A0A5K4F1G9_SCHMA Loading...

polynucleotide adenylyltransferase AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F1G9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,176 aa.

						>A0A5K4F1G9_SCHMA|A0A5K4F1G9
MKDFKSDYKLSNNLSYLTSSPSSSTTTSTTTSTTTVATTTTTTSSSSSLSLSYYSKNNKSLDYTLKNHFNTYNTTYNNTNDTTYYHTTEYKFKTKLESFTKMYQIKDDINYEFNIKLPKLITNSYYNNKQTKNFLNLKQNKFYKKRKTLNYINDTIYKPIYNNEENIIQKRNNKLSFYRSPLTNTTTSYTTDNTTYNNNNISSTFYKRSDYGRFKRNKDNGPSLSDVPMNVNFNTLNNSCTTNRYHILNFEQVQYLDDIMNTYISISPNPRLQNLLGTNTVISPGLPTTTSSTSSTVINKPCSCFSSMNSTNFNNTENSDHIDTINSSSISTTVPISKINNLVTSIPEGFSNSTNIDNTINNPYQHSINDCCLPNHHIPFISQQSQKLPTIRIQLKKLIRIIRDGLLKESIPVKEIRLNGDVASSIIIGSQDKQSFHDIELIFYVDLSNSTTCNKIKSVVYSCIANILTDTIILENLSNFTNHSISYTTNNNNTLPFNIPSTQDSLSSHYCKDCSYCILNKQNLQNLNHHQNINKNKQSLEINNQSINDNQLIETKLSQINKHYHLINNEQKIKYNNNNINDNNNCKLCHLSLRHLYPLYDYNSLITYSLHIILDSLLKFYDITNQYIKKKLNKNYYPIVVVKSIACNYIDVIKHILNHIIVIYKPEEIYGGGLLKYCKLLVNGYKPCQMIDIILMEKYMCSRFFIDFPNILNQYHQLNYYLLNYFDNNYQMKINYLNILYEVVSHSTICLMTHERQQTLCLIEMFLRDVTEQEKENKQSVVHLQEFSSNNWALDKVFYGTNYFPKQIYSINDQHDLYDLYNYQCQVEFMHNSKDITDQQNSTISNSFQSKIELKHVNKVENTPNAEGDNDNNDNDDDDAYSHNNNNDTHENNNDHTPFTNESQTELKCYHNNDHLEKSTESNNHLQKTIEDSTYRKIPMNDTETFQNIPRIHNKITYSNEELLCRNNSTFYNHHFHSQLCHNHHHHQQHNPHHYHHHHHHSQQFNNELYYVPQIVTYFPANEYLLSLSTNKNQSFYSIPQSTIPDHINNDTTYNTTTNTTNILSNKLPHYHAKILLPQDNSIEATNNGDIRYYVGVPCCYPTNTIYSKYSPYNNNNTNNNNVSNTNNDNTIETRDDLLTYCGEPFIYYTPDQNYYIYSTPTPTITSSIQENISIL
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	30	Very low	29.5	Very low	194 Å²	194	160.5 Å²	160.5	96%	0.956	78%	0.784	S	S	*	*				0	16.7	0	-157.4	167.6	177.4	0	0	112.6	D3	M1-D3 VanDerWaalsContact C-N 3.34Å; M1-D3 WeakPolarHBondContact CA-OD2 3.44Å; M1-D3 PolarHBondContact N-OD2 3.41Å
2	K	28.3	Very low	29.3	Very low	195 Å²	195	160.7 Å²	160.7	85%	0.848	79%	0.792	S	S	*	*			trans	-93.9	0.1	167.3	-76.4	-173.9	171.2	-177.3	0	111.9	F4	K2-F4 PolarHBondContact O-N 3.43Å
3	D	29.4	Very low	29.1	Very low	115 Å²	115	159.2 Å²	159.2	62%	0.615	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.5	30.9	-149.3	-31.9	-78.9	0	0	0	111.8	M1	M1-D3 VanDerWaalsContact C-N 3.34Å; M1-D3 WeakPolarHBondContact CA-OD2 3.44Å; M1-D3 PolarHBondContact N-OD2 3.41Å
4	F	33.3	Very low	29.1	Very low	211 Å²	211	160.6 Å²	160.6	93%	0.925	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.9	11.9	-179.3	-99.2	-78	0	0	0	113	K2	K2-F4 PolarHBondContact O-N 3.43Å
5	K	34.4	Very low	28.9	Very low	161 Å²	161	156 Å²	156	70%	0.7	79%	0.789	S	S	*	*	S	Bend	trans	-108.4	19.9	176.7	-133	172.6	-174.9	175.1	0	112	D707	K5-D707 IonicContact NZ-OD1 3.84Å; K5-D707 PolarHBondContact NZ-OD1 3.04Å
6	S	28.9	Very low	28.9	Very low	92 Å²	92	158.8 Å²	158.8	64%	0.643	79%	0.789	S	S	*	*			trans	-138.2	52.7	-167.9	62	0	0	0	0	113.4
7	D	28.2	Very low	29	Very low	151 Å²	151	159.5 Å²	159.5	81%	0.807	80%	0.795	S	S	*	*			trans	-143.6	156	161.6	-101.3	-45.1	0	0	0	108.3
8	Y	29.9	Very low	29	Very low	178 Å²	178	156.8 Å²	156.8	70%	0.698	79%	0.788	S	S	*	*			trans	66.8	38.5	-174.6	-55.1	-67.1	0	0	0	117.2	K457	Y8-K457 PolarHBondContact OH-NZ 2.87Å
9	K	26.5	Very low	29.1	Very low	211 Å²	211	154.8 Å²	154.8	92%	0.917	79%	0.791	S	S	*	*				-86.5	105.8	128.2	-90.7	-169.8	175.5	-176	0	107.2
10	L	28.5	Very low	29.2	Very low	159 Å²	159	152.7 Å²	152.7	83%	0.832	79%	0.79	S	S	*	*			trans	-116.4	129.9	166.1	-141.7	78.1	0	0	0	108.6
11	S	27.5	Very low	29.6	Very low	98 Å²	98	151.9 Å²	151.9	69%	0.685	80%	0.795	S	S	*	*			trans	-78.2	140	-175.4	51.6	0	0	0	0	112.2	N13	S11-N13 PolarHBondContact O-N 2.63Å
12	N	26.7	Very low	29.6	Very low	163 Å²	163	148 Å²	148	87%	0.872	79%	0.787	S	S	*	*	S	Bend	trans	-63	95.6	159.8	-71	-11.5	0	0	0	109.1
13	N	27	Very low	29.9	Very low	141 Å²	141	144.5 Å²	144.5	75%	0.754	79%	0.787	S	S	*	*			trans	-171.9	89.4	164.5	-98.8	-24.4	0	0	0	110.6	S11	S11-N13 PolarHBondContact O-N 2.63Å
14	L	29	Very low	30.1	Very low	180 Å²	180	143.8 Å²	143.8	94%	0.942	79%	0.791	S	S	*	*			trans	-158.8	113.6	153.9	-145.5	73.8	0	0	0	110.5
15	S	26	Very low	30.1	Very low	91 Å²	91	140.1 Å²	140.1	64%	0.636	79%	0.786	S	S	*	*			trans	-150.2	137.7	179.9	56.2	0	0	0	0	109.7
16	Y	28.8	Very low	29.7	Very low	200 Å²	200	138.6 Å²	138.6	78%	0.784	79%	0.791	S	S	*	*			trans	68	152.2	-174.8	-54.1	-76.2	0	0	0	112.4
17	L	31.1	Very low	29.9	Very low	171 Å²	171	140.6 Å²	140.6	90%	0.895	80%	0.799	S	S	*	*			cis	-124.7	169.2	34.9	-82.1	158.4	0	0	0	116.4
18	T	28.1	Very low	30.1	Very low	111 Å²	111	137.9 Å²	137.9	68%	0.681	79%	0.792	S	S	*	*			trans	-107	157.7	-170.6	50.7	0	0	0	0	113.2
19	S	31.9	Very low	30.2	Very low	120 Å²	120	135 Å²	135	84%	0.839	79%	0.793	S	S	*	*			trans	-146.8	127.3	150.2	51.3	0	0	0	0	112.4
20	S	31.6	Very low	30.4	Very low	111 Å²	111	130.8 Å²	130.8	78%	0.776	79%	0.785	S	S	*	*			trans	-107.3	170.9	162.3	-52.6	0	0	0	0	108.3
21	P	37.3	Very low	30.6	Very low	136 Å²	136	128.7 Å²	128.7	88%	0.883	78%	0.779	S	S	*	*				-147.7	-179.4	91.8	38.4	-20.9	0	0	0	115
22	S	29.6	Very low	30.8	Very low	114 Å²	114	128.8 Å²	128.8	80%	0.797	78%	0.78	S	S	*	*			trans	-120	141.5	-170.3	55.5	0	0	0	0	114.3
23	S	34.7	Very low	31.2	Very low	120 Å²	120	126.4 Å²	126.4	84%	0.839	77%	0.771	S	S	*	*			trans	-173.8	153.6	158.2	47.7	0	0	0	0	110
24	S	33.7	Very low	31.5	Very low	100 Å²	100	125.3 Å²	125.3	70%	0.699	77%	0.77	S	S	*	*			cis	-165.3	142.6	-18.9	47	0	0	0	0	110.4
25	T	32.5	Very low	31.7	Very low	135 Å²	135	122.2 Å²	122.2	83%	0.828	76%	0.758	S	S	*	*			trans	41.9	119	153.3	52.7	0	0	0	0	121.2
26	T	27.1	Very low	32.1	Very low	129 Å²	129	123.7 Å²	123.7	79%	0.791	76%	0.763	S	S	*	*			trans	-53.4	146.5	161.4	49.1	0	0	0	0	115.7
27	T	33.3	Very low	32.2	Very low	134 Å²	134	118.1 Å²	118.1	82%	0.822	76%	0.759	S	S	*	*				-167	123.1	121.4	18.8	0	0	0	0	114.6
28	S	31.5	Very low	32.2	Very low	94 Å²	94	115.7 Å²	115.7	66%	0.657	75%	0.751	S	S	*	*			trans	37.2	122	140.2	61.4	0	0	0	0	124.2
29	T	31	Very low	32.3	Very low	117 Å²	117	115.8 Å²	115.8	72%	0.718	75%	0.752	S	S	*	*				78.3	127.5	126.2	54.9	0	0	0	0	124.1
30	T	31.5	Very low	32.1	Very low	122 Å²	122	115.7 Å²	115.7	75%	0.748	75%	0.746	S	S	*	*			trans	66.6	142.6	139.9	57	0	0	0	0	119.2
31	T	32.7	Very low	32	Very low	115 Å²	115	115.4 Å²	115.4	71%	0.706	74%	0.74	S	S	*	*			cis	-164.4	164.2	-2.3	9.7	0	0	0	0	110
32	S	32.4	Very low	31.5	Very low	101 Å²	101	114.6 Å²	114.6	71%	0.706	73%	0.733	S	S	*	*			trans	65.5	148.4	147.3	65.2	0	0	0	0	118.9
33	T	33.6	Very low	31.3	Very low	113 Å²	113	114.8 Å²	114.8	69%	0.693	73%	0.729	S	S	*	*			cis	-168	157.7	-5	14.3	0	0	0	0	110.2
34	T	33.6	Very low	30.9	Very low	117 Å²	117	114.1 Å²	114.1	72%	0.718	73%	0.725	S	S	*	*			trans	61.8	149.5	146.9	56.8	0	0	0	0	119.7
35	T	33.1	Very low	30.6	Very low	115 Å²	115	114.5 Å²	114.5	71%	0.706	73%	0.727	S	S	*	*			cis	-167	160.6	-4.4	16.5	0	0	0	0	110.6
36	V	34.2	Very low	30.3	Very low	122 Å²	122	113.6 Å²	113.6	74%	0.739	73%	0.727	S	S	*	*			trans	58.1	109.5	146.4	169.9	0	0	0	0	116.7
37	A	32.5	Very low	30.3	Very low	84 Å²	84	112.7 Å²	112.7	69%	0.694	73%	0.726	S	S	*	*				67	147.4	68.6	0	0	0	0	0	113.3
38	T	30.4	Very low	29.9	Very low	119 Å²	119	111.5 Å²	111.5	73%	0.73	72%	0.722	S	S	*	*			cis	-153.8	174.2	15.7	-23.1	0	0	0	0	111.2
39	T	29.4	Very low	29.8	Very low	113 Å²	113	114.9 Å²	114.9	69%	0.693	73%	0.732	S	S	*	*			trans	-9.3	145.6	150.9	52.1	0	0	0	0	117.7
40	T	28.5	Very low	29.5	Very low	118 Å²	118	113.5 Å²	113.5	72%	0.724	73%	0.727	S	S	*	*			cis	-169.7	-173.6	21.8	7.6	0	0	0	0	108.1
41	T	28.7	Very low	29.4	Very low	106 Å²	106	116 Å²	116	65%	0.65	74%	0.736	S	S	*	*			cis	-166	151	23.6	-11.1	0	0	0	0	111.6
42	T	26.8	Very low	28.9	Very low	118 Å²	118	113.8 Å²	113.8	72%	0.724	72%	0.724	S	S	*	*			trans	62.6	158.4	145.7	51.3	0	0	0	0	124.4
43	T	27.3	Very low	28.6	Very low	118 Å²	118	117.9 Å²	117.9	72%	0.724	73%	0.726	S	S	*	*			trans	74.5	84.6	151.4	39.1	0	0	0	0	121.2
44	S	25.4	Very low	28.2	Very low	107 Å²	107	121 Å²	121	75%	0.748	73%	0.726	S	S	*	*				83.9	173.8	115.2	83.2	0	0	0	0	120.3
45	S	28.1	Very low	27.8	Very low	107 Å²	107	120.3 Å²	120.3	75%	0.748	73%	0.726	S	S	*	*			trans	74.1	116.1	173.9	74.9	0	0	0	0	117.8
46	S	24.5	Very low	27.5	Very low	117 Å²	117	123 Å²	123	82%	0.818	73%	0.728	S	S	*	*			trans	-36.9	140.5	155.6	49.7	0	0	0	0	116
47	S	28.3	Very low	27	Very low	110 Å²	110	123.3 Å²	123.3	77%	0.769	73%	0.725	S	S	*	*			trans	-150.2	131.7	133.5	47.2	0	0	0	0	111.8
48	S	23.8	Very low	26.7	Very low	108 Å²	108	125 Å²	125	76%	0.755	72%	0.723	S	S	*	*			trans	-83.5	124.4	163.8	50.6	0	0	0	0	108.8
49	L	29.8	Very low	26.5	Very low	165 Å²	165	128 Å²	128	86%	0.864	73%	0.725	S	S	*	*			trans	-104	79.6	165.8	-90.2	166.8	0	0	0	110.4	L51	L49-L51 PolarHBondContact O-N 2.69Å
50	S	23.9	Very low	26.2	Very low	88 Å²	88	126.9 Å²	126.9	62%	0.615	72%	0.723	S	S	*	*			trans	-70.5	118.8	160.9	51.6	0	0	0	0	109.5	S52	S50-S52 PolarHBondContact O-N 2.8Å; S50-S52 VanDerWaalsContact O-N 3.12Å
51	L	29.7	Very low	26	Very low	176 Å²	176	128.4 Å²	128.4	92%	0.921	73%	0.725	S	S	*	*			trans	-82.6	78.9	159.3	-127.6	74.7	0	0	0	109.3	L49	L49-L51 PolarHBondContact O-N 2.69Å
52	S	23.5	Very low	25.8	Very low	67 Å²	67	127.9 Å²	127.9	47%	0.469	72%	0.719	S	S	.	*			trans	-63.1	148.5	155.4	52.7	0	0	0	0	109.6	S50	S50-S52 PolarHBondContact O-N 2.8Å; S50-S52 VanDerWaalsContact O-N 3.12Å
53	Y	25.5	Very low	25.8	Very low	187 Å²	187	131.6 Å²	131.6	73%	0.733	72%	0.721	S	S	*	*				-179.8	163.3	110.1	-100.2	-61.4	0	0	0	114.2
54	Y	26	Very low	25.6	Very low	179 Å²	179	130.9 Å²	130.9	70%	0.702	72%	0.717	S	S	*	*			trans	27.7	115.7	169.2	-61.7	-72.7	0	0	0	119.2
55	S	23.4	Very low	25.6	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	72%	0.723	S	S	*	*			cis	72.1	153.2	44.1	-166.5	0	0	0	0	114.6
56	K	27.3	Very low	25.4	Very low	171 Å²	171	136.2 Å²	136.2	74%	0.743	72%	0.72	S	S	*	*			trans	76.5	145.8	-171.5	-55.8	176.7	-177.4	173.5	0	114.1
57	N	24.9	Very low	25.4	Very low	128 Å²	128	136 Å²	136	68%	0.684	71%	0.709	S	S	*	*			cis	-168.3	175.4	-22.3	-110.4	-8.3	0	0	0	108.5
58	N	26.3	Very low	25.5	Very low	119 Å²	119	138.8 Å²	138.8	64%	0.636	71%	0.71	S	S	*	*			trans	73.5	129.8	156	-72.4	-24.7	0	0	0	115.1
59	K	25.1	Very low	25.5	Very low	182 Å²	182	141 Å²	141	79%	0.791	71%	0.706	S	S	*	*				64.6	139.5	74.4	-63.4	178.8	-167.3	178.9	0	112.5
60	S	22.9	Very low	25.3	Very low	91 Å²	91	139 Å²	139	64%	0.636	70%	0.696	S	S	*	*			cis	-178.7	162.9	-11.3	48.5	0	0	0	0	109.7
61	L	24.3	Very low	25.4	Very low	149 Å²	149	138 Å²	138	78%	0.78	69%	0.687	S	S	*	*			trans	69.2	177.8	151.9	-125.1	66.6	0	0	0	115.8
62	D	25.4	Very low	25.2	Very low	96 Å²	96	139.9 Å²	139.9	51%	0.513	68%	0.683	S	S	.	*			trans	65.8	134.2	150.3	-67.1	-0.8	0	0	0	120.1
63	Y	26.4	Very low	25.3	Very low	196 Å²	196	141.2 Å²	141.2	77%	0.769	69%	0.685	S	S	*	*			cis	-130.3	140.1	0.6	-101	-68	0	0	0	114.9
64	T	22.8	Very low	25.3	Very low	103 Å²	103	137.7 Å²	137.7	63%	0.632	68%	0.683	S	S	*	*			trans	-45.8	143.4	153.9	-27	0	0	0	0	114.1
65	L	26.5	Very low	25.3	Very low	167 Å²	167	134 Å²	134	87%	0.874	68%	0.68	S	S	*	*			trans	175.9	114.3	136.3	-93.4	153.3	0	0	0	107.4
66	K	23.8	Very low	25.3	Very low	158 Å²	158	138.8 Å²	138.8	69%	0.687	68%	0.683	S	S	*	*			cis	82.5	110.8	31.1	-164.4	-174.6	-178.9	-176.5	0	113.6
67	N	24.3	Very low	25.2	Very low	112 Å²	112	136.3 Å²	136.3	60%	0.599	68%	0.678	S	S	*	*			trans	63.6	130.6	170.8	-56.3	0.7	0	0	0	114.7	F69	N67-F69 HydrophobicContact CB-CD2 4.49Å
68	H	29.5	Very low	25.1	Very low	170 Å²	170	136.1 Å²	136.1	79%	0.787	68%	0.677	S	S	*	*				-135.2	144	61.9	-93.1	-103.4	0	0	0	111.8
69	F	24.5	Very low	25.1	Very low	154 Å²	154	136 Å²	136	68%	0.675	68%	0.681	S	S	*	*				53.4	128.4	77.3	-79	-100.6	0	0	0	113.1	N67	N67-F69 HydrophobicContact CB-CD2 4.49Å
70	N	25.5	Very low	25.1	Very low	122 Å²	122	133.8 Å²	133.8	65%	0.652	68%	0.678	S	S	*	*			cis	-163.3	-162.4	-7	-154	10.4	0	0	0	110.8
71	T	25.8	Very low	25.1	Very low	69 Å²	69	136.3 Å²	136.3	42%	0.423	68%	0.684	S	S	.	*			trans	-6.3	140.9	145.4	54	0	0	0	0	115.6
72	Y	26.3	Very low	25.1	Very low	214 Å²	214	136.3 Å²	136.3	84%	0.839	69%	0.691	S	S	*	*				-141.4	153.2	55.5	-88.3	-100.8	0	0	0	110.2
73	N	25.3	Very low	25	Very low	95 Å²	95	137.8 Å²	137.8	51%	0.508	70%	0.703	S	S	.	*			cis	159	153.9	-9.9	-117.4	18.3	0	0	0	103.5
74	T	25.7	Very low	24.9	Very low	114 Å²	114	137.8 Å²	137.8	70%	0.699	70%	0.703	S	S	*	*			trans	56.9	146.3	142.9	62.4	0	0	0	0	120.9
75	T	24.5	Very low	24.9	Very low	101 Å²	101	142.4 Å²	142.4	62%	0.62	71%	0.71	S	S	*	*			cis	-172.8	160.3	-8.6	29.2	0	0	0	0	106.6
76	Y	24.2	Very low	24.8	Very low	203 Å²	203	142.2 Å²	142.2	80%	0.796	71%	0.705	S	S	*	*			trans	42.1	141.1	130.6	-62.5	-136.8	0	0	0	118.3
77	N	24.9	Very low	24.8	Very low	120 Å²	120	140 Å²	140	64%	0.642	70%	0.704	S	S	*	*			cis	-164.6	174.4	29.5	-135.4	-2.3	0	0	0	112.5
78	N	24	Very low	24.9	Very low	124 Å²	124	140.6 Å²	140.6	66%	0.663	71%	0.713	S	S	*	*			trans	-21.3	148.1	147.3	-41.2	-25.9	0	0	0	114
79	T	25.3	Very low	24.6	Very low	115 Å²	115	140 Å²	140	71%	0.706	71%	0.71	S	S	*	*				-171	150.9	65.5	37.8	0	0	0	0	114.4
80	N	24.6	Very low	24.6	Very low	136 Å²	136	140.9 Å²	140.9	73%	0.727	71%	0.71	S	S	*	*			trans	69.4	161.2	143.3	-61.7	9.6	0	0	0	121.4
81	D	23.5	Very low	24.6	Very low	144 Å²	144	142.7 Å²	142.7	77%	0.77	71%	0.712	S	S	*	*			trans	58.2	110.3	163.4	-52.7	-21.3	0	0	0	119.7
82	T	24	Very low	24.5	Very low	150 Å²	150	148.8 Å²	148.8	92%	0.92	73%	0.733	S	S	*	*				-166.3	111	115	12.6	0	0	0	0	111.6
83	T	24.3	Very low	24.5	Very low	126 Å²	126	146.9 Å²	146.9	77%	0.773	73%	0.729	S	S	*	*			trans	-90.4	137.5	163.9	31.4	0	0	0	0	110.4
84	Y	22.9	Very low	24.6	Very low	196 Å²	196	148.2 Å²	148.2	77%	0.769	74%	0.741	S	S	*	*			trans	70	162.5	151.7	-91.6	-103.8	0	0	0	120.9
85	Y	22.7	Very low	24.6	Very low	200 Å²	200	152.5 Å²	152.5	78%	0.784	75%	0.75	S	S	*	*			trans	71.3	95.6	165.2	-60.3	-63.7	0	0	0	121.7
86	H	25.3	Very low	24.6	Very low	163 Å²	163	154.3 Å²	154.3	76%	0.755	76%	0.755	S	S	*	*				41.6	123.5	102.7	-121.1	-86.8	0	0	0	120.3
87	T	24.5	Very low	24.6	Very low	111 Å²	111	152.8 Å²	152.8	68%	0.681	76%	0.755	S	S	*	*			trans	74	141.2	149.6	12.3	0	0	0	0	121.6
88	T	25.1	Very low	24.8	Very low	126 Å²	126	152.4 Å²	152.4	77%	0.773	76%	0.762	S	S	*	*			trans	68.7	119.4	154.4	41	0	0	0	0	123.3
89	E	23.1	Very low	25	Very low	157 Å²	157	155.7 Å²	155.7	73%	0.734	77%	0.771	S	S	*	*			trans	82.5	130	138.2	-67.8	-150.7	141.6	0	0	126.2
90	Y	25.2	Very low	25.2	Very low	172 Å²	172	155.6 Å²	155.6	68%	0.675	77%	0.77	S	S	*	*			trans	76.1	124.5	140.5	-84.5	-52.2	0	0	0	126.8
91	K	25.6	Very low	25.3	Very low	161 Å²	161	157.6 Å²	157.6	70%	0.7	77%	0.772	S	S	*	*			trans	82.3	105.4	136.4	-88.5	152.3	-174.5	162.6	0	122.2
92	F	24.5	Very low	25.4	Very low	197 Å²	197	159.3 Å²	159.3	86%	0.864	78%	0.778	S	S	*	*				66.6	119.8	124.5	-99.6	-91.6	0	0	0	122.1
93	K	24.8	Very low	25.4	Very low	173 Å²	173	160.4 Å²	160.4	75%	0.752	77%	0.766	S	S	*	*				130.1	105.1	111.5	-164.4	178.3	-177.4	178.8	0	117.6
94	T	27.2	Very low	25.5	Very low	124 Å²	124	162.6 Å²	162.6	76%	0.761	77%	0.768	S	S	*	*			trans	60.2	150	156.1	63.5	0	0	0	0	117.9
95	K	26	Very low	25.6	Very low	204 Å²	204	161.3 Å²	161.3	89%	0.887	77%	0.772	S	S	*	*			cis	-163.9	-176.8	44.8	-150.9	174.7	-178	-178.4	0	112.3
96	L	25.1	Very low	25.7	Very low	139 Å²	139	160.3 Å²	160.3	73%	0.728	77%	0.772	S	S	*	*			trans	-71	160.9	179.1	-109.5	66.2	0	0	0	115.3
97	E	24	Very low	25.7	Very low	171 Å²	171	158.3 Å²	158.3	80%	0.799	77%	0.767	S	S	*	*			trans	60.2	104.6	147.4	-68.5	174.6	170.8	0	0	121
98	S	28.2	Very low	25.8	Very low	112 Å²	112	160.3 Å²	160.3	78%	0.783	77%	0.773	S	S	*	*			trans	178.7	150.7	148.2	30.7	0	0	0	0	110.5
99	F	28.9	Very low	25.8	Very low	192 Å²	192	161.1 Å²	161.1	84%	0.842	77%	0.772	S	S	*	*			cis	-149.8	147.3	-15.5	-130.8	-65.9	0	0	0	110.7
100	T	28.9	Very low	26	Very low	113 Å²	113	160.7 Å²	160.7	69%	0.693	77%	0.774	S	S	*	*			trans	-78.7	126.9	177	-44	0	0	0	0	113.2
101	K	26.8	Very low	26.1	Very low	178 Å²	178	161.7 Å²	161.7	77%	0.774	78%	0.778	S	S	*	*			trans	-172.6	154.9	156.8	-98.4	139.9	-172.7	176.5	0	108.8
102	M	25.6	Very low	26	Very low	180 Å²	180	161.2 Å²	161.2	89%	0.887	78%	0.779	S	S	*	*			cis	-111.3	167.3	8.2	-72.6	-173.1	68.1	0	0	114.4
103	Y	25.2	Very low	26.2	Very low	174 Å²	174	160.2 Å²	160.2	68%	0.682	77%	0.774	S	S	*	*			trans	-95.8	169.6	-179.4	-87.7	-119.4	0	0	0	112.5
104	Q	24.9	Very low	26.1	Very low	172 Å²	172	157.3 Å²	157.3	80%	0.804	77%	0.767	S	S	*	*			trans	32.1	110	142.1	-64.3	164.8	-25.7	0	0	118.3
105	I	26.1	Very low	26.1	Very low	168 Å²	168	159.6 Å²	159.6	86%	0.862	77%	0.773	S	S	*	*			trans	-123.5	125.9	142.2	-62.5	-178.7	0	0	0	108
106	K	24.5	Very low	26	Very low	179 Å²	179	158.7 Å²	158.7	78%	0.778	77%	0.769	S	S	*	*			trans	-108.6	133.7	166.9	-121.1	-168.8	174.4	-163.1	0	106.6
107	D	25.1	Very low	26	Very low	122 Å²	122	158 Å²	158	65%	0.652	77%	0.765	S	S	*	*	S	Bend	trans	62.3	174.2	157.2	-49.2	-45.5	0	0	0	117.3
108	D	26.2	Very low	26	Very low	152 Å²	152	156.2 Å²	156.2	81%	0.813	77%	0.768	S	S	*	*			trans	56.4	93.1	170.1	-59.4	-17.9	0	0	0	122
109	I	26.5	Very low	25.9	Very low	143 Å²	143	158.8 Å²	158.8	73%	0.733	77%	0.765	S	S	*	*			trans	-5.6	126.1	136.4	-55.9	160.8	0	0	0	116.1
110	N	26.8	Very low	25.7	Very low	148 Å²	148	157.5 Å²	157.5	79%	0.791	77%	0.767	S	S	*	*				-166.4	163.4	124.3	-107.9	-45.2	0	0	0	117.3
111	Y	26.2	Very low	25.4	Very low	194 Å²	194	159.1 Å²	159.1	76%	0.761	77%	0.769	S	S	*	*			trans	-68.3	170.9	168.4	-70.3	-111	0	0	0	111.1
112	E	25.1	Very low	25.4	Very low	151 Å²	151	156 Å²	156	71%	0.706	77%	0.765	S	S	*	*			cis	-154.6	-152.2	5.8	-146.6	167.9	-168.9	0	0	110.5
113	F	27.1	Very low	25.3	Very low	176 Å²	176	153.8 Å²	153.8	77%	0.772	76%	0.757	S	S	*	*			trans	77.5	140.4	167.2	-66.9	-101.8	0	0	0	118
114	N	23.7	Very low	25.3	Very low	111 Å²	111	149.6 Å²	149.6	59%	0.594	75%	0.753	S	S	*	*			cis	-168.3	136.4	-33.8	-129.4	-34.8	0	0	0	109.8
115	I	26.2	Very low	25.4	Very low	172 Å²	172	150.2 Å²	150.2	88%	0.882	75%	0.749	S	S	*	*			trans	-178.9	154.1	149.7	-97.4	153.2	0	0	0	108.2
116	K	24.7	Very low	25.5	Very low	186 Å²	186	150.8 Å²	150.8	81%	0.809	74%	0.742	S	S	*	*			trans	-105.5	136	-150.8	-64.4	173.2	-179.1	172.5	0	115.1
117	L	26.2	Very low	25.6	Very low	123 Å²	123	148.3 Å²	148.3	64%	0.644	74%	0.737	S	S	*	*				30.4	143.2	128.5	-111.4	71.5	0	0	0	120.4	K119	L117-K119 HydrophobicContact CD1-CG 4.26Å; L117-K119 HydrophobicContact CD2-CB 4.41Å; L117-K119 HydrophobicContact CD2-CD 3.96Å; L117-K119 HydrophobicContact CD2-CG 3.82Å; L117-K119 HydrophobicContact CG-CG 3.95Å
118	P	23.9	Very low	25.9	Very low	134 Å²	134	148.4 Å²	148.4	87%	0.87	74%	0.738	S	S	*	*				-119.1	160.6	76.6	-5.1	25.9	0	0	0	116.8
119	K	25	Very low	25.9	Very low	166 Å²	166	149.1 Å²	149.1	72%	0.722	73%	0.734	S	S	*	*			trans	-117.2	136.3	166.9	-66.8	168.2	-175.3	172.7	0	109.1	L117	L117-K119 HydrophobicContact CD1-CG 4.26Å; L117-K119 HydrophobicContact CD2-CB 4.41Å; L117-K119 HydrophobicContact CD2-CD 3.96Å; L117-K119 HydrophobicContact CD2-CG 3.82Å; L117-K119 HydrophobicContact CG-CG 3.95Å
120	L	24.5	Very low	25.9	Very low	166 Å²	166	149.9 Å²	149.9	87%	0.869	73%	0.734	S	S	*	*			trans	-160.1	143.4	153.9	-79.4	-178.6	0	0	0	108.1
121	I	24.2	Very low	26.1	Very low	147 Å²	147	148.7 Å²	148.7	75%	0.754	73%	0.732	S	S	*	*			cis	-148.1	176.8	-35	-140.7	176.7	0	0	0	109.1
122	T	25	Very low	26	Very low	111 Å²	111	148.6 Å²	148.6	68%	0.681	74%	0.736	S	S	*	*			trans	-64.8	172.3	178.5	50.6	0	0	0	0	112.7
123	N	24.8	Very low	26.2	Very low	135 Å²	135	148.3 Å²	148.3	72%	0.722	74%	0.739	S	S	*	*			cis	-173.3	157.9	38.9	-149.9	-3.9	0	0	0	115.7
124	S	25.1	Very low	26.2	Very low	85 Å²	85	148.8 Å²	148.8	59%	0.594	74%	0.741	S	S	*	*			trans	66.2	158.4	149.3	68.9	0	0	0	0	118.8
125	Y	26.8	Very low	26.2	Very low	186 Å²	186	150.8 Å²	150.8	73%	0.729	75%	0.751	S	S	*	*			cis	-137.7	137.4	20.1	-110.8	-98.2	0	0	0	114.1
126	Y	28.7	Very low	26.2	Very low	179 Å²	179	149.3 Å²	149.3	70%	0.702	75%	0.745	S	S	*	*			trans	55	132.4	145	-78.9	-127.1	0	0	0	121.3
127	N	26.6	Very low	26.5	Very low	127 Å²	127	148.9 Å²	148.9	68%	0.679	75%	0.751	S	S	*	*			cis	87.8	105.5	44.6	-80.6	-36.4	0	0	0	116.1
128	N	31	Very low	26.5	Very low	124 Å²	124	151.2 Å²	151.2	66%	0.663	76%	0.755	S	S	*	*				-174.3	147.6	97.4	-104.8	-56.4	0	0	0	116.9
129	K	26.3	Very low	26.5	Very low	168 Å²	168	152.5 Å²	152.5	73%	0.73	75%	0.75	S	S	*	*			trans	4.6	152.5	137.9	-65.1	171.2	-171.3	165.8	0	118.9
130	Q	26.9	Very low	26.8	Very low	158 Å²	158	152 Å²	152	74%	0.738	76%	0.755	S	S	*	*			cis	-170	177	25.2	-134.3	159.8	7.1	0	0	113.8
131	T	29.6	Very low	26.9	Very low	123 Å²	123	152.6 Å²	152.6	76%	0.755	75%	0.751	S	S	*	*			trans	59.1	124.3	162	46.9	0	0	0	0	118.7
132	K	25.2	Very low	27	Very low	193 Å²	193	155.9 Å²	155.9	84%	0.839	76%	0.76	S	S	*	*			cis	61.4	112.1	46.6	-74.5	-169.4	173.1	-178.4	0	115.9
133	N	28.2	Very low	27	Very low	144 Å²	144	161 Å²	161	77%	0.77	77%	0.768	S	S	*	*				-165.4	156.4	124.4	-113.1	-19.6	0	0	0	116.3
134	F	27.9	Very low	27.2	Very low	186 Å²	186	164 Å²	164	82%	0.816	78%	0.775	S	S	*	*			trans	52.8	91.4	166.4	-66.3	-66.6	0	0	0	122.8
135	L	24	Very low	27.2	Very low	153 Å²	153	169.5 Å²	169.5	80%	0.801	79%	0.788	S	S	*	*			trans	-86.6	133.7	137.2	-107.8	159	0	0	0	109.4
136	N	25	Very low	27.3	Very low	142 Å²	142	172.9 Å²	172.9	76%	0.759	80%	0.8	S	S	*	*			trans	148.1	125.9	143	-84.7	-42.9	0	0	0	113.3
137	L	31.8	Very low	27.1	Very low	177 Å²	177	173.4 Å²	173.4	93%	0.927	81%	0.805	S	S	*	*				-169.7	155.8	108.2	-101.3	163.2	0	0	0	110.8
138	K	26	Very low	27	Very low	171 Å²	171	172.9 Å²	172.9	74%	0.743	81%	0.807	S	S	*	*			trans	-103.6	155.8	-175	-75	179.7	178	174.9	0	111.7
139	Q	25.2	Very low	26.8	Very low	161 Å²	161	174.7 Å²	174.7	75%	0.752	82%	0.816	S	S	*	*			trans	40.7	119.6	141	-63.6	164.9	-36.6	0	0	118.4
140	N	30.3	Very low	26.8	Very low	157 Å²	157	173.4 Å²	173.4	84%	0.84	82%	0.817	S	S	*	*				-162.7	167.8	109.1	-110.3	-56	0	0	0	115.1
141	K	26.2	Very low	26.7	Very low	178 Å²	178	175.8 Å²	175.8	77%	0.774	82%	0.821	S	S	*	*			trans	-82.7	148.9	-178.1	-51.8	158.4	-176.7	169.5	0	110.7
142	F	27.2	Very low	26.7	Very low	215 Å²	215	178.1 Å²	178.1	94%	0.943	83%	0.827	S	S	*	*			trans	-155.4	139.6	136.1	-105.6	-68.9	0	0	0	112.4
143	Y	24.4	Very low	26.8	Very low	219 Å²	219	174.8 Å²	174.8	86%	0.859	82%	0.818	S	S	*	*			trans	-113.6	135.8	175.5	-101.9	-97.8	0	0	0	108.9
144	K	29.6	Very low	26.7	Very low	198 Å²	198	174.8 Å²	174.8	86%	0.861	82%	0.818	S	S	*	*				176.1	132.5	124.3	-99.5	165.8	-177.7	176.1	0	115
145	K	24.4	Very low	26.6	Very low	200 Å²	200	172.2 Å²	172.2	87%	0.87	82%	0.818	S	S	*	*			trans	6	127.7	147.1	-59.4	178	177	-178.5	0	118.8
146	R	29.2	Very low	26.9	Very low	258 Å²	258	171.6 Å²	171.6	97%	0.974	81%	0.814	S	S	*	*				-147.6	164.5	115	-109.2	169.5	-175.9	174.6	1.1	110.2
147	K	24.8	Very low	27	Very low	189 Å²	189	176.2 Å²	176.2	82%	0.822	82%	0.822	S	S	*	*			trans	-109.8	155.4	-167.4	-108.5	-171	175.8	-170.8	0	111.3
148	T	23.8	Very low	26.8	Very low	116 Å²	116	176.5 Å²	176.5	71%	0.712	82%	0.816	S	S	*	*			trans	51	116.7	149.9	54.5	0	0	0	0	119.7
149	L	26.3	Very low	26.9	Very low	163 Å²	163	173.6 Å²	173.6	85%	0.853	82%	0.815	S	S	*	*				-151.1	166.2	115.8	-138.1	68.8	0	0	0	112.4
150	N	27.6	Very low	27	Very low	140 Å²	140	173.1 Å²	173.1	75%	0.749	82%	0.816	S	S	*	*			trans	-71.9	165.5	-154.3	-57.5	-29.2	0	0	0	118
151	Y	24.2	Very low	26.9	Very low	209 Å²	209	175.5 Å²	175.5	82%	0.82	81%	0.814	S	S	*	*			trans	-26	142.4	151.2	-79.3	-105.6	0	0	0	116.5
152	I	29.6	Very low	26.8	Very low	172 Å²	172	174 Å²	174	88%	0.882	82%	0.815	S	S	*	*			trans	-156.1	161.1	135.3	-101.8	153	0	0	0	107.9
153	N	27.8	Very low	26.9	Very low	123 Å²	123	170.7 Å²	170.7	66%	0.658	81%	0.807	S	S	*	*			trans	-100.2	156.6	-152.4	-55.7	-22.4	0	0	0	116.5
154	D	25.6	Very low	27	Very low	143 Å²	143	169.7 Å²	169.7	77%	0.765	81%	0.81	S	S	*	*			trans	62.5	153	140.6	-75.4	-44.8	0	0	0	123.1
155	T	26.6	Very low	27	Very low	132 Å²	132	169.2 Å²	169.2	81%	0.81	81%	0.811	S	S	*	*			trans	70	149.1	-179.2	76	0	0	0	0	114
156	I	28.3	Very low	27.1	Very low	141 Å²	141	167 Å²	167	72%	0.723	81%	0.809	S	S	*	*			cis	-135.1	139.1	19.7	-63.3	163	0	0	0	110.6
157	Y	27.7	Very low	27.2	Very low	239 Å²	239	162.1 Å²	162.1	94%	0.937	80%	0.8	S	S	*	*			trans	-157.4	100.5	137.5	-109.2	-71.8	0	0	0	109.2
158	K	28.1	Very low	27.4	Very low	183 Å²	183	159.6 Å²	159.6	80%	0.796	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-100.7	150.7	165.9	-82.5	-175.8	174.5	-179.3	0	108.7
159	P	27	Very low	27.7	Very low	109 Å²	109	160.5 Å²	160.5	71%	0.708	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-65.4	146	164.2	30.4	-34.3	0	0	0	110	Y161	P159-Y161 PolarHBondContact O-N 3.24Å
160	I	27.8	Very low	27.8	Very low	151 Å²	151	160.1 Å²	160.1	77%	0.774	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-77.4	119.3	-179.6	-62.5	173.1	0	0	0	109.3	N162	I160-N162 WeakPolarHBondContact CG2-OD1 3.46Å
161	Y	28	Very low	27.8	Very low	208 Å²	208	163.6 Å²	163.6	82%	0.816	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-92.8	129.1	157.6	-92	-99.2	0	0	0	108	P159 N163	P159-Y161 PolarHBondContact O-N 3.24Å; Y161-N163 PolarHBondContact O-N 2.87Å
162	N	25	Very low	28.1	Very low	146 Å²	146	159.7 Å²	159.7	78%	0.781	78%	0.778	S	S	*	*			trans	-84.7	105	169.5	-74	1.8	0	0	0	109.3	I160	I160-N162 WeakPolarHBondContact CG2-OD1 3.46Å
163	N	28	Very low	28.1	Very low	146 Å²	146	157.7 Å²	157.7	78%	0.781	77%	0.769	S	S	*	*			trans	-133.2	111.8	158.8	-91.4	-15.3	0	0	0	106.6	Y161	Y161-N163 PolarHBondContact O-N 2.87Å
164	E	27	Very low	28.2	Very low	198 Å²	198	160.6 Å²	160.6	93%	0.925	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-81.6	118.1	172	-66.9	-174.5	137.3	0	0	108.8
165	E	30.4	Very low	28.3	Very low	188 Å²	188	160.7 Å²	160.7	88%	0.879	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-77.9	136.1	174.9	-68.8	-170.5	132.5	0	0	111
166	N	26.6	Very low	28.4	Very low	153 Å²	153	157.8 Å²	157.8	82%	0.818	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-57.3	136.5	163.4	-60.3	-88	0	0	0	109.5
167	I	30.2	Very low	28.3	Very low	156 Å²	156	158.7 Å²	158.7	80%	0.8	76%	0.76	S	S	*	*			trans	-174.5	120.2	133.3	-100.7	155.5	0	0	0	113.8
168	I	28.9	Very low	28.4	Very low	135 Å²	135	156.7 Å²	156.7	69%	0.692	75%	0.752	S	S	*	*			trans	76.5	107.1	142.7	-69	-177.8	0	0	0	121.3
169	Q	30.3	Very low	28.2	Very low	136 Å²	136	159 Å²	159	64%	0.636	76%	0.755	S	S	*	*			trans	86	105.7	136.5	-74	-177.8	60.4	0	0	123.6
170	K	28.6	Very low	28.2	Very low	154 Å²	154	159.5 Å²	159.5	67%	0.67	76%	0.761	S	S	*	*				87.3	117	123.1	-72.2	170.9	-178.9	160.7	0	120.2
171	R	28.5	Very low	28.6	Very low	214 Å²	214	157.6 Å²	157.6	81%	0.808	76%	0.759	S	S	*	*			trans	76.2	136.2	156.4	-58.7	171.8	176.9	133.7	-6.3	115.5
172	N	29.7	Very low	28.5	Very low	126 Å²	126	154.6 Å²	154.6	67%	0.674	76%	0.756	S	S	*	*			cis	-158.1	157.4	-7.8	-112	-3.4	0	0	0	110.7
173	N	30.5	Very low	28.5	Very low	130 Å²	130	153 Å²	153	70%	0.695	75%	0.752	S	S	*	*			trans	65.9	112.7	158	-66.3	-20.3	0	0	0	120.6
174	K	30.3	Very low	28.3	Very low	184 Å²	184	153.5 Å²	153.5	80%	0.8	76%	0.755	S	S	*	*			trans	64.8	144	130.6	-54.7	-164.5	177.2	-177.6	0	119.4
175	L	28	Very low	28.3	Very low	145 Å²	145	150.1 Å²	150.1	76%	0.759	75%	0.748	S	S	*	*			cis	-158.4	114	-20.1	-133.9	70.1	0	0	0	102.6
176	S	27.2	Very low	27.9	Very low	72 Å²	72	146.8 Å²	146.8	50%	0.503	74%	0.741	S	S	.	*				83.4	142.9	90.1	76.4	0	0	0	0	116.1
177	F	27	Very low	27.9	Very low	160 Å²	160	145.2 Å²	145.2	70%	0.702	74%	0.737	S	S	*	*			trans	68.9	152.6	152.7	-60.9	-47	0	0	0	118.2
178	Y	29.7	Very low	27.6	Very low	197 Å²	197	142 Å²	142	77%	0.773	73%	0.728	S	S	*	*			cis	-145.6	164.5	-6.7	-118.6	-48.6	0	0	0	110.3
179	R	24.6	Very low	27.5	Very low	230 Å²	230	145.4 Å²	145.4	87%	0.868	73%	0.734	S	S	*	*			trans	-66	151.9	159.2	-70.1	174.5	166.6	-176.1	-4.5	110
180	S	26.3	Very low	27.3	Very low	120 Å²	120	144.4 Å²	144.4	84%	0.839	74%	0.737	S	S	*	*				-178.8	165.6	121.4	-81.1	0	0	0	0	112.6
181	P	35.4	Very low	27.2	Very low	111 Å²	111	141.3 Å²	141.3	72%	0.721	73%	0.731	S	S	*	*			trans	-116.8	-166.9	-173	26.3	-3.1	0	0	0	113.5
182	L	25.9	Very low	27.3	Very low	145 Å²	145	138.6 Å²	138.6	76%	0.759	73%	0.733	S	S	*	*			trans	104.4	133.2	165.3	-78.2	81.6	0	0	0	119.7
183	T	24.7	Very low	27.1	Very low	114 Å²	114	138.6 Å²	138.6	70%	0.699	73%	0.732	S	S	*	*			trans	57.2	124.3	141.1	56.8	0	0	0	0	124.2
184	N	25.1	Very low	27.2	Very low	155 Å²	155	139.5 Å²	139.5	83%	0.829	74%	0.743	S	S	*	*			trans	12.2	120	132.1	-53.1	5	0	0	0	120.4
185	T	26.9	Very low	26.9	Very low	128 Å²	128	136.2 Å²	136.2	79%	0.785	74%	0.738	S	S	*	*				-168.3	121.6	127.6	35.6	0	0	0	0	106.4
186	T	22.6	Very low	27	Very low	118 Å²	118	139.8 Å²	139.8	72%	0.724	74%	0.743	S	S	*	*				59.1	145.6	74.8	59.2	0	0	0	0	115.9
187	T	25.2	Very low	27	Very low	120 Å²	120	141.9 Å²	141.9	74%	0.736	75%	0.749	S	S	*	*			trans	62	109.5	-177.8	51.9	0	0	0	0	115.1
188	S	23.7	Very low	27	Very low	88 Å²	88	140 Å²	140	62%	0.615	75%	0.746	S	S	*	*				84.6	168.2	59.7	73.8	0	0	0	0	113.5
189	Y	27.7	Very low	26.9	Very low	207 Å²	207	136.5 Å²	136.5	81%	0.812	74%	0.741	S	S	*	*			trans	87.2	129.2	-170.7	-53.8	-62.5	0	0	0	115.1
190	T	26.7	Very low	27.1	Very low	114 Å²	114	131.9 Å²	131.9	70%	0.699	73%	0.733	S	S	*	*			cis	-155.8	160.2	-16.5	-8.8	0	0	0	0	112.2
191	T	26	Very low	27.1	Very low	89 Å²	89	133.4 Å²	133.4	55%	0.546	73%	0.73	S	S	.	*			trans	-3.2	136.9	156.8	51.9	0	0	0	0	121.1
192	D	30.3	Very low	26.7	Very low	158 Å²	158	132.6 Å²	132.6	85%	0.845	73%	0.728	S	S	*	*				-161.7	96.4	115.6	-92.4	-22.8	0	0	0	108.5
193	N	26.1	Very low	26.6	Very low	125 Å²	125	129.1 Å²	129.1	67%	0.668	72%	0.715	S	S	*	*				58	84.4	70.5	-72.7	-11.1	0	0	0	116.1
194	T	31.3	Very low	26.7	Very low	150 Å²	150	128.9 Å²	128.9	92%	0.92	71%	0.714	S	S	*	*			trans	-145.1	118.2	136	26.2	0	0	0	0	111.2
195	T	24.9	Very low	26.6	Very low	114 Å²	114	126.4 Å²	126.4	70%	0.699	70%	0.696	S	S	*	*			trans	-91.1	141.3	177.3	48.2	0	0	0	0	112.3
196	Y	28.9	Very low	26.5	Very low	220 Å²	220	128.9 Å²	128.9	86%	0.863	69%	0.692	S	S	*	*			trans	-158.3	117.2	140.7	-97.7	-82.4	0	0	0	106
197	N	27.7	Very low	26.6	Very low	117 Å²	117	130.6 Å²	130.6	63%	0.626	69%	0.689	S	S	*	*				52.9	132.3	75.3	-69.1	-4.6	0	0	0	112.7
198	N	28	Very low	26.7	Very low	120 Å²	120	137.2 Å²	137.2	64%	0.642	70%	0.701	S	S	*	*			cis	-163.4	165.7	0.8	-113.9	-12.8	0	0	0	110.5
199	N	27.7	Very low	26.8	Very low	123 Å²	123	138 Å²	138	66%	0.658	71%	0.707	S	S	*	*			trans	40.4	120.2	146.4	-51.8	-13.1	0	0	0	118.5
200	N	28.9	Very low	26.6	Very low	133 Å²	133	135.6 Å²	135.6	71%	0.711	71%	0.708	S	S	*	*				-169.9	148.1	62	-91.6	-52.4	0	0	0	113.4
201	I	26.4	Very low	26.7	Very low	152 Å²	152	140.8 Å²	140.8	78%	0.779	72%	0.716	S	S	*	*				20.8	130.6	114.1	-55.3	169.6	0	0	0	115.3
202	S	26.2	Very low	26.6	Very low	95 Å²	95	139.4 Å²	139.4	66%	0.664	72%	0.72	S	S	*	*			cis	-150	166.3	23.5	39.5	0	0	0	0	115.4
203	S	24.8	Very low	26.3	Very low	71 Å²	71	143.1 Å²	143.1	50%	0.497	72%	0.722	S	S	.	*			trans	-26.6	126.7	156.9	50.2	0	0	0	0	117.8	L907	S203-L907 WeakPolarHBondContact O-CD1 3.26Å
204	T	24.9	Very low	26.2	Very low	110 Å²	110	146.6 Å²	146.6	68%	0.675	73%	0.731	S	S	*	*			trans	-136.6	145.4	162.1	39.1	0	0	0	0	110.4	L907 K908	T204-L907 WeakPolarHBondContact O-CD2 3.48Å; T204-K908 WeakPolarHBondContact O-CE 3.44Å; T204-K908 PolarHBondContact O-NZ 3.23Å
205	F	25.1	Very low	26	Very low	102 Å²	102	148 Å²	148	45%	0.447	72%	0.724	S	S	.	*			trans	-57.3	-168.8	-150.8	-130.7	-80	0	0	0	119	E906 K908	F205-E906 HydrophobicContact CB-CB 3.92Å; F205-E906 HydrophobicContact CB-CG 3.82Å; F205-E906 HydrophobicContact CD1-CB 3.33Å; F205-E906 HydrophobicContact CD1-CG 2.3Å; F205-E906 WeakPolarHBondContact CD1-OE1 3.45Å; F205-E906 HydrophobicContact CD2-CB 2.76Å; F205-E906 HydrophobicContact CD2-CG 2.3Å; F205-E906 WeakPolarHBondContact CD2-OE1 3.49Å; F205-E906 WeakPolarHBondContact CD2-OE2 3.21Å; F205-E906 HydrophobicContact CE1-CB 3.84Å; F205-E906 HydrophobicContact CE1-CG 2.31Å; F205-E906 WeakPolarHBondContact CE1-OE1 3.3Å; F205-E906 HydrophobicContact CE2-CB 3.35Å; F205-E906 HydrophobicContact CE2-CG 2.3Å; F205-E906 WeakPolarHBondContact CE2-OE2 3.48Å; F205-E906 HydrophobicContact CG-CB 2.78Å; F205-E906 HydrophobicContact CG-CG 2.33Å; F205-E906 WeakPolarHBondContact CG-OE1 2.87Å; F205-E906 WeakPolarHBondContact CG-OE2 3.29Å; F205-E906 HydrophobicContact CZ-CB 3.86Å; F205-E906 HydrophobicContact CZ-CG 2.32Å; F205-E906 WeakPolarHBondContact CZ-OE1 3.34Å; F205-E906 WeakPolarHBondContact CZ-OE2 3.38Å; F205-K908 VanDerWaalsContact O-CE 3.3Å; F205-K908 WeakPolarHBondContact O-CE 3.32Å; F205-K908 PolarHBondContact O-NZ 2.95Å
206	Y	23.8	Very low	26	Very low	181 Å²	181	154.3 Å²	154.3	71%	0.71	74%	0.735	S	S	*	*			trans	-112.1	101.9	176.9	-124.2	-80.8	0	0	0	109
207	K	25	Very low	25.9	Very low	153 Å²	153	149.3 Å²	149.3	67%	0.665	72%	0.724	S	S	*	*			trans	-136	138.7	169.3	-78.2	-170.2	169.3	78.8	0	110.4	S209 E906	K207-S209 PolarHBondContact O-N 3Å; K207-E906 VanDerWaalsContact NZ-CD 3.3Å; K207-E906 IonicContact NZ-OE1 2.83Å; K207-E906 PolarHBondContact NZ-OE1 3.48Å; K207-E906 IonicContact NZ-OE2 3.7Å; K207-E906 PolarHBondContact NZ-OE2 3.14Å
208	R	25.9	Very low	26	Very low	259 Å²	259	153.3 Å²	153.3	98%	0.977	74%	0.736	S	S	*	*			trans	-63.7	116	168.4	-79.5	172.3	160.8	146.1	-8.1	108
209	S	25.8	Very low	26.1	Very low	105 Å²	105	153.3 Å²	153.3	73%	0.734	74%	0.736	S	S	*	*			trans	-111.8	140.8	175.1	51.8	0	0	0	0	111.5	K207	K207-S209 PolarHBondContact O-N 3Å
210	D	25.1	Very low	26.4	Very low	156 Å²	156	154.5 Å²	154.5	83%	0.834	74%	0.742	S	S	*	*			trans	-70.2	129.1	-170.1	-54.5	-91	0	0	0	113.7
211	Y	27.5	Very low	26.7	Very low	224 Å²	224	151.3 Å²	151.3	88%	0.878	74%	0.741	S	S	*	*			trans	-103	69.6	153	-92.3	-79	0	0	0	110.6
212	G	24.4	Very low	27	Very low	60 Å²	60	148.8 Å²	148.8	62%	0.619	73%	0.734	S	S	*	*			trans	-65.4	153.9	171.9	0	0	0	0	0	112.7
213	R	24.1	Very low	27.5	Very low	235 Å²	235	147.4 Å²	147.4	89%	0.887	72%	0.724	S	S	*	*			trans	70	42.3	154.2	-145	-176.3	-156.9	-178.6	8.1	117.7	K215	R213-K215 PolarHBondContact O-N 3.29Å
214	F	24.7	Very low	28.3	Very low	199 Å²	199	148.9 Å²	148.9	87%	0.873	73%	0.726	S	S	*	*			trans	-56.6	113.3	142.5	-94.2	-77.5	0	0	0	108.4	R216	F214-R216 PolarHBondContact O-N 3.47Å
215	K	25.9	Very low	29	Very low	178 Å²	178	147.9 Å²	147.9	77%	0.774	72%	0.724	S	S	*	*			trans	-58.9	137.4	176.9	-88.6	179.4	173.9	174.8	0	109	R213 N217	R213-K215 PolarHBondContact O-N 3.29Å; K215-N217 VanDerWaalsContact C-N 3.27Å; K215-N217 PolarHBondContact O-N 3.11Å
216	R	25.2	Very low	29.6	Very low	247 Å²	247	147.5 Å²	147.5	93%	0.932	73%	0.726	S	S	*	*			trans	-65.7	88.8	164.7	-59.6	176.5	-168	150.5	2.2	108.7	F214	F214-R216 PolarHBondContact O-N 3.47Å
217	N	26.9	Very low	30.4	Very low	115 Å²	115	143.1 Å²	143.1	62%	0.615	72%	0.718	S	S	*	*			trans	-61.5	143.1	157.2	-97.2	24.7	0	0	0	108.6	K215 D219	K215-N217 VanDerWaalsContact C-N 3.27Å; K215-N217 PolarHBondContact O-N 3.11Å; N217-D219 HydrophobicContact CB-CB 4.43Å; N217-D219 VanDerWaalsContact CB-OD2 3.26Å; N217-D219 WeakPolarHBondContact CB-OD2 3.43Å; N217-D219 PolarHBondContact ND2-OD2 2.94Å; N217-D219 PolarHBondContact O-N 3.44Å; N217-D219 VanDerWaalsContact O-N 3.13Å
218	K	29.4	Very low	30.7	Very low	202 Å²	202	140.1 Å²	140.1	88%	0.878	71%	0.714	S	S	*	*			trans	-88.5	43.3	179.9	-66.1	-178.4	177	179.8	0	110.5	N220	K218-N220 PolarHBondContact O-N 3.43Å
219	D	31.6	Very low	31.2	Very low	120 Å²	120	136.7 Å²	136.7	64%	0.642	71%	0.712	S	S	*	*			trans	-86.5	113.2	-168.6	-62.1	-9.1	0	0	0	107.9	N217 G221	N217-D219 HydrophobicContact CB-CB 4.43Å; N217-D219 VanDerWaalsContact CB-OD2 3.26Å; N217-D219 WeakPolarHBondContact CB-OD2 3.43Å; N217-D219 PolarHBondContact ND2-OD2 2.94Å; N217-D219 PolarHBondContact O-N 3.44Å; N217-D219 VanDerWaalsContact O-N 3.13Å; D219-G221 PolarHBondContact O-N 3.48Å
220	N	33.3	Very low	31.6	Very low	148 Å²	148	139.4 Å²	139.4	79%	0.791	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-55.8	134	176.5	-58.6	-76.2	0	0	0	108.6	K218	K218-N220 PolarHBondContact O-N 3.43Å
221	G	34.5	Very low	32	Very low	66 Å²	66	134.2 Å²	134.2	68%	0.68	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-54.2	138.5	169.8	0	0	0	0	0	109.5	D219 S223	D219-G221 PolarHBondContact O-N 3.48Å; G221-S223 PolarHBondContact O-N 2.97Å
222	P	32.3	Very low	32.2	Very low	98 Å²	98	128.5 Å²	128.5	64%	0.636	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-53.5	134.2	-166.5	17.3	-31	0	0	0	111.8	D226	P222-D226 WeakPolarHBondContact CA-OD2 3.43Å; P222-D226 HydrophobicContact CB-CB 3.9Å
223	S	36.6	Very low	32.7	Very low	66 Å²	66	132.1 Å²	132.1	46%	0.462	68%	0.675	S	S	.	*	P	Polyproline II helix	trans	-65.4	157.9	170.4	166.7	0	0	0	0	109.4	G221 S225 D226	G221-S223 PolarHBondContact O-N 2.97Å; S223-S225 WeakPolarHBondContact CB-OG 3.46Å; S223-S225 PolarHBondContact O-N 3.14Å; S223-S225 PolarHBondContact OG-N 3.4Å; S223-S225 PolarHBondContact OG-OG 3.47Å; S223-D226 WeakPolarHBondContact CB-OD2 3.46Å; S223-D226 PolarHBondContact N-OD2 2.87Å; S223-D226 WeakPolarHBondContact O-CB 3.44Å; S223-D226 PolarHBondContact O-N 3.17Å
224	L	42.7	Very low	33.3	Very low	102 Å²	102	128.1 Å²	128.1	53%	0.534	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.1	-9.3	171.9	-93.9	140.1	0	0	0	113.4	D226	L224-D226 VanDerWaalsContact C-N 3.33Å
225	S	39.8	Very low	33.9	Very low	90 Å²	90	123.8 Å²	123.8	63%	0.629	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.6	-19.4	167.4	46.7	0	0	0	0	114.6	S223	S223-S225 WeakPolarHBondContact CB-OG 3.46Å; S223-S225 PolarHBondContact O-N 3.14Å; S223-S225 PolarHBondContact OG-N 3.4Å; S223-S225 PolarHBondContact OG-OG 3.47Å
226	D	37.6	Very low	34.1	Very low	93 Å²	93	119.3 Å²	119.3	50%	0.497	65%	0.646	S	S	.	*	S	Bend	trans	-102.8	2.9	-161.7	-45.7	-19.6	0	0	0	112.2	P222 S223 L224	P222-D226 WeakPolarHBondContact CA-OD2 3.43Å; P222-D226 HydrophobicContact CB-CB 3.9Å; S223-D226 WeakPolarHBondContact CB-OD2 3.46Å; S223-D226 PolarHBondContact N-OD2 2.87Å; S223-D226 WeakPolarHBondContact O-CB 3.44Å; S223-D226 PolarHBondContact O-N 3.17Å; L224-D226 VanDerWaalsContact C-N 3.33Å
227	V	39.1	Very low	34.3	Very low	89 Å²	89	114.1 Å²	114.1	54%	0.539	64%	0.637	S	S	.	*	S	Bend	trans	-93.4	113.8	176.1	-177.4	0	0	0	0	109	M229	V227-M229 PolarHBondContact O-N 3.19Å
228	P	31.3	Very low	34.6	Very low	91 Å²	91	117.3 Å²	117.3	59%	0.591	65%	0.654	S	S	*	*			trans	-67.8	127.7	-178.2	-16.3	29.7	0	0	0	111.1	N230 V231	P228-N230 PolarHBondContact O-N 3.31Å; P228-V231 HydrophobicContact CB-CG2 4Å; P228-V231 HydrophobicContact CG-CG2 4.21Å
229	M	36.4	Very low	34.7	Very low	186 Å²	186	112.8 Å²	112.8	92%	0.916	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.3	7.7	-170.9	-68.1	-177.6	64.9	0	0	116.1	V227	V227-M229 PolarHBondContact O-N 3.19Å
230	N	35.1	Very low	34.6	Very low	162 Å²	162	112.5 Å²	112.5	87%	0.866	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-142.4	28.7	-171.2	-129.5	8.4	0	0	0	113.5	P228 N232	P228-N230 PolarHBondContact O-N 3.31Å; N230-N232 PolarHBondContact O-N 3.37Å
231	V	34.1	Very low	34.9	Very low	48 Å²	48	109.4 Å²	109.4	29%	0.291	64%	0.64	S	S	.	*			trans	-79.2	112.5	177.5	176.6	0	0	0	0	110.6	P228 F233 L236	P228-V231 HydrophobicContact CB-CG2 4Å; P228-V231 HydrophobicContact CG-CG2 4.21Å; V231-F233 HydrophobicContact CB-CD2 4.42Å; V231-F233 HydrophobicContact CB-CE2 4.1Å; V231-F233 HydrophobicContact CB-CZ 4.28Å; V231-F233 HydrophobicContact CG1-CD1 4.13Å; V231-F233 HydrophobicContact CG1-CD2 4.11Å; V231-F233 HydrophobicContact CG1-CE1 4.12Å; V231-F233 HydrophobicContact CG1-CE2 4.1Å; V231-F233 HydrophobicContact CG1-CG 4.12Å; V231-F233 HydrophobicContact CG1-CZ 4.11Å; V231-F233 VanDerWaalsContact O-CD2 3.26Å; V231-F233 WeakPolarHBondContact O-CD2 3.24Å; V231-F233 PolarHBondContact O-N 3.42Å; V231-F233 VanDerWaalsContact O-N 3.16Å; V231-L236 HydrophobicContact CG1-CD1 3.48Å; V231-L236 VanDerWaalsContact CG1-CD1 3.48Å
232	N	31.8	Very low	35.9	Very low	104 Å²	104	110.5 Å²	110.5	56%	0.556	63%	0.634	S	S	*	*			trans	-77.4	95.1	166.6	-166.6	-2.5	0	0	0	108.7	N230 N234 T235	N230-N232 PolarHBondContact O-N 3.37Å; N232-N234 PolarHBondContact O-N 3.07Å; N232-T235 PolarHBondContact O-N 3.3Å; N232-T235 VanDerWaalsContact O-N 3.09Å; N232-T235 PolarHBondContact O-OG1 2.96Å; N232-T235 VanDerWaalsContact O-OG1 3.09Å
233	F	35.3	Very low	37.8	Very low	135 Å²	135	109.6 Å²	109.6	59%	0.592	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-60.1	-17.2	-169.5	-78.5	-87.1	0	0	0	114.9	V231 T235	V231-F233 HydrophobicContact CB-CD2 4.42Å; V231-F233 HydrophobicContact CB-CE2 4.1Å; V231-F233 HydrophobicContact CB-CZ 4.28Å; V231-F233 HydrophobicContact CG1-CD1 4.13Å; V231-F233 HydrophobicContact CG1-CD2 4.11Å; V231-F233 HydrophobicContact CG1-CE1 4.12Å; V231-F233 HydrophobicContact CG1-CE2 4.1Å; V231-F233 HydrophobicContact CG1-CG 4.12Å; V231-F233 HydrophobicContact CG1-CZ 4.11Å; V231-F233 VanDerWaalsContact O-CD2 3.26Å; V231-F233 WeakPolarHBondContact O-CD2 3.24Å; V231-F233 PolarHBondContact O-N 3.42Å; V231-F233 VanDerWaalsContact O-N 3.16Å; F233-T235 PolarHBondContact O-N 3.45Å
234	N	36	Very low	40.1	Very low	152 Å²	152	111 Å²	111	81%	0.813	62%	0.619	S	S	*	*	G	3₁₀ helix	trans	-76.4	-1	177.3	-64.8	-6.5	0	0	0	114	N232	N232-N234 PolarHBondContact O-N 3.07Å
235	T	37	Very low	42.3	Very low	108 Å²	108	111.7 Å²	111.7	66%	0.663	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-126.9	19.2	-174.9	65.3	0	0	0	0	115.1	N232 F233	N232-T235 PolarHBondContact O-N 3.3Å; N232-T235 VanDerWaalsContact O-N 3.09Å; N232-T235 PolarHBondContact O-OG1 2.96Å; N232-T235 VanDerWaalsContact O-OG1 3.09Å; F233-T235 PolarHBondContact O-N 3.45Å
236	L	30.9	Very low	44.7	Very low	84 Å²	84	110.7 Å²	110.7	44%	0.44	60%	0.6	S	S	.	*	S	Bend	trans	-102	141.5	168.8	-83.6	97.4	0	0	0	111.9	V231 N238 T241	V231-L236 HydrophobicContact CG1-CD1 3.48Å; V231-L236 VanDerWaalsContact CG1-CD1 3.48Å; L236-N238 PolarHBondContact O-N 3.28Å; L236-T241 HydrophobicContact CD2-CG2 4.25Å
237	N	29.4	Very low	47.4	Very low	138 Å²	138	110.8 Å²	110.8	74%	0.738	60%	0.6	S	S	*	*			trans	-52	130.8	-178.4	-72.3	-25.8	0	0	0	112.8	S239	N237-S239 PolarHBondContact O-N 3.15Å
238	N	32.8	Very low	49.9	Very low	181 Å²	181	106.7 Å²	106.7	97%	0.968	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.6	-0.4	-176.3	-75.4	-10.1	0	0	0	116.4	L236	L236-N238 PolarHBondContact O-N 3.28Å
239	S	31.3	Very low	52.8	Low	108 Å²	108	105.8 Å²	105.8	76%	0.755	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102	-19.2	-169	55.5	0	0	0	0	116	N237	N237-S239 PolarHBondContact O-N 3.15Å
240	C	29.8	Very low	55.4	Low	113 Å²	113	98.4 Å²	98.4	76%	0.764	53%	0.528	S	S	*	.	S	Bend	trans	-154.5	38.6	-167	-139.6	0	0	0	0	117.8
241	T	39.8	Very low	58.1	Low	83 Å²	83	96.2 Å²	96.2	51%	0.509	51%	0.513	S	S	.	.			trans	-134.7	141	156.2	59.6	0	0	0	0	110.9	L236 N243	L236-T241 HydrophobicContact CD2-CG2 4.25Å; T241-N243 PolarHBondContact O-N 3.36Å
242	T	54.3	Low	60.9	Low	90 Å²	90	94.9 Å²	94.9	55%	0.552	50%	0.503	S	S	*	.			trans	-86.2	111.2	-174.8	59.2	0	0	0	0	111.1	R244	T242-R244 PolarHBondContact O-N 3.14Å
243	N	73.1	Confident	63.8	Low	78 Å²	78	89.9 Å²	89.9	42%	0.417	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	43.2	176.7	-74.6	-19.8	0	0	0	113.2	T241 N648 Y649	T241-N243 PolarHBondContact O-N 3.36Å; N243-N648 HydrophobicContact CB-CB 4.15Å; N243-N648 CarbonylContact O-C 3.56Å; N243-N648 WeakPolarHBondContact O-CA 3.31Å; N243-Y649 WeakPolarHBondContact O-CB 3.31Å; N243-Y649 PolarHBondContact O-N 3.11Å
244	R	84.9	Confident	66.4	Low	97 Å²	97	87.5 Å²	87.5	37%	0.366	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-12.9	-178.9	-65.4	-167.3	-162.3	-158.5	8	113.9	T242 S644 I645	T242-R244 PolarHBondContact O-N 3.14Å; R244-S644 PolarHBondContact O-N 3.09Å; R244-I645 PolarHBondContact NH1-O 3.04Å
245	Y	89.3	Confident	69.1	Low	115 Å²	115	82.7 Å²	82.7	45%	0.451	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	147.9	-178.3	-62.9	-84.3	0	0	0	111.3	V641 V642 K643	Y245-V641 HydrophobicContact CD1-CG1 4.01Å; Y245-V642 VanDerWaalsContact CA-O 3.3Å; Y245-V642 WeakPolarHBondContact CA-O 3.48Å; Y245-K643 HydrophobicContact CD1-CB 3.98Å; Y245-K643 HydrophobicContact CD1-CG 4.1Å; Y245-K643 HydrophobicContact CE1-CB 3.85Å; Y245-K643 HydrophobicContact CE1-CD 3.66Å; Y245-K643 HydrophobicContact CE1-CG 3.63Å; Y245-K643 WeakPolarHBondContact OH-CE 3.45Å; Y245-K643 PolarHBondContact OH-NZ 3.49Å
246	H	90.4	Very high	71.7	Confident	70 Å²	70	77.5 Å²	77.5	32%	0.324	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	152.5	175.5	-172.9	75.4	0	0	0	110.3	V641 V642 Y649	H246-V641 CarbonylContact O-C 3.51Å; H246-V641 WeakPolarHBondContact O-CA 3.18Å; H246-V642 HydrophobicContact CB-CB 4.4Å; H246-V642 PolarHBondContact N-O 3.21Å; H246-V642 PolarHBondContact O-N 2.95Å; H246-Y649 HydrophobicContact CB-CD1 3.61Å; H246-Y649 HydrophobicContact CB-CD2 3.85Å; H246-Y649 HydrophobicContact CB-CE1 3.51Å; H246-Y649 HydrophobicContact CB-CE2 3.75Å; H246-Y649 HydrophobicContact CB-CG 3.77Å; H246-Y649 AromaticContact CD2-CE1 3.63Å; H246-Y649 AromaticContact CD2-CZ 3.44Å; H246-Y649 VanDerWaalsContact CD2-CZ 3.44Å; H246-Y649 PolarHBondContact CD2-OH 3.45Å; H246-Y649 AromaticContact CE1-CE1 3.91Å; H246-Y649 AromaticContact CG-CD1 3.81Å; H246-Y649 AromaticContact CG-CE1 3.26Å; H246-Y649 AromaticContact CG-CZ 3.45Å; H246-Y649 VanDerWaalsContact CG-CZ 3.45Å; H246-Y649 AromaticContact ND1-CD1 3.94Å; H246-Y649 AromaticContact ND1-CE1 3.47Å; H246-Y649 WeakPolarHBondContact ND1-CE1 3.28Å
247	I	92.4	Very high	74.6	Confident	95 Å²	95	74.7 Å²	74.7	49%	0.487	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	125.6	177.4	-64.5	172.1	0	0	0	107.9	I639 V641	I247-I639 HydrophobicContact CD1-CG2 4.27Å; I247-I639 HydrophobicContact CG1-CG2 4.32Å; I247-I639 HydrophobicContact CG2-CG2 3.86Å; I247-V641 HydrophobicContact CG1-CG2 4.47Å
248	L	92.7	Very high	77.5	Confident	2 Å²	2	72.2 Å²	72.2	1%	0.01	38%	0.378	C	S	.	.			trans	-65.9	140.3	179.2	-66.8	-175.8	0	0	0	111.7	Q252 V253 L256 I426 I427 I612 V640 V642	L248-Q252 HydrophobicContact CB-CB 4.07Å; L248-Q252 HydrophobicContact CD1-CB 4.39Å; L248-Q252 HydrophobicContact CD2-CB 3.99Å; L248-Q252 HydrophobicContact CD2-CG 4.47Å; L248-Q252 HydrophobicContact CG-CB 4.38Å; L248-V253 HydrophobicContact CB-CG2 3.56Å; L248-V253 HydrophobicContact CD1-CG2 4.3Å; L248-L256 HydrophobicContact CD1-CD2 4.17Å; L248-I426 HydrophobicContact CD1-CG2 4.22Å; L248-I427 HydrophobicContact CD2-CG1 4.07Å; L248-I612 HydrophobicContact CD1-CD1 4.47Å; L248-I612 HydrophobicContact CD1-CG2 4.12Å; L248-V640 HydrophobicContact CB-CB 4.45Å; L248-V640 HydrophobicContact CD1-CB 4.13Å; L248-V640 HydrophobicContact CD1-CG1 3.75Å; L248-V640 HydrophobicContact CG-CB 4.47Å; L248-V640 HydrophobicContact CG-CG1 4.37Å; L248-V640 PolarHBondContact N-O 3.16Å; L248-V642 HydrophobicContact CD1-CG2 4.48Å; L248-V642 HydrophobicContact CD2-CG2 3.35Å; L248-V642 HydrophobicContact CG-CG2 3.8Å
249	N	92	Very high	80.1	Confident	73 Å²	73	64 Å²	64	39%	0.39	33%	0.334	S	S	.	.			trans	-73.6	169.9	170.7	78.5	31.8	0	0	0	111.2	E251 Q252 V253	N249-E251 VanDerWaalsContact C-N 3.32Å; N249-E251 PolarHBondContact O-N 3.46Å; N249-E251 WeakPolarHBondContact OD1-CB 3Å; N249-E251 PolarHBondContact OD1-N 2.82Å; N249-Q252 PolarHBondContact O-N 3.18Å; N249-Q252 WeakPolarHBondContact OD1-CG 3.5Å; N249-Q252 PolarHBondContact OD1-N 3.27Å; N249-V253 WeakPolarHBondContact O-CG2 3.49Å; N249-V253 PolarHBondContact O-N 2.74Å
250	F	91.5	Very high	82.9	Confident	31 Å²	31	58.8 Å²	58.8	14%	0.136	30%	0.298	C	S	.	.	H	α-helix	trans	-57.3	-40.3	-177.9	172.2	-109	0	0	0	113.7	V253 Q254 L632 N633 K634 Y637	F250-V253 PolarHBondContact O-N 3.25Å; F250-Q254 VanDerWaalsContact CE1-OE1 3.27Å; F250-Q254 HydrophobicContact CZ-CB 4.33Å; F250-Q254 WeakPolarHBondContact O-CB 3.45Å; F250-Q254 PolarHBondContact O-N 3.01Å; F250-L632 HydrophobicContact CD2-CD2 4.45Å; F250-L632 HydrophobicContact CE2-CD2 3.65Å; F250-L632 HydrophobicContact CE2-CG 4.35Å; F250-L632 HydrophobicContact CZ-CD2 4.34Å; F250-N633 WeakPolarHBondContact CE2-O 3.42Å; F250-K634 HydrophobicContact CB-CG 4.44Å; F250-K634 HydrophobicContact CD1-CB 3.93Å; F250-K634 HydrophobicContact CD1-CD 4.36Å; F250-K634 HydrophobicContact CD1-CG 4.03Å; F250-K634 HydrophobicContact CD2-CB 4.37Å; F250-K634 HydrophobicContact CE1-CB 4.04Å; F250-K634 HydrophobicContact CE2-CB 4.47Å; F250-K634 VanDerWaalsContact CE2-N 3.3Å; F250-K634 HydrophobicContact CG-CB 4.11Å; F250-K634 HydrophobicContact CG-CG 4.13Å; F250-K634 HydrophobicContact CZ-CB 4.32Å; F250-Y637 HydrophobicContact CB-CD1 4.35Å; F250-Y637 HydrophobicContact CB-CE1 3.9Å; F250-Y637 AromaticContact CD2-CD1 3.65Å; F250-Y637 HydrophobicContact CD2-CD1 3.65Å; F250-Y637 HydrophobicContact CD2-CE1 4.07Å; F250-Y637 AromaticContact CD2-CG 3.96Å; F250-Y637 HydrophobicContact CD2-CG 3.96Å; F250-Y637 HydrophobicContact CG-CD1 4.41Å; F250-Y637 HydrophobicContact CG-CE1 4.4Å
251	E	90.9	Very high	85.6	Confident	116 Å²	116	55.5 Å²	55.5	54%	0.542	27%	0.273	S	S	.	.	H	α-helix	trans	-71	-39.6	-176	-67.4	160.8	-155.2	0	0	111.4	N249 Q254 Y255	N249-E251 VanDerWaalsContact C-N 3.32Å; N249-E251 PolarHBondContact O-N 3.46Å; N249-E251 WeakPolarHBondContact OD1-CB 3Å; N249-E251 PolarHBondContact OD1-N 2.82Å; E251-Q254 PolarHBondContact O-N 3.13Å; E251-Y255 PolarHBondContact O-N 3.34Å
