4	93.9	0	0	115.3
465	L	29.6	Very low	28.7	Very low	131 Å²	131	140.7 Å²	140.7	69%	0.686	74%	0.744	S	S	*	*			cis	-141	138	31.4	-72	164.3	0	0	0	111.8
466	K	28.8	Very low	28.7	Very low	144 Å²	144	146.9 Å²	146.9	63%	0.626	75%	0.752	S	S	*	*				73.6	123.8	80.5	-133.1	175	-78.7	163.3	0	111.9
467	L	31.3	Very low	28.6	Very low	131 Å²	131	149.3 Å²	149.3	69%	0.686	76%	0.756	S	S	*	*				-158.1	144.3	53.8	-77.2	148.8	0	0	0	114.8
468	K	29.3	Very low	28.4	Very low	165 Å²	165	147.1 Å²	147.1	72%	0.717	75%	0.752	S	S	*	*				33.6	147.3	129.4	-58.1	176.9	-171.9	172.7	0	120.1
469	N	24.6	Very low	28	Very low	138 Å²	138	143.8 Å²	143.8	74%	0.738	75%	0.747	S	S	*	*			cis	-171.2	171	-1.6	-98.7	-9	0	0	0	105.3
470	K	29.1	Very low	27.9	Very low	175 Å²	175	140.1 Å²	140.1	76%	0.761	74%	0.743	S	S	*	*			cis	-163.6	146.3	20.6	-145.2	176.7	-175.7	-178.9	0	108.2
471	S	22.6	Very low	27.7	Very low	119 Å²	119	140.3 Å²	140.3	83%	0.832	74%	0.742	S	S	*	*			trans	-93.7	147.9	161.9	-53	0	0	0	0	110.8
472	I	29.9	Very low	27.7	Very low	161 Å²	161	146.7 Å²	146.7	83%	0.826	75%	0.753	S	S	*	*			trans	-122.2	157.9	163	-65.8	-177.6	0	0	0	107.9
473	K	25.4	Very low	27.5	Very low	184 Å²	184	146.7 Å²	146.7	80%	0.8	76%	0.755	S	S	*	*			trans	-122.6	162.4	-152.1	-139.3	179.1	-173.6	-179.1	0	111.5
474	L	24.8	Very low	27.3	Very low	133 Å²	133	148.9 Å²	148.9	70%	0.696	77%	0.767	S	S	*	*			trans	83.2	98.5	155.9	-60.3	161.3	0	0	0	120.7
475	N	23.9	Very low	27.1	Very low	140 Å²	140	148.5 Å²	148.5	75%	0.749	77%	0.773	S	S	*	*				80.8	149.3	116	-65.1	7.5	0	0	0	123.3
476	K	28.8	Very low	26.9	Very low	195 Å²	195	149.1 Å²	149.1	85%	0.848	78%	0.777	S	S	*	*			trans	78.6	129.3	175.2	-58.9	-178.2	-178.7	-179.6	0	114
477	L	25.3	Very low	26.9	Very low	158 Å²	158	149.3 Å²	149.3	83%	0.827	78%	0.784	S	S	*	*			cis	-145.7	179.3	2.2	-112.9	161.6	0	0	0	112
478	S	25.3	Very low	26.7	Very low	101 Å²	101	151.3 Å²	151.3	71%	0.706	79%	0.79	S	S	*	*			trans	-80.7	158.2	-165.1	45.7	0	0	0	0	116.2
479	P	28.7	Very low	26.5	Very low	129 Å²	129	148.2 Å²	148.2	84%	0.838	78%	0.784	S	S	*	*			trans	-90	156	-173.7	36.5	-36.5	0	0	0	114.5
480	S	24.3	Very low	26.5	Very low	111 Å²	111	147 Å²	147	78%	0.776	78%	0.782	S	S	*	*			trans	-152.6	135.8	160.9	-176.1	0	0	0	0	111.2
481	M	29.3	Very low	26.3	Very low	175 Å²	175	145.9 Å²	145.9	86%	0.862	78%	0.779	S	S	*	*			trans	154.3	109.4	150	-83	-93	79.7	0	0	108
482	K	28.3	Very low	26.5	Very low	192 Å²	192	146.6 Å²	146.6	84%	0.835	77%	0.769	S	S	*	*			trans	-122.7	131.3	166	-85.2	-170.5	174.1	-174.7	0	108.9
483	N	28.8	Very low	26.4	Very low	156 Å²	156	145.9 Å²	145.9	83%	0.834	76%	0.762	S	S	*	*			trans	42.6	117.2	153.3	-57.2	18.6	0	0	0	119.2
484	N	23.8	Very low	26.5	Very low	159 Å²	159	144.8 Å²	144.8	85%	0.85	77%	0.765	S	S	*	*			trans	-62	157.4	149.3	-88.8	-23.4	0	0	0	111.2
485	V	26.6	Very low	26.8	Very low	122 Å²	122	145.7 Å²	145.7	74%	0.739	77%	0.771	S	S	*	*				173.9	113.7	107.6	156.3	0	0	0	0	109.2
486	N	26.5	Very low	27.2	Very low	144 Å²	144	144.1 Å²	144.1	77%	0.77	77%	0.768	S	S	*	*				-168.4	157.3	125.7	-133.8	-24	0	0	0	114.4
487	L	28.8	Very low	27.3	Very low	148 Å²	148	141.5 Å²	141.5	78%	0.775	76%	0.763	S	S	*	*			trans	43.2	85.9	157.2	-107.3	68.2	0	0	0	122.5
488	H	26.2	Very low	27.4	Very low	173 Å²	173	140 Å²	140	80%	0.801	76%	0.756	S	S	*	*				42.9	129.5	101.2	-136.2	21.9	0	0	0	122.7
489	V	25	Very low	27.4	Very low	100 Å²	100	140.8 Å²	140.8	61%	0.606	75%	0.752	S	S	*	*			trans	79.5	115.3	149.8	-147	0	0	0	0	121.6
490	T	25	Very low	27.6	Very low	112 Å²	112	145.2 Å²	145.2	69%	0.687	76%	0.758	S	S	*	*			trans	59.5	147	150.4	56.4	0	0	0	0	120.4
491	E	26	Very low	27.8	Very low	151 Å²	151	149 Å²	149	71%	0.706	76%	0.756	S	S	*	*			cis	-162.7	171.5	-5.2	-127.1	162.3	-155.9	0	0	112.9
492	H	26.8	Very low	27.8	Very low	135 Å²	135	152.3 Å²	152.3	63%	0.625	76%	0.758	S	S	*	*			trans	64.9	121.2	150.8	-80.2	-67.2	0	0	0	123.6
493	H	26.1	Very low	27.8	Very low	146 Å²	146	148.6 Å²	148.6	68%	0.676	74%	0.742	S	S	*	*			trans	64.3	107.5	145.4	-59.3	-53.3	0	0	0	121
494	N	28.9	Very low	27.9	Very low	161 Å²	161	152 Å²	152	86%	0.861	75%	0.745	S	S	*	*				-173.7	132.8	84.9	-88.9	-55	0	0	0	111.9
495	D	30.2	Very low	28.2	Very low	152 Å²	152	149.5 Å²	149.5	81%	0.813	74%	0.74	S	S	*	*			trans	-100.6	145	169.1	-132.5	-40.4	0	0	0	108.3
496	P	33.7	Very low	28.2	Very low	106 Å²	106	147.3 Å²	147.3	69%	0.688	72%	0.724	S	S	*	*				-152.2	141	110.8	36	-18.9	0	0	0	116.4
497	N	28.9	Very low	28.4	Very low	140 Å²	140	149.2 Å²	149.2	75%	0.749	73%	0.726	S	S	*	*			trans	47.6	143.9	135.3	-75.6	-45.3	0	0	0	120.9
498	N	27.8	Very low	28.4	Very low	126 Å²	126	148.7 Å²	148.7	67%	0.674	72%	0.719	S	S	*	*			cis	-158	155.4	21	-145.9	-24.9	0	0	0	114
499	N	26.4	Very low	28.6	Very low	118 Å²	118	147.7 Å²	147.7	63%	0.631	72%	0.715	S	S	*	*			trans	-4.6	137.4	161.9	-82	-81.1	0	0	0	121.4
500	K	32.6	Very low	29	Very low	223 Å²	223	149.4 Å²	149.4	97%	0.97	72%	0.721	S	S	*	*				-126.8	98	128.5	-83.1	-173.7	178.9	173.2	0	110.8
501	R	28.5	Very low	29.2	Very low	190 Å²	190	150.7 Å²	150.7	72%	0.717	72%	0.723	S	S	*	*			trans	-109.7	137.6	169.6	-174.9	179.3	-177.6	-176.5	3.4	109
502	R	28.4	Very low	29.9	Very low	244 Å²	244	148.7 Å²	148.7	92%	0.921	72%	0.724	S	S	*	*			trans	-115.7	125.2	158.1	-94.7	-172.5	168.1	-175.9	-4.4	109
503	K	29.2	Very low	30.1	Very low	114 Å²	114	149.5 Å²	149.5	50%	0.496	73%	0.732	S	S	.	*			trans	-87.8	166	165.7	-62.7	178.7	167.8	-168.3	0	109.2	N506	K503-N506 PolarHBondContact NZ-OD1 3.26Å
504	Y	30.4	Very low	30.4	Very low	229 Å²	229	150 Å²	150	90%	0.898	74%	0.74	S	S	*	*				-162.4	150.4	115.2	-86.8	-67.6	0	0	0	107.1
505	S	30.9	Very low	30.4	Very low	105 Å²	105	145.5 Å²	145.5	73%	0.734	73%	0.732	S	S	*	*			cis	-132.2	162.5	2.2	-167.7	0	0	0	0	111.7
506	N	26.5	Very low	30.6	Very low	77 Å²	77	147.5 Å²	147.5	41%	0.412	73%	0.733	S	S	.	*			trans	-102.1	170	174.4	-43.5	-28.9	0	0	0	111.2	K503 E508	K503-N506 PolarHBondContact NZ-OD1 3.26Å; N506-E508 HydrophobicContact CB-CG 4.46Å; N506-E508 VanDerWaalsContact CB-OE1 3.29Å; N506-E508 WeakPolarHBondContact CB-OE1 3.35Å; N506-E508 PolarHBondContact ND2-OE1 3.44Å
507	K	31.2	Very low	30.3	Very low	184 Å²	184	149.3 Å²	149.3	80%	0.8	74%	0.735	S	S	*	*				-151.4	134.6	117.3	-85.9	-171	175.8	-164.5	0	106.2
508	E	27.9	Very low	30.2	Very low	136 Å²	136	150.2 Å²	150.2	64%	0.636	74%	0.737	S	S	*	*			cis	69.1	136.9	42.5	-61.6	162	-136.5	0	0	110.3	N506	N506-E508 HydrophobicContact CB-CG 4.46Å; N506-E508 VanDerWaalsContact CB-OE1 3.29Å; N506-E508 WeakPolarHBondContact CB-OE1 3.35Å; N506-E508 PolarHBondContact ND2-OE1 3.44Å
509	E	30.5	Very low	30.1	Very low	153 Å²	153	151.5 Å²	151.5	72%	0.715	74%	0.744	S	S	*	*			cis	-134.2	166.1	21	-67.2	84.7	-123.3	0	0	110.8
510	D	32.7	Very low	30.2	Very low	136 Å²	136	149.7 Å²	149.7	73%	0.727	75%	0.753	S	S	*	*			cis	-173.2	164.3	-15.6	175.8	42.7	0	0	0	112.7
511	N	30.1	Very low	29.8	Very low	138 Å²	138	146.6 Å²	146.6	74%	0.738	75%	0.747	S	S	*	*			trans	68.4	149	160.2	-94.1	-48.1	0	0	0	126.8
512	P	39.5	Very low	29.7	Very low	110 Å²	110	143.9 Å²	143.9	71%	0.714	75%	0.747	S	S	*	*			trans	-126.9	-171.7	-173.7	46.9	-33.6	0	0	0	116.4
513	N	32.3	Very low	29.6	Very low	152 Å²	152	139.7 Å²	139.7	81%	0.813	74%	0.738	S	S	*	*			trans	-158.9	170.6	149	-135.4	-7.6	0	0	0	116.1
514	D	31.8	Very low	29.4	Very low	157 Å²	157	141.4 Å²	141.4	84%	0.84	75%	0.751	S	S	*	*			trans	-52.6	166.1	-178.1	-67.1	-45.2	0	0	0	117.8
515	G	29.8	Very low	29.3	Very low	66 Å²	66	138 Å²	138	68%	0.68	74%	0.741	S	S	*	*			cis	155.5	166.8	-5.5	0	0	0	0	0	114.8
516	K	33.2	Very low	29.2	Very low	194 Å²	194	139.8 Å²	139.8	84%	0.843	75%	0.748	S	S	*	*			trans	72.8	120.8	162.8	-74.3	178.2	174.5	171.9	0	123.4
517	I	26.6	Very low	29.3	Very low	144 Å²	144	141.1 Å²	141.1	74%	0.738	76%	0.755	S	S	*	*				87.7	115	122.7	-68.9	174.7	0	0	0	122.4
518	M	27.5	Very low	29.1	Very low	158 Å²	158	139.2 Å²	139.2	78%	0.778	76%	0.758	S	S	*	*			trans	69.2	120.2	143.3	-68.3	-72.8	-166.6	0	0	124.4
519	N	25.7	Very low	29.1	Very low	153 Å²	153	139 Å²	139	82%	0.818	77%	0.766	S	S	*	*			trans	35.6	119	131.1	-63.3	-2.5	0	0	0	121.7
520	G	28.2	Very low	28.8	Very low	80 Å²	80	138.2 Å²	138.2	83%	0.825	77%	0.767	S	S	*	*			trans	-143.2	137.6	153.4	0	0	0	0	0	110.7
521	N	24.9	Very low	28.5	Very low	158 Å²	158	137.3 Å²	137.3	85%	0.845	77%	0.77	S	S	*	*			trans	-99.4	159.8	-178.6	-93.3	-21.6	0	0	0	112.5
522	N	26.1	Very low	28.3	Very low	134 Å²	134	139.8 Å²	139.8	72%	0.717	77%	0.77	S	S	*	*			trans	83.4	118.8	156.5	-71.2	-19.3	0	0	0	121.2
523	Q	26.2	Very low	28	Very low	155 Å²	155	141.7 Å²	141.7	72%	0.724	78%	0.775	S	S	*	*				91.1	125.8	129.4	-73.8	178.1	46.4	0	0	121.9
524	L	24.8	Very low	27.7	Very low	150 Å²	150	140.8 Å²	140.8	79%	0.785	77%	0.77	S	S	*	*			trans	66.9	88.6	140.2	-63.8	169.4	0	0	0	119.5
525	K	29.1	Very low	27.5	Very low	157 Å²	157	140.4 Å²	140.4	68%	0.683	77%	0.768	S	S	*	*				-163.3	138.1	114.1	-111.4	160.1	167	-76.9	0	111.5	D527	K525-D527 WeakPolarHBondContact CD-OD2 3.24Å; K525-D527 IonicContact NZ-OD1 2.69Å; K525-D527 PolarHBondContact NZ-OD1 3.12Å; K525-D527 IonicContact NZ-OD2 3.48Å; K525-D527 PolarHBondContact NZ-OD2 3.47Å
526	V	29.3	Very low	27.6	Very low	144 Å²	144	145.7 Å²	145.7	87%	0.873	78%	0.781	S	S	*	*			trans	-127.8	83.6	160.8	-177.7	0	0	0	0	105
527	D	27.8	Very low	27.5	Very low	105 Å²	105	139.6 Å²	139.6	56%	0.561	77%	0.772	S	S	*	*			trans	-77.6	148.3	175.4	-68.8	-44.8	0	0	0	109.9	K525	K525-D527 WeakPolarHBondContact CD-OD2 3.24Å; K525-D527 IonicContact NZ-OD1 2.69Å; K525-D527 PolarHBondContact NZ-OD1 3.12Å; K525-D527 IonicContact NZ-OD2 3.48Å; K525-D527 PolarHBondContact NZ-OD2 3.47Å
528	V	27.5	Very low	27.6	Very low	143 Å²	143	140.9 Å²	140.9	87%	0.867	78%	0.781	S	S	*	*			trans	-93.2	112.2	-177.8	176.7	0	0	0	0	109.8
529	T	27.7	Very low	27.9	Very low	131 Å²	131	137.8 Å²	137.8	80%	0.804	77%	0.767	S	S	*	*			trans	-151.7	152.2	163.7	17.3	0	0	0	0	112.7
530	N	24.2	Very low	28.5	Very low	137 Å²	137	135.5 Å²	135.5	73%	0.733	76%	0.759	S	S	*	*			trans	-58.7	146.6	-179.9	-52.8	-26.8	0	0	0	113.4	Y532	N530-Y532 HydrophobicContact CB-CD2 4.18Å; N530-Y532 HydrophobicContact CB-CE2 4.48Å
531	C	27.1	Very low	28.8	Very low	117 Å²	117	136.7 Å²	136.7	79%	0.791	75%	0.746	S	S	*	*			trans	-118.6	98	150	55.2	0	0	0	0	108.7
532	Y	25.3	Very low	29.5	Very low	190 Å²	190	132.1 Å²	132.1	75%	0.745	72%	0.722	S	S	*	*			trans	-84.6	124.4	155.3	-77.1	-95.1	0	0	0	106.6	N530	N530-Y532 HydrophobicContact CB-CD2 4.18Å; N530-Y532 HydrophobicContact CB-CE2 4.48Å
533	D	33.2	Very low	29.9	Very low	150 Å²	150	132.1 Å²	132.1	80%	0.802	72%	0.722	S	S	*	*			trans	-134.9	136.3	160.1	-76.4	-63.4	0	0	0	107.1
534	N	26.3	Very low	30.4	Very low	133 Å²	133	127.4 Å²	127.4	71%	0.711	70%	0.701	S	S	*	*			trans	-102.3	-175.2	-176.1	-63.9	-59.2	0	0	0	111
535	D	26.2	Very low	30.9	Very low	150 Å²	150	128.4 Å²	128.4	80%	0.802	70%	0.702	S	S	*	*			trans	70	82.1	154.4	-52.3	-36.2	0	0	0	117.4
536	D	31.6	Very low	31	Very low	177 Å²	177	125.1 Å²	125.1	95%	0.947	69%	0.692	S	S	*	*	S	Bend		-159.3	108.7	125.6	-112.5	-24.8	0	0	0	112.2
537	G	31.6	Very low	31.2	Very low	65 Å²	65	124.6 Å²	124.6	67%	0.67	69%	0.685	S	S	*	*			trans	91.5	80	151.7	0	0	0	0	0	121.5	D539	G537-D539 VanDerWaalsContact C-N 3.32Å; G537-D539 PolarHBondContact O-N 3.22Å
538	D	28.9	Very low	31.3	Very low	172 Å²	172	125.3 Å²	125.3	92%	0.92	69%	0.688	S	S	*	*			trans	50	-5.1	134	-95.3	11.5	0	0	0	124	V540	D538-V540 PolarHBondContact O-N 3.24Å
539	D	34.8	Very low	31.5	Very low	92 Å²	92	123.6 Å²	123.6	49%	0.492	67%	0.674	S	S	.	*			trans	-91.2	88	170	-92	-40.8	0	0	0	109.3	G537 D541 K691	G537-D539 VanDerWaalsContact C-N 3.32Å; G537-D539 PolarHBondContact O-N 3.22Å; D539-D541 PolarHBondContact O-N 3.05Å; D539-D541 VanDerWaalsContact O-N 3.1Å; D539-K691 IonicContact OD1-NZ 2.71Å; D539-K691 IonicContact OD2-NZ 2.64Å; D539-K691 PolarHBondContact OD2-NZ 3.41Å
540	V	37	Very low	31.6	Very low	105 Å²	105	123.7 Å²	123.7	64%	0.636	67%	0.67	S	S	*	*			trans	-70.7	100.6	172.3	-179.5	0	0	0	0	109.5	D538 D542	D538-V540 PolarHBondContact O-N 3.24Å; V540-D542 PolarHBondContact O-N 3.45Å
541	D	34.6	Very low	32	Very low	105 Å²	105	120 Å²	120	56%	0.561	65%	0.65	S	S	*	*			trans	-67.3	80.5	165.3	-76.5	-38.7	0	0	0	109.3	D539 D543	D539-D541 PolarHBondContact O-N 3.05Å; D539-D541 VanDerWaalsContact O-N 3.1Å; D541-D543 PolarHBondContact O-N 2.88Å
542	D	39.3	Very low	32.1	Very low	63 Å²	63	119.1 Å²	119.1	34%	0.337	64%	0.638	S	S	.	*			trans	-69.4	82.8	166.5	-86.6	-60.4	0	0	0	108.8	V540 D544 R732 V734	V540-D542 PolarHBondContact O-N 3.45Å; D542-D544 PolarHBondContact O-N 3.27Å; D542-R732 IonicContact OD2-CZ 2.94Å; D542-R732 VanDerWaalsContact OD2-CZ 3.22Å; D542-R732 IonicContact OD2-NH1 3.69Å; D542-R732 PolarHBondContact OD2-NH1 3.23Å; D542-R732 IonicContact OD2-NH2 3.53Å; D542-R732 PolarHBondContact OD2-NH2 2.97Å; D542-R732 VanDerWaalsContact OD2-NH2 3.09Å; D542-V734 HydrophobicContact CB-CG1 4.25Å; D542-V734 HydrophobicContact CB-CG2 4.37Å; D542-V734 WeakPolarHBondContact OD1-CG1 3.44Å
543	D	34.7	Very low	32.4	Very low	133 Å²	133	115.7 Å²	115.7	71%	0.711	63%	0.632	S	S	*	*			trans	-63.6	80.5	169	-77.9	-36.2	0	0	0	110.2	D541 E545	D541-D543 PolarHBondContact O-N 2.88Å; D543-E545 VanDerWaalsContact C-N 3.31Å; D543-E545 PolarHBondContact O-N 2.82Å
544	D	36.5	Very low	32.4	Very low	56 Å²	56	113.4 Å²	113.4	30%	0.299	62%	0.62	S	S	.	*			trans	-68	92.3	157.5	-88.9	-37.1	0	0	0	107.3	D542 D546 K733 R737	D542-D544 PolarHBondContact O-N 3.27Å; D544-D546 PolarHBondContact O-N 3.44Å; D544-K733 WeakPolarHBondContact OD2-CB 3.46Å; D544-R737 IonicContact OD1-NH2 3.7Å; D544-R737 PolarHBondContact OD1-NH2 3.47Å
545	E	36.4	Very low	32.7	Very low	171 Å²	171	109.6 Å²	109.6	80%	0.799	60%	0.6	S	S	*	*			trans	-63.8	55.6	175.3	-70.7	-162.6	156.3	0	0	113.4	D543 D547	D543-E545 VanDerWaalsContact C-N 3.31Å; D543-E545 PolarHBondContact O-N 2.82Å; E545-D547 VanDerWaalsContact C-N 3.28Å
546	D	31.6	Very low	33	Very low	89 Å²	89	105.1 Å²	105.1	48%	0.476	58%	0.577	S	S	.	*			trans	-97.7	42.2	168.8	-65.3	2.1	0	0	0	109.2	D544 D548 K733	D544-D546 PolarHBondContact O-N 3.44Å; D546-D548 PolarHBondContact O-N 2.94Å; D546-K733 IonicContact OD1-NZ 3.13Å; D546-K733 PolarHBondContact OD1-NZ 3.45Å; D546-K733 IonicContact OD2-NZ 2.93Å; D546-K733 PolarHBondContact OD2-NZ 3.44Å
547	D	32.8	Very low	33	Very low	133 Å²	133	103.1 Å²	103.1	71%	0.711	57%	0.565	S	S	*	*			trans	-81.6	15	-176.5	-155.4	35	0	0	0	113.3	E545	E545-D547 VanDerWaalsContact C-N 3.28Å
548	D	30.7	Very low	33.1	Very low	120 Å²	120	103.8 Å²	103.8	64%	0.642	56%	0.556	S	S	*	*	S	Bend	trans	-92.1	115.8	169.5	-83.4	-46.7	0	0	0	110	D546	D546-D548 PolarHBondContact O-N 2.94Å
549	N	31.3	Very low	33.1	Very low	107 Å²	107	102.3 Å²	102.3	57%	0.572	55%	0.548	S	S	*	.			trans	90.5	25.9	168.7	-45.2	-82.4	0	0	0	119.7	D551 K647	N549-D551 PolarHBondContact O-N 3.33Å; N549-K647 WeakPolarHBondContact OD1-CE 3.48Å; N549-K647 PolarHBondContact OD1-NZ 3.38Å
550	N	29.5	Very low	32.9	Very low	133 Å²	133	103 Å²	103	71%	0.711	55%	0.552	S	S	*	*			trans	-75.6	57.7	154	-73.9	-57.3	0	0	0	111.3	D552	N550-D552 VanDerWaalsContact C-N 3.35Å
551	D	32.2	Very low	32.9	Very low	58 Å²	58	105.7 Å²	105.7	31%	0.31	56%	0.558	S	S	.	*			trans	-86.2	-2.2	175.2	-86.5	-57.4	0	0	0	113.1	N549 K647	N549-D551 PolarHBondContact O-N 3.33Å; D551-K647 WeakPolarHBondContact OD2-CD 3.36Å; D551-K647 WeakPolarHBondContact OD2-CE 3.22Å; D551-K647 IonicContact OD2-NZ 3.91Å; D551-K647 PolarHBondContact OD2-NZ 3.14Å
552	D	29.4	Very low	33.1	Very low	100 Å²	100	106.3 Å²	106.3	54%	0.535	56%	0.557	S	S	.	*	S	Bend	trans	-92	127.8	-178.7	-84.4	-30.9	0	0	0	112.5	N550 D554 K616	N550-D552 VanDerWaalsContact C-N 3.35Å; D552-D554 PolarHBondContact O-N 3.05Å; D552-K616 IonicContact OD1-NZ 3.35Å; D552-K616 PolarHBondContact OD1-NZ 3.1Å; D552-K616 IonicContact OD2-NZ 2.79Å; D552-K616 PolarHBondContact OD2-NZ 3.42Å
553	D	32.2	Very low	33.1	Very low	117 Å²	117	107.6 Å²	107.6	63%	0.626	56%	0.563	S	S	*	*	S	Bend	trans	61.9	23.1	177.1	-69.7	-48	0	0	0	118	D555 R607	D553-D555 PolarHBondContact O-N 3.35Å; D553-R607 IonicContact OD1-CZ 2.65Å; D553-R607 IonicContact OD1-NH1 2.63Å; D553-R607 PolarHBondContact OD1-NH1 2.67Å; D553-R607 IonicContact OD1-NH2 3.37Å; D553-R607 PolarHBondContact OD1-NH2 2.98Å
554	D	33.8	Very low	33.3	Very low	102 Å²	102	107.1 Å²	107.1	55%	0.545	56%	0.559	S	S	.	*			trans	-71.3	59.8	153.8	-159.6	43.5	0	0	0	109.9	D552 V556 R648	D552-D554 PolarHBondContact O-N 3.05Å; D554-V556 PolarHBondContact O-N 3.16Å; D554-R648 IonicContact OD2-CZ 3.08Å; D554-R648 IonicContact OD2-NH1 3.68Å; D554-R648 PolarHBondContact OD2-NH1 2.98Å; D554-R648 VanDerWaalsContact OD2-NH1 3.13Å; D554-R648 IonicContact OD2-NH2 3.86Å
555	D	31.9	Very low	33.3	Very low	54 Å²	54	108.2 Å²	108.2	29%	0.289	57%	0.565	S	S	.	*			trans	-67.5	97	-175.4	-169.9	16.4	0	0	0	109.3	D553 I557 R600	D553-D555 PolarHBondContact O-N 3.35Å; D555-I557 PolarHBondContact O-N 3.19Å; D555-R600 IonicContact OD1-CZ 2.89Å; D555-R600 IonicContact OD1-NE 3.63Å; D555-R600 PolarHBondContact OD1-NE 3.3Å; D555-R600 IonicContact OD1-NH2 2.7Å; D555-R600 PolarHBondContact OD1-NH2 3.33Å; D555-R600 IonicContact OD2-CZ 2.58Å; D555-R600 IonicContact OD2-NE 2.71Å; D555-R600 PolarHBondContact OD2-NE 2.95Å; D555-R600 IonicContact OD2-NH2 3.58Å
556	V	32.8	Very low	33.1	Very low	55 Å²	55	104.6 Å²	104.6	33%	0.333	55%	0.551	S	S	.	*			trans	-38.1	106.6	-167.4	177.5	0	0	0	0	111.8	D554 V558 R600	D554-V556 PolarHBondContact O-N 3.16Å; V556-V558 HydrophobicContact CG1-CG2 4.23Å; V556-V558 PolarHBondContact O-N 3.28Å; V556-R600 PolarHBondContact O-NH1 3.04Å; V556-R600 PolarHBondContact O-NH2 2.88Å
557	I	32	Very low	33.5	Very low	135 Å²	135	106.2 Å²	106.2	69%	0.692	57%	0.566	S	S	*	*			trans	-64.3	98.8	154.4	-60.9	176.3	0	0	0	104.1	D555 D559	D555-I557 PolarHBondContact O-N 3.19Å; I557-D559 PolarHBondContact O-N 2.92Å
