A0A5K4F108_SCHMA Loading...

C2H2-type domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F108, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 926 aa.

						>A0A5K4F108_SCHMA|A0A5K4F108
MGQYGYATPFTDQWGLDHVNNPPKNPYLGYNHPKSHPYPQIVPGSSNPPFPRPGSQRLAAAHPLPPSSPPSFFVARGFQSSNQQESNHKLPTDHMSRHSMPMRSTSPPPRSRLSHSGRSASLVRYEYNQYGNCEDQIVYDDANQPSNLDRSPYLRRHGSNATRPSLGRPTLRDRSLDRYPSQRSEGMPRLQPPNYEMRSFMPMRRGEPVGDDVEMDNLRPRARRSSLERSFPRGEDSSNHHGLPHSSERASRQFPSYDMKPFATPRRVEQEDGVDIFEYGPREVRRSFDRPPTRIDDSPMSYSVHRHSEEKQRFQPPNYDRRSFTTPKQGELREPMDMDPYGVNHPRSIRDVPMNYDNRDERPKFQFPTYDLKALVSPRRGGQDDGRIPPDVHGSYRPRPLPPPPPSMRTSHSGRRSMPTENRQSPPPPPSAIPPVRERRSLENRSNGKRTVPLYFLKKPFDKSTRILCAKDRIDRAKEGIIIRRVRPHRKYCDICERRFTTRLKLTKHLQSEPHNKNLNLFKETIAKIKEDEGDDSSLLNDCYEGKTPKIYCGICKETFINKTRYMEHLKFRRHKVNTRIYEVYKAIKNNTEDKTIKLPSDDPLESFCLYMNSDAHTTLFGEKAEETTITTTTTTTTSSDNNDSNTVSSNVPDFTKQKIFMRKYLDLRHLLYEEPGPAGEEYIDELDQSAVKESKLYCCSLCNLDISGVDKLENHLHSVAHQEQYKSRVDPQWIVQKPVTTLSFNDVIFDVWKACRDKHSRDMRTVERTPVNLQCVCSYDIKTFDQFKQHYPKIFPKNIVVKDPSMFAAVENARRIRSYRNIFRECINILKLFTLTSETIVAKRAYAMKAAKARSCNNNNNIVKVPSSPPPPTTTTTTTTTTKPTSQSCSIKEENKDKEEPVNSSMDTSLPAPPTTVTVTTTQSE
					

Structure Viewer

Loading PAE data...

(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	36.6	Very low	32.7	Very low	244 Å²	244	147.1 Å²	147.1	100%	1.202	80%	0.8	S	S	*	*				0	149	0	-64.5	-54.9	-170.9	0	0	108.1
2	G	33.9	Very low	32.6	Very low	76 Å²	76	145.6 Å²	145.6	78%	0.784	79%	0.791	S	S	*	*			trans	-82.4	-168.9	-176.9	0	0	0	0	0	113.9
3	Q	35.8	Very low	32.2	Very low	175 Å²	175	147.2 Å²	147.2	82%	0.818	79%	0.79	S	S	*	*			cis	-149.1	176	9.3	-106.7	-179.6	-3.8	0	0	111.1
4	Y	34.1	Very low	32.1	Very low	215 Å²	215	154.7 Å²	154.7	84%	0.843	80%	0.802	S	S	*	*			trans	-20.1	149.1	174.2	-48.8	-85.7	0	0	0	119.5
5	G	33.3	Very low	31.9	Very low	56 Å²	56	149 Å²	149	58%	0.577	80%	0.796	S	S	*	*			cis	134.6	102.9	-5.8	0	0	0	0	0	115.4
6	Y	30.2	Very low	31.6	Very low	238 Å²	238	150.6 Å²	150.6	93%	0.933	80%	0.803	S	S	*	*			trans	60.2	154.3	158.6	-58.7	-90.7	0	0	0	119.6
7	A	31.4	Very low	31.4	Very low	82 Å²	82	150.4 Å²	150.4	68%	0.678	80%	0.802	S	S	*	*			cis	-168.1	148.9	-27.7	0	0	0	0	0	111.5
8	T	29.6	Very low	31.4	Very low	131 Å²	131	151.9 Å²	151.9	80%	0.804	80%	0.803	S	S	*	*			trans	-107.6	-177.7	144.3	61	0	0	0	0	106.6
9	P	34.7	Very low	31.4	Very low	100 Å²	100	150.5 Å²	150.5	65%	0.649	80%	0.801	S	S	*	*			cis	-138.2	-144.5	1.5	29.2	-1.6	0	0	0	112.5
10	F	32.1	Very low	31.2	Very low	191 Å²	191	150.1 Å²	150.1	84%	0.838	80%	0.799	S	S	*	*			trans	93.4	142.2	156.6	-79.5	-66.3	0	0	0	122.4
11	T	27.6	Very low	31.2	Very low	110 Å²	110	150.5 Å²	150.5	68%	0.675	80%	0.801	S	S	*	*			trans	-92.8	161.8	169.7	47.8	0	0	0	0	110.1
12	D	31.6	Very low	31	Very low	129 Å²	129	143.9 Å²	143.9	69%	0.69	78%	0.776	S	S	*	*				177.9	136.3	116.3	-89.9	-4.1	0	0	0	115.5
13	Q	28.3	Very low	31.1	Very low	166 Å²	166	146.6 Å²	146.6	78%	0.776	78%	0.78	S	S	*	*			trans	53.6	-179.4	151	-63.4	-166.8	2.6	0	0	120.7
14	W	30.8	Very low	31.1	Very low	253 Å²	253	147.7 Å²	147.7	96%	0.958	78%	0.782	S	S	*	*			trans	63.7	132.5	-171.7	-45.2	86.7	0	0	0	114.4
15	G	29.1	Very low	31	Very low	69 Å²	69	143.9 Å²	143.9	71%	0.711	78%	0.777	S	S	*	*			cis	175	148.2	-5.7	0	0	0	0	0	108.2	D17	G15-D17 PolarHBondContact O-N 2.97Å
16	L	26.6	Very low	30.9	Very low	174 Å²	174	146.4 Å²	146.4	91%	0.911	78%	0.783	S	S	*	*			trans	-74.6	123	177.1	-87.2	76.7	0	0	0	110.2
17	D	28	Very low	30.9	Very low	147 Å²	147	145 Å²	145	79%	0.786	78%	0.777	S	S	*	*				-169.5	-178.4	129.7	-114.8	-34.8	0	0	0	113.2	G15	G15-D17 PolarHBondContact O-N 2.97Å
18	H	32.1	Very low	31.1	Very low	179 Å²	179	149.8 Å²	149.8	83%	0.829	79%	0.79	S	S	*	*			trans	78.5	79.1	171.9	-58.3	-54.8	0	0	0	118.7
19	V	30.6	Very low	31	Very low	124 Å²	124	146.7 Å²	146.7	75%	0.752	78%	0.784	S	S	*	*			trans	-44.1	145	151.1	168.7	0	0	0	0	113.9
20	N	27.1	Very low	30.8	Very low	142 Å²	142	152.5 Å²	152.5	76%	0.759	80%	0.795	S	S	*	*			trans	64.3	94.5	164.2	-68.8	-20.4	0	0	0	119.7
21	N	31	Very low	30.8	Very low	159 Å²	159	150.1 Å²	150.1	85%	0.85	79%	0.791	S	S	*	*				-166.3	139	129	-108.5	-69.5	0	0	0	112.1
22	P	34.1	Very low	31	Very low	105 Å²	105	154 Å²	154	68%	0.682	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-79.7	145.6	171	32.5	-33.4	0	0	0	111.8
23	P	34.5	Very low	31.1	Very low	133 Å²	133	153.6 Å²	153.6	86%	0.864	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-69.1	136.5	-176.2	27.2	-34.5	0	0	0	112.7
24	K	36.4	Very low	31.3	Very low	199 Å²	199	154.9 Å²	154.9	87%	0.865	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-73.8	144.1	175.1	-70.5	176.4	179.2	172.1	0	111.2	P26	K24-P26 WeakPolarHBondContact O-CD 3.27Å
25	N	31.8	Very low	31.4	Very low	135 Å²	135	147.9 Å²	147.9	72%	0.722	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-71.4	121.1	-178.9	179.6	13.4	0	0	0	112	Y27	N25-Y27 PolarHBondContact O-N 3.43Å
26	P	30.9	Very low	31.6	Very low	108 Å²	108	152.9 Å²	152.9	70%	0.701	80%	0.803	S	S	*	*			trans	-94.3	28.7	-170.9	38.7	-37.5	0	0	0	115.3	K24	K24-P26 WeakPolarHBondContact O-CD 3.27Å
27	Y	31.1	Very low	32	Very low	209 Å²	209	150.3 Å²	150.3	82%	0.82	80%	0.796	S	S	*	*			trans	-129.3	73.4	176.3	-83.7	-80.2	0	0	0	113.2	N25	N25-Y27 PolarHBondContact O-N 3.43Å
28	L	34.3	Very low	31.9	Very low	182 Å²	182	154 Å²	154	95%	0.953	80%	0.801	S	S	*	*			trans	-128.7	87.2	161.1	-89.2	174.9	0	0	0	109.7
29	G	29.3	Very low	32.1	Very low	66 Å²	66	150.6 Å²	150.6	68%	0.68	80%	0.795	S	S	*	*			trans	-168.5	102.3	174.9	0	0	0	0	0	111.4
30	Y	30.6	Very low	32	Very low	222 Å²	222	153.9 Å²	153.9	87%	0.871	80%	0.802	S	S	*	*	S	Bend	trans	-176	121.5	131	-102.7	-64.2	0	0	0	111.1
31	N	31.4	Very low	32.2	Very low	141 Å²	141	154.8 Å²	154.8	75%	0.754	81%	0.805	S	S	*	*			trans	51.3	85.7	154.6	-60	-13.7	0	0	0	120.2
32	H	30.9	Very low	32.5	Very low	193 Å²	193	152.8 Å²	152.8	89%	0.894	80%	0.798	S	S	*	*			trans	-89	136.5	136.8	-97.5	-82.2	0	0	0	109.5	K34	H32-K34 PolarHBondContact O-N 3.29Å
33	P	34.4	Very low	32.4	Very low	120 Å²	120	154.3 Å²	154.3	78%	0.779	81%	0.808	S	S	*	*			trans	-80.5	101.9	-178.2	30.3	-33.6	0	0	0	113.5
34	K	32.8	Very low	32.3	Very low	192 Å²	192	150.5 Å²	150.5	84%	0.835	79%	0.793	S	S	*	*			trans	61.2	136.1	147.6	-63.4	-177.4	176	-179.1	0	121	H32	H32-K34 PolarHBondContact O-N 3.29Å
35	S	32.5	Very low	32.2	Very low	106 Å²	106	147 Å²	147	74%	0.741	79%	0.794	S	S	*	*			trans	69.1	138.3	158.5	69.4	0	0	0	0	117
36	H	33.1	Very low	32.2	Very low	175 Å²	175	145 Å²	145	81%	0.81	79%	0.79	S	S	*	*			cis	-121.7	164.5	4.3	-89.5	-88.1	0	0	0	112.4
37	P	36	Very low	32.4	Very low	119 Å²	119	147 Å²	147	77%	0.773	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-84.8	159.2	-171.4	33.9	-36.8	0	0	0	115.8
38	Y	24.6	Very low	32.5	Very low	224 Å²	224	142.4 Å²	142.4	88%	0.878	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-77.1	154.6	170.9	-97.7	-100	0	0	0	113.3
39	P	36.3	Very low	32.7	Very low	109 Å²	109	139.5 Å²	139.5	71%	0.708	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-96	145	141	-5.5	25.2	0	0	0	111.3
40	Q	29.7	Very low	32.9	Very low	192 Å²	192	145.8 Å²	145.8	90%	0.897	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-83.6	140.1	170.3	-59.6	170.9	-2.1	0	0	109.9
41	I	31.2	Very low	33.5	Very low	161 Å²	161	140.9 Å²	140.9	83%	0.826	79%	0.788	S	S	*	*			trans	-134.4	136	164.1	-58.1	-176.6	0	0	0	110.7
42	V	37.1	Very low	33.8	Very low	118 Å²	118	145.8 Å²	145.8	72%	0.715	80%	0.795	S	S	*	*			trans	-58.2	146.9	179.1	179.8	0	0	0	0	111.9	G44	V42-G44 PolarHBondContact O-N 3.31Å
43	P	32.1	Very low	34.1	Very low	136 Å²	136	143.1 Å²	143.1	88%	0.883	80%	0.795	S	S	*	*	S	Bend	trans	-67.8	98.5	173.8	28.3	-35.7	0	0	0	111.8
44	G	32.1	Very low	34.1	Very low	54 Å²	54	141.2 Å²	141.2	56%	0.557	80%	0.798	S	S	*	*			trans	-175.1	152.2	174.8	0	0	0	0	0	112.5	V42	V42-G44 PolarHBondContact O-N 3.31Å
45	S	34.3	Very low	34.2	Very low	124 Å²	124	136.7 Å²	136.7	87%	0.867	79%	0.79	S	S	*	*			trans	66.8	127.1	-178.6	71	0	0	0	0	118.3
46	S	32.4	Very low	34.4	Very low	94 Å²	94	140 Å²	140	66%	0.657	79%	0.794	S	S	*	*			trans	-48.8	150.9	168.8	47.8	0	0	0	0	118.2
47	N	34.6	Very low	34.4	Very low	150 Å²	150	142 Å²	142	80%	0.802	79%	0.794	S	S	*	*			trans	75.1	122	151.8	-59.3	-19.4	0	0	0	119.3
48	P	33	Very low	34.4	Very low	112 Å²	112	143.8 Å²	143.8	73%	0.727	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-97.2	144.6	175.7	36.6	-32.7	0	0	0	113.9
49	P	38.6	Very low	34.8	Very low	122 Å²	122	137.6 Å²	137.6	79%	0.792	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-101.1	129	164.9	34.4	-28.1	0	0	0	112.5
50	F	33.3	Very low	34.7	Very low	197 Å²	197	136.6 Å²	136.6	86%	0.864	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-91	128.8	170	-90.5	-88.9	0	0	0	111.5
51	P	44.1	Very low	35	Very low	120 Å²	120	131.5 Å²	131.5	78%	0.779	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-89.8	148.6	161.9	21.3	-8.1	0	0	0	112.1
52	R	37.4	Very low	35.3	Very low	243 Å²	243	132.2 Å²	132.2	92%	0.917	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-89.1	153.7	-178	-66.6	-178.1	175.1	-158.4	-1.9	113.1
53	P	36	Very low	35.3	Very low	138 Å²	138	132.5 Å²	132.5	90%	0.896	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-84.9	151.6	174.4	34.4	-35.1	0	0	0	114.2
54	G	34.6	Very low	35.5	Very low	80 Å²	80	133.8 Å²	133.8	83%	0.825	79%	0.786	S	S	*	*			trans	179.2	164.4	170.7	0	0	0	0	0	109.4
55	S	34.8	Very low	36	Very low	97 Å²	97	136.9 Å²	136.9	68%	0.678	80%	0.796	S	S	*	*			cis	-162.7	162.6	-2.2	-170.5	0	0	0	0	109.3
56	Q	36.6	Very low	36.3	Very low	175 Å²	175	135.7 Å²	135.7	82%	0.818	79%	0.786	S	S	*	*			trans	67	147.4	167.9	-62.5	146.9	58.8	0	0	116.1
57	R	33.3	Very low	36.6	Very low	217 Å²	217	136.8 Å²	136.8	82%	0.819	79%	0.793	S	S	*	*			cis	-142.6	146.5	35.6	-79.5	178.9	162.1	-166.3	-5.3	114.4
58	L	36.8	Very low	36.6	Very low	156 Å²	156	134.8 Å²	134.8	82%	0.817	79%	0.791	S	S	*	*			trans	46.1	133.5	132.3	-53.6	171.5	0	0	0	119.6
59	A	32.9	Very low	36.8	Very low	95 Å²	95	135 Å²	135	79%	0.785	79%	0.793	S	S	*	*			cis	-162.4	177.3	-5.1	0	0	0	0	0	108.2
60	A	34.8	Very low	37	Very low	88 Å²	88	134.2 Å²	134.2	73%	0.727	79%	0.787	S	S	*	*			cis	-154.5	161	5.9	0	0	0	0	0	110.8
61	A	35.1	Very low	37	Very low	85 Å²	85	129.1 Å²	129.1	70%	0.702	78%	0.776	S	S	*	*			trans	44.5	145.6	153.1	0	0	0	0	0	122.2
62	H	37.6	Very low	36.5	Very low	176 Å²	176	132.4 Å²	132.4	82%	0.815	78%	0.778	S	S	*	*			cis	-174.4	-163.4	-16.8	-87.2	-54.8	0	0	0	106
63	P	37.6	Very low	36.3	Very low	124 Å²	124	129.8 Å²	129.8	81%	0.805	77%	0.774	S	S	*	*				-48.6	173.8	-83	46.9	-23.9	0	0	0	128.9
64	L	35.6	Very low	36.4	Very low	162 Å²	162	129.3 Å²	129.3	85%	0.848	77%	0.768	S	S	*	*			trans	-131.3	-170.3	153.4	-74	169.5	0	0	0	107.8
65	P	43	Very low	36.3	Very low	119 Å²	119	129.9 Å²	129.9	77%	0.773	77%	0.765	S	S	*	*			cis	-119.4	-114.7	-12.6	22.6	5.1	0	0	0	109.9
66	P	40.7	Very low	36.2	Very low	100 Å²	100	136.3 Å²	136.3	65%	0.649	77%	0.774	S	S	*	*			cis	-138.4	162.2	-34.2	39.3	-20.3	0	0	0	119
67	S	37.9	Very low	36.2	Very low	117 Å²	117	131.1 Å²	131.1	82%	0.818	77%	0.768	S	S	*	*			trans	73.5	158	139.2	63	0	0	0	0	125.2
68	S	34.2	Very low	36.2	Very low	108 Å²	108	129.7 Å²	129.7	76%	0.755	77%	0.768	S	S	*	*			trans	-153.2	-150.9	-170.9	63.1	0	0	0	0	108.6
69	P	38.1	Very low	36.2	Very low	117 Å²	117	130.8 Å²	130.8	76%	0.76	77%	0.769	S	S	*	*			cis	-127.5	-98.8	-1.3	23.5	5.4	0	0	0	119.2
70	P	42.2	Very low	36.1	Very low	105 Å²	105	132.1 Å²	132.1	68%	0.682	77%	0.773	S	S	*	*				-144.9	-178.1	-129.9	47.2	-27	0	0	0	121.7
71	S	33.5	Very low	36.1	Very low	89 Å²	89	133.4 Å²	133.4	62%	0.622	78%	0.776	S	S	*	*			trans	97.6	165.8	136.1	75.1	0	0	0	0	124.4
72	F	34.3	Very low	35.8	Very low	189 Å²	189	136.7 Å²	136.7	83%	0.829	78%	0.782	S	S	*	*			trans	82.6	157.2	174.8	-53.8	-75.1	0	0	0	120.4
73	F	33.3	Very low	35.7	Very low	188 Å²	188	136 Å²	136	83%	0.825	78%	0.779	S	S	*	*				-165	-179.6	-56.8	-131.6	-86.5	0	0	0	111.1
74	V	36.7	Very low	35.5	Very low	128 Å²	128	138 Å²	138	78%	0.776	78%	0.778	S	S	*	*			trans	81.4	140.5	171.5	-177.5	0	0	0	0	116
75	A	33.4	Very low	35.2	Very low	92 Å²	92	138 Å²	138	76%	0.76	77%	0.773	S	S	*	*			cis	104.2	156.3	7.2	0	0	0	0	0	116.4
76	R	32.9	Very low	35	Very low	232 Å²	232	138.1 Å²	138.1	88%	0.875	78%	0.777	S	S	*	*			cis	-166.1	136.3	7.1	-171.2	-173.6	-173.9	-172.5	2.5	113.8
77	G	37.2	Very low	34.5	Very low	67 Å²	67	139.8 Å²	139.8	69%	0.691	78%	0.781	S	S	*	*			trans	98.5	173	155	0	0	0	0	0	120
78	F	33.3	Very low	34.4	Very low	187 Å²	187	142.5 Å²	142.5	82%	0.82	78%	0.78	S	S	*	*			cis	-171.6	166.8	-23.3	-124.1	-69.2	0	0	0	113.3
79	Q	36	Very low	34.4	Very low	179 Å²	179	145.4 Å²	145.4	84%	0.836	78%	0.779	S	S	*	*			trans	85.3	164	157.4	-72.6	179.8	6	0	0	122.1
80	S	31	Very low	34	Very low	122 Å²	122	147.1 Å²	147.1	85%	0.853	78%	0.781	S	S	*	*			trans	-162.9	136.4	-161.2	-43.5	0	0	0	0	114.8
81	S	35.2	Very low	33.8	Very low	115 Å²	115	147.7 Å²	147.7	80%	0.804	79%	0.785	S	S	*	*			trans	-167.1	132.4	158.4	52.6	0	0	0	0	108.8
82	N	28.8	Very low	33.8	Very low	155 Å²	155	148.3 Å²	148.3	83%	0.829	79%	0.785	S	S	*	*				91.3	140.3	50.5	-148.8	13.6	0	0	0	113.3
83	Q	35.4	Very low	33.9	Very low	161 Å²	161	147 Å²	147	75%	0.752	79%	0.786	S	S	*	*			trans	87.2	124.5	173.8	-61.4	-171.3	-8.7	0	0	123.1
84	Q	33.3	Very low	34	Very low	166 Å²	166	145 Å²	145	78%	0.776	78%	0.779	S	S	*	*			trans	78.3	159.7	135.4	-85.7	-173.6	-62.4	0	0	125.3
85	E	29.1	Very low	34	Very low	162 Å²	162	146.7 Å²	146.7	76%	0.757	78%	0.781	S	S	*	*			trans	-96.3	160.5	-162.8	-51.4	133.6	103.1	0	0	113
86	S	38.3	Very low	34	Very low	121 Å²	121	146.5 Å²	146.5	85%	0.846	77%	0.774	S	S	*	*				-170.8	169.6	129.5	30.5	0	0	0	0	111.3
87	N	29.9	Very low	33.9	Very low	136 Å²	136	145 Å²	145	73%	0.727	77%	0.768	S	S	*	*			trans	-98.4	177.8	-172.6	-77.6	-86.9	0	0	0	112.7
88	H	35.5	Very low	33.9	Very low	174 Å²	174	149.5 Å²	149.5	81%	0.806	77%	0.771	S	S	*	*			trans	104.1	155.5	152.4	-49	-55.8	0	0	0	118.7
89	K	33.9	Very low	34	Very low	169 Å²	169	145.9 Å²	145.9	74%	0.735	77%	0.769	S	S	*	*			cis	-174.3	100.7	-36.3	-177.4	174.6	175.7	-177.2	0	110.8
90	L	31.3	Very low	33.9	Very low	152 Å²	152	146 Å²	146	80%	0.796	77%	0.771	S	S	*	*			trans	61	-179.1	165.1	-65.7	167	0	0	0	114.9
91	P	36.7	Very low	34.2	Very low	118 Å²	118	146.1 Å²	146.1	77%	0.766	77%	0.769	S	S	*	*			cis	-124.7	174.9	-9.6	22	2.3	0	0	0	116.7
92	T	33.4	Very low	34.1	Very low	101 Å²	101	149.2 Å²	149.2	62%	0.62	77%	0.773	S	S	*	*			trans	-29.7	153.4	159.1	-36	0	0	0	0	118.7
93	D	36.8	Very low	34.2	Very low	161 Å²	161	154.1 Å²	154.1	86%	0.861	78%	0.78	S	S	*	*			trans	-147.7	166	132.6	-138.8	-27.6	0	0	0	113.4
94	H	34.9	Very low	33.9	Very low	147 Å²	147	151.5 Å²	151.5	68%	0.681	78%	0.78	S	S	*	*			trans	-131.9	147.7	-168.1	-72.4	-83.8	0	0	0	115
95	M	38	Very low	33.9	Very low	164 Å²	164	150.3 Å²	150.3	81%	0.808	78%	0.784	S	S	*	*			trans	-170.4	124.7	141.4	-92.8	-45	101.3	0	0	108
96	S	32.9	Very low	34	Very low	87 Å²	87	147.3 Å²	147.3	61%	0.608	78%	0.781	S	S	*	*				74.7	141.8	76.9	-68.9	0	0	0	0	115.3
97	R	31.4	Very low	33.7	Very low	201 Å²	201	147.4 Å²	147.4	76%	0.758	78%	0.778	S	S	*	*			cis	-172.7	176.9	-17.3	-108.6	-177.1	-178.2	-171.8	1.5	107
98	H	37.3	Very low	34.1	Very low	162 Å²	162	146.7 Å²	146.7	75%	0.75	78%	0.781	S	S	*	*			trans	72.6	142.3	166	-51.4	-68.2	0	0	0	115.9
99	S	34.5	Very low	33.9	Very low	110 Å²	110	144 Å²	144	77%	0.769	78%	0.78	S	S	*	*			cis	-152.9	159.2	-7.1	-89.8	0	0	0	0	111
100	M	33.7	Very low	33.6	Very low	182 Å²	182	147.2 Å²	147.2	90%	0.897	79%	0.787	S	S	*	*			trans	-107.6	157.8	165.7	-80.5	-81.9	-175.7	0	0	110.1
101	P	37.7	Very low	33.6	Very low	125 Å²	125	145.2 Å²	145.2	81%	0.812	79%	0.785	S	S	*	*				-141	162.6	118.8	37.5	-25.5	0	0	0	115.6
102	M	32.3	Very low	33.2	Very low	179 Å²	179	150.6 Å²	150.6	88%	0.882	79%	0.79	S	S	*	*			trans	-79.4	154.9	-179.6	-61.2	-82	-176.9	0	0	113.5
103	R	32.4	Very low	33.1	Very low	258 Å²	258	153.6 Å²	153.6	97%	0.974	80%	0.802	S	S	*	*				-160.4	160.6	129.3	-111.1	162.7	-167.1	-97.5	-0.9	113.3
104	S	28.7	Very low	32.7	Very low	107 Å²	107	150.7 Å²	150.7	75%	0.748	79%	0.794	S	S	*	*			trans	-137.3	132.3	-153.6	55.7	0	0	0	0	114.4
105	T	33.6	Very low	32.3	Very low	141 Å²	141	152.7 Å²	152.7	87%	0.865	80%	0.803	S	S	*	*			trans	-171.2	147.9	159.2	21.4	0	0	0	0	108
106	S	30.7	Very low	32	Very low	99 Å²	99	150.7 Å²	150.7	69%	0.692	81%	0.806	S	S	*	*			cis	-166.6	147.9	-24.4	36.9	0	0	0	0	107.8
107	P	30.9	Very low	31.6	Very low	122 Å²	122	150.1 Å²	150.1	79%	0.792	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-83.2	140.6	-168.1	32	-35.5	0	0	0	114.3
108	P	38.9	Very low	31.5	Very low	121 Å²	121	152 Å²	152	79%	0.786	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-72.3	156.2	162.6	31.2	-33.2	0	0	0	111.4
109	P	31.3	Very low	31	Very low	119 Å²	119	149.9 Å²	149.9	77%	0.773	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-86.3	160.2	-158.7	33.1	-37.7	0	0	0	116	S111	P109-S111 PolarHBondContact O-N 3.46Å
110	R	28	Very low	30.5	Very low	236 Å²	236	149.5 Å²	149.5	89%	0.891	83%	0.828	S	S	*	*			trans	-64.4	96.3	167.3	-78.1	177.5	164.1	178	-3.2	111.8	R112	R110-R112 PolarHBondContact O-N 3.48Å; R110-R112 VanDerWaalsContact O-N 3.07Å
111	S	31.4	Very low	30.1	Very low	109 Å²	109	145.7 Å²	145.7	76%	0.762	82%	0.819	S	S	*	*			trans	-78.5	80.9	166.4	44.8	0	0	0	0	111.8	P109 L113	P109-S111 PolarHBondContact O-N 3.46Å; S111-L113 VanDerWaalsContact C-N 3.34Å; S111-L113 PolarHBondContact O-N 3.26Å
112	R	27.2	Very low	29.6	Very low	231 Å²	231	147.9 Å²	147.9	87%	0.872	82%	0.823	S	S	*	*			trans	-69.7	89.6	162.4	-84.1	-173.6	169.9	-175	-2.5	109.5	R110	R110-R112 PolarHBondContact O-N 3.48Å; R110-R112 VanDerWaalsContact O-N 3.07Å
113	L	33	Very low	29.3	Very low	165 Å²	165	144.4 Å²	144.4	86%	0.864	81%	0.812	S	S	*	*			trans	-124.6	120.9	164.9	-86.7	170	0	0	0	111	S111	S111-L113 VanDerWaalsContact C-N 3.34Å; S111-L113 PolarHBondContact O-N 3.26Å
114	S	27.2	Very low	29	Very low	100 Å²	100	142 Å²	142	70%	0.699	80%	0.803	S	S	*	*			trans	-89.7	149.1	-174.9	44.7	0	0	0	0	112.8
115	H	28	Very low	28.9	Very low	188 Å²	188	146.9 Å²	146.9	87%	0.87	81%	0.806	S	S	*	*			trans	53.6	101.5	158.7	-58	-37.3	0	0	0	118.9
116	S	30.6	Very low	28.6	Very low	122 Å²	122	147 Å²	147	85%	0.853	80%	0.797	S	S	*	*			trans	-142.5	92.9	134.9	-170.4	0	0	0	0	109.3
117	G	25.8	Very low	28.4	Very low	75 Å²	75	152.4 Å²	152.4	77%	0.773	80%	0.804	S	S	*	*			trans	-87.1	121.1	-178.4	0	0	0	0	0	111.6
118	R	28.8	Very low	28.3	Very low	240 Å²	240	152.7 Å²	152.7	91%	0.906	80%	0.798	S	S	*	*			trans	-142.1	72.3	168	-95.3	-177.9	-177.9	-164.3	-0.7	111.7	A120	R118-A120 PolarHBondContact O-N 3.4Å
119	S	25.5	Very low	27.8	Very low	119 Å²	119	156.3 Å²	156.3	83%	0.832	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-54.9	120.1	157.9	-10.4	0	0	0	0	108.2	S121	S119-S121 PolarHBondContact O-N 2.85Å
120	A	25.7	Very low	27.8	Very low	102 Å²	102	160.9 Å²	160.9	84%	0.843	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-66.4	118.5	177.7	0	0	0	0	0	109.2	R118 L122	R118-A120 PolarHBondContact O-N 3.4Å; A120-L122 PolarHBondContact O-N 2.88Å
121	S	25.3	Very low	27.7	Very low	102 Å²	102	152.6 Å²	152.6	71%	0.713	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-59	118.8	-168.1	56.7	0	0	0	0	113.8	S119 V123	S119-S121 PolarHBondContact O-N 2.85Å; S121-V123 PolarHBondContact O-N 2.98Å
122	L	26.9	Very low	27.4	Very low	170 Å²	170	154.9 Å²	154.9	89%	0.89	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-58.9	126.8	144.1	-169.3	79.4	0	0	0	106.6	A120 R124	A120-L122 PolarHBondContact O-N 2.88Å; L122-R124 PolarHBondContact O-N 3.42Å
123	V	26	Very low	27.5	Very low	107 Å²	107	149.9 Å²	149.9	65%	0.648	80%	0.799	S	S	*	*			trans	-72.3	101.9	-173.8	178.5	0	0	0	0	109.6	S121 Y125	S121-V123 PolarHBondContact O-N 2.98Å; V123-Y125 HydrophobicContact CG1-CD2 4.38Å; V123-Y125 PolarHBondContact O-N 2.83Å
124	R	25.1	Very low	27.2	Very low	207 Å²	207	151.1 Å²	151.1	78%	0.781	80%	0.8	S	S	*	*			trans	-62.3	117.4	158.4	-85.7	-174.2	169.6	156.7	-0.3	108.4	L122 E126	L122-R124 PolarHBondContact O-N 3.42Å; R124-E126 VanDerWaalsContact C-N 3.27Å; R124-E126 HydrophobicContact CB-CG 4.26Å; R124-E126 PolarHBondContact O-N 3.15Å; R124-E126 VanDerWaalsContact O-N 3.12Å
125	Y	26.7	Very low	27.4	Very low	209 Å²	209	153 Å²	153	82%	0.82	80%	0.802	S	S	*	*			trans	-73.4	89.8	152.9	-96.2	-94.7	0	0	0	107.8	V123 Y127	V123-Y125 HydrophobicContact CG1-CD2 4.38Å; V123-Y125 PolarHBondContact O-N 2.83Å; Y125-Y127 PolarHBondContact O-N 3.21Å
126	E	26.9	Very low	27.3	Very low	143 Å²	143	153.3 Å²	153.3	67%	0.668	80%	0.804	S	S	*	*			trans	-70.4	106.2	162	-74.6	176.8	171.6	0	0	107.5	R124 N128	R124-E126 VanDerWaalsContact C-N 3.27Å; R124-E126 HydrophobicContact CB-CG 4.26Å; R124-E126 PolarHBondContact O-N 3.15Å; R124-E126 VanDerWaalsContact O-N 3.12Å; E126-N128 PolarHBondContact O-N 3.39Å; E126-N128 VanDerWaalsContact O-N 3.12Å
127	Y	27.7	Very low	27.2	Very low	214 Å²	214	154.2 Å²	154.2	84%	0.839	80%	0.798	S	S	*	*			trans	-73.4	99.7	172.1	-133.8	-87.6	0	0	0	107.1	Y125 Q129	Y125-Y127 PolarHBondContact O-N 3.21Å; Y127-Q129 PolarHBondContact O-N 3.03Å
128	N	29	Very low	27.3	Very low	128 Å²	128	155.6 Å²	155.6	68%	0.684	79%	0.792	S	S	*	*			trans	-57.7	112.1	-178.9	-87.2	-10.6	0	0	0	110.5	E126 Y130	E126-N128 PolarHBondContact O-N 3.39Å; E126-N128 VanDerWaalsContact O-N 3.12Å; N128-Y130 HydrophobicContact CB-CD2 4.41Å; N128-Y130 PolarHBondContact O-N 3.24Å; N128-Y130 VanDerWaalsContact O-N 3.1Å
129	Q	27.7	Very low	27.2	Very low	196 Å²	196	155.4 Å²	155.4	92%	0.916	79%	0.792	S	S	*	*			trans	-73.5	95.6	166.3	-70.3	-179.5	-35.4	0	0	108.8	Y127	Y127-Q129 PolarHBondContact O-N 3.03Å
130	Y	30.4	Very low	27.4	Very low	216 Å²	216	157 Å²	157	85%	0.847	79%	0.792	S	S	*	*			trans	-105.6	114.2	155.9	-90.8	-84.7	0	0	0	107.9	N128	N128-Y130 HydrophobicContact CB-CD2 4.41Å; N128-Y130 PolarHBondContact O-N 3.24Å; N128-Y130 VanDerWaalsContact O-N 3.1Å
131	G	26.3	Very low	27.4	Very low	62 Å²	62	158.8 Å²	158.8	64%	0.639	79%	0.787	S	S	*	*			trans	-100	170.1	171	0	0	0	0	0	111.7
132	N	26.5	Very low	27.8	Very low	156 Å²	156	158.6 Å²	158.6	83%	0.834	79%	0.792	S	S	*	*			trans	53	82.1	166.7	-65	31.1	0	0	0	117.1
133	C	27.8	Very low	28	Very low	127 Å²	127	155.3 Å²	155.3	86%	0.858	78%	0.775	S	S	*	*				-123.9	110.8	128	-64	0	0	0	0	107.5
134	E	26.8	Very low	28.1	Very low	190 Å²	190	154.8 Å²	154.8	89%	0.888	77%	0.765	S	S	*	*			trans	-79.6	124.2	156	-66.5	173.4	129.4	0	0	106.2
135	D	31.7	Very low	28.5	Very low	139 Å²	139	150.1 Å²	150.1	74%	0.743	76%	0.762	S	S	*	*			trans	-141.2	106.5	168.9	-111	-40.3	0	0	0	108.6	I137	D135-I137 PolarHBondContact O-N 2.89Å
136	Q	26.6	Very low	28.5	Very low	195 Å²	195	144.8 Å²	144.8	91%	0.911	76%	0.755	S	S	*	*			trans	-90.3	78.2	-170.8	-174	177.6	45.3	0	0	109.9
137	I	27.7	Very low	28.5	Very low	141 Å²	141	144.9 Å²	144.9	72%	0.723	76%	0.76	S	S	*	*			trans	-106.3	94.9	-179.8	-53.8	-175.5	0	0	0	110.8	D135	D135-I137 PolarHBondContact O-N 2.89Å
138	V	28.8	Very low	28.5	Very low	105 Å²	105	142.3 Å²	142.3	64%	0.636	76%	0.76	S	S	*	*			trans	-10.2	124.8	157.2	-176.6	0	0	0	0	115.4
139	Y	25.4	Very low	28.4	Very low	236 Å²	236	142.7 Å²	142.7	93%	0.925	76%	0.762	S	S	*	*			trans	-80.9	109.7	154	-82.9	-102.1	0	0	0	108.3
140	D	30.2	Very low	28.5	Very low	153 Å²	153	143.3 Å²	143.3	82%	0.818	76%	0.756	S	S	*	*			trans	-88.4	122.6	162	-95.7	-44.3	0	0	0	109.1
141	D	26.9	Very low	28.7	Very low	138 Å²	138	139.1 Å²	139.1	74%	0.738	76%	0.758	S	S	*	*			trans	-84.9	139	-176	-147.2	-13.9	0	0	0	110.9	N143	D141-N143 VanDerWaalsContact CG-ND2 3.32Å; D141-N143 PolarHBondContact OD1-ND2 3.28Å; D141-N143 PolarHBondContact OD2-ND2 3.36Å
142	A	33.4	Very low	29	Very low	99 Å²	99	140.1 Å²	140.1	82%	0.818	75%	0.754	S	S	*	*			trans	-136.4	57.2	-176.2	0	0	0	0	0	111.7	Q144	A142-Q144 PolarHBondContact O-N 3.37Å
143	N	29.7	Very low	29.1	Very low	101 Å²	101	142.3 Å²	142.3	54%	0.54	75%	0.752	S	S	.	*			trans	-60	118.1	173.1	-75	-76.7	0	0	0	111.9	D141	D141-N143 VanDerWaalsContact CG-ND2 3.32Å; D141-N143 PolarHBondContact OD1-ND2 3.28Å; D141-N143 PolarHBondContact OD2-ND2 3.36Å
144	Q	28.3	Very low	29.1	Very low	95 Å²	95	143.5 Å²	143.5	44%	0.444	75%	0.749	S	S	.	*				169.9	151.2	102	-89	-150.9	-13.8	0	0	113.5	A142 L372	A142-Q144 PolarHBondContact O-N 3.37Å; Q144-L372 VanDerWaalsContact CD-CD1 3.41Å; Q144-L372 HydrophobicContact CG-CD1 3.94Å
145	P	34.8	Very low	29.2	Very low	110 Å²	110	144.7 Å²	144.7	71%	0.714	75%	0.745	S	S	*	*			trans	-93.2	163	163	38.1	-33.1	0	0	0	112.2
146	S	26.8	Very low	29.3	Very low	96 Å²	96	148 Å²	148	67%	0.671	75%	0.748	S	S	*	*				160	158.5	122.7	59.7	0	0	0	0	115
147	N	25.5	Very low	29.6	Very low	145 Å²	145	147.4 Å²	147.4	78%	0.775	74%	0.744	S	S	*	*			trans	73.8	157.5	153.5	-64.8	-47	0	0	0	121
148	L	29	Very low	29.8	Very low	161 Å²	161	144 Å²	144	84%	0.843	74%	0.744	S	S	*	*			trans	69.8	87.3	179.8	-53.8	177.2	0	0	0	113.8
149	D	26.4	Very low	30	Very low	136 Å²	136	143.6 Å²	143.6	73%	0.727	75%	0.745	S	S	*	*				72.5	146.3	53	-165.5	30.4	0	0	0	114.1
150	R	28.7	Very low	30.2	Very low	208 Å²	208	139.9 Å²	139.9	79%	0.785	74%	0.742	S	S	*	*			trans	68.5	97.5	176.7	-54	-179.6	180	-174	-5.8	117	P152	R150-P152 WeakPolarHBondContact O-CD 3.48Å
151	S	35.9	Very low	30.1	Very low	128 Å²	128	136.1 Å²	136.1	90%	0.895	73%	0.732	S	S	*	*			trans	-71.1	132.5	137.2	-67	0	0	0	0	109.1
152	P	33.2	Very low	30.4	Very low	84 Å²	84	135.9 Å²	135.9	55%	0.545	74%	0.736	S	S	.	*			trans	-150.6	167	138.8	35.6	-17.2	0	0	0	116.1	R150	R150-P152 WeakPolarHBondContact O-CD 3.48Å
153	Y	28.6	Very low	30.3	Very low	202 Å²	202	142.1 Å²	142.1	79%	0.792	74%	0.738	S	S	*	*			trans	70.9	124.2	169.6	-49.9	-67.6	0	0	0	116.9
154	L	27.3	Very low	30.6	Very low	151 Å²	151	142.9 Å²	142.9	79%	0.791	75%	0.749	S	S	*	*			cis	94	145.4	36	-76.2	166.4	0	0	0	114.8
155	R	29	Very low	30.7	Very low	215 Å²	215	143.5 Å²	143.5	81%	0.811	76%	0.763	S	S	*	*			trans	76.4	140.8	176.9	-64	170.4	174.2	165	-2	114.7
156	R	34.3	Very low	30.5	Very low	210 Å²	210	146.7 Å²	146.7	79%	0.792	77%	0.773	S	S	*	*			cis	-127.1	145.7	-0.4	-91.5	126.6	-174.6	-77.3	5.2	109.4
157	H	32	Very low	30.8	Very low	182 Å²	182	145.7 Å²	145.7	84%	0.843	78%	0.778	S	S	*	*				39.2	129.6	91.6	-52.1	-82.1	0	0	0	114.5
158	G	32.2	Very low	31.1	Very low	69 Å²	69	150.7 Å²	150.7	71%	0.711	79%	0.786	S	S	*	*			cis	-167.2	-164.1	-2.7	0	0	0	0	0	107.5
159	S	31.6	Very low	31.6	Very low	96 Å²	96	148.2 Å²	148.2	67%	0.671	78%	0.78	S	S	*	*			cis	158	145.6	-3.2	43	0	0	0	0	104.9
160	N	30.9	Very low	32.2	Very low	158 Å²	158	148.3 Å²	148.3	85%	0.845	79%	0.785	S	S	*	*			trans	73.8	150.3	169.8	-48.5	-21.7	0	0	0	116.2
161	A	28.9	Very low	32.5	Very low	74 Å²	74	145.2 Å²	145.2	61%	0.612	78%	0.784	S	S	*	*			cis	-170.3	172.9	-22	0	0	0	0	0	109.5
162	T	32.7	Very low	32.6	Very low	134 Å²	134	149.5 Å²	149.5	82%	0.822	78%	0.781	S	S	*	*			trans	64.5	148.6	158.7	34.7	0	0	0	0	118.2
163	R	30.8	Very low	32.5	Very low	229 Å²	229	152 Å²	152	86%	0.864	79%	0.789	S	S	*	*			cis	-163.5	151.5	-17.9	-154.1	173.6	-177.7	-168.5	-0.3	107.7
164	P	37	Very low	32.8	Very low	118 Å²	118	154.3 Å²	154.3	77%	0.766	80%	0.796	S	S	*	*			trans	-91.9	143.7	173.3	34	-34.2	0	0	0	113.6
165	S	28.6	Very low	33	Very low	107 Å²	107	152 Å²	152	75%	0.748	79%	0.793	S	S	*	*			trans	-177.6	134.3	148.4	60.9	0	0	0	0	115.8
166	L	32.1	Very low	33.4	Very low	178 Å²	178	149.6 Å²	149.6	93%	0.932	80%	0.796	S	S	*	*			trans	62	132.7	135.4	-63.3	168.5	0	0	0	123.9
167	G	33.2	Very low	33.3	Very low	75 Å²	75	146.1 Å²	146.1	77%	0.773	79%	0.792	S	S	*	*			trans	106	136.6	150.4	0	0	0	0	0	116.5
168	R	31.4	Very low	33.4	Very low	249 Å²	249	148.5 Å²	148.5	94%	0.94	79%	0.794	S	S	*	*			cis	-156.2	162	-12.6	-128.4	-158.7	176.1	-157.2	0.4	109.5
169	P	39.8	Very low	33.4	Very low	110 Å²	110	155.6 Å²	155.6	71%	0.714	80%	0.801	S	S	*	*			trans	-115.7	163.6	-170.2	41.5	-32.8	0	0	0	116.3
170	T	39.4	Very low	33.6	Very low	137 Å²	137	156.8 Å²	156.8	84%	0.84	81%	0.807	S	S	*	*			trans	-173.8	158.3	158.5	35	0	0	0	0	110
171	L	33.7	Very low	33.7	Very low	144 Å²	144	154.8 Å²	154.8	75%	0.754	81%	0.805	S	S	*	*			cis	-167.6	164.5	-32	-157	84.5	0	0	0	108.7
172	R	37.5	Very low	33.8	Very low	218 Å²	218	159 Å²	159	82%	0.823	81%	0.812	S	S	*	*			trans	76	123.8	175.8	-60	-173.1	170.4	176.9	-2.4	115.1
173	D	32.3	Very low	33.6	Very low	137 Å²	137	163.6 Å²	163.6	73%	0.733	81%	0.814	S	S	*	*			cis	76.1	106.2	31.7	-54.5	-59.8	0	0	0	116.2
174	R	35.1	Very low	33.6	Very low	249 Å²	249	157.6 Å²	157.6	94%	0.94	81%	0.807	S	S	*	*				-160.7	98.9	117.3	-112.8	176	178.7	169.9	-0.6	111.7
175	S	31	Very low	33.3	Very low	102 Å²	102	161.4 Å²	161.4	71%	0.713	82%	0.815	S	S	*	*			trans	-74.9	154.3	151.1	46.3	0	0	0	0	110
176	L	36.8	Very low	33.7	Very low	166 Å²	166	160.3 Å²	160.3	87%	0.869	82%	0.82	S	S	*	*			trans	-178.2	145.7	139.7	-103.5	167.9	0	0	0	111.1
177	D	31.8	Very low	33.6	Very low	136 Å²	136	160 Å²	160	73%	0.727	82%	0.816	S	S	*	*			trans	-76.9	155.6	-178.5	-47.4	-101	0	0	0	113.5
178	R	34	Very low	33.7	Very low	233 Å²	233	161.5 Å²	161.5	88%	0.879	81%	0.812	S	S	*	*				-175.5	121.3	123.5	-100	158.3	-169.5	-152.4	1.4	114.5
179	Y	32.8	Very low	33.5	Very low	217 Å²	217	160.3 Å²	160.3	85%	0.851	81%	0.808	S	S	*	*			trans	32.6	137.9	137.9	-78	-93.7	0	0	0	122.8
180	P	36.9	Very low	33.2	Very low	122 Å²	122	163.8 Å²	163.8	79%	0.792	82%	0.82	S	S	*	*			trans	-88.5	152.2	171	36.8	-34.3	0	0	0	113.3
181	S	32.5	Very low	32.9	Very low	115 Å²	115	166.5 Å²	166.5	80%	0.804	82%	0.822	S	S	*	*			trans	-158.3	161.3	148.1	-156.8	0	0	0	0	114.3
182	Q	31.4	Very low	33	Very low	164 Å²	164	164.6 Å²	164.6	77%	0.766	82%	0.819	S	S	*	*			trans	-50.1	176.1	-173.8	-56	170.7	-4.2	0	0	119.2
183	R	28.6	Very low	33.1	Very low	230 Å²	230	160.3 Å²	160.3	87%	0.868	82%	0.819	S	S	*	*			trans	83.7	145.7	162.5	-66.5	-174.4	175.6	-174	-3.3	117.1
184	S	30.6	Very low	33	Very low	103 Å²	103	161 Å²	161	72%	0.72	82%	0.823	S	S	*	*			cis	-160	169.7	-14.1	44.5	0	0	0	0	112.5
185	E	30.5	Very low	33	Very low	198 Å²	198	159.1 Å²	159.1	93%	0.925	82%	0.817	S	S	*	*			trans	-35.4	145.6	176	-58.9	161.2	134.7	0	0	117.4
186	G	35.6	Very low	33.1	Very low	83 Å²	83	159.7 Å²	159.7	86%	0.856	81%	0.809	S	S	*	*			trans	-175.3	90.7	175	0	0	0	0	0	114.8
187	M	31.1	Very low	33.1	Very low	171 Å²	171	159.9 Å²	159.9	84%	0.842	81%	0.807	S	S	*	*			trans	-88.1	171.7	165.5	-87.8	-93.7	-78.1	0	0	110.2
188	P	35	Very low	33.2	Very low	108 Å²	108	163.6 Å²	163.6	70%	0.701	81%	0.811	S	S	*	*			cis	-138.4	-175.4	12.8	42.9	-24.4	0	0	0	117.1
189	R	27	Very low	33.2	Very low	223 Å²	223	157.2 Å²	157.2	84%	0.842	80%	0.802	S	S	*	*			trans	-8.6	135.4	156.5	-60.6	170	171.6	165.6	-4.9	119.5
190	L	34.7	Very low	33.3	Very low	184 Å²	184	156.3 Å²	156.3	96%	0.963	80%	0.803	S	S	*	*			trans	-145.6	167	137	-82.9	-171.5	0	0	0	111.1
191	Q	31.4	Very low	33.1	Very low	193 Å²	193	157.4 Å²	157.4	90%	0.902	80%	0.799	S	S	*	*			trans	-110.8	171.6	-165.5	-105.4	-173.1	-8.1	0	0	114.5
192	P	35.9	Very low	33.3	Very low	105 Å²	105	157.4 Å²	157.4	68%	0.682	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-89.8	168.1	-165.2	37.1	-38.4	0	0	0	115.5
193	P	39.6	Very low	33.2	Very low	127 Å²	127	156.1 Å²	156.1	83%	0.825	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-83	141.5	175.1	33.2	-34.6	0	0	0	114
194	N	31.2	Very low	33.6	Very low	151 Å²	151	156.2 Å²	156.2	81%	0.807	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-82.1	165.6	165.4	-74.8	-60.6	0	0	0	111.6
195	Y	34.3	Very low	33.7	Very low	211 Å²	211	162.5 Å²	162.5	83%	0.827	80%	0.8	S	S	*	*				-163.3	159.7	115.2	-120.3	-84.3	0	0	0	114.1
196	E	34.3	Very low	33.9	Very low	114 Å²	114	156.8 Å²	156.8	53%	0.533	80%	0.795	S	S	.	*			trans	-62.6	168.9	-173.5	-67.5	-174.9	95.3	0	0	115.2	R198	E196-R198 IonicContact OE1-NE 3.53Å; E196-R198 IonicContact OE1-NH2 3.92Å
197	M	35.7	Very low	33.7	Very low	170 Å²	170	161.5 Å²	161.5	84%	0.837	79%	0.794	S	S	*	*			cis	-152.7	141.8	45	-67	-176.5	173.1	0	0	117.7
198	R	33.6	Very low	34	Very low	214 Å²	214	159 Å²	159	81%	0.808	79%	0.791	S	S	*	*			trans	23.2	134.6	131.6	-54.5	176.5	-179.5	-138.9	-3.5	117.7	E196	E196-R198 IonicContact OE1-NE 3.53Å; E196-R198 IonicContact OE1-NH2 3.92Å
199	S	35.4	Very low	33.9	Very low	99 Å²	99	159.5 Å²	159.5	69%	0.692	79%	0.792	S	S	*	*			cis	-156.3	-175.4	29.6	64.6	0	0	0	0	110.6
200	F	33.1	Very low	34.4	Very low	197 Å²	197	152 Å²	152	86%	0.864	78%	0.784	S	S	*	*			cis	-149.4	-151	10.1	-135.4	-43.4	0	0	0	110.8
201	M	32.7	Very low	34.3	Very low	146 Å²	146	149.9 Å²	149.9	72%	0.719	77%	0.774	S	S	*	*			trans	-156.5	179.1	-175.8	-122	-155.2	-174.2	0	0	110.4	M203	M201-M203 HydrophobicContact CE-CG 4.26Å; M201-M203 HydrophobicContact SD-CG 3.8Å
202	P	38.4	Very low	34.6	Very low	115 Å²	115	148.2 Å²	148.2	75%	0.747	77%	0.771	S	S	*	*			cis	-145.6	154.5	37.2	40.7	-19.3	0	0	0	121.2
203	M	29.4	Very low	34.7	Very low	136 Å²	136	148.4 Å²	148.4	67%	0.67	77%	0.77	S	S	*	*			trans	7.9	142.8	145.6	-58.1	-169.5	-72.4	0	0	123.5	M201	M201-M203 HydrophobicContact CE-CG 4.26Å; M201-M203 HydrophobicContact SD-CG 3.8Å
204	R	36.7	Very low	34.6	Very low	233 Å²	233	150.6 Å²	150.6	88%	0.879	77%	0.769	S	S	*	*				-157.7	121.8	103.1	-96.7	172.1	-167.1	-147.9	3.1	109.6
205	R	32.3	Very low	34.5	Very low	234 Å²	234	151.1 Å²	151.1	88%	0.883	77%	0.769	S	S	*	*				57.3	123.8	104.4	-63.9	-170.6	-177.7	-157.3	0.9	115
206	G	33.7	Very low	34.4	Very low	79 Å²	79	146.6 Å²	146.6	81%	0.814	76%	0.759	S	S	*	*			cis	-177.2	-178.4	-0.8	0	0	0	0	0	115.4
207	E	31.1	Very low	34.3	Very low	181 Å²	181	147.3 Å²	147.3	85%	0.846	77%	0.766	S	S	*	*			trans	-67.6	-177.7	172.9	-82.6	175.4	168.9	0	0	113.8
208	P	39.4	Very low	34.3	Very low	119 Å²	119	145.5 Å²	145.5	77%	0.773	76%	0.76	S	S	*	*			cis	-121.4	171.6	16.6	9.1	19.6	0	0	0	116.1
209	V	31.5	Very low	34.3	Very low	118 Å²	118	145.8 Å²	145.8	72%	0.715	76%	0.761	S	S	*	*				77.6	142.1	58.1	-170.5	0	0	0	0	114.2	D211	V209-D211 VanDerWaalsContact CG1-OD2 3.31Å; V209-D211 WeakPolarHBondContact CG1-OD2 3.4Å