252	Q	92.6	Very high	87.6	Confident	19 Å²	19	53.3 Å²	53.3	9%	0.089	26%	0.259	C	S	.	.	H	α-helix	trans	-65.2	-39.9	171.8	-64	168.3	-38	0	0	111.6	L248 N249 L256 I426 I427	L248-Q252 HydrophobicContact CB-CB 4.07Å; L248-Q252 HydrophobicContact CD1-CB 4.39Å; L248-Q252 HydrophobicContact CD2-CB 3.99Å; L248-Q252 HydrophobicContact CD2-CG 4.47Å; L248-Q252 HydrophobicContact CG-CB 4.38Å; N249-Q252 PolarHBondContact O-N 3.18Å; N249-Q252 WeakPolarHBondContact OD1-CG 3.5Å; N249-Q252 PolarHBondContact OD1-N 3.27Å; Q252-L256 WeakPolarHBondContact O-CB 3.42Å; Q252-L256 PolarHBondContact O-N 3.02Å; Q252-I426 HydrophobicContact CB-CG2 4.45Å; Q252-I426 WeakPolarHBondContact CG-O 3.47Å; Q252-I427 PolarHBondContact NE2-O 2.75Å
253	V	93.1	Very high	88.8	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-69	-35.7	174.9	176.6	0	0	0	0	111.7	L248 N249 F250 L256 D257 L632 Y637 V640	L248-V253 HydrophobicContact CB-CG2 3.56Å; L248-V253 HydrophobicContact CD1-CG2 4.3Å; N249-V253 WeakPolarHBondContact O-CG2 3.49Å; N249-V253 PolarHBondContact O-N 2.74Å; F250-V253 PolarHBondContact O-N 3.25Å; V253-L256 PolarHBondContact O-N 3.44Å; V253-D257 PolarHBondContact O-N 3.38Å; V253-L632 HydrophobicContact CG1-CD1 4Å; V253-Y637 HydrophobicContact CB-CD2 4.12Å; V253-Y637 HydrophobicContact CG1-CD2 4.07Å; V253-Y637 HydrophobicContact CG2-CD2 4.06Å; V253-Y637 HydrophobicContact CG2-CE2 4.26Å; V253-V640 HydrophobicContact CG1-CG2 4.24Å; V253-V640 HydrophobicContact CG2-CB 4.07Å; V253-V640 HydrophobicContact CG2-CG2 4.02Å
254	Q	91.4	Very high	88.9	Confident	85 Å²	85	51.6 Å²	51.6	40%	0.397	24%	0.238	S	C	.	.	H	α-helix	trans	-64.8	-47.2	174.5	-177.8	179	-23.6	0	0	111.1	F250 E251 L256 D257 D258 L632	F250-Q254 VanDerWaalsContact CE1-OE1 3.27Å; F250-Q254 HydrophobicContact CZ-CB 4.33Å; F250-Q254 WeakPolarHBondContact O-CB 3.45Å; F250-Q254 PolarHBondContact O-N 3.01Å; E251-Q254 PolarHBondContact O-N 3.13Å; Q254-L256 VanDerWaalsContact C-N 3.26Å; Q254-L256 PolarHBondContact O-N 3.28Å; Q254-D257 WeakPolarHBondContact O-CB 3.3Å; Q254-D257 PolarHBondContact O-N 3.37Å; Q254-D258 PolarHBondContact O-N 3.33Å; Q254-L632 HydrophobicContact CB-CD2 4.09Å; Q254-L632 HydrophobicContact CG-CD2 4.46Å
255	Y	91.3	Very high	87.9	Confident	50 Å²	50	47.1 Å²	47.1	20%	0.196	22%	0.221	C	C	.	.	H	α-helix	trans	-63.2	-32.7	176.3	-177.6	-146.1	0	0	0	112.3	E251 I259 I426	E251-Y255 PolarHBondContact O-N 3.34Å; Y255-I259 HydrophobicContact CD1-CD1 4.46Å; Y255-I259 HydrophobicContact CD2-CD1 4.02Å; Y255-I259 HydrophobicContact CD2-CG1 4.31Å; Y255-I259 HydrophobicContact CE1-CD1 4.18Å; Y255-I259 HydrophobicContact CE2-CD1 3.7Å; Y255-I259 HydrophobicContact CE2-CG1 4.07Å; Y255-I259 HydrophobicContact CG-CD1 4.37Å; Y255-I259 WeakPolarHBondContact O-CG1 3.38Å; Y255-I259 PolarHBondContact O-N 2.98Å; Y255-I426 HydrophobicContact CD1-CB 4.45Å; Y255-I426 HydrophobicContact CD1-CG1 4.12Å; Y255-I426 HydrophobicContact CE1-CG1 4.21Å
256	L	92.5	Very high	86.8	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-68.5	-37.5	169.9	174	63.7	0	0	0	113	L248 Q252 V253 Q254 I259 M260 L418 I426 I612 L614 L617 V640	L248-L256 HydrophobicContact CD1-CD2 4.17Å; Q252-L256 WeakPolarHBondContact O-CB 3.42Å; Q252-L256 PolarHBondContact O-N 3.02Å; V253-L256 PolarHBondContact O-N 3.44Å; Q254-L256 VanDerWaalsContact C-N 3.26Å; Q254-L256 PolarHBondContact O-N 3.28Å; L256-I259 PolarHBondContact O-N 3.49Å; L256-M260 HydrophobicContact CD1-CG 3.98Å; L256-M260 HydrophobicContact CG-CG 4.42Å; L256-M260 VanDerWaalsContact O-CB 3.28Å; L256-M260 WeakPolarHBondContact O-CB 3.44Å; L256-M260 WeakPolarHBondContact O-CG 3.42Å; L256-M260 PolarHBondContact O-N 2.9Å; L256-L418 HydrophobicContact CD1-CD2 3.64Å; L256-I426 HydrophobicContact CB-CD1 4.26Å; L256-I426 HydrophobicContact CB-CG2 4.29Å; L256-I426 HydrophobicContact CD1-CD1 3.78Å; L256-I612 HydrophobicContact CD2-CG2 4.05Å; L256-L614 HydrophobicContact CD1-CD2 4.04Å; L256-L614 HydrophobicContact CD2-CD2 4.4Å; L256-L617 HydrophobicContact CD1-CD2 4.42Å; L256-L617 HydrophobicContact CD2-CD2 3.65Å; L256-L617 HydrophobicContact CG-CD2 3.61Å; L256-V640 HydrophobicContact CD2-CG1 3.82Å; L256-V640 HydrophobicContact CD2-CG2 4.4Å
257	D	91.7	Very high	85.1	Confident	24 Å²	24	40.7 Å²	40.7	13%	0.128	20%	0.2	C	C	.	.	H	α-helix	trans	-62.3	-47.9	171.8	-172.9	12.4	0	0	0	110	V253 Q254 I259 M260 N261 Y621 L632	V253-D257 PolarHBondContact O-N 3.38Å; Q254-D257 WeakPolarHBondContact O-CB 3.3Å; Q254-D257 PolarHBondContact O-N 3.37Å; D257-I259 PolarHBondContact O-N 3.31Å; D257-M260 CarbonylContact O-C 3.16Å; D257-M260 PolarHBondContact O-N 2.94Å; D257-M260 VanDerWaalsContact O-N 3.09Å; D257-N261 WeakPolarHBondContact O-CB 3.44Å; D257-N261 PolarHBondContact O-N 2.99Å; D257-N261 PolarHBondContact O-ND2 2.86Å; D257-N261 PolarHBondContact OD1-ND2 3.11Å; D257-Y621 PolarHBondContact OD1-OH 3.3Å; D257-L632 HydrophobicContact CB-CD2 4.46Å; D257-L632 WeakPolarHBondContact OD2-CB 3.45Å
258	D	88.9	Confident	83.1	Confident	87 Å²	87	38.2 Å²	38.2	47%	0.465	19%	0.19	S	C	.	.	H	α-helix	trans	-54.7	-48.4	174.7	-70.1	-33.7	0	0	0	112.1	Q254 M260 N261 T262	Q254-D258 PolarHBondContact O-N 3.33Å; D258-M260 PolarHBondContact O-N 2.81Å; D258-N261 WeakPolarHBondContact O-CB 3.27Å; D258-N261 PolarHBondContact O-N 3.23Å; D258-N261 VanDerWaalsContact O-N 3.14Å; D258-T262 PolarHBondContact O-N 2.92Å
259	I	88.3	Confident	80.9	Confident	7 Å²	7	42.1 Å²	42.1	4%	0.036	21%	0.211	C	C	.	.	H	α-helix	trans	-61.2	-44.1	174.9	-72.8	164.5	0	0	0	111.4	Y255 L256 D257 N261 T262 L395 V422 I426 F436	Y255-I259 HydrophobicContact CD1-CD1 4.46Å; Y255-I259 HydrophobicContact CD2-CD1 4.02Å; Y255-I259 HydrophobicContact CD2-CG1 4.31Å; Y255-I259 HydrophobicContact CE1-CD1 4.18Å; Y255-I259 HydrophobicContact CE2-CD1 3.7Å; Y255-I259 HydrophobicContact CE2-CG1 4.07Å; Y255-I259 HydrophobicContact CG-CD1 4.37Å; Y255-I259 WeakPolarHBondContact O-CG1 3.38Å; Y255-I259 PolarHBondContact O-N 2.98Å; L256-I259 PolarHBondContact O-N 3.49Å; D257-I259 PolarHBondContact O-N 3.31Å; I259-N261 PolarHBondContact O-N 3.28Å; I259-T262 WeakPolarHBondContact O-CB 3.41Å; I259-T262 PolarHBondContact O-N 2.99Å; I259-T262 VanDerWaalsContact O-N 3.12Å; I259-T262 PolarHBondContact O-OG1 3.16Å; I259-L395 HydrophobicContact CG2-CD2 4.19Å; I259-V422 HydrophobicContact CD1-CG1 4.29Å; I259-V422 HydrophobicContact CG2-CG1 4.27Å; I259-I426 HydrophobicContact CD1-CD1 3.72Å; I259-I426 HydrophobicContact CD1-CG1 3.55Å; I259-F436 HydrophobicContact CD1-CE1 4.31Å; I259-F436 HydrophobicContact CD1-CZ 4.47Å; I259-F436 HydrophobicContact CG1-CZ 4.49Å
260	M	89.8	Confident	78.3	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-66.9	-19.9	177.2	-71.2	-73.9	-75.5	0	0	113.3	L256 D257 D258 L395 K396 I399 L614 L617 L618 Y621	L256-M260 HydrophobicContact CD1-CG 3.98Å; L256-M260 HydrophobicContact CG-CG 4.42Å; L256-M260 VanDerWaalsContact O-CB 3.28Å; L256-M260 WeakPolarHBondContact O-CB 3.44Å; L256-M260 WeakPolarHBondContact O-CG 3.42Å; L256-M260 PolarHBondContact O-N 2.9Å; D257-M260 CarbonylContact O-C 3.16Å; D257-M260 PolarHBondContact O-N 2.94Å; D257-M260 VanDerWaalsContact O-N 3.09Å; D258-M260 PolarHBondContact O-N 2.81Å; M260-L395 HydrophobicContact SD-CD2 3.91Å; M260-L395 HydrophobicContact SD-CG 3.94Å; M260-K396 HydrophobicContact CB-CB 4.42Å; M260-K396 HydrophobicContact CE-CB 4.13Å; M260-K396 WeakPolarHBondContact O-CB 3.48Å; M260-K396 WeakPolarHBondContact O-CG 3.5Å; M260-K396 PolarHBondContact O-N 3.02Å; M260-I399 HydrophobicContact CE-CD1 3.72Å; M260-I399 HydrophobicContact SD-CD1 3.87Å; M260-L614 HydrophobicContact CE-CD1 4.16Å; M260-L614 HydrophobicContact SD-CD1 4.12Å; M260-L614 HydrophobicContact SD-CD2 4.48Å; M260-L617 HydrophobicContact CG-CD2 4.13Å; M260-L618 HydrophobicContact CE-CD2 3.76Å; M260-Y621 HydrophobicContact CB-CE2 4.17Å; M260-Y621 WeakPolarHBondContact CB-OH 3.36Å; M260-Y621 HydrophobicContact CE-CE2 3.94Å
261	N	87.6	Confident	75.7	Confident	44 Å²	44	47.9 Å²	47.9	24%	0.235	24%	0.237	C	C	.	.	H	α-helix	trans	-86.5	-15.3	173.5	-70.6	-43.9	0	0	0	113.9	D257 D258 I259 K396	D257-N261 WeakPolarHBondContact O-CB 3.44Å; D257-N261 PolarHBondContact O-N 2.99Å; D257-N261 PolarHBondContact O-ND2 2.86Å; D257-N261 PolarHBondContact OD1-ND2 3.11Å; D258-N261 WeakPolarHBondContact O-CB 3.27Å; D258-N261 PolarHBondContact O-N 3.23Å; D258-N261 VanDerWaalsContact O-N 3.14Å; I259-N261 PolarHBondContact O-N 3.28Å; N261-K396 WeakPolarHBondContact OD1-CD 3.43Å; N261-K396 WeakPolarHBondContact OD1-CE 3.34Å; N261-K396 PolarHBondContact OD1-NZ 2.84Å
262	T	81.1	Confident	72.9	Confident	36 Å²	36	44.5 Å²	44.5	22%	0.221	22%	0.222	C	C	.	.	S	Bend	trans	-59.7	142.3	178.8	60.8	0	0	0	0	112.5	D258 I259 I264 Q394 L395	D258-T262 PolarHBondContact O-N 2.92Å; I259-T262 WeakPolarHBondContact O-CB 3.41Å; I259-T262 PolarHBondContact O-N 2.99Å; I259-T262 VanDerWaalsContact O-N 3.12Å; I259-T262 PolarHBondContact O-OG1 3.16Å; T262-I264 PolarHBondContact O-N 3.35Å; T262-Q394 CarbonylContact O-C 3.19Å; T262-Q394 VanDerWaalsContact O-CA 3.27Å; T262-Q394 WeakPolarHBondContact O-CA 3.4Å; T262-L395 PolarHBondContact O-N 2.89Å
263	Y	78.8	Confident	70.1	Confident	132 Å²	132	46.7 Å²	46.7	52%	0.518	23%	0.233	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	91.3	178.2	-81.4	-99.6	0	0	0	110.9	S265 I393 Q394 Y575	Y263-S265 PolarHBondContact O-N 3.09Å; Y263-I393 CarbonylContact C-O 3.39Å; Y263-Q394 HydrophobicContact CD1-CG 4.03Å; Y263-Q394 HydrophobicContact CD2-CG 3.94Å; Y263-Q394 HydrophobicContact CE1-CG 3.84Å; Y263-Q394 HydrophobicContact CE2-CG 3.73Å; Y263-Q394 HydrophobicContact CG-CG 4.1Å; Y263-Q394 PolarHBondContact OH-NE2 3.05Å; Y263-Y575 WeakPolarHBondContact O-CD2 3.3Å; Y263-Y575 WeakPolarHBondContact O-CE2 3.47Å
264	I	75	Confident	67.1	Low	0 Å²	0	52.5 Å²	52.5	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	123.9	168.6	-67.6	179.1	0	0	0	108.9	T262 I266 I393 L395 L398 I439 I573 C589	T262-I264 PolarHBondContact O-N 3.35Å; I264-I266 HydrophobicContact CG2-CG1 4.48Å; I264-I393 WeakPolarHBondContact CA-O 3.37Å; I264-I393 PolarHBondContact N-O 3.3Å; I264-I393 PolarHBondContact O-N 3.09Å; I264-I393 VanDerWaalsContact O-O 3.14Å; I264-L395 HydrophobicContact CD1-CB 3.83Å; I264-L395 HydrophobicContact CD1-CD1 3.64Å; I264-L395 HydrophobicContact CD1-CG 4.19Å; I264-L395 HydrophobicContact CG1-CB 4.31Å; I264-L398 HydrophobicContact CD1-CD2 4.48Å; I264-I439 HydrophobicContact CD1-CD1 4.14Å; I264-I439 HydrophobicContact CG1-CD1 4.35Å; I264-I573 HydrophobicContact CG2-CG2 3.65Å; I264-C589 HydrophobicContact CD1-CB 4.25Å; I264-C589 HydrophobicContact CG2-CB 4.33Å
265	S	65.3	Low	64.2	Low	3 Å²	3	53.6 Å²	53.6	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	150.6	165.2	-54.4	0	0	0	0	109.8	Y263 I391 I573 K574 Y575	Y263-S265 PolarHBondContact O-N 3.09Å; S265-I391 CarbonylContact C-O 3.52Å; S265-I391 WeakPolarHBondContact CA-O 3.5Å; S265-I391 WeakPolarHBondContact CB-O 3.15Å; S265-I573 WeakPolarHBondContact O-CG2 3.26Å; S265-K574 CarbonylContact C-O 3.5Å; S265-K574 CarbonylContact O-C 3.49Å; S265-K574 VanDerWaalsContact O-C 3.3Å; S265-Y575 VanDerWaalsContact O-CA 3.28Å; S265-Y575 WeakPolarHBondContact O-CA 3.3Å; S265-Y575 PolarHBondContact O-N 2.73Å
266	I	66.1	Low	61.3	Low	11 Å²	11	56.8 Å²	56.8	6%	0.056	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	103.5	169.3	-53.1	153.7	0	0	0	107	I264 I391 I393 I573	I264-I266 HydrophobicContact CG2-CG1 4.48Å; I266-I391 HydrophobicContact CB-CB 3.96Å; I266-I391 HydrophobicContact CB-CD1 3.97Å; I266-I391 HydrophobicContact CB-CG1 4.28Å; I266-I391 HydrophobicContact CD1-CB 4.23Å; I266-I391 HydrophobicContact CD1-CD1 3.83Å; I266-I391 HydrophobicContact CD1-CG2 4.08Å; I266-I391 HydrophobicContact CG1-CB 4.43Å; I266-I391 HydrophobicContact CG1-CD1 4.48Å; I266-I391 HydrophobicContact CG2-CD1 4.32Å; I266-I391 PolarHBondContact N-O 2.91Å; I266-I391 PolarHBondContact O-N 3.38Å; I266-I391 VanDerWaalsContact O-N 3.13Å; I266-I393 HydrophobicContact CD1-CG2 4.06Å; I266-I573 HydrophobicContact CB-CG2 4.18Å; I266-I573 HydrophobicContact CD1-CD1 4.34Å; I266-I573 HydrophobicContact CG1-CB 4.36Å; I266-I573 HydrophobicContact CG1-CD1 4.16Å; I266-I573 HydrophobicContact CG1-CG1 4.07Å; I266-I573 HydrophobicContact CG1-CG2 3.5Å; I266-I573 HydrophobicContact CG2-CB 4.5Å; I266-I573 HydrophobicContact CG2-CG1 3.99Å; I266-I573 HydrophobicContact CG2-CG2 4.32Å
267	S	54.4	Low	58.2	Low	40 Å²	40	60.1 Å²	60.1	28%	0.28	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-95	137.2	173	-53.4	0	0	0	0	110.5	T390 K574	S267-T390 WeakPolarHBondContact OG-CG2 3.43Å; S267-K574 PolarHBondContact N-O 3.01Å
268	P	49.5	Very low	55.3	Low	42 Å²	42	64.2 Å²	64.2	27%	0.273	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-57	141.1	166.6	-16	25.9	0	0	0	110.8	P270 L388	P268-P270 WeakPolarHBondContact O-CD 3.49Å; P268-L388 HydrophobicContact CG-CB 3.57Å
269	N	47.6	Very low	52.3	Low	85 Å²	85	66.3 Å²	66.3	46%	0.455	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-67.4	122.2	176.8	-177.7	-10.8	0	0	0	109.9	R271 L272	N269-R271 PolarHBondContact O-N 3.18Å; N269-R271 PolarHBondContact OD1-N 3.43Å; N269-R271 VanDerWaalsContact OD1-N 3.14Å; N269-L272 PolarHBondContact O-N 2.95Å
270	P	37.1	Very low	49.4	Very low	81 Å²	81	71.8 Å²	71.8	53%	0.526	40%	0.397	S	S	.	.	G	3₁₀ helix	trans	-59.7	-20.4	-177.7	22.4	-33.5	0	0	0	113.7	P268 L272 Q273	P268-P270 WeakPolarHBondContact O-CD 3.49Å; P270-L272 PolarHBondContact O-N 2.99Å; P270-L272 VanDerWaalsContact O-N 3.15Å; P270-Q273 WeakPolarHBondContact O-CB 3.3Å; P270-Q273 PolarHBondContact O-N 3.3Å
271	R	35.9	Very low	46.3	Very low	144 Å²	144	78.2 Å²	78.2	54%	0.543	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-61.7	-19.1	172.8	-68.5	-172	175.7	166.5	2.3	114.1	N269	N269-R271 PolarHBondContact O-N 3.18Å; N269-R271 PolarHBondContact OD1-N 3.43Å; N269-R271 VanDerWaalsContact OD1-N 3.14Å
272	L	32.7	Very low	43.5	Very low	44 Å²	44	83.3 Å²	83.3	23%	0.23	46%	0.462	C	S	.	.	G	3₁₀ helix	trans	-84.3	-15.6	171.1	-80.3	164	0	0	0	113.6	N269 P270 L276 N569	N269-L272 PolarHBondContact O-N 2.95Å; P270-L272 PolarHBondContact O-N 2.99Å; P270-L272 VanDerWaalsContact O-N 3.15Å; L272-L276 WeakPolarHBondContact O-CD1 3.44Å; L272-N569 HydrophobicContact CD2-CB 4.38Å
273	Q	33.8	Very low	40.8	Very low	66 Å²	66	86.1 Å²	86.1	31%	0.308	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-26.9	-177.9	-67.6	175.2	-13.3	0	0	112.5	P270	P270-Q273 WeakPolarHBondContact O-CB 3.3Å; P270-Q273 PolarHBondContact O-N 3.3Å
274	N	31	Very low	38.4	Very low	122 Å²	122	86.1 Å²	86.1	65%	0.652	50%	0.499	S	S	*	.	S	Bend	trans	-86.3	-18.2	176.6	-67.2	10.5	0	0	0	113.4	L276	N274-L276 VanDerWaalsContact C-N 3.31Å; N274-L276 PolarHBondContact O-N 3.27Å
275	L	30.9	Very low	36.1	Very low	107 Å²	107	89.8 Å²	89.8	56%	0.56	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-3.3	-171.5	-132.8	77.5	0	0	0	115
276	L	28.8	Very low	34.4	Very low	117 Å²	117	97.6 Å²	97.6	61%	0.613	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.6	-1.3	-179.3	-85.2	92.3	0	0	0	114.6	L272 N274 L566	L272-L276 WeakPolarHBondContact O-CD1 3.44Å; N274-L276 VanDerWaalsContact C-N 3.31Å; N274-L276 PolarHBondContact O-N 3.27Å; L276-L566 HydrophobicContact CD1-CD2 3.67Å; L276-L566 HydrophobicContact CD2-CD2 3.93Å; L276-L566 HydrophobicContact CG-CD2 4.4Å
277	G	29	Very low	32.6	Very low	70 Å²	70	102.4 Å²	102.4	72%	0.722	61%	0.61	S	S	*	*	S	Bend	trans	-83.3	-15.5	176.2	0	0	0	0	0	115
278	T	29	Very low	31.4	Very low	111 Å²	111	106.7 Å²	106.7	68%	0.681	63%	0.634	S	S	*	*	S	Bend	trans	-139.3	49	-160	61.7	0	0	0	0	113.7
279	N	26.3	Very low	30.3	Very low	130 Å²	130	110.8 Å²	110.8	70%	0.695	66%	0.659	S	S	*	*			trans	-149.4	46.7	176.5	-95.5	-52.8	0	0	0	114.2
280	T	26.9	Very low	29.4	Very low	123 Å²	123	113 Å²	113	76%	0.755	68%	0.675	S	S	*	*			trans	-121.6	82.4	161.5	50.6	0	0	0	0	109.7	I282	T280-I282 VanDerWaalsContact C-N 3.31Å; T280-I282 PolarHBondContact O-N 3.45Å
281	V	26.7	Very low	29.1	Very low	134 Å²	134	113.9 Å²	113.9	81%	0.812	68%	0.684	S	S	*	*			trans	-70.7	91.8	167.4	-179.6	0	0	0	0	107.8
282	I	27	Very low	28.8	Very low	152 Å²	152	111.9 Å²	111.9	78%	0.779	69%	0.692	S	S	*	*			trans	-93.1	110.6	164.5	-60.7	178.9	0	0	0	105.9	T280	T280-I282 VanDerWaalsContact C-N 3.31Å; T280-I282 PolarHBondContact O-N 3.45Å
283	S	25.8	Very low	28.6	Very low	94 Å²	94	116 Å²	116	66%	0.657	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-59.7	144.2	-178	-54	0	0	0	0	111.7	G285	S283-G285 PolarHBondContact O-N 3.22Å
284	P	27.3	Very low	28.2	Very low	132 Å²	132	117.7 Å²	117.7	86%	0.857	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-67.7	124	-179.8	27.6	-34.1	0	0	0	111.3
285	G	27.5	Very low	28	Very low	78 Å²	78	116.5 Å²	116.5	80%	0.804	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-81.8	127.7	171.1	0	0	0	0	0	111.4	S283	S283-G285 PolarHBondContact O-N 3.22Å
286	L	28.9	Very low	27.8	Very low	166 Å²	166	117.5 Å²	117.5	87%	0.869	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-77.2	142.3	-178.6	-164.9	69.4	0	0	0	111.3
287	P	27.8	Very low	27.7	Very low	113 Å²	113	117.6 Å²	117.6	73%	0.734	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-88	154.7	-173.7	34.7	-36.1	0	0	0	114
288	T	29.7	Very low	27.4	Very low	129 Å²	129	121.6 Å²	121.6	79%	0.791	76%	0.758	S	S	*	*			trans	-115	100.4	179	39.1	0	0	0	0	113.7
289	T	26.4	Very low	27.5	Very low	129 Å²	129	123.9 Å²	123.9	79%	0.791	77%	0.766	S	S	*	*			trans	42.8	125.5	136.3	59.2	0	0	0	0	121.3
290	T	29.2	Very low	27.4	Very low	131 Å²	131	123.2 Å²	123.2	80%	0.804	76%	0.757	S	S	*	*				-158.6	144.7	122.1	137.1	0	0	0	0	112.2
291	S	30.2	Very low	27.6	Very low	100 Å²	100	123.3 Å²	123.3	70%	0.699	76%	0.76	S	S	*	*			trans	61.2	114.9	161.5	62.5	0	0	0	0	122.4
292	S	29	Very low	27.4	Very low	101 Å²	101	121.5 Å²	121.5	71%	0.706	75%	0.752	S	S	*	*			trans	77.3	112.4	135.8	57.4	0	0	0	0	123.3
293	T	28.6	Very low	27.3	Very low	132 Å²	132	118.6 Å²	118.6	81%	0.81	75%	0.745	S	S	*	*			trans	61.2	135.6	139	55.4	0	0	0	0	121.1
294	S	26.2	Very low	27.3	Very low	100 Å²	100	120.1 Å²	120.1	70%	0.699	76%	0.755	S	S	*	*			cis	-170.3	163.1	-16.2	44.2	0	0	0	0	110.8
295	S	26.8	Very low	27.1	Very low	97 Å²	97	123.7 Å²	123.7	68%	0.678	76%	0.757	S	S	*	*			trans	60	104.3	155.9	52.5	0	0	0	0	120.7
296	T	27.5	Very low	26.9	Very low	128 Å²	128	124.9 Å²	124.9	79%	0.785	75%	0.753	S	S	*	*			trans	61.5	94.3	131.7	57.3	0	0	0	0	121.3
297	V	24.9	Very low	26.6	Very low	120 Å²	120	121.4 Å²	121.4	73%	0.727	74%	0.742	S	S	*	*				34.3	108.7	111.2	-173.4	0	0	0	0	117.7
298	I	23.8	Very low	26.5	Very low	154 Å²	154	123.1 Å²	123.1	79%	0.79	74%	0.743	S	S	*	*				-179	75	126.2	-80.8	146.5	0	0	0	105	K300	I298-K300 PolarHBondContact O-N 2.77Å
299	N	31	Very low	26.2	Very low	158 Å²	158	123.3 Å²	123.3	85%	0.845	74%	0.739	S	S	*	*			trans	-89.4	76.2	-159.5	-64.8	41.2	0	0	0	111.9
300	K	24.7	Very low	26	Very low	117 Å²	117	121.4 Å²	121.4	51%	0.509	73%	0.73	S	S	.	*			trans	-91.3	154.8	165.7	-94.8	175.6	175.1	166.5	0	111.6	I298 N1087 N1088	I298-K300 PolarHBondContact O-N 2.77Å; K300-N1087 PolarHBondContact NZ-OD1 2.87Å; K300-N1088 PolarHBondContact NZ-OD1 2.96Å
301	P	31.3	Very low	25.8	Very low	124 Å²	124	120.5 Å²	120.5	81%	0.805	73%	0.725	S	S	*	*			trans	-96	147	-162.6	36.2	-34.7	0	0	0	113.7
302	C	22.7	Very low	25.5	Very low	97 Å²	97	121.9 Å²	121.9	66%	0.655	73%	0.725	S	S	*	*			trans	-160.9	170.1	143.7	-145.1	0	0	0	0	112.8
303	S	24.4	Very low	25.3	Very low	91 Å²	91	125.1 Å²	125.1	64%	0.636	73%	0.726	S	S	*	*			trans	11.6	133.7	150.8	55.3	0	0	0	0	121.4
304	C	24.7	Very low	25.2	Very low	126 Å²	126	124.1 Å²	124.1	85%	0.851	72%	0.716	S	S	*	*				-160.3	84.1	121.1	-109.1	0	0	0	0	110
305	F	24.2	Very low	25.1	Very low	207 Å²	207	125.6 Å²	125.6	91%	0.908	72%	0.716	S	S	*	*			trans	-86.1	150.9	156.8	-144.1	-85.4	0	0	0	107.4
306	S	22.7	Very low	25	Very low	103 Å²	103	126 Å²	126	72%	0.72	72%	0.715	S	S	*	*			trans	68.8	158	-165.1	88	0	0	0	0	113.3
307	S	23.9	Very low	24.9	Very low	92 Å²	92	127.8 Å²	127.8	64%	0.643	71%	0.714	S	S	*	*			cis	-149.7	159.7	15.3	87.2	0	0	0	0	114.3
308	M	24.1	Very low	25.2	Very low	150 Å²	150	128.7 Å²	128.7	74%	0.739	72%	0.715	S	S	*	*			trans	66.2	119.5	147.4	-64.6	-61.2	163.8	0	0	121
309	N	23.5	Very low	25.3	Very low	132 Å²	132	126.3 Å²	126.3	71%	0.706	71%	0.712	S	S	*	*			trans	77.6	117.7	137	-56.6	-12.4	0	0	0	118
310	S	22.9	Very low	25.3	Very low	89 Å²	89	126 Å²	126	62%	0.622	71%	0.71	S	S	*	*			cis	82.2	157.6	38.9	87.4	0	0	0	0	114.4
311	T	24.4	Very low	25.5	Very low	112 Å²	112	127.3 Å²	127.3	69%	0.687	72%	0.718	S	S	*	*			trans	71	121.3	-160.6	67.3	0	0	0	0	111
312	N	23.4	Very low	25.4	Very low	130 Å²	130	128.8 Å²	128.8	70%	0.695	72%	0.717	S	S	*	*				60.4	131.9	68.4	-48.4	-10.4	0	0	0	109.2
313	F	26	Very low	25.6	Very low	168 Å²	168	129.9 Å²	129.9	74%	0.737	72%	0.716	S	S	*	*			cis	-147.2	148.2	43.5	-92.5	-103.2	0	0	0	113
314	N	25.4	Very low	25.8	Very low	112 Å²	112	130.6 Å²	130.6	60%	0.599	72%	0.717	S	S	*	*			trans	49.8	142.7	134.8	-61.4	15.9	0	0	0	120.3
315	N	23.9	Very low	26	Very low	131 Å²	131	131.5 Å²	131.5	70%	0.701	71%	0.712	S	S	*	*				42.4	120.9	80.4	-22.9	-36.1	0	0	0	110.8
316	T	26.6	Very low	26.2	Very low	105 Å²	105	128.5 Å²	128.5	64%	0.644	71%	0.705	S	S	*	*				-167	144.3	50.7	39.9	0	0	0	0	112.4
317	E	25.4	Very low	26.6	Very low	166 Å²	166	128.4 Å²	128.4	78%	0.776	71%	0.705	S	S	*	*				66.1	170.3	128.7	-60	161.6	172.4	0	0	121
318	N	30.6	Very low	26.8	Very low	138 Å²	138	128.8 Å²	128.8	74%	0.738	71%	0.708	S	S	*	*			trans	65	105.9	-176.9	-53	-12.4	0	0	0	114.2
319	S	26.2	Very low	27	Very low	104 Å²	104	126.4 Å²	126.4	73%	0.727	71%	0.706	S	S	*	*			cis	65.6	58.5	8.6	85.7	0	0	0	0	117.8
320	D	29.6	Very low	27.1	Very low	151 Å²	151	128.1 Å²	128.1	81%	0.807	71%	0.713	S	S	*	*			trans	-125.1	89.5	141.6	-73.9	-52	0	0	0	106.4
321	H	30.3	Very low	27.1	Very low	145 Å²	145	128 Å²	128	67%	0.671	71%	0.713	S	S	*	*				-15.5	114.7	90.1	-110.5	-84.2	0	0	0	115.7	D323	H321-D323 PolarHBondContact ND1-O 3.44Å; H321-D323 PolarHBondContact O-N 3.09Å
322	I	28	Very low	27.1	Very low	155 Å²	155	128.4 Å²	128.4	80%	0.795	72%	0.715	S	S	*	*	S	Bend	trans	-61.8	113.8	137.6	-64	175.1	0	0	0	105.3
323	D	26.5	Very low	27	Very low	120 Å²	120	129.1 Å²	129.1	64%	0.642	72%	0.724	S	S	*	*	S	Bend	trans	60.2	109.3	171.9	-53.2	-37.9	0	0	0	118.6	H321	H321-D323 PolarHBondContact ND1-O 3.44Å; H321-D323 PolarHBondContact O-N 3.09Å
324	T	28.6	Very low	27.3	Very low	107 Å²	107	127.7 Å²	127.7	66%	0.656	73%	0.729	S	S	*	*			trans	73.9	117.5	139.7	49.6	0	0	0	0	123.5
325	I	29.4	Very low	27.2	Very low	144 Å²	144	127 Å²	127	74%	0.738	73%	0.731	S	S	*	*			trans	89.2	97	133.6	-61.1	165.9	0	0	0	119.8
326	N	28.8	Very low	27.1	Very low	144 Å²	144	128.2 Å²	128.2	77%	0.77	74%	0.735	S	S	*	*			trans	75.4	117	133.5	-64.4	1	0	0	0	124.9
327	S	30.2	Very low	27	Very low	102 Å²	102	128.4 Å²	128.4	71%	0.713	74%	0.741	S	S	*	*				78.9	90.9	126.6	67.8	0	0	0	0	122.8
328	S	29.3	Very low	26.9	Very low	100 Å²	100	126.6 Å²	126.6	70%	0.699	73%	0.731	S	S	*	*				73.2	96.4	109.9	72.9	0	0	0	0	122.8
329	S	27.2	Very low	26.6	Very low	99 Å²	99	126.1 Å²	126.1	69%	0.692	73%	0.727	S	S	*	*				79.3	137.4	102.7	77.3	0	0	0	0	124.6
330	I	26.6	Very low	26.4	Very low	168 Å²	168	126.9 Å²	126.9	86%	0.862	72%	0.723	S	S	*	*			trans	87.9	151.4	138.2	-75.4	162.5	0	0	0	119.5
331	S	22.7	Very low	26.2	Very low	88 Å²	88	125.6 Å²	125.6	62%	0.615	72%	0.716	S	S	*	*			trans	-126.5	176.3	-161.2	60.6	0	0	0	0	113.2
332	T	23.6	Very low	25.9	Very low	119 Å²	119	126.2 Å²	126.2	73%	0.73	72%	0.723	S	S	*	*			trans	56.5	104.7	151.6	46.9	0	0	0	0	118.9
333	T	22.9	Very low	25.7	Very low	146 Å²	146	123.9 Å²	123.9	90%	0.896	72%	0.716	S	S	*	*				-171	159.8	108.4	21.4	0	0	0	0	112
334	V	30.7	Very low	25.6	Very low	137 Å²	137	124.5 Å²	124.5	83%	0.83	72%	0.724	S	S	*	*			trans	-98.1	133	-174.9	171.3	0	0	0	0	110.3
335	P	23.8	Very low	25.3	Very low	99 Å²	99	123.7 Å²	123.7	64%	0.643	72%	0.723	S	S	*	*				-148.7	126.8	121.2	34.3	-16.7	0	0	0	114.8
336	I	22.7	Very low	25.1	Very low	155 Å²	155	124.3 Å²	124.3	80%	0.795	73%	0.726	S	S	*	*			trans	-133.9	97.5	156.1	-56.7	-178.9	0	0	0	108.9
337	S	23.2	Very low	25.1	Very low	110 Å²	110	122.1 Å²	122.1	77%	0.769	72%	0.72	S	S	*	*			trans	-160.5	154.5	162.1	77.4	0	0	0	0	111.1
338	K	23.9	Very low	24.9	Very low	128 Å²	128	126.4 Å²	126.4	56%	0.557	73%	0.729	S	S	*	*			trans	72.6	145	168.3	-112.4	-165.2	179.5	-162	0	118.5	D795	K338-D795 PolarHBondContact NZ-O 2.96Å; K338-D795 IonicContact NZ-OD1 3.52Å; K338-D795 PolarHBondContact NZ-OD1 2.91Å
339	I	23.7	Very low	24.6	Very low	127 Å²	127	125 Å²	125	65%	0.651	73%	0.73	S	S	*	*			trans	79.6	99.5	157.4	-62.4	159.6	0	0	0	113.9
340	N	23.3	Very low	24.6	Very low	120 Å²	120	129.8 Å²	129.8	64%	0.642	74%	0.739	S	S	*	*			cis	74.5	144	44.5	-48.5	4.1	0	0	0	113.6
341	N	25.5	Very low	24.5	Very low	124 Å²	124	126.1 Å²	126.1	66%	0.663	73%	0.728	S	S	*	*			trans	68.6	144.9	169.3	-44	-27.5	0	0	0	112.8
342	L	23.9	Very low	24.7	Very low	158 Å²	158	128.9 Å²	128.9	83%	0.827	74%	0.736	S	S	*	*			cis	-120.2	140.9	29.3	-94.3	71.8	0	0	0	111.3
343	V	23.8	Very low	24.9	Very low	107 Å²	107	128 Å²	128	65%	0.648	73%	0.734	S	S	*	*				84	140.8	63.5	166.2	0	0	0	0	112.8
344	T	23.7	Very low	25.1	Very low	132 Å²	132	127.6 Å²	127.6	81%	0.81	73%	0.732	S	S	*	*			trans	62.8	142.5	-177.8	47.8	0	0	0	0	116.2
345	S	23.4	Very low	24.8	Very low	90 Å²	90	128.5 Å²	128.5	63%	0.629	73%	0.732	S	S	*	*			cis	-172.3	153.6	-12.9	46.7	0	0	0	0	110.3
346	I	24.6	Very low	25.1	Very low	157 Å²	157	131.3 Å²	131.3	81%	0.805	74%	0.74	S	S	*	*			trans	35.5	129.1	139.2	-52.6	165.4	0	0	0	118.4
347	P	29.4	Very low	25.2	Very low	98 Å²	98	131.1 Å²	131.1	64%	0.636	74%	0.74	S	S	*	*			cis	-135.5	-156.9	-18.1	41.6	-21.2	0	0	0	112.7
348	E	24.2	Very low	25.5	Very low	193 Å²	193	133 Å²	133	90%	0.902	74%	0.742	S	S	*	*			trans	52.3	121.2	152.6	-70.6	168.6	-142	0	0	121.9
349	G	24.9	Very low	25.6	Very low	70 Å²	70	132.5 Å²	132.5	72%	0.722	75%	0.75	S	S	*	*			trans	133.5	131	147.1	0	0	0	0	0	119.8
350	F	25.2	Very low	25.8	Very low	200 Å²	200	134.2 Å²	134.2	88%	0.877	76%	0.758	S	S	*	*			trans	49.2	100.9	145.5	-67.7	-82.9	0	0	0	123.5
351	S	25.5	Very low	25.9	Very low	90 Å²	90	135 Å²	135	63%	0.629	76%	0.763	S	S	*	*				44.3	134.9	121.2	65.6	0	0	0	0	124.6
352	N	26.3	Very low	26	Very low	147 Å²	147	135 Å²	135	79%	0.786	76%	0.763	S	S	*	*			trans	100.8	97.4	144.4	-64.5	-10.7	0	0	0	121.7
353	S	27.6	Very low	26.2	Very low	101 Å²	101	133 Å²	133	71%	0.706	76%	0.76	S	S	*	*				33.9	129.4	129.4	63.7	0	0	0	0	122.5
354	T	26.9	Very low	26.4	Very low	137 Å²	137	135.4 Å²	135.4	84%	0.84	76%	0.758	S	S	*	*				-170.9	168.2	104.2	20.1	0	0	0	0	113.6
355	N	26.2	Very low	26.5	Very low	156 Å²	156	137.4 Å²	137.4	83%	0.834	76%	0.758	S	S	*	*			trans	-62.2	143.3	-169	-47	-24.4	0	0	0	115.8
356	I	28.5	Very low	26.7	Very low	158 Å²	158	142.7 Å²	142.7	81%	0.81	77%	0.773	S	S	*	*			trans	-140.9	141.4	143	-60.9	-174.2	0	0	0	108
357	D	25	Very low	26.9	Very low	150 Å²	150	140.6 Å²	140.6	80%	0.802	77%	0.771	S	S	*	*			trans	-62.7	150	175.4	-57	-88	0	0	0	113.5
358	N	29.5	Very low	26.9	Very low	149 Å²	149	142.4 Å²	142.4	80%	0.797	78%	0.775	S	S	*	*			trans	-151.5	125.1	158.2	-107.9	-56.5	0	0	0	113.1	I360	N358-I360 PolarHBondContact O-N 3.17Å
359	T	25.8	Very low	27.1	Very low	119 Å²	119	140 Å²	140	73%	0.73	77%	0.768	S	S	*	*			trans	-75.2	103	173	47.1	0	0	0	0	110.7	N361	T359-N361 PolarHBondContact O-N 3.48Å
360	I	28.5	Very low	27.3	Very low	162 Å²	162	144.5 Å²	144.5	83%	0.831	78%	0.775	S	S	*	*			trans	-90.8	100.4	163.8	-61.6	-178	0	0	0	108	N358 N362	N358-I360 PolarHBondContact O-N 3.17Å; I360-N362 PolarHBondContact O-N 3.14Å
361	N	25.9	Very low	27.5	Very low	136 Å²	136	140.9 Å²	140.9	73%	0.727	77%	0.773	S	S	*	*			trans	-65.8	127.6	174.4	-67.3	-41.5	0	0	0	109.6	T359 P363	T359-N361 PolarHBondContact O-N 3.48Å; N361-P363 WeakPolarHBondContact O-CD 3.1Å
362	N	27.9	Very low	27.7	Very low	126 Å²	126	141.9 Å²	141.9	67%	0.674	78%	0.779	S	S	*	*			trans	-82.4	115.8	179.6	-158.9	6.2	0	0	0	109.2	I360 Y364	I360-N362 PolarHBondContact O-N 3.14Å; N362-Y364 PolarHBondContact O-N 2.65Å
363	P	26.8	Very low	28	Very low	116 Å²	116	143 Å²	143	75%	0.753	78%	0.784	S	S	*	*	S	Bend	trans	-80.5	54.1	-169.2	34.7	-37.5	0	0	0	112.9	N361	N361-P363 WeakPolarHBondContact O-CD 3.1Å
364	Y	28.1	Very low	28.1	Very low	156 Å²	156	142.9 Å²	142.9	61%	0.612	78%	0.781	S	S	*	*			trans	-128.4	44.4	179.5	-74.2	-75.7	0	0	0	111.9	N362	N362-Y364 PolarHBondContact O-N 2.65Å
365	Q	26.8	Very low	28.1	Very low	174 Å²	174	143.1 Å²	143.1	81%	0.813	78%	0.777	S	S	*	*			trans	-144.9	73.2	169.3	-68	-165	-89.3	0	0	110.9
366	H	27.9	Very low	28.5	Very low	202 Å²	202	144.3 Å²	144.3	94%	0.935	78%	0.777	S	S	*	*			trans	-173.2	76.6	157.3	-98	-63.6	0	0	0	112.1
367	S	27.5	Very low	28.4	Very low	112 Å²	112	146 Å²	146	78%	0.783	78%	0.782	S	S	*	*	S	Bend	trans	-161	159.6	156.9	59	0	0	0	0	109.9
368	I	29.2	Very low	28.7	Very low	137 Å²	137	144.9 Å²	144.9	70%	0.703	77%	0.774	S	S	*	*	S	Bend	trans	64.8	55.7	-166.8	-39.8	175	0	0	0	112.8
369	N	28.7	Very low	28.4	Very low	141 Å²	141	143.6 Å²	143.6	75%	0.754	77%	0.774	S	S	*	*			trans	-156.4	45.5	162.1	-141.5	46.1	0	0	0	112.6
370	D	30.5	Very low	28.6	Very low	165 Å²	165	146.8 Å²	146.8	88%	0.882	78%	0.778	S	S	*	*			trans	-130.6	116	177.8	-97.5	-57.7	0	0	0	111.9
371	C	29.2	Very low	28.4	Very low	124 Å²	124	146.4 Å²	146.4	84%	0.838	78%	0.776	S	S	*	*			trans	-158.3	83.8	157.6	-138.7	0	0	0	0	109.5
372	C	30.1	Very low	28.3	Very low	111 Å²	111	145.2 Å²	145.2	75%	0.75	78%	0.779	S	S	*	*	S	Bend	trans	64.1	101.4	159.5	-55.2	0	0	0	0	118.9
373	L	32.1	Very low	28.3	Very low	170 Å²	170	148.1 Å²	148.1	89%	0.89	79%	0.788	S	S	*	*				-176.3	138.4	102.7	-93.6	165.5	0	0	0	111
374	P	28.7	Very low	28.3	Very low	100 Å²	100	151.5 Å²	151.5	65%	0.649	79%	0.794	S	S	*	*			trans	-97.4	170.8	-172.2	38.5	-36.3	0	0	0	114.9
375	N	28.2	Very low	28.5	Very low	141 Å²	141	148 Å²	148	75%	0.754	79%	0.792	S	S	*	*			trans	71.2	94.1	163.1	-57.3	-16.8	0	0	0	118.4
376	H	33.5	Very low	29.2	Very low	181 Å²	181	146 Å²	146	84%	0.838	78%	0.783	S	S	*	*				-168.3	135.9	103.1	-106.6	-77.6	0	0	0	111.7
377	H	26.9	Very low	30.6	Very low	195 Å²	195	144.5 Å²	144.5	90%	0.903	77%	0.774	S	S	*	*			trans	-75.5	123.2	171.9	-86.8	-88.9	0	0	0	111.1
378	I	30.2	Very low	32.2	Very low	125 Å²	125	140.8 Å²	140.8	64%	0.641	75%	0.745	S	S	*	*			trans	-136	123.9	161.8	-52	-179.7	0	0	0	107.7	F380	I378-F380 HydrophobicContact CG2-CD2 3.83Å; I378-F380 HydrophobicContact CG2-CE2 3.66Å; I378-F380 PolarHBondContact O-N 2.76Å
379	P	24.9	Very low	34.1	Very low	123 Å²	123	135.4 Å²	135.4	80%	0.799	72%	0.719	S	S	*	*			trans	-82.5	110.4	-173.1	31.3	-33.2	0	0	0	111.5
380	F	28.3	Very low	36	Very low	185 Å²	185	131.5 Å²	131.5	81%	0.811	70%	0.7	S	S	*	*			trans	-121.7	132.1	172.1	-88.9	-77.6	0	0	0	113.9	I378	I378-F380 HydrophobicContact CG2-CD2 3.83Å; I378-F380 HydrophobicContact CG2-CE2 3.66Å; I378-F380 PolarHBondContact O-N 2.76Å
381	I	25.6	Very low	38.1	Very low	155 Å²	155	123.7 Å²	123.7	80%	0.795	66%	0.658	S	S	*	*			trans	-54.6	138.5	-169.6	-66.2	156	0	0	0	112.5	Q383	I381-Q383 PolarHBondContact O-N 2.89Å; I381-Q383 VanDerWaalsContact O-N 3.08Å
382	S	24.2	Very low	40.5	Very low	111 Å²	111	124.8 Å²	124.8	78%	0.776	65%	0.645	S	S	*	*			trans	-57	106.5	179.6	54.6	0	0	0	0	113.5
383	Q	26.9	Very low	43	Very low	187 Å²	187	119.7 Å²	119.7	87%	0.874	61%	0.61	S	S	*	*			trans	-102.4	100.2	160.5	-68.9	-170.2	-1.5	0	0	109.2	I381 S385	I381-Q383 PolarHBondContact O-N 2.89Å; I381-Q383 VanDerWaalsContact O-N 3.08Å; Q383-S385 PolarHBondContact O-N 3.27Å
384	Q	27.1	Very low	45.6	Very low	187 Å²	187	114 Å²	114	87%	0.874	58%	0.579	S	S	*	*			trans	-63.4	123.6	169.5	-72.6	-180	-15.3	0	0	109.3	Q386	Q384-Q386 PolarHBondContact O-N 2.98Å
385	S	32	Very low	48.5	Very low	82 Å²	82	109.2 Å²	109.2	57%	0.573	55%	0.548	S	S	*	.			trans	-65.3	119	174.5	47.3	0	0	0	0	109.6	Q383 K387	Q383-S385 PolarHBondContact O-N 3.27Å; S385-K387 PolarHBondContact O-N 2.84Å
386	Q	41.3	Very low	51.5	Low	132 Å²	132	104.4 Å²	104.4	62%	0.617	52%	0.52	S	S	*	.			trans	-62.6	107.9	-174	-74.9	-179.6	-31.5	0	0	110.9	Q384 L388	Q384-Q386 PolarHBondContact O-N 2.98Å; Q386-L388 PolarHBondContact O-N 2.96Å
387	K	57.7	Low	54.1	Low	171 Å²	171	100 Å²	100	74%	0.743	50%	0.499	S	S	*	.			trans	-71.4	104.4	-177.3	-172.2	176.5	-175.7	176.1	0	109.6	S385	S385-K387 PolarHBondContact O-N 2.84Å
388	L	60.5	Low	57.1	Low	34 Å²	34	91 Å²	91	18%	0.178	46%	0.457	C	S	.	.			trans	-52.6	138.1	171.4	-87.9	75.1	0	0	0	109.9	P268 Q386	P268-L388 HydrophobicContact CG-CB 3.57Å; Q386-L388 PolarHBondContact O-N 2.96Å
389	P	69.8	Low	60.1	Low	23 Å²	23	85 Å²	85	15%	0.149	43%	0.426	C	S	.	.			trans	-68.2	157.1	-175.5	27.7	-34.7	0	0	0	112.2	I391 I472 E475	P389-I391 PolarHBondContact O-N 3.49Å; P389-I472 HydrophobicContact CG-CD1 4.41Å; P389-I472 HydrophobicContact CG-CG1 3.67Å; P389-E475 WeakPolarHBondContact CB-OE1 3.46Å; P389-E475 VanDerWaalsContact CB-OE2 3.29Å; P389-E475 WeakPolarHBondContact CB-OE2 3.41Å
390	T	68.3	Low	63.3	Low	59 Å²	59	81.2 Å²	81.2	36%	0.362	40%	0.396	S	S	.	.			trans	-82.3	103.9	174.6	-61.4	0	0	0	0	108.9	S267	S267-T390 WeakPolarHBondContact OG-CG2 3.43Å
391	I	75.1	Confident	66.3	Low	2 Å²	2	74.8 Å²	74.8	1%	0.01	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	143.5	174.1	-53.9	175.2	0	0	0	109	S265 I266 P389 I393 I464 I467 L468 T471	S265-I391 CarbonylContact C-O 3.52Å; S265-I391 WeakPolarHBondContact CA-O 3.5Å; S265-I391 WeakPolarHBondContact CB-O 3.15Å; I266-I391 HydrophobicContact CB-CB 3.96Å; I266-I391 HydrophobicContact CB-CD1 3.97Å; I266-I391 HydrophobicContact CB-CG1 4.28Å; I266-I391 HydrophobicContact CD1-CB 4.23Å; I266-I391 HydrophobicContact CD1-CD1 3.83Å; I266-I391 HydrophobicContact CD1-CG2 4.08Å; I266-I391 HydrophobicContact CG1-CB 4.43Å; I266-I391 HydrophobicContact CG1-CD1 4.48Å; I266-I391 HydrophobicContact CG2-CD1 4.32Å; I266-I391 PolarHBondContact N-O 2.91Å; I266-I391 PolarHBondContact O-N 3.38Å; I266-I391 VanDerWaalsContact O-N 3.13Å; P389-I391 PolarHBondContact O-N 3.49Å; I391-I393 HydrophobicContact CG2-CB 4.45Å; I391-I393 HydrophobicContact CG2-CG2 4.22Å; I391-I464 HydrophobicContact CD1-CG2 4.15Å; I391-I467 HydrophobicContact CG2-CB 4.4Å; I391-I467 HydrophobicContact CG2-CG2 3.35Å; I391-L468 HydrophobicContact CD1-CD2 3.6Å; I391-L468 HydrophobicContact CD1-CG 3.56Å; I391-L468 HydrophobicContact CG1-CD2 3.55Å; I391-L468 HydrophobicContact CG1-CG 4.04Å; I391-T471 HydrophobicContact CG2-CG2 4.33Å
392	R	78.1	Confident	69.5	Low	147 Å²	147	67.6 Å²	67.6	56%	0.555	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.4	119	167.1	-66.2	-177.5	172.6	170.1	-1.8	110.6
393	I	83.2	Confident	72.8	Confident	3 Å²	3	64.2 Å²	64.2	2%	0.015	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	133.7	-174.6	-179.5	157.9	0	0	0	112.1	Y263 I264 I266 I391 L395 K397 L398 I401 I467	Y263-I393 CarbonylContact C-O 3.39Å; I264-I393 WeakPolarHBondContact CA-O 3.37Å; I264-I393 PolarHBondContact N-O 3.3Å; I264-I393 PolarHBondContact O-N 3.09Å; I264-I393 VanDerWaalsContact O-O 3.14Å; I266-I393 HydrophobicContact CD1-CG2 4.06Å; I391-I393 HydrophobicContact CG2-CB 4.45Å; I391-I393 HydrophobicContact CG2-CG2 4.22Å; I393-L395 PolarHBondContact O-N 2.9Å; I393-K397 HydrophobicContact CD1-CB 4.21Å; I393-K397 HydrophobicContact CD1-CD 4.02Å; I393-K397 HydrophobicContact CD1-CG 3.89Å; I393-K397 HydrophobicContact CG1-CB 3.95Å; I393-K397 HydrophobicContact CG1-CD 4.09Å; I393-K397 HydrophobicContact CG1-CG 4.09Å; I393-L398 HydrophobicContact CD1-CB 4.15Å; I393-L398 HydrophobicContact CD1-CD1 4.44Å; I393-L398 HydrophobicContact CG1-CB 4.19Å; I393-L398 HydrophobicContact CG2-CB 4.43Å; I393-I401 HydrophobicContact CD1-CD1 4.02Å; I393-I467 HydrophobicContact CD1-CD1 3.63Å; I393-I467 HydrophobicContact CD1-CG1 4.05Å; I393-I467 HydrophobicContact CD1-CG2 4.14Å
394	Q	86.1	Confident	75.9	Confident	51 Å²	51	58.5 Å²	58.5	24%	0.238	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	137.3	173.9	-68.5	-175.6	-20.2	0	0	111.6	T262 Y263 K396 K397 L398	T262-Q394 CarbonylContact O-C 3.19Å; T262-Q394 VanDerWaalsContact O-CA 3.27Å; T262-Q394 WeakPolarHBondContact O-CA 3.4Å; Y263-Q394 HydrophobicContact CD1-CG 4.03Å; Y263-Q394 HydrophobicContact CD2-CG 3.94Å; Y263-Q394 HydrophobicContact CE1-CG 3.84Å; Y263-Q394 HydrophobicContact CE2-CG 3.73Å; Y263-Q394 HydrophobicContact CG-CG 4.1Å; Y263-Q394 PolarHBondContact OH-NE2 3.05Å; Q394-K396 VanDerWaalsContact C-N 3.3Å; Q394-K396 HydrophobicContact CB-CG 4.36Å; Q394-K396 PolarHBondContact O-N 3.09Å; Q394-K397 HydrophobicContact CB-CB 4.18Å; Q394-K397 WeakPolarHBondContact O-CA 3.1Å; Q394-K397 WeakPolarHBondContact O-CB 3.28Å; Q394-K397 PolarHBondContact O-N 2.98Å; Q394-L398 PolarHBondContact O-N 3.49Å
395	L	89.6	Confident	79.1	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-50.8	-47.2	178.4	171.3	54.2	0	0	0	112.1	I259 M260 T262 I264 I393 K397 L398 I399 I439 L441	I259-L395 HydrophobicContact CG2-CD2 4.19Å; M260-L395 HydrophobicContact SD-CD2 3.91Å; M260-L395 HydrophobicContact SD-CG 3.94Å; T262-L395 PolarHBondContact O-N 2.89Å; I264-L395 HydrophobicContact CD1-CB 3.83Å; I264-L395 HydrophobicContact CD1-CD1 3.64Å; I264-L395 HydrophobicContact CD1-CG 4.19Å; I264-L395 HydrophobicContact CG1-CB 4.31Å; I393-L395 PolarHBondContact O-N 2.9Å; L395-K397 VanDerWaalsContact C-N 3.3Å; L395-K397 PolarHBondContact O-N 3.01Å; L395-L398 PolarHBondContact O-N 2.88Å; L395-I399 HydrophobicContact CD1-CD1 3.61Å; L395-I399 HydrophobicContact CD1-CG1 3.98Å; L395-I399 HydrophobicContact CG-CD1 3.97Å; L395-I399 WeakPolarHBondContact O-CG1 3.28Å; L395-I399 PolarHBondContact O-N 3.34Å; L395-I439 HydrophobicContact CD2-CG2 4.15Å; L395-L441 HydrophobicContact CD1-CD1 3.72Å; L395-L441 HydrophobicContact CD1-CD2 4.13Å; L395-L441 HydrophobicContact CD1-CG 4.42Å
396	K	91.2	Very high	82	Confident	39 Å²	39	46.5 Å²	46.5	17%	0.17	22%	0.218	C	C	.	.	H	α-helix	trans	-63.1	-28.7	175.1	71.4	-172.7	-173.6	-178.8	0	114.6	M260 N261 Q394 R400 Y621	M260-K396 HydrophobicContact CB-CB 4.42Å; M260-K396 HydrophobicContact CE-CB 4.13Å; M260-K396 WeakPolarHBondContact O-CB 3.48Å; M260-K396 WeakPolarHBondContact O-CG 3.5Å; M260-K396 PolarHBondContact O-N 3.02Å; N261-K396 WeakPolarHBondContact OD1-CD 3.43Å; N261-K396 WeakPolarHBondContact OD1-CE 3.34Å; N261-K396 PolarHBondContact OD1-NZ 2.84Å; Q394-K396 VanDerWaalsContact C-N 3.3Å; Q394-K396 HydrophobicContact CB-CG 4.36Å; Q394-K396 PolarHBondContact O-N 3.09Å; K396-R400 VanDerWaalsContact O-CG 3.27Å; K396-R400 WeakPolarHBondContact O-CG 3.35Å; K396-R400 PolarHBondContact O-N 2.69Å; K396-Y621 HydrophobicContact CB-CD2 4.1Å; K396-Y621 HydrophobicContact CB-CE2 3.96Å; K396-Y621 HydrophobicContact CD-CD2 4.12Å; K396-Y621 HydrophobicContact CD-CE2 3.99Å
397	K	89.7	Confident	84.4	Confident	90 Å²	90	44.4 Å²	44.4	39%	0.391	21%	0.211	S	C	.	.	H	α-helix	trans	-74.5	-42.4	174.4	-175.8	-177.9	171	-169.2	0	110.2	I393 Q394 L395 R400 I401	I393-K397 HydrophobicContact CD1-CB 4.21Å; I393-K397 HydrophobicContact CD1-CD 4.02Å; I393-K397 HydrophobicContact CD1-CG 3.89Å; I393-K397 HydrophobicContact CG1-CB 3.95Å; I393-K397 HydrophobicContact CG1-CD 4.09Å; I393-K397 HydrophobicContact CG1-CG 4.09Å; Q394-K397 HydrophobicContact CB-CB 4.18Å; Q394-K397 WeakPolarHBondContact O-CA 3.1Å; Q394-K397 WeakPolarHBondContact O-CB 3.28Å; Q394-K397 PolarHBondContact O-N 2.98Å; L395-K397 VanDerWaalsContact C-N 3.3Å; L395-K397 PolarHBondContact O-N 3.01Å; K397-R400 PolarHBondContact O-N 3.38Å; K397-I401 HydrophobicContact CD-CD1 4.42Å; K397-I401 HydrophobicContact CG-CD1 3.91Å; K397-I401 HydrophobicContact CG-CG1 4.48Å; K397-I401 WeakPolarHBondContact O-CB 3.44Å; K397-I401 WeakPolarHBondContact O-CG1 3.41Å; K397-I401 PolarHBondContact O-N 2.96Å
398	L	90	Very high	86.1	Confident	4 Å²	4	44.8 Å²	44.8	2%	0.021	21%	0.212	C	C	.	.	H	α-helix	trans	-61	-48.2	176.5	-177.8	62.2	0	0	0	111.6	I264 I393 Q394 L395 R400 I401 I402 I467	I264-L398 HydrophobicContact CD1-CD2 4.48Å; I393-L398 HydrophobicContact CD1-CB 4.15Å; I393-L398 HydrophobicContact CD1-CD1 4.44Å; I393-L398 HydrophobicContact CG1-CB 4.19Å; I393-L398 HydrophobicContact CG2-CB 4.43Å; Q394-L398 PolarHBondContact O-N 3.49Å; L395-L398 PolarHBondContact O-N 2.88Å; L398-R400 PolarHBondContact O-N 2.72Å; L398-I401 PolarHBondContact O-N 3.18Å; L398-I402 HydrophobicContact CD1-CD1 3.87Å; L398-I402 HydrophobicContact CD1-CG1 4.41Å; L398-I402 HydrophobicContact CG-CD1 4.01Å; L398-I402 WeakPolarHBondContact O-CG1 3.38Å; L398-I402 PolarHBondContact O-N 2.98Å; L398-I467 HydrophobicContact CD1-CD1 4.21Å
399	I	92.4	Very high	87.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.6	-46.8	177.1	-69.7	165.2	0	0	0	111.4	M260 L395 I402 R403 I416 L441 F443 L614 L618	M260-I399 HydrophobicContact CE-CD1 3.72Å; M260-I399 HydrophobicContact SD-CD1 3.87Å; L395-I399 HydrophobicContact CD1-CD1 3.61Å; L395-I399 HydrophobicContact CD1-CG1 3.98Å; L395-I399 HydrophobicContact CG-CD1 3.97Å; L395-I399 WeakPolarHBondContact O-CG1 3.28Å; L395-I399 PolarHBondContact O-N 3.34Å; I399-I402 PolarHBondContact O-N 3.17Å; I399-R403 VanDerWaalsContact O-CB 3.24Å; I399-R403 WeakPolarHBondContact O-CB 3.47Å; I399-R403 PolarHBondContact O-N 3.11Å; I399-I416 HydrophobicContact CG2-CD1 3.86Å; I399-I416 HydrophobicContact CG2-CG2 4.3Å; I399-L441 HydrophobicContact CD1-CD1 4.3Å; I399-L441 HydrophobicContact CD1-CD2 4Å; I399-L441 HydrophobicContact CG1-CD1 3.95Å; I399-L441 HydrophobicContact CG1-CD2 4.49Å; I399-F443 HydrophobicContact CG2-CZ 4.15Å; I399-L614 HydrophobicContact CD1-CD1 3.95Å; I399-L618 HydrophobicContact CG2-CD1 3.82Å; I399-L618 HydrophobicContact CG2-CD2 3.9Å
400	R	92.5	Very high	88.6	Confident	43 Å²	43	50.9 Å²	50.9	16%	0.162	25%	0.25	C	C	.	.	H	α-helix	trans	-63.6	-46.4	179.1	-72.8	173.4	79.4	-152.3	-0.3	111.7	K396 K397 L398 I402 R403 D404 D622	K396-R400 VanDerWaalsContact O-CG 3.27Å; K396-R400 WeakPolarHBondContact O-CG 3.35Å; K396-R400 PolarHBondContact O-N 2.69Å; K397-R400 PolarHBondContact O-N 3.38Å; L398-R400 PolarHBondContact O-N 2.72Å; R400-I402 VanDerWaalsContact C-N 3.35Å; R400-I402 PolarHBondContact O-N 3.35Å; R400-R403 PolarHBondContact O-N 2.88Å; R400-D404 VanDerWaalsContact O-CB 3.25Å; R400-D404 WeakPolarHBondContact O-CB 3.47Å; R400-D404 PolarHBondContact O-N 3.47Å; R400-D622 IonicContact CZ-OD1 3.09Å; R400-D622 IonicContact NE-OD1 2.84Å; R400-D622 PolarHBondContact NE-OD1 2.95Å; R400-D622 IonicContact NH2-OD1 2.69Å; R400-D622 PolarHBondContact NH2-OD1 2.87Å
401	I	91.4	Very high	89.6	Confident	50 Å²	50	48.4 Å²	48.4	26%	0.256	23%	0.234	S	C	.	.	H	α-helix	trans	-57.6	-46.5	177.8	-74	173.9	0	0	0	111.5	I393 K397 L398 G405 C463 I467	I393-I401 HydrophobicContact CD1-CD1 4.02Å; K397-I401 HydrophobicContact CD-CD1 4.42Å; K397-I401 HydrophobicContact CG-CD1 3.91Å; K397-I401 HydrophobicContact CG-CG1 4.48Å; K397-I401 WeakPolarHBondContact O-CB 3.44Å; K397-I401 WeakPolarHBondContact O-CG1 3.41Å; K397-I401 PolarHBondContact O-N 2.96Å; L398-I401 PolarHBondContact O-N 3.18Å; I401-G405 PolarHBondContact O-N 2.88Å; I401-C463 HydrophobicContact CG2-CB 3.67Å; I401-I467 HydrophobicContact CD1-CD1 4.26Å; I401-I467 HydrophobicContact CD1-CG1 4.15Å; I401-I467 HydrophobicContact CG2-CD1 4.44Å
402	I	92.1	Very high	90.2	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.026	26%	0.256	C	S	.	.	H	α-helix	trans	-66.9	-46.6	178.9	-66	169.1	0	0	0	111	L398 I399 R400 D404 G405 L406 F443 V460 L591	L398-I402 HydrophobicContact CD1-CD1 3.87Å; L398-I402 HydrophobicContact CD1-CG1 4.41Å; L398-I402 HydrophobicContact CG-CD1 4.01Å; L398-I402 WeakPolarHBondContact O-CG1 3.38Å; L398-I402 PolarHBondContact O-N 2.98Å; I399-I402 PolarHBondContact O-N 3.17Å; R400-I402 VanDerWaalsContact C-N 3.35Å; R400-I402 PolarHBondContact O-N 3.35Å; I402-D404 PolarHBondContact O-N 2.81Å; I402-G405 PolarHBondContact O-N 2.74Å; I402-L406 HydrophobicContact CG2-CD1 4.03Å; I402-L406 HydrophobicContact CG2-CG 4.47Å; I402-L406 VanDerWaalsContact O-CG 3.29Å; I402-L406 WeakPolarHBondContact O-CG 3.44Å; I402-L406 PolarHBondContact O-N 3.01Å; I402-F443 HydrophobicContact CB-CE1 4.37Å; I402-F443 HydrophobicContact CB-CZ 4.26Å; I402-F443 HydrophobicContact CG2-CD1 4.49Å; I402-F443 HydrophobicContact CG2-CE1 3.89Å; I402-F443 HydrophobicContact CG2-CZ 3.98Å; I402-V460 HydrophobicContact CG2-CG2 4.32Å; I402-L591 HydrophobicContact CD1-CD2 3.91Å
403	R	93.6	Very high	90.8	Very high	39 Å²	39	46 Å²	46	15%	0.147	24%	0.237	C	C	.	.	H	α-helix	trans	-56.2	-51.2	176.9	-179.2	-166.1	70.1	179.9	0.1	111.4	I399 R400 G405 L406 L407 I416 F443 D622	I399-R403 VanDerWaalsContact O-CB 3.24Å; I399-R403 WeakPolarHBondContact O-CB 3.47Å; I399-R403 PolarHBondContact O-N 3.11Å; R400-R403 PolarHBondContact O-N 2.88Å; R403-G405 VanDerWaalsContact C-N 3.34Å; R403-L406 PolarHBondContact O-N 3.22Å; R403-L407 HydrophobicContact CG-CD1 4.14Å; R403-L407 WeakPolarHBondContact O-CG 3.05Å; R403-L407 PolarHBondContact O-N 3.18Å; R403-I416 HydrophobicContact CB-CD1 4.12Å; R403-I416 HydrophobicContact CG-CD1 4.08Å; R403-F443 HydrophobicContact CB-CE1 4.38Å; R403-D622 IonicContact CZ-OD2 2.64Å; R403-D622 IonicContact NH1-OD2 2.8Å; R403-D622 PolarHBondContact NH1-OD2 3.39Å; R403-D622 IonicContact NH2-OD1 2.61Å; R403-D622 PolarHBondContact NH2-OD1 3.43Å; R403-D622 IonicContact NH2-OD2 3.36Å; R403-D622 PolarHBondContact NH2-OD2 3.01Å; R403-D622 VanDerWaalsContact NH2-OD2 3.11Å
404	D	93.1	Very high	91	Very high	68 Å²	68	52 Å²	52	36%	0.364	26%	0.263	S	S	.	.	H	α-helix	trans	-71.9	-32.3	-173.8	-59.2	-12.2	0	0	0	110.6	R400 I402 K408	R400-D404 VanDerWaalsContact O-CB 3.25Å; R400-D404 WeakPolarHBondContact O-CB 3.47Å; R400-D404 PolarHBondContact O-N 3.47Å; I402-D404 PolarHBondContact O-N 2.81Å; D404-K408 PolarHBondContact O-N 3.3Å
405	G	93	Very high	91.2	Very high	17 Å²	17	51.1 Å²	51.1	18%	0.175	26%	0.259	C	S	.	.	H	α-helix	trans	-66	-40.5	169.8	0	0	0	0	0	113.9	I401 I402 R403 K408 E409	I401-G405 PolarHBondContact O-N 2.88Å; I402-G405 PolarHBondContact O-N 2.74Å; R403-G405 VanDerWaalsContact C-N 3.34Å; G405-K408 WeakPolarHBondContact O-CB 3.4Å; G405-K408 PolarHBondContact O-N 3.41Å; G405-E409 PolarHBondContact O-N 2.81Å
406	L	92.8	Very high	91.4	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.7	-43.1	175	-72.3	171.9	0	0	0	111.3	I402 R403 K408 E409 S410 I411 V413 F443 V445 I456 V459 L593	I402-L406 HydrophobicContact CG2-CD1 4.03Å; I402-L406 HydrophobicContact CG2-CG 4.47Å; I402-L406 VanDerWaalsContact O-CG 3.29Å; I402-L406 WeakPolarHBondContact O-CG 3.44Å; I402-L406 PolarHBondContact O-N 3.01Å; R403-L406 PolarHBondContact O-N 3.22Å; L406-K408 VanDerWaalsContact C-N 3.3Å; L406-K408 PolarHBondContact O-N 3.45Å; L406-E409 PolarHBondContact O-N 3.29Å; L406-S410 PolarHBondContact O-N 3.48Å; L406-I411 CarbonylContact C-O 3.3Å; L406-I411 HydrophobicContact CB-CB 4.35Å; L406-I411 HydrophobicContact CD2-CD1 4.07Å; L406-I411 WeakPolarHBondContact O-CB 3.47Å; L406-I411 PolarHBondContact O-N 3.2Å; L406-V413 HydrophobicContact CB-CG2 3.92Å; L406-V413 HydrophobicContact CD1-CG2 3.74Å; L406-V413 HydrophobicContact CG-CG2 4.5Å; L406-F443 HydrophobicContact CD1-CD1 4.25Å; L406-V445 HydrophobicContact CD1-CG1 4.47Å; L406-I456 HydrophobicContact CD2-CB 4.31Å; L406-I456 HydrophobicContact CD2-CG1 3.72Å; L406-I456 HydrophobicContact CD2-CG2 4.45Å; L406-V459 HydrophobicContact CD2-CB 4.2Å; L406-V459 HydrophobicContact CD2-CG1 3.98Å; L406-V459 HydrophobicContact CD2-CG2 4.46Å; L406-V459 HydrophobicContact CG-CG1 4.07Å; L406-L593 HydrophobicContact CD1-CD2 4.25Å
407	L	92.9	Very high	91.4	Very high	88 Å²	88	50.2 Å²	50.2	46%	0.461	26%	0.255	S	S	.	.	H	α-helix	trans	-61.9	-36.5	175.1	-69.4	171	0	0	0	112.1	R403 E409 S410	R403-L407 HydrophobicContact CG-CD1 4.14Å; R403-L407 WeakPolarHBondContact O-CG 3.05Å; R403-L407 PolarHBondContact O-N 3.18Å; L407-E409 VanDerWaalsContact C-N 3.34Å; L407-E409 PolarHBondContact O-N 3.36Å; L407-S410 WeakPolarHBondContact O-CA 3.49Å; L407-S410 PolarHBondContact O-N 3.26Å
408	K	92.7	Very high	91.5	Very high	178 Å²	178	45.9 Å²	45.9	77%	0.774	24%	0.236	S	C	*	.	H	α-helix	trans	-60.6	-39.6	174.1	-172.8	-173.1	175.5	-169.4	0	112.5	D404 G405 L406 S410	D404-K408 PolarHBondContact O-N 3.3Å; G405-K408 WeakPolarHBondContact O-CB 3.4Å; G405-K408 PolarHBondContact O-N 3.41Å; L406-K408 VanDerWaalsContact C-N 3.3Å; L406-K408 PolarHBondContact O-N 3.45Å; K408-S410 PolarHBondContact O-N 3.12Å
409	E	91.1	Very high	91.4	Very high	77 Å²	77	45.7 Å²	45.7	36%	0.36	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	10.5	174	-80.8	-58.6	124	0	0	114.3	G405 L406 L407 I411 K455 V459	G405-E409 PolarHBondContact O-N 2.81Å; L406-E409 PolarHBondContact O-N 3.29Å; L407-E409 VanDerWaalsContact C-N 3.34Å; L407-E409 PolarHBondContact O-N 3.36Å; E409-I411 VanDerWaalsContact C-N 3.27Å; E409-I411 HydrophobicContact CB-CD1 4.11Å; E409-I411 HydrophobicContact CB-CG1 4.14Å; E409-I411 PolarHBondContact O-N 2.74Å; E409-K455 IonicContact OE2-NZ 2.68Å; E409-K455 PolarHBondContact OE2-NZ 3.47Å; E409-V459 HydrophobicContact CB-CG2 4.05Å; E409-V459 HydrophobicContact CG-CG2 3.48Å; E409-V459 VanDerWaalsContact CG-CG2 3.48Å