558	V	33.1	Very low	33.9	Very low	80 Å²	80	108.9 Å²	108.9	49%	0.485	57%	0.571	S	S	.	*			trans	-62.3	123.4	154	-175.8	0	0	0	0	103.5	V556 D560	V556-V558 HydrophobicContact CG1-CG2 4.23Å; V556-V558 PolarHBondContact O-N 3.28Å; V558-D560 HydrophobicContact CG1-CB 4.39Å; V558-D560 PolarHBondContact O-N 3.46Å
559	D	29.4	Very low	34	Very low	140 Å²	140	110.8 Å²	110.8	75%	0.749	58%	0.577	S	S	*	*			trans	-71.3	45.9	171.2	-68.4	-61.2	0	0	0	110.6	I557 E561	I557-D559 PolarHBondContact O-N 2.92Å; D559-E561 VanDerWaalsContact C-N 3.33Å; D559-E561 PolarHBondContact O-N 3.49Å; D559-E561 VanDerWaalsContact O-N 3.12Å
560	D	30.4	Very low	34.1	Very low	106 Å²	106	109.9 Å²	109.9	57%	0.567	57%	0.571	S	S	*	*			trans	-61.2	102.2	148.9	-73.3	-23.9	0	0	0	104.3	V558 E562	V558-D560 HydrophobicContact CG1-CB 4.39Å; V558-D560 PolarHBondContact O-N 3.46Å; D560-E562 PolarHBondContact O-N 3.11Å
561	E	36.2	Very low	34.5	Very low	163 Å²	163	108.6 Å²	108.6	76%	0.762	57%	0.57	S	S	*	*			trans	-48.6	116.5	-173.8	-67.3	-170.8	140.2	0	0	110.2	D559 I563	D559-E561 VanDerWaalsContact C-N 3.33Å; D559-E561 PolarHBondContact O-N 3.49Å; D559-E561 VanDerWaalsContact O-N 3.12Å; E561-I563 HydrophobicContact CB-CG1 4.41Å; E561-I563 WeakPolarHBondContact O-CG1 3.4Å; E561-I563 PolarHBondContact O-N 3.03Å
562	E	38.8	Very low	35.1	Very low	117 Å²	117	114 Å²	114	55%	0.547	59%	0.594	S	S	.	*			trans	-74.1	83.5	178.6	-164.2	179.7	-157	0	0	108.2	D560 I564 K586	D560-E562 PolarHBondContact O-N 3.11Å; E562-I564 HydrophobicContact CG-CD1 4.37Å; E562-I564 HydrophobicContact CG-CG1 3.77Å; E562-I564 PolarHBondContact O-N 3.39Å; E562-K586 IonicContact OE1-NZ 2.76Å; E562-K586 PolarHBondContact OE1-NZ 2.77Å
563	I	39.2	Very low	35.8	Very low	91 Å²	91	115.8 Å²	115.8	47%	0.467	60%	0.603	S	S	.	*			trans	-70.1	79.9	173.7	-42.2	-178	0	0	0	107.7	E561 L565 V589	E561-I563 HydrophobicContact CB-CG1 4.41Å; E561-I563 WeakPolarHBondContact O-CG1 3.4Å; E561-I563 PolarHBondContact O-N 3.03Å; I563-L565 HydrophobicContact CG2-CD2 3.61Å; I563-L565 HydrophobicContact CG2-CG 3.74Å; I563-L565 PolarHBondContact O-N 3.26Å; I563-V589 HydrophobicContact CD1-CG2 4.45Å
564	I	39	Very low	36.2	Very low	122 Å²	122	114.7 Å²	114.7	63%	0.626	60%	0.597	S	S	*	*			trans	-68.3	79.9	167.2	-53.6	-179.5	0	0	0	106.8	E562 D566	E562-I564 HydrophobicContact CG-CD1 4.37Å; E562-I564 HydrophobicContact CG-CG1 3.77Å; E562-I564 PolarHBondContact O-N 3.39Å; I564-D566 PolarHBondContact O-N 3.42Å
565	L	36.2	Very low	36.8	Very low	80 Å²	80	113.9 Å²	113.9	42%	0.419	60%	0.597	S	S	.	*			trans	-65.4	90.6	167.8	-68.7	-178.6	0	0	0	107.9	I563 P567	I563-L565 HydrophobicContact CG2-CD2 3.61Å; I563-L565 HydrophobicContact CG2-CG 3.74Å; I563-L565 PolarHBondContact O-N 3.26Å; L565-P567 WeakPolarHBondContact O-CD 3.29Å
566	D	33.7	Very low	37.8	Very low	95 Å²	95	120.5 Å²	120.5	51%	0.508	63%	0.628	S	S	.	*			trans	-56.7	117.6	173.2	-164.4	1.6	0	0	0	108	I564 K568 Q569	I564-D566 PolarHBondContact O-N 3.42Å; D566-K568 PolarHBondContact O-N 3.4Å; D566-Q569 PolarHBondContact O-N 3.33Å
567	P	38.7	Very low	38.9	Very low	122 Å²	122	123.6 Å²	123.6	79%	0.792	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	12.5	-166.2	-26.6	36.1	0	0	0	117.1	L565	L565-P567 WeakPolarHBondContact O-CD 3.29Å
568	K	41.5	Very low	40.7	Very low	189 Å²	189	119.2 Å²	119.2	82%	0.822	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-6	177.2	-64.2	174.9	-178.3	170.1	0	113.1	D566	D566-K568 PolarHBondContact O-N 3.4Å
569	Q	32.7	Very low	43	Very low	161 Å²	161	119 Å²	119	75%	0.752	61%	0.614	S	S	*	*	S	Bend	trans	-113.7	95.4	178	-62.1	-159.8	24.1	0	0	112.6	D566	D566-Q569 PolarHBondContact O-N 3.33Å
570	N	33	Very low	45.7	Very low	87 Å²	87	116.2 Å²	116.2	47%	0.465	59%	0.594	S	S	.	*			trans	54.4	106	165	-164.8	4.8	0	0	0	118.6	E572	N570-E572 VanDerWaalsContact C-N 3.3Å; N570-E572 PolarHBondContact O-N 3.09Å; N570-E572 WeakPolarHBondContact OD1-CB 3.47Å; N570-E572 PolarHBondContact OD1-N 3.21Å
571	P	38.5	Very low	48.4	Very low	106 Å²	106	111.2 Å²	111.2	69%	0.688	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-76.2	-8.8	175.7	33.9	-36.5	0	0	0	114.8	N573	P571-N573 VanDerWaalsContact C-N 3.31Å; P571-N573 PolarHBondContact O-N 3.41Å
572	E	45.5	Very low	50.6	Low	172 Å²	172	110 Å²	110	80%	0.804	57%	0.567	S	S	*	*	G	3₁₀ helix	trans	-83.6	0.7	-169.6	-59.6	-175.2	161.4	0	0	114.6	N570	N570-E572 VanDerWaalsContact C-N 3.3Å; N570-E572 PolarHBondContact O-N 3.09Å; N570-E572 WeakPolarHBondContact OD1-CB 3.47Å; N570-E572 PolarHBondContact OD1-N 3.21Å
573	N	42.5	Very low	52.7	Low	137 Å²	137	110 Å²	110	73%	0.733	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-122.9	33.9	-175.4	-140.2	-2.2	0	0	0	113.4	P571 P575	P571-N573 VanDerWaalsContact C-N 3.31Å; P571-N573 PolarHBondContact O-N 3.41Å; N573-P575 VanDerWaalsContact O-CD 3.26Å; N573-P575 WeakPolarHBondContact O-CD 3.28Å
574	I	41.3	Very low	54.8	Low	95 Å²	95	108.3 Å²	108.3	49%	0.487	57%	0.565	S	S	.	*			trans	-90.9	106.2	176.3	-64.2	174.5	0	0	0	108.8	I578	I574-I578 HydrophobicContact CG2-CD1 4.25Å
575	P	45.6	Very low	56.7	Low	84 Å²	84	107.1 Å²	107.1	55%	0.545	56%	0.56	S	S	.	*			trans	-63.1	144.4	171.6	25.5	-33.7	0	0	0	110.9	N573 N577 I578	N573-P575 VanDerWaalsContact O-CD 3.26Å; N573-P575 WeakPolarHBondContact O-CD 3.28Å; P575-N577 PolarHBondContact O-N 3.44Å; P575-I578 HydrophobicContact CG-CD1 3.87Å; P575-I578 HydrophobicContact CG-CG1 4.13Å
576	M	53.4	Low	58.8	Low	193 Å²	193	107.5 Å²	107.5	95%	0.951	56%	0.559	S	S	*	*	S	Bend	trans	-64.6	-6.1	-167.9	-77.2	-171.2	-78.3	0	0	116.5
577	N	56.8	Low	61.3	Low	121 Å²	121	107.8 Å²	107.8	65%	0.647	55%	0.553	S	S	*	*			trans	-111.5	56.7	179.1	-74.9	-25.9	0	0	0	112	P575	P575-N577 PolarHBondContact O-N 3.44Å
578	I	68.5	Low	63.5	Low	43 Å²	43	103.7 Å²	103.7	22%	0.221	52%	0.523	C	S	.	.			trans	-113.5	120.2	170.5	-61.6	-173.3	0	0	0	110.1	I574 P575 Y587 F588	I574-I578 HydrophobicContact CG2-CD1 4.25Å; P575-I578 HydrophobicContact CG-CD1 3.87Å; P575-I578 HydrophobicContact CG-CG1 4.13Å; I578-Y587 HydrophobicContact CG2-CD1 3.75Å; I578-Y587 HydrophobicContact CG2-CG 4.1Å; I578-F588 CarbonylContact C-O 3.55Å; I578-F588 WeakPolarHBondContact CA-O 3.44Å
579	F	82.3	Confident	65.3	Low	76 Å²	76	99.2 Å²	99.2	33%	0.333	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	118.1	-177.3	-63.7	-91.6	0	0	0	110.2	F588 A591 L594	F579-F588 PolarHBondContact N-O 3.17Å; F579-F588 PolarHBondContact O-N 2.78Å; F579-A591 HydrophobicContact CD1-CB 3.88Å; F579-A591 HydrophobicContact CD2-CB 4.47Å; F579-A591 VanDerWaalsContact CD2-N 3.28Å; F579-A591 HydrophobicContact CE1-CB 3.66Å; F579-A591 HydrophobicContact CE2-CB 4.28Å; F579-A591 HydrophobicContact CG-CB 4.29Å; F579-A591 HydrophobicContact CZ-CB 3.88Å; F579-L594 HydrophobicContact CB-CB 3.94Å; F579-L594 HydrophobicContact CB-CD2 3.84Å
580	K	86.4	Confident	67.7	Low	80 Å²	80	94.7 Å²	94.7	35%	0.348	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	134.8	-177.1	-171.9	-176.3	179.7	-165.5	0	112	N585 Y587 L594	K580-N585 WeakPolarHBondContact CE-OD1 3.24Å; K580-N585 PolarHBondContact NZ-OD1 3.03Å; K580-Y587 HydrophobicContact CB-CD1 3.88Å; K580-Y587 HydrophobicContact CB-CE1 3.73Å; K580-Y587 HydrophobicContact CD-CE1 3.67Å; K580-Y587 WeakPolarHBondContact CE-OH 3.45Å; K580-Y587 HydrophobicContact CG-CD1 3.92Å; K580-Y587 HydrophobicContact CG-CE1 3.49Å; K580-Y587 VanDerWaalsContact CG-CE1 3.49Å; K580-L594 WeakPolarHBondContact O-CD2 3.31Å
581	C	86.1	Confident	70.1	Confident	1 Å²	1	93 Å²	93	1%	0.007	49%	0.493	C	S	.	.	P	Polyproline II helix	trans	-79.5	116.9	166.2	-176.3	0	0	0	0	110.8	L583 N585 K586 F588 L594 H597 H602	C581-L583 PolarHBondContact O-N 3.11Å; C581-L583 PolarHBondContact SG-N 3.2Å; C581-L583 VanDerWaalsContact SG-N 3.42Å; C581-N585 WeakPolarHBondContact O-CA 3.39Å; C581-N585 PolarHBondContact O-N 2.82Å; C581-K586 PolarHBondContact N-O 3.4Å; C581-F588 HydrophobicContact CB-CE2 4.16Å; C581-L594 VanDerWaalsContact CA-CD1 3.49Å; C581-L594 HydrophobicContact CB-CD1 3.58Å; C581-H597 WeakPolarHBondContact CB-NE2 3.22Å; C581-H597 VanDerWaalsContact SG-CD2 3.57Å; C581-H597 PolarHBondContact SG-NE2 3.01Å; C581-H602 VanDerWaalsContact SG-CD2 3.58Å; C581-H602 PolarHBondContact SG-NE2 2.98Å
582	N	82.5	Confident	72.2	Confident	138 Å²	138	93.2 Å²	93.2	74%	0.738	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-5.5	178.6	-63.6	-25.1	0	0	0	113.8
583	L	82.9	Confident	74.1	Confident	118 Å²	118	85.5 Å²	85.5	62%	0.618	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-19	-176.3	-58.7	176.4	0	0	0	113.8	C581 H602	C581-L583 PolarHBondContact O-N 3.11Å; C581-L583 PolarHBondContact SG-N 3.2Å; C581-L583 VanDerWaalsContact SG-N 3.42Å; L583-H602 HydrophobicContact CD1-CB 3.6Å
584	C	84.2	Confident	76.2	Confident	54 Å²	54	80.6 Å²	80.6	37%	0.365	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.6	10.1	171	69	0	0	0	0	115.4	K586 H597 H602	C584-K586 PolarHBondContact O-N 2.92Å; C584-K586 VanDerWaalsContact O-N 3.08Å; C584-H597 PolarHBondContact SG-CE1 3.06Å; C584-H597 PolarHBondContact SG-NE2 3.38Å; C584-H602 PolarHBondContact SG-NE2 3.44Å; C584-H602 VanDerWaalsContact SG-NE2 3.36Å
585	N	77.7	Confident	78.1	Confident	97 Å²	97	81.3 Å²	81.3	52%	0.519	43%	0.426	S	S	.	.			trans	59.3	9.2	-177.1	-67.5	-45.1	0	0	0	116.4	K580 C581 Y587	K580-N585 WeakPolarHBondContact CE-OD1 3.24Å; K580-N585 PolarHBondContact NZ-OD1 3.03Å; C581-N585 WeakPolarHBondContact O-CA 3.39Å; C581-N585 PolarHBondContact O-N 2.82Å; N585-Y587 VanDerWaalsContact O-CD2 3.31Å; N585-Y587 WeakPolarHBondContact O-CD2 3.43Å; N585-Y587 WeakPolarHBondContact O-CE2 3.44Å
586	K	81	Confident	79.7	Confident	89 Å²	89	78.1 Å²	78.1	39%	0.387	41%	0.405	S	S	.	.			trans	-63.3	155.9	168.6	-76.7	-164.4	174.1	-164.7	0	111.9	E562 C581 C584 F588	E562-K586 IonicContact OE1-NZ 2.76Å; E562-K586 PolarHBondContact OE1-NZ 2.77Å; C581-K586 PolarHBondContact N-O 3.4Å; C584-K586 PolarHBondContact O-N 2.92Å; C584-K586 VanDerWaalsContact O-N 3.08Å; K586-F588 HydrophobicContact CB-CE2 3.67Å; K586-F588 HydrophobicContact CB-CZ 3.74Å; K586-F588 HydrophobicContact CD-CZ 4.34Å
587	Y	85	Confident	81.2	Confident	101 Å²	101	70 Å²	70	40%	0.396	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	142.8	-174.5	-70.7	-79.4	0	0	0	110.8	I578 K580 N585	I578-Y587 HydrophobicContact CG2-CD1 3.75Å; I578-Y587 HydrophobicContact CG2-CG 4.1Å; K580-Y587 HydrophobicContact CB-CD1 3.88Å; K580-Y587 HydrophobicContact CB-CE1 3.73Å; K580-Y587 HydrophobicContact CD-CE1 3.67Å; K580-Y587 WeakPolarHBondContact CE-OH 3.45Å; K580-Y587 HydrophobicContact CG-CD1 3.92Å; K580-Y587 HydrophobicContact CG-CE1 3.49Å; K580-Y587 VanDerWaalsContact CG-CE1 3.49Å; N585-Y587 VanDerWaalsContact O-CD2 3.31Å; N585-Y587 WeakPolarHBondContact O-CD2 3.43Å; N585-Y587 WeakPolarHBondContact O-CE2 3.44Å
588	F	85.9	Confident	82.3	Confident	36 Å²	36	66 Å²	66	16%	0.158	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	137.6	-173.6	-60.4	-83	0	0	0	111.2	I578 F579 C581 K586 T590 L594 H597	I578-F588 CarbonylContact C-O 3.55Å; I578-F588 WeakPolarHBondContact CA-O 3.44Å; F579-F588 PolarHBondContact N-O 3.17Å; F579-F588 PolarHBondContact O-N 2.78Å; C581-F588 HydrophobicContact CB-CE2 4.16Å; K586-F588 HydrophobicContact CB-CE2 3.67Å; K586-F588 HydrophobicContact CB-CZ 3.74Å; K586-F588 HydrophobicContact CD-CZ 4.34Å; F588-T590 PolarHBondContact O-N 3.27Å; F588-L594 HydrophobicContact CB-CB 4.21Å; F588-L594 HydrophobicContact CD2-CB 3.98Å; F588-L594 HydrophobicContact CD2-CD1 3.91Å; F588-L594 HydrophobicContact CE2-CD1 4.19Å; F588-L594 HydrophobicContact CG-CB 4.25Å; F588-H597 HydrophobicContact CD1-CB 4.4Å; F588-H597 HydrophobicContact CE1-CB 3.68Å; F588-H597 AromaticContact CE1-CG 3.95Å; F588-H597 HydrophobicContact CE2-CB 3.82Å; F588-H597 AromaticContact CE2-CD2 3.36Å; F588-H597 WeakPolarHBondContact CE2-CD2 3.35Å; F588-H597 AromaticContact CE2-CG 3.51Å; F588-H597 HydrophobicContact CZ-CB 3.37Å; F588-H597 AromaticContact CZ-CD2 3.5Å; F588-H597 AromaticContact CZ-CG 3.13Å; F588-H597 AromaticContact CZ-ND1 3.58Å
589	V	78.5	Confident	82.8	Confident	95 Å²	95	65.7 Å²	65.7	58%	0.576	34%	0.341	S	S	*	.	S	Bend	trans	-71.5	-16.5	-179.3	-170.5	0	0	0	0	112.3	I563	I563-V589 HydrophobicContact CD1-CG2 4.45Å
590	T	83.3	Confident	82.5	Confident	65 Å²	65	66.5 Å²	66.5	40%	0.399	34%	0.342	S	S	.	.	S	Bend	trans	-132.7	150.1	178.6	72.9	0	0	0	0	112.4	F588 H592 G593 L594	F588-T590 PolarHBondContact O-N 3.27Å; T590-H592 PolarHBondContact O-N 3.42Å; T590-G593 PolarHBondContact O-N 3.3Å; T590-G593 PolarHBondContact OG1-N 3.35Å; T590-L594 PolarHBondContact O-N 2.86Å; T590-L594 VanDerWaalsContact O-N 3.14Å
591	A	84.8	Confident	82.2	Confident	53 Å²	53	65.5 Å²	65.5	44%	0.438	35%	0.349	S	S	.	.	H	α-helix	trans	-59.5	-34.6	174	0	0	0	0	0	112.1	F579 L594 E595	F579-A591 HydrophobicContact CD1-CB 3.88Å; F579-A591 HydrophobicContact CD2-CB 4.47Å; F579-A591 VanDerWaalsContact CD2-N 3.28Å; F579-A591 HydrophobicContact CE1-CB 3.66Å; F579-A591 HydrophobicContact CE2-CB 4.28Å; F579-A591 HydrophobicContact CG-CB 4.29Å; F579-A591 HydrophobicContact CZ-CB 3.88Å; A591-L594 PolarHBondContact O-N 3.48Å; A591-E595 WeakPolarHBondContact O-CB 3.27Å; A591-E595 PolarHBondContact O-N 3.21Å
592	H	82.9	Confident	81.9	Confident	109 Å²	109	67.7 Å²	67.7	51%	0.505	36%	0.358	S	S	.	.	H	α-helix	trans	-71.3	-37	176.7	-170.2	56.6	0	0	0	112.1	T590 L594 E595 V596	T590-H592 PolarHBondContact O-N 3.42Å; H592-L594 VanDerWaalsContact C-N 3.31Å; H592-L594 PolarHBondContact O-N 2.95Å; H592-E595 IonicContact CE1-OE2 3.56Å; H592-E595 IonicContact CG-OE2 3.4Å; H592-E595 IonicContact ND1-OE2 2.81Å; H592-E595 PolarHBondContact ND1-OE2 3.19Å; H592-E595 WeakPolarHBondContact O-CB 3.38Å; H592-E595 PolarHBondContact O-N 2.78Å; H592-V596 WeakPolarHBondContact O-CB 3.26Å; H592-V596 VanDerWaalsContact O-CG2 3.24Å; H592-V596 WeakPolarHBondContact O-CG2 3.07Å; H592-V596 PolarHBondContact O-N 3.37Å
593	G	84.4	Confident	81.2	Confident	11 Å²	11	64.5 Å²	64.5	11%	0.113	34%	0.342	C	S	.	.	H	α-helix	trans	-58	-43.7	170.8	0	0	0	0	0	111.8	T590 H597	T590-G593 PolarHBondContact O-N 3.3Å; T590-G593 PolarHBondContact OG1-N 3.35Å; G593-H597 VanDerWaalsContact O-CB 3.22Å; G593-H597 WeakPolarHBondContact O-CB 3.39Å; G593-H597 PolarHBondContact O-N 3.35Å
594	L	85.8	Confident	80.2	Confident	34 Å²	34	66.6 Å²	66.6	18%	0.178	35%	0.354	C	S	.	.	H	α-helix	trans	-63.4	-45.6	172.7	173.5	60.4	0	0	0	112.5	F579 K580 C581 F588 T590 A591 H592 H597 V598	F579-L594 HydrophobicContact CB-CB 3.94Å; F579-L594 HydrophobicContact CB-CD2 3.84Å; K580-L594 WeakPolarHBondContact O-CD2 3.31Å; C581-L594 VanDerWaalsContact CA-CD1 3.49Å; C581-L594 HydrophobicContact CB-CD1 3.58Å; F588-L594 HydrophobicContact CB-CB 4.21Å; F588-L594 HydrophobicContact CD2-CB 3.98Å; F588-L594 HydrophobicContact CD2-CD1 3.91Å; F588-L594 HydrophobicContact CE2-CD1 4.19Å; F588-L594 HydrophobicContact CG-CB 4.25Å; T590-L594 PolarHBondContact O-N 2.86Å; T590-L594 VanDerWaalsContact O-N 3.14Å; A591-L594 PolarHBondContact O-N 3.48Å; H592-L594 VanDerWaalsContact C-N 3.31Å; H592-L594 PolarHBondContact O-N 2.95Å; L594-H597 PolarHBondContact O-N 2.81Å; L594-V598 HydrophobicContact CD1-CG2 3.86Å; L594-V598 HydrophobicContact CG-CG2 4.46Å; L594-V598 WeakPolarHBondContact O-CG2 3.12Å; L594-V598 PolarHBondContact O-N 3.01Å
595	E	82.3	Confident	78.9	Confident	109 Å²	109	67.1 Å²	67.1	51%	0.509	37%	0.368	S	S	.	.	H	α-helix	trans	-58	-49.8	177.4	-175	-156.9	165.6	0	0	111.7	A591 H592 H597 V598 R599	A591-E595 WeakPolarHBondContact O-CB 3.27Å; A591-E595 PolarHBondContact O-N 3.21Å; H592-E595 IonicContact CE1-OE2 3.56Å; H592-E595 IonicContact CG-OE2 3.4Å; H592-E595 IonicContact ND1-OE2 2.81Å; H592-E595 PolarHBondContact ND1-OE2 3.19Å; H592-E595 WeakPolarHBondContact O-CB 3.38Å; H592-E595 PolarHBondContact O-N 2.78Å; E595-H597 VanDerWaalsContact C-N 3.32Å; E595-H597 PolarHBondContact O-N 2.89Å; E595-V598 PolarHBondContact O-N 3.19Å; E595-R599 WeakPolarHBondContact O-CB 3.32Å; E595-R599 PolarHBondContact O-N 2.95Å
596	V	78.7	Confident	78.2	Confident	17 Å²	17	70.2 Å²	70.2	10%	0.103	38%	0.376	C	S	.	.	H	α-helix	trans	-59.3	-44.2	176.1	166.2	0	0	0	0	110.7	H592 R599 R600 H620	H592-V596 WeakPolarHBondContact O-CB 3.26Å; H592-V596 VanDerWaalsContact O-CG2 3.24Å; H592-V596 WeakPolarHBondContact O-CG2 3.07Å; H592-V596 PolarHBondContact O-N 3.37Å; V596-R599 PolarHBondContact O-N 2.78Å; V596-R600 WeakPolarHBondContact O-CB 3.46Å; V596-R600 PolarHBondContact O-N 3.37Å; V596-H620 VanDerWaalsContact CG1-CE1 3.45Å; V596-H620 WeakPolarHBondContact CG1-CE1 3.49Å
597	H	85.2	Confident	77.8	Confident	24 Å²	24	70.2 Å²	70.2	11%	0.111	37%	0.374	C	S	.	.	H	α-helix	trans	-63.1	-49.2	177.2	162.9	68.9	0	0	0	112.1	C581 C584 F588 G593 L594 E595 R599 R600 A601 H602	C581-H597 WeakPolarHBondContact CB-NE2 3.22Å; C581-H597 VanDerWaalsContact SG-CD2 3.57Å; C581-H597 PolarHBondContact SG-NE2 3.01Å; C584-H597 PolarHBondContact SG-CE1 3.06Å; C584-H597 PolarHBondContact SG-NE2 3.38Å; F588-H597 HydrophobicContact CD1-CB 4.4Å; F588-H597 HydrophobicContact CE1-CB 3.68Å; F588-H597 AromaticContact CE1-CG 3.95Å; F588-H597 HydrophobicContact CE2-CB 3.82Å; F588-H597 AromaticContact CE2-CD2 3.36Å; F588-H597 WeakPolarHBondContact CE2-CD2 3.35Å; F588-H597 AromaticContact CE2-CG 3.51Å; F588-H597 HydrophobicContact CZ-CB 3.37Å; F588-H597 AromaticContact CZ-CD2 3.5Å; F588-H597 AromaticContact CZ-CG 3.13Å; F588-H597 AromaticContact CZ-ND1 3.58Å; G593-H597 VanDerWaalsContact O-CB 3.22Å; G593-H597 WeakPolarHBondContact O-CB 3.39Å; G593-H597 PolarHBondContact O-N 3.35Å; L594-H597 PolarHBondContact O-N 2.81Å; E595-H597 VanDerWaalsContact C-N 3.32Å; E595-H597 PolarHBondContact O-N 2.89Å; H597-R599 VanDerWaalsContact C-N 3.28Å; H597-R599 PolarHBondContact O-N 2.93Å; H597-R600 PolarHBondContact O-N 3.37Å; H597-A601 VanDerWaalsContact O-CB 3.3Å; H597-A601 WeakPolarHBondContact O-CB 3.44Å; H597-A601 PolarHBondContact O-N 3.4Å; H597-H602 AromaticContact CE1-NE2 3.75Å; H597-H602 AromaticContact NE2-CD2 3.67Å; H597-H602 AromaticContact NE2-NE2 3.35Å; H597-H602 PolarHBondContact NE2-NE2 3.31Å