210	G	38.1	Very low	34.3	Very low	66 Å²	66	146.4 Å²	146.4	68%	0.68	76%	0.762	S	S	*	*			trans	124.3	80.2	-162.5	0	0	0	0	0	109.2
211	D	31.6	Very low	34.5	Very low	139 Å²	139	149 Å²	149	74%	0.743	77%	0.766	S	S	*	*				64.1	142.9	55.4	-64.3	-39.2	0	0	0	113.9	V209	V209-D211 VanDerWaalsContact CG1-OD2 3.31Å; V209-D211 WeakPolarHBondContact CG1-OD2 3.4Å
212	D	38.3	Very low	34.7	Very low	158 Å²	158	146.7 Å²	146.7	85%	0.845	77%	0.77	S	S	*	*			trans	95.3	137.8	-172.4	-64.7	-18.5	0	0	0	117.3
213	V	38.3	Very low	34.4	Very low	110 Å²	110	152.6 Å²	152.6	67%	0.667	78%	0.778	S	S	*	*			cis	-169.7	158.2	-34.6	117.2	0	0	0	0	106.6
214	E	37.3	Very low	34.6	Very low	172 Å²	172	157.2 Å²	157.2	80%	0.804	79%	0.788	S	S	*	*			trans	41.5	110.5	167.3	-70.6	164.1	168.3	0	0	119
215	M	28.6	Very low	34.3	Very low	163 Å²	163	150.9 Å²	150.9	80%	0.803	78%	0.779	S	S	*	*				58	147.4	70.1	-75.6	-70.4	-72	0	0	117.2
216	D	32.1	Very low	34.3	Very low	115 Å²	115	145 Å²	145	62%	0.615	77%	0.774	S	S	*	*			trans	81.3	127.5	151	-105.6	34	0	0	0	121.6
217	N	31.9	Very low	34.2	Very low	129 Å²	129	148 Å²	148	69%	0.69	77%	0.771	S	S	*	*			trans	69.8	133.2	150.2	-59.2	-42.7	0	0	0	117.5
218	L	37.2	Very low	34.1	Very low	133 Å²	133	145.5 Å²	145.5	70%	0.696	76%	0.759	S	S	*	*			cis	-141.7	171.5	17.3	-64.9	166.8	0	0	0	109.3
219	R	33.3	Very low	33.7	Very low	220 Å²	220	149.5 Å²	149.5	83%	0.83	76%	0.759	S	S	*	*			cis	-156.9	147.9	13.8	-146.6	159.6	-172.5	152.6	1.6	111.4
220	P	35.8	Very low	33.6	Very low	111 Å²	111	149.3 Å²	149.3	72%	0.721	76%	0.763	S	S	*	*			trans	-109.2	159.9	-174.8	39.7	-35	0	0	0	115.7
221	R	36.2	Very low	33.2	Very low	253 Å²	253	155.6 Å²	155.6	96%	0.955	77%	0.771	S	S	*	*			trans	-179.2	143.8	154.3	-102.9	155.2	173.3	178.5	-1.8	110.1
222	A	37.1	Very low	33.5	Very low	97 Å²	97	154.2 Å²	154.2	80%	0.802	77%	0.77	S	S	*	*			cis	-155.5	158.5	-17.5	0	0	0	0	0	112
223	R	32.4	Very low	33.2	Very low	239 Å²	239	157.5 Å²	157.5	90%	0.902	77%	0.77	S	S	*	*			trans	-63.5	145.2	-178.4	-58.2	162.6	171.5	164.7	-6.2	114.3
224	R	33.1	Very low	32.8	Very low	232 Å²	232	155.3 Å²	155.3	88%	0.875	77%	0.77	S	S	*	*				-173.1	123.8	115.7	-99	167.3	179.5	-172.8	-0.9	109.3
225	S	32.1	Very low	32.6	Very low	101 Å²	101	155 Å²	155	71%	0.706	77%	0.769	S	S	*	*				71.4	117.6	107	-56.3	0	0	0	0	113
226	S	32	Very low	32.8	Very low	110 Å²	110	155 Å²	155	77%	0.769	77%	0.772	S	S	*	*				61.6	126.6	64.9	-53.7	0	0	0	0	111.9
227	L	30.7	Very low	32.9	Very low	143 Å²	143	154.8 Å²	154.8	75%	0.749	78%	0.779	S	S	*	*			cis	-162.2	164.6	0.3	-150.7	78.2	0	0	0	109.8
228	E	29.5	Very low	33.1	Very low	127 Å²	127	153.5 Å²	153.5	59%	0.593	78%	0.781	S	S	*	*			trans	58.8	135.6	147.5	-87.9	-169	143.7	0	0	124.4
229	R	30.6	Very low	32.9	Very low	204 Å²	204	153.8 Å²	153.8	77%	0.77	78%	0.783	S	S	*	*			trans	75.5	141.6	139.2	-66.8	172.1	-161.9	-123.4	-0.4	122.5
230	S	30.5	Very low	33	Very low	114 Å²	114	152.3 Å²	152.3	80%	0.797	79%	0.785	S	S	*	*			trans	87.8	109.6	149.6	-60.2	0	0	0	0	122.2
231	F	29.1	Very low	33	Very low	198 Å²	198	156.2 Å²	156.2	87%	0.868	79%	0.793	S	S	*	*			trans	-36.8	175.1	145.8	-62.3	-80.2	0	0	0	117.4
232	P	38.6	Very low	32.7	Very low	109 Å²	109	147.8 Å²	147.8	71%	0.708	79%	0.785	S	S	*	*			cis	-139.8	-177.4	-22.5	33	-11.7	0	0	0	115.8
233	R	30.5	Very low	32.5	Very low	228 Å²	228	151.4 Å²	151.4	86%	0.86	79%	0.79	S	S	*	*			trans	43.7	144.7	142.9	-83.3	-170.3	174.6	-137.4	3.8	123.5
234	G	29.9	Very low	32.8	Very low	64 Å²	64	145 Å²	145	66%	0.66	78%	0.779	S	S	*	*			trans	123.7	107.6	158.6	0	0	0	0	0	110.8
235	E	33.7	Very low	32.8	Very low	165 Å²	165	142.9 Å²	142.9	77%	0.771	78%	0.779	S	S	*	*				95.7	155.3	52.8	-74.6	175.9	164.9	0	0	112.5
236	D	32.1	Very low	32.7	Very low	164 Å²	164	142.8 Å²	142.8	88%	0.877	78%	0.778	S	S	*	*			trans	64.1	141.7	-173.2	-63.5	-23.7	0	0	0	116.5
237	S	35	Very low	32.7	Very low	110 Å²	110	142.8 Å²	142.8	77%	0.769	78%	0.778	S	S	*	*			cis	-162.3	177.4	-11.1	61	0	0	0	0	107.7
238	S	36	Very low	32.8	Very low	102 Å²	102	143.3 Å²	143.3	71%	0.713	78%	0.777	S	S	*	*			cis	-154.8	158.2	9.3	57.2	0	0	0	0	111.9
239	N	33.4	Very low	32.9	Very low	139 Å²	139	147.7 Å²	147.7	74%	0.743	79%	0.787	S	S	*	*			trans	-6.5	138.9	159.7	-51.7	-20.1	0	0	0	120
240	H	34.9	Very low	32.9	Very low	188 Å²	188	142.2 Å²	142.2	87%	0.87	79%	0.786	S	S	*	*				-161.3	143.4	101.6	-112	-80.7	0	0	0	112.8
241	H	35.1	Very low	32.9	Very low	194 Å²	194	141.9 Å²	141.9	90%	0.898	78%	0.784	S	S	*	*			trans	-86.2	147.1	173.2	-79.5	-92.3	0	0	0	111.7
242	G	31	Very low	33.2	Very low	75 Å²	75	143.4 Å²	143.4	77%	0.773	78%	0.784	S	S	*	*			trans	-157	122.2	165.1	0	0	0	0	0	110.1
243	L	32.9	Very low	33	Very low	173 Å²	173	147 Å²	147	91%	0.906	79%	0.791	S	S	*	*			trans	-95	168.8	178.5	-89.5	172.7	0	0	0	110.8
244	P	38.8	Very low	32.9	Very low	104 Å²	104	145.8 Å²	145.8	68%	0.675	79%	0.792	S	S	*	*			trans	-91.8	160.5	-142.9	36.3	-38.5	0	0	0	114
245	H	33.6	Very low	33.5	Very low	189 Å²	189	148.8 Å²	148.8	88%	0.875	80%	0.8	S	S	*	*			trans	-137.6	159.5	150.1	-99	-77.8	0	0	0	112.5
246	S	29	Very low	33.4	Very low	99 Å²	99	145.5 Å²	145.5	69%	0.692	80%	0.795	S	S	*	*			trans	-69.4	172.8	-177.7	45.7	0	0	0	0	115
247	S	32.5	Very low	33.4	Very low	109 Å²	109	148.6 Å²	148.6	76%	0.762	80%	0.796	S	S	*	*			trans	98.1	125.8	159.6	78.2	0	0	0	0	119.2
248	E	33.3	Very low	33.2	Very low	155 Å²	155	150.3 Å²	150.3	72%	0.724	80%	0.797	S	S	*	*			trans	58.4	113.7	136.2	-66.5	-152.9	-169.5	0	0	123.4
249	R	31.4	Very low	33	Very low	218 Å²	218	154.1 Å²	154.1	82%	0.823	81%	0.806	S	S	*	*				91.7	86.3	114.9	-160.1	177.9	-158.8	147.9	-3	120.9
250	A	29.1	Very low	33.1	Very low	90 Å²	90	155.8 Å²	155.8	74%	0.744	81%	0.806	S	S	*	*				88.4	149.3	122.3	0	0	0	0	0	123.3
251	S	31.5	Very low	33.1	Very low	106 Å²	106	152.8 Å²	152.8	74%	0.741	80%	0.804	S	S	*	*			trans	78.6	103.2	150.1	-61.8	0	0	0	0	122
252	R	34.8	Very low	33	Very low	231 Å²	231	151.9 Å²	151.9	87%	0.872	80%	0.797	S	S	*	*			trans	-178.4	93	135.2	-92.8	146.3	-160.7	-89	3.7	108.4
253	Q	34.6	Very low	33.4	Very low	184 Å²	184	152.8 Å²	152.8	86%	0.86	80%	0.797	S	S	*	*				77.6	119.7	91.5	-79.8	179.4	-37.5	0	0	114.9
254	F	29	Very low	33.6	Very low	203 Å²	203	150.7 Å²	150.7	89%	0.89	79%	0.792	S	S	*	*			trans	-106.4	158.8	179.8	-73.4	-99.9	0	0	0	111.8
255	P	42.5	Very low	33.5	Very low	127 Å²	127	148.9 Å²	148.9	83%	0.825	78%	0.78	S	S	*	*			trans	-67.1	144.4	153.5	-15.2	31.3	0	0	0	111.7
256	S	30.7	Very low	33.7	Very low	96 Å²	96	150.5 Å²	150.5	67%	0.671	78%	0.779	S	S	*	*			trans	-94.2	148.8	-172.2	-173	0	0	0	0	114.1
257	Y	33.4	Very low	34.1	Very low	228 Å²	228	154 Å²	154	89%	0.894	78%	0.777	S	S	*	*			trans	-141.1	144.2	147.4	-90.4	-74.9	0	0	0	109.4
258	D	30.6	Very low	34.9	Very low	146 Å²	146	153.9 Å²	153.9	78%	0.781	77%	0.771	S	S	*	*			trans	-64.2	131.8	-158.8	-70.1	-62.3	0	0	0	116.7
259	M	31.2	Very low	35.3	Very low	183 Å²	183	155 Å²	155	90%	0.901	78%	0.777	S	S	*	*			trans	-113.9	108.6	157.6	-87.5	-72.6	172.3	0	0	109.4
260	K	36.2	Very low	35.7	Very low	174 Å²	174	152.1 Å²	152.1	76%	0.757	77%	0.772	S	S	*	*			trans	-69.6	130.6	175.2	-71.1	-174.7	-178.1	-176.6	0	110.3	F262	K260-F262 PolarHBondContact O-N 2.79Å
261	P	34.5	Very low	36.2	Very low	125 Å²	125	156.1 Å²	156.1	81%	0.812	78%	0.775	S	S	*	*			trans	-71.2	131.4	179.7	29.3	-34.3	0	0	0	110.7
262	F	32.5	Very low	37	Very low	175 Å²	175	159.2 Å²	159.2	77%	0.768	78%	0.784	S	S	*	*			trans	-112.3	105.2	169.4	-85.1	-81.3	0	0	0	109.9	K260	K260-F262 PolarHBondContact O-N 2.79Å
263	A	39.1	Very low	37.4	Very low	93 Å²	93	151.3 Å²	151.3	77%	0.769	77%	0.774	S	S	*	*			trans	19.5	114.4	165.5	0	0	0	0	0	118.3
264	T	37.6	Very low	37.7	Very low	129 Å²	129	147.7 Å²	147.7	79%	0.791	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-56.7	142.4	154	45.9	0	0	0	0	110.4	R266	T264-R266 PolarHBondContact O-N 3.08Å
265	P	35.9	Very low	38.3	Very low	67 Å²	67	142 Å²	142	44%	0.435	74%	0.743	S	S	.	*	P	Polyproline II helix	trans	-57.3	139.4	169.8	-21.7	32.9	0	0	0	111	F277	P265-F277 HydrophobicContact CB-CD1 3.72Å; P265-F277 HydrophobicContact CB-CE1 4.28Å; P265-F277 HydrophobicContact CG-CD1 4.02Å
266	R	38.9	Very low	38.2	Very low	222 Å²	222	142.3 Å²	142.3	84%	0.838	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-83.1	134.6	164.1	-76.7	-177.2	170.8	176	-4	108.3	T264	T264-R266 PolarHBondContact O-N 3.08Å
267	R	37.6	Very low	38.6	Very low	173 Å²	173	143.8 Å²	143.8	65%	0.653	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-71.2	127.8	167.6	-157.4	-178.6	-150.7	177.3	8.2	107.9	D275	R267-D275 IonicContact CZ-OD1 3.19Å; R267-D275 IonicContact CZ-OD2 3.9Å; R267-D275 IonicContact NE-OD1 2.74Å; R267-D275 PolarHBondContact NE-OD1 2.83Å; R267-D275 IonicContact NH2-OD1 2.81Å; R267-D275 PolarHBondContact NH2-OD1 3.12Å; R267-D275 IonicContact NH2-OD2 2.88Å; R267-D275 PolarHBondContact NH2-OD2 2.97Å
268	V	48.3	Very low	39	Very low	106 Å²	106	141.3 Å²	141.3	64%	0.642	73%	0.728	S	S	*	*			trans	-126.9	98.1	179.2	-178.6	0	0	0	0	108
269	E	42.3	Very low	39.4	Very low	180 Å²	180	143.9 Å²	143.9	84%	0.841	73%	0.728	S	S	*	*			trans	59.8	168.6	172.5	-61.1	-177.2	144.6	0	0	116.3
270	Q	38.8	Very low	39.7	Very low	157 Å²	157	137.9 Å²	137.9	73%	0.734	71%	0.713	S	S	*	*			trans	-139.4	89.5	-168.2	-177.5	-176.8	-8.7	0	0	109.6
271	E	40.3	Very low	39.8	Very low	173 Å²	173	135.9 Å²	135.9	81%	0.808	72%	0.718	S	S	*	*	S	Bend	trans	-104.7	140.7	164.9	-65	-170.6	135.5	0	0	109.2	G273	E271-G273 PolarHBondContact O-N 2.74Å
272	D	47.7	Very low	39.8	Very low	172 Å²	172	140.4 Å²	140.4	92%	0.92	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	48.5	21.9	172.5	-61.6	-14.8	0	0	0	118.3	V274	D272-V274 PolarHBondContact O-N 3.06Å
273	G	43.8	Very low	40	Very low	65 Å²	65	139.1 Å²	139.1	67%	0.67	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.8	16	165.1	0	0	0	0	0	116.3	E271	E271-G273 PolarHBondContact O-N 2.74Å
274	V	40.1	Very low	39.7	Very low	108 Å²	108	141.1 Å²	141.1	66%	0.655	72%	0.717	S	S	*	*			trans	-114	119.6	177.6	-177.9	0	0	0	0	110.3	D272 I276	D272-V274 PolarHBondContact O-N 3.06Å; V274-I276 PolarHBondContact O-N 3.34Å
275	D	42.9	Very low	39.4	Very low	82 Å²	82	145 Å²	145	44%	0.439	72%	0.718	S	S	.	*			trans	-67.6	110.7	175.2	-86.4	-55.7	0	0	0	111.5	R267 F277	R267-D275 IonicContact CZ-OD1 3.19Å; R267-D275 IonicContact CZ-OD2 3.9Å; R267-D275 IonicContact NE-OD1 2.74Å; R267-D275 PolarHBondContact NE-OD1 2.83Å; R267-D275 IonicContact NH2-OD1 2.81Å; R267-D275 PolarHBondContact NH2-OD1 3.12Å; R267-D275 IonicContact NH2-OD2 2.88Å; R267-D275 PolarHBondContact NH2-OD2 2.97Å; D275-F277 HydrophobicContact CB-CE2 3.96Å; D275-F277 HydrophobicContact CB-CZ 4.25Å
276	I	40.2	Very low	39.3	Very low	135 Å²	135	151.7 Å²	151.7	69%	0.692	73%	0.734	S	S	*	*			trans	-92.2	125.4	176.6	-61.7	175.4	0	0	0	110	V274	V274-I276 PolarHBondContact O-N 3.34Å
277	F	39.7	Very low	39.1	Very low	127 Å²	127	147.2 Å²	147.2	56%	0.557	74%	0.737	S	S	*	*			trans	-110	102.9	177.7	-65.5	-79.4	0	0	0	111.4	P265 D275	P265-F277 HydrophobicContact CB-CD1 3.72Å; P265-F277 HydrophobicContact CB-CE1 4.28Å; P265-F277 HydrophobicContact CG-CD1 4.02Å; D275-F277 HydrophobicContact CB-CE2 3.96Å; D275-F277 HydrophobicContact CB-CZ 4.25Å
278	E	41.3	Very low	38.9	Very low	176 Å²	176	147 Å²	147	82%	0.822	74%	0.741	S	S	*	*			trans	-80.6	120.8	175.3	-169.4	175	-154.4	0	0	111.9
279	Y	38.1	Very low	38.2	Very low	199 Å²	199	149.7 Å²	149.7	78%	0.78	75%	0.752	S	S	*	*			trans	-98.4	103	172.5	-84.9	-90.6	0	0	0	110.7
280	G	37.6	Very low	37.7	Very low	58 Å²	58	152 Å²	152	60%	0.598	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-60.3	151.4	177.2	0	0	0	0	0	114	R282	G280-R282 PolarHBondContact O-N 3.2Å
281	P	39.2	Very low	37.7	Very low	131 Å²	131	149.5 Å²	149.5	85%	0.851	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-69.4	128.2	-173.7	27.8	-34.8	0	0	0	112.5	E283	P281-E283 PolarHBondContact O-N 2.88Å
282	R	34.9	Very low	37.7	Very low	221 Å²	221	147 Å²	147	83%	0.834	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-71.8	119.9	173.7	-88.2	-173.9	168.2	-174.1	-3.6	111.7	G280	G280-R282 PolarHBondContact O-N 3.2Å
283	E	34.9	Very low	37.1	Very low	148 Å²	148	144.5 Å²	144.5	69%	0.692	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-60.5	136.9	172.8	-58.9	-179.2	144.5	0	0	112.7	P281 R285	P281-E283 PolarHBondContact O-N 2.88Å; E283-R285 PolarHBondContact O-N 2.81Å; E283-R285 IonicContact OE2-CZ 3.66Å; E283-R285 IonicContact OE2-NH1 2.75Å; E283-R285 PolarHBondContact OE2-NH1 2.74Å
284	V	33.7	Very low	36.5	Very low	134 Å²	134	152 Å²	152	81%	0.812	75%	0.748	S	S	*	*			trans	-87.4	83.5	169.8	-176.6	0	0	0	0	109.3	R286	V284-R286 PolarHBondContact O-N 3.17Å
285	R	32.1	Very low	36.3	Very low	211 Å²	211	153.2 Å²	153.2	80%	0.796	75%	0.749	S	S	*	*			trans	-68.2	93.1	171.4	-95.2	178.8	151.9	92.3	-6.2	111	E283	E283-R285 PolarHBondContact O-N 2.81Å; E283-R285 IonicContact OE2-CZ 3.66Å; E283-R285 IonicContact OE2-NH1 2.75Å; E283-R285 PolarHBondContact OE2-NH1 2.74Å
286	R	33.8	Very low	35.9	Very low	208 Å²	208	155.4 Å²	155.4	79%	0.785	76%	0.761	S	S	*	*			trans	-77.3	120.1	154.2	-76.2	-177.9	172.4	174.9	-2.1	108.3	V284	V284-R286 PolarHBondContact O-N 3.17Å
287	S	34.3	Very low	35.9	Very low	127 Å²	127	156.7 Å²	156.7	89%	0.888	77%	0.769	S	S	*	*			trans	-69.5	129.6	164.3	34	0	0	0	0	109.6
288	F	31.9	Very low	35.4	Very low	170 Å²	170	155.8 Å²	155.8	75%	0.746	78%	0.779	S	S	*	*			trans	-110.7	130.5	177.2	-105.3	-88.5	0	0	0	109.9
289	D	35.4	Very low	35.3	Very low	162 Å²	162	152.9 Å²	152.9	87%	0.866	78%	0.775	S	S	*	*			trans	-139.8	132.5	146.3	-85.7	-57.3	0	0	0	104.2
290	R	31.1	Very low	35.2	Very low	228 Å²	228	152.2 Å²	152.2	86%	0.86	78%	0.782	S	S	*	*			cis	-161	124.7	15	174.5	-177.1	-173.9	168.8	3.6	110.3
291	P	38.4	Very low	34.9	Very low	105 Å²	105	154.4 Å²	154.4	68%	0.682	79%	0.787	S	S	*	*			trans	-92.2	-169.8	167.7	39.2	-34.8	0	0	0	110.6
292	P	39.8	Very low	34.3	Very low	119 Å²	119	158 Å²	158	77%	0.773	79%	0.785	S	S	*	*			cis	-117	-168.7	-4.8	42.2	-24.6	0	0	0	111.3
293	T	35.6	Very low	34.1	Very low	120 Å²	120	153.3 Å²	153.3	74%	0.736	79%	0.787	S	S	*	*				-146.9	139.4	52.4	44.9	0	0	0	0	111.8
294	R	31.6	Very low	33.7	Very low	223 Å²	223	151.9 Å²	151.9	84%	0.842	79%	0.788	S	S	*	*				60.7	123.5	94.5	-129.5	-166.6	-174.5	174	2.3	111.6
295	I	36.2	Very low	33.6	Very low	133 Å²	133	154 Å²	154	68%	0.682	79%	0.789	S	S	*	*			cis	-149.4	143	43.9	-85	169.6	0	0	0	110.5
296	D	34.9	Very low	33.4	Very low	128 Å²	128	154 Å²	154	68%	0.684	79%	0.788	S	S	*	*			trans	26.3	143.1	138.3	-37.9	-32.7	0	0	0	119.6
297	D	38.9	Very low	33.4	Very low	162 Å²	162	151.4 Å²	151.4	87%	0.866	79%	0.785	S	S	*	*			cis	-146.8	173.2	41.6	-128.2	-44	0	0	0	117.3
298	S	30.2	Very low	33.1	Very low	109 Å²	109	149.4 Å²	149.4	76%	0.762	77%	0.771	S	S	*	*			trans	-92.4	174.5	-160.4	-91.4	0	0	0	0	118.1
299	P	39.2	Very low	32.9	Very low	114 Å²	114	150.3 Å²	150.3	74%	0.74	78%	0.777	S	S	*	*			trans	-110.4	170.3	-171.7	42	-34.7	0	0	0	115.1
300	M	34.5	Very low	32.6	Very low	186 Å²	186	149.5 Å²	149.5	92%	0.916	77%	0.768	S	S	*	*			trans	-168.3	160.8	160.5	-100.2	158.6	90.8	0	0	108.8
301	S	33	Very low	32.5	Very low	103 Å²	103	146.1 Å²	146.1	72%	0.72	76%	0.76	S	S	*	*			cis	-158.9	171.4	-9.3	47	0	0	0	0	111
302	Y	25.8	Very low	32.1	Very low	206 Å²	206	148.3 Å²	148.3	81%	0.808	76%	0.761	S	S	*	*			trans	-53.4	153.4	172.6	-90.6	-127.1	0	0	0	114.8
303	S	31.2	Very low	31.4	Very low	123 Å²	123	152.9 Å²	152.9	86%	0.86	76%	0.763	S	S	*	*				-155.7	125.8	129.9	-83.3	0	0	0	0	111.2
304	V	26.3	Very low	31.3	Very low	118 Å²	118	156.3 Å²	156.3	72%	0.715	77%	0.768	S	S	*	*			trans	-129	109.6	172	174.9	0	0	0	0	108.4
305	H	32.2	Very low	31.3	Very low	180 Å²	180	154.7 Å²	154.7	83%	0.833	77%	0.77	S	S	*	*			trans	-134.4	125.7	163	-81.6	29.1	0	0	0	104.2
306	R	27.6	Very low	31.5	Very low	209 Å²	209	152.6 Å²	152.6	79%	0.789	77%	0.765	S	S	*	*			cis	69.5	137.7	28.4	-146.9	-176.7	-162.1	-163.6	3.6	112.6
307	H	33.1	Very low	31.6	Very low	155 Å²	155	152 Å²	152	72%	0.718	77%	0.768	S	S	*	*			trans	74.6	148.4	-171.7	-58.4	-83.9	0	0	0	115
308	S	28.4	Very low	31.3	Very low	84 Å²	84	150.5 Å²	150.5	59%	0.587	76%	0.76	S	S	*	*			cis	-170	138.6	-46.6	35.8	0	0	0	0	109.8
309	E	26.9	Very low	31.5	Very low	189 Å²	189	155.1 Å²	155.1	88%	0.883	76%	0.762	S	S	*	*			trans	64.3	175.6	157.8	-62.8	178.2	137.7	0	0	119
310	E	29.6	Very low	31.4	Very low	145 Å²	145	154.7 Å²	154.7	68%	0.678	75%	0.754	S	S	*	*			trans	73.3	100.7	150.8	-157.9	126.8	-113.4	0	0	122.1
311	K	29.6	Very low	31.3	Very low	157 Å²	157	154.3 Å²	154.3	68%	0.683	74%	0.742	S	S	*	*			trans	56.1	129.9	134.8	-66.7	171.8	-168.2	152.8	0	122.8
312	Q	29.6	Very low	31.3	Very low	152 Å²	152	158.5 Å²	158.5	71%	0.71	74%	0.742	S	S	*	*			trans	77.2	115.9	133.3	-69.3	178.6	30.7	0	0	123.3
313	R	25.9	Very low	31.4	Very low	215 Å²	215	153.8 Å²	153.8	81%	0.811	74%	0.739	S	S	*	*				76.7	167.6	128.9	-70	-176.1	169	-160.1	-1.5	120.9
314	F	31.8	Very low	31.4	Very low	192 Å²	192	156.4 Å²	156.4	84%	0.842	74%	0.735	S	S	*	*			trans	75.4	88.9	-178.7	-55	-72.1	0	0	0	115.1
315	Q	31.5	Very low	31.7	Very low	188 Å²	188	156.6 Å²	156.6	88%	0.879	74%	0.737	S	S	*	*			cis	87.2	146.7	49.9	-80.5	-152.2	-22.1	0	0	116.8
316	P	40.9	Very low	31.6	Very low	89 Å²	89	154.3 Å²	154.3	58%	0.578	74%	0.736	S	S	*	*			trans	-116.7	-172.2	-171.1	45.4	-33.7	0	0	0	113.4
317	P	36.4	Very low	31.9	Very low	115 Å²	115	149.3 Å²	149.3	75%	0.747	73%	0.731	S	S	*	*			trans	-80.1	127.9	147.4	32.7	-31.1	0	0	0	109.8
318	N	34.5	Very low	31.7	Very low	132 Å²	132	150.4 Å²	150.4	71%	0.706	73%	0.734	S	S	*	*				57.1	125.6	64.5	-66.3	-31.7	0	0	0	111.9
319	Y	34.2	Very low	31.7	Very low	206 Å²	206	155.2 Å²	155.2	81%	0.808	75%	0.747	S	S	*	*			cis	-144.5	163.8	39.9	-95.5	-106.6	0	0	0	110.9
320	D	35.8	Very low	31.7	Very low	105 Å²	105	149.3 Å²	149.3	56%	0.561	74%	0.736	S	S	*	*			cis	-154.7	167.8	-5.9	-152.8	-0.2	0	0	0	112.1
321	R	32.7	Very low	31.7	Very low	178 Å²	178	151.6 Å²	151.6	67%	0.672	75%	0.747	S	S	*	*			trans	21.8	145.8	149.8	-77.1	162.8	-160.5	-156.1	-3.5	122.2
322	R	32.9	Very low	31.7	Very low	191 Å²	191	151 Å²	151	72%	0.721	75%	0.75	S	S	*	*			cis	-160.4	162.2	3.9	-133.6	158.9	-162	-157.7	2.4	111.4
323	S	27.6	Very low	32	Very low	107 Å²	107	155.4 Å²	155.4	75%	0.748	76%	0.76	S	S	*	*			trans	-133.5	146.4	179.9	-42.1	0	0	0	0	111.9
324	F	32.3	Very low	32.2	Very low	177 Å²	177	153.6 Å²	153.6	78%	0.776	76%	0.761	S	S	*	*			trans	-154.4	105.1	160.8	-89.7	-72.5	0	0	0	108.1
325	T	32.4	Very low	32.3	Very low	122 Å²	122	149.5 Å²	149.5	75%	0.748	75%	0.754	S	S	*	*				79.9	119.7	98	55.6	0	0	0	0	116.7
326	T	30.9	Very low	32.4	Very low	132 Å²	132	149 Å²	149	81%	0.81	75%	0.754	S	S	*	*			trans	-60	169	156.3	47.4	0	0	0	0	111.4
327	P	33.5	Very low	31.9	Very low	105 Å²	105	152.2 Å²	152.2	68%	0.682	77%	0.766	S	S	*	*			cis	-151.8	-164	30.8	46.1	-24.7	0	0	0	117.8
328	K	28.6	Very low	31.6	Very low	178 Å²	178	155.5 Å²	155.5	77%	0.774	77%	0.774	S	S	*	*			trans	68.6	111.3	152.2	-78	-176.6	177.3	-174	0	120.8
329	Q	27.2	Very low	31.8	Very low	185 Å²	185	156.4 Å²	156.4	86%	0.864	78%	0.778	S	S	*	*				55.3	115.6	108.7	-167.4	178.9	15	0	0	119.5
330	G	28.3	Very low	31.8	Very low	64 Å²	64	151.5 Å²	151.5	66%	0.66	77%	0.772	S	S	*	*			trans	125.3	117.5	154.8	0	0	0	0	0	115
331	E	29.8	Very low	31.3	Very low	193 Å²	193	157.2 Å²	157.2	90%	0.902	79%	0.787	S	S	*	*			trans	60.4	152.7	145.4	-67.9	167.8	-156.2	0	0	119.9
332	L	28.8	Very low	31.1	Very low	144 Å²	144	152.6 Å²	152.6	75%	0.754	80%	0.795	S	S	*	*			cis	-166.4	115.4	-23.9	174	103.7	0	0	0	107.1
333	R	35.6	Very low	30.9	Very low	245 Å²	245	148.8 Å²	148.8	93%	0.925	79%	0.793	S	S	*	*			trans	-176	104.8	150	-105.7	159.2	-168.9	-147.7	-0.8	113.2
334	E	30.8	Very low	31.2	Very low	177 Å²	177	151.6 Å²	151.6	83%	0.827	80%	0.799	S	S	*	*			trans	-65.8	-174.2	155.6	-54.6	173.2	142.4	0	0	111.3
335	P	34.6	Very low	31.1	Very low	107 Å²	107	150.3 Å²	150.3	70%	0.695	80%	0.796	S	S	*	*			cis	-126.5	177	-18	16.6	7.5	0	0	0	112.7
336	M	32.4	Very low	31	Very low	178 Å²	178	150.5 Å²	150.5	88%	0.877	80%	0.799	S	S	*	*				169.4	106.3	114	-86.4	-156.2	-167	0	0	110.8
337	D	30.4	Very low	30.9	Very low	155 Å²	155	155.3 Å²	155.3	83%	0.829	80%	0.802	S	S	*	*			trans	-69.5	145.7	146.8	-64.4	-76.2	0	0	0	109.2
338	M	31.3	Very low	30.7	Very low	185 Å²	185	155.2 Å²	155.2	91%	0.911	80%	0.804	S	S	*	*			trans	171.8	129.6	145.5	-92.9	-49.7	155.8	0	0	110.4
339	D	37.3	Very low	30.7	Very low	150 Å²	150	153.1 Å²	153.1	80%	0.802	80%	0.8	S	S	*	*			trans	-64.5	166.9	153.9	-69.1	-61.1	0	0	0	110
340	P	34.6	Very low	31	Very low	104 Å²	104	154 Å²	154	68%	0.675	80%	0.795	S	S	*	*			cis	-151.6	-161.4	26.2	45.3	-23.1	0	0	0	116.7
341	Y	24.8	Very low	31	Very low	225 Å²	225	157.8 Å²	157.8	88%	0.882	80%	0.8	S	S	*	*			trans	30.6	115.6	155.5	-68.5	-68.8	0	0	0	120.9
342	G	28	Very low	31.1	Very low	81 Å²	81	155 Å²	155	84%	0.835	80%	0.796	S	S	*	*			trans	-147.5	38.7	-176.9	0	0	0	0	0	118.5
343	V	29.4	Very low	31.5	Very low	111 Å²	111	153.3 Å²	153.3	67%	0.673	79%	0.794	S	S	*	*			trans	4.2	132.1	158.3	177.2	0	0	0	0	119.8
344	N	33.4	Very low	31.2	Very low	165 Å²	165	149.9 Å²	149.9	88%	0.882	79%	0.79	S	S	*	*			trans	-151.3	141.1	131.2	-104.8	-54.1	0	0	0	112.7
345	H	30.8	Very low	31.2	Very low	151 Å²	151	146.5 Å²	146.5	70%	0.699	78%	0.778	S	S	*	*			trans	-119.7	172	-170.4	-105.3	36.2	0	0	0	111
346	P	29.8	Very low	30.9	Very low	126 Å²	126	150.4 Å²	150.4	82%	0.818	78%	0.78	S	S	*	*				-112.3	152.1	112.9	31.6	-34.2	0	0	0	113.3
347	R	29.4	Very low	30.8	Very low	232 Å²	232	147.7 Å²	147.7	88%	0.875	77%	0.769	S	S	*	*			trans	-80.2	173.7	-174.6	-53.1	169.1	176.1	169.7	-3.5	109.9
348	S	30	Very low	30.8	Very low	103 Å²	103	146.3 Å²	146.3	72%	0.72	76%	0.762	S	S	*	*			cis	-171.1	175.4	27.7	73.4	0	0	0	0	109.4
349	I	28.7	Very low	30.8	Very low	134 Å²	134	148.6 Å²	148.6	69%	0.687	76%	0.76	S	S	*	*			cis	-162.1	161.4	4.3	-142.9	166.9	0	0	0	110.9
350	R	32.1	Very low	30.5	Very low	205 Å²	205	148.4 Å²	148.4	77%	0.774	76%	0.759	S	S	*	*			trans	57.4	105.8	160.7	-72.6	169.5	-179.1	165.1	0.2	120.5
351	D	29.5	Very low	30.4	Very low	143 Å²	143	152.5 Å²	152.5	77%	0.765	77%	0.769	S	S	*	*				28.8	142.6	99.1	-31.5	-51.7	0	0	0	117.8
352	V	30.5	Very low	30.6	Very low	133 Å²	133	152.4 Å²	152.4	81%	0.806	77%	0.767	S	S	*	*			cis	-150.1	144.3	37	174.2	0	0	0	0	111.5
353	P	39	Very low	30.6	Very low	110 Å²	110	154.5 Å²	154.5	71%	0.714	77%	0.766	S	S	*	*			trans	-100.5	166.6	171.6	39.1	-34.4	0	0	0	114.1
354	M	29.1	Very low	30.7	Very low	172 Å²	172	158.4 Å²	158.4	85%	0.847	77%	0.774	S	S	*	*			trans	151.8	146.8	160.1	-84.7	-75.5	-96.5	0	0	108.7
355	N	29.9	Very low	30.3	Very low	106 Å²	106	160.5 Å²	160.5	57%	0.567	78%	0.776	S	S	*	*			cis	-161.4	163.9	-23.4	-154.1	-2.7	0	0	0	111
356	Y	27.8	Very low	30.3	Very low	190 Å²	190	161.4 Å²	161.4	75%	0.745	78%	0.78	S	S	*	*			trans	48.4	131.6	159	-78.1	-56.8	0	0	0	124.4
357	D	31	Very low	30.3	Very low	120 Å²	120	165 Å²	165	64%	0.642	78%	0.783	S	S	*	*				104.3	120	126.4	-89.1	12	0	0	0	123.3
358	N	30.8	Very low	30.4	Very low	127 Å²	127	158.7 Å²	158.7	68%	0.679	77%	0.773	S	S	*	*				40.4	120	129.2	-55.6	-40.5	0	0	0	117.6
359	R	31.7	Very low	30.3	Very low	233 Å²	233	160.2 Å²	160.2	88%	0.879	78%	0.778	S	S	*	*				-164.5	173.7	62.1	-85.7	-169.6	173.3	141.9	4.3	113.9
360	D	30.3	Very low	30.1	Very low	145 Å²	145	162.5 Å²	162.5	78%	0.775	78%	0.779	S	S	*	*			trans	-52.8	144	169.9	-42.8	-102.6	0	0	0	113.9
361	E	33	Very low	30.3	Very low	190 Å²	190	158.9 Å²	158.9	89%	0.888	78%	0.775	S	S	*	*				-171.8	157.1	108.3	-104.5	-168.2	-170.1	0	0	114.7
362	R	29.4	Very low	30.3	Very low	224 Å²	224	156.9 Å²	156.9	85%	0.845	76%	0.764	S	S	*	*			trans	-30.5	153.3	-175.4	-79.7	171.9	153.3	-175.6	-7	121
363	P	27.9	Very low	30.4	Very low	124 Å²	124	158.3 Å²	158.3	81%	0.805	76%	0.759	S	S	*	*			trans	-73.8	147.3	173.7	33.4	-36.4	0	0	0	113.3
364	K	31.5	Very low	30	Very low	194 Å²	194	157 Å²	157	84%	0.843	76%	0.757	S	S	*	*			trans	-134	132.7	164.1	-73.1	-179.2	-175.5	171.6	0	110.5
365	F	25.1	Very low	29.9	Very low	208 Å²	208	156.3 Å²	156.3	91%	0.912	76%	0.756	S	S	*	*			trans	-74.5	121.9	168.4	-94.6	-98	0	0	0	109.9
366	Q	29.5	Very low	30	Very low	171 Å²	171	157.3 Å²	157.3	80%	0.799	77%	0.766	S	S	*	*			trans	-156	112.4	164.5	-122.5	170.1	-8.7	0	0	110.8
367	F	30.6	Very low	30.3	Very low	201 Å²	201	153.7 Å²	153.7	88%	0.882	77%	0.769	S	S	*	*			trans	-80.7	133.1	155.3	-74.5	-84.3	0	0	0	107.6
368	P	31.3	Very low	30.6	Very low	100 Å²	100	153.2 Å²	153.2	65%	0.649	77%	0.772	S	S	*	*				-148.5	145.5	126.3	36.7	-20.7	0	0	0	116.2
369	T	27.4	Very low	30.5	Very low	135 Å²	135	158.3 Å²	158.3	83%	0.828	78%	0.782	S	S	*	*			trans	53.5	130.4	142.2	57.6	0	0	0	0	122.8
370	Y	25.9	Very low	30.4	Very low	181 Å²	181	159 Å²	159	71%	0.71	78%	0.784	S	S	*	*			trans	-69.7	155.8	157.3	-69	-103.3	0	0	0	112.6
371	D	34.3	Very low	30.4	Very low	130 Å²	130	156.2 Å²	156.2	70%	0.695	79%	0.789	S	S	*	*			trans	-135.8	156.4	138.1	-164	-0.5	0	0	0	108.7	K373	D371-K373 IonicContact OD1-NZ 2.58Å; D371-K373 PolarHBondContact OD1-NZ 2.83Å; D371-K373 IonicContact OD2-NZ 3.59Å
372	L	29.9	Very low	30.3	Very low	100 Å²	100	150.4 Å²	150.4	52%	0.524	78%	0.781	S	S	.	*			trans	-147.6	108	-172.9	-157.1	170.9	0	0	0	111.1	Q144	Q144-L372 VanDerWaalsContact CD-CD1 3.41Å; Q144-L372 HydrophobicContact CG-CD1 3.94Å
373	K	32.4	Very low	30.5	Very low	164 Å²	164	148.2 Å²	148.2	71%	0.713	78%	0.78	S	S	*	*			trans	-160.4	154.8	167.1	-79.9	111.2	-164.4	166.8	0	105.8	D371	D371-K373 IonicContact OD1-NZ 2.58Å; D371-K373 PolarHBondContact OD1-NZ 2.83Å; D371-K373 IonicContact OD2-NZ 3.59Å
374	A	30.9	Very low	30.8	Very low	82 Å²	82	148 Å²	148	68%	0.678	77%	0.772	S	S	*	*			cis	-164.2	165	0.4	0	0	0	0	0	104.3
375	L	28.3	Very low	30.8	Very low	158 Å²	158	146.4 Å²	146.4	83%	0.827	77%	0.773	S	S	*	*			cis	174.6	170.2	8.7	-110.5	169.9	0	0	0	105.3
376	V	31.8	Very low	31	Very low	127 Å²	127	140 Å²	140	77%	0.77	77%	0.765	S	S	*	*			trans	67.3	113.6	155.3	175.3	0	0	0	0	119.7
377	S	34.5	Very low	31.1	Very low	114 Å²	114	143.6 Å²	143.6	80%	0.797	77%	0.772	S	S	*	*			trans	-99.2	162.5	147.7	-35.1	0	0	0	0	109.2
378	P	35.5	Very low	31.2	Very low	110 Å²	110	141.8 Å²	141.8	71%	0.714	77%	0.769	S	S	*	*				-160.5	156.6	94.3	40	-20.1	0	0	0	119.6
379	R	28.8	Very low	31.4	Very low	233 Å²	233	142.5 Å²	142.5	88%	0.879	77%	0.774	S	S	*	*			trans	33.1	124.1	140.8	-61.5	-179.9	173.6	-169.8	-1.6	122.6
380	R	30.2	Very low	32.1	Very low	249 Å²	249	141.3 Å²	141.3	94%	0.94	77%	0.769	S	S	*	*				162.1	131	121.9	-85.7	163.1	-163.7	-95.5	7.9	106
381	G	30	Very low	32.3	Very low	85 Å²	85	138.3 Å²	138.3	88%	0.876	77%	0.765	S	S	*	*				107.7	139.7	56.2	0	0	0	0	0	107.8
382	G	31.7	Very low	32.6	Very low	69 Å²	69	139.1 Å²	139.1	71%	0.711	77%	0.774	S	S	*	*			cis	177.8	-173.3	-3.3	0	0	0	0	0	110.3
383	Q	34.1	Very low	32.7	Very low	178 Å²	178	141.9 Å²	141.9	83%	0.832	78%	0.784	S	S	*	*			trans	69.4	148.3	167.6	-57.9	-174.9	-100.5	0	0	118
384	D	33.3	Very low	32.8	Very low	119 Å²	119	137.9 Å²	137.9	64%	0.636	79%	0.789	S	S	*	*			cis	-158.1	160.9	-17.9	-100.3	-17.8	0	0	0	111.8
385	D	31.3	Very low	32.9	Very low	160 Å²	160	138.4 Å²	138.4	86%	0.856	79%	0.788	S	S	*	*			trans	27	146.1	152.7	-68.6	-23.8	0	0	0	124.4
386	G	29.1	Very low	33	Very low	73 Å²	73	141.1 Å²	141.1	75%	0.753	79%	0.789	S	S	*	*			trans	-163.8	-22.1	175.2	0	0	0	0	0	123.7
387	R	32.5	Very low	33.1	Very low	247 Å²	247	146.5 Å²	146.5	93%	0.932	80%	0.795	S	S	*	*			trans	63.3	121.5	172	-55.3	-177.6	179.7	-161.2	-0.2	121.2
388	I	32.8	Very low	33.2	Very low	163 Å²	163	146.6 Å²	146.6	84%	0.836	79%	0.793	S	S	*	*			trans	-40.1	169.8	145.6	29	167.3	0	0	0	115.7
389	P	35.6	Very low	33.4	Very low	115 Å²	115	153.1 Å²	153.1	75%	0.747	80%	0.804	S	S	*	*			cis	-140	-142.5	21.5	32.3	-3.9	0	0	0	114.5
390	P	40.8	Very low	33.9	Very low	111 Å²	111	147.9 Å²	147.9	72%	0.721	80%	0.799	S	S	*	*				-133.6	-177.8	-82.7	44.4	-28	0	0	0	117
391	D	30.2	Very low	34.3	Very low	117 Å²	117	143.8 Å²	143.8	63%	0.626	80%	0.796	S	S	*	*			trans	49.4	121.4	146.1	-122.9	-45.2	0	0	0	123	H393	D391-H393 IonicContact OD1-CE1 3.74Å; D391-H393 PolarHBondContact OD1-CE1 3.35Å; D391-H393 IonicContact OD1-CG 2.71Å; D391-H393 IonicContact OD1-ND1 2.73Å; D391-H393 PolarHBondContact OD1-ND1 2.97Å; D391-H393 IonicContact OD2-CE1 3.83Å
392	V	40.3	Very low	35.6	Very low	148 Å²	148	145.2 Å²	145.2	90%	0.897	79%	0.789	S	S	*	*			trans	-140.4	118.8	146.8	-178.6	0	0	0	0	109.3
393	H	33.9	Very low	36.5	Very low	158 Å²	158	147.5 Å²	147.5	73%	0.731	79%	0.791	S	S	*	*			trans	-86.1	148.9	174.8	-87.1	48.2	0	0	0	112.8	D391	D391-H393 IonicContact OD1-CE1 3.74Å; D391-H393 PolarHBondContact OD1-CE1 3.35Å; D391-H393 IonicContact OD1-CG 2.71Å; D391-H393 IonicContact OD1-ND1 2.73Å; D391-H393 PolarHBondContact OD1-ND1 2.97Å; D391-H393 IonicContact OD2-CE1 3.83Å
394	G	33.1	Very low	37.3	Very low	79 Å²	79	144.4 Å²	144.4	81%	0.814	79%	0.787	S	S	*	*			trans	-170	127.1	169	0	0	0	0	0	112.1
395	S	33.3	Very low	38.5	Very low	93 Å²	93	144.8 Å²	144.8	65%	0.65	80%	0.796	S	S	*	*			trans	-133.8	159.1	-153	-58.5	0	0	0	0	116.9
396	Y	30.7	Very low	39	Very low	216 Å²	216	142.3 Å²	142.3	85%	0.847	79%	0.789	S	S	*	*			trans	76.4	121	162.5	-61.6	-77	0	0	0	120.4
397	R	34	Very low	39.2	Very low	239 Å²	239	144.5 Å²	144.5	90%	0.902	79%	0.792	S	S	*	*				179.3	122.7	93	-94.4	-174.3	-178.7	-154.9	0.8	114.1
398	P	36.2	Very low	39.5	Very low	116 Å²	116	140.4 Å²	140.4	75%	0.753	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-87.5	155.1	151.9	34.4	-30.8	0	0	0	111.2
399	R	38.8	Very low	39.4	Very low	248 Å²	248	143.7 Å²	143.7	94%	0.936	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-97.5	143.3	-179	-133.4	177.1	-158.9	-100.7	5.7	111.7
400	P	39.5	Very low	39.2	Very low	122 Å²	122	144.9 Å²	144.9	79%	0.792	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-97.8	168.1	-162	-2.8	24.8	0	0	0	115.8
401	L	39.1	Very low	38.7	Very low	164 Å²	164	143.2 Å²	143.2	86%	0.859	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-69.9	155.1	168.4	-75	149.7	0	0	0	112.7
402	P	57.3	Low	38.7	Very low	115 Å²	115	146 Å²	146	75%	0.747	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-74.3	148.7	172.3	31.4	-34.8	0	0	0	112.6
403	P	50.7	Low	38.2	Very low	116 Å²	116	144.5 Å²	144.5	75%	0.753	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-89.4	163.6	-176	36.2	-36.9	0	0	0	114.1
404	P	50.2	Low	38.2	Very low	114 Å²	114	140.4 Å²	140.4	74%	0.74	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-74.2	156.5	166.7	33	-35.4	0	0	0	112.2
405	P	60.1	Low	38.1	Very low	126 Å²	126	146.6 Å²	146.6	82%	0.818	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-70.2	149	179.2	28.9	-34.9	0	0	0	112.9
406	P	41.8	Very low	38	Very low	109 Å²	109	152 Å²	152	71%	0.708	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-86	153.2	-169.3	34.1	-36.7	0	0	0	114.4
407	S	32.5	Very low	38.2	Very low	118 Å²	118	146.6 Å²	146.6	83%	0.825	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-85.8	128.9	165.1	-176.9	0	0	0	0	110.4
408	M	39.2	Very low	38.4	Very low	162 Å²	162	143.3 Å²	143.3	80%	0.798	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-93.8	120.6	179.1	-79.6	-74.9	103.4	0	0	111.8
409	R	29.7	Very low	38.6	Very low	232 Å²	232	142 Å²	142	88%	0.875	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-90.6	132.8	165.4	-82.3	174	142.4	-154	-0.9	110
410	T	31.3	Very low	38.3	Very low	139 Å²	139	135.8 Å²	135.8	85%	0.853	77%	0.766	S	S	*	*			trans	173.5	155	141.9	31	0	0	0	0	108.5
411	S	30.4	Very low	38	Very low	77 Å²	77	136.9 Å²	136.9	54%	0.538	76%	0.761	S	S	.	*			cis	-167.7	169.6	-19.2	45.4	0	0	0	0	109.5
412	H	31.4	Very low	37.7	Very low	176 Å²	176	134 Å²	134	82%	0.815	75%	0.747	S	S	*	*			trans	69.7	155	166.8	-51	-54.1	0	0	0	116.5
413	S	30.1	Very low	36.6	Very low	115 Å²	115	137.7 Å²	137.7	80%	0.804	75%	0.746	S	S	*	*			cis	-157.8	165.2	-12.2	43.9	0	0	0	0	111.3
414	G	32.4	Very low	35.7	Very low	73 Å²	73	140 Å²	140	75%	0.753	75%	0.747	S	S	*	*			trans	79.9	150.5	161.4	0	0	0	0	0	117
415	R	31.2	Very low	34.8	Very low	209 Å²	209	140.1 Å²	140.1	79%	0.789	75%	0.75	S	S	*	*			cis	170.1	131.5	-29.5	-114.6	-177.6	174.4	-161.9	0	105.1
416	R	30.6	Very low	33.8	Very low	205 Å²	205	139.5 Å²	139.5	77%	0.774	75%	0.746	S	S	*	*			trans	71.7	144.8	156.7	-60	169.1	-178	-140.1	-2.9	117.1
417	S	36.7	Very low	34	Very low	104 Å²	104	140.3 Å²	140.3	73%	0.727	75%	0.751	S	S	*	*			cis	-157.8	137.7	-13.5	-91.5	0	0	0	0	112.3
418	M	36.5	Very low	34.7	Very low	169 Å²	169	140.4 Å²	140.4	83%	0.833	75%	0.749	S	S	*	*				4.4	160.1	127.7	-68.2	-61.9	-93	0	0	120.3
419	P	41.6	Very low	34.7	Very low	88 Å²	88	138.8 Å²	138.8	57%	0.571	75%	0.75	S	S	*	*			cis	-147	-159.2	-16.9	36	-12.3	0	0	0	115.3
420	T	31.9	Very low	35.5	Very low	118 Å²	118	133 Å²	133	72%	0.724	74%	0.743	S	S	*	*			trans	72.8	152.7	149.2	41.4	0	0	0	0	118.9
421	E	34	Very low	35.6	Very low	145 Å²	145	132 Å²	132	68%	0.678	74%	0.741	S	S	*	*			cis	-155.6	158.7	7	-135.9	-173.3	143.6	0	0	112.7
422	N	32.4	Very low	35.9	Very low	104 Å²	104	133.2 Å²	133.2	56%	0.556	76%	0.756	S	S	*	*			trans	55.7	155.3	149.8	-66.3	-27.9	0	0	0	121.5
423	R	34.5	Very low	36.3	Very low	192 Å²	192	132.6 Å²	132.6	73%	0.725	76%	0.757	S	S	*	*			cis	-158.3	135.8	-14.9	-111.7	167.9	-156.9	-161.3	5.9	111.5
424	Q	30.8	Very low	36.7	Very low	166 Å²	166	132.6 Å²	132.6	78%	0.776	76%	0.755	S	S	*	*			trans	23	126.5	142.1	-66.8	156.4	-24.8	0	0	123.2
425	S	31.2	Very low	37.2	Very low	115 Å²	115	134.2 Å²	134.2	80%	0.804	75%	0.752	S	S	*	*			trans	71.9	165.2	139.6	-57.5	0	0	0	0	120.4
426	P	39.3	Very low	37.4	Very low	114 Å²	114	131 Å²	131	74%	0.74	76%	0.755	S	S	*	*			cis	-127.4	177.6	-34.9	36.7	-20.2	0	0	0	113.2
427	P	45.5	Very low	37.8	Very low	125 Å²	125	131.2 Å²	131.2	81%	0.812	76%	0.756	S	S	*	*			trans	-93.5	140	178.6	34.8	-33.6	0	0	0	115.4
428	P	47.3	Very low	37.8	Very low	121 Å²	121	131.7 Å²	131.7	79%	0.786	75%	0.747	S	S	*	*			trans	-111.1	163.6	169.9	38.4	-30.4	0	0	0	114.6
429	P	40.4	Very low	37.7	Very low	127 Å²	127	132.3 Å²	132.3	83%	0.825	74%	0.74	S	S	*	*			trans	-126.6	-130.2	-156.2	37.1	-13	0	0	0	115.1