410	S	91.1	Very high	90.8	Very high	109 Å²	109	45.8 Å²	45.8	76%	0.762	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.7	29.4	-175.4	-54.6	0	0	0	0	114.1	L406 L407 K408 P412	L406-S410 PolarHBondContact O-N 3.48Å; L407-S410 WeakPolarHBondContact O-CA 3.49Å; L407-S410 PolarHBondContact O-N 3.26Å; K408-S410 PolarHBondContact O-N 3.12Å; S410-P412 WeakPolarHBondContact O-CD 3.36Å
411	I	89.7	Confident	90.2	Very high	7 Å²	7	44.3 Å²	44.3	4%	0.036	23%	0.231	C	C	.	.			trans	-97.9	106.6	176.6	-54	176.3	0	0	0	108.5	L406 E409 V413 V445 T452 K455 I456	L406-I411 CarbonylContact C-O 3.3Å; L406-I411 HydrophobicContact CB-CB 4.35Å; L406-I411 HydrophobicContact CD2-CD1 4.07Å; L406-I411 WeakPolarHBondContact O-CB 3.47Å; L406-I411 PolarHBondContact O-N 3.2Å; E409-I411 VanDerWaalsContact C-N 3.27Å; E409-I411 HydrophobicContact CB-CD1 4.11Å; E409-I411 HydrophobicContact CB-CG1 4.14Å; E409-I411 PolarHBondContact O-N 2.74Å; I411-V413 PolarHBondContact O-N 3.24Å; I411-V445 HydrophobicContact CG2-CB 4.33Å; I411-V445 HydrophobicContact CG2-CG1 4.23Å; I411-T452 HydrophobicContact CD1-CG2 3.73Å; I411-T452 HydrophobicContact CG1-CG2 3.99Å; I411-T452 HydrophobicContact CG2-CG2 3.95Å; I411-K455 HydrophobicContact CD1-CB 3.8Å; I411-K455 HydrophobicContact CD1-CD 4.4Å; I411-I456 HydrophobicContact CD1-CG1 3.91Å
412	P	88.5	Confident	90	Very high	71 Å²	71	42 Å²	42	46%	0.461	22%	0.219	S	C	.	.			trans	-73.3	112.6	-177.7	28.9	-33.8	0	0	0	111	S410 K414	S410-P412 WeakPolarHBondContact O-CD 3.36Å; P412-K414 PolarHBondContact O-N 3.4Å
413	V	90.1	Very high	89.8	Confident	26 Å²	26	41.7 Å²	41.7	16%	0.158	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	114.2	164.8	-174.7	0	0	0	0	107.7	L406 I411 I416 F443 V445	L406-V413 HydrophobicContact CB-CG2 3.92Å; L406-V413 HydrophobicContact CD1-CG2 3.74Å; L406-V413 HydrophobicContact CG-CG2 4.5Å; I411-V413 PolarHBondContact O-N 3.24Å; V413-I416 HydrophobicContact CG1-CD1 4.05Å; V413-I416 HydrophobicContact CG1-CG1 3.61Å; V413-F443 HydrophobicContact CG1-CD1 4.01Å; V413-F443 HydrophobicContact CG2-CD1 4.43Å; V413-V445 HydrophobicContact CB-CG1 4.47Å; V413-V445 HydrophobicContact CG2-CG1 3.99Å
414	K	88.1	Confident	89.5	Confident	130 Å²	130	39.9 Å²	39.9	57%	0.565	21%	0.211	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-82.6	-32.3	-178.4	-72	-157.7	-171.2	175.8	0	113.8	P412 Y444 L596	P412-K414 PolarHBondContact O-N 3.4Å; K414-Y444 PolarHBondContact N-O 2.87Å; K414-L596 HydrophobicContact CB-CD2 4.26Å; K414-L596 HydrophobicContact CD-CD1 4.29Å; K414-L596 HydrophobicContact CD-CD2 3.75Å; K414-L596 HydrophobicContact CG-CD2 3.86Å
415	E	90.4	Very high	89.2	Confident	33 Å²	33	36.6 Å²	36.6	15%	0.154	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.1	142.2	-170.5	-173.7	-176	28.2	0	0	108.6	R417 Y444 I613	E415-R417 VanDerWaalsContact CD-CZ 3.47Å; E415-R417 HydrophobicContact CG-CG 4.16Å; E415-R417 IonicContact OE1-CZ 2.91Å; E415-R417 IonicContact OE1-NE 3.15Å; E415-R417 PolarHBondContact OE1-NE 3.01Å; E415-R417 IonicContact OE1-NH2 2.91Å; E415-R417 PolarHBondContact OE1-NH2 2.95Å; E415-R417 IonicContact OE2-CZ 3.35Å; E415-R417 IonicContact OE2-NE 3.15Å; E415-R417 PolarHBondContact OE2-NE 2.75Å; E415-R417 IonicContact OE2-NH2 2.7Å; E415-R417 PolarHBondContact OE2-NH2 2.67Å; E415-Y444 HydrophobicContact CB-CD2 4.18Å; E415-Y444 HydrophobicContact CG-CD2 4.43Å; E415-Y444 PolarHBondContact O-N 2.95Å; E415-I613 HydrophobicContact CG-CG2 4.05Å; E415-I613 WeakPolarHBondContact OE2-CD1 3.26Å; E415-I613 WeakPolarHBondContact OE2-CG1 3.49Å
416	I	92.6	Very high	89	Confident	2 Å²	2	35.8 Å²	35.8	1%	0.01	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	128.6	172.6	-54	176.7	0	0	0	108.7	I399 R403 V413 I442 F443 L614 D615 L618	I399-I416 HydrophobicContact CG2-CD1 3.86Å; I399-I416 HydrophobicContact CG2-CG2 4.3Å; R403-I416 HydrophobicContact CB-CD1 4.12Å; R403-I416 HydrophobicContact CG-CD1 4.08Å; V413-I416 HydrophobicContact CG1-CD1 4.05Å; V413-I416 HydrophobicContact CG1-CG1 3.61Å; I416-I442 WeakPolarHBondContact CA-O 3.27Å; I416-F443 HydrophobicContact CD1-CD1 3.93Å; I416-F443 HydrophobicContact CD1-CE1 3.57Å; I416-F443 HydrophobicContact CD1-CZ 4.19Å; I416-F443 HydrophobicContact CG1-CD1 3.95Å; I416-F443 HydrophobicContact CG1-CE1 4.07Å; I416-F443 HydrophobicContact CG1-CG 4.49Å; I416-F443 HydrophobicContact CG2-CD2 4.4Å; I416-F443 HydrophobicContact CG2-CE1 4.42Å; I416-F443 HydrophobicContact CG2-CE2 4.22Å; I416-F443 HydrophobicContact CG2-CZ 4.24Å; I416-L614 HydrophobicContact CG2-CD1 4.18Å; I416-L614 WeakPolarHBondContact O-CB 3.17Å; I416-L614 PolarHBondContact O-N 3.01Å; I416-D615 PolarHBondContact N-OD1 3.38Å; I416-L618 HydrophobicContact CB-CD1 4.25Å; I416-L618 HydrophobicContact CD1-CD1 3.83Å
417	R	92.5	Very high	88.8	Confident	17 Å²	17	36.2 Å²	36.2	6%	0.064	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	151.8	178.1	-57.7	-164.9	-172.6	141.1	3.6	113.1	E415 I442 Y444 H611 I612 I613	E415-R417 VanDerWaalsContact CD-CZ 3.47Å; E415-R417 HydrophobicContact CG-CG 4.16Å; E415-R417 IonicContact OE1-CZ 2.91Å; E415-R417 IonicContact OE1-NE 3.15Å; E415-R417 PolarHBondContact OE1-NE 3.01Å; E415-R417 IonicContact OE1-NH2 2.91Å; E415-R417 PolarHBondContact OE1-NH2 2.95Å; E415-R417 IonicContact OE2-CZ 3.35Å; E415-R417 IonicContact OE2-NE 3.15Å; E415-R417 PolarHBondContact OE2-NE 2.75Å; E415-R417 IonicContact OE2-NH2 2.7Å; E415-R417 PolarHBondContact OE2-NH2 2.67Å; R417-I442 HydrophobicContact CB-CB 4.42Å; R417-I442 PolarHBondContact N-O 3.46Å; R417-I442 PolarHBondContact O-N 3.28Å; R417-Y444 HydrophobicContact CG-CD2 4.44Å; R417-Y444 HydrophobicContact CG-CE2 3.93Å; R417-Y444 PolarHBondContact NH1-OH 2.98Å; R417-H611 HydrophobicContact CB-CB 4.22Å; R417-H611 HydrophobicContact CG-CB 4.49Å; R417-I612 CarbonylContact C-O 3.57Å; R417-I612 WeakPolarHBondContact CA-O 3.37Å; R417-I612 WeakPolarHBondContact CB-O 3.19Å; R417-I613 HydrophobicContact CG-CG1 4.24Å
418	L	91.4	Very high	88.3	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	137.8	168.5	-178.6	64.5	0	0	0	108.7	L256 V422 I426 I439 L441 H611 I612 L614	L256-L418 HydrophobicContact CD1-CD2 3.64Å; L418-V422 HydrophobicContact CD1-CB 4.47Å; L418-V422 HydrophobicContact CD1-CG1 4.03Å; L418-V422 HydrophobicContact CD2-CG1 3.72Å; L418-V422 HydrophobicContact CG-CG1 4Å; L418-I426 HydrophobicContact CD2-CD1 3.74Å; L418-I439 HydrophobicContact CD1-CG2 3.98Å; L418-L441 HydrophobicContact CD1-CD2 3.87Å; L418-H611 CarbonylContact O-C 3.5Å; L418-H611 WeakPolarHBondContact O-CA 3.47Å; L418-I612 HydrophobicContact CB-CB 4.38Å; L418-I612 PolarHBondContact N-O 3.21Å; L418-I612 PolarHBondContact O-N 3.28Å; L418-L614 HydrophobicContact CB-CD1 4.19Å; L418-L614 HydrophobicContact CB-CD2 3.99Å; L418-L614 HydrophobicContact CB-CG 4.21Å; L418-L614 HydrophobicContact CD2-CD2 4.44Å
419	N	87.8	Confident	87.3	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	176.1	-173.3	-172.5	32.3	0	0	0	112.4	E440 I442 N603 Y608 L610 H611	N419-E440 HydrophobicContact CB-CB 3.88Å; N419-E440 PolarHBondContact N-O 3.12Å; N419-E440 PolarHBondContact ND2-OE2 2.87Å; N419-I442 HydrophobicContact CB-CD1 3.77Å; N419-I442 HydrophobicContact CB-CG1 4.43Å; N419-N603 PolarHBondContact ND2-ND2 3.49Å; N419-Y608 PolarHBondContact OD1-O 3.48Å; N419-L610 PolarHBondContact OD1-O 3.32Å; N419-H611 VanDerWaalsContact CG-CD2 3.41Å; N419-H611 VanDerWaalsContact CG-NE2 3.32Å; N419-H611 PolarHBondContact OD1-CD2 3.23Å; N419-H611 PolarHBondContact OD1-NE2 3.5Å; N419-H611 VanDerWaalsContact OD1-NE2 3.16Å
420	G	80.5	Confident	85.9	Confident	2 Å²	2	25.6 Å²	25.6	2%	0.021	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	-159.5	167.5	0	0	0	0	0	113.6	V422 A423 S424	G420-V422 PolarHBondContact O-N 2.95Å; G420-A423 PolarHBondContact O-N 3.23Å; G420-S424 PolarHBondContact O-N 2.85Å
421	D	79.9	Confident	84.3	Confident	12 Å²	12	28.7 Å²	28.7	6%	0.064	15%	0.152	C	C	.	.	H	α-helix	trans	-51	-34.4	-178.6	-58.8	-9.1	0	0	0	111.8	S425 F436 Y608 K679	D421-S425 WeakPolarHBondContact O-CB 3.27Å; D421-S425 PolarHBondContact O-N 3.26Å; D421-S425 PolarHBondContact O-OG 3.39Å; D421-F436 HydrophobicContact CB-CB 3.58Å; D421-Y608 WeakPolarHBondContact OD1-CE1 3.21Å; D421-Y608 PolarHBondContact OD1-OH 2.95Å; D421-K679 IonicContact OD1-NZ 2.74Å; D421-K679 IonicContact OD2-NZ 2.73Å; D421-K679 PolarHBondContact OD2-NZ 2.98Å
422	V	85.7	Confident	82.8	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-60.5	-51	175.3	175.5	0	0	0	0	111.9	I259 L418 G420 S424 S425 I426 F436 D438 I439	I259-V422 HydrophobicContact CD1-CG1 4.29Å; I259-V422 HydrophobicContact CG2-CG1 4.27Å; L418-V422 HydrophobicContact CD1-CB 4.47Å; L418-V422 HydrophobicContact CD1-CG1 4.03Å; L418-V422 HydrophobicContact CD2-CG1 3.72Å; L418-V422 HydrophobicContact CG-CG1 4Å; G420-V422 PolarHBondContact O-N 2.95Å; V422-S424 VanDerWaalsContact C-N 3.33Å; V422-S424 PolarHBondContact O-N 3.32Å; V422-S425 PolarHBondContact O-N 2.96Å; V422-S425 PolarHBondContact O-OG 3.31Å; V422-I426 HydrophobicContact CG1-CD1 3.73Å; V422-I426 HydrophobicContact CG1-CG1 4.42Å; V422-I426 WeakPolarHBondContact O-CG1 3.28Å; V422-I426 PolarHBondContact O-N 2.83Å; V422-F436 HydrophobicContact CB-CB 4.49Å; V422-F436 HydrophobicContact CB-CG 4.37Å; V422-F436 HydrophobicContact CG2-CB 3.78Å; V422-F436 HydrophobicContact CG2-CD1 4.12Å; V422-F436 HydrophobicContact CG2-CD2 3.31Å; V422-F436 HydrophobicContact CG2-CE2 3.79Å; V422-F436 HydrophobicContact CG2-CG 3.49Å; V422-F436 VanDerWaalsContact CG2-CG 3.49Å; V422-F436 HydrophobicContact CG2-CZ 4.37Å; V422-D438 VanDerWaalsContact CG2-O 3.24Å; V422-D438 WeakPolarHBondContact CG2-O 3.47Å; V422-I439 HydrophobicContact CG2-CB 4.48Å; V422-I439 HydrophobicContact CG2-CG1 4.07Å
423	A	89.3	Confident	81.2	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-60.9	-45.6	-176.9	0	0	0	0	0	110.6	G420 I426 I427 L610 I612	G420-A423 PolarHBondContact O-N 3.23Å; A423-I426 PolarHBondContact O-N 3.45Å; A423-I427 WeakPolarHBondContact O-CD1 3.27Å; A423-I427 VanDerWaalsContact O-CG1 3.23Å; A423-I427 WeakPolarHBondContact O-CG1 3.5Å; A423-I427 PolarHBondContact O-N 3.2Å; A423-L610 WeakPolarHBondContact CB-O 3.38Å; A423-I612 HydrophobicContact CB-CD1 4.14Å; A423-I612 HydrophobicContact CB-CG1 4.02Å
424	S	86.5	Confident	79.9	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-59.8	-46.5	174.2	-63.5	0	0	0	0	111.9	G420 V422 I426 I427 I428 T607	G420-S424 PolarHBondContact O-N 2.85Å; V422-S424 VanDerWaalsContact C-N 3.33Å; V422-S424 PolarHBondContact O-N 3.32Å; S424-I426 VanDerWaalsContact C-N 3.35Å; S424-I426 PolarHBondContact O-N 3.25Å; S424-I427 PolarHBondContact O-N 2.96Å; S424-I427 VanDerWaalsContact O-N 3.08Å; S424-I428 WeakPolarHBondContact O-CG1 3.41Å; S424-I428 PolarHBondContact O-N 3.4Å; S424-T607 PolarHBondContact OG-O 2.99Å
425	S	86.6	Confident	78.9	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-61.2	-37.4	178.3	76.7	0	0	0	0	113.9	D421 V422 I427 G429 Q434 F436	D421-S425 WeakPolarHBondContact O-CB 3.27Å; D421-S425 PolarHBondContact O-N 3.26Å; D421-S425 PolarHBondContact O-OG 3.39Å; V422-S425 PolarHBondContact O-N 2.96Å; V422-S425 PolarHBondContact O-OG 3.31Å; S425-I427 VanDerWaalsContact C-N 3.25Å; S425-I427 PolarHBondContact O-N 3.37Å; S425-G429 PolarHBondContact O-N 3.4Å; S425-Q434 VanDerWaalsContact CB-O 3.29Å; S425-Q434 WeakPolarHBondContact CB-O 3.41Å; S425-F436 WeakPolarHBondContact OG-CD1 3.4Å
426	I	89.3	Confident	78	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-64.3	-35.1	176.4	-71.9	165.1	0	0	0	111.1	L248 Q252 Y255 L256 I259 L418 V422 A423 S424 I612	L248-I426 HydrophobicContact CD1-CG2 4.22Å; Q252-I426 HydrophobicContact CB-CG2 4.45Å; Q252-I426 WeakPolarHBondContact CG-O 3.47Å; Y255-I426 HydrophobicContact CD1-CB 4.45Å; Y255-I426 HydrophobicContact CD1-CG1 4.12Å; Y255-I426 HydrophobicContact CE1-CG1 4.21Å; L256-I426 HydrophobicContact CB-CD1 4.26Å; L256-I426 HydrophobicContact CB-CG2 4.29Å; L256-I426 HydrophobicContact CD1-CD1 3.78Å; I259-I426 HydrophobicContact CD1-CD1 3.72Å; I259-I426 HydrophobicContact CD1-CG1 3.55Å; L418-I426 HydrophobicContact CD2-CD1 3.74Å; V422-I426 HydrophobicContact CG1-CD1 3.73Å; V422-I426 HydrophobicContact CG1-CG1 4.42Å; V422-I426 WeakPolarHBondContact O-CG1 3.28Å; V422-I426 PolarHBondContact O-N 2.83Å; A423-I426 PolarHBondContact O-N 3.45Å; S424-I426 VanDerWaalsContact C-N 3.35Å; S424-I426 PolarHBondContact O-N 3.25Å; I426-I612 HydrophobicContact CB-CD1 3.92Å; I426-I612 HydrophobicContact CD1-CD1 3.87Å; I426-I612 HydrophobicContact CG2-CD1 3.76Å
427	I	87.3	Confident	77	Confident	9 Å²	9	36.9 Å²	36.9	5%	0.046	19%	0.193	C	C	.	.	H	α-helix	trans	-84.6	-38.1	-171.6	-67	162.1	0	0	0	111.8	L248 Q252 A423 S424 S425 G429 L610 I612 V642 Y649 I653	L248-I427 HydrophobicContact CD2-CG1 4.07Å; Q252-I427 PolarHBondContact NE2-O 2.75Å; A423-I427 WeakPolarHBondContact O-CD1 3.27Å; A423-I427 VanDerWaalsContact O-CG1 3.23Å; A423-I427 WeakPolarHBondContact O-CG1 3.5Å; A423-I427 PolarHBondContact O-N 3.2Å; S424-I427 PolarHBondContact O-N 2.96Å; S424-I427 VanDerWaalsContact O-N 3.08Å; S425-I427 VanDerWaalsContact C-N 3.25Å; S425-I427 PolarHBondContact O-N 3.37Å; I427-G429 VanDerWaalsContact C-N 3.3Å; I427-L610 HydrophobicContact CD1-CB 4.04Å; I427-L610 HydrophobicContact CD1-CD1 3.79Å; I427-L610 HydrophobicContact CD1-CD2 4.39Å; I427-L610 HydrophobicContact CD1-CG 4.3Å; I427-I612 HydrophobicContact CD1-CD1 4.31Å; I427-I612 HydrophobicContact CD1-CG1 4.26Å; I427-I612 HydrophobicContact CG1-CD1 4.35Å; I427-V642 HydrophobicContact CD1-CB 4.34Å; I427-V642 HydrophobicContact CD1-CG1 3.51Å; I427-V642 HydrophobicContact CD1-CG2 3.86Å; I427-V642 HydrophobicContact CG1-CG2 4.1Å; I427-Y649 HydrophobicContact CG2-CE2 4.06Å; I427-Y649 WeakPolarHBondContact CG2-OH 3.45Å; I427-I653 HydrophobicContact CG2-CD1 3.51Å; I427-I653 HydrophobicContact CG2-CG1 4.47Å
428	I	83.3	Confident	76.1	Confident	43 Å²	43	36.4 Å²	36.4	22%	0.221	19%	0.192	C	C	.	.	H	α-helix	trans	-60.4	-44.3	170.2	-59.9	161.6	0	0	0	109.6	S424 D432 Q434 I656 L657	S424-I428 WeakPolarHBondContact O-CG1 3.41Å; S424-I428 PolarHBondContact O-N 3.4Å; I428-D432 HydrophobicContact CG2-CB 3.73Å; I428-Q434 HydrophobicContact CD1-CB 3.96Å; I428-I656 HydrophobicContact CD1-CG2 3.56Å; I428-I656 HydrophobicContact CG1-CG2 3.72Å; I428-L657 HydrophobicContact CG2-CD2 4.14Å
429	G	71.6	Confident	75.6	Confident	14 Å²	14	36.5 Å²	36.5	14%	0.144	19%	0.192	C	C	.	.			trans	113.9	-174	174.7	0	0	0	0	0	113.7	S425 I427	S425-G429 PolarHBondContact O-N 3.4Å; I427-G429 VanDerWaalsContact C-N 3.3Å
430	S	60.7	Low	75.5	Confident	62 Å²	62	38 Å²	38	43%	0.434	20%	0.199	S	C	.	.	S	Bend	trans	-86.2	-5.4	-169.8	57.3	0	0	0	0	115.2	K433	S430-K433 WeakPolarHBondContact O-CE 3.36Å; S430-K433 VanDerWaalsContact O-CG 3.28Å; S430-K433 WeakPolarHBondContact O-CG 3.38Å
431	Q	57.8	Low	75.9	Confident	174 Å²	174	38 Å²	38	81%	0.813	20%	0.199	S	C	*	.	S	Bend	trans	-86.9	-62.9	178.5	-58.4	-172.4	17.8	0	0	109.8	K433	Q431-K433 VanDerWaalsContact C-N 3.3Å; Q431-K433 PolarHBondContact O-N 3.01Å
432	D	58.4	Low	76.3	Confident	115 Å²	115	37.4 Å²	37.4	62%	0.615	20%	0.196	S	C	*	.	S	Bend	trans	-82.3	72.5	174.1	-54.7	-52.8	0	0	0	111.1	I428 Q434	I428-D432 HydrophobicContact CG2-CB 3.73Å; D432-Q434 VanDerWaalsContact C-N 3.34Å; D432-Q434 PolarHBondContact O-N 3.36Å
433	K	56	Low	76.5	Confident	158 Å²	158	37.4 Å²	37.4	69%	0.687	20%	0.196	S	C	*	.			trans	-67	81.9	-174.6	-66	-178.4	-176.4	171.6	0	113.1	S430 Q431 S435	S430-K433 WeakPolarHBondContact O-CE 3.36Å; S430-K433 VanDerWaalsContact O-CG 3.28Å; S430-K433 WeakPolarHBondContact O-CG 3.38Å; Q431-K433 VanDerWaalsContact C-N 3.3Å; Q431-K433 PolarHBondContact O-N 3.01Å; K433-S435 PolarHBondContact O-N 3.08Å; K433-S435 VanDerWaalsContact O-N 3.14Å
434	Q	61.9	Low	76.5	Confident	38 Å²	38	38.6 Å²	38.6	18%	0.178	20%	0.201	C	C	.	.			trans	-57.4	118.1	168.2	177.4	158.8	70.5	0	0	110.5	S425 I428 D432 F436 Y685	S425-Q434 VanDerWaalsContact CB-O 3.29Å; S425-Q434 WeakPolarHBondContact CB-O 3.41Å; I428-Q434 HydrophobicContact CD1-CB 3.96Å; D432-Q434 VanDerWaalsContact C-N 3.34Å; D432-Q434 PolarHBondContact O-N 3.36Å; Q434-F436 PolarHBondContact O-N 2.98Å; Q434-Y685 PolarHBondContact NE2-OH 3.28Å
435	S	67.3	Low	76.5	Confident	73 Å²	73	38.6 Å²	38.6	51%	0.51	20%	0.201	S	C	.	.			trans	-72	110.1	-178.6	55.2	0	0	0	0	111.5	K433	K433-S435 PolarHBondContact O-N 3.08Å; K433-S435 VanDerWaalsContact O-N 3.14Å
436	F	72.3	Confident	76.4	Confident	22 Å²	22	41.3 Å²	41.3	10%	0.096	22%	0.215	C	C	.	.			trans	-87.1	139	169.9	62.5	-94.8	0	0	0	112	I259 D421 V422 S425 Q434 I439 K587	I259-F436 HydrophobicContact CD1-CE1 4.31Å; I259-F436 HydrophobicContact CD1-CZ 4.47Å; I259-F436 HydrophobicContact CG1-CZ 4.49Å; D421-F436 HydrophobicContact CB-CB 3.58Å; V422-F436 HydrophobicContact CB-CB 4.49Å; V422-F436 HydrophobicContact CB-CG 4.37Å; V422-F436 HydrophobicContact CG2-CB 3.78Å; V422-F436 HydrophobicContact CG2-CD1 4.12Å; V422-F436 HydrophobicContact CG2-CD2 3.31Å; V422-F436 HydrophobicContact CG2-CE2 3.79Å; V422-F436 HydrophobicContact CG2-CG 3.49Å; V422-F436 VanDerWaalsContact CG2-CG 3.49Å; V422-F436 HydrophobicContact CG2-CZ 4.37Å; S425-F436 WeakPolarHBondContact OG-CD1 3.4Å; Q434-F436 PolarHBondContact O-N 2.98Å; F436-I439 HydrophobicContact CE2-CG1 4.31Å; F436-K587 HydrophobicContact CD2-CD 3.76Å; F436-K587 VanDerWaalsContact CD2-NZ 3.3Å; F436-K587 HydrophobicContact CE2-CD 3.57Å; F436-K587 HydrophobicContact CZ-CD 4.45Å; F436-K587 WeakPolarHBondContact O-CD 3.44Å; F436-K587 VanDerWaalsContact O-CE 3.28Å; F436-K587 WeakPolarHBondContact O-CE 3.28Å; F436-K587 PolarHBondContact O-NZ 2.94Å
437	H	69.7	Low	76.1	Confident	35 Å²	35	43.3 Å²	43.3	16%	0.162	23%	0.225	C	C	.	.			trans	-104.7	-28.3	175.9	-55.9	-97.5	0	0	0	112.6	K587 L588 Y725	H437-K587 WeakPolarHBondContact O-CA 3Å; H437-K587 VanDerWaalsContact O-CB 3.31Å; H437-K587 WeakPolarHBondContact O-CB 3.31Å; H437-L588 PolarHBondContact O-N 3.38Å; H437-Y725 HydrophobicContact CB-CD1 3.89Å; H437-Y725 HydrophobicContact CB-CE1 4.3Å; H437-Y725 PolarHBondContact CE1-O 3.47Å; H437-Y725 PolarHBondContact ND1-O 2.78Å
438	D	74.4	Confident	75.7	Confident	7 Å²	7	47.2 Å²	47.2	4%	0.037	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138.2	-178.4	-66.4	-25.8	0	0	0	111.5	V422 L588 H590 Y725	V422-D438 VanDerWaalsContact CG2-O 3.24Å; V422-D438 WeakPolarHBondContact CG2-O 3.47Å; D438-L588 CarbonylContact C-O 3.43Å; D438-L588 VanDerWaalsContact CA-O 3.31Å; D438-L588 WeakPolarHBondContact CA-O 3.29Å; D438-L588 WeakPolarHBondContact OD1-CB 3.38Å; D438-H590 IonicContact OD1-CD2 2.65Å; D438-Y725 WeakPolarHBondContact OD2-CE1 3.22Å; D438-Y725 VanDerWaalsContact OD2-CZ 3.23Å; D438-Y725 PolarHBondContact OD2-OH 2.95Å
439	I	81.7	Confident	75.5	Confident	2 Å²	2	49 Å²	49	1%	0.01	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	100.5	164	-55.8	178.2	0	0	0	108.3	I264 L395 L418 V422 F436 L441 L588 C589 H590	I264-I439 HydrophobicContact CD1-CD1 4.14Å; I264-I439 HydrophobicContact CG1-CD1 4.35Å; L395-I439 HydrophobicContact CD2-CG2 4.15Å; L418-I439 HydrophobicContact CD1-CG2 3.98Å; V422-I439 HydrophobicContact CG2-CB 4.48Å; V422-I439 HydrophobicContact CG2-CG1 4.07Å; F436-I439 HydrophobicContact CE2-CG1 4.31Å; I439-L441 HydrophobicContact CG2-CD2 4.35Å; I439-L441 HydrophobicContact CG2-CG 4.41Å; I439-L588 PolarHBondContact N-O 2.85Å; I439-C589 HydrophobicContact CB-CB 4.49Å; I439-H590 PolarHBondContact O-N 2.87Å
440	E	84.7	Confident	75.8	Confident	31 Å²	31	53.1 Å²	53.1	15%	0.145	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	119.8	175.8	-73.9	-169.9	-148.8	0	0	111.9	N419 H590	N419-E440 HydrophobicContact CB-CB 3.88Å; N419-E440 PolarHBondContact N-O 3.12Å; N419-E440 PolarHBondContact ND2-OE2 2.87Å; E440-H590 WeakPolarHBondContact CA-O 3.45Å; E440-H590 HydrophobicContact CG-CB 4.24Å
441	L	88.5	Confident	76.9	Confident	3 Å²	3	53.6 Å²	53.6	2%	0.016	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	133.1	174.8	-60.5	174.3	0	0	0	110.6	L395 I399 L418 I439 F443 H590 L591 S592	L395-L441 HydrophobicContact CD1-CD1 3.72Å; L395-L441 HydrophobicContact CD1-CD2 4.13Å; L395-L441 HydrophobicContact CD1-CG 4.42Å; I399-L441 HydrophobicContact CD1-CD1 4.3Å; I399-L441 HydrophobicContact CD1-CD2 4Å; I399-L441 HydrophobicContact CG1-CD1 3.95Å; I399-L441 HydrophobicContact CG1-CD2 4.49Å; L418-L441 HydrophobicContact CD1-CD2 3.87Å; I439-L441 HydrophobicContact CG2-CD2 4.35Å; I439-L441 HydrophobicContact CG2-CG 4.41Å; L441-F443 HydrophobicContact CB-CE2 4.23Å; L441-H590 PolarHBondContact N-O 3.08Å; L441-L591 HydrophobicContact CB-CD1 4.16Å; L441-S592 WeakPolarHBondContact O-CA 3.36Å; L441-S592 WeakPolarHBondContact O-CB 3.48Å; L441-S592 PolarHBondContact O-N 3Å
442	I	89.1	Confident	78.2	Confident	0 Å²	0	46 Å²	46	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	115.3	-179.7	-61.8	171.6	0	0	0	109.8	I416 R417 N419 Y444 S592 R594 H611	I416-I442 WeakPolarHBondContact CA-O 3.27Å; R417-I442 HydrophobicContact CB-CB 4.42Å; R417-I442 PolarHBondContact N-O 3.46Å; R417-I442 PolarHBondContact O-N 3.28Å; N419-I442 HydrophobicContact CB-CD1 3.77Å; N419-I442 HydrophobicContact CB-CG1 4.43Å; I442-Y444 HydrophobicContact CG2-CD2 3.98Å; I442-Y444 HydrophobicContact CG2-CE2 3.53Å; I442-S592 WeakPolarHBondContact CA-O 3.31Å; I442-R594 HydrophobicContact CG2-CB 4.15Å; I442-R594 HydrophobicContact CG2-CG 3.93Å; I442-H611 WeakPolarHBondContact CD1-CE1 3.05Å
443	F	90.4	Very high	79.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	119.5	172.6	-72.8	-112.9	0	0	0	109.4	I399 I402 R403 L406 V413 I416 L441 L591 S592 L593 R594	I399-F443 HydrophobicContact CG2-CZ 4.15Å; I402-F443 HydrophobicContact CB-CE1 4.37Å; I402-F443 HydrophobicContact CB-CZ 4.26Å; I402-F443 HydrophobicContact CG2-CD1 4.49Å; I402-F443 HydrophobicContact CG2-CE1 3.89Å; I402-F443 HydrophobicContact CG2-CZ 3.98Å; R403-F443 HydrophobicContact CB-CE1 4.38Å; L406-F443 HydrophobicContact CD1-CD1 4.25Å; V413-F443 HydrophobicContact CG1-CD1 4.01Å; V413-F443 HydrophobicContact CG2-CD1 4.43Å; I416-F443 HydrophobicContact CD1-CD1 3.93Å; I416-F443 HydrophobicContact CD1-CE1 3.57Å; I416-F443 HydrophobicContact CD1-CZ 4.19Å; I416-F443 HydrophobicContact CG1-CD1 3.95Å; I416-F443 HydrophobicContact CG1-CE1 4.07Å; I416-F443 HydrophobicContact CG1-CG 4.49Å; I416-F443 HydrophobicContact CG2-CD2 4.4Å; I416-F443 HydrophobicContact CG2-CE1 4.42Å; I416-F443 HydrophobicContact CG2-CE2 4.22Å; I416-F443 HydrophobicContact CG2-CZ 4.24Å; L441-F443 HydrophobicContact CB-CE2 4.23Å; F443-L591 HydrophobicContact CD2-CD1 3.64Å; F443-L591 HydrophobicContact CE2-CD1 3.44Å; F443-L591 VanDerWaalsContact CE2-CD1 3.44Å; F443-L591 HydrophobicContact CZ-CD1 4.47Å; F443-S592 PolarHBondContact N-O 3.16Å; F443-S592 VanDerWaalsContact N-O 3.07Å; F443-L593 HydrophobicContact CB-CD2 3.86Å; F443-L593 HydrophobicContact CB-CG 4.23Å; F443-R594 PolarHBondContact O-N 2.9Å
444	Y	87.9	Confident	80.7	Confident	25 Å²	25	40.4 Å²	40.4	10%	0.098	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	110.1	175.1	-74.8	-89.3	0	0	0	110.4	K414 E415 R417 I442	K414-Y444 PolarHBondContact N-O 2.87Å; E415-Y444 HydrophobicContact CB-CD2 4.18Å; E415-Y444 HydrophobicContact CG-CD2 4.43Å; E415-Y444 PolarHBondContact O-N 2.95Å; R417-Y444 HydrophobicContact CG-CD2 4.44Å; R417-Y444 HydrophobicContact CG-CE2 3.93Å; R417-Y444 PolarHBondContact NH1-OH 2.98Å; I442-Y444 HydrophobicContact CG2-CD2 3.98Å; I442-Y444 HydrophobicContact CG2-CE2 3.53Å
445	V	87.4	Confident	82	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	153.5	-173.6	-72.7	0	0	0	0	111.7	L406 I411 V413 L447 I456 L593 R594 H595 L596	L406-V445 HydrophobicContact CD1-CG1 4.47Å; I411-V445 HydrophobicContact CG2-CB 4.33Å; I411-V445 HydrophobicContact CG2-CG1 4.23Å; V413-V445 HydrophobicContact CB-CG1 4.47Å; V413-V445 HydrophobicContact CG2-CG1 3.99Å; V445-L447 HydrophobicContact CG2-CD2 3.83Å; V445-L447 HydrophobicContact CG2-CG 4.14Å; V445-L447 PolarHBondContact O-N 2.82Å; V445-I456 HydrophobicContact CG2-CD1 4.05Å; V445-L593 HydrophobicContact CG1-CD2 4.5Å; V445-L593 HydrophobicContact CG2-CB 4.36Å; V445-L593 HydrophobicContact CG2-CD2 3.98Å; V445-R594 PolarHBondContact N-O 2.93Å; V445-H595 WeakPolarHBondContact O-CA 3.44Å; V445-L596 WeakPolarHBondContact O-CG 3.36Å; V445-L596 PolarHBondContact O-N 3.48Å
446	D	84.4	Confident	83	Confident	56 Å²	56	39.4 Å²	39.4	30%	0.299	22%	0.223	S	C	.	.			trans	-73.1	128.1	171.2	-150.6	-38.7	0	0	0	110.6	S448 T452 H595 L596	D446-S448 VanDerWaalsContact OD1-CB 3.24Å; D446-S448 WeakPolarHBondContact OD1-CB 3.25Å; D446-S448 PolarHBondContact OD1-N 3.05Å; D446-S448 PolarHBondContact OD1-OG 2.91Å; D446-T452 WeakPolarHBondContact O-CG2 3.46Å; D446-H595 IonicContact OD1-CE1 3.24Å; D446-H595 PolarHBondContact OD1-CE1 2.99Å; D446-L596 HydrophobicContact CB-CD1 3.67Å; D446-L596 HydrophobicContact CB-CG 4.25Å; D446-L596 WeakPolarHBondContact OD2-CD1 3.46Å
447	L	82.5	Confident	83.7	Confident	42 Å²	42	43 Å²	43	22%	0.22	24%	0.239	C	C	.	.			trans	-126.3	11.1	-179.6	-57.3	179.5	0	0	0	111.1	V445 N449 I456 H595	V445-L447 HydrophobicContact CG2-CD2 3.83Å; V445-L447 HydrophobicContact CG2-CG 4.14Å; V445-L447 PolarHBondContact O-N 2.82Å; L447-N449 PolarHBondContact O-N 2.7Å; L447-I456 HydrophobicContact CD2-CD1 3.36Å; L447-H595 HydrophobicContact CB-CB 4.36Å; L447-H595 HydrophobicContact CD1-CB 4.07Å; L447-H595 HydrophobicContact CG-CB 4.4Å; L447-H595 PolarHBondContact N-CE1 3.3Å; L447-H595 VanDerWaalsContact N-CE1 3.3Å; L447-H595 PolarHBondContact N-ND1 3.06Å; L447-H595 VanDerWaalsContact N-ND1 3.12Å
448	S	78.8	Confident	84.5	Confident	92 Å²	92	45 Å²	45	64%	0.643	26%	0.257	S	S	*	.	S	Bend	trans	-65.3	-22	179.8	56.5	0	0	0	0	113.2	D446 H595	D446-S448 VanDerWaalsContact OD1-CB 3.24Å; D446-S448 WeakPolarHBondContact OD1-CB 3.25Å; D446-S448 PolarHBondContact OD1-N 3.05Å; D446-S448 PolarHBondContact OD1-OG 2.91Å; S448-H595 PolarHBondContact N-CE1 2.68Å
449	N	79	Confident	85.2	Confident	81 Å²	81	45.2 Å²	45.2	43%	0.433	26%	0.259	S	S	.	.	S	Bend	trans	-97.2	120.7	168.7	171.8	-2.1	0	0	0	109.3	L447 T451 T452	L447-N449 PolarHBondContact O-N 2.7Å; N449-T451 VanDerWaalsContact C-N 3.26Å; N449-T451 VanDerWaalsContact CG-OG1 3.22Å; N449-T451 PolarHBondContact ND2-OG1 3.25Å; N449-T451 VanDerWaalsContact ND2-OG1 3.14Å; N449-T451 PolarHBondContact O-N 2.91Å; N449-T451 WeakPolarHBondContact OD1-CB 3.35Å; N449-T451 PolarHBondContact OD1-N 3.37Å; N449-T451 PolarHBondContact OD1-OG1 2.76Å; N449-T452 VanDerWaalsContact O-CB 3.27Å; N449-T452 WeakPolarHBondContact O-CB 3.4Å; N449-T452 PolarHBondContact O-N 2.76Å; N449-T452 PolarHBondContact O-OG1 3.37Å
450	S	78	Confident	85.5	Confident	99 Å²	99	46.1 Å²	46.1	69%	0.692	26%	0.264	S	S	*	.	H	α-helix	trans	-60	-30.8	-178	54.4	0	0	0	0	113.9	T452 C453	S450-T452 PolarHBondContact O-N 3.43Å; S450-C453 PolarHBondContact O-N 3.43Å
451	T	85.6	Confident	85.5	Confident	73 Å²	73	47.5 Å²	47.5	45%	0.448	27%	0.268	S	S	.	.	H	α-helix	trans	-66.2	-23.8	177.2	65.5	0	0	0	0	112.7	N449 C453 N454 K455	N449-T451 VanDerWaalsContact C-N 3.26Å; N449-T451 VanDerWaalsContact CG-OG1 3.22Å; N449-T451 PolarHBondContact ND2-OG1 3.25Å; N449-T451 VanDerWaalsContact ND2-OG1 3.14Å; N449-T451 PolarHBondContact O-N 2.91Å; N449-T451 WeakPolarHBondContact OD1-CB 3.35Å; N449-T451 PolarHBondContact OD1-N 3.37Å; N449-T451 PolarHBondContact OD1-OG1 2.76Å; T451-C453 VanDerWaalsContact C-N 3.3Å; T451-C453 PolarHBondContact O-N 3.17Å; T451-N454 PolarHBondContact O-N 3.16Å; T451-N454 VanDerWaalsContact O-N 3.16Å; T451-K455 PolarHBondContact O-N 3.49Å
452	T	84.2	Confident	85.4	Confident	15 Å²	15	50.1 Å²	50.1	9%	0.092	29%	0.287	C	S	.	.	H	α-helix	trans	-63.6	-36.1	-178.6	-44.2	0	0	0	0	111.6	I411 D446 N449 S450 N454 K455 I456	I411-T452 HydrophobicContact CD1-CG2 3.73Å; I411-T452 HydrophobicContact CG1-CG2 3.99Å; I411-T452 HydrophobicContact CG2-CG2 3.95Å; D446-T452 WeakPolarHBondContact O-CG2 3.46Å; N449-T452 VanDerWaalsContact O-CB 3.27Å; N449-T452 WeakPolarHBondContact O-CB 3.4Å; N449-T452 PolarHBondContact O-N 2.76Å; N449-T452 PolarHBondContact O-OG1 3.37Å; S450-T452 PolarHBondContact O-N 3.43Å; T452-N454 VanDerWaalsContact C-N 3.31Å; T452-N454 PolarHBondContact O-N 2.79Å; T452-K455 PolarHBondContact O-N 2.77Å; T452-I456 HydrophobicContact CG2-CD1 3.97Å; T452-I456 HydrophobicContact CG2-CG1 4.35Å; T452-I456 WeakPolarHBondContact O-CB 3.35Å; T452-I456 WeakPolarHBondContact O-CD1 3.49Å; T452-I456 WeakPolarHBondContact O-CG1 3.45Å; T452-I456 PolarHBondContact O-N 3.01Å
453	C	82.6	Confident	85.3	Confident	53 Å²	53	50.6 Å²	50.6	36%	0.358	29%	0.29	S	S	.	.	H	α-helix	trans	-59.9	-40.1	175.6	-64.8	0	0	0	0	112.4	S450 T451 K457	S450-C453 PolarHBondContact O-N 3.43Å; T451-C453 VanDerWaalsContact C-N 3.3Å; T451-C453 PolarHBondContact O-N 3.17Å; C453-K457 WeakPolarHBondContact O-CG 3.08Å; C453-K457 PolarHBondContact O-N 3.5Å; C453-K457 VanDerWaalsContact O-N 3.09Å
454	N	84.3	Confident	85.1	Confident	101 Å²	101	51 Å²	51	54%	0.54	29%	0.292	S	S	.	.	H	α-helix	trans	-75.1	-37.3	177.9	-70	-13.5	0	0	0	111.9	T451 T452 K457 S458	T451-N454 PolarHBondContact O-N 3.16Å; T451-N454 VanDerWaalsContact O-N 3.16Å; T452-N454 VanDerWaalsContact C-N 3.31Å; T452-N454 PolarHBondContact O-N 2.79Å; N454-K457 PolarHBondContact O-N 3.24Å; N454-S458 WeakPolarHBondContact O-CB 3.21Å; N454-S458 PolarHBondContact O-N 3.4Å
455	K	88.5	Confident	84.7	Confident	81 Å²	81	50 Å²	50	35%	0.352	29%	0.289	S	S	.	.	H	α-helix	trans	-59	-46.2	169.5	-76.3	176.3	160.5	-104.1	0	111.7	E409 I411 T451 T452 K457 S458 V459	E409-K455 IonicContact OE2-NZ 2.68Å; E409-K455 PolarHBondContact OE2-NZ 3.47Å; I411-K455 HydrophobicContact CD1-CB 3.8Å; I411-K455 HydrophobicContact CD1-CD 4.4Å; T451-K455 PolarHBondContact O-N 3.49Å; T452-K455 PolarHBondContact O-N 2.77Å; K455-K457 PolarHBondContact O-N 3.13Å; K455-S458 WeakPolarHBondContact O-CB 3.23Å; K455-S458 PolarHBondContact O-N 3.46Å; K455-V459 WeakPolarHBondContact O-CG2 3.45Å; K455-V459 PolarHBondContact O-N 3.44Å
456	I	88.3	Confident	84.6	Confident	9 Å²	9	54 Å²	54	5%	0.046	31%	0.311	C	S	.	.	H	α-helix	trans	-58.7	-48	177.5	-72.5	162.6	0	0	0	110.9	L406 I411 V445 L447 T452 S458 V459 V460 L593	L406-I456 HydrophobicContact CD2-CB 4.31Å; L406-I456 HydrophobicContact CD2-CG1 3.72Å; L406-I456 HydrophobicContact CD2-CG2 4.45Å; I411-I456 HydrophobicContact CD1-CG1 3.91Å; V445-I456 HydrophobicContact CG2-CD1 4.05Å; L447-I456 HydrophobicContact CD2-CD1 3.36Å; T452-I456 HydrophobicContact CG2-CD1 3.97Å; T452-I456 HydrophobicContact CG2-CG1 4.35Å; T452-I456 WeakPolarHBondContact O-CB 3.35Å; T452-I456 WeakPolarHBondContact O-CD1 3.49Å; T452-I456 WeakPolarHBondContact O-CG1 3.45Å; T452-I456 PolarHBondContact O-N 3.01Å; I456-S458 VanDerWaalsContact C-N 3.35Å; I456-S458 PolarHBondContact O-N 3Å; I456-V459 PolarHBondContact O-N 2.7Å; I456-V460 WeakPolarHBondContact O-CG2 3.16Å; I456-V460 PolarHBondContact O-N 3.04Å; I456-L593 HydrophobicContact CD1-CD2 4.39Å; I456-L593 HydrophobicContact CG2-CD1 3.61Å; I456-L593 HydrophobicContact CG2-CD2 3.7Å; I456-L593 HydrophobicContact CG2-CG 4.19Å
457	K	86.9	Confident	84.6	Confident	98 Å²	98	51.7 Å²	51.7	43%	0.426	30%	0.298	S	S	.	.	H	α-helix	trans	-55.8	-49.4	174.5	-74.3	176.3	177.7	-179	0	111.1	Y8 C453 N454 K455 V459 V460 Y461	Y8-K457 PolarHBondContact OH-NZ 2.87Å; C453-K457 WeakPolarHBondContact O-CG 3.08Å; C453-K457 PolarHBondContact O-N 3.5Å; C453-K457 VanDerWaalsContact O-N 3.09Å; N454-K457 PolarHBondContact O-N 3.24Å; K455-K457 PolarHBondContact O-N 3.13Å; K457-V459 PolarHBondContact O-N 3.4Å; K457-V460 PolarHBondContact O-N 2.84Å; K457-Y461 HydrophobicContact CB-CD2 4.47Å; K457-Y461 HydrophobicContact CB-CE2 4.37Å; K457-Y461 WeakPolarHBondContact O-CD2 3.38Å; K457-Y461 PolarHBondContact O-N 3.17Å
458	S	87.3	Confident	84.5	Confident	77 Å²	77	50.5 Å²	50.5	54%	0.538	29%	0.292	S	S	.	.	H	α-helix	trans	-59.6	-44.4	178	-173.3	0	0	0	0	112.9	N454 K455 I456 S462	N454-S458 WeakPolarHBondContact O-CB 3.21Å; N454-S458 PolarHBondContact O-N 3.4Å; K455-S458 WeakPolarHBondContact O-CB 3.23Å; K455-S458 PolarHBondContact O-N 3.46Å; I456-S458 VanDerWaalsContact C-N 3.35Å; I456-S458 PolarHBondContact O-N 3Å; S458-S462 VanDerWaalsContact O-CB 3.25Å; S458-S462 WeakPolarHBondContact O-CB 3.3Å; S458-S462 PolarHBondContact O-N 3.39Å
459	V	89.5	Confident	84.6	Confident	12 Å²	12	48.5 Å²	48.5	7%	0.073	28%	0.276	C	S	.	.	H	α-helix	trans	-60.6	-49.2	175.5	167.9	0	0	0	0	111.2	L406 E409 K455 I456 K457 S462 C463	L406-V459 HydrophobicContact CD2-CB 4.2Å; L406-V459 HydrophobicContact CD2-CG1 3.98Å; L406-V459 HydrophobicContact CD2-CG2 4.46Å; L406-V459 HydrophobicContact CG-CG1 4.07Å; E409-V459 HydrophobicContact CB-CG2 4.05Å; E409-V459 HydrophobicContact CG-CG2 3.48Å; E409-V459 VanDerWaalsContact CG-CG2 3.48Å; K455-V459 WeakPolarHBondContact O-CG2 3.45Å; K455-V459 PolarHBondContact O-N 3.44Å; I456-V459 PolarHBondContact O-N 2.7Å; K457-V459 PolarHBondContact O-N 3.4Å; V459-S462 PolarHBondContact O-N 3.48Å; V459-C463 WeakPolarHBondContact O-CB 3.48Å; V459-C463 PolarHBondContact O-N 2.9Å; V459-C463 PolarHBondContact O-SG 3.26Å
460	V	87.8	Confident	84.6	Confident	20 Å²	20	48 Å²	48	12%	0.121	27%	0.273	C	S	.	.	H	α-helix	trans	-64.4	-44	-178.6	172.8	0	0	0	0	111	I402 I456 K457 C463 I464 L591	I402-V460 HydrophobicContact CG2-CG2 4.32Å; I456-V460 WeakPolarHBondContact O-CG2 3.16Å; I456-V460 PolarHBondContact O-N 3.04Å; K457-V460 PolarHBondContact O-N 2.84Å; V460-C463 WeakPolarHBondContact O-CB 3.36Å; V460-C463 PolarHBondContact O-N 3.01Å; V460-I464 HydrophobicContact CG1-CD1 3.91Å; V460-I464 WeakPolarHBondContact O-CG1 3.44Å; V460-I464 PolarHBondContact O-N 2.83Å; V460-L591 HydrophobicContact CG1-CD2 4.11Å; V460-L591 HydrophobicContact CG2-CD2 4.2Å
461	Y	83.7	Confident	84.5	Confident	61 Å²	61	44.2 Å²	44.2	24%	0.239	25%	0.246	C	C	.	.	H	α-helix	trans	-65	-41.3	175.4	-69.9	-46.2	0	0	0	112.7	K457 C463 I464 A465 I567 N568 Q571	K457-Y461 HydrophobicContact CB-CD2 4.47Å; K457-Y461 HydrophobicContact CB-CE2 4.37Å; K457-Y461 WeakPolarHBondContact O-CD2 3.38Å; K457-Y461 PolarHBondContact O-N 3.17Å; Y461-C463 VanDerWaalsContact C-N 3.34Å; Y461-C463 PolarHBondContact O-N 2.89Å; Y461-I464 PolarHBondContact O-N 2.81Å; Y461-A465 VanDerWaalsContact O-CB 3.29Å; Y461-A465 WeakPolarHBondContact O-CB 3.05Å; Y461-A465 PolarHBondContact O-N 3.21Å; Y461-I567 HydrophobicContact CD1-CG2 3.6Å; Y461-I567 HydrophobicContact CE1-CG2 4.06Å; Y461-I567 HydrophobicContact CG-CG2 4.21Å; Y461-N568 PolarHBondContact OH-O 2.83Å; Y461-Q571 HydrophobicContact CE1-CG 4.37Å
462	S	87.5	Confident	83.9	Confident	58 Å²	58	43.4 Å²	43.4	41%	0.406	24%	0.238	S	C	.	.	H	α-helix	trans	-62.3	-41.4	173.9	-179.7	0	0	0	0	111.6	S458 V459 A465 N466	S458-S462 VanDerWaalsContact O-CB 3.25Å; S458-S462 WeakPolarHBondContact O-CB 3.3Å; S458-S462 PolarHBondContact O-N 3.39Å; V459-S462 PolarHBondContact O-N 3.48Å; S462-A465 PolarHBondContact O-N 3.09Å; S462-N466 WeakPolarHBondContact O-CB 3.42Å; S462-N466 PolarHBondContact O-N 2.77Å; S462-N466 PolarHBondContact O-ND2 2.8Å
463	C	87.7	Confident	83.5	Confident	10 Å²	10	47 Å²	47	7%	0.068	26%	0.256	C	S	.	.	H	α-helix	trans	-59.1	-49.7	174.1	-70.1	0	0	0	0	111.4	I401 V459 V460 Y461 N466 I467	I401-C463 HydrophobicContact CG2-CB 3.67Å; V459-C463 WeakPolarHBondContact O-CB 3.48Å; V459-C463 PolarHBondContact O-N 2.9Å; V459-C463 PolarHBondContact O-SG 3.26Å; V460-C463 WeakPolarHBondContact O-CB 3.36Å; V460-C463 PolarHBondContact O-N 3.01Å; Y461-C463 VanDerWaalsContact C-N 3.34Å; Y461-C463 PolarHBondContact O-N 2.89Å; C463-N466 PolarHBondContact O-N 3.06Å; C463-I467 VanDerWaalsContact O-CD1 3.27Å; C463-I467 WeakPolarHBondContact O-CD1 3.5Å; C463-I467 WeakPolarHBondContact O-CG1 3.37Å; C463-I467 PolarHBondContact O-N 3.14Å; C463-I467 VanDerWaalsContact O-N 3.09Å
464	I	84.3	Confident	82.8	Confident	8 Å²	8	47.2 Å²	47.2	4%	0.041	25%	0.253	C	S	.	.	H	α-helix	trans	-63.5	-42.8	178.6	-66.7	167	0	0	0	111.1	I391 V460 Y461 N466 I467 L468	I391-I464 HydrophobicContact CD1-CG2 4.15Å; V460-I464 HydrophobicContact CG1-CD1 3.91Å; V460-I464 WeakPolarHBondContact O-CG1 3.44Å; V460-I464 PolarHBondContact O-N 2.83Å; Y461-I464 PolarHBondContact O-N 2.81Å; I464-N466 PolarHBondContact O-N 3.35Å; I464-I467 PolarHBondContact O-N 3.22Å; I464-L468 HydrophobicContact CG2-CD1 4.26Å; I464-L468 PolarHBondContact O-N 3.05Å
465	A	80.9	Confident	82	Confident	4 Å²	4	46.6 Å²	46.6	3%	0.033	25%	0.247	C	C	.	.	H	α-helix	trans	-64.6	-37.5	178.1	0	0	0	0	0	113.1	Y461 S462 L468 T469 Y564	Y461-A465 VanDerWaalsContact O-CB 3.29Å; Y461-A465 WeakPolarHBondContact O-CB 3.05Å; Y461-A465 PolarHBondContact O-N 3.21Å; S462-A465 PolarHBondContact O-N 3.09Å; A465-L468 PolarHBondContact O-N 2.91Å; A465-T469 WeakPolarHBondContact O-CB 3.34Å; A465-T469 PolarHBondContact O-N 3.08Å; A465-T469 PolarHBondContact O-OG1 3.41Å; A465-Y564 HydrophobicContact CB-CD1 4.36Å; A465-Y564 HydrophobicContact CB-CE1 3.56Å
466	N	84.9	Confident	80.7	Confident	85 Å²	85	46.7 Å²	46.7	46%	0.455	25%	0.251	S	S	.	.	H	α-helix	trans	-64.4	-42.6	172.9	-67.2	-27.4	0	0	0	110.9	S462 C463 I464 T469 D470	S462-N466 WeakPolarHBondContact O-CB 3.42Å; S462-N466 PolarHBondContact O-N 2.77Å; S462-N466 PolarHBondContact O-ND2 2.8Å; C463-N466 PolarHBondContact O-N 3.06Å; I464-N466 PolarHBondContact O-N 3.35Å; N466-T469 PolarHBondContact O-N 2.95Å; N466-D470 PolarHBondContact O-N 2.91Å
467	I	84.9	Confident	79	Confident	6 Å²	6	49 Å²	49	3%	0.031	26%	0.264	C	S	.	.	H	α-helix	trans	-69.2	-36.5	177.9	-54.4	152.7	0	0	0	111.2	I391 I393 L398 I401 C463 I464 T469 D470 T471	I391-I467 HydrophobicContact CG2-CB 4.4Å; I391-I467 HydrophobicContact CG2-CG2 3.35Å; I393-I467 HydrophobicContact CD1-CD1 3.63Å; I393-I467 HydrophobicContact CD1-CG1 4.05Å; I393-I467 HydrophobicContact CD1-CG2 4.14Å; L398-I467 HydrophobicContact CD1-CD1 4.21Å; I401-I467 HydrophobicContact CD1-CD1 4.26Å; I401-I467 HydrophobicContact CD1-CG1 4.15Å; I401-I467 HydrophobicContact CG2-CD1 4.44Å; C463-I467 VanDerWaalsContact O-CD1 3.27Å; C463-I467 WeakPolarHBondContact O-CD1 3.5Å; C463-I467 WeakPolarHBondContact O-CG1 3.37Å; C463-I467 PolarHBondContact O-N 3.14Å; C463-I467 VanDerWaalsContact O-N 3.09Å; I464-I467 PolarHBondContact O-N 3.22Å; I467-T469 VanDerWaalsContact C-N 3.33Å; I467-D470 PolarHBondContact O-N 3.47Å; I467-T471 PolarHBondContact O-N 3.21Å; I467-T471 PolarHBondContact O-OG1 2.95Å; I467-T471 VanDerWaalsContact O-OG1 3.04Å
468	L	79.5	Confident	77.5	Confident	17 Å²	17	47 Å²	47	9%	0.089	26%	0.262	C	S	.	.	H	α-helix	trans	-57.7	-47.2	169.6	-80.9	167.8	0	0	0	111	I391 I464 A465 T471 I472 I567	I391-L468 HydrophobicContact CD1-CD2 3.6Å; I391-L468 HydrophobicContact CD1-CG 3.56Å; I391-L468 HydrophobicContact CG1-CD2 3.55Å; I391-L468 HydrophobicContact CG1-CG 4.04Å; I464-L468 HydrophobicContact CG2-CD1 4.26Å; I464-L468 PolarHBondContact O-N 3.05Å; A465-L468 PolarHBondContact O-N 2.91Å; L468-T471 WeakPolarHBondContact CA-OG1 3.5Å; L468-T471 PolarHBondContact O-N 2.93Å; L468-T471 VanDerWaalsContact O-N 3.17Å; L468-T471 PolarHBondContact O-OG1 3.05Å; L468-I472 VanDerWaalsContact O-CG1 3.3Å; L468-I472 WeakPolarHBondContact O-CG1 3.17Å; L468-I472 PolarHBondContact O-N 2.93Å; L468-I567 HydrophobicContact CD1-CD1 3.73Å
469	T	81.2	Confident	75.3	Confident	51 Å²	51	48.4 Å²	48.4	31%	0.313	26%	0.263	S	S	.	.	H	α-helix	trans	-63.6	-45.3	-179.3	-55.7	0	0	0	0	111.3	A465 N466 I467 T471 I472 I473	A465-T469 WeakPolarHBondContact O-CB 3.34Å; A465-T469 PolarHBondContact O-N 3.08Å; A465-T469 PolarHBondContact O-OG1 3.41Å; N466-T469 PolarHBondContact O-N 2.95Å; I467-T469 VanDerWaalsContact C-N 3.33Å; T469-T471 VanDerWaalsContact C-N 3.32Å; T469-T471 PolarHBondContact O-N 3.44Å; T469-I472 PolarHBondContact O-N 2.83Å; T469-I473 HydrophobicContact CG2-CD1 3.82Å; T469-I473 WeakPolarHBondContact O-CB 3.43Å; T469-I473 WeakPolarHBondContact O-CD1 3.36Å; T469-I473 VanDerWaalsContact O-CG1 3.25Å; T469-I473 WeakPolarHBondContact O-CG1 3.29Å; T469-I473 PolarHBondContact O-N 2.94Å
470	D	78.8	Confident	72.9	Confident	71 Å²	71	55 Å²	55	38%	0.38	29%	0.291	S	S	.	.	H	α-helix	trans	-51.6	-49.7	170	-83.3	-1.8	0	0	0	110.9	N466 I467 I473 L474	N466-D470 PolarHBondContact O-N 2.91Å; I467-D470 PolarHBondContact O-N 3.47Å; D470-I473 PolarHBondContact O-N 3.47Å; D470-L474 VanDerWaalsContact O-CG 3.28Å; D470-L474 WeakPolarHBondContact O-CG 3.5Å; D470-L474 PolarHBondContact O-N 3Å; D470-L474 VanDerWaalsContact O-N 3.13Å
471	T	76.1	Confident	70.8	Confident	19 Å²	19	57.6 Å²	57.6	12%	0.117	31%	0.307	C	S	.	.	H	α-helix	trans	-68.8	-40.1	-177.5	47.1	0	0	0	0	113.9	I391 I467 L468 T469 I473 L474 E475	I391-T471 HydrophobicContact CG2-CG2 4.33Å; I467-T471 PolarHBondContact O-N 3.21Å; I467-T471 PolarHBondContact O-OG1 2.95Å; I467-T471 VanDerWaalsContact O-OG1 3.04Å; L468-T471 WeakPolarHBondContact CA-OG1 3.5Å; L468-T471 PolarHBondContact O-N 2.93Å; L468-T471 VanDerWaalsContact O-N 3.17Å; L468-T471 PolarHBondContact O-OG1 3.05Å; T469-T471 VanDerWaalsContact C-N 3.32Å; T469-T471 PolarHBondContact O-N 3.44Å; T471-I473 VanDerWaalsContact C-N 3.32Å; T471-I473 PolarHBondContact O-N 3.29Å; T471-L474 PolarHBondContact O-N 2.94Å; T471-E475 WeakPolarHBondContact O-CG 3.25Å; T471-E475 PolarHBondContact O-N 3.18Å
472	I	73.9	Confident	68.4	Low	56 Å²	56	61.3 Å²	61.3	29%	0.287	33%	0.331	S	S	.	.	H	α-helix	trans	-63.9	-40	176.4	-68.4	162.8	0	0	0	110.4	P389 L468 T469 L474 N476	P389-I472 HydrophobicContact CG-CD1 4.41Å; P389-I472 HydrophobicContact CG-CG1 3.67Å; L468-I472 VanDerWaalsContact O-CG1 3.3Å; L468-I472 WeakPolarHBondContact O-CG1 3.17Å; L468-I472 PolarHBondContact O-N 2.93Å; T469-I472 PolarHBondContact O-N 2.83Å; I472-L474 VanDerWaalsContact C-N 3.35Å; I472-L474 PolarHBondContact O-N 3.46Å; I472-N476 PolarHBondContact O-N 3.41Å; I472-N476 VanDerWaalsContact O-N 3.16Å; I472-N476 PolarHBondContact O-ND2 3.28Å
473	I	74.3	Confident	65.8	Low	90 Å²	90	67.1 Å²	67.1	46%	0.462	35%	0.352	S	S	.	.	H	α-helix	trans	-63.2	-41.9	176.5	-70.7	166.5	0	0	0	110.7	T469 D470 T471 L477	T469-I473 HydrophobicContact CG2-CD1 3.82Å; T469-I473 WeakPolarHBondContact O-CB 3.43Å; T469-I473 WeakPolarHBondContact O-CD1 3.36Å; T469-I473 VanDerWaalsContact O-CG1 3.25Å; T469-I473 WeakPolarHBondContact O-CG1 3.29Å; T469-I473 PolarHBondContact O-N 2.94Å; D470-I473 PolarHBondContact O-N 3.47Å; T471-I473 VanDerWaalsContact C-N 3.32Å; T471-I473 PolarHBondContact O-N 3.29Å; I473-L477 HydrophobicContact CG2-CD1 3.85Å; I473-L477 HydrophobicContact CG2-CG 4.48Å; I473-L477 WeakPolarHBondContact O-CB 3.47Å; I473-L477 VanDerWaalsContact O-CG 3.27Å; I473-L477 WeakPolarHBondContact O-CG 3.35Å; I473-L477 PolarHBondContact O-N 3.34Å
474	L	69.1	Low	63	Low	57 Å²	57	70.2 Å²	70.2	30%	0.298	37%	0.373	S	S	.	.	H	α-helix	trans	-64.8	-46.2	178	-69.5	166.1	0	0	0	113.4	D470 T471 I472 N476 L477 S478 Y516	D470-L474 VanDerWaalsContact O-CG 3.28Å; D470-L474 WeakPolarHBondContact O-CG 3.5Å; D470-L474 PolarHBondContact O-N 3Å; D470-L474 VanDerWaalsContact O-N 3.13Å; T471-L474 PolarHBondContact O-N 2.94Å; I472-L474 VanDerWaalsContact C-N 3.35Å; I472-L474 PolarHBondContact O-N 3.46Å; L474-N476 PolarHBondContact O-N 3.28Å; L474-L477 PolarHBondContact O-N 3.02Å; L474-S478 PolarHBondContact O-N 3.03Å; L474-Y516 HydrophobicContact CD1-CE2 3.66Å; L474-Y516 WeakPolarHBondContact CD1-OH 3.43Å; L474-Y516 HydrophobicContact CD2-CD2 4.36Å; L474-Y516 HydrophobicContact CD2-CE2 3.46Å; L474-Y516 VanDerWaalsContact CD2-CE2 3.46Å; L474-Y516 HydrophobicContact CG-CE2 4.19Å
475	E	67.5	Low	60.5	Low	89 Å²	89	78 Å²	78	42%	0.416	41%	0.413	S	S	.	.	H	α-helix	trans	-60.5	-46.7	179.3	-72.9	176.5	170.7	0	0	110.5	P389 T471 L477 S478 N479	P389-E475 WeakPolarHBondContact CB-OE1 3.46Å; P389-E475 VanDerWaalsContact CB-OE2 3.29Å; P389-E475 WeakPolarHBondContact CB-OE2 3.41Å; T471-E475 WeakPolarHBondContact O-CG 3.25Å; T471-E475 PolarHBondContact O-N 3.18Å; E475-L477 PolarHBondContact O-N 3.19Å; E475-S478 PolarHBondContact O-N 3.46Å; E475-S478 PolarHBondContact O-OG 3.5Å; E475-N479 PolarHBondContact O-N 3.39Å; E475-N479 VanDerWaalsContact O-N 3.12Å; E475-N479 PolarHBondContact O-ND2 3.22Å
476	N	61.5	Low	57.7	Low	83 Å²	83	82.1 Å²	82.1	44%	0.444	44%	0.442	S	S	.	.	H	α-helix	trans	-59.1	-46.3	174.9	-77.1	-68.5	0	0	0	112.4	I472 L474 S478 N479 F480	I472-N476 PolarHBondContact O-N 3.41Å; I472-N476 VanDerWaalsContact O-N 3.16Å; I472-N476 PolarHBondContact O-ND2 3.28Å; L474-N476 PolarHBondContact O-N 3.28Å; N476-S478 VanDerWaalsContact C-N 3.31Å; N476-S478 PolarHBondContact O-N 3.12Å; N476-N479 PolarHBondContact O-N 3.33Å; N476-F480 VanDerWaalsContact O-CD2 3.29Å; N476-F480 WeakPolarHBondContact O-CD2 3.14Å; N476-F480 PolarHBondContact O-N 2.98Å
477	L	52	Low	55	Low	58 Å²	58	87.7 Å²	87.7	30%	0.304	46%	0.458	S	S	.	.	H	α-helix	trans	-59.6	-40.7	177.1	-75.4	167.9	0	0	0	112.2	I473 L474 E475 N479 F480 T481	I473-L477 HydrophobicContact CG2-CD1 3.85Å; I473-L477 HydrophobicContact CG2-CG 4.48Å; I473-L477 WeakPolarHBondContact O-CB 3.47Å; I473-L477 VanDerWaalsContact O-CG 3.27Å; I473-L477 WeakPolarHBondContact O-CG 3.35Å; I473-L477 PolarHBondContact O-N 3.34Å; L474-L477 PolarHBondContact O-N 3.02Å; E475-L477 PolarHBondContact O-N 3.19Å; L477-N479 VanDerWaalsContact C-N 3.34Å; L477-N479 PolarHBondContact O-N 3.3Å; L477-F480 PolarHBondContact O-N 2.92Å; L477-T481 PolarHBondContact O-N 2.82Å; L477-T481 PolarHBondContact O-OG1 2.87Å
478	S	54.3	Low	52.2	Low	55 Å²	55	93.6 Å²	93.6	39%	0.385	49%	0.494	S	S	.	.	H	α-helix	trans	-66.1	-34.4	178.9	70.6	0	0	0	0	113.2	L474 E475 N476 T481 N482	L474-S478 PolarHBondContact O-N 3.03Å; E475-S478 PolarHBondContact O-N 3.46Å; E475-S478 PolarHBondContact O-OG 3.5Å; N476-S478 VanDerWaalsContact C-N 3.31Å; N476-S478 PolarHBondContact O-N 3.12Å; S478-T481 PolarHBondContact O-OG1 2.91Å; S478-N482 PolarHBondContact O-N 3.37Å; S478-N482 PolarHBondContact O-ND2 2.98Å
479	N	42.3	Very low	49.5	Very low	106 Å²	106	99 Å²	99	57%	0.567	53%	0.529	S	S	*	.	H	α-helix	trans	-70.4	-36.6	176.8	-69	-22.1	0	0	0	112.1	E475 N476 L477	E475-N479 PolarHBondContact O-N 3.39Å; E475-N479 VanDerWaalsContact O-N 3.12Å; E475-N479 PolarHBondContact O-ND2 3.22Å; N476-N479 PolarHBondContact O-N 3.33Å; L477-N479 VanDerWaalsContact C-N 3.34Å; L477-N479 PolarHBondContact O-N 3.3Å
480	F	39.7	Very low	47	Very low	150 Å²	150	104.3 Å²	104.3	66%	0.658	56%	0.555	S	S	*	*	H	α-helix	trans	-67.6	-40.4	174.8	-82.4	-71.6	0	0	0	112.7	N476 L477 N482 H483 S484	N476-F480 VanDerWaalsContact O-CD2 3.29Å; N476-F480 WeakPolarHBondContact O-CD2 3.14Å; N476-F480 PolarHBondContact O-N 2.98Å; L477-F480 PolarHBondContact O-N 2.92Å; F480-N482 VanDerWaalsContact C-N 3.26Å; F480-N482 PolarHBondContact O-N 2.86Å; F480-H483 PolarHBondContact O-N 2.95Å; F480-S484 PolarHBondContact O-OG 3.19Å
481	T	42.8	Very low	44.5	Very low	75 Å²	75	107 Å²	107	46%	0.46	57%	0.569	S	S	.	*	H	α-helix	trans	-66.3	-24.6	-179.1	44.5	0	0	0	0	114.4	L477 S478	L477-T481 PolarHBondContact O-N 2.82Å; L477-T481 PolarHBondContact O-OG1 2.87Å; S478-T481 PolarHBondContact O-OG1 2.91Å
482	N	34.3	Very low	42.2	Very low	139 Å²	139	113 Å²	113	74%	0.743	60%	0.6	S	S	*	*	H	α-helix	trans	-81.5	-15.2	178.7	-69.3	-18.3	0	0	0	113.3	S478 F480	S478-N482 PolarHBondContact O-N 3.37Å; S478-N482 PolarHBondContact O-ND2 2.98Å; F480-N482 VanDerWaalsContact C-N 3.26Å; F480-N482 PolarHBondContact O-N 2.86Å
483	H	32.8	Very low	40.2	Very low	181 Å²	181	118.3 Å²	118.3	84%	0.838	63%	0.63	S	S	*	*	H	α-helix	trans	-104.3	-3.5	-178.1	-124.3	-58.1	0	0	0	114.2	F480	F480-H483 PolarHBondContact O-N 2.95Å
484	S	28.7	Very low	38.1	Very low	75 Å²	75	119.7 Å²	119.7	52%	0.524	64%	0.642	S	S	.	*	S	Bend	trans	-146	91.7	178.8	52.6	0	0	0	0	112.8	F480	F480-S484 PolarHBondContact O-OG 3.19Å
485	I	30.6	Very low	36	Very low	171 Å²	171	124.6 Å²	124.6	88%	0.877	67%	0.668	S	S	*	*			trans	-174.6	73	143.6	-89.8	146.5	0	0	0	106.3
486	S	22.8	Very low	34.3	Very low	90 Å²	90	124.8 Å²	124.8	63%	0.629	68%	0.677	S	S	*	*			trans	-91.5	156.4	154.6	49.1	0	0	0	0	108.7
487	Y	28.1	Very low	32.7	Very low	203 Å²	203	129.3 Å²	129.3	80%	0.796	69%	0.693	S	S	*	*	S	Bend	trans	79.1	105.5	175.8	-52.7	-70.8	0	0	0	118.7
488	T	25.8	Very low	31.6	Very low	130 Å²	130	133.5 Å²	133.5	80%	0.798	72%	0.716	S	S	*	*			trans	63.6	98.5	136.2	57.9	0	0	0	0	119.1
489	T	23.1	Very low	30.2	Very low	131 Å²	131	138.3 Å²	138.3	80%	0.804	74%	0.735	S	S	*	*			trans	-55.9	144.2	148.3	46.2	0	0	0	0	111.6
490	N	28.6	Very low	29.4	Very low	161 Å²	161	138.7 Å²	138.7	86%	0.861	74%	0.744	S	S	*	*			trans	-149.7	149.3	150.8	-133.9	-22.3	0	0	0	111.9
491	N	27.3	Very low	28.7	Very low	129 Å²	129	136.1 Å²	136.1	69%	0.69	74%	0.744	S	S	*	*			trans	-91.7	164	-153.8	-70.4	-37.6	0	0	0	115.9