598	V	80.6	Confident	77.4	Confident	37 Å²	37	69.4 Å²	69.4	22%	0.224	38%	0.381	C	S	.	.	H	α-helix	trans	-59.9	-41.6	177.3	171.3	0	0	0	0	110.4	L594 E595 H602 N603	L594-V598 HydrophobicContact CD1-CG2 3.86Å; L594-V598 HydrophobicContact CG-CG2 4.46Å; L594-V598 WeakPolarHBondContact O-CG2 3.12Å; L594-V598 PolarHBondContact O-N 3.01Å; E595-V598 PolarHBondContact O-N 3.19Å; V598-H602 HydrophobicContact CG1-CB 4.37Å; V598-H602 WeakPolarHBondContact O-CA 3.36Å; V598-H602 WeakPolarHBondContact O-CB 3.3Å; V598-H602 PolarHBondContact O-N 3.48Å; V598-N603 PolarHBondContact O-N 2.92Å; V598-N603 VanDerWaalsContact O-N 3.11Å
599	R	77.9	Confident	77.1	Confident	35 Å²	35	71.2 Å²	71.2	13%	0.132	39%	0.389	C	S	.	.	H	α-helix	trans	-66	-37.1	176.2	-178.7	169.8	44.7	65	-18.8	113.7	E595 V596 H597 G619 H620	E595-R599 WeakPolarHBondContact O-CB 3.32Å; E595-R599 PolarHBondContact O-N 2.95Å; V596-R599 PolarHBondContact O-N 2.78Å; H597-R599 VanDerWaalsContact C-N 3.28Å; H597-R599 PolarHBondContact O-N 2.93Å; R599-G619 PolarHBondContact NH1-O 2.85Å; R599-G619 PolarHBondContact NH2-O 2.69Å; R599-H620 PolarHBondContact NH2-CE1 3.4Å; R599-H620 PolarHBondContact NH2-ND1 3.39Å
600	R	76.9	Confident	77.5	Confident	93 Å²	93	70.8 Å²	70.8	35%	0.351	38%	0.381	S	S	.	.	H	α-helix	trans	-75.4	-47.2	176.1	-84.1	-179.7	164.8	154.4	-3.1	112.6	D555 V556 V596 H597 H620	D555-R600 IonicContact OD1-CZ 2.89Å; D555-R600 IonicContact OD1-NE 3.63Å; D555-R600 PolarHBondContact OD1-NE 3.3Å; D555-R600 IonicContact OD1-NH2 2.7Å; D555-R600 PolarHBondContact OD1-NH2 3.33Å; D555-R600 IonicContact OD2-CZ 2.58Å; D555-R600 IonicContact OD2-NE 2.71Å; D555-R600 PolarHBondContact OD2-NE 2.95Å; D555-R600 IonicContact OD2-NH2 3.58Å; V556-R600 PolarHBondContact O-NH1 3.04Å; V556-R600 PolarHBondContact O-NH2 2.88Å; V596-R600 WeakPolarHBondContact O-CB 3.46Å; V596-R600 PolarHBondContact O-N 3.37Å; H597-R600 PolarHBondContact O-N 3.37Å; R600-H620 PolarHBondContact NH2-NE2 2.84Å
601	A	79.8	Confident	77.8	Confident	60 Å²	60	67.7 Å²	67.7	50%	0.496	36%	0.362	S	S	.	.	H	α-helix	trans	-98.7	-18.8	-165.6	0	0	0	0	0	115.1	H597	H597-A601 VanDerWaalsContact O-CB 3.3Å; H597-A601 WeakPolarHBondContact O-CB 3.44Å; H597-A601 PolarHBondContact O-N 3.4Å
602	H	80.5	Confident	77.9	Confident	46 Å²	46	72.2 Å²	72.2	21%	0.213	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.8	-20.8	-168.7	-62	-49.1	0	0	0	115.5	C581 L583 C584 H597 V598 N604	C581-H602 VanDerWaalsContact SG-CD2 3.58Å; C581-H602 PolarHBondContact SG-NE2 2.98Å; L583-H602 HydrophobicContact CD1-CB 3.6Å; C584-H602 PolarHBondContact SG-NE2 3.44Å; C584-H602 VanDerWaalsContact SG-NE2 3.36Å; H597-H602 AromaticContact CE1-NE2 3.75Å; H597-H602 AromaticContact NE2-CD2 3.67Å; H597-H602 AromaticContact NE2-NE2 3.35Å; H597-H602 PolarHBondContact NE2-NE2 3.31Å; V598-H602 HydrophobicContact CG1-CB 4.37Å; V598-H602 WeakPolarHBondContact O-CA 3.36Å; V598-H602 WeakPolarHBondContact O-CB 3.3Å; V598-H602 PolarHBondContact O-N 3.48Å; H602-N604 PolarHBondContact O-N 3.1Å; H602-N604 PolarHBondContact O-OD1 3Å
603	N	66.9	Low	78.1	Confident	72 Å²	72	73.2 Å²	73.2	39%	0.385	38%	0.382	S	S	.	.	S	Bend	trans	-81.5	31.7	-179	-73.4	-2.1	0	0	0	114.5	V598 G605 K606	V598-N603 PolarHBondContact O-N 2.92Å; V598-N603 VanDerWaalsContact O-N 3.11Å; N603-G605 VanDerWaalsContact C-N 3.28Å; N603-G605 PolarHBondContact O-N 2.84Å; N603-K606 HydrophobicContact CB-CB 4.36Å; N603-K606 WeakPolarHBondContact O-CB 3.49Å; N603-K606 PolarHBondContact O-N 2.84Å
604	N	61.3	Low	78.3	Confident	162 Å²	162	75.3 Å²	75.3	87%	0.866	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.2	47.3	175.4	-69	2	0	0	0	114.9	H602 K606	H602-N604 PolarHBondContact O-N 3.1Å; H602-N604 PolarHBondContact O-OD1 3Å; N604-K606 VanDerWaalsContact C-N 3.34Å; N604-K606 PolarHBondContact O-N 3.2Å
605	G	58.3	Low	78.2	Confident	64 Å²	64	80.3 Å²	80.3	66%	0.66	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	8.2	177.5	0	0	0	0	0	116	N603 R607	N603-G605 VanDerWaalsContact C-N 3.28Å; N603-G605 PolarHBondContact O-N 2.84Å; G605-R607 PolarHBondContact O-N 3.19Å
606	K	62	Low	78.1	Confident	162 Å²	162	79.1 Å²	79.1	70%	0.704	41%	0.41	S	S	*	.			trans	-66.6	79.7	170.3	-71.6	-174.2	176.2	179.9	0	111.3	N603 N604 P608	N603-K606 HydrophobicContact CB-CB 4.36Å; N603-K606 WeakPolarHBondContact O-CB 3.49Å; N603-K606 PolarHBondContact O-N 2.84Å; N604-K606 VanDerWaalsContact C-N 3.34Å; N604-K606 PolarHBondContact O-N 3.2Å; K606-P608 WeakPolarHBondContact O-CD 3.45Å
607	R	73.8	Confident	78.4	Confident	90 Å²	90	81.1 Å²	81.1	34%	0.34	42%	0.422	S	S	.	.			trans	-83.5	101	168.3	-80.2	-175.6	165.4	-178.1	-4.7	107.7	D553 G605 F609 T617 F618	D553-R607 IonicContact OD1-CZ 2.65Å; D553-R607 IonicContact OD1-NH1 2.63Å; D553-R607 PolarHBondContact OD1-NH1 2.67Å; D553-R607 IonicContact OD1-NH2 3.37Å; D553-R607 PolarHBondContact OD1-NH2 2.98Å; G605-R607 PolarHBondContact O-N 3.19Å; R607-F609 PolarHBondContact O-N 3.13Å; R607-T617 VanDerWaalsContact CD-O 3.26Å; R607-T617 WeakPolarHBondContact CD-O 3.28Å; R607-T617 WeakPolarHBondContact O-CB 3.42Å; R607-F618 CarbonylContact C-O 3.59Å; R607-F618 WeakPolarHBondContact CA-O 3.42Å; R607-F618 VanDerWaalsContact CB-C 3.47Å; R607-F618 WeakPolarHBondContact CB-O 3.5Å
608	P	75.1	Confident	78.3	Confident	84 Å²	84	81.3 Å²	81.3	55%	0.545	42%	0.423	S	S	.	.			trans	-86.2	0.2	-161.7	34.4	-35.5	0	0	0	115.2	K606 F618	K606-P608 WeakPolarHBondContact O-CD 3.45Å; P608-F618 WeakPolarHBondContact CD-O 3.14Å
609	F	80.8	Confident	78.4	Confident	74 Å²	74	79.8 Å²	79.8	33%	0.325	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	100.2	-179.1	-60.9	-80.6	0	0	0	109.8	R607 T617 F618 G619 H620 A621 L624	R607-F609 PolarHBondContact O-N 3.13Å; F609-T617 CarbonylContact O-C 3.58Å; F609-F618 HydrophobicContact CB-CB 4.3Å; F609-F618 PolarHBondContact N-O 2.95Å; F609-F618 VanDerWaalsContact N-O 3.12Å; F609-F618 PolarHBondContact O-N 3.17Å; F609-G619 WeakPolarHBondContact CD2-O 3.18Å; F609-G619 WeakPolarHBondContact CE2-O 3.47Å; F609-H620 VanDerWaalsContact CD2-CA 3.48Å; F609-A621 HydrophobicContact CD1-CB 3.86Å; F609-A621 HydrophobicContact CE1-CB 3.67Å; F609-A621 HydrophobicContact CG-CB 4.4Å; F609-A621 HydrophobicContact CZ-CB 4.04Å; F609-L624 HydrophobicContact CB-CB 3.93Å; F609-L624 HydrophobicContact CB-CD2 3.86Å
610	E	86.3	Confident	78.6	Confident	85 Å²	85	79.5 Å²	79.5	40%	0.397	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	130.4	-174.7	-171.5	-174.3	154.2	0	0	112.6	Q612 T617	E610-Q612 PolarHBondContact O-N 3.45Å; E610-Q612 PolarHBondContact O-NE2 3.14Å; E610-T617 HydrophobicContact CB-CG2 4.09Å; E610-T617 HydrophobicContact CG-CG2 4.01Å
611	C	89.1	Confident	78.9	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	42%	0.419	C	S	.	.			trans	-74	116.2	173.3	-177.8	0	0	0	0	111.4	L613 C614 Q615 K616 F618 L624 H627 H631	C611-L613 PolarHBondContact O-N 3.25Å; C611-C614 PolarHBondContact O-N 2.92Å; C611-Q615 VanDerWaalsContact O-CA 3.28Å; C611-Q615 WeakPolarHBondContact O-CA 3.35Å; C611-Q615 PolarHBondContact O-N 3.26Å; C611-K616 PolarHBondContact N-O 2.85Å; C611-F618 HydrophobicContact CB-CE2 4.19Å; C611-L624 VanDerWaalsContact CA-CD1 3.5Å; C611-L624 HydrophobicContact CB-CD1 3.64Å; C611-H627 VanDerWaalsContact SG-CD2 3.56Å; C611-H627 PolarHBondContact SG-NE2 2.91Å; C611-H627 VanDerWaalsContact SG-NE2 3.4Å; C611-H631 PolarHBondContact SG-CD2 3.39Å; C611-H631 PolarHBondContact SG-NE2 2.93Å
612	Q	88.4	Confident	79.1	Confident	148 Å²	148	79.6 Å²	79.6	69%	0.692	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-5.3	-175.9	-54.7	-58.4	-73.7	0	0	114.1	E610	E610-Q612 PolarHBondContact O-N 3.45Å; E610-Q612 PolarHBondContact O-NE2 3.14Å
613	L	85.5	Confident	79.4	Confident	131 Å²	131	78 Å²	78	69%	0.686	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.1	-22.1	-179.2	-62.2	176.7	0	0	0	114	C611 H631	C611-L613 PolarHBondContact O-N 3.25Å; L613-H631 HydrophobicContact CD1-CB 3.55Å
614	C	88.5	Confident	80.4	Confident	54 Å²	54	75.7 Å²	75.7	37%	0.365	41%	0.407	S	S	.	.	T	Hydrogen-bonded Turn	trans	-142.1	3.6	178.4	72.3	0	0	0	0	115.4	C611 K616 H627 H631	C611-C614 PolarHBondContact O-N 2.92Å; C614-K616 PolarHBondContact O-N 2.93Å; C614-H627 PolarHBondContact SG-NE2 3.14Å; C614-H631 PolarHBondContact SG-NE2 2.93Å; C614-H631 VanDerWaalsContact SG-NE2 3.36Å
615	Q	83.7	Confident	81.5	Confident	139 Å²	139	75 Å²	75	65%	0.65	39%	0.393	S	S	*	.			trans	60.2	10.3	179.3	-57	176.5	-8.4	0	0	115.1	C611 T617	C611-Q615 VanDerWaalsContact O-CA 3.28Å; C611-Q615 WeakPolarHBondContact O-CA 3.35Å; C611-Q615 PolarHBondContact O-N 3.26Å; Q615-T617 PolarHBondContact O-N 3.09Å
616	K	82	Confident	82.7	Confident	84 Å²	84	75 Å²	75	37%	0.365	38%	0.376	S	S	.	.			trans	-60.9	131.1	165.7	-79.1	-175.7	168.3	-178.1	0	109.5	D552 C611 C614 F618	D552-K616 IonicContact OD1-NZ 3.35Å; D552-K616 PolarHBondContact OD1-NZ 3.1Å; D552-K616 IonicContact OD2-NZ 2.79Å; D552-K616 PolarHBondContact OD2-NZ 3.42Å; C611-K616 PolarHBondContact N-O 2.85Å; C614-K616 PolarHBondContact O-N 2.93Å; K616-F618 HydrophobicContact CB-CE2 3.67Å; K616-F618 HydrophobicContact CB-CZ 3.74Å; K616-F618 HydrophobicContact CD-CZ 4.39Å; K616-F618 VanDerWaalsContact O-CE2 3.28Å; K616-F618 WeakPolarHBondContact O-CE2 3.21Å
617	T	84.6	Confident	83.8	Confident	59 Å²	59	68.2 Å²	68.2	36%	0.362	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	143.4	179	50.1	0	0	0	0	111.2	R607 F609 E610 Q615	R607-T617 VanDerWaalsContact CD-O 3.26Å; R607-T617 WeakPolarHBondContact CD-O 3.28Å; R607-T617 WeakPolarHBondContact O-CB 3.42Å; F609-T617 CarbonylContact O-C 3.58Å; E610-T617 HydrophobicContact CB-CG2 4.09Å; E610-T617 HydrophobicContact CG-CG2 4.01Å; Q615-T617 PolarHBondContact O-N 3.09Å
618	F	83.5	Confident	84.2	Confident	28 Å²	28	67.6 Å²	67.6	12%	0.123	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	148.1	-175.5	-63.1	-82.1	0	0	0	112.3	R607 P608 F609 C611 K616 H620 L624 H627	R607-F618 CarbonylContact C-O 3.59Å; R607-F618 WeakPolarHBondContact CA-O 3.42Å; R607-F618 VanDerWaalsContact CB-C 3.47Å; R607-F618 WeakPolarHBondContact CB-O 3.5Å; P608-F618 WeakPolarHBondContact CD-O 3.14Å; F609-F618 HydrophobicContact CB-CB 4.3Å; F609-F618 PolarHBondContact N-O 2.95Å; F609-F618 VanDerWaalsContact N-O 3.12Å; F609-F618 PolarHBondContact O-N 3.17Å; C611-F618 HydrophobicContact CB-CE2 4.19Å; K616-F618 HydrophobicContact CB-CE2 3.67Å; K616-F618 HydrophobicContact CB-CZ 3.74Å; K616-F618 HydrophobicContact CD-CZ 4.39Å; K616-F618 VanDerWaalsContact O-CE2 3.28Å; K616-F618 WeakPolarHBondContact O-CE2 3.21Å; F618-H620 VanDerWaalsContact C-N 3.31Å; F618-L624 HydrophobicContact CB-CB 4.22Å; F618-L624 HydrophobicContact CD2-CB 4.07Å; F618-L624 HydrophobicContact CD2-CD1 3.94Å; F618-L624 HydrophobicContact CE2-CD1 4.28Å; F618-L624 HydrophobicContact CG-CB 4.33Å; F618-H627 HydrophobicContact CE1-CB 3.83Å; F618-H627 HydrophobicContact CE2-CB 3.84Å; F618-H627 AromaticContact CE2-CD2 3.31Å; F618-H627 WeakPolarHBondContact CE2-CD2 3.31Å; F618-H627 AromaticContact CE2-CG 3.52Å; F618-H627 AromaticContact CE2-NE2 3.99Å; F618-H627 HydrophobicContact CZ-CB 3.43Å; F618-H627 VanDerWaalsContact CZ-CB 3.43Å; F618-H627 AromaticContact CZ-CD2 3.45Å; F618-H627 VanDerWaalsContact CZ-CD2 3.45Å; F618-H627 WeakPolarHBondContact CZ-CD2 2.91Å; F618-H627 AromaticContact CZ-CG 3.15Å; F618-H627 AromaticContact CZ-ND1 3.6Å
619	G	82	Confident	84.5	Confident	6 Å²	6	64.7 Å²	64.7	6%	0.062	33%	0.329	C	S	.	.	S	Bend	trans	-67	-32.8	176.7	0	0	0	0	0	112.7	R599 F609	R599-G619 PolarHBondContact NH1-O 2.85Å; R599-G619 PolarHBondContact NH2-O 2.69Å; F609-G619 WeakPolarHBondContact CD2-O 3.18Å; F609-G619 WeakPolarHBondContact CE2-O 3.47Å
620	H	80.9	Confident	84.4	Confident	28 Å²	28	64 Å²	64	13%	0.13	33%	0.332	C	S	.	.	S	Bend	trans	-131.5	149.9	-172.8	-52.4	-87.7	0	0	0	112.3	V596 R599 R600 F609 F618 T622 S623 L624	V596-H620 VanDerWaalsContact CG1-CE1 3.45Å; V596-H620 WeakPolarHBondContact CG1-CE1 3.49Å; R599-H620 PolarHBondContact NH2-CE1 3.4Å; R599-H620 PolarHBondContact NH2-ND1 3.39Å; R600-H620 PolarHBondContact NH2-NE2 2.84Å; F609-H620 VanDerWaalsContact CD2-CA 3.48Å; F618-H620 VanDerWaalsContact C-N 3.31Å; H620-T622 WeakPolarHBondContact CB-OG1 3.39Å; H620-T622 PolarHBondContact O-N 3.06Å; H620-S623 WeakPolarHBondContact O-CB 3.36Å; H620-S623 PolarHBondContact O-N 3.14Å; H620-L624 PolarHBondContact O-N 3.27Å
621	A	84.2	Confident	84.1	Confident	53 Å²	53	63.6 Å²	63.6	44%	0.438	33%	0.329	S	S	.	.	H	α-helix	trans	-60.2	-31.9	172.6	0	0	0	0	0	112.8	F609 L624 Y625	F609-A621 HydrophobicContact CD1-CB 3.86Å; F609-A621 HydrophobicContact CE1-CB 3.67Å; F609-A621 HydrophobicContact CG-CB 4.4Å; F609-A621 HydrophobicContact CZ-CB 4.04Å; A621-L624 PolarHBondContact O-N 2.97Å; A621-Y625 WeakPolarHBondContact O-CB 3.44Å; A621-Y625 PolarHBondContact O-N 3.05Å
622	T	84.1	Confident	83.1	Confident	102 Å²	102	65.8 Å²	65.8	63%	0.626	34%	0.344	S	S	*	.	H	α-helix	trans	-66.3	-43.3	174.8	44.1	0	0	0	0	112	H620 Y625 Q626	H620-T622 WeakPolarHBondContact CB-OG1 3.39Å; H620-T622 PolarHBondContact O-N 3.06Å; T622-Y625 PolarHBondContact O-N 2.92Å; T622-Q626 VanDerWaalsContact O-CB 3.27Å; T622-Q626 WeakPolarHBondContact O-CB 3.45Å; T622-Q626 PolarHBondContact O-N 3.46Å
623	S	86.5	Confident	81.8	Confident	13 Å²	13	63.2 Å²	63.2	9%	0.091	33%	0.332	C	S	.	.	H	α-helix	trans	-64.8	-40.4	174.4	-53	0	0	0	0	111.8	H620 Q626 H627	H620-S623 WeakPolarHBondContact O-CB 3.36Å; H620-S623 PolarHBondContact O-N 3.14Å; S623-Q626 PolarHBondContact O-N 3.24Å; S623-H627 WeakPolarHBondContact O-CB 3.37Å; S623-H627 PolarHBondContact O-N 2.8Å
624	L	87.5	Confident	80.6	Confident	23 Å²	23	63.7 Å²	63.7	12%	0.12	34%	0.335	C	S	.	.	H	α-helix	trans	-61.2	-52.2	172.5	170.9	59.1	0	0	0	111.4	F609 C611 F618 H620 A621 Q626 H627 E628	F609-L624 HydrophobicContact CB-CB 3.93Å; F609-L624 HydrophobicContact CB-CD2 3.86Å; C611-L624 VanDerWaalsContact CA-CD1 3.5Å; C611-L624 HydrophobicContact CB-CD1 3.64Å; F618-L624 HydrophobicContact CB-CB 4.22Å; F618-L624 HydrophobicContact CD2-CB 4.07Å; F618-L624 HydrophobicContact CD2-CD1 3.94Å; F618-L624 HydrophobicContact CE2-CD1 4.28Å; F618-L624 HydrophobicContact CG-CB 4.33Å; H620-L624 PolarHBondContact O-N 3.27Å; A621-L624 PolarHBondContact O-N 2.97Å; L624-Q626 VanDerWaalsContact C-N 3.26Å; L624-Q626 PolarHBondContact O-N 3.29Å; L624-H627 CarbonylContact O-C 3.17Å; L624-H627 WeakPolarHBondContact O-CA 3.24Å; L624-H627 WeakPolarHBondContact O-CB 3.2Å; L624-H627 PolarHBondContact O-N 3.14Å; L624-E628 HydrophobicContact CD1-CG 3.94Å; L624-E628 HydrophobicContact CG-CG 4.37Å; L624-E628 WeakPolarHBondContact O-CG 3.34Å; L624-E628 PolarHBondContact O-N 3.33Å
625	Y	85.2	Confident	79	Confident	148 Å²	148	67.6 Å²	67.6	58%	0.58	34%	0.343	S	S	*	.	H	α-helix	trans	-59.5	-35.9	179.1	178.3	-95.7	0	0	0	113	A621 T622 R635	A621-Y625 WeakPolarHBondContact O-CB 3.44Å; A621-Y625 PolarHBondContact O-N 3.05Å; T622-Y625 PolarHBondContact O-N 2.92Å; Y625-R635 PolarHBondContact OH-NH1 3.42Å; Y625-R635 VanDerWaalsContact OH-NH1 3.09Å
626	Q	83	Confident	78.6	Confident	64 Å²	64	64.9 Å²	64.9	30%	0.299	33%	0.33	S	S	.	.	H	α-helix	trans	-67.1	-43.5	173.5	179.1	165.2	50.8	0	0	111.5	T622 S623 L624 S629 R648	T622-Q626 VanDerWaalsContact O-CB 3.27Å; T622-Q626 WeakPolarHBondContact O-CB 3.45Å; T622-Q626 PolarHBondContact O-N 3.46Å; S623-Q626 PolarHBondContact O-N 3.24Å; L624-Q626 VanDerWaalsContact C-N 3.26Å; L624-Q626 PolarHBondContact O-N 3.29Å; Q626-S629 WeakPolarHBondContact O-CB 3.47Å; Q626-S629 PolarHBondContact O-N 2.86Å; Q626-S629 PolarHBondContact O-OG 3.37Å; Q626-R648 VanDerWaalsContact NE2-NE 3.17Å
627	H	85.7	Confident	78.5	Confident	19 Å²	19	65.1 Å²	65.1	9%	0.088	33%	0.331	C	S	.	.	H	α-helix	trans	-66.6	-35.9	174.9	168	73.1	0	0	0	113	C611 C614 F618 S623 L624 S629 V630 H631	C611-H627 VanDerWaalsContact SG-CD2 3.56Å; C611-H627 PolarHBondContact SG-NE2 2.91Å; C611-H627 VanDerWaalsContact SG-NE2 3.4Å; C614-H627 PolarHBondContact SG-NE2 3.14Å; F618-H627 HydrophobicContact CE1-CB 3.83Å; F618-H627 HydrophobicContact CE2-CB 3.84Å; F618-H627 AromaticContact CE2-CD2 3.31Å; F618-H627 WeakPolarHBondContact CE2-CD2 3.31Å; F618-H627 AromaticContact CE2-CG 3.52Å; F618-H627 AromaticContact CE2-NE2 3.99Å; F618-H627 HydrophobicContact CZ-CB 3.43Å; F618-H627 VanDerWaalsContact CZ-CB 3.43Å; F618-H627 AromaticContact CZ-CD2 3.45Å; F618-H627 VanDerWaalsContact CZ-CD2 3.45Å; F618-H627 WeakPolarHBondContact CZ-CD2 2.91Å; F618-H627 AromaticContact CZ-CG 3.15Å; F618-H627 AromaticContact CZ-ND1 3.6Å; S623-H627 WeakPolarHBondContact O-CB 3.37Å; S623-H627 PolarHBondContact O-N 2.8Å; L624-H627 CarbonylContact O-C 3.17Å; L624-H627 WeakPolarHBondContact O-CA 3.24Å; L624-H627 WeakPolarHBondContact O-CB 3.2Å; L624-H627 PolarHBondContact O-N 3.14Å; H627-S629 PolarHBondContact O-N 2.77Å; H627-S629 VanDerWaalsContact O-N 3.14Å; H627-V630 WeakPolarHBondContact O-CB 3.45Å; H627-V630 WeakPolarHBondContact O-CG2 3.31Å; H627-V630 PolarHBondContact O-N 3.4Å; H627-H631 AromaticContact CE1-NE2 3.77Å; H627-H631 AromaticContact NE2-CD2 3.84Å; H627-H631 AromaticContact NE2-NE2 3.31Å; H627-H631 PolarHBondContact NE2-NE2 3.17Å
628	E	82.4	Confident	78.6	Confident	77 Å²	77	68.3 Å²	68.3	36%	0.36	34%	0.342	S	S	.	.	H	α-helix	trans	-60	-23.1	174.2	-75	175.9	161.7	0	0	112.6	L624 V630 H631 C632	L624-E628 HydrophobicContact CD1-CG 3.94Å; L624-E628 HydrophobicContact CG-CG 4.37Å; L624-E628 WeakPolarHBondContact O-CG 3.34Å; L624-E628 PolarHBondContact O-N 3.33Å; E628-V630 VanDerWaalsContact C-N 3.27Å; E628-V630 PolarHBondContact O-N 2.83Å; E628-H631 PolarHBondContact O-N 3.21Å; E628-C632 PolarHBondContact O-N 3.47Å