430	P	46	Very low	37.3	Very low	110 Å²	110	138 Å²	138	71%	0.714	75%	0.75	S	S	*	*			trans	-123.1	-178.6	-131	39.5	-19.6	0	0	0	115.7
431	S	32.8	Very low	37.5	Very low	118 Å²	118	136.6 Å²	136.6	83%	0.825	75%	0.745	S	S	*	*			trans	149.1	136.4	133.9	-69.1	0	0	0	0	114.7
432	A	37.3	Very low	37.4	Very low	103 Å²	103	136.6 Å²	136.6	85%	0.851	75%	0.749	S	S	*	*			trans	-168.3	112.7	144.7	0	0	0	0	0	111.2
433	I	39.6	Very low	37.7	Very low	164 Å²	164	138.3 Å²	138.3	84%	0.841	75%	0.753	S	S	*	*			trans	-135.2	153.2	166.7	-27.2	175.3	0	0	0	106.7
434	P	38.9	Very low	37.7	Very low	115 Å²	115	134 Å²	134	75%	0.747	75%	0.745	S	S	*	*				-154.2	-160.2	108	37.5	-17	0	0	0	112.8
435	P	43.2	Very low	38	Very low	107 Å²	107	136 Å²	136	70%	0.695	75%	0.745	S	S	*	*				-120.8	138.6	-58.2	29.1	-11.9	0	0	0	112.7
436	V	35.4	Very low	38.2	Very low	141 Å²	141	134.7 Å²	134.7	86%	0.855	74%	0.736	S	S	*	*				79.8	148.5	84.6	175.6	0	0	0	0	116.6
437	R	38.4	Very low	37.9	Very low	210 Å²	210	136.5 Å²	136.5	79%	0.792	74%	0.74	S	S	*	*			trans	91.4	139.9	172.8	-86.4	-173.1	151.7	116.3	8.1	118.7
438	E	36.5	Very low	37.3	Very low	114 Å²	114	133.9 Å²	133.9	53%	0.533	74%	0.736	S	S	.	*			cis	-156.9	131.8	-10.2	-156.5	151.4	-146.8	0	0	115.9
439	R	35.4	Very low	36.6	Very low	181 Å²	181	136.4 Å²	136.4	68%	0.683	73%	0.734	S	S	*	*			trans	55.8	135	144.4	-74.6	176	-177.5	-167.3	-2.1	126.3
440	R	33.7	Very low	36.2	Very low	207 Å²	207	141.2 Å²	141.2	78%	0.781	74%	0.736	S	S	*	*			trans	76	148.3	137.8	-72.3	172.9	178.9	-175	-3.6	118.1
441	S	34.9	Very low	35.3	Very low	89 Å²	89	141.5 Å²	141.5	62%	0.622	74%	0.736	S	S	*	*			cis	-159.5	151.7	-3.7	-114.4	0	0	0	0	111.7
442	L	33	Very low	35	Very low	146 Å²	146	142.5 Å²	142.5	76%	0.764	74%	0.736	S	S	*	*			trans	47.2	151.8	147	-83.6	61.4	0	0	0	120.3
443	E	38	Very low	34.9	Very low	139 Å²	139	142.5 Å²	142.5	65%	0.65	73%	0.728	S	S	*	*			cis	-155.6	156.7	14.3	-138	177.5	132.8	0	0	113
444	N	34.9	Very low	34.2	Very low	103 Å²	103	140.9 Å²	140.9	55%	0.551	72%	0.72	S	S	*	*			trans	46.6	152.7	148.9	-66.7	-22.7	0	0	0	122.1
445	R	35.8	Very low	33.6	Very low	207 Å²	207	144.7 Å²	144.7	78%	0.781	72%	0.721	S	S	*	*			cis	-171.1	159.8	-10.9	-100.6	166.6	-161.9	-169.8	5.9	105.3
446	S	36	Very low	32.8	Very low	88 Å²	88	148.6 Å²	148.6	62%	0.615	73%	0.728	S	S	*	*			cis	-172.5	139.3	-14.6	48.9	0	0	0	0	112.3
447	N	32	Very low	32.5	Very low	152 Å²	152	149.5 Å²	149.5	81%	0.813	73%	0.727	S	S	*	*			trans	56.8	134.9	136.4	-58.8	-28.3	0	0	0	123.6
448	G	34.2	Very low	32	Very low	70 Å²	70	148.7 Å²	148.7	72%	0.722	73%	0.729	S	S	*	*			trans	141.5	65.5	158.3	0	0	0	0	0	114.8
449	K	32.1	Very low	31.9	Very low	174 Å²	174	152.2 Å²	152.2	76%	0.757	74%	0.742	S	S	*	*				70.1	132.4	79.5	-67.5	-176.1	178.2	177.9	0	115.8
450	R	31.2	Very low	31.8	Very low	227 Å²	227	149.5 Å²	149.5	86%	0.857	75%	0.748	S	S	*	*			trans	74.1	148.1	155.6	-73.8	172.7	178.4	164.8	-4.5	118.7
451	T	28.5	Very low	31.4	Very low	116 Å²	116	147.7 Å²	147.7	71%	0.712	75%	0.746	S	S	*	*			cis	-170	145.6	-34.5	12.1	0	0	0	0	110.6
452	V	26.3	Very low	31.2	Very low	139 Å²	139	151 Å²	151	84%	0.842	76%	0.757	S	S	*	*			trans	70.7	147.7	153.6	174.9	0	0	0	0	117.3
453	P	35.1	Very low	31.1	Very low	104 Å²	104	152.4 Å²	152.4	68%	0.675	76%	0.757	S	S	*	*			trans	-115.4	172.1	-166.6	41.7	-30.6	0	0	0	115
454	L	25.6	Very low	30.7	Very low	130 Å²	130	150.7 Å²	150.7	68%	0.681	76%	0.76	S	S	*	*				178.4	149.6	121.4	-96.3	173.1	0	0	0	114.6
455	Y	25.1	Very low	30.5	Very low	194 Å²	194	151.2 Å²	151.2	76%	0.761	77%	0.767	S	S	*	*			trans	63	153.4	163	-56.8	-53.3	0	0	0	122.7
456	F	26.8	Very low	30.5	Very low	190 Å²	190	153 Å²	153	83%	0.833	77%	0.774	S	S	*	*			trans	-39.5	136.9	-174.8	-61.5	-102.2	0	0	0	118.4
457	L	28.3	Very low	30.2	Very low	160 Å²	160	155.9 Å²	155.9	84%	0.838	78%	0.781	S	S	*	*				-174.9	105	120.7	-100	161.7	0	0	0	115.5
458	K	28.9	Very low	30.5	Very low	192 Å²	192	153.2 Å²	153.2	84%	0.835	77%	0.766	S	S	*	*			trans	22.8	94.4	134.6	-159.8	177.7	-174.5	-178.7	0	120.8
459	K	34.3	Very low	30.3	Very low	188 Å²	188	152.7 Å²	152.7	82%	0.817	75%	0.751	S	S	*	*			trans	71.1	163.5	154.6	-84.6	-176.1	-178.4	-175.8	0	116.1
460	P	32.4	Very low	30.4	Very low	124 Å²	124	147.7 Å²	147.7	81%	0.805	74%	0.742	S	S	*	*			cis	-124.4	-161.5	24.7	44.4	-29.5	0	0	0	116.9
461	F	26	Very low	30.7	Very low	170 Å²	170	143.6 Å²	143.6	75%	0.746	73%	0.731	S	S	*	*			trans	-67	158.8	176	-95.6	-106.4	0	0	0	113	K463	F461-K463 HydrophobicContact CD1-CG 4.09Å
462	D	31.7	Very low	31.2	Very low	158 Å²	158	141.4 Å²	141.4	85%	0.845	71%	0.714	S	S	*	*			trans	-135.4	162.4	132.2	-153.9	-9.7	0	0	0	110.5
463	K	29.8	Very low	31.9	Very low	176 Å²	176	143.8 Å²	143.8	77%	0.765	71%	0.708	S	S	*	*			trans	-128.1	108.5	-168.8	-63.2	173.4	-175.8	169.7	0	111.7	F461	F461-K463 HydrophobicContact CD1-CG 4.09Å
464	S	29.9	Very low	32.2	Very low	103 Å²	103	143.1 Å²	143.1	72%	0.72	70%	0.698	S	S	*	*			trans	-144.5	119	166.1	50.4	0	0	0	0	114.7
465	T	31.5	Very low	32.8	Very low	113 Å²	113	139.4 Å²	139.4	69%	0.693	68%	0.679	S	S	*	*			trans	43.5	82.7	141.3	58.4	0	0	0	0	119.5
466	R	35	Very low	33.6	Very low	244 Å²	244	136.6 Å²	136.6	92%	0.921	67%	0.667	S	S	*	*				-125.9	91.4	118.6	-76.2	-161.6	176.4	-176.2	-0.3	109.9	L468	R466-L468 PolarHBondContact O-N 3.48Å
467	I	30.6	Very low	34	Very low	150 Å²	150	129.8 Å²	129.8	77%	0.769	65%	0.645	S	S	*	*			trans	-73.4	83.3	174.8	-55.3	171.8	0	0	0	107.5	C469	I467-C469 PolarHBondContact O-N 3.37Å
468	L	36.2	Very low	34.4	Very low	95 Å²	95	128 Å²	128	50%	0.497	63%	0.631	S	S	.	*			trans	-69.9	114.8	157.3	-73.1	173.6	0	0	0	106.2	R466 D472	R466-L468 PolarHBondContact O-N 3.48Å; L468-D472 HydrophobicContact CB-CB 4.42Å; L468-D472 HydrophobicContact CD2-CB 4.48Å
469	C	31.6	Very low	34.7	Very low	60 Å²	60	125.7 Å²	125.7	41%	0.405	62%	0.623	S	S	.	*			trans	-57.9	154.3	-171.1	-172.4	0	0	0	0	110.2	I467 K471 D472 R473	I467-C469 PolarHBondContact O-N 3.37Å; C469-K471 HydrophobicContact CB-CB 4.25Å; C469-K471 PolarHBondContact O-N 3.24Å; C469-K471 VanDerWaalsContact O-N 3.13Å; C469-K471 PolarHBondContact SG-N 3.49Å; C469-D472 WeakPolarHBondContact CB-OD2 3.39Å; C469-D472 PolarHBondContact N-OD2 3.25Å; C469-D472 WeakPolarHBondContact O-CA 3.41Å; C469-D472 WeakPolarHBondContact O-CB 3.4Å; C469-D472 PolarHBondContact O-N 3.14Å; C469-R473 PolarHBondContact O-N 3.11Å; C469-R473 VanDerWaalsContact O-N 3.13Å
470	A	34	Very low	34.4	Very low	68 Å²	68	118.9 Å²	118.9	56%	0.562	61%	0.606	S	S	*	*	H	α-helix	trans	-52.9	-34	168.1	0	0	0	0	0	110.6	R473 I474	A470-R473 PolarHBondContact O-N 3.28Å; A470-I474 WeakPolarHBondContact O-CB 3.28Å; A470-I474 WeakPolarHBondContact O-CD1 3.45Å; A470-I474 VanDerWaalsContact O-CG1 3.24Å; A470-I474 WeakPolarHBondContact O-CG1 3.48Å; A470-I474 PolarHBondContact O-N 3.13Å
471	K	37.8	Very low	34.3	Very low	142 Å²	142	117.8 Å²	117.8	62%	0.617	59%	0.593	S	S	*	*	H	α-helix	trans	-60.9	-46.1	171.3	-154.4	151.9	-175.6	177.4	0	112.7	C469 R473 I474 D475	C469-K471 HydrophobicContact CB-CB 4.25Å; C469-K471 PolarHBondContact O-N 3.24Å; C469-K471 VanDerWaalsContact O-N 3.13Å; C469-K471 PolarHBondContact SG-N 3.49Å; K471-R473 PolarHBondContact O-N 3.23Å; K471-I474 PolarHBondContact O-N 3.3Å; K471-I474 VanDerWaalsContact O-N 3.14Å; K471-D475 WeakPolarHBondContact CG-OD2 3.38Å; K471-D475 VanDerWaalsContact O-CB 3.31Å; K471-D475 WeakPolarHBondContact O-CB 3.39Å; K471-D475 VanDerWaalsContact O-CG 3.32Å; K471-D475 PolarHBondContact O-N 2.76Å
472	D	38.6	Very low	34.5	Very low	70 Å²	70	115.8 Å²	115.8	37%	0.374	59%	0.588	S	S	.	*	H	α-helix	trans	-66.5	-16.8	174.5	-57.1	-42.7	0	0	0	114.7	L468 C469 R476	L468-D472 HydrophobicContact CB-CB 4.42Å; L468-D472 HydrophobicContact CD2-CB 4.48Å; C469-D472 WeakPolarHBondContact CB-OD2 3.39Å; C469-D472 PolarHBondContact N-OD2 3.25Å; C469-D472 WeakPolarHBondContact O-CA 3.41Å; C469-D472 WeakPolarHBondContact O-CB 3.4Å; C469-D472 PolarHBondContact O-N 3.14Å; D472-R476 WeakPolarHBondContact O-CB 3.35Å; D472-R476 PolarHBondContact O-NE 2.9Å; D472-R476 PolarHBondContact O-NH2 2.59Å
473	R	41.3	Very low	34.4	Very low	189 Å²	189	114.8 Å²	114.8	71%	0.713	58%	0.581	S	S	*	*	H	α-helix	trans	-88.7	-39.2	170.6	-70.3	-172.1	-178.1	-178.6	1.8	111.7	C469 A470 K471 A477	C469-R473 PolarHBondContact O-N 3.11Å; C469-R473 VanDerWaalsContact O-N 3.13Å; A470-R473 PolarHBondContact O-N 3.28Å; K471-R473 PolarHBondContact O-N 3.23Å; R473-A477 VanDerWaalsContact O-CB 3.25Å; R473-A477 WeakPolarHBondContact O-CB 3.38Å; R473-A477 PolarHBondContact O-N 3.33Å
474	I	41.8	Very low	34.5	Very low	90 Å²	90	113.5 Å²	113.5	46%	0.462	57%	0.572	S	S	.	*	H	α-helix	trans	-71.2	-36.7	177.9	-72.7	165	0	0	0	110.8	A470 K471 A477 K478	A470-I474 WeakPolarHBondContact O-CB 3.28Å; A470-I474 WeakPolarHBondContact O-CD1 3.45Å; A470-I474 VanDerWaalsContact O-CG1 3.24Å; A470-I474 WeakPolarHBondContact O-CG1 3.48Å; A470-I474 PolarHBondContact O-N 3.13Å; K471-I474 PolarHBondContact O-N 3.3Å; K471-I474 VanDerWaalsContact O-N 3.14Å; I474-A477 CarbonylContact O-C 3.53Å; I474-A477 WeakPolarHBondContact O-CA 3.42Å; I474-A477 WeakPolarHBondContact O-CB 3.03Å; I474-A477 PolarHBondContact O-N 2.99Å; I474-K478 HydrophobicContact CG2-CD 4.44Å; I474-K478 WeakPolarHBondContact O-CG 3.25Å; I474-K478 PolarHBondContact O-N 2.77Å
475	D	37.8	Very low	34.5	Very low	52 Å²	52	119.2 Å²	119.2	28%	0.278	58%	0.578	S	S	.	*	H	α-helix	trans	-82.6	-33.7	-178.5	-62.1	-24.5	0	0	0	110.8	K471 A477 K478 E479	K471-D475 WeakPolarHBondContact CG-OD2 3.38Å; K471-D475 VanDerWaalsContact O-CB 3.31Å; K471-D475 WeakPolarHBondContact O-CB 3.39Å; K471-D475 VanDerWaalsContact O-CG 3.32Å; K471-D475 PolarHBondContact O-N 2.76Å; D475-A477 PolarHBondContact O-N 3.3Å; D475-K478 PolarHBondContact O-N 3.18Å; D475-K478 WeakPolarHBondContact OD1-CD 3.45Å; D475-K478 WeakPolarHBondContact OD1-CE 3.47Å; D475-K478 IonicContact OD1-NZ 3.95Å; D475-K478 PolarHBondContact OD1-NZ 3.16Å; D475-E479 WeakPolarHBondContact O-CB 3.46Å; D475-E479 WeakPolarHBondContact O-CG 3.22Å; D475-E479 PolarHBondContact O-N 3.45Å
476	R	40.7	Very low	34.5	Very low	135 Å²	135	118.3 Å²	118.3	51%	0.509	57%	0.572	S	S	.	*	H	α-helix	trans	-69.7	-15.7	160.4	-84.8	-179.2	-70.1	-156	-12.5	114.4	D472 G480	D472-R476 WeakPolarHBondContact O-CB 3.35Å; D472-R476 PolarHBondContact O-NE 2.9Å; D472-R476 PolarHBondContact O-NH2 2.59Å; R476-G480 VanDerWaalsContact O-CA 3.27Å; R476-G480 WeakPolarHBondContact O-CA 3.24Å; R476-G480 PolarHBondContact O-N 3.44Å
477	A	36	Very low	34.4	Very low	46 Å²	46	117.7 Å²	117.7	38%	0.38	57%	0.569	S	S	.	*	H	α-helix	trans	-78	-43.8	166.1	0	0	0	0	0	110.3	R473 I474 D475 G480 I481	R473-A477 VanDerWaalsContact O-CB 3.25Å; R473-A477 WeakPolarHBondContact O-CB 3.38Å; R473-A477 PolarHBondContact O-N 3.33Å; I474-A477 CarbonylContact O-C 3.53Å; I474-A477 WeakPolarHBondContact O-CA 3.42Å; I474-A477 WeakPolarHBondContact O-CB 3.03Å; I474-A477 PolarHBondContact O-N 2.99Å; D475-A477 PolarHBondContact O-N 3.3Å; A477-G480 CarbonylContact O-C 3.41Å; A477-G480 PolarHBondContact O-N 3.18Å; A477-I481 VanDerWaalsContact O-CB 3.31Å; A477-I481 WeakPolarHBondContact O-CB 3.37Å; A477-I481 VanDerWaalsContact O-CD1 3.32Å; A477-I481 WeakPolarHBondContact O-CD1 3.08Å; A477-I481 WeakPolarHBondContact O-CG1 3.17Å; A477-I481 PolarHBondContact O-N 3.35Å
478	K	37	Very low	34.6	Very low	123 Å²	123	112.9 Å²	112.9	54%	0.535	55%	0.548	S	S	.	.	H	α-helix	trans	-61.3	-47.8	175.2	-69	166	-168	160.8	0	111.9	I474 D475 G480	I474-K478 HydrophobicContact CG2-CD 4.44Å; I474-K478 WeakPolarHBondContact O-CG 3.25Å; I474-K478 PolarHBondContact O-N 2.77Å; D475-K478 PolarHBondContact O-N 3.18Å; D475-K478 WeakPolarHBondContact OD1-CD 3.45Å; D475-K478 WeakPolarHBondContact OD1-CE 3.47Å; D475-K478 IonicContact OD1-NZ 3.95Å; D475-K478 PolarHBondContact OD1-NZ 3.16Å; K478-G480 VanDerWaalsContact C-N 3.34Å
479	E	34.4	Very low	34.9	Very low	144 Å²	144	116 Å²	116	67%	0.673	56%	0.56	S	S	*	*	H	α-helix	trans	-67.7	-33.4	172.6	-66.6	-178	157.1	0	0	112	D475 I482	D475-E479 WeakPolarHBondContact O-CB 3.46Å; D475-E479 WeakPolarHBondContact O-CG 3.22Å; D475-E479 PolarHBondContact O-N 3.45Å; E479-I482 WeakPolarHBondContact O-CB 3.4Å; E479-I482 PolarHBondContact O-N 3.44Å
480	G	29.1	Very low	36.2	Very low	45 Å²	45	123.7 Å²	123.7	46%	0.464	58%	0.58	S	S	.	*	H	α-helix	trans	-82.9	-9.6	179.5	0	0	0	0	0	116.1	R476 A477 K478 I482	R476-G480 VanDerWaalsContact O-CA 3.27Å; R476-G480 WeakPolarHBondContact O-CA 3.24Å; R476-G480 PolarHBondContact O-N 3.44Å; A477-G480 CarbonylContact O-C 3.41Å; A477-G480 PolarHBondContact O-N 3.18Å; K478-G480 VanDerWaalsContact C-N 3.34Å; G480-I482 VanDerWaalsContact C-N 3.34Å
481	I	29.8	Very low	37.7	Very low	100 Å²	100	126 Å²	126	51%	0.513	58%	0.578	S	S	.	*	H	α-helix	trans	-77.2	-28	170.5	-80.6	160.1	0	0	0	109.8	A477 I483 R484	A477-I481 VanDerWaalsContact O-CB 3.31Å; A477-I481 WeakPolarHBondContact O-CB 3.37Å; A477-I481 VanDerWaalsContact O-CD1 3.32Å; A477-I481 WeakPolarHBondContact O-CD1 3.08Å; A477-I481 WeakPolarHBondContact O-CG1 3.17Å; A477-I481 PolarHBondContact O-N 3.35Å; I481-I483 PolarHBondContact O-N 3.12Å; I481-R484 PolarHBondContact O-N 2.78Å
482	I	30.2	Very low	39.2	Very low	128 Å²	128	123 Å²	123	66%	0.656	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.7	115.4	167.2	-52.5	177.4	0	0	0	107.7	E479 G480	E479-I482 WeakPolarHBondContact O-CB 3.4Å; E479-I482 PolarHBondContact O-N 3.44Å; G480-I482 VanDerWaalsContact C-N 3.34Å
483	I	29.8	Very low	41.3	Very low	137 Å²	137	119.9 Å²	119.9	70%	0.703	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	72.6	-168.7	-41.3	168.6	0	0	0	112.1	I481 R485	I481-I483 PolarHBondContact O-N 3.12Å; I483-R485 VanDerWaalsContact C-N 3.25Å; I483-R485 PolarHBondContact O-N 2.64Å
484	R	31.1	Very low	42.7	Very low	150 Å²	150	114.1 Å²	114.1	57%	0.566	53%	0.53	S	S	*	.			trans	-49.5	103.8	140.3	-82	-164.3	-166.5	153.5	16.6	105.8	I481 V486 E545	I481-R484 PolarHBondContact O-N 2.78Å; R484-V486 PolarHBondContact O-N 3.48Å; R484-E545 IonicContact CZ-OE2 3.8Å; R484-E545 IonicContact NH2-OE1 3.68Å; R484-E545 IonicContact NH2-OE2 3.84Å; R484-E545 PolarHBondContact NH2-OE2 3.19Å
485	R	29.5	Very low	44.4	Very low	223 Å²	223	112.5 Å²	112.5	84%	0.842	52%	0.522	S	S	*	.			trans	-48.1	113.2	-178.1	-68.5	175.5	-179.9	164.1	-0.4	107.7	I483 R487	I483-R485 VanDerWaalsContact C-N 3.25Å; I483-R485 PolarHBondContact O-N 2.64Å; R485-R487 PolarHBondContact O-N 2.93Å
486	V	32.1	Very low	46.4	Very low	94 Å²	94	110.9 Å²	110.9	57%	0.57	51%	0.514	S	S	*	.			trans	-60	94.7	165.5	177.1	0	0	0	0	104.5	R484 P488 D494	R484-V486 PolarHBondContact O-N 3.48Å; V486-P488 WeakPolarHBondContact O-CD 3.45Å; V486-P488 VanDerWaalsContact O-N 3.07Å; V486-D494 WeakPolarHBondContact CG1-OD1 3.49Å
487	R	32.9	Very low	48.3	Very low	230 Å²	230	111.1 Å²	111.1	87%	0.868	52%	0.521	S	S	*	.			trans	-64	110.6	174.6	-102.5	-175.8	174.4	162.7	-0.2	103.3	R485 H489	R485-R487 PolarHBondContact O-N 2.93Å; R487-H489 PolarHBondContact O-N 3.14Å; R487-H489 VanDerWaalsContact O-N 3.11Å
488	P	34.6	Very low	50.2	Low	50 Å²	50	116.2 Å²	116.2	33%	0.325	53%	0.531	S	S	.	.			trans	-61.7	128.2	175.4	-16.3	31.7	0	0	0	105.8	V486 R490 L506	V486-P488 WeakPolarHBondContact O-CD 3.45Å; V486-P488 VanDerWaalsContact O-N 3.07Å; P488-R490 WeakPolarHBondContact O-CA 3.32Å; P488-R490 PolarHBondContact O-N 3.24Å; P488-L506 HydrophobicContact CB-CD2 3.55Å; P488-L506 HydrophobicContact CG-CD2 3.89Å
489	H	43.5	Very low	52.3	Low	161 Å²	161	120.6 Å²	120.6	75%	0.745	54%	0.543	S	S	*	.			trans	-44.5	119.6	144.8	-106.4	-110.3	0	0	0	104.5	R487 K491 Y492	R487-H489 PolarHBondContact O-N 3.14Å; R487-H489 VanDerWaalsContact O-N 3.11Å; H489-K491 CarbonylContact O-C 3.52Å; H489-K491 PolarHBondContact O-N 2.79Å; H489-Y492 HydrophobicContact CB-CD1 3.98Å; H489-Y492 PolarHBondContact O-N 2.81Å
490	R	58.2	Low	54.7	Low	220 Å²	220	115.2 Å²	115.2	83%	0.83	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	4.2	-140.2	-64	179.6	176.1	179.8	-0.9	117.4	P488	P488-R490 WeakPolarHBondContact O-CA 3.32Å; P488-R490 PolarHBondContact O-N 3.24Å
491	K	65.6	Low	56.9	Low	117 Å²	117	117 Å²	117	51%	0.509	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-150.1	31.3	-166.9	-70	-164.7	-175.5	-164.2	0	111.7	H489 R499 F500 T501	H489-K491 CarbonylContact O-C 3.52Å; H489-K491 PolarHBondContact O-N 2.79Å; K491-R499 CarbonylContact O-C 3.44Å; K491-R499 VanDerWaalsContact O-CA 3.28Å; K491-R499 WeakPolarHBondContact O-CA 3.36Å; K491-F500 WeakPolarHBondContact CA-O 3.4Å; K491-F500 WeakPolarHBondContact CB-O 3.33Å; K491-F500 WeakPolarHBondContact CD-O 3.44Å; K491-F500 WeakPolarHBondContact CG-O 3.3Å; K491-F500 PolarHBondContact O-N 2.91Å; K491-T501 WeakPolarHBondContact CE-O 3.46Å; K491-T501 PolarHBondContact NZ-O 3.28Å
492	Y	69.7	Low	59.3	Low	79 Å²	79	115.2 Å²	115.2	31%	0.31	51%	0.514	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	155.3	-174.5	142.3	-89.4	0	0	0	112.5	H489 D494 R498 L506	H489-Y492 HydrophobicContact CB-CD1 3.98Å; H489-Y492 PolarHBondContact O-N 2.81Å; Y492-D494 HydrophobicContact CE1-CB 4.31Å; Y492-D494 WeakPolarHBondContact CE1-OD1 3.46Å; Y492-D494 VanDerWaalsContact CE1-OD2 3.23Å; Y492-D494 WeakPolarHBondContact CE1-OD2 3.24Å; Y492-D494 WeakPolarHBondContact OH-CA 3.25Å; Y492-D494 WeakPolarHBondContact OH-CB 3.3Å; Y492-D494 PolarHBondContact OH-OD2 3.38Å; Y492-R498 CarbonylContact C-O 3.6Å; Y492-R498 WeakPolarHBondContact CA-O 3.36Å; Y492-L506 VanDerWaalsContact O-CD1 3.27Å; Y492-L506 WeakPolarHBondContact O-CD1 3.48Å
493	C	82.2	Confident	61.7	Low	4 Å²	4	118.3 Å²	118.3	3%	0.027	52%	0.517	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	116.7	175.2	-178.5	0	0	0	0	112.2	I495 C496 E497 R498 F500 L506 H515	C493-I495 VanDerWaalsContact C-N 3.31Å; C493-I495 PolarHBondContact O-N 3.1Å; C493-C496 PolarHBondContact O-N 3.46Å; C493-E497 WeakPolarHBondContact O-CA 3.44Å; C493-E497 PolarHBondContact O-N 3.03Å; C493-R498 PolarHBondContact N-O 3.11Å; C493-F500 HydrophobicContact CB-CE2 3.84Å; C493-L506 HydrophobicContact CB-CD1 4.1Å; C493-H515 PolarHBondContact SG-CE1 3.36Å
494	D	71.8	Confident	64.3	Low	69 Å²	69	117.4 Å²	117.4	37%	0.369	51%	0.513	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-32.4	-176.6	-48.5	63.7	0	0	0	113.9	V486 Y492	V486-D494 WeakPolarHBondContact CG1-OD1 3.49Å; Y492-D494 HydrophobicContact CE1-CB 4.31Å; Y492-D494 WeakPolarHBondContact CE1-OD1 3.46Å; Y492-D494 VanDerWaalsContact CE1-OD2 3.23Å; Y492-D494 WeakPolarHBondContact CE1-OD2 3.24Å; Y492-D494 WeakPolarHBondContact OH-CA 3.25Å; Y492-D494 WeakPolarHBondContact OH-CB 3.3Å; Y492-D494 PolarHBondContact OH-OD2 3.38Å
495	I	77.3	Confident	66.8	Low	56 Å²	56	115.8 Å²	115.8	29%	0.287	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-13	-172.9	-48.8	-177	0	0	0	111.8	C493 N518 L519	C493-I495 VanDerWaalsContact C-N 3.31Å; C493-I495 PolarHBondContact O-N 3.1Å; I495-N518 HydrophobicContact CG2-CB 4.22Å; I495-L519 HydrophobicContact CD1-CD2 3.52Å; I495-L519 HydrophobicContact CD1-CG 3.74Å; I495-L519 HydrophobicContact CG2-CG 4.37Å
496	C	79.1	Confident	69.6	Low	17 Å²	17	105.4 Å²	105.4	12%	0.115	47%	0.472	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.4	4.8	-177.3	-62.8	0	0	0	0	112.6	C493 R498 H509 H515	C493-C496 PolarHBondContact O-N 3.46Å; C496-R498 WeakPolarHBondContact O-CG 3.29Å; C496-R498 PolarHBondContact O-N 3.12Å; C496-H509 WeakPolarHBondContact CB-NE2 3.5Å; C496-H509 VanDerWaalsContact SG-CE1 3.59Å; C496-H509 PolarHBondContact SG-NE2 2.92Å; C496-H515 PolarHBondContact SG-ND1 2.96Å; C496-H515 VanDerWaalsContact SG-ND1 3.38Å
497	E	80.5	Confident	72	Confident	140 Å²	140	103.6 Å²	103.6	65%	0.654	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	7.7	-178.9	-62.9	174.7	171.8	0	0	115.5	C493	C493-E497 WeakPolarHBondContact O-CA 3.44Å; C493-E497 PolarHBondContact O-N 3.03Å
498	R	76.5	Confident	74.7	Confident	154 Å²	154	99.6 Å²	99.6	58%	0.581	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.1	141.6	-171.6	-79.3	165.4	-170.8	-160.7	-0.8	113.6	Y492 C493 C496 F500	Y492-R498 CarbonylContact C-O 3.6Å; Y492-R498 WeakPolarHBondContact CA-O 3.36Å; C493-R498 PolarHBondContact N-O 3.11Å; C496-R498 WeakPolarHBondContact O-CG 3.29Å; C496-R498 PolarHBondContact O-N 3.12Å; R498-F500 HydrophobicContact CB-CE2 3.58Å; R498-F500 HydrophobicContact CB-CZ 3.55Å; R498-F500 WeakPolarHBondContact O-CD2 3.41Å; R498-F500 VanDerWaalsContact O-CE2 3.25Å; R498-F500 WeakPolarHBondContact O-CE2 3.26Å
499	R	80.6	Confident	77.3	Confident	214 Å²	214	97.9 Å²	97.9	81%	0.808	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	150.8	167.8	-61.8	178.4	-179.1	174.3	3.4	110.3	K491	K491-R499 CarbonylContact O-C 3.44Å; K491-R499 VanDerWaalsContact O-CA 3.28Å; K491-R499 WeakPolarHBondContact O-CA 3.36Å
500	F	84	Confident	79.4	Confident	31 Å²	31	93.4 Å²	93.4	14%	0.136	42%	0.419	C	S	.	.			trans	-137.8	117.2	-170.3	-68.3	-80.2	0	0	0	111.9	K491 C493 R498 T502 K505 L506 H509	K491-F500 WeakPolarHBondContact CA-O 3.4Å; K491-F500 WeakPolarHBondContact CB-O 3.33Å; K491-F500 WeakPolarHBondContact CD-O 3.44Å; K491-F500 WeakPolarHBondContact CG-O 3.3Å; K491-F500 PolarHBondContact O-N 2.91Å; C493-F500 HydrophobicContact CB-CE2 3.84Å; R498-F500 HydrophobicContact CB-CE2 3.58Å; R498-F500 HydrophobicContact CB-CZ 3.55Å; R498-F500 WeakPolarHBondContact O-CD2 3.41Å; R498-F500 VanDerWaalsContact O-CE2 3.25Å; R498-F500 WeakPolarHBondContact O-CE2 3.26Å; F500-T502 PolarHBondContact O-N 3.5Å; F500-K505 HydrophobicContact CB-CB 4.3Å; F500-K505 HydrophobicContact CD1-CB 4.13Å; F500-L506 HydrophobicContact CB-CB 4Å; F500-L506 HydrophobicContact CD2-CB 4.31Å; F500-L506 HydrophobicContact CD2-CD1 3.69Å; F500-L506 HydrophobicContact CE2-CD1 4.07Å; F500-L506 HydrophobicContact CG-CB 4.15Å; F500-L506 HydrophobicContact CG-CD1 4.36Å; F500-H509 HydrophobicContact CD1-CB 4.25Å; F500-H509 HydrophobicContact CE1-CB 3.51Å; F500-H509 AromaticContact CE1-CG 3.65Å; F500-H509 HydrophobicContact CE2-CB 4.31Å; F500-H509 AromaticContact CE2-CD2 3.44Å; F500-H509 VanDerWaalsContact CE2-CD2 3.44Å; F500-H509 WeakPolarHBondContact CE2-CD2 3.44Å; F500-H509 AromaticContact CE2-CG 3.94Å; F500-H509 HydrophobicContact CZ-CB 3.57Å; F500-H509 AromaticContact CZ-CD2 3.12Å; F500-H509 WeakPolarHBondContact CZ-CD2 3.3Å; F500-H509 AromaticContact CZ-CG 3.19Å; F500-H509 AromaticContact CZ-ND1 3.79Å; F500-H509 AromaticContact CZ-NE2 3.67Å
501	T	76	Confident	80.7	Confident	82 Å²	82	90.3 Å²	90.3	50%	0.503	41%	0.413	S	S	.	.	S	Bend	trans	-58.5	-24.7	-170.9	67.7	0	0	0	0	115	K491 K505	K491-T501 WeakPolarHBondContact CE-O 3.46Å; K491-T501 PolarHBondContact NZ-O 3.28Å; T501-K505 PolarHBondContact OG1-NZ 2.86Å
502	T	81	Confident	81.8	Confident	63 Å²	63	86 Å²	86	39%	0.387	40%	0.398	S	S	.	.	S	Bend	trans	-135.2	155.6	174.2	70.5	0	0	0	0	112.5	F500 L504 K505 L506	F500-T502 PolarHBondContact O-N 3.5Å; T502-L504 PolarHBondContact O-N 2.7Å; T502-K505 PolarHBondContact O-N 2.85Å; T502-K505 VanDerWaalsContact O-N 3.15Å; T502-K505 PolarHBondContact OG1-N 2.93Å; T502-K505 VanDerWaalsContact OG1-N 3.16Å; T502-L506 PolarHBondContact O-N 3.18Å; T502-L506 VanDerWaalsContact O-N 3.12Å
503	R	80.4	Confident	82.5	Confident	193 Å²	193	87.7 Å²	87.7	73%	0.728	41%	0.409	S	S	*	.	H	α-helix	trans	-58.7	-29.4	172.6	-173.3	176.9	177.6	-173.3	-2.3	112.3	L506 T507	R503-L506 PolarHBondContact O-N 2.9Å; R503-T507 PolarHBondContact O-N 3.18Å; R503-T507 PolarHBondContact O-OG1 3.23Å
504	L	82.9	Confident	82.5	Confident	119 Å²	119	90.8 Å²	90.8	62%	0.623	43%	0.429	S	S	*	.	H	α-helix	trans	-70.7	-38.9	177	-162.4	78.2	0	0	0	112.4	T502 L506 T507 K508	T502-L504 PolarHBondContact O-N 2.7Å; L504-L506 VanDerWaalsContact C-N 3.33Å; L504-T507 WeakPolarHBondContact CA-OG1 3.47Å; L504-T507 PolarHBondContact O-N 3.41Å; L504-T507 PolarHBondContact O-OG1 2.86Å; L504-T507 VanDerWaalsContact O-OG1 3.05Å; L504-K508 WeakPolarHBondContact O-CG 3.42Å; L504-K508 PolarHBondContact O-N 3.29Å
505	K	83.7	Confident	83.2	Confident	116 Å²	116	87.9 Å²	87.9	50%	0.504	41%	0.413	S	S	.	.	H	α-helix	trans	-63.5	-41.6	170.8	-74.5	-171.7	179.5	-175.7	0	110.8	F500 T501 T502 K508 H509	F500-K505 HydrophobicContact CB-CB 4.3Å; F500-K505 HydrophobicContact CD1-CB 4.13Å; T501-K505 PolarHBondContact OG1-NZ 2.86Å; T502-K505 PolarHBondContact O-N 2.85Å; T502-K505 VanDerWaalsContact O-N 3.15Å; T502-K505 PolarHBondContact OG1-N 2.93Å; T502-K505 VanDerWaalsContact OG1-N 3.16Å; K505-K508 PolarHBondContact O-N 3.01Å; K505-H509 WeakPolarHBondContact O-CB 3.48Å; K505-H509 PolarHBondContact O-N 2.88Å
506	L	88	Confident	83.5	Confident	5 Å²	5	88.3 Å²	88.3	3%	0.026	42%	0.416	C	S	.	.	H	α-helix	trans	-61.8	-46.5	175.3	175.8	62.4	0	0	0	112.3	P488 Y492 C493 F500 T502 R503 L504 K508 H509 L510	P488-L506 HydrophobicContact CB-CD2 3.55Å; P488-L506 HydrophobicContact CG-CD2 3.89Å; Y492-L506 VanDerWaalsContact O-CD1 3.27Å; Y492-L506 WeakPolarHBondContact O-CD1 3.48Å; C493-L506 HydrophobicContact CB-CD1 4.1Å; F500-L506 HydrophobicContact CB-CB 4Å; F500-L506 HydrophobicContact CD2-CB 4.31Å; F500-L506 HydrophobicContact CD2-CD1 3.69Å; F500-L506 HydrophobicContact CE2-CD1 4.07Å; F500-L506 HydrophobicContact CG-CB 4.15Å; F500-L506 HydrophobicContact CG-CD1 4.36Å; T502-L506 PolarHBondContact O-N 3.18Å; T502-L506 VanDerWaalsContact O-N 3.12Å; R503-L506 PolarHBondContact O-N 2.9Å; L504-L506 VanDerWaalsContact C-N 3.33Å; L506-K508 PolarHBondContact O-N 3.45Å; L506-H509 WeakPolarHBondContact O-CB 3.45Å; L506-H509 PolarHBondContact O-N 3.3Å; L506-H509 VanDerWaalsContact O-N 3.14Å; L506-L510 HydrophobicContact CD1-CD1 4.07Å; L506-L510 HydrophobicContact CD1-CD2 4.4Å; L506-L510 HydrophobicContact CD1-CG 3.99Å; L506-L510 HydrophobicContact CG-CD1 4.04Å; L506-L510 HydrophobicContact CG-CG 4.37Å; L506-L510 WeakPolarHBondContact O-CG 3.43Å; L506-L510 PolarHBondContact O-N 3.45Å
507	T	84.2	Confident	83.8	Confident	55 Å²	55	93.4 Å²	93.4	34%	0.337	44%	0.436	S	S	.	.	H	α-helix	trans	-64.6	-39	177.9	49.1	0	0	0	0	112.3	R503 L504 H509 L510 Q511	R503-T507 PolarHBondContact O-N 3.18Å; R503-T507 PolarHBondContact O-OG1 3.23Å; L504-T507 WeakPolarHBondContact CA-OG1 3.47Å; L504-T507 PolarHBondContact O-N 3.41Å; L504-T507 PolarHBondContact O-OG1 2.86Å; L504-T507 VanDerWaalsContact O-OG1 3.05Å; T507-H509 VanDerWaalsContact C-N 3.3Å; T507-H509 PolarHBondContact O-N 3.26Å; T507-L510 PolarHBondContact O-N 3.03Å; T507-Q511 WeakPolarHBondContact O-CG 3.23Å; T507-Q511 PolarHBondContact O-N 3.44Å; T507-Q511 VanDerWaalsContact O-N 3.17Å
508	K	88.3	Confident	83.7	Confident	147 Å²	147	90 Å²	90	64%	0.639	42%	0.423	S	S	*	.	H	α-helix	trans	-62.1	-36.7	171.9	-74.6	-170.6	175.5	-166.2	0	112.2	L504 K505 L506 Q511 S512	L504-K508 WeakPolarHBondContact O-CG 3.42Å; L504-K508 PolarHBondContact O-N 3.29Å; K505-K508 PolarHBondContact O-N 3.01Å; L506-K508 PolarHBondContact O-N 3.45Å; K508-Q511 PolarHBondContact O-N 2.95Å; K508-S512 WeakPolarHBondContact O-CB 3.44Å; K508-S512 PolarHBondContact O-N 3.35Å
509	H	90.3	Very high	83.9	Confident	14 Å²	14	84.7 Å²	84.7	7%	0.065	41%	0.406	C	S	.	.	H	α-helix	trans	-69.5	-44.4	175.2	173.7	62	0	0	0	112.9	C496 F500 K505 L506 T507 Q511 S512 H515	C496-H509 WeakPolarHBondContact CB-NE2 3.5Å; C496-H509 VanDerWaalsContact SG-CE1 3.59Å; C496-H509 PolarHBondContact SG-NE2 2.92Å; F500-H509 HydrophobicContact CD1-CB 4.25Å; F500-H509 HydrophobicContact CE1-CB 3.51Å; F500-H509 AromaticContact CE1-CG 3.65Å; F500-H509 HydrophobicContact CE2-CB 4.31Å; F500-H509 AromaticContact CE2-CD2 3.44Å; F500-H509 VanDerWaalsContact CE2-CD2 3.44Å; F500-H509 WeakPolarHBondContact CE2-CD2 3.44Å; F500-H509 AromaticContact CE2-CG 3.94Å; F500-H509 HydrophobicContact CZ-CB 3.57Å; F500-H509 AromaticContact CZ-CD2 3.12Å; F500-H509 WeakPolarHBondContact CZ-CD2 3.3Å; F500-H509 AromaticContact CZ-CG 3.19Å; F500-H509 AromaticContact CZ-ND1 3.79Å; F500-H509 AromaticContact CZ-NE2 3.67Å; K505-H509 WeakPolarHBondContact O-CB 3.48Å; K505-H509 PolarHBondContact O-N 2.88Å; L506-H509 WeakPolarHBondContact O-CB 3.45Å; L506-H509 PolarHBondContact O-N 3.3Å; L506-H509 VanDerWaalsContact O-N 3.14Å; T507-H509 VanDerWaalsContact C-N 3.3Å; T507-H509 PolarHBondContact O-N 3.26Å; H509-Q511 PolarHBondContact O-N 3.32Å; H509-Q511 VanDerWaalsContact O-N 3.13Å; H509-S512 PolarHBondContact ND1-OG 3.41Å; H509-S512 VanDerWaalsContact O-CB 3.31Å; H509-S512 WeakPolarHBondContact O-CB 3.42Å; H509-S512 PolarHBondContact O-N 3.49Å; H509-S512 PolarHBondContact O-OG 3.15Å; H509-H515 AromaticContact NE2-ND1 3.66Å; H509-H515 WeakPolarHBondContact O-CB 3.42Å
510	L	87	Confident	83.8	Confident	67 Å²	67	78.7 Å²	78.7	35%	0.351	39%	0.389	S	S	.	.	H	α-helix	trans	-63.5	-17.4	176.4	-65.8	173.5	0	0	0	113	L506 T507 H515	L506-L510 HydrophobicContact CD1-CD1 4.07Å; L506-L510 HydrophobicContact CD1-CD2 4.4Å; L506-L510 HydrophobicContact CD1-CG 3.99Å; L506-L510 HydrophobicContact CG-CD1 4.04Å; L506-L510 HydrophobicContact CG-CG 4.37Å; L506-L510 WeakPolarHBondContact O-CG 3.43Å; L506-L510 PolarHBondContact O-N 3.45Å; T507-L510 PolarHBondContact O-N 3.03Å; L510-H515 PolarHBondContact O-CD2 3.34Å
511	Q	85	Confident	83.4	Confident	154 Å²	154	82.1 Å²	82.1	72%	0.72	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	4.3	172.6	-67.2	175.7	-40	0	0	113.3	T507 K508 H509	T507-Q511 WeakPolarHBondContact O-CG 3.23Å; T507-Q511 PolarHBondContact O-N 3.44Å; T507-Q511 VanDerWaalsContact O-N 3.17Å; K508-Q511 PolarHBondContact O-N 2.95Å; H509-Q511 PolarHBondContact O-N 3.32Å; H509-Q511 VanDerWaalsContact O-N 3.13Å
512	S	88.9	Confident	83.3	Confident	28 Å²	28	81.4 Å²	81.4	20%	0.196	40%	0.399	C	S	.	.	S	Bend	trans	-90.2	142.5	-172.9	71.8	0	0	0	0	113.1	K508 H509 H515 N516	K508-S512 WeakPolarHBondContact O-CB 3.44Å; K508-S512 PolarHBondContact O-N 3.35Å; H509-S512 PolarHBondContact ND1-OG 3.41Å; H509-S512 VanDerWaalsContact O-CB 3.31Å; H509-S512 WeakPolarHBondContact O-CB 3.42Å; H509-S512 PolarHBondContact O-N 3.49Å; H509-S512 PolarHBondContact O-OG 3.15Å; S512-H515 WeakPolarHBondContact O-CA 3.21Å; S512-H515 WeakPolarHBondContact O-CB 3.44Å; S512-H515 PolarHBondContact O-N 3.01Å; S512-N516 PolarHBondContact O-N 3.03Å
513	E	85.3	Confident	83	Confident	113 Å²	113	84 Å²	84	53%	0.528	40%	0.404	S	S	.	.	H	α-helix	trans	-42.3	-51	171.7	-86.3	-62.1	107.9	0	0	115.4	H515 N516 K517	E513-H515 VanDerWaalsContact C-N 3.28Å; E513-H515 PolarHBondContact O-N 3.32Å; E513-N516 PolarHBondContact O-N 3.05Å; E513-K517 WeakPolarHBondContact O-CG 3.44Å; E513-K517 PolarHBondContact O-N 3.22Å; E513-K517 VanDerWaalsContact OE2-CE 3.25Å; E513-K517 WeakPolarHBondContact OE2-CE 3.24Å; E513-K517 IonicContact OE2-NZ 2.75Å
514	P	81.8	Confident	82.7	Confident	70 Å²	70	79.3 Å²	79.3	46%	0.455	39%	0.391	S	S	.	.	H	α-helix	trans	-63.7	-30.1	177.4	23.3	-34	0	0	0	113.7	N518	P514-N518 PolarHBondContact O-N 3.19Å; P514-N518 VanDerWaalsContact O-N 3.1Å; P514-N518 PolarHBondContact O-OD1 2.86Å
515	H	86.2	Confident	81.9	Confident	8 Å²	8	75.6 Å²	75.6	4%	0.037	37%	0.373	C	S	.	.	H	α-helix	trans	-69.6	-43	172.7	-178.3	72.1	0	0	0	111.4	C493 C496 H509 L510 S512 E513 K517 N518 L519	C493-H515 PolarHBondContact SG-CE1 3.36Å; C496-H515 PolarHBondContact SG-ND1 2.96Å; C496-H515 VanDerWaalsContact SG-ND1 3.38Å; H509-H515 AromaticContact NE2-ND1 3.66Å; H509-H515 WeakPolarHBondContact O-CB 3.42Å; L510-H515 PolarHBondContact O-CD2 3.34Å; S512-H515 WeakPolarHBondContact O-CA 3.21Å; S512-H515 WeakPolarHBondContact O-CB 3.44Å; S512-H515 PolarHBondContact O-N 3.01Å; E513-H515 VanDerWaalsContact C-N 3.28Å; E513-H515 PolarHBondContact O-N 3.32Å; H515-K517 VanDerWaalsContact C-N 3.33Å; H515-K517 PolarHBondContact O-N 3.42Å; H515-N518 PolarHBondContact O-N 2.93Å; H515-L519 WeakPolarHBondContact NE2-CD1 3.42Å; H515-L519 WeakPolarHBondContact O-CB 3.38Å; H515-L519 PolarHBondContact O-N 3.36Å
516	N	83.5	Confident	81	Confident	64 Å²	64	72.1 Å²	72.1	34%	0.342	36%	0.36	S	S	.	.	H	α-helix	trans	-61.1	-39.6	175.2	-76.5	-23.5	0	0	0	112.4	S512 E513 L519 N520	S512-N516 PolarHBondContact O-N 3.03Å; E513-N516 PolarHBondContact O-N 3.05Å; N516-L519 WeakPolarHBondContact O-CB 3.37Å; N516-L519 PolarHBondContact O-N 3.23Å; N516-N520 PolarHBondContact O-N 3.09Å
517	K	85	Confident	79.9	Confident	124 Å²	124	74.1 Å²	74.1	54%	0.539	38%	0.377	S	S	.	.	H	α-helix	trans	-64.2	-47.5	175.8	-71.2	173.7	-175.4	179.4	0	111.5	E513 H515 L519 N520 L521	E513-K517 WeakPolarHBondContact O-CG 3.44Å; E513-K517 PolarHBondContact O-N 3.22Å; E513-K517 VanDerWaalsContact OE2-CE 3.25Å; E513-K517 WeakPolarHBondContact OE2-CE 3.24Å; E513-K517 IonicContact OE2-NZ 2.75Å; H515-K517 VanDerWaalsContact C-N 3.33Å; H515-K517 PolarHBondContact O-N 3.42Å; K517-L519 VanDerWaalsContact C-N 3.33Å; K517-L519 PolarHBondContact O-N 2.76Å; K517-N520 PolarHBondContact O-N 3.05Å; K517-L521 WeakPolarHBondContact O-CG 3.4Å; K517-L521 PolarHBondContact O-N 2.84Å
518	N	80.4	Confident	79.1	Confident	69 Å²	69	76.7 Å²	76.7	37%	0.369	38%	0.383	S	S	.	.	H	α-helix	trans	-62.7	-38.3	174.1	-71.8	15.2	0	0	0	112.2	I495 P514 H515 N520 F522	I495-N518 HydrophobicContact CG2-CB 4.22Å; P514-N518 PolarHBondContact O-N 3.19Å; P514-N518 VanDerWaalsContact O-N 3.1Å; P514-N518 PolarHBondContact O-OD1 2.86Å; H515-N518 PolarHBondContact O-N 2.93Å; N518-N520 VanDerWaalsContact C-N 3.33Å; N518-N520 PolarHBondContact O-N 3.35Å; N518-F522 VanDerWaalsContact O-CB 3.26Å; N518-F522 WeakPolarHBondContact O-CB 3.37Å; N518-F522 PolarHBondContact O-N 3.46Å
519	L	78.6	Confident	77.6	Confident	43 Å²	43	71.8 Å²	71.8	23%	0.225	36%	0.364	C	S	.	.	H	α-helix	trans	-59.4	-40.9	173.7	-108.3	170.2	0	0	0	112.5	I495 H515 N516 K517 K523	I495-L519 HydrophobicContact CD1-CD2 3.52Å; I495-L519 HydrophobicContact CD1-CG 3.74Å; I495-L519 HydrophobicContact CG2-CG 4.37Å; H515-L519 WeakPolarHBondContact NE2-CD1 3.42Å; H515-L519 WeakPolarHBondContact O-CB 3.38Å; H515-L519 PolarHBondContact O-N 3.36Å; N516-L519 WeakPolarHBondContact O-CB 3.37Å; N516-L519 PolarHBondContact O-N 3.23Å; K517-L519 VanDerWaalsContact C-N 3.33Å; K517-L519 PolarHBondContact O-N 2.76Å; L519-K523 VanDerWaalsContact O-CG 3.3Å; L519-K523 WeakPolarHBondContact O-CG 3.4Å; L519-K523 PolarHBondContact O-N 3.34Å