492	N	27.4	Very low	28	Very low	143 Å²	143	139.5 Å²	139.5	77%	0.765	77%	0.765	S	S	*	*			trans	65.8	114.2	151.2	-59.3	-19.1	0	0	0	119.7
493	N	32.3	Very low	27.7	Very low	169 Å²	169	141.8 Å²	141.8	90%	0.904	77%	0.771	S	S	*	*				-163.8	162.8	119	-96.9	-35.9	0	0	0	111.4
494	T	28.5	Very low	27.5	Very low	119 Å²	119	141.2 Å²	141.2	73%	0.73	77%	0.774	S	S	*	*			trans	-118.4	137.3	-158.7	51	0	0	0	0	115.9
495	L	25.6	Very low	27.3	Very low	159 Å²	159	143.1 Å²	143.1	83%	0.832	79%	0.788	S	S	*	*			trans	62.4	174.7	155.8	-88.3	74.6	0	0	0	116.3
496	P	32.2	Very low	27.1	Very low	93 Å²	93	143.3 Å²	143.3	60%	0.604	79%	0.79	S	S	*	*				-128.3	-175.4	-61.3	37.9	-21.7	0	0	0	111.5
497	F	28.2	Very low	27.4	Very low	178 Å²	178	144.6 Å²	144.6	78%	0.781	80%	0.799	S	S	*	*				163.3	134.6	127.2	-98.5	-76.1	0	0	0	115.3
498	N	27.2	Very low	27.5	Very low	146 Å²	146	139.2 Å²	139.2	78%	0.781	79%	0.791	S	S	*	*			trans	18.3	140.4	155.2	-63.1	-4.3	0	0	0	124.9
499	I	26.3	Very low	27.8	Very low	156 Å²	156	138.4 Å²	138.4	80%	0.8	78%	0.778	S	S	*	*			trans	-85.7	161.6	163.9	-18.5	176.4	0	0	0	109.7
500	P	26.1	Very low	28.2	Very low	115 Å²	115	140.2 Å²	140.2	75%	0.747	77%	0.771	S	S	*	*				-151	142	88.8	37.6	-18.7	0	0	0	117.9
501	S	23.9	Very low	28.6	Very low	95 Å²	95	135.9 Å²	135.9	66%	0.664	75%	0.752	S	S	*	*			trans	18.6	123.1	149.6	61.5	0	0	0	0	122.6
502	T	29.3	Very low	29.2	Very low	147 Å²	147	138.7 Å²	138.7	90%	0.902	76%	0.759	S	S	*	*				-124.2	149	122.3	47.5	0	0	0	0	109.2
503	Q	27.8	Very low	29.7	Very low	187 Å²	187	136.7 Å²	136.7	87%	0.874	75%	0.748	S	S	*	*			trans	-110.5	122	179.2	-71.6	-179	-22.2	0	0	109.8
504	D	28	Very low	29.8	Very low	168 Å²	168	131.2 Å²	131.2	90%	0.898	72%	0.722	S	S	*	*			trans	-130	133.7	159.9	-106.3	-48.4	0	0	0	109.8	L506	D504-L506 PolarHBondContact O-N 3.48Å
505	S	25	Very low	30.1	Very low	116 Å²	116	130 Å²	130	81%	0.811	72%	0.718	S	S	*	*			trans	-97.5	77.8	-158.2	60.7	0	0	0	0	113
506	L	26.4	Very low	30.3	Very low	174 Å²	174	127.5 Å²	127.5	91%	0.911	70%	0.699	S	S	*	*			trans	-145.2	84.6	172.2	-142.7	83.3	0	0	0	112	D504	D504-L506 PolarHBondContact O-N 3.48Å
507	S	28.1	Very low	30.5	Very low	118 Å²	118	124 Å²	124	83%	0.825	68%	0.676	S	S	*	*			trans	-138	108.4	175.7	66.5	0	0	0	0	112.6
508	S	30.4	Very low	31.2	Very low	89 Å²	89	119.6 Å²	119.6	62%	0.622	66%	0.66	S	S	*	*			trans	-69.4	167.7	165.7	50	0	0	0	0	111.7	Y510	S508-Y510 WeakPolarHBondContact O-CD2 3.08Å; S508-Y510 PolarHBondContact O-N 3.26Å
509	H	32.1	Very low	31.7	Very low	113 Å²	113	117.2 Å²	117.2	52%	0.523	65%	0.647	S	S	.	*			trans	-57	114.9	-176.5	-82.5	-78	0	0	0	113.7
510	Y	31.4	Very low	32.1	Very low	170 Å²	170	111.6 Å²	111.6	67%	0.667	62%	0.618	S	S	*	*			trans	-126.5	129.5	160.8	-70.7	-78	0	0	0	110.4	S508 K512	S508-Y510 WeakPolarHBondContact O-CD2 3.08Å; S508-Y510 PolarHBondContact O-N 3.26Å; Y510-K512 PolarHBondContact O-N 2.9Å
511	C	37.7	Very low	32.9	Very low	69 Å²	69	113 Å²	113	47%	0.466	61%	0.613	S	S	.	*			trans	-72.7	125	177.8	-176.6	0	0	0	0	109.9	D513 C514 C517	C511-D513 PolarHBondContact O-N 3.41Å; C511-C514 HydrophobicContact CB-CB 3.96Å; C511-C517 WeakPolarHBondContact O-CB 3.07Å; C511-C517 PolarHBondContact O-SG 2.92Å
512	K	39.8	Very low	33.6	Very low	189 Å²	189	113.5 Å²	113.5	82%	0.822	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.9	-10.4	-178.1	-68.5	-177.6	179.3	177.6	0	114	Y510	Y510-K512 PolarHBondContact O-N 2.9Å
513	D	38.5	Very low	33.9	Very low	100 Å²	100	108.7 Å²	108.7	54%	0.535	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-122.7	-1	-166.2	-54.8	45.8	0	0	0	112.9	C511 K629	C511-D513 PolarHBondContact O-N 3.41Å; D513-K629 IonicContact OD1-NZ 2.69Å; D513-K629 PolarHBondContact OD1-NZ 3.1Å; D513-K629 IonicContact OD2-NZ 2.63Å; D513-K629 PolarHBondContact OD2-NZ 3.19Å
514	C	34.4	Very low	34.5	Very low	54 Å²	54	104.1 Å²	104.1	37%	0.365	55%	0.554	S	S	.	*			trans	-89.4	133.4	-176.8	-171.1	0	0	0	0	111	C511 Y516 C517 I518	C511-C514 HydrophobicContact CB-CB 3.96Å; C514-Y516 PolarHBondContact O-N 3.43Å; C514-Y516 VanDerWaalsContact O-N 3.13Å; C514-C517 HydrophobicContact CB-CB 4.26Å; C514-C517 WeakPolarHBondContact O-CA 3.44Å; C514-C517 WeakPolarHBondContact O-CB 3.49Å; C514-C517 PolarHBondContact O-N 3.08Å; C514-I518 PolarHBondContact O-N 3.45Å
515	S	34.4	Very low	35	Very low	94 Å²	94	102.6 Å²	102.6	66%	0.657	54%	0.542	S	S	*	.	H	α-helix	trans	-53.1	-36.7	177.1	-156.6	0	0	0	0	112.7	C517 I518 L519	S515-C517 VanDerWaalsContact C-N 3.34Å; S515-C517 PolarHBondContact O-N 3.08Å; S515-I518 PolarHBondContact O-N 3.26Å; S515-L519 PolarHBondContact O-N 3.45Å
516	Y	29.9	Very low	35.5	Very low	106 Å²	106	102.6 Å²	102.6	42%	0.416	53%	0.533	S	S	.	.	H	α-helix	trans	-59.1	-39.4	172.5	-177.3	-84.8	0	0	0	113.3	L474 C514 N520	L474-Y516 HydrophobicContact CD1-CE2 3.66Å; L474-Y516 WeakPolarHBondContact CD1-OH 3.43Å; L474-Y516 HydrophobicContact CD2-CD2 4.36Å; L474-Y516 HydrophobicContact CD2-CE2 3.46Å; L474-Y516 VanDerWaalsContact CD2-CE2 3.46Å; L474-Y516 HydrophobicContact CG-CE2 4.19Å; C514-Y516 PolarHBondContact O-N 3.43Å; C514-Y516 VanDerWaalsContact O-N 3.13Å; Y516-N520 PolarHBondContact O-N 2.78Å; Y516-N520 VanDerWaalsContact O-N 3.16Å
517	C	36.4	Very low	36	Very low	20 Å²	20	99.9 Å²	99.9	14%	0.135	52%	0.519	C	S	.	.	H	α-helix	trans	-83.3	-20.8	179.3	-64.1	0	0	0	0	113.1	C511 C514 S515 K521	C511-C517 WeakPolarHBondContact O-CB 3.07Å; C511-C517 PolarHBondContact O-SG 2.92Å; C514-C517 HydrophobicContact CB-CB 4.26Å; C514-C517 WeakPolarHBondContact O-CA 3.44Å; C514-C517 WeakPolarHBondContact O-CB 3.49Å; C514-C517 PolarHBondContact O-N 3.08Å; S515-C517 VanDerWaalsContact C-N 3.34Å; S515-C517 PolarHBondContact O-N 3.08Å; C517-K521 WeakPolarHBondContact O-CB 3.28Å; C517-K521 PolarHBondContact O-N 2.99Å; C517-K521 VanDerWaalsContact O-N 3.14Å
518	I	43.4	Very low	36.4	Very low	85 Å²	85	99 Å²	99	44%	0.436	51%	0.505	S	S	.	.	H	α-helix	trans	-69.8	-50.6	169.6	-64.4	171	0	0	0	109.1	C514 S515 N520 K521 Q522	C514-I518 PolarHBondContact O-N 3.45Å; S515-I518 PolarHBondContact O-N 3.26Å; I518-N520 PolarHBondContact O-N 2.74Å; I518-K521 WeakPolarHBondContact O-CB 3.33Å; I518-K521 PolarHBondContact O-N 2.73Å; I518-K521 VanDerWaalsContact O-N 3.11Å; I518-Q522 PolarHBondContact O-N 2.74Å; I518-Q522 VanDerWaalsContact O-N 3.15Å
519	L	36.7	Very low	36.7	Very low	96 Å²	96	102.2 Å²	102.2	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-58.1	-48.3	177.3	-134.6	75.8	0	0	0	111.9	S515 K521 Q522 N523	S515-L519 PolarHBondContact O-N 3.45Å; L519-K521 VanDerWaalsContact C-N 3.3Å; L519-K521 PolarHBondContact O-N 3.24Å; L519-Q522 PolarHBondContact O-N 3.03Å; L519-N523 WeakPolarHBondContact O-CB 3.27Å; L519-N523 PolarHBondContact O-N 2.67Å
520	N	34.9	Very low	36.8	Very low	39 Å²	39	104.5 Å²	104.5	21%	0.209	52%	0.52	C	S	.	.	H	α-helix	trans	-65.9	-28.5	177.3	-87.7	3.9	0	0	0	113.3	Y516 I518 L524	Y516-N520 PolarHBondContact O-N 2.78Å; Y516-N520 VanDerWaalsContact O-N 3.16Å; I518-N520 PolarHBondContact O-N 2.74Å; N520-L524 HydrophobicContact CB-CD1 4.25Å; N520-L524 VanDerWaalsContact O-CB 3.31Å; N520-L524 WeakPolarHBondContact O-CB 3.19Å; N520-L524 VanDerWaalsContact O-CD1 3.24Å; N520-L524 WeakPolarHBondContact O-CD1 3.41Å; N520-L524 PolarHBondContact O-N 2.65Å
521	K	41.8	Very low	36.8	Very low	143 Å²	143	104.6 Å²	104.6	62%	0.622	53%	0.526	S	S	*	.	H	α-helix	trans	-65.6	-46.8	173	-101.5	-172	168.3	-168.3	0	112	C517 I518 L519 Q525	C517-K521 WeakPolarHBondContact O-CB 3.28Å; C517-K521 PolarHBondContact O-N 2.99Å; C517-K521 VanDerWaalsContact O-N 3.14Å; I518-K521 WeakPolarHBondContact O-CB 3.33Å; I518-K521 PolarHBondContact O-N 2.73Å; I518-K521 VanDerWaalsContact O-N 3.11Å; L519-K521 VanDerWaalsContact C-N 3.3Å; L519-K521 PolarHBondContact O-N 3.24Å; K521-Q525 WeakPolarHBondContact O-CB 3.29Å; K521-Q525 VanDerWaalsContact O-CG 3.28Å; K521-Q525 WeakPolarHBondContact O-CG 3.47Å; K521-Q525 PolarHBondContact O-N 3.39Å
522	Q	38.9	Very low	36.5	Very low	106 Å²	106	108.1 Å²	108.1	50%	0.495	54%	0.541	S	S	.	.	H	α-helix	trans	-65.5	-45.4	179.8	-69.1	168.4	-42.1	0	0	110.6	I518 L519 Q525 N526	I518-Q522 PolarHBondContact O-N 2.74Å; I518-Q522 VanDerWaalsContact O-N 3.15Å; L519-Q522 PolarHBondContact O-N 3.03Å; Q522-Q525 PolarHBondContact O-N 3.14Å; Q522-N526 PolarHBondContact O-N 2.87Å
523	N	35.5	Very low	36.2	Very low	46 Å²	46	105.7 Å²	105.7	25%	0.246	54%	0.536	C	S	.	.	H	α-helix	trans	-75.3	-36.5	-176.6	-69	-13.9	0	0	0	113.8	L519 Q525 N526 L527	L519-N523 WeakPolarHBondContact O-CB 3.27Å; L519-N523 PolarHBondContact O-N 2.67Å; N523-Q525 VanDerWaalsContact C-N 3.29Å; N523-Q525 PolarHBondContact O-N 2.93Å; N523-N526 PolarHBondContact O-N 2.76Å; N523-L527 WeakPolarHBondContact O-CD1 3.24Å; N523-L527 PolarHBondContact O-N 2.9Å
524	L	40.1	Very low	35.8	Very low	91 Å²	91	108.7 Å²	108.7	48%	0.476	55%	0.551	S	S	.	*	H	α-helix	trans	-67.7	-28.5	172.4	-90.6	78.5	0	0	0	112.4	N520 N528	N520-L524 HydrophobicContact CB-CD1 4.25Å; N520-L524 VanDerWaalsContact O-CB 3.31Å; N520-L524 WeakPolarHBondContact O-CB 3.19Å; N520-L524 VanDerWaalsContact O-CD1 3.24Å; N520-L524 WeakPolarHBondContact O-CD1 3.41Å; N520-L524 PolarHBondContact O-N 2.65Å; L524-N528 VanDerWaalsContact O-CB 3.3Å; L524-N528 WeakPolarHBondContact O-CB 3.42Å; L524-N528 PolarHBondContact O-N 3.46Å; L524-N528 VanDerWaalsContact O-N 3.09Å; L524-N528 PolarHBondContact O-ND2 3.31Å
525	Q	38.9	Very low	35.8	Very low	137 Å²	137	115.1 Å²	115.1	64%	0.64	57%	0.573	S	S	*	*	H	α-helix	trans	-69.3	-38.8	174.1	-75	177.4	-32.8	0	0	111.5	K521 Q522 N523 H529	K521-Q525 WeakPolarHBondContact O-CB 3.29Å; K521-Q525 VanDerWaalsContact O-CG 3.28Å; K521-Q525 WeakPolarHBondContact O-CG 3.47Å; K521-Q525 PolarHBondContact O-N 3.39Å; Q522-Q525 PolarHBondContact O-N 3.14Å; N523-Q525 VanDerWaalsContact C-N 3.29Å; N523-Q525 PolarHBondContact O-N 2.93Å; Q525-H529 PolarHBondContact O-N 3.36Å
526	N	36.9	Very low	35.6	Very low	115 Å²	115	118.1 Å²	118.1	62%	0.615	58%	0.582	S	S	*	*	H	α-helix	trans	-70.1	-42.9	177.1	-67	-14.3	0	0	0	112.9	Q522 N523 H529	Q522-N526 PolarHBondContact O-N 2.87Å; N523-N526 PolarHBondContact O-N 2.76Å; N526-H529 PolarHBondContact O-N 2.61Å
527	L	36.4	Very low	35.8	Very low	118 Å²	118	123.2 Å²	123.2	62%	0.618	61%	0.606	S	S	*	*	H	α-helix	trans	-69.5	-37.9	177.3	-88.6	117.3	0	0	0	113.4	N523 H529 H530	N523-L527 WeakPolarHBondContact O-CD1 3.24Å; N523-L527 PolarHBondContact O-N 2.9Å; L527-H529 PolarHBondContact O-N 3.04Å; L527-H530 PolarHBondContact O-N 3.41Å
528	N	36.2	Very low	35.5	Very low	99 Å²	99	130.9 Å²	130.9	53%	0.529	64%	0.64	S	S	.	*	H	α-helix	trans	-74.2	-6.9	178.8	-74.7	-72.8	0	0	0	114	L524	L524-N528 VanDerWaalsContact O-CB 3.3Å; L524-N528 WeakPolarHBondContact O-CB 3.42Å; L524-N528 PolarHBondContact O-N 3.46Å; L524-N528 VanDerWaalsContact O-N 3.09Å; L524-N528 PolarHBondContact O-ND2 3.31Å
529	H	35.6	Very low	34.8	Very low	156 Å²	156	132.1 Å²	132.1	72%	0.722	66%	0.656	S	S	*	*	H	α-helix	trans	-83.9	-21.2	170.1	-123.4	30	0	0	0	113.3	Q525 N526 L527	Q525-H529 PolarHBondContact O-N 3.36Å; N526-H529 PolarHBondContact O-N 2.61Å; L527-H529 PolarHBondContact O-N 3.04Å
530	H	34	Very low	34.6	Very low	161 Å²	161	136 Å²	136	75%	0.745	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-6.1	-179.8	-108.9	-73.5	0	0	0	115.4	L527	L527-H530 PolarHBondContact O-N 3.41Å
531	Q	33.5	Very low	34.2	Very low	172 Å²	172	142.6 Å²	142.6	80%	0.804	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	11.2	178.5	-68.5	-166	-17.2	0	0	114.7
532	N	31	Very low	33.7	Very low	143 Å²	143	143 Å²	143	77%	0.765	71%	0.714	S	S	*	*	S	Bend	trans	-112.4	14	179.8	-125.3	-21.1	0	0	0	114.4
533	I	32.1	Very low	33.2	Very low	139 Å²	139	144.2 Å²	144.2	71%	0.713	72%	0.723	S	S	*	*			trans	-108.8	68	172.8	-49.1	179.1	0	0	0	109.1
534	N	30	Very low	32.8	Very low	162 Å²	162	148.8 Å²	148.8	87%	0.866	75%	0.748	S	S	*	*			trans	-156.3	46.2	164.7	-112.4	-30.9	0	0	0	113.4
535	K	34.6	Very low	32.4	Very low	190 Å²	190	153.8 Å²	153.8	83%	0.826	77%	0.768	S	S	*	*	S	Bend	trans	-133.8	131.3	155.9	-70.3	-174.8	179.6	175	0	108.4
536	N	31.3	Very low	32.1	Very low	156 Å²	156	151.7 Å²	151.7	83%	0.834	77%	0.769	S	S	*	*	S	Bend	trans	67.9	86	173	-47.1	-20.5	0	0	0	116.6
537	K	33.6	Very low	31.9	Very low	213 Å²	213	152.6 Å²	152.6	93%	0.926	77%	0.773	S	S	*	*				-166.1	138.4	116.3	-105.3	166.2	-175.8	-178.1	0	112.2
538	Q	31.1	Very low	32	Very low	182 Å²	182	152.9 Å²	152.9	85%	0.85	78%	0.775	S	S	*	*			trans	-84.1	173.6	161.1	-71.3	171.7	-40.7	0	0	109.2
539	S	28.2	Very low	31.9	Very low	111 Å²	111	153.1 Å²	153.1	78%	0.776	78%	0.776	S	S	*	*			trans	54	93.5	174.2	64	0	0	0	0	116.2
540	L	32.2	Very low	31.9	Very low	176 Å²	176	151.4 Å²	151.4	92%	0.921	77%	0.772	S	S	*	*				-167.2	131.9	106.5	-96.7	156.6	0	0	0	109
541	E	26.6	Very low	32.1	Very low	179 Å²	179	149.7 Å²	149.7	84%	0.836	77%	0.765	S	S	*	*			trans	-84.9	153.7	176.4	-62.5	172	129.8	0	0	110.4
542	I	31	Very low	32.1	Very low	152 Å²	152	145.6 Å²	145.6	78%	0.779	75%	0.748	S	S	*	*			trans	153.6	123.8	139.3	-79.6	158.9	0	0	0	111.4
543	N	28.5	Very low	32.5	Very low	130 Å²	130	143.4 Å²	143.4	70%	0.695	74%	0.735	S	S	*	*			trans	63.6	83.1	158.9	-61.2	-6.9	0	0	0	121.9
544	N	26.5	Very low	32.7	Very low	142 Å²	142	143.5 Å²	143.5	76%	0.759	73%	0.732	S	S	*	*				33	90.4	112.5	-57.1	-16.7	0	0	0	120
545	Q	32.8	Very low	33	Very low	196 Å²	196	139.3 Å²	139.3	92%	0.916	71%	0.713	S	S	*	*			trans	-155	8.5	159.7	-143.2	84.3	57.2	0	0	118
546	S	31.4	Very low	33.1	Very low	93 Å²	93	135.4 Å²	135.4	65%	0.65	70%	0.696	S	S	*	*			trans	-137.4	43.4	-167.1	71	0	0	0	0	116.8
547	I	33.2	Very low	33.4	Very low	135 Å²	135	132.5 Å²	132.5	69%	0.692	68%	0.68	S	S	*	*	S	Bend	trans	-89	-16.6	-178.4	-70.5	176.1	0	0	0	113.4
548	N	38.1	Very low	33.6	Very low	124 Å²	124	125.4 Å²	125.4	66%	0.663	66%	0.657	S	S	*	*	H	α-helix	trans	-81.1	-28.2	-169.5	-67.5	-1.7	0	0	0	115.2	N550 Q551 L552	N548-N550 PolarHBondContact O-N 3.35Å; N548-Q551 PolarHBondContact O-N 3.27Å; N548-L552 PolarHBondContact O-N 3.42Å
549	D	35.7	Very low	34.1	Very low	103 Å²	103	120.8 Å²	120.8	55%	0.551	64%	0.635	S	S	*	*	H	α-helix	trans	-70	-34.7	-166.8	-62.8	-51	0	0	0	114	Q551 L552 I553	D549-Q551 VanDerWaalsContact C-N 3.35Å; D549-Q551 PolarHBondContact O-N 3.47Å; D549-L552 WeakPolarHBondContact O-CB 3.38Å; D549-L552 PolarHBondContact O-N 3.25Å; D549-I553 PolarHBondContact O-N 3.23Å
550	N	35.1	Very low	34.6	Very low	120 Å²	120	118.5 Å²	118.5	64%	0.642	61%	0.614	S	S	*	*	H	α-helix	trans	-68	-35.2	178.1	-71.8	-36.7	0	0	0	112	N548 L552 I553 E554	N548-N550 PolarHBondContact O-N 3.35Å; N550-L552 VanDerWaalsContact C-N 3.3Å; N550-L552 PolarHBondContact O-N 3.18Å; N550-I553 PolarHBondContact O-N 3.48Å; N550-E554 PolarHBondContact O-N 2.76Å; N550-E554 VanDerWaalsContact O-N 3.12Å
551	Q	37.4	Very low	34.9	Very low	126 Å²	126	114.9 Å²	114.9	59%	0.589	60%	0.595	S	S	*	*	H	α-helix	trans	-67.5	-32	173.4	-65.4	-173.7	-5.4	0	0	111.7	N548 D549 I553 T555	N548-Q551 PolarHBondContact O-N 3.27Å; D549-Q551 VanDerWaalsContact C-N 3.35Å; D549-Q551 PolarHBondContact O-N 3.47Å; Q551-I553 VanDerWaalsContact C-N 3.29Å; Q551-I553 PolarHBondContact O-N 3.17Å; Q551-T555 WeakPolarHBondContact O-CB 3.38Å; Q551-T555 WeakPolarHBondContact O-CG2 3.24Å; Q551-T555 PolarHBondContact O-N 3.46Å; Q551-T555 PolarHBondContact O-OG1 3.31Å
552	L	34.8	Very low	35.5	Very low	86 Å²	86	113.4 Å²	113.4	45%	0.45	59%	0.586	S	S	.	*	H	α-helix	trans	-66.7	-30.6	173.5	-164.3	71.5	0	0	0	112.3	N548 D549 N550 T555 K556	N548-L552 PolarHBondContact O-N 3.42Å; D549-L552 WeakPolarHBondContact O-CB 3.38Å; D549-L552 PolarHBondContact O-N 3.25Å; N550-L552 VanDerWaalsContact C-N 3.3Å; N550-L552 PolarHBondContact O-N 3.18Å; L552-T555 WeakPolarHBondContact CA-OG1 3.44Å; L552-T555 PolarHBondContact O-OG1 3.13Å; L552-K556 HydrophobicContact CG-CD 4.38Å; L552-K556 WeakPolarHBondContact O-CB 3.19Å; L552-K556 WeakPolarHBondContact O-CD 3.47Å; L552-K556 WeakPolarHBondContact O-CG 3.35Å; L552-K556 PolarHBondContact O-N 2.78Å
553	I	37.8	Very low	36.1	Very low	96 Å²	96	108.4 Å²	108.4	49%	0.492	56%	0.559	S	S	.	*	H	α-helix	trans	-74.9	-47.2	176.6	-66.1	168.2	0	0	0	110.8	D549 N550 Q551 T555 K556 L557	D549-I553 PolarHBondContact O-N 3.23Å; N550-I553 PolarHBondContact O-N 3.48Å; Q551-I553 VanDerWaalsContact C-N 3.29Å; Q551-I553 PolarHBondContact O-N 3.17Å; I553-T555 PolarHBondContact O-N 3.12Å; I553-K556 PolarHBondContact O-N 2.92Å; I553-L557 HydrophobicContact CG2-CD1 3.97Å; I553-L557 WeakPolarHBondContact O-CG 3.29Å; I553-L557 PolarHBondContact O-N 3.2Å
554	E	36.1	Very low	36.4	Very low	142 Å²	142	107 Å²	107	66%	0.664	55%	0.545	S	S	*	.	H	α-helix	trans	-64.5	-39.1	177.9	-69.3	-167.7	141.1	0	0	112.6	N550 K556 L557 S558	N550-E554 PolarHBondContact O-N 2.76Å; N550-E554 VanDerWaalsContact O-N 3.12Å; E554-K556 PolarHBondContact O-N 3.26Å; E554-L557 PolarHBondContact O-N 2.93Å; E554-S558 WeakPolarHBondContact O-CB 3.32Å; E554-S558 PolarHBondContact O-N 3.24Å
555	T	36.8	Very low	36.9	Very low	74 Å²	74	107.5 Å²	107.5	45%	0.454	54%	0.542	S	S	.	.	H	α-helix	trans	-65.9	-36.6	175	49.4	0	0	0	0	112.5	Q551 L552 I553 S558 Q559	Q551-T555 WeakPolarHBondContact O-CB 3.38Å; Q551-T555 WeakPolarHBondContact O-CG2 3.24Å; Q551-T555 PolarHBondContact O-N 3.46Å; Q551-T555 PolarHBondContact O-OG1 3.31Å; L552-T555 WeakPolarHBondContact CA-OG1 3.44Å; L552-T555 PolarHBondContact O-OG1 3.13Å; I553-T555 PolarHBondContact O-N 3.12Å; T555-S558 WeakPolarHBondContact O-CB 3.47Å; T555-S558 PolarHBondContact O-N 3.46Å; T555-Q559 WeakPolarHBondContact O-CG 3.36Å; T555-Q559 PolarHBondContact O-N 3.28Å
556	K	37.7	Very low	37.2	Very low	107 Å²	107	101 Å²	101	47%	0.465	51%	0.514	S	S	.	.	H	α-helix	trans	-69	-38	172.4	-75.2	172.2	-179.4	176.3	0	112.8	L552 I553 E554 S558 Q559 I560	L552-K556 HydrophobicContact CG-CD 4.38Å; L552-K556 WeakPolarHBondContact O-CB 3.19Å; L552-K556 WeakPolarHBondContact O-CD 3.47Å; L552-K556 WeakPolarHBondContact O-CG 3.35Å; L552-K556 PolarHBondContact O-N 2.78Å; I553-K556 PolarHBondContact O-N 2.92Å; E554-K556 PolarHBondContact O-N 3.26Å; K556-S558 VanDerWaalsContact C-N 3.32Å; K556-S558 PolarHBondContact O-N 2.83Å; K556-Q559 WeakPolarHBondContact O-CB 3.36Å; K556-Q559 PolarHBondContact O-N 3.32Å; K556-I560 WeakPolarHBondContact O-CG1 3.33Å; K556-I560 PolarHBondContact O-N 3.39Å
557	L	37.5	Very low	37.8	Very low	95 Å²	95	97 Å²	97	50%	0.497	49%	0.485	S	S	.	.	H	α-helix	trans	-65.2	-36	172.4	-71.8	167.3	0	0	0	111.9	I553 E554 I560 N561	I553-L557 HydrophobicContact CG2-CD1 3.97Å; I553-L557 WeakPolarHBondContact O-CG 3.29Å; I553-L557 PolarHBondContact O-N 3.2Å; E554-L557 PolarHBondContact O-N 2.93Å; L557-I560 HydrophobicContact CD2-CD1 4.44Å; L557-I560 PolarHBondContact O-N 3.02Å; L557-N561 PolarHBondContact O-N 3.41Å
558	S	38.1	Very low	37.9	Very low	64 Å²	64	94.7 Å²	94.7	45%	0.448	47%	0.474	S	S	.	.	H	α-helix	trans	-64.5	-38.7	171.9	-173.6	0	0	0	0	112.5	E554 T555 K556 N561 K562	E554-S558 WeakPolarHBondContact O-CB 3.32Å; E554-S558 PolarHBondContact O-N 3.24Å; T555-S558 WeakPolarHBondContact O-CB 3.47Å; T555-S558 PolarHBondContact O-N 3.46Å; K556-S558 VanDerWaalsContact C-N 3.32Å; K556-S558 PolarHBondContact O-N 2.83Å; S558-N561 PolarHBondContact O-N 3.43Å; S558-K562 PolarHBondContact O-N 3.4Å
559	Q	40.3	Very low	37.7	Very low	85 Å²	85	93.8 Å²	93.8	40%	0.397	47%	0.469	S	S	.	.	H	α-helix	trans	-62.6	-42.8	171.8	-70.3	163.4	-1.7	0	0	111.8	T555 K556 N561 K562 H563	T555-Q559 WeakPolarHBondContact O-CG 3.36Å; T555-Q559 PolarHBondContact O-N 3.28Å; K556-Q559 WeakPolarHBondContact O-CB 3.36Å; K556-Q559 PolarHBondContact O-N 3.32Å; Q559-N561 VanDerWaalsContact C-N 3.32Å; Q559-N561 PolarHBondContact O-N 2.83Å; Q559-K562 WeakPolarHBondContact O-CB 3.46Å; Q559-K562 PolarHBondContact O-N 3.48Å; Q559-K562 VanDerWaalsContact O-N 3.09Å; Q559-H563 PolarHBondContact O-CD2 2.84Å; Q559-H563 VanDerWaalsContact O-CD2 3.29Å; Q559-H563 PolarHBondContact O-N 2.91Å
560	I	39.7	Very low	37.8	Very low	63 Å²	63	97 Å²	97	32%	0.323	48%	0.481	S	S	.	.	H	α-helix	trans	-60.6	-40.5	174	-66.8	164.9	0	0	0	111	K556 L557 K562 H563 Y564	K556-I560 WeakPolarHBondContact O-CG1 3.33Å; K556-I560 PolarHBondContact O-N 3.39Å; L557-I560 HydrophobicContact CD2-CD1 4.44Å; L557-I560 PolarHBondContact O-N 3.02Å; I560-K562 VanDerWaalsContact C-N 3.33Å; I560-K562 PolarHBondContact O-N 3.23Å; I560-H563 CarbonylContact O-C 3.5Å; I560-H563 WeakPolarHBondContact O-CA 3.23Å; I560-H563 WeakPolarHBondContact O-CB 3.36Å; I560-H563 PolarHBondContact O-N 2.92Å; I560-Y564 HydrophobicContact CG2-CD2 4.02Å; I560-Y564 HydrophobicContact CG2-CE2 3.73Å; I560-Y564 VanDerWaalsContact O-CD2 3.31Å; I560-Y564 WeakPolarHBondContact O-CD2 3.47Å; I560-Y564 PolarHBondContact O-N 2.79Å
561	N	37.8	Very low	38	Very low	100 Å²	100	94.5 Å²	94.5	54%	0.535	47%	0.465	S	S	.	.	H	α-helix	trans	-64.8	-31.2	173.6	-75.6	-24	0	0	0	113.7	L557 S558 Q559 Y564	L557-N561 PolarHBondContact O-N 3.41Å; S558-N561 PolarHBondContact O-N 3.43Å; Q559-N561 VanDerWaalsContact C-N 3.32Å; Q559-N561 PolarHBondContact O-N 2.83Å; N561-Y564 PolarHBondContact O-N 2.84Å
562	K	38.8	Very low	38.1	Very low	149 Å²	149	92.9 Å²	92.9	65%	0.648	46%	0.456	S	S	*	.	H	α-helix	trans	-67.8	-37.5	167.9	-70.2	-177	177.2	-176.6	0	112.1	S558 Q559 I560 H565 L566	S558-K562 PolarHBondContact O-N 3.4Å; Q559-K562 WeakPolarHBondContact O-CB 3.46Å; Q559-K562 PolarHBondContact O-N 3.48Å; Q559-K562 VanDerWaalsContact O-N 3.09Å; I560-K562 VanDerWaalsContact C-N 3.33Å; I560-K562 PolarHBondContact O-N 3.23Å; K562-H565 PolarHBondContact O-N 2.84Å; K562-L566 PolarHBondContact O-N 2.96Å
563	H	45	Very low	38.4	Very low	46 Å²	46	89.4 Å²	89.4	21%	0.213	44%	0.438	C	S	.	.	H	α-helix	trans	-66.8	-33.2	174.4	-63.4	-47.9	0	0	0	113.3	Q559 I560 H565 L566 I567	Q559-H563 PolarHBondContact O-CD2 2.84Å; Q559-H563 VanDerWaalsContact O-CD2 3.29Å; Q559-H563 PolarHBondContact O-N 2.91Å; I560-H563 CarbonylContact O-C 3.5Å; I560-H563 WeakPolarHBondContact O-CA 3.23Å; I560-H563 WeakPolarHBondContact O-CB 3.36Å; I560-H563 PolarHBondContact O-N 2.92Å; H563-H565 PolarHBondContact O-N 3.32Å; H563-L566 PolarHBondContact O-N 3.32Å; H563-L566 VanDerWaalsContact O-N 3.14Å; H563-I567 PolarHBondContact O-N 3.48Å
564	Y	34.2	Very low	38.2	Very low	101 Å²	101	88.2 Å²	88.2	40%	0.396	43%	0.429	S	S	.	.	H	α-helix	trans	-57.9	-32.8	170.9	-85.7	-73.5	0	0	0	112.9	A465 I560 N561 N568	A465-Y564 HydrophobicContact CB-CD1 4.36Å; A465-Y564 HydrophobicContact CB-CE1 3.56Å; I560-Y564 HydrophobicContact CG2-CD2 4.02Å; I560-Y564 HydrophobicContact CG2-CE2 3.73Å; I560-Y564 VanDerWaalsContact O-CD2 3.31Å; I560-Y564 WeakPolarHBondContact O-CD2 3.47Å; I560-Y564 PolarHBondContact O-N 2.79Å; N561-Y564 PolarHBondContact O-N 2.84Å; Y564-N568 PolarHBondContact O-ND2 2.98Å
565	H	36.9	Very low	38.3	Very low	152 Å²	152	82.1 Å²	82.1	70%	0.704	40%	0.4	S	S	*	.	H	α-helix	trans	-72.2	-36	174.7	-87.5	-84.5	0	0	0	113.6	K562 H563 I567 N568	K562-H565 PolarHBondContact O-N 2.84Å; H563-H565 PolarHBondContact O-N 3.32Å; H565-I567 PolarHBondContact O-N 3.36Å; H565-N568 WeakPolarHBondContact CA-ND2 3.38Å; H565-N568 PolarHBondContact O-N 2.72Å; H565-N568 PolarHBondContact O-ND2 3.32Å
566	L	38.9	Very low	37.9	Very low	60 Å²	60	80.4 Å²	80.4	31%	0.314	39%	0.388	S	S	.	.	H	α-helix	trans	-66.7	-19.2	-180	-70.8	170.1	0	0	0	114	L276 K562 H563 N568	L276-L566 HydrophobicContact CD1-CD2 3.67Å; L276-L566 HydrophobicContact CD2-CD2 3.93Å; L276-L566 HydrophobicContact CG-CD2 4.4Å; K562-L566 PolarHBondContact O-N 2.96Å; H563-L566 PolarHBondContact O-N 3.32Å; H563-L566 VanDerWaalsContact O-N 3.14Å; L566-N568 VanDerWaalsContact C-N 3.34Å
567	I	44.4	Very low	37.6	Very low	10 Å²	10	78.7 Å²	78.7	5%	0.051	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-17.8	-177.5	-73.1	169	0	0	0	112.9	Y461 L468 H563 H565 N569 Q571	Y461-I567 HydrophobicContact CD1-CG2 3.6Å; Y461-I567 HydrophobicContact CE1-CG2 4.06Å; Y461-I567 HydrophobicContact CG-CG2 4.21Å; L468-I567 HydrophobicContact CD1-CD1 3.73Å; H563-I567 PolarHBondContact O-N 3.48Å; H565-I567 PolarHBondContact O-N 3.36Å; I567-N569 VanDerWaalsContact C-N 3.3Å; I567-N569 PolarHBondContact O-N 2.94Å; I567-Q571 PolarHBondContact O-NE2 3.34Å
568	N	34.2	Very low	37	Very low	86 Å²	86	78.7 Å²	78.7	46%	0.46	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-11.5	-167	-68.8	-59.7	0	0	0	116.4	Y461 Y564 H565 L566	Y461-N568 PolarHBondContact OH-O 2.83Å; Y564-N568 PolarHBondContact O-ND2 2.98Å; H565-N568 WeakPolarHBondContact CA-ND2 3.38Å; H565-N568 PolarHBondContact O-N 2.72Å; H565-N568 PolarHBondContact O-ND2 3.32Å; L566-N568 VanDerWaalsContact C-N 3.34Å
569	N	35.4	Very low	36.7	Very low	105 Å²	105	81.5 Å²	81.5	56%	0.561	40%	0.395	S	S	*	.	S	Bend	trans	-99.4	117.5	-178.2	-70.6	-15.3	0	0	0	111.6	L272 I567 Q571	L272-N569 HydrophobicContact CD2-CB 4.38Å; I567-N569 VanDerWaalsContact C-N 3.3Å; I567-N569 PolarHBondContact O-N 2.94Å; N569-Q571 PolarHBondContact O-N 3.32Å
570	E	36.5	Very low	36.3	Very low	170 Å²	170	84.4 Å²	84.4	79%	0.794	41%	0.412	S	S	*	.			trans	8.3	84.6	175.2	-61.1	-160.1	155.9	0	0	117.8	K572	E570-K572 PolarHBondContact O-N 2.99Å
571	Q	39.4	Very low	35.8	Very low	68 Å²	68	89.5 Å²	89.5	32%	0.318	44%	0.44	S	S	.	.			trans	-81.7	117.5	177.3	-62.7	-159.3	-14.7	0	0	112.9	Y461 I567 N569	Y461-Q571 HydrophobicContact CE1-CG 4.37Å; I567-Q571 PolarHBondContact O-NE2 3.34Å; N569-Q571 PolarHBondContact O-N 3.32Å
572	K	39.9	Very low	35.4	Very low	92 Å²	92	91.6 Å²	91.6	40%	0.4	45%	0.451	S	S	.	.			trans	-107	135.5	164.1	-61.7	179.1	179.7	178.4	0	108.6	E570 Y720	E570-K572 PolarHBondContact O-N 2.99Å; K572-Y720 HydrophobicContact CD-CE2 4.11Å; K572-Y720 WeakPolarHBondContact CD-OH 3.39Å; K572-Y720 VanDerWaalsContact NZ-CE2 3.35Å; K572-Y720 VanDerWaalsContact NZ-CZ 3.26Å; K572-Y720 PolarHBondContact NZ-OH 2.93Å
573	I	42	Very low	35	Very low	13 Å²	13	90.9 Å²	90.9	7%	0.067	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	108.7	-168.9	-68.8	172.4	0	0	0	110.6	I264 S265 I266 L588 C589	I264-I573 HydrophobicContact CG2-CG2 3.65Å; S265-I573 WeakPolarHBondContact O-CG2 3.26Å; I266-I573 HydrophobicContact CB-CG2 4.18Å; I266-I573 HydrophobicContact CD1-CD1 4.34Å; I266-I573 HydrophobicContact CG1-CB 4.36Å; I266-I573 HydrophobicContact CG1-CD1 4.16Å; I266-I573 HydrophobicContact CG1-CG1 4.07Å; I266-I573 HydrophobicContact CG1-CG2 3.5Å; I266-I573 HydrophobicContact CG2-CB 4.5Å; I266-I573 HydrophobicContact CG2-CG1 3.99Å; I266-I573 HydrophobicContact CG2-CG2 4.32Å; I573-L588 WeakPolarHBondContact O-CD1 3.38Å; I573-C589 HydrophobicContact CB-CB 4.01Å; I573-C589 HydrophobicContact CG2-CB 3.78Å; I573-C589 PolarHBondContact O-N 3.47Å
574	K	33.3	Very low	34.5	Very low	71 Å²	71	94.8 Å²	94.8	31%	0.309	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	119.4	169.9	-82.3	-175.6	175.7	-93.6	0	111.6	S265 S267 L588 L723 N724	S265-K574 CarbonylContact C-O 3.5Å; S265-K574 CarbonylContact O-C 3.49Å; S265-K574 VanDerWaalsContact O-C 3.3Å; S267-K574 PolarHBondContact N-O 3.01Å; K574-L588 HydrophobicContact CB-CD1 4.39Å; K574-L588 HydrophobicContact CG-CD1 3.45Å; K574-L588 VanDerWaalsContact CG-CD1 3.45Å; K574-L723 PolarHBondContact NZ-O 3.41Å; K574-N724 VanDerWaalsContact CE-OD1 3.24Å; K574-N724 WeakPolarHBondContact CE-OD1 3.26Å; K574-N724 PolarHBondContact NZ-OD1 2.78Å
575	Y	38.1	Very low	34.8	Very low	13 Å²	13	93.9 Å²	93.9	5%	0.051	48%	0.479	C	S	.	.			trans	-95.1	166.5	174.2	141.4	-99.5	0	0	0	111.5	Y263 S265 N577 C586 K587	Y263-Y575 WeakPolarHBondContact O-CD2 3.3Å; Y263-Y575 WeakPolarHBondContact O-CE2 3.47Å; S265-Y575 VanDerWaalsContact O-CA 3.28Å; S265-Y575 WeakPolarHBondContact O-CA 3.3Å; S265-Y575 PolarHBondContact O-N 2.73Å; Y575-N577 HydrophobicContact CE1-CB 4.06Å; Y575-N577 HydrophobicContact CE2-CB 4.16Å; Y575-N577 WeakPolarHBondContact OH-CB 3.42Å; Y575-N577 PolarHBondContact OH-OD1 3.07Å; Y575-C586 CarbonylContact O-C 3.39Å; Y575-C586 WeakPolarHBondContact O-CA 3.34Å; Y575-C586 WeakPolarHBondContact O-CB 3.19Å; Y575-K587 WeakPolarHBondContact CA-O 3.36Å; Y575-K587 VanDerWaalsContact CB-O 3.31Å; Y575-K587 WeakPolarHBondContact CB-O 3.39Å; Y575-K587 HydrophobicContact CD1-CB 3.61Å; Y575-K587 HydrophobicContact CD1-CG 4.23Å; Y575-K587 WeakPolarHBondContact CD1-O 3.29Å; Y575-K587 HydrophobicContact CE1-CB 3.77Å; Y575-K587 HydrophobicContact CE1-CD 4.16Å; Y575-K587 HydrophobicContact CE1-CG 3.92Å; Y575-K587 PolarHBondContact N-O 2.79Å
576	N	27.4	Very low	35	Very low	38 Å²	38	88.8 Å²	88.8	20%	0.203	46%	0.459	C	S	.	.			trans	-140.4	136.9	167.3	-171.5	8.1	0	0	0	109.2	N578 C586	N576-N578 PolarHBondContact O-N 2.68Å; N576-C586 VanDerWaalsContact CG-SG 3.57Å
577	N	31.4	Very low	35.6	Very low	72 Å²	72	88.1 Å²	88.1	39%	0.385	45%	0.454	S	S	.	.			trans	-97.1	74.9	-170.9	-172.3	38.4	0	0	0	113.4	Y575 N579	Y575-N577 HydrophobicContact CE1-CB 4.06Å; Y575-N577 HydrophobicContact CE2-CB 4.16Å; Y575-N577 WeakPolarHBondContact OH-CB 3.42Å; Y575-N577 PolarHBondContact OH-OD1 3.07Å; N577-N579 PolarHBondContact O-N 3.44Å
578	N	26.4	Very low	35.7	Very low	94 Å²	94	87.9 Å²	87.9	50%	0.503	45%	0.453	S	S	.	.			trans	-76.7	80.9	173.3	-71	68.4	0	0	0	111.8	N576	N576-N578 PolarHBondContact O-N 2.68Å
579	N	31.1	Very low	36.4	Very low	124 Å²	124	83.9 Å²	83.9	66%	0.663	43%	0.432	S	S	*	.	S	Bend	trans	-159.6	124.8	159.9	-95.8	-37.4	0	0	0	110.8	N577	N577-N579 PolarHBondContact O-N 3.44Å
580	I	31	Very low	37.4	Very low	146 Å²	146	81.3 Å²	81.3	75%	0.749	42%	0.416	S	S	*	.	S	Bend	trans	67.3	93.4	176.9	-47.8	174.5	0	0	0	114.5	D582	I580-D582 VanDerWaalsContact C-N 3.26Å; I580-D582 PolarHBondContact O-N 3.14Å
581	N	29	Very low	38.3	Very low	170 Å²	170	75.7 Å²	75.7	91%	0.909	39%	0.391	S	S	*	.	S	Bend	trans	44.4	-4.2	148.6	-68.4	20.8	0	0	0	123.5
582	D	29.4	Very low	39	Very low	143 Å²	143	74.4 Å²	74.4	77%	0.765	39%	0.39	S	S	*	.	S	Bend	trans	-104.1	155.4	175.3	-78.4	-55.5	0	0	0	112.9	I580	I580-D582 VanDerWaalsContact C-N 3.26Å; I580-D582 PolarHBondContact O-N 3.14Å
583	N	31.8	Very low	39.3	Very low	134 Å²	134	72.4 Å²	72.4	72%	0.717	38%	0.383	S	S	*	.			trans	-60.1	159.9	-166.2	-71	-56.6	0	0	0	115.9	N585	N583-N585 VanDerWaalsContact C-N 3.28Å; N583-N585 VanDerWaalsContact O-CG 3.31Å; N583-N585 PolarHBondContact O-N 3.37Å
584	N	33.5	Very low	39.9	Very low	128 Å²	128	73.9 Å²	73.9	68%	0.684	39%	0.388	S	S	*	.			trans	-48.7	58.1	-173.2	-68.1	-57.1	0	0	0	118.3	C586	N584-C586 PolarHBondContact O-N 2.79Å; N584-C586 PolarHBondContact O-SG 2.82Å
585	N	41.6	Very low	40.3	Very low	83 Å²	83	72.1 Å²	72.1	44%	0.444	38%	0.381	S	S	.	.			trans	-82.4	106.5	-174.6	-70.2	-24	0	0	0	112.2	N583 K587	N583-N585 VanDerWaalsContact C-N 3.28Å; N583-N585 VanDerWaalsContact O-CG 3.31Å; N583-N585 PolarHBondContact O-N 3.37Å; N585-K587 PolarHBondContact O-N 3.18Å
586	C	40.8	Very low	40.5	Very low	44 Å²	44	73.5 Å²	73.5	30%	0.297	39%	0.389	S	S	.	.			trans	-95.2	70.8	-170.6	-66.2	0	0	0	0	113.9	Y575 N576 N584	Y575-C586 CarbonylContact O-C 3.39Å; Y575-C586 WeakPolarHBondContact O-CA 3.34Å; Y575-C586 WeakPolarHBondContact O-CB 3.19Å; N576-C586 VanDerWaalsContact CG-SG 3.57Å; N584-C586 PolarHBondContact O-N 2.79Å; N584-C586 PolarHBondContact O-SG 2.82Å
587	K	51	Low	41	Very low	47 Å²	47	79.5 Å²	79.5	20%	0.204	41%	0.41	C	S	.	.			trans	-59	148.9	-179	-43.9	-170.6	176	-154.1	0	112.3	F436 H437 Y575 N585	F436-K587 HydrophobicContact CD2-CD 3.76Å; F436-K587 VanDerWaalsContact CD2-NZ 3.3Å; F436-K587 HydrophobicContact CE2-CD 3.57Å; F436-K587 HydrophobicContact CZ-CD 4.45Å; F436-K587 WeakPolarHBondContact O-CD 3.44Å; F436-K587 VanDerWaalsContact O-CE 3.28Å; F436-K587 WeakPolarHBondContact O-CE 3.28Å; F436-K587 PolarHBondContact O-NZ 2.94Å; H437-K587 WeakPolarHBondContact O-CA 3Å; H437-K587 VanDerWaalsContact O-CB 3.31Å; H437-K587 WeakPolarHBondContact O-CB 3.31Å; Y575-K587 WeakPolarHBondContact CA-O 3.36Å; Y575-K587 VanDerWaalsContact CB-O 3.31Å; Y575-K587 WeakPolarHBondContact CB-O 3.39Å; Y575-K587 HydrophobicContact CD1-CB 3.61Å; Y575-K587 HydrophobicContact CD1-CG 4.23Å; Y575-K587 WeakPolarHBondContact CD1-O 3.29Å; Y575-K587 HydrophobicContact CE1-CB 3.77Å; Y575-K587 HydrophobicContact CE1-CD 4.16Å; Y575-K587 HydrophobicContact CE1-CG 3.92Å; Y575-K587 PolarHBondContact N-O 2.79Å; N585-K587 PolarHBondContact O-N 3.18Å
588	L	46.5	Very low	41.3	Very low	4 Å²	4	81.5 Å²	81.5	2%	0.021	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	146.4	-175.5	-168	69.3	0	0	0	110.4	H437 D438 I439 I573 K574 H590 N724	H437-L588 PolarHBondContact O-N 3.38Å; D438-L588 CarbonylContact C-O 3.43Å; D438-L588 VanDerWaalsContact CA-O 3.31Å; D438-L588 WeakPolarHBondContact CA-O 3.29Å; D438-L588 WeakPolarHBondContact OD1-CB 3.38Å; I439-L588 PolarHBondContact N-O 2.85Å; I573-L588 WeakPolarHBondContact O-CD1 3.38Å; K574-L588 HydrophobicContact CB-CD1 4.39Å; K574-L588 HydrophobicContact CG-CD1 3.45Å; K574-L588 VanDerWaalsContact CG-CD1 3.45Å; L588-H590 WeakPolarHBondContact CD2-NE2 3.31Å; L588-N724 HydrophobicContact CD2-CB 4.31Å
589	C	48.7	Very low	41.8	Very low	3 Å²	3	81.7 Å²	81.7	2%	0.02	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	119.7	172.3	-173.3	0	0	0	0	109.8	I264 I439 I573	I264-C589 HydrophobicContact CD1-CB 4.25Å; I264-C589 HydrophobicContact CG2-CB 4.33Å; I439-C589 HydrophobicContact CB-CB 4.49Å; I573-C589 HydrophobicContact CB-CB 4.01Å; I573-C589 HydrophobicContact CG2-CB 3.78Å; I573-C589 PolarHBondContact O-N 3.47Å
590	H	56.7	Low	42.4	Very low	50 Å²	50	82.4 Å²	82.4	23%	0.231	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	104	-178.6	-94.4	-65.7	0	0	0	110.4	D438 I439 E440 L441 L588	D438-H590 IonicContact OD1-CD2 2.65Å; I439-H590 PolarHBondContact O-N 2.87Å; E440-H590 WeakPolarHBondContact CA-O 3.45Å; E440-H590 HydrophobicContact CG-CB 4.24Å; L441-H590 PolarHBondContact N-O 3.08Å; L588-H590 WeakPolarHBondContact CD2-NE2 3.31Å
591	L	56.1	Low	43.2	Very low	52 Å²	52	77.1 Å²	77.1	27%	0.272	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	118.6	173.8	-178.9	63.4	0	0	0	110.2	I402 L441 F443 V460 L593	I402-L591 HydrophobicContact CD1-CD2 3.91Å; L441-L591 HydrophobicContact CB-CD1 4.16Å; F443-L591 HydrophobicContact CD2-CD1 3.64Å; F443-L591 HydrophobicContact CE2-CD1 3.44Å; F443-L591 VanDerWaalsContact CE2-CD1 3.44Å; F443-L591 HydrophobicContact CZ-CD1 4.47Å; V460-L591 HydrophobicContact CG1-CD2 4.11Å; V460-L591 HydrophobicContact CG2-CD2 4.2Å; L591-L593 HydrophobicContact CG-CD1 4.47Å
592	S	54.4	Low	44.3	Very low	41 Å²	41	75.6 Å²	75.6	29%	0.287	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	134.9	174.8	-171.3	0	0	0	0	110.3	L441 I442 F443	L441-S592 WeakPolarHBondContact O-CA 3.36Å; L441-S592 WeakPolarHBondContact O-CB 3.48Å; L441-S592 PolarHBondContact O-N 3Å; I442-S592 WeakPolarHBondContact CA-O 3.31Å; F443-S592 PolarHBondContact N-O 3.16Å; F443-S592 VanDerWaalsContact N-O 3.07Å
593	L	45.5	Very low	45.5	Very low	50 Å²	50	69.9 Å²	69.9	26%	0.262	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	130.6	168.8	-69.6	116.5	0	0	0	108.1	L406 F443 V445 I456 L591	L406-L593 HydrophobicContact CD1-CD2 4.25Å; F443-L593 HydrophobicContact CB-CD2 3.86Å; F443-L593 HydrophobicContact CB-CG 4.23Å; V445-L593 HydrophobicContact CG1-CD2 4.5Å; V445-L593 HydrophobicContact CG2-CB 4.36Å; V445-L593 HydrophobicContact CG2-CD2 3.98Å; I456-L593 HydrophobicContact CD1-CD2 4.39Å; I456-L593 HydrophobicContact CG2-CD1 3.61Å; I456-L593 HydrophobicContact CG2-CD2 3.7Å; I456-L593 HydrophobicContact CG2-CG 4.19Å; L591-L593 HydrophobicContact CG-CD1 4.47Å
594	R	55.6	Low	46.6	Very low	44 Å²	44	64 Å²	64	17%	0.166	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	148.5	-176.9	-66.3	-168.4	-173.8	-173.9	7.3	110.9	I442 F443 V445 D601	I442-R594 HydrophobicContact CG2-CB 4.15Å; I442-R594 HydrophobicContact CG2-CG 3.93Å; F443-R594 PolarHBondContact O-N 2.9Å; V445-R594 PolarHBondContact N-O 2.93Å; R594-D601 IonicContact CZ-OD1 2.73Å; R594-D601 IonicContact NH1-OD1 3.54Å; R594-D601 PolarHBondContact NH1-OD1 3.36Å
595	H	39.9	Very low	48.1	Very low	34 Å²	34	58.5 Å²	58.5	16%	0.157	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	161.9	178.1	-161.7	17.5	0	0	0	111.5	V445 D446 L447 S448 Y597 L599	V445-H595 WeakPolarHBondContact O-CA 3.44Å; D446-H595 IonicContact OD1-CE1 3.24Å; D446-H595 PolarHBondContact OD1-CE1 2.99Å; L447-H595 HydrophobicContact CB-CB 4.36Å; L447-H595 HydrophobicContact CD1-CB 4.07Å; L447-H595 HydrophobicContact CG-CB 4.4Å; L447-H595 PolarHBondContact N-CE1 3.3Å; L447-H595 VanDerWaalsContact N-CE1 3.3Å; L447-H595 PolarHBondContact N-ND1 3.06Å; L447-H595 VanDerWaalsContact N-ND1 3.12Å; S448-H595 PolarHBondContact N-CE1 2.68Å; H595-Y597 VanDerWaalsContact C-N 3.32Å; H595-Y597 AromaticContact CD2-CD2 3.78Å; H595-Y597 AromaticContact NE2-CD2 3.48Å; H595-Y597 WeakPolarHBondContact NE2-CD2 3.35Å; H595-Y597 AromaticContact NE2-CE2 3.84Å; H595-Y597 PolarHBondContact O-N 3.31Å; H595-L599 HydrophobicContact CB-CD1 4.11Å
596	L	43	Very low	49	Very low	42 Å²	42	54.7 Å²	54.7	22%	0.22	27%	0.266	C	S	.	.	S	Bend	trans	-70.6	-25	-178.3	-61.3	180	0	0	0	114	K414 V445 D446	K414-L596 HydrophobicContact CB-CD2 4.26Å; K414-L596 HydrophobicContact CD-CD1 4.29Å; K414-L596 HydrophobicContact CD-CD2 3.75Å; K414-L596 HydrophobicContact CG-CD2 3.86Å; V445-L596 WeakPolarHBondContact O-CG 3.36Å; V445-L596 PolarHBondContact O-N 3.48Å; D446-L596 HydrophobicContact CB-CD1 3.67Å; D446-L596 HydrophobicContact CB-CG 4.25Å; D446-L596 WeakPolarHBondContact OD2-CD1 3.46Å
597	Y	38	Very low	49.9	Very low	165 Å²	165	52.9 Å²	52.9	65%	0.647	25%	0.254	S	S	*	.	S	Bend	trans	-77	141.3	170.8	-64.5	-75.9	0	0	0	109.3	H595 L599	H595-Y597 VanDerWaalsContact C-N 3.32Å; H595-Y597 AromaticContact CD2-CD2 3.78Å; H595-Y597 AromaticContact NE2-CD2 3.48Å; H595-Y597 WeakPolarHBondContact NE2-CD2 3.35Å; H595-Y597 AromaticContact NE2-CE2 3.84Å; H595-Y597 PolarHBondContact O-N 3.31Å; Y597-L599 PolarHBondContact O-N 2.93Å
598	P	37.6	Very low	50.7	Low	114 Å²	114	51.1 Å²	51.1	74%	0.74	25%	0.246	S	C	*	.			trans	-70.2	75.1	169.2	31.5	-34.6	0	0	0	109.5	Y600	P598-Y600 PolarHBondContact O-N 2.62Å
599	L	36.2	Very low	52.3	Low	97 Å²	97	50.9 Å²	50.9	51%	0.508	25%	0.245	S	C	.	.			trans	-58.7	131.1	158.7	-69.2	171	0	0	0	106.9	H595 Y597 D601	H595-L599 HydrophobicContact CB-CD1 4.11Å; Y597-L599 PolarHBondContact O-N 2.93Å; L599-D601 PolarHBondContact O-N 3.45Å
600	Y	43.4	Very low	54.2	Low	140 Å²	140	50.8 Å²	50.8	55%	0.549	24%	0.244	S	C	.	.			trans	-37.4	118.1	-170.2	-58.4	-78.6	0	0	0	113	P598 Y602 E668	P598-Y600 PolarHBondContact O-N 2.62Å; Y600-Y602 VanDerWaalsContact O-CD2 3.27Å; Y600-Y602 WeakPolarHBondContact O-CD2 3.37Å; Y600-Y602 WeakPolarHBondContact O-CE2 3.25Å; Y600-Y602 PolarHBondContact O-N 3.49Å; Y600-E668 WeakPolarHBondContact CB-OE1 3.47Å; Y600-E668 WeakPolarHBondContact CD1-OE1 3.27Å
601	D	49.3	Very low	55.8	Low	35 Å²	35	48.5 Å²	48.5	19%	0.187	23%	0.233	C	C	.	.			trans	-67.8	98.1	-176.3	-87.7	-64.9	0	0	0	110.5	R594 L599 N603 I645	R594-D601 IonicContact CZ-OD1 2.73Å; R594-D601 IonicContact NH1-OD1 3.54Å; R594-D601 PolarHBondContact NH1-OD1 3.36Å; L599-D601 PolarHBondContact O-N 3.45Å; D601-N603 PolarHBondContact O-N 3.2Å; D601-I645 HydrophobicContact CB-CD1 4.47Å; D601-I645 HydrophobicContact CB-CG2 3.55Å; D601-I645 WeakPolarHBondContact OD2-CG2 3.4Å
602	Y	51.9	Low	57.5	Low	137 Å²	137	46 Å²	46	54%	0.537	22%	0.22	S	C	.	.	S	Bend	trans	-53.7	10.4	-175.9	-61.3	-83.6	0	0	0	117.9	Y600 Y670	Y600-Y602 VanDerWaalsContact O-CD2 3.27Å; Y600-Y602 WeakPolarHBondContact O-CD2 3.37Å; Y600-Y602 WeakPolarHBondContact O-CE2 3.25Å; Y600-Y602 PolarHBondContact O-N 3.49Å; Y602-Y670 HydrophobicContact CD1-CD2 4.33Å; Y602-Y670 AromaticContact CD1-CE2 3.83Å; Y602-Y670 HydrophobicContact CD1-CE2 3.83Å; Y602-Y670 AromaticContact CE1-CE2 3.95Å; Y602-Y670 HydrophobicContact CE1-CE2 3.95Å
603	N	53.3	Low	59.4	Low	23 Å²	23	44.5 Å²	44.5	12%	0.123	21%	0.209	C	C	.	.			trans	-109.6	74.2	-179.6	-76.4	-22.7	0	0	0	110.3	N419 D601 L605 Y608 K676	N419-N603 PolarHBondContact ND2-ND2 3.49Å; D601-N603 PolarHBondContact O-N 3.2Å; N603-L605 PolarHBondContact O-N 2.86Å; N603-L605 VanDerWaalsContact O-N 3.16Å; N603-Y608 VanDerWaalsContact CB-O 3.26Å; N603-Y608 WeakPolarHBondContact CB-O 3.49Å; N603-Y608 PolarHBondContact ND2-O 3.45Å; N603-K676 PolarHBondContact OD1-NZ 3.3Å
604	S	56.9	Low	61.8	Low	12 Å²	12	42.1 Å²	42.1	8%	0.084	20%	0.196	C	C	.	.			trans	-62	-18	177.2	-53	0	0	0	0	114.5	I663 Y664 K665	S604-I663 WeakPolarHBondContact O-CA 3.49Å; S604-Y664 PolarHBondContact O-N 2.84Å; S604-K665 VanDerWaalsContact CB-O 3.27Å; S604-K665 WeakPolarHBondContact CB-O 3.4Å; S604-K665 PolarHBondContact OG-O 3.13Å
605	L	63.8	Low	63.5	Low	11 Å²	11	41.3 Å²	41.3	6%	0.058	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-91.8	129.5	-179.2	-69	164.6	0	0	0	111.3	N603 T607 Y608 I661 I663 K676 L680	N603-L605 PolarHBondContact O-N 2.86Å; N603-L605 VanDerWaalsContact O-N 3.16Å; L605-T607 VanDerWaalsContact C-N 3.34Å; L605-T607 PolarHBondContact O-N 2.98Å; L605-Y608 HydrophobicContact CB-CD2 4.12Å; L605-Y608 PolarHBondContact O-N 3.49Å; L605-Y608 VanDerWaalsContact O-N 3.08Å; L605-I661 HydrophobicContact CD2-CG2 3.53Å; L605-I663 HydrophobicContact CD2-CD1 4Å; L605-I663 HydrophobicContact CD2-CG1 3.64Å; L605-I663 HydrophobicContact CG-CG1 4.5Å; L605-K676 HydrophobicContact CD1-CB 3.68Å; L605-L680 HydrophobicContact CB-CD1 4.5Å; L605-L680 HydrophobicContact CD1-CD1 4.17Å; L605-L680 HydrophobicContact CD2-CD1 4.16Å
606	I	60.2	Low	66	Low	3 Å²	3	41.1 Å²	41.1	2%	0.015	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-49.7	-45.3	-173.8	-78.8	-169.8	0	0	0	114.6	Y608 S609 V652 H655 I656 V662 Y664	I606-Y608 PolarHBondContact O-N 3.14Å; I606-S609 WeakPolarHBondContact O-CB 3.37Å; I606-S609 PolarHBondContact O-N 3.26Å; I606-S609 PolarHBondContact O-OG 3.22Å; I606-V652 HydrophobicContact CG2-CB 4.26Å; I606-V652 HydrophobicContact CG2-CG1 3.79Å; I606-V652 HydrophobicContact CG2-CG2 4.26Å; I606-H655 HydrophobicContact CD1-CB 3.63Å; I606-H655 WeakPolarHBondContact CD1-ND1 3.45Å; I606-H655 HydrophobicContact CG2-CB 4.23Å; I606-I656 HydrophobicContact CG2-CD1 4.29Å; I606-I656 HydrophobicContact CG2-CG1 3.89Å; I606-V662 HydrophobicContact CD1-CB 3.52Å; I606-V662 HydrophobicContact CD1-CG1 4.35Å; I606-V662 HydrophobicContact CD1-CG2 3.69Å; I606-V662 HydrophobicContact CG1-CB 3.98Å; I606-V662 PolarHBondContact N-O 3.28Å; I606-Y664 HydrophobicContact CD1-CD2 4.47Å; I606-Y664 HydrophobicContact CD1-CE2 3.54Å; I606-Y664 HydrophobicContact CG1-CD2 4.1Å; I606-Y664 HydrophobicContact CG1-CE2 3.6Å
607	T	60.4	Low	68.4	Low	7 Å²	7	39.1 Å²	39.1	4%	0.043	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-60.6	-15.2	-175.8	43.5	0	0	0	0	114.1	S424 L605 I656 L680 Y685	S424-T607 PolarHBondContact OG-O 2.99Å; L605-T607 VanDerWaalsContact C-N 3.34Å; L605-T607 PolarHBondContact O-N 2.98Å; T607-I656 HydrophobicContact CG2-CG1 4.26Å; T607-L680 HydrophobicContact CG2-CD2 3.94Å; T607-Y685 HydrophobicContact CG2-CD1 4.48Å; T607-Y685 HydrophobicContact CG2-CE1 3.72Å
608	Y	68.1	Low	71	Confident	9 Å²	9	31.5 Å²	31.5	4%	0.035	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-110.2	13.1	178.4	-61.8	-83.9	0	0	0	113.1	N419 D421 N603 L605 I606 K676 K679	N419-Y608 PolarHBondContact OD1-O 3.48Å; D421-Y608 WeakPolarHBondContact OD1-CE1 3.21Å; D421-Y608 PolarHBondContact OD1-OH 2.95Å; N603-Y608 VanDerWaalsContact CB-O 3.26Å; N603-Y608 WeakPolarHBondContact CB-O 3.49Å; N603-Y608 PolarHBondContact ND2-O 3.45Å; L605-Y608 HydrophobicContact CB-CD2 4.12Å; L605-Y608 PolarHBondContact O-N 3.49Å; L605-Y608 VanDerWaalsContact O-N 3.08Å; I606-Y608 PolarHBondContact O-N 3.14Å; Y608-K676 HydrophobicContact CD2-CD 4.25Å; Y608-K676 HydrophobicContact CE2-CD 4.05Å; Y608-K679 PolarHBondContact OH-NZ 3.11Å
609	S	80	Confident	73.5	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.147	C	C	.	.			trans	-102.7	0	-173.1	74.1	0	0	0	0	115.4	I606 I645	I606-S609 WeakPolarHBondContact O-CB 3.37Å; I606-S609 PolarHBondContact O-N 3.26Å; I606-S609 PolarHBondContact O-OG 3.22Å; S609-I645 PolarHBondContact O-N 3.47Å
610	L	87.2	Confident	76.1	Confident	1 Å²	1	28 Å²	28	1%	0.005	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	116.6	179.8	-67.5	170.9	0	0	0	110.7	N419 A423 I427 V642 Y649 V652 I653 I656	N419-L610 PolarHBondContact OD1-O 3.32Å; A423-L610 WeakPolarHBondContact CB-O 3.38Å; I427-L610 HydrophobicContact CD1-CB 4.04Å; I427-L610 HydrophobicContact CD1-CD1 3.79Å; I427-L610 HydrophobicContact CD1-CD2 4.39Å; I427-L610 HydrophobicContact CD1-CG 4.3Å; L610-V642 HydrophobicContact CD2-CG1 4.02Å; L610-Y649 HydrophobicContact CD2-CD2 3.87Å; L610-Y649 HydrophobicContact CD2-CE2 4.1Å; L610-V652 HydrophobicContact CD1-CG1 3.73Å; L610-V652 HydrophobicContact CD2-CB 4.42Å; L610-V652 HydrophobicContact CD2-CG1 3.67Å; L610-V652 HydrophobicContact CG-CG1 3.68Å; L610-I653 HydrophobicContact CD1-CD1 4.1Å; L610-I656 HydrophobicContact CD1-CD1 3.54Å
611	H	90.5	Very high	78.3	Confident	1 Å²	1	21.7 Å²	21.7	1%	0.005	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	130.1	172.3	-67.7	-160	0	0	0	110.5	R417 L418 N419 I442 K643 I645	R417-H611 HydrophobicContact CB-CB 4.22Å; R417-H611 HydrophobicContact CG-CB 4.49Å; L418-H611 CarbonylContact O-C 3.5Å; L418-H611 WeakPolarHBondContact O-CA 3.47Å; N419-H611 VanDerWaalsContact CG-CD2 3.41Å; N419-H611 VanDerWaalsContact CG-NE2 3.32Å; N419-H611 PolarHBondContact OD1-CD2 3.23Å; N419-H611 PolarHBondContact OD1-NE2 3.5Å; N419-H611 VanDerWaalsContact OD1-NE2 3.16Å; I442-H611 WeakPolarHBondContact CD1-CE1 3.05Å; H611-K643 PolarHBondContact N-O 3.06Å; H611-K643 PolarHBondContact O-N 3.42Å; H611-I645 WeakPolarHBondContact CD2-CD1 3.47Å; H611-I645 WeakPolarHBondContact CE1-CD1 3.4Å; H611-I645 WeakPolarHBondContact NE2-CD1 3.41Å
612	I	93.1	Very high	80	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	129.1	175.1	-52.1	-179.9	0	0	0	109.4	L248 L256 R417 L418 A423 I426 I427 V640 V642	L248-I612 HydrophobicContact CD1-CD1 4.47Å; L248-I612 HydrophobicContact CD1-CG2 4.12Å; L256-I612 HydrophobicContact CD2-CG2 4.05Å; R417-I612 CarbonylContact C-O 3.57Å; R417-I612 WeakPolarHBondContact CA-O 3.37Å; R417-I612 WeakPolarHBondContact CB-O 3.19Å; L418-I612 HydrophobicContact CB-CB 4.38Å; L418-I612 PolarHBondContact N-O 3.21Å; L418-I612 PolarHBondContact O-N 3.28Å; A423-I612 HydrophobicContact CB-CD1 4.14Å; A423-I612 HydrophobicContact CB-CG1 4.02Å; I426-I612 HydrophobicContact CB-CD1 3.92Å; I426-I612 HydrophobicContact CD1-CD1 3.87Å; I426-I612 HydrophobicContact CG2-CD1 3.76Å; I427-I612 HydrophobicContact CD1-CD1 4.31Å; I427-I612 HydrophobicContact CD1-CG1 4.26Å; I427-I612 HydrophobicContact CG1-CD1 4.35Å; I612-V640 HydrophobicContact CG2-CG1 3.54Å; I612-V642 HydrophobicContact CG1-CG2 4.32Å
613	I	94	Very high	81.5	Confident	9 Å²	9	18.8 Å²	18.8	5%	0.046	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	113.5	-178.2	-55.5	173.4	0	0	0	109.6	E415 R417 D615 V641	E415-I613 HydrophobicContact CG-CG2 4.05Å; E415-I613 WeakPolarHBondContact OE2-CD1 3.26Å; E415-I613 WeakPolarHBondContact OE2-CG1 3.49Å; R417-I613 HydrophobicContact CG-CG1 4.24Å; I613-D615 HydrophobicContact CG2-CB 4.28Å; I613-V641 WeakPolarHBondContact CB-O 3.33Å; I613-V641 HydrophobicContact CD1-CB 4.34Å; I613-V641 HydrophobicContact CD1-CG1 4.28Å; I613-V641 PolarHBondContact N-O 2.74Å
614	L	94.8	Very high	82.8	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.095	C	C	.	.			trans	-84.8	-16.4	-171.6	-60.2	-175.2	0	0	0	114	L256 M260 I399 I416 L418 S616 L617 L618	L256-L614 HydrophobicContact CD1-CD2 4.04Å; L256-L614 HydrophobicContact CD2-CD2 4.4Å; M260-L614 HydrophobicContact CE-CD1 4.16Å; M260-L614 HydrophobicContact SD-CD1 4.12Å; M260-L614 HydrophobicContact SD-CD2 4.48Å; I399-L614 HydrophobicContact CD1-CD1 3.95Å; I416-L614 HydrophobicContact CG2-CD1 4.18Å; I416-L614 WeakPolarHBondContact O-CB 3.17Å; I416-L614 PolarHBondContact O-N 3.01Å; L418-L614 HydrophobicContact CB-CD1 4.19Å; L418-L614 HydrophobicContact CB-CD2 3.99Å; L418-L614 HydrophobicContact CB-CG 4.21Å; L418-L614 HydrophobicContact CD2-CD2 4.44Å; L614-S616 VanDerWaalsContact C-N 3.33Å; L614-S616 PolarHBondContact O-N 3.47Å; L614-L617 WeakPolarHBondContact O-CA 3.36Å; L614-L617 WeakPolarHBondContact O-CB 3.22Å; L614-L617 PolarHBondContact O-N 2.91Å; L614-L618 HydrophobicContact CB-CD1 4.01Å; L614-L618 HydrophobicContact CB-CG 4.22Å; L614-L618 WeakPolarHBondContact O-CG 3.32Å; L614-L618 PolarHBondContact O-N 3.29Å
615	D	92.7	Very high	83.5	Confident	27 Å²	27	22 Å²	22	14%	0.144	11%	0.113	C	C	.	.	H	α-helix	trans	-49.4	-44.9	-172.7	-80.6	37.3	0	0	0	114.7	I416 I613 L617 L618 K619	I416-D615 PolarHBondContact N-OD1 3.38Å; I613-D615 HydrophobicContact CG2-CB 4.28Å; D615-L617 VanDerWaalsContact C-N 3.33Å; D615-L617 PolarHBondContact O-N 3.17Å; D615-L618 PolarHBondContact O-N 3.3Å; D615-K619 WeakPolarHBondContact O-CB 3.47Å; D615-K619 WeakPolarHBondContact O-CD 3.22Å; D615-K619 WeakPolarHBondContact O-CG 3.35Å; D615-K619 PolarHBondContact O-N 3.02Å