629	S	80.6	Confident	78.9	Confident	23 Å²	23	67.1 Å²	67.1	16%	0.161	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-66.9	-25.6	170.8	79	0	0	0	0	113.4	Q626 H627 H631 C632	Q626-S629 WeakPolarHBondContact O-CB 3.47Å; Q626-S629 PolarHBondContact O-N 2.86Å; Q626-S629 PolarHBondContact O-OG 3.37Å; H627-S629 PolarHBondContact O-N 2.77Å; H627-S629 VanDerWaalsContact O-N 3.14Å; S629-H631 PolarHBondContact O-N 2.95Å; S629-C632 CarbonylContact O-C 3.59Å; S629-C632 PolarHBondContact O-N 3.43Å; S629-C632 VanDerWaalsContact O-N 3.09Å
630	V	78.4	Confident	79.2	Confident	61 Å²	61	72.4 Å²	72.4	37%	0.37	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-65.2	-29	173.7	-173.4	0	0	0	0	111.1	H627 E628 K647	H627-V630 WeakPolarHBondContact O-CB 3.45Å; H627-V630 WeakPolarHBondContact O-CG2 3.31Å; H627-V630 PolarHBondContact O-N 3.4Å; E628-V630 VanDerWaalsContact C-N 3.27Å; E628-V630 PolarHBondContact O-N 2.83Å; V630-K647 HydrophobicContact CG2-CD 4Å
631	H	80.4	Confident	79.5	Confident	75 Å²	75	76.9 Å²	76.9	35%	0.347	39%	0.394	S	S	.	.	G	3₁₀ helix	trans	-86.9	-4.1	174.9	-63.3	-56.2	0	0	0	114	C611 L613 C614 H627 E628 S629	C611-H631 PolarHBondContact SG-CD2 3.39Å; C611-H631 PolarHBondContact SG-NE2 2.93Å; L613-H631 HydrophobicContact CD1-CB 3.55Å; C614-H631 PolarHBondContact SG-NE2 2.93Å; C614-H631 VanDerWaalsContact SG-NE2 3.36Å; H627-H631 AromaticContact CE1-NE2 3.77Å; H627-H631 AromaticContact NE2-CD2 3.84Å; H627-H631 AromaticContact NE2-NE2 3.31Å; H627-H631 PolarHBondContact NE2-NE2 3.17Å; E628-H631 PolarHBondContact O-N 3.21Å; S629-H631 PolarHBondContact O-N 2.95Å
632	C	68.2	Low	79.8	Confident	47 Å²	47	77.2 Å²	77.2	32%	0.318	39%	0.392	S	S	.	.			trans	-123.9	91.6	-175.1	-172.2	0	0	0	0	110.6	E628 S629 D634 R635	E628-C632 PolarHBondContact O-N 3.47Å; S629-C632 CarbonylContact O-C 3.59Å; S629-C632 PolarHBondContact O-N 3.43Å; S629-C632 VanDerWaalsContact O-N 3.09Å; C632-D634 PolarHBondContact O-N 3.28Å; C632-R635 PolarHBondContact O-N 2.86Å
633	Q	61.9	Low	79.9	Confident	93 Å²	93	74 Å²	74	44%	0.435	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-20.4	-177.4	-74.2	171.4	-15.4	0	0	114	R635 Q636 D760 N761	Q633-R635 VanDerWaalsContact C-N 3.34Å; Q633-R635 PolarHBondContact O-N 3.42Å; Q633-Q636 WeakPolarHBondContact O-CG 3.28Å; Q633-Q636 PolarHBondContact O-NE2 2.91Å; Q633-D760 PolarHBondContact NE2-O 2.91Å; Q633-N761 PolarHBondContact NE2-OD1 3.09Å
634	D	58.7	Low	79.9	Confident	141 Å²	141	79.2 Å²	79.2	75%	0.754	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	7.9	-177	-60.2	-40.4	0	0	0	115.3	C632	C632-D634 PolarHBondContact O-N 3.28Å
635	R	55.3	Low	79.8	Confident	137 Å²	137	81.1 Å²	81.1	52%	0.517	41%	0.413	S	S	.	.			trans	-113.5	37	-176.5	-67.5	-170.4	175.5	-151	0.8	114.6	Y625 C632 Q633	Y625-R635 PolarHBondContact OH-NH1 3.42Å; Y625-R635 VanDerWaalsContact OH-NH1 3.09Å; C632-R635 PolarHBondContact O-N 2.86Å; Q633-R635 VanDerWaalsContact C-N 3.34Å; Q633-R635 PolarHBondContact O-N 3.42Å
636	Q	75	Confident	79.8	Confident	81 Å²	81	75.6 Å²	75.6	38%	0.379	39%	0.392	S	S	.	.			trans	-92.9	134.1	-176.9	-53	176.9	40.8	0	0	112.1	Q633 T645 F646	Q633-Q636 WeakPolarHBondContact O-CG 3.28Å; Q633-Q636 PolarHBondContact O-NE2 2.91Å; Q636-T645 HydrophobicContact CB-CG2 4.4Å; Q636-T645 PolarHBondContact OE1-OG1 3.46Å; Q636-F646 CarbonylContact C-O 3.46Å; Q636-F646 WeakPolarHBondContact CA-O 3.5Å
637	F	80.6	Confident	79.7	Confident	90 Å²	90	75.1 Å²	75.1	40%	0.395	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	112.5	172.8	-62.7	-93.7	0	0	0	108.9	F646 S649 L652	F637-F646 PolarHBondContact N-O 3.17Å; F637-F646 PolarHBondContact O-N 2.94Å; F637-S649 VanDerWaalsContact CD2-N 3.32Å; F637-L652 HydrophobicContact CB-CB 4.12Å; F637-L652 HydrophobicContact CB-CD2 3.73Å
638	Q	87.2	Confident	79.5	Confident	126 Å²	126	76 Å²	76	59%	0.589	39%	0.392	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.4	138.4	-176.2	-166.6	169.8	31	0	0	112.8	G643 T645	Q638-G643 WeakPolarHBondContact CG-O 3.48Å; Q638-G643 PolarHBondContact NE2-O 3.03Å; Q638-T645 HydrophobicContact CB-CG2 3.98Å; Q638-T645 HydrophobicContact CG-CG2 3.78Å
639	C	89.5	Confident	79.7	Confident	2 Å²	2	75.3 Å²	75.3	1%	0.014	40%	0.395	C	S	.	.			trans	-73.7	121.5	166.7	-179.8	0	0	0	0	110.5	Q641 G643 K644 F646 L652 H655 H659	C639-Q641 PolarHBondContact O-N 3.38Å; C639-Q641 PolarHBondContact SG-N 2.86Å; C639-G643 VanDerWaalsContact O-CA 3.28Å; C639-G643 WeakPolarHBondContact O-CA 3.48Å; C639-G643 PolarHBondContact O-N 3.11Å; C639-K644 WeakPolarHBondContact CB-O 3.28Å; C639-K644 PolarHBondContact N-O 3.07Å; C639-F646 HydrophobicContact CB-CE2 4.15Å; C639-L652 HydrophobicContact CB-CD1 3.76Å; C639-H655 WeakPolarHBondContact CB-NE2 3.31Å; C639-H655 PolarHBondContact SG-NE2 2.95Å; C639-H659 VanDerWaalsContact SG-CD2 3.56Å
640	S	87.5	Confident	80	Confident	117 Å²	117	76.9 Å²	76.9	82%	0.818	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-10.7	179	53.1	0	0	0	0	114.7
641	Q	87.9	Confident	80.5	Confident	123 Å²	123	76.2 Å²	76.2	58%	0.575	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-44.1	-177.9	-62	-162.9	30.2	0	0	113.7	C639 H659	C639-Q641 PolarHBondContact O-N 3.38Å; C639-Q641 PolarHBondContact SG-N 2.86Å; Q641-H659 WeakPolarHBondContact CB-ND1 3.44Å; Q641-H659 PolarHBondContact OE1-ND1 2.89Å; Q641-H659 VanDerWaalsContact OE1-ND1 3.09Å
642	C	91.3	Very high	80.8	Confident	60 Å²	60	73.7 Å²	73.7	41%	0.405	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	0.9	-179.8	74.2	0	0	0	0	114.7	K644 H655 H659	C642-K644 PolarHBondContact O-N 2.92Å; C642-K644 VanDerWaalsContact SG-CB 3.59Å; C642-H655 PolarHBondContact SG-NE2 3.3Å; C642-H659 WeakPolarHBondContact CB-NE2 3.44Å; C642-H659 PolarHBondContact SG-NE2 3.34Å; C642-H659 VanDerWaalsContact SG-NE2 3.41Å
643	G	86	Confident	81.9	Confident	35 Å²	35	74.5 Å²	74.5	36%	0.361	40%	0.398	S	S	.	.			trans	71.3	-7.1	179.9	0	0	0	0	0	116	Q638 C639	Q638-G643 WeakPolarHBondContact CG-O 3.48Å; Q638-G643 PolarHBondContact NE2-O 3.03Å; C639-G643 VanDerWaalsContact O-CA 3.28Å; C639-G643 WeakPolarHBondContact O-CA 3.48Å; C639-G643 PolarHBondContact O-N 3.11Å
644	K	85.8	Confident	83.1	Confident	122 Å²	122	72.6 Å²	72.6	53%	0.53	39%	0.392	S	S	.	.			trans	-56.9	144	174.8	-75.8	-168.4	175.8	-163.1	0	110.6	C639 C642 F646	C639-K644 WeakPolarHBondContact CB-O 3.28Å; C639-K644 PolarHBondContact N-O 3.07Å; C642-K644 PolarHBondContact O-N 2.92Å; C642-K644 VanDerWaalsContact SG-CB 3.59Å; K644-F646 HydrophobicContact CB-CE2 3.76Å; K644-F646 HydrophobicContact CB-CZ 3.9Å; K644-F646 HydrophobicContact CD-CZ 4.47Å; K644-F646 WeakPolarHBondContact O-CE2 3.42Å
645	T	86.5	Confident	84.6	Confident	63 Å²	63	66.9 Å²	66.9	39%	0.387	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	138.5	-173.5	49.3	0	0	0	0	111.7	Q636 Q638	Q636-T645 HydrophobicContact CB-CG2 4.4Å; Q636-T645 PolarHBondContact OE1-OG1 3.46Å; Q638-T645 HydrophobicContact CB-CG2 3.98Å; Q638-T645 HydrophobicContact CG-CG2 3.78Å
646	F	84.2	Confident	86.2	Confident	31 Å²	31	63.2 Å²	63.2	14%	0.136	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	137.2	-169.7	-62.1	-89.1	0	0	0	111.3	Q636 F637 C639 K644 R648 L652 H655	Q636-F646 CarbonylContact C-O 3.46Å; Q636-F646 WeakPolarHBondContact CA-O 3.5Å; F637-F646 PolarHBondContact N-O 3.17Å; F637-F646 PolarHBondContact O-N 2.94Å; C639-F646 HydrophobicContact CB-CE2 4.15Å; K644-F646 HydrophobicContact CB-CE2 3.76Å; K644-F646 HydrophobicContact CB-CZ 3.9Å; K644-F646 HydrophobicContact CD-CZ 4.47Å; K644-F646 WeakPolarHBondContact O-CE2 3.42Å; F646-R648 PolarHBondContact O-N 3.43Å; F646-L652 HydrophobicContact CB-CB 4.13Å; F646-L652 HydrophobicContact CD2-CB 4.04Å; F646-L652 HydrophobicContact CD2-CD1 3.8Å; F646-L652 HydrophobicContact CE2-CD1 4.06Å; F646-L652 HydrophobicContact CG-CB 4.19Å; F646-H655 HydrophobicContact CE1-CB 3.83Å; F646-H655 AromaticContact CE1-CG 3.95Å; F646-H655 HydrophobicContact CE2-CB 4.13Å; F646-H655 AromaticContact CE2-CD2 3.28Å; F646-H655 WeakPolarHBondContact CE2-CD2 3.35Å; F646-H655 AromaticContact CE2-CG 3.68Å; F646-H655 AromaticContact CE2-NE2 3.83Å; F646-H655 HydrophobicContact CZ-CB 3.57Å; F646-H655 AromaticContact CZ-CD2 3.31Å; F646-H655 WeakPolarHBondContact CZ-CD2 3.38Å; F646-H655 AromaticContact CZ-CG 3.2Å; F646-H655 AromaticContact CZ-ND1 3.68Å; F646-H655 AromaticContact CZ-NE2 3.83Å
647	K	80.5	Confident	86.9	Confident	54 Å²	54	61.3 Å²	61.3	24%	0.235	34%	0.344	C	S	.	.	S	Bend	trans	-68.4	-19.2	179.2	-54	-179	-159.1	155.6	0	113.9	N549 D551 V630	N549-K647 WeakPolarHBondContact OD1-CE 3.48Å; N549-K647 PolarHBondContact OD1-NZ 3.38Å; D551-K647 WeakPolarHBondContact OD2-CD 3.36Å; D551-K647 WeakPolarHBondContact OD2-CE 3.22Å; D551-K647 IonicContact OD2-NZ 3.91Å; D551-K647 PolarHBondContact OD2-NZ 3.14Å; V630-K647 HydrophobicContact CG2-CD 4Å
648	R	83	Confident	87.3	Confident	39 Å²	39	62.1 Å²	62.1	15%	0.147	35%	0.351	C	S	.	.	S	Bend	trans	-127.3	135.9	-175.4	-64.2	165.6	59.7	166.9	-2.6	110.4	D554 Q626 F646 S650 T651 L652	D554-R648 IonicContact OD2-CZ 3.08Å; D554-R648 IonicContact OD2-NH1 3.68Å; D554-R648 PolarHBondContact OD2-NH1 2.98Å; D554-R648 VanDerWaalsContact OD2-NH1 3.13Å; D554-R648 IonicContact OD2-NH2 3.86Å; Q626-R648 VanDerWaalsContact NE2-NE 3.17Å; F646-R648 PolarHBondContact O-N 3.43Å; R648-S650 PolarHBondContact NE-OG 2.75Å; R648-S650 PolarHBondContact O-N 2.85Å; R648-T651 HydrophobicContact CB-CG2 4.3Å; R648-T651 PolarHBondContact O-N 3.4Å; R648-T651 PolarHBondContact O-OG1 2.78Å; R648-T651 VanDerWaalsContact O-OG1 3.09Å; R648-L652 PolarHBondContact O-N 3.36Å; R648-L652 VanDerWaalsContact O-N 3.1Å
649	S	86.6	Confident	87.3	Confident	61 Å²	61	59 Å²	59	43%	0.427	34%	0.336	S	S	.	.	H	α-helix	trans	-57.8	-31.1	169.4	-175.2	0	0	0	0	112	F637 S653	F637-S649 VanDerWaalsContact CD2-N 3.32Å; S649-S653 WeakPolarHBondContact O-CB 3.41Å; S649-S653 PolarHBondContact O-N 2.96Å; S649-S653 PolarHBondContact O-OG 3.48Å
650	S	86.4	Confident	86.9	Confident	56 Å²	56	60.7 Å²	60.7	39%	0.392	35%	0.348	S	S	.	.	H	α-helix	trans	-66.1	-40.9	177.8	62	0	0	0	0	112.6	R648 S653 T654	R648-S650 PolarHBondContact NE-OG 2.75Å; R648-S650 PolarHBondContact O-N 2.85Å; S650-S653 WeakPolarHBondContact O-CB 3.22Å; S650-S653 PolarHBondContact O-N 3.06Å; S650-T654 PolarHBondContact O-N 2.8Å; S650-T654 PolarHBondContact O-OG1 3.34Å
651	T	87.4	Confident	86.4	Confident	47 Å²	47	63 Å²	63	29%	0.288	35%	0.352	S	S	.	.	H	α-helix	trans	-77.4	-31.7	179.7	55.3	0	0	0	0	111.7	R648 S653 T654 H655	R648-T651 HydrophobicContact CB-CG2 4.3Å; R648-T651 PolarHBondContact O-N 3.4Å; R648-T651 PolarHBondContact O-OG1 2.78Å; R648-T651 VanDerWaalsContact O-OG1 3.09Å; T651-S653 VanDerWaalsContact C-N 3.34Å; T651-T654 WeakPolarHBondContact CA-OG1 3.24Å; T651-T654 PolarHBondContact O-N 3.29Å; T651-T654 PolarHBondContact O-OG1 3.2Å; T651-T654 VanDerWaalsContact O-OG1 3.11Å; T651-H655 VanDerWaalsContact O-CB 3.25Å; T651-H655 WeakPolarHBondContact O-CB 3.3Å; T651-H655 PolarHBondContact O-N 2.78Å
652	L	88.7	Confident	86.2	Confident	22 Å²	22	61 Å²	61	12%	0.115	35%	0.348	C	S	.	.	H	α-helix	trans	-59.6	-44.6	163.6	174.2	60.2	0	0	0	111.1	F637 C639 F646 R648 T654 H655 L656	F637-L652 HydrophobicContact CB-CB 4.12Å; F637-L652 HydrophobicContact CB-CD2 3.73Å; C639-L652 HydrophobicContact CB-CD1 3.76Å; F646-L652 HydrophobicContact CB-CB 4.13Å; F646-L652 HydrophobicContact CD2-CB 4.04Å; F646-L652 HydrophobicContact CD2-CD1 3.8Å; F646-L652 HydrophobicContact CE2-CD1 4.06Å; F646-L652 HydrophobicContact CG-CB 4.19Å; R648-L652 PolarHBondContact O-N 3.36Å; R648-L652 VanDerWaalsContact O-N 3.1Å; L652-T654 PolarHBondContact O-N 3.39Å; L652-H655 PolarHBondContact O-N 3.23Å; L652-L656 HydrophobicContact CD1-CD1 4.03Å; L652-L656 HydrophobicContact CD1-CD2 4.42Å; L652-L656 HydrophobicContact CD1-CG 3.89Å; L652-L656 HydrophobicContact CG-CD1 3.96Å; L652-L656 HydrophobicContact CG-CG 4.29Å; L652-L656 WeakPolarHBondContact O-CB 3.43Å; L652-L656 VanDerWaalsContact O-CG 3.31Å; L652-L656 WeakPolarHBondContact O-CG 3.43Å; L652-L656 PolarHBondContact O-N 3.45Å
653	S	89.7	Confident	86.1	Confident	65 Å²	65	63.6 Å²	63.6	46%	0.455	35%	0.349	S	S	.	.	H	α-helix	trans	-63.5	-38.3	180	-63.5	0	0	0	0	113.3	S649 S650 T651	S649-S653 WeakPolarHBondContact O-CB 3.41Å; S649-S653 PolarHBondContact O-N 2.96Å; S649-S653 PolarHBondContact O-OG 3.48Å; S650-S653 WeakPolarHBondContact O-CB 3.22Å; S650-S653 PolarHBondContact O-N 3.06Å; T651-S653 VanDerWaalsContact C-N 3.34Å
654	T	88.4	Confident	86.3	Confident	53 Å²	53	64.7 Å²	64.7	33%	0.325	35%	0.35	S	S	.	.	H	α-helix	trans	-73.5	-34.8	173.6	51.5	0	0	0	0	112.5	S650 T651 L652 L657	S650-T654 PolarHBondContact O-N 2.8Å; S650-T654 PolarHBondContact O-OG1 3.34Å; T651-T654 WeakPolarHBondContact CA-OG1 3.24Å; T651-T654 PolarHBondContact O-N 3.29Å; T651-T654 PolarHBondContact O-OG1 3.2Å; T651-T654 VanDerWaalsContact O-OG1 3.11Å; L652-T654 PolarHBondContact O-N 3.39Å; T654-L657 VanDerWaalsContact O-CB 3.3Å; T654-L657 WeakPolarHBondContact O-CB 3.26Å; T654-L657 PolarHBondContact O-N 3.02Å
655	H	90.2	Very high	86.6	Confident	21 Å²	21	63.2 Å²	63.2	10%	0.097	34%	0.341	C	S	.	.	H	α-helix	trans	-64.9	-37.3	172.6	165.2	68.6	0	0	0	112.6	C639 C642 F646 T651 L652 L657 I658 H659	C639-H655 WeakPolarHBondContact CB-NE2 3.31Å; C639-H655 PolarHBondContact SG-NE2 2.95Å; C642-H655 PolarHBondContact SG-NE2 3.3Å; F646-H655 HydrophobicContact CE1-CB 3.83Å; F646-H655 AromaticContact CE1-CG 3.95Å; F646-H655 HydrophobicContact CE2-CB 4.13Å; F646-H655 AromaticContact CE2-CD2 3.28Å; F646-H655 WeakPolarHBondContact CE2-CD2 3.35Å; F646-H655 AromaticContact CE2-CG 3.68Å; F646-H655 AromaticContact CE2-NE2 3.83Å; F646-H655 HydrophobicContact CZ-CB 3.57Å; F646-H655 AromaticContact CZ-CD2 3.31Å; F646-H655 WeakPolarHBondContact CZ-CD2 3.38Å; F646-H655 AromaticContact CZ-CG 3.2Å; F646-H655 AromaticContact CZ-ND1 3.68Å; F646-H655 AromaticContact CZ-NE2 3.83Å; T651-H655 VanDerWaalsContact O-CB 3.25Å; T651-H655 WeakPolarHBondContact O-CB 3.3Å; T651-H655 PolarHBondContact O-N 2.78Å; L652-H655 PolarHBondContact O-N 3.23Å; H655-L657 PolarHBondContact O-N 2.79Å; H655-L657 VanDerWaalsContact O-N 3.16Å; H655-I658 VanDerWaalsContact O-CB 3.28Å; H655-I658 WeakPolarHBondContact O-CB 3.26Å; H655-I658 WeakPolarHBondContact O-CG1 3.32Å; H655-I658 PolarHBondContact O-N 3Å; H655-H659 AromaticContact CE1-CD2 3.62Å; H655-H659 AromaticContact CE1-NE2 3.54Å; H655-H659 AromaticContact NE2-CD2 3.4Å; H655-H659 PolarHBondContact NE2-CD2 3.5Å; H655-H659 AromaticContact NE2-NE2 3.42Å; H655-H659 PolarHBondContact NE2-NE2 3.44Å
656	L	88.4	Confident	87	Confident	60 Å²	60	63.1 Å²	63.1	31%	0.314	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-17.6	174.5	-74.4	169.8	0	0	0	113.1	L652 I658 H659 S660	L652-L656 HydrophobicContact CD1-CD1 4.03Å; L652-L656 HydrophobicContact CD1-CD2 4.42Å; L652-L656 HydrophobicContact CD1-CG 3.89Å; L652-L656 HydrophobicContact CG-CD1 3.96Å; L652-L656 HydrophobicContact CG-CG 4.29Å; L652-L656 WeakPolarHBondContact O-CB 3.43Å; L652-L656 VanDerWaalsContact O-CG 3.31Å; L652-L656 WeakPolarHBondContact O-CG 3.43Å; L652-L656 PolarHBondContact O-N 3.45Å; L656-I658 VanDerWaalsContact C-N 3.27Å; L656-H659 PolarHBondContact O-N 3.24Å; L656-S660 PolarHBondContact O-N 2.99Å
657	L	90	Very high	87.5	Confident	41 Å²	41	61.8 Å²	61.8	22%	0.215	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-17.4	169.5	-59.1	173.7	0	0	0	113.3	T654 H655 S660 P664 H675	T654-L657 VanDerWaalsContact O-CB 3.3Å; T654-L657 WeakPolarHBondContact O-CB 3.26Å; T654-L657 PolarHBondContact O-N 3.02Å; H655-L657 PolarHBondContact O-N 2.79Å; H655-L657 VanDerWaalsContact O-N 3.16Å; L657-S660 PolarHBondContact O-OG 2.75Å; L657-P664 HydrophobicContact CD1-CG 4.08Å; L657-H675 HydrophobicContact CB-CB 4.25Å; L657-H675 WeakPolarHBondContact CD1-O 3.47Å; L657-H675 PolarHBondContact O-CD2 3.44Å
658	I	87.9	Confident	88.1	Confident	106 Å²	106	68 Å²	68	54%	0.544	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-29.4	173.6	-51.5	172.7	0	0	0	109.8	H655 L656 S660	H655-I658 VanDerWaalsContact O-CB 3.28Å; H655-I658 WeakPolarHBondContact O-CB 3.26Å; H655-I658 WeakPolarHBondContact O-CG1 3.32Å; H655-I658 PolarHBondContact O-N 3Å; L656-I658 VanDerWaalsContact C-N 3.27Å; I658-S660 PolarHBondContact O-N 3.42Å
659	H	88.3	Confident	88.6	Confident	60 Å²	60	72.7 Å²	72.7	28%	0.278	39%	0.385	S	S	.	.	S	Bend	trans	-80.4	0	175.1	-84.4	-66.5	0	0	0	114.3	C639 Q641 C642 H655 L656	C639-H659 VanDerWaalsContact SG-CD2 3.56Å; Q641-H659 WeakPolarHBondContact CB-ND1 3.44Å; Q641-H659 PolarHBondContact OE1-ND1 2.89Å; Q641-H659 VanDerWaalsContact OE1-ND1 3.09Å; C642-H659 WeakPolarHBondContact CB-NE2 3.44Å; C642-H659 PolarHBondContact SG-NE2 3.34Å; C642-H659 VanDerWaalsContact SG-NE2 3.41Å; H655-H659 AromaticContact CE1-CD2 3.62Å; H655-H659 AromaticContact CE1-NE2 3.54Å; H655-H659 AromaticContact NE2-CD2 3.4Å; H655-H659 PolarHBondContact NE2-CD2 3.5Å; H655-H659 AromaticContact NE2-NE2 3.42Å; H655-H659 PolarHBondContact NE2-NE2 3.44Å; L656-H659 PolarHBondContact O-N 3.24Å
660	S	80.3	Confident	89	Confident	38 Å²	38	72.7 Å²	72.7	27%	0.266	38%	0.384	S	S	.	.	S	Bend	trans	-125.5	155.2	171.4	62.5	0	0	0	0	108.9	L656 L657 I658 T662	L656-S660 PolarHBondContact O-N 2.99Å; L657-S660 PolarHBondContact O-OG 2.75Å; I658-S660 PolarHBondContact O-N 3.42Å; S660-T662 PolarHBondContact O-N 2.66Å; S660-T662 PolarHBondContact OG-N 3.2Å; S660-T662 PolarHBondContact OG-OG1 3.26Å
661	D	77.4	Confident	89.1	Confident	167 Å²	167	72 Å²	72	89%	0.893	39%	0.386	S	S	*	.	S	Bend	trans	-73.6	13.2	169.9	-56.1	-70.1	0	0	0	112.8	R663	D661-R663 PolarHBondContact O-N 2.69Å
662	T	83.5	Confident	89.4	Confident	80 Å²	80	75.9 Å²	75.9	49%	0.491	40%	0.399	S	S	.	.			trans	-87.9	96.2	-176.2	69.1	0	0	0	0	110.9	S660 P664	S660-T662 PolarHBondContact O-N 2.66Å; S660-T662 PolarHBondContact OG-N 3.2Å; S660-T662 PolarHBondContact OG-OG1 3.26Å; T662-P664 WeakPolarHBondContact O-CD 3.31Å