520	N	78.5	Confident	75.9	Confident	87 Å²	87	78.9 Å²	78.9	47%	0.465	39%	0.394	S	S	.	.	H	α-helix	trans	-75.9	-41.1	-179.1	-71.4	-14.9	0	0	0	111.8	N516 K517 N518 F522 K523 E524	N516-N520 PolarHBondContact O-N 3.09Å; K517-N520 PolarHBondContact O-N 3.05Å; N518-N520 VanDerWaalsContact C-N 3.33Å; N518-N520 PolarHBondContact O-N 3.35Å; N520-F522 VanDerWaalsContact C-N 3.29Å; N520-F522 PolarHBondContact O-N 2.84Å; N520-K523 WeakPolarHBondContact O-CB 3.3Å; N520-K523 PolarHBondContact O-N 2.8Å; N520-K523 PolarHBondContact OD1-NZ 2.96Å; N520-E524 PolarHBondContact O-N 3.33Å
521	L	77.3	Confident	74.3	Confident	103 Å²	103	83.3 Å²	83.3	54%	0.539	41%	0.413	S	S	.	.	H	α-helix	trans	-58.1	-42.1	170.2	-69.9	169.8	0	0	0	111.5	K517 E524 T525	K517-L521 WeakPolarHBondContact O-CG 3.4Å; K517-L521 PolarHBondContact O-N 2.84Å; L521-E524 PolarHBondContact O-N 3.23Å; L521-T525 PolarHBondContact O-N 3.14Å; L521-T525 PolarHBondContact O-OG1 2.95Å
522	F	72.7	Confident	72.6	Confident	67 Å²	67	82.4 Å²	82.4	29%	0.294	41%	0.413	S	S	.	.	H	α-helix	trans	-61.7	-45.7	175.9	-174.3	-111.7	0	0	0	111.8	N518 N520 E524 T525 I526 T548 I561	N518-F522 VanDerWaalsContact O-CB 3.26Å; N518-F522 WeakPolarHBondContact O-CB 3.37Å; N518-F522 PolarHBondContact O-N 3.46Å; N520-F522 VanDerWaalsContact C-N 3.29Å; N520-F522 PolarHBondContact O-N 2.84Å; F522-E524 VanDerWaalsContact C-N 3.35Å; F522-E524 PolarHBondContact O-N 3.32Å; F522-T525 WeakPolarHBondContact CA-OG1 3.25Å; F522-T525 PolarHBondContact O-N 3.45Å; F522-T525 PolarHBondContact O-OG1 3.41Å; F522-I526 HydrophobicContact CD1-CD1 3.72Å; F522-I526 HydrophobicContact CE1-CD1 3.58Å; F522-I526 HydrophobicContact CE2-CD1 4.44Å; F522-I526 HydrophobicContact CG-CD1 4.23Å; F522-I526 HydrophobicContact CZ-CD1 3.96Å; F522-I526 WeakPolarHBondContact O-CD1 3.45Å; F522-I526 VanDerWaalsContact O-CG1 3.24Å; F522-I526 WeakPolarHBondContact O-CG1 3.18Å; F522-I526 PolarHBondContact O-N 3.41Å; F522-I526 VanDerWaalsContact O-N 3.14Å; F522-T548 HydrophobicContact CZ-CG2 4.16Å; F522-I561 HydrophobicContact CD2-CG2 4.08Å; F522-I561 HydrophobicContact CE2-CG2 3.85Å
523	K	74.5	Confident	70.3	Confident	117 Å²	117	87.8 Å²	87.8	51%	0.509	44%	0.435	S	S	.	.	H	α-helix	trans	-58.4	-44.4	172.8	-68.9	166	-163.8	164.2	0	112.2	L519 N520 I526 A527	L519-K523 VanDerWaalsContact O-CG 3.3Å; L519-K523 WeakPolarHBondContact O-CG 3.4Å; L519-K523 PolarHBondContact O-N 3.34Å; N520-K523 WeakPolarHBondContact O-CB 3.3Å; N520-K523 PolarHBondContact O-N 2.8Å; N520-K523 PolarHBondContact OD1-NZ 2.96Å; K523-I526 PolarHBondContact O-N 3.44Å; K523-I526 VanDerWaalsContact O-N 3.14Å; K523-A527 PolarHBondContact O-N 3.36Å
524	E	74	Confident	68.1	Low	95 Å²	95	85.4 Å²	85.4	44%	0.444	44%	0.441	S	S	.	.	H	α-helix	trans	-63.2	-42.6	-179.5	-165.9	-167.4	139.2	0	0	111.7	N520 L521 F522 I526 A527 K528	N520-E524 PolarHBondContact O-N 3.33Å; L521-E524 PolarHBondContact O-N 3.23Å; F522-E524 VanDerWaalsContact C-N 3.35Å; F522-E524 PolarHBondContact O-N 3.32Å; E524-I526 VanDerWaalsContact C-N 3.26Å; E524-I526 PolarHBondContact O-N 2.82Å; E524-A527 PolarHBondContact O-N 3.3Å; E524-K528 HydrophobicContact CG-CD 4.49Å; E524-K528 PolarHBondContact O-N 3.42Å; E524-K528 VanDerWaalsContact O-N 3.08Å; E524-K528 WeakPolarHBondContact OE1-CE 3.48Å; E524-K528 IonicContact OE1-NZ 3.67Å; E524-K528 PolarHBondContact OE1-NZ 2.97Å
525	T	66.5	Low	65.8	Low	42 Å²	42	89.9 Å²	89.9	26%	0.258	46%	0.461	S	S	.	.	H	α-helix	trans	-63.3	-31.3	173.7	51.8	0	0	0	0	113	L521 F522 I529	L521-T525 PolarHBondContact O-N 3.14Å; L521-T525 PolarHBondContact O-OG1 2.95Å; F522-T525 WeakPolarHBondContact CA-OG1 3.25Å; F522-T525 PolarHBondContact O-N 3.45Å; F522-T525 PolarHBondContact O-OG1 3.41Å; T525-I529 VanDerWaalsContact O-CD1 3.3Å; T525-I529 WeakPolarHBondContact O-CD1 3.22Å; T525-I529 VanDerWaalsContact O-CG1 3.28Å; T525-I529 WeakPolarHBondContact O-CG1 3.27Å
526	I	65	Low	63.5	Low	43 Å²	43	96.9 Å²	96.9	22%	0.221	50%	0.499	C	S	.	.	H	α-helix	trans	-75.6	-31.1	176.2	-63.2	160.2	0	0	0	111.6	F522 K523 E524 T548	F522-I526 HydrophobicContact CD1-CD1 3.72Å; F522-I526 HydrophobicContact CE1-CD1 3.58Å; F522-I526 HydrophobicContact CE2-CD1 4.44Å; F522-I526 HydrophobicContact CG-CD1 4.23Å; F522-I526 HydrophobicContact CZ-CD1 3.96Å; F522-I526 WeakPolarHBondContact O-CD1 3.45Å; F522-I526 VanDerWaalsContact O-CG1 3.24Å; F522-I526 WeakPolarHBondContact O-CG1 3.18Å; F522-I526 PolarHBondContact O-N 3.41Å; F522-I526 VanDerWaalsContact O-N 3.14Å; K523-I526 PolarHBondContact O-N 3.44Å; K523-I526 VanDerWaalsContact O-N 3.14Å; E524-I526 VanDerWaalsContact C-N 3.26Å; E524-I526 PolarHBondContact O-N 2.82Å; I526-T548 HydrophobicContact CD1-CG2 3.44Å; I526-T548 VanDerWaalsContact CD1-CG2 3.44Å; I526-T548 HydrophobicContact CG1-CG2 3.58Å; I526-T548 HydrophobicContact CG2-CG2 4.46Å
527	A	64.9	Low	61.2	Low	46 Å²	46	98.3 Å²	98.3	38%	0.38	51%	0.514	S	S	.	.	H	α-helix	trans	-68.1	-51.4	175.3	0	0	0	0	0	111	K523 E524 I529 K530	K523-A527 PolarHBondContact O-N 3.36Å; E524-A527 PolarHBondContact O-N 3.3Å; A527-I529 PolarHBondContact O-N 3.27Å; A527-K530 WeakPolarHBondContact O-CB 3.35Å; A527-K530 PolarHBondContact O-N 2.95Å
528	K	66.9	Low	59	Low	110 Å²	110	97.3 Å²	97.3	48%	0.478	52%	0.523	S	S	.	.	H	α-helix	trans	-58.2	-43.1	-176.7	-73.8	172.9	170.9	172.2	0	113.3	E524 K530 E531	E524-K528 HydrophobicContact CG-CD 4.49Å; E524-K528 PolarHBondContact O-N 3.42Å; E524-K528 VanDerWaalsContact O-N 3.08Å; E524-K528 WeakPolarHBondContact OE1-CE 3.48Å; E524-K528 IonicContact OE1-NZ 3.67Å; E524-K528 PolarHBondContact OE1-NZ 2.97Å; K528-K530 PolarHBondContact O-N 2.92Å; K528-E531 WeakPolarHBondContact O-CB 3.34Å; K528-E531 PolarHBondContact O-N 3.41Å
529	I	58.3	Low	57	Low	43 Å²	43	102.5 Å²	102.5	22%	0.221	55%	0.549	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-8.5	-179.5	-45.4	159.4	0	0	0	112	T525 A527 P549	T525-I529 VanDerWaalsContact O-CD1 3.3Å; T525-I529 WeakPolarHBondContact O-CD1 3.22Å; T525-I529 VanDerWaalsContact O-CG1 3.28Å; T525-I529 WeakPolarHBondContact O-CG1 3.27Å; A527-I529 PolarHBondContact O-N 3.27Å; I529-P549 HydrophobicContact CB-CB 4.44Å; I529-P549 HydrophobicContact CB-CG 3.45Å; I529-P549 VanDerWaalsContact CB-CG 3.45Å; I529-P549 HydrophobicContact CD1-CG 4.06Å; I529-P549 HydrophobicContact CG1-CG 4.37Å; I529-P549 HydrophobicContact CG2-CB 3.73Å; I529-P549 HydrophobicContact CG2-CG 3.28Å
530	K	54.5	Low	55	Low	163 Å²	163	105.8 Å²	105.8	71%	0.709	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-13.3	166.6	-79.2	-176	162.4	-153.9	0	113.7	A527 K528	A527-K530 WeakPolarHBondContact O-CB 3.35Å; A527-K530 PolarHBondContact O-N 2.95Å; K528-K530 PolarHBondContact O-N 2.92Å
531	E	52.5	Low	52.8	Low	160 Å²	160	107.7 Å²	107.7	75%	0.748	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-14.6	179.7	-64.7	167.1	169.7	0	0	111.3	K528	K528-E531 WeakPolarHBondContact O-CB 3.34Å; K528-E531 PolarHBondContact O-N 3.41Å
532	D	49.6	Very low	50.7	Low	135 Å²	135	110.8 Å²	110.8	72%	0.722	59%	0.594	S	S	*	*	S	Bend	trans	-93.7	-10.9	-178.9	-76.5	-28.6	0	0	0	114.9
533	E	41.1	Very low	48.8	Very low	141 Å²	141	113 Å²	113	66%	0.659	62%	0.617	S	S	*	*			trans	-107	101.7	-177.2	-73.3	-176.8	172.2	0	0	111.8
534	G	38.1	Very low	46.7	Very low	63 Å²	63	115.4 Å²	115.4	65%	0.649	62%	0.624	S	S	*	*			trans	-114.5	139	178.6	0	0	0	0	0	114.4	D536	G534-D536 PolarHBondContact O-N 2.55Å
535	D	35.1	Very low	44.7	Very low	164 Å²	164	117.6 Å²	117.6	88%	0.877	63%	0.634	S	S	*	*	S	Bend	trans	46.1	42.6	153.3	-62.2	-10.2	0	0	0	120.5
536	D	37.7	Very low	42.9	Very low	156 Å²	156	118.4 Å²	118.4	83%	0.834	65%	0.651	S	S	*	*			trans	-123.3	55.5	165.4	-141.5	-15.5	0	0	0	111.7	G534 S538	G534-D536 PolarHBondContact O-N 2.55Å; D536-S538 PolarHBondContact O-N 3.03Å
537	S	33.5	Very low	41.8	Very low	93 Å²	93	122.5 Å²	122.5	65%	0.65	67%	0.667	S	S	*	*			trans	-99.7	28.5	-153.3	56.1	0	0	0	0	116.5
538	S	39.7	Very low	40.8	Very low	104 Å²	104	122.7 Å²	122.7	73%	0.727	66%	0.663	S	S	*	*	S	Bend	trans	-122	-5.2	-170.2	-68.7	0	0	0	0	117.9	D536	D536-S538 PolarHBondContact O-N 3.03Å
539	L	37.5	Very low	39.5	Very low	177 Å²	177	119.1 Å²	119.1	93%	0.927	65%	0.651	S	S	*	*	S	Bend	trans	-122.1	15.1	-177.5	-86.3	169.5	0	0	0	115.2
540	L	38.4	Very low	39	Very low	112 Å²	112	122 Å²	122	59%	0.586	66%	0.662	S	S	*	*			trans	-130.3	24.1	-166.1	-133.2	155.2	0	0	0	114.7	Y544	L540-Y544 HydrophobicContact CD2-CE2 3.93Å; L540-Y544 WeakPolarHBondContact O-CD2 3.25Å; L540-Y544 WeakPolarHBondContact O-CE2 3.3Å
541	N	31.3	Very low	39.1	Very low	128 Å²	128	116.8 Å²	116.8	68%	0.684	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.9	-13.8	-167.8	-80	-34.4	0	0	0	117	C543	N541-C543 PolarHBondContact O-N 3.45Å
542	D	33.5	Very low	39.5	Very low	168 Å²	168	115 Å²	115	90%	0.898	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.5	11.1	-175.3	-73.8	-35.8	0	0	0	115.5
543	C	32.8	Very low	40.9	Very low	114 Å²	114	108.8 Å²	108.8	77%	0.77	60%	0.596	S	S	*	*			trans	-141.3	37.1	-172	-88.6	0	0	0	0	116.1	N541	N541-C543 PolarHBondContact O-N 3.45Å
544	Y	29.3	Very low	42	Very low	167 Å²	167	104.5 Å²	104.5	66%	0.655	59%	0.589	S	S	*	*			trans	-106.9	96.2	-178.3	-93.2	-89.8	0	0	0	116.2	L540	L540-Y544 HydrophobicContact CD2-CE2 3.93Å; L540-Y544 WeakPolarHBondContact O-CD2 3.25Å; L540-Y544 WeakPolarHBondContact O-CE2 3.3Å
545	E	32.4	Very low	43.5	Very low	141 Å²	141	104.2 Å²	104.2	66%	0.659	57%	0.572	S	S	*	*			trans	-133.5	95	145.4	-98.8	-149.1	155.1	0	0	109	R484	R484-E545 IonicContact CZ-OE2 3.8Å; R484-E545 IonicContact NH2-OE1 3.68Å; R484-E545 IonicContact NH2-OE2 3.84Å; R484-E545 PolarHBondContact NH2-OE2 3.19Å
546	G	29.9	Very low	45.1	Very low	59 Å²	59	97.3 Å²	97.3	61%	0.608	54%	0.537	S	S	*	.			trans	-68.1	152.1	-156.9	0	0	0	0	0	118.4
547	K	40.4	Very low	46.8	Very low	129 Å²	129	96.7 Å²	96.7	56%	0.561	53%	0.527	S	S	*	.			trans	-164.2	106.2	152.3	-96	129.5	-167.8	154.2	0	110.3	K550	K547-K550 WeakPolarHBondContact O-CE 3.29Å
548	T	44.5	Very low	48.5	Very low	50 Å²	50	94.8 Å²	94.8	31%	0.307	51%	0.507	S	S	.	.			trans	60	136.5	169.2	68.8	0	0	0	0	115.3	F522 I526 K550	F522-T548 HydrophobicContact CZ-CG2 4.16Å; I526-T548 HydrophobicContact CD1-CG2 3.44Å; I526-T548 VanDerWaalsContact CD1-CG2 3.44Å; I526-T548 HydrophobicContact CG1-CG2 3.58Å; I526-T548 HydrophobicContact CG2-CG2 4.46Å; T548-K550 VanDerWaalsContact C-N 3.29Å; T548-K550 PolarHBondContact O-N 2.83Å; T548-K550 WeakPolarHBondContact OG1-CE 3.32Å; T548-K550 WeakPolarHBondContact OG1-CG 3.4Å
549	P	38.8	Very low	49.7	Very low	35 Å²	35	93.6 Å²	93.6	23%	0.227	50%	0.496	C	S	.	.			trans	-68.1	90.2	170.9	26.9	-31.1	0	0	0	109.5	I529 I551	I529-P549 HydrophobicContact CB-CB 4.44Å; I529-P549 HydrophobicContact CB-CG 3.45Å; I529-P549 VanDerWaalsContact CB-CG 3.45Å; I529-P549 HydrophobicContact CD1-CG 4.06Å; I529-P549 HydrophobicContact CG1-CG 4.37Å; I529-P549 HydrophobicContact CG2-CB 3.73Å; I529-P549 HydrophobicContact CG2-CG 3.28Å; P549-I551 PolarHBondContact O-N 3.5Å
550	K	48.4	Very low	51.6	Low	104 Å²	104	86.5 Å²	86.5	45%	0.452	46%	0.457	S	S	.	.			trans	-83	107.9	-179.8	-72.2	171.4	-173.7	174.7	0	108	K547 T548 Y552 T559	K547-K550 WeakPolarHBondContact O-CE 3.29Å; T548-K550 VanDerWaalsContact C-N 3.29Å; T548-K550 PolarHBondContact O-N 2.83Å; T548-K550 WeakPolarHBondContact OG1-CE 3.32Å; T548-K550 WeakPolarHBondContact OG1-CG 3.4Å; K550-Y552 PolarHBondContact O-N 3.44Å; K550-T559 HydrophobicContact CB-CG2 4.05Å; K550-T559 HydrophobicContact CD-CG2 4.18Å
551	I	56.1	Low	53	Low	53 Å²	53	85.5 Å²	85.5	27%	0.272	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	116.5	174.2	-52.4	172.2	0	0	0	106.8	P549 F560 K563 Y566	P549-I551 PolarHBondContact O-N 3.5Å; I551-F560 HydrophobicContact CB-CB 4.45Å; I551-F560 PolarHBondContact N-O 2.85Å; I551-F560 VanDerWaalsContact N-O 3.16Å; I551-F560 WeakPolarHBondContact O-CD2 3.24Å; I551-F560 PolarHBondContact O-N 3.16Å; I551-K563 VanDerWaalsContact CD1-CA 3.46Å; I551-K563 HydrophobicContact CD1-CB 3.86Å; I551-K563 HydrophobicContact CD1-CG 4.45Å; I551-Y566 HydrophobicContact CB-CD2 4.38Å; I551-Y566 HydrophobicContact CB-CG 4.3Å; I551-Y566 HydrophobicContact CG2-CD1 3.72Å; I551-Y566 HydrophobicContact CG2-CD2 3.55Å; I551-Y566 HydrophobicContact CG2-CE1 3.97Å; I551-Y566 HydrophobicContact CG2-CE2 3.81Å; I551-Y566 HydrophobicContact CG2-CG 3.48Å; I551-Y566 VanDerWaalsContact CG2-CG 3.48Å
552	Y	62.6	Low	54.5	Low	123 Å²	123	82.2 Å²	82.2	48%	0.482	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	123.8	-168.6	173.9	-117.2	0	0	0	110.3	K550 G554 K557 T559	K550-Y552 PolarHBondContact O-N 3.44Å; Y552-G554 PolarHBondContact O-N 2.83Å; Y552-K557 HydrophobicContact CE2-CB 4.27Å; Y552-T559 HydrophobicContact CD2-CG2 3.72Å; Y552-T559 HydrophobicContact CE2-CG2 4.5Å
553	C	76.9	Confident	56.4	Low	3 Å²	3	81.4 Å²	81.4	2%	0.02	42%	0.423	C	S	.	.			trans	-81.8	98.3	169.5	-175.2	0	0	0	0	109.6	I555 C556 K557 E558 F560 Y566 H569 H575	C553-I555 PolarHBondContact O-N 3.5Å; C553-C556 HydrophobicContact CB-CB 4.15Å; C553-C556 PolarHBondContact O-N 3.28Å; C553-C556 VanDerWaalsContact O-N 3.09Å; C553-C556 PolarHBondContact SG-N 3.45Å; C553-C556 VanDerWaalsContact SG-N 3.41Å; C553-K557 WeakPolarHBondContact O-CA 3.34Å; C553-K557 PolarHBondContact O-N 2.82Å; C553-E558 PolarHBondContact N-O 2.83Å; C553-F560 HydrophobicContact CB-CE2 3.95Å; C553-Y566 HydrophobicContact CB-CE2 4.26Å; C553-H569 WeakPolarHBondContact CB-NE2 3.4Å; C553-H569 PolarHBondContact SG-NE2 3.47Å; C553-H575 PolarHBondContact SG-CE1 3.39Å; C553-H575 PolarHBondContact SG-ND1 2.99Å; C553-H575 VanDerWaalsContact SG-ND1 3.41Å
554	G	64.5	Low	58.3	Low	51 Å²	51	79.7 Å²	79.7	53%	0.526	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-23.7	176.8	0	0	0	0	0	114.7	Y552	Y552-G554 PolarHBondContact O-N 2.83Å
555	I	70.6	Confident	60.2	Low	57 Å²	57	78 Å²	78	29%	0.292	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-44.5	177.5	-50.3	179.9	0	0	0	111.3	C553 N578 T579	C553-I555 PolarHBondContact O-N 3.5Å; I555-N578 HydrophobicContact CG2-CB 3.8Å; I555-N578 WeakPolarHBondContact CG2-O 3.44Å; I555-T579 HydrophobicContact CD1-CG2 4.18Å
556	C	67.8	Low	62.3	Low	19 Å²	19	74.3 Å²	74.3	13%	0.128	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	-13	-174.2	-58.6	0	0	0	0	114.3	C553 E558 H569 N578	C553-C556 HydrophobicContact CB-CB 4.15Å; C553-C556 PolarHBondContact O-N 3.28Å; C553-C556 VanDerWaalsContact O-N 3.09Å; C553-C556 PolarHBondContact SG-N 3.45Å; C553-C556 VanDerWaalsContact SG-N 3.41Å; C556-E558 HydrophobicContact CB-CB 4.43Å; C556-E558 HydrophobicContact CB-CG 4.23Å; C556-E558 PolarHBondContact O-N 2.87Å; C556-H569 VanDerWaalsContact CB-CE1 3.5Å; C556-H569 WeakPolarHBondContact CB-CE1 3.23Å; C556-H569 PolarHBondContact SG-CE1 3.45Å; C556-H569 PolarHBondContact SG-NE2 3.39Å; C556-H569 VanDerWaalsContact SG-NE2 3.37Å; C556-N578 VanDerWaalsContact SG-CB 3.53Å; C556-N578 PolarHBondContact SG-ND2 3.39Å
557	K	73.3	Confident	64.3	Low	144 Å²	144	76 Å²	76	63%	0.626	38%	0.375	S	S	*	.			trans	61.2	12	-171.6	-50	-177.5	-177.8	173.2	0	115.3	Y552 C553	Y552-K557 HydrophobicContact CE2-CB 4.27Å; C553-K557 WeakPolarHBondContact O-CA 3.34Å; C553-K557 PolarHBondContact O-N 2.82Å
558	E	69.7	Low	66.1	Low	53 Å²	53	73.5 Å²	73.5	25%	0.248	37%	0.365	C	S	.	.			trans	-81.8	144.5	175.1	-66.3	175.5	173.5	0	0	110.1	C553 C556 F560 H569 R574	C553-E558 PolarHBondContact N-O 2.83Å; C556-E558 HydrophobicContact CB-CB 4.43Å; C556-E558 HydrophobicContact CB-CG 4.23Å; C556-E558 PolarHBondContact O-N 2.87Å; E558-F560 HydrophobicContact CB-CE1 4.39Å; E558-F560 HydrophobicContact CB-CE2 3.6Å; E558-F560 HydrophobicContact CB-CZ 3.37Å; E558-F560 HydrophobicContact CG-CZ 4.43Å; E558-F560 WeakPolarHBondContact O-CE2 3.47Å; E558-F560 WeakPolarHBondContact OE2-CZ 3.44Å; E558-H569 IonicContact OE2-CE1 3.05Å; E558-H569 PolarHBondContact OE2-CE1 2.83Å; E558-H569 IonicContact OE2-ND1 3.65Å; E558-H569 PolarHBondContact OE2-ND1 2.86Å; E558-R574 WeakPolarHBondContact OE1-CD 3.5Å; E558-R574 IonicContact OE1-CZ 3.93Å; E558-R574 IonicContact OE1-NE 2.97Å; E558-R574 IonicContact OE1-NH1 2.92Å; E558-R574 PolarHBondContact OE1-NH1 2.85Å
559	T	65.6	Low	67.8	Low	79 Å²	79	71.4 Å²	71.4	49%	0.485	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	132.1	178.5	42.4	0	0	0	0	110.5	K550 Y552	K550-T559 HydrophobicContact CB-CG2 4.05Å; K550-T559 HydrophobicContact CD-CG2 4.18Å; Y552-T559 HydrophobicContact CD2-CG2 3.72Å; Y552-T559 HydrophobicContact CE2-CG2 4.5Å
560	F	77.6	Confident	69.5	Low	27 Å²	27	72.6 Å²	72.6	12%	0.118	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	136.2	-171.7	-61.4	-78.5	0	0	0	112	I551 C553 E558 R565 Y566 H569	I551-F560 HydrophobicContact CB-CB 4.45Å; I551-F560 PolarHBondContact N-O 2.85Å; I551-F560 VanDerWaalsContact N-O 3.16Å; I551-F560 WeakPolarHBondContact O-CD2 3.24Å; I551-F560 PolarHBondContact O-N 3.16Å; C553-F560 HydrophobicContact CB-CE2 3.95Å; E558-F560 HydrophobicContact CB-CE1 4.39Å; E558-F560 HydrophobicContact CB-CE2 3.6Å; E558-F560 HydrophobicContact CB-CZ 3.37Å; E558-F560 HydrophobicContact CG-CZ 4.43Å; E558-F560 WeakPolarHBondContact O-CE2 3.47Å; E558-F560 WeakPolarHBondContact OE2-CZ 3.44Å; F560-R565 HydrophobicContact CD1-CB 4.17Å; F560-Y566 AromaticContact CD2-CD2 3.72Å; F560-Y566 HydrophobicContact CD2-CD2 3.72Å; F560-Y566 HydrophobicContact CE2-CD2 4.31Å; F560-Y566 HydrophobicContact CG-CD2 4.33Å; F560-H569 HydrophobicContact CD1-CB 4.22Å; F560-H569 HydrophobicContact CE1-CB 3.58Å; F560-H569 AromaticContact CE1-CG 3.82Å; F560-H569 AromaticContact CE1-ND1 3.96Å; F560-H569 HydrophobicContact CE2-CB 4.07Å; F560-H569 AromaticContact CE2-CD2 3.73Å; F560-H569 AromaticContact CE2-CG 3.65Å; F560-H569 AromaticContact CE2-ND1 3.94Å; F560-H569 HydrophobicContact CZ-CB 3.51Å; F560-H569 AromaticContact CZ-CD2 3.77Å; F560-H569 AromaticContact CZ-CE1 3.75Å; F560-H569 AromaticContact CZ-CG 3.19Å; F560-H569 AromaticContact CZ-ND1 3.21Å; F560-H569 WeakPolarHBondContact CZ-ND1 3.39Å
561	I	66.6	Low	70.8	Confident	92 Å²	92	75.8 Å²	75.8	47%	0.472	37%	0.37	S	S	.	.	S	Bend	trans	-76.2	-24.9	-177.4	-60.7	169.2	0	0	0	111.7	F522	F522-I561 HydrophobicContact CD2-CG2 4.08Å; F522-I561 HydrophobicContact CE2-CG2 3.85Å
562	N	63.8	Low	71.4	Confident	59 Å²	59	79.5 Å²	79.5	32%	0.316	38%	0.384	S	S	.	.	S	Bend	trans	-147.8	148	-174.8	-170.2	-30.2	0	0	0	110.5	T564 R565 Y566	N562-T564 VanDerWaalsContact CG-OG1 3.22Å; N562-T564 PolarHBondContact O-N 3.31Å; N562-T564 PolarHBondContact OD1-N 3.38Å; N562-T564 VanDerWaalsContact OD1-N 3.08Å; N562-T564 PolarHBondContact OD1-OG1 3.18Å; N562-R565 PolarHBondContact O-N 2.71Å; N562-R565 VanDerWaalsContact O-N 3.11Å; N562-Y566 PolarHBondContact O-N 3.39Å
563	K	72.8	Confident	71.3	Confident	151 Å²	151	79.3 Å²	79.3	66%	0.657	38%	0.383	S	S	*	.	H	α-helix	trans	-52.7	-33.9	171.8	-168.9	171.2	-177	171.6	0	112.3	I551 Y566 M567	I551-K563 VanDerWaalsContact CD1-CA 3.46Å; I551-K563 HydrophobicContact CD1-CB 3.86Å; I551-K563 HydrophobicContact CD1-CG 4.45Å; K563-Y566 PolarHBondContact O-N 3.37Å; K563-M567 HydrophobicContact CG-CG 4.48Å; K563-M567 WeakPolarHBondContact O-CB 3.38Å; K563-M567 WeakPolarHBondContact O-CG 3.2Å; K563-M567 PolarHBondContact O-N 2.92Å
564	T	73	Confident	70.2	Confident	78 Å²	78	86 Å²	86	48%	0.479	41%	0.408	S	S	.	.	H	α-helix	trans	-61	-53.7	173.1	53.5	0	0	0	0	112.1	N562 Y566 M567 E568	N562-T564 VanDerWaalsContact CG-OG1 3.22Å; N562-T564 PolarHBondContact O-N 3.31Å; N562-T564 PolarHBondContact OD1-N 3.38Å; N562-T564 VanDerWaalsContact OD1-N 3.08Å; N562-T564 PolarHBondContact OD1-OG1 3.18Å; T564-Y566 VanDerWaalsContact C-N 3.27Å; T564-Y566 PolarHBondContact O-N 2.84Å; T564-M567 CarbonylContact O-C 3.6Å; T564-M567 PolarHBondContact O-N 2.85Å; T564-M567 VanDerWaalsContact O-N 3.13Å; T564-E568 WeakPolarHBondContact O-CG 3.03Å; T564-E568 PolarHBondContact O-N 2.95Å
565	R	69	Low	70.4	Confident	132 Å²	132	84.5 Å²	84.5	50%	0.498	39%	0.387	S	S	.	.	H	α-helix	trans	-62.1	-32.3	176.9	-69.6	-54.1	-148.3	-174.8	6	113	F560 N562 E568 H569	F560-R565 HydrophobicContact CD1-CB 4.17Å; N562-R565 PolarHBondContact O-N 2.71Å; N562-R565 VanDerWaalsContact O-N 3.11Å; R565-E568 WeakPolarHBondContact CD-OE2 3.29Å; R565-E568 IonicContact CZ-OE2 4Å; R565-E568 IonicContact NE-OE2 2.77Å; R565-E568 IonicContact NH1-OE1 3.36Å; R565-E568 IonicContact NH1-OE2 3.99Å; R565-E568 PolarHBondContact NH1-OE2 3.44Å; R565-H569 WeakPolarHBondContact O-CB 3.13Å; R565-H569 PolarHBondContact O-N 3.24Å
566	Y	75.7	Confident	70.3	Confident	62 Å²	62	88 Å²	88	24%	0.243	40%	0.4	C	S	.	.	H	α-helix	trans	-67.3	-47	171.4	-178.8	-110.6	0	0	0	112.1	I551 C553 F560 N562 K563 T564 E568 H569 L570	I551-Y566 HydrophobicContact CB-CD2 4.38Å; I551-Y566 HydrophobicContact CB-CG 4.3Å; I551-Y566 HydrophobicContact CG2-CD1 3.72Å; I551-Y566 HydrophobicContact CG2-CD2 3.55Å; I551-Y566 HydrophobicContact CG2-CE1 3.97Å; I551-Y566 HydrophobicContact CG2-CE2 3.81Å; I551-Y566 HydrophobicContact CG2-CG 3.48Å; I551-Y566 VanDerWaalsContact CG2-CG 3.48Å; C553-Y566 HydrophobicContact CB-CE2 4.26Å; F560-Y566 AromaticContact CD2-CD2 3.72Å; F560-Y566 HydrophobicContact CD2-CD2 3.72Å; F560-Y566 HydrophobicContact CE2-CD2 4.31Å; F560-Y566 HydrophobicContact CG-CD2 4.33Å; N562-Y566 PolarHBondContact O-N 3.39Å; K563-Y566 PolarHBondContact O-N 3.37Å; T564-Y566 VanDerWaalsContact C-N 3.27Å; T564-Y566 PolarHBondContact O-N 2.84Å; Y566-E568 VanDerWaalsContact C-N 3.27Å; Y566-E568 PolarHBondContact O-N 2.82Å; Y566-H569 WeakPolarHBondContact O-CA 3.29Å; Y566-H569 WeakPolarHBondContact O-CB 3.44Å; Y566-H569 PolarHBondContact O-N 2.93Å; Y566-H569 VanDerWaalsContact O-N 3.11Å; Y566-L570 HydrophobicContact CD1-CD1 4.23Å; Y566-L570 HydrophobicContact CD1-CG 4.46Å; Y566-L570 HydrophobicContact CE1-CD1 3.81Å; Y566-L570 HydrophobicContact CE1-CD2 4.37Å; Y566-L570 HydrophobicContact CE1-CG 4.21Å; Y566-L570 HydrophobicContact CE2-CD2 4.18Å; Y566-L570 WeakPolarHBondContact O-CG 3.18Å; Y566-L570 PolarHBondContact O-N 3.33Å
567	M	72.8	Confident	69.5	Low	96 Å²	96	90.1 Å²	90.1	47%	0.473	41%	0.412	S	S	.	.	H	α-helix	trans	-68.3	-24.2	177.4	-67.8	-63.1	-69.4	0	0	113.3	K563 T564 L570 K571	K563-M567 HydrophobicContact CG-CG 4.48Å; K563-M567 WeakPolarHBondContact O-CB 3.38Å; K563-M567 WeakPolarHBondContact O-CG 3.2Å; K563-M567 PolarHBondContact O-N 2.92Å; T564-M567 CarbonylContact O-C 3.6Å; T564-M567 PolarHBondContact O-N 2.85Å; T564-M567 VanDerWaalsContact O-N 3.13Å; M567-L570 HydrophobicContact SD-CD1 3.98Å; M567-K571 WeakPolarHBondContact O-CG 3.27Å
568	E	77.7	Confident	68.6	Low	75 Å²	75	83.8 Å²	83.8	35%	0.35	39%	0.385	S	S	.	.	H	α-helix	trans	-69.3	-53.3	164.2	-73	168.1	-165	0	0	110.4	T564 R565 Y566 L570 K571 F572	T564-E568 WeakPolarHBondContact O-CG 3.03Å; T564-E568 PolarHBondContact O-N 2.95Å; R565-E568 WeakPolarHBondContact CD-OE2 3.29Å; R565-E568 IonicContact CZ-OE2 4Å; R565-E568 IonicContact NE-OE2 2.77Å; R565-E568 IonicContact NH1-OE1 3.36Å; R565-E568 IonicContact NH1-OE2 3.99Å; R565-E568 PolarHBondContact NH1-OE2 3.44Å; Y566-E568 VanDerWaalsContact C-N 3.27Å; Y566-E568 PolarHBondContact O-N 2.82Å; E568-L570 VanDerWaalsContact C-N 3.31Å; E568-L570 PolarHBondContact O-N 2.94Å; E568-K571 WeakPolarHBondContact O-CA 3.3Å; E568-K571 WeakPolarHBondContact O-CB 3.49Å; E568-K571 PolarHBondContact O-N 2.87Å; E568-F572 HydrophobicContact CB-CE2 4.23Å; E568-F572 VanDerWaalsContact O-CD2 3.27Å; E568-F572 WeakPolarHBondContact O-CD2 3.42Å; E568-F572 PolarHBondContact O-N 3.22Å
569	H	80.2	Confident	68.2	Low	7 Å²	7	82.8 Å²	82.8	3%	0.032	38%	0.383	C	S	.	.	H	α-helix	trans	-49.4	-47.7	177.8	169.6	81.2	0	0	0	112.7	C553 C556 E558 F560 R565 Y566 K571 F572 H575	C553-H569 WeakPolarHBondContact CB-NE2 3.4Å; C553-H569 PolarHBondContact SG-NE2 3.47Å; C556-H569 VanDerWaalsContact CB-CE1 3.5Å; C556-H569 WeakPolarHBondContact CB-CE1 3.23Å; C556-H569 PolarHBondContact SG-CE1 3.45Å; C556-H569 PolarHBondContact SG-NE2 3.39Å; C556-H569 VanDerWaalsContact SG-NE2 3.37Å; E558-H569 IonicContact OE2-CE1 3.05Å; E558-H569 PolarHBondContact OE2-CE1 2.83Å; E558-H569 IonicContact OE2-ND1 3.65Å; E558-H569 PolarHBondContact OE2-ND1 2.86Å; F560-H569 HydrophobicContact CD1-CB 4.22Å; F560-H569 HydrophobicContact CE1-CB 3.58Å; F560-H569 AromaticContact CE1-CG 3.82Å; F560-H569 AromaticContact CE1-ND1 3.96Å; F560-H569 HydrophobicContact CE2-CB 4.07Å; F560-H569 AromaticContact CE2-CD2 3.73Å; F560-H569 AromaticContact CE2-CG 3.65Å; F560-H569 AromaticContact CE2-ND1 3.94Å; F560-H569 HydrophobicContact CZ-CB 3.51Å; F560-H569 AromaticContact CZ-CD2 3.77Å; F560-H569 AromaticContact CZ-CE1 3.75Å; F560-H569 AromaticContact CZ-CG 3.19Å; F560-H569 AromaticContact CZ-ND1 3.21Å; F560-H569 WeakPolarHBondContact CZ-ND1 3.39Å; R565-H569 WeakPolarHBondContact O-CB 3.13Å; R565-H569 PolarHBondContact O-N 3.24Å; Y566-H569 WeakPolarHBondContact O-CA 3.29Å; Y566-H569 WeakPolarHBondContact O-CB 3.44Å; Y566-H569 PolarHBondContact O-N 2.93Å; Y566-H569 VanDerWaalsContact O-N 3.11Å; H569-K571 PolarHBondContact O-N 2.89Å; H569-F572 PolarHBondContact O-N 3.37Å; H569-H575 AromaticContact CD2-ND1 3.41Å; H569-H575 PolarHBondContact CD2-ND1 3.3Å; H569-H575 AromaticContact CE1-ND1 3.89Å; H569-H575 AromaticContact NE2-CE1 3.98Å; H569-H575 AromaticContact NE2-CG 3.71Å; H569-H575 AromaticContact NE2-ND1 2.95Å; H569-H575 PolarHBondContact NE2-ND1 3.43Å; H569-H575 WeakPolarHBondContact O-CB 3.38Å
570	L	75.7	Confident	67.3	Low	59 Å²	59	82.9 Å²	82.9	31%	0.309	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56	-25.2	177.3	-65.1	-176.5	0	0	0	113.6	Y566 M567 E568 H575	Y566-L570 HydrophobicContact CD1-CD1 4.23Å; Y566-L570 HydrophobicContact CD1-CG 4.46Å; Y566-L570 HydrophobicContact CE1-CD1 3.81Å; Y566-L570 HydrophobicContact CE1-CD2 4.37Å; Y566-L570 HydrophobicContact CE1-CG 4.21Å; Y566-L570 HydrophobicContact CE2-CD2 4.18Å; Y566-L570 WeakPolarHBondContact O-CG 3.18Å; Y566-L570 PolarHBondContact O-N 3.33Å; M567-L570 HydrophobicContact SD-CD1 3.98Å; E568-L570 VanDerWaalsContact C-N 3.31Å; E568-L570 PolarHBondContact O-N 2.94Å; L570-H575 WeakPolarHBondContact CD2-CE1 3.47Å; L570-H575 WeakPolarHBondContact CD2-NE2 3.37Å; L570-H575 PolarHBondContact O-CD2 3.09Å
571	K	74.3	Confident	65.9	Low	172 Å²	172	83.1 Å²	83.1	75%	0.748	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-18.1	178.3	-61.1	172	-174.2	178.5	0	113.7	M567 E568 H569	M567-K571 WeakPolarHBondContact O-CG 3.27Å; E568-K571 WeakPolarHBondContact O-CA 3.3Å; E568-K571 WeakPolarHBondContact O-CB 3.49Å; E568-K571 PolarHBondContact O-N 2.87Å; H569-K571 PolarHBondContact O-N 2.89Å
572	F	68.3	Low	65.2	Low	130 Å²	130	84.7 Å²	84.7	57%	0.57	38%	0.377	S	S	*	.	S	Bend	trans	-67.1	148.3	-178.3	-87.4	-88.8	0	0	0	112.3	E568 H569 R574 H575 K576	E568-F572 HydrophobicContact CB-CE2 4.23Å; E568-F572 VanDerWaalsContact O-CD2 3.27Å; E568-F572 WeakPolarHBondContact O-CD2 3.42Å; E568-F572 PolarHBondContact O-N 3.22Å; H569-F572 PolarHBondContact O-N 3.37Å; F572-R574 PolarHBondContact O-N 3.33Å; F572-H575 PolarHBondContact O-N 3.18Å; F572-H575 VanDerWaalsContact O-N 3.09Å; F572-K576 PolarHBondContact O-N 2.93Å; F572-K576 VanDerWaalsContact O-N 3.09Å
573	R	60.4	Low	64.7	Low	120 Å²	120	87 Å²	87	45%	0.453	39%	0.386	S	S	.	.	H	α-helix	trans	-50.8	-42	173.5	-78.2	-177.6	171.2	-179.3	-2.4	112.2	H575 K576 V577 E675	R573-H575 PolarHBondContact O-N 2.96Å; R573-K576 PolarHBondContact O-N 3.15Å; R573-V577 WeakPolarHBondContact O-CB 3.43Å; R573-V577 WeakPolarHBondContact O-CG2 3.36Å; R573-V577 PolarHBondContact O-N 3.11Å; R573-E675 IonicContact NH1-OE1 3.97Å; R573-E675 PolarHBondContact NH1-OE1 3Å; R573-E675 IonicContact NH1-OE2 2.7Å
574	R	54	Low	63.3	Low	143 Å²	143	82.1 Å²	82.1	54%	0.54	37%	0.369	S	S	.	.	H	α-helix	trans	-55.5	-48	177.5	-174.1	-177.3	-69.3	172.7	-0.2	112	E558 F572 V577 N578	E558-R574 WeakPolarHBondContact OE1-CD 3.5Å; E558-R574 IonicContact OE1-CZ 3.93Å; E558-R574 IonicContact OE1-NE 2.97Å; E558-R574 IonicContact OE1-NH1 2.92Å; E558-R574 PolarHBondContact OE1-NH1 2.85Å; F572-R574 PolarHBondContact O-N 3.33Å; R574-V577 PolarHBondContact O-N 3.06Å; R574-N578 WeakPolarHBondContact O-CB 3.34Å; R574-N578 PolarHBondContact O-N 3.39Å; R574-N578 PolarHBondContact O-ND2 2.98Å
575	H	69.8	Low	62	Low	19 Å²	19	84.3 Å²	84.3	9%	0.088	37%	0.369	C	S	.	.	H	α-helix	trans	-65.8	-44.6	176.9	-175.4	87.8	0	0	0	112.1	C553 H569 L570 F572 R573 V577 N578 T579	C553-H575 PolarHBondContact SG-CE1 3.39Å; C553-H575 PolarHBondContact SG-ND1 2.99Å; C553-H575 VanDerWaalsContact SG-ND1 3.41Å; H569-H575 AromaticContact CD2-ND1 3.41Å; H569-H575 PolarHBondContact CD2-ND1 3.3Å; H569-H575 AromaticContact CE1-ND1 3.89Å; H569-H575 AromaticContact NE2-CE1 3.98Å; H569-H575 AromaticContact NE2-CG 3.71Å; H569-H575 AromaticContact NE2-ND1 2.95Å; H569-H575 PolarHBondContact NE2-ND1 3.43Å; H569-H575 WeakPolarHBondContact O-CB 3.38Å; L570-H575 WeakPolarHBondContact CD2-CE1 3.47Å; L570-H575 WeakPolarHBondContact CD2-NE2 3.37Å; L570-H575 PolarHBondContact O-CD2 3.09Å; F572-H575 PolarHBondContact O-N 3.18Å; F572-H575 VanDerWaalsContact O-N 3.09Å; R573-H575 PolarHBondContact O-N 2.96Å; H575-V577 VanDerWaalsContact C-N 3.28Å; H575-V577 PolarHBondContact O-N 3.39Å; H575-N578 PolarHBondContact O-N 2.89Å; H575-T579 PolarHBondContact CD2-OG1 3.21Å; H575-T579 PolarHBondContact NE2-OG1 2.99Å; H575-T579 VanDerWaalsContact NE2-OG1 3.14Å; H575-T579 WeakPolarHBondContact O-CB 3.47Å; H575-T579 PolarHBondContact O-N 2.98Å; H575-T579 PolarHBondContact O-OG1 3.25Å
576	K	69	Low	61.5	Low	132 Å²	132	83.6 Å²	83.6	57%	0.574	37%	0.37	S	S	*	.	H	α-helix	trans	-62.5	-34	178.7	-168.5	171.2	-175.4	173.7	0	112.9	F572 R573 R580	F572-K576 PolarHBondContact O-N 2.93Å; F572-K576 VanDerWaalsContact O-N 3.09Å; R573-K576 PolarHBondContact O-N 3.15Å; K576-R580 WeakPolarHBondContact O-CG 3.31Å; K576-R580 PolarHBondContact O-N 3.49Å
577	V	50.2	Low	60	Low	63 Å²	63	82.7 Å²	82.7	38%	0.382	38%	0.375	S	S	.	.	H	α-helix	trans	-70.3	-49.5	171.8	167.5	0	0	0	0	110.4	R573 R574 H575 T579 R580 I581	R573-V577 WeakPolarHBondContact O-CB 3.43Å; R573-V577 WeakPolarHBondContact O-CG2 3.36Å; R573-V577 PolarHBondContact O-N 3.11Å; R574-V577 PolarHBondContact O-N 3.06Å; H575-V577 VanDerWaalsContact C-N 3.28Å; H575-V577 PolarHBondContact O-N 3.39Å; V577-T579 VanDerWaalsContact C-N 3.29Å; V577-T579 PolarHBondContact O-N 3.45Å; V577-R580 PolarHBondContact O-N 2.76Å; V577-I581 HydrophobicContact CG1-CD1 3.58Å; V577-I581 HydrophobicContact CG1-CG1 4.43Å; V577-I581 WeakPolarHBondContact O-CD1 3.36Å; V577-I581 WeakPolarHBondContact O-CG1 3.43Å; V577-I581 PolarHBondContact O-N 3.29Å
578	N	55.3	Low	58.5	Low	11 Å²	11	81.1 Å²	81.1	6%	0.059	37%	0.368	C	S	.	.	H	α-helix	trans	-63	-32.7	179.6	-70.6	-13.4	0	0	0	113.2	I555 C556 R574 H575 I581 Y582 H670	I555-N578 HydrophobicContact CG2-CB 3.8Å; I555-N578 WeakPolarHBondContact CG2-O 3.44Å; C556-N578 VanDerWaalsContact SG-CB 3.53Å; C556-N578 PolarHBondContact SG-ND2 3.39Å; R574-N578 WeakPolarHBondContact O-CB 3.34Å; R574-N578 PolarHBondContact O-N 3.39Å; R574-N578 PolarHBondContact O-ND2 2.98Å; H575-N578 PolarHBondContact O-N 2.89Å; N578-I581 WeakPolarHBondContact O-CB 3.42Å; N578-I581 PolarHBondContact O-N 2.97Å; N578-Y582 WeakPolarHBondContact O-CB 3.49Å; N578-Y582 PolarHBondContact O-N 2.81Å; N578-H670 PolarHBondContact OD1-CE1 2.86Å; N578-H670 PolarHBondContact OD1-NE2 3.06Å
579	T	60.7	Low	57	Low	31 Å²	31	83.3 Å²	83.3	19%	0.19	38%	0.377	C	S	.	.	H	α-helix	trans	-67.9	-45.9	175.6	-55.9	0	0	0	0	110.8	I555 H575 V577 I581 Y582 E583	I555-T579 HydrophobicContact CD1-CG2 4.18Å; H575-T579 PolarHBondContact CD2-OG1 3.21Å; H575-T579 PolarHBondContact NE2-OG1 2.99Å; H575-T579 VanDerWaalsContact NE2-OG1 3.14Å; H575-T579 WeakPolarHBondContact O-CB 3.47Å; H575-T579 PolarHBondContact O-N 2.98Å; H575-T579 PolarHBondContact O-OG1 3.25Å; V577-T579 VanDerWaalsContact C-N 3.29Å; V577-T579 PolarHBondContact O-N 3.45Å; T579-I581 VanDerWaalsContact C-N 3.27Å; T579-I581 PolarHBondContact O-N 3.5Å; T579-Y582 CarbonylContact O-C 3.54Å; T579-Y582 WeakPolarHBondContact O-CB 3.09Å; T579-Y582 PolarHBondContact O-N 3.06Å; T579-Y582 VanDerWaalsContact O-N 3.1Å; T579-E583 WeakPolarHBondContact O-CB 3.07Å; T579-E583 VanDerWaalsContact O-CG 3.3Å; T579-E583 WeakPolarHBondContact O-CG 3.37Å; T579-E583 PolarHBondContact O-N 3.11Å
580	R	47.3	Very low	55.6	Low	81 Å²	81	87.7 Å²	87.7	31%	0.306	40%	0.4	S	S	.	.	H	α-helix	trans	-59.8	-36.2	171.8	-74.2	170.8	165.1	-169.8	-6	113.2	K576 V577 E583 V584	K576-R580 WeakPolarHBondContact O-CG 3.31Å; K576-R580 PolarHBondContact O-N 3.49Å; V577-R580 PolarHBondContact O-N 2.76Å; R580-E583 WeakPolarHBondContact CA-OE2 3.5Å; R580-E583 PolarHBondContact O-N 3.27Å; R580-V584 WeakPolarHBondContact O-CB 3.47Å; R580-V584 VanDerWaalsContact O-CG2 3.32Å; R580-V584 WeakPolarHBondContact O-CG2 3.41Å; R580-V584 PolarHBondContact O-N 3.26Å
581	I	48	Very low	53.9	Low	33 Å²	33	90.6 Å²	90.6	17%	0.169	42%	0.416	C	S	.	.	H	α-helix	trans	-64.9	-42.8	175.1	-70.8	164.5	0	0	0	110.7	V577 N578 T579 Y585 L666	V577-I581 HydrophobicContact CG1-CD1 3.58Å; V577-I581 HydrophobicContact CG1-CG1 4.43Å; V577-I581 WeakPolarHBondContact O-CD1 3.36Å; V577-I581 WeakPolarHBondContact O-CG1 3.43Å; V577-I581 PolarHBondContact O-N 3.29Å; N578-I581 WeakPolarHBondContact O-CB 3.42Å; N578-I581 PolarHBondContact O-N 2.97Å; T579-I581 VanDerWaalsContact C-N 3.27Å; T579-I581 PolarHBondContact O-N 3.5Å; I581-Y585 WeakPolarHBondContact O-CB 3.32Å; I581-Y585 PolarHBondContact O-N 3.37Å; I581-L666 HydrophobicContact CB-CD2 4.11Å; I581-L666 HydrophobicContact CD1-CD2 3.66Å; I581-L666 HydrophobicContact CG1-CD2 3.51Å; I581-L666 HydrophobicContact CG2-CD1 3.46Å; I581-L666 VanDerWaalsContact CG2-CD1 3.46Å; I581-L666 HydrophobicContact CG2-CD2 3.53Å; I581-L666 HydrophobicContact CG2-CG 4Å