616	S	92.6	Very high	83.5	Confident	31 Å²	31	26.2 Å²	26.2	22%	0.217	13%	0.132	C	C	.	.	H	α-helix	trans	-62.6	-39.9	178.1	-57.4	0	0	0	0	112.3	L614 F620 I639	L614-S616 VanDerWaalsContact C-N 3.33Å; L614-S616 PolarHBondContact O-N 3.47Å; S616-F620 WeakPolarHBondContact O-CB 3.46Å; S616-F620 PolarHBondContact O-N 3.49Å; S616-I639 WeakPolarHBondContact CB-O 3.37Å; S616-I639 PolarHBondContact OG-O 3.02Å
617	L	93.2	Very high	83.7	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-75.5	-38	-179.1	-174.9	61.7	0	0	0	111.6	L256 M260 L614 D615 F620 Y621 P638 V640	L256-L617 HydrophobicContact CD1-CD2 4.42Å; L256-L617 HydrophobicContact CD2-CD2 3.65Å; L256-L617 HydrophobicContact CG-CD2 3.61Å; M260-L617 HydrophobicContact CG-CD2 4.13Å; L614-L617 WeakPolarHBondContact O-CA 3.36Å; L614-L617 WeakPolarHBondContact O-CB 3.22Å; L614-L617 PolarHBondContact O-N 2.91Å; D615-L617 VanDerWaalsContact C-N 3.33Å; D615-L617 PolarHBondContact O-N 3.17Å; L617-F620 WeakPolarHBondContact O-CB 3.44Å; L617-F620 PolarHBondContact O-N 2.88Å; L617-Y621 HydrophobicContact CD1-CE1 3.92Å; L617-Y621 HydrophobicContact CD1-CE2 4.34Å; L617-Y621 HydrophobicContact CD2-CE2 4.31Å; L617-Y621 WeakPolarHBondContact CD2-OH 3.39Å; L617-Y621 HydrophobicContact CG-CE1 4.27Å; L617-Y621 HydrophobicContact CG-CE2 3.78Å; L617-Y621 WeakPolarHBondContact CG-OH 3.41Å; L617-Y621 WeakPolarHBondContact O-CD2 3.43Å; L617-Y621 PolarHBondContact O-N 3.32Å; L617-P638 HydrophobicContact CB-CG 4.34Å; L617-P638 HydrophobicContact CD1-CG 3.66Å; L617-V640 HydrophobicContact CB-CG2 4.18Å
618	L	92.2	Very high	83.8	Confident	4 Å²	4	37 Å²	37	2%	0.021	18%	0.177	C	C	.	.	H	α-helix	trans	-64.2	-42.9	172.8	-66.5	172.3	0	0	0	111.6	M260 I399 I416 L614 D615 F620 Y621 D622	M260-L618 HydrophobicContact CE-CD2 3.76Å; I399-L618 HydrophobicContact CG2-CD1 3.82Å; I399-L618 HydrophobicContact CG2-CD2 3.9Å; I416-L618 HydrophobicContact CB-CD1 4.25Å; I416-L618 HydrophobicContact CD1-CD1 3.83Å; L614-L618 HydrophobicContact CB-CD1 4.01Å; L614-L618 HydrophobicContact CB-CG 4.22Å; L614-L618 WeakPolarHBondContact O-CG 3.32Å; L614-L618 PolarHBondContact O-N 3.29Å; D615-L618 PolarHBondContact O-N 3.3Å; L618-F620 VanDerWaalsContact C-N 3.34Å; L618-F620 PolarHBondContact O-N 2.98Å; L618-Y621 HydrophobicContact CD2-CD2 4.32Å; L618-Y621 PolarHBondContact O-N 3.25Å; L618-D622 PolarHBondContact O-N 2.94Å
619	K	90.2	Very high	83.7	Confident	118 Å²	118	44.5 Å²	44.5	51%	0.513	21%	0.209	S	C	.	.	H	α-helix	trans	-61.7	-40.7	173.1	-72	162.6	-171.7	164.1	0	111.8	D615 D622 I623	D615-K619 WeakPolarHBondContact O-CB 3.47Å; D615-K619 WeakPolarHBondContact O-CD 3.22Å; D615-K619 WeakPolarHBondContact O-CG 3.35Å; D615-K619 PolarHBondContact O-N 3.02Å; K619-D622 PolarHBondContact O-N 3.06Å; K619-I623 WeakPolarHBondContact O-CG1 3.45Å; K619-I623 PolarHBondContact O-N 3.05Å
620	F	90.4	Very high	83.2	Confident	21 Å²	21	51 Å²	51	9%	0.092	24%	0.237	C	C	.	.	H	α-helix	trans	-61.3	-42.4	173.6	-179.4	-94.6	0	0	0	112.1	S616 L617 L618 T624 L632 Y636 P638	S616-F620 WeakPolarHBondContact O-CB 3.46Å; S616-F620 PolarHBondContact O-N 3.49Å; L617-F620 WeakPolarHBondContact O-CB 3.44Å; L617-F620 PolarHBondContact O-N 2.88Å; L618-F620 VanDerWaalsContact C-N 3.34Å; L618-F620 PolarHBondContact O-N 2.98Å; F620-T624 HydrophobicContact CD1-CG2 4.4Å; F620-T624 HydrophobicContact CE1-CG2 4.14Å; F620-T624 HydrophobicContact CE2-CG2 4.4Å; F620-T624 HydrophobicContact CZ-CG2 4.14Å; F620-T624 WeakPolarHBondContact O-CB 3.36Å; F620-T624 WeakPolarHBondContact O-CG2 3.42Å; F620-T624 PolarHBondContact O-N 3.31Å; F620-T624 PolarHBondContact O-OG1 3.49Å; F620-L632 HydrophobicContact CE1-CB 4.37Å; F620-L632 HydrophobicContact CE1-CD1 4Å; F620-L632 HydrophobicContact CZ-CD1 4.35Å; F620-Y636 AromaticContact CE2-CD1 3.8Å; F620-Y636 HydrophobicContact CE2-CD1 3.8Å; F620-Y636 AromaticContact CE2-CE1 3.45Å; F620-Y636 HydrophobicContact CE2-CE1 3.45Å; F620-Y636 VanDerWaalsContact CE2-CE1 3.45Å; F620-Y636 HydrophobicContact CE2-CE2 4.43Å; F620-Y636 HydrophobicContact CE2-CG 4.43Å; F620-Y636 AromaticContact CE2-CZ 3.8Å; F620-Y636 AromaticContact CZ-CD1 3.85Å; F620-Y636 HydrophobicContact CZ-CD1 3.85Å; F620-Y636 AromaticContact CZ-CE1 3.68Å; F620-Y636 HydrophobicContact CZ-CE1 3.68Å; F620-P638 HydrophobicContact CB-CB 3.97Å; F620-P638 HydrophobicContact CB-CG 3.83Å; F620-P638 HydrophobicContact CD1-CG 4.31Å; F620-P638 HydrophobicContact CD2-CB 4.28Å; F620-P638 HydrophobicContact CD2-CG 4.21Å; F620-P638 HydrophobicContact CG-CB 4.26Å; F620-P638 HydrophobicContact CG-CG 3.89Å
621	Y	89.4	Confident	82.7	Confident	6 Å²	6	59.8 Å²	59.8	2%	0.024	28%	0.276	C	S	.	.	H	α-helix	trans	-64.5	-43.2	171.9	-61.3	-32.2	0	0	0	112.7	D257 M260 K396 L617 L618 I623 T624 N625	D257-Y621 PolarHBondContact OD1-OH 3.3Å; M260-Y621 HydrophobicContact CB-CE2 4.17Å; M260-Y621 WeakPolarHBondContact CB-OH 3.36Å; M260-Y621 HydrophobicContact CE-CE2 3.94Å; K396-Y621 HydrophobicContact CB-CD2 4.1Å; K396-Y621 HydrophobicContact CB-CE2 3.96Å; K396-Y621 HydrophobicContact CD-CD2 4.12Å; K396-Y621 HydrophobicContact CD-CE2 3.99Å; L617-Y621 HydrophobicContact CD1-CE1 3.92Å; L617-Y621 HydrophobicContact CD1-CE2 4.34Å; L617-Y621 HydrophobicContact CD2-CE2 4.31Å; L617-Y621 WeakPolarHBondContact CD2-OH 3.39Å; L617-Y621 HydrophobicContact CG-CE1 4.27Å; L617-Y621 HydrophobicContact CG-CE2 3.78Å; L617-Y621 WeakPolarHBondContact CG-OH 3.41Å; L617-Y621 WeakPolarHBondContact O-CD2 3.43Å; L617-Y621 PolarHBondContact O-N 3.32Å; L618-Y621 HydrophobicContact CD2-CD2 4.32Å; L618-Y621 PolarHBondContact O-N 3.25Å; Y621-I623 VanDerWaalsContact C-N 3.33Å; Y621-I623 PolarHBondContact O-N 3.19Å; Y621-T624 WeakPolarHBondContact CA-OG1 3.39Å; Y621-T624 PolarHBondContact O-N 2.71Å; Y621-T624 PolarHBondContact O-OG1 3.5Å; Y621-N625 VanDerWaalsContact O-CB 3.3Å; Y621-N625 WeakPolarHBondContact O-CB 3.35Å; Y621-N625 PolarHBondContact O-N 3.33Å; Y621-N625 PolarHBondContact O-ND2 3.04Å
622	D	86.1	Confident	82.5	Confident	27 Å²	27	60.9 Å²	60.9	14%	0.144	28%	0.282	C	S	.	.	H	α-helix	trans	-60.8	-42.1	178.8	-74.9	-46.9	0	0	0	111.1	R400 R403 L618 K619 Q626	R400-D622 IonicContact CZ-OD1 3.09Å; R400-D622 IonicContact NE-OD1 2.84Å; R400-D622 PolarHBondContact NE-OD1 2.95Å; R400-D622 IonicContact NH2-OD1 2.69Å; R400-D622 PolarHBondContact NH2-OD1 2.87Å; R403-D622 IonicContact CZ-OD2 2.64Å; R403-D622 IonicContact NH1-OD2 2.8Å; R403-D622 PolarHBondContact NH1-OD2 3.39Å; R403-D622 IonicContact NH2-OD1 2.61Å; R403-D622 PolarHBondContact NH2-OD1 3.43Å; R403-D622 IonicContact NH2-OD2 3.36Å; R403-D622 PolarHBondContact NH2-OD2 3.01Å; R403-D622 VanDerWaalsContact NH2-OD2 3.11Å; L618-D622 PolarHBondContact O-N 2.94Å; K619-D622 PolarHBondContact O-N 3.06Å; D622-Q626 WeakPolarHBondContact O-CB 3.2Å; D622-Q626 VanDerWaalsContact O-CG 3.27Å; D622-Q626 WeakPolarHBondContact O-CG 3.39Å; D622-Q626 PolarHBondContact O-N 3.43Å
623	I	83.6	Confident	82.2	Confident	85 Å²	85	64 Å²	64	44%	0.436	30%	0.298	S	S	.	.	H	α-helix	trans	-68.4	-48.2	177.1	-66.3	164.6	0	0	0	112.2	K619 Y621 N625 Q626 Y627 I628	K619-I623 WeakPolarHBondContact O-CG1 3.45Å; K619-I623 PolarHBondContact O-N 3.05Å; Y621-I623 VanDerWaalsContact C-N 3.33Å; Y621-I623 PolarHBondContact O-N 3.19Å; I623-N625 PolarHBondContact O-N 3.2Å; I623-Q626 PolarHBondContact O-N 2.93Å; I623-Y627 PolarHBondContact O-N 2.94Å; I623-I628 HydrophobicContact CG2-CD1 4.45Å
624	T	78.9	Confident	81.9	Confident	20 Å²	20	70.3 Å²	70.3	12%	0.123	33%	0.325	C	S	.	.	H	α-helix	trans	-66.7	-35.8	-177.5	48.5	0	0	0	0	112.4	F620 Y621 Q626 I628 Y636	F620-T624 HydrophobicContact CD1-CG2 4.4Å; F620-T624 HydrophobicContact CE1-CG2 4.14Å; F620-T624 HydrophobicContact CE2-CG2 4.4Å; F620-T624 HydrophobicContact CZ-CG2 4.14Å; F620-T624 WeakPolarHBondContact O-CB 3.36Å; F620-T624 WeakPolarHBondContact O-CG2 3.42Å; F620-T624 PolarHBondContact O-N 3.31Å; F620-T624 PolarHBondContact O-OG1 3.49Å; Y621-T624 WeakPolarHBondContact CA-OG1 3.39Å; Y621-T624 PolarHBondContact O-N 2.71Å; Y621-T624 PolarHBondContact O-OG1 3.5Å; T624-Q626 VanDerWaalsContact C-N 3.3Å; T624-Q626 PolarHBondContact O-N 2.76Å; T624-I628 CarbonylContact C-O 3.49Å; T624-I628 WeakPolarHBondContact CA-O 3.32Å; T624-I628 VanDerWaalsContact CB-O 3.29Å; T624-I628 WeakPolarHBondContact CB-O 3.42Å; T624-I628 CarbonylContact O-C 3.56Å; T624-I628 VanDerWaalsContact O-C 3.29Å; T624-I628 PolarHBondContact O-N 3.14Å; T624-Y636 HydrophobicContact CG2-CE1 4.41Å
625	N	73	Confident	81.6	Confident	83 Å²	83	77.6 Å²	77.6	44%	0.444	36%	0.364	S	S	.	.	H	α-helix	trans	-73.3	-15.9	174.4	-74.6	-73.8	0	0	0	114.2	Y621 I623	Y621-N625 VanDerWaalsContact O-CB 3.3Å; Y621-N625 WeakPolarHBondContact O-CB 3.35Å; Y621-N625 PolarHBondContact O-N 3.33Å; Y621-N625 PolarHBondContact O-ND2 3.04Å; I623-N625 PolarHBondContact O-N 3.2Å
626	Q	63.4	Low	81.4	Confident	99 Å²	99	79.8 Å²	79.8	46%	0.463	37%	0.371	S	S	.	.	H	α-helix	trans	-98	-45.3	178.6	-73.7	179.9	7.8	0	0	113.1	D622 I623 T624	D622-Q626 WeakPolarHBondContact O-CB 3.2Å; D622-Q626 VanDerWaalsContact O-CG 3.27Å; D622-Q626 WeakPolarHBondContact O-CG 3.39Å; D622-Q626 PolarHBondContact O-N 3.43Å; I623-Q626 PolarHBondContact O-N 2.93Å; T624-Q626 VanDerWaalsContact C-N 3.3Å; T624-Q626 PolarHBondContact O-N 2.76Å
627	Y	63.1	Low	81.3	Confident	178 Å²	178	82.3 Å²	82.3	70%	0.698	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.6	-31.1	-167.2	-53.6	-74.7	0	0	0	114.7	I623	I623-Y627 PolarHBondContact O-N 2.94Å
628	I	63.6	Low	81.2	Confident	59 Å²	59	83 Å²	83	30%	0.303	38%	0.381	S	S	.	.			trans	-130.3	98.4	-165.4	-53.8	179.5	0	0	0	111	I623 T624 K630	I623-I628 HydrophobicContact CG2-CD1 4.45Å; T624-I628 CarbonylContact C-O 3.49Å; T624-I628 WeakPolarHBondContact CA-O 3.32Å; T624-I628 VanDerWaalsContact CB-O 3.29Å; T624-I628 WeakPolarHBondContact CB-O 3.42Å; T624-I628 CarbonylContact O-C 3.56Å; T624-I628 VanDerWaalsContact O-C 3.29Å; T624-I628 PolarHBondContact O-N 3.14Å; I628-K630 HydrophobicContact CG2-CB 3.79Å; I628-K630 HydrophobicContact CG2-CD 3.73Å; I628-K630 HydrophobicContact CG2-CG 3.6Å; I628-K630 PolarHBondContact O-N 3.32Å
629	K	66.4	Low	81.3	Confident	165 Å²	165	87.7 Å²	87.7	72%	0.717	41%	0.405	S	S	*	.			trans	-69.1	38.7	172.8	-67.6	-177.6	174.8	176	0	114	D513	D513-K629 IonicContact OD1-NZ 2.69Å; D513-K629 PolarHBondContact OD1-NZ 3.1Å; D513-K629 IonicContact OD2-NZ 2.63Å; D513-K629 PolarHBondContact OD2-NZ 3.19Å
630	K	69.1	Low	81.5	Confident	136 Å²	136	82.1 Å²	82.1	59%	0.591	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-92.9	131.4	172.9	-71	179.9	-178.7	179.1	0	109.5	I628 Y636	I628-K630 HydrophobicContact CG2-CB 3.79Å; I628-K630 HydrophobicContact CG2-CD 3.73Å; I628-K630 HydrophobicContact CG2-CG 3.6Å; I628-K630 PolarHBondContact O-N 3.32Å; K630-Y636 HydrophobicContact CB-CD1 4.24Å; K630-Y636 HydrophobicContact CB-CE1 4.02Å; K630-Y636 HydrophobicContact CD-CE1 4.44Å
631	K	77.5	Confident	81.6	Confident	187 Å²	187	82.1 Å²	82.1	81%	0.813	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-73.9	154.8	167.1	-65.9	-174.3	178.3	-176.2	0	110.3	N633	K631-N633 PolarHBondContact O-ND2 3.22Å; K631-N633 VanDerWaalsContact O-ND2 3.11Å
632	L	85.5	Confident	81.8	Confident	24 Å²	24	81.8 Å²	81.8	13%	0.126	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-54.3	137.2	170.3	-170.6	119.1	0	0	0	110.3	F250 V253 Q254 D257 F620	F250-L632 HydrophobicContact CD2-CD2 4.45Å; F250-L632 HydrophobicContact CE2-CD2 3.65Å; F250-L632 HydrophobicContact CE2-CG 4.35Å; F250-L632 HydrophobicContact CZ-CD2 4.34Å; V253-L632 HydrophobicContact CG1-CD1 4Å; Q254-L632 HydrophobicContact CB-CD2 4.09Å; Q254-L632 HydrophobicContact CG-CD2 4.46Å; D257-L632 HydrophobicContact CB-CD2 4.46Å; D257-L632 WeakPolarHBondContact OD2-CB 3.45Å; F620-L632 HydrophobicContact CE1-CB 4.37Å; F620-L632 HydrophobicContact CE1-CD1 4Å; F620-L632 HydrophobicContact CZ-CD1 4.35Å
633	N	86.6	Confident	81.9	Confident	66 Å²	66	82.9 Å²	82.9	35%	0.353	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-156.5	168.5	176.7	64	80.9	0	0	0	111	F250 K631 N635 Y636	F250-N633 WeakPolarHBondContact CE2-O 3.42Å; K631-N633 PolarHBondContact O-ND2 3.22Å; K631-N633 VanDerWaalsContact O-ND2 3.11Å; N633-N635 PolarHBondContact O-N 3.47Å; N633-N635 PolarHBondContact OD1-N 3.31Å; N633-N635 VanDerWaalsContact OD1-N 3.14Å; N633-Y636 PolarHBondContact N-O 2.57Å; N633-Y636 VanDerWaalsContact N-O 3.14Å; N633-Y636 CarbonylContact O-C 3.29Å; N633-Y636 PolarHBondContact O-N 2.83Å; N633-Y636 PolarHBondContact OD1-N 3.46Å
634	K	88	Confident	82.2	Confident	140 Å²	140	78.8 Å²	78.8	61%	0.609	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-22.6	-172.8	-168.1	165.6	-178.3	166	0	114.8	F250 Y637	F250-K634 HydrophobicContact CB-CG 4.44Å; F250-K634 HydrophobicContact CD1-CB 3.93Å; F250-K634 HydrophobicContact CD1-CD 4.36Å; F250-K634 HydrophobicContact CD1-CG 4.03Å; F250-K634 HydrophobicContact CD2-CB 4.37Å; F250-K634 HydrophobicContact CE1-CB 4.04Å; F250-K634 HydrophobicContact CE2-CB 4.47Å; F250-K634 VanDerWaalsContact CE2-N 3.3Å; F250-K634 HydrophobicContact CG-CB 4.11Å; F250-K634 HydrophobicContact CG-CG 4.13Å; F250-K634 HydrophobicContact CZ-CB 4.32Å; K634-Y637 WeakPolarHBondContact O-CE1 3.33Å
635	N	87.9	Confident	82.3	Confident	153 Å²	153	79.1 Å²	79.1	82%	0.818	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.8	-0.2	178.6	-59.2	-11.6	0	0	0	112.9	N633	N633-N635 PolarHBondContact O-N 3.47Å; N633-N635 PolarHBondContact OD1-N 3.31Å; N633-N635 VanDerWaalsContact OD1-N 3.14Å
636	Y	87.8	Confident	82.4	Confident	74 Å²	74	76.7 Å²	76.7	29%	0.29	36%	0.356	S	S	.	.	B	Isolated β-bridge	trans	-153.9	83.7	-177	-172.5	-110	0	0	0	110.6	F620 T624 K630 N633	F620-Y636 AromaticContact CE2-CD1 3.8Å; F620-Y636 HydrophobicContact CE2-CD1 3.8Å; F620-Y636 AromaticContact CE2-CE1 3.45Å; F620-Y636 HydrophobicContact CE2-CE1 3.45Å; F620-Y636 VanDerWaalsContact CE2-CE1 3.45Å; F620-Y636 HydrophobicContact CE2-CE2 4.43Å; F620-Y636 HydrophobicContact CE2-CG 4.43Å; F620-Y636 AromaticContact CE2-CZ 3.8Å; F620-Y636 AromaticContact CZ-CD1 3.85Å; F620-Y636 HydrophobicContact CZ-CD1 3.85Å; F620-Y636 AromaticContact CZ-CE1 3.68Å; F620-Y636 HydrophobicContact CZ-CE1 3.68Å; T624-Y636 HydrophobicContact CG2-CE1 4.41Å; K630-Y636 HydrophobicContact CB-CD1 4.24Å; K630-Y636 HydrophobicContact CB-CE1 4.02Å; K630-Y636 HydrophobicContact CD-CE1 4.44Å; N633-Y636 PolarHBondContact N-O 2.57Å; N633-Y636 VanDerWaalsContact N-O 3.14Å; N633-Y636 CarbonylContact O-C 3.29Å; N633-Y636 PolarHBondContact O-N 2.83Å; N633-Y636 PolarHBondContact OD1-N 3.46Å
637	Y	90.7	Very high	83	Confident	83 Å²	83	72.9 Å²	72.9	33%	0.325	34%	0.34	S	S	.	.			trans	-141.6	153.9	173	69.5	-84.6	0	0	0	109.7	F250 V253 K634	F250-Y637 HydrophobicContact CB-CD1 4.35Å; F250-Y637 HydrophobicContact CB-CE1 3.9Å; F250-Y637 AromaticContact CD2-CD1 3.65Å; F250-Y637 HydrophobicContact CD2-CD1 3.65Å; F250-Y637 HydrophobicContact CD2-CE1 4.07Å; F250-Y637 AromaticContact CD2-CG 3.96Å; F250-Y637 HydrophobicContact CD2-CG 3.96Å; F250-Y637 HydrophobicContact CG-CD1 4.41Å; F250-Y637 HydrophobicContact CG-CE1 4.4Å; V253-Y637 HydrophobicContact CB-CD2 4.12Å; V253-Y637 HydrophobicContact CG1-CD2 4.07Å; V253-Y637 HydrophobicContact CG2-CD2 4.06Å; V253-Y637 HydrophobicContact CG2-CE2 4.26Å; K634-Y637 WeakPolarHBondContact O-CE1 3.33Å
638	P	92.9	Very high	84.2	Confident	16 Å²	16	67.3 Å²	67.3	10%	0.104	32%	0.322	C	S	.	.			trans	-78.4	150	179.7	30.5	-32.5	0	0	0	112	L617 F620 V640	L617-P638 HydrophobicContact CB-CG 4.34Å; L617-P638 HydrophobicContact CD1-CG 3.66Å; F620-P638 HydrophobicContact CB-CB 3.97Å; F620-P638 HydrophobicContact CB-CG 3.83Å; F620-P638 HydrophobicContact CD1-CG 4.31Å; F620-P638 HydrophobicContact CD2-CB 4.28Å; F620-P638 HydrophobicContact CD2-CG 4.21Å; F620-P638 HydrophobicContact CG-CB 4.26Å; F620-P638 HydrophobicContact CG-CG 3.89Å; P638-V640 HydrophobicContact CG-CG2 4.26Å; P638-V640 PolarHBondContact O-N 2.98Å; P638-V640 VanDerWaalsContact O-N 3.11Å
639	I	93.1	Very high	85.3	Confident	102 Å²	102	65.3 Å²	65.3	52%	0.523	31%	0.311	S	S	.	.			trans	-70.3	106	170.5	-59.3	177.2	0	0	0	108.5	I247 S616 V641	I247-I639 HydrophobicContact CD1-CG2 4.27Å; I247-I639 HydrophobicContact CG1-CG2 4.32Å; I247-I639 HydrophobicContact CG2-CG2 3.86Å; S616-I639 WeakPolarHBondContact CB-O 3.37Å; S616-I639 PolarHBondContact OG-O 3.02Å; I639-V641 HydrophobicContact CG2-CG2 4.41Å
640	V	94.3	Very high	86.3	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.299	C	S	.	.			trans	-101	134	175.6	-177.7	0	0	0	0	109.4	L248 V253 L256 I612 L617 P638	L248-V640 HydrophobicContact CB-CB 4.45Å; L248-V640 HydrophobicContact CD1-CB 4.13Å; L248-V640 HydrophobicContact CD1-CG1 3.75Å; L248-V640 HydrophobicContact CG-CB 4.47Å; L248-V640 HydrophobicContact CG-CG1 4.37Å; L248-V640 PolarHBondContact N-O 3.16Å; V253-V640 HydrophobicContact CG1-CG2 4.24Å; V253-V640 HydrophobicContact CG2-CB 4.07Å; V253-V640 HydrophobicContact CG2-CG2 4.02Å; L256-V640 HydrophobicContact CD2-CG1 3.82Å; L256-V640 HydrophobicContact CD2-CG2 4.4Å; I612-V640 HydrophobicContact CG2-CG1 3.54Å; L617-V640 HydrophobicContact CB-CG2 4.18Å; P638-V640 HydrophobicContact CG-CG2 4.26Å; P638-V640 PolarHBondContact O-N 2.98Å; P638-V640 VanDerWaalsContact O-N 3.11Å
641	V	93.4	Very high	87.1	Confident	21 Å²	21	57.3 Å²	57.3	13%	0.127	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	132.8	-173.5	179.7	0	0	0	0	110.5	Y245 H246 I247 I613 I639	Y245-V641 HydrophobicContact CD1-CG1 4.01Å; H246-V641 CarbonylContact O-C 3.51Å; H246-V641 WeakPolarHBondContact O-CA 3.18Å; I247-V641 HydrophobicContact CG1-CG2 4.47Å; I613-V641 WeakPolarHBondContact CB-O 3.33Å; I613-V641 HydrophobicContact CD1-CB 4.34Å; I613-V641 HydrophobicContact CD1-CG1 4.28Å; I613-V641 PolarHBondContact N-O 2.74Å; I639-V641 HydrophobicContact CG2-CG2 4.41Å
642	V	92.1	Very high	87.5	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	144.5	168.3	-172	0	0	0	0	109.5	Y245 H246 L248 I427 L610 I612 Y649	Y245-V642 VanDerWaalsContact CA-O 3.3Å; Y245-V642 WeakPolarHBondContact CA-O 3.48Å; H246-V642 HydrophobicContact CB-CB 4.4Å; H246-V642 PolarHBondContact N-O 3.21Å; H246-V642 PolarHBondContact O-N 2.95Å; L248-V642 HydrophobicContact CD1-CG2 4.48Å; L248-V642 HydrophobicContact CD2-CG2 3.35Å; L248-V642 HydrophobicContact CG-CG2 3.8Å; I427-V642 HydrophobicContact CD1-CB 4.34Å; I427-V642 HydrophobicContact CD1-CG1 3.51Å; I427-V642 HydrophobicContact CD1-CG2 3.86Å; I427-V642 HydrophobicContact CG1-CG2 4.1Å; L610-V642 HydrophobicContact CD2-CG1 4.02Å; I612-V642 HydrophobicContact CG1-CG2 4.32Å; V642-Y649 HydrophobicContact CB-CE2 4.29Å; V642-Y649 HydrophobicContact CG1-CD2 4.23Å; V642-Y649 HydrophobicContact CG1-CE2 3.99Å
643	K	89.8	Confident	87.5	Confident	49 Å²	49	48.9 Å²	48.9	21%	0.213	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	117.5	168.6	-177.4	176.9	-173.2	151.9	0	110.2	Y245 H611	Y245-K643 HydrophobicContact CD1-CB 3.98Å; Y245-K643 HydrophobicContact CD1-CG 4.1Å; Y245-K643 HydrophobicContact CE1-CB 3.85Å; Y245-K643 HydrophobicContact CE1-CD 3.66Å; Y245-K643 HydrophobicContact CE1-CG 3.63Å; Y245-K643 WeakPolarHBondContact OH-CE 3.45Å; Y245-K643 PolarHBondContact OH-NZ 3.49Å; H611-K643 PolarHBondContact N-O 3.06Å; H611-K643 PolarHBondContact O-N 3.42Å
644	S	88.7	Confident	87.5	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	131.9	158.8	175.1	0	0	0	0	109.5	R244 C647 V652	R244-S644 PolarHBondContact O-N 3.09Å; S644-C647 WeakPolarHBondContact CB-O 3.47Å; S644-C647 PolarHBondContact OG-O 3.48Å; S644-V652 WeakPolarHBondContact OG-CG2 3.24Å
645	I	82.3	Confident	87.5	Confident	26 Å²	26	45.9 Å²	45.9	13%	0.133	23%	0.23	C	C	.	.	S	Bend	trans	-89.3	-51	179.6	-78.4	160.7	0	0	0	111.5	R244 D601 S609 H611	R244-I645 PolarHBondContact NH1-O 3.04Å; D601-I645 HydrophobicContact CB-CD1 4.47Å; D601-I645 HydrophobicContact CB-CG2 3.55Å; D601-I645 WeakPolarHBondContact OD2-CG2 3.4Å; S609-I645 PolarHBondContact O-N 3.47Å; H611-I645 WeakPolarHBondContact CD2-CD1 3.47Å; H611-I645 WeakPolarHBondContact CE1-CD1 3.4Å; H611-I645 WeakPolarHBondContact NE2-CD1 3.41Å
646	A	73.9	Confident	87.3	Confident	33 Å²	33	38.8 Å²	38.8	27%	0.273	19%	0.191	S	C	.	.	S	Bend	trans	-75.8	-52.5	-165	0	0	0	0	0	112.9	Y664	A646-Y664 HydrophobicContact CB-CD2 3.56Å; A646-Y664 HydrophobicContact CB-CE2 4.23Å; A646-Y664 HydrophobicContact CB-CG 4.26Å
647	C	77.2	Confident	87.2	Confident	18 Å²	18	39.5 Å²	39.5	12%	0.122	20%	0.2	C	C	.	.	S	Bend	trans	-138.7	-164.1	-178.9	70.1	0	0	0	0	111.1	S644 V652 Y664	S644-C647 WeakPolarHBondContact CB-O 3.47Å; S644-C647 PolarHBondContact OG-O 3.48Å; C647-V652 WeakPolarHBondContact SG-CG2 3.24Å; C647-Y664 HydrophobicContact CB-CD2 4.33Å; C647-Y664 HydrophobicContact CB-CE1 4.02Å; C647-Y664 HydrophobicContact CB-CE2 3.67Å; C647-Y664 WeakPolarHBondContact SG-CE2 3.2Å; C647-Y664 PolarHBondContact SG-OH 2.92Å
648	N	86.7	Confident	87	Confident	61 Å²	61	40.9 Å²	40.9	33%	0.326	21%	0.213	S	C	.	.			trans	-63.2	143.6	174.6	-51.6	-52.6	0	0	0	110.8	N243 I650 D651 V652	N243-N648 HydrophobicContact CB-CB 4.15Å; N243-N648 CarbonylContact O-C 3.56Å; N243-N648 WeakPolarHBondContact O-CA 3.31Å; N648-I650 VanDerWaalsContact C-N 3.31Å; N648-I650 PolarHBondContact O-N 3.43Å; N648-D651 WeakPolarHBondContact CB-OD2 3.44Å; N648-D651 PolarHBondContact ND2-OD2 3.32Å; N648-D651 PolarHBondContact O-N 2.97Å; N648-D651 VanDerWaalsContact O-N 3.14Å; N648-V652 PolarHBondContact O-N 2.83Å
649	Y	87.8	Confident	86.7	Confident	17 Å²	17	44.2 Å²	44.2	7%	0.067	23%	0.227	C	C	.	.	H	α-helix	trans	-55.7	-45.3	176.6	173.1	-93.9	0	0	0	111.9	N243 H246 I427 L610 V642 D651 V652 I653	N243-Y649 WeakPolarHBondContact O-CB 3.31Å; N243-Y649 PolarHBondContact O-N 3.11Å; H246-Y649 HydrophobicContact CB-CD1 3.61Å; H246-Y649 HydrophobicContact CB-CD2 3.85Å; H246-Y649 HydrophobicContact CB-CE1 3.51Å; H246-Y649 HydrophobicContact CB-CE2 3.75Å; H246-Y649 HydrophobicContact CB-CG 3.77Å; H246-Y649 AromaticContact CD2-CE1 3.63Å; H246-Y649 AromaticContact CD2-CZ 3.44Å; H246-Y649 VanDerWaalsContact CD2-CZ 3.44Å; H246-Y649 PolarHBondContact CD2-OH 3.45Å; H246-Y649 AromaticContact CE1-CE1 3.91Å; H246-Y649 AromaticContact CG-CD1 3.81Å; H246-Y649 AromaticContact CG-CE1 3.26Å; H246-Y649 AromaticContact CG-CZ 3.45Å; H246-Y649 VanDerWaalsContact CG-CZ 3.45Å; H246-Y649 AromaticContact ND1-CD1 3.94Å; H246-Y649 AromaticContact ND1-CE1 3.47Å; H246-Y649 WeakPolarHBondContact ND1-CE1 3.28Å; I427-Y649 HydrophobicContact CG2-CE2 4.06Å; I427-Y649 WeakPolarHBondContact CG2-OH 3.45Å; L610-Y649 HydrophobicContact CD2-CD2 3.87Å; L610-Y649 HydrophobicContact CD2-CE2 4.1Å; V642-Y649 HydrophobicContact CB-CE2 4.29Å; V642-Y649 HydrophobicContact CG1-CD2 4.23Å; V642-Y649 HydrophobicContact CG1-CE2 3.99Å; Y649-D651 PolarHBondContact O-N 3.33Å; Y649-V652 WeakPolarHBondContact O-CB 3.03Å; Y649-V652 PolarHBondContact O-N 3.05Å; Y649-I653 HydrophobicContact CD1-CG1 4.14Å; Y649-I653 HydrophobicContact CD2-CD1 4.5Å; Y649-I653 HydrophobicContact CD2-CG1 4.34Å; Y649-I653 HydrophobicContact CE1-CD1 4.48Å; Y649-I653 HydrophobicContact CE1-CG1 3.67Å; Y649-I653 HydrophobicContact CE2-CD1 3.86Å; Y649-I653 HydrophobicContact CE2-CG1 3.89Å; Y649-I653 HydrophobicContact CG-CG1 4.45Å; Y649-I653 WeakPolarHBondContact O-CG1 3.47Å; Y649-I653 PolarHBondContact O-N 3.28Å
650	I	88	Confident	86.5	Confident	91 Å²	91	41.5 Å²	41.5	47%	0.467	21%	0.213	S	C	.	.	H	α-helix	trans	-56.7	-40	179	-62.6	172.7	0	0	0	111.4	N648 I653 K654	N648-I650 VanDerWaalsContact C-N 3.31Å; N648-I650 PolarHBondContact O-N 3.43Å; I650-I653 PolarHBondContact O-N 3.02Å; I650-K654 WeakPolarHBondContact O-CG 3.2Å; I650-K654 PolarHBondContact O-N 3.45Å; I650-K654 VanDerWaalsContact O-N 3.08Å
651	D	85.7	Confident	86.2	Confident	42 Å²	42	41.8 Å²	41.8	23%	0.225	22%	0.215	C	C	.	.	H	α-helix	trans	-77	-36.8	-178.5	-55.7	-40.9	0	0	0	111	N648 Y649 I653 K654 H655	N648-D651 WeakPolarHBondContact CB-OD2 3.44Å; N648-D651 PolarHBondContact ND2-OD2 3.32Å; N648-D651 PolarHBondContact O-N 2.97Å; N648-D651 VanDerWaalsContact O-N 3.14Å; Y649-D651 PolarHBondContact O-N 3.33Å; D651-I653 VanDerWaalsContact C-N 3.34Å; D651-I653 PolarHBondContact O-N 3.37Å; D651-K654 PolarHBondContact O-N 2.97Å; D651-K654 IonicContact OD1-NZ 3.37Å; D651-K654 PolarHBondContact OD1-NZ 3.29Å; D651-H655 PolarHBondContact O-N 3.05Å; D651-H655 VanDerWaalsContact O-N 3.08Å; D651-H655 PolarHBondContact O-ND1 3.17Å
652	V	85.1	Confident	85.8	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-55.2	-47.6	167.5	167	0	0	0	0	111.6	I606 L610 S644 C647 N648 Y649 H655 I656	I606-V652 HydrophobicContact CG2-CB 4.26Å; I606-V652 HydrophobicContact CG2-CG1 3.79Å; I606-V652 HydrophobicContact CG2-CG2 4.26Å; L610-V652 HydrophobicContact CD1-CG1 3.73Å; L610-V652 HydrophobicContact CD2-CB 4.42Å; L610-V652 HydrophobicContact CD2-CG1 3.67Å; L610-V652 HydrophobicContact CG-CG1 3.68Å; S644-V652 WeakPolarHBondContact OG-CG2 3.24Å; C647-V652 WeakPolarHBondContact SG-CG2 3.24Å; N648-V652 PolarHBondContact O-N 2.83Å; Y649-V652 WeakPolarHBondContact O-CB 3.03Å; Y649-V652 PolarHBondContact O-N 3.05Å; V652-H655 PolarHBondContact O-N 2.92Å; V652-I656 HydrophobicContact CG1-CD1 3.59Å; V652-I656 HydrophobicContact CG1-CG1 4.27Å; V652-I656 WeakPolarHBondContact O-CG1 3.33Å; V652-I656 PolarHBondContact O-N 3.46Å
653	I	86.4	Confident	85.4	Confident	34 Å²	34	42.2 Å²	42.2	17%	0.174	22%	0.216	C	C	.	.	H	α-helix	trans	-65.5	-42.1	-178.4	-61.4	-46.1	0	0	0	112	I427 L610 Y649 I650 D651 H655 I656 L657	I427-I653 HydrophobicContact CG2-CD1 3.51Å; I427-I653 HydrophobicContact CG2-CG1 4.47Å; L610-I653 HydrophobicContact CD1-CD1 4.1Å; Y649-I653 HydrophobicContact CD1-CG1 4.14Å; Y649-I653 HydrophobicContact CD2-CD1 4.5Å; Y649-I653 HydrophobicContact CD2-CG1 4.34Å; Y649-I653 HydrophobicContact CE1-CD1 4.48Å; Y649-I653 HydrophobicContact CE1-CG1 3.67Å; Y649-I653 HydrophobicContact CE2-CD1 3.86Å; Y649-I653 HydrophobicContact CE2-CG1 3.89Å; Y649-I653 HydrophobicContact CG-CG1 4.45Å; Y649-I653 WeakPolarHBondContact O-CG1 3.47Å; Y649-I653 PolarHBondContact O-N 3.28Å; I650-I653 PolarHBondContact O-N 3.02Å; D651-I653 VanDerWaalsContact C-N 3.34Å; D651-I653 PolarHBondContact O-N 3.37Å; I653-H655 VanDerWaalsContact C-N 3.34Å; I653-H655 PolarHBondContact O-N 2.82Å; I653-I656 PolarHBondContact O-N 3.16Å; I653-L657 HydrophobicContact CG2-CD1 3.66Å; I653-L657 HydrophobicContact CG2-CG 4.07Å; I653-L657 WeakPolarHBondContact O-CB 3.15Å; I653-L657 WeakPolarHBondContact O-CG 3.47Å; I653-L657 PolarHBondContact O-N 2.72Å
654	K	86.7	Confident	84.7	Confident	108 Å²	108	44.1 Å²	44.1	47%	0.47	22%	0.223	S	C	.	.	H	α-helix	trans	-55.6	-47.3	172.2	-70.1	168.7	-169.7	158.1	0	112	I650 D651 N658	I650-K654 WeakPolarHBondContact O-CG 3.2Å; I650-K654 PolarHBondContact O-N 3.45Å; I650-K654 VanDerWaalsContact O-N 3.08Å; D651-K654 PolarHBondContact O-N 2.97Å; D651-K654 IonicContact OD1-NZ 3.37Å; D651-K654 PolarHBondContact OD1-NZ 3.29Å; K654-N658 VanDerWaalsContact O-CB 3.23Å; K654-N658 WeakPolarHBondContact O-CB 3.47Å; K654-N658 VanDerWaalsContact O-CG 3.23Å; K654-N658 PolarHBondContact O-N 2.94Å
655	H	86.5	Confident	84.3	Confident	36 Å²	36	47.4 Å²	47.4	17%	0.167	24%	0.237	C	C	.	.	H	α-helix	trans	-68.4	-35.3	-179.8	-63.4	121	0	0	0	112.4	I606 D651 V652 I653 H659 I660 V662	I606-H655 HydrophobicContact CD1-CB 3.63Å; I606-H655 WeakPolarHBondContact CD1-ND1 3.45Å; I606-H655 HydrophobicContact CG2-CB 4.23Å; D651-H655 PolarHBondContact O-N 3.05Å; D651-H655 VanDerWaalsContact O-N 3.08Å; D651-H655 PolarHBondContact O-ND1 3.17Å; V652-H655 PolarHBondContact O-N 2.92Å; I653-H655 VanDerWaalsContact C-N 3.34Å; I653-H655 PolarHBondContact O-N 2.82Å; H655-H659 PolarHBondContact O-N 3.23Å; H655-I660 HydrophobicContact CB-CB 4.22Å; H655-I660 PolarHBondContact O-N 3.27Å; H655-V662 HydrophobicContact CB-CG2 4.43Å
656	I	84.9	Confident	84.2	Confident	3 Å²	3	48.5 Å²	48.5	2%	0.015	25%	0.246	C	C	.	.	H	α-helix	trans	-67.7	-49	176.3	-71.8	175.5	0	0	0	111.3	I428 I606 T607 L610 V652 I653 H659	I428-I656 HydrophobicContact CD1-CG2 3.56Å; I428-I656 HydrophobicContact CG1-CG2 3.72Å; I606-I656 HydrophobicContact CG2-CD1 4.29Å; I606-I656 HydrophobicContact CG2-CG1 3.89Å; T607-I656 HydrophobicContact CG2-CG1 4.26Å; L610-I656 HydrophobicContact CD1-CD1 3.54Å; V652-I656 HydrophobicContact CG1-CD1 3.59Å; V652-I656 HydrophobicContact CG1-CG1 4.27Å; V652-I656 WeakPolarHBondContact O-CG1 3.33Å; V652-I656 PolarHBondContact O-N 3.46Å; I653-I656 PolarHBondContact O-N 3.16Å; I656-H659 PolarHBondContact O-N 3.3Å
657	L	85.8	Confident	84.6	Confident	89 Å²	89	52.4 Å²	52.4	47%	0.466	26%	0.258	S	S	.	.	H	α-helix	trans	-66.4	-37.7	-179.4	-67.8	175	0	0	0	112.5	I428 I653 H659	I428-L657 HydrophobicContact CG2-CD2 4.14Å; I653-L657 HydrophobicContact CG2-CD1 3.66Å; I653-L657 HydrophobicContact CG2-CG 4.07Å; I653-L657 WeakPolarHBondContact O-CB 3.15Å; I653-L657 WeakPolarHBondContact O-CG 3.47Å; I653-L657 PolarHBondContact O-N 2.72Å; L657-H659 PolarHBondContact O-CD2 3.12Å; L657-H659 PolarHBondContact O-N 3.39Å
658	N	86.3	Confident	84.7	Confident	112 Å²	112	52.8 Å²	52.8	60%	0.599	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	6.5	177.8	-64.2	-2.7	0	0	0	113	K654 I660	K654-N658 VanDerWaalsContact O-CB 3.23Å; K654-N658 WeakPolarHBondContact O-CB 3.47Å; K654-N658 VanDerWaalsContact O-CG 3.23Å; K654-N658 PolarHBondContact O-N 2.94Å; N658-I660 VanDerWaalsContact C-N 3.35Å; N658-I660 HydrophobicContact CB-CD1 3.7Å; N658-I660 HydrophobicContact CB-CG1 3.81Å; N658-I660 WeakPolarHBondContact O-CG1 3.41Å; N658-I660 PolarHBondContact O-N 2.62Å
659	H	86.8	Confident	84.4	Confident	87 Å²	87	50.3 Å²	50.3	40%	0.403	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.4	44.1	-176.8	-69.1	-98.9	0	0	0	113.8	H655 I656 L657 Y685 K686	H655-H659 PolarHBondContact O-N 3.23Å; I656-H659 PolarHBondContact O-N 3.3Å; L657-H659 PolarHBondContact O-CD2 3.12Å; L657-H659 PolarHBondContact O-N 3.39Å; H659-Y685 VanDerWaalsContact CA-CD1 3.49Å; H659-Y685 HydrophobicContact CB-CD1 4.09Å; H659-Y685 HydrophobicContact CB-CE1 4.32Å; H659-Y685 HydrophobicContact CB-CG 4.2Å; H659-Y685 AromaticContact ND1-CD2 3.79Å; H659-Y685 AromaticContact ND1-CE2 3.52Å; H659-Y685 AromaticContact ND1-CZ 3.71Å; H659-Y685 CarbonylContact O-C 3.49Å; H659-Y685 WeakPolarHBondContact O-CA 3.32Å; H659-K686 PolarHBondContact O-N 3.36Å
660	I	88.6	Confident	84.3	Confident	44 Å²	44	54.5 Å²	54.5	23%	0.226	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	127.5	-177.6	-56.1	175.8	0	0	0	111.4	H655 N658 V662 K686 C688	H655-I660 HydrophobicContact CB-CB 4.22Å; H655-I660 PolarHBondContact O-N 3.27Å; N658-I660 VanDerWaalsContact C-N 3.35Å; N658-I660 HydrophobicContact CB-CD1 3.7Å; N658-I660 HydrophobicContact CB-CG1 3.81Å; N658-I660 WeakPolarHBondContact O-CG1 3.41Å; N658-I660 PolarHBondContact O-N 2.62Å; I660-V662 HydrophobicContact CG2-CG2 3.93Å; I660-K686 CarbonylContact C-O 3.6Å; I660-K686 WeakPolarHBondContact CA-O 3.3Å; I660-C688 HydrophobicContact CG2-CB 3.65Å
661	I	87.8	Confident	84	Confident	7 Å²	7	50.1 Å²	50.1	4%	0.036	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	118.3	169.2	-43.9	180	0	0	0	109.2	L605 Y677 L680 L681 Y685 K686 C688	L605-I661 HydrophobicContact CD2-CG2 3.53Å; I661-Y677 HydrophobicContact CD1-CD2 3.85Å; I661-Y677 HydrophobicContact CD1-CE2 3.82Å; I661-Y677 HydrophobicContact CG2-CD2 4.37Å; I661-L680 HydrophobicContact CD1-CB 3.72Å; I661-L680 HydrophobicContact CD1-CD1 4.43Å; I661-L680 HydrophobicContact CG1-CB 4.23Å; I661-L680 HydrophobicContact CG1-CD1 4.41Å; I661-L680 HydrophobicContact CG2-CD1 4.27Å; I661-L681 HydrophobicContact CD1-CD2 3.87Å; I661-L681 HydrophobicContact CD1-CG 4.4Å; I661-Y685 HydrophobicContact CG1-CG 4.46Å; I661-K686 PolarHBondContact N-O 2.94Å; I661-C688 WeakPolarHBondContact O-CB 3.44Å; I661-C688 PolarHBondContact O-N 3.4Å
662	V	84.9	Confident	84	Confident	13 Å²	13	49.5 Å²	49.5	8%	0.079	24%	0.243	C	C	.	.			trans	-123.3	143.8	169.2	-170.7	0	0	0	0	108.9	I606 H655 I660 Y664 C688 I691	I606-V662 HydrophobicContact CD1-CB 3.52Å; I606-V662 HydrophobicContact CD1-CG1 4.35Å; I606-V662 HydrophobicContact CD1-CG2 3.69Å; I606-V662 HydrophobicContact CG1-CB 3.98Å; I606-V662 PolarHBondContact N-O 3.28Å; H655-V662 HydrophobicContact CB-CG2 4.43Å; I660-V662 HydrophobicContact CG2-CG2 3.93Å; V662-Y664 HydrophobicContact CG1-CD1 4.49Å; V662-Y664 HydrophobicContact CG1-CE1 4.11Å; V662-Y664 HydrophobicContact CG1-CE2 4.19Å; V662-C688 HydrophobicContact CG2-CB 3.96Å; V662-I691 HydrophobicContact CG1-CD1 4.27Å
663	I	82.5	Confident	84.1	Confident	16 Å²	16	50.2 Å²	50.2	8%	0.082	25%	0.25	C	C	.	.	B	Isolated β-bridge	trans	-122	109.7	177.1	-69.5	161.9	0	0	0	107.7	S604 L605 P666 I669 M696 M700	S604-I663 WeakPolarHBondContact O-CA 3.49Å; L605-I663 HydrophobicContact CD2-CD1 4Å; L605-I663 HydrophobicContact CD2-CG1 3.64Å; L605-I663 HydrophobicContact CG-CG1 4.5Å; I663-P666 HydrophobicContact CG2-CB 4.14Å; I663-I669 HydrophobicContact CD1-CD1 4.16Å; I663-I669 HydrophobicContact CG2-CD1 3.87Å; I663-M696 HydrophobicContact CB-CE 4.1Å; I663-M696 HydrophobicContact CB-SD 4.4Å; I663-M696 HydrophobicContact CD1-CE 4.12Å; I663-M696 HydrophobicContact CD1-CG 3.62Å; I663-M696 HydrophobicContact CD1-SD 3.55Å; I663-M696 VanDerWaalsContact CD1-SD 3.55Å; I663-M696 HydrophobicContact CG2-CE 4.01Å; I663-M696 HydrophobicContact CG2-SD 4.07Å; I663-M700 HydrophobicContact CD1-CE 3.35Å
664	Y	76	Confident	84.3	Confident	89 Å²	89	48.6 Å²	48.6	35%	0.349	24%	0.242	S	C	.	.	S	Bend	trans	-83.3	-16.4	-178.5	-74.7	-67.2	0	0	0	114	S604 I606 A646 C647 V662	S604-Y664 PolarHBondContact O-N 2.84Å; I606-Y664 HydrophobicContact CD1-CD2 4.47Å; I606-Y664 HydrophobicContact CD1-CE2 3.54Å; I606-Y664 HydrophobicContact CG1-CD2 4.1Å; I606-Y664 HydrophobicContact CG1-CE2 3.6Å; A646-Y664 HydrophobicContact CB-CD2 3.56Å; A646-Y664 HydrophobicContact CB-CE2 4.23Å; A646-Y664 HydrophobicContact CB-CG 4.26Å; C647-Y664 HydrophobicContact CB-CD2 4.33Å; C647-Y664 HydrophobicContact CB-CE1 4.02Å; C647-Y664 HydrophobicContact CB-CE2 3.67Å; C647-Y664 WeakPolarHBondContact SG-CE2 3.2Å; C647-Y664 PolarHBondContact SG-OH 2.92Å; V662-Y664 HydrophobicContact CG1-CD1 4.49Å; V662-Y664 HydrophobicContact CG1-CE1 4.11Å; V662-Y664 HydrophobicContact CG1-CE2 4.19Å
665	K	79.6	Confident	84.5	Confident	70 Å²	70	43.5 Å²	43.5	30%	0.304	22%	0.219	S	C	.	.			trans	-148.7	83.1	-176.5	-68.9	-167.8	-172	176.8	0	110.7	S604 E667 E668	S604-K665 VanDerWaalsContact CB-O 3.27Å; S604-K665 WeakPolarHBondContact CB-O 3.4Å; S604-K665 PolarHBondContact OG-O 3.13Å; K665-E667 VanDerWaalsContact C-OE2 3.23Å; K665-E667 VanDerWaalsContact CA-OE2 3.25Å; K665-E667 WeakPolarHBondContact CA-OE2 3.27Å; K665-E667 WeakPolarHBondContact CB-OE1 3.39Å; K665-E667 WeakPolarHBondContact CG-OE1 3.42Å; K665-E667 PolarHBondContact O-N 2.99Å; K665-E668 HydrophobicContact CB-CB 4.26Å; K665-E668 HydrophobicContact CB-CG 4.42Å; K665-E668 HydrophobicContact CD-CG 4.04Å; K665-E668 WeakPolarHBondContact CD-OE1 3.44Å; K665-E668 WeakPolarHBondContact CD-OE2 3.43Å; K665-E668 IonicContact NZ-OE1 2.68Å; K665-E668 PolarHBondContact NZ-OE1 2.96Å; K665-E668 IonicContact NZ-OE2 2.72Å; K665-E668 PolarHBondContact NZ-OE2 2.8Å; K665-E668 PolarHBondContact O-N 2.64Å
666	P	81.7	Confident	84.5	Confident	48 Å²	48	43.9 Å²	43.9	31%	0.312	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-61.9	-31.8	176.3	25.1	-33.2	0	0	0	112.2	I663 E668 I669 M696 Y699	I663-P666 HydrophobicContact CG2-CB 4.14Å; P666-E668 PolarHBondContact O-N 3.47Å; P666-I669 VanDerWaalsContact O-CB 3.27Å; P666-I669 WeakPolarHBondContact O-CB 3.48Å; P666-I669 WeakPolarHBondContact O-CG1 3.24Å; P666-I669 PolarHBondContact O-N 2.75Å; P666-M696 HydrophobicContact CB-CE 4.03Å; P666-M696 HydrophobicContact CB-SD 3.98Å; P666-Y699 WeakPolarHBondContact O-CE1 3.32Å
667	E	81.1	Confident	84.8	Confident	115 Å²	115	44.1 Å²	44.1	54%	0.537	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-65.8	-20.4	-179	76.3	-69.4	172.5	0	0	114.4	K665	K665-E667 VanDerWaalsContact C-OE2 3.23Å; K665-E667 VanDerWaalsContact CA-OE2 3.25Å; K665-E667 WeakPolarHBondContact CA-OE2 3.27Å; K665-E667 WeakPolarHBondContact CB-OE1 3.39Å; K665-E667 WeakPolarHBondContact CG-OE1 3.42Å; K665-E667 PolarHBondContact O-N 2.99Å
668	E	80.2	Confident	85.1	Confident	27 Å²	27	39.9 Å²	39.9	13%	0.126	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-90.7	2.8	175	-70.2	-179.6	-171.6	0	0	112.9	Y600 K665 P666 Y670	Y600-E668 WeakPolarHBondContact CB-OE1 3.47Å; Y600-E668 WeakPolarHBondContact CD1-OE1 3.27Å; K665-E668 HydrophobicContact CB-CB 4.26Å; K665-E668 HydrophobicContact CB-CG 4.42Å; K665-E668 HydrophobicContact CD-CG 4.04Å; K665-E668 WeakPolarHBondContact CD-OE1 3.44Å; K665-E668 WeakPolarHBondContact CD-OE2 3.43Å; K665-E668 IonicContact NZ-OE1 2.68Å; K665-E668 PolarHBondContact NZ-OE1 2.96Å; K665-E668 IonicContact NZ-OE2 2.72Å; K665-E668 PolarHBondContact NZ-OE2 2.8Å; K665-E668 PolarHBondContact O-N 2.64Å; P666-E668 PolarHBondContact O-N 3.47Å; E668-Y670 VanDerWaalsContact O-CD2 3.25Å; E668-Y670 WeakPolarHBondContact O-CD2 3.42Å; E668-Y670 WeakPolarHBondContact O-CE2 3.43Å
669	I	80.3	Confident	85.2	Confident	9 Å²	9	34.7 Å²	34.7	5%	0.046	17%	0.171	C	C	.	.			trans	-73.9	135.4	175.8	-65.3	176.7	0	0	0	111	I663 P666 M696 Y699 M700 R703	I663-I669 HydrophobicContact CD1-CD1 4.16Å; I663-I669 HydrophobicContact CG2-CD1 3.87Å; P666-I669 VanDerWaalsContact O-CB 3.27Å; P666-I669 WeakPolarHBondContact O-CB 3.48Å; P666-I669 WeakPolarHBondContact O-CG1 3.24Å; P666-I669 PolarHBondContact O-N 2.75Å; I669-M696 HydrophobicContact CD1-SD 4.24Å; I669-Y699 HydrophobicContact CB-CE1 4.16Å; I669-M700 HydrophobicContact CD1-CE 4.05Å; I669-M700 HydrophobicContact CG2-CG 4.39Å; I669-R703 PolarHBondContact O-NE 3.47Å; I669-R703 PolarHBondContact O-NH2 3.05Å
670	Y	85.6	Confident	85.3	Confident	104 Å²	104	30.8 Å²	30.8	41%	0.408	15%	0.153	S	C	.	.			trans	-114.5	169.6	169.2	-68.5	-98.3	0	0	0	109.9	Y602 E668 G672 G673	Y602-Y670 HydrophobicContact CD1-CD2 4.33Å; Y602-Y670 AromaticContact CD1-CE2 3.83Å; Y602-Y670 HydrophobicContact CD1-CE2 3.83Å; Y602-Y670 AromaticContact CE1-CE2 3.95Å; Y602-Y670 HydrophobicContact CE1-CE2 3.95Å; E668-Y670 VanDerWaalsContact O-CD2 3.25Å; E668-Y670 WeakPolarHBondContact O-CD2 3.42Å; E668-Y670 WeakPolarHBondContact O-CE2 3.43Å; Y670-G672 PolarHBondContact O-N 3.02Å; Y670-G673 PolarHBondContact O-N 3.23Å
671	G	82.4	Confident	85.4	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-33	-174.6	0	0	0	0	0	116.3	G673 L674 D707	G671-G673 PolarHBondContact O-N 3.34Å; G671-G673 VanDerWaalsContact O-N 3.14Å; G671-L674 PolarHBondContact O-N 2.95Å; G671-D707 PolarHBondContact N-OD2 2.94Å
672	G	84.8	Confident	85.5	Confident	29 Å²	29	31.3 Å²	31.3	30%	0.299	16%	0.157	S	C	.	.	H	α-helix	trans	-64.5	-12.7	174.2	0	0	0	0	0	115.1	Y670 L675 K676	Y670-G672 PolarHBondContact O-N 3.02Å; G672-L675 PolarHBondContact O-N 3.03Å; G672-K676 PolarHBondContact O-N 2.96Å; G672-K676 VanDerWaalsContact O-N 3.13Å
673	G	86.8	Confident	85.5	Confident	14 Å²	14	33.2 Å²	33.2	14%	0.144	17%	0.167	C	C	.	.	H	α-helix	trans	-65.7	-36.9	174.6	0	0	0	0	0	113.2	Y670 G671 L675 K676 Y677	Y670-G673 PolarHBondContact O-N 3.23Å; G671-G673 PolarHBondContact O-N 3.34Å; G671-G673 VanDerWaalsContact O-N 3.14Å; G673-L675 VanDerWaalsContact C-N 3.33Å; G673-L675 PolarHBondContact O-N 3.22Å; G673-K676 PolarHBondContact O-N 3.31Å; G673-Y677 WeakPolarHBondContact O-CB 3.35Å; G673-Y677 PolarHBondContact O-N 2.92Å
674	L	90.7	Very high	85.7	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-57.4	-48.6	172.7	179.3	62.3	0	0	0	110.6	G671 K676 Y677 C678 M700 F704 L740 V743 V744	G671-L674 PolarHBondContact O-N 2.95Å; L674-K676 PolarHBondContact O-N 3.08Å; L674-Y677 WeakPolarHBondContact O-CB 3.11Å; L674-Y677 PolarHBondContact O-N 3.48Å; L674-Y677 VanDerWaalsContact O-N 3.14Å; L674-C678 PolarHBondContact O-N 3.22Å; L674-C678 PolarHBondContact O-SG 2.82Å; L674-C678 VanDerWaalsContact O-SG 3.37Å; L674-M700 HydrophobicContact CB-CB 4.14Å; L674-M700 HydrophobicContact CD1-CB 4.06Å; L674-F704 HydrophobicContact CB-CB 4.43Å; L674-F704 HydrophobicContact CD2-CB 3.85Å; L674-F704 HydrophobicContact CD2-CD1 4.23Å; L674-F704 HydrophobicContact CD2-CD2 4.24Å; L674-F704 HydrophobicContact CD2-CG 3.85Å; L674-L740 HydrophobicContact CD2-CD1 4.12Å; L674-L740 HydrophobicContact CG-CD1 4.1Å; L674-V743 HydrophobicContact CD1-CG1 3.68Å; L674-V744 HydrophobicContact CD2-CG2 4.19Å
675	L	91.6	Very high	86.3	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-63.9	-41	-178.6	-52.7	-177.5	0	0	0	111.9	G672 G673 K679 F704 Q717 L718 Y721 Y736 L740	G672-L675 PolarHBondContact O-N 3.03Å; G673-L675 VanDerWaalsContact C-N 3.33Å; G673-L675 PolarHBondContact O-N 3.22Å; L675-K679 PolarHBondContact O-N 2.78Å; L675-K679 VanDerWaalsContact O-N 3.13Å; L675-F704 HydrophobicContact CD1-CE2 4.49Å; L675-F704 HydrophobicContact CD2-CE2 4.12Å; L675-F704 HydrophobicContact CG-CE2 4.42Å; L675-Q717 HydrophobicContact CD1-CG 3.9Å; L675-L718 HydrophobicContact CD2-CD2 3.58Å; L675-Y721 HydrophobicContact CB-CD2 3.96Å; L675-Y721 HydrophobicContact CB-CE1 4.34Å; L675-Y721 HydrophobicContact CB-CE2 3.72Å; L675-Y721 HydrophobicContact CB-CG 4.38Å; L675-Y721 HydrophobicContact CD1-CD2 3.95Å; L675-Y721 HydrophobicContact CD1-CE2 4.48Å; L675-Y721 HydrophobicContact CD1-CG 4.3Å; L675-Y721 PolarHBondContact O-OH 2.92Å; L675-Y736 WeakPolarHBondContact CA-OH 3.43Å; L675-Y736 WeakPolarHBondContact CB-OH 3.36Å; L675-Y736 WeakPolarHBondContact CD2-OH 3.4Å; L675-Y736 PolarHBondContact O-OH 3.05Å; L675-L740 HydrophobicContact CD2-CD1 4.26Å; L675-L740 HydrophobicContact CD2-CD2 4.43Å
676	K	86.9	Confident	86.9	Confident	44 Å²	44	34 Å²	34	19%	0.191	19%	0.185	C	C	.	.	H	α-helix	trans	-66.2	-35.8	173.6	-73.9	-168.1	175.3	-164.2	0	112.6	N603 L605 Y608 G672 G673 L674 L680	N603-K676 PolarHBondContact OD1-NZ 3.3Å; L605-K676 HydrophobicContact CD1-CB 3.68Å; Y608-K676 HydrophobicContact CD2-CD 4.25Å; Y608-K676 HydrophobicContact CE2-CD 4.05Å; G672-K676 PolarHBondContact O-N 2.96Å; G672-K676 VanDerWaalsContact O-N 3.13Å; G673-K676 PolarHBondContact O-N 3.31Å; L674-K676 PolarHBondContact O-N 3.08Å; K676-L680 WeakPolarHBondContact O-CG 3.21Å; K676-L680 PolarHBondContact O-N 2.99Å; K676-L680 VanDerWaalsContact O-N 3.17Å
677	Y	90.1	Very high	87.2	Confident	8 Å²	8	33.3 Å²	33.3	3%	0.031	18%	0.18	C	C	.	.	H	α-helix	trans	-65.6	-51.2	176.1	171.7	-108.1	0	0	0	111.4	I661 G673 L674 K679 L680 L681 P687 I693 E697 M700 V743	I661-Y677 HydrophobicContact CD1-CD2 3.85Å; I661-Y677 HydrophobicContact CD1-CE2 3.82Å; I661-Y677 HydrophobicContact CG2-CD2 4.37Å; G673-Y677 WeakPolarHBondContact O-CB 3.35Å; G673-Y677 PolarHBondContact O-N 2.92Å; L674-Y677 WeakPolarHBondContact O-CB 3.11Å; L674-Y677 PolarHBondContact O-N 3.48Å; L674-Y677 VanDerWaalsContact O-N 3.14Å; Y677-K679 VanDerWaalsContact C-N 3.28Å; Y677-K679 PolarHBondContact O-N 3.18Å; Y677-L680 WeakPolarHBondContact O-CA 3.47Å; Y677-L680 WeakPolarHBondContact O-CB 3.44Å; Y677-L680 PolarHBondContact O-N 3.09Å; Y677-L681 HydrophobicContact CD1-CD1 4.16Å; Y677-L681 HydrophobicContact CE1-CD1 3.62Å; Y677-L681 HydrophobicContact CE1-CG 4.34Å; Y677-L681 HydrophobicContact CE2-CD1 4.48Å; Y677-L681 HydrophobicContact CE2-CD2 4.28Å; Y677-L681 HydrophobicContact CE2-CG 4.4Å; Y677-L681 PolarHBondContact O-N 3.02Å; Y677-P687 HydrophobicContact CE2-CG 4.17Å; Y677-I693 WeakPolarHBondContact OH-CG2 3.42Å; Y677-E697 HydrophobicContact CE1-CG 3.64Å; Y677-E697 VanDerWaalsContact CE1-OE1 3.25Å; Y677-E697 WeakPolarHBondContact CE1-OE1 3.43Å; Y677-E697 PolarHBondContact OH-OE1 3Å; Y677-M700 VanDerWaalsContact CB-SD 3.53Å; Y677-M700 HydrophobicContact CD1-SD 3.86Å; Y677-M700 HydrophobicContact CD2-CE 4.03Å; Y677-M700 HydrophobicContact CD2-SD 4.31Å; Y677-M700 HydrophobicContact CG-CE 3.94Å; Y677-M700 HydrophobicContact CG-SD 3.65Å; Y677-V743 HydrophobicContact CE1-CG2 4.23Å
678	C	92.1	Very high	87.5	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59	-36.9	175.8	-60.4	0	0	0	0	112.3	L674 L680 L681 V682 Y736 I739	L674-C678 PolarHBondContact O-N 3.22Å; L674-C678 PolarHBondContact O-SG 2.82Å; L674-C678 VanDerWaalsContact O-SG 3.37Å; C678-L680 VanDerWaalsContact C-N 3.32Å; C678-L680 PolarHBondContact O-N 3.41Å; C678-L681 PolarHBondContact O-N 3.27Å; C678-V682 WeakPolarHBondContact O-CG2 3.34Å; C678-V682 PolarHBondContact O-N 2.61Å; C678-Y736 HydrophobicContact CB-CD2 4.16Å; C678-Y736 HydrophobicContact CB-CE2 3.66Å; C678-I739 HydrophobicContact CB-CG2 4.06Å
679	K	89	Confident	87.6	Confident	3 Å²	3	36.8 Å²	36.8	1%	0.013	20%	0.199	C	C	.	.	H	α-helix	trans	-62.2	-36.8	173.4	178	-174.6	167.6	-163.4	0	112.2	D421 Y608 L675 Y677 N683 Y721 Y725 F726 Y736	D421-K679 IonicContact OD1-NZ 2.74Å; D421-K679 IonicContact OD2-NZ 2.73Å; D421-K679 PolarHBondContact OD2-NZ 2.98Å; Y608-K679 PolarHBondContact OH-NZ 3.11Å; L675-K679 PolarHBondContact O-N 2.78Å; L675-K679 VanDerWaalsContact O-N 3.13Å; Y677-K679 VanDerWaalsContact C-N 3.28Å; Y677-K679 PolarHBondContact O-N 3.18Å; K679-N683 WeakPolarHBondContact O-CB 3.04Å; K679-N683 VanDerWaalsContact O-CG 3.28Å; K679-N683 PolarHBondContact O-N 3.03Å; K679-Y721 HydrophobicContact CB-CE1 4.31Å; K679-Y721 WeakPolarHBondContact CB-OH 3.3Å; K679-Y721 WeakPolarHBondContact CD-OH 3.46Å; K679-Y725 HydrophobicContact CD-CD1 4.32Å; K679-Y725 HydrophobicContact CD-CG 4.42Å; K679-F726 HydrophobicContact CG-CZ 4.32Å; K679-Y736 HydrophobicContact CB-CE2 4.23Å
680	L	88.3	Confident	87.5	Confident	6 Å²	6	44.6 Å²	44.6	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-69.6	-42.5	176.2	-70.6	172	0	0	0	111.5	L605 T607 I661 K676 Y677 C678 V682 N683 G684 Y685	L605-L680 HydrophobicContact CB-CD1 4.5Å; L605-L680 HydrophobicContact CD1-CD1 4.17Å; L605-L680 HydrophobicContact CD2-CD1 4.16Å; T607-L680 HydrophobicContact CG2-CD2 3.94Å; I661-L680 HydrophobicContact CD1-CB 3.72Å; I661-L680 HydrophobicContact CD1-CD1 4.43Å; I661-L680 HydrophobicContact CG1-CB 4.23Å; I661-L680 HydrophobicContact CG1-CD1 4.41Å; I661-L680 HydrophobicContact CG2-CD1 4.27Å; K676-L680 WeakPolarHBondContact O-CG 3.21Å; K676-L680 PolarHBondContact O-N 2.99Å; K676-L680 VanDerWaalsContact O-N 3.17Å; Y677-L680 WeakPolarHBondContact O-CA 3.47Å; Y677-L680 WeakPolarHBondContact O-CB 3.44Å; Y677-L680 PolarHBondContact O-N 3.09Å; C678-L680 VanDerWaalsContact C-N 3.32Å; C678-L680 PolarHBondContact O-N 3.41Å; L680-V682 PolarHBondContact O-N 3.01Å; L680-N683 CarbonylContact O-C 3.55Å; L680-N683 WeakPolarHBondContact O-CA 3.46Å; L680-N683 PolarHBondContact O-N 3.48Å; L680-N683 VanDerWaalsContact O-N 3.1Å; L680-G684 PolarHBondContact O-N 3.28Å; L680-Y685 HydrophobicContact CB-CD2 4.43Å; L680-Y685 HydrophobicContact CB-CG 4.29Å; L680-Y685 HydrophobicContact CD2-CD2 3.99Å; L680-Y685 HydrophobicContact CD2-CE2 4.15Å; L680-Y685 HydrophobicContact CD2-CG 4.19Å; L680-Y685 VanDerWaalsContact O-CB 3.3Å; L680-Y685 WeakPolarHBondContact O-CB 3.16Å; L680-Y685 WeakPolarHBondContact O-CD2 3.41Å; L680-Y685 PolarHBondContact O-N 3.43Å
681	L	91.5	Very high	87.2	Confident	39 Å²	39	41.2 Å²	41.2	20%	0.204	23%	0.226	C	C	.	.	H	α-helix	trans	-58.3	-46.1	175	-64	179.5	0	0	0	112	I661 Y677 C678 N683 G684 Y685 P687 I739 V743	I661-L681 HydrophobicContact CD1-CD2 3.87Å; I661-L681 HydrophobicContact CD1-CG 4.4Å; Y677-L681 HydrophobicContact CD1-CD1 4.16Å; Y677-L681 HydrophobicContact CE1-CD1 3.62Å; Y677-L681 HydrophobicContact CE1-CG 4.34Å; Y677-L681 HydrophobicContact CE2-CD1 4.48Å; Y677-L681 HydrophobicContact CE2-CD2 4.28Å; Y677-L681 HydrophobicContact CE2-CG 4.4Å; Y677-L681 PolarHBondContact O-N 3.02Å; C678-L681 PolarHBondContact O-N 3.27Å; L681-N683 PolarHBondContact O-N 3.14Å; L681-G684 PolarHBondContact O-N 3.44Å; L681-Y685 WeakPolarHBondContact CD2-O 3.45Å; L681-P687 HydrophobicContact CD2-CG 4.39Å; L681-I739 HydrophobicContact CB-CD1 4.27Å; L681-I739 HydrophobicContact CB-CG2 4.01Å; L681-I739 HydrophobicContact CD1-CG2 3.68Å; L681-I739 HydrophobicContact CG-CG2 4.5Å; L681-V743 HydrophobicContact CD1-CG2 4.4Å
682	V	89.4	Confident	87.3	Confident	22 Å²	22	45.7 Å²	45.7	13%	0.133	25%	0.25	C	S	.	.	H	α-helix	trans	-57.1	-38.9	173.8	172.2	0	0	0	0	111.9	C678 L680 G684 F726 M732 Y736 I739	C678-V682 WeakPolarHBondContact O-CG2 3.34Å; C678-V682 PolarHBondContact O-N 2.61Å; L680-V682 PolarHBondContact O-N 3.01Å; V682-G684 PolarHBondContact O-N 2.98Å; V682-G684 VanDerWaalsContact O-N 3.14Å; V682-F726 HydrophobicContact CG1-CE1 4.35Å; V682-M732 HydrophobicContact CG1-SD 3.67Å; V682-Y736 VanDerWaalsContact CG2-CA 3.45Å; V682-Y736 HydrophobicContact CG2-CD2 4.04Å; V682-Y736 HydrophobicContact CG2-CG 4.45Å; V682-I739 HydrophobicContact CG2-CD1 3.79Å