663	R	89.1	Confident	89.7	Confident	114 Å²	114	80.9 Å²	80.9	43%	0.43	42%	0.416	S	S	.	.			trans	-96.4	91.6	169.8	-72.7	157.4	174.7	-112	5.2	109.9	D661 Y665 R673 F674 H675	D661-R663 PolarHBondContact O-N 2.69Å; R663-Y665 VanDerWaalsContact C-N 3.31Å; R663-Y665 PolarHBondContact O-N 2.71Å; R663-R673 HydrophobicContact CB-CB 3.45Å; R663-R673 VanDerWaalsContact CB-CB 3.45Å; R663-R673 WeakPolarHBondContact CD-O 3.42Å; R663-R673 HydrophobicContact CG-CB 4.45Å; R663-R673 PolarHBondContact NH1-O 3.48Å; R663-R673 VanDerWaalsContact O-CZ 3.31Å; R663-R673 PolarHBondContact O-NE 3.17Å; R663-R673 PolarHBondContact O-NH2 3.34Å; R663-F674 CarbonylContact C-O 3.07Å; R663-F674 WeakPolarHBondContact CA-O 3.47Å; R663-H675 WeakPolarHBondContact CG-CD2 3.5Å; R663-H675 VanDerWaalsContact CG-NE2 3.3Å; R663-H675 WeakPolarHBondContact CG-NE2 3.46Å; R663-H675 PolarHBondContact NE-NE2 2.97Å
664	P	89.4	Confident	89.8	Confident	58 Å²	58	79.2 Å²	79.2	38%	0.377	40%	0.401	S	S	.	.			trans	-68	-22.4	-170.3	22.9	-33.1	0	0	0	115	L657 T662 P666	L657-P664 HydrophobicContact CD1-CG 4.08Å; T662-P664 WeakPolarHBondContact O-CD 3.31Å; P664-P666 WeakPolarHBondContact O-CD 3.25Å
665	Y	93.5	Very high	89.9	Confident	91 Å²	91	78.5 Å²	78.5	36%	0.357	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	100.3	-172.9	-55.1	-74.1	0	0	0	112.2	R663 R673 F674 H675 K677	R663-Y665 VanDerWaalsContact C-N 3.31Å; R663-Y665 PolarHBondContact O-N 2.71Å; Y665-R673 WeakPolarHBondContact O-CA 3.48Å; Y665-F674 PolarHBondContact N-O 3.08Å; Y665-F674 PolarHBondContact O-N 2.87Å; Y665-H675 WeakPolarHBondContact CD2-O 3.24Å; Y665-H675 VanDerWaalsContact CE2-O 3.32Å; Y665-H675 WeakPolarHBondContact CE2-O 3.33Å; Y665-K677 HydrophobicContact CD1-CB 3.9Å; Y665-K677 HydrophobicContact CD1-CG 4.31Å; Y665-K677 HydrophobicContact CD2-CB 4.41Å; Y665-K677 VanDerWaalsContact CD2-N 3.29Å; Y665-K677 HydrophobicContact CE1-CB 3.77Å; Y665-K677 HydrophobicContact CE1-CG 4.31Å; Y665-K677 HydrophobicContact CE2-CB 4.29Å; Y665-K677 HydrophobicContact CG-CB 4.22Å
666	P	94.3	Very high	90	Very high	62 Å²	62	80.8 Å²	80.8	40%	0.403	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	143.1	172.1	32.9	-35.1	0	0	0	111.8	P664 R673	P664-P666 WeakPolarHBondContact O-CD 3.25Å; P666-R673 HydrophobicContact CB-CG 4.3Å
667	C	95	Very high	90.1	Very high	3 Å²	3	84.4 Å²	84.4	2%	0.02	42%	0.418	C	S	.	.			trans	-71.4	131.3	163.3	-177.2	0	0	0	0	110	Y669 G671 K672 F674 H683	C667-Y669 VanDerWaalsContact C-N 3.29Å; C667-Y669 PolarHBondContact O-N 3Å; C667-G671 VanDerWaalsContact O-CA 3.26Å; C667-G671 WeakPolarHBondContact O-CA 3.48Å; C667-G671 PolarHBondContact O-N 2.76Å; C667-K672 WeakPolarHBondContact CB-O 3.28Å; C667-K672 PolarHBondContact N-O 3.34Å; C667-F674 HydrophobicContact CB-CE2 4.31Å; C667-H683 VanDerWaalsContact SG-CD2 3.56Å
668	Q	93	Very high	90.1	Very high	183 Å²	183	84.9 Å²	84.9	86%	0.855	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-21.8	-178.9	-67.7	-178.2	-13.7	0	0	113.6
669	Y	92.5	Very high	90.3	Very high	139 Å²	139	81.8 Å²	81.8	55%	0.545	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-34	-177	-59.7	-72.4	0	0	0	113.9	C667 T684 H687 T688	C667-Y669 VanDerWaalsContact C-N 3.29Å; C667-Y669 PolarHBondContact O-N 3Å; Y669-T684 HydrophobicContact CD2-CG2 4.22Å; Y669-T684 HydrophobicContact CE2-CG2 4.11Å; Y669-H687 VanDerWaalsContact CB-CG 3.47Å; Y669-H687 HydrophobicContact CD1-CB 4.35Å; Y669-H687 HydrophobicContact CD2-CB 3.57Å; Y669-H687 AromaticContact CD2-CG 3.83Å; Y669-H687 HydrophobicContact CE2-CB 4.16Å; Y669-H687 HydrophobicContact CG-CB 3.68Å; Y669-H687 AromaticContact CG-CG 3.81Å; Y669-T688 HydrophobicContact CE2-CG2 4.32Å
670	C	94.6	Very high	90.6	Very high	60 Å²	60	80.7 Å²	80.7	41%	0.405	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-134.4	3.1	-174.9	67.5	0	0	0	0	115.1	K672 H683 H687	C670-K672 PolarHBondContact O-N 3.42Å; C670-K672 VanDerWaalsContact SG-CB 3.55Å; C670-H683 PolarHBondContact SG-NE2 2.7Å; C670-H687 WeakPolarHBondContact CB-CE1 3.44Å; C670-H687 PolarHBondContact SG-CE1 2.79Å; C670-H687 PolarHBondContact SG-NE2 3.34Å
671	G	90.6	Very high	91.1	Very high	43 Å²	43	84.8 Å²	84.8	44%	0.443	42%	0.418	S	S	.	.			trans	71.3	-12.7	-179.1	0	0	0	0	0	116.2	C667 R673	C667-G671 VanDerWaalsContact O-CA 3.26Å; C667-G671 WeakPolarHBondContact O-CA 3.48Å; C667-G671 PolarHBondContact O-N 2.76Å; G671-R673 WeakPolarHBondContact O-CG 3.48Å; G671-R673 PolarHBondContact O-N 3.13Å
672	K	93.6	Very high	91.7	Very high	127 Å²	127	81.6 Å²	81.6	55%	0.552	40%	0.396	S	S	*	.			trans	-51.1	132	178.1	-171	173.3	-178.2	176.4	0	110.6	C667 C670 F674	C667-K672 WeakPolarHBondContact CB-O 3.28Å; C667-K672 PolarHBondContact N-O 3.34Å; C670-K672 PolarHBondContact O-N 3.42Å; C670-K672 VanDerWaalsContact SG-CB 3.55Å; K672-F674 HydrophobicContact CB-CE2 4.18Å; K672-F674 HydrophobicContact CB-CZ 4.49Å; K672-F674 HydrophobicContact CD-CZ 4.02Å; K672-F674 HydrophobicContact CG-CE2 4.03Å; K672-F674 HydrophobicContact CG-CZ 3.96Å; K672-F674 WeakPolarHBondContact O-CD2 3.39Å; K672-F674 VanDerWaalsContact O-CE2 3.29Å; K672-F674 WeakPolarHBondContact O-CE2 3.41Å
673	R	93.4	Very high	92.2	Very high	127 Å²	127	79.1 Å²	79.1	48%	0.479	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	140.4	-167.9	-51.9	-174.3	63.6	127.8	3.9	112.8	R663 Y665 P666 G671	R663-R673 HydrophobicContact CB-CB 3.45Å; R663-R673 VanDerWaalsContact CB-CB 3.45Å; R663-R673 WeakPolarHBondContact CD-O 3.42Å; R663-R673 HydrophobicContact CG-CB 4.45Å; R663-R673 PolarHBondContact NH1-O 3.48Å; R663-R673 VanDerWaalsContact O-CZ 3.31Å; R663-R673 PolarHBondContact O-NE 3.17Å; R663-R673 PolarHBondContact O-NH2 3.34Å; Y665-R673 WeakPolarHBondContact O-CA 3.48Å; P666-R673 HydrophobicContact CB-CG 4.3Å; G671-R673 WeakPolarHBondContact O-CG 3.48Å; G671-R673 PolarHBondContact O-N 3.13Å
674	F	92.7	Very high	92.4	Very high	31 Å²	31	74.9 Å²	74.9	14%	0.136	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	154.7	-174	-59.8	-94.9	0	0	0	112.2	R663 Y665 C667 K672 D679 M680 H683	R663-F674 CarbonylContact C-O 3.07Å; R663-F674 WeakPolarHBondContact CA-O 3.47Å; Y665-F674 PolarHBondContact N-O 3.08Å; Y665-F674 PolarHBondContact O-N 2.87Å; C667-F674 HydrophobicContact CB-CE2 4.31Å; K672-F674 HydrophobicContact CB-CE2 4.18Å; K672-F674 HydrophobicContact CB-CZ 4.49Å; K672-F674 HydrophobicContact CD-CZ 4.02Å; K672-F674 HydrophobicContact CG-CE2 4.03Å; K672-F674 HydrophobicContact CG-CZ 3.96Å; K672-F674 WeakPolarHBondContact O-CD2 3.39Å; K672-F674 VanDerWaalsContact O-CE2 3.29Å; K672-F674 WeakPolarHBondContact O-CE2 3.41Å; F674-D679 HydrophobicContact CD1-CB 4.01Å; F674-M680 HydrophobicContact CB-CB 4.08Å; F674-M680 HydrophobicContact CD2-CB 3.76Å; F674-M680 HydrophobicContact CD2-CG 4.03Å; F674-M680 HydrophobicContact CG-CB 4.03Å; F674-H683 HydrophobicContact CE1-CB 3.98Å; F674-H683 HydrophobicContact CE2-CB 4.11Å; F674-H683 AromaticContact CE2-CD2 3.42Å; F674-H683 VanDerWaalsContact CE2-CD2 3.42Å; F674-H683 WeakPolarHBondContact CE2-CD2 3.47Å; F674-H683 AromaticContact CE2-CG 3.9Å; F674-H683 HydrophobicContact CZ-CB 3.52Å; F674-H683 AromaticContact CZ-CD2 3.35Å; F674-H683 WeakPolarHBondContact CZ-CD2 3.28Å; F674-H683 AromaticContact CZ-CG 3.37Å
675	H	90.5	Very high	92.5	Very high	37 Å²	37	74.2 Å²	74.2	17%	0.171	36%	0.356	C	S	.	.	S	Bend	trans	-76.6	-29.8	175.7	-51.2	118.2	0	0	0	112.3	L657 R663 Y665	L657-H675 HydrophobicContact CB-CB 4.25Å; L657-H675 WeakPolarHBondContact CD1-O 3.47Å; L657-H675 PolarHBondContact O-CD2 3.44Å; R663-H675 WeakPolarHBondContact CG-CD2 3.5Å; R663-H675 VanDerWaalsContact CG-NE2 3.3Å; R663-H675 WeakPolarHBondContact CG-NE2 3.46Å; R663-H675 PolarHBondContact NE-NE2 2.97Å; Y665-H675 WeakPolarHBondContact CD2-O 3.24Å; Y665-H675 VanDerWaalsContact CE2-O 3.32Å; Y665-H675 WeakPolarHBondContact CE2-O 3.33Å
676	Q	91.1	Very high	92.5	Very high	70 Å²	70	74.3 Å²	74.3	33%	0.327	37%	0.366	S	S	.	.	S	Bend	trans	-121.3	153.3	177	-44.2	-171.2	20.1	0	0	113.4	S678 D679 M680	Q676-S678 WeakPolarHBondContact CB-OG 3.36Å; Q676-S678 PolarHBondContact OE1-OG 3.44Å; Q676-D679 WeakPolarHBondContact CB-OD2 3.41Å; Q676-D679 WeakPolarHBondContact CG-OD2 3.36Å; Q676-M680 PolarHBondContact O-N 3.23Å
677	K	91.6	Very high	92.5	Very high	135 Å²	135	75.6 Å²	75.6	59%	0.587	37%	0.367	S	S	*	.	H	α-helix	trans	-69.9	-33.3	176.1	-173.4	-179.3	177.3	-175.7	0	112.1	Y665 M680 K681	Y665-K677 HydrophobicContact CD1-CB 3.9Å; Y665-K677 HydrophobicContact CD1-CG 4.31Å; Y665-K677 HydrophobicContact CD2-CB 4.41Å; Y665-K677 VanDerWaalsContact CD2-N 3.29Å; Y665-K677 HydrophobicContact CE1-CB 3.77Å; Y665-K677 HydrophobicContact CE1-CG 4.31Å; Y665-K677 HydrophobicContact CE2-CB 4.29Å; Y665-K677 HydrophobicContact CG-CB 4.22Å; K677-M680 HydrophobicContact CG-CE 4.4Å; K677-K681 WeakPolarHBondContact O-CB 3.46Å; K677-K681 PolarHBondContact O-N 3.4Å
678	S	89.5	Confident	92.3	Very high	51 Å²	51	78.2 Å²	78.2	36%	0.357	38%	0.382	S	S	.	.	H	α-helix	trans	-54.4	-53.8	171.3	38.6	0	0	0	0	111.3	Q676 K681 K682	Q676-S678 WeakPolarHBondContact CB-OG 3.36Å; Q676-S678 PolarHBondContact OE1-OG 3.44Å; S678-K681 WeakPolarHBondContact O-CB 3.45Å; S678-K681 PolarHBondContact O-N 3.34Å; S678-K681 VanDerWaalsContact O-N 3.15Å; S678-K682 WeakPolarHBondContact O-CG 3.32Å; S678-K682 PolarHBondContact O-N 2.84Å
679	D	91.6	Very high	92.2	Very high	42 Å²	42	71.9 Å²	71.9	23%	0.225	37%	0.366	C	S	.	.	H	α-helix	trans	-71.4	-38.3	-175.4	-51.9	-41.4	0	0	0	112.4	F674 Q676 K681 K682 H683	F674-D679 HydrophobicContact CD1-CB 4.01Å; Q676-D679 WeakPolarHBondContact CB-OD2 3.41Å; Q676-D679 WeakPolarHBondContact CG-OD2 3.36Å; D679-K681 VanDerWaalsContact C-N 3.28Å; D679-K681 PolarHBondContact O-N 2.98Å; D679-K682 PolarHBondContact O-N 3.01Å; D679-K682 WeakPolarHBondContact OD1-CE 3.46Å; D679-K682 IonicContact OD1-NZ 3.55Å; D679-K682 PolarHBondContact OD1-NZ 3.37Å; D679-H683 WeakPolarHBondContact O-CB 3.26Å; D679-H683 PolarHBondContact O-N 3.46Å
680	M	94.7	Very high	92	Very high	37 Å²	37	70.5 Å²	70.5	18%	0.182	37%	0.365	C	S	.	.	H	α-helix	trans	-56.6	-43.4	168.8	-176.6	-80.2	-63.5	0	0	111	F674 Q676 K677 H683 T684	F674-M680 HydrophobicContact CB-CB 4.08Å; F674-M680 HydrophobicContact CD2-CB 3.76Å; F674-M680 HydrophobicContact CD2-CG 4.03Å; F674-M680 HydrophobicContact CG-CB 4.03Å; Q676-M680 PolarHBondContact O-N 3.23Å; K677-M680 HydrophobicContact CG-CE 4.4Å; M680-H683 PolarHBondContact O-N 3.06Å; M680-T684 PolarHBondContact O-N 2.92Å; M680-T684 HydrophobicContact SD-CG2 3.99Å
681	K	91.9	Very high	91.7	Very high	124 Å²	124	71.4 Å²	71.4	54%	0.539	36%	0.362	S	S	.	.	H	α-helix	trans	-66.5	-45.5	175.8	-172.1	-179.8	178.6	-177.7	0	112.5	K677 S678 D679 H683 T684	K677-K681 WeakPolarHBondContact O-CB 3.46Å; K677-K681 PolarHBondContact O-N 3.4Å; S678-K681 WeakPolarHBondContact O-CB 3.45Å; S678-K681 PolarHBondContact O-N 3.34Å; S678-K681 VanDerWaalsContact O-N 3.15Å; D679-K681 VanDerWaalsContact C-N 3.28Å; D679-K681 PolarHBondContact O-N 2.98Å; K681-H683 PolarHBondContact O-N 3.48Å; K681-T684 PolarHBondContact O-N 3.28Å; K681-T684 VanDerWaalsContact O-N 3.07Å; K681-T684 PolarHBondContact O-OG1 3.19Å
682	K	90.3	Very high	91.5	Very high	100 Å²	100	72.9 Å²	72.9	44%	0.435	36%	0.364	S	S	.	.	H	α-helix	trans	-52.5	-45.1	173.1	-66.1	171.8	-166.7	161.6	0	110.3	S678 D679 Y685	S678-K682 WeakPolarHBondContact O-CG 3.32Å; S678-K682 PolarHBondContact O-N 2.84Å; D679-K682 PolarHBondContact O-N 3.01Å; D679-K682 WeakPolarHBondContact OD1-CE 3.46Å; D679-K682 IonicContact OD1-NZ 3.55Å; D679-K682 PolarHBondContact OD1-NZ 3.37Å; K682-Y685 WeakPolarHBondContact O-CB 3.36Å; K682-Y685 WeakPolarHBondContact O-CD2 3.36Å; K682-Y685 PolarHBondContact O-N 3.42Å
683	H	94.2	Very high	91.2	Very high	27 Å²	27	71.2 Å²	71.2	13%	0.125	35%	0.354	C	S	.	.	H	α-helix	trans	-66.9	-32.3	178.1	171.5	58.2	0	0	0	113.8	C667 C670 F674 D679 M680 K681 Y685 T686 H687	C667-H683 VanDerWaalsContact SG-CD2 3.56Å; C670-H683 PolarHBondContact SG-NE2 2.7Å; F674-H683 HydrophobicContact CE1-CB 3.98Å; F674-H683 HydrophobicContact CE2-CB 4.11Å; F674-H683 AromaticContact CE2-CD2 3.42Å; F674-H683 VanDerWaalsContact CE2-CD2 3.42Å; F674-H683 WeakPolarHBondContact CE2-CD2 3.47Å; F674-H683 AromaticContact CE2-CG 3.9Å; F674-H683 HydrophobicContact CZ-CB 3.52Å; F674-H683 AromaticContact CZ-CD2 3.35Å; F674-H683 WeakPolarHBondContact CZ-CD2 3.28Å; F674-H683 AromaticContact CZ-CG 3.37Å; D679-H683 WeakPolarHBondContact O-CB 3.26Å; D679-H683 PolarHBondContact O-N 3.46Å; M680-H683 PolarHBondContact O-N 3.06Å; K681-H683 PolarHBondContact O-N 3.48Å; H683-Y685 PolarHBondContact O-N 3.09Å; H683-T686 PolarHBondContact CE1-OG1 2.71Å; H683-T686 VanDerWaalsContact CE1-OG1 3.31Å; H683-T686 PolarHBondContact ND1-OG1 2.79Å; H683-T686 PolarHBondContact O-N 2.93Å; H683-T686 PolarHBondContact O-OG1 3.21Å; H683-H687 AromaticContact CD2-NE2 3.26Å; H683-H687 PolarHBondContact CD2-NE2 3.31Å; H683-H687 VanDerWaalsContact CD2-NE2 3.26Å; H683-H687 AromaticContact CE1-CD2 3.87Å; H683-H687 AromaticContact CE1-NE2 2.41Å; H683-H687 PolarHBondContact CE1-NE2 3.02Å; H683-H687 AromaticContact CG-NE2 3.96Å; H683-H687 AromaticContact ND1-NE2 3.54Å; H683-H687 AromaticContact NE2-CD2 3.72Å; H683-H687 AromaticContact NE2-NE2 2.12Å; H683-H687 PolarHBondContact NE2-NE2 3.18Å
684	T	92.4	Very high	90.9	Very high	26 Å²	26	69.7 Å²	69.7	16%	0.16	36%	0.355	C	S	.	.	H	α-helix	trans	-58.3	-24.6	176.7	53.7	0	0	0	0	113.6	Y669 M680 K681 T686 H687 T688	Y669-T684 HydrophobicContact CD2-CG2 4.22Å; Y669-T684 HydrophobicContact CE2-CG2 4.11Å; M680-T684 PolarHBondContact O-N 2.92Å; M680-T684 HydrophobicContact SD-CG2 3.99Å; K681-T684 PolarHBondContact O-N 3.28Å; K681-T684 VanDerWaalsContact O-N 3.07Å; K681-T684 PolarHBondContact O-OG1 3.19Å; T684-T686 PolarHBondContact O-N 3.41Å; T684-H687 PolarHBondContact O-N 2.85Å; T684-T688 PolarHBondContact O-N 3.12Å; T684-T688 PolarHBondContact O-OG1 3.39Å
685	Y	92.4	Very high	90.6	Very high	44 Å²	44	68.5 Å²	68.5	17%	0.173	35%	0.35	C	S	.	.	H	α-helix	trans	-65	-21	173.4	-56	-38	0	0	0	114.1	K682 H683 H687 G689 E690	K682-Y685 WeakPolarHBondContact O-CB 3.36Å; K682-Y685 WeakPolarHBondContact O-CD2 3.36Å; K682-Y685 PolarHBondContact O-N 3.42Å; H683-Y685 PolarHBondContact O-N 3.09Å; Y685-H687 PolarHBondContact O-N 2.96Å; Y685-G689 WeakPolarHBondContact O-CA 3.48Å; Y685-G689 PolarHBondContact O-N 3.41Å; Y685-E690 HydrophobicContact CD1-CB 4Å
686	T	93.3	Very high	90.5	Very high	93 Å²	93	74.9 Å²	74.9	57%	0.571	39%	0.385	S	S	*	.	H	α-helix	trans	-72.6	-19.4	172.2	74.4	0	0	0	0	112.3	H683 T684	H683-T686 PolarHBondContact CE1-OG1 2.71Å; H683-T686 VanDerWaalsContact CE1-OG1 3.31Å; H683-T686 PolarHBondContact ND1-OG1 2.79Å; H683-T686 PolarHBondContact O-N 2.93Å; H683-T686 PolarHBondContact O-OG1 3.21Å; T684-T686 PolarHBondContact O-N 3.41Å
687	H	93.4	Very high	90.2	Very high	89 Å²	89	77.8 Å²	77.8	41%	0.412	40%	0.398	S	S	.	.	H	α-helix	trans	-97.6	-38	177.8	-62.9	-78.2	0	0	0	112.4	Y669 C670 H683 T684 Y685	Y669-H687 VanDerWaalsContact CB-CG 3.47Å; Y669-H687 HydrophobicContact CD1-CB 4.35Å; Y669-H687 HydrophobicContact CD2-CB 3.57Å; Y669-H687 AromaticContact CD2-CG 3.83Å; Y669-H687 HydrophobicContact CE2-CB 4.16Å; Y669-H687 HydrophobicContact CG-CB 3.68Å; Y669-H687 AromaticContact CG-CG 3.81Å; C670-H687 WeakPolarHBondContact CB-CE1 3.44Å; C670-H687 PolarHBondContact SG-CE1 2.79Å; C670-H687 PolarHBondContact SG-NE2 3.34Å; H683-H687 AromaticContact CD2-NE2 3.26Å; H683-H687 PolarHBondContact CD2-NE2 3.31Å; H683-H687 VanDerWaalsContact CD2-NE2 3.26Å; H683-H687 AromaticContact CE1-CD2 3.87Å; H683-H687 AromaticContact CE1-NE2 2.41Å; H683-H687 PolarHBondContact CE1-NE2 3.02Å; H683-H687 AromaticContact CG-NE2 3.96Å; H683-H687 AromaticContact ND1-NE2 3.54Å; H683-H687 AromaticContact NE2-CD2 3.72Å; H683-H687 AromaticContact NE2-NE2 2.12Å; H683-H687 PolarHBondContact NE2-NE2 3.18Å; T684-H687 PolarHBondContact O-N 2.85Å; Y685-H687 PolarHBondContact O-N 2.96Å
688	T	91.2	Very high	90.2	Very high	57 Å²	57	73.8 Å²	73.8	35%	0.35	39%	0.387	S	S	.	.	H	α-helix	trans	-80.6	-19.1	177.2	62.9	0	0	0	0	113	Y669 T684 E690	Y669-T688 HydrophobicContact CE2-CG2 4.32Å; T684-T688 PolarHBondContact O-N 3.12Å; T684-T688 PolarHBondContact O-OG1 3.39Å; T688-E690 PolarHBondContact O-N 2.78Å; T688-E690 WeakPolarHBondContact OG1-CB 3.48Å; T688-E690 WeakPolarHBondContact OG1-CG 3.36Å; T688-E690 PolarHBondContact OG1-N 2.97Å; T688-E690 PolarHBondContact OG1-OE2 3.14Å; T688-E690 VanDerWaalsContact OG1-OE2 3.05Å
689	G	90	Very high	90.1	Very high	50 Å²	50	73.9 Å²	73.9	52%	0.515	40%	0.396	S	S	.	.			trans	69.7	7.7	-172	0	0	0	0	0	113.6	Y685 K691	Y685-G689 WeakPolarHBondContact O-CA 3.48Å; Y685-G689 PolarHBondContact O-N 3.41Å; G689-K691 PolarHBondContact O-N 2.85Å
690	E	88.3	Confident	90.1	Very high	110 Å²	110	78.2 Å²	78.2	51%	0.514	41%	0.413	S	S	.	.			trans	-66.6	119.5	-178.6	-73.3	172.7	146	0	0	110.9	Y685 T688 P692	Y685-E690 HydrophobicContact CD1-CB 4Å; T688-E690 PolarHBondContact O-N 2.78Å; T688-E690 WeakPolarHBondContact OG1-CB 3.48Å; T688-E690 WeakPolarHBondContact OG1-CG 3.36Å; T688-E690 PolarHBondContact OG1-N 2.97Å; T688-E690 PolarHBondContact OG1-OE2 3.14Å; T688-E690 VanDerWaalsContact OG1-OE2 3.05Å; E690-P692 VanDerWaalsContact C-CD 3.49Å; E690-P692 WeakPolarHBondContact O-CD 3.44Å
691	K	90.1	Very high	89.9	Confident	80 Å²	80	78.4 Å²	78.4	35%	0.348	42%	0.42	S	S	.	.			trans	-119.3	75.1	177.8	-70.1	-174.3	-172.4	-88	0	109.3	D539 G689 Y693 A701 F702	D539-K691 IonicContact OD1-NZ 2.71Å; D539-K691 IonicContact OD2-NZ 2.64Å; D539-K691 PolarHBondContact OD2-NZ 3.41Å; G689-K691 PolarHBondContact O-N 2.85Å; K691-Y693 VanDerWaalsContact C-N 3.27Å; K691-Y693 PolarHBondContact O-N 3.11Å; K691-A701 HydrophobicContact CB-CB 3.75Å; K691-A701 WeakPolarHBondContact O-CB 3.36Å; K691-F702 CarbonylContact C-O 3.59Å; K691-F702 VanDerWaalsContact CA-O 3.25Å; K691-F702 WeakPolarHBondContact CA-O 3.36Å
