A0A3Q0KNY5_SCHMA Loading...

AMP-activated protein kinase, gamma regulatory subunit, putative

AlphaFold DB , UniProt , Accession A0A3Q0KNY5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,213 aa.

						>A0A3Q0KNY5_SCHMA|A0A3Q0KNY5
MLEAEKYEQSSPSSVSDLIDSENCGIDAIQEYSSQKSSNIKGSVGCSSSIIPDEVSSRFIPIGSFLSSILEPIPQGQELAVGAMTTSTDESKFTVQNCHSSSDHHTTTQLKNEVCCPCRLANSRVTQQRNYPQDTGHTCNATTSVTTNITETTTKQITSSNHPLNVHGHGDNHTNNRNSVSSRSSWARSIFERLRASSLTSSTNESKAHHSSNGQNEFLSRFKEHNSNHSHSVNISSDVIDPRRLPKAHGPVSNCLEFSKRPLQKSNNYLHSKSIPVSSTHGDLMSPSLSNSLQPSNTNNNHIKHRRRIRWFSHSTSCDTGPGDPTLSSSNYHSQLSSSAIEEIQGAVSILAGRQVFPSSIACSRPGIRVKSASESEHLLVISKSLSNSKEELSPSSFGHFDENHVYTTLFRHSTCYDVLPGSGKLVILDSRLPTLRAICALLDNGVMAAPVWCSETQSYMGVFSQELALDMIGHLHYTEVIKSSDSDIQTLSSGSVTDTSTATNSSSSGFFASFNANLYGWGTKQLGKVFNFMYSRPDRQLFSDLFVYPHYCLQKALYRLFHHNHYPEQHRPYHQSQHPHHQDSLSHHDTLFKSKFSNTRDHRSSYPNNSTKMPMDDNPNYKFNRQSPSVLPGQSSHSSSRLSFSEDNGSVTLPYSPLLSSRSPGYQIFNSNKSDDAISGVISEDFERVSSKCCPLSNPTSLYTSLVPYLIVIDDRSGNALGLLCADRLLAYLRLRVDELPNTGRMNVPIGSVHGLRWAERHTSKKPTDTKTTAECLQFREIPVLHPNDRVRDALHVLTNWLPQLPCLPVVHYLDDNQSQSIDQISFISPGDLLNFIICSTSDTVLNEPISRIIEKKSVHCPYQQQCVCFVTETVDIVLDRMFRLKTPCLIMFDTRKNSASCAVASKPFGRPVGMVTAKDVLHTVILGHRHHPSSLHPHPTHHIDESLNTSQNISGDDYIPYRSKIRDNYKRTVSFESGVLSSSCQDGSENIFDAPDGQVKLEHSEEKFSRSASFGSLPSSGTFSVSSSNSEVMHSLSNERFTSTCTDTVTRRDHCNCTCHHKPSSILDNHQQSHHSKDTQSPVNPSVGFLDKIHNRSLHGSGQEWCADRRSSVPYTTKANMRGDLNVPENKRKSIPEVNSNRSKQLTVPNAYIQNNNDLNSSLQLIDNSFDGINESNVGDISLQLNNNNNLKNKLDKLVTQEEDDTVFPMD
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.1	Very low	32.4	Very low	226 Å²	226	171.6 Å²	171.6	100%	1.113	87%	0.874	S	S	*	*				0	89.6	0	-73.4	167.9	59.3	0	0	107.7
2	L	30.1	Very low	32.5	Very low	159 Å²	159	167.3 Å²	167.3	83%	0.832	87%	0.866	S	S	*	*			trans	178.6	45.4	162.4	-105.7	169.9	0	0	0	109.1
3	E	32.6	Very low	32.3	Very low	182 Å²	182	162.9 Å²	162.9	85%	0.85	86%	0.859	S	S	*	*	S	Bend	trans	-158.5	22.3	-179.4	-142.9	171.7	-141.4	0	0	112.6
4	A	34.4	Very low	32.3	Very low	96 Å²	96	158.4 Å²	158.4	79%	0.793	85%	0.847	S	S	*	*	S	Bend	trans	-131.8	7.8	-172.2	0	0	0	0	0	113.9
5	E	34	Very low	32.1	Very low	172 Å²	172	156.4 Å²	156.4	80%	0.804	84%	0.842	S	S	*	*			trans	-116.1	44.6	-173.6	-67.7	171.2	132.7	0	0	111.1
6	K	37.1	Very low	31.9	Very low