683	N	84.4	Confident	87.4	Confident	53 Å²	53	47.4 Å²	47.4	28%	0.283	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	21	177.5	-68.2	-4.9	0	0	0	113.2	K679 L680 L681 Y685	K679-N683 WeakPolarHBondContact O-CB 3.04Å; K679-N683 VanDerWaalsContact O-CG 3.28Å; K679-N683 PolarHBondContact O-N 3.03Å; L680-N683 CarbonylContact O-C 3.55Å; L680-N683 WeakPolarHBondContact O-CA 3.46Å; L680-N683 PolarHBondContact O-N 3.48Å; L680-N683 VanDerWaalsContact O-N 3.1Å; L681-N683 PolarHBondContact O-N 3.14Å; N683-Y685 VanDerWaalsContact C-N 3.29Å; N683-Y685 HydrophobicContact CB-CD2 4.11Å; N683-Y685 HydrophobicContact CB-CE2 4.34Å; N683-Y685 WeakPolarHBondContact O-CD2 3.29Å; N683-Y685 PolarHBondContact O-N 3.2Å
684	G	87.5	Confident	87.3	Confident	47 Å²	47	51.6 Å²	51.6	49%	0.485	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	5.9	174.5	0	0	0	0	0	115.6	L680 L681 V682	L680-G684 PolarHBondContact O-N 3.28Å; L681-G684 PolarHBondContact O-N 3.44Å; V682-G684 PolarHBondContact O-N 2.98Å; V682-G684 VanDerWaalsContact O-N 3.14Å
685	Y	89.5	Confident	87.1	Confident	5 Å²	5	57 Å²	57	2%	0.02	30%	0.298	C	S	.	.			trans	-74	144.1	177.4	-72	-107.2	0	0	0	111.8	Q434 T607 H659 I661 L680 L681 N683	Q434-Y685 PolarHBondContact NE2-OH 3.28Å; T607-Y685 HydrophobicContact CG2-CD1 4.48Å; T607-Y685 HydrophobicContact CG2-CE1 3.72Å; H659-Y685 VanDerWaalsContact CA-CD1 3.49Å; H659-Y685 HydrophobicContact CB-CD1 4.09Å; H659-Y685 HydrophobicContact CB-CE1 4.32Å; H659-Y685 HydrophobicContact CB-CG 4.2Å; H659-Y685 AromaticContact ND1-CD2 3.79Å; H659-Y685 AromaticContact ND1-CE2 3.52Å; H659-Y685 AromaticContact ND1-CZ 3.71Å; H659-Y685 CarbonylContact O-C 3.49Å; H659-Y685 WeakPolarHBondContact O-CA 3.32Å; I661-Y685 HydrophobicContact CG1-CG 4.46Å; L680-Y685 HydrophobicContact CB-CD2 4.43Å; L680-Y685 HydrophobicContact CB-CG 4.29Å; L680-Y685 HydrophobicContact CD2-CD2 3.99Å; L680-Y685 HydrophobicContact CD2-CE2 4.15Å; L680-Y685 HydrophobicContact CD2-CG 4.19Å; L680-Y685 VanDerWaalsContact O-CB 3.3Å; L680-Y685 WeakPolarHBondContact O-CB 3.16Å; L680-Y685 WeakPolarHBondContact O-CD2 3.41Å; L680-Y685 PolarHBondContact O-N 3.43Å; L681-Y685 WeakPolarHBondContact CD2-O 3.45Å; N683-Y685 VanDerWaalsContact C-N 3.29Å; N683-Y685 HydrophobicContact CB-CD2 4.11Å; N683-Y685 HydrophobicContact CB-CE2 4.34Å; N683-Y685 WeakPolarHBondContact O-CD2 3.29Å; N683-Y685 PolarHBondContact O-N 3.2Å
686	K	90.3	Very high	86.9	Confident	140 Å²	140	58.2 Å²	58.2	61%	0.609	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	139.5	179.7	-61.4	-176.5	-179.1	-177.7	0	110.5	H659 I660 I661	H659-K686 PolarHBondContact O-N 3.36Å; I660-K686 CarbonylContact C-O 3.6Å; I660-K686 WeakPolarHBondContact CA-O 3.3Å; I661-K686 PolarHBondContact N-O 2.94Å
687	P	89.2	Confident	87.1	Confident	34 Å²	34	57.2 Å²	57.2	22%	0.221	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	145.7	172.8	-25.4	35.9	0	0	0	112.8	Y677 L681 I693	Y677-P687 HydrophobicContact CE2-CG 4.17Å; L681-P687 HydrophobicContact CD2-CG 4.39Å; P687-I693 HydrophobicContact CB-CD1 3.67Å; P687-I693 HydrophobicContact CB-CG1 3.69Å; P687-I693 HydrophobicContact CB-CG2 4.42Å; P687-I693 HydrophobicContact CG-CD1 3.93Å; P687-I693 HydrophobicContact CG-CG1 4.18Å; P687-I693 HydrophobicContact CG-CG2 4.07Å
688	C	86.7	Confident	87.1	Confident	25 Å²	25	60.3 Å²	60.3	17%	0.169	31%	0.313	C	S	.	.			trans	-66.2	132.3	173.5	-174.8	0	0	0	0	111	I660 I661 V662 M690 I691	I660-C688 HydrophobicContact CG2-CB 3.65Å; I661-C688 WeakPolarHBondContact O-CB 3.44Å; I661-C688 PolarHBondContact O-N 3.4Å; V662-C688 HydrophobicContact CG2-CB 3.96Å; C688-M690 PolarHBondContact O-N 3.43Å; C688-I691 HydrophobicContact CB-CD1 4.12Å; C688-I691 HydrophobicContact CB-CG1 4.29Å; C688-I691 PolarHBondContact O-N 3.17Å
689	Q	82.3	Confident	86.9	Confident	190 Å²	190	64.3 Å²	64.3	89%	0.888	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-19.9	-179.7	-66.9	172.5	-28.1	0	0	114.3	I691	Q689-I691 VanDerWaalsContact C-N 3.29Å
690	M	79.3	Confident	86.9	Confident	172 Å²	172	64.2 Å²	64.2	85%	0.847	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	1.9	178.2	-58.4	-65.8	170.1	0	0	113.7	C688	C688-M690 PolarHBondContact O-N 3.43Å
691	I	78.9	Confident	87	Confident	34 Å²	34	64 Å²	64	17%	0.174	33%	0.328	C	S	.	.	S	Bend	trans	-112.5	130.2	-179.8	-60.4	177.7	0	0	0	108.8	V662 C688 Q689 I693 M696	V662-I691 HydrophobicContact CG1-CD1 4.27Å; C688-I691 HydrophobicContact CB-CD1 4.12Å; C688-I691 HydrophobicContact CB-CG1 4.29Å; C688-I691 PolarHBondContact O-N 3.17Å; Q689-I691 VanDerWaalsContact C-N 3.29Å; I691-I693 PolarHBondContact O-N 3.27Å; I691-M696 HydrophobicContact CG2-CB 4.17Å; I691-M696 HydrophobicContact CG2-CE 3.69Å; I691-M696 HydrophobicContact CG2-CG 4.44Å
692	D	84.5	Confident	87	Confident	94 Å²	94	64.1 Å²	64.1	50%	0.503	33%	0.332	S	S	.	.			trans	-67	98.3	164.1	-178.7	-14.8	0	0	0	108.9	I694 L695 M696	D692-I694 VanDerWaalsContact C-N 3.29Å; D692-I694 PolarHBondContact O-N 2.84Å; D692-I694 PolarHBondContact OD1-N 3.25Å; D692-L695 HydrophobicContact CB-CB 3.95Å; D692-L695 PolarHBondContact O-N 2.89Å; D692-L695 PolarHBondContact OD1-N 3.14Å; D692-L695 VanDerWaalsContact OD2-CB 3.31Å; D692-L695 WeakPolarHBondContact OD2-CB 3.33Å; D692-M696 VanDerWaalsContact O-CB 3.29Å; D692-M696 WeakPolarHBondContact O-CB 3.41Å; D692-M696 PolarHBondContact O-N 3.36Å
693	I	86.4	Confident	87	Confident	65 Å²	65	64.7 Å²	64.7	33%	0.333	33%	0.332	S	S	.	.	H	α-helix	trans	-60.5	-42.2	-178.4	-50.8	173.8	0	0	0	110.1	Y677 P687 I691 M696 E697	Y677-I693 WeakPolarHBondContact OH-CG2 3.42Å; P687-I693 HydrophobicContact CB-CD1 3.67Å; P687-I693 HydrophobicContact CB-CG1 3.69Å; P687-I693 HydrophobicContact CB-CG2 4.42Å; P687-I693 HydrophobicContact CG-CD1 3.93Å; P687-I693 HydrophobicContact CG-CG1 4.18Å; P687-I693 HydrophobicContact CG-CG2 4.07Å; I691-I693 PolarHBondContact O-N 3.27Å; I693-M696 PolarHBondContact O-N 2.97Å; I693-E697 HydrophobicContact CG2-CG 4.33Å; I693-E697 WeakPolarHBondContact O-CB 3.29Å; I693-E697 WeakPolarHBondContact O-CG 3.24Å; I693-E697 PolarHBondContact O-N 3.28Å
694	I	85.7	Confident	87.3	Confident	101 Å²	101	62.3 Å²	62.3	52%	0.518	32%	0.319	S	S	.	.	H	α-helix	trans	-67.1	-43.2	-175.3	-61.1	173	0	0	0	109.9	D692 K698	D692-I694 VanDerWaalsContact C-N 3.29Å; D692-I694 PolarHBondContact O-N 2.84Å; D692-I694 PolarHBondContact OD1-N 3.25Å; I694-K698 HydrophobicContact CG2-CD 4.05Å; I694-K698 VanDerWaalsContact CG2-CE 3.49Å; I694-K698 WeakPolarHBondContact O-CB 3.31Å; I694-K698 WeakPolarHBondContact O-CD 3.49Å; I694-K698 WeakPolarHBondContact O-CG 3.44Å; I694-K698 PolarHBondContact O-N 2.88Å; I694-K698 VanDerWaalsContact O-N 3.1Å
695	L	86.5	Confident	87.5	Confident	115 Å²	115	60.5 Å²	60.5	60%	0.602	30%	0.298	S	S	*	.	H	α-helix	trans	-67.1	-39.3	173.8	-178.2	62.6	0	0	0	111.9	D692 K698 Y699	D692-L695 HydrophobicContact CB-CB 3.95Å; D692-L695 PolarHBondContact O-N 2.89Å; D692-L695 PolarHBondContact OD1-N 3.14Å; D692-L695 VanDerWaalsContact OD2-CB 3.31Å; D692-L695 WeakPolarHBondContact OD2-CB 3.33Å; L695-K698 PolarHBondContact O-N 2.9Å; L695-Y699 PolarHBondContact O-N 2.89Å
696	M	87.2	Confident	87.5	Confident	26 Å²	26	65.5 Å²	65.5	13%	0.128	32%	0.324	C	S	.	.	H	α-helix	trans	-65	-46.6	179.9	-171.7	64.1	65.3	0	0	112	I663 P666 I669 I691 D692 I693 Y699 M700	I663-M696 HydrophobicContact CB-CE 4.1Å; I663-M696 HydrophobicContact CB-SD 4.4Å; I663-M696 HydrophobicContact CD1-CE 4.12Å; I663-M696 HydrophobicContact CD1-CG 3.62Å; I663-M696 HydrophobicContact CD1-SD 3.55Å; I663-M696 VanDerWaalsContact CD1-SD 3.55Å; I663-M696 HydrophobicContact CG2-CE 4.01Å; I663-M696 HydrophobicContact CG2-SD 4.07Å; P666-M696 HydrophobicContact CB-CE 4.03Å; P666-M696 HydrophobicContact CB-SD 3.98Å; I669-M696 HydrophobicContact CD1-SD 4.24Å; I691-M696 HydrophobicContact CG2-CB 4.17Å; I691-M696 HydrophobicContact CG2-CE 3.69Å; I691-M696 HydrophobicContact CG2-CG 4.44Å; D692-M696 VanDerWaalsContact O-CB 3.29Å; D692-M696 WeakPolarHBondContact O-CB 3.41Å; D692-M696 PolarHBondContact O-N 3.36Å; I693-M696 PolarHBondContact O-N 2.97Å; M696-Y699 WeakPolarHBondContact O-CB 3.5Å; M696-Y699 PolarHBondContact O-N 3.26Å; M696-M700 HydrophobicContact CG-CE 4.03Å; M696-M700 WeakPolarHBondContact O-CG 3.47Å; M696-M700 PolarHBondContact O-N 3.34Å
697	E	90.2	Very high	87.4	Confident	23 Å²	23	60.5 Å²	60.5	11%	0.107	30%	0.303	C	S	.	.	H	α-helix	trans	-65.7	-41.1	176.2	-72.4	180	-175.7	0	0	111.7	Y677 I693 Y699 M700 C701 V743 S747	Y677-E697 HydrophobicContact CE1-CG 3.64Å; Y677-E697 VanDerWaalsContact CE1-OE1 3.25Å; Y677-E697 WeakPolarHBondContact CE1-OE1 3.43Å; Y677-E697 PolarHBondContact OH-OE1 3Å; I693-E697 HydrophobicContact CG2-CG 4.33Å; I693-E697 WeakPolarHBondContact O-CB 3.29Å; I693-E697 WeakPolarHBondContact O-CG 3.24Å; I693-E697 PolarHBondContact O-N 3.28Å; E697-Y699 PolarHBondContact O-N 2.91Å; E697-M700 PolarHBondContact O-N 3.38Å; E697-C701 PolarHBondContact O-N 2.93Å; E697-C701 PolarHBondContact O-SG 3.43Å; E697-V743 HydrophobicContact CB-CG1 4.13Å; E697-V743 HydrophobicContact CG-CG1 3.96Å; E697-S747 VanDerWaalsContact CB-CB 3.43Å; E697-S747 VanDerWaalsContact CB-OG 3.26Å; E697-S747 WeakPolarHBondContact CB-OG 3.38Å; E697-S747 PolarHBondContact OE2-OG 3.31Å
698	K	89.1	Confident	87.5	Confident	72 Å²	72	60.7 Å²	60.7	31%	0.313	30%	0.301	S	S	.	.	H	α-helix	trans	-57.4	-38.4	172.8	-76.8	168	-174.6	172.9	0	111.9	I694 L695 S702 S747	I694-K698 HydrophobicContact CG2-CD 4.05Å; I694-K698 VanDerWaalsContact CG2-CE 3.49Å; I694-K698 WeakPolarHBondContact O-CB 3.31Å; I694-K698 WeakPolarHBondContact O-CD 3.49Å; I694-K698 WeakPolarHBondContact O-CG 3.44Å; I694-K698 PolarHBondContact O-N 2.88Å; I694-K698 VanDerWaalsContact O-N 3.1Å; L695-K698 PolarHBondContact O-N 2.9Å; K698-S702 VanDerWaalsContact O-CB 3.27Å; K698-S702 WeakPolarHBondContact O-CB 3.43Å; K698-S702 PolarHBondContact O-N 3.01Å; K698-S702 VanDerWaalsContact O-N 3.12Å; K698-S702 PolarHBondContact O-OG 2.89Å; K698-S747 WeakPolarHBondContact CA-O 3.1Å; K698-S747 WeakPolarHBondContact CG-O 3.47Å
699	Y	89	Confident	87.6	Confident	84 Å²	84	64 Å²	64	33%	0.329	32%	0.322	S	S	.	.	H	α-helix	trans	-66.8	-46.5	171.6	-169.1	-92.8	0	0	0	112.1	P666 I669 L695 M696 E697 S702 R703	P666-Y699 WeakPolarHBondContact O-CE1 3.32Å; I669-Y699 HydrophobicContact CB-CE1 4.16Å; L695-Y699 PolarHBondContact O-N 2.89Å; M696-Y699 WeakPolarHBondContact O-CB 3.5Å; M696-Y699 PolarHBondContact O-N 3.26Å; E697-Y699 PolarHBondContact O-N 2.91Å; Y699-S702 PolarHBondContact O-N 3.42Å; Y699-R703 HydrophobicContact CD1-CG 3.87Å; Y699-R703 HydrophobicContact CE1-CG 3.48Å; Y699-R703 VanDerWaalsContact CE1-CG 3.48Å; Y699-R703 HydrophobicContact CE2-CG 4.47Å; Y699-R703 HydrophobicContact CG-CG 4.49Å; Y699-R703 WeakPolarHBondContact O-CB 3.33Å; Y699-R703 VanDerWaalsContact O-CG 3.27Å; Y699-R703 WeakPolarHBondContact O-CG 3.47Å; Y699-R703 PolarHBondContact O-N 3Å
700	M	89.3	Confident	88	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-59.3	-48.4	178.1	-71.6	-173.6	-175.5	0	0	112.9	I663 I669 L674 Y677 M696 E697 R703 F704	I663-M700 HydrophobicContact CD1-CE 3.35Å; I669-M700 HydrophobicContact CD1-CE 4.05Å; I669-M700 HydrophobicContact CG2-CG 4.39Å; L674-M700 HydrophobicContact CB-CB 4.14Å; L674-M700 HydrophobicContact CD1-CB 4.06Å; Y677-M700 VanDerWaalsContact CB-SD 3.53Å; Y677-M700 HydrophobicContact CD1-SD 3.86Å; Y677-M700 HydrophobicContact CD2-CE 4.03Å; Y677-M700 HydrophobicContact CD2-SD 4.31Å; Y677-M700 HydrophobicContact CG-CE 3.94Å; Y677-M700 HydrophobicContact CG-SD 3.65Å; M696-M700 HydrophobicContact CG-CE 4.03Å; M696-M700 WeakPolarHBondContact O-CG 3.47Å; M696-M700 PolarHBondContact O-N 3.34Å; E697-M700 PolarHBondContact O-N 3.38Å; M700-R703 PolarHBondContact O-N 2.74Å; M700-F704 WeakPolarHBondContact O-CB 3.36Å; M700-F704 PolarHBondContact O-N 3.46Å
701	C	90.9	Very high	88.5	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.007	27%	0.273	C	S	.	.	H	α-helix	trans	-63.4	-42.1	178.2	-68.1	0	0	0	0	111.4	E697 R703 F704 F705 T748	E697-C701 PolarHBondContact O-N 2.93Å; E697-C701 PolarHBondContact O-SG 3.43Å; C701-R703 PolarHBondContact O-N 3.24Å; C701-F704 WeakPolarHBondContact O-CB 3.42Å; C701-F704 PolarHBondContact O-N 3.31Å; C701-F705 WeakPolarHBondContact O-CD2 3.35Å; C701-F705 PolarHBondContact O-N 3.47Å; C701-T748 HydrophobicContact CB-CG2 3.72Å
702	S	89.7	Confident	89.2	Confident	43 Å²	43	55.8 Å²	55.8	30%	0.301	29%	0.287	S	S	.	.	H	α-helix	trans	-60.7	-43.7	174.4	-59.3	0	0	0	0	112	K698 Y699 F705 I706	K698-S702 VanDerWaalsContact O-CB 3.27Å; K698-S702 WeakPolarHBondContact O-CB 3.43Å; K698-S702 PolarHBondContact O-N 3.01Å; K698-S702 VanDerWaalsContact O-N 3.12Å; K698-S702 PolarHBondContact O-OG 2.89Å; Y699-S702 PolarHBondContact O-N 3.42Å; S702-F705 PolarHBondContact O-N 3.09Å; S702-I706 WeakPolarHBondContact O-CB 3.31Å; S702-I706 WeakPolarHBondContact O-CD1 3.48Å; S702-I706 WeakPolarHBondContact O-CG1 3.3Å; S702-I706 PolarHBondContact O-N 2.92Å
703	R	90.4	Very high	89.5	Confident	34 Å²	34	55 Å²	55	13%	0.128	28%	0.283	C	S	.	.	H	α-helix	trans	-69.1	-31.5	176.3	-66	-67.9	-74.2	102.5	3.6	112.7	I669 Y699 M700 C701 D707	I669-R703 PolarHBondContact O-NE 3.47Å; I669-R703 PolarHBondContact O-NH2 3.05Å; Y699-R703 HydrophobicContact CD1-CG 3.87Å; Y699-R703 HydrophobicContact CE1-CG 3.48Å; Y699-R703 VanDerWaalsContact CE1-CG 3.48Å; Y699-R703 HydrophobicContact CE2-CG 4.47Å; Y699-R703 HydrophobicContact CG-CG 4.49Å; Y699-R703 WeakPolarHBondContact O-CB 3.33Å; Y699-R703 VanDerWaalsContact O-CG 3.27Å; Y699-R703 WeakPolarHBondContact O-CG 3.47Å; Y699-R703 PolarHBondContact O-N 3Å; M700-R703 PolarHBondContact O-N 2.74Å; C701-R703 PolarHBondContact O-N 3.24Å; R703-D707 IonicContact CZ-OD2 3.51Å; R703-D707 IonicContact NH1-OD1 2.71Å; R703-D707 IonicContact NH1-OD2 2.67Å; R703-D707 PolarHBondContact NH1-OD2 3.28Å; R703-D707 IonicContact NH2-OD2 3.25Å; R703-D707 WeakPolarHBondContact O-CB 3.4Å; R703-D707 PolarHBondContact O-N 3.32Å
704	F	91.3	Very high	89.8	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.009	27%	0.268	C	S	.	.	H	α-helix	trans	-62.8	-50	172.8	179.9	-100.1	0	0	0	111.6	L674 L675 M700 C701 I706 D707 F708 Q714 T759	L674-F704 HydrophobicContact CB-CB 4.43Å; L674-F704 HydrophobicContact CD2-CB 3.85Å; L674-F704 HydrophobicContact CD2-CD1 4.23Å; L674-F704 HydrophobicContact CD2-CD2 4.24Å; L674-F704 HydrophobicContact CD2-CG 3.85Å; L675-F704 HydrophobicContact CD1-CE2 4.49Å; L675-F704 HydrophobicContact CD2-CE2 4.12Å; L675-F704 HydrophobicContact CG-CE2 4.42Å; M700-F704 WeakPolarHBondContact O-CB 3.36Å; M700-F704 PolarHBondContact O-N 3.46Å; C701-F704 WeakPolarHBondContact O-CB 3.42Å; C701-F704 PolarHBondContact O-N 3.31Å; F704-I706 PolarHBondContact O-N 3.18Å; F704-D707 PolarHBondContact O-N 3.49Å; F704-F708 AromaticContact CD2-CD2 3.64Å; F704-F708 HydrophobicContact CD2-CD2 3.64Å; F704-F708 HydrophobicContact CD2-CE2 4.11Å; F704-F708 AromaticContact CE2-CD2 3.68Å; F704-F708 HydrophobicContact CE2-CD2 3.68Å; F704-F708 HydrophobicContact CE2-CE2 4.19Å; F704-F708 HydrophobicContact CE2-CG 4.45Å; F704-F708 HydrophobicContact CG-CD2 4.37Å; F704-F708 HydrophobicContact CZ-CD2 4.46Å; F704-F708 PolarHBondContact O-N 3.13Å; F704-Q714 HydrophobicContact CE1-CG 3.96Å; F704-Q714 HydrophobicContact CZ-CB 4.27Å; F704-Q714 HydrophobicContact CZ-CG 3.97Å; F704-T759 HydrophobicContact CE1-CG2 4.21Å
705	F	90.9	Very high	90.2	Very high	10 Å²	10	50 Å²	50	4%	0.044	25%	0.254	C	S	.	.	H	α-helix	trans	-66.6	-35.9	177.2	-57.5	-34.3	0	0	0	113.1	C701 S702 D707 F708 P709 V744 T748 M752 T759	C701-F705 WeakPolarHBondContact O-CD2 3.35Å; C701-F705 PolarHBondContact O-N 3.47Å; S702-F705 PolarHBondContact O-N 3.09Å; F705-D707 PolarHBondContact O-N 3.2Å; F705-F708 CarbonylContact O-C 3.39Å; F705-P709 VanDerWaalsContact O-CA 3.26Å; F705-P709 WeakPolarHBondContact O-CA 3.44Å; F705-P709 WeakPolarHBondContact O-CB 3.44Å; F705-P709 VanDerWaalsContact O-N 3.14Å; F705-V744 HydrophobicContact CZ-CG1 4.41Å; F705-T748 HydrophobicContact CE2-CG2 3.63Å; F705-T748 HydrophobicContact CZ-CG2 3.94Å; F705-M752 HydrophobicContact CB-CE 4.25Å; F705-M752 HydrophobicContact CD2-CB 4.28Å; F705-M752 HydrophobicContact CD2-CE 4.3Å; F705-M752 HydrophobicContact CD2-CG 4.49Å; F705-M752 HydrophobicContact CE2-CB 4.35Å; F705-T759 HydrophobicContact CE1-CG2 4.23Å; F705-T759 WeakPolarHBondContact CE1-OG1 3.26Å
706	I	89.8	Confident	90.4	Very high	109 Å²	109	48.8 Å²	48.8	56%	0.559	25%	0.245	S	C	*	.	H	α-helix	trans	-65.5	-36	176.1	-71.5	165.6	0	0	0	112.4	S702 F704	S702-I706 WeakPolarHBondContact O-CB 3.31Å; S702-I706 WeakPolarHBondContact O-CD1 3.48Å; S702-I706 WeakPolarHBondContact O-CG1 3.3Å; S702-I706 PolarHBondContact O-N 2.92Å; F704-I706 PolarHBondContact O-N 3.18Å
707	D	88.9	Confident	90.5	Very high	35 Å²	35	50.2 Å²	50.2	19%	0.187	25%	0.251	C	S	.	.	H	α-helix	trans	-89	-25.9	179.2	-72	-37	0	0	0	113.1	K5 G671 R703 F704 F705	K5-D707 IonicContact NZ-OD1 3.84Å; K5-D707 PolarHBondContact NZ-OD1 3.04Å; G671-D707 PolarHBondContact N-OD2 2.94Å; R703-D707 IonicContact CZ-OD2 3.51Å; R703-D707 IonicContact NH1-OD1 2.71Å; R703-D707 IonicContact NH1-OD2 2.67Å; R703-D707 PolarHBondContact NH1-OD2 3.28Å; R703-D707 IonicContact NH2-OD2 3.25Å; R703-D707 WeakPolarHBondContact O-CB 3.4Å; R703-D707 PolarHBondContact O-N 3.32Å; F704-D707 PolarHBondContact O-N 3.49Å; F705-D707 PolarHBondContact O-N 3.2Å
708	F	89.9	Confident	90.6	Very high	39 Å²	39	49.2 Å²	49.2	17%	0.171	25%	0.246	C	C	.	.			trans	-128.7	67.2	177.8	-52.3	-74.8	0	0	0	112.7	F704 F705 N710 Q714 Q717	F704-F708 AromaticContact CD2-CD2 3.64Å; F704-F708 HydrophobicContact CD2-CD2 3.64Å; F704-F708 HydrophobicContact CD2-CE2 4.11Å; F704-F708 AromaticContact CE2-CD2 3.68Å; F704-F708 HydrophobicContact CE2-CD2 3.68Å; F704-F708 HydrophobicContact CE2-CE2 4.19Å; F704-F708 HydrophobicContact CE2-CG 4.45Å; F704-F708 HydrophobicContact CG-CD2 4.37Å; F704-F708 HydrophobicContact CZ-CD2 4.46Å; F704-F708 PolarHBondContact O-N 3.13Å; F705-F708 CarbonylContact O-C 3.39Å; F708-N710 PolarHBondContact O-N 2.96Å; F708-Q714 HydrophobicContact CB-CG 3.87Å; F708-Q714 VanDerWaalsContact O-CG 3.31Å; F708-Q714 WeakPolarHBondContact O-CG 3.47Å; F708-Q714 PolarHBondContact O-NE2 3.4Å; F708-Q717 HydrophobicContact CD1-CB 4.43Å; F708-Q717 HydrophobicContact CD1-CG 4.47Å; F708-Q717 HydrophobicContact CE1-CB 4.21Å; F708-Q717 HydrophobicContact CE1-CG 3.9Å; F708-Q717 HydrophobicContact CE2-CG 4.21Å; F708-Q717 HydrophobicContact CZ-CG 3.75Å
709	P	89.6	Confident	90.7	Very high	94 Å²	94	46.9 Å²	46.9	61%	0.61	24%	0.238	S	C	*	.			trans	-75.8	-17.7	-173.9	29.2	-36.9	0	0	0	114.9	F705	F705-P709 VanDerWaalsContact O-CA 3.26Å; F705-P709 WeakPolarHBondContact O-CA 3.44Å; F705-P709 WeakPolarHBondContact O-CB 3.44Å; F705-P709 VanDerWaalsContact O-N 3.14Å
710	N	90	Very high	90.6	Very high	81 Å²	81	45.2 Å²	45.2	43%	0.433	23%	0.231	S	C	.	.	S	Bend	trans	-97.6	129.2	177.2	-179.2	-16.1	0	0	0	109.8	F708 L712 N713 Q714	F708-N710 PolarHBondContact O-N 2.96Å; N710-L712 PolarHBondContact O-N 3.14Å; N710-L712 PolarHBondContact OD1-N 2.86Å; N710-N713 HydrophobicContact CB-CB 4.46Å; N710-N713 WeakPolarHBondContact O-CA 3.25Å; N710-N713 WeakPolarHBondContact O-CB 3.43Å; N710-N713 PolarHBondContact O-N 3.35Å; N710-Q714 PolarHBondContact O-N 3.13Å; N710-Q714 VanDerWaalsContact O-N 3.09Å
711	I	91.2	Very high	90.5	Very high	54 Å²	54	45.7 Å²	45.7	28%	0.277	23%	0.233	S	C	.	.	H	α-helix	trans	-55	-32.5	178.4	-162.4	61.9	0	0	0	113.4	Q714 Y715 Q758 L762	I711-Q714 WeakPolarHBondContact O-CB 3.34Å; I711-Q714 PolarHBondContact O-N 3.37Å; I711-Y715 PolarHBondContact O-N 3.16Å; I711-Q758 HydrophobicContact CD1-CB 3.91Å; I711-Q758 HydrophobicContact CG1-CB 4.39Å; I711-L762 HydrophobicContact CD1-CB 3.93Å; I711-L762 HydrophobicContact CD1-CD2 3.56Å; I711-L762 HydrophobicContact CD1-CG 4.34Å; I711-L762 HydrophobicContact CG1-CD2 4.2Å
712	L	92	Very high	90.4	Very high	88 Å²	88	46 Å²	46	46%	0.461	24%	0.235	S	C	.	.	H	α-helix	trans	-67.1	-36.3	174.9	-176.3	62.6	0	0	0	112.3	N710 Y715 H716	N710-L712 PolarHBondContact O-N 3.14Å; N710-L712 PolarHBondContact OD1-N 2.86Å; L712-Y715 HydrophobicContact CD1-CD1 4.27Å; L712-Y715 PolarHBondContact O-N 3.37Å; L712-H716 WeakPolarHBondContact O-CB 3.43Å; L712-H716 PolarHBondContact O-CD2 3.42Å; L712-H716 VanDerWaalsContact O-CG 3.31Å; L712-H716 PolarHBondContact O-N 3.25Å
713	N	91.2	Very high	90.1	Very high	77 Å²	77	48.2 Å²	48.2	41%	0.412	24%	0.242	S	C	.	.	H	α-helix	trans	-69.4	-37.8	174.3	-66.8	-7.8	0	0	0	110.7	N710 Q717	N710-N713 HydrophobicContact CB-CB 4.46Å; N710-N713 WeakPolarHBondContact O-CA 3.25Å; N710-N713 WeakPolarHBondContact O-CB 3.43Å; N710-N713 PolarHBondContact O-N 3.35Å; N713-Q717 VanDerWaalsContact O-CB 3.22Å; N713-Q717 WeakPolarHBondContact O-CB 3.43Å; N713-Q717 PolarHBondContact O-N 3.14Å
714	Q	92.9	Very high	89.5	Confident	5 Å²	5	47.2 Å²	47.2	2%	0.023	24%	0.24	C	C	.	.	H	α-helix	trans	-63.5	-47.2	173.2	-61.2	-179.3	12.8	0	0	111.1	F704 F708 N710 I711 H716 Q717 L718 T759 L762	F704-Q714 HydrophobicContact CE1-CG 3.96Å; F704-Q714 HydrophobicContact CZ-CB 4.27Å; F704-Q714 HydrophobicContact CZ-CG 3.97Å; F708-Q714 HydrophobicContact CB-CG 3.87Å; F708-Q714 VanDerWaalsContact O-CG 3.31Å; F708-Q714 WeakPolarHBondContact O-CG 3.47Å; F708-Q714 PolarHBondContact O-NE2 3.4Å; N710-Q714 PolarHBondContact O-N 3.13Å; N710-Q714 VanDerWaalsContact O-N 3.09Å; I711-Q714 WeakPolarHBondContact O-CB 3.34Å; I711-Q714 PolarHBondContact O-N 3.37Å; Q714-H716 PolarHBondContact O-N 2.68Å; Q714-Q717 PolarHBondContact O-N 2.98Å; Q714-L718 WeakPolarHBondContact O-CB 3.48Å; Q714-L718 WeakPolarHBondContact O-CG 3.27Å; Q714-L718 PolarHBondContact O-N 2.97Å; Q714-T759 PolarHBondContact OE1-OG1 3.43Å; Q714-L762 HydrophobicContact CB-CD2 3.73Å
715	Y	94	Very high	88.8	Confident	58 Å²	58	48.2 Å²	48.2	23%	0.227	24%	0.244	C	C	.	.	H	α-helix	trans	-55.9	-50.8	175	168.9	-106.2	0	0	0	111.5	I711 L712 Q717 L718 N719 L762 M765 F766	I711-Y715 PolarHBondContact O-N 3.16Å; L712-Y715 HydrophobicContact CD1-CD1 4.27Å; L712-Y715 PolarHBondContact O-N 3.37Å; Y715-Q717 VanDerWaalsContact C-N 3.34Å; Y715-Q717 PolarHBondContact O-N 2.62Å; Y715-L718 PolarHBondContact O-N 2.8Å; Y715-N719 WeakPolarHBondContact O-CB 3.25Å; Y715-N719 PolarHBondContact O-N 3.41Å; Y715-N719 PolarHBondContact OH-ND2 3.23Å; Y715-N719 VanDerWaalsContact OH-ND2 3.15Å; Y715-L762 HydrophobicContact CD2-CD1 3.91Å; Y715-L762 HydrophobicContact CG-CD1 4.37Å; Y715-M765 HydrophobicContact CD2-CE 3.95Å; Y715-M765 HydrophobicContact CE2-CE 3.87Å; Y715-F766 AromaticContact CD2-CE1 3.98Å; Y715-F766 HydrophobicContact CD2-CE1 3.98Å; Y715-F766 AromaticContact CD2-CE2 3.94Å; Y715-F766 HydrophobicContact CD2-CE2 3.94Å; Y715-F766 AromaticContact CD2-CZ 3.3Å; Y715-F766 HydrophobicContact CD2-CZ 3.3Å; Y715-F766 AromaticContact CE2-CE1 3.77Å; Y715-F766 HydrophobicContact CE2-CE1 3.77Å; Y715-F766 AromaticContact CE2-CZ 3.59Å; Y715-F766 HydrophobicContact CE2-CZ 3.59Å; Y715-F766 HydrophobicContact CG-CZ 4.3Å
716	H	91.3	Very high	88.3	Confident	89 Å²	89	48.4 Å²	48.4	41%	0.412	24%	0.244	S	C	.	.	H	α-helix	trans	-62.4	-38.8	178.3	-70.7	-25.8	0	0	0	112.9	L712 Q714 Y720	L712-H716 WeakPolarHBondContact O-CB 3.43Å; L712-H716 PolarHBondContact O-CD2 3.42Å; L712-H716 VanDerWaalsContact O-CG 3.31Å; L712-H716 PolarHBondContact O-N 3.25Å; Q714-H716 PolarHBondContact O-N 2.68Å; H716-Y720 WeakPolarHBondContact O-CB 3.4Å; H716-Y720 PolarHBondContact O-N 3.4Å
717	Q	90	Very high	87.3	Confident	56 Å²	56	45.2 Å²	45.2	26%	0.262	23%	0.228	S	C	.	.	H	α-helix	trans	-70.9	-42.8	179	-177	63.7	19.1	0	0	112.3	L675 F708 N713 Q714 Y715 Y721	L675-Q717 HydrophobicContact CD1-CG 3.9Å; F708-Q717 HydrophobicContact CD1-CB 4.43Å; F708-Q717 HydrophobicContact CD1-CG 4.47Å; F708-Q717 HydrophobicContact CE1-CB 4.21Å; F708-Q717 HydrophobicContact CE1-CG 3.9Å; F708-Q717 HydrophobicContact CE2-CG 4.21Å; F708-Q717 HydrophobicContact CZ-CG 3.75Å; N713-Q717 VanDerWaalsContact O-CB 3.22Å; N713-Q717 WeakPolarHBondContact O-CB 3.43Å; N713-Q717 PolarHBondContact O-N 3.14Å; Q714-Q717 PolarHBondContact O-N 2.98Å; Y715-Q717 VanDerWaalsContact C-N 3.34Å; Y715-Q717 PolarHBondContact O-N 2.62Å; Q717-Y721 WeakPolarHBondContact O-CB 3.46Å; Q717-Y721 PolarHBondContact O-N 2.69Å
718	L	92.3	Very high	86.5	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-68.3	-47	176.9	-70.9	177.1	0	0	0	111.5	L675 Q714 Y715 Y720 Y721 L722 L740 L762 I763 F766	L675-L718 HydrophobicContact CD2-CD2 3.58Å; Q714-L718 WeakPolarHBondContact O-CB 3.48Å; Q714-L718 WeakPolarHBondContact O-CG 3.27Å; Q714-L718 PolarHBondContact O-N 2.97Å; Y715-L718 PolarHBondContact O-N 2.8Å; L718-Y720 VanDerWaalsContact C-N 3.31Å; L718-Y720 PolarHBondContact O-N 2.83Å; L718-Y721 WeakPolarHBondContact O-CA 3.06Å; L718-Y721 WeakPolarHBondContact O-CB 3.25Å; L718-Y721 PolarHBondContact O-N 2.73Å; L718-L722 WeakPolarHBondContact O-CG 3.34Å; L718-L722 PolarHBondContact O-N 3.08Å; L718-L740 HydrophobicContact CD1-CD2 4.44Å; L718-L740 HydrophobicContact CD2-CD2 3.6Å; L718-L762 HydrophobicContact CD1-CD2 4.04Å; L718-L762 HydrophobicContact CD1-CG 4.35Å; L718-I763 HydrophobicContact CD1-CG1 4.39Å; L718-F766 HydrophobicContact CB-CD2 4.38Å; L718-F766 HydrophobicContact CB-CE2 3.64Å; L718-F766 HydrophobicContact CB-CZ 4.02Å; L718-F766 HydrophobicContact CD1-CD2 4.36Å; L718-F766 HydrophobicContact CD1-CE2 4Å; L718-F766 HydrophobicContact CG-CE2 4.48Å
719	N	90.8	Very high	86.2	Confident	24 Å²	24	51.9 Å²	51.9	13%	0.128	27%	0.266	C	S	.	.	H	α-helix	trans	-57.7	-45.1	174.8	-171	-35.7	0	0	0	110.6	Y715 Y721 L722 L723 F766	Y715-N719 WeakPolarHBondContact O-CB 3.25Å; Y715-N719 PolarHBondContact O-N 3.41Å; Y715-N719 PolarHBondContact OH-ND2 3.23Å; Y715-N719 VanDerWaalsContact OH-ND2 3.15Å; N719-Y721 VanDerWaalsContact C-N 3.34Å; N719-Y721 PolarHBondContact O-N 2.89Å; N719-L722 PolarHBondContact O-N 3.22Å; N719-L723 VanDerWaalsContact O-CB 3.32Å; N719-L723 WeakPolarHBondContact O-CB 3.24Å; N719-L723 VanDerWaalsContact O-CG 3.29Å; N719-L723 WeakPolarHBondContact O-CG 3.46Å; N719-L723 PolarHBondContact O-N 3.06Å; N719-L723 WeakPolarHBondContact OD1-CD1 3.43Å; N719-F766 HydrophobicContact CB-CE1 3.92Å; N719-F766 HydrophobicContact CB-CZ 3.86Å
720	Y	85.5	Confident	86	Confident	48 Å²	48	49.3 Å²	49.3	19%	0.188	24%	0.244	C	C	.	.	H	α-helix	trans	-60.6	-39.1	172.2	178.3	-84.2	0	0	0	112.9	K572 H716 L718 N724	K572-Y720 HydrophobicContact CD-CE2 4.11Å; K572-Y720 WeakPolarHBondContact CD-OH 3.39Å; K572-Y720 VanDerWaalsContact NZ-CE2 3.35Å; K572-Y720 VanDerWaalsContact NZ-CZ 3.26Å; K572-Y720 PolarHBondContact NZ-OH 2.93Å; H716-Y720 WeakPolarHBondContact O-CB 3.4Å; H716-Y720 PolarHBondContact O-N 3.4Å; L718-Y720 VanDerWaalsContact C-N 3.31Å; L718-Y720 PolarHBondContact O-N 2.83Å; Y720-N724 WeakPolarHBondContact CD2-ND2 3.35Å; Y720-N724 VanDerWaalsContact CE2-ND2 3.33Å; Y720-N724 WeakPolarHBondContact CE2-ND2 3.49Å; Y720-N724 PolarHBondContact O-N 3.15Å; Y720-N724 PolarHBondContact O-ND2 3.27Å
721	Y	87.1	Confident	85.9	Confident	11 Å²	11	50.2 Å²	50.2	4%	0.043	25%	0.246	C	C	.	.	H	α-helix	trans	-65.8	-49	178.9	-156.5	-93.1	0	0	0	111.3	L675 K679 Q717 L718 N719 L723 N724 Y725 F726 Y736	L675-Y721 HydrophobicContact CB-CD2 3.96Å; L675-Y721 HydrophobicContact CB-CE1 4.34Å; L675-Y721 HydrophobicContact CB-CE2 3.72Å; L675-Y721 HydrophobicContact CB-CG 4.38Å; L675-Y721 HydrophobicContact CD1-CD2 3.95Å; L675-Y721 HydrophobicContact CD1-CE2 4.48Å; L675-Y721 HydrophobicContact CD1-CG 4.3Å; L675-Y721 PolarHBondContact O-OH 2.92Å; K679-Y721 HydrophobicContact CB-CE1 4.31Å; K679-Y721 WeakPolarHBondContact CB-OH 3.3Å; K679-Y721 WeakPolarHBondContact CD-OH 3.46Å; Q717-Y721 WeakPolarHBondContact O-CB 3.46Å; Q717-Y721 PolarHBondContact O-N 2.69Å; L718-Y721 WeakPolarHBondContact O-CA 3.06Å; L718-Y721 WeakPolarHBondContact O-CB 3.25Å; L718-Y721 PolarHBondContact O-N 2.73Å; N719-Y721 VanDerWaalsContact C-N 3.34Å; N719-Y721 PolarHBondContact O-N 2.89Å; Y721-L723 PolarHBondContact O-N 3.37Å; Y721-N724 PolarHBondContact O-N 3.14Å; Y721-Y725 AromaticContact CD1-CD2 3.75Å; Y721-Y725 HydrophobicContact CD1-CD2 3.75Å; Y721-Y725 AromaticContact CD2-CD2 3.6Å; Y721-Y725 HydrophobicContact CD2-CD2 3.6Å; Y721-Y725 AromaticContact CD2-CE2 3.56Å; Y721-Y725 HydrophobicContact CD2-CE2 3.56Å; Y721-Y725 AromaticContact CE1-CD2 3.62Å; Y721-Y725 HydrophobicContact CE1-CD2 3.62Å; Y721-Y725 HydrophobicContact CE1-CE2 4.33Å; Y721-Y725 HydrophobicContact CE1-CG 4.22Å; Y721-Y725 AromaticContact CE2-CD2 3.48Å; Y721-Y725 HydrophobicContact CE2-CD2 3.48Å; Y721-Y725 VanDerWaalsContact CE2-CD2 3.48Å; Y721-Y725 AromaticContact CE2-CE2 3.31Å; Y721-Y725 HydrophobicContact CE2-CE2 3.31Å; Y721-Y725 AromaticContact CG-CD2 3.73Å; Y721-Y725 HydrophobicContact CG-CD2 3.73Å; Y721-Y725 HydrophobicContact CG-CE2 4.17Å; Y721-Y725 AromaticContact CZ-CD2 3.47Å; Y721-Y725 VanDerWaalsContact CZ-CD2 3.47Å; Y721-Y725 AromaticContact CZ-CE2 3.73Å; Y721-Y725 WeakPolarHBondContact O-CD2 3.18Å; Y721-Y725 PolarHBondContact O-N 2.92Å; Y721-F726 HydrophobicContact CD1-CE2 4.1Å; Y721-F726 AromaticContact CE1-CE2 3.99Å; Y721-F726 HydrophobicContact CE1-CE2 3.99Å; Y721-Y736 HydrophobicContact CD1-CE1 4.06Å; Y721-Y736 HydrophobicContact CD1-CE2 4.2Å; Y721-Y736 AromaticContact CD1-CZ 3.62Å; Y721-Y736 VanDerWaalsContact CD1-OH 3.3Å; Y721-Y736 WeakPolarHBondContact CD1-OH 3.32Å; Y721-Y736 HydrophobicContact CE1-CE1 4.44Å; Y721-Y736 AromaticContact CE1-CE2 3.75Å; Y721-Y736 HydrophobicContact CE1-CE2 3.75Å; Y721-Y736 AromaticContact CE1-CZ 3.6Å; Y721-Y736 VanDerWaalsContact CE1-OH 3.31Å; Y721-Y736 WeakPolarHBondContact CE1-OH 3.22Å
722	L	89.8	Confident	85.7	Confident	9 Å²	9	51 Å²	51	5%	0.047	25%	0.249	C	C	.	.	H	α-helix	trans	-59.9	-42.5	178.2	-65.3	172.1	0	0	0	112.4	L718 N719 N724 F726 K733 Y736 L737 F766	L718-L722 WeakPolarHBondContact O-CG 3.34Å; L718-L722 PolarHBondContact O-N 3.08Å; N719-L722 PolarHBondContact O-N 3.22Å; L722-N724 VanDerWaalsContact C-N 3.28Å; L722-N724 PolarHBondContact O-N 2.91Å; L722-F726 HydrophobicContact CD2-CD2 4.16Å; L722-F726 PolarHBondContact O-N 3Å; L722-K733 HydrophobicContact CD2-CB 4.45Å; L722-K733 HydrophobicContact CD2-CG 4.3Å; L722-Y736 HydrophobicContact CD2-CD1 3.87Å; L722-Y736 HydrophobicContact CD2-CE1 4.28Å; L722-L737 HydrophobicContact CD1-CD1 4.31Å; L722-L737 HydrophobicContact CD1-CD2 4.3Å; L722-L737 HydrophobicContact CD2-CD1 4.45Å; L722-L737 HydrophobicContact CD2-CD2 4.47Å; L722-L737 HydrophobicContact CD2-CG 4.28Å; L722-F766 HydrophobicContact CD1-CB 4.44Å; L722-F766 HydrophobicContact CD1-CD1 3.89Å; L722-F766 HydrophobicContact CD1-CE1 4.27Å; L722-F766 HydrophobicContact CD1-CG 4.15Å
723	L	83.9	Confident	85.7	Confident	88 Å²	88	47.4 Å²	47.4	46%	0.461	23%	0.23	S	C	.	.	H	α-helix	trans	-75	-2.3	-178.8	-73.2	-178.5	0	0	0	115.8	K574 N719 Y721	K574-L723 PolarHBondContact NZ-O 3.41Å; N719-L723 VanDerWaalsContact O-CB 3.32Å; N719-L723 WeakPolarHBondContact O-CB 3.24Å; N719-L723 VanDerWaalsContact O-CG 3.29Å; N719-L723 WeakPolarHBondContact O-CG 3.46Å; N719-L723 PolarHBondContact O-N 3.06Å; N719-L723 WeakPolarHBondContact OD1-CD1 3.43Å; Y721-L723 PolarHBondContact O-N 3.37Å
724	N	76.8	Confident	85.7	Confident	13 Å²	13	44.6 Å²	44.6	7%	0.07	22%	0.215	C	C	.	.	H	α-helix	trans	-128.4	-20.8	178.6	-62.6	-67.8	0	0	0	114.1	K574 L588 Y720 Y721 L722	K574-N724 VanDerWaalsContact CE-OD1 3.24Å; K574-N724 WeakPolarHBondContact CE-OD1 3.26Å; K574-N724 PolarHBondContact NZ-OD1 2.78Å; L588-N724 HydrophobicContact CD2-CB 4.31Å; Y720-N724 WeakPolarHBondContact CD2-ND2 3.35Å; Y720-N724 VanDerWaalsContact CE2-ND2 3.33Å; Y720-N724 WeakPolarHBondContact CE2-ND2 3.49Å; Y720-N724 PolarHBondContact O-N 3.15Å; Y720-N724 PolarHBondContact O-ND2 3.27Å; Y721-N724 PolarHBondContact O-N 3.14Å; L722-N724 VanDerWaalsContact C-N 3.28Å; L722-N724 PolarHBondContact O-N 2.91Å
725	Y	77.4	Confident	85.7	Confident	24 Å²	24	47.2 Å²	47.2	9%	0.094	23%	0.229	C	C	.	.	H	α-helix	trans	-106.4	-17.6	178.4	-67	-63.2	0	0	0	115.1	H437 D438 K679 Y721	H437-Y725 HydrophobicContact CB-CD1 3.89Å; H437-Y725 HydrophobicContact CB-CE1 4.3Å; H437-Y725 PolarHBondContact CE1-O 3.47Å; H437-Y725 PolarHBondContact ND1-O 2.78Å; D438-Y725 WeakPolarHBondContact OD2-CE1 3.22Å; D438-Y725 VanDerWaalsContact OD2-CZ 3.23Å; D438-Y725 PolarHBondContact OD2-OH 2.95Å; K679-Y725 HydrophobicContact CD-CD1 4.32Å; K679-Y725 HydrophobicContact CD-CG 4.42Å; Y721-Y725 AromaticContact CD1-CD2 3.75Å; Y721-Y725 HydrophobicContact CD1-CD2 3.75Å; Y721-Y725 AromaticContact CD2-CD2 3.6Å; Y721-Y725 HydrophobicContact CD2-CD2 3.6Å; Y721-Y725 AromaticContact CD2-CE2 3.56Å; Y721-Y725 HydrophobicContact CD2-CE2 3.56Å; Y721-Y725 AromaticContact CE1-CD2 3.62Å; Y721-Y725 HydrophobicContact CE1-CD2 3.62Å; Y721-Y725 HydrophobicContact CE1-CE2 4.33Å; Y721-Y725 HydrophobicContact CE1-CG 4.22Å; Y721-Y725 AromaticContact CE2-CD2 3.48Å; Y721-Y725 HydrophobicContact CE2-CD2 3.48Å; Y721-Y725 VanDerWaalsContact CE2-CD2 3.48Å; Y721-Y725 AromaticContact CE2-CE2 3.31Å; Y721-Y725 HydrophobicContact CE2-CE2 3.31Å; Y721-Y725 AromaticContact CG-CD2 3.73Å; Y721-Y725 HydrophobicContact CG-CD2 3.73Å; Y721-Y725 HydrophobicContact CG-CE2 4.17Å; Y721-Y725 AromaticContact CZ-CD2 3.47Å; Y721-Y725 VanDerWaalsContact CZ-CD2 3.47Å; Y721-Y725 AromaticContact CZ-CE2 3.73Å; Y721-Y725 WeakPolarHBondContact O-CD2 3.18Å; Y721-Y725 PolarHBondContact O-N 2.92Å
726	F	79.4	Confident	85.8	Confident	14 Å²	14	44.5 Å²	44.5	6%	0.061	22%	0.218	C	C	.	.	S	Bend	trans	-128.5	9.9	-172.4	-59.8	-71.8	0	0	0	114.6	K679 V682 Y721 L722 N728 N729 M732 K733 Y736	K679-F726 HydrophobicContact CG-CZ 4.32Å; V682-F726 HydrophobicContact CG1-CE1 4.35Å; Y721-F726 HydrophobicContact CD1-CE2 4.1Å; Y721-F726 AromaticContact CE1-CE2 3.99Å; Y721-F726 HydrophobicContact CE1-CE2 3.99Å; L722-F726 HydrophobicContact CD2-CD2 4.16Å; L722-F726 PolarHBondContact O-N 3Å; F726-N728 PolarHBondContact O-N 3.15Å; F726-N729 PolarHBondContact O-N 2.99Å; F726-M732 HydrophobicContact CD1-CB 3.88Å; F726-M732 HydrophobicContact CE1-CB 4.44Å; F726-K733 HydrophobicContact CB-CG 3.56Å; F726-K733 HydrophobicContact CG-CG 4.39Å; F726-Y736 HydrophobicContact CD2-CG 4.41Å; F726-Y736 AromaticContact CE2-CD1 3.93Å; F726-Y736 HydrophobicContact CE2-CD1 3.93Å; F726-Y736 AromaticContact CE2-CD2 3.56Å; F726-Y736 HydrophobicContact CE2-CD2 3.56Å; F726-Y736 HydrophobicContact CE2-CE1 4.33Å; F726-Y736 AromaticContact CE2-CE2 3.97Å; F726-Y736 HydrophobicContact CE2-CE2 3.97Å; F726-Y736 AromaticContact CE2-CG 3.53Å; F726-Y736 HydrophobicContact CE2-CG 3.53Å; F726-Y736 HydrophobicContact CZ-CD1 4.49Å; F726-Y736 AromaticContact CZ-CD2 3.4Å; F726-Y736 HydrophobicContact CZ-CD2 3.4Å; F726-Y736 HydrophobicContact CZ-CE2 4.06Å; F726-Y736 AromaticContact CZ-CG 3.65Å; F726-Y736 HydrophobicContact CZ-CG 3.65Å
727	D	70.3	Confident	86	Confident	42 Å²	42	40.2 Å²	40.2	23%	0.225	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	34.8	-119.3	171.8	-67.8	-38.3	0	0	0	114.2	K733	D727-K733 WeakPolarHBondContact O-CE 3.35Å; D727-K733 PolarHBondContact O-NZ 3.01Å
728	N	70.5	Confident	86.2	Confident	133 Å²	133	41.1 Å²	41.1	71%	0.711	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-103.4	19.5	174.6	-70.4	-1.8	0	0	0	112.5	F726 Y730	F726-N728 PolarHBondContact O-N 3.15Å; N728-Y730 WeakPolarHBondContact O-CD2 3.32Å; N728-Y730 WeakPolarHBondContact O-CE2 3.26Å; N728-Y730 PolarHBondContact O-N 3.39Å
729	N	83.3	Confident	86.3	Confident	80 Å²	80	42.9 Å²	42.9	43%	0.428	21%	0.214	S	C	.	.			trans	-88.6	84.1	179.5	-168.6	-29.8	0	0	0	110.5	F726 Q731 M732 K733	F726-N729 PolarHBondContact O-N 2.99Å; N729-Q731 VanDerWaalsContact C-N 3.33Å; N729-Q731 PolarHBondContact O-N 3.36Å; N729-M732 HydrophobicContact CB-CB 4.15Å; N729-M732 HydrophobicContact CB-CG 4.41Å; N729-M732 VanDerWaalsContact CG-CG 3.47Å; N729-M732 VanDerWaalsContact ND2-CG 3.34Å; N729-M732 WeakPolarHBondContact ND2-CG 3.44Å; N729-M732 PolarHBondContact O-N 2.88Å; N729-M732 WeakPolarHBondContact OD1-CG 3.18Å; N729-M732 PolarHBondContact OD1-N 2.84Å; N729-K733 PolarHBondContact O-N 3.24Å
730	Y	86.7	Confident	86.5	Confident	41 Å²	41	41.9 Å²	41.9	16%	0.161	21%	0.208	C	C	.	.	H	α-helix	trans	-55	-44.4	-179.2	-63.7	-80.7	0	0	0	112.8	N728 M732 K733 I734 V770 Q773 E774 N777	N728-Y730 WeakPolarHBondContact O-CD2 3.32Å; N728-Y730 WeakPolarHBondContact O-CE2 3.26Å; N728-Y730 PolarHBondContact O-N 3.39Å; Y730-M732 PolarHBondContact O-N 3.46Å; Y730-K733 WeakPolarHBondContact O-CB 3.31Å; Y730-K733 PolarHBondContact O-N 2.9Å; Y730-I734 WeakPolarHBondContact O-CG1 3.1Å; Y730-I734 PolarHBondContact O-N 3.44Å; Y730-V770 HydrophobicContact CD1-CG1 4.03Å; Y730-Q773 HydrophobicContact CD1-CB 4.14Å; Y730-Q773 HydrophobicContact CE1-CB 3.48Å; Y730-Q773 VanDerWaalsContact CE1-CB 3.48Å; Y730-E774 HydrophobicContact CD1-CB 4.26Å; Y730-E774 HydrophobicContact CG-CB 4.07Å; Y730-E774 HydrophobicContact CG-CG 4.18Å; Y730-N777 PolarHBondContact OH-ND2 3.25Å
731	Q	88	Confident	86.9	Confident	100 Å²	100	43.2 Å²	43.2	47%	0.467	21%	0.214	S	C	.	.	H	α-helix	trans	-59.5	-44.1	177.4	-172.5	66.1	65.9	0	0	112.3	N729 I734 N735	N729-Q731 VanDerWaalsContact C-N 3.33Å; N729-Q731 PolarHBondContact O-N 3.36Å; Q731-I734 PolarHBondContact O-N 2.96Å; Q731-N735 PolarHBondContact NE2-OD1 2.9Å; Q731-N735 WeakPolarHBondContact O-CB 3.43Å; Q731-N735 PolarHBondContact O-N 3.32Å; Q731-N735 PolarHBondContact O-OD1 2.98Å; Q731-N735 VanDerWaalsContact O-OD1 3.14Å
732	M	86.3	Confident	87.2	Confident	69 Å²	69	48 Å²	48	34%	0.34	24%	0.237	S	C	.	.	H	α-helix	trans	-68.9	-33.4	177.7	-72.5	-65.5	-171.2	0	0	112.7	V682 F726 N729 Y730 Y736	V682-M732 HydrophobicContact CG1-SD 3.67Å; F726-M732 HydrophobicContact CD1-CB 3.88Å; F726-M732 HydrophobicContact CE1-CB 4.44Å; N729-M732 HydrophobicContact CB-CB 4.15Å; N729-M732 HydrophobicContact CB-CG 4.41Å; N729-M732 VanDerWaalsContact CG-CG 3.47Å; N729-M732 VanDerWaalsContact ND2-CG 3.34Å; N729-M732 WeakPolarHBondContact ND2-CG 3.44Å; N729-M732 PolarHBondContact O-N 2.88Å; N729-M732 WeakPolarHBondContact OD1-CG 3.18Å; N729-M732 PolarHBondContact OD1-N 2.84Å; Y730-M732 PolarHBondContact O-N 3.46Å; M732-Y736 VanDerWaalsContact O-CB 3.24Å; M732-Y736 WeakPolarHBondContact O-CB 3.5Å; M732-Y736 PolarHBondContact O-N 2.83Å
733	K	91.7	Very high	87.3	Confident	13 Å²	13	47.9 Å²	47.9	6%	0.057	24%	0.236	C	C	.	.	H	α-helix	trans	-63	-45.1	171.3	-69	176.4	-173.2	170.3	0	111.5	L722 F726 D727 N729 Y730 Y736 L737 V770	L722-K733 HydrophobicContact CD2-CB 4.45Å; L722-K733 HydrophobicContact CD2-CG 4.3Å; F726-K733 HydrophobicContact CB-CG 3.56Å; F726-K733 HydrophobicContact CG-CG 4.39Å; D727-K733 WeakPolarHBondContact O-CE 3.35Å; D727-K733 PolarHBondContact O-NZ 3.01Å; N729-K733 PolarHBondContact O-N 3.24Å; Y730-K733 WeakPolarHBondContact O-CB 3.31Å; Y730-K733 PolarHBondContact O-N 2.9Å; K733-Y736 PolarHBondContact O-N 3.02Å; K733-L737 WeakPolarHBondContact O-CB 3.38Å; K733-L737 WeakPolarHBondContact O-CD1 3.39Å; K733-L737 VanDerWaalsContact O-CG 3.29Å; K733-L737 WeakPolarHBondContact O-CG 3.43Å; K733-L737 PolarHBondContact O-N 3.48Å; K733-V770 HydrophobicContact CB-CG1 3.71Å; K733-V770 HydrophobicContact CB-CG2 4.35Å; K733-V770 HydrophobicContact CD-CG1 4.14Å; K733-V770 HydrophobicContact CD-CG2 4.15Å
734	I	92.3	Very high	87.7	Confident	19 Å²	19	43.7 Å²	43.7	10%	0.097	21%	0.214	C	C	.	.	H	α-helix	trans	-62.8	-49	177.7	-67.4	160.7	0	0	0	110.2	Y730 Q731 Y736 L737 N738 L767 V770 T771 E774	Y730-I734 WeakPolarHBondContact O-CG1 3.1Å; Y730-I734 PolarHBondContact O-N 3.44Å; Q731-I734 PolarHBondContact O-N 2.96Å; I734-Y736 VanDerWaalsContact C-N 3.31Å; I734-Y736 PolarHBondContact O-N 3.47Å; I734-L737 PolarHBondContact O-N 3.02Å; I734-N738 WeakPolarHBondContact O-CB 3.18Å; I734-N738 VanDerWaalsContact O-CG 3.27Å; I734-N738 PolarHBondContact O-N 3.14Å; I734-L767 HydrophobicContact CG2-CD2 4.28Å; I734-V770 HydrophobicContact CD1-CG1 4.28Å; I734-V770 HydrophobicContact CG1-CG1 3.75Å; I734-T771 HydrophobicContact CD1-CG2 3.66Å; I734-T771 HydrophobicContact CG1-CG2 3.96Å; I734-E774 WeakPolarHBondContact CD1-OE2 3.27Å
735	N	93	Very high	88.4	Confident	60 Å²	60	45.2 Å²	45.2	32%	0.321	23%	0.226	S	C	.	.	H	α-helix	trans	-58.3	-42.9	177.2	-66.6	2.4	0	0	0	111.7	Q731 I739	Q731-N735 PolarHBondContact NE2-OD1 2.9Å; Q731-N735 WeakPolarHBondContact O-CB 3.43Å; Q731-N735 PolarHBondContact O-N 3.32Å; Q731-N735 PolarHBondContact O-OD1 2.98Å; Q731-N735 VanDerWaalsContact O-OD1 3.14Å; N735-I739 WeakPolarHBondContact O-CG1 3.47Å; N735-I739 PolarHBondContact O-N 2.79Å; N735-I739 VanDerWaalsContact O-N 3.09Å
736	Y	94.6	Very high	88.8	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-45.4	176.5	177.5	-95.7	0	0	0	113.1	L675 C678 K679 V682 Y721 L722 F726 M732 K733 I734 I739 L740	L675-Y736 WeakPolarHBondContact CA-OH 3.43Å; L675-Y736 WeakPolarHBondContact CB-OH 3.36Å; L675-Y736 WeakPolarHBondContact CD2-OH 3.4Å; L675-Y736 PolarHBondContact O-OH 3.05Å; C678-Y736 HydrophobicContact CB-CD2 4.16Å; C678-Y736 HydrophobicContact CB-CE2 3.66Å; K679-Y736 HydrophobicContact CB-CE2 4.23Å; V682-Y736 VanDerWaalsContact CG2-CA 3.45Å; V682-Y736 HydrophobicContact CG2-CD2 4.04Å; V682-Y736 HydrophobicContact CG2-CG 4.45Å; Y721-Y736 HydrophobicContact CD1-CE1 4.06Å; Y721-Y736 HydrophobicContact CD1-CE2 4.2Å; Y721-Y736 AromaticContact CD1-CZ 3.62Å; Y721-Y736 VanDerWaalsContact CD1-OH 3.3Å; Y721-Y736 WeakPolarHBondContact CD1-OH 3.32Å; Y721-Y736 HydrophobicContact CE1-CE1 4.44Å; Y721-Y736 AromaticContact CE1-CE2 3.75Å; Y721-Y736 HydrophobicContact CE1-CE2 3.75Å; Y721-Y736 AromaticContact CE1-CZ 3.6Å; Y721-Y736 VanDerWaalsContact CE1-OH 3.31Å; Y721-Y736 WeakPolarHBondContact CE1-OH 3.22Å; L722-Y736 HydrophobicContact CD2-CD1 3.87Å; L722-Y736 HydrophobicContact CD2-CE1 4.28Å; F726-Y736 HydrophobicContact CD2-CG 4.41Å; F726-Y736 AromaticContact CE2-CD1 3.93Å; F726-Y736 HydrophobicContact CE2-CD1 3.93Å; F726-Y736 AromaticContact CE2-CD2 3.56Å; F726-Y736 HydrophobicContact CE2-CD2 3.56Å; F726-Y736 HydrophobicContact CE2-CE1 4.33Å; F726-Y736 AromaticContact CE2-CE2 3.97Å; F726-Y736 HydrophobicContact CE2-CE2 3.97Å; F726-Y736 AromaticContact CE2-CG 3.53Å; F726-Y736 HydrophobicContact CE2-CG 3.53Å; F726-Y736 HydrophobicContact CZ-CD1 4.49Å; F726-Y736 AromaticContact CZ-CD2 3.4Å; F726-Y736 HydrophobicContact CZ-CD2 3.4Å; F726-Y736 HydrophobicContact CZ-CE2 4.06Å; F726-Y736 AromaticContact CZ-CG 3.65Å; F726-Y736 HydrophobicContact CZ-CG 3.65Å; M732-Y736 VanDerWaalsContact O-CB 3.24Å; M732-Y736 WeakPolarHBondContact O-CB 3.5Å; M732-Y736 PolarHBondContact O-N 2.83Å; K733-Y736 PolarHBondContact O-N 3.02Å; I734-Y736 VanDerWaalsContact C-N 3.31Å; I734-Y736 PolarHBondContact O-N 3.47Å; Y736-I739 PolarHBondContact O-N 3.25Å; Y736-L740 HydrophobicContact CE1-CD2 4.19Å; Y736-L740 WeakPolarHBondContact O-CB 3.42Å; Y736-L740 PolarHBondContact O-N 2.91Å
737	L	95.4	Very high	88.8	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-68.8	-37.2	-179.7	-73.9	164.9	0	0	0	111.9	L722 K733 I734 L740 Y741 I763 F766 L767 V770	L722-L737 HydrophobicContact CD1-CD1 4.31Å; L722-L737 HydrophobicContact CD1-CD2 4.3Å; L722-L737 HydrophobicContact CD2-CD1 4.45Å; L722-L737 HydrophobicContact CD2-CD2 4.47Å; L722-L737 HydrophobicContact CD2-CG 4.28Å; K733-L737 WeakPolarHBondContact O-CB 3.38Å; K733-L737 WeakPolarHBondContact O-CD1 3.39Å; K733-L737 VanDerWaalsContact O-CG 3.29Å; K733-L737 WeakPolarHBondContact O-CG 3.43Å; K733-L737 PolarHBondContact O-N 3.48Å; I734-L737 PolarHBondContact O-N 3.02Å; L737-L740 PolarHBondContact O-N 3.46Å; L737-Y741 WeakPolarHBondContact O-CB 3.33Å; L737-Y741 PolarHBondContact O-N 2.98Å; L737-I763 HydrophobicContact CB-CG2 4.29Å; L737-I763 HydrophobicContact CD2-CG2 4.1Å; L737-I763 WeakPolarHBondContact O-CG2 3.22Å; L737-F766 HydrophobicContact CD1-CB 3.77Å; L737-F766 HydrophobicContact CD2-CB 3.88Å; L737-L767 HydrophobicContact CB-CD1 4.37Å; L737-L767 HydrophobicContact CB-CD2 3.48Å; L737-L767 VanDerWaalsContact CB-CD2 3.48Å; L737-L767 HydrophobicContact CB-CG 3.71Å; L737-L767 HydrophobicContact CD1-CD2 4.15Å; L737-L767 HydrophobicContact CD1-CG 4.25Å; L737-L767 HydrophobicContact CG-CD2 4.47Å; L737-V770 HydrophobicContact CD1-CG2 4.3Å
738	N	94.8	Very high	88.7	Confident	75 Å²	75	48.5 Å²	48.5	40%	0.401	24%	0.242	S	C	.	.	H	α-helix	trans	-62.8	-47.4	173.3	-72.4	-14.8	0	0	0	111.6	I734 L740 Y741 E742 L767	I734-N738 WeakPolarHBondContact O-CB 3.18Å; I734-N738 VanDerWaalsContact O-CG 3.27Å; I734-N738 PolarHBondContact O-N 3.14Å; N738-L740 VanDerWaalsContact C-N 3.32Å; N738-L740 PolarHBondContact O-N 2.85Å; N738-Y741 WeakPolarHBondContact O-CB 3.3Å; N738-Y741 PolarHBondContact O-N 3.46Å; N738-E742 WeakPolarHBondContact O-CB 3.41Å; N738-E742 PolarHBondContact O-N 3.22Å; N738-L767 WeakPolarHBondContact OD1-CD1 3.26Å; N738-L767 VanDerWaalsContact OD1-CD2 3.32Å; N738-L767 WeakPolarHBondContact OD1-CD2 3.49Å
739	I	94.1	Very high	88.5	Confident	37 Å²	37	46.4 Å²	46.4	19%	0.19	23%	0.23	C	C	.	.	H	α-helix	trans	-63.4	-38.1	175.9	-75.9	168.4	0	0	0	111.4	C678 L681 V682 N735 Y736 E742 V743	C678-I739 HydrophobicContact CB-CG2 4.06Å; L681-I739 HydrophobicContact CB-CD1 4.27Å; L681-I739 HydrophobicContact CB-CG2 4.01Å; L681-I739 HydrophobicContact CD1-CG2 3.68Å; L681-I739 HydrophobicContact CG-CG2 4.5Å; V682-I739 HydrophobicContact CG2-CD1 3.79Å; N735-I739 WeakPolarHBondContact O-CG1 3.47Å; N735-I739 PolarHBondContact O-N 2.79Å; N735-I739 VanDerWaalsContact O-N 3.09Å; Y736-I739 PolarHBondContact O-N 3.25Å; I739-E742 PolarHBondContact O-N 2.85Å; I739-V743 WeakPolarHBondContact O-CG2 3.1Å; I739-V743 PolarHBondContact O-N 2.89Å
740	L	95	Very high	87.2	Confident	3 Å²	3	47.7 Å²	47.7	2%	0.016	24%	0.244	C	C	.	.	H	α-helix	trans	-66.7	-39.9	175.6	-176.9	65.4	0	0	0	111.7	L674 L675 L718 Y736 L737 N738 V744 I763	L674-L740 HydrophobicContact CD2-CD1 4.12Å; L674-L740 HydrophobicContact CG-CD1 4.1Å; L675-L740 HydrophobicContact CD2-CD1 4.26Å; L675-L740 HydrophobicContact CD2-CD2 4.43Å; L718-L740 HydrophobicContact CD1-CD2 4.44Å; L718-L740 HydrophobicContact CD2-CD2 3.6Å; Y736-L740 HydrophobicContact CE1-CD2 4.19Å; Y736-L740 WeakPolarHBondContact O-CB 3.42Å; Y736-L740 PolarHBondContact O-N 2.91Å; L737-L740 PolarHBondContact O-N 3.46Å; N738-L740 VanDerWaalsContact C-N 3.32Å; N738-L740 PolarHBondContact O-N 2.85Å; L740-V744 HydrophobicContact CD1-CG2 4.15Å; L740-V744 HydrophobicContact CG-CG2 4.46Å; L740-V744 VanDerWaalsContact O-CB 3.3Å; L740-V744 WeakPolarHBondContact O-CB 3.4Å; L740-V744 WeakPolarHBondContact O-CG2 3.29Å; L740-V744 PolarHBondContact O-N 2.96Å; L740-I763 HydrophobicContact CD2-CD1 4.02Å; L740-I763 HydrophobicContact CD2-CG1 4.09Å; L740-I763 HydrophobicContact CG-CD1 3.82Å; L740-I763 HydrophobicContact CG-CG1 4.4Å
741	Y	94.9	Very high	85.9	Confident	77 Å²	77	53.4 Å²	53.4	30%	0.302	28%	0.276	S	S	.	.	H	α-helix	trans	-61.6	-47.9	173.9	-170.9	-90.7	0	0	0	111.2	L737 N738 V744 S745 L760 I763 E764	L737-Y741 WeakPolarHBondContact O-CB 3.33Å; L737-Y741 PolarHBondContact O-N 2.98Å; N738-Y741 WeakPolarHBondContact O-CB 3.3Å; N738-Y741 PolarHBondContact O-N 3.46Å; Y741-V744 PolarHBondContact O-N 2.92Å; Y741-S745 WeakPolarHBondContact O-CB 2.56Å; Y741-S745 PolarHBondContact O-N 2.68Å; Y741-L760 HydrophobicContact CD1-CD2 4.35Å; Y741-L760 HydrophobicContact CD2-CB 4.3Å; Y741-L760 HydrophobicContact CD2-CD2 3.53Å; Y741-L760 HydrophobicContact CD2-CG 4.49Å; Y741-L760 HydrophobicContact CE1-CD2 4.49Å; Y741-L760 HydrophobicContact CE2-CB 3.83Å; Y741-L760 HydrophobicContact CE2-CD2 3.69Å; Y741-L760 HydrophobicContact CE2-CG 4.26Å; Y741-L760 HydrophobicContact CG-CD2 3.9Å; Y741-I763 HydrophobicContact CD2-CB 4.28Å; Y741-I763 HydrophobicContact CD2-CG2 4.03Å; Y741-I763 HydrophobicContact CG-CG2 4.48Å; Y741-E764 HydrophobicContact CD2-CG 4.21Å; Y741-E764 HydrophobicContact CE2-CG 3.59Å; Y741-E764 VanDerWaalsContact CE2-OE1 3.24Å; Y741-E764 WeakPolarHBondContact CE2-OE1 3.46Å; Y741-E764 PolarHBondContact OH-OE1 3.09Å
742	E	93.2	Very high	85.3	Confident	111 Å²	111	51.7 Å²	51.7	52%	0.519	27%	0.269	S	S	.	.	H	α-helix	trans	-58.2	-50.8	178.8	-171.8	-178	174.9	0	0	111.8	N738 I739 S745 H746	N738-E742 WeakPolarHBondContact O-CB 3.41Å; N738-E742 PolarHBondContact O-N 3.22Å; I739-E742 PolarHBondContact O-N 2.85Å; E742-S745 PolarHBondContact O-N 3.08Å; E742-H746 PolarHBondContact O-N 3.03Å; E742-H746 PolarHBondContact O-ND1 3.47Å
743	V	92.2	Very high	85	Confident	6 Å²	6	50.4 Å²	50.4	4%	0.036	27%	0.265	C	S	.	.	H	α-helix	trans	-65.5	-43.3	178.9	172.9	0	0	0	0	111.5	L674 Y677 L681 E697 I739 S745 S747	L674-V743 HydrophobicContact CD1-CG1 3.68Å; Y677-V743 HydrophobicContact CE1-CG2 4.23Å; L681-V743 HydrophobicContact CD1-CG2 4.4Å; E697-V743 HydrophobicContact CB-CG1 4.13Å; E697-V743 HydrophobicContact CG-CG1 3.96Å; I739-V743 WeakPolarHBondContact O-CG2 3.1Å; I739-V743 PolarHBondContact O-N 2.89Å; V743-S745 VanDerWaalsContact C-N 3.33Å; V743-S745 PolarHBondContact O-N 3.28Å; V743-S747 VanDerWaalsContact O-CB 3.26Å; V743-S747 WeakPolarHBondContact O-CB 2.48Å; V743-S747 PolarHBondContact O-N 3.45Å