692	P	86.3	Confident	89.8	Confident	74 Å²	74	74.3 Å²	74.3	48%	0.481	40%	0.402	S	S	.	.			trans	-70.9	-13.7	-169.3	27.5	-35.1	0	0	0	115	E690	E690-P692 VanDerWaalsContact C-CD 3.49Å; E690-P692 WeakPolarHBondContact O-CD 3.44Å
693	Y	87.1	Confident	89.8	Confident	91 Å²	91	70.3 Å²	70.3	36%	0.357	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	97.7	-176.3	-58.4	-75.8	0	0	0	111.1	K691 A701 F702 S703 S705	K691-Y693 VanDerWaalsContact C-N 3.27Å; K691-Y693 PolarHBondContact O-N 3.11Å; Y693-A701 CarbonylContact O-C 3.53Å; Y693-F702 PolarHBondContact N-O 2.84Å; Y693-F702 PolarHBondContact O-N 2.95Å; Y693-S703 WeakPolarHBondContact CE2-O 3.26Å; Y693-S705 VanDerWaalsContact CD2-N 3.34Å
694	I	86.1	Confident	89.5	Confident	96 Å²	96	71.6 Å²	71.6	49%	0.492	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	131.8	-174	-53.9	177.8	0	0	0	111.9	L696 A701	I694-L696 PolarHBondContact O-N 2.91Å; I694-A701 HydrophobicContact CG1-CB 4.12Å
695	C	87.6	Confident	89.3	Confident	5 Å²	5	73.1 Å²	73.1	3%	0.034	41%	0.405	C	S	.	.			trans	-80.1	108.6	172.6	-172	0	0	0	0	111.7	Q697 C698 G699 K700 F702 L708	C695-Q697 PolarHBondContact O-N 3.41Å; C695-Q697 VanDerWaalsContact O-N 3.09Å; C695-C698 PolarHBondContact O-N 3.49Å; C695-G699 WeakPolarHBondContact O-CA 3.37Å; C695-G699 PolarHBondContact O-N 2.9Å; C695-K700 WeakPolarHBondContact CB-O 3.39Å; C695-K700 PolarHBondContact N-O 2.97Å; C695-F702 HydrophobicContact CB-CE2 4.32Å; C695-L708 HydrophobicContact CB-CD1 3.52Å
696	L	87	Confident	88.8	Confident	171 Å²	171	73.3 Å²	73.3	90%	0.895	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-17.3	-178	-56.9	-179.7	0	0	0	114.5	I694	I694-L696 PolarHBondContact O-N 2.91Å
697	Q	84.9	Confident	88.6	Confident	132 Å²	132	71 Å²	71	62%	0.617	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-19.7	179.6	-66.8	-175.6	-70.1	0	0	114.1	C695 H715	C695-Q697 PolarHBondContact O-N 3.41Å; C695-Q697 VanDerWaalsContact O-N 3.09Å; Q697-H715 PolarHBondContact OE1-CD2 3.16Å
698	C	92.5	Very high	88.2	Confident	50 Å²	50	68.6 Å²	68.6	34%	0.338	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.4	-0.6	-174.5	71.6	0	0	0	0	115.1	C695 K700 H711 H715	C695-C698 PolarHBondContact O-N 3.49Å; C698-K700 PolarHBondContact O-N 3.4Å; C698-H711 PolarHBondContact SG-NE2 3.37Å; C698-H715 WeakPolarHBondContact CB-NE2 3.37Å
699	G	86.8	Confident	87.9	Confident	54 Å²	54	70.4 Å²	70.4	56%	0.557	39%	0.393	S	S	*	.			trans	73.8	-6.4	-178.9	0	0	0	0	0	115.5	C695 A701	C695-G699 WeakPolarHBondContact O-CA 3.37Å; C695-G699 PolarHBondContact O-N 2.9Å; G699-A701 PolarHBondContact O-N 3.31Å
700	K	92.2	Very high	87.5	Confident	133 Å²	133	70 Å²	70	58%	0.578	38%	0.381	S	S	*	.			trans	-67.2	133.3	-179.9	-68.9	-162.3	173.2	-160.4	0	111.6	C695 C698 F702	C695-K700 WeakPolarHBondContact CB-O 3.39Å; C695-K700 PolarHBondContact N-O 2.97Å; C698-K700 PolarHBondContact O-N 3.4Å; K700-F702 HydrophobicContact CB-CE2 3.97Å; K700-F702 HydrophobicContact CB-CZ 4.05Å; K700-F702 WeakPolarHBondContact O-CE2 3.42Å
701	A	90.5	Very high	87.6	Confident	41 Å²	41	65.8 Å²	65.8	34%	0.339	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	145.8	-177.6	0	0	0	0	0	111.6	K691 Y693 I694 G699	K691-A701 HydrophobicContact CB-CB 3.75Å; K691-A701 WeakPolarHBondContact O-CB 3.36Å; Y693-A701 CarbonylContact O-C 3.53Å; I694-A701 HydrophobicContact CG1-CB 4.12Å; G699-A701 PolarHBondContact O-N 3.31Å
702	F	90.2	Very high	87.2	Confident	37 Å²	37	63.8 Å²	63.8	16%	0.162	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	146.5	-178.2	-59.4	-86.2	0	0	0	111.8	K691 Y693 C695 K700 Q704 N707 L708 H711	K691-F702 CarbonylContact C-O 3.59Å; K691-F702 VanDerWaalsContact CA-O 3.25Å; K691-F702 WeakPolarHBondContact CA-O 3.36Å; Y693-F702 PolarHBondContact N-O 2.84Å; Y693-F702 PolarHBondContact O-N 2.95Å; C695-F702 HydrophobicContact CB-CE2 4.32Å; K700-F702 HydrophobicContact CB-CE2 3.97Å; K700-F702 HydrophobicContact CB-CZ 4.05Å; K700-F702 WeakPolarHBondContact O-CE2 3.42Å; F702-Q704 VanDerWaalsContact C-N 3.34Å; F702-N707 HydrophobicContact CB-CB 4.31Å; F702-N707 HydrophobicContact CD1-CB 3.98Å; F702-N707 HydrophobicContact CG-CB 4.39Å; F702-L708 HydrophobicContact CB-CB 4.41Å; F702-L708 HydrophobicContact CD2-CB 4.01Å; F702-L708 HydrophobicContact CD2-CD1 4.02Å; F702-L708 HydrophobicContact CE2-CD1 4.24Å; F702-L708 HydrophobicContact CG-CB 4.4Å; F702-H711 HydrophobicContact CE1-CB 4.1Å; F702-H711 HydrophobicContact CE2-CB 3.91Å; F702-H711 AromaticContact CE2-CD2 3.63Å; F702-H711 AromaticContact CE2-CG 3.68Å; F702-H711 HydrophobicContact CZ-CB 3.56Å; F702-H711 AromaticContact CZ-CD2 3.67Å; F702-H711 AromaticContact CZ-CG 3.3Å; F702-H711 AromaticContact CZ-ND1 3.57Å
703	S	89.3	Confident	87.2	Confident	17 Å²	17	62.9 Å²	62.9	12%	0.119	35%	0.345	C	S	.	.	S	Bend	trans	-73.3	-24.8	175.4	42.2	0	0	0	0	112.8	Y693	Y693-S703 WeakPolarHBondContact CE2-O 3.26Å
704	Q	88.8	Confident	87.2	Confident	53 Å²	53	64.7 Å²	64.7	25%	0.248	35%	0.354	C	S	.	.	S	Bend	trans	-127.3	147.1	-179.7	-51.7	-169.3	31.2	0	0	112.2	F702 S706 N707 L708	F702-Q704 VanDerWaalsContact C-N 3.34Å; Q704-S706 VanDerWaalsContact CB-OG 3.27Å; Q704-S706 WeakPolarHBondContact CB-OG 3.42Å; Q704-S706 PolarHBondContact OE1-OG 2.91Å; Q704-N707 PolarHBondContact O-N 2.84Å; Q704-L708 PolarHBondContact O-N 3.44Å
705	S	86.6	Confident	87	Confident	58 Å²	58	64.6 Å²	64.6	41%	0.406	35%	0.352	S	S	.	.	H	α-helix	trans	-68.5	-35.8	177.2	51.6	0	0	0	0	112.7	Y693 N707 L708 I709	Y693-S705 VanDerWaalsContact CD2-N 3.34Å; S705-N707 VanDerWaalsContact C-N 3.29Å; S705-N707 PolarHBondContact O-N 3.48Å; S705-L708 PolarHBondContact O-N 2.91Å; S705-I709 WeakPolarHBondContact O-CG1 3.39Å; S705-I709 PolarHBondContact O-N 3.46Å
706	S	83.1	Confident	86.8	Confident	49 Å²	49	68.8 Å²	68.8	34%	0.343	38%	0.377	S	S	.	.	H	α-helix	trans	-48.9	-49.7	168.8	46.3	0	0	0	0	111.7	Q704 I709 T710	Q704-S706 VanDerWaalsContact CB-OG 3.27Å; Q704-S706 WeakPolarHBondContact CB-OG 3.42Å; Q704-S706 PolarHBondContact OE1-OG 2.91Å; S706-I709 PolarHBondContact O-N 3.34Å; S706-I709 VanDerWaalsContact O-N 3.16Å; S706-T710 PolarHBondContact O-N 2.92Å; S706-T710 PolarHBondContact O-OG1 3.39Å
707	N	87.9	Confident	86.5	Confident	44 Å²	44	62.7 Å²	62.7	24%	0.235	36%	0.356	C	S	.	.	H	α-helix	trans	-71.4	-32.5	-177.6	-68.4	-3.2	0	0	0	112.3	F702 Q704 S705 T710 H711	F702-N707 HydrophobicContact CB-CB 4.31Å; F702-N707 HydrophobicContact CD1-CB 3.98Å; F702-N707 HydrophobicContact CG-CB 4.39Å; Q704-N707 PolarHBondContact O-N 2.84Å; S705-N707 VanDerWaalsContact C-N 3.29Å; S705-N707 PolarHBondContact O-N 3.48Å; N707-T710 PolarHBondContact O-OG1 2.86Å; N707-H711 WeakPolarHBondContact O-CB 3.44Å; N707-H711 PolarHBondContact O-N 3.23Å
708	L	87	Confident	86.2	Confident	39 Å²	39	62.3 Å²	62.3	20%	0.204	35%	0.352	C	S	.	.	H	α-helix	trans	-65	-41.8	167.7	173.6	60	0	0	0	112	C695 F702 Q704 S705 H711 S712	C695-L708 HydrophobicContact CB-CD1 3.52Å; F702-L708 HydrophobicContact CB-CB 4.41Å; F702-L708 HydrophobicContact CD2-CB 4.01Å; F702-L708 HydrophobicContact CD2-CD1 4.02Å; F702-L708 HydrophobicContact CE2-CD1 4.24Å; F702-L708 HydrophobicContact CG-CB 4.4Å; Q704-L708 PolarHBondContact O-N 3.44Å; S705-L708 PolarHBondContact O-N 2.91Å; L708-H711 PolarHBondContact O-N 3.03Å; L708-S712 PolarHBondContact O-N 2.9Å
709	I	83.1	Confident	85.9	Confident	94 Å²	94	65 Å²	65	48%	0.482	36%	0.358	S	S	.	.	H	α-helix	trans	-65.9	-49	179.6	-69.9	164.6	0	0	0	110.4	S705 S706 H711 S712 R713	S705-I709 WeakPolarHBondContact O-CG1 3.39Å; S705-I709 PolarHBondContact O-N 3.46Å; S706-I709 PolarHBondContact O-N 3.34Å; S706-I709 VanDerWaalsContact O-N 3.16Å; I709-H711 VanDerWaalsContact C-N 3.31Å; I709-H711 PolarHBondContact O-N 3.27Å; I709-S712 PolarHBondContact O-N 2.91Å; I709-S712 PolarHBondContact O-OG 3.05Å; I709-R713 PolarHBondContact O-N 3.36Å
710	T	83.1	Confident	85.6	Confident	41 Å²	41	65 Å²	65	25%	0.252	35%	0.348	S	S	.	.	H	α-helix	trans	-65.5	-33.7	176.7	59.6	0	0	0	0	112.1	S706 N707 R713	S706-T710 PolarHBondContact O-N 2.92Å; S706-T710 PolarHBondContact O-OG1 3.39Å; N707-T710 PolarHBondContact O-OG1 2.86Å; T710-R713 WeakPolarHBondContact O-CB 3.45Å
711	H	89.6	Confident	85.2	Confident	22 Å²	22	61.2 Å²	61.2	10%	0.102	33%	0.332	C	S	.	.	H	α-helix	trans	-63	-46	171.4	177.5	74.7	0	0	0	112.7	C698 F702 N707 L708 I709 R713 K714 H715	C698-H711 PolarHBondContact SG-NE2 3.37Å; F702-H711 HydrophobicContact CE1-CB 4.1Å; F702-H711 HydrophobicContact CE2-CB 3.91Å; F702-H711 AromaticContact CE2-CD2 3.63Å; F702-H711 AromaticContact CE2-CG 3.68Å; F702-H711 HydrophobicContact CZ-CB 3.56Å; F702-H711 AromaticContact CZ-CD2 3.67Å; F702-H711 AromaticContact CZ-CG 3.3Å; F702-H711 AromaticContact CZ-ND1 3.57Å; N707-H711 WeakPolarHBondContact O-CB 3.44Å; N707-H711 PolarHBondContact O-N 3.23Å; L708-H711 PolarHBondContact O-N 3.03Å; I709-H711 VanDerWaalsContact C-N 3.31Å; I709-H711 PolarHBondContact O-N 3.27Å; H711-R713 PolarHBondContact O-N 3.47Å; H711-R713 VanDerWaalsContact O-N 3.14Å; H711-K714 VanDerWaalsContact O-CB 3.22Å; H711-K714 WeakPolarHBondContact O-CB 3.41Å; H711-K714 PolarHBondContact O-N 3.28Å; H711-H715 AromaticContact NE2-NE2 3.86Å
712	S	81	Confident	85	Confident	39 Å²	39	62 Å²	62	27%	0.273	34%	0.335	S	S	.	.	H	α-helix	trans	-61.5	-25.9	-176.9	68.1	0	0	0	0	113.8	L708 I709 K714 H715 T716	L708-S712 PolarHBondContact O-N 2.9Å; I709-S712 PolarHBondContact O-N 2.91Å; I709-S712 PolarHBondContact O-OG 3.05Å; S712-K714 PolarHBondContact O-N 3.4Å; S712-H715 PolarHBondContact O-N 3.31Å; S712-T716 PolarHBondContact O-N 2.74Å; S712-T716 PolarHBondContact O-OG1 2.79Å
713	R	86.9	Confident	85.1	Confident	55 Å²	55	60.3 Å²	60.3	21%	0.208	33%	0.328	C	S	.	.	H	α-helix	trans	-58.8	-22.7	170.3	-63	178.1	-169.8	168.5	4	113.5	I709 T710 H711 G717 F718 Q731	I709-R713 PolarHBondContact O-N 3.36Å; T710-R713 WeakPolarHBondContact O-CB 3.45Å; H711-R713 PolarHBondContact O-N 3.47Å; H711-R713 VanDerWaalsContact O-N 3.14Å; R713-G717 CarbonylContact O-C 3.33Å; R713-G717 WeakPolarHBondContact O-CA 3.5Å; R713-G717 PolarHBondContact O-N 3.36Å; R713-G717 VanDerWaalsContact O-N 3.1Å; R713-F718 PolarHBondContact O-N 2.64Å; R713-Q731 HydrophobicContact CB-CB 4.47Å; R713-Q731 HydrophobicContact CB-CG 4.44Å; R713-Q731 WeakPolarHBondContact CD-O 3.45Å; R713-Q731 PolarHBondContact NH1-O 3.28Å; R713-Q731 PolarHBondContact O-NE2 3.25Å
714	K	86.1	Confident	85	Confident	128 Å²	128	68.1 Å²	68.1	56%	0.557	36%	0.36	S	S	*	.	H	α-helix	trans	-70.8	-33.4	174.5	-64.7	179.7	176.8	-177.2	0	112.3	H711 S712	H711-K714 VanDerWaalsContact O-CB 3.22Å; H711-K714 WeakPolarHBondContact O-CB 3.41Å; H711-K714 PolarHBondContact O-N 3.28Å; S712-K714 PolarHBondContact O-N 3.4Å
715	H	83.9	Confident	84.9	Confident	95 Å²	95	69.7 Å²	69.7	44%	0.44	37%	0.367	S	S	.	.	H	α-helix	trans	-81.4	-36.3	178	-57.9	-47.7	0	0	0	113.1	Q697 C698 H711 S712 G717	Q697-H715 PolarHBondContact OE1-CD2 3.16Å; C698-H715 WeakPolarHBondContact CB-NE2 3.37Å; H711-H715 AromaticContact NE2-NE2 3.86Å; S712-H715 PolarHBondContact O-N 3.31Å; H715-G717 VanDerWaalsContact C-N 3.34Å
716	T	81.5	Confident	85.2	Confident	93 Å²	93	69.4 Å²	69.4	57%	0.571	36%	0.364	S	S	*	.	H	α-helix	trans	-83.1	-11.9	179	59.1	0	0	0	0	113.5	S712 F718	S712-T716 PolarHBondContact O-N 2.74Å; S712-T716 PolarHBondContact O-OG1 2.79Å; T716-F718 PolarHBondContact O-N 2.87Å; T716-F718 WeakPolarHBondContact OG1-CB 3.47Å; T716-F718 PolarHBondContact OG1-N 3.14Å
717	G	80.8	Confident	85.4	Confident	43 Å²	43	73.6 Å²	73.6	44%	0.443	38%	0.382	S	S	.	.			trans	68.2	3	-170.8	0	0	0	0	0	114.2	R713 H715 K719	R713-G717 CarbonylContact O-C 3.33Å; R713-G717 WeakPolarHBondContact O-CA 3.5Å; R713-G717 PolarHBondContact O-N 3.36Å; R713-G717 VanDerWaalsContact O-N 3.1Å; H715-G717 VanDerWaalsContact C-N 3.34Å; G717-K719 WeakPolarHBondContact O-CG 3.47Å; G717-K719 PolarHBondContact O-N 2.99Å
718	F	79.1	Confident	85.5	Confident	124 Å²	124	79 Å²	79	54%	0.544	40%	0.399	S	S	.	.			trans	-67.5	124.1	-170.6	-176.6	-111.8	0	0	0	112.3	R713 T716 P720	R713-F718 PolarHBondContact O-N 2.64Å; T716-F718 PolarHBondContact O-N 2.87Å; T716-F718 WeakPolarHBondContact OG1-CB 3.47Å; T716-F718 PolarHBondContact OG1-N 3.14Å; F718-P720 HydrophobicContact CD1-CG 4.28Å; F718-P720 HydrophobicContact CE1-CB 3.76Å; F718-P720 HydrophobicContact CE1-CG 3.86Å; F718-P720 HydrophobicContact CZ-CB 3.98Å
719	K	86.6	Confident	85.6	Confident	105 Å²	105	78.5 Å²	78.5	46%	0.457	40%	0.401	S	S	.	.			trans	-128.5	83.8	-171.1	-78.3	161.6	158.5	-130.4	0	110.3	G717 F721 A729 F730 Q731	G717-K719 WeakPolarHBondContact O-CG 3.47Å; G717-K719 PolarHBondContact O-N 2.99Å; K719-F721 VanDerWaalsContact C-N 3.27Å; K719-F721 PolarHBondContact O-N 3.23Å; K719-A729 HydrophobicContact CB-CB 3.68Å; K719-A729 HydrophobicContact CD-CB 4.32Å; K719-A729 VanDerWaalsContact CD-O 3.29Å; K719-A729 WeakPolarHBondContact CD-O 3.35Å; K719-A729 WeakPolarHBondContact CE-O 3.45Å; K719-A729 PolarHBondContact NZ-O 3.2Å; K719-F730 CarbonylContact C-O 3.59Å; K719-F730 VanDerWaalsContact C-O 3.29Å; K719-F730 VanDerWaalsContact CA-O 3.24Å; K719-F730 WeakPolarHBondContact CA-O 3.3Å; K719-Q731 HydrophobicContact CG-CG 3.69Å
720	P	80.7	Confident	86	Confident	55 Å²	55	76 Å²	76	36%	0.357	39%	0.387	S	S	.	.			trans	-73.9	-13.4	-174.4	27.4	-32.6	0	0	0	114.2	F718	F718-P720 HydrophobicContact CD1-CG 4.28Å; F718-P720 HydrophobicContact CE1-CB 3.76Å; F718-P720 HydrophobicContact CE1-CG 3.86Å; F718-P720 HydrophobicContact CZ-CB 3.98Å
721	F	84.3	Confident	86.1	Confident	53 Å²	53	76 Å²	76	23%	0.232	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	92.9	-172.3	-58.1	-69.4	0	0	0	111.9	K719 F730 K733 L736	K719-F721 VanDerWaalsContact C-N 3.27Å; K719-F721 PolarHBondContact O-N 3.23Å; F721-F730 HydrophobicContact CB-CB 4.36Å; F721-F730 PolarHBondContact N-O 3.38Å; F721-F730 WeakPolarHBondContact O-CD2 3.28Å; F721-F730 PolarHBondContact O-N 3.4Å; F721-K733 HydrophobicContact CD1-CB 4.49Å; F721-K733 HydrophobicContact CE1-CB 4.13Å; F721-K733 HydrophobicContact CE1-CG 4.48Å; F721-K733 HydrophobicContact CE2-CB 4.37Å; F721-K733 HydrophobicContact CZ-CB 4.05Å; F721-L736 HydrophobicContact CB-CB 4.12Å; F721-L736 HydrophobicContact CB-CD2 3.91Å
722	S	86.7	Confident	86	Confident	58 Å²	58	78 Å²	78	41%	0.406	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	143	174	-59.4	0	0	0	0	113.1	R728	S722-R728 WeakPolarHBondContact CA-O 3.27Å
723	C	90.4	Very high	86.1	Confident	1 Å²	1	78.1 Å²	78.1	1%	0.007	39%	0.386	C	S	.	.			trans	-78.8	135.6	167	-177.6	0	0	0	0	110.8	L727 R728 F730 L736 H739 H744	C723-L727 WeakPolarHBondContact O-CA 3.33Å; C723-L727 PolarHBondContact O-N 3.18Å; C723-R728 PolarHBondContact N-O 3.09Å; C723-F730 HydrophobicContact CB-CE2 4.38Å; C723-L736 HydrophobicContact CB-CD1 3.66Å; C723-H739 WeakPolarHBondContact CB-NE2 3.33Å; C723-H739 PolarHBondContact SG-NE2 2.95Å; C723-H744 PolarHBondContact SG-CD2 2.94Å; C723-H744 PolarHBondContact SG-NE2 3.4Å
724	F	87.9	Confident	86.2	Confident	182 Å²	182	76 Å²	76	80%	0.798	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-32.1	179.6	-170	-99.2	0	0	0	112.9
725	H	86.4	Confident	86.5	Confident	86 Å²	86	71.1 Å²	71.1	40%	0.398	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-31.5	-170.5	-58.1	-95.1	0	0	0	113.8	H744 D748	H725-H744 AromaticContact CG-CD2 3.99Å; H725-H744 AromaticContact CG-CG 3.9Å; H725-D748 IonicContact CE1-OD1 2.66Å; H725-D748 PolarHBondContact CE1-OD1 3.46Å; H725-D748 IonicContact CE1-OD2 2.78Å; H725-D748 PolarHBondContact CE1-OD2 2.87Å; H725-D748 IonicContact ND1-OD2 3.5Å; H725-D748 WeakPolarHBondContact NE2-CB 3.3Å; H725-D748 VanDerWaalsContact NE2-CG 3.31Å; H725-D748 IonicContact NE2-OD1 3.23Å; H725-D748 IonicContact NE2-OD2 2.67Å
726	C	92.7	Very high	86.9	Confident	51 Å²	51	67 Å²	67	35%	0.345	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.1	7.6	-178.6	69.6	0	0	0	0	114.3	R728 H739	C726-R728 PolarHBondContact O-N 3.43Å; C726-H739 VanDerWaalsContact SG-CE1 3.51Å; C726-H739 PolarHBondContact SG-NE2 3.43Å
727	L	87.8	Confident	87.3	Confident	137 Å²	137	67.6 Å²	67.6	72%	0.717	33%	0.332	S	S	*	.			trans	56.4	6	178.2	-55.2	179.8	0	0	0	116.2	C723 A729	C723-L727 WeakPolarHBondContact O-CA 3.33Å; C723-L727 PolarHBondContact O-N 3.18Å; L727-A729 PolarHBondContact O-N 3.35Å
728	R	90.9	Very high	87.9	Confident	157 Å²	157	71.8 Å²	71.8	59%	0.592	34%	0.335	S	S	*	.			trans	-62.2	133.6	173.9	-71.8	-178	172.1	-175.1	-1.4	110.6	S722 C723 C726 F730	S722-R728 WeakPolarHBondContact CA-O 3.27Å; C723-R728 PolarHBondContact N-O 3.09Å; C726-R728 PolarHBondContact O-N 3.43Å; R728-F730 HydrophobicContact CB-CE2 3.77Å; R728-F730 HydrophobicContact CB-CZ 4Å; R728-F730 WeakPolarHBondContact O-CD2 3.31Å; R728-F730 VanDerWaalsContact O-CE2 3.24Å; R728-F730 WeakPolarHBondContact O-CE2 3.28Å
729	A	89.1	Confident	88.6	Confident	29 Å²	29	66.5 Å²	66.5	24%	0.24	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	137.9	-177.1	0	0	0	0	0	112.7	K719 L727	K719-A729 HydrophobicContact CB-CB 3.68Å; K719-A729 HydrophobicContact CD-CB 4.32Å; K719-A729 VanDerWaalsContact CD-O 3.29Å; K719-A729 WeakPolarHBondContact CD-O 3.35Å; K719-A729 WeakPolarHBondContact CE-O 3.45Å; K719-A729 PolarHBondContact NZ-O 3.2Å; L727-A729 PolarHBondContact O-N 3.35Å