582	Y	51	Low	52.2	Low	125 Å²	125	84.8 Å²	84.8	49%	0.49	40%	0.395	S	S	.	.	H	α-helix	trans	-69.7	-37.8	176.2	-177.6	-92.2	0	0	0	112.4	N578 T579 Y585 K586	N578-Y582 WeakPolarHBondContact O-CB 3.49Å; N578-Y582 PolarHBondContact O-N 2.81Å; T579-Y582 CarbonylContact O-C 3.54Å; T579-Y582 WeakPolarHBondContact O-CB 3.09Å; T579-Y582 PolarHBondContact O-N 3.06Å; T579-Y582 VanDerWaalsContact O-N 3.1Å; Y582-Y585 PolarHBondContact O-N 2.87Å; Y582-K586 VanDerWaalsContact O-CB 3.28Å; Y582-K586 WeakPolarHBondContact O-CB 3.41Å; Y582-K586 PolarHBondContact O-N 3.05Å
583	E	53.3	Low	50.8	Low	108 Å²	108	86.5 Å²	86.5	51%	0.505	41%	0.405	S	S	.	.	H	α-helix	trans	-60	-48.5	171.5	-73.3	164.3	176.7	0	0	111.3	T579 R580 K586 A587	T579-E583 WeakPolarHBondContact O-CB 3.07Å; T579-E583 VanDerWaalsContact O-CG 3.3Å; T579-E583 WeakPolarHBondContact O-CG 3.37Å; T579-E583 PolarHBondContact O-N 3.11Å; R580-E583 WeakPolarHBondContact CA-OE2 3.5Å; R580-E583 PolarHBondContact O-N 3.27Å; E583-K586 PolarHBondContact O-N 2.88Å; E583-A587 WeakPolarHBondContact O-CB 3.49Å; E583-A587 PolarHBondContact O-N 2.97Å
584	V	43.4	Very low	49.4	Very low	48 Å²	48	86.9 Å²	86.9	29%	0.291	42%	0.416	S	S	.	.	H	α-helix	trans	-63.9	-41.5	175.7	168.7	0	0	0	0	111.2	R580 K586 A587 I588 M662 V740	R580-V584 WeakPolarHBondContact O-CB 3.47Å; R580-V584 VanDerWaalsContact O-CG2 3.32Å; R580-V584 WeakPolarHBondContact O-CG2 3.41Å; R580-V584 PolarHBondContact O-N 3.26Å; V584-K586 VanDerWaalsContact C-N 3.33Å; V584-K586 PolarHBondContact O-N 2.85Å; V584-A587 PolarHBondContact O-N 3.38Å; V584-I588 HydrophobicContact CG1-CD1 3.72Å; V584-I588 HydrophobicContact CG1-CG1 4.44Å; V584-I588 WeakPolarHBondContact O-CB 3.21Å; V584-I588 VanDerWaalsContact O-CG1 3.24Å; V584-I588 WeakPolarHBondContact O-CG1 3.45Å; V584-I588 PolarHBondContact O-N 3.39Å; V584-M662 HydrophobicContact CG1-CE 4.29Å; V584-V740 HydrophobicContact CG2-CG1 3.79Å
585	Y	45.9	Very low	48.6	Very low	124 Å²	124	88.9 Å²	88.9	49%	0.486	43%	0.429	S	S	.	.	H	α-helix	trans	-62.8	-38.8	174.2	178.8	-98	0	0	0	112.4	I581 Y582 K589	I581-Y585 WeakPolarHBondContact O-CB 3.32Å; I581-Y585 PolarHBondContact O-N 3.37Å; Y582-Y585 PolarHBondContact O-N 2.87Å; Y585-K589 WeakPolarHBondContact O-CB 3.5Å; Y585-K589 PolarHBondContact O-N 3.33Å
586	K	57.9	Low	46.8	Very low	116 Å²	116	94.7 Å²	94.7	50%	0.504	47%	0.465	S	S	.	.	H	α-helix	trans	-69.1	-42.3	175.6	-172.3	178.8	179.1	-176.5	0	111.4	Y582 E583 V584 K589 N590	Y582-K586 VanDerWaalsContact O-CB 3.28Å; Y582-K586 WeakPolarHBondContact O-CB 3.41Å; Y582-K586 PolarHBondContact O-N 3.05Å; E583-K586 PolarHBondContact O-N 2.88Å; V584-K586 VanDerWaalsContact C-N 3.33Å; V584-K586 PolarHBondContact O-N 2.85Å; K586-K589 CarbonylContact O-C 3.59Å; K586-K589 PolarHBondContact O-N 2.93Å; K586-K589 VanDerWaalsContact O-N 3.12Å; K586-N590 WeakPolarHBondContact O-CB 3.38Å; K586-N590 PolarHBondContact O-N 3.24Å; K586-N590 PolarHBondContact O-OD1 3.37Å; K586-N590 VanDerWaalsContact O-OD1 3.08Å
587	A	45.6	Very low	45.2	Very low	44 Å²	44	95.4 Å²	95.4	36%	0.364	47%	0.474	S	S	.	.	H	α-helix	trans	-61.5	-43.9	173.8	0	0	0	0	0	111.6	E583 V584 K589 N590 N591	E583-A587 WeakPolarHBondContact O-CB 3.49Å; E583-A587 PolarHBondContact O-N 2.97Å; V584-A587 PolarHBondContact O-N 3.38Å; A587-K589 VanDerWaalsContact C-N 3.26Å; A587-K589 PolarHBondContact O-N 2.92Å; A587-N590 PolarHBondContact O-N 3.19Å; A587-N591 VanDerWaalsContact O-CB 3.27Å; A587-N591 WeakPolarHBondContact O-CB 3.02Å; A587-N591 VanDerWaalsContact O-CG 3.27Å; A587-N591 PolarHBondContact O-N 3.08Å
588	I	39.8	Very low	44.2	Very low	63 Å²	63	101.8 Å²	101.8	32%	0.323	50%	0.496	S	S	.	.	H	α-helix	trans	-65	-28.2	173.9	-68.3	166.2	0	0	0	112	V584 T592	V584-I588 HydrophobicContact CG1-CD1 3.72Å; V584-I588 HydrophobicContact CG1-CG1 4.44Å; V584-I588 WeakPolarHBondContact O-CB 3.21Å; V584-I588 VanDerWaalsContact O-CG1 3.24Å; V584-I588 WeakPolarHBondContact O-CG1 3.45Å; V584-I588 PolarHBondContact O-N 3.39Å; I588-T592 WeakPolarHBondContact O-CG2 3.42Å; I588-T592 PolarHBondContact O-OG1 3.13Å; I588-T592 VanDerWaalsContact O-OG1 3.06Å
589	K	47.3	Very low	43.2	Very low	121 Å²	121	108.4 Å²	108.4	53%	0.526	53%	0.531	S	S	.	.	H	α-helix	trans	-78.8	-35.3	174.5	-165.5	-164.7	172.1	-160.9	0	112.5	Y585 K586 A587 T592	Y585-K589 WeakPolarHBondContact O-CB 3.5Å; Y585-K589 PolarHBondContact O-N 3.33Å; K586-K589 CarbonylContact O-C 3.59Å; K586-K589 PolarHBondContact O-N 2.93Å; K586-K589 VanDerWaalsContact O-N 3.12Å; A587-K589 VanDerWaalsContact C-N 3.26Å; A587-K589 PolarHBondContact O-N 2.92Å; K589-T592 VanDerWaalsContact C-OG1 3.3Å; K589-T592 PolarHBondContact O-OG1 2.89Å
590	N	50	Low	41.7	Very low	98 Å²	98	111.7 Å²	111.7	52%	0.524	55%	0.553	S	S	.	*	H	α-helix	trans	-85.3	-29.3	-176.9	-73.8	37.7	0	0	0	112.5	K586 A587 T592	K586-N590 WeakPolarHBondContact O-CB 3.38Å; K586-N590 PolarHBondContact O-N 3.24Å; K586-N590 PolarHBondContact O-OD1 3.37Å; K586-N590 VanDerWaalsContact O-OD1 3.08Å; A587-N590 PolarHBondContact O-N 3.19Å; N590-T592 VanDerWaalsContact C-N 3.28Å; N590-T592 PolarHBondContact O-N 3.23Å
591	N	40.8	Very low	41	Very low	120 Å²	120	112 Å²	112	64%	0.642	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	8.9	175.4	-61.5	-3.3	0	0	0	112.8	A587	A587-N591 VanDerWaalsContact O-CB 3.27Å; A587-N591 WeakPolarHBondContact O-CB 3.02Å; A587-N591 VanDerWaalsContact O-CG 3.27Å; A587-N591 PolarHBondContact O-N 3.08Å
592	T	39.3	Very low	40.2	Very low	50 Å²	50	117.3 Å²	117.3	31%	0.307	60%	0.596	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.3	-5.1	176.7	18	0	0	0	0	114.8	I588 K589 N590 F655	I588-T592 WeakPolarHBondContact O-CG2 3.42Å; I588-T592 PolarHBondContact O-OG1 3.13Å; I588-T592 VanDerWaalsContact O-OG1 3.06Å; K589-T592 VanDerWaalsContact C-OG1 3.3Å; K589-T592 PolarHBondContact O-OG1 2.89Å; N590-T592 VanDerWaalsContact C-N 3.28Å; N590-T592 PolarHBondContact O-N 3.23Å; T592-F655 HydrophobicContact CG2-CD1 3.6Å; T592-F655 HydrophobicContact CG2-CD2 4.49Å; T592-F655 HydrophobicContact CG2-CE1 3.37Å; T592-F655 HydrophobicContact CG2-CE2 4.31Å; T592-F655 HydrophobicContact CG2-CG 4.16Å; T592-F655 HydrophobicContact CG2-CZ 3.76Å
593	E	37.9	Very low	39.4	Very low	167 Å²	167	114.6 Å²	114.6	78%	0.78	59%	0.59	S	S	*	*	S	Bend	trans	-101.3	-21.4	-175.4	-74.4	161	-158.7	0	0	112.8
594	D	30.7	Very low	38.5	Very low	128 Å²	128	114.3 Å²	114.3	68%	0.684	60%	0.598	S	S	*	*	S	Bend	trans	-148.6	147.4	-179.7	-103.2	-50.9	0	0	0	114.5
595	K	37.6	Very low	37.9	Very low	185 Å²	185	114 Å²	114	80%	0.804	60%	0.595	S	S	*	*			trans	77.5	108.1	169.3	-62.3	152.2	-171.9	168.7	0	117.8
596	T	31.4	Very low	37.3	Very low	140 Å²	140	112.2 Å²	112.2	86%	0.859	59%	0.59	S	S	*	*			trans	-74.8	120.4	168.1	37.7	0	0	0	0	111.9
597	I	35.2	Very low	36.1	Very low	148 Å²	148	110.8 Å²	110.8	76%	0.759	60%	0.595	S	S	*	*			trans	-88.9	114.3	173.9	-58.2	176.4	0	0	0	109.1	L599	I597-L599 HydrophobicContact CG2-CD1 4.37Å; I597-L599 HydrophobicContact CG2-CG 4.18Å
598	K	31	Very low	35.4	Very low	196 Å²	196	113.3 Å²	113.3	85%	0.852	60%	0.598	S	S	*	*			trans	-86.4	140.1	166.5	-63.7	-176.7	-179.6	-179.1	0	109.6
599	L	32.7	Very low	35	Very low	150 Å²	150	112 Å²	112	79%	0.785	59%	0.594	S	S	*	*			trans	-131.7	160.7	175.8	-78.5	162.1	0	0	0	109.9	I597	I597-L599 HydrophobicContact CG2-CD1 4.37Å; I597-L599 HydrophobicContact CG2-CG 4.18Å
600	P	29.6	Very low	34.2	Very low	100 Å²	100	111 Å²	111	65%	0.649	59%	0.594	S	S	*	*			trans	-76.4	152.2	-168.8	-16.8	32.9	0	0	0	114.8	D602	P600-D602 VanDerWaalsContact C-N 3.34Å; P600-D602 PolarHBondContact O-N 3.42Å
601	S	32.2	Very low	33.4	Very low	88 Å²	88	113.7 Å²	113.7	62%	0.615	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.5	-12.6	-167.1	48.2	0	0	0	0	117.6
602	D	32.5	Very low	32.9	Very low	145 Å²	145	113.1 Å²	113.1	78%	0.775	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	3.8	-161.5	-54.7	-12.9	0	0	0	112.8	P600	P600-D602 VanDerWaalsContact C-N 3.34Å; P600-D602 PolarHBondContact O-N 3.42Å
603	D	33.5	Very low	32.6	Very low	68 Å²	68	115 Å²	115	36%	0.364	60%	0.601	S	S	.	*			trans	-79.8	124.8	-177.8	-166	-17.5	0	0	0	110.6	L605 E606	D603-L605 HydrophobicContact CB-CB 4.39Å; D603-L605 PolarHBondContact O-N 3.01Å; D603-L605 WeakPolarHBondContact OD1-CB 3.41Å; D603-L605 PolarHBondContact OD1-N 3.41Å; D603-E606 PolarHBondContact O-N 2.77Å
604	P	33.8	Very low	32.3	Very low	101 Å²	101	109.3 Å²	109.3	66%	0.656	58%	0.58	S	S	*	*	H	α-helix	trans	-58.5	-13	171.1	24.8	-35.6	0	0	0	113.5	S607 F608	P604-S607 WeakPolarHBondContact O-CB 3.49Å; P604-S607 PolarHBondContact O-N 3.09Å; P604-F608 PolarHBondContact O-N 3.2Å
605	L	31.4	Very low	32.2	Very low	43 Å²	43	107.3 Å²	107.3	23%	0.225	57%	0.569	C	S	.	*	H	α-helix	trans	-63.8	-38	165.8	-162.6	83.6	0	0	0	113.1	D603 S607 F608 C609 F745 N746	D603-L605 HydrophobicContact CB-CB 4.39Å; D603-L605 PolarHBondContact O-N 3.01Å; D603-L605 WeakPolarHBondContact OD1-CB 3.41Å; D603-L605 PolarHBondContact OD1-N 3.41Å; L605-S607 VanDerWaalsContact C-N 3.26Å; L605-S607 PolarHBondContact O-N 2.99Å; L605-F608 CarbonylContact O-C 3.53Å; L605-F608 WeakPolarHBondContact O-CA 3.44Å; L605-F608 WeakPolarHBondContact O-CB 3.18Å; L605-F608 PolarHBondContact O-N 2.85Å; L605-C609 WeakPolarHBondContact O-CB 3.38Å; L605-C609 PolarHBondContact O-N 3.24Å; L605-F745 HydrophobicContact CD1-CD1 4.18Å; L605-F745 HydrophobicContact CD2-CD1 4.36Å; L605-N746 VanDerWaalsContact CD1-OD1 3.25Å; L605-N746 WeakPolarHBondContact CD1-OD1 3.41Å; L605-N746 WeakPolarHBondContact CD2-OD1 3.49Å
606	E	34.3	Very low	31.8	Very low	85 Å²	85	99.3 Å²	99.3	40%	0.397	54%	0.537	S	S	.	.	H	α-helix	trans	-63.6	-36.5	177.3	-176.9	160	-165.4	0	0	110.5	D603 F608 C609 L610	D603-E606 PolarHBondContact O-N 2.77Å; E606-F608 VanDerWaalsContact C-N 3.27Å; E606-F608 PolarHBondContact O-N 3.16Å; E606-C609 PolarHBondContact O-N 3.46Å; E606-L610 HydrophobicContact CG-CD1 3.78Å; E606-L610 HydrophobicContact CG-CG 3.98Å; E606-L610 VanDerWaalsContact O-CB 3.24Å; E606-L610 WeakPolarHBondContact O-CB 3.2Å; E606-L610 WeakPolarHBondContact O-CG 3.48Å; E606-L610 PolarHBondContact O-N 2.75Å
607	S	31.2	Very low	31.7	Very low	87 Å²	87	98.9 Å²	98.9	61%	0.608	53%	0.525	S	S	*	.	H	α-helix	trans	-58.3	-37.8	170.6	-59.6	0	0	0	0	112.8	P604 L605 Y611	P604-S607 WeakPolarHBondContact O-CB 3.49Å; P604-S607 PolarHBondContact O-N 3.09Å; L605-S607 VanDerWaalsContact C-N 3.26Å; L605-S607 PolarHBondContact O-N 2.99Å; S607-Y611 WeakPolarHBondContact O-CB 3.41Å; S607-Y611 PolarHBondContact O-N 3.03Å
608	F	31.5	Very low	31.3	Very low	96 Å²	96	95.2 Å²	95.2	42%	0.421	51%	0.51	S	S	.	.	H	α-helix	trans	-79.2	-36.9	178.9	-174	-104.7	0	0	0	112.7	P604 L605 E606 Y611 M612 I749	P604-F608 PolarHBondContact O-N 3.2Å; L605-F608 CarbonylContact O-C 3.53Å; L605-F608 WeakPolarHBondContact O-CA 3.44Å; L605-F608 WeakPolarHBondContact O-CB 3.18Å; L605-F608 PolarHBondContact O-N 2.85Å; E606-F608 VanDerWaalsContact C-N 3.27Å; E606-F608 PolarHBondContact O-N 3.16Å; F608-Y611 WeakPolarHBondContact O-CB 3.34Å; F608-Y611 PolarHBondContact O-N 3.4Å; F608-M612 HydrophobicContact CD1-CG 4.39Å; F608-M612 HydrophobicContact CE1-CG 4.14Å; F608-M612 HydrophobicContact CZ-CG 4.25Å; F608-M612 WeakPolarHBondContact O-CB 3.47Å; F608-M612 VanDerWaalsContact O-CG 3.23Å; F608-M612 WeakPolarHBondContact O-CG 3.32Å; F608-M612 PolarHBondContact O-N 3.01Å; F608-I749 HydrophobicContact CE1-CD1 4.25Å
609	C	31.3	Very low	31.2	Very low	36 Å²	36	91.1 Å²	91.1	24%	0.243	50%	0.502	C	S	.	.	H	α-helix	trans	-72.9	-38.6	176.2	-75.8	0	0	0	0	111.8	L605 E606 Y611 M612 N613	L605-C609 WeakPolarHBondContact O-CB 3.38Å; L605-C609 PolarHBondContact O-N 3.24Å; E606-C609 PolarHBondContact O-N 3.46Å; C609-Y611 VanDerWaalsContact C-N 3.31Å; C609-Y611 PolarHBondContact O-N 3.38Å; C609-M612 PolarHBondContact O-N 3.5Å; C609-N613 WeakPolarHBondContact O-CB 3.32Å; C609-N613 PolarHBondContact O-N 3.03Å; C609-N613 PolarHBondContact O-ND2 2.72Å
610	L	31.7	Very low	30.8	Very low	101 Å²	101	91.5 Å²	91.5	53%	0.529	50%	0.504	S	S	.	.	H	α-helix	trans	-61.8	-39.6	168.1	-70.5	171.1	0	0	0	110.9	E606 M612 S614	E606-L610 HydrophobicContact CG-CD1 3.78Å; E606-L610 HydrophobicContact CG-CG 3.98Å; E606-L610 VanDerWaalsContact O-CB 3.24Å; E606-L610 WeakPolarHBondContact O-CB 3.2Å; E606-L610 WeakPolarHBondContact O-CG 3.48Å; E606-L610 PolarHBondContact O-N 2.75Å; L610-M612 VanDerWaalsContact C-N 3.32Å; L610-M612 PolarHBondContact O-N 2.81Å; L610-S614 WeakPolarHBondContact O-CB 3.26Å; L610-S614 PolarHBondContact O-N 3.17Å; L610-S614 VanDerWaalsContact O-N 3.12Å; L610-S614 PolarHBondContact O-OG 3.31Å
611	Y	33.1	Very low	30.5	Very low	153 Å²	153	96.9 Å²	96.9	60%	0.6	52%	0.517	S	S	*	.	H	α-helix	trans	-64.4	-33.3	173.5	-177.3	-105.1	0	0	0	113.3	S607 F608 C609	S607-Y611 WeakPolarHBondContact O-CB 3.41Å; S607-Y611 PolarHBondContact O-N 3.03Å; F608-Y611 WeakPolarHBondContact O-CB 3.34Å; F608-Y611 PolarHBondContact O-N 3.4Å; C609-Y611 VanDerWaalsContact C-N 3.31Å; C609-Y611 PolarHBondContact O-N 3.38Å
612	M	30	Very low	30.1	Very low	109 Å²	109	96.6 Å²	96.6	54%	0.537	53%	0.528	S	S	.	.	H	α-helix	trans	-88.7	-27.7	-178.5	-71.8	-73.8	-69.5	0	0	114.5	F608 C609 L610	F608-M612 HydrophobicContact CD1-CG 4.39Å; F608-M612 HydrophobicContact CE1-CG 4.14Å; F608-M612 HydrophobicContact CZ-CG 4.25Å; F608-M612 WeakPolarHBondContact O-CB 3.47Å; F608-M612 VanDerWaalsContact O-CG 3.23Å; F608-M612 WeakPolarHBondContact O-CG 3.32Å; F608-M612 PolarHBondContact O-N 3.01Å; C609-M612 PolarHBondContact O-N 3.5Å; L610-M612 VanDerWaalsContact C-N 3.32Å; L610-M612 PolarHBondContact O-N 2.81Å
613	N	33	Very low	29.8	Very low	89 Å²	89	99.1 Å²	99.1	48%	0.476	54%	0.535	S	S	.	.	H	α-helix	trans	-99.8	-17	-175	-62.6	-18.7	0	0	0	113.3	C609 D615 A616	C609-N613 WeakPolarHBondContact O-CB 3.32Å; C609-N613 PolarHBondContact O-N 3.03Å; C609-N613 PolarHBondContact O-ND2 2.72Å; N613-D615 PolarHBondContact O-N 3.44Å; N613-D615 VanDerWaalsContact O-N 3.14Å; N613-A616 VanDerWaalsContact O-CB 3.25Å; N613-A616 WeakPolarHBondContact O-CB 3.38Å
614	S	31.1	Very low	29.4	Very low	48 Å²	48	105.8 Å²	105.8	34%	0.336	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.6	18.3	-172.9	64.5	0	0	0	0	116.2	L610 R855	L610-S614 WeakPolarHBondContact O-CB 3.26Å; L610-S614 PolarHBondContact O-N 3.17Å; L610-S614 VanDerWaalsContact O-N 3.12Å; L610-S614 PolarHBondContact O-OG 3.31Å; S614-R855 PolarHBondContact O-NH2 3.15Å; S614-R855 PolarHBondContact OG-NH1 3.23Å
615	D	28.7	Very low	29.1	Very low	86 Å²	86	105.7 Å²	105.7	46%	0.46	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-142.7	58	168	-79.7	-27.7	0	0	0	108.9	N613 Y847 R855	N613-D615 PolarHBondContact O-N 3.44Å; N613-D615 VanDerWaalsContact O-N 3.14Å; D615-Y847 HydrophobicContact CB-CE1 4.35Å; D615-R855 IonicContact OD1-NH2 2.83Å; D615-R855 PolarHBondContact OD1-NH2 3.45Å
616	A	29.8	Very low	28.9	Very low	16 Å²	16	112.6 Å²	112.6	13%	0.132	60%	0.6	C	S	.	*			trans	-129.1	-26.1	-166.9	0	0	0	0	0	116.7	N613 D654 K657	N613-A616 VanDerWaalsContact O-CB 3.25Å; N613-A616 WeakPolarHBondContact O-CB 3.38Å; A616-D654 WeakPolarHBondContact CB-OD1 3.49Å; A616-D654 VanDerWaalsContact CB-OD2 3.24Å; A616-D654 WeakPolarHBondContact CB-OD2 3.38Å; A616-K657 VanDerWaalsContact C-NZ 3.33Å; A616-K657 PolarHBondContact O-NZ 3.29Å
617	H	27.7	Very low	28.7	Very low	131 Å²	131	118 Å²	118	61%	0.606	63%	0.625	S	S	*	*			trans	-69.3	148.5	173.6	-81.1	-100.8	0	0	0	113	D654	H617-D654 IonicContact CD2-OD2 2.71Å
618	T	27.5	Very low	28.6	Very low	72 Å²	72	119.8 Å²	119.8	44%	0.442	63%	0.632	S	S	.	*	S	Bend	trans	61.9	109	161.6	49.7	0	0	0	0	121.1
619	T	28.6	Very low	28.4	Very low	110 Å²	110	120.8 Å²	120.8	68%	0.675	65%	0.646	S	S	*	*			trans	60.1	114.2	134.9	54.9	0	0	0	0	121.9
620	L	24	Very low	28.2	Very low	158 Å²	158	126.1 Å²	126.1	83%	0.827	67%	0.671	S	S	*	*			trans	-72.5	126.4	132.6	-68.9	87.8	0	0	0	108
621	F	24.6	Very low	27.9	Very low	213 Å²	213	126.4 Å²	126.4	93%	0.934	68%	0.677	S	S	*	*				-177	142.9	127.5	-97.4	-67.5	0	0	0	106.5
622	G	23.3	Very low	27.7	Very low	81 Å²	81	124.8 Å²	124.8	84%	0.835	68%	0.683	S	S	*	*			trans	-113.7	118.9	-178.5	0	0	0	0	0	110.2
623	E	26.2	Very low	27.6	Very low	198 Å²	198	124.6 Å²	124.6	93%	0.925	69%	0.688	S	S	*	*			trans	-137.2	152.3	163.3	-157.8	150.6	-132.4	0	0	108.3
624	K	25.9	Very low	27.4	Very low	208 Å²	208	125.9 Å²	125.9	90%	0.904	70%	0.699	S	S	*	*			trans	-97	134.4	-167.4	-62.6	174.7	-179.6	175.8	0	111.4
625	A	26.8	Very low	27.2	Very low	100 Å²	100	128.7 Å²	128.7	83%	0.826	72%	0.715	S	S	*	*			trans	-139	152.5	151.2	0	0	0	0	0	107.6
626	E	27.9	Very low	27.1	Very low	188 Å²	188	130.7 Å²	130.7	88%	0.879	73%	0.73	S	S	*	*			trans	-90	154.2	-159.2	-70.6	171.6	127.9	0	0	114.7
627	E	28.4	Very low	27.1	Very low	198 Å²	198	135.3 Å²	135.3	93%	0.925	76%	0.757	S	S	*	*			trans	-87.7	100.8	177.1	176.4	176.4	-146.5	0	0	109.1
628	T	30.2	Very low	27.1	Very low	125 Å²	125	135.3 Å²	135.3	77%	0.767	77%	0.767	S	S	*	*			trans	-132.1	116.1	172	-28.1	0	0	0	0	111.2
629	T	27.2	Very low	27.2	Very low	116 Å²	116	136.7 Å²	136.7	71%	0.712	78%	0.779	S	S	*	*			trans	-58.8	157.8	163.1	41.3	0	0	0	0	110.7
630	I	27	Very low	27.3	Very low	148 Å²	148	135.5 Å²	135.5	76%	0.759	78%	0.775	S	S	*	*				-171.8	114.7	92.6	-88.2	157.9	0	0	0	105.7
631	T	26.1	Very low	27.8	Very low	108 Å²	108	134.7 Å²	134.7	66%	0.663	77%	0.772	S	S	*	*				71.8	117.1	95.4	-48.9	0	0	0	0	113.9
632	T	28.1	Very low	28.2	Very low	118 Å²	118	131 Å²	131	72%	0.724	76%	0.762	S	S	*	*			trans	36.4	133.8	143.1	-28.3	0	0	0	0	118.1
633	T	28.2	Very low	28.5	Very low	106 Å²	106	134 Å²	134	65%	0.65	76%	0.759	S	S	*	*				-175.7	158.2	64.7	-38.7	0	0	0	0	110.7
634	T	28.1	Very low	28.6	Very low	115 Å²	115	131.7 Å²	131.7	71%	0.706	75%	0.753	S	S	*	*			trans	36.5	139.4	145.3	50.8	0	0	0	0	121.6
635	T	27.7	Very low	28.9	Very low	108 Å²	108	127 Å²	127	66%	0.663	75%	0.746	S	S	*	*			cis	-175.7	154	-0.4	16	0	0	0	0	108.5
636	T	26.9	Very low	29	Very low	127 Å²	127	129.8 Å²	129.8	78%	0.779	75%	0.747	S	S	*	*			trans	59.2	150.4	151.5	53.9	0	0	0	0	118.7
637	T	27.9	Very low	29.1	Very low	114 Å²	114	126.8 Å²	126.8	70%	0.699	74%	0.742	S	S	*	*			cis	-146.1	157.2	10.6	30.8	0	0	0	0	109.8
638	T	27.8	Very low	29.1	Very low	131 Å²	131	124 Å²	124	80%	0.804	74%	0.738	S	S	*	*			trans	56.6	138.1	150.8	50.7	0	0	0	0	119.9
639	S	30.1	Very low	28.9	Very low	101 Å²	101	123.4 Å²	123.4	71%	0.706	74%	0.739	S	S	*	*			cis	-162.3	172.9	-0.1	53.7	0	0	0	0	111.4
640	S	32.1	Very low	29	Very low	85 Å²	85	121.4 Å²	121.4	59%	0.594	73%	0.729	S	S	*	*			trans	56.9	102.1	150.5	55.1	0	0	0	0	120
641	D	33.7	Very low	29.1	Very low	141 Å²	141	122.1 Å²	122.1	75%	0.754	74%	0.735	S	S	*	*				82.3	111	119.5	-53	-21.4	0	0	0	122.4
642	N	32.3	Very low	29.3	Very low	136 Å²	136	120 Å²	120	73%	0.727	72%	0.722	S	S	*	*			trans	72.9	92.8	136.6	-59.8	-34.8	0	0	0	121.6
643	N	29.6	Very low	29.5	Very low	143 Å²	143	118.1 Å²	118.1	77%	0.765	71%	0.712	S	S	*	*			trans	69.1	164.9	132.9	-67.3	-10.7	0	0	0	121.9
644	D	29.5	Very low	29.9	Very low	150 Å²	150	115.2 Å²	115.2	80%	0.802	69%	0.692	S	S	*	*			trans	64.4	66.6	161.5	-58.5	-20.6	0	0	0	119.3
645	S	32.3	Very low	30	Very low	109 Å²	109	114.6 Å²	114.6	76%	0.762	68%	0.68	S	S	*	*			trans	-116.2	87.7	159.7	49.6	0	0	0	0	112.6	T647	S645-T647 PolarHBondContact O-N 3.43Å
646	N	28.1	Very low	30.5	Very low	158 Å²	158	112.9 Å²	112.9	85%	0.845	67%	0.669	S	S	*	*			trans	-78.8	108.4	173.1	-94.2	-59.9	0	0	0	111.9
647	T	29.3	Very low	31	Very low	126 Å²	126	111.6 Å²	111.6	77%	0.773	65%	0.653	S	S	*	*			trans	-136	85	176.2	40.4	0	0	0	0	114.9	S645	S645-T647 PolarHBondContact O-N 3.43Å
648	V	28.8	Very low	31.3	Very low	139 Å²	139	111.4 Å²	111.4	84%	0.842	64%	0.644	S	S	*	*			trans	39.6	119.4	134.5	-175.6	0	0	0	0	119.7
649	S	27.1	Very low	31.7	Very low	113 Å²	113	108.3 Å²	108.3	79%	0.79	62%	0.619	S	S	*	*			trans	-162.9	130	136.8	-91.5	0	0	0	0	116.3
650	S	28.7	Very low	32	Very low	73 Å²	73	108.1 Å²	108.1	51%	0.51	61%	0.609	S	S	.	*			trans	64.8	70.3	157.7	68.9	0	0	0	0	120.7	V652	S650-V652 PolarHBondContact O-N 2.84Å
651	N	28.1	Very low	32.2	Very low	163 Å²	163	108.8 Å²	108.8	87%	0.872	60%	0.602	S	S	*	*			trans	-73.9	110.9	162.9	-81.2	-37.6	0	0	0	112.2
652	V	31.5	Very low	32.3	Very low	65 Å²	65	104.8 Å²	104.8	39%	0.394	58%	0.579	S	S	.	*			trans	-121.5	115.2	166.9	-178.6	0	0	0	0	108.9	S650 D654	S650-V652 PolarHBondContact O-N 2.84Å; V652-D654 PolarHBondContact O-N 3.01Å
653	P	31.6	Very low	32.5	Very low	78 Å²	78	106.6 Å²	106.6	51%	0.506	58%	0.576	S	S	.	*			trans	-82.3	122.6	-163	29.7	-35.2	0	0	0	114.6	F655 T656	P653-F655 PolarHBondContact O-N 2.85Å; P653-F655 VanDerWaalsContact O-N 3.11Å; P653-T656 PolarHBondContact O-N 3.37Å; P653-T656 VanDerWaalsContact O-N 3.12Å; P653-T656 PolarHBondContact O-OG1 2.98Å
654	D	36.3	Very low	32.8	Very low	44 Å²	44	104.9 Å²	104.9	24%	0.235	56%	0.562	C	S	.	*	T	Hydrogen-bonded Turn	trans	-63.5	-15.3	177.4	-89.3	-42	0	0	0	115.1	A616 H617 V652 T656 K657 Q658	A616-D654 WeakPolarHBondContact CB-OD1 3.49Å; A616-D654 VanDerWaalsContact CB-OD2 3.24Å; A616-D654 WeakPolarHBondContact CB-OD2 3.38Å; H617-D654 IonicContact CD2-OD2 2.71Å; V652-D654 PolarHBondContact O-N 3.01Å; D654-T656 PolarHBondContact O-N 3.18Å; D654-K657 PolarHBondContact O-N 3.34Å; D654-K657 WeakPolarHBondContact OD1-CD 3.32Å; D654-K657 WeakPolarHBondContact OD1-CE 3.36Å; D654-K657 IonicContact OD1-NZ 3.64Å; D654-K657 PolarHBondContact OD1-NZ 2.9Å; D654-Q658 PolarHBondContact O-N 2.84Å
655	F	31.2	Very low	33	Very low	103 Å²	103	99 Å²	99	45%	0.452	53%	0.528	S	S	.	.	H	α-helix	trans	-49.2	-29	166.7	-80.7	-78.1	0	0	0	113.4	T592 P653 K659	T592-F655 HydrophobicContact CG2-CD1 3.6Å; T592-F655 HydrophobicContact CG2-CD2 4.49Å; T592-F655 HydrophobicContact CG2-CE1 3.37Å; T592-F655 HydrophobicContact CG2-CE2 4.31Å; T592-F655 HydrophobicContact CG2-CG 4.16Å; T592-F655 HydrophobicContact CG2-CZ 3.76Å; P653-F655 PolarHBondContact O-N 2.85Å; P653-F655 VanDerWaalsContact O-N 3.11Å; F655-K659 VanDerWaalsContact O-CB 3.29Å; F655-K659 WeakPolarHBondContact O-CB 3.28Å; F655-K659 VanDerWaalsContact O-CG 3.26Å; F655-K659 WeakPolarHBondContact O-CG 3.39Å; F655-K659 PolarHBondContact O-N 3.11Å
656	T	38.5	Very low	33	Very low	71 Å²	71	95.2 Å²	95.2	44%	0.436	50%	0.499	S	S	.	.	H	α-helix	trans	-63.1	-41.7	174.5	53.3	0	0	0	0	112.4	P653 D654 K659 I660	P653-T656 PolarHBondContact O-N 3.37Å; P653-T656 VanDerWaalsContact O-N 3.12Å; P653-T656 PolarHBondContact O-OG1 2.98Å; D654-T656 PolarHBondContact O-N 3.18Å; T656-K659 PolarHBondContact O-N 3.25Å; T656-I660 WeakPolarHBondContact O-CD1 3.47Å; T656-I660 VanDerWaalsContact O-CG1 3.27Å; T656-I660 WeakPolarHBondContact O-CG1 3.22Å; T656-I660 PolarHBondContact O-N 2.84Å
657	K	36.9	Very low	33.2	Very low	101 Å²	101	92.1 Å²	92.1	44%	0.439	48%	0.483	S	S	.	.	H	α-helix	trans	-73.8	-39.4	-179.1	-63.4	175.1	-163.4	152.7	0	111.9	A616 D654 I660 F661	A616-K657 VanDerWaalsContact C-NZ 3.33Å; A616-K657 PolarHBondContact O-NZ 3.29Å; D654-K657 PolarHBondContact O-N 3.34Å; D654-K657 WeakPolarHBondContact OD1-CD 3.32Å; D654-K657 WeakPolarHBondContact OD1-CE 3.36Å; D654-K657 IonicContact OD1-NZ 3.64Å; D654-K657 PolarHBondContact OD1-NZ 2.9Å; K657-I660 PolarHBondContact O-N 3.13Å; K657-F661 WeakPolarHBondContact O-CB 3.25Å; K657-F661 PolarHBondContact O-N 3.41Å
658	Q	34.1	Very low	33.3	Very low	109 Å²	109	88.8 Å²	88.8	51%	0.509	46%	0.46	S	S	.	.	H	α-helix	trans	-62.5	-42.4	171	-70	-173.3	-4.1	0	0	111.5	D654 I660 F661 M662	D654-Q658 PolarHBondContact O-N 2.84Å; Q658-I660 VanDerWaalsContact C-N 3.33Å; Q658-I660 PolarHBondContact O-N 3.01Å; Q658-F661 PolarHBondContact O-N 3.42Å; Q658-M662 WeakPolarHBondContact O-CB 3.27Å; Q658-M662 WeakPolarHBondContact O-CG 3.28Å; Q658-M662 PolarHBondContact O-N 2.79Å
659	K	36.9	Very low	33.5	Very low	67 Å²	67	85.9 Å²	85.9	29%	0.291	43%	0.434	S	S	.	.	H	α-helix	trans	-62.4	-36.5	174.1	-77	168.3	178.1	166.6	0	112.4	F655 T656 R663	F655-K659 VanDerWaalsContact O-CB 3.29Å; F655-K659 WeakPolarHBondContact O-CB 3.28Å; F655-K659 VanDerWaalsContact O-CG 3.26Å; F655-K659 WeakPolarHBondContact O-CG 3.39Å; F655-K659 PolarHBondContact O-N 3.11Å; T656-K659 PolarHBondContact O-N 3.25Å; K659-R663 VanDerWaalsContact O-CB 3.25Å; K659-R663 WeakPolarHBondContact O-CB 3.1Å; K659-R663 PolarHBondContact O-N 3.41Å
660	I	35.2	Very low	33.8	Very low	96 Å²	96	84.2 Å²	84.2	49%	0.492	41%	0.413	S	S	.	.	H	α-helix	trans	-71.2	-42.4	173.9	-68.7	162.2	0	0	0	111.9	T656 K657 Q658 R663 K664	T656-I660 WeakPolarHBondContact O-CD1 3.47Å; T656-I660 VanDerWaalsContact O-CG1 3.27Å; T656-I660 WeakPolarHBondContact O-CG1 3.22Å; T656-I660 PolarHBondContact O-N 2.84Å; K657-I660 PolarHBondContact O-N 3.13Å; Q658-I660 VanDerWaalsContact C-N 3.33Å; Q658-I660 PolarHBondContact O-N 3.01Å; I660-R663 PolarHBondContact O-N 3.44Å; I660-K664 WeakPolarHBondContact O-CG 3.3Å; I660-K664 PolarHBondContact O-N 2.81Å
661	F	36	Very low	33.8	Very low	99 Å²	99	85.8 Å²	85.8	43%	0.434	42%	0.415	S	S	.	.	H	α-helix	trans	-61.8	-48.5	175.6	176.8	-95.5	0	0	0	110.9	K657 Q658 R663 K664 Y665 F745	K657-F661 WeakPolarHBondContact O-CB 3.25Å; K657-F661 PolarHBondContact O-N 3.41Å; Q658-F661 PolarHBondContact O-N 3.42Å; F661-R663 PolarHBondContact O-N 3.02Å; F661-K664 PolarHBondContact O-N 3.43Å; F661-Y665 VanDerWaalsContact O-CB 3.31Å; F661-Y665 WeakPolarHBondContact O-CB 3.39Å; F661-Y665 PolarHBondContact O-N 3.49Å; F661-F745 HydrophobicContact CE1-CE2 4.15Å; F661-F745 HydrophobicContact CE1-CZ 4.48Å
662	M	36.8	Very low	33.9	Very low	58 Å²	58	81.3 Å²	81.3	29%	0.286	39%	0.391	S	S	.	.	H	α-helix	trans	-56.4	-51.6	173.4	-78.6	-65	-69.9	0	0	111	V584 Q658 K664 Y665 L666	V584-M662 HydrophobicContact CG1-CE 4.29Å; Q658-M662 WeakPolarHBondContact O-CB 3.27Å; Q658-M662 WeakPolarHBondContact O-CG 3.28Å; Q658-M662 PolarHBondContact O-N 2.79Å; M662-K664 VanDerWaalsContact C-N 3.3Å; M662-K664 PolarHBondContact O-N 2.9Å; M662-Y665 WeakPolarHBondContact O-CB 3.22Å; M662-Y665 PolarHBondContact O-N 2.88Å; M662-L666 WeakPolarHBondContact O-CB 3.39Å; M662-L666 WeakPolarHBondContact O-CD1 3.27Å; M662-L666 WeakPolarHBondContact O-CG 3.26Å; M662-L666 PolarHBondContact O-N 3.21Å
663	R	35.8	Very low	34.1	Very low	173 Å²	173	83.9 Å²	83.9	65%	0.653	40%	0.395	S	S	*	.	H	α-helix	trans	-55.9	-43.5	179.4	-169.6	164.2	173.1	171.3	-6.6	112.3	K659 I660 F661 L666 D667	K659-R663 VanDerWaalsContact O-CB 3.25Å; K659-R663 WeakPolarHBondContact O-CB 3.1Å; K659-R663 PolarHBondContact O-N 3.41Å; I660-R663 PolarHBondContact O-N 3.44Å; F661-R663 PolarHBondContact O-N 3.02Å; R663-L666 PolarHBondContact O-N 2.83Å; R663-D667 PolarHBondContact O-N 3.5Å; R663-D667 VanDerWaalsContact O-N 3.11Å
664	K	35.3	Very low	34	Very low	108 Å²	108	87.2 Å²	87.2	47%	0.47	40%	0.404	S	S	.	.	H	α-helix	trans	-70.2	-36	174.3	-71.2	-170.4	175.5	-166.3	0	114	I660 F661 M662 L666 D667 L668	I660-K664 WeakPolarHBondContact O-CG 3.3Å; I660-K664 PolarHBondContact O-N 2.81Å; F661-K664 PolarHBondContact O-N 3.43Å; M662-K664 VanDerWaalsContact C-N 3.3Å; M662-K664 PolarHBondContact O-N 2.9Å; K664-L666 PolarHBondContact O-N 2.82Å; K664-D667 PolarHBondContact O-N 3.33Å; K664-L668 VanDerWaalsContact O-CB 3.28Å; K664-L668 WeakPolarHBondContact O-CB 3.16Å; K664-L668 PolarHBondContact O-N 3.25Å
665	Y	34.4	Very low	33.9	Very low	26 Å²	26	91 Å²	91	10%	0.102	42%	0.42	C	S	.	.	H	α-helix	trans	-60.9	-37.9	173.4	172.3	-81.2	0	0	0	110.7	F661 M662 L668 R669 V748 V752	F661-Y665 VanDerWaalsContact O-CB 3.31Å; F661-Y665 WeakPolarHBondContact O-CB 3.39Å; F661-Y665 PolarHBondContact O-N 3.49Å; M662-Y665 WeakPolarHBondContact O-CB 3.22Å; M662-Y665 PolarHBondContact O-N 2.88Å; Y665-L668 CarbonylContact O-C 3.48Å; Y665-L668 WeakPolarHBondContact O-CB 3.31Å; Y665-L668 PolarHBondContact O-N 3.46Å; Y665-R669 PolarHBondContact O-N 3.13Å; Y665-V748 HydrophobicContact CE1-CG1 4.12Å; Y665-V748 HydrophobicContact CE2-CG1 3.7Å; Y665-V748 VanDerWaalsContact CZ-CG1 3.45Å; Y665-V748 VanDerWaalsContact OH-CG1 3.3Å; Y665-V748 WeakPolarHBondContact OH-CG1 3.37Å; Y665-V752 HydrophobicContact CE2-CG2 3.63Å
666	L	31.6	Very low	34	Very low	30 Å²	30	91.6 Å²	91.6	16%	0.157	43%	0.434	C	S	.	.	H	α-helix	trans	-72.1	-45.4	-180	-63.5	165.1	0	0	0	111.2	I581 M662 R663 K664 L668 R669 H670	I581-L666 HydrophobicContact CB-CD2 4.11Å; I581-L666 HydrophobicContact CD1-CD2 3.66Å; I581-L666 HydrophobicContact CG1-CD2 3.51Å; I581-L666 HydrophobicContact CG2-CD1 3.46Å; I581-L666 VanDerWaalsContact CG2-CD1 3.46Å; I581-L666 HydrophobicContact CG2-CD2 3.53Å; I581-L666 HydrophobicContact CG2-CG 4Å; M662-L666 WeakPolarHBondContact O-CB 3.39Å; M662-L666 WeakPolarHBondContact O-CD1 3.27Å; M662-L666 WeakPolarHBondContact O-CG 3.26Å; M662-L666 PolarHBondContact O-N 3.21Å; R663-L666 PolarHBondContact O-N 2.83Å; K664-L666 PolarHBondContact O-N 2.82Å; L666-L668 VanDerWaalsContact C-N 3.27Å; L666-L668 PolarHBondContact O-N 3.31Å; L666-R669 WeakPolarHBondContact O-CB 3.39Å; L666-R669 PolarHBondContact O-N 3.37Å; L666-H670 PolarHBondContact O-N 3.5Å; L666-H670 PolarHBondContact O-ND1 2.94Å; L666-H670 VanDerWaalsContact O-ND1 3.15Å
667	D	32.4	Very low	33.6	Very low	93 Å²	93	89.7 Å²	89.7	50%	0.497	43%	0.429	S	S	.	.	H	α-helix	trans	-58.6	-39.8	169.7	-62.4	-34.8	0	0	0	111.3	R663 K664 H670 L671	R663-D667 PolarHBondContact O-N 3.5Å; R663-D667 VanDerWaalsContact O-N 3.11Å; K664-D667 PolarHBondContact O-N 3.33Å; D667-H670 PolarHBondContact O-N 2.94Å; D667-L671 PolarHBondContact O-N 2.81Å
668	L	32.2	Very low	33.4	Very low	55 Å²	55	90.5 Å²	90.5	29%	0.288	44%	0.444	S	S	.	.	H	α-helix	trans	-64.4	-35.4	172.6	-97.5	154.9	0	0	0	112.9	K664 Y665 L666 H670 L671 L672 F834	K664-L668 VanDerWaalsContact O-CB 3.28Å; K664-L668 WeakPolarHBondContact O-CB 3.16Å; K664-L668 PolarHBondContact O-N 3.25Å; Y665-L668 CarbonylContact O-C 3.48Å; Y665-L668 WeakPolarHBondContact O-CB 3.31Å; Y665-L668 PolarHBondContact O-N 3.46Å; L666-L668 VanDerWaalsContact C-N 3.27Å; L666-L668 PolarHBondContact O-N 3.31Å; L668-H670 VanDerWaalsContact C-N 3.32Å; L668-L671 PolarHBondContact O-N 2.79Å; L668-L672 HydrophobicContact CD2-CD1 4.08Å; L668-L672 HydrophobicContact CD2-CG 4.41Å; L668-L672 VanDerWaalsContact O-CB 3.27Å; L668-L672 WeakPolarHBondContact O-CB 3.22Å; L668-L672 VanDerWaalsContact O-CG 3.25Å; L668-L672 WeakPolarHBondContact O-CG 3.43Å; L668-L672 PolarHBondContact O-N 3.3Å; L668-F834 HydrophobicContact CD1-CE2 4.14Å; L668-F834 HydrophobicContact CD1-CZ 4.29Å; L668-F834 HydrophobicContact CD2-CE2 3.92Å; L668-F834 HydrophobicContact CD2-CZ 3.65Å; L668-F834 HydrophobicContact CG-CE2 4.18Å; L668-F834 HydrophobicContact CG-CZ 3.85Å
669	R	33	Very low	33.5	Very low	78 Å²	78	89 Å²	89	29%	0.294	45%	0.45	S	S	.	.	H	α-helix	trans	-68.1	-35.1	175.8	-144.9	176.3	-163.4	169	8.4	110.4	Y665 L666 Y673	Y665-R669 PolarHBondContact O-N 3.13Å; L666-R669 WeakPolarHBondContact O-CB 3.39Å; L666-R669 PolarHBondContact O-N 3.37Å; R669-Y673 HydrophobicContact CG-CD2 3.76Å; R669-Y673 HydrophobicContact CG-CE2 3.99Å; R669-Y673 VanDerWaalsContact O-CB 3.3Å; R669-Y673 WeakPolarHBondContact O-CB 3.05Å; R669-Y673 WeakPolarHBondContact O-CD2 3.49Å; R669-Y673 PolarHBondContact O-N 2.83Å
670	H	32.8	Very low	33.4	Very low	78 Å²	78	86.3 Å²	86.3	36%	0.361	44%	0.441	S	S	.	.	H	α-helix	trans	-67.7	-39	171.6	-68.7	32.9	0	0	0	112.2	N578 L666 D667 L668 Y673 E674	N578-H670 PolarHBondContact OD1-CE1 2.86Å; N578-H670 PolarHBondContact OD1-NE2 3.06Å; L666-H670 PolarHBondContact O-N 3.5Å; L666-H670 PolarHBondContact O-ND1 2.94Å; L666-H670 VanDerWaalsContact O-ND1 3.15Å; D667-H670 PolarHBondContact O-N 2.94Å; L668-H670 VanDerWaalsContact C-N 3.32Å; H670-Y673 CarbonylContact O-C 3.44Å; H670-E674 PolarHBondContact O-N 3.13Å; H670-E674 VanDerWaalsContact O-N 3.14Å
671	L	30.1	Very low	33.4	Very low	106 Å²	106	88.9 Å²	88.9	56%	0.555	45%	0.451	S	S	*	.	H	α-helix	trans	-75.9	-20.9	177.4	-76.6	161.9	0	0	0	114.9	D667 L668 F834	D667-L671 PolarHBondContact O-N 2.81Å; L668-L671 PolarHBondContact O-N 2.79Å; L671-F834 HydrophobicContact CD1-CE1 4.24Å
672	L	29.6	Very low	33.4	Very low	69 Å²	69	90.5 Å²	90.5	36%	0.361	46%	0.461	S	S	.	.	H	α-helix	trans	-100	-17.6	177.9	-68.2	172.6	0	0	0	113.1	L668	L668-L672 HydrophobicContact CD2-CD1 4.08Å; L668-L672 HydrophobicContact CD2-CG 4.41Å; L668-L672 VanDerWaalsContact O-CB 3.27Å; L668-L672 WeakPolarHBondContact O-CB 3.22Å; L668-L672 VanDerWaalsContact O-CG 3.25Å; L668-L672 WeakPolarHBondContact O-CG 3.43Å; L668-L672 PolarHBondContact O-N 3.3Å
673	Y	34.8	Very low	33.6	Very low	120 Å²	120	95.2 Å²	95.2	47%	0.471	48%	0.476	S	S	.	.			trans	-120.5	36.2	174.6	-63.5	-98.5	0	0	0	111.9	R669 H670 E675	R669-Y673 HydrophobicContact CG-CD2 3.76Å; R669-Y673 HydrophobicContact CG-CE2 3.99Å; R669-Y673 VanDerWaalsContact O-CB 3.3Å; R669-Y673 WeakPolarHBondContact O-CB 3.05Å; R669-Y673 WeakPolarHBondContact O-CD2 3.49Å; R669-Y673 PolarHBondContact O-N 2.83Å; H670-Y673 CarbonylContact O-C 3.44Å; Y673-E675 PolarHBondContact O-N 3.17Å
674	E	31.3	Very low	33.9	Very low	148 Å²	148	88.2 Å²	88.2	69%	0.692	45%	0.451	S	S	*	.			trans	-61.8	88.3	138.8	-76.6	-171.8	140.9	0	0	106.8	H670	H670-E674 PolarHBondContact O-N 3.13Å; H670-E674 VanDerWaalsContact O-N 3.14Å
675	E	33	Very low	34.1	Very low	123 Å²	123	88.5 Å²	88.5	58%	0.575	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-50.9	133.5	156.2	-73.4	-180	145.1	0	0	106.3	R573 Y673 G677	R573-E675 IonicContact NH1-OE1 3.97Å; R573-E675 PolarHBondContact NH1-OE1 3Å; R573-E675 IonicContact NH1-OE2 2.7Å; Y673-E675 PolarHBondContact O-N 3.17Å; E675-G677 PolarHBondContact O-N 3.26Å
676	P	33.1	Very low	34.5	Very low	116 Å²	116	93.9 Å²	93.9	75%	0.753	48%	0.484	S	S	*	.	P	Polyproline II helix	trans	-54.7	137.2	170.1	25.1	-33.3	0	0	0	108.1