744	V	92.4	Very high	84.8	Confident	1 Å²	1	55.2 Å²	55.2	1%	0.006	29%	0.287	C	S	.	.	H	α-helix	trans	-67.1	-33.9	178	171.7	0	0	0	0	111.7	L674 F705 L740 Y741 T748 T759 L760 I763	L674-V744 HydrophobicContact CD2-CG2 4.19Å; F705-V744 HydrophobicContact CZ-CG1 4.41Å; L740-V744 HydrophobicContact CD1-CG2 4.15Å; L740-V744 HydrophobicContact CG-CG2 4.46Å; L740-V744 VanDerWaalsContact O-CB 3.3Å; L740-V744 WeakPolarHBondContact O-CB 3.4Å; L740-V744 WeakPolarHBondContact O-CG2 3.29Å; L740-V744 PolarHBondContact O-N 2.96Å; Y741-V744 PolarHBondContact O-N 2.92Å; V744-T748 HydrophobicContact CG1-CG2 4.48Å; V744-T748 WeakPolarHBondContact O-CB 3.27Å; V744-T748 WeakPolarHBondContact O-CG2 3.31Å; V744-T748 PolarHBondContact O-OG1 3.48Å; V744-T759 HydrophobicContact CG1-CG2 4.06Å; V744-L760 HydrophobicContact CB-CD2 4.07Å; V744-L760 HydrophobicContact CG1-CD2 3.82Å; V744-L760 HydrophobicContact CG1-CG 4.13Å; V744-I763 HydrophobicContact CB-CD1 4.43Å; V744-I763 HydrophobicContact CG2-CD1 4.29Å
745	S	90.7	Very high	84.5	Confident	44 Å²	44	57.2 Å²	57.2	31%	0.308	30%	0.297	S	S	.	.	H	α-helix	trans	-69.2	-52.4	178.8	-172.3	0	0	0	0	112.1	Y741 E742 V743	Y741-S745 WeakPolarHBondContact O-CB 2.56Å; Y741-S745 PolarHBondContact O-N 2.68Å; E742-S745 PolarHBondContact O-N 3.08Å; V743-S745 VanDerWaalsContact C-N 3.33Å; V743-S745 PolarHBondContact O-N 3.28Å
746	H	85.8	Confident	84.3	Confident	134 Å²	134	57.5 Å²	57.5	62%	0.62	29%	0.293	S	S	*	.	H	α-helix	trans	-76.2	-36.5	-175.7	-64.9	106.5	0	0	0	113.9	E742 T748	E742-H746 PolarHBondContact O-N 3.03Å; E742-H746 PolarHBondContact O-ND1 3.47Å; H746-T748 PolarHBondContact O-N 3.44Å
747	S	78.8	Confident	84.1	Confident	3 Å²	3	62.2 Å²	62.2	2%	0.021	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	34.6	-166.2	-66.2	0	0	0	0	113.5	E697 K698 V743	E697-S747 VanDerWaalsContact CB-CB 3.43Å; E697-S747 VanDerWaalsContact CB-OG 3.26Å; E697-S747 WeakPolarHBondContact CB-OG 3.38Å; E697-S747 PolarHBondContact OE2-OG 3.31Å; K698-S747 WeakPolarHBondContact CA-O 3.1Å; K698-S747 WeakPolarHBondContact CG-O 3.47Å; V743-S747 VanDerWaalsContact O-CB 3.26Å; V743-S747 WeakPolarHBondContact O-CB 2.48Å; V743-S747 PolarHBondContact O-N 3.45Å
748	T	68.5	Low	83.9	Confident	13 Å²	13	65.9 Å²	65.9	8%	0.08	33%	0.332	C	S	.	.			trans	-128.2	123.1	178.6	46.3	0	0	0	0	112.5	C701 F705 V744 H746 R756	C701-T748 HydrophobicContact CB-CG2 3.72Å; F705-T748 HydrophobicContact CE2-CG2 3.63Å; F705-T748 HydrophobicContact CZ-CG2 3.94Å; V744-T748 HydrophobicContact CG1-CG2 4.48Å; V744-T748 WeakPolarHBondContact O-CB 3.27Å; V744-T748 WeakPolarHBondContact O-CG2 3.31Å; V744-T748 PolarHBondContact O-OG1 3.48Å; H746-T748 PolarHBondContact O-N 3.44Å; T748-R756 WeakPolarHBondContact OG1-CD 3.22Å; T748-R756 WeakPolarHBondContact OG1-CG 3.44Å
749	I	65.8	Low	83.8	Confident	89 Å²	89	62.4 Å²	62.4	46%	0.456	31%	0.314	S	S	.	.			trans	-74.7	145.9	-173.7	-59.9	169.1	0	0	0	110.2	L751 M752	I749-L751 HydrophobicContact CG2-CG 4.49Å; I749-L751 PolarHBondContact O-N 2.85Å; I749-M752 PolarHBondContact O-N 3.18Å
750	C	57.7	Low	83.7	Confident	107 Å²	107	61.5 Å²	61.5	72%	0.723	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-50.7	-24.3	-174.4	-45.9	0	0	0	0	115.4	M752 T753	C750-M752 PolarHBondContact O-N 2.74Å; C750-T753 WeakPolarHBondContact CA-OG1 2.97Å; C750-T753 PolarHBondContact O-N 3.35Å; C750-T753 PolarHBondContact O-OG1 3.07Å
751	L	58	Low	83.7	Confident	160 Å²	160	64.8 Å²	64.8	84%	0.838	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-65.9	-18.9	176.3	-64.5	173.1	0	0	0	114.1	I749	I749-L751 HydrophobicContact CG2-CG 4.49Å; I749-L751 PolarHBondContact O-N 2.85Å
752	M	75.3	Confident	83.7	Confident	64 Å²	64	61.9 Å²	61.9	32%	0.315	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-115.4	29.8	-179.7	-55.4	-59.2	-59.7	0	0	111.8	F705 I749 C750 H754 E755 R756	F705-M752 HydrophobicContact CB-CE 4.25Å; F705-M752 HydrophobicContact CD2-CB 4.28Å; F705-M752 HydrophobicContact CD2-CE 4.3Å; F705-M752 HydrophobicContact CD2-CG 4.49Å; F705-M752 HydrophobicContact CE2-CB 4.35Å; I749-M752 PolarHBondContact O-N 3.18Å; C750-M752 PolarHBondContact O-N 2.74Å; M752-H754 VanDerWaalsContact C-N 3.33Å; M752-H754 PolarHBondContact O-N 3.16Å; M752-E755 WeakPolarHBondContact CA-OE2 3.43Å; M752-E755 HydrophobicContact CE-CB 4.19Å; M752-E755 VanDerWaalsContact CE-CD 3.43Å; M752-E755 HydrophobicContact CE-CG 3.73Å; M752-E755 PolarHBondContact O-N 3.21Å; M752-R756 VanDerWaalsContact O-CB 3.3Å; M752-R756 WeakPolarHBondContact O-CB 2.52Å; M752-R756 PolarHBondContact O-N 3.14Å
753	T	81.6	Confident	83.7	Confident	43 Å²	43	56.6 Å²	56.6	26%	0.264	30%	0.297	S	S	.	.	H	α-helix	trans	-63.9	-35.9	-171.6	-64.4	0	0	0	0	112.8	C750 R756 Q757	C750-T753 WeakPolarHBondContact CA-OG1 2.97Å; C750-T753 PolarHBondContact O-N 3.35Å; C750-T753 PolarHBondContact O-OG1 3.07Å; T753-R756 WeakPolarHBondContact O-CB 3.04Å; T753-Q757 WeakPolarHBondContact O-CB 3.38Å; T753-Q757 WeakPolarHBondContact O-CG 3.21Å; T753-Q757 PolarHBondContact O-N 2.95Å; T753-Q757 PolarHBondContact O-OE1 3.29Å
754	H	85.8	Confident	83.9	Confident	113 Å²	113	58.8 Å²	58.8	52%	0.523	31%	0.306	S	S	.	.	H	α-helix	trans	-70.2	-46.6	179.3	170.8	-105.7	0	0	0	111.4	M752 R756 Q757 Q758	M752-H754 VanDerWaalsContact C-N 3.33Å; M752-H754 PolarHBondContact O-N 3.16Å; H754-R756 VanDerWaalsContact C-N 3.34Å; H754-R756 PolarHBondContact O-N 2.99Å; H754-Q757 PolarHBondContact O-N 3.3Å; H754-Q758 PolarHBondContact CE1-NE2 3.37Å; H754-Q758 PolarHBondContact NE2-NE2 3.47Å; H754-Q758 WeakPolarHBondContact O-CG 3.49Å; H754-Q758 PolarHBondContact O-N 2.94Å
755	E	86.2	Confident	84	Confident	62 Å²	62	62.6 Å²	62.6	29%	0.29	33%	0.325	S	S	.	.	H	α-helix	trans	-61.5	-43	174.9	-62.7	84.3	168.2	0	0	110.9	M752 Q758 T759	M752-E755 WeakPolarHBondContact CA-OE2 3.43Å; M752-E755 HydrophobicContact CE-CB 4.19Å; M752-E755 VanDerWaalsContact CE-CD 3.43Å; M752-E755 HydrophobicContact CE-CG 3.73Å; M752-E755 PolarHBondContact O-N 3.21Å; E755-Q758 PolarHBondContact O-N 3.29Å; E755-T759 WeakPolarHBondContact O-CB 3.44Å; E755-T759 PolarHBondContact O-N 3.39Å; E755-T759 PolarHBondContact O-OG1 2.88Å
756	R	89.5	Confident	84.1	Confident	65 Å²	65	60.9 Å²	60.9	25%	0.245	31%	0.312	C	S	.	.	H	α-helix	trans	-54.3	-53.3	171.3	175.5	-177	83.8	-175.2	3	111.4	T748 M752 T753 H754 Q758 T759 L760	T748-R756 WeakPolarHBondContact OG1-CD 3.22Å; T748-R756 WeakPolarHBondContact OG1-CG 3.44Å; M752-R756 VanDerWaalsContact O-CB 3.3Å; M752-R756 WeakPolarHBondContact O-CB 2.52Å; M752-R756 PolarHBondContact O-N 3.14Å; T753-R756 WeakPolarHBondContact O-CB 3.04Å; H754-R756 VanDerWaalsContact C-N 3.34Å; H754-R756 PolarHBondContact O-N 2.99Å; R756-Q758 PolarHBondContact O-N 3.19Å; R756-T759 PolarHBondContact O-N 2.97Å; R756-L760 HydrophobicContact CG-CD1 3.74Å; R756-L760 HydrophobicContact CG-CG 4.24Å; R756-L760 WeakPolarHBondContact O-CB 3.35Å; R756-L760 VanDerWaalsContact O-CG 3.3Å; R756-L760 WeakPolarHBondContact O-CG 3.48Å; R756-L760 PolarHBondContact O-N 3.1Å
757	Q	90.1	Very high	84.5	Confident	99 Å²	99	55.7 Å²	55.7	46%	0.463	29%	0.289	S	S	.	.	H	α-helix	trans	-59.7	-45.5	-179.5	-77.6	170.1	-38.5	0	0	111.6	T753 H754 T759 L760 C761	T753-Q757 WeakPolarHBondContact O-CB 3.38Å; T753-Q757 WeakPolarHBondContact O-CG 3.21Å; T753-Q757 PolarHBondContact O-N 2.95Å; T753-Q757 PolarHBondContact O-OE1 3.29Å; H754-Q757 PolarHBondContact O-N 3.3Å; Q757-T759 PolarHBondContact O-N 3.47Å; Q757-L760 PolarHBondContact O-N 2.96Å; Q757-C761 WeakPolarHBondContact O-CB 3.47Å; Q757-C761 PolarHBondContact O-N 2.96Å; Q757-C761 PolarHBondContact O-SG 3.46Å
758	Q	91.2	Very high	85.1	Confident	78 Å²	78	62.4 Å²	62.4	36%	0.364	31%	0.314	S	S	.	.	H	α-helix	trans	-59.7	-45	175.2	-68.9	-168.2	-9	0	0	112.2	I711 H754 E755 R756 L762	I711-Q758 HydrophobicContact CD1-CB 3.91Å; I711-Q758 HydrophobicContact CG1-CB 4.39Å; H754-Q758 PolarHBondContact CE1-NE2 3.37Å; H754-Q758 PolarHBondContact NE2-NE2 3.47Å; H754-Q758 WeakPolarHBondContact O-CG 3.49Å; H754-Q758 PolarHBondContact O-N 2.94Å; E755-Q758 PolarHBondContact O-N 3.29Å; R756-Q758 PolarHBondContact O-N 3.19Å; Q758-L762 WeakPolarHBondContact O-CB 3.19Å; Q758-L762 PolarHBondContact O-N 3.41Å
759	T	92.6	Very high	86.2	Confident	2 Å²	2	64.6 Å²	64.6	1%	0.012	33%	0.325	C	S	.	.	H	α-helix	trans	-66.4	-39.4	178.5	-56.8	0	0	0	0	112.4	F704 F705 Q714 V744 E755 R756 Q757 L762 I763	F704-T759 HydrophobicContact CE1-CG2 4.21Å; F705-T759 HydrophobicContact CE1-CG2 4.23Å; F705-T759 WeakPolarHBondContact CE1-OG1 3.26Å; Q714-T759 PolarHBondContact OE1-OG1 3.43Å; V744-T759 HydrophobicContact CG1-CG2 4.06Å; E755-T759 WeakPolarHBondContact O-CB 3.44Å; E755-T759 PolarHBondContact O-N 3.39Å; E755-T759 PolarHBondContact O-OG1 2.88Å; R756-T759 PolarHBondContact O-N 2.97Å; Q757-T759 PolarHBondContact O-N 3.47Å; T759-L762 WeakPolarHBondContact O-CB 3.16Å; T759-L762 PolarHBondContact O-N 3.46Å; T759-I763 HydrophobicContact CG2-CD1 3.96Å; T759-I763 WeakPolarHBondContact O-CD1 3.43Å; T759-I763 VanDerWaalsContact O-CG1 3.26Å; T759-I763 WeakPolarHBondContact O-CG1 3.26Å; T759-I763 PolarHBondContact O-N 2.84Å
760	L	93.6	Very high	87.3	Confident	18 Å²	18	60.7 Å²	60.7	9%	0.094	31%	0.305	C	S	.	.	H	α-helix	trans	-66	-46.3	176.5	-69.9	174.4	0	0	0	111.3	Y741 V744 R756 Q757 L762 I763 E764	Y741-L760 HydrophobicContact CD1-CD2 4.35Å; Y741-L760 HydrophobicContact CD2-CB 4.3Å; Y741-L760 HydrophobicContact CD2-CD2 3.53Å; Y741-L760 HydrophobicContact CD2-CG 4.49Å; Y741-L760 HydrophobicContact CE1-CD2 4.49Å; Y741-L760 HydrophobicContact CE2-CB 3.83Å; Y741-L760 HydrophobicContact CE2-CD2 3.69Å; Y741-L760 HydrophobicContact CE2-CG 4.26Å; Y741-L760 HydrophobicContact CG-CD2 3.9Å; V744-L760 HydrophobicContact CB-CD2 4.07Å; V744-L760 HydrophobicContact CG1-CD2 3.82Å; V744-L760 HydrophobicContact CG1-CG 4.13Å; R756-L760 HydrophobicContact CG-CD1 3.74Å; R756-L760 HydrophobicContact CG-CG 4.24Å; R756-L760 WeakPolarHBondContact O-CB 3.35Å; R756-L760 VanDerWaalsContact O-CG 3.3Å; R756-L760 WeakPolarHBondContact O-CG 3.48Å; R756-L760 PolarHBondContact O-N 3.1Å; Q757-L760 PolarHBondContact O-N 2.96Å; L760-L762 VanDerWaalsContact C-N 3.27Å; L760-L762 PolarHBondContact O-N 3.47Å; L760-I763 PolarHBondContact O-N 3.39Å; L760-I763 VanDerWaalsContact O-N 3.1Å; L760-E764 PolarHBondContact O-N 3.23Å
761	C	94	Very high	88.8	Confident	72 Å²	72	57.6 Å²	57.6	49%	0.486	28%	0.283	S	S	.	.	H	α-helix	trans	-58.7	-37.8	173.6	-68.9	0	0	0	0	112.4	Q757 E764 M765	Q757-C761 WeakPolarHBondContact O-CB 3.47Å; Q757-C761 PolarHBondContact O-N 2.96Å; Q757-C761 PolarHBondContact O-SG 3.46Å; C761-E764 PolarHBondContact O-N 2.94Å; C761-M765 PolarHBondContact O-N 2.84Å
762	L	94.2	Very high	90.2	Very high	15 Å²	15	55.1 Å²	55.1	8%	0.079	27%	0.267	C	S	.	.	H	α-helix	trans	-65.7	-40.7	174.2	172.1	64.4	0	0	0	112.4	I711 Q714 Y715 L718 Q758 T759 L760 M765 F766	I711-L762 HydrophobicContact CD1-CB 3.93Å; I711-L762 HydrophobicContact CD1-CD2 3.56Å; I711-L762 HydrophobicContact CD1-CG 4.34Å; I711-L762 HydrophobicContact CG1-CD2 4.2Å; Q714-L762 HydrophobicContact CB-CD2 3.73Å; Y715-L762 HydrophobicContact CD2-CD1 3.91Å; Y715-L762 HydrophobicContact CG-CD1 4.37Å; L718-L762 HydrophobicContact CD1-CD2 4.04Å; L718-L762 HydrophobicContact CD1-CG 4.35Å; Q758-L762 WeakPolarHBondContact O-CB 3.19Å; Q758-L762 PolarHBondContact O-N 3.41Å; T759-L762 WeakPolarHBondContact O-CB 3.16Å; T759-L762 PolarHBondContact O-N 3.46Å; L760-L762 VanDerWaalsContact C-N 3.27Å; L760-L762 PolarHBondContact O-N 3.47Å; L762-M765 HydrophobicContact CD1-CE 4.07Å; L762-M765 WeakPolarHBondContact O-CB 3.46Å; L762-M765 PolarHBondContact O-N 3.37Å; L762-F766 HydrophobicContact CD1-CD2 4.14Å; L762-F766 HydrophobicContact CD1-CE2 3.66Å; L762-F766 HydrophobicContact CD1-CZ 4.43Å; L762-F766 HydrophobicContact CG-CD2 4.27Å; L762-F766 HydrophobicContact CG-CE2 3.97Å; L762-F766 WeakPolarHBondContact O-CD2 3.48Å; L762-F766 PolarHBondContact O-N 3.46Å
763	I	94.9	Very high	90.6	Very high	1 Å²	1	55 Å²	55	1%	0.005	27%	0.266	C	S	.	.	H	α-helix	trans	-67.1	-40.4	175.9	-67.2	159.7	0	0	0	110.6	L718 L737 L740 Y741 V744 T759 L760 M765 F766 L767	L718-I763 HydrophobicContact CD1-CG1 4.39Å; L737-I763 HydrophobicContact CB-CG2 4.29Å; L737-I763 HydrophobicContact CD2-CG2 4.1Å; L737-I763 WeakPolarHBondContact O-CG2 3.22Å; L740-I763 HydrophobicContact CD2-CD1 4.02Å; L740-I763 HydrophobicContact CD2-CG1 4.09Å; L740-I763 HydrophobicContact CG-CD1 3.82Å; L740-I763 HydrophobicContact CG-CG1 4.4Å; Y741-I763 HydrophobicContact CD2-CB 4.28Å; Y741-I763 HydrophobicContact CD2-CG2 4.03Å; Y741-I763 HydrophobicContact CG-CG2 4.48Å; V744-I763 HydrophobicContact CB-CD1 4.43Å; V744-I763 HydrophobicContact CG2-CD1 4.29Å; T759-I763 HydrophobicContact CG2-CD1 3.96Å; T759-I763 WeakPolarHBondContact O-CD1 3.43Å; T759-I763 VanDerWaalsContact O-CG1 3.26Å; T759-I763 WeakPolarHBondContact O-CG1 3.26Å; T759-I763 PolarHBondContact O-N 2.84Å; L760-I763 PolarHBondContact O-N 3.39Å; L760-I763 VanDerWaalsContact O-N 3.1Å; I763-M765 VanDerWaalsContact C-N 3.33Å; I763-M765 PolarHBondContact O-N 2.83Å; I763-F766 PolarHBondContact O-N 3.07Å; I763-L767 HydrophobicContact CG2-CD1 4.26Å; I763-L767 PolarHBondContact O-N 3.4Å
764	E	94.7	Very high	90.7	Very high	52 Å²	52	54.7 Å²	54.7	24%	0.243	26%	0.261	C	S	.	.	H	α-helix	trans	-63.2	-36.3	173.6	-77.3	-179.8	-146.2	0	0	113.2	Y741 L760 C761 L767 R768	Y741-E764 HydrophobicContact CD2-CG 4.21Å; Y741-E764 HydrophobicContact CE2-CG 3.59Å; Y741-E764 VanDerWaalsContact CE2-OE1 3.24Å; Y741-E764 WeakPolarHBondContact CE2-OE1 3.46Å; Y741-E764 PolarHBondContact OH-OE1 3.09Å; L760-E764 PolarHBondContact O-N 3.23Å; C761-E764 PolarHBondContact O-N 2.94Å; E764-L767 PolarHBondContact O-N 2.65Å; E764-R768 WeakPolarHBondContact O-CD 3.34Å; E764-R768 WeakPolarHBondContact O-CG 3.47Å; E764-R768 PolarHBondContact O-N 3.48Å; E764-R768 PolarHBondContact O-NE 3.27Å; E764-R768 IonicContact OE2-CZ 3.95Å; E764-R768 IonicContact OE2-NH2 3.85Å; E764-R768 PolarHBondContact OE2-NH2 3.3Å
765	M	94.4	Very high	90.5	Very high	80 Å²	80	54.6 Å²	54.6	39%	0.394	26%	0.259	S	S	.	.	H	α-helix	trans	-60.2	-50.6	173.2	-168.7	-171.7	80.6	0	0	110.2	Y715 C761 L762 I763 L767 R768 D769	Y715-M765 HydrophobicContact CD2-CE 3.95Å; Y715-M765 HydrophobicContact CE2-CE 3.87Å; C761-M765 PolarHBondContact O-N 2.84Å; L762-M765 HydrophobicContact CD1-CE 4.07Å; L762-M765 WeakPolarHBondContact O-CB 3.46Å; L762-M765 PolarHBondContact O-N 3.37Å; I763-M765 VanDerWaalsContact C-N 3.33Å; I763-M765 PolarHBondContact O-N 2.83Å; M765-L767 VanDerWaalsContact C-N 3.29Å; M765-L767 PolarHBondContact O-N 2.83Å; M765-R768 PolarHBondContact O-N 3.34Å; M765-R768 VanDerWaalsContact O-N 3.14Å; M765-D769 PolarHBondContact O-N 3.04Å
766	F	93.9	Very high	90	Very high	9 Å²	9	56.9 Å²	56.9	4%	0.039	27%	0.27	C	S	.	.	H	α-helix	trans	-60.4	-34.6	174.9	-75.4	-64.2	0	0	0	113.4	Y715 L718 N719 L722 L737 L762 I763 V770	Y715-F766 AromaticContact CD2-CE1 3.98Å; Y715-F766 HydrophobicContact CD2-CE1 3.98Å; Y715-F766 AromaticContact CD2-CE2 3.94Å; Y715-F766 HydrophobicContact CD2-CE2 3.94Å; Y715-F766 AromaticContact CD2-CZ 3.3Å; Y715-F766 HydrophobicContact CD2-CZ 3.3Å; Y715-F766 AromaticContact CE2-CE1 3.77Å; Y715-F766 HydrophobicContact CE2-CE1 3.77Å; Y715-F766 AromaticContact CE2-CZ 3.59Å; Y715-F766 HydrophobicContact CE2-CZ 3.59Å; Y715-F766 HydrophobicContact CG-CZ 4.3Å; L718-F766 HydrophobicContact CB-CD2 4.38Å; L718-F766 HydrophobicContact CB-CE2 3.64Å; L718-F766 HydrophobicContact CB-CZ 4.02Å; L718-F766 HydrophobicContact CD1-CD2 4.36Å; L718-F766 HydrophobicContact CD1-CE2 4Å; L718-F766 HydrophobicContact CG-CE2 4.48Å; N719-F766 HydrophobicContact CB-CE1 3.92Å; N719-F766 HydrophobicContact CB-CZ 3.86Å; L722-F766 HydrophobicContact CD1-CB 4.44Å; L722-F766 HydrophobicContact CD1-CD1 3.89Å; L722-F766 HydrophobicContact CD1-CE1 4.27Å; L722-F766 HydrophobicContact CD1-CG 4.15Å; L737-F766 HydrophobicContact CD1-CB 3.77Å; L737-F766 HydrophobicContact CD2-CB 3.88Å; L762-F766 HydrophobicContact CD1-CD2 4.14Å; L762-F766 HydrophobicContact CD1-CE2 3.66Å; L762-F766 HydrophobicContact CD1-CZ 4.43Å; L762-F766 HydrophobicContact CG-CD2 4.27Å; L762-F766 HydrophobicContact CG-CE2 3.97Å; L762-F766 WeakPolarHBondContact O-CD2 3.48Å; L762-F766 PolarHBondContact O-N 3.46Å; I763-F766 PolarHBondContact O-N 3.07Å; F766-V770 VanDerWaalsContact O-CB 3.31Å; F766-V770 WeakPolarHBondContact O-CB 3.46Å; F766-V770 WeakPolarHBondContact O-CG2 3.37Å; F766-V770 PolarHBondContact O-N 3.45Å
767	L	93.2	Very high	89	Confident	25 Å²	25	57.4 Å²	57.4	13%	0.131	28%	0.278	C	S	.	.	H	α-helix	trans	-65.2	-42	174.9	-79.4	166.1	0	0	0	111.9	I734 L737 N738 I763 E764 M765 T771	I734-L767 HydrophobicContact CG2-CD2 4.28Å; L737-L767 HydrophobicContact CB-CD1 4.37Å; L737-L767 HydrophobicContact CB-CD2 3.48Å; L737-L767 VanDerWaalsContact CB-CD2 3.48Å; L737-L767 HydrophobicContact CB-CG 3.71Å; L737-L767 HydrophobicContact CD1-CD2 4.15Å; L737-L767 HydrophobicContact CD1-CG 4.25Å; L737-L767 HydrophobicContact CG-CD2 4.47Å; N738-L767 WeakPolarHBondContact OD1-CD1 3.26Å; N738-L767 VanDerWaalsContact OD1-CD2 3.32Å; N738-L767 WeakPolarHBondContact OD1-CD2 3.49Å; I763-L767 HydrophobicContact CG2-CD1 4.26Å; I763-L767 PolarHBondContact O-N 3.4Å; E764-L767 PolarHBondContact O-N 2.65Å; M765-L767 VanDerWaalsContact C-N 3.29Å; M765-L767 PolarHBondContact O-N 2.83Å; L767-T771 WeakPolarHBondContact O-CB 3.2Å; L767-T771 VanDerWaalsContact O-CG2 3.26Å; L767-T771 WeakPolarHBondContact O-CG2 3.33Å; L767-T771 PolarHBondContact O-N 3.27Å; L767-T771 PolarHBondContact O-OG1 2.9Å
768	R	92.3	Very high	87.9	Confident	143 Å²	143	59.9 Å²	59.9	54%	0.54	29%	0.287	S	S	.	.	H	α-helix	trans	-62.1	-55.6	174.9	-64.5	159.1	-155.4	-128.7	7.4	109.7	E764 M765 V770 T771 E772	E764-R768 WeakPolarHBondContact O-CD 3.34Å; E764-R768 WeakPolarHBondContact O-CG 3.47Å; E764-R768 PolarHBondContact O-N 3.48Å; E764-R768 PolarHBondContact O-NE 3.27Å; E764-R768 IonicContact OE2-CZ 3.95Å; E764-R768 IonicContact OE2-NH2 3.85Å; E764-R768 PolarHBondContact OE2-NH2 3.3Å; M765-R768 PolarHBondContact O-N 3.34Å; M765-R768 VanDerWaalsContact O-N 3.14Å; R768-V770 VanDerWaalsContact C-N 3.3Å; R768-V770 PolarHBondContact O-N 3.02Å; R768-T771 PolarHBondContact O-N 3.46Å; R768-T771 VanDerWaalsContact O-N 3.16Å; R768-T771 PolarHBondContact O-OG1 3.48Å; R768-T771 VanDerWaalsContact O-OG1 3.07Å; R768-E772 WeakPolarHBondContact O-CB 3.16Å; R768-E772 WeakPolarHBondContact O-CG 3.33Å; R768-E772 PolarHBondContact O-N 3.36Å
769	D	90.8	Very high	86.3	Confident	60 Å²	60	63.1 Å²	63.1	32%	0.321	30%	0.302	S	S	.	.	H	α-helix	trans	-50.3	-47.1	178.2	-62.5	-10.5	0	0	0	112.6	M765 Q773	M765-D769 PolarHBondContact O-N 3.04Å; D769-Q773 VanDerWaalsContact O-CG 3.22Å; D769-Q773 WeakPolarHBondContact O-CG 3.27Å; D769-Q773 PolarHBondContact O-N 3.05Å; D769-Q773 PolarHBondContact O-NE2 2.82Å
770	V	89.2	Confident	84.3	Confident	7 Å²	7	66.1 Å²	66.1	4%	0.042	32%	0.323	C	S	.	.	H	α-helix	trans	-73.4	-39.3	-176.6	171.3	0	0	0	0	111.9	Y730 K733 I734 L737 F766 R768 E772 E774	Y730-V770 HydrophobicContact CD1-CG1 4.03Å; K733-V770 HydrophobicContact CB-CG1 3.71Å; K733-V770 HydrophobicContact CB-CG2 4.35Å; K733-V770 HydrophobicContact CD-CG1 4.14Å; K733-V770 HydrophobicContact CD-CG2 4.15Å; I734-V770 HydrophobicContact CD1-CG1 4.28Å; I734-V770 HydrophobicContact CG1-CG1 3.75Å; L737-V770 HydrophobicContact CD1-CG2 4.3Å; F766-V770 VanDerWaalsContact O-CB 3.31Å; F766-V770 WeakPolarHBondContact O-CB 3.46Å; F766-V770 WeakPolarHBondContact O-CG2 3.37Å; F766-V770 PolarHBondContact O-N 3.45Å; R768-V770 VanDerWaalsContact C-N 3.3Å; R768-V770 PolarHBondContact O-N 3.02Å; V770-E772 VanDerWaalsContact C-N 3.33Å; V770-E774 PolarHBondContact O-N 3.21Å
771	T	89.2	Confident	81.8	Confident	41 Å²	41	70.4 Å²	70.4	25%	0.252	35%	0.35	S	S	.	.	H	α-helix	trans	-73.1	-25.4	176.9	59.6	0	0	0	0	112.8	I734 L767 R768 K775	I734-T771 HydrophobicContact CD1-CG2 3.66Å; I734-T771 HydrophobicContact CG1-CG2 3.96Å; L767-T771 WeakPolarHBondContact O-CB 3.2Å; L767-T771 VanDerWaalsContact O-CG2 3.26Å; L767-T771 WeakPolarHBondContact O-CG2 3.33Å; L767-T771 PolarHBondContact O-N 3.27Å; L767-T771 PolarHBondContact O-OG1 2.9Å; R768-T771 PolarHBondContact O-N 3.46Å; R768-T771 VanDerWaalsContact O-N 3.16Å; R768-T771 PolarHBondContact O-OG1 3.48Å; R768-T771 VanDerWaalsContact O-OG1 3.07Å; T771-K775 WeakPolarHBondContact O-CD 3.04Å; T771-K775 WeakPolarHBondContact O-CE 2.53Å; T771-K775 VanDerWaalsContact O-CG 3.24Å; T771-K775 WeakPolarHBondContact O-CG 3.33Å; T771-K775 PolarHBondContact O-N 2.85Å
772	E	87	Confident	79.3	Confident	109 Å²	109	72.6 Å²	72.6	51%	0.509	36%	0.361	S	S	.	.	H	α-helix	trans	-73.1	-47.8	171.8	-73.5	175.4	-172.8	0	0	111.1	R768 V770 E774 K775 E776	R768-E772 WeakPolarHBondContact O-CB 3.16Å; R768-E772 WeakPolarHBondContact O-CG 3.33Å; R768-E772 PolarHBondContact O-N 3.36Å; V770-E772 VanDerWaalsContact C-N 3.33Å; E772-E774 PolarHBondContact O-N 3.12Å; E772-K775 WeakPolarHBondContact O-CB 3.49Å; E772-K775 PolarHBondContact O-N 3.05Å; E772-E776 PolarHBondContact O-N 3.49Å
773	Q	83.9	Confident	76.8	Confident	61 Å²	61	78 Å²	78	29%	0.285	39%	0.385	S	S	.	.	H	α-helix	trans	-57.1	-34.6	171.8	-69.8	164.7	33	0	0	112.6	Y730 D769 N777	Y730-Q773 HydrophobicContact CD1-CB 4.14Å; Y730-Q773 HydrophobicContact CE1-CB 3.48Å; Y730-Q773 VanDerWaalsContact CE1-CB 3.48Å; D769-Q773 VanDerWaalsContact O-CG 3.22Å; D769-Q773 WeakPolarHBondContact O-CG 3.27Å; D769-Q773 PolarHBondContact O-N 3.05Å; D769-Q773 PolarHBondContact O-NE2 2.82Å; Q773-N777 WeakPolarHBondContact O-CB 3.33Å; Q773-N777 PolarHBondContact O-N 2.83Å; Q773-N777 VanDerWaalsContact O-N 3.11Å; Q773-N777 PolarHBondContact O-ND2 3.1Å
774	E	84	Confident	74.5	Confident	36 Å²	36	83.6 Å²	83.6	17%	0.168	42%	0.415	C	S	.	.	H	α-helix	trans	-67.9	-38	174.8	-162.8	-169.6	163.3	0	0	112.4	Y730 I734 V770 E772 K778	Y730-E774 HydrophobicContact CD1-CB 4.26Å; Y730-E774 HydrophobicContact CG-CB 4.07Å; Y730-E774 HydrophobicContact CG-CG 4.18Å; I734-E774 WeakPolarHBondContact CD1-OE2 3.27Å; V770-E774 PolarHBondContact O-N 3.21Å; E772-E774 PolarHBondContact O-N 3.12Å; E774-K778 WeakPolarHBondContact O-CG 3.48Å; E774-K778 PolarHBondContact O-N 2.67Å; E774-K778 WeakPolarHBondContact OE1-CE 3.24Å; E774-K778 IonicContact OE1-NZ 2.62Å; E774-K778 PolarHBondContact OE1-NZ 2.71Å
775	K	80.8	Confident	72.2	Confident	111 Å²	111	87 Å²	87	48%	0.483	43%	0.431	S	S	.	.	H	α-helix	trans	-68	-44.9	175.5	-67.9	158.6	-164.5	158.4	0	111.2	T771 E772 N777 K778 Q779	T771-K775 WeakPolarHBondContact O-CD 3.04Å; T771-K775 WeakPolarHBondContact O-CE 2.53Å; T771-K775 VanDerWaalsContact O-CG 3.24Å; T771-K775 WeakPolarHBondContact O-CG 3.33Å; T771-K775 PolarHBondContact O-N 2.85Å; E772-K775 WeakPolarHBondContact O-CB 3.49Å; E772-K775 PolarHBondContact O-N 3.05Å; K775-N777 PolarHBondContact O-N 3.48Å; K775-K778 CarbonylContact O-C 3.6Å; K775-K778 PolarHBondContact O-N 3.38Å; K775-K778 VanDerWaalsContact O-N 3.08Å; K775-Q779 WeakPolarHBondContact O-CG 3.45Å; K775-Q779 PolarHBondContact O-N 2.67Å
776	E	77	Confident	69.9	Low	110 Å²	110	91.2 Å²	91.2	51%	0.514	45%	0.449	S	S	.	.	H	α-helix	trans	-60.9	-44.9	178.9	-69.7	-172.1	141.3	0	0	111.7	E772 K778 Q779 S780	E772-E776 PolarHBondContact O-N 3.49Å; E776-K778 PolarHBondContact O-N 3.06Å; E776-Q779 PolarHBondContact O-N 3.35Å; E776-S780 PolarHBondContact O-N 2.98Å
777	N	68.2	Low	67.6	Low	77 Å²	77	96.1 Å²	96.1	41%	0.412	47%	0.471	S	S	.	.	H	α-helix	trans	-65.6	-19	175.6	-77.7	-65.2	0	0	0	114	Y730 Q773 K775	Y730-N777 PolarHBondContact OH-ND2 3.25Å; Q773-N777 WeakPolarHBondContact O-CB 3.33Å; Q773-N777 PolarHBondContact O-N 2.83Å; Q773-N777 VanDerWaalsContact O-N 3.11Å; Q773-N777 PolarHBondContact O-ND2 3.1Å; K775-N777 PolarHBondContact O-N 3.48Å
778	K	67	Low	65.3	Low	150 Å²	150	98.8 Å²	98.8	65%	0.652	49%	0.492	S	S	*	.	H	α-helix	trans	-88.8	-18	171.4	-70.3	172.4	-173.8	174.2	0	113.1	E774 K775 E776	E774-K778 WeakPolarHBondContact O-CG 3.48Å; E774-K778 PolarHBondContact O-N 2.67Å; E774-K778 WeakPolarHBondContact OE1-CE 3.24Å; E774-K778 IonicContact OE1-NZ 2.62Å; E774-K778 PolarHBondContact OE1-NZ 2.71Å; K775-K778 CarbonylContact O-C 3.6Å; K775-K778 PolarHBondContact O-N 3.38Å; K775-K778 VanDerWaalsContact O-N 3.08Å; E776-K778 PolarHBondContact O-N 3.06Å
779	Q	58.4	Low	63.2	Low	146 Å²	146	95 Å²	95	68%	0.682	49%	0.487	S	S	*	.	H	α-helix	trans	-101.9	-15.6	-178.6	-71.2	-176.6	2.9	0	0	114.1	K775 E776 V781	K775-Q779 WeakPolarHBondContact O-CG 3.45Å; K775-Q779 PolarHBondContact O-N 2.67Å; E776-Q779 PolarHBondContact O-N 3.35Å; Q779-V781 PolarHBondContact O-N 3.49Å
780	S	49.1	Very low	61.4	Low	65 Å²	65	100.1 Å²	100.1	46%	0.455	52%	0.515	S	S	.	.			trans	-67.1	-4.8	-176.7	58.5	0	0	0	0	115.5	E776 V782	E776-S780 PolarHBondContact O-N 2.98Å; S780-V782 PolarHBondContact O-N 2.71Å
781	V	42.4	Very low	59.5	Low	109 Å²	109	107.2 Å²	107.2	66%	0.661	55%	0.552	S	S	*	*			trans	-100.5	64.6	176.6	-167	0	0	0	0	111	Q779 H783	Q779-V781 PolarHBondContact O-N 3.49Å; V781-H783 PolarHBondContact O-N 2.73Å; V781-H783 VanDerWaalsContact O-N 3.14Å
782	V	41.1	Very low	57.7	Low	117 Å²	117	113.8 Å²	113.8	71%	0.709	57%	0.572	S	S	*	*			trans	-77.5	92	160.3	179.4	0	0	0	0	107.4	S780 L784	S780-V782 PolarHBondContact O-N 2.71Å; V782-L784 PolarHBondContact O-N 3.33Å
783	H	41.5	Very low	55.7	Low	129 Å²	129	112.7 Å²	112.7	60%	0.597	58%	0.582	S	S	*	*			trans	-73.5	93.9	-174.7	-143.7	-50.4	0	0	0	110.1	V781 Q785	V781-H783 PolarHBondContact O-N 2.73Å; V781-H783 VanDerWaalsContact O-N 3.14Å; H783-Q785 PolarHBondContact CE1-OE1 2.96Å; H783-Q785 VanDerWaalsContact CE1-OE1 3.23Å; H783-Q785 PolarHBondContact ND1-OE1 2.94Å; H783-Q785 PolarHBondContact O-N 3.35Å
784	L	45.5	Very low	54	Low	119 Å²	119	116.2 Å²	116.2	62%	0.623	60%	0.602	S	S	*	*	G	3₁₀ helix	trans	-64.3	16	-178.7	-70.4	169.6	0	0	0	115.1	V782 E786 F787	V782-L784 PolarHBondContact O-N 3.33Å; L784-E786 VanDerWaalsContact C-N 3.27Å; L784-E786 PolarHBondContact O-N 3.36Å; L784-F787 HydrophobicContact CB-CD2 4.42Å; L784-F787 HydrophobicContact CD2-CD2 3.65Å; L784-F787 HydrophobicContact CD2-CE2 3.88Å; L784-F787 PolarHBondContact O-N 2.84Å
785	Q	47.5	Very low	52.3	Low	124 Å²	124	119.5 Å²	119.5	58%	0.579	62%	0.621	S	S	*	*	G	3₁₀ helix	trans	-61	-34.4	-177.8	-149.6	75.8	17.9	0	0	112.3	H783 F787 S788	H783-Q785 PolarHBondContact CE1-OE1 2.96Å; H783-Q785 VanDerWaalsContact CE1-OE1 3.23Å; H783-Q785 PolarHBondContact ND1-OE1 2.94Å; H783-Q785 PolarHBondContact O-N 3.35Å; Q785-F787 PolarHBondContact O-N 3Å; Q785-S788 VanDerWaalsContact O-CB 3.3Å; Q785-S788 WeakPolarHBondContact O-CB 3.47Å; Q785-S788 PolarHBondContact O-N 3.45Å; Q785-S788 PolarHBondContact O-OG 2.89Å
786	E	47	Very low	50.4	Low	168 Å²	168	121.1 Å²	121.1	79%	0.785	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-65.3	-25	-178.4	-61.1	-174.8	134.3	0	0	112.5	L784 S788	L784-E786 VanDerWaalsContact C-N 3.27Å; L784-E786 PolarHBondContact O-N 3.36Å; E786-S788 VanDerWaalsContact C-N 3.3Å; E786-S788 PolarHBondContact O-N 3.23Å
787	F	44.1	Very low	48.9	Very low	111 Å²	111	120 Å²	120	49%	0.487	63%	0.628	S	S	.	*	G	3₁₀ helix	trans	-85.4	3.4	175.7	-55.9	-76.9	0	0	0	113.6	L784 Q785 S789	L784-F787 HydrophobicContact CB-CD2 4.42Å; L784-F787 HydrophobicContact CD2-CD2 3.65Å; L784-F787 HydrophobicContact CD2-CE2 3.88Å; L784-F787 PolarHBondContact O-N 2.84Å; Q785-F787 PolarHBondContact O-N 3Å; F787-S789 VanDerWaalsContact C-N 3.34Å; F787-S789 PolarHBondContact O-N 2.67Å
788	S	46.1	Very low	47.5	Very low	82 Å²	82	124.5 Å²	124.5	57%	0.573	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-86.8	8.2	-177.4	70.8	0	0	0	0	115.2	Q785 E786	Q785-S788 VanDerWaalsContact O-CB 3.3Å; Q785-S788 WeakPolarHBondContact O-CB 3.47Å; Q785-S788 PolarHBondContact O-N 3.45Å; Q785-S788 PolarHBondContact O-OG 2.89Å; E786-S788 VanDerWaalsContact C-N 3.3Å; E786-S788 PolarHBondContact O-N 3.23Å
789	S	48.3	Very low	46.1	Very low	62 Å²	62	127.9 Å²	127.9	43%	0.434	66%	0.655	S	S	.	*	S	Bend	trans	-80.1	138.5	176.1	66.2	0	0	0	0	112.2	F787 N791 W792	F787-S789 VanDerWaalsContact C-N 3.34Å; F787-S789 PolarHBondContact O-N 2.67Å; S789-N791 PolarHBondContact O-N 3.18Å; S789-W792 PolarHBondContact O-N 2.93Å; S789-W792 PolarHBondContact OG-NE1 2.93Å
790	N	51.3	Low	44.9	Very low	169 Å²	169	123.5 Å²	123.5	90%	0.904	65%	0.649	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-1.1	-166.6	-66.1	-7.4	0	0	0	117.4
791	N	51	Low	44.4	Very low	155 Å²	155	125.3 Å²	125.3	83%	0.829	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.9	0.3	-174.9	-65.5	-2.2	0	0	0	113.8	S789	S789-N791 PolarHBondContact O-N 3.18Å
792	W	49.8	Very low	44.4	Very low	179 Å²	179	127.2 Å²	127.2	68%	0.678	66%	0.664	S	S	*	*			trans	-109.1	113.4	-175	-66.1	75.7	0	0	0	112.2	S789	S789-W792 PolarHBondContact O-N 2.93Å; S789-W792 PolarHBondContact OG-NE1 2.93Å
793	A	45.6	Very low	44.2	Very low	87 Å²	87	131.5 Å²	131.5	72%	0.719	67%	0.669	S	S	*	*			trans	-91.8	115.2	170.6	0	0	0	0	0	110.4	D795	A793-D795 VanDerWaalsContact C-N 3.32Å; A793-D795 PolarHBondContact O-N 3.48Å
794	L	49.3	Very low	43.7	Very low	134 Å²	134	133.9 Å²	133.9	70%	0.702	68%	0.678	S	S	*	*			trans	-79.1	74.1	-177.7	-161.3	72.6	0	0	0	111.2	K796 V797	L794-K796 PolarHBondContact O-N 2.9Å; L794-V797 HydrophobicContact CD2-CG2 3.47Å; L794-V797 VanDerWaalsContact CD2-CG2 3.47Å; L794-V797 HydrophobicContact CG-CG2 3.87Å
795	D	47.2	Very low	43.1	Very low	105 Å²	105	133.2 Å²	133.2	56%	0.561	68%	0.681	S	S	*	*			trans	-66.8	-30.7	-165.4	-174	37.9	0	0	0	114.8	K338 A793	K338-D795 PolarHBondContact NZ-O 2.96Å; K338-D795 IonicContact NZ-OD1 3.52Å; K338-D795 PolarHBondContact NZ-OD1 2.91Å; A793-D795 VanDerWaalsContact C-N 3.32Å; A793-D795 PolarHBondContact O-N 3.48Å
796	K	41.4	Very low	42.4	Very low	145 Å²	145	136.9 Å²	136.9	63%	0.63	70%	0.695	S	S	*	*			trans	-145.3	130.1	172.8	-62.3	-179.1	-173.2	171.7	0	111	L794 F798	L794-K796 PolarHBondContact O-N 2.9Å; K796-F798 HydrophobicContact CB-CD2 4.35Å; K796-F798 HydrophobicContact CB-CE2 3.83Å; K796-F798 HydrophobicContact CB-CZ 4.38Å; K796-F798 HydrophobicContact CD-CE2 4.1Å; K796-F798 HydrophobicContact CD-CZ 3.99Å
797	V	45.6	Very low	41.6	Very low	86 Å²	86	135.9 Å²	135.9	52%	0.521	69%	0.69	S	S	.	*			trans	-103.1	120.8	165.3	178	0	0	0	0	108.1	L794 Y799	L794-V797 HydrophobicContact CD2-CG2 3.47Å; L794-V797 VanDerWaalsContact CD2-CG2 3.47Å; L794-V797 HydrophobicContact CG-CG2 3.87Å; V797-Y799 HydrophobicContact CG1-CE2 4.31Å
798	F	39.1	Very low	40.9	Very low	173 Å²	173	138.1 Å²	138.1	76%	0.759	71%	0.706	S	S	*	*			trans	-99.5	115.4	170.5	-68.4	-85.1	0	0	0	108.9	K796 G800	K796-F798 HydrophobicContact CB-CD2 4.35Å; K796-F798 HydrophobicContact CB-CE2 3.83Å; K796-F798 HydrophobicContact CB-CZ 4.38Å; K796-F798 HydrophobicContact CD-CE2 4.1Å; K796-F798 HydrophobicContact CD-CZ 3.99Å; F798-G800 PolarHBondContact O-N 3.42Å
799	Y	36.2	Very low	39.9	Very low	220 Å²	220	142.9 Å²	142.9	86%	0.863	71%	0.712	S	S	*	*			trans	-73.2	82.6	168.8	-70.9	-83.5	0	0	0	109.2	V797 T801	V797-Y799 HydrophobicContact CG1-CE2 4.31Å; Y799-T801 PolarHBondContact O-N 2.78Å
800	G	33.5	Very low	38.9	Very low	54 Å²	54	145.4 Å²	145.4	56%	0.557	73%	0.73	S	S	*	*			trans	-64.9	126.6	169.5	0	0	0	0	0	110	F798	F798-G800 PolarHBondContact O-N 3.42Å
801	T	38.8	Very low	37.7	Very low	104 Å²	104	144.5 Å²	144.5	64%	0.638	72%	0.723	S	S	*	*			trans	-66.5	161.4	164.4	52.4	0	0	0	0	109.7	Y799 Y803	Y799-T801 PolarHBondContact O-N 2.78Å; T801-Y803 PolarHBondContact O-N 2.98Å
802	N	41.7	Very low	36.5	Very low	149 Å²	149	143.6 Å²	143.6	80%	0.797	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.6	23.9	-171.5	-68.7	-11.6	0	0	0	115.4
803	Y	38.3	Very low	35.6	Very low	206 Å²	206	143.2 Å²	143.2	81%	0.808	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	11.3	-174.3	-70.4	-77.7	0	0	0	114.7	T801 P805	T801-Y803 PolarHBondContact O-N 2.98Å; Y803-P805 WeakPolarHBondContact O-CD 3.36Å
804	F	30	Very low	34.7	Very low	179 Å²	179	148.1 Å²	148.1	79%	0.785	74%	0.738	S	S	*	*			trans	-76.7	117.5	175.4	-111.2	-83.8	0	0	0	111.6	K806	F804-K806 PolarHBondContact O-N 3.21Å
805	P	33.9	Very low	33.7	Very low	106 Å²	106	150 Å²	150	69%	0.688	74%	0.743	S	S	*	*			trans	-72.3	111.8	177.4	29.2	-33.2	0	0	0	110.2	Y803 Q807	Y803-P805 WeakPolarHBondContact O-CD 3.36Å; P805-Q807 PolarHBondContact O-N 2.92Å
806	K	33.3	Very low	32.9	Very low	200 Å²	200	152 Å²	152	87%	0.87	75%	0.753	S	S	*	*			trans	-74.1	68.7	173.7	-73.4	-172.7	175.9	-179.7	0	111.9	F804 I808	F804-K806 PolarHBondContact O-N 3.21Å; K806-I808 PolarHBondContact O-N 3.15Å
807	Q	29	Very low	32.2	Very low	148 Å²	148	152.6 Å²	152.6	69%	0.692	76%	0.763	S	S	*	*			trans	-90.7	81.7	160.4	-72.5	-170.4	-3.9	0	0	109.5	P805 Y809	P805-Q807 PolarHBondContact O-N 2.92Å; Q807-Y809 HydrophobicContact CB-CD2 4.48Å; Q807-Y809 HydrophobicContact CB-CE2 4.3Å; Q807-Y809 HydrophobicContact CG-CE2 4.42Å
808	I	29.9	Very low	31.2	Very low	158 Å²	158	158.4 Å²	158.4	81%	0.81	78%	0.777	S	S	*	*			trans	-103.6	93.4	163.4	-59.4	179.2	0	0	0	106.6	K806 S810	K806-I808 PolarHBondContact O-N 3.15Å; I808-S810 PolarHBondContact O-N 2.87Å
809	Y	25.4	Very low	30.7	Very low	181 Å²	181	157.7 Å²	157.7	71%	0.71	78%	0.781	S	S	*	*			trans	-75.9	117	167.3	-74.1	-86.9	0	0	0	108.6	Q807 I811	Q807-Y809 HydrophobicContact CB-CD2 4.48Å; Q807-Y809 HydrophobicContact CB-CE2 4.3Å; Q807-Y809 HydrophobicContact CG-CE2 4.42Å; Y809-I811 PolarHBondContact O-N 3.16Å
810	S	27.4	Very low	30.4	Very low	115 Å²	115	154.4 Å²	154.4	80%	0.804	78%	0.777	S	S	*	*			trans	-77	104.1	160.9	-168.3	0	0	0	0	107.6	I808 N812	I808-S810 PolarHBondContact O-N 2.87Å; S810-N812 PolarHBondContact O-N 3.27Å; S810-N812 VanDerWaalsContact O-N 3.08Å
811	I	24.9	Very low	30	Very low	150 Å²	150	162.4 Å²	162.4	77%	0.769	79%	0.792	S	S	*	*			trans	-79.2	91.5	175.1	-58.9	173.1	0	0	0	107.4	Y809	Y809-I811 PolarHBondContact O-N 3.16Å
812	N	26.7	Very low	29.5	Very low	136 Å²	136	163.4 Å²	163.4	73%	0.727	79%	0.794	S	S	*	*			trans	173.3	96.4	152.7	-89.4	-13.4	0	0	0	108.5	S810	S810-N812 PolarHBondContact O-N 3.27Å; S810-N812 VanDerWaalsContact O-N 3.08Å
813	D	30.3	Very low	28.8	Very low	172 Å²	172	164.8 Å²	164.8	92%	0.92	79%	0.789	S	S	*	*			trans	178.1	77.3	146	-90.9	-18.9	0	0	0	107.1
814	Q	26.5	Very low	28.2	Very low	190 Å²	190	160.2 Å²	160.2	89%	0.888	78%	0.775	S	S	*	*			trans	-90.8	100	169.6	-70.1	-176	-94.3	0	0	108.7
815	H	29.3	Very low	28	Very low	172 Å²	172	157.7 Å²	157.7	80%	0.796	78%	0.778	S	S	*	*			trans	-157.2	152.9	152.4	-113.3	-79.9	0	0	0	111.3
816	D	29.4	Very low	27.7	Very low	147 Å²	147	158.8 Å²	158.8	79%	0.786	77%	0.774	S	S	*	*			trans	61.3	65.3	158.1	-48.7	-17	0	0	0	117.2
817	L	26	Very low	27.3	Very low	158 Å²	158	154.5 Å²	154.5	83%	0.827	77%	0.765	S	S	*	*			trans	-107.7	139	150.4	-134.7	174.1	0	0	0	107
818	Y	25.8	Very low	27.1	Very low	209 Å²	209	152.1 Å²	152.1	82%	0.82	75%	0.754	S	S	*	*			trans	75.4	100.9	-160.4	-64.3	-95.6	0	0	0	114.2
819	D	28.2	Very low	26.9	Very low	157 Å²	157	151.5 Å²	151.5	84%	0.84	75%	0.745	S	S	*	*				-173.9	176.1	110.8	-107.1	-23.7	0	0	0	114.1
820	L	29.4	Very low	26.8	Very low	152 Å²	152	149 Å²	149	80%	0.796	74%	0.742	S	S	*	*			trans	67.9	88.3	170.9	-94.9	66.7	0	0	0	119.6
821	Y	26.2	Very low	26.9	Very low	222 Å²	222	150.5 Å²	150.5	87%	0.871	74%	0.735	S	S	*	*			trans	-68.9	138.2	149.3	-99.2	-116	0	0	0	112.3
822	N	27.5	Very low	26.9	Very low	125 Å²	125	149 Å²	149	67%	0.668	73%	0.729	S	S	*	*				59.3	173.2	129.7	-156.1	24.8	0	0	0	121.4
823	Y	26.4	Very low	26.9	Very low	178 Å²	178	147.6 Å²	147.6	70%	0.698	73%	0.73	S	S	*	*			trans	78.1	154.8	174.4	-76.6	-107.5	0	0	0	119.1
824	Q	27.7	Very low	26.9	Very low	109 Å²	109	147.5 Å²	147.5	51%	0.509	72%	0.721	S	S	.	*			cis	-173.9	148.7	-41.1	-163.7	149.6	-48.3	0	0	111.1	Q826	Q824-Q826 HydrophobicContact CG-CG 4.12Å
825	C	25.1	Very low	27.1	Very low	126 Å²	126	144.2 Å²	144.2	85%	0.851	71%	0.71	S	S	*	*			trans	-142.6	120	146.4	-76.9	0	0	0	0	105
826	Q	26.4	Very low	27.1	Very low	129 Å²	129	142.5 Å²	142.5	60%	0.603	71%	0.705	S	S	*	*			cis	54.6	130.3	43	-68	170.8	23.9	0	0	110.8	Q824	Q824-Q826 HydrophobicContact CG-CG 4.12Å
827	V	25.4	Very low	27.1	Very low	111 Å²	111	140.6 Å²	140.6	67%	0.673	70%	0.699	S	S	*	*			cis	-117.5	152.6	37.6	170.1	0	0	0	0	109.9
828	E	24.5	Very low	27.3	Very low	98 Å²	98	139.3 Å²	139.3	46%	0.458	69%	0.693	S	S	.	*			cis	-114.6	-158.6	21.3	-128.1	151.8	-160.2	0	0	110.8	N1050	E828-N1050 PolarHBondContact OE2-ND2 3.34Å
829	F	25.8	Very low	27.5	Very low	145 Å²	145	136.5 Å²	136.5	64%	0.636	69%	0.687	S	S	*	*			cis	-138.3	169.7	0.1	-153.2	-89.2	0	0	0	111.5
830	M	24.8	Very low	27.5	Very low	129 Å²	129	136.2 Å²	136.2	64%	0.635	68%	0.681	S	S	*	*			trans	-66.9	154	172	-50.2	-140.2	73.2	0	0	111.5
831	H	28	Very low	27.4	Very low	145 Å²	145	135.6 Å²	135.6	67%	0.671	68%	0.678	S	S	*	*			cis	-152.3	169.9	21.2	-89.4	-70.7	0	0	0	107.3
832	N	25.6	Very low	27.5	Very low	120 Å²	120	130.4 Å²	130.4	64%	0.642	68%	0.675	S	S	*	*			cis	-161.3	146.8	-1.2	-120.6	-14.7	0	0	0	108.5
833	S	27.5	Very low	27.5	Very low	105 Å²	105	130.3 Å²	130.3	73%	0.734	68%	0.678	S	S	*	*			trans	58.2	139.4	156.2	58.4	0	0	0	0	119.4
834	K	29.8	Very low	27.4	Very low	171 Å²	171	129.2 Å²	129.2	74%	0.743	68%	0.683	S	S	*	*			cis	-167.3	155	3	-120.2	175.4	173.3	-169.6	0	110.2
835	D	31	Very low	27.4	Very low	121 Å²	121	128.9 Å²	128.9	65%	0.647	69%	0.693	S	S	*	*			trans	63.4	136.7	147.5	-54.4	-20.6	0	0	0	119.3
836	I	28.9	Very low	27.4	Very low	136 Å²	136	127.4 Å²	127.4	70%	0.697	68%	0.677	S	S	*	*			cis	-165.2	144.5	-16.5	-125.9	163.8	0	0	0	111
837	T	29.3	Very low	27.4	Very low	107 Å²	107	125.7 Å²	125.7	66%	0.656	68%	0.679	S	S	*	*			trans	50.2	120.9	156.7	64.1	0	0	0	0	123.9
838	D	29.2	Very low	27.3	Very low	130 Å²	130	126 Å²	126	70%	0.695	67%	0.671	S	S	*	*				104.6	133.5	112.4	-81.7	30.1	0	0	0	125.5
839	Q	30.6	Very low	27.3	Very low	150 Å²	150	129.2 Å²	129.2	70%	0.701	69%	0.686	S	S	*	*			trans	92.5	96.2	144.2	-73.7	168.1	49.7	0	0	123
840	Q	29.3	Very low	27.3	Very low	152 Å²	152	127.3 Å²	127.3	71%	0.71	69%	0.691	S	S	*	*				86.1	104.8	123	-68.7	179.6	27.8	0	0	122.5
841	N	27.3	Very low	27.5	Very low	138 Å²	138	128.9 Å²	128.9	74%	0.738	69%	0.694	S	S	*	*				85.8	126.7	128.2	-58.8	-23	0	0	0	122.4
842	S	28.7	Very low	27.4	Very low	114 Å²	114	129.5 Å²	129.5	80%	0.797	70%	0.701	S	S	*	*			trans	80.7	66.7	151.9	63	0	0	0	0	121.9
843	T	26.6	Very low	27.4	Very low	122 Å²	122	130.4 Å²	130.4	75%	0.748	70%	0.701	S	S	*	*			trans	-75.8	139.3	142.1	37.2	0	0	0	0	109.5
844	I	24.9	Very low	27.4	Very low	156 Å²	156	131.8 Å²	131.8	80%	0.8	70%	0.7	S	S	*	*				67.8	103.8	53.1	-58.2	178.7	0	0	0	112.8
845	S	26.8	Very low	27.5	Very low	102 Å²	102	132.4 Å²	132.4	71%	0.713	70%	0.702	S	S	*	*			trans	-158.4	112.7	164.4	65	0	0	0	0	113.6
846	N	25.3	Very low	27.4	Very low	95 Å²	95	134.2 Å²	134.2	51%	0.508	71%	0.706	S	S	.	*				61.7	118.8	121.7	-61	-2.3	0	0	0	121.2	N1059	N846-N1059 VanDerWaalsContact C-ND2 3.31Å; N846-N1059 HydrophobicContact CB-CB 3.56Å; N846-N1059 WeakPolarHBondContact CB-ND2 3.3Å; N846-N1059 PolarHBondContact O-ND2 3.34Å
847	S	27.2	Very low	27.5	Very low	93 Å²	93	134.4 Å²	134.4	65%	0.65	71%	0.714	S	S	*	*			trans	-159.2	101.1	151.5	69.8	0	0	0	0	115.4	N1059 T1060	S847-N1059 VanDerWaalsContact CA-CG 3.41Å; S847-N1059 WeakPolarHBondContact CA-OD1 3.35Å; S847-T1060 VanDerWaalsContact C-OG1 3.26Å; S847-T1060 PolarHBondContact N-OG1 3.42Å; S847-T1060 WeakPolarHBondContact O-CG2 3.21Å
848	F	23.3	Very low	27.4	Very low	118 Å²	118	135.2 Å²	135.2	52%	0.518	71%	0.714	S	S	.	*			trans	-92.2	178.8	159.6	-103.2	-31.5	0	0	0	107.6	N1059 T1060	F848-N1059 VanDerWaalsContact CB-C 3.48Å; F848-N1059 VanDerWaalsContact CD2-O 3.31Å; F848-N1059 WeakPolarHBondContact CD2-O 3.46Å; F848-N1059 PolarHBondContact N-OD1 3.47Å; F848-T1060 HydrophobicContact CB-CG2 3.92Å; F848-T1060 VanDerWaalsContact CB-N 3.28Å; F848-T1060 HydrophobicContact CD1-CG2 3.25Å; F848-T1060 HydrophobicContact CD2-CG2 4.23Å; F848-T1060 HydrophobicContact CE1-CG2 3.76Å; F848-T1060 VanDerWaalsContact CG-CA 3.43Å; F848-T1060 HydrophobicContact CG-CG2 3.48Å; F848-T1060 VanDerWaalsContact CG-CG2 3.48Å; F848-T1060 HydrophobicContact CZ-CG2 4.42Å; F848-T1060 VanDerWaalsContact N-N 3.14Å
849	Q	24.1	Very low	27.6	Very low	165 Å²	165	137 Å²	137	77%	0.771	72%	0.716	S	S	*	*			trans	61.2	80.2	161	-68.2	162.9	-59.2	0	0	115.2
850	S	25.9	Very low	27.6	Very low	105 Å²	105	135.6 Å²	135.6	73%	0.734	72%	0.717	S	S	*	*			trans	-152.6	137.6	138	95.9	0	0	0	0	108.8
851	K	27.7	Very low	27.7	Very low	162 Å²	162	133.9 Å²	133.9	70%	0.704	71%	0.709	S	S	*	*			cis	-139.5	135.8	3.2	-63.8	178	-178.8	-175	0	111.5
852	I	26.4	Very low	27.9	Very low	158 Å²	158	134 Å²	134	81%	0.81	71%	0.709	S	S	*	*			trans	-119.3	105.7	147.2	-65.8	178.9	0	0	0	105.7	L854	I852-L854 HydrophobicContact CG2-CD1 4.49Å; I852-L854 HydrophobicContact CG2-CG 4.26Å; I852-L854 PolarHBondContact O-N 2.93Å
853	E	26.3	Very low	28.1	Very low	139 Å²	139	133.9 Å²	133.9	65%	0.65	71%	0.705	S	S	*	*			trans	-83.6	99.5	175.8	-74.2	-175.3	-166.3	0	0	110.2
854	L	27.5	Very low	28.5	Very low	134 Å²	134	133.4 Å²	133.4	70%	0.702	70%	0.704	S	S	*	*			trans	-97.1	104.9	165.5	-82	168.2	0	0	0	109.7	I852 H856	I852-L854 HydrophobicContact CG2-CD1 4.49Å; I852-L854 HydrophobicContact CG2-CG 4.26Å; I852-L854 PolarHBondContact O-N 2.93Å; L854-H856 PolarHBondContact O-N 3.47Å; L854-H856 VanDerWaalsContact O-N 3.14Å
855	K	30.6	Very low	28.9	Very low	183 Å²	183	133.2 Å²	133.2	80%	0.796	70%	0.704	S	S	*	*			trans	-74.4	100.5	175.9	-68.1	-179	179.6	177.2	0	110.4
856	H	28.8	Very low	29.2	Very low	159 Å²	159	132.1 Å²	132.1	74%	0.736	70%	0.701	S	S	*	*			trans	-73.3	142.2	163.5	-105.6	-103.2	0	0	0	110.7	L854 N858	L854-H856 PolarHBondContact O-N 3.47Å; L854-H856 VanDerWaalsContact O-N 3.14Å; H856-N858 PolarHBondContact ND1-OD1 3.37Å
857	V	31.7	Very low	29.6	Very low	141 Å²	141	137 Å²	137	86%	0.855	72%	0.721	S	S	*	*			trans	-126.5	105.8	162.9	178.1	0	0	0	0	107.2
858	N	28.2	Very low	30	Very low	123 Å²	123	135.5 Å²	135.5	66%	0.658	72%	0.72	S	S	*	*			trans	-89.8	158.4	173.8	-59	-14.6	0	0	0	109.9	H856	H856-N858 PolarHBondContact ND1-OD1 3.37Å
859	K	31.7	Very low	30.6	Very low	168 Å²	168	137.2 Å²	137.2	73%	0.73	74%	0.735	S	S	*	*			trans	167.9	163.7	144.3	-96.6	178.8	-179.9	-130.1	0	110.8	E861	K859-E861 WeakPolarHBondContact CD-OE1 3.44Å; K859-E861 WeakPolarHBondContact CE-OE1 3.31Å; K859-E861 WeakPolarHBondContact CG-OE1 3.36Å; K859-E861 IonicContact NZ-OE1 3.11Å; K859-E861 PolarHBondContact NZ-OE1 3.08Å; K859-E861 IonicContact NZ-OE2 2.72Å; K859-E861 PolarHBondContact NZ-OE2 3.07Å
860	V	32.2	Very low	31.2	Very low	121 Å²	121	135.5 Å²	135.5	73%	0.733	73%	0.731	S	S	*	*			cis	-150	149.5	17.3	86.3	0	0	0	0	109.4
861	E	30.2	Very low	31.7	Very low	116 Å²	116	136 Å²	136	54%	0.542	73%	0.725	S	S	.	*			cis	-126.7	-74.6	-17.1	-157.7	74.7	-77.5	0	0	110.7	K859	K859-E861 WeakPolarHBondContact CD-OE1 3.44Å; K859-E861 WeakPolarHBondContact CE-OE1 3.31Å; K859-E861 WeakPolarHBondContact CG-OE1 3.36Å; K859-E861 IonicContact NZ-OE1 3.11Å; K859-E861 PolarHBondContact NZ-OE1 3.08Å; K859-E861 IonicContact NZ-OE2 2.72Å; K859-E861 PolarHBondContact NZ-OE2 3.07Å
862	N	31.2	Very low	32.2	Very low	139 Å²	139	134.2 Å²	134.2	74%	0.743	72%	0.724	S	S	*	*			cis	-170.5	130.6	-21.7	-154.4	67	0	0	0	108.4
863	T	33.5	Very low	32.7	Very low	113 Å²	113	132.7 Å²	132.7	69%	0.693	72%	0.717	S	S	*	*			cis	-155.2	159.7	-12.6	13.8	0	0	0	0	109.8
864	P	34.3	Very low	33.3	Very low	112 Å²	112	131.7 Å²	131.7	73%	0.727	72%	0.716	S	S	*	*			trans	-114.8	-177.7	-161	43.9	-36.5	0	0	0	116.1
865	N	33.2	Very low	33.8	Very low	152 Å²	152	131.3 Å²	131.3	81%	0.813	72%	0.715	S	S	*	*			trans	-162.3	140.1	140.7	-86	-23.1	0	0	0	106.3
866	A	34.4	Very low	34.3	Very low	78 Å²	78	128.3 Å²	128.3	65%	0.645	71%	0.707	S	S	*	*			cis	66.9	127.7	49.9	0	0	0	0	0	111.6
867	E	33.7	Very low	34.8	Very low	198 Å²	198	127.2 Å²	127.2	93%	0.925	71%	0.707	S	S	*	*			cis	-147	175	-0.8	-101.6	149.4	-157.4	0	0	105.4
868	G	35.9	Very low	35.1	Very low	62 Å²	62	127.6 Å²	127.6	64%	0.639	70%	0.704	S	S	*	*			cis	130	78.1	25.5	0	0	0	0	0	109.1
869	D	34	Very low	35.6	Very low	153 Å²	153	129.3 Å²	129.3	82%	0.818	71%	0.713	S	S	*	*			trans	60.5	143.2	155.4	-60	-12.9	0	0	0	123.4
870	N	37.1	Very low	35.6	Very low	129 Å²	129	125.1 Å²	125.1	69%	0.69	71%	0.71	S	S	*	*			trans	84.2	117.7	145.4	-79.4	34.6	0	0	0	123.8
871	D	37	Very low	35.7	Very low	115 Å²	115	130.5 Å²	130.5	62%	0.615	72%	0.719	S	S	*	*				93.8	112.6	121.3	-67.5	-3.2	0	0	0	122
872	N	38	Very low	35.8	Very low	126 Å²	126	128.6 Å²	128.6	67%	0.674	72%	0.718	S	S	*	*			trans	82.9	125.1	132.7	-65.1	-22.8	0	0	0	120.6
873	N	36.7	Very low	36.1	Very low	126 Å²	126	129.8 Å²	129.8	67%	0.674	72%	0.719	S	S	*	*			trans	70	146.5	140.2	-66.1	46.8	0	0	0	117.4
874	D	40	Very low	36.2	Very low	117 Å²	117	130.1 Å²	130.1	63%	0.626	72%	0.716	S	S	*	*			cis	-160	152.7	-8.4	-99.1	-19.8	0	0	0	106.7
875	N	38.3	Very low	36.3	Very low	126 Å²	126	130.6 Å²	130.6	67%	0.674	71%	0.713	S	S	*	*			trans	64.5	161.3	152	-68.1	36.5	0	0	0	117.5
876	D	39.4	Very low	36.5	Very low	120 Å²	120	129.4 Å²	129.4	64%	0.642	71%	0.706	S	S	*	*			cis	-156.8	170.9	-16.3	-99.6	-15.5	0	0	0	108.2
877	D	40.5	Very low	36.6	Very low	136 Å²	136	131.3 Å²	131.3	73%	0.727	71%	0.706	S	S	*	*			trans	57.2	102	152.1	-59.8	-5	0	0	0	121.8
878	D	37.6	Very low	36.7	Very low	149 Å²	149	127.6 Å²	127.6	80%	0.797	69%	0.693	S	S	*	*				67.2	141.8	112.7	-69.3	-8	0	0	0	125.8
879	D	37.9	Very low	36.6	Very low	160 Å²	160	129.9 Å²	129.9	86%	0.856	69%	0.694	S	S	*	*			trans	77.8	146.7	145.5	-93.6	-19.3	0	0	0	123.2
880	A	32.2	Very low	36.7	Very low	79 Å²	79	130 Å²	130	65%	0.653	69%	0.689	S	S	*	*			trans	-97.3	168.5	-179.7	0	0	0	0	0	111.9
881	Y	34.3	Very low	36.6	Very low	234 Å²	234	131 Å²	131	92%	0.918	69%	0.69	S	S	*	*				-170.5	165.6	120.9	-111.5	-77.4	0	0	0	112.2
882	S	32	Very low	36.4	Very low	76 Å²	76	131.4 Å²	131.4	53%	0.531	69%	0.692	S	S	.	*			trans	-80.5	157.4	-176.3	60	0	0	0	0	115
883	H	37.7	Very low	36.3	Very low	165 Å²	165	132 Å²	132	76%	0.764	70%	0.695	S	S	*	*				-163.1	123.2	126	-93.6	-39	0	0	0	110.2
884	N	35.5	Very low	36.1	Very low	119 Å²	119	132 Å²	132	64%	0.636	70%	0.695	S	S	*	*				67.8	126.8	86.7	-80.3	8.4	0	0	0	112.6
885	N	37.1	Very low	35.7	Very low	123 Å²	123	132.1 Å²	132.1	66%	0.658	70%	0.696	S	S	*	*				179.3	161.9	50.9	-115.1	-2.2	0	0	0	112.1
886	N	37.5	Very low	35.5	Very low	126 Å²	126	133.3 Å²	133.3	67%	0.674	70%	0.697	S	S	*	*			trans	69.7	143.9	146.6	-62.3	8.4	0	0	0	120.3
887	N	35.7	Very low	35	Very low	119 Å²	119	133.6 Å²	133.6	64%	0.636	70%	0.703	S	S	*	*			cis	-168.2	170.4	-18.4	-124.1	31.8	0	0	0	112.7
888	D	36.4	Very low	34.7	Very low	120 Å²	120	132.2 Å²	132.2	64%	0.642	70%	0.702	S	S	*	*			trans	66.1	84.7	146.1	-54.4	-25	0	0	0	123.5
889	T	32.7	Very low	34.2	Very low	109 Å²	109	133.7 Å²	133.7	67%	0.669	70%	0.701	S	S	*	*				48.6	156.4	109.3	59.7	0	0	0	0	125.1
890	H	37.7	Very low	33.6	Very low	156 Å²	156	131.2 Å²	131.2	72%	0.722	69%	0.692	S	S	*	*			trans	77.5	142.3	163.8	-61.8	-80.2	0	0	0	116.9
891	E	35.3	Very low	33.5	Very low	151 Å²	151	133.8 Å²	133.8	71%	0.706	70%	0.695	S	S	*	*			cis	-154.2	178.5	-8	-135.9	165.3	-138.8	0	0	114.5
892	N	31.7	Very low	33.1	Very low	123 Å²	123	130.9 Å²	130.9	66%	0.658	69%	0.69	S	S	*	*			trans	-62.9	158.2	-177.1	-49.4	-65	0	0	0	114.7
893	N	35.6	Very low	32.8	Very low	138 Å²	138	131.9 Å²	131.9	74%	0.738	70%	0.697	S	S	*	*				176.2	115	104.2	-90.3	-53.7	0	0	0	114.1
894	N	32.1	Very low	32.4	Very low	125 Å²	125	131.8 Å²	131.8	67%	0.668	70%	0.696	S	S	*	*				58	142.7	118.6	-77.3	35	0	0	0	125
895	D	32.3	Very low	32	Very low	120 Å²	120	131.9 Å²	131.9	64%	0.642	70%	0.702	S	S	*	*			trans	91.3	103.5	139	-63.7	-2.9	0	0	0	123.5
896	H	34.6	Very low	31.6	Very low	152 Å²	152	128.9 Å²	128.9	70%	0.704	68%	0.684	S	S	*	*				76.3	109.4	121	-73.7	-59.6	0	0	0	122.8
897	T	28.2	Very low	31.1	Very low	125 Å²	125	126.3 Å²	126.3	77%	0.767	67%	0.669	S	S	*	*				84.2	151.6	129.2	57.4	0	0	0	0	121.5
898	P	34.1	Very low	30.8	Very low	107 Å²	107	125.8 Å²	125.8	70%	0.695	66%	0.662	S	S	*	*			trans	-105.9	174.3	-167.3	41.5	-34	0	0	0	113.6
899	F	27.1	Very low	30.2	Very low	180 Å²	180	124.4 Å²	124.4	79%	0.789	66%	0.66	S	S	*	*				177.9	126.7	124.1	-114.6	-97.9	0	0	0	113.7
900	T	26.1	Very low	29.8	Very low	109 Å²	109	128.2 Å²	128.2	67%	0.669	66%	0.664	S	S	*	*			trans	62.7	149.6	144.3	46.4	0	0	0	0	126.1
901	N	29	Very low	29.5	Very low	132 Å²	132	130 Å²	130	71%	0.706	67%	0.672	S	S	*	*			trans	93.7	92.8	145.3	-66.9	-6	0	0	0	122.8
902	E	26.2	Very low	29.2	Very low	174 Å²	174	129.9 Å²	129.9	81%	0.813	68%	0.676	S	S	*	*				55.2	108	117.7	-65.1	-160.8	141.3	0	0	123.1
903	S	26.3	Very low	28.9	Very low	97 Å²	97	130.5 Å²	130.5	68%	0.678	68%	0.68	S	S	*	*				101.5	139.2	116.6	83.8	0	0	0	0	122
904	Q	28.9	Very low	28.3	Very low	162 Å²	162	130.2 Å²	130.2	76%	0.757	68%	0.678	S	S	*	*			trans	60.1	123.3	159.3	-55.3	179	38.3	0	0	118.2
905	T	27.5	Very low	28.1	Very low	121 Å²	121	132.4 Å²	132.4	74%	0.742	68%	0.684	S	S	*	*				-164.7	169.6	67.5	26.6	0	0	0	0	113.9