730	F	90.4	Very high	88.7	Confident	43 Å²	43	62.1 Å²	62.1	19%	0.189	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	155.8	-172.3	-60.5	-91.9	0	0	0	111.7	K719 F721 C723 R728 D735 L736 H739	K719-F730 CarbonylContact C-O 3.59Å; K719-F730 VanDerWaalsContact C-O 3.29Å; K719-F730 VanDerWaalsContact CA-O 3.24Å; K719-F730 WeakPolarHBondContact CA-O 3.3Å; F721-F730 HydrophobicContact CB-CB 4.36Å; F721-F730 PolarHBondContact N-O 3.38Å; F721-F730 WeakPolarHBondContact O-CD2 3.28Å; F721-F730 PolarHBondContact O-N 3.4Å; C723-F730 HydrophobicContact CB-CE2 4.38Å; R728-F730 HydrophobicContact CB-CE2 3.77Å; R728-F730 HydrophobicContact CB-CZ 4Å; R728-F730 WeakPolarHBondContact O-CD2 3.31Å; R728-F730 VanDerWaalsContact O-CE2 3.24Å; R728-F730 WeakPolarHBondContact O-CE2 3.28Å; F730-D735 HydrophobicContact CB-CB 4.27Å; F730-D735 HydrophobicContact CD1-CB 4.11Å; F730-L736 HydrophobicContact CB-CB 4.28Å; F730-L736 HydrophobicContact CD2-CB 4.16Å; F730-L736 HydrophobicContact CD2-CD1 3.91Å; F730-L736 HydrophobicContact CE2-CD1 4.15Å; F730-L736 HydrophobicContact CG-CB 4.33Å; F730-H739 HydrophobicContact CE1-CB 3.87Å; F730-H739 HydrophobicContact CE2-CB 4.09Å; F730-H739 AromaticContact CE2-CD2 3.22Å; F730-H739 WeakPolarHBondContact CE2-CD2 3.45Å; F730-H739 AromaticContact CE2-CG 3.68Å; F730-H739 AromaticContact CE2-NE2 3.91Å; F730-H739 HydrophobicContact CZ-CB 3.55Å; F730-H739 AromaticContact CZ-CD2 3.31Å; F730-H739 WeakPolarHBondContact CZ-CD2 3.3Å; F730-H739 AromaticContact CZ-CG 3.24Å; F730-H739 AromaticContact CZ-ND1 3.89Å; F730-H739 AromaticContact CZ-NE2 3.97Å
731	Q	85.2	Confident	89.2	Confident	40 Å²	40	64.2 Å²	64.2	19%	0.187	30%	0.298	C	S	.	.	S	Bend	trans	-86.3	-23.7	-175	-69.2	175.5	-19.6	0	0	113.6	R713 K719	R713-Q731 HydrophobicContact CB-CB 4.47Å; R713-Q731 HydrophobicContact CB-CG 4.44Å; R713-Q731 WeakPolarHBondContact CD-O 3.45Å; R713-Q731 PolarHBondContact NH1-O 3.28Å; R713-Q731 PolarHBondContact O-NE2 3.25Å; K719-Q731 HydrophobicContact CG-CG 3.69Å
732	R	87.4	Confident	89.5	Confident	63 Å²	63	66 Å²	66	24%	0.238	31%	0.313	C	S	.	.	S	Bend	trans	-133.8	155	-177.3	-45.2	-175	-60.5	149.1	16	110.9	D542 V734 D735 L736	D542-R732 IonicContact OD2-CZ 2.94Å; D542-R732 VanDerWaalsContact OD2-CZ 3.22Å; D542-R732 IonicContact OD2-NH1 3.69Å; D542-R732 PolarHBondContact OD2-NH1 3.23Å; D542-R732 IonicContact OD2-NH2 3.53Å; D542-R732 PolarHBondContact OD2-NH2 2.97Å; D542-R732 VanDerWaalsContact OD2-NH2 3.09Å; R732-V734 HydrophobicContact CB-CG2 3.94Å; R732-D735 WeakPolarHBondContact CB-OD2 3.42Å; R732-D735 WeakPolarHBondContact CG-OD2 3.49Å; R732-D735 IonicContact CZ-OD1 3.22Å; R732-D735 IonicContact CZ-OD2 3.99Å; R732-D735 IonicContact NE-OD1 2.62Å; R732-D735 IonicContact NE-OD2 3.69Å; R732-D735 PolarHBondContact NE-OD2 3Å; R732-D735 IonicContact NH2-OD1 3.59Å; R732-D735 PolarHBondContact NH2-OD1 2.93Å; R732-D735 IonicContact NH2-OD2 2.83Å; R732-D735 PolarHBondContact O-N 3.27Å; R732-L736 PolarHBondContact O-N 2.78Å
733	K	84.2	Confident	89.6	Confident	42 Å²	42	68.8 Å²	68.8	18%	0.183	32%	0.32	C	S	.	.	H	α-helix	trans	-67.2	-42.2	-177.2	-170.2	179.6	-174.7	173.9	0	110.7	D544 D546 F721 D735 L736 R737	D544-K733 WeakPolarHBondContact OD2-CB 3.46Å; D546-K733 IonicContact OD1-NZ 3.13Å; D546-K733 PolarHBondContact OD1-NZ 3.45Å; D546-K733 IonicContact OD2-NZ 2.93Å; D546-K733 PolarHBondContact OD2-NZ 3.44Å; F721-K733 HydrophobicContact CD1-CB 4.49Å; F721-K733 HydrophobicContact CE1-CB 4.13Å; F721-K733 HydrophobicContact CE1-CG 4.48Å; F721-K733 HydrophobicContact CE2-CB 4.37Å; F721-K733 HydrophobicContact CZ-CB 4.05Å; K733-D735 VanDerWaalsContact C-N 3.34Å; K733-D735 PolarHBondContact O-N 3.41Å; K733-L736 WeakPolarHBondContact O-CB 3.48Å; K733-L736 PolarHBondContact O-N 2.86Å; K733-R737 PolarHBondContact O-N 3.17Å
734	V	89.3	Confident	89.5	Confident	11 Å²	11	71.8 Å²	71.8	7%	0.067	33%	0.334	C	S	.	.	H	α-helix	trans	-57.4	-37.8	173	-63.9	0	0	0	0	114.4	D542 R732 L736 R737 R738	D542-V734 HydrophobicContact CB-CG1 4.25Å; D542-V734 HydrophobicContact CB-CG2 4.37Å; D542-V734 WeakPolarHBondContact OD1-CG1 3.44Å; R732-V734 HydrophobicContact CB-CG2 3.94Å; V734-L736 VanDerWaalsContact C-N 3.33Å; V734-L736 PolarHBondContact O-N 2.95Å; V734-R737 WeakPolarHBondContact O-CB 3.42Å; V734-R737 PolarHBondContact O-N 3.36Å; V734-R738 WeakPolarHBondContact O-CB 3.48Å; V734-R738 PolarHBondContact O-N 3.35Å
735	D	92.6	Very high	89.1	Confident	26 Å²	26	64.4 Å²	64.4	14%	0.139	31%	0.309	C	S	.	.	H	α-helix	trans	-71	-32.9	179.4	-60.2	-39.6	0	0	0	111.3	F730 R732 K733 R738 H739	F730-D735 HydrophobicContact CB-CB 4.27Å; F730-D735 HydrophobicContact CD1-CB 4.11Å; R732-D735 WeakPolarHBondContact CB-OD2 3.42Å; R732-D735 WeakPolarHBondContact CG-OD2 3.49Å; R732-D735 IonicContact CZ-OD1 3.22Å; R732-D735 IonicContact CZ-OD2 3.99Å; R732-D735 IonicContact NE-OD1 2.62Å; R732-D735 IonicContact NE-OD2 3.69Å; R732-D735 PolarHBondContact NE-OD2 3Å; R732-D735 IonicContact NH2-OD1 3.59Å; R732-D735 PolarHBondContact NH2-OD1 2.93Å; R732-D735 IonicContact NH2-OD2 2.83Å; R732-D735 PolarHBondContact O-N 3.27Å; K733-D735 VanDerWaalsContact C-N 3.34Å; K733-D735 PolarHBondContact O-N 3.41Å; D735-R738 IonicContact OD1-CZ 3.82Å; D735-R738 IonicContact OD1-NH1 3.09Å; D735-R738 IonicContact OD1-NH2 3.66Å; D735-R738 PolarHBondContact OD1-NH2 3.01Å; D735-H739 VanDerWaalsContact O-CB 3.28Å; D735-H739 WeakPolarHBondContact O-CB 3.21Å; D735-H739 PolarHBondContact O-N 2.9Å
736	L	91.6	Very high	88.3	Confident	7 Å²	7	64.2 Å²	64.2	4%	0.037	31%	0.314	C	S	.	.	H	α-helix	trans	-70.1	-42.2	169.1	172.8	62.5	0	0	0	111.6	F721 C723 F730 R732 K733 V734 H739 I740	F721-L736 HydrophobicContact CB-CB 4.12Å; F721-L736 HydrophobicContact CB-CD2 3.91Å; C723-L736 HydrophobicContact CB-CD1 3.66Å; F730-L736 HydrophobicContact CB-CB 4.28Å; F730-L736 HydrophobicContact CD2-CB 4.16Å; F730-L736 HydrophobicContact CD2-CD1 3.91Å; F730-L736 HydrophobicContact CE2-CD1 4.15Å; F730-L736 HydrophobicContact CG-CB 4.33Å; R732-L736 PolarHBondContact O-N 2.78Å; K733-L736 WeakPolarHBondContact O-CB 3.48Å; K733-L736 PolarHBondContact O-N 2.86Å; V734-L736 VanDerWaalsContact C-N 3.33Å; V734-L736 PolarHBondContact O-N 2.95Å; L736-H739 PolarHBondContact O-N 3.4Å; L736-I740 HydrophobicContact CD1-CD1 3.83Å; L736-I740 HydrophobicContact CD1-CG1 3.97Å; L736-I740 HydrophobicContact CG-CD1 3.94Å; L736-I740 HydrophobicContact CG-CG1 4.47Å; L736-I740 WeakPolarHBondContact O-CG1 3.39Å; L736-I740 PolarHBondContact O-N 2.92Å
737	R	90.2	Very high	86.9	Confident	107 Å²	107	68 Å²	68	40%	0.404	33%	0.329	S	S	.	.	H	α-helix	trans	-56.4	-56.1	178.7	-167.1	-171.5	-59.4	153.4	7.8	110.5	D544 K733 V734 H739 I740 E741 L749	D544-R737 IonicContact OD1-NH2 3.7Å; D544-R737 PolarHBondContact OD1-NH2 3.47Å; K733-R737 PolarHBondContact O-N 3.17Å; V734-R737 WeakPolarHBondContact O-CB 3.42Å; V734-R737 PolarHBondContact O-N 3.36Å; R737-H739 VanDerWaalsContact C-N 3.28Å; R737-H739 PolarHBondContact O-N 3.33Å; R737-I740 PolarHBondContact O-N 3.36Å; R737-E741 WeakPolarHBondContact O-CB 3.34Å; R737-E741 PolarHBondContact O-N 2.96Å; R737-L749 HydrophobicContact CG-CD2 3.97Å
738	R	92.5	Very high	85.5	Confident	130 Å²	130	62.6 Å²	62.6	49%	0.491	30%	0.302	S	S	.	.	H	α-helix	trans	-58.3	-37.1	175.6	-177.1	176.3	62.4	-118.1	-10.2	112.4	V734 D735 T742	V734-R738 WeakPolarHBondContact O-CB 3.48Å; V734-R738 PolarHBondContact O-N 3.35Å; D735-R738 IonicContact OD1-CZ 3.82Å; D735-R738 IonicContact OD1-NH1 3.09Å; D735-R738 IonicContact OD1-NH2 3.66Å; D735-R738 PolarHBondContact OD1-NH2 3.01Å; R738-T742 HydrophobicContact CG-CG2 4.38Å; R738-T742 WeakPolarHBondContact O-CB 3.28Å; R738-T742 VanDerWaalsContact O-CG2 3.32Å; R738-T742 WeakPolarHBondContact O-CG2 3.45Å; R738-T742 PolarHBondContact O-N 2.79Å; R738-T742 PolarHBondContact O-OG1 3.04Å
739	H	93.1	Very high	83.9	Confident	14 Å²	14	57 Å²	57	7%	0.065	28%	0.283	C	S	.	.	H	α-helix	trans	-67.1	-45.2	176.5	162.7	54.7	0	0	0	112.9	C723 C726 F730 D735 L736 R737 Q743 H744	C723-H739 WeakPolarHBondContact CB-NE2 3.33Å; C723-H739 PolarHBondContact SG-NE2 2.95Å; C726-H739 VanDerWaalsContact SG-CE1 3.51Å; C726-H739 PolarHBondContact SG-NE2 3.43Å; F730-H739 HydrophobicContact CE1-CB 3.87Å; F730-H739 HydrophobicContact CE2-CB 4.09Å; F730-H739 AromaticContact CE2-CD2 3.22Å; F730-H739 WeakPolarHBondContact CE2-CD2 3.45Å; F730-H739 AromaticContact CE2-CG 3.68Å; F730-H739 AromaticContact CE2-NE2 3.91Å; F730-H739 HydrophobicContact CZ-CB 3.55Å; F730-H739 AromaticContact CZ-CD2 3.31Å; F730-H739 WeakPolarHBondContact CZ-CD2 3.3Å; F730-H739 AromaticContact CZ-CG 3.24Å; F730-H739 AromaticContact CZ-ND1 3.89Å; F730-H739 AromaticContact CZ-NE2 3.97Å; D735-H739 VanDerWaalsContact O-CB 3.28Å; D735-H739 WeakPolarHBondContact O-CB 3.21Å; D735-H739 PolarHBondContact O-N 2.9Å; L736-H739 PolarHBondContact O-N 3.4Å; R737-H739 VanDerWaalsContact C-N 3.28Å; R737-H739 PolarHBondContact O-N 3.33Å; H739-Q743 WeakPolarHBondContact ND1-CG 3.46Å; H739-Q743 VanDerWaalsContact O-CB 3.27Å; H739-Q743 WeakPolarHBondContact O-CB 3.35Å; H739-Q743 WeakPolarHBondContact O-CG 3.32Å; H739-Q743 PolarHBondContact O-N 3.5Å; H739-H744 AromaticContact CE1-NE2 3.45Å; H739-H744 PolarHBondContact CE1-NE2 3.07Å; H739-H744 AromaticContact NE2-CD2 3.91Å; H739-H744 AromaticContact NE2-NE2 3.43Å; H739-H744 PolarHBondContact NE2-NE2 3.47Å
740	I	90	Very high	82.3	Confident	13 Å²	13	63.4 Å²	63.4	7%	0.067	30%	0.302	C	S	.	.	H	α-helix	trans	-61	-51	176.4	-67.7	166.7	0	0	0	109.1	L736 R737 T742 Q743 H744 G745 D748 L749	L736-I740 HydrophobicContact CD1-CD1 3.83Å; L736-I740 HydrophobicContact CD1-CG1 3.97Å; L736-I740 HydrophobicContact CG-CD1 3.94Å; L736-I740 HydrophobicContact CG-CG1 4.47Å; L736-I740 WeakPolarHBondContact O-CG1 3.39Å; L736-I740 PolarHBondContact O-N 2.92Å; R737-I740 PolarHBondContact O-N 3.36Å; I740-T742 PolarHBondContact O-N 3.36Å; I740-Q743 PolarHBondContact O-N 2.97Å; I740-H744 HydrophobicContact CG2-CB 4.39Å; I740-H744 CarbonylContact O-C 3.29Å; I740-H744 WeakPolarHBondContact O-CA 3.39Å; I740-H744 WeakPolarHBondContact O-CB 3.31Å; I740-H744 PolarHBondContact O-N 3.09Å; I740-G745 PolarHBondContact O-N 3.45Å; I740-D748 HydrophobicContact CG2-CB 4.02Å; I740-L749 HydrophobicContact CB-CD2 3.82Å; I740-L749 HydrophobicContact CD1-CD2 4.3Å; I740-L749 HydrophobicContact CG2-CD2 3.73Å; I740-L749 HydrophobicContact CG2-CG 4.06Å
741	E	90.4	Very high	80.5	Confident	99 Å²	99	67.5 Å²	67.5	46%	0.463	32%	0.32	S	S	.	.	H	α-helix	trans	-54.7	-46.7	179.4	-175.5	169.4	-145.6	0	0	113.1	R737 G745 T746 L749	R737-E741 WeakPolarHBondContact O-CB 3.34Å; R737-E741 PolarHBondContact O-N 2.96Å; E741-G745 WeakPolarHBondContact O-CA 3.33Å; E741-G745 PolarHBondContact O-N 3.5Å; E741-T746 HydrophobicContact CG-CG2 4.32Å; E741-L749 HydrophobicContact CB-CD1 4.43Å
742	T	91.9	Very high	78.6	Confident	90 Å²	90	69.2 Å²	69.2	55%	0.552	33%	0.327	S	S	*	.	H	α-helix	trans	-85	-13.9	-176	56	0	0	0	0	115.5	R738 I740	R738-T742 HydrophobicContact CG-CG2 4.38Å; R738-T742 WeakPolarHBondContact O-CB 3.28Å; R738-T742 VanDerWaalsContact O-CG2 3.32Å; R738-T742 WeakPolarHBondContact O-CG2 3.45Å; R738-T742 PolarHBondContact O-N 2.79Å; R738-T742 PolarHBondContact O-OG1 3.04Å; I740-T742 PolarHBondContact O-N 3.36Å
743	Q	88.7	Confident	76.2	Confident	117 Å²	117	70.9 Å²	70.9	55%	0.547	34%	0.34	S	S	.	.	H	α-helix	trans	-124.9	-18.3	-174.6	-55.8	-72.4	-96.6	0	0	114.2	H739 I740	H739-Q743 WeakPolarHBondContact ND1-CG 3.46Å; H739-Q743 VanDerWaalsContact O-CB 3.27Å; H739-Q743 WeakPolarHBondContact O-CB 3.35Å; H739-Q743 WeakPolarHBondContact O-CG 3.32Å; H739-Q743 PolarHBondContact O-N 3.5Å; I740-Q743 PolarHBondContact O-N 2.97Å
744	H	88.6	Confident	73.7	Confident	63 Å²	63	77 Å²	77	29%	0.292	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.7	-16.5	-177.3	-53.8	-45.1	0	0	0	112.3	C723 H725 H739 I740	C723-H744 PolarHBondContact SG-CD2 2.94Å; C723-H744 PolarHBondContact SG-NE2 3.4Å; H725-H744 AromaticContact CG-CD2 3.99Å; H725-H744 AromaticContact CG-CG 3.9Å; H739-H744 AromaticContact CE1-NE2 3.45Å; H739-H744 PolarHBondContact CE1-NE2 3.07Å; H739-H744 AromaticContact NE2-CD2 3.91Å; H739-H744 AromaticContact NE2-NE2 3.43Å; H739-H744 PolarHBondContact NE2-NE2 3.47Å; I740-H744 HydrophobicContact CG2-CB 4.39Å; I740-H744 CarbonylContact O-C 3.29Å; I740-H744 WeakPolarHBondContact O-CA 3.39Å; I740-H744 WeakPolarHBondContact O-CB 3.31Å; I740-H744 PolarHBondContact O-N 3.09Å
745	G	79.1	Confident	71	Confident	27 Å²	27	81.2 Å²	81.2	28%	0.278	39%	0.389	S	S	.	.			trans	93.3	172.7	176.9	0	0	0	0	0	113.5	I740 E741 I747	I740-G745 PolarHBondContact O-N 3.45Å; E741-G745 WeakPolarHBondContact O-CA 3.33Å; E741-G745 PolarHBondContact O-N 3.5Å; G745-I747 VanDerWaalsContact C-N 3.34Å; G745-I747 PolarHBondContact O-N 2.88Å
746	T	69.1	Low	68.3	Low	83 Å²	83	85.1 Å²	85.1	51%	0.509	41%	0.41	S	S	.	.	G	3₁₀ helix	trans	-71.9	-23.6	-172.6	50.4	0	0	0	0	114.2	E741 D748 L749	E741-T746 HydrophobicContact CG-CG2 4.32Å; T746-D748 VanDerWaalsContact C-N 3.28Å; T746-D748 PolarHBondContact O-N 3.16Å; T746-L749 PolarHBondContact O-N 3.48Å
747	I	64	Low	65.3	Low	129 Å²	129	89.4 Å²	89.4	66%	0.662	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-61	-35.1	-175.3	-64	175.3	0	0	0	112.1	G745	G745-I747 VanDerWaalsContact C-N 3.34Å; G745-I747 PolarHBondContact O-N 2.88Å
748	D	58	Low	62.3	Low	25 Å²	25	88.1 Å²	88.1	13%	0.134	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-84.6	-13	-173.5	-74	-53.3	0	0	0	114.6	H725 I740 T746 Y750 K751	H725-D748 IonicContact CE1-OD1 2.66Å; H725-D748 PolarHBondContact CE1-OD1 3.46Å; H725-D748 IonicContact CE1-OD2 2.78Å; H725-D748 PolarHBondContact CE1-OD2 2.87Å; H725-D748 IonicContact ND1-OD2 3.5Å; H725-D748 WeakPolarHBondContact NE2-CB 3.3Å; H725-D748 VanDerWaalsContact NE2-CG 3.31Å; H725-D748 IonicContact NE2-OD1 3.23Å; H725-D748 IonicContact NE2-OD2 2.67Å; I740-D748 HydrophobicContact CG2-CB 4.02Å; T746-D748 VanDerWaalsContact C-N 3.28Å; T746-D748 PolarHBondContact O-N 3.16Å; D748-Y750 VanDerWaalsContact C-N 3.33Å; D748-Y750 PolarHBondContact O-N 3.42Å; D748-K751 PolarHBondContact O-N 3.41Å; D748-K751 WeakPolarHBondContact OD1-CD 3.49Å; D748-K751 WeakPolarHBondContact OD1-CE 3.42Å; D748-K751 IonicContact OD1-NZ 2.69Å; D748-K751 PolarHBondContact OD1-NZ 2.92Å
749	L	57.2	Low	59.4	Low	39 Å²	39	85.9 Å²	85.9	20%	0.204	44%	0.443	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-42.1	175	-68.1	175.3	0	0	0	111.9	R737 I740 E741 T746 K751 K752	R737-L749 HydrophobicContact CG-CD2 3.97Å; I740-L749 HydrophobicContact CB-CD2 3.82Å; I740-L749 HydrophobicContact CD1-CD2 4.3Å; I740-L749 HydrophobicContact CG2-CD2 3.73Å; I740-L749 HydrophobicContact CG2-CG 4.06Å; E741-L749 HydrophobicContact CB-CD1 4.43Å; T746-L749 PolarHBondContact O-N 3.48Å; L749-K751 VanDerWaalsContact C-N 3.29Å; L749-K751 PolarHBondContact O-N 2.76Å; L749-K752 PolarHBondContact O-N 3.12Å
750	Y	54.3	Low	56.5	Low	163 Å²	163	91.8 Å²	91.8	64%	0.639	48%	0.475	S	S	*	.	H	α-helix	trans	-63.2	-30.8	-177.1	-77.3	-86.7	0	0	0	113.7	D748 K752 N753 Y754	D748-Y750 VanDerWaalsContact C-N 3.33Å; D748-Y750 PolarHBondContact O-N 3.42Å; Y750-K752 PolarHBondContact O-N 3.18Å; Y750-N753 PolarHBondContact O-N 3.19Å; Y750-Y754 VanDerWaalsContact O-CD2 3.28Å; Y750-Y754 WeakPolarHBondContact O-CD2 3.39Å
751	K	53.3	Low	53.6	Low	129 Å²	129	95 Å²	95	56%	0.561	49%	0.493	S	S	*	.	H	α-helix	trans	-64.8	-23.8	-176.6	-67.3	174.4	-174.5	163.5	0	113	D748 L749 T755	D748-K751 PolarHBondContact O-N 3.41Å; D748-K751 WeakPolarHBondContact OD1-CD 3.49Å; D748-K751 WeakPolarHBondContact OD1-CE 3.42Å; D748-K751 IonicContact OD1-NZ 2.69Å; D748-K751 PolarHBondContact OD1-NZ 2.92Å; L749-K751 VanDerWaalsContact C-N 3.29Å; L749-K751 PolarHBondContact O-N 2.76Å; K751-T755 PolarHBondContact O-OG1 2.83Å
752	K	46	Very low	50.7	Low	77 Å²	77	99.1 Å²	99.1	34%	0.335	50%	0.504	S	S	.	.	H	α-helix	trans	-85.6	-36.1	-178.6	-160.1	159.4	-175.6	169.4	0	113.4	L749 Y750 Y754 T755 L756	L749-K752 PolarHBondContact O-N 3.12Å; Y750-K752 PolarHBondContact O-N 3.18Å; K752-Y754 VanDerWaalsContact C-N 3.29Å; K752-Y754 PolarHBondContact O-N 3.09Å; K752-T755 WeakPolarHBondContact CA-OG1 3.36Å; K752-T755 PolarHBondContact O-N 3.39Å; K752-T755 PolarHBondContact O-OG1 3.16Å; K752-T755 VanDerWaalsContact O-OG1 3.11Å; K752-L756 HydrophobicContact CD-CD1 4.44Å; K752-L756 HydrophobicContact CG-CD1 4Å; K752-L756 HydrophobicContact CG-CG 4.37Å; K752-L756 PolarHBondContact O-N 3.41Å
753	N	36.4	Very low	47.9	Very low	97 Å²	97	104.3 Å²	104.3	52%	0.519	52%	0.519	S	S	.	.	H	α-helix	trans	-66.2	-32.8	177.5	-61.2	13.1	0	0	0	111.4	Y750 T755	Y750-N753 PolarHBondContact O-N 3.19Å; N753-T755 PolarHBondContact O-N 2.78Å
754	Y	32.1	Very low	45	Very low	170 Å²	170	107.2 Å²	107.2	67%	0.667	53%	0.532	S	S	*	.	H	α-helix	trans	-73.5	-5.2	172.5	-73.8	-66.8	0	0	0	115.1	Y750 K752 R762	Y750-Y754 VanDerWaalsContact O-CD2 3.28Å; Y750-Y754 WeakPolarHBondContact O-CD2 3.39Å; K752-Y754 VanDerWaalsContact C-N 3.29Å; K752-Y754 PolarHBondContact O-N 3.09Å; Y754-R762 PolarHBondContact O-NH2 3.06Å
755	T	32.8	Very low	42.2	Very low	100 Å²	100	109.9 Å²	109.9	61%	0.613	56%	0.558	S	S	*	*	H	α-helix	trans	-125.9	-7.8	-171.4	50.2	0	0	0	0	116.1	K751 K752 N753	K751-T755 PolarHBondContact O-OG1 2.83Å; K752-T755 WeakPolarHBondContact CA-OG1 3.36Å; K752-T755 PolarHBondContact O-N 3.39Å; K752-T755 PolarHBondContact O-OG1 3.16Å; K752-T755 VanDerWaalsContact O-OG1 3.11Å; N753-T755 PolarHBondContact O-N 2.78Å
756	L	35.4	Very low	39.7	Very low	109 Å²	109	113.9 Å²	113.9	57%	0.571	58%	0.582	S	S	*	*	H	α-helix	trans	-106.2	-37	171.2	-69.3	179.2	0	0	0	113.5	K752 N758	K752-L756 HydrophobicContact CD-CD1 4.44Å; K752-L756 HydrophobicContact CG-CD1 4Å; K752-L756 HydrophobicContact CG-CG 4.37Å; K752-L756 PolarHBondContact O-N 3.41Å; L756-N758 PolarHBondContact O-N 3.11Å
757	D	28.1	Very low	37.8	Very low	96 Å²	96	117.1 Å²	117.1	51%	0.513	60%	0.595	S	S	.	*	S	Bend	trans	-94.9	6.6	-162.4	-45	-44	0	0	0	113.8
758	N	28.6	Very low	36.3	Very low	80 Å²	80	119.1 Å²	119.1	43%	0.428	61%	0.606	S	S	.	*			trans	-147.1	60.2	-174.5	-91	-77.6	0	0	0	113.7	L756 R762	L756-N758 PolarHBondContact O-N 3.11Å; N758-R762 PolarHBondContact O-NE 3.2Å
759	A	31.3	Very low	34.7	Very low	83 Å²	83	125 Å²	125	69%	0.686	63%	0.633	S	S	*	*	S	Bend	trans	-77.9	-45.7	168.3	0	0	0	0	0	112.4
760	D	32.5	Very low	33.4	Very low	138 Å²	138	133.6 Å²	133.6	74%	0.738	66%	0.664	S	S	*	*	S	Bend	trans	-90.5	-22.8	-166.2	-65.4	-54.3	0	0	0	115.9	Q633 R762	Q633-D760 PolarHBondContact NE2-O 2.91Å; D760-R762 PolarHBondContact O-N 3.05Å