677	G	29.6	Very low	35	Very low	31 Å²	31	93.6 Å²	93.6	32%	0.32	48%	0.483	S	S	.	.	S	Bend	trans	-47.8	145	173.9	0	0	0	0	0	110.2	E675 A679	E675-G677 PolarHBondContact O-N 3.26Å; G677-A679 PolarHBondContact O-N 3.15Å
678	P	32.9	Very low	35.6	Very low	117 Å²	117	92.8 Å²	92.8	76%	0.76	48%	0.478	S	S	*	.	S	Bend	trans	-45.2	113.5	-166	17.9	-32.5	0	0	0	110.7	G680	P678-G680 WeakPolarHBondContact O-CA 3.43Å; P678-G680 PolarHBondContact O-N 3.36Å
679	A	36.9	Very low	36.2	Very low	77 Å²	77	97.4 Å²	97.4	64%	0.636	50%	0.498	S	S	*	.	S	Bend	trans	-53.6	110.5	-162.4	0	0	0	0	0	110.3	G677 L717	G677-A679 PolarHBondContact O-N 3.15Å; A679-L717 VanDerWaalsContact O-CD1 3.28Å; A679-L717 WeakPolarHBondContact O-CD1 3.42Å
680	G	33.9	Very low	36.6	Very low	11 Å²	11	95.3 Å²	95.3	11%	0.113	50%	0.496	C	S	.	.	S	Bend	trans	158	-120.6	-151.8	0	0	0	0	0	109.6	P678 E682 Y683 I684	P678-G680 WeakPolarHBondContact O-CA 3.43Å; P678-G680 PolarHBondContact O-N 3.36Å; G680-E682 PolarHBondContact O-N 3.36Å; G680-E682 VanDerWaalsContact O-N 3.17Å; G680-Y683 PolarHBondContact O-N 3.01Å; G680-I684 WeakPolarHBondContact O-CG1 3.3Å; G680-I684 PolarHBondContact O-N 3.3Å
681	E	35.6	Very low	37.1	Very low	150 Å²	150	96.7 Å²	96.7	70%	0.701	52%	0.521	S	S	*	.	H	α-helix	trans	-39.8	-58.2	-165.4	-61.3	-179	174.9	0	0	115.2	Y683 I684 D685	E681-Y683 VanDerWaalsContact C-N 3.31Å; E681-Y683 PolarHBondContact O-N 3.28Å; E681-I684 PolarHBondContact O-N 2.75Å; E681-D685 PolarHBondContact O-N 2.87Å
682	E	36.5	Very low	37.9	Very low	134 Å²	134	95.4 Å²	95.4	63%	0.626	52%	0.517	S	S	*	.	H	α-helix	trans	-69.1	-25.6	-175.1	-60.3	-168.8	-94.5	0	0	113.9	G680	G680-E682 PolarHBondContact O-N 3.36Å; G680-E682 VanDerWaalsContact O-N 3.17Å
683	Y	41	Very low	38.5	Very low	157 Å²	157	97.9 Å²	97.9	62%	0.616	53%	0.525	S	S	*	.	H	α-helix	trans	-88.9	-30.4	176.7	-154.7	-112.8	0	0	0	111.8	G680 E681 L687	G680-Y683 PolarHBondContact O-N 3.01Å; E681-Y683 VanDerWaalsContact C-N 3.31Å; E681-Y683 PolarHBondContact O-N 3.28Å; Y683-L687 HydrophobicContact CD1-CD1 3.61Å; Y683-L687 HydrophobicContact CD1-CG 4.28Å; Y683-L687 HydrophobicContact CE1-CD1 3.83Å; Y683-L687 HydrophobicContact CE1-CG 4.35Å; Y683-L687 WeakPolarHBondContact O-CB 3.35Å; Y683-L687 WeakPolarHBondContact O-CD1 3.38Å; Y683-L687 VanDerWaalsContact O-CG 3.24Å; Y683-L687 WeakPolarHBondContact O-CG 3.47Å; Y683-L687 PolarHBondContact O-N 2.87Å
684	I	42	Very low	39.1	Very low	25 Å²	25	101.3 Å²	101.3	13%	0.128	55%	0.545	C	S	.	.	H	α-helix	trans	-62.8	-47.8	169.4	-70.4	170	0	0	0	109.3	G680 E681 E686 L687 D688 V710 E714	G680-I684 WeakPolarHBondContact O-CG1 3.3Å; G680-I684 PolarHBondContact O-N 3.3Å; E681-I684 PolarHBondContact O-N 2.75Å; I684-E686 VanDerWaalsContact C-N 3.32Å; I684-E686 PolarHBondContact O-N 2.74Å; I684-L687 PolarHBondContact O-N 3.29Å; I684-L687 VanDerWaalsContact O-N 3.08Å; I684-D688 WeakPolarHBondContact O-CB 3.33Å; I684-D688 PolarHBondContact O-N 3.2Å; I684-V710 HydrophobicContact CG1-CG1 4.19Å; I684-V710 HydrophobicContact CG2-CG1 3.9Å; I684-E714 HydrophobicContact CD1-CB 4.03Å; I684-E714 HydrophobicContact CD1-CG 4.18Å
685	D	39.3	Very low	39.8	Very low	114 Å²	114	98.9 Å²	98.9	61%	0.61	54%	0.544	S	S	*	.	H	α-helix	trans	-59.6	-36.1	179.3	-114.8	6.9	0	0	0	113	E681 Q689	E681-D685 PolarHBondContact O-N 2.87Å; D685-Q689 WeakPolarHBondContact O-CG 3.28Å; D685-Q689 PolarHBondContact O-NE2 2.64Å
686	E	43.8	Very low	40.7	Very low	140 Å²	140	95.9 Å²	95.9	65%	0.654	53%	0.53	S	S	*	.	H	α-helix	trans	-76.6	-35.3	172.6	-77.7	-157.7	139.5	0	0	113.2	I684	I684-E686 VanDerWaalsContact C-N 3.32Å; I684-E686 PolarHBondContact O-N 2.74Å
687	L	40.9	Very low	41.6	Very low	24 Å²	24	96.9 Å²	96.9	13%	0.126	53%	0.528	C	S	.	.	H	α-helix	trans	-69	-37.2	176.1	-78	168.5	0	0	0	112.3	Y683 I684 Q689 S690 K696 Y698	Y683-L687 HydrophobicContact CD1-CD1 3.61Å; Y683-L687 HydrophobicContact CD1-CG 4.28Å; Y683-L687 HydrophobicContact CE1-CD1 3.83Å; Y683-L687 HydrophobicContact CE1-CG 4.35Å; Y683-L687 WeakPolarHBondContact O-CB 3.35Å; Y683-L687 WeakPolarHBondContact O-CD1 3.38Å; Y683-L687 VanDerWaalsContact O-CG 3.24Å; Y683-L687 WeakPolarHBondContact O-CG 3.47Å; Y683-L687 PolarHBondContact O-N 2.87Å; I684-L687 PolarHBondContact O-N 3.29Å; I684-L687 VanDerWaalsContact O-N 3.08Å; L687-Q689 VanDerWaalsContact C-N 3.27Å; L687-Q689 PolarHBondContact O-N 3.11Å; L687-S690 WeakPolarHBondContact O-CB 3.48Å; L687-S690 PolarHBondContact O-N 3.36Å; L687-S690 PolarHBondContact O-OG 3.08Å; L687-K696 HydrophobicContact CD2-CD 4.28Å; L687-Y698 HydrophobicContact CD1-CE1 3.79Å; L687-Y698 HydrophobicContact CD2-CE1 4.43Å
688	D	44.8	Very low	42.8	Very low	75 Å²	75	97.1 Å²	97.1	40%	0.401	52%	0.519	S	S	.	.	H	α-helix	trans	-73.5	-21.6	-178.5	-143.1	31.1	0	0	0	112.5	I684 S690 K693	I684-D688 WeakPolarHBondContact O-CB 3.33Å; I684-D688 PolarHBondContact O-N 3.2Å; D688-S690 VanDerWaalsContact C-N 3.3Å; D688-K693 VanDerWaalsContact OD1-CE 3.24Å; D688-K693 WeakPolarHBondContact OD1-CE 3.33Å; D688-K693 IonicContact OD1-NZ 2.64Å; D688-K693 PolarHBondContact OD1-NZ 3.31Å; D688-K693 IonicContact OD2-NZ 2.74Å
689	Q	46	Very low	43.8	Very low	152 Å²	152	96.4 Å²	96.4	71%	0.71	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-11	167	-73.4	174.4	90.1	0	0	113.4	D685 L687	D685-Q689 WeakPolarHBondContact O-CG 3.28Å; D685-Q689 PolarHBondContact O-NE2 2.64Å; L687-Q689 VanDerWaalsContact C-N 3.27Å; L687-Q689 PolarHBondContact O-N 3.11Å
690	S	40.4	Very low	45.6	Very low	35 Å²	35	93.4 Å²	93.4	25%	0.245	49%	0.49	C	S	.	.	S	Bend	trans	-87.9	124.4	173.6	79.6	0	0	0	0	111	L687 D688 V692 K696	L687-S690 WeakPolarHBondContact O-CB 3.48Å; L687-S690 PolarHBondContact O-N 3.36Å; L687-S690 PolarHBondContact O-OG 3.08Å; D688-S690 VanDerWaalsContact C-N 3.3Å; S690-V692 PolarHBondContact O-N 3.2Å; S690-K696 PolarHBondContact OG-NZ 2.81Å
691	A	43.9	Very low	47.2	Very low	107 Å²	107	97.9 Å²	97.9	88%	0.884	52%	0.52	S	S	*	.	S	Bend	trans	-75	35.1	-174.9	0	0	0	0	0	114.4
692	V	46.2	Very low	48.8	Very low	79 Å²	79	92.9 Å²	92.9	48%	0.479	50%	0.498	S	S	.	.			trans	-130.3	67.7	-177.4	-170.9	0	0	0	0	107.8	S690	S690-V692 PolarHBondContact O-N 3.2Å
693	K	42.9	Very low	50.5	Low	120 Å²	120	87.5 Å²	87.5	52%	0.522	47%	0.474	S	S	.	.			trans	-79.2	-19.4	-168.9	-75.1	-161	164.1	-136.2	0	115.2	D688	D688-K693 VanDerWaalsContact OD1-CE 3.24Å; D688-K693 WeakPolarHBondContact OD1-CE 3.33Å; D688-K693 IonicContact OD1-NZ 2.64Å; D688-K693 PolarHBondContact OD1-NZ 3.31Å; D688-K693 IonicContact OD2-NZ 2.74Å
694	E	46.6	Very low	51.9	Low	192 Å²	192	86.5 Å²	86.5	90%	0.897	48%	0.48	S	S	*	.	S	Bend	trans	-115.2	-2.7	-155	-66.5	171.3	169.9	0	0	115.9
695	S	47.4	Very low	53.4	Low	97 Å²	97	89.3 Å²	89.3	68%	0.678	50%	0.495	S	S	*	.			trans	-139.1	10	-169.8	59.7	0	0	0	0	116.8
696	K	50.4	Low	55	Low	61 Å²	61	89.7 Å²	89.7	27%	0.265	50%	0.497	S	S	.	.			trans	-84	120.2	175.3	-69.7	174.4	-177.3	170.2	0	111.1	L687 S690 Y698 G709	L687-K696 HydrophobicContact CD2-CD 4.28Å; S690-K696 PolarHBondContact OG-NZ 2.81Å; K696-Y698 HydrophobicContact CB-CE1 4.29Å; K696-Y698 HydrophobicContact CB-CE2 3.91Å; K696-Y698 WeakPolarHBondContact CD-OH 3.14Å; K696-G709 PolarHBondContact O-N 3.18Å
697	L	52.1	Low	56.5	Low	136 Å²	136	83.3 Å²	83.3	71%	0.712	47%	0.467	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	123.1	164.8	-66.6	171	0	0	0	108.9
698	Y	54.4	Low	57.8	Low	37 Å²	37	84.7 Å²	84.7	15%	0.145	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	135.4	172.5	-55	-81.4	0	0	0	108.8	L687 K696 D706 I707 V710 L713	L687-Y698 HydrophobicContact CD1-CE1 3.79Å; L687-Y698 HydrophobicContact CD2-CE1 4.43Å; K696-Y698 HydrophobicContact CB-CE1 4.29Å; K696-Y698 HydrophobicContact CB-CE2 3.91Å; K696-Y698 WeakPolarHBondContact CD-OH 3.14Å; Y698-D706 CarbonylContact O-C 3.57Å; Y698-D706 WeakPolarHBondContact O-CA 3.14Å; Y698-I707 PolarHBondContact N-O 3.5Å; Y698-I707 PolarHBondContact O-N 2.76Å; Y698-V710 HydrophobicContact CE2-CG2 4.45Å; Y698-L713 HydrophobicContact CD1-CD2 3.95Å; Y698-L713 HydrophobicContact CD2-CB 4.41Å; Y698-L713 HydrophobicContact CD2-CD2 4.12Å; Y698-L713 HydrophobicContact CE1-CD2 4.34Å; Y698-L713 HydrophobicContact CE2-CD2 4.49Å; Y698-L713 HydrophobicContact CG-CD2 3.84Å
699	C	55.2	Low	58.6	Low	101 Å²	101	82.1 Å²	82.1	68%	0.682	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	124.1	176.5	56.3	0	0	0	0	110.6	S701 D706	C699-S701 PolarHBondContact O-N 3.31Å; C699-D706 WeakPolarHBondContact CB-OD1 3.41Å
700	C	75	Confident	59.5	Low	15 Å²	15	75.7 Å²	75.7	10%	0.101	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	109.7	173.3	-176.8	0	0	0	0	110.2	L702 C703 N704 L705 I707 H716 H722	C700-L702 VanDerWaalsContact C-N 3.26Å; C700-L702 PolarHBondContact O-N 2.96Å; C700-C703 HydrophobicContact CB-CB 4.13Å; C700-C703 CarbonylContact O-C 3.58Å; C700-C703 PolarHBondContact O-N 2.98Å; C700-N704 WeakPolarHBondContact O-CA 3.41Å; C700-N704 PolarHBondContact O-N 2.84Å; C700-L705 PolarHBondContact N-O 3.29Å; C700-L705 PolarHBondContact O-N 3.26Å; C700-I707 HydrophobicContact CB-CD1 4.14Å; C700-H716 WeakPolarHBondContact CB-NE2 3.33Å; C700-H716 PolarHBondContact SG-NE2 3.23Å; C700-H722 VanDerWaalsContact SG-CE1 3.51Å
701	S	66.9	Low	60.9	Low	105 Å²	105	79.7 Å²	79.7	73%	0.734	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-19.5	178.9	56.4	0	0	0	0	114.8	C699	C699-S701 PolarHBondContact O-N 3.31Å
702	L	68.4	Low	62.2	Low	45 Å²	45	80.7 Å²	80.7	24%	0.236	44%	0.444	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-28.4	173.1	-67.2	179.1	0	0	0	112.3	C700 Q725 Y726 R729 V730	C700-L702 VanDerWaalsContact C-N 3.26Å; C700-L702 PolarHBondContact O-N 2.96Å; L702-Q725 PolarHBondContact O-OE1 3.35Å; L702-Y726 HydrophobicContact CD1-CD2 3.62Å; L702-Y726 HydrophobicContact CD1-CE2 4.39Å; L702-Y726 HydrophobicContact CD1-CG 4.45Å; L702-R729 WeakPolarHBondContact O-CD 3.5Å; L702-R729 PolarHBondContact O-NH1 3.35Å; L702-V730 HydrophobicContact CD1-CG2 4.46Å; L702-V730 HydrophobicContact CD2-CG2 4.01Å
703	C	72.3	Confident	63.5	Low	20 Å²	20	78 Å²	78	14%	0.135	43%	0.427	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.7	-6.3	-174.3	-58.4	0	0	0	0	114.5	C700 L705 H716 H722 Q725	C700-C703 HydrophobicContact CB-CB 4.13Å; C700-C703 CarbonylContact O-C 3.58Å; C700-C703 PolarHBondContact O-N 2.98Å; C703-L705 HydrophobicContact CB-CB 4.12Å; C703-L705 PolarHBondContact O-N 3.37Å; C703-H716 VanDerWaalsContact SG-CE1 3.54Å; C703-H722 PolarHBondContact SG-ND1 3.45Å; C703-Q725 VanDerWaalsContact CA-OE1 3.3Å; C703-Q725 PolarHBondContact SG-OE1 2.84Å; C703-Q725 VanDerWaalsContact SG-OE1 3.38Å
704	N	72.2	Confident	64.8	Low	137 Å²	137	76.4 Å²	76.4	73%	0.733	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	42.8	-170.9	-65.5	-11.6	0	0	0	113.1	C700	C700-N704 WeakPolarHBondContact O-CA 3.41Å; C700-N704 PolarHBondContact O-N 2.84Å
705	L	72.6	Confident	66.3	Low	84 Å²	84	72.9 Å²	72.9	44%	0.44	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	124.6	-171	-159.6	149.4	0	0	0	110.2	C700 C703 I707	C700-L705 PolarHBondContact N-O 3.29Å; C700-L705 PolarHBondContact O-N 3.26Å; C703-L705 HydrophobicContact CB-CB 4.12Å; C703-L705 PolarHBondContact O-N 3.37Å; L705-I707 HydrophobicContact CD2-CD1 4.41Å; L705-I707 HydrophobicContact CD2-CG1 3.6Å
706	D	72	Confident	67.9	Low	121 Å²	121	69.5 Å²	69.5	65%	0.647	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	128.4	177.2	-70.8	-30.9	0	0	0	110.7	Y698 C699	Y698-D706 CarbonylContact O-C 3.57Å; Y698-D706 WeakPolarHBondContact O-CA 3.14Å; C699-D706 WeakPolarHBondContact CB-OD1 3.41Å
707	I	75.4	Confident	69.1	Low	7 Å²	7	68.6 Å²	68.6	4%	0.036	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	116.6	-165.3	-56.1	161.2	0	0	0	108.5	Y698 C700 L705 K712 L713 H716	Y698-I707 PolarHBondContact N-O 3.5Å; Y698-I707 PolarHBondContact O-N 2.76Å; C700-I707 HydrophobicContact CB-CD1 4.14Å; L705-I707 HydrophobicContact CD2-CD1 4.41Å; L705-I707 HydrophobicContact CD2-CG1 3.6Å; I707-K712 VanDerWaalsContact CG2-C 3.45Å; I707-K712 HydrophobicContact CG2-CB 3.53Å; I707-L713 HydrophobicContact CD1-CD1 3.9Å; I707-L713 HydrophobicContact CG2-CB 4.16Å; I707-H716 HydrophobicContact CD1-CB 3.79Å; I707-H716 VanDerWaalsContact CD1-CG 3.48Å
708	S	69.8	Low	70.2	Confident	53 Å²	53	67.6 Å²	67.6	37%	0.371	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	115.9	178.6	66.8	0	0	0	0	111.3	K712	S708-K712 VanDerWaalsContact O-CD 3.29Å; S708-K712 WeakPolarHBondContact O-CD 3.38Å; S708-K712 PolarHBondContact OG-NZ 2.88Å
709	G	60.8	Low	71.5	Confident	20 Å²	20	68.1 Å²	68.1	21%	0.206	38%	0.38	C	S	.	.	S	Bend	trans	85.4	158.8	174.3	0	0	0	0	0	115.3	K696 L713	K696-G709 PolarHBondContact O-N 3.18Å; G709-L713 PolarHBondContact O-N 3.46Å
710	V	64.1	Low	72.6	Confident	17 Å²	17	67.7 Å²	67.7	10%	0.103	37%	0.374	C	S	.	.	H	α-helix	trans	-70	-47.9	-167.6	-177.3	0	0	0	0	111.9	I684 Y698 K712 L713 E714	I684-V710 HydrophobicContact CG1-CG1 4.19Å; I684-V710 HydrophobicContact CG2-CG1 3.9Å; Y698-V710 HydrophobicContact CE2-CG2 4.45Å; V710-K712 PolarHBondContact O-N 2.85Å; V710-L713 WeakPolarHBondContact O-CA 3.47Å; V710-L713 WeakPolarHBondContact O-CB 3.32Å; V710-L713 PolarHBondContact O-N 3.29Å; V710-E714 PolarHBondContact O-N 3.43Å
711	D	70.6	Confident	72.7	Confident	120 Å²	120	69.3 Å²	69.3	64%	0.642	39%	0.389	S	S	*	.	H	α-helix	trans	-57.3	-37.2	-178.8	-35.1	-22.1	0	0	0	111.8	N715	D711-N715 WeakPolarHBondContact O-CB 3.09Å; D711-N715 PolarHBondContact O-N 3.2Å; D711-N715 PolarHBondContact O-ND2 3.31Å
712	K	72.1	Confident	73.4	Confident	127 Å²	127	65.2 Å²	65.2	55%	0.552	36%	0.358	S	S	*	.	H	α-helix	trans	-72.5	-30	176.8	-59.1	-166.7	-162.5	172.6	0	112.3	I707 S708 V710 H716	I707-K712 VanDerWaalsContact CG2-C 3.45Å; I707-K712 HydrophobicContact CG2-CB 3.53Å; S708-K712 VanDerWaalsContact O-CD 3.29Å; S708-K712 WeakPolarHBondContact O-CD 3.38Å; S708-K712 PolarHBondContact OG-NZ 2.88Å; V710-K712 PolarHBondContact O-N 2.85Å; K712-H716 WeakPolarHBondContact O-CB 3.46Å; K712-H716 PolarHBondContact O-N 2.94Å
713	L	71.8	Confident	73.6	Confident	24 Å²	24	67.1 Å²	67.1	13%	0.126	37%	0.366	C	S	.	.	H	α-helix	trans	-70.5	-46.4	175.4	178.6	63.4	0	0	0	110.6	Y698 I707 G709 V710 H716 L717	Y698-L713 HydrophobicContact CD1-CD2 3.95Å; Y698-L713 HydrophobicContact CD2-CB 4.41Å; Y698-L713 HydrophobicContact CD2-CD2 4.12Å; Y698-L713 HydrophobicContact CE1-CD2 4.34Å; Y698-L713 HydrophobicContact CE2-CD2 4.49Å; Y698-L713 HydrophobicContact CG-CD2 3.84Å; I707-L713 HydrophobicContact CD1-CD1 3.9Å; I707-L713 HydrophobicContact CG2-CB 4.16Å; G709-L713 PolarHBondContact O-N 3.46Å; V710-L713 WeakPolarHBondContact O-CA 3.47Å; V710-L713 WeakPolarHBondContact O-CB 3.32Å; V710-L713 PolarHBondContact O-N 3.29Å; L713-H716 WeakPolarHBondContact O-CB 3.34Å; L713-H716 PolarHBondContact O-N 3.41Å; L713-L717 HydrophobicContact CD1-CD1 3.97Å; L713-L717 HydrophobicContact CD1-CG 4.29Å; L713-L717 HydrophobicContact CG-CD1 3.82Å; L713-L717 WeakPolarHBondContact O-CD1 3.14Å; L713-L717 VanDerWaalsContact O-CG 3.24Å; L713-L717 WeakPolarHBondContact O-CG 3.45Å; L713-L717 PolarHBondContact O-N 2.96Å
714	E	71	Confident	73.7	Confident	85 Å²	85	71.5 Å²	71.5	40%	0.397	38%	0.384	S	S	.	.	H	α-helix	trans	-58.5	-53	174.5	-173.9	177.9	178.9	0	0	111.1	I684 V710 H716 L717 H718	I684-E714 HydrophobicContact CD1-CB 4.03Å; I684-E714 HydrophobicContact CD1-CG 4.18Å; V710-E714 PolarHBondContact O-N 3.43Å; E714-H716 VanDerWaalsContact C-N 3.25Å; E714-H716 PolarHBondContact O-N 2.77Å; E714-L717 PolarHBondContact O-N 3.03Å; E714-L717 VanDerWaalsContact O-N 3.17Å; E714-H718 PolarHBondContact O-CD2 3.43Å; E714-H718 VanDerWaalsContact O-CD2 3.23Å; E714-H718 PolarHBondContact O-N 3.15Å
715	N	78	Confident	73.7	Confident	119 Å²	119	68 Å²	68	64%	0.636	36%	0.363	S	S	*	.	H	α-helix	trans	-61	-31.4	176.4	-79.8	-78.7	0	0	0	113.2	D711 S719	D711-N715 WeakPolarHBondContact O-CB 3.09Å; D711-N715 PolarHBondContact O-N 3.2Å; D711-N715 PolarHBondContact O-ND2 3.31Å; N715-S719 WeakPolarHBondContact O-CB 3.29Å; N715-S719 PolarHBondContact O-N 2.85Å; N715-S719 VanDerWaalsContact O-N 3.15Å
716	H	81.9	Confident	73.5	Confident	26 Å²	26	68.8 Å²	68.8	12%	0.12	36%	0.361	C	S	.	.	H	α-helix	trans	-68.5	-48.3	173.4	173.9	83.9	0	0	0	111.8	C700 C703 I707 K712 L713 E714 H718 S719 H722	C700-H716 WeakPolarHBondContact CB-NE2 3.33Å; C700-H716 PolarHBondContact SG-NE2 3.23Å; C703-H716 VanDerWaalsContact SG-CE1 3.54Å; I707-H716 HydrophobicContact CD1-CB 3.79Å; I707-H716 VanDerWaalsContact CD1-CG 3.48Å; K712-H716 WeakPolarHBondContact O-CB 3.46Å; K712-H716 PolarHBondContact O-N 2.94Å; L713-H716 WeakPolarHBondContact O-CB 3.34Å; L713-H716 PolarHBondContact O-N 3.41Å; E714-H716 VanDerWaalsContact C-N 3.25Å; E714-H716 PolarHBondContact O-N 2.77Å; H716-H718 VanDerWaalsContact C-N 3.32Å; H716-H718 PolarHBondContact O-N 3.22Å; H716-S719 WeakPolarHBondContact O-CB 3.39Å; H716-S719 PolarHBondContact O-N 3.4Å; H716-H722 AromaticContact CD2-ND1 3.49Å; H716-H722 PolarHBondContact CD2-ND1 2.91Å; H716-H722 AromaticContact CE1-ND1 3.9Å; H716-H722 AromaticContact NE2-CE1 3.9Å; H716-H722 AromaticContact NE2-CG 3.93Å; H716-H722 AromaticContact NE2-ND1 3Å; H716-H722 PolarHBondContact NE2-ND1 3.25Å; H716-H722 WeakPolarHBondContact O-CB 3.42Å
717	L	75.3	Confident	73.3	Confident	41 Å²	41	69.2 Å²	69.2	22%	0.215	36%	0.357	C	S	.	.	H	α-helix	trans	-63.8	-37	-178.6	-69.4	158.1	0	0	0	112.1	A679 L713 E714 S719	A679-L717 VanDerWaalsContact O-CD1 3.28Å; A679-L717 WeakPolarHBondContact O-CD1 3.42Å; L713-L717 HydrophobicContact CD1-CD1 3.97Å; L713-L717 HydrophobicContact CD1-CG 4.29Å; L713-L717 HydrophobicContact CG-CD1 3.82Å; L713-L717 WeakPolarHBondContact O-CD1 3.14Å; L713-L717 VanDerWaalsContact O-CG 3.24Å; L713-L717 WeakPolarHBondContact O-CG 3.45Å; L713-L717 PolarHBondContact O-N 2.96Å; E714-L717 PolarHBondContact O-N 3.03Å; E714-L717 VanDerWaalsContact O-N 3.17Å; L717-S719 VanDerWaalsContact C-N 3.33Å
718	H	73.9	Confident	72.8	Confident	115 Å²	115	73.2 Å²	73.2	53%	0.532	39%	0.386	S	S	.	.	H	α-helix	trans	-79.4	-10.5	174	-70.1	-68.5	0	0	0	114.1	E714 H716 Q723	E714-H718 PolarHBondContact O-CD2 3.43Å; E714-H718 VanDerWaalsContact O-CD2 3.23Å; E714-H718 PolarHBondContact O-N 3.15Å; H716-H718 VanDerWaalsContact C-N 3.32Å; H716-H718 PolarHBondContact O-N 3.22Å; H718-Q723 PolarHBondContact O-NE2 3.06Å
719	S	82.8	Confident	72.2	Confident	48 Å²	48	77.6 Å²	77.6	34%	0.336	39%	0.394	S	S	.	.	S	Bend	trans	-62.6	138.5	-179.2	-176.6	0	0	0	0	112.5	N715 H716 L717 A721 H722 Q723	N715-S719 WeakPolarHBondContact O-CB 3.29Å; N715-S719 PolarHBondContact O-N 2.85Å; N715-S719 VanDerWaalsContact O-N 3.15Å; H716-S719 WeakPolarHBondContact O-CB 3.39Å; H716-S719 PolarHBondContact O-N 3.4Å; L717-S719 VanDerWaalsContact C-N 3.33Å; S719-A721 PolarHBondContact O-N 2.85Å; S719-A721 PolarHBondContact OG-N 3.08Å; S719-H722 WeakPolarHBondContact O-CB 3.28Å; S719-H722 PolarHBondContact O-N 2.92Å; S719-Q723 PolarHBondContact O-N 3.31Å
720	V	78.2	Confident	71.5	Confident	93 Å²	93	78.7 Å²	78.7	56%	0.564	40%	0.397	S	S	*	.	H	α-helix	trans	-55.3	-40	174.7	-177.7	0	0	0	0	110.9	H722 Q723 E724	V720-H722 VanDerWaalsContact C-N 3.34Å; V720-H722 PolarHBondContact O-N 2.96Å; V720-Q723 CarbonylContact O-C 3.54Å; V720-Q723 PolarHBondContact O-N 3.19Å; V720-Q723 VanDerWaalsContact O-N 3.13Å; V720-E724 HydrophobicContact CG1-CG 4.33Å; V720-E724 WeakPolarHBondContact O-CG 3.37Å; V720-E724 PolarHBondContact O-N 3.33Å
721	A	77.6	Confident	70.4	Confident	49 Å²	49	81.4 Å²	81.4	41%	0.405	41%	0.411	S	S	.	.	H	α-helix	trans	-64	-36	177.7	0	0	0	0	0	112.9	S719 Q725	S719-A721 PolarHBondContact O-N 2.85Å; S719-A721 PolarHBondContact OG-N 3.08Å; A721-Q725 WeakPolarHBondContact O-CB 3.33Å; A721-Q725 WeakPolarHBondContact O-CG 3.47Å; A721-Q725 PolarHBondContact O-N 3.32Å
722	H	80.8	Confident	68.9	Low	19 Å²	19	79.8 Å²	79.8	9%	0.088	41%	0.407	C	S	.	.	H	α-helix	trans	-68.1	-43	172.5	-178.8	96.1	0	0	0	110.6	C700 C703 H716 S719 V720 E724 Q725 Y726	C700-H722 VanDerWaalsContact SG-CE1 3.51Å; C703-H722 PolarHBondContact SG-ND1 3.45Å; H716-H722 AromaticContact CD2-ND1 3.49Å; H716-H722 PolarHBondContact CD2-ND1 2.91Å; H716-H722 AromaticContact CE1-ND1 3.9Å; H716-H722 AromaticContact NE2-CE1 3.9Å; H716-H722 AromaticContact NE2-CG 3.93Å; H716-H722 AromaticContact NE2-ND1 3Å; H716-H722 PolarHBondContact NE2-ND1 3.25Å; H716-H722 WeakPolarHBondContact O-CB 3.42Å; S719-H722 WeakPolarHBondContact O-CB 3.28Å; S719-H722 PolarHBondContact O-N 2.92Å; V720-H722 VanDerWaalsContact C-N 3.34Å; V720-H722 PolarHBondContact O-N 2.96Å; H722-E724 VanDerWaalsContact C-N 3.31Å; H722-E724 PolarHBondContact O-N 2.93Å; H722-Q725 PolarHBondContact O-N 3.14Å; H722-Y726 VanDerWaalsContact O-CB 3.32Å; H722-Y726 WeakPolarHBondContact O-CB 3.12Å; H722-Y726 PolarHBondContact O-N 3.38Å
723	Q	72.7	Confident	67.3	Low	84 Å²	84	79.1 Å²	79.1	39%	0.393	41%	0.406	S	S	.	.	H	α-helix	trans	-64.5	-33.5	177	-63.5	-177	27.6	0	0	113	H718 S719 V720 K727	H718-Q723 PolarHBondContact O-NE2 3.06Å; S719-Q723 PolarHBondContact O-N 3.31Å; V720-Q723 CarbonylContact O-C 3.54Å; V720-Q723 PolarHBondContact O-N 3.19Å; V720-Q723 VanDerWaalsContact O-N 3.13Å; Q723-K727 WeakPolarHBondContact O-CB 3.37Å; Q723-K727 VanDerWaalsContact O-CD 3.29Å; Q723-K727 WeakPolarHBondContact O-CD 3.35Å; Q723-K727 WeakPolarHBondContact O-CG 3.5Å; Q723-K727 PolarHBondContact O-N 3.15Å
724	E	75	Confident	65.5	Low	112 Å²	112	88.8 Å²	88.8	52%	0.523	44%	0.44	S	S	.	.	H	α-helix	trans	-72.7	-41.5	174.9	-74.3	171.7	172.8	0	0	111.9	V720 H722 Y726 K727 S728	V720-E724 HydrophobicContact CG1-CG 4.33Å; V720-E724 WeakPolarHBondContact O-CG 3.37Å; V720-E724 PolarHBondContact O-N 3.33Å; H722-E724 VanDerWaalsContact C-N 3.31Å; H722-E724 PolarHBondContact O-N 2.93Å; E724-Y726 VanDerWaalsContact C-N 3.33Å; E724-K727 PolarHBondContact O-N 3.48Å; E724-S728 WeakPolarHBondContact O-CB 3.24Å; E724-S728 PolarHBondContact O-N 2.89Å; E724-S728 PolarHBondContact O-OG 3.36Å
725	Q	71	Confident	63.9	Low	63 Å²	63	90.7 Å²	90.7	29%	0.294	45%	0.452	S	S	.	.	H	α-helix	trans	-67.1	-34.2	172.8	-69.8	-173.4	29.9	0	0	112.1	L702 C703 A721 H722 S728 R729	L702-Q725 PolarHBondContact O-OE1 3.35Å; C703-Q725 VanDerWaalsContact CA-OE1 3.3Å; C703-Q725 PolarHBondContact SG-OE1 2.84Å; C703-Q725 VanDerWaalsContact SG-OE1 3.38Å; A721-Q725 WeakPolarHBondContact O-CB 3.33Å; A721-Q725 WeakPolarHBondContact O-CG 3.47Å; A721-Q725 PolarHBondContact O-N 3.32Å; H722-Q725 PolarHBondContact O-N 3.14Å; Q725-S728 WeakPolarHBondContact CA-OG 3.37Å; Q725-S728 PolarHBondContact O-OG 3.41Å; Q725-R729 WeakPolarHBondContact O-CB 3.43Å; Q725-R729 WeakPolarHBondContact O-CG 3.17Å; Q725-R729 PolarHBondContact O-N 2.9Å
726	Y	68.9	Low	61.6	Low	101 Å²	101	88.4 Å²	88.4	40%	0.396	44%	0.442	S	S	.	.	H	α-helix	trans	-61.5	-54.1	168.4	-174.4	-78.7	0	0	0	110.9	L702 H722 E724 S728 R729 V730	L702-Y726 HydrophobicContact CD1-CD2 3.62Å; L702-Y726 HydrophobicContact CD1-CE2 4.39Å; L702-Y726 HydrophobicContact CD1-CG 4.45Å; H722-Y726 VanDerWaalsContact O-CB 3.32Å; H722-Y726 WeakPolarHBondContact O-CB 3.12Å; H722-Y726 PolarHBondContact O-N 3.38Å; E724-Y726 VanDerWaalsContact C-N 3.33Å; Y726-S728 VanDerWaalsContact C-N 3.26Å; Y726-S728 PolarHBondContact O-N 3.26Å; Y726-R729 PolarHBondContact O-N 3.31Å; Y726-V730 HydrophobicContact CD1-CB 4.36Å; Y726-V730 HydrophobicContact CD2-CG2 4.13Å; Y726-V730 HydrophobicContact CE1-CB 4.24Å; Y726-V730 HydrophobicContact CE1-CG1 4.39Å; Y726-V730 HydrophobicContact CE2-CG2 4.19Å; Y726-V730 HydrophobicContact CG-CG2 4.31Å; Y726-V730 WeakPolarHBondContact O-CA 3.29Å; Y726-V730 VanDerWaalsContact O-CB 3.23Å; Y726-V730 WeakPolarHBondContact O-CB 3.44Å; Y726-V730 PolarHBondContact O-N 3.32Å
727	K	66.8	Low	59.3	Low	131 Å²	131	93.5 Å²	93.5	57%	0.57	47%	0.466	S	S	*	.	H	α-helix	trans	-61.1	-29.8	-178.8	-72.6	161	-167.5	164.8	0	113.9	Q723 E724	Q723-K727 WeakPolarHBondContact O-CB 3.37Å; Q723-K727 VanDerWaalsContact O-CD 3.29Å; Q723-K727 WeakPolarHBondContact O-CD 3.35Å; Q723-K727 WeakPolarHBondContact O-CG 3.5Å; Q723-K727 PolarHBondContact O-N 3.15Å; E724-K727 PolarHBondContact O-N 3.48Å
728	S	64.8	Low	57.3	Low	90 Å²	90	97.1 Å²	97.1	63%	0.629	48%	0.48	S	S	*	.	H	α-helix	trans	-93.8	-26.5	-178.4	55.4	0	0	0	0	114.6	E724 Q725 Y726	E724-S728 WeakPolarHBondContact O-CB 3.24Å; E724-S728 PolarHBondContact O-N 2.89Å; E724-S728 PolarHBondContact O-OG 3.36Å; Q725-S728 WeakPolarHBondContact CA-OG 3.37Å; Q725-S728 PolarHBondContact O-OG 3.41Å; Y726-S728 VanDerWaalsContact C-N 3.26Å; Y726-S728 PolarHBondContact O-N 3.26Å
729	R	58.3	Low	55.4	Low	146 Å²	146	95 Å²	95	55%	0.551	48%	0.477	S	S	*	.	H	α-helix	trans	-99.4	-24.5	178	-61.2	178.1	172	-161.8	-7.7	113.4	L702 Q725 Y726	L702-R729 WeakPolarHBondContact O-CD 3.5Å; L702-R729 PolarHBondContact O-NH1 3.35Å; Q725-R729 WeakPolarHBondContact O-CB 3.43Å; Q725-R729 WeakPolarHBondContact O-CG 3.17Å; Q725-R729 PolarHBondContact O-N 2.9Å; Y726-R729 PolarHBondContact O-N 3.31Å
730	V	46.8	Very low	53.4	Low	43 Å²	43	95.2 Å²	95.2	26%	0.261	48%	0.476	S	S	.	.	S	Bend	trans	-105.1	71.8	175.5	-169	0	0	0	0	108.4	L702 Y726 P732	L702-V730 HydrophobicContact CD1-CG2 4.46Å; L702-V730 HydrophobicContact CD2-CG2 4.01Å; Y726-V730 HydrophobicContact CD1-CB 4.36Å; Y726-V730 HydrophobicContact CD2-CG2 4.13Å; Y726-V730 HydrophobicContact CE1-CB 4.24Å; Y726-V730 HydrophobicContact CE1-CG1 4.39Å; Y726-V730 HydrophobicContact CE2-CG2 4.19Å; Y726-V730 HydrophobicContact CG-CG2 4.31Å; Y726-V730 WeakPolarHBondContact O-CA 3.29Å; Y726-V730 VanDerWaalsContact O-CB 3.23Å; Y726-V730 WeakPolarHBondContact O-CB 3.44Å; Y726-V730 PolarHBondContact O-N 3.32Å; V730-P732 VanDerWaalsContact O-CD 3.3Å; V730-P732 WeakPolarHBondContact O-CD 3.41Å; V730-P732 VanDerWaalsContact O-N 3.1Å
731	D	39.6	Very low	51.6	Low	74 Å²	74	97.2 Å²	97.2	40%	0.396	49%	0.488	S	S	.	.			trans	-56	114.1	-179.6	177.2	-0.4	0	0	0	110.5	Q733 W734	D731-Q733 PolarHBondContact O-N 3.39Å; D731-Q733 WeakPolarHBondContact OD1-CB 3.47Å; D731-Q733 PolarHBondContact OD1-N 3.33Å; D731-W734 HydrophobicContact CB-CB 4.2Å; D731-W734 PolarHBondContact O-N 3.27Å
732	P	40	Very low	50	Low	86 Å²	86	98.8 Å²	98.8	56%	0.558	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-11.6	-176.5	30.1	-36	0	0	0	113.4	V730	V730-P732 VanDerWaalsContact O-CD 3.3Å; V730-P732 WeakPolarHBondContact O-CD 3.41Å; V730-P732 VanDerWaalsContact O-N 3.1Å
733	Q	37.7	Very low	48	Very low	113 Å²	113	101.2 Å²	101.2	53%	0.528	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-30.3	176.3	-55.2	-163.2	7.5	0	0	112.7	D731 I735 V736 Q737	D731-Q733 PolarHBondContact O-N 3.39Å; D731-Q733 WeakPolarHBondContact OD1-CB 3.47Å; D731-Q733 PolarHBondContact OD1-N 3.33Å; Q733-I735 PolarHBondContact O-N 3.4Å; Q733-V736 CarbonylContact O-C 3.57Å; Q733-V736 PolarHBondContact O-N 3.22Å; Q733-Q737 HydrophobicContact CB-CG 4.22Å
734	W	34	Very low	46.7	Very low	226 Å²	226	99.5 Å²	99.5	86%	0.856	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-8.9	-172.9	-139.2	57.5	0	0	0	114.9	D731	D731-W734 HydrophobicContact CB-CB 4.2Å; D731-W734 PolarHBondContact O-N 3.27Å
735	I	37.5	Very low	44.9	Very low	126 Å²	126	98.5 Å²	98.5	65%	0.646	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.8	-15.7	174.9	-61.3	174.8	0	0	0	111.6	Q733	Q733-I735 PolarHBondContact O-N 3.4Å
736	V	30.8	Very low	43.3	Very low	71 Å²	71	97.6 Å²	97.6	43%	0.43	50%	0.495	S	S	.	.	S	Bend	trans	-147.8	60.6	-168.9	-160.2	0	0	0	0	113.7	Q733	Q733-V736 CarbonylContact O-C 3.57Å; Q733-V736 PolarHBondContact O-N 3.22Å
737	Q	32.1	Very low	42	Very low	133 Å²	133	94.8 Å²	94.8	62%	0.621	49%	0.487	S	S	*	.			trans	-112.9	-17.5	174.2	-90.9	-175	-3.7	0	0	116.5	Q733	Q733-Q737 HydrophobicContact CB-CG 4.22Å
738	K	33.8	Very low	40.7	Very low	117 Å²	117	90.1 Å²	90.1	51%	0.509	47%	0.469	S	S	.	.	S	Bend	trans	-75.5	129.8	165.8	-76.3	-169.5	-179.3	-175.2	0	109.8	L743 D747	K738-L743 HydrophobicContact CB-CD2 4.05Å; K738-L743 HydrophobicContact CB-CG 4.47Å; K738-L743 HydrophobicContact CD-CD2 3.79Å; K738-D747 IonicContact NZ-OD1 3.86Å; K738-D747 PolarHBondContact NZ-OD1 3.26Å
739	P	35.2	Very low	39.5	Very low	71 Å²	71	88.8 Å²	88.8	46%	0.461	45%	0.454	S	S	.	.			trans	-66.9	146.6	170.5	29.7	-34	0	0	0	110.1	T741 T742	P739-T741 PolarHBondContact O-N 2.93Å; P739-T741 VanDerWaalsContact O-N 3.15Å; P739-T742 HydrophobicContact CG-CG2 4.14Å; P739-T742 PolarHBondContact O-N 3.17Å; P739-T742 PolarHBondContact O-OG1 3.07Å
740	V	40.5	Very low	38.9	Very low	52 Å²	52	88.4 Å²	88.4	32%	0.315	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-65.5	-22	-174.4	-177.8	0	0	0	0	112.1	V584 T742 L743	V584-V740 HydrophobicContact CG2-CG1 3.79Å; V740-T742 PolarHBondContact O-N 2.89Å; V740-L743 PolarHBondContact O-N 2.76Å
741	T	40.9	Very low	38.8	Very low	134 Å²	134	89.8 Å²	89.8	82%	0.822	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-64.4	-14.3	172.8	48.6	0	0	0	0	114.5	P739	P739-T741 PolarHBondContact O-N 2.93Å; P739-T741 VanDerWaalsContact O-N 3.15Å
742	T	42.5	Very low	38.8	Very low	83 Å²	83	88.2 Å²	88.2	51%	0.509	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-122	19.3	179.1	70.7	0	0	0	0	113	P739 V740	P739-T742 HydrophobicContact CG-CG2 4.14Å; P739-T742 PolarHBondContact O-N 3.17Å; P739-T742 PolarHBondContact O-OG1 3.07Å; V740-T742 PolarHBondContact O-N 2.89Å
743	L	38.9	Very low	39	Very low	69 Å²	69	90.1 Å²	90.1	36%	0.361	45%	0.452	S	S	.	.			trans	-94.2	112.5	172.9	-73.2	174.5	0	0	0	109.5	K738 V740 D747	K738-L743 HydrophobicContact CB-CD2 4.05Å; K738-L743 HydrophobicContact CB-CG 4.47Å; K738-L743 HydrophobicContact CD-CD2 3.79Å; V740-L743 PolarHBondContact O-N 2.76Å; L743-D747 HydrophobicContact CD2-CB 4.03Å
744	S	44.9	Very low	39.4	Very low	48 Å²	48	90.5 Å²	90.5	34%	0.336	45%	0.452	S	S	.	.			trans	-73.2	162.6	176.3	70.1	0	0	0	0	111.3	N746 D747 V748	S744-N746 PolarHBondContact O-N 2.92Å; S744-N746 VanDerWaalsContact O-N 3.13Å; S744-N746 WeakPolarHBondContact OG-CB 3.39Å; S744-N746 PolarHBondContact OG-N 3.49Å; S744-D747 WeakPolarHBondContact CB-OD2 3.45Å; S744-D747 PolarHBondContact N-OD2 3.14Å; S744-D747 PolarHBondContact O-N 3.32Å; S744-D747 PolarHBondContact OG-N 2.93Å; S744-D747 VanDerWaalsContact OG-N 3.11Å; S744-D747 PolarHBondContact OG-OD2 3.14Å; S744-V748 WeakPolarHBondContact O-CG2 3.45Å; S744-V748 PolarHBondContact O-N 3.17Å
745	F	38.6	Very low	39.7	Very low	91 Å²	91	81.2 Å²	81.2	40%	0.399	42%	0.424	S	S	.	.	H	α-helix	trans	-55.1	-26.9	167.2	-175.8	-112.5	0	0	0	111.9	L605 F661 V748 I749	L605-F745 HydrophobicContact CD1-CD1 4.18Å; L605-F745 HydrophobicContact CD2-CD1 4.36Å; F661-F745 HydrophobicContact CE1-CE2 4.15Å; F661-F745 HydrophobicContact CE1-CZ 4.48Å; F745-V748 PolarHBondContact O-N 2.79Å; F745-I749 HydrophobicContact CD1-CD1 3.89Å; F745-I749 HydrophobicContact CE1-CD1 3.39Å; F745-I749 HydrophobicContact CE1-CG1 4.45Å; F745-I749 HydrophobicContact CE2-CD1 4.33Å; F745-I749 HydrophobicContact CZ-CD1 3.65Å; F745-I749 HydrophobicContact CZ-CG1 4.49Å; F745-I749 PolarHBondContact O-N 3.26Å
746	N	37.7	Very low	39.8	Very low	44 Å²	44	77.9 Å²	77.9	24%	0.235	41%	0.41	C	S	.	.	H	α-helix	trans	-73.1	-47.4	-177.9	-48.4	9.4	0	0	0	110.1	L605 S744 V748 I749 F750	L605-N746 VanDerWaalsContact CD1-OD1 3.25Å; L605-N746 WeakPolarHBondContact CD1-OD1 3.41Å; L605-N746 WeakPolarHBondContact CD2-OD1 3.49Å; S744-N746 PolarHBondContact O-N 2.92Å; S744-N746 VanDerWaalsContact O-N 3.13Å; S744-N746 WeakPolarHBondContact OG-CB 3.39Å; S744-N746 PolarHBondContact OG-N 3.49Å; N746-V748 PolarHBondContact O-N 3.4Å; N746-I749 PolarHBondContact O-N 3.31Å; N746-F750 WeakPolarHBondContact O-CB 3.43Å; N746-F750 WeakPolarHBondContact O-CD2 3.43Å; N746-F750 PolarHBondContact O-N 3.39Å
747	D	41.6	Very low	40.3	Very low	43 Å²	43	81.7 Å²	81.7	23%	0.23	42%	0.417	C	S	.	.	H	α-helix	trans	-54.4	-44.8	172.8	-60.3	-94.9	0	0	0	110	K738 L743 S744 I749 F750 D751	K738-D747 IonicContact NZ-OD1 3.86Å; K738-D747 PolarHBondContact NZ-OD1 3.26Å; L743-D747 HydrophobicContact CD2-CB 4.03Å; S744-D747 WeakPolarHBondContact CB-OD2 3.45Å; S744-D747 PolarHBondContact N-OD2 3.14Å; S744-D747 PolarHBondContact O-N 3.32Å; S744-D747 PolarHBondContact OG-N 2.93Å; S744-D747 VanDerWaalsContact OG-N 3.11Å; S744-D747 PolarHBondContact OG-OD2 3.14Å; D747-I749 PolarHBondContact O-N 3.45Å; D747-F750 PolarHBondContact O-N 2.95Å; D747-D751 WeakPolarHBondContact O-CB 3.16Å; D747-D751 PolarHBondContact O-N 2.67Å
748	V	39.7	Very low	40.8	Very low	33 Å²	33	78.6 Å²	78.6	20%	0.2	41%	0.405	C	S	.	.	H	α-helix	trans	-66	-34.6	-177.2	174.3	0	0	0	0	113	Y665 S744 F745 N746	Y665-V748 HydrophobicContact CE1-CG1 4.12Å; Y665-V748 HydrophobicContact CE2-CG1 3.7Å; Y665-V748 VanDerWaalsContact CZ-CG1 3.45Å; Y665-V748 VanDerWaalsContact OH-CG1 3.3Å; Y665-V748 WeakPolarHBondContact OH-CG1 3.37Å; S744-V748 WeakPolarHBondContact O-CG2 3.45Å; S744-V748 PolarHBondContact O-N 3.17Å; F745-V748 PolarHBondContact O-N 2.79Å; N746-V748 PolarHBondContact O-N 3.4Å
749	I	39.8	Very low	41.2	Very low	62 Å²	62	78.2 Å²	78.2	32%	0.318	40%	0.403	S	S	.	.	H	α-helix	trans	-77.1	-42	172.7	-75.7	179.6	0	0	0	111.4	F608 F745 N746 D747 D751 V752 W753	F608-I749 HydrophobicContact CE1-CD1 4.25Å; F745-I749 HydrophobicContact CD1-CD1 3.89Å; F745-I749 HydrophobicContact CE1-CD1 3.39Å; F745-I749 HydrophobicContact CE1-CG1 4.45Å; F745-I749 HydrophobicContact CE2-CD1 4.33Å; F745-I749 HydrophobicContact CZ-CD1 3.65Å; F745-I749 HydrophobicContact CZ-CG1 4.49Å; F745-I749 PolarHBondContact O-N 3.26Å; N746-I749 PolarHBondContact O-N 3.31Å; D747-I749 PolarHBondContact O-N 3.45Å; I749-D751 VanDerWaalsContact C-N 3.34Å; I749-D751 PolarHBondContact O-N 3.21Å; I749-V752 PolarHBondContact O-N 3.26Å; I749-W753 WeakPolarHBondContact O-CB 3.47Å; I749-W753 PolarHBondContact O-N 2.91Å