906	E	27.9	Very low	27.7	Very low	60 Å²	60	132.8 Å²	132.8	28%	0.28	69%	0.685	S	S	.	*			trans	-62.5	163.3	-178.2	-64.2	136.8	113.2	0	0	113.1	F205 K207	F205-E906 HydrophobicContact CB-CB 3.92Å; F205-E906 HydrophobicContact CB-CG 3.82Å; F205-E906 HydrophobicContact CD1-CB 3.33Å; F205-E906 HydrophobicContact CD1-CG 2.3Å; F205-E906 WeakPolarHBondContact CD1-OE1 3.45Å; F205-E906 HydrophobicContact CD2-CB 2.76Å; F205-E906 HydrophobicContact CD2-CG 2.3Å; F205-E906 WeakPolarHBondContact CD2-OE1 3.49Å; F205-E906 WeakPolarHBondContact CD2-OE2 3.21Å; F205-E906 HydrophobicContact CE1-CB 3.84Å; F205-E906 HydrophobicContact CE1-CG 2.31Å; F205-E906 WeakPolarHBondContact CE1-OE1 3.3Å; F205-E906 HydrophobicContact CE2-CB 3.35Å; F205-E906 HydrophobicContact CE2-CG 2.3Å; F205-E906 WeakPolarHBondContact CE2-OE2 3.48Å; F205-E906 HydrophobicContact CG-CB 2.78Å; F205-E906 HydrophobicContact CG-CG 2.33Å; F205-E906 WeakPolarHBondContact CG-OE1 2.87Å; F205-E906 WeakPolarHBondContact CG-OE2 3.29Å; F205-E906 HydrophobicContact CZ-CB 3.86Å; F205-E906 HydrophobicContact CZ-CG 2.32Å; F205-E906 WeakPolarHBondContact CZ-OE1 3.34Å; F205-E906 WeakPolarHBondContact CZ-OE2 3.38Å; K207-E906 VanDerWaalsContact NZ-CD 3.3Å; K207-E906 IonicContact NZ-OE1 2.83Å; K207-E906 PolarHBondContact NZ-OE1 3.48Å; K207-E906 IonicContact NZ-OE2 3.7Å; K207-E906 PolarHBondContact NZ-OE2 3.14Å
907	L	27.6	Very low	27.2	Very low	72 Å²	72	133.3 Å²	133.3	38%	0.377	69%	0.688	S	S	.	*				170.8	150.5	90.2	-98.9	135.5	0	0	0	120.4	S203 T204	S203-L907 WeakPolarHBondContact O-CD1 3.26Å; T204-L907 WeakPolarHBondContact O-CD2 3.48Å
908	K	28.7	Very low	27.2	Very low	109 Å²	109	136.9 Å²	136.9	47%	0.474	69%	0.693	S	S	.	*			trans	21.1	150.6	139	-77.7	177	-167.4	170.9	0	121	T204 F205	T204-K908 WeakPolarHBondContact O-CE 3.44Å; T204-K908 PolarHBondContact O-NZ 3.23Å; F205-K908 VanDerWaalsContact O-CE 3.3Å; F205-K908 WeakPolarHBondContact O-CE 3.32Å; F205-K908 PolarHBondContact O-NZ 2.95Å
909	C	25.7	Very low	26.8	Very low	91 Å²	91	136.2 Å²	136.2	62%	0.615	69%	0.691	S	S	*	*			cis	-167	-178.7	23.2	-127.8	0	0	0	0	113.5
910	Y	24	Very low	26.9	Very low	188 Å²	188	133.4 Å²	133.4	74%	0.737	69%	0.689	S	S	*	*			trans	-29.6	147.7	170.1	-52.7	-81.5	0	0	0	119
911	H	31.8	Very low	26.9	Very low	194 Å²	194	137 Å²	137	90%	0.898	70%	0.698	S	S	*	*			trans	-89.2	141.7	148.3	-106	-85.7	0	0	0	110.9
912	N	27.9	Very low	26.9	Very low	148 Å²	148	135.7 Å²	135.7	79%	0.791	70%	0.699	S	S	*	*			trans	-92.2	172.4	177	-72.7	-36.6	0	0	0	112
913	N	24.9	Very low	27	Very low	137 Å²	137	133.9 Å²	133.9	73%	0.733	70%	0.695	S	S	*	*			trans	-67.3	176	169.9	-50.6	-27.5	0	0	0	112.7
914	D	24.4	Very low	27.2	Very low	132 Å²	132	135.7 Å²	135.7	71%	0.706	70%	0.697	S	S	*	*			trans	67.4	128.1	158.5	-43.9	-45.7	0	0	0	114.9
915	H	26.7	Very low	27.3	Very low	170 Å²	170	135.5 Å²	135.5	79%	0.787	70%	0.696	S	S	*	*				-169.5	152.6	52	-115.2	-63.3	0	0	0	113.9
916	L	25.1	Very low	27.3	Very low	128 Å²	128	136.6 Å²	136.6	67%	0.67	70%	0.697	S	S	*	*			trans	70.5	108.8	130.3	-155.6	72.4	0	0	0	122.2
917	E	23.7	Very low	27.2	Very low	163 Å²	163	141.8 Å²	141.8	76%	0.762	72%	0.721	S	S	*	*			trans	21.1	117.7	134.8	-52.7	175.3	134.6	0	0	121.2
918	K	27.8	Very low	27.3	Very low	200 Å²	200	147.5 Å²	147.5	87%	0.87	74%	0.743	S	S	*	*				172.8	147.9	129.6	-93.5	150	-171.8	171.9	0	109.2
919	S	25.8	Very low	27.1	Very low	94 Å²	94	148 Å²	148	66%	0.657	76%	0.755	S	S	*	*			cis	-167.4	-173.1	-13	44	0	0	0	0	107.8
920	T	30	Very low	27.2	Very low	121 Å²	121	150.3 Å²	150.3	74%	0.742	76%	0.76	S	S	*	*			trans	57.7	93.1	174.7	57.6	0	0	0	0	114
921	E	25.6	Very low	27.5	Very low	183 Å²	183	149.7 Å²	149.7	86%	0.855	76%	0.763	S	S	*	*				64	146.1	51.6	-55.9	-166.9	116.8	0	0	115.9
922	S	29.3	Very low	27.2	Very low	106 Å²	106	147 Å²	147	74%	0.741	76%	0.756	S	S	*	*			trans	83.3	136.2	175.5	80.4	0	0	0	0	117.3
923	N	27	Very low	27.4	Very low	136 Å²	136	145.8 Å²	145.8	73%	0.727	76%	0.759	S	S	*	*			cis	-164.2	174.6	-20.8	-111.5	-27.7	0	0	0	110.3
924	N	31.5	Very low	27.5	Very low	134 Å²	134	144.2 Å²	144.2	72%	0.717	76%	0.755	S	S	*	*			trans	76.5	145	165.8	-45.9	-40.6	0	0	0	116.4
925	H	30.1	Very low	27.7	Very low	158 Å²	158	149 Å²	149	73%	0.731	76%	0.764	S	S	*	*			cis	-165.1	152.1	-23.9	-121.1	-59.5	0	0	0	110.5
926	L	28	Very low	27.5	Very low	145 Å²	145	152.2 Å²	152.2	76%	0.759	77%	0.77	S	S	*	*			trans	63.5	136.1	171.9	-76.2	75.8	0	0	0	116.9
927	Q	25.1	Very low	27.7	Very low	168 Å²	168	154.8 Å²	154.8	79%	0.785	78%	0.775	S	S	*	*			cis	107.7	88.2	12.3	-168	178.6	11.6	0	0	115.5
928	K	31.1	Very low	28	Very low	193 Å²	193	154 Å²	154	84%	0.839	77%	0.774	S	S	*	*			trans	-170	127	154.1	-98.3	163.4	-176.1	178.2	0	105
929	T	23	Very low	27.9	Very low	120 Å²	120	149.9 Å²	149.9	74%	0.736	77%	0.768	S	S	*	*			cis	72	141.7	33.2	-35.3	0	0	0	0	112.6
930	I	29	Very low	28.1	Very low	138 Å²	138	154.3 Å²	154.3	71%	0.708	78%	0.781	S	S	*	*			trans	86.6	128.1	-178.7	-60.1	165.4	0	0	0	113
931	E	30.3	Very low	27.8	Very low	175 Å²	175	154.6 Å²	154.6	82%	0.818	78%	0.778	S	S	*	*			cis	-156.1	173.2	-7.5	-124.6	162.2	-148.3	0	0	113.8
932	D	25.4	Very low	27.8	Very low	138 Å²	138	152 Å²	152	74%	0.738	77%	0.77	S	S	*	*			trans	-80.9	158.6	175.8	-81.6	-73.9	0	0	0	114.2
933	S	31.6	Very low	27.8	Very low	122 Å²	122	152.7 Å²	152.7	85%	0.853	77%	0.77	S	S	*	*			trans	-157.6	81.7	135.8	58.3	0	0	0	0	113.2
934	T	27.1	Very low	27.7	Very low	105 Å²	105	154.1 Å²	154.1	64%	0.644	77%	0.772	S	S	*	*			trans	-45.2	150.8	164.9	56.5	0	0	0	0	115.5
935	Y	28.2	Very low	27.4	Very low	233 Å²	233	153 Å²	153	91%	0.914	77%	0.771	S	S	*	*			trans	-136.7	92	141.7	-106.8	-83.3	0	0	0	112.4
936	R	23.4	Very low	27.3	Very low	237 Å²	237	153.5 Å²	153.5	89%	0.894	77%	0.771	S	S	*	*			trans	-117.4	131.7	154.8	-72.7	-172.4	-176	-174.7	3.9	108.4
937	K	29.3	Very low	27.3	Very low	182 Å²	182	153.8 Å²	153.8	79%	0.791	77%	0.768	S	S	*	*			trans	-157	105.4	154.7	-106	149	-175.1	177.3	0	106.7
938	I	28.5	Very low	27.3	Very low	145 Å²	145	152.2 Å²	152.2	74%	0.744	77%	0.765	S	S	*	*				78.3	121	93.7	-74.9	174.1	0	0	0	110.7
939	P	27.5	Very low	27.1	Very low	114 Å²	114	150.3 Å²	150.3	74%	0.74	76%	0.763	S	S	*	*			trans	-81.3	148.8	178.1	34.4	-34.8	0	0	0	111.6
940	M	29	Very low	27.2	Very low	187 Å²	187	150.4 Å²	150.4	92%	0.921	77%	0.766	S	S	*	*			trans	-147.4	168.3	154.5	-105	-57.5	144	0	0	110.5
941	N	24.7	Very low	27.2	Very low	127 Å²	127	154.6 Å²	154.6	68%	0.679	77%	0.772	S	S	*	*			trans	-111.1	165.3	-159.2	-140.4	47.1	0	0	0	112.7
942	D	25.8	Very low	26.9	Very low	129 Å²	129	152.9 Å²	152.9	69%	0.69	77%	0.767	S	S	*	*			trans	73.9	147.1	153.7	-57.8	-43.6	0	0	0	122.7
943	T	27.7	Very low	27.1	Very low	120 Å²	120	154.7 Å²	154.7	74%	0.736	77%	0.771	S	S	*	*			trans	68.9	101.5	155.6	43.4	0	0	0	0	122.1
944	E	25.7	Very low	26.8	Very low	166 Å²	166	155 Å²	155	78%	0.776	76%	0.763	S	S	*	*				74.5	100.4	114.8	-71.3	-176.1	178.3	0	0	123.3
945	T	26	Very low	26.9	Very low	112 Å²	112	158.9 Å²	158.9	69%	0.687	77%	0.771	S	S	*	*				91.5	154.8	123.7	68.9	0	0	0	0	123.8
946	F	27.3	Very low	26.8	Very low	167 Å²	167	154.8 Å²	154.8	73%	0.732	76%	0.763	S	S	*	*			trans	67.9	99	158.4	-68.5	-65.1	0	0	0	122.9
947	Q	27.4	Very low	26.8	Very low	152 Å²	152	148.9 Å²	148.9	71%	0.71	75%	0.754	S	S	*	*				66.5	123.6	123.5	-77.9	176.6	-7.2	0	0	122.6
948	N	25.3	Very low	26.8	Very low	134 Å²	134	151.8 Å²	151.8	72%	0.717	76%	0.761	S	S	*	*			trans	53.5	112.2	132.2	-56.7	-11	0	0	0	120.5
949	I	26.9	Very low	26.6	Very low	153 Å²	153	149.3 Å²	149.3	79%	0.785	76%	0.757	S	S	*	*				-176.5	133.4	109.7	-92.1	152.7	0	0	0	109.3
950	P	26	Very low	26.6	Very low	123 Å²	123	150.6 Å²	150.6	80%	0.799	76%	0.758	S	S	*	*			trans	-96.7	130.4	-178.9	34.7	-31.6	0	0	0	113.5
951	R	28.4	Very low	26.7	Very low	226 Å²	226	149.7 Å²	149.7	85%	0.853	75%	0.751	S	S	*	*			trans	-145	109.5	163.9	-78	-166.9	171.1	164.9	-2	113.4
952	I	23.9	Very low	26.7	Very low	139 Å²	139	152.2 Å²	152.2	71%	0.713	76%	0.759	S	S	*	*				32.2	122.2	127.2	-56.8	162.9	0	0	0	117.2
953	H	28.9	Very low	26.6	Very low	175 Å²	175	153.7 Å²	153.7	81%	0.81	77%	0.766	S	S	*	*				-155.7	140.7	127.1	-122.1	-92	0	0	0	114.2
954	N	26.7	Very low	26.5	Very low	128 Å²	128	155.3 Å²	155.3	68%	0.684	77%	0.769	S	S	*	*			trans	-45.4	170.3	177.3	-49.9	-34.5	0	0	0	115.5
955	K	27.4	Very low	26.6	Very low	188 Å²	188	153.6 Å²	153.6	82%	0.817	77%	0.774	S	S	*	*			cis	-155.2	174	20.7	-146	174.1	175.4	-173.7	0	106.6
956	I	27.3	Very low	26.5	Very low	147 Å²	147	159 Å²	159	75%	0.754	78%	0.782	S	S	*	*			cis	-143.3	173.8	16.4	-37.6	160.5	0	0	0	109.8
957	T	24.1	Very low	26.4	Very low	112 Å²	112	157.6 Å²	157.6	69%	0.687	78%	0.782	S	S	*	*			trans	-118.7	157.6	-175.2	46.3	0	0	0	0	113.3
958	Y	28.5	Very low	26.4	Very low	243 Å²	243	157.2 Å²	157.2	95%	0.953	79%	0.785	S	S	*	*			trans	-139	142.8	136.7	-104.4	-78.3	0	0	0	109
959	S	24	Very low	26.4	Very low	93 Å²	93	155.1 Å²	155.1	65%	0.65	78%	0.781	S	S	*	*			trans	-158.6	146.3	-171.3	51.9	0	0	0	0	109.6
960	N	27.9	Very low	26.2	Very low	142 Å²	142	153.2 Å²	153.2	76%	0.759	78%	0.776	S	S	*	*			trans	-171.3	144.1	160.1	-98.9	14.4	0	0	0	105.4
961	E	30.7	Very low	26.3	Very low	167 Å²	167	156.9 Å²	156.9	78%	0.78	78%	0.78	S	S	*	*			cis	-132.8	165.8	2.5	-98.2	131.3	-143.6	0	0	111.2
962	E	24.6	Very low	26.1	Very low	180 Å²	180	156 Å²	156	84%	0.841	78%	0.778	S	S	*	*			trans	-104.7	-173.8	175.5	-63.3	-172.8	108.5	0	0	111.8
963	L	24.5	Very low	26.1	Very low	161 Å²	161	155.8 Å²	155.8	84%	0.843	78%	0.779	S	S	*	*			trans	80	127.7	171.8	-52.7	160.4	0	0	0	114.3
964	L	25.5	Very low	26.1	Very low	153 Å²	153	156.1 Å²	156.1	80%	0.801	78%	0.78	S	S	*	*			cis	-130.7	163.8	-7.3	-60.4	93.2	0	0	0	107.3
965	C	27.7	Very low	26	Very low	130 Å²	130	158.2 Å²	158.2	88%	0.878	79%	0.786	S	S	*	*			cis	-149.6	176.2	43.6	-102.7	0	0	0	0	113.4
966	R	23.2	Very low	26	Very low	226 Å²	226	159 Å²	159	85%	0.853	79%	0.789	S	S	*	*			trans	-117.7	165.9	-162.8	-145.2	174.7	-171.5	158.5	-0.1	111.8
967	N	25.1	Very low	25.9	Very low	137 Å²	137	160 Å²	160	73%	0.733	79%	0.791	S	S	*	*			trans	77.3	135	171.1	-45	-20.9	0	0	0	113.7
968	N	28.4	Very low	26.1	Very low	144 Å²	144	159.9 Å²	159.9	77%	0.77	79%	0.794	S	S	*	*			cis	-132.7	126.9	4.1	-74.8	-46.1	0	0	0	108
969	S	24.7	Very low	25.9	Very low	90 Å²	90	155.5 Å²	155.5	63%	0.629	78%	0.782	S	S	*	*				75.2	90.6	65.2	79	0	0	0	0	116.4
970	T	23.7	Very low	25.9	Very low	113 Å²	113	158 Å²	158	69%	0.693	79%	0.788	S	S	*	*			trans	52	121.1	131.3	57.5	0	0	0	0	122
971	F	26.4	Very low	25.8	Very low	201 Å²	201	155.8 Å²	155.8	88%	0.882	78%	0.782	S	S	*	*				-175.3	103.9	122.6	-97.9	-69.1	0	0	0	107.9
972	Y	24.7	Very low	25.7	Very low	206 Å²	206	155.1 Å²	155.1	81%	0.808	78%	0.779	S	S	*	*				68	135.4	80.4	-104.8	-82.4	0	0	0	117.1
973	N	24.1	Very low	25.8	Very low	136 Å²	136	152.2 Å²	152.2	73%	0.727	77%	0.769	S	S	*	*			trans	-66	155.7	-178.1	-52.8	-73	0	0	0	113.3
974	H	29.3	Very low	26	Very low	182 Å²	182	151 Å²	151	84%	0.843	76%	0.759	S	S	*	*				-162.5	145.3	121.8	-118.3	-82.6	0	0	0	114.3
975	H	24.2	Very low	26.2	Very low	172 Å²	172	150.3 Å²	150.3	80%	0.796	75%	0.751	S	S	*	*			trans	-67.8	146.6	160.4	-102.8	-55.7	0	0	0	110.4
976	F	27.6	Very low	26.4	Very low	204 Å²	204	150.9 Å²	150.9	90%	0.895	74%	0.74	S	S	*	*				-160.2	168.3	127.4	-113.6	-73.1	0	0	0	112.1
977	H	24.8	Very low	26.7	Very low	169 Å²	169	146.9 Å²	146.9	78%	0.782	73%	0.731	S	S	*	*			trans	-139.9	115.8	-168.2	-179.2	50.7	0	0	0	111.1
978	S	28.7	Very low	26.9	Very low	109 Å²	109	147 Å²	147	76%	0.762	73%	0.728	S	S	*	*			trans	-161.9	112.1	169.4	-176.1	0	0	0	0	106.9
979	Q	24.4	Very low	26.7	Very low	151 Å²	151	147.7 Å²	147.7	71%	0.706	73%	0.726	S	S	*	*				71	118.8	73.9	-77.6	-160	1.3	0	0	115.9
980	L	23.7	Very low	27	Very low	145 Å²	145	151.8 Å²	151.8	76%	0.759	74%	0.735	S	S	*	*			trans	83.1	114.2	142.5	-64.6	166.7	0	0	0	122
981	C	25.6	Very low	27.2	Very low	95 Å²	95	153.8 Å²	153.8	64%	0.642	74%	0.741	S	S	*	*				98.1	106.5	129.9	-70.5	0	0	0	0	123.2
982	H	28.1	Very low	27.5	Very low	154 Å²	154	149.2 Å²	149.2	71%	0.713	73%	0.732	S	S	*	*				69.7	117.7	123.4	-69.3	95.7	0	0	0	123
983	N	26.7	Very low	27.8	Very low	119 Å²	119	148.9 Å²	148.9	64%	0.636	74%	0.737	S	S	*	*			trans	70.9	156.1	132.6	-64.5	17.7	0	0	0	119
984	H	30.6	Very low	28	Very low	135 Å²	135	150.6 Å²	150.6	63%	0.625	74%	0.741	S	S	*	*			cis	-154.2	143	4.7	-121.3	-44.8	0	0	0	112.7
985	H	29.2	Very low	27.9	Very low	138 Å²	138	153.1 Å²	153.1	64%	0.639	74%	0.744	S	S	*	*			trans	64.2	144.6	137.4	-81.6	-26.1	0	0	0	127.2
986	H	31.6	Very low	28.2	Very low	142 Å²	142	152.1 Å²	152.1	66%	0.657	74%	0.74	S	S	*	*			trans	71.6	147	142.7	-71	-41.5	0	0	0	121.1
987	H	30.2	Very low	28.4	Very low	142 Å²	142	150.9 Å²	150.9	66%	0.657	74%	0.737	S	S	*	*			cis	-165.7	164.5	-20.9	-131.9	-6.7	0	0	0	113.3
988	Q	27.6	Very low	28.7	Very low	141 Å²	141	149.3 Å²	149.3	66%	0.659	73%	0.729	S	S	*	*			trans	65.6	107.6	148.4	-70	168.3	10.6	0	0	124.6
989	Q	25.8	Very low	28.8	Very low	157 Å²	157	150.4 Å²	150.4	73%	0.734	72%	0.722	S	S	*	*				40.7	128.4	116.9	-60	168.8	-50.9	0	0	122.8
990	H	30.6	Very low	29	Very low	176 Å²	176	151.9 Å²	151.9	82%	0.815	73%	0.728	S	S	*	*				-179	-177.6	103	-104.5	-75.4	0	0	0	115.6
991	N	26.8	Very low	29.2	Very low	155 Å²	155	152.8 Å²	152.8	83%	0.829	73%	0.728	S	S	*	*			trans	-86.8	174.2	-155.7	-101.1	2.9	0	0	0	118.2
992	P	34.4	Very low	29.2	Very low	106 Å²	106	154 Å²	154	69%	0.688	74%	0.738	S	S	*	*			trans	-107.5	172.7	-167.3	41.9	-36.7	0	0	0	116.8
993	H	29.6	Very low	28.9	Very low	198 Å²	198	154.9 Å²	154.9	92%	0.917	74%	0.743	S	S	*	*			trans	-152.5	165.7	165.3	-95.6	-74.6	0	0	0	114.2
994	H	28	Very low	28.9	Very low	173 Å²	173	158.4 Å²	158.4	80%	0.801	76%	0.755	S	S	*	*			trans	-81.3	164.6	-176.1	-73.1	-77.9	0	0	0	115.8
995	Y	27.5	Very low	28.6	Very low	234 Å²	234	160.2 Å²	160.2	92%	0.918	76%	0.762	S	S	*	*			trans	-160.2	166.8	130.6	-102.2	-67.8	0	0	0	112.1
996	H	30.2	Very low	28.4	Very low	151 Å²	151	160 Å²	160	70%	0.699	77%	0.765	S	S	*	*			trans	-155.9	149.6	-168.4	-140.6	-18.6	0	0	0	111.2
997	H	33	Very low	28.1	Very low	179 Å²	179	161 Å²	161	83%	0.829	78%	0.775	S	S	*	*			trans	-157.9	-179.5	165.1	-105.9	-49.8	0	0	0	113.8
998	H	30.5	Very low	27.8	Very low	136 Å²	136	161.4 Å²	161.4	63%	0.63	78%	0.778	S	S	*	*			trans	-138.2	157.9	-142.2	-100.2	-106.3	0	0	0	118.4
999	H	30.2	Very low	27.7	Very low	131 Å²	131	162.6 Å²	162.6	61%	0.606	79%	0.787	S	S	*	*			trans	63	156.4	150.7	-66.1	-46	0	0	0	119.9
1000	H	29.7	Very low	27.6	Very low	182 Å²	182	163.8 Å²	163.8	84%	0.843	79%	0.787	S	S	*	*			cis	-148.7	-172.6	38.3	-112.2	-75.2	0	0	0	116.1
1001	H	26.5	Very low	27.3	Very low	164 Å²	164	165.6 Å²	165.6	76%	0.759	79%	0.788	S	S	*	*			trans	-114.1	155.6	-168.1	-109	-77.4	0	0	0	114.7
1002	S	25.6	Very low	27.3	Very low	121 Å²	121	163.8 Å²	163.8	85%	0.846	78%	0.782	S	S	*	*			trans	-155.2	141.3	149.8	58.5	0	0	0	0	111.7
1003	Q	22.9	Very low	26.9	Very low	173 Å²	173	163.7 Å²	163.7	81%	0.808	78%	0.781	S	S	*	*			trans	-116.1	152	179.6	-65.9	173.1	-42.3	0	0	111.4
1004	Q	26.9	Very low	26.7	Very low	192 Å²	192	161.5 Å²	161.5	90%	0.897	77%	0.772	S	S	*	*			trans	-155.1	148.9	149.1	-119.2	168.9	8.6	0	0	113.8
1005	F	23.9	Very low	26.6	Very low	174 Å²	174	160.7 Å²	160.7	76%	0.763	77%	0.771	S	S	*	*			trans	-67.2	154.6	-154.8	-76	-101.1	0	0	0	120.1
1006	N	24.4	Very low	26.5	Very low	134 Å²	134	154.3 Å²	154.3	72%	0.717	76%	0.756	S	S	*	*			trans	54.3	113.3	139.1	-62.1	5.9	0	0	0	121.8
1007	N	25.7	Very low	26.4	Very low	162 Å²	162	152 Å²	152	87%	0.866	75%	0.753	S	S	*	*				-165.1	114.9	105.7	-96.2	-20.4	0	0	0	110
1008	E	24.5	Very low	26.1	Very low	151 Å²	151	153.7 Å²	153.7	71%	0.706	75%	0.754	S	S	*	*			trans	-84.4	121.8	177	-64	-170.3	161.2	0	0	110.8	Y1010	E1008-Y1010 HydrophobicContact CB-CD2 4.31Å; E1008-Y1010 HydrophobicContact CB-CE2 3.74Å; E1008-Y1010 WeakPolarHBondContact OE2-CE2 3.47Å; E1008-Y1010 VanDerWaalsContact OE2-CZ 3.3Å; E1008-Y1010 PolarHBondContact OE2-OH 3.39Å
1009	L	24.3	Very low	25.9	Very low	165 Å²	165	155.8 Å²	155.8	86%	0.864	76%	0.761	S	S	*	*			trans	-114.9	101	173.7	-142.5	98	0	0	0	109.7	Y1011	L1009-Y1011 PolarHBondContact O-N 3.45Å
1010	Y	25.1	Very low	26.1	Very low	183 Å²	183	155 Å²	155	72%	0.718	77%	0.768	S	S	*	*			trans	-76	112.3	-179.9	-71.7	-95.9	0	0	0	110.6	E1008 V1012	E1008-Y1010 HydrophobicContact CB-CD2 4.31Å; E1008-Y1010 HydrophobicContact CB-CE2 3.74Å; E1008-Y1010 WeakPolarHBondContact OE2-CE2 3.47Å; E1008-Y1010 VanDerWaalsContact OE2-CZ 3.3Å; E1008-Y1010 PolarHBondContact OE2-OH 3.39Å; Y1010-V1012 PolarHBondContact O-N 2.68Å
1011	Y	24.3	Very low	26.1	Very low	213 Å²	213	151 Å²	151	84%	0.835	77%	0.766	S	S	*	*			trans	-86.8	106.5	-179.7	-157.8	-89.1	0	0	0	111.1	L1009	L1009-Y1011 PolarHBondContact O-N 3.45Å
1012	V	25.4	Very low	26.3	Very low	118 Å²	118	149.2 Å²	149.2	72%	0.715	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-86.4	120	175.5	-178.7	0	0	0	0	109.3	Y1010 Q1014	Y1010-V1012 PolarHBondContact O-N 2.68Å; V1012-Q1014 PolarHBondContact O-N 3.43Å
1013	P	26.4	Very low	26.6	Very low	103 Å²	103	152.9 Å²	152.9	67%	0.669	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-68.3	120.2	178.1	27.4	-33.3	0	0	0	110.6	I1015	P1013-I1015 PolarHBondContact O-N 2.92Å
1014	Q	24.9	Very low	26.8	Very low	153 Å²	153	153.7 Å²	153.7	72%	0.715	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-73	119.3	173.7	-73.3	-175.3	-25.8	0	0	110.4	V1012 V1016	V1012-Q1014 PolarHBondContact O-N 3.43Å; Q1014-V1016 PolarHBondContact O-N 3.32Å
1015	I	27	Very low	26.9	Very low	155 Å²	155	153 Å²	153	80%	0.795	77%	0.765	S	S	*	*			trans	-76.9	111	171.6	-58.8	174.5	0	0	0	108	P1013 T1017	P1013-I1015 PolarHBondContact O-N 2.92Å; I1015-T1017 HydrophobicContact CG2-CG2 4.32Å
1016	V	25.7	Very low	27.1	Very low	100 Å²	100	151.4 Å²	151.4	61%	0.606	76%	0.763	S	S	*	*			trans	-94.5	103.8	175.9	-178.4	0	0	0	0	109.4	Q1014 Y1018	Q1014-V1016 PolarHBondContact O-N 3.32Å; V1016-Y1018 HydrophobicContact CG1-CD2 4.13Å; V1016-Y1018 HydrophobicContact CG1-CE2 3.73Å
1017	T	26.6	Very low	27	Very low	103 Å²	103	150.7 Å²	150.7	63%	0.632	77%	0.769	S	S	*	*			trans	-90.2	115.3	173.7	37.7	0	0	0	0	111.2	I1015	I1015-T1017 HydrophobicContact CG2-CG2 4.32Å
1018	Y	26.5	Very low	27.1	Very low	214 Å²	214	149.7 Å²	149.7	84%	0.839	76%	0.762	S	S	*	*			trans	-85.5	124.2	171	-75.8	-91.2	0	0	0	110.6	V1016	V1016-Y1018 HydrophobicContact CG1-CD2 4.13Å; V1016-Y1018 HydrophobicContact CG1-CE2 3.73Å
1019	F	27.9	Very low	27.3	Very low	180 Å²	180	147.4 Å²	147.4	79%	0.789	76%	0.764	S	S	*	*			trans	-110.1	125.1	164.7	-72.7	-86.1	0	0	0	109.1	A1021	F1019-A1021 PolarHBondContact O-N 2.89Å
1020	P	33.1	Very low	27.5	Very low	116 Å²	116	145.3 Å²	145.3	75%	0.753	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-71.4	122.9	169.2	29.3	-31.7	0	0	0	109.3
1021	A	29.7	Very low	27.7	Very low	96 Å²	96	144.4 Å²	144.4	79%	0.793	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-79.5	133.7	173.1	0	0	0	0	0	110.2	F1019 E1023	F1019-A1021 PolarHBondContact O-N 2.89Å; A1021-E1023 PolarHBondContact O-N 2.63Å
1022	N	31.6	Very low	27.9	Very low	127 Å²	127	142.8 Å²	142.8	68%	0.679	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-72.3	125.4	171.6	-71.8	-21.9	0	0	0	109.8	Y1024	N1022-Y1024 HydrophobicContact CB-CD2 4.45Å; N1022-Y1024 PolarHBondContact O-N 3.32Å
1023	E	30.7	Very low	27.9	Very low	199 Å²	199	144.1 Å²	144.1	93%	0.93	77%	0.765	S	S	*	*			trans	-69.1	97.1	168	-70.7	-169.8	147.9	0	0	110.3	A1021	A1021-E1023 PolarHBondContact O-N 2.63Å
1024	Y	28.5	Very low	27.9	Very low	190 Å²	190	148.5 Å²	148.5	75%	0.745	78%	0.777	S	S	*	*			trans	-75.7	116.7	160.3	-87.8	-94.1	0	0	0	108.9	N1022 L1026	N1022-Y1024 HydrophobicContact CB-CD2 4.45Å; N1022-Y1024 PolarHBondContact O-N 3.32Å; Y1024-L1026 VanDerWaalsContact C-N 3.35Å; Y1024-L1026 PolarHBondContact O-N 3.43Å
1025	L	28.2	Very low	27.9	Very low	177 Å²	177	145.6 Å²	145.6	93%	0.927	77%	0.773	S	S	*	*			trans	-65.5	93.6	167.7	-81.3	169.4	0	0	0	109.7	S1027	L1025-S1027 PolarHBondContact O-N 3.27Å
1026	L	27.8	Very low	27.8	Very low	141 Å²	141	146.1 Å²	146.1	74%	0.738	77%	0.77	S	S	*	*			trans	-81.2	98.2	176.8	-147.9	80	0	0	0	109.4	Y1024 L1028	Y1024-L1026 VanDerWaalsContact C-N 3.35Å; Y1024-L1026 PolarHBondContact O-N 3.43Å; L1026-L1028 HydrophobicContact CD2-CD1 3.77Å; L1026-L1028 HydrophobicContact CG-CD1 4.17Å; L1026-L1028 PolarHBondContact O-N 3.38Å; L1026-L1028 VanDerWaalsContact O-N 3.11Å
1027	S	23.8	Very low	27.8	Very low	118 Å²	118	150.2 Å²	150.2	83%	0.825	78%	0.776	S	S	*	*			trans	-69.7	101.7	174.4	58.1	0	0	0	0	110.4	L1025	L1025-S1027 PolarHBondContact O-N 3.27Å
1028	L	26.7	Very low	27.8	Very low	141 Å²	141	150.3 Å²	150.3	74%	0.738	78%	0.781	S	S	*	*			trans	-151.4	97.8	-178.7	-113.8	157	0	0	0	112.7	L1026	L1026-L1028 HydrophobicContact CD2-CD1 3.77Å; L1026-L1028 HydrophobicContact CG-CD1 4.17Å; L1026-L1028 PolarHBondContact O-N 3.38Å; L1026-L1028 VanDerWaalsContact O-N 3.11Å
1029	S	28.6	Very low	27.7	Very low	104 Å²	104	147.5 Å²	147.5	73%	0.727	78%	0.779	S	S	*	*				-173.4	125.8	125.8	45.4	0	0	0	0	112.2
1030	T	29.7	Very low	27.5	Very low	121 Å²	121	144 Å²	144	74%	0.742	77%	0.774	S	S	*	*			trans	30.5	117.1	145.4	57.1	0	0	0	0	118.4
1031	N	28.8	Very low	27.2	Very low	163 Å²	163	147 Å²	147	87%	0.872	78%	0.778	S	S	*	*				-155.8	169.4	67.8	-120.6	-29.9	0	0	0	115.1
1032	K	27.5	Very low	27	Very low	180 Å²	180	147.1 Å²	147.1	78%	0.783	77%	0.773	S	S	*	*			trans	-91.9	155.1	178.7	-65.4	177.7	180	175	0	111.8
1033	N	26.4	Very low	26.7	Very low	145 Å²	145	146.6 Å²	146.6	78%	0.775	78%	0.775	S	S	*	*			trans	51.7	99.5	156.4	-55.1	-6.4	0	0	0	117.4
1034	Q	26.9	Very low	26.6	Very low	196 Å²	196	144.3 Å²	144.3	92%	0.916	77%	0.768	S	S	*	*				-170.9	154.7	107.8	-102.5	165.9	-2.8	0	0	114.6
1035	S	25.2	Very low	26.6	Very low	91 Å²	91	140.1 Å²	140.1	64%	0.636	76%	0.763	S	S	*	*			trans	-57.5	134.1	-174.9	42.2	0	0	0	0	118.7
1036	F	24	Very low	26.6	Very low	166 Å²	166	137 Å²	137	73%	0.728	75%	0.748	S	S	*	*				76.7	133.1	126.7	-80.6	-60.2	0	0	0	124.2
1037	Y	25.8	Very low	26.8	Very low	187 Å²	187	137.1 Å²	137.1	73%	0.733	74%	0.744	S	S	*	*			trans	77.6	128	144.1	-72.1	-54.6	0	0	0	122.8
1038	S	25.9	Very low	27.2	Very low	105 Å²	105	137.4 Å²	137.4	73%	0.734	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-53.9	128.6	153.5	47.8	0	0	0	0	112.3
1039	I	25.8	Very low	27.4	Very low	155 Å²	155	136 Å²	136	80%	0.795	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-78.7	135.6	176	-64.1	163.6	0	0	0	110.8
1040	P	23.2	Very low	27.5	Very low	105 Å²	105	134.9 Å²	134.9	68%	0.682	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-103.2	133.3	135.8	33.4	-27.9	0	0	0	109.8
1041	Q	26.1	Very low	27.6	Very low	179 Å²	179	134.1 Å²	134.1	84%	0.836	71%	0.706	S	S	*	*			trans	36.2	116.1	157.2	-64.3	164.4	-37.5	0	0	117
1042	S	25	Very low	27.7	Very low	100 Å²	100	131 Å²	131	70%	0.699	69%	0.692	S	S	*	*				179.3	164.4	63.1	37.8	0	0	0	0	111.9
1043	T	27.2	Very low	27.7	Very low	116 Å²	116	127.6 Å²	127.6	71%	0.712	69%	0.687	S	S	*	*			trans	59	114	166.4	44.3	0	0	0	0	117.1
1044	I	26.9	Very low	27.7	Very low	151 Å²	151	129.9 Å²	129.9	77%	0.774	69%	0.686	S	S	*	*				64.5	123.8	55.6	-56.6	167.2	0	0	0	110.2
1045	P	29	Very low	27.5	Very low	101 Å²	101	126.9 Å²	126.9	66%	0.656	68%	0.676	S	S	*	*			cis	-125.6	-154.9	-13.9	37	-14.8	0	0	0	109.9
1046	D	28.3	Very low	27.6	Very low	113 Å²	113	127.9 Å²	127.9	60%	0.604	68%	0.679	S	S	*	*			cis	-163.4	163.4	21.9	-135.6	-17.8	0	0	0	115.3
1047	H	31.8	Very low	27.6	Very low	142 Å²	142	125.7 Å²	125.7	66%	0.657	68%	0.679	S	S	*	*			trans	65.7	113.5	149.7	-75.6	10.1	0	0	0	118.7
1048	I	32.4	Very low	27.5	Very low	124 Å²	124	121.1 Å²	121.1	64%	0.636	67%	0.671	S	S	*	*				88.7	128.7	77	-85.5	175.3	0	0	0	110.7
1049	N	31	Very low	27.6	Very low	113 Å²	113	118.5 Å²	118.5	60%	0.604	65%	0.649	S	S	*	*			cis	-169.8	-172.8	-11.4	-133.1	30.9	0	0	0	109.9
1050	N	31.3	Very low	27.6	Very low	80 Å²	80	112.9 Å²	112.9	43%	0.428	62%	0.622	S	S	.	*			trans	69.7	141.9	148.9	-67.7	6.2	0	0	0	118.4	E828	E828-N1050 PolarHBondContact OE2-ND2 3.34Å
1051	D	31.7	Very low	27.7	Very low	105 Å²	105	111.9 Å²	111.9	56%	0.561	61%	0.614	S	S	*	*			cis	-156.7	175.2	-11.2	-130.7	-37.5	0	0	0	114.7
1052	T	30.9	Very low	27.7	Very low	96 Å²	96	109.1 Å²	109.1	59%	0.589	61%	0.605	S	S	*	*			trans	36.4	113.4	156.4	58.1	0	0	0	0	119.5
1053	T	26.1	Very low	27.7	Very low	109 Å²	109	110.6 Å²	110.6	67%	0.669	60%	0.604	S	S	*	*				72.5	146.6	60.6	71.6	0	0	0	0	117.1
1054	Y	26.7	Very low	27.8	Very low	194 Å²	194	113.3 Å²	113.3	76%	0.761	61%	0.613	S	S	*	*			trans	75.8	102.3	161.9	-59.9	-57.9	0	0	0	122.5
1055	N	24.2	Very low	27.7	Very low	132 Å²	132	110 Å²	110	71%	0.706	60%	0.603	S	S	*	*				87	154.2	115.9	-71.9	-10.8	0	0	0	122.9
1056	T	25.7	Very low	27.7	Very low	112 Å²	112	113 Å²	113	69%	0.687	61%	0.613	S	S	*	*			trans	68	82.5	148.8	38.2	0	0	0	0	119.9
1057	T	23.7	Very low	27.7	Very low	120 Å²	120	114.6 Å²	114.6	74%	0.736	62%	0.615	S	S	*	*				72	164.8	123.2	52	0	0	0	0	120.2
1058	T	25.6	Very low	27.7	Very low	92 Å²	92	115.2 Å²	115.2	56%	0.564	62%	0.622	S	S	*	*			trans	91.1	121.8	156.2	90.3	0	0	0	0	117.6
1059	N	27.2	Very low	27.6	Very low	50 Å²	50	113.9 Å²	113.9	27%	0.267	62%	0.622	S	S	.	*				102.9	164	125.6	-63.2	-16.9	0	0	0	124.4	N846 S847 F848	N846-N1059 VanDerWaalsContact C-ND2 3.31Å; N846-N1059 HydrophobicContact CB-CB 3.56Å; N846-N1059 WeakPolarHBondContact CB-ND2 3.3Å; N846-N1059 PolarHBondContact O-ND2 3.34Å; S847-N1059 VanDerWaalsContact CA-CG 3.41Å; S847-N1059 WeakPolarHBondContact CA-OD1 3.35Å; F848-N1059 VanDerWaalsContact CB-C 3.48Å; F848-N1059 VanDerWaalsContact CD2-O 3.31Å; F848-N1059 WeakPolarHBondContact CD2-O 3.46Å; F848-N1059 PolarHBondContact N-OD1 3.47Å
1060	T	25.3	Very low	27.5	Very low	37 Å²	37	115.2 Å²	115.2	23%	0.227	62%	0.624	C	S	.	*			trans	-55.4	160	177.9	37.1	0	0	0	0	112.8	S847 F848	S847-T1060 VanDerWaalsContact C-OG1 3.26Å; S847-T1060 PolarHBondContact N-OG1 3.42Å; S847-T1060 WeakPolarHBondContact O-CG2 3.21Å; F848-T1060 HydrophobicContact CB-CG2 3.92Å; F848-T1060 VanDerWaalsContact CB-N 3.28Å; F848-T1060 HydrophobicContact CD1-CG2 3.25Å; F848-T1060 HydrophobicContact CD2-CG2 4.23Å; F848-T1060 HydrophobicContact CE1-CG2 3.76Å; F848-T1060 VanDerWaalsContact CG-CA 3.43Å; F848-T1060 HydrophobicContact CG-CG2 3.48Å; F848-T1060 VanDerWaalsContact CG-CG2 3.48Å; F848-T1060 HydrophobicContact CZ-CG2 4.42Å; F848-T1060 VanDerWaalsContact N-N 3.14Å
1061	T	25.8	Very low	27.4	Very low	84 Å²	84	119.2 Å²	119.2	52%	0.515	63%	0.634	S	S	.	*			cis	-156.4	-176.4	25.1	-17.3	0	0	0	0	110.9
1062	N	26.4	Very low	27.3	Very low	121 Å²	121	120.3 Å²	120.3	65%	0.647	64%	0.636	S	S	*	*			trans	54.4	125.1	139	-67	-15.8	0	0	0	121.8
1063	I	25.6	Very low	27.1	Very low	131 Å²	131	119.5 Å²	119.5	67%	0.672	64%	0.639	S	S	*	*				49.7	112.5	124	-52.8	157.5	0	0	0	117.5
1064	L	28.2	Very low	27.2	Very low	172 Å²	172	122.2 Å²	122.2	90%	0.901	64%	0.641	S	S	*	*				-137.7	141	122.6	-143.7	73.2	0	0	0	110.6	N1066	L1064-N1066 PolarHBondContact O-N 3.48Å
1065	S	25.8	Very low	27.3	Very low	83 Å²	83	119.2 Å²	119.2	58%	0.58	64%	0.637	S	S	*	*			trans	-90.9	107	-169	-56	0	0	0	0	112.9	K1067	S1065-K1067 PolarHBondContact O-N 3.41Å
1066	N	28.7	Very low	27.5	Very low	162 Å²	162	119.3 Å²	119.3	87%	0.866	64%	0.637	S	S	*	*			trans	-71.6	79	155.3	-77.8	4.8	0	0	0	109.1	L1064 L1068	L1064-N1066 PolarHBondContact O-N 3.48Å; N1066-L1068 PolarHBondContact O-N 2.87Å; N1066-L1068 VanDerWaalsContact O-N 3.16Å
1067	K	28.6	Very low	27.7	Very low	148 Å²	148	120.8 Å²	120.8	64%	0.643	64%	0.64	S	S	*	*			trans	-61.5	112.6	170	-68.6	-175.4	-178.5	-177.6	0	108.1	S1065 Y1101	S1065-K1067 PolarHBondContact O-N 3.41Å; K1067-Y1101 PolarHBondContact NZ-OH 3.26Å
1068	L	30.2	Very low	28.1	Very low	154 Å²	154	121 Å²	121	81%	0.806	64%	0.643	S	S	*	*			trans	-58.9	132.9	162.4	-77.9	92.6	0	0	0	108.3	N1066 H1070	N1066-L1068 PolarHBondContact O-N 2.87Å; N1066-L1068 VanDerWaalsContact O-N 3.16Å; L1068-H1070 PolarHBondContact O-N 3.16Å; L1068-H1070 VanDerWaalsContact O-N 3.15Å
1069	P	30.2	Very low	28.2	Very low	97 Å²	97	125.6 Å²	125.6	63%	0.63	66%	0.658	S	S	*	*			trans	-66.7	114.7	176.9	26.5	-32.8	0	0	0	109.4	Y1071	P1069-Y1071 HydrophobicContact CB-CE2 4.06Å; P1069-Y1071 HydrophobicContact CG-CE2 4.14Å; P1069-Y1071 WeakPolarHBondContact O-CD2 3.5Å
1070	H	30.6	Very low	28.4	Very low	140 Å²	140	130.3 Å²	130.3	65%	0.648	68%	0.684	S	S	*	*			trans	-84.3	130.2	171.7	61.5	-87.7	0	0	0	109.3	L1068 H1072	L1068-H1070 PolarHBondContact O-N 3.16Å; L1068-H1070 VanDerWaalsContact O-N 3.15Å; H1070-H1072 AromaticContact CD2-CE1 3.42Å; H1070-H1072 PolarHBondContact CD2-CE1 2.99Å; H1070-H1072 VanDerWaalsContact CD2-CE1 3.42Å; H1070-H1072 AromaticContact CD2-ND1 3.91Å; H1070-H1072 AromaticContact CD2-NE2 3.55Å; H1070-H1072 AromaticContact NE2-CE1 3.47Å; H1070-H1072 PolarHBondContact NE2-CE1 3.11Å; H1070-H1072 AromaticContact NE2-NE2 3.98Å
1071	Y	27.8	Very low	28.4	Very low	164 Å²	164	136.4 Å²	136.4	64%	0.643	72%	0.715	S	S	*	*			trans	-103.4	113.1	175.8	-67.9	-91.2	0	0	0	109	P1069 A1073	P1069-Y1071 HydrophobicContact CB-CE2 4.06Å; P1069-Y1071 HydrophobicContact CG-CE2 4.14Å; P1069-Y1071 WeakPolarHBondContact O-CD2 3.5Å; Y1071-A1073 PolarHBondContact O-N 2.91Å; Y1071-A1073 VanDerWaalsContact O-N 3.16Å
1072	H	30.1	Very low	28.5	Very low	128 Å²	128	137.2 Å²	137.2	59%	0.593	72%	0.724	S	S	*	*			trans	-75.5	103.1	175.5	-72.7	136.3	0	0	0	110.6	H1070 K1074	H1070-H1072 AromaticContact CD2-CE1 3.42Å; H1070-H1072 PolarHBondContact CD2-CE1 2.99Å; H1070-H1072 VanDerWaalsContact CD2-CE1 3.42Å; H1070-H1072 AromaticContact CD2-ND1 3.91Å; H1070-H1072 AromaticContact CD2-NE2 3.55Å; H1070-H1072 AromaticContact NE2-CE1 3.47Å; H1070-H1072 PolarHBondContact NE2-CE1 3.11Å; H1070-H1072 AromaticContact NE2-NE2 3.98Å; H1072-K1074 PolarHBondContact O-N 3.24Å
1073	A	27.6	Very low	28.6	Very low	79 Å²	79	138.8 Å²	138.8	65%	0.653	73%	0.731	S	S	*	*			trans	-70.2	79	169.4	0	0	0	0	0	110.7	Y1071 I1075	Y1071-A1073 PolarHBondContact O-N 2.91Å; Y1071-A1073 VanDerWaalsContact O-N 3.16Å; A1073-I1075 PolarHBondContact O-N 3.19Å
1074	K	28.2	Very low	28.5	Very low	166 Å²	166	140 Å²	140	72%	0.722	73%	0.734	S	S	*	*			trans	-76.3	108	177.1	-172	177.9	-177.1	-178.8	0	110.2	H1072 L1076	H1072-K1074 PolarHBondContact O-N 3.24Å; K1074-L1076 HydrophobicContact CD-CD2 4.08Å; K1074-L1076 HydrophobicContact CG-CD2 4.41Å; K1074-L1076 HydrophobicContact CG-CG 4.47Å; K1074-L1076 PolarHBondContact O-N 2.98Å
1075	I	28.5	Very low	28.6	Very low	131 Å²	131	136.1 Å²	136.1	67%	0.672	73%	0.726	S	S	*	*			trans	-68	99.8	167.9	-55.6	177.7	0	0	0	108.1	A1073 L1077	A1073-I1075 PolarHBondContact O-N 3.19Å; I1075-L1077 HydrophobicContact CG2-CD2 4.31Å; I1075-L1077 HydrophobicContact CG2-CG 4.19Å; I1075-L1077 PolarHBondContact O-N 2.88Å
1076	L	28.5	Very low	28.7	Very low	134 Å²	134	137.8 Å²	137.8	70%	0.702	73%	0.733	S	S	*	*			trans	-78.5	92.1	167	-71.3	170.3	0	0	0	108.5	K1074	K1074-L1076 HydrophobicContact CD-CD2 4.08Å; K1074-L1076 HydrophobicContact CG-CD2 4.41Å; K1074-L1076 HydrophobicContact CG-CG 4.47Å; K1074-L1076 PolarHBondContact O-N 2.98Å
1077	L	29.3	Very low	28.6	Very low	143 Å²	143	135.4 Å²	135.4	75%	0.749	72%	0.72	S	S	*	*			trans	-68.6	127.6	160.4	-69	173.3	0	0	0	108.1	I1075 Q1079	I1075-L1077 HydrophobicContact CG2-CD2 4.31Å; I1075-L1077 HydrophobicContact CG2-CG 4.19Å; I1075-L1077 PolarHBondContact O-N 2.88Å; L1077-Q1079 PolarHBondContact O-N 3.2Å; L1077-Q1079 VanDerWaalsContact O-N 3.09Å
1078	P	31.9	Very low	28.6	Very low	125 Å²	125	134.8 Å²	134.8	81%	0.812	72%	0.724	S	S	*	*			trans	-63.6	112	174.4	-22.1	34	0	0	0	110.7	D1080	P1078-D1080 PolarHBondContact O-N 2.86Å
1079	Q	27.3	Very low	28.4	Very low	188 Å²	188	131.3 Å²	131.3	88%	0.879	73%	0.726	S	S	*	*			trans	-81.9	98.3	153.6	-68.2	-176.7	-61.8	0	0	106.9	L1077	L1077-Q1079 PolarHBondContact O-N 3.2Å; L1077-Q1079 VanDerWaalsContact O-N 3.09Å
1080	D	31.5	Very low	28.4	Very low	149 Å²	149	133.9 Å²	133.9	80%	0.797	73%	0.734	S	S	*	*			trans	-173.1	157.9	137.3	-99.7	-31.5	0	0	0	112.5	P1078 S1082	P1078-D1080 PolarHBondContact O-N 2.86Å; D1080-S1082 PolarHBondContact O-N 2.91Å
1081	N	25.2	Very low	28.2	Very low	165 Å²	165	132.1 Å²	132.1	88%	0.882	73%	0.728	S	S	*	*			trans	-96.3	90.7	-165	-62.1	-74.5	0	0	0	113.2
1082	S	27.8	Very low	28.2	Very low	101 Å²	101	135.3 Å²	135.3	71%	0.706	74%	0.739	S	S	*	*			trans	-158.9	117.2	161.9	61.3	0	0	0	0	116.1	D1080	D1080-S1082 PolarHBondContact O-N 2.91Å
1083	I	28.5	Very low	28.2	Very low	154 Å²	154	134.8 Å²	134.8	79%	0.79	73%	0.733	S	S	*	*			trans	58.2	100.4	134.3	-52.1	172.5	0	0	0	118.5
1084	E	24.6	Very low	28.2	Very low	158 Å²	158	141.4 Å²	141.4	74%	0.738	74%	0.743	S	S	*	*			trans	7.7	115.5	134.1	-53.5	179.3	138.3	0	0	119.5
1085	A	30.1	Very low	28.3	Very low	89 Å²	89	139.6 Å²	139.6	74%	0.736	75%	0.745	S	S	*	*			trans	-173.2	86.1	141.1	0	0	0	0	0	114
1086	T	27.5	Very low	28.2	Very low	118 Å²	118	135.9 Å²	135.9	72%	0.724	74%	0.739	S	S	*	*				42.9	141.2	129.7	62.8	0	0	0	0	124.1
1087	N	27.9	Very low	28.3	Very low	112 Å²	112	134.2 Å²	134.2	60%	0.599	74%	0.735	S	S	*	*			trans	96	109.4	147.2	-60.1	-33	0	0	0	120.6	K300	K300-N1087 PolarHBondContact NZ-OD1 2.87Å
1088	N	27.2	Very low	28.2	Very low	135 Å²	135	132.7 Å²	132.7	72%	0.722	73%	0.733	S	S	*	*			trans	55.7	103.5	136.6	-65.5	20.7	0	0	0	119.9	K300	K300-N1088 PolarHBondContact NZ-OD1 2.96Å
1089	G	26.4	Very low	28.2	Very low	82 Å²	82	131.6 Å²	131.6	85%	0.845	73%	0.727	S	S	*	*			trans	80.4	76.4	139.9	0	0	0	0	0	115.5
1090	D	30	Very low	28.4	Very low	150 Å²	150	128.8 Å²	128.8	80%	0.802	73%	0.727	S	S	*	*			trans	-135.6	145.1	167.5	-128.1	-36.4	0	0	0	112.7
1091	I	26.9	Very low	28.2	Very low	104 Å²	104	130.5 Å²	130.5	53%	0.533	72%	0.723	S	S	.	*			trans	-85.5	121.8	-171.7	-65.2	168.8	0	0	0	108.8	Y1093	I1091-Y1093 HydrophobicContact CB-CE1 4.35Å; I1091-Y1093 HydrophobicContact CB-CE2 4.18Å; I1091-Y1093 HydrophobicContact CG2-CD1 4.12Å; I1091-Y1093 HydrophobicContact CG2-CE1 3.84Å; I1091-Y1093 HydrophobicContact CG2-CE2 4.38Å; I1091-Y1093 WeakPolarHBondContact O-CD2 3.28Å; I1091-Y1093 WeakPolarHBondContact O-CE2 3.34Å; I1091-Y1093 PolarHBondContact O-N 3.43Å
1092	R	28	Very low	28.5	Very low	230 Å²	230	128.3 Å²	128.3	87%	0.868	72%	0.718	S	S	*	*			trans	-80.2	89.4	175.7	-65.2	-168.1	-172.8	-169.3	3.1	110.6
1093	Y	29.6	Very low	28.4	Very low	118 Å²	118	129.8 Å²	129.8	46%	0.463	72%	0.723	S	S	.	*			trans	-61.1	138.9	173.9	-57.6	-77.1	0	0	0	112	I1091 P1145	I1091-Y1093 HydrophobicContact CB-CE1 4.35Å; I1091-Y1093 HydrophobicContact CB-CE2 4.18Å; I1091-Y1093 HydrophobicContact CG2-CD1 4.12Å; I1091-Y1093 HydrophobicContact CG2-CE1 3.84Å; I1091-Y1093 HydrophobicContact CG2-CE2 4.38Å; I1091-Y1093 WeakPolarHBondContact O-CD2 3.28Å; I1091-Y1093 WeakPolarHBondContact O-CE2 3.34Å; I1091-Y1093 PolarHBondContact O-N 3.43Å; Y1093-P1145 HydrophobicContact CD1-CG 3.45Å; Y1093-P1145 VanDerWaalsContact CD1-CG 3.45Å; Y1093-P1145 HydrophobicContact CE1-CG 3.72Å; Y1093-P1145 HydrophobicContact CG-CG 4.31Å
1094	Y	27	Very low	28.5	Very low	218 Å²	218	129.5 Å²	129.5	86%	0.855	72%	0.723	S	S	*	*			trans	-96	124.8	170.9	-73.8	-95.3	0	0	0	109.7
1095	V	29.7	Very low	28.6	Very low	127 Å²	127	127 Å²	127	77%	0.77	72%	0.719	S	S	*	*			trans	-119.3	114.2	173.7	-179	0	0	0	0	108.7	V1097	V1095-V1097 HydrophobicContact CG1-CG2 4.4Å
1096	G	26.4	Very low	28.3	Very low	54 Å²	54	129.2 Å²	129.2	56%	0.557	72%	0.717	S	S	*	*			trans	-83.4	122.8	174.6	0	0	0	0	0	110.9
1097	V	31.7	Very low	28.2	Very low	99 Å²	99	133.5 Å²	133.5	60%	0.6	72%	0.721	S	S	*	*			trans	-109.4	128.3	179.3	-177.5	0	0	0	0	109.7	V1095	V1095-V1097 HydrophobicContact CG1-CG2 4.4Å
1098	P	28	Very low	28.1	Very low	110 Å²	110	132.1 Å²	132.1	71%	0.714	72%	0.721	S	S	*	*			trans	-69.2	141.8	177.7	29	-34.7	0	0	0	111.4
1099	C	31.5	Very low	28.1	Very low	102 Å²	102	134 Å²	134	69%	0.689	72%	0.723	S	S	*	*			trans	-108.9	139.4	177.2	-67.4	0	0	0	0	110.8
1100	C	30.9	Very low	28.2	Very low	129 Å²	129	139.9 Å²	139.9	87%	0.872	72%	0.721	S	S	*	*	P	Polyproline II helix	trans	-87	165	-166.9	-58.6	0	0	0	0	115
1101	Y	27.2	Very low	27.9	Very low	185 Å²	185	138 Å²	138	73%	0.725	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-76.2	165.6	168.4	-86.6	-89.5	0	0	0	111.9	K1067	K1067-Y1101 PolarHBondContact NZ-OH 3.26Å
1102	P	31.7	Very low	28.2	Very low	120 Å²	120	138 Å²	138	78%	0.779	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-86.3	165.6	-148.3	33.1	-37.9	0	0	0	116.8
1103	T	25.5	Very low	28.1	Very low	132 Å²	132	136.8 Å²	136.8	81%	0.81	72%	0.723	S	S	*	*	P	Polyproline II helix	trans	-80.9	146	176.3	45.7	0	0	0	0	113.4
1104	N	30.1	Very low	27.9	Very low	147 Å²	147	137 Å²	137	79%	0.786	73%	0.732	S	S	*	*			trans	-156.4	109.2	142.1	-113.9	-17.3	0	0	0	114.7
1105	T	27.4	Very low	28	Very low	107 Å²	107	132 Å²	132	66%	0.656	72%	0.721	S	S	*	*			trans	50.9	124	131.1	45.3	0	0	0	0	123.7
1106	I	24.4	Very low	28	Very low	135 Å²	135	131.5 Å²	131.5	69%	0.692	71%	0.713	S	S	*	*				103.7	106.3	125	-77.6	170.2	0	0	0	120.9
1107	Y	25.5	Very low	28.1	Very low	207 Å²	207	135.3 Å²	135.3	81%	0.812	72%	0.721	S	S	*	*			trans	69.2	148.1	145.6	-76.3	-129.5	0	0	0	120.1
1108	S	25	Very low	28.1	Very low	84 Å²	84	135.5 Å²	135.5	59%	0.587	72%	0.723	S	S	*	*			cis	-168.1	166.7	-23.1	67.1	0	0	0	0	112.6
1109	K	27.2	Very low	28.3	Very low	174 Å²	174	136.6 Å²	136.6	76%	0.757	72%	0.722	S	S	*	*			trans	76.5	117.3	149.7	-75.7	177.4	-179.5	177.4	0	121.5
1110	Y	27.7	Very low	28.4	Very low	205 Å²	205	137 Å²	137	80%	0.804	72%	0.718	S	S	*	*			trans	54.9	108	140.8	-64	-71.5	0	0	0	122.6
1111	S	24.8	Very low	28.6	Very low	111 Å²	111	136.7 Å²	136.7	78%	0.776	71%	0.707	S	S	*	*				63.8	174.9	107.7	-119.1	0	0	0	0	118.9
1112	P	33.6	Very low	28.8	Very low	105 Å²	105	134.2 Å²	134.2	68%	0.682	71%	0.707	S	S	*	*				-129.3	-170.7	-116.1	37.7	-16.9	0	0	0	115.6
1113	Y	24.5	Very low	28.9	Very low	203 Å²	203	133.8 Å²	133.8	80%	0.796	70%	0.702	S	S	*	*			trans	83.8	127.8	160.5	-103	-93.9	0	0	0	119.8
1114	N	26.7	Very low	29	Very low	122 Å²	122	131.7 Å²	131.7	65%	0.652	69%	0.692	S	S	*	*			trans	53.9	140.6	147.4	-84.7	18.3	0	0	0	118.7
1115	N	27.4	Very low	29	Very low	115 Å²	115	131.2 Å²	131.2	62%	0.615	69%	0.69	S	S	*	*			cis	175.8	166.9	29.7	-128.7	2.9	0	0	0	109.8
1116	N	30	Very low	29.2	Very low	116 Å²	116	131 Å²	131	62%	0.62	69%	0.688	S	S	*	*			trans	72.2	113.8	145	-64.3	-4.4	0	0	0	121.1
1117	N	29.1	Very low	29.4	Very low	134 Å²	134	130.8 Å²	130.8	72%	0.717	69%	0.688	S	S	*	*				81	143.1	123.8	-65.6	0.2	0	0	0	118.2
1118	T	32.6	Very low	29.6	Very low	103 Å²	103	126.6 Å²	126.6	63%	0.632	68%	0.68	S	S	*	*			cis	-159.5	153.7	4.9	1.4	0	0	0	0	111.3
1119	N	32	Very low	29.8	Very low	133 Å²	133	127.7 Å²	127.7	71%	0.711	68%	0.679	S	S	*	*			trans	68.3	149.6	148	-65.4	-6.2	0	0	0	117.9
1120	N	33.5	Very low	29.9	Very low	111 Å²	111	125.3 Å²	125.3	59%	0.594	68%	0.675	S	S	*	*			cis	-159.2	145.4	2.5	-120.4	1.4	0	0	0	110.9
1121	N	34.5	Very low	30	Very low	122 Å²	122	120.6 Å²	120.6	65%	0.652	67%	0.668	S	S	*	*			trans	64.5	163.1	148	-56.4	-11.8	0	0	0	117.2
1122	N	31.7	Very low	30.1	Very low	133 Å²	133	121.5 Å²	121.5	71%	0.711	66%	0.663	S	S	*	*			cis	-163.3	153.9	-18.8	-103.9	0.3	0	0	0	108.1
1123	V	33.3	Very low	29.8	Very low	111 Å²	111	124.9 Å²	124.9	67%	0.673	67%	0.669	S	S	*	*			cis	-161.3	122.1	-13.3	60.2	0	0	0	0	112.1
1124	S	28.6	Very low	30.1	Very low	87 Å²	87	121 Å²	121	61%	0.608	67%	0.667	S	S	*	*			trans	69.8	160.5	146.2	77.9	0	0	0	0	123.5
1125	N	29.9	Very low	30	Very low	137 Å²	137	125.7 Å²	125.7	73%	0.733	68%	0.676	S	S	*	*			trans	74.8	134.1	148.4	-65.2	-6.8	0	0	0	118.8
1126	T	30.6	Very low	30.1	Very low	102 Å²	102	127 Å²	127	63%	0.626	68%	0.682	S	S	*	*			cis	-164.6	159.1	-9	16.2	0	0	0	0	109.4
1127	N	29.2	Very low	30	Very low	131 Å²	131	128.3 Å²	128.3	70%	0.701	69%	0.69	S	S	*	*			trans	41.4	140.1	134.1	-56.2	18.5	0	0	0	119.3
1128	N	30.4	Very low	29.7	Very low	119 Å²	119	130.2 Å²	130.2	64%	0.636	70%	0.699	S	S	*	*			cis	-173.4	178.5	11.1	-107.7	21.7	0	0	0	104.3
1129	D	29	Very low	29.4	Very low	107 Å²	107	132.3 Å²	132.3	57%	0.572	71%	0.705	S	S	*	*			cis	-167	159.6	0.2	-117.8	-19.1	0	0	0	106.7
1130	N	29.2	Very low	29	Very low	124 Å²	124	131.3 Å²	131.3	66%	0.663	70%	0.704	S	S	*	*			trans	58.4	145	146.1	-61.2	-29.5	0	0	0	119.5
1131	T	29.5	Very low	28.6	Very low	107 Å²	107	137.1 Å²	137.1	66%	0.656	72%	0.72	S	S	*	*			cis	-157.5	141.4	1.4	18.9	0	0	0	0	104.9
1132	I	25.8	Very low	28.1	Very low	130 Å²	130	137.2 Å²	137.2	67%	0.667	73%	0.728	S	S	*	*				51	108.6	78.7	-54.4	169.6	0	0	0	108.2
1133	E	28.3	Very low	27.8	Very low	175 Å²	175	134.2 Å²	134.2	82%	0.818	73%	0.729	S	S	*	*				-172.4	169.9	55.8	-122.2	147.7	-142.5	0	0	106.8
1134	T	30.8	Very low	27.4	Very low	122 Å²	122	136.9 Å²	136.9	75%	0.748	73%	0.734	S	S	*	*			cis	-127.3	-178.5	7.8	57.1	0	0	0	0	111.4
1135	R	25	Very low	27.2	Very low	221 Å²	221	136.4 Å²	136.4	83%	0.834	73%	0.729	S	S	*	*			trans	-96.5	-156.8	168.1	-64.6	165.5	67.7	111.5	-4.3	109.5
1136	D	28.9	Very low	27.1	Very low	142 Å²	142	139.9 Å²	139.9	76%	0.759	74%	0.738	S	S	*	*			trans	84.7	117	172.1	-43	-12.2	0	0	0	113.1
1137	D	28	Very low	26.9	Very low	144 Å²	144	139.8 Å²	139.8	77%	0.77	73%	0.732	S	S	*	*			cis	-147.6	151.5	-1	-127.5	-26.4	0	0	0	113.7	L1139	D1137-L1139 PolarHBondContact O-N 3.45Å
1138	L	23.6	Very low	26.6	Very low	173 Å²	173	143.9 Å²	143.9	91%	0.906	74%	0.739	S	S	*	*			trans	-94.5	77.9	-179.8	-103.9	171.7	0	0	0	110.8
1139	L	24.9	Very low	26.5	Very low	147 Å²	147	147.7 Å²	147.7	77%	0.77	75%	0.746	S	S	*	*			trans	-148.4	115.8	173.7	-104.1	162.2	0	0	0	113.4	D1137	D1137-L1139 PolarHBondContact O-N 3.45Å
1140	T	23.8	Very low	26.4	Very low	113 Å²	113	148.7 Å²	148.7	69%	0.693	76%	0.757	S	S	*	*			trans	25.9	110.4	145.8	-50.1	0	0	0	0	119.1
1141	Y	26.3	Very low	26.4	Very low	233 Å²	233	147.7 Å²	147.7	91%	0.914	76%	0.756	S	S	*	*			trans	-149.2	135	135.9	-118.5	-78.4	0	0	0	112.1
1142	C	23	Very low	26.5	Very low	123 Å²	123	149.1 Å²	149.1	83%	0.831	76%	0.76	S	S	*	*			trans	-107.6	142	171.5	-65.3	0	0	0	0	109.5
1143	G	25.9	Very low	26.6	Very low	70 Å²	70	151 Å²	151	72%	0.722	77%	0.766	S	S	*	*			trans	152	147.5	175.2	0	0	0	0	0	111.6
1144	E	25	Very low	26.5	Very low	167 Å²	167	147.6 Å²	147.6	78%	0.78	75%	0.754	S	S	*	*			cis	-145.5	157.7	-8.3	-74.4	-165.1	139.7	0	0	109.5
1145	P	25.1	Very low	26.3	Very low	78 Å²	78	151.3 Å²	151.3	51%	0.506	76%	0.755	S	S	.	*			trans	-75	130.7	172.6	30.4	-32.6	0	0	0	111.4	Y1093 I1147	Y1093-P1145 HydrophobicContact CD1-CG 3.45Å; Y1093-P1145 VanDerWaalsContact CD1-CG 3.45Å; Y1093-P1145 HydrophobicContact CE1-CG 3.72Å; Y1093-P1145 HydrophobicContact CG-CG 4.31Å; P1145-I1147 PolarHBondContact O-N 3.09Å; P1145-I1147 VanDerWaalsContact O-N 3.14Å
1146	F	26.3	Very low	26.3	Very low	210 Å²	210	148.8 Å²	148.8	92%	0.921	75%	0.747	S	S	*	*			trans	-65.3	112.1	-179.9	-83.7	-93	0	0	0	112.7
1147	I	26.2	Very low	26	Very low	99 Å²	99	148.5 Å²	148.5	51%	0.508	74%	0.744	S	S	.	*			trans	-86.4	120.3	172.4	-60.8	174.8	0	0	0	109.5	P1145 Y1149	P1145-I1147 PolarHBondContact O-N 3.09Å; P1145-I1147 VanDerWaalsContact O-N 3.14Å; I1147-Y1149 HydrophobicContact CG2-CD2 4.08Å; I1147-Y1149 HydrophobicContact CG2-CE2 4.47Å; I1147-Y1149 PolarHBondContact O-N 3.03Å; I1147-Y1149 VanDerWaalsContact O-N 3.1Å
1148	Y	24.9	Very low	25.9	Very low	217 Å²	217	150.7 Å²	150.7	85%	0.851	74%	0.743	S	S	*	*			trans	-73.7	97.4	166.4	-91	-84.1	0	0	0	110.3
1149	Y	26.9	Very low	25.8	Very low	200 Å²	200	147.1 Å²	147.1	78%	0.784	73%	0.732	S	S	*	*			trans	-71.3	124.9	169.8	-111.5	-92.8	0	0	0	111	I1147 P1151	I1147-Y1149 HydrophobicContact CG2-CD2 4.08Å; I1147-Y1149 HydrophobicContact CG2-CE2 4.47Å; I1147-Y1149 PolarHBondContact O-N 3.03Å; I1147-Y1149 VanDerWaalsContact O-N 3.1Å; Y1149-P1151 VanDerWaalsContact O-CD 3.28Å; Y1149-P1151 WeakPolarHBondContact O-CD 3.15Å
1150	T	26.9	Very low	25.9	Very low	128 Å²	128	145.6 Å²	145.6	79%	0.785	73%	0.729	S	S	*	*			trans	-91.2	107	162.1	52.8	0	0	0	0	109.3
1151	P	30.3	Very low	26.1	Very low	102 Å²	102	146.2 Å²	146.2	66%	0.662	74%	0.735	S	S	*	*			trans	-68.9	168.2	165.5	30.9	-34.4	0	0	0	111	Y1149	Y1149-P1151 VanDerWaalsContact O-CD 3.28Å; Y1149-P1151 WeakPolarHBondContact O-CD 3.15Å
1152	D	30.3	Very low	26	Very low	137 Å²	137	140.9 Å²	140.9	73%	0.733	73%	0.727	S	S	*	*			trans	64.6	55.3	170.4	-59.5	-15.9	0	0	0	117.3	N1154	D1152-N1154 PolarHBondContact O-N 3.14Å
1153	Q	27.5	Very low	26.4	Very low	169 Å²	169	141.1 Å²	141.1	79%	0.79	73%	0.727	S	S	*	*			trans	-63.2	107.5	133.7	-79.7	-159.2	14.5	0	0	108.8
1154	N	27.7	Very low	26.4	Very low	105 Å²	105	143.5 Å²	143.5	56%	0.561	73%	0.728	S	S	*	*			trans	-132.2	88.8	163.4	-101	-53.1	0	0	0	109.7	D1152 Y1156	D1152-N1154 PolarHBondContact O-N 3.14Å; N1154-Y1156 HydrophobicContact CB-CD2 3.99Å; N1154-Y1156 HydrophobicContact CB-CE2 3.95Å; N1154-Y1156 PolarHBondContact O-N 3.1Å
1155	Y	25.1	Very low	26.6	Very low	200 Å²	200	143.3 Å²	143.3	78%	0.784	73%	0.73	S	S	*	*			trans	-67	79.5	168.3	-87.3	-91.1	0	0	0	110	I1157	Y1155-I1157 VanDerWaalsContact C-N 3.25Å; Y1155-I1157 PolarHBondContact O-N 3.48Å
1156	Y	25.9	Very low	26.7	Very low	167 Å²	167	145 Å²	145	66%	0.655	74%	0.74	S	S	*	*			trans	-72.7	83.5	169	-86.5	-72.8	0	0	0	110.6	N1154 Y1158	N1154-Y1156 HydrophobicContact CB-CD2 3.99Å; N1154-Y1156 HydrophobicContact CB-CE2 3.95Å; N1154-Y1156 PolarHBondContact O-N 3.1Å; Y1156-Y1158 VanDerWaalsContact C-N 3.26Å; Y1156-Y1158 HydrophobicContact CD1-CE2 4.09Å; Y1156-Y1158 HydrophobicContact CG-CE2 4.34Å; Y1156-Y1158 PolarHBondContact O-N 2.73Å
1157	I	23.3	Very low	26.8	Very low	136 Å²	136	140.2 Å²	140.2	70%	0.697	73%	0.732	S	S	*	*			trans	-66.1	89.6	163.2	-53.9	177.2	0	0	0	107.3	Y1155 S1159	Y1155-I1157 VanDerWaalsContact C-N 3.25Å; Y1155-I1157 PolarHBondContact O-N 3.48Å; I1157-S1159 PolarHBondContact O-N 2.96Å
1158	Y	24.2	Very low	26.9	Very low	190 Å²	190	140.6 Å²	140.6	75%	0.745	74%	0.744	S	S	*	*			trans	-75.2	74.7	174	-102.5	-75.7	0	0	0	111	Y1156 T1160	Y1156-Y1158 VanDerWaalsContact C-N 3.26Å; Y1156-Y1158 HydrophobicContact CD1-CE2 4.09Å; Y1156-Y1158 HydrophobicContact CG-CE2 4.34Å; Y1156-Y1158 PolarHBondContact O-N 2.73Å; Y1158-T1160 VanDerWaalsContact C-N 3.33Å; Y1158-T1160 PolarHBondContact O-N 2.78Å
1159	S	23.2	Very low	27	Very low	98 Å²	98	137 Å²	137	69%	0.685	74%	0.737	S	S	*	*			trans	-67.6	86.1	167.5	-62.7	0	0	0	0	110.2	I1157	I1157-S1159 PolarHBondContact O-N 2.96Å
1160	T	26.7	Very low	27.1	Very low	115 Å²	115	134.3 Å²	134.3	71%	0.706	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-72.5	125.1	168.7	50.5	0	0	0	0	109.9	Y1158	Y1158-T1160 VanDerWaalsContact C-N 3.33Å; Y1158-T1160 PolarHBondContact O-N 2.78Å
1161	P	26.9	Very low	27.3	Very low	126 Å²	126	135.2 Å²	135.2	82%	0.818	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-73.4	134.3	-170.9	28.6	-35.2	0	0	0	112.7
1162	T	24.9	Very low	27.2	Very low	121 Å²	121	136.2 Å²	136.2	74%	0.742	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-83.7	126.7	174.6	49.6	0	0	0	0	111.9	T1164	T1162-T1164 PolarHBondContact O-N 3.39Å
1163	P	31	Very low	27	Very low	128 Å²	128	136.7 Å²	136.7	83%	0.831	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-74.8	117.5	161	30.2	-30.6	0	0	0	109.7
1164	T	26	Very low	27	Very low	120 Å²	120	132.6 Å²	132.6	74%	0.736	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-71.9	133	-179.3	47.9	0	0	0	0	113.2	T1162	T1162-T1164 PolarHBondContact O-N 3.39Å
1165	I	29	Very low	26.9	Very low	163 Å²	163	134.9 Å²	134.9	84%	0.836	73%	0.729	S	S	*	*			trans	-130	91.4	146.9	-58.9	-175	0	0	0	109.4
1166	T	26.9	Very low	26.9	Very low	115 Å²	115	136.6 Å²	136.6	71%	0.706	75%	0.751	S	S	*	*			trans	2.3	130.9	150.6	54.9	0	0	0	0	119.5
1167	S	28.5	Very low	26.9	Very low	108 Å²	108	135.1 Å²	135.1	76%	0.755	76%	0.755	S	S	*	*				-166.8	131.2	99.6	29.9	0	0	0	0	113.9
1168	S	29.5	Very low	27.1	Very low	108 Å²	108	135.1 Å²	135.1	76%	0.755	76%	0.759	S	S	*	*			trans	55.8	138.9	154.6	55.3	0	0	0	0	123
1169	I	27.3	Very low	27.3	Very low	140 Å²	140	132 Å²	132	72%	0.718	76%	0.759	S	S	*	*			cis	-173.3	148.3	-31.4	-120.2	158.3	0	0	0	109.2
1170	Q	27.2	Very low	27.5	Very low	145 Å²	145	134 Å²	134	68%	0.678	76%	0.764	S	S	*	*			trans	61.2	150	169.2	-74.8	162.9	-83.1	0	0	116.5
1171	E	31.5	Very low	27.6	Very low	147 Å²	147	135.2 Å²	135.2	69%	0.687	77%	0.767	S	S	*	*			cis	-141.4	113.8	2.7	-151.8	125.3	-129	0	0	113
1172	N	28	Very low	27.6	Very low	122 Å²	122	135.8 Å²	135.8	65%	0.652	76%	0.764	S	S	*	*			trans	31.9	121.3	133.6	-70.3	-9.3	0	0	0	122.2
1173	I	27.7	Very low	27.8	Very low	147 Å²	147	136.9 Å²	136.9	75%	0.754	77%	0.765	S	S	*	*				62.5	132.2	112.3	-64.1	165.2	0	0	0	117.1
1174	S	26.6	Very low	27.6	Very low	84 Å²	84	137.5 Å²	137.5	59%	0.587	76%	0.76	S	S	*	*			cis	-152.3	143.1	27.7	-144.3	0	0	0	0	114.8
1175	I	25.1	Very low	27.7	Very low	153 Å²	153	139 Å²	139	79%	0.785	76%	0.762	S	S	*	*			trans	32.7	108.2	130.5	-52.6	171.9	0	0	0	117.8
1176	L	25.4	Very low	27.6	Very low	236 Å²	236	136.8 Å²	136.8	100%	1.236	76%	0.756	S	S	*	*				-140.2	0	107.9	-126.7	172.3	0	0	0	109.6

Retrieved 1,176 of 1,176 residues in 241.7 ms (Link to these results)

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