761	N	28.7	Very low	32.1	Very low	82 Å²	82	132 Å²	132	44%	0.439	67%	0.667	S	S	.	*			trans	-86.4	4.2	-171.8	-74.1	-31.9	0	0	0	115.2	Q633 K763	Q633-N761 PolarHBondContact NE2-OD1 3.09Å; N761-K763 VanDerWaalsContact C-N 3.26Å; N761-K763 PolarHBondContact O-N 3.41Å
762	R	29.1	Very low	31.1	Very low	185 Å²	185	133.1 Å²	133.1	70%	0.698	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	59.6	-173.9	-64	-166.2	-171.6	-142.5	1.2	114.5	Y754 N758 D760	Y754-R762 PolarHBondContact O-NH2 3.06Å; N758-R762 PolarHBondContact O-NE 3.2Å; D760-R762 PolarHBondContact O-N 3.05Å
763	K	31.9	Very low	30.2	Very low	199 Å²	199	138.3 Å²	138.3	87%	0.865	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-131.5	-11.8	161.4	-77.5	-169.2	177.4	176	0	115.7	N761	N761-K763 VanDerWaalsContact C-N 3.26Å; N761-K763 PolarHBondContact O-N 3.41Å
764	Q	28.1	Very low	29.9	Very low	177 Å²	177	141.1 Å²	141.1	83%	0.827	71%	0.714	S	S	*	*	S	Bend	trans	-139.3	82.2	176.5	-67.7	-173.9	6	0	0	112.1
765	S	29.5	Very low	29.7	Very low	120 Å²	120	138.6 Å²	138.6	84%	0.839	72%	0.717	S	S	*	*			trans	-163.2	69.1	162.8	-178.3	0	0	0	0	111
766	S	27.3	Very low	29.6	Very low	111 Å²	111	141.6 Å²	141.6	78%	0.776	73%	0.728	S	S	*	*			trans	-100.9	145.5	159.1	48.6	0	0	0	0	109.1
767	L	28.6	Very low	29.1	Very low	151 Å²	151	144 Å²	144	79%	0.791	74%	0.742	S	S	*	*			trans	59.1	97	-171.2	-88.1	72.1	0	0	0	115.8
768	L	32.5	Very low	29.1	Very low	170 Å²	170	144.4 Å²	144.4	89%	0.89	75%	0.753	S	S	*	*				-132.2	124	117.5	-77.6	-176.7	0	0	0	108.4
769	H	25.8	Very low	29.1	Very low	149 Å²	149	145.8 Å²	145.8	69%	0.69	77%	0.768	S	S	*	*			trans	-75.9	143.3	161.1	-83.6	34	0	0	0	108.6
770	Y	30.3	Very low	29	Very low	220 Å²	220	147.8 Å²	147.8	86%	0.863	78%	0.777	S	S	*	*			trans	-142.8	106	148.7	-116.9	-80.6	0	0	0	109.1	N772	Y770-N772 PolarHBondContact O-N 3.29Å; Y770-N772 VanDerWaalsContact O-N 3.14Å
771	D	26.6	Very low	28.9	Very low	129 Å²	129	146.7 Å²	146.7	69%	0.69	78%	0.78	S	S	*	*			trans	-70.3	102.1	177.7	-74.1	-75.2	0	0	0	110.9
772	N	30.7	Very low	28.9	Very low	152 Å²	152	147.9 Å²	147.9	81%	0.813	80%	0.795	S	S	*	*			trans	-101.9	97.4	161.8	-95.5	-34.8	0	0	0	109.6	Y770 I774	Y770-N772 PolarHBondContact O-N 3.29Å; Y770-N772 VanDerWaalsContact O-N 3.14Å; N772-I774 PolarHBondContact O-N 3.38Å
773	K	27.2	Very low	29	Very low	187 Å²	187	143.8 Å²	143.8	81%	0.813	80%	0.795	S	S	*	*			trans	-67.6	100.1	177.8	-68.9	179.5	179.7	176.8	0	111
774	I	30	Very low	28.8	Very low	155 Å²	155	142.5 Å²	142.5	80%	0.795	80%	0.796	S	S	*	*			trans	-120.6	75.9	157.2	-53.5	-177.4	0	0	0	107.8	N772 L776	N772-I774 PolarHBondContact O-N 3.38Å; I774-L776 PolarHBondContact O-N 3.13Å
775	T	29.7	Very low	28.9	Very low	117 Å²	117	138.7 Å²	138.7	72%	0.718	79%	0.789	S	S	*	*			trans	-74.5	112.4	170.2	45.4	0	0	0	0	109.3
776	L	30.9	Very low	29.6	Very low	163 Å²	163	138.6 Å²	138.6	85%	0.853	79%	0.786	S	S	*	*			trans	-65.4	132.3	170.1	-70.6	168	0	0	0	110	I774 S778	I774-L776 PolarHBondContact O-N 3.13Å; L776-S778 PolarHBondContact O-N 2.97Å
777	N	24.3	Very low	29.5	Very low	159 Å²	159	140.1 Å²	140.1	85%	0.85	79%	0.785	S	S	*	*			trans	-80	113.5	-179.4	-75.2	-31.6	0	0	0	111.8
778	S	28.7	Very low	30.2	Very low	106 Å²	106	138.1 Å²	138.1	74%	0.741	78%	0.781	S	S	*	*			trans	-173	95.8	146.3	34.8	0	0	0	0	110.3	L776	L776-S778 PolarHBondContact O-N 2.97Å
779	S	27.5	Very low	30.1	Very low	109 Å²	109	136 Å²	136	76%	0.762	77%	0.771	S	S	*	*				89.3	105.9	59.9	70.2	0	0	0	0	114.6
780	S	28.8	Very low	30.3	Very low	125 Å²	125	136.1 Å²	136.1	87%	0.874	78%	0.775	S	S	*	*			trans	161.1	149.5	143.9	48.7	0	0	0	0	109.3
781	S	30.1	Very low	30.2	Very low	114 Å²	114	132.2 Å²	132.2	80%	0.797	77%	0.768	S	S	*	*			cis	-140.9	179.1	-10.6	65	0	0	0	0	107.3
782	S	29.9	Very low	30.5	Very low	108 Å²	108	131.7 Å²	131.7	76%	0.755	77%	0.774	S	S	*	*			cis	-149.1	-163	14.9	53.2	0	0	0	0	107.8
783	S	29.9	Very low	30.4	Very low	99 Å²	99	130 Å²	130	69%	0.692	77%	0.774	S	S	*	*			cis	-155.4	-149.8	12.8	66.9	0	0	0	0	111
784	L	29.2	Very low	31	Very low	171 Å²	171	126.6 Å²	126.6	90%	0.895	77%	0.771	S	S	*	*			trans	55	93.2	171.3	-69.7	169.6	0	0	0	117.7
785	S	29.7	Very low	31.3	Very low	97 Å²	97	129 Å²	129	68%	0.678	78%	0.776	S	S	*	*			trans	-136.4	157.6	154.8	61.5	0	0	0	0	109.4
786	P	43.2	Very low	31.4	Very low	118 Å²	118	127.8 Å²	127.8	77%	0.766	77%	0.772	S	S	*	*				-139.7	152	114.9	26	-7.1	0	0	0	112.9
787	L	27.1	Very low	31.2	Very low	144 Å²	144	127.6 Å²	127.6	75%	0.754	77%	0.77	S	S	*	*			cis	79.5	156.2	39	-71.7	165	0	0	0	115.1
788	P	41.8	Very low	31.3	Very low	108 Å²	108	128 Å²	128	70%	0.701	77%	0.767	S	S	*	*			cis	-104.5	-139.3	-8.6	27	-4.9	0	0	0	110.1
789	N	30	Very low	31.2	Very low	127 Å²	127	129.1 Å²	129.1	68%	0.679	76%	0.764	S	S	*	*			cis	-161.7	-178.3	-1.1	-144.1	-1.2	0	0	0	107
790	I	31.2	Very low	31.1	Very low	151 Å²	151	131 Å²	131	77%	0.774	76%	0.761	S	S	*	*			cis	-135	173.3	12.6	-60.6	-178.4	0	0	0	110.1
791	L	28.5	Very low	30.9	Very low	137 Å²	137	131.1 Å²	131.1	72%	0.717	75%	0.751	S	S	*	*			trans	-67	160.2	-174.3	-77.3	54.4	0	0	0	120.6
792	S	32.3	Very low	30.8	Very low	119 Å²	119	136.9 Å²	136.9	83%	0.832	76%	0.757	S	S	*	*			trans	111.4	133.2	143.8	-49.8	0	0	0	0	116.7
793	S	29.6	Very low	30.9	Very low	116 Å²	116	136.9 Å²	136.9	81%	0.811	76%	0.757	S	S	*	*			cis	-164	146.9	-14.6	-172.7	0	0	0	0	110.7
794	P	38.6	Very low	30.8	Very low	116 Å²	116	140 Å²	140	75%	0.753	77%	0.767	S	S	*	*			trans	-122.1	169.4	-170.8	42.5	-32.7	0	0	0	117.5
795	K	36.8	Very low	30.8	Very low	206 Å²	206	137 Å²	137	90%	0.896	76%	0.76	S	S	*	*			trans	-162.5	176.8	155.5	-114.6	166.5	-173.2	177.4	0	113.9
796	S	30.4	Very low	30.7	Very low	91 Å²	91	137.3 Å²	137.3	64%	0.636	76%	0.762	S	S	*	*				-156.4	131.4	-129	54.9	0	0	0	0	120.3
797	I	27.3	Very low	30.1	Very low	158 Å²	158	138.4 Å²	138.4	81%	0.81	76%	0.761	S	S	*	*			trans	73	149.6	142.7	-41.1	151	0	0	0	120.6
798	Q	27.3	Very low	30.1	Very low	167 Å²	167	138.7 Å²	138.7	78%	0.78	76%	0.763	S	S	*	*			trans	87.6	145.6	167.1	-58.3	-157.5	-3.6	0	0	117.6
799	L	25.6	Very low	29.5	Very low	130 Å²	130	140.9 Å²	140.9	68%	0.681	77%	0.765	S	S	*	*			cis	-158.5	173.4	-5	-118.8	175.4	0	0	0	113.2
800	H	26.6	Very low	29.5	Very low	150 Å²	150	141.4 Å²	141.4	69%	0.694	77%	0.768	S	S	*	*			trans	-4.6	139.7	173.1	-82	-50.9	0	0	0	125.7
801	N	24.1	Very low	29.3	Very low	126 Å²	126	138.7 Å²	138.7	67%	0.674	76%	0.763	S	S	*	*			trans	43.7	131.9	130.9	-51.9	9.1	0	0	0	122.8
802	Y	28.7	Very low	29.3	Very low	236 Å²	236	141.2 Å²	141.2	93%	0.925	77%	0.768	S	S	*	*				-167	-177.3	115.5	-105.8	-65.9	0	0	0	111.8
803	S	30.5	Very low	29.3	Very low	108 Å²	108	144 Å²	144	76%	0.755	77%	0.768	S	S	*	*			trans	-117.7	157.2	-153.3	-51	0	0	0	0	117.2
804	N	27.3	Very low	29.1	Very low	165 Å²	165	146.1 Å²	146.1	88%	0.882	77%	0.765	S	S	*	*			trans	-5.2	132.1	164.8	-55.2	-2.1	0	0	0	122.1
805	S	29.4	Very low	28.7	Very low	107 Å²	107	149.6 Å²	149.6	75%	0.748	77%	0.768	S	S	*	*			trans	-159.7	117.5	136.5	57.6	0	0	0	0	108.1
806	S	29.4	Very low	28.4	Very low	104 Å²	104	146.4 Å²	146.4	73%	0.727	76%	0.761	S	S	*	*				92.8	136.6	73	-64.3	0	0	0	0	114
807	D	29.7	Very low	28.2	Very low	141 Å²	141	145.5 Å²	145.5	75%	0.754	77%	0.766	S	S	*	*			trans	73.7	110.8	156.5	-51	-34.4	0	0	0	122.7
808	L	26.7	Very low	28.3	Very low	150 Å²	150	146.8 Å²	146.8	79%	0.785	77%	0.773	S	S	*	*				44.3	119.1	128.7	-61.4	164.8	0	0	0	120.8
809	M	30.2	Very low	28.2	Very low	153 Å²	153	145.3 Å²	145.3	75%	0.754	77%	0.771	S	S	*	*				-175.1	158.2	93.7	-102.3	-47.6	-146.2	0	0	117.1
810	D	28.5	Very low	28.4	Very low	138 Å²	138	145.9 Å²	145.9	74%	0.738	77%	0.774	S	S	*	*			trans	64.7	171	149.5	-72.5	-43.6	0	0	0	122.9
811	S	27.4	Very low	28.4	Very low	95 Å²	95	142.8 Å²	142.8	66%	0.664	77%	0.769	S	S	*	*			trans	-145.6	177.9	-159.5	-69.7	0	0	0	0	112.5
812	F	28.9	Very low	28.8	Very low	189 Å²	189	142.6 Å²	142.6	83%	0.829	77%	0.773	S	S	*	*			trans	70.6	135.3	-178.2	-50	-88.5	0	0	0	113.3
813	H	31.3	Very low	28.9	Very low	178 Å²	178	136.5 Å²	136.5	82%	0.824	76%	0.76	S	S	*	*			cis	-145.5	159.6	36.7	-101.4	-95.3	0	0	0	113.9
814	H	27	Very low	28.9	Very low	161 Å²	161	136.7 Å²	136.7	75%	0.745	76%	0.757	S	S	*	*			trans	-81.2	145.5	149.7	-81.1	29.5	0	0	0	109.6
815	F	30.6	Very low	29.2	Very low	188 Å²	188	135.8 Å²	135.8	83%	0.825	75%	0.752	S	S	*	*				-172.3	167.6	107.5	-117.3	-90.4	0	0	0	113.5
816	N	29.6	Very low	29.4	Very low	140 Å²	140	135.7 Å²	135.7	75%	0.749	75%	0.747	S	S	*	*			trans	-75.7	142.1	-164.2	-50.6	-32	0	0	0	115.4
817	G	26.2	Very low	29.6	Very low	72 Å²	72	136.1 Å²	136.1	74%	0.742	75%	0.746	S	S	*	*				72.1	144.2	114.7	0	0	0	0	0	121.4
818	L	30.2	Very low	29.7	Very low	184 Å²	184	135.6 Å²	135.6	96%	0.963	74%	0.743	S	S	*	*				-160	174.3	118.4	-106.9	168.2	0	0	0	110.7
819	D	24.9	Very low	29.9	Very low	136 Å²	136	134.8 Å²	134.8	73%	0.727	74%	0.739	S	S	*	*			trans	-136.4	176.7	-160.3	-164	-2.4	0	0	0	110.7
820	L	28.8	Very low	30.1	Very low	143 Å²	143	133.4 Å²	133.4	75%	0.749	74%	0.739	S	S	*	*			trans	68.7	157.5	174.9	-80.9	65.5	0	0	0	116.8
821	S	27.4	Very low	30.3	Very low	84 Å²	84	132.3 Å²	132.3	59%	0.587	74%	0.738	S	S	*	*			cis	-176.2	-162.8	-27.7	59.4	0	0	0	0	109.9
822	T	31.1	Very low	30.3	Very low	122 Å²	122	133.4 Å²	133.4	75%	0.748	74%	0.741	S	S	*	*			trans	71.9	147.1	167.1	59.7	0	0	0	0	117.9
823	T	32.6	Very low	30.4	Very low	109 Å²	109	131.9 Å²	131.9	67%	0.669	74%	0.741	S	S	*	*			cis	-153.2	120.3	0.3	8.9	0	0	0	0	109.7
824	T	30.6	Very low	30.2	Very low	112 Å²	112	130.1 Å²	130.1	69%	0.687	74%	0.738	S	S	*	*				67.9	131.8	101.8	66.2	0	0	0	0	119
825	N	32	Very low	30.4	Very low	146 Å²	146	130.4 Å²	130.4	78%	0.781	75%	0.745	S	S	*	*				170.9	142.3	128.3	-84.5	-7.4	0	0	0	109.3
826	T	34.1	Very low	30.3	Very low	105 Å²	105	124.3 Å²	124.3	64%	0.644	74%	0.736	S	S	*	*			cis	-165.4	146.3	-0.5	12.1	0	0	0	0	111.6
827	T	34.2	Very low	30.3	Very low	113 Å²	113	123.9 Å²	123.9	69%	0.693	74%	0.738	S	S	*	*			trans	61.1	146.8	147.1	58.1	0	0	0	0	120.9
828	N	32.3	Very low	30.4	Very low	130 Å²	130	126.7 Å²	126.7	70%	0.695	74%	0.736	S	S	*	*			cis	-161.2	148.2	-1.4	-104.1	-15.2	0	0	0	112.2
829	N	30.7	Very low	30.3	Very low	133 Å²	133	124.3 Å²	124.3	71%	0.711	72%	0.724	S	S	*	*			trans	23.3	152.6	139.9	-42.6	-25.5	0	0	0	121.6
830	T	32.8	Very low	30.9	Very low	123 Å²	123	124 Å²	124	76%	0.755	72%	0.722	S	S	*	*			cis	-168.6	149	49.1	34.4	0	0	0	0	115.9
831	T	33	Very low	31.2	Very low	116 Å²	116	122.8 Å²	122.8	71%	0.712	72%	0.717	S	S	*	*			trans	26.3	116.1	144.9	56.6	0	0	0	0	122.1
832	T	28.8	Very low	31.2	Very low	118 Å²	118	125 Å²	125	72%	0.724	72%	0.722	S	S	*	*				64.3	119.4	81.6	64.2	0	0	0	0	119
833	N	30.7	Very low	31.2	Very low	157 Å²	157	125 Å²	125	84%	0.84	72%	0.717	S	S	*	*				178.6	176.7	125.9	-96.2	-21.8	0	0	0	115.4
834	N	27.4	Very low	31.2	Very low	141 Å²	141	124.5 Å²	124.5	75%	0.754	71%	0.711	S	S	*	*			trans	-88	178.9	-168.9	-60.6	-46.7	0	0	0	115.6
835	N	31.1	Very low	31.3	Very low	166 Å²	166	127.5 Å²	127.5	89%	0.888	71%	0.711	S	S	*	*			trans	78.5	147.8	176.8	-47.4	-19.2	0	0	0	113.8
836	G	28.7	Very low	31.5	Very low	61 Å²	61	127.3 Å²	127.3	63%	0.629	71%	0.705	S	S	*	*			cis	154.1	139.1	-8.4	0	0	0	0	0	112.3
837	T	28.6	Very low	31.3	Very low	131 Å²	131	128.4 Å²	128.4	80%	0.804	71%	0.707	S	S	*	*			trans	62.4	146.5	169.1	38.4	0	0	0	0	119.2
838	D	28.9	Very low	31.1	Very low	130 Å²	130	128.4 Å²	128.4	70%	0.695	71%	0.71	S	S	*	*			trans	68.4	125.6	153.2	-55	-10.1	0	0	0	121.1
839	N	28.8	Very low	30.7	Very low	134 Å²	134	128.9 Å²	128.9	72%	0.717	71%	0.713	S	S	*	*			trans	67.3	142.7	132.6	-62.9	5	0	0	0	118.9
840	D	37.3	Very low	30.5	Very low	129 Å²	129	128.8 Å²	128.8	69%	0.69	72%	0.717	S	S	*	*			cis	-144.3	167.3	8.6	-79.6	-56.9	0	0	0	107.3
841	N	34.8	Very low	30.4	Very low	119 Å²	119	130.4 Å²	130.4	64%	0.636	72%	0.719	S	S	*	*			cis	-153.3	148.1	-21.9	-100.3	-38.1	0	0	0	104.4
842	N	27.2	Very low	30	Very low	129 Å²	129	131.9 Å²	131.9	69%	0.69	72%	0.723	S	S	*	*				55	128.4	73.8	-87.7	-1.5	0	0	0	115.6
843	N	30.7	Very low	30.5	Very low	122 Å²	122	130 Å²	130	65%	0.652	71%	0.713	S	S	*	*			trans	81.1	144.1	138.5	-69.5	42.4	0	0	0	118.7
844	D	33.9	Very low	30.5	Very low	100 Å²	100	131.7 Å²	131.7	54%	0.535	71%	0.713	S	S	.	*			cis	-155.2	175.1	-8.4	-88.9	-31.7	0	0	0	107.3
845	Y	32.7	Very low	30.4	Very low	175 Å²	175	131 Å²	131	69%	0.686	71%	0.709	S	S	*	*			cis	-148.4	174	8	-93	-58.3	0	0	0	106.5
846	H	36.2	Very low	30.3	Very low	142 Å²	142	132.5 Å²	132.5	66%	0.657	70%	0.704	S	S	*	*			cis	-147	148.6	-1.3	-107.6	-48.5	0	0	0	105
847	D	29.3	Very low	30.3	Very low	128 Å²	128	134.9 Å²	134.9	68%	0.684	71%	0.706	S	S	*	*				51.7	143.4	81.1	-66.5	-47.9	0	0	0	116
848	C	29.1	Very low	30.2	Very low	113 Å²	113	136.1 Å²	136.1	76%	0.764	71%	0.707	S	S	*	*			cis	-162.7	-174.4	-8.9	50.9	0	0	0	0	110.7
849	D	25.3	Very low	30.2	Very low	139 Å²	139	135.6 Å²	135.6	74%	0.743	71%	0.714	S	S	*	*			trans	-73.4	170.5	-168.9	-59.6	-92.3	0	0	0	118.7
850	T	25.8	Very low	30.1	Very low	131 Å²	131	134.6 Å²	134.6	80%	0.804	72%	0.717	S	S	*	*			trans	79.9	166.6	146.5	48.8	0	0	0	0	121.9
851	I	30.3	Very low	30.3	Very low	157 Å²	157	133.5 Å²	133.5	81%	0.805	72%	0.717	S	S	*	*			trans	89.8	77.7	164	-43.3	-171.5	0	0	0	117.9
852	N	25.3	Very low	30.1	Very low	148 Å²	148	134.1 Å²	134.1	79%	0.791	72%	0.72	S	S	*	*			trans	-60.3	153.8	138.5	-166.7	25.8	0	0	0	108.7
853	P	38.6	Very low	30.2	Very low	79 Å²	79	134.9 Å²	134.9	51%	0.513	73%	0.725	S	S	.	*			cis	-151.8	-166.2	22.2	45.7	-24.5	0	0	0	118
854	K	30.6	Very low	30.3	Very low	192 Å²	192	136 Å²	136	84%	0.835	73%	0.729	S	S	*	*			trans	69.9	162.9	157.6	-66.8	164.2	-168.9	170.5	0	117.2
855	N	26.1	Very low	30.3	Very low	125 Å²	125	140.1 Å²	140.1	67%	0.668	74%	0.744	S	S	*	*			cis	171.6	151.2	-35	-141.3	8.7	0	0	0	105.6
856	Y	27.9	Very low	30.3	Very low	198 Å²	198	134.9 Å²	134.9	78%	0.776	74%	0.744	S	S	*	*			trans	86.5	132.5	162.4	-68.6	-64.4	0	0	0	124.1
857	T	28.3	Very low	30.2	Very low	111 Å²	111	135 Å²	135	68%	0.681	75%	0.75	S	S	*	*			trans	73.6	106.1	141.4	48.6	0	0	0	0	123.8
858	L	26.2	Very low	30.4	Very low	158 Å²	158	136 Å²	136	83%	0.827	75%	0.754	S	S	*	*				56.2	119.7	118	-62.9	168.9	0	0	0	121
859	S	29.3	Very low	30.4	Very low	119 Å²	119	138.2 Å²	138.2	83%	0.832	76%	0.759	S	S	*	*				137.1	128.8	128.4	-59.1	0	0	0	0	114.1
860	S	28.2	Very low	30.7	Very low	113 Å²	113	141.1 Å²	141.1	79%	0.79	77%	0.768	S	S	*	*			trans	-71.2	167.9	166.5	-35	0	0	0	0	110.5
861	P	39.7	Very low	31	Very low	106 Å²	106	143.8 Å²	143.8	69%	0.688	77%	0.768	S	S	*	*				-154.6	172.1	56.7	43.7	-22.6	0	0	0	120.1
862	N	31.1	Very low	31	Very low	131 Å²	131	144.2 Å²	144.2	70%	0.701	77%	0.771	S	S	*	*			trans	73.2	108.5	148.3	-65.6	-12	0	0	0	123.2
863	N	30.6	Very low	31.2	Very low	146 Å²	146	145 Å²	145	78%	0.781	78%	0.775	S	S	*	*			trans	67.6	153	133.8	-50.7	-18.8	0	0	0	117.9
864	I	32.7	Very low	31.3	Very low	144 Å²	144	146 Å²	146	74%	0.738	78%	0.782	S	S	*	*			cis	-147.6	156.8	35.1	-81.4	177.2	0	0	0	111.4
865	H	34	Very low	31.3	Very low	187 Å²	187	148 Å²	148	87%	0.866	79%	0.785	S	S	*	*			trans	67.9	132.9	173.3	-86	81	0	0	0	117.2
866	G	32.2	Very low	31.5	Very low	65 Å²	65	147 Å²	147	67%	0.67	79%	0.788	S	S	*	*			cis	180	160	-8.3	0	0	0	0	0	115.3
867	N	34	Very low	31.6	Very low	146 Å²	146	142.8 Å²	142.8	78%	0.781	78%	0.783	S	S	*	*			trans	71.5	83.9	166.1	-64.2	-0.4	0	0	0	120.6
868	N	32.2	Very low	31.9	Very low	147 Å²	147	146.1 Å²	146.1	79%	0.786	79%	0.791	S	S	*	*				81	102.7	122.5	-57.5	-4	0	0	0	120.3
869	D	29.1	Very low	32.1	Very low	161 Å²	161	144.9 Å²	144.9	86%	0.861	79%	0.785	S	S	*	*			trans	-68.4	171.4	160.1	-43.3	-104.1	0	0	0	113.5
870	E	32.1	Very low	32.2	Very low	199 Å²	199	146.4 Å²	146.4	93%	0.93	78%	0.783	S	S	*	*				-147.5	140.9	128.2	-144.6	175.8	-130.6	0	0	111.6
871	K	33.4	Very low	32.4	Very low	187 Å²	187	148.1 Å²	148.1	81%	0.813	78%	0.783	S	S	*	*			trans	-160.5	141.3	176.9	-141.3	179.2	-172.6	173.1	0	112.5
872	L	29.9	Very low	32.1	Very low	166 Å²	166	147.6 Å²	147.6	87%	0.869	78%	0.781	S	S	*	*			trans	85.6	132.1	167.1	-59	165.5	0	0	0	118.3
873	L	27.9	Very low	32.2	Very low	166 Å²	166	146.8 Å²	146.8	87%	0.869	79%	0.786	S	S	*	*			trans	-81.5	-176.3	173.6	-58	164.6	0	0	0	110
874	P	41.7	Very low	32.6	Very low	100 Å²	100	148 Å²	148	65%	0.649	79%	0.792	S	S	*	*			cis	-135.7	174.1	0.2	42.7	-26.7	0	0	0	115.6
875	Y	31.2	Very low	33.3	Very low	232 Å²	232	151.5 Å²	151.5	91%	0.91	82%	0.82	S	S	*	*				-171.1	-179.7	116.7	-108.2	-76.5	0	0	0	109.6
876	S	29	Very low	33.3	Very low	104 Å²	104	149.8 Å²	149.8	73%	0.727	82%	0.818	S	S	*	*			trans	-124.6	152.2	-166.1	-177.6	0	0	0	0	112.5
877	V	31.5	Very low	33.3	Very low	110 Å²	110	154.2 Å²	154.2	67%	0.667	83%	0.825	S	S	*	*				158.8	126.7	127.8	158.9	0	0	0	0	111.2
878	E	33.8	Very low	33.3	Very low	182 Å²	182	154.7 Å²	154.7	85%	0.85	83%	0.828	S	S	*	*			trans	58.3	165.2	159.9	-72	162.9	-152.2	0	0	120.5
879	N	31.1	Very low	33.4	Very low	132 Å²	132	155.1 Å²	155.1	71%	0.706	83%	0.83	S	S	*	*				-169	133.2	-50.9	-145.8	-8.1	0	0	0	108.4
880	L	30.4	Very low	33.6	Very low	150 Å²	150	154.8 Å²	154.8	79%	0.785	83%	0.828	S	S	*	*			trans	64.6	148.9	172.7	-50.1	168.6	0	0	0	114.6
881	L	32.5	Very low	33.7	Very low	150 Å²	150	151.8 Å²	151.8	79%	0.785	82%	0.822	S	S	*	*			cis	-154.7	145	34.9	-168.9	69.1	0	0	0	113.5
882	S	33.7	Very low	33.8	Very low	94 Å²	94	149.3 Å²	149.3	66%	0.657	82%	0.822	S	S	*	*			trans	11.8	129.8	157	-49.4	0	0	0	0	124.2
883	S	32.7	Very low	34.1	Very low	115 Å²	115	148 Å²	148	80%	0.804	82%	0.819	S	S	*	*				65.2	120.1	129	-54.5	0	0	0	0	122.2
884	L	40.2	Very low	34.6	Very low	172 Å²	172	146.5 Å²	146.5	90%	0.901	81%	0.814	S	S	*	*			trans	-168	99.8	140	-112.8	164.4	0	0	0	113.1
885	T	47.2	Very low	33.9	Very low	217 Å²	217	150.7 Å²	150.7	100%	1.331	83%	0.829	S	S	*	*			trans	174.6	0	134.7	42.9	0	0	0	0	108

Retrieved 885 of 885 residues in 855.2 ms (Link to these results)

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