750	F	44.7	Very low	41.5	Very low	137 Å²	137	79.2 Å²	79.2	60%	0.601	40%	0.402	S	S	*	.	H	α-helix	trans	-62.9	-38.7	178.1	-96.1	-80.3	0	0	0	112.2	N746 D747 W753 K754	N746-F750 WeakPolarHBondContact O-CB 3.43Å; N746-F750 WeakPolarHBondContact O-CD2 3.43Å; N746-F750 PolarHBondContact O-N 3.39Å; D747-F750 PolarHBondContact O-N 2.95Å; F750-W753 HydrophobicContact CD1-CE3 4.15Å; F750-W753 HydrophobicContact CE1-CE3 4.45Å; F750-W753 PolarHBondContact O-N 3.07Å; F750-K754 WeakPolarHBondContact O-CB 3.17Å; F750-K754 PolarHBondContact O-N 3Å
751	D	44.2	Very low	41.6	Very low	72 Å²	72	78.7 Å²	78.7	39%	0.385	40%	0.401	S	S	.	.	H	α-helix	trans	-59.6	-44.5	172.9	-88.9	-8.5	0	0	0	112.2	D747 I749 K754 A755	D747-D751 WeakPolarHBondContact O-CB 3.16Å; D747-D751 PolarHBondContact O-N 2.67Å; I749-D751 VanDerWaalsContact C-N 3.34Å; I749-D751 PolarHBondContact O-N 3.21Å; D751-K754 PolarHBondContact O-N 3.29Å; D751-A755 VanDerWaalsContact O-CB 3.3Å; D751-A755 WeakPolarHBondContact O-CB 3.28Å; D751-A755 PolarHBondContact O-N 2.94Å
752	V	39.8	Very low	41.8	Very low	42 Å²	42	79.5 Å²	79.5	26%	0.255	39%	0.388	S	S	.	.	H	α-helix	trans	-70.6	-39.9	178	170.5	0	0	0	0	111.4	Y665 I749 K754 A755 C756	Y665-V752 HydrophobicContact CE2-CG2 3.63Å; I749-V752 PolarHBondContact O-N 3.26Å; V752-K754 VanDerWaalsContact C-N 3.33Å; V752-K754 PolarHBondContact O-N 3.49Å; V752-A755 PolarHBondContact O-N 3.22Å; V752-C756 VanDerWaalsContact O-CB 3.28Å; V752-C756 WeakPolarHBondContact O-CB 3.24Å; V752-C756 PolarHBondContact O-N 3.33Å; V752-C756 PolarHBondContact O-SG 3.17Å; V752-C756 VanDerWaalsContact O-SG 3.33Å
753	W	43.4	Very low	41.6	Very low	125 Å²	125	79.5 Å²	79.5	47%	0.473	39%	0.385	S	S	.	.	H	α-helix	trans	-60.3	-43.9	173.4	176.6	79	0	0	0	111.6	I749 F750 C756 R757	I749-W753 WeakPolarHBondContact O-CB 3.47Å; I749-W753 PolarHBondContact O-N 2.91Å; F750-W753 HydrophobicContact CD1-CE3 4.15Å; F750-W753 HydrophobicContact CE1-CE3 4.45Å; F750-W753 PolarHBondContact O-N 3.07Å; W753-C756 PolarHBondContact O-N 2.9Å; W753-R757 VanDerWaalsContact CH2-NH1 3.26Å; W753-R757 WeakPolarHBondContact O-CB 3.28Å; W753-R757 PolarHBondContact O-N 2.83Å
754	K	47.5	Very low	41.5	Very low	122 Å²	122	79.2 Å²	79.2	53%	0.53	38%	0.383	S	S	.	.	H	α-helix	trans	-65.3	-47.9	177.7	-169.8	176.8	-179.9	-175	0	111.4	F750 D751 V752 C756 R757 D758	F750-K754 WeakPolarHBondContact O-CB 3.17Å; F750-K754 PolarHBondContact O-N 3Å; D751-K754 PolarHBondContact O-N 3.29Å; V752-K754 VanDerWaalsContact C-N 3.33Å; V752-K754 PolarHBondContact O-N 3.49Å; K754-C756 PolarHBondContact O-N 2.94Å; K754-R757 PolarHBondContact O-N 2.95Å; K754-D758 WeakPolarHBondContact O-CB 3.38Å; K754-D758 VanDerWaalsContact O-CG 3.29Å; K754-D758 PolarHBondContact O-N 3.05Å
755	A	40.2	Very low	41.4	Very low	31 Å²	31	83 Å²	83	26%	0.256	39%	0.39	S	S	.	.	H	α-helix	trans	-60.3	-42.6	175.8	0	0	0	0	0	112.6	D751 V752 D758 K759	D751-A755 VanDerWaalsContact O-CB 3.3Å; D751-A755 WeakPolarHBondContact O-CB 3.28Å; D751-A755 PolarHBondContact O-N 2.94Å; V752-A755 PolarHBondContact O-N 3.22Å; A755-D758 PolarHBondContact O-N 2.85Å; A755-K759 WeakPolarHBondContact O-CB 3.34Å; A755-K759 PolarHBondContact O-N 3.44Å
756	C	38.5	Very low	41.5	Very low	55 Å²	55	82.3 Å²	82.3	37%	0.372	39%	0.393	S	S	.	.	H	α-helix	trans	-66.6	-40.7	174.7	-73.8	0	0	0	0	112.2	V752 W753 K754 K759 H760	V752-C756 VanDerWaalsContact O-CB 3.28Å; V752-C756 WeakPolarHBondContact O-CB 3.24Å; V752-C756 PolarHBondContact O-N 3.33Å; V752-C756 PolarHBondContact O-SG 3.17Å; V752-C756 VanDerWaalsContact O-SG 3.33Å; W753-C756 PolarHBondContact O-N 2.9Å; K754-C756 PolarHBondContact O-N 2.94Å; C756-K759 PolarHBondContact O-N 3.17Å; C756-H760 WeakPolarHBondContact O-CB 3.45Å; C756-H760 PolarHBondContact O-N 3.23Å
757	R	41.8	Very low	41.4	Very low	151 Å²	151	83.3 Å²	83.3	57%	0.57	40%	0.401	S	S	*	.	H	α-helix	trans	-63.1	-41.1	174.1	178.6	-179.7	174.8	-171.6	-3.1	111.8	W753 K754 S761	W753-R757 VanDerWaalsContact CH2-NH1 3.26Å; W753-R757 WeakPolarHBondContact O-CB 3.28Å; W753-R757 PolarHBondContact O-N 2.83Å; K754-R757 PolarHBondContact O-N 2.95Å; R757-S761 WeakPolarHBondContact O-CB 3.3Å; R757-S761 PolarHBondContact O-N 2.96Å
758	D	42.3	Very low	41.5	Very low	69 Å²	69	87.6 Å²	87.6	37%	0.369	42%	0.419	S	S	.	.	H	α-helix	trans	-77.1	-24.9	179.6	-69.4	-23.1	0	0	0	112.4	K754 A755 R762	K754-D758 WeakPolarHBondContact O-CB 3.38Å; K754-D758 VanDerWaalsContact O-CG 3.29Å; K754-D758 PolarHBondContact O-N 3.05Å; A755-D758 PolarHBondContact O-N 2.85Å; D758-R762 WeakPolarHBondContact O-CG 3.32Å; D758-R762 PolarHBondContact O-N 3.23Å; D758-R762 PolarHBondContact O-NE 2.92Å
759	K	42	Very low	41.8	Very low	108 Å²	108	96.1 Å²	96.1	47%	0.47	45%	0.448	S	S	.	.	H	α-helix	trans	-70.4	-54.6	165.7	-176.5	168.8	-178.8	172.6	0	110.7	A755 C756 S761 R762 D763	A755-K759 WeakPolarHBondContact O-CB 3.34Å; A755-K759 PolarHBondContact O-N 3.44Å; C756-K759 PolarHBondContact O-N 3.17Å; K759-S761 PolarHBondContact O-N 3.25Å; K759-R762 CarbonylContact O-C 3.31Å; K759-R762 WeakPolarHBondContact O-CA 3.1Å; K759-R762 WeakPolarHBondContact O-CB 3.31Å; K759-R762 PolarHBondContact O-N 3Å; K759-D763 WeakPolarHBondContact CG-OD2 3.46Å; K759-D763 PolarHBondContact O-N 3.02Å
760	H	41.4	Very low	41.7	Very low	92 Å²	92	96 Å²	96	43%	0.426	45%	0.45	S	S	.	.	H	α-helix	trans	-57.7	-35.7	176	-173.2	-64.9	0	0	0	112.2	C756 M764	C756-H760 WeakPolarHBondContact O-CB 3.45Å; C756-H760 PolarHBondContact O-N 3.23Å; H760-M764 WeakPolarHBondContact CE1-CG 3.5Å; H760-M764 WeakPolarHBondContact ND1-CG 3.26Å; H760-M764 VanDerWaalsContact O-CB 3.28Å; H760-M764 WeakPolarHBondContact O-CB 3.35Å; H760-M764 WeakPolarHBondContact O-CG 3.48Å; H760-M764 PolarHBondContact O-N 3.2Å
761	S	43.2	Very low	41.7	Very low	42 Å²	42	95.5 Å²	95.5	29%	0.294	46%	0.461	S	S	.	.	H	α-helix	trans	-71.8	-26.8	175.3	-175.5	0	0	0	0	113.4	R757 K759 R765	R757-S761 WeakPolarHBondContact O-CB 3.3Å; R757-S761 PolarHBondContact O-N 2.96Å; K759-S761 PolarHBondContact O-N 3.25Å; S761-R765 WeakPolarHBondContact O-CB 3.2Å; S761-R765 WeakPolarHBondContact O-CG 3.38Å; S761-R765 PolarHBondContact O-N 3.02Å; S761-R765 PolarHBondContact O-NE 3.41Å; S761-R765 PolarHBondContact OG-NH2 2.96Å
762	R	44.7	Very low	41.8	Very low	151 Å²	151	96.6 Å²	96.6	57%	0.57	47%	0.47	S	S	*	.	H	α-helix	trans	-75	-51.2	168.3	-82.4	175.1	-76.6	171.5	-6.3	110.4	D758 K759 M764 R765 T766	D758-R762 WeakPolarHBondContact O-CG 3.32Å; D758-R762 PolarHBondContact O-N 3.23Å; D758-R762 PolarHBondContact O-NE 2.92Å; K759-R762 CarbonylContact O-C 3.31Å; K759-R762 WeakPolarHBondContact O-CA 3.1Å; K759-R762 WeakPolarHBondContact O-CB 3.31Å; K759-R762 PolarHBondContact O-N 3Å; R762-M764 VanDerWaalsContact C-N 3.32Å; R762-M764 PolarHBondContact O-N 3.43Å; R762-R765 CarbonylContact O-C 3.59Å; R762-R765 WeakPolarHBondContact O-CA 3.35Å; R762-R765 WeakPolarHBondContact O-CB 3.41Å; R762-R765 PolarHBondContact O-N 3.23Å; R762-T766 PolarHBondContact O-N 2.95Å; R762-T766 PolarHBondContact O-OG1 2.96Å; R762-T766 VanDerWaalsContact O-OG1 3.05Å
763	D	38.5	Very low	42.1	Very low	83 Å²	83	98.9 Å²	98.9	44%	0.444	48%	0.481	S	S	.	.	H	α-helix	trans	-58.6	-42.6	-178.3	-62.5	-22.1	0	0	0	111.6	K759 T766 V767	K759-D763 WeakPolarHBondContact CG-OD2 3.46Å; K759-D763 PolarHBondContact O-N 3.02Å; D763-T766 WeakPolarHBondContact O-CB 3.45Å; D763-T766 PolarHBondContact O-N 3.36Å; D763-V767 WeakPolarHBondContact O-CG2 3.4Å; D763-V767 PolarHBondContact O-N 2.99Å
764	M	37.5	Very low	42.3	Very low	63 Å²	63	96.5 Å²	96.5	31%	0.31	48%	0.477	S	S	.	.	H	α-helix	trans	-63	-39.6	171.9	-71.2	-71.7	-74.4	0	0	112.8	H760 R762 T766 V767 E768	H760-M764 WeakPolarHBondContact CE1-CG 3.5Å; H760-M764 WeakPolarHBondContact ND1-CG 3.26Å; H760-M764 VanDerWaalsContact O-CB 3.28Å; H760-M764 WeakPolarHBondContact O-CB 3.35Å; H760-M764 WeakPolarHBondContact O-CG 3.48Å; H760-M764 PolarHBondContact O-N 3.2Å; R762-M764 VanDerWaalsContact C-N 3.32Å; R762-M764 PolarHBondContact O-N 3.43Å; M764-T766 VanDerWaalsContact C-N 3.28Å; M764-T766 PolarHBondContact O-N 2.91Å; M764-V767 WeakPolarHBondContact O-CB 3.44Å; M764-V767 PolarHBondContact O-N 3.45Å; M764-E768 WeakPolarHBondContact O-CG 3.34Å; M764-E768 PolarHBondContact O-N 3.25Å
765	R	43	Very low	42.2	Very low	126 Å²	126	97 Å²	97	48%	0.475	48%	0.481	S	S	.	.	H	α-helix	trans	-69.2	-24.7	174.1	-82.8	-179	-82.6	-177.6	-9.4	112.9	S761 R762 E768 R769	S761-R765 WeakPolarHBondContact O-CB 3.2Å; S761-R765 WeakPolarHBondContact O-CG 3.38Å; S761-R765 PolarHBondContact O-N 3.02Å; S761-R765 PolarHBondContact O-NE 3.41Å; S761-R765 PolarHBondContact OG-NH2 2.96Å; R762-R765 CarbonylContact O-C 3.59Å; R762-R765 WeakPolarHBondContact O-CA 3.35Å; R762-R765 WeakPolarHBondContact O-CB 3.41Å; R762-R765 PolarHBondContact O-N 3.23Å; R765-E768 WeakPolarHBondContact CG-OE2 3.43Å; R765-R769 WeakPolarHBondContact O-CB 3.46Å; R765-R769 WeakPolarHBondContact O-CD 3.19Å; R765-R769 WeakPolarHBondContact O-CG 3.43Å; R765-R769 PolarHBondContact O-N 2.71Å
766	T	39.7	Very low	42.5	Very low	77 Å²	77	96.2 Å²	96.2	47%	0.472	47%	0.473	S	S	.	.	H	α-helix	trans	-72.4	-40.8	169.8	-48.7	0	0	0	0	110.7	R762 D763 M764 R769 T770	R762-T766 PolarHBondContact O-N 2.95Å; R762-T766 PolarHBondContact O-OG1 2.96Å; R762-T766 VanDerWaalsContact O-OG1 3.05Å; D763-T766 WeakPolarHBondContact O-CB 3.45Å; D763-T766 PolarHBondContact O-N 3.36Å; M764-T766 VanDerWaalsContact C-N 3.28Å; M764-T766 PolarHBondContact O-N 2.91Å; T766-R769 PolarHBondContact O-N 2.96Å; T766-T770 PolarHBondContact O-N 3.06Å; T766-T770 PolarHBondContact O-OG1 2.73Å
767	V	37	Very low	42.9	Very low	66 Å²	66	101 Å²	101	40%	0.4	50%	0.501	S	S	.	.	H	α-helix	trans	-64.7	-40	173.3	169	0	0	0	0	112	D763 M764 R769 L774	D763-V767 WeakPolarHBondContact O-CG2 3.4Å; D763-V767 PolarHBondContact O-N 2.99Å; M764-V767 WeakPolarHBondContact O-CB 3.44Å; M764-V767 PolarHBondContact O-N 3.45Å; V767-R769 PolarHBondContact O-N 2.71Å; V767-L774 HydrophobicContact CB-CD1 4.45Å; V767-L774 HydrophobicContact CG1-CD1 3.54Å; V767-L774 HydrophobicContact CG2-CD1 3.97Å
768	E	42.5	Very low	43.1	Very low	132 Å²	132	97.3 Å²	97.3	62%	0.617	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.5	173.3	-74.2	174.1	160.5	0	0	113.5	M764 R765	M764-E768 WeakPolarHBondContact O-CG 3.34Å; M764-E768 PolarHBondContact O-N 3.25Å; R765-E768 WeakPolarHBondContact CG-OE2 3.43Å
769	R	45.5	Very low	43.4	Very low	213 Å²	213	98.3 Å²	98.3	80%	0.804	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.1	-9.2	-174.7	-72.9	175.5	175.1	-166.8	-4.8	114.8	R765 T766 V767	R765-R769 WeakPolarHBondContact O-CB 3.46Å; R765-R769 WeakPolarHBondContact O-CD 3.19Å; R765-R769 WeakPolarHBondContact O-CG 3.43Å; R765-R769 PolarHBondContact O-N 2.71Å; T766-R769 PolarHBondContact O-N 2.96Å; V767-R769 PolarHBondContact O-N 2.71Å
770	T	38.7	Very low	43.9	Very low	58 Å²	58	97.9 Å²	97.9	36%	0.356	51%	0.506	S	S	.	.	S	Bend	trans	-129.9	127.7	-174.9	58.7	0	0	0	0	111	T766 V772	T766-T770 PolarHBondContact O-N 3.06Å; T766-T770 PolarHBondContact O-OG1 2.73Å; T770-V772 PolarHBondContact O-N 3.32Å
771	P	44.6	Very low	44.4	Very low	127 Å²	127	96.3 Å²	96.3	83%	0.825	50%	0.501	S	S	*	.			trans	-79.4	48.3	-178.5	34.6	-37.2	0	0	0	112
772	V	46	Very low	44.9	Very low	96 Å²	96	94.7 Å²	94.7	58%	0.582	49%	0.489	S	S	*	.			trans	-79.5	118.7	176.5	-178.6	0	0	0	0	108.4	T770 L774	T770-V772 PolarHBondContact O-N 3.32Å; V772-L774 PolarHBondContact O-N 3.38Å
773	N	47.1	Very low	45.2	Very low	90 Å²	90	93.1 Å²	93.1	48%	0.481	49%	0.486	S	S	.	.			trans	-61.6	108.6	175.2	-56.9	-75.1	0	0	0	109.4	Q775 K783	N773-Q775 PolarHBondContact O-N 3.19Å; N773-K783 VanDerWaalsContact OD1-CD 3.22Å; N773-K783 WeakPolarHBondContact OD1-CD 3.38Å; N773-K783 WeakPolarHBondContact OD1-CE 3.42Å; N773-K783 WeakPolarHBondContact OD1-CG 3.29Å
774	L	47.2	Very low	45.8	Very low	75 Å²	75	92.5 Å²	92.5	39%	0.393	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	99.4	177.4	-82.3	168.2	0	0	0	109.2	V767 V772 C776 I782	V767-L774 HydrophobicContact CB-CD1 4.45Å; V767-L774 HydrophobicContact CG1-CD1 3.54Å; V767-L774 HydrophobicContact CG2-CD1 3.97Å; V772-L774 PolarHBondContact O-N 3.38Å; L774-C776 PolarHBondContact O-N 3.25Å; L774-I782 HydrophobicContact CB-CB 4.17Å; L774-I782 PolarHBondContact N-O 3.47Å; L774-I782 VanDerWaalsContact O-CB 3.27Å; L774-I782 WeakPolarHBondContact O-CB 3.36Å; L774-I782 PolarHBondContact O-N 2.82Å
775	Q	44	Very low	46.1	Very low	131 Å²	131	94 Å²	94	61%	0.612	49%	0.49	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.4	122.1	179.5	-166.7	162.4	84.8	0	0	111.1	N773 D781	N773-Q775 PolarHBondContact O-N 3.19Å; Q775-D781 PolarHBondContact NE2-OD1 3.47Å
776	C	47.4	Very low	46.6	Very low	15 Å²	15	92.1 Å²	92.1	10%	0.101	49%	0.49	C	S	.	.			trans	-59.6	155.2	172.2	176.2	0	0	0	0	111.5	L774 C778 S779 Y780 H791	L774-C776 PolarHBondContact O-N 3.25Å; C776-C778 HydrophobicContact CB-CB 4.28Å; C776-C778 WeakPolarHBondContact CB-SG 3.32Å; C776-C778 PolarHBondContact O-N 2.85Å; C776-C778 WeakPolarHBondContact SG-CB 3.24Å; C776-C778 PolarHBondContact SG-N 2.98Å; C776-C778 CovalentContact SG-SG 2.06Å; C776-C778 PolarHBondContact SG-SG 3.4Å; C776-S779 WeakPolarHBondContact O-CA 3.4Å; C776-S779 PolarHBondContact O-N 3.26Å; C776-Y780 WeakPolarHBondContact CB-O 3.33Å; C776-Y780 PolarHBondContact N-O 3.5Å; C776-H791 PolarHBondContact SG-CE1 2.92Å
777	V	46	Very low	47.2	Very low	156 Å²	156	91 Å²	91	95%	0.945	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	-17	164.7	-179.3	0	0	0	0	112.9
778	C	46.9	Very low	47.7	Very low	73 Å²	73	90.6 Å²	90.6	49%	0.493	47%	0.472	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	15.7	176.4	63.8	0	0	0	0	113.9	C776 Y780 H791	C776-C778 HydrophobicContact CB-CB 4.28Å; C776-C778 WeakPolarHBondContact CB-SG 3.32Å; C776-C778 PolarHBondContact O-N 2.85Å; C776-C778 WeakPolarHBondContact SG-CB 3.24Å; C776-C778 PolarHBondContact SG-N 2.98Å; C776-C778 CovalentContact SG-SG 2.06Å; C776-C778 PolarHBondContact SG-SG 3.4Å; C778-Y780 PolarHBondContact O-N 2.92Å; C778-Y780 VanDerWaalsContact O-N 3.11Å; C778-H791 PolarHBondContact SG-CE1 2.86Å; C778-H791 PolarHBondContact SG-NE2 3.2Å
779	S	48.3	Very low	48.3	Very low	91 Å²	91	87.8 Å²	87.8	64%	0.636	46%	0.458	S	S	*	.	S	Bend	trans	62.4	9.2	-179.1	-51.1	0	0	0	0	116.6	C776	C776-S779 WeakPolarHBondContact O-CA 3.4Å; C776-S779 PolarHBondContact O-N 3.26Å
780	Y	53	Low	49	Very low	99 Å²	99	84.6 Å²	84.6	39%	0.388	45%	0.452	S	S	.	.			trans	-77	122.7	173.3	-170.7	-85.3	0	0	0	111.2	C776 C778 I782 H791	C776-Y780 WeakPolarHBondContact CB-O 3.33Å; C776-Y780 PolarHBondContact N-O 3.5Å; C778-Y780 PolarHBondContact O-N 2.92Å; C778-Y780 VanDerWaalsContact O-N 3.11Å; Y780-I782 HydrophobicContact CD1-CG1 3.83Å; Y780-I782 HydrophobicContact CE1-CG1 4.26Å; Y780-I782 PolarHBondContact O-N 3.37Å; Y780-H791 HydrophobicContact CD1-CB 4.47Å; Y780-H791 AromaticContact CD1-CD2 3.44Å; Y780-H791 VanDerWaalsContact CD1-CD2 3.44Å; Y780-H791 WeakPolarHBondContact CD1-CD2 3.33Å; Y780-H791 HydrophobicContact CE1-CB 4.44Å; Y780-H791 AromaticContact CE1-CD2 4Å; Y780-H791 AromaticContact CG-CD2 3.46Å; Y780-H791 VanDerWaalsContact CG-CD2 3.46Å; Y780-H791 AromaticContact CG-NE2 3.94Å
781	D	52.5	Low	49.9	Very low	59 Å²	59	84.1 Å²	84.1	32%	0.316	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	111.2	176.8	-75.7	-4	0	0	0	111.6	Q775 K783	Q775-D781 PolarHBondContact NE2-OD1 3.47Å; D781-K783 VanDerWaalsContact CB-CE 3.44Å; D781-K783 HydrophobicContact CB-CG 4.46Å; D781-K783 IonicContact OD2-NZ 2.67Å; D781-K783 PolarHBondContact OD2-NZ 2.75Å
782	I	53.3	Low	50	Low	8 Å²	8	81.3 Å²	81.3	4%	0.041	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	115.3	174.8	-55.7	175.7	0	0	0	109	L774 Y780 T784 Q787 F788 H791 Y792	L774-I782 HydrophobicContact CB-CB 4.17Å; L774-I782 PolarHBondContact N-O 3.47Å; L774-I782 VanDerWaalsContact O-CB 3.27Å; L774-I782 WeakPolarHBondContact O-CB 3.36Å; L774-I782 PolarHBondContact O-N 2.82Å; Y780-I782 HydrophobicContact CD1-CG1 3.83Å; Y780-I782 HydrophobicContact CE1-CG1 4.26Å; Y780-I782 PolarHBondContact O-N 3.37Å; I782-T784 WeakPolarHBondContact CG2-O 3.25Å; I782-Q787 HydrophobicContact CG2-CB 4.19Å; I782-F788 HydrophobicContact CD1-CD2 3.84Å; I782-F788 HydrophobicContact CG2-CB 3.79Å; I782-F788 HydrophobicContact CG2-CD2 4.28Å; I782-H791 HydrophobicContact CD1-CB 4.29Å; I782-Y792 HydrophobicContact CD1-CD2 4.34Å; I782-Y792 HydrophobicContact CD1-CE2 3.62Å
783	K	50.7	Low	50.2	Low	117 Å²	117	80.5 Å²	80.5	51%	0.509	42%	0.416	S	S	.	.			trans	-113.2	-13.9	-175.5	-45	-168.8	178.5	-173.5	0	113	N773 D781	N773-K783 VanDerWaalsContact OD1-CD 3.22Å; N773-K783 WeakPolarHBondContact OD1-CD 3.38Å; N773-K783 WeakPolarHBondContact OD1-CE 3.42Å; N773-K783 WeakPolarHBondContact OD1-CG 3.29Å; D781-K783 VanDerWaalsContact CB-CE 3.44Å; D781-K783 HydrophobicContact CB-CG 4.46Å; D781-K783 IonicContact OD2-NZ 2.67Å; D781-K783 PolarHBondContact OD2-NZ 2.75Å
784	T	50.1	Low	50	Low	71 Å²	71	85 Å²	85	44%	0.436	43%	0.431	S	S	.	.	S	Bend	trans	-140.6	158	176.2	69.7	0	0	0	0	111.7	I782 D786 Q787 F788	I782-T784 WeakPolarHBondContact CG2-O 3.25Å; T784-D786 PolarHBondContact O-N 2.98Å; T784-Q787 WeakPolarHBondContact O-CB 3.36Å; T784-Q787 PolarHBondContact O-N 3.18Å; T784-Q787 WeakPolarHBondContact OG1-CG 3.44Å; T784-Q787 PolarHBondContact OG1-N 2.89Å; T784-Q787 VanDerWaalsContact OG1-N 3.15Å; T784-F788 PolarHBondContact O-N 2.78Å
785	F	45.6	Very low	49.8	Very low	93 Å²	93	84.6 Å²	84.6	41%	0.408	43%	0.429	S	S	.	.	H	α-helix	trans	-63.2	-28.4	175.6	-177.1	-132.9	0	0	0	112.9	F788 K789 F796	F785-F788 HydrophobicContact CD2-CB 4.37Å; F785-F788 HydrophobicContact CD2-CD1 4.38Å; F785-F788 HydrophobicContact CE2-CD1 4.33Å; F785-F788 WeakPolarHBondContact O-CB 3.43Å; F785-F788 PolarHBondContact O-N 2.76Å; F785-K789 VanDerWaalsContact CD1-CE 3.48Å; F785-K789 WeakPolarHBondContact O-CG 3.18Å; F785-K789 PolarHBondContact O-N 3.06Å; F785-F796 HydrophobicContact CE2-CZ 4.34Å
786	D	52.5	Low	49.6	Very low	87 Å²	87	82 Å²	82	47%	0.465	42%	0.415	S	S	.	.	H	α-helix	trans	-76.5	-31.9	175.3	-62.8	-48.2	0	0	0	112.5	T784 F788 K789 Q790	T784-D786 PolarHBondContact O-N 2.98Å; D786-F788 VanDerWaalsContact C-N 3.31Å; D786-K789 PolarHBondContact O-N 2.89Å; D786-K789 IonicContact OD1-NZ 3.78Å; D786-K789 PolarHBondContact OD1-NZ 2.86Å; D786-Q790 WeakPolarHBondContact O-CB 3.25Å; D786-Q790 VanDerWaalsContact O-CG 3.26Å; D786-Q790 WeakPolarHBondContact O-CG 3.39Å; D786-Q790 PolarHBondContact O-N 3.35Å
787	Q	53.5	Low	49.4	Very low	55 Å²	55	83.6 Å²	83.6	26%	0.257	43%	0.426	S	S	.	.	H	α-helix	trans	-62.5	-39.2	164.5	-74.8	171.3	-8.4	0	0	111	I782 T784 K789 Q790 H791	I782-Q787 HydrophobicContact CG2-CB 4.19Å; T784-Q787 WeakPolarHBondContact O-CB 3.36Å; T784-Q787 PolarHBondContact O-N 3.18Å; T784-Q787 WeakPolarHBondContact OG1-CG 3.44Å; T784-Q787 PolarHBondContact OG1-N 2.89Å; T784-Q787 VanDerWaalsContact OG1-N 3.15Å; Q787-K789 PolarHBondContact O-N 3.17Å; Q787-Q790 PolarHBondContact O-N 2.96Å; Q787-H791 WeakPolarHBondContact O-CB 3.44Å; Q787-H791 PolarHBondContact O-N 3.31Å
788	F	47.3	Very low	49.4	Very low	56 Å²	56	85.5 Å²	85.5	25%	0.246	42%	0.422	C	S	.	.	H	α-helix	trans	-60	-44.6	174	-170.9	-97.3	0	0	0	112	I782 T784 F785 D786 H791 Y792 F796	I782-F788 HydrophobicContact CD1-CD2 3.84Å; I782-F788 HydrophobicContact CG2-CB 3.79Å; I782-F788 HydrophobicContact CG2-CD2 4.28Å; T784-F788 PolarHBondContact O-N 2.78Å; F785-F788 HydrophobicContact CD2-CB 4.37Å; F785-F788 HydrophobicContact CD2-CD1 4.38Å; F785-F788 HydrophobicContact CE2-CD1 4.33Å; F785-F788 WeakPolarHBondContact O-CB 3.43Å; F785-F788 PolarHBondContact O-N 2.76Å; D786-F788 VanDerWaalsContact C-N 3.31Å; F788-H791 PolarHBondContact O-N 2.98Å; F788-Y792 HydrophobicContact CD1-CD2 4.34Å; F788-Y792 AromaticContact CD2-CD2 3.71Å; F788-Y792 HydrophobicContact CD2-CD2 3.71Å; F788-Y792 AromaticContact CD2-CE2 3.76Å; F788-Y792 HydrophobicContact CD2-CE2 3.76Å; F788-Y792 HydrophobicContact CE1-CD2 4.24Å; F788-Y792 AromaticContact CE2-CD2 3.58Å; F788-Y792 HydrophobicContact CE2-CD2 3.58Å; F788-Y792 AromaticContact CE2-CE2 3.5Å; F788-Y792 HydrophobicContact CE2-CE2 3.5Å; F788-Y792 VanDerWaalsContact CE2-CE2 3.5Å; F788-Y792 HydrophobicContact CG-CD2 4.09Å; F788-Y792 AromaticContact CZ-CD2 3.86Å; F788-Y792 HydrophobicContact CZ-CD2 3.86Å; F788-Y792 HydrophobicContact CZ-CE2 4.14Å; F788-Y792 WeakPolarHBondContact O-CB 3.39Å; F788-Y792 WeakPolarHBondContact O-CD2 3.23Å; F788-Y792 PolarHBondContact O-N 3.47Å; F788-F796 AromaticContact CD1-CE2 3.61Å; F788-F796 HydrophobicContact CD1-CE2 3.61Å; F788-F796 HydrophobicContact CD1-CZ 4.02Å; F788-F796 AromaticContact CE1-CE2 3.59Å; F788-F796 HydrophobicContact CE1-CE2 3.59Å; F788-F796 AromaticContact CE1-CZ 3.88Å; F788-F796 HydrophobicContact CE1-CZ 3.88Å
789	K	54.7	Low	49.1	Very low	73 Å²	73	88.8 Å²	88.8	32%	0.317	43%	0.434	S	S	.	.	H	α-helix	trans	-62.8	-47	175.2	-67.7	169.8	-164.9	157.8	0	112.7	F785 D786 Q787 H791 Y792 F796	F785-K789 VanDerWaalsContact CD1-CE 3.48Å; F785-K789 WeakPolarHBondContact O-CG 3.18Å; F785-K789 PolarHBondContact O-N 3.06Å; D786-K789 PolarHBondContact O-N 2.89Å; D786-K789 IonicContact OD1-NZ 3.78Å; D786-K789 PolarHBondContact OD1-NZ 2.86Å; Q787-K789 PolarHBondContact O-N 3.17Å; K789-H791 VanDerWaalsContact C-N 3.31Å; K789-H791 PolarHBondContact O-N 3.32Å; K789-Y792 CarbonylContact O-C 3.58Å; K789-Y792 VanDerWaalsContact O-C 3.31Å; K789-Y792 PolarHBondContact O-N 3.38Å; K789-F796 HydrophobicContact CB-CD2 4.25Å; K789-F796 HydrophobicContact CG-CD1 4.44Å; K789-F796 HydrophobicContact CG-CD2 4.04Å; K789-F796 HydrophobicContact CG-CE2 4.32Å; K789-F796 HydrophobicContact CG-CG 4.1Å
790	Q	59.6	Low	48.8	Very low	147 Å²	147	91 Å²	91	69%	0.687	44%	0.438	S	S	*	.	H	α-helix	trans	-66.3	-34.5	179.6	-72.1	175.3	11.6	0	0	112.1	D786 Q787 P793	D786-Q790 WeakPolarHBondContact O-CB 3.25Å; D786-Q790 VanDerWaalsContact O-CG 3.26Å; D786-Q790 WeakPolarHBondContact O-CG 3.39Å; D786-Q790 PolarHBondContact O-N 3.35Å; Q787-Q790 PolarHBondContact O-N 2.96Å; Q790-P793 WeakPolarHBondContact O-CD 3.36Å
791	H	57.5	Low	48.3	Very low	48 Å²	48	92.4 Å²	92.4	22%	0.222	46%	0.456	C	S	.	.	H	α-helix	trans	-76.2	-32.2	177.4	-171.2	-80.9	0	0	0	112.6	C776 C778 Y780 I782 Q787 F788 K789 P793	C776-H791 PolarHBondContact SG-CE1 2.92Å; C778-H791 PolarHBondContact SG-CE1 2.86Å; C778-H791 PolarHBondContact SG-NE2 3.2Å; Y780-H791 HydrophobicContact CD1-CB 4.47Å; Y780-H791 AromaticContact CD1-CD2 3.44Å; Y780-H791 VanDerWaalsContact CD1-CD2 3.44Å; Y780-H791 WeakPolarHBondContact CD1-CD2 3.33Å; Y780-H791 HydrophobicContact CE1-CB 4.44Å; Y780-H791 AromaticContact CE1-CD2 4Å; Y780-H791 AromaticContact CG-CD2 3.46Å; Y780-H791 VanDerWaalsContact CG-CD2 3.46Å; Y780-H791 AromaticContact CG-NE2 3.94Å; I782-H791 HydrophobicContact CD1-CB 4.29Å; Q787-H791 WeakPolarHBondContact O-CB 3.44Å; Q787-H791 PolarHBondContact O-N 3.31Å; F788-H791 PolarHBondContact O-N 2.98Å; K789-H791 VanDerWaalsContact C-N 3.31Å; K789-H791 PolarHBondContact O-N 3.32Å; H791-P793 WeakPolarHBondContact O-CD 3.45Å
792	Y	47.4	Very low	47.9	Very low	67 Å²	67	91 Å²	91	26%	0.263	45%	0.449	S	S	.	.			trans	-115.3	58.8	177.8	-62.5	-68.6	0	0	0	113.5	I782 F788 K789 K794 I795 F796	I782-Y792 HydrophobicContact CD1-CD2 4.34Å; I782-Y792 HydrophobicContact CD1-CE2 3.62Å; F788-Y792 HydrophobicContact CD1-CD2 4.34Å; F788-Y792 AromaticContact CD2-CD2 3.71Å; F788-Y792 HydrophobicContact CD2-CD2 3.71Å; F788-Y792 AromaticContact CD2-CE2 3.76Å; F788-Y792 HydrophobicContact CD2-CE2 3.76Å; F788-Y792 HydrophobicContact CE1-CD2 4.24Å; F788-Y792 AromaticContact CE2-CD2 3.58Å; F788-Y792 HydrophobicContact CE2-CD2 3.58Å; F788-Y792 AromaticContact CE2-CE2 3.5Å; F788-Y792 HydrophobicContact CE2-CE2 3.5Å; F788-Y792 VanDerWaalsContact CE2-CE2 3.5Å; F788-Y792 HydrophobicContact CG-CD2 4.09Å; F788-Y792 AromaticContact CZ-CD2 3.86Å; F788-Y792 HydrophobicContact CZ-CD2 3.86Å; F788-Y792 HydrophobicContact CZ-CE2 4.14Å; F788-Y792 WeakPolarHBondContact O-CB 3.39Å; F788-Y792 WeakPolarHBondContact O-CD2 3.23Å; F788-Y792 PolarHBondContact O-N 3.47Å; K789-Y792 CarbonylContact O-C 3.58Å; K789-Y792 VanDerWaalsContact O-C 3.31Å; K789-Y792 PolarHBondContact O-N 3.38Å; Y792-K794 PolarHBondContact O-N 2.96Å; Y792-K794 VanDerWaalsContact O-N 3.07Å; Y792-I795 HydrophobicContact CD1-CD1 4.21Å; Y792-I795 HydrophobicContact CG-CD1 4.04Å; Y792-I795 WeakPolarHBondContact O-CB 3.46Å; Y792-I795 PolarHBondContact O-N 2.95Å; Y792-F796 PolarHBondContact O-N 3.35Å
793	P	48.7	Very low	47.8	Very low	80 Å²	80	99.7 Å²	99.7	52%	0.519	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-14.3	-177	31.1	-36.3	0	0	0	112.9	Q790 H791 I795 F796	Q790-P793 WeakPolarHBondContact O-CD 3.36Å; H791-P793 WeakPolarHBondContact O-CD 3.45Å; P793-I795 VanDerWaalsContact C-N 3.35Å; P793-F796 CarbonylContact O-C 3.58Å
794	K	44.2	Very low	47.6	Very low	184 Å²	184	98.5 Å²	98.5	80%	0.8	49%	0.486	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-17.6	172.3	-63.4	-176.6	-179.7	178.9	0	113.1	Y792	Y792-K794 PolarHBondContact O-N 2.96Å; Y792-K794 VanDerWaalsContact O-N 3.07Å
795	I	43.3	Very low	47.8	Very low	67 Å²	67	100.3 Å²	100.3	34%	0.344	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	-40.1	173.8	-57.1	-174.9	0	0	0	110	Y792 P793 P797	Y792-I795 HydrophobicContact CD1-CD1 4.21Å; Y792-I795 HydrophobicContact CG-CD1 4.04Å; Y792-I795 WeakPolarHBondContact O-CB 3.46Å; Y792-I795 PolarHBondContact O-N 2.95Å; P793-I795 VanDerWaalsContact C-N 3.35Å; I795-P797 WeakPolarHBondContact O-CD 3.15Å
796	F	40	Very low	48	Very low	75 Å²	75	100.2 Å²	100.2	33%	0.329	51%	0.51	S	S	.	.	S	Bend	trans	-110.5	81.2	178.7	-54.4	-83.4	0	0	0	110.9	F785 F788 K789 Y792 P793 K798	F785-F796 HydrophobicContact CE2-CZ 4.34Å; F788-F796 AromaticContact CD1-CE2 3.61Å; F788-F796 HydrophobicContact CD1-CE2 3.61Å; F788-F796 HydrophobicContact CD1-CZ 4.02Å; F788-F796 AromaticContact CE1-CE2 3.59Å; F788-F796 HydrophobicContact CE1-CE2 3.59Å; F788-F796 AromaticContact CE1-CZ 3.88Å; F788-F796 HydrophobicContact CE1-CZ 3.88Å; K789-F796 HydrophobicContact CB-CD2 4.25Å; K789-F796 HydrophobicContact CG-CD1 4.44Å; K789-F796 HydrophobicContact CG-CD2 4.04Å; K789-F796 HydrophobicContact CG-CE2 4.32Å; K789-F796 HydrophobicContact CG-CG 4.1Å; Y792-F796 PolarHBondContact O-N 3.35Å; P793-F796 CarbonylContact O-C 3.58Å; F796-K798 PolarHBondContact O-N 3.33Å
797	P	43.1	Very low	47.5	Very low	50 Å²	50	101.1 Å²	101.1	33%	0.325	51%	0.513	S	S	.	.			trans	-57.9	130.3	164.8	27.1	-32.8	0	0	0	108.3	I795	I795-P797 WeakPolarHBondContact O-CD 3.15Å
798	K	45.9	Very low	47.1	Very low	196 Å²	196	104.1 Å²	104.1	85%	0.852	53%	0.525	S	S	*	.			trans	-54.5	142.8	168.9	-67.1	-177.4	178.3	-178.3	0	108.4	F796 I800	F796-K798 PolarHBondContact O-N 3.33Å; K798-I800 PolarHBondContact O-N 2.71Å
799	N	40.9	Very low	47.2	Very low	142 Å²	142	104.1 Å²	104.1	76%	0.759	54%	0.536	S	S	*	.			trans	-61.5	98.3	177.8	-72	-10	0	0	0	109.9
800	I	41.8	Very low	46.8	Very low	138 Å²	138	103.4 Å²	103.4	71%	0.708	54%	0.543	S	S	*	.			trans	-77.1	119.4	162.6	-59.8	175.4	0	0	0	105.3	K798 V802	K798-I800 PolarHBondContact O-N 2.71Å; I800-V802 HydrophobicContact CB-CG2 4.31Å; I800-V802 HydrophobicContact CG2-CG2 3.88Å; I800-V802 PolarHBondContact O-N 3.1Å
801	V	42.3	Very low	46.1	Very low	128 Å²	128	99.9 Å²	99.9	78%	0.776	53%	0.531	S	S	*	.			trans	-74.1	95.3	170.8	179.7	0	0	0	0	107
802	V	43	Very low	45.6	Very low	29 Å²	29	100 Å²	100	18%	0.176	53%	0.532	C	S	.	.			trans	-85.4	116.8	178	-176.9	0	0	0	0	108.1	I800 M807 F808 V811	I800-V802 HydrophobicContact CB-CG2 4.31Å; I800-V802 HydrophobicContact CG2-CG2 3.88Å; I800-V802 PolarHBondContact O-N 3.1Å; V802-M807 HydrophobicContact CG1-CB 3.34Å; V802-F808 HydrophobicContact CB-CB 4.45Å; V802-F808 HydrophobicContact CG1-CB 4.27Å; V802-V811 HydrophobicContact CG2-CG2 4.22Å
803	K	51.1	Low	45.4	Very low	191 Å²	191	101.1 Å²	101.1	83%	0.83	54%	0.543	S	S	*	.			trans	-80.8	-31.5	-179.1	-70.2	-168.3	172.6	-167.8	0	113.4
804	D	47.5	Very low	45.1	Very low	91 Å²	91	98.8 Å²	98.8	49%	0.487	53%	0.53	S	S	.	.	S	Bend	trans	-82.8	126.6	-177.5	-48.9	-67.4	0	0	0	111.5	S806 M807 F808	D804-S806 VanDerWaalsContact C-N 3.26Å; D804-S806 PolarHBondContact O-N 3.44Å; D804-M807 HydrophobicContact CB-CB 4.09Å; D804-M807 HydrophobicContact CB-CG 4.19Å; D804-M807 PolarHBondContact O-N 3.19Å; D804-M807 VanDerWaalsContact O-N 3.16Å; D804-F808 PolarHBondContact O-N 3.04Å
805	P	54.3	Low	44.9	Very low	109 Å²	109	95.5 Å²	95.5	71%	0.708	51%	0.513	S	S	*	.	H	α-helix	trans	-58.1	-34.4	179.3	-27.7	35.8	0	0	0	114	F808 A809	P805-F808 PolarHBondContact O-N 3.34Å; P805-A809 WeakPolarHBondContact O-CB 3.38Å; P805-A809 PolarHBondContact O-N 2.93Å
806	S	48.7	Very low	44.7	Very low	91 Å²	91	99 Å²	99	64%	0.636	52%	0.522	S	S	*	.	H	α-helix	trans	-67	-43.4	177	55.9	0	0	0	0	112.3	D804 A809 A810	D804-S806 VanDerWaalsContact C-N 3.26Å; D804-S806 PolarHBondContact O-N 3.44Å; S806-A809 PolarHBondContact O-N 2.84Å; S806-A810 WeakPolarHBondContact O-CB 3.46Å; S806-A810 PolarHBondContact O-N 3.34Å
807	M	42	Very low	44.5	Very low	107 Å²	107	99.5 Å²	99.5	53%	0.527	53%	0.527	S	S	.	.	H	α-helix	trans	-70.3	-35.2	174.2	-71.9	-97.9	-79.6	0	0	111.4	V802 D804 A810 V811	V802-M807 HydrophobicContact CG1-CB 3.34Å; D804-M807 HydrophobicContact CB-CB 4.09Å; D804-M807 HydrophobicContact CB-CG 4.19Å; D804-M807 PolarHBondContact O-N 3.19Å; D804-M807 VanDerWaalsContact O-N 3.16Å; M807-A810 PolarHBondContact O-N 2.85Å; M807-V811 VanDerWaalsContact O-CB 3.32Å; M807-V811 WeakPolarHBondContact O-CB 3.46Å; M807-V811 VanDerWaalsContact O-CG2 3.29Å; M807-V811 WeakPolarHBondContact O-CG2 3.27Å; M807-V811 PolarHBondContact O-N 2.74Å
808	F	45.2	Very low	44	Very low	117 Å²	117	103 Å²	103	51%	0.513	53%	0.534	S	S	.	.	H	α-helix	trans	-63.7	-47.3	173.9	-178.8	-90.9	0	0	0	110.5	V802 D804 P805 A810 V811 E812	V802-F808 HydrophobicContact CB-CB 4.45Å; V802-F808 HydrophobicContact CG1-CB 4.27Å; D804-F808 PolarHBondContact O-N 3.04Å; P805-F808 PolarHBondContact O-N 3.34Å; F808-A810 PolarHBondContact O-N 3.33Å; F808-V811 PolarHBondContact O-N 2.92Å; F808-E812 WeakPolarHBondContact O-CB 3.31Å; F808-E812 PolarHBondContact O-N 3.5Å
809	A	50.6	Low	43.5	Very low	57 Å²	57	96.3 Å²	96.3	47%	0.471	51%	0.511	S	S	.	.	H	α-helix	trans	-57.7	-46.2	173.1	0	0	0	0	0	111.4	P805 S806 E812 N813	P805-A809 WeakPolarHBondContact O-CB 3.38Å; P805-A809 PolarHBondContact O-N 2.93Å; S806-A809 PolarHBondContact O-N 2.84Å; A809-E812 PolarHBondContact O-N 2.74Å; A809-N813 VanDerWaalsContact O-CB 3.25Å; A809-N813 WeakPolarHBondContact O-CB 3.44Å; A809-N813 PolarHBondContact O-N 3.35Å
810	A	46.1	Very low	43.2	Very low	58 Å²	58	97 Å²	97	48%	0.479	50%	0.504	S	S	.	.	H	α-helix	trans	-63.9	-40.5	177.3	0	0	0	0	0	113.2	S806 M807 F808 A814	S806-A810 WeakPolarHBondContact O-CB 3.46Å; S806-A810 PolarHBondContact O-N 3.34Å; M807-A810 PolarHBondContact O-N 2.85Å; F808-A810 PolarHBondContact O-N 3.33Å; A810-A814 VanDerWaalsContact O-CB 3.3Å; A810-A814 WeakPolarHBondContact O-CB 3.25Å; A810-A814 PolarHBondContact O-N 2.94Å
811	V	45.2	Very low	42.7	Very low	72 Å²	72	98.9 Å²	98.9	44%	0.436	50%	0.503	S	S	.	.	H	α-helix	trans	-68.8	-41.6	177	165.4	0	0	0	0	111.4	V802 M807 F808 A814 R815	V802-V811 HydrophobicContact CG2-CG2 4.22Å; M807-V811 VanDerWaalsContact O-CB 3.32Å; M807-V811 WeakPolarHBondContact O-CB 3.46Å; M807-V811 VanDerWaalsContact O-CG2 3.29Å; M807-V811 WeakPolarHBondContact O-CG2 3.27Å; M807-V811 PolarHBondContact O-N 2.74Å; F808-V811 PolarHBondContact O-N 2.92Å; V811-A814 CarbonylContact O-C 3.48Å; V811-A814 WeakPolarHBondContact O-CB 3.33Å; V811-A814 PolarHBondContact O-N 3.49Å; V811-R815 WeakPolarHBondContact O-CB 3.46Å; V811-R815 PolarHBondContact O-N 2.8Å
812	E	45.6	Very low	42.3	Very low	50 Å²	50	94.6 Å²	94.6	23%	0.234	48%	0.476	C	S	.	.	H	α-helix	trans	-72.4	-33.7	177.7	-165.3	57.4	-145.5	0	0	111.3	F808 A809 R815 R816	F808-E812 WeakPolarHBondContact O-CB 3.31Å; F808-E812 PolarHBondContact O-N 3.5Å; A809-E812 PolarHBondContact O-N 2.74Å; E812-R815 VanDerWaalsContact O-CB 3.29Å; E812-R815 WeakPolarHBondContact O-CB 3.37Å; E812-R815 PolarHBondContact O-N 3.22Å; E812-R815 WeakPolarHBondContact OE1-CD 3.48Å; E812-R815 IonicContact OE1-NH1 3.47Å; E812-R815 WeakPolarHBondContact OE2-CD 3.44Å; E812-R815 IonicContact OE2-CZ 2.83Å; E812-R815 IonicContact OE2-NE 2.89Å; E812-R815 IonicContact OE2-NH1 3.98Å; E812-R815 PolarHBondContact OE2-NH1 2.74Å; E812-R816 WeakPolarHBondContact O-CG 3.27Å; E812-R816 PolarHBondContact O-N 2.94Å
813	N	43.8	Very low	42.1	Very low	92 Å²	92	96.7 Å²	96.7	49%	0.492	49%	0.485	S	S	.	.	H	α-helix	trans	-66.5	-40.8	169.8	-140.9	0.3	0	0	0	110.9	A809 R815 R816 I817	A809-N813 VanDerWaalsContact O-CB 3.25Å; A809-N813 WeakPolarHBondContact O-CB 3.44Å; A809-N813 PolarHBondContact O-N 3.35Å; N813-R815 VanDerWaalsContact C-N 3.27Å; N813-R815 PolarHBondContact O-N 3.18Å; N813-R816 PolarHBondContact O-N 2.84Å; N813-I817 WeakPolarHBondContact O-CB 3.24Å; N813-I817 WeakPolarHBondContact O-CD1 3.45Å; N813-I817 VanDerWaalsContact O-CG1 3.24Å; N813-I817 WeakPolarHBondContact O-CG1 3.17Å; N813-I817 PolarHBondContact O-N 2.82Å
814	A	41.4	Very low	41.3	Very low	31 Å²	31	92.8 Å²	92.8	26%	0.256	47%	0.468	S	S	.	.	H	α-helix	trans	-63.9	-30.7	170.8	0	0	0	0	0	112.7	A810 V811 R818	A810-A814 VanDerWaalsContact O-CB 3.3Å; A810-A814 WeakPolarHBondContact O-CB 3.25Å; A810-A814 PolarHBondContact O-N 2.94Å; V811-A814 CarbonylContact O-C 3.48Å; V811-A814 WeakPolarHBondContact O-CB 3.33Å; V811-A814 PolarHBondContact O-N 3.49Å; A814-R818 WeakPolarHBondContact O-CB 3.26Å; A814-R818 WeakPolarHBondContact O-CG 3.41Å; A814-R818 PolarHBondContact O-N 3.23Å
815	R	40.4	Very low	40.9	Very low	114 Å²	114	96.9 Å²	96.9	43%	0.43	48%	0.477	S	S	.	.	H	α-helix	trans	-68.7	-46.8	173.5	-155.6	-176.7	-156.3	165.4	4.8	110.9	V811 E812 N813 R818 S819	V811-R815 WeakPolarHBondContact O-CB 3.46Å; V811-R815 PolarHBondContact O-N 2.8Å; E812-R815 VanDerWaalsContact O-CB 3.29Å; E812-R815 WeakPolarHBondContact O-CB 3.37Å; E812-R815 PolarHBondContact O-N 3.22Å; E812-R815 WeakPolarHBondContact OE1-CD 3.48Å; E812-R815 IonicContact OE1-NH1 3.47Å; E812-R815 WeakPolarHBondContact OE2-CD 3.44Å; E812-R815 IonicContact OE2-CZ 2.83Å; E812-R815 IonicContact OE2-NE 2.89Å; E812-R815 IonicContact OE2-NH1 3.98Å; E812-R815 PolarHBondContact OE2-NH1 2.74Å; N813-R815 VanDerWaalsContact C-N 3.27Å; N813-R815 PolarHBondContact O-N 3.18Å; R815-R818 CarbonylContact O-C 3.59Å; R815-R818 PolarHBondContact O-N 2.87Å; R815-R818 VanDerWaalsContact O-N 3.17Å; R815-S819 PolarHBondContact O-N 3.18Å; R815-S819 PolarHBondContact O-OG 3.39Å
816	R	39.5	Very low	40.2	Very low	142 Å²	142	96 Å²	96	54%	0.536	46%	0.463	S	S	.	.	H	α-helix	trans	-58.1	-48.5	171.5	-68.7	172.3	-172.9	-171.1	1.3	111.5	E812 N813 R818 S819 Y820	E812-R816 WeakPolarHBondContact O-CG 3.27Å; E812-R816 PolarHBondContact O-N 2.94Å; N813-R816 PolarHBondContact O-N 2.84Å; R816-R818 VanDerWaalsContact C-N 3.26Å; R816-R818 PolarHBondContact O-N 2.84Å; R816-S819 WeakPolarHBondContact CA-OG 3.46Å; R816-S819 PolarHBondContact O-N 3.15Å; R816-S819 PolarHBondContact O-OG 3.19Å; R816-Y820 HydrophobicContact CB-CD2 4.4Å; R816-Y820 HydrophobicContact CB-CE2 4.12Å; R816-Y820 WeakPolarHBondContact O-CB 3.05Å; R816-Y820 WeakPolarHBondContact O-CD2 3.5Å; R816-Y820 PolarHBondContact O-N 2.95Å
817	I	35.7	Very low	39.6	Very low	84 Å²	84	94.5 Å²	94.5	43%	0.431	45%	0.452	S	S	.	.	H	α-helix	trans	-61	-33.9	176.3	-68.1	162.9	0	0	0	111.5	N813 R821	N813-I817 WeakPolarHBondContact O-CB 3.24Å; N813-I817 WeakPolarHBondContact O-CD1 3.45Å; N813-I817 VanDerWaalsContact O-CG1 3.24Å; N813-I817 WeakPolarHBondContact O-CG1 3.17Å; N813-I817 PolarHBondContact O-N 2.82Å; I817-R821 WeakPolarHBondContact O-CB 3.44Å; I817-R821 WeakPolarHBondContact O-CG 3.37Å; I817-R821 PolarHBondContact O-N 3.14Å
818	R	32.6	Very low	39.6	Very low	124 Å²	124	91.1 Å²	91.1	47%	0.468	44%	0.436	S	S	.	.	H	α-helix	trans	-73.5	-40.4	173.6	-73.8	170	-160.9	177.1	8.3	112.7	A814 R815 R816 R821 N822	A814-R818 WeakPolarHBondContact O-CB 3.26Å; A814-R818 WeakPolarHBondContact O-CG 3.41Å; A814-R818 PolarHBondContact O-N 3.23Å; R815-R818 CarbonylContact O-C 3.59Å; R815-R818 PolarHBondContact O-N 2.87Å; R815-R818 VanDerWaalsContact O-N 3.17Å; R816-R818 VanDerWaalsContact C-N 3.26Å; R816-R818 PolarHBondContact O-N 2.84Å; R818-R821 PolarHBondContact O-N 3.13Å; R818-N822 PolarHBondContact O-N 3.5Å
819	S	35.6	Very low	39.4	Very low	55 Å²	55	90 Å²	90	39%	0.385	44%	0.435	S	S	.	.	H	α-helix	trans	-65.1	-43.6	174.2	58.7	0	0	0	0	111	R815 R816 R821 N822 I823	R815-S819 PolarHBondContact O-N 3.18Å; R815-S819 PolarHBondContact O-OG 3.39Å; R816-S819 WeakPolarHBondContact CA-OG 3.46Å; R816-S819 PolarHBondContact O-N 3.15Å; R816-S819 PolarHBondContact O-OG 3.19Å; S819-R821 VanDerWaalsContact C-N 3.31Å; S819-R821 PolarHBondContact O-N 2.92Å; S819-N822 PolarHBondContact O-N 3.35Å; S819-N822 VanDerWaalsContact O-N 3.11Å; S819-I823 WeakPolarHBondContact O-CB 3.38Å; S819-I823 VanDerWaalsContact O-CG1 3.26Å; S819-I823 WeakPolarHBondContact O-CG1 3.48Å; S819-I823 PolarHBondContact O-N 3Å
820	Y	33.5	Very low	38.8	Very low	156 Å²	156	91 Å²	91	61%	0.612	43%	0.431	S	S	*	.	H	α-helix	trans	-58.7	-39.2	171.4	-67.9	-52.5	0	0	0	112.3	R816 N822 I823 F824	R816-Y820 HydrophobicContact CB-CD2 4.4Å; R816-Y820 HydrophobicContact CB-CE2 4.12Å; R816-Y820 WeakPolarHBondContact O-CB 3.05Å; R816-Y820 WeakPolarHBondContact O-CD2 3.5Å; R816-Y820 PolarHBondContact O-N 2.95Å; Y820-N822 PolarHBondContact O-N 3.3Å; Y820-I823 HydrophobicContact CD1-CD1 4.38Å; Y820-I823 PolarHBondContact O-N 2.84Å; Y820-F824 VanDerWaalsContact O-CB 3.22Å; Y820-F824 WeakPolarHBondContact O-CB 3.19Å; Y820-F824 PolarHBondContact O-N 3.11Å
821	R	32.5	Very low	38.3	Very low	178 Å²	178	92.1 Å²	92.1	67%	0.672	43%	0.429	S	S	*	.	H	α-helix	trans	-68.4	-28.7	174.2	-81.5	176.1	166.5	173.7	-2.3	114.4	I817 R818 S819 R825	I817-R821 WeakPolarHBondContact O-CB 3.44Å; I817-R821 WeakPolarHBondContact O-CG 3.37Å; I817-R821 PolarHBondContact O-N 3.14Å; R818-R821 PolarHBondContact O-N 3.13Å; S819-R821 VanDerWaalsContact C-N 3.31Å; S819-R821 PolarHBondContact O-N 2.92Å; R821-R825 PolarHBondContact O-N 3.01Å
822	N	34.4	Very low	38	Very low	39 Å²	39	94.3 Å²	94.3	21%	0.209	43%	0.433	C	S	.	.	H	α-helix	trans	-76.4	-45.7	172.6	-72.8	-15.7	0	0	0	111.1	R818 S819 Y820 F824 R825 E826	R818-N822 PolarHBondContact O-N 3.5Å; S819-N822 PolarHBondContact O-N 3.35Å; S819-N822 VanDerWaalsContact O-N 3.11Å; Y820-N822 PolarHBondContact O-N 3.3Å; N822-F824 VanDerWaalsContact C-N 3.25Å; N822-F824 PolarHBondContact O-N 3.31Å; N822-R825 WeakPolarHBondContact O-CA 3.04Å; N822-R825 WeakPolarHBondContact O-CB 3.28Å; N822-R825 PolarHBondContact O-N 2.9Å; N822-E826 PolarHBondContact O-N 2.87Å
823	I	37.1	Very low	37.4	Very low	73 Å²	73	98.7 Å²	98.7	37%	0.374	46%	0.457	S	S	.	.	H	α-helix	trans	-53.9	-44.7	170.9	-67.1	162.7	0	0	0	109.9	S819 Y820 R825 E826 C827	S819-I823 WeakPolarHBondContact O-CB 3.38Å; S819-I823 VanDerWaalsContact O-CG1 3.26Å; S819-I823 WeakPolarHBondContact O-CG1 3.48Å; S819-I823 PolarHBondContact O-N 3Å; Y820-I823 HydrophobicContact CD1-CD1 4.38Å; Y820-I823 PolarHBondContact O-N 2.84Å; I823-R825 VanDerWaalsContact C-N 3.32Å; I823-R825 PolarHBondContact O-N 3.41Å; I823-E826 PolarHBondContact O-N 3.45Å; I823-E826 VanDerWaalsContact O-N 3.13Å; I823-C827 WeakPolarHBondContact O-CB 3.48Å; I823-C827 PolarHBondContact O-N 2.86Å; I823-C827 PolarHBondContact O-SG 2.97Å
824	F	34.9	Very low	36.9	Very low	109 Å²	109	98.1 Å²	98.1	48%	0.478	45%	0.451	S	S	.	.	H	α-helix	trans	-63.6	-33	176.4	-164.6	-100.6	0	0	0	113.2	Y820 N822 I828	Y820-F824 VanDerWaalsContact O-CB 3.22Å; Y820-F824 WeakPolarHBondContact O-CB 3.19Å; Y820-F824 PolarHBondContact O-N 3.11Å; N822-F824 VanDerWaalsContact C-N 3.25Å; N822-F824 PolarHBondContact O-N 3.31Å; F824-I828 HydrophobicContact CD1-CD1 3.67Å; F824-I828 HydrophobicContact CD1-CG1 4.46Å; F824-I828 HydrophobicContact CE1-CD1 3.53Å; F824-I828 HydrophobicContact CE1-CG1 4.42Å; F824-I828 HydrophobicContact CZ-CD1 4.4Å; F824-I828 WeakPolarHBondContact O-CB 3.33Å; F824-I828 VanDerWaalsContact O-CG1 3.28Å; F824-I828 WeakPolarHBondContact O-CG1 3.38Å; F824-I828 PolarHBondContact O-N 2.8Å
825	R	39.2	Very low	36.6	Very low	176 Å²	176	102.9 Å²	102.9	66%	0.664	48%	0.477	S	S	*	.	H	α-helix	trans	-69.1	-39.8	171.1	-85.2	178	157.8	-167.4	-7.9	112.2	R821 N822 I823 I828 N829	R821-R825 PolarHBondContact O-N 3.01Å; N822-R825 WeakPolarHBondContact O-CA 3.04Å; N822-R825 WeakPolarHBondContact O-CB 3.28Å; N822-R825 PolarHBondContact O-N 2.9Å; I823-R825 VanDerWaalsContact C-N 3.32Å; I823-R825 PolarHBondContact O-N 3.41Å; R825-I828 PolarHBondContact O-N 3.3Å; R825-N829 VanDerWaalsContact O-CG 3.23Å; R825-N829 PolarHBondContact O-N 3.29Å; R825-N829 PolarHBondContact O-ND2 3.32Å
826	E	41.1	Very low	36.4	Very low	91 Å²	91	100.8 Å²	100.8	43%	0.425	47%	0.474	S	S	.	.	H	α-helix	trans	-67.8	-43.8	175.7	-74.1	165.9	-144.1	0	0	111.1	N822 I823 I828 N829 I830	N822-E826 PolarHBondContact O-N 2.87Å; I823-E826 PolarHBondContact O-N 3.45Å; I823-E826 VanDerWaalsContact O-N 3.13Å; E826-I828 VanDerWaalsContact C-N 3.31Å; E826-I828 PolarHBondContact O-N 2.06Å; E826-N829 PolarHBondContact O-N 3.1Å; E826-N829 VanDerWaalsContact O-N 3.08Å; E826-I830 VanDerWaalsContact O-CG1 3.29Å; E826-I830 WeakPolarHBondContact O-CG1 3.36Å; E826-I830 PolarHBondContact O-N 2.85Å
827	C	36.1	Very low	36.5	Very low	59 Å²	59	97.5 Å²	97.5	40%	0.399	47%	0.469	S	S	.	.	H	α-helix	trans	-57.5	-40.6	169.3	-65.9	0	0	0	0	112.2	I823 I830 L831	I823-C827 WeakPolarHBondContact O-CB 3.48Å; I823-C827 PolarHBondContact O-N 2.86Å; I823-C827 PolarHBondContact O-SG 2.97Å; C827-I830 PolarHBondContact O-N 2.8Å; C827-L831 WeakPolarHBondContact O-CB 3.46Å; C827-L831 WeakPolarHBondContact O-CG 3.31Å; C827-L831 PolarHBondContact O-N 3.24Å
828	I	41.5	Very low	36.7	Very low	37 Å²	37	97.9 Å²	97.9	19%	0.19	48%	0.48	C	S	.	.	H	α-helix	trans	-65.6	-38.3	173.5	-78.2	170.5	0	0	0	111.9	F824 R825 E826 L831 K832	F824-I828 HydrophobicContact CD1-CD1 3.67Å; F824-I828 HydrophobicContact CD1-CG1 4.46Å; F824-I828 HydrophobicContact CE1-CD1 3.53Å; F824-I828 HydrophobicContact CE1-CG1 4.42Å; F824-I828 HydrophobicContact CZ-CD1 4.4Å; F824-I828 WeakPolarHBondContact O-CB 3.33Å; F824-I828 VanDerWaalsContact O-CG1 3.28Å; F824-I828 WeakPolarHBondContact O-CG1 3.38Å; F824-I828 PolarHBondContact O-N 2.8Å; R825-I828 PolarHBondContact O-N 3.3Å; E826-I828 VanDerWaalsContact C-N 3.31Å; E826-I828 PolarHBondContact O-N 2.06Å; I828-L831 PolarHBondContact O-N 3.12Å; I828-K832 HydrophobicContact CG2-CD 4.3Å; I828-K832 WeakPolarHBondContact O-CB 3.49Å; I828-K832 WeakPolarHBondContact O-CG 3.12Å; I828-K832 PolarHBondContact O-N 3.43Å
829	N	40.5	Very low	37.4	Very low	93 Å²	93	99.2 Å²	99.2	50%	0.497	49%	0.491	S	S	.	.	H	α-helix	trans	-67.6	-39.2	176.4	-69.5	-17.8	0	0	0	111.3	R825 E826 K832 L833	R825-N829 VanDerWaalsContact O-CG 3.23Å; R825-N829 PolarHBondContact O-N 3.29Å; R825-N829 PolarHBondContact O-ND2 3.32Å; E826-N829 PolarHBondContact O-N 3.1Å; E826-N829 VanDerWaalsContact O-N 3.08Å; N829-K832 PolarHBondContact O-N 2.65Å; N829-L833 WeakPolarHBondContact O-CG 3.09Å; N829-L833 PolarHBondContact O-N 3.08Å
830	I	38.1	Very low	37.8	Very low	77 Å²	77	99.7 Å²	99.7	40%	0.395	49%	0.491	S	S	.	.	H	α-helix	trans	-61.4	-46.1	171	-67.9	163.8	0	0	0	110.4	E826 C827 K832 L833 F834	E826-I830 VanDerWaalsContact O-CG1 3.29Å; E826-I830 WeakPolarHBondContact O-CG1 3.36Å; E826-I830 PolarHBondContact O-N 2.85Å; C827-I830 PolarHBondContact O-N 2.8Å; I830-K832 VanDerWaalsContact C-N 3.3Å; I830-K832 PolarHBondContact O-N 3.39Å; I830-L833 WeakPolarHBondContact O-CB 3.44Å; I830-L833 PolarHBondContact O-N 2.99Å; I830-L833 VanDerWaalsContact O-N 3.15Å; I830-F834 HydrophobicContact CG2-CD2 4.08Å; I830-F834 HydrophobicContact CG2-CE2 3.66Å; I830-F834 WeakPolarHBondContact O-CD2 3.27Å; I830-F834 PolarHBondContact O-N 2.74Å
831	L	35.9	Very low	38.2	Very low	83 Å²	83	93.9 Å²	93.9	44%	0.435	47%	0.471	S	S	.	.	H	α-helix	trans	-64.2	-30.7	176.5	-74	166.6	0	0	0	113.3	C827 I828 F834 L836	C827-L831 WeakPolarHBondContact O-CB 3.46Å; C827-L831 WeakPolarHBondContact O-CG 3.31Å; C827-L831 PolarHBondContact O-N 3.24Å; I828-L831 PolarHBondContact O-N 3.12Å; L831-F834 PolarHBondContact O-N 2.91Å; L831-L836 HydrophobicContact CB-CD1 4.21Å; L831-L836 HydrophobicContact CD2-CD1 3.87Å
832	K	38.3	Very low	38.9	Very low	118 Å²	118	90 Å²	90	51%	0.513	47%	0.467	S	S	.	.	H	α-helix	trans	-73.2	-32	172.5	-77	178.3	174.2	-168.3	0	113.3	I828 N829 I830 F834 T835 I841	I828-K832 HydrophobicContact CG2-CD 4.3Å; I828-K832 WeakPolarHBondContact O-CB 3.49Å; I828-K832 WeakPolarHBondContact O-CG 3.12Å; I828-K832 PolarHBondContact O-N 3.43Å; N829-K832 PolarHBondContact O-N 2.65Å; I830-K832 VanDerWaalsContact C-N 3.3Å; I830-K832 PolarHBondContact O-N 3.39Å; K832-F834 PolarHBondContact O-N 2.59Å; K832-T835 PolarHBondContact O-N 3.12Å; K832-I841 HydrophobicContact CG-CD1 3.66Å
833	L	33.2	Very low	39.4	Very low	142 Å²	142	91 Å²	91	74%	0.743	48%	0.48	S	S	*	.	H	α-helix	trans	-64.3	-26.6	170	-72.9	162.2	0	0	0	111.6	N829 I830 T835	N829-L833 WeakPolarHBondContact O-CG 3.09Å; N829-L833 PolarHBondContact O-N 3.08Å; I830-L833 WeakPolarHBondContact O-CB 3.44Å; I830-L833 PolarHBondContact O-N 2.99Å; I830-L833 VanDerWaalsContact O-N 3.15Å; L833-T835 VanDerWaalsContact C-N 3.29Å; L833-T835 PolarHBondContact O-N 3.02Å
834	F	33.3	Very low	39.8	Very low	80 Å²	80	95.2 Å²	95.2	35%	0.351	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	32.2	173.7	-65.3	-61	0	0	0	114.7	L668 L671 I830 L831 K832 L836	L668-F834 HydrophobicContact CD1-CE2 4.14Å; L668-F834 HydrophobicContact CD1-CZ 4.29Å; L668-F834 HydrophobicContact CD2-CE2 3.92Å; L668-F834 HydrophobicContact CD2-CZ 3.65Å; L668-F834 HydrophobicContact CG-CE2 4.18Å; L668-F834 HydrophobicContact CG-CZ 3.85Å; L671-F834 HydrophobicContact CD1-CE1 4.24Å; I830-F834 HydrophobicContact CG2-CD2 4.08Å; I830-F834 HydrophobicContact CG2-CE2 3.66Å; I830-F834 WeakPolarHBondContact O-CD2 3.27Å; I830-F834 PolarHBondContact O-N 2.74Å; L831-F834 PolarHBondContact O-N 2.91Å; K832-F834 PolarHBondContact O-N 2.59Å; F834-L836 PolarHBondContact O-N 3.01Å
835	T	35.7	Very low	40.1	Very low	131 Å²	131	98.1 Å²	98.1	80%	0.804	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	24.2	167.5	61.2	0	0	0	0	116.9	K832 L833 T837	K832-T835 PolarHBondContact O-N 3.12Å; L833-T835 VanDerWaalsContact C-N 3.29Å; L833-T835 PolarHBondContact O-N 3.02Å; T835-T837 PolarHBondContact O-N 3.1Å
836	L	36.8	Very low	40.4	Very low	70 Å²	70	92.6 Å²	92.6	37%	0.366	50%	0.495	S	S	.	.			trans	-68.3	129	168.4	-70.6	170.9	0	0	0	109.4	L831 F834 I841	L831-L836 HydrophobicContact CB-CD1 4.21Å; L831-L836 HydrophobicContact CD2-CD1 3.87Å; F834-L836 PolarHBondContact O-N 3.01Å; L836-I841 HydrophobicContact CB-CD1 4.09Å; L836-I841 HydrophobicContact CB-CG1 4.17Å
837	T	40.4	Very low	40.6	Very low	73 Å²	73	95.4 Å²	95.4	45%	0.448	50%	0.503	S	S	.	.			trans	-63.9	148.2	-174.5	69.1	0	0	0	0	111.6	T835 E839 T840 I841	T835-T837 PolarHBondContact O-N 3.1Å; T837-E839 PolarHBondContact O-N 2.89Å; T837-E839 VanDerWaalsContact O-N 3.17Å; T837-T840 PolarHBondContact N-OG1 3.41Å; T837-T840 PolarHBondContact O-N 3.23Å; T837-T840 VanDerWaalsContact O-N 3.07Å; T837-T840 PolarHBondContact O-OG1 3.39Å; T837-T840 WeakPolarHBondContact OG1-CG2 3.49Å; T837-T840 PolarHBondContact OG1-N 3.13Å; T837-T840 PolarHBondContact OG1-OG1 3.17Å; T837-I841 PolarHBondContact O-N 3.13Å
838	S	40.2	Very low	40.8	Very low	92 Å²	92	94.5 Å²	94.5	64%	0.643	50%	0.5	S	S	*	.	H	α-helix	trans	-48.9	-43.2	177	-57.3	0	0	0	0	112.3	I841 V842	S838-I841 PolarHBondContact O-N 3.21Å; S838-V842 WeakPolarHBondContact O-CB 3.36Å; S838-V842 VanDerWaalsContact O-CG2 3.29Å; S838-V842 WeakPolarHBondContact O-CG2 3.07Å; S838-V842 PolarHBondContact O-N 2.87Å
839	E	46.8	Very low	40.7	Very low	152 Å²	152	98.9 Å²	98.9	71%	0.71	52%	0.521	S	S	*	.	H	α-helix	trans	-62.1	-48.6	177.9	-69.3	141.8	-158.8	0	0	112.4	T837 I841 V842 A843	T837-E839 PolarHBondContact O-N 2.89Å; T837-E839 VanDerWaalsContact O-N 3.17Å; E839-I841 PolarHBondContact O-N 3.32Å; E839-V842 PolarHBondContact O-N 2.91Å; E839-V842 VanDerWaalsContact O-N 3.17Å; E839-A843 WeakPolarHBondContact O-CB 3.49Å; E839-A843 PolarHBondContact O-N 2.92Å
840	T	44.6	Very low	41.2	Very low	64 Å²	64	102.4 Å²	102.4	39%	0.393	53%	0.532	S	S	.	.	H	α-helix	trans	-63	-32.1	179.8	59	0	0	0	0	112.7	T837 K844	T837-T840 PolarHBondContact N-OG1 3.41Å; T837-T840 PolarHBondContact O-N 3.23Å; T837-T840 VanDerWaalsContact O-N 3.07Å; T837-T840 PolarHBondContact O-OG1 3.39Å; T837-T840 WeakPolarHBondContact OG1-CG2 3.49Å; T837-T840 PolarHBondContact OG1-N 3.13Å; T837-T840 PolarHBondContact OG1-OG1 3.17Å; T840-K844 WeakPolarHBondContact O-CB 3.41Å; T840-K844 VanDerWaalsContact O-CG 3.31Å; T840-K844 WeakPolarHBondContact O-CG 3.46Å; T840-K844 PolarHBondContact O-N 3.11Å
841	I	41.2	Very low	41.3	Very low	34 Å²	34	99.7 Å²	99.7	17%	0.174	52%	0.521	C	S	.	.	H	α-helix	trans	-74.1	-41.8	175.2	-60.8	171.4	0	0	0	110.9	K832 L836 T837 S838 E839 R845	K832-I841 HydrophobicContact CG-CD1 3.66Å; L836-I841 HydrophobicContact CB-CD1 4.09Å; L836-I841 HydrophobicContact CB-CG1 4.17Å; T837-I841 PolarHBondContact O-N 3.13Å; S838-I841 PolarHBondContact O-N 3.21Å; E839-I841 PolarHBondContact O-N 3.32Å; I841-R845 VanDerWaalsContact O-CB 3.26Å; I841-R845 WeakPolarHBondContact O-CB 3.16Å; I841-R845 PolarHBondContact O-N 2.83Å; I841-R845 VanDerWaalsContact O-N 3.15Å
842	V	48	Very low	41.3	Very low	98 Å²	98	98.7 Å²	98.7	59%	0.594	52%	0.524	S	S	*	.	H	α-helix	trans	-70.6	-44.6	179.3	169.4	0	0	0	0	111.6	S838 E839 R845 A846	S838-V842 WeakPolarHBondContact O-CB 3.36Å; S838-V842 VanDerWaalsContact O-CG2 3.29Å; S838-V842 WeakPolarHBondContact O-CG2 3.07Å; S838-V842 PolarHBondContact O-N 2.87Å; E839-V842 PolarHBondContact O-N 2.91Å; E839-V842 VanDerWaalsContact O-N 3.17Å; V842-R845 PolarHBondContact O-N 2.81Å; V842-A846 WeakPolarHBondContact O-CB 3.36Å; V842-A846 PolarHBondContact O-N 2.58Å
843	A	44.9	Very low	41.6	Very low	58 Å²	58	100.9 Å²	100.9	48%	0.479	53%	0.534	S	S	.	.	H	α-helix	trans	-61.9	-49	179.1	0	0	0	0	0	111.6	E839 R845 A846 Y847	E839-A843 WeakPolarHBondContact O-CB 3.49Å; E839-A843 PolarHBondContact O-N 2.92Å; A843-R845 VanDerWaalsContact C-N 3.29Å; A843-R845 PolarHBondContact O-N 2.82Å; A843-A846 PolarHBondContact O-N 2.65Å; A843-Y847 WeakPolarHBondContact O-CB 3.24Å; A843-Y847 PolarHBondContact O-N 3.34Å
844	K	44.5	Very low	42.1	Very low	163 Å²	163	96.8 Å²	96.8	71%	0.709	52%	0.521	S	S	*	.	H	α-helix	trans	-62.3	-36.5	175.9	-72.3	-174	174.8	-164.8	0	112.5	T840 A848	T840-K844 WeakPolarHBondContact O-CB 3.41Å; T840-K844 VanDerWaalsContact O-CG 3.31Å; T840-K844 WeakPolarHBondContact O-CG 3.46Å; T840-K844 PolarHBondContact O-N 3.11Å; K844-A848 WeakPolarHBondContact O-CB 3.15Å; K844-A848 PolarHBondContact O-N 3.43Å
845	R	41.3	Very low	42.4	Very low	170 Å²	170	98.3 Å²	98.3	64%	0.642	52%	0.524	S	S	*	.	H	α-helix	trans	-67.7	-39.8	174.2	-175.9	178.4	176	-147.6	-5.9	112.4	I841 V842 A843 M849	I841-R845 VanDerWaalsContact O-CB 3.26Å; I841-R845 WeakPolarHBondContact O-CB 3.16Å; I841-R845 PolarHBondContact O-N 2.83Å; I841-R845 VanDerWaalsContact O-N 3.15Å; V842-R845 PolarHBondContact O-N 2.81Å; A843-R845 VanDerWaalsContact C-N 3.29Å; A843-R845 PolarHBondContact O-N 2.82Å; R845-M849 WeakPolarHBondContact O-CB 3.22Å; R845-M849 WeakPolarHBondContact O-CG 3.06Å; R845-M849 PolarHBondContact O-N 3.11Å; R845-M849 VanDerWaalsContact O-N 3.13Å
846	A	46.5	Very low	42.5	Very low	59 Å²	59	95.6 Å²	95.6	49%	0.488	51%	0.51	S	S	.	.	H	α-helix	trans	-66.6	-43.1	176.2	0	0	0	0	0	111.4	V842 A843 M849 K850	V842-A846 WeakPolarHBondContact O-CB 3.36Å; V842-A846 PolarHBondContact O-N 2.58Å; A843-A846 PolarHBondContact O-N 2.65Å; A846-M849 PolarHBondContact O-N 3.25Å; A846-K850 PolarHBondContact O-N 3.24Å
847	Y	44.4	Very low	42.8	Very low	150 Å²	150	96 Å²	96	59%	0.588	52%	0.518	S	S	*	.	H	α-helix	trans	-59.5	-54.4	176.1	-167.8	-86.8	0	0	0	111.6	D615 A843 M849 K850 A851	D615-Y847 HydrophobicContact CB-CE1 4.35Å; A843-Y847 WeakPolarHBondContact O-CB 3.24Å; A843-Y847 PolarHBondContact O-N 3.34Å; Y847-M849 VanDerWaalsContact C-N 3.27Å; Y847-M849 PolarHBondContact O-N 2.97Å; Y847-K850 WeakPolarHBondContact O-CA 3.47Å; Y847-K850 WeakPolarHBondContact O-CB 3.35Å; Y847-K850 PolarHBondContact O-N 3.38Å; Y847-A851 PolarHBondContact O-N 2.97Å
848	A	39.7	Very low	42.8	Very low	40 Å²	40	97.7 Å²	97.7	33%	0.331	52%	0.524	S	S	.	.	H	α-helix	trans	-58.9	-36.4	178.3	0	0	0	0	0	112.9	K844 A852	K844-A848 WeakPolarHBondContact O-CB 3.15Å; K844-A848 PolarHBondContact O-N 3.43Å; A848-A852 VanDerWaalsContact O-CB 3.27Å; A848-A852 WeakPolarHBondContact O-CB 3.22Å; A848-A852 PolarHBondContact O-N 2.8Å
849	M	40.6	Very low	42.6	Very low	129 Å²	129	98.2 Å²	98.2	64%	0.635	52%	0.52	S	S	*	.	H	α-helix	trans	-69.9	-30.9	174.5	-69.8	-75.6	-61.9	0	0	112.8	R845 A846 Y847 K853	R845-M849 WeakPolarHBondContact O-CB 3.22Å; R845-M849 WeakPolarHBondContact O-CG 3.06Å; R845-M849 PolarHBondContact O-N 3.11Å; R845-M849 VanDerWaalsContact O-N 3.13Å; A846-M849 PolarHBondContact O-N 3.25Å; Y847-M849 VanDerWaalsContact C-N 3.27Å; Y847-M849 PolarHBondContact O-N 2.97Å; M849-K853 PolarHBondContact O-N 3.14Å
850	K	50.2	Low	42.2	Very low	168 Å²	168	96.3 Å²	96.3	73%	0.73	52%	0.515	S	S	*	.	H	α-helix	trans	-74.9	-44.4	174.7	-163.6	179.9	-177.8	-173.5	0	111	A846 Y847 K853 A854	A846-K850 PolarHBondContact O-N 3.24Å; Y847-K850 WeakPolarHBondContact O-CA 3.47Å; Y847-K850 WeakPolarHBondContact O-CB 3.35Å; Y847-K850 PolarHBondContact O-N 3.38Å; K850-K853 WeakPolarHBondContact O-CB 3.43Å; K850-K853 PolarHBondContact O-N 2.92Å; K850-A854 PolarHBondContact O-N 3.42Å
851	A	41.6	Very low	41.8	Very low	20 Å²	20	99.3 Å²	99.3	17%	0.165	53%	0.529	C	S	.	.	H	α-helix	trans	-61.7	-45.6	176.5	0	0	0	0	0	112.3	Y847 K853 A854 R855	Y847-A851 PolarHBondContact O-N 2.97Å; A851-K853 VanDerWaalsContact C-N 3.26Å; A851-K853 PolarHBondContact O-N 3.39Å; A851-A854 PolarHBondContact O-N 3.26Å; A851-R855 WeakPolarHBondContact O-CG 3.39Å; A851-R855 PolarHBondContact O-N 2.91Å
852	A	34.2	Very low	41.6	Very low	61 Å²	61	104.6 Å²	104.6	50%	0.504	56%	0.557	S	S	.	*	H	α-helix	trans	-59.7	-36	174.3	0	0	0	0	0	112.5	A848 S856	A848-A852 VanDerWaalsContact O-CB 3.27Å; A848-A852 WeakPolarHBondContact O-CB 3.22Å; A848-A852 PolarHBondContact O-N 2.8Å; A852-S856 WeakPolarHBondContact O-CB 3.46Å; A852-S856 PolarHBondContact O-N 3.44Å; A852-S856 VanDerWaalsContact O-N 3.15Å
853	K	45	Very low	40.9	Very low	164 Å²	164	106.5 Å²	106.5	71%	0.713	56%	0.562	S	S	*	*	H	α-helix	trans	-66.9	-43.8	175.9	-131.8	-176.8	-178.7	-168	0	111.9	M849 K850 A851 S856 C857	M849-K853 PolarHBondContact O-N 3.14Å; K850-K853 WeakPolarHBondContact O-CB 3.43Å; K850-K853 PolarHBondContact O-N 2.92Å; A851-K853 VanDerWaalsContact C-N 3.26Å; A851-K853 PolarHBondContact O-N 3.39Å; K853-S856 PolarHBondContact O-N 3.17Å; K853-C857 PolarHBondContact O-N 2.93Å; K853-C857 PolarHBondContact O-SG 3.12Å; K853-C857 VanDerWaalsContact O-SG 3.42Å
854	A	44.9	Very low	40.3	Very low	56 Å²	56	109.4 Å²	109.4	46%	0.463	57%	0.574	S	S	.	*	H	α-helix	trans	-63.5	-45.6	177.8	0	0	0	0	0	112.5	K850 A851 S856 C857 N858	K850-A854 PolarHBondContact O-N 3.42Å; A851-A854 PolarHBondContact O-N 3.26Å; A854-S856 VanDerWaalsContact C-N 3.27Å; A854-S856 PolarHBondContact O-N 3.46Å; A854-C857 WeakPolarHBondContact O-CB 3.34Å; A854-C857 PolarHBondContact O-N 3.47Å; A854-N858 PolarHBondContact O-N 3.19Å
855	R	39.8	Very low	39.6	Very low	112 Å²	112	111.5 Å²	111.5	42%	0.423	58%	0.583	S	S	.	*	H	α-helix	trans	-64.1	-32.6	178	-62.9	178.9	-159.8	-173.3	7.9	112.2	S614 D615 A851 C857 N858 N859	S614-R855 PolarHBondContact O-NH2 3.15Å; S614-R855 PolarHBondContact OG-NH1 3.23Å; D615-R855 IonicContact OD1-NH2 2.83Å; D615-R855 PolarHBondContact OD1-NH2 3.45Å; A851-R855 WeakPolarHBondContact O-CG 3.39Å; A851-R855 PolarHBondContact O-N 2.91Å; R855-C857 VanDerWaalsContact C-N 3.27Å; R855-C857 PolarHBondContact O-N 2.81Å; R855-N858 PolarHBondContact O-N 3.16Å; R855-N859 PolarHBondContact O-N 3.05Å; R855-N859 VanDerWaalsContact O-N 3.16Å
856	S	37.6	Very low	39.2	Very low	74 Å²	74	109.8 Å²	109.8	52%	0.517	59%	0.591	S	S	.	*	H	α-helix	trans	-69.4	-18.5	172.5	-169	0	0	0	0	114.4	A852 K853 A854	A852-S856 WeakPolarHBondContact O-CB 3.46Å; A852-S856 PolarHBondContact O-N 3.44Å; A852-S856 VanDerWaalsContact O-N 3.15Å; K853-S856 PolarHBondContact O-N 3.17Å; A854-S856 VanDerWaalsContact C-N 3.27Å; A854-S856 PolarHBondContact O-N 3.46Å
857	C	42	Very low	38.6	Very low	78 Å²	78	112.8 Å²	112.8	53%	0.527	61%	0.606	S	S	.	*	H	α-helix	trans	-82.8	-45.3	171.4	-62.8	0	0	0	0	110.8	K853 A854 R855 N859 N860	K853-C857 PolarHBondContact O-N 2.93Å; K853-C857 PolarHBondContact O-SG 3.12Å; K853-C857 VanDerWaalsContact O-SG 3.42Å; A854-C857 WeakPolarHBondContact O-CB 3.34Å; A854-C857 PolarHBondContact O-N 3.47Å; R855-C857 VanDerWaalsContact C-N 3.27Å; R855-C857 PolarHBondContact O-N 2.81Å; C857-N859 PolarHBondContact O-N 3.06Å; C857-N860 PolarHBondContact O-N 3.36Å
858	N	40	Very low	38.1	Very low	109 Å²	109	111.1 Å²	111.1	58%	0.583	62%	0.616	S	S	*	*	H	α-helix	trans	-68	-35	-175.8	-70.2	13.2	0	0	0	113	A854 R855 N860 N861	A854-N858 PolarHBondContact O-N 3.19Å; R855-N858 PolarHBondContact O-N 3.16Å; N858-N860 PolarHBondContact O-N 2.77Å; N858-N861 PolarHBondContact O-N 3.04Å; N858-N861 VanDerWaalsContact O-N 3.14Å
859	N	36.7	Very low	38	Very low	104 Å²	104	114.1 Å²	114.1	56%	0.556	64%	0.635	S	S	*	*	H	α-helix	trans	-65.1	-22.6	177	-80.7	19.7	0	0	0	113.5	R855 C857 N861 I863	R855-N859 PolarHBondContact O-N 3.05Å; R855-N859 VanDerWaalsContact O-N 3.16Å; C857-N859 PolarHBondContact O-N 3.06Å; N859-N861 VanDerWaalsContact C-N 3.3Å; N859-N861 PolarHBondContact O-N 3.48Å; N859-I863 WeakPolarHBondContact O-CD1 3.31Å; N859-I863 WeakPolarHBondContact O-CG1 3.47Å
860	N	37.4	Very low	37.9	Very low	112 Å²	112	113.6 Å²	113.6	60%	0.599	64%	0.641	S	S	*	*	H	α-helix	trans	-74.1	-21.6	176.5	-68.7	-4.6	0	0	0	112.7	C857 N858	C857-N860 PolarHBondContact O-N 3.36Å; N858-N860 PolarHBondContact O-N 2.77Å
861	N	37.9	Very low	37.5	Very low	127 Å²	127	111.2 Å²	111.2	68%	0.679	64%	0.643	S	S	*	*	H	α-helix	trans	-89.2	-17.3	-178.1	-67.9	-0.3	0	0	0	113.2	N858 N859	N858-N861 PolarHBondContact O-N 3.04Å; N858-N861 VanDerWaalsContact O-N 3.14Å; N859-N861 VanDerWaalsContact C-N 3.3Å; N859-N861 PolarHBondContact O-N 3.48Å
862	N	35.6	Very low	37.5	Very low	144 Å²	144	115.7 Å²	115.7	77%	0.77	67%	0.67	S	S	*	*	S	Bend	trans	-101.8	6.2	-178.3	-75.5	-8.1	0	0	0	114.1
863	I	33.4	Very low	37.9	Very low	138 Å²	138	118.9 Å²	118.9	71%	0.708	69%	0.685	S	S	*	*	S	Bend	trans	-112.2	27.1	177.8	-54	173.9	0	0	0	110.3	N859	N859-I863 WeakPolarHBondContact O-CD1 3.31Å; N859-I863 WeakPolarHBondContact O-CG1 3.47Å
864	V	32.5	Very low	37.3	Very low	120 Å²	120	117.1 Å²	117.1	73%	0.727	69%	0.689	S	S	*	*			trans	-133.6	70.1	176.6	-167.8	0	0	0	0	110.8
865	K	30.3	Very low	37	Very low	206 Å²	206	121.2 Å²	121.2	90%	0.896	71%	0.708	S	S	*	*			trans	-151	42.6	166.3	-132.6	175.1	-172.6	-178.9	0	114
866	V	31.9	Very low	36.8	Very low	134 Å²	134	121.2 Å²	121.2	81%	0.812	72%	0.721	S	S	*	*			trans	-70.9	131.3	163.4	-178.9	0	0	0	0	108	S868	V866-S868 PolarHBondContact O-N 3.07Å
867	P	34.7	Very low	36.6	Very low	122 Å²	122	123.6 Å²	123.6	79%	0.792	73%	0.732	S	S	*	*			trans	-61	125.2	174.7	-22.4	33.9	0	0	0	110.9	S869	P867-S869 PolarHBondContact O-N 3Å
868	S	34.4	Very low	36.2	Very low	115 Å²	115	125.1 Å²	125.1	80%	0.804	74%	0.739	S	S	*	*			trans	-75.5	110.7	179.5	52.9	0	0	0	0	111.1	V866	V866-S868 PolarHBondContact O-N 3.07Å
869	S	37.1	Very low	35.9	Very low	104 Å²	104	125.3 Å²	125.3	73%	0.727	74%	0.744	S	S	*	*	P	Polyproline II helix	trans	-62.5	147.6	162	46.1	0	0	0	0	110.7	P867	P867-S869 PolarHBondContact O-N 3Å
870	P	38.6	Very low	35.8	Very low	117 Å²	117	126.1 Å²	126.1	76%	0.76	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-69.8	150.8	-174.1	28.1	-35.2	0	0	0	112.6
871	P	41.3	Very low	35.7	Very low	119 Å²	119	126.3 Å²	126.3	77%	0.773	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-76.9	142.9	-177.1	31.3	-35.2	0	0	0	112.5
872	P	41.7	Very low	35.5	Very low	114 Å²	114	126 Å²	126	74%	0.74	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-72.6	153	165.9	32.2	-34.3	0	0	0	110.9
873	P	43.1	Very low	35.5	Very low	127 Å²	127	126.1 Å²	126.1	83%	0.825	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-70.8	141.7	-178.3	28.8	-34.8	0	0	0	112.8
874	T	33.3	Very low	35.6	Very low	127 Å²	127	129.1 Å²	129.1	78%	0.779	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-74.7	132.8	-176.3	-45.8	0	0	0	0	112.8
875	T	38.3	Very low	35.7	Very low	142 Å²	142	128.9 Å²	128.9	87%	0.871	78%	0.777	S	S	*	*			trans	-140.7	138.6	154.7	-49.8	0	0	0	0	109.1
876	T	34.2	Very low	35.9	Very low	112 Å²	112	125.8 Å²	125.8	69%	0.687	78%	0.775	S	S	*	*			trans	-100.7	165.7	-161.7	-41.8	0	0	0	0	112.1
877	T	34.1	Very low	35.9	Very low	124 Å²	124	124.3 Å²	124.3	76%	0.761	77%	0.771	S	S	*	*			trans	87.3	132.1	155.4	-33.9	0	0	0	0	115
878	T	33.1	Very low	36	Very low	110 Å²	110	127.3 Å²	127.3	68%	0.675	77%	0.774	S	S	*	*			cis	-170.3	148.8	-20.1	-106.5	0	0	0	0	111.2
879	T	35.2	Very low	35.8	Very low	113 Å²	113	126.5 Å²	126.5	69%	0.693	77%	0.769	S	S	*	*			trans	57.4	134.8	161.8	48.9	0	0	0	0	123.8
880	T	33.5	Very low	35.5	Very low	121 Å²	121	127.4 Å²	127.4	74%	0.742	77%	0.774	S	S	*	*			trans	64.6	143.2	137.2	59.5	0	0	0	0	120.3
881	T	35.7	Very low	35.3	Very low	117 Å²	117	128 Å²	128	72%	0.718	78%	0.78	S	S	*	*			cis	-162	151.5	-7.9	10.5	0	0	0	0	111.5
882	T	33.1	Very low	34.9	Very low	119 Å²	119	129.8 Å²	129.8	73%	0.73	78%	0.782	S	S	*	*			trans	47.8	109.9	142.4	-45.5	0	0	0	0	120.7
883	T	36.7	Very low	34.7	Very low	147 Å²	147	134.3 Å²	134.3	90%	0.902	79%	0.79	S	S	*	*				-170.6	177.1	117.3	19	0	0	0	0	113
884	K	34	Very low	34.3	Very low	201 Å²	201	136.4 Å²	136.4	87%	0.874	79%	0.789	S	S	*	*			trans	-76.2	161.6	-164.9	-91.8	-173.1	171.1	-173.4	0	116.4
885	P	36	Very low	34.7	Very low	116 Å²	116	139.5 Å²	139.5	75%	0.753	80%	0.795	S	S	*	*			trans	-95	165.5	171.5	39.6	-35.7	0	0	0	114.1
886	T	33	Very low	34.7	Very low	140 Å²	140	138.9 Å²	138.9	86%	0.859	79%	0.786	S	S	*	*			trans	-152.6	144.1	154.3	-72.4	0	0	0	0	111.6
887	S	33	Very low	35.3	Very low	104 Å²	104	142.6 Å²	142.6	73%	0.727	79%	0.792	S	S	*	*			trans	-31.4	148.2	176.1	-42	0	0	0	0	122.2
888	Q	36.5	Very low	35.7	Very low	184 Å²	184	142.9 Å²	142.9	86%	0.86	79%	0.789	S	S	*	*			trans	169.5	118.9	133.8	-92.4	167.3	14.9	0	0	107.8
889	S	31.4	Very low	36.4	Very low	98 Å²	98	145.9 Å²	145.9	69%	0.685	79%	0.793	S	S	*	*				92.2	113.5	54.8	72.6	0	0	0	0	114.4
890	C	30	Very low	36.7	Very low	124 Å²	124	148.2 Å²	148.2	84%	0.838	80%	0.796	S	S	*	*			trans	53.1	123.8	155.6	-58	0	0	0	0	120.8
891	S	34.5	Very low	37.1	Very low	128 Å²	128	150.9 Å²	150.9	90%	0.895	80%	0.8	S	S	*	*				-175	159.1	114.1	-81.3	0	0	0	0	112.9
892	I	32.2	Very low	37.7	Very low	158 Å²	158	149.5 Å²	149.5	81%	0.81	79%	0.793	S	S	*	*			trans	-92.6	152	179	-63	161.7	0	0	0	109.7
893	K	37.2	Very low	38.1	Very low	209 Å²	209	149.7 Å²	149.7	91%	0.909	79%	0.794	S	S	*	*			trans	-149.7	139.9	153.6	-113.7	-179.9	-179.3	-173.1	0	111.8
894	E	35.4	Very low	38.1	Very low	171 Å²	171	149 Å²	149	80%	0.799	79%	0.785	S	S	*	*			trans	-94.4	161.3	172.3	-56.8	163	123	0	0	109.9
895	E	41.1	Very low	38.3	Very low	192 Å²	192	144.2 Å²	144.2	90%	0.897	78%	0.777	S	S	*	*			trans	-150.2	151.3	150	-142.7	176	146.7	0	0	111.3
896	N	39	Very low	38.5	Very low	128 Å²	128	143.3 Å²	143.3	68%	0.684	77%	0.773	S	S	*	*			trans	-109.9	155.2	-165.4	-67.6	-56.4	0	0	0	113.7
897	K	47.5	Very low	38.9	Very low	191 Å²	191	144.4 Å²	144.4	83%	0.83	77%	0.77	S	S	*	*			trans	168.9	156.1	137.5	-94.3	154.5	-179.1	167	0	110.1
898	D	42.3	Very low	39.1	Very low	129 Å²	129	145.7 Å²	145.7	69%	0.69	77%	0.769	S	S	*	*			cis	164	156.5	-29.7	-96.8	-36	0	0	0	105.8
899	K	46	Very low	39.1	Very low	174 Å²	174	142 Å²	142	76%	0.757	76%	0.759	S	S	*	*			trans	74.1	144.1	174.9	-60.9	161.3	161.6	-82	0	115.4
900	E	43.2	Very low	39.4	Very low	162 Å²	162	142.9 Å²	142.9	76%	0.757	77%	0.765	S	S	*	*			cis	-144.8	175.5	1.8	-131.9	142.1	-135.9	0	0	112.6
901	E	41.3	Very low	39.8	Very low	177 Å²	177	145 Å²	145	83%	0.827	77%	0.767	S	S	*	*			trans	-122.3	-167.8	-157.2	-112.3	-152.1	131.3	0	0	111.7
902	P	48.1	Very low	40.1	Very low	88 Å²	88	144.9 Å²	144.9	57%	0.571	76%	0.764	S	S	*	*			cis	-143	-157.7	-44.1	39.8	-20.2	0	0	0	114.5
903	V	41	Very low	40.5	Very low	123 Å²	123	141.7 Å²	141.7	75%	0.745	76%	0.76	S	S	*	*			trans	75.8	137.8	147.3	158	0	0	0	0	117.3
904	N	38.3	Very low	41	Very low	132 Å²	132	137.2 Å²	137.2	71%	0.706	75%	0.753	S	S	*	*			cis	-141	144.3	20.1	-112.9	-36.5	0	0	0	110.2
905	S	38.2	Very low	41.4	Very low	101 Å²	101	135.2 Å²	135.2	71%	0.706	76%	0.755	S	S	*	*				59.7	141.9	83.6	92.9	0	0	0	0	116.3
906	S	39.4	Very low	41.3	Very low	96 Å²	96	132.3 Å²	132.3	67%	0.671	75%	0.75	S	S	*	*			cis	-162.1	165.2	-0.6	-159.5	0	0	0	0	112.2
907	M	40.4	Very low	41.1	Very low	164 Å²	164	132 Å²	132	81%	0.808	75%	0.753	S	S	*	*			trans	34.4	152.8	146.6	-77.3	165.2	166.7	0	0	122.6
908	D	37.8	Very low	40.7	Very low	131 Å²	131	129.5 Å²	129.5	70%	0.701	75%	0.753	S	S	*	*			cis	-162.9	170.5	11.6	-137.3	-39.5	0	0	0	115.6
909	T	37.7	Very low	40.3	Very low	107 Å²	107	129.5 Å²	129.5	66%	0.656	76%	0.759	S	S	*	*			trans	53	132.4	150.8	-32.8	0	0	0	0	125
910	S	37	Very low	40.3	Very low	116 Å²	116	128 Å²	128	81%	0.811	76%	0.764	S	S	*	*			trans	84.6	141.5	144	54.1	0	0	0	0	125.3
911	L	39	Very low	39.9	Very low	167 Å²	167	126.1 Å²	126.1	87%	0.874	76%	0.763	S	S	*	*			trans	-87.2	170	169.4	-79	164.3	0	0	0	110.9
912	P	40.7	Very low	39.9	Very low	127 Å²	127	123.3 Å²	123.3	83%	0.825	76%	0.758	S	S	*	*			cis	-141.2	-151.4	31.9	42.9	-20.8	0	0	0	116
913	A	40.4	Very low	39.8	Very low	90 Å²	90	125.5 Å²	125.5	74%	0.744	77%	0.77	S	S	*	*			trans	-109.5	-160.9	-161.4	0	0	0	0	0	114.4
914	P	46.6	Very low	39.9	Very low	115 Å²	115	128.9 Å²	128.9	75%	0.747	78%	0.778	S	S	*	*				-123.1	-178.5	-116.9	40.3	-22.4	0	0	0	115.5
915	P	45.1	Very low	40.5	Very low	130 Å²	130	128 Å²	128	84%	0.844	78%	0.782	S	S	*	*			trans	-134.7	-177.1	150.9	37.8	-23.1	0	0	0	115.1
916	T	38.3	Very low	40.7	Very low	130 Å²	130	136.4 Å²	136.4	80%	0.798	81%	0.81	S	S	*	*			trans	-119	155.3	-156.8	24.6	0	0	0	0	116.4
917	T	34.8	Very low	40.8	Very low	121 Å²	121	138.4 Å²	138.4	74%	0.742	82%	0.817	S	S	*	*			trans	62.4	122.6	144.7	-53.6	0	0	0	0	121.8
918	V	38.4	Very low	40.8	Very low	139 Å²	139	137.1 Å²	137.1	84%	0.842	82%	0.818	S	S	*	*			trans	-145.4	148.1	143.9	-172.6	0	0	0	0	109.9
919	T	33.7	Very low	40.9	Very low	130 Å²	130	137.4 Å²	137.4	80%	0.798	82%	0.824	S	S	*	*			trans	-115.9	156.7	175.3	30.4	0	0	0	0	112.6
920	V	45.9	Very low	41.1	Very low	143 Å²	143	139.2 Å²	139.2	87%	0.867	83%	0.834	S	S	*	*			trans	-141.6	138.4	173.8	-177.2	0	0	0	0	111
921	T	36.3	Very low	41.4	Very low	122 Å²	122	140.6 Å²	140.6	75%	0.748	84%	0.835	S	S	*	*			trans	-89.8	166.7	175.7	49.6	0	0	0	0	111.8
922	T	40.6	Very low	41.6	Very low	117 Å²	117	138.9 Å²	138.9	72%	0.718	83%	0.833	S	S	*	*				167.5	146.5	83.8	-46.2	0	0	0	0	105
923	T	46.4	Very low	41.6	Very low	135 Å²	135	139.7 Å²	139.7	83%	0.828	83%	0.833	S	S	*	*				-169.9	166.9	78.2	41.4	0	0	0	0	112
924	Q	42.7	Very low	41.7	Very low	194 Å²	194	143.5 Å²	143.5	91%	0.907	84%	0.84	S	S	*	*			trans	-105.2	159.5	178.8	-58.5	168.2	-60.2	0	0	112.5
925	S	51.8	Low	41.3	Very low	113 Å²	113	145.9 Å²	145.9	79%	0.79	85%	0.848	S	S	*	*			trans	-161.3	123.5	145.6	57.8	0	0	0	0	110.9
926	E	41.8	Very low	41	Very low	277 Å²	277	147.4 Å²	147.4	100%	1.294	85%	0.848	S	S	*	*			trans	61.1	0	178	-55.9	-163.8	139.1	0	0	117.6

Retrieved 926 of 926 residues in 113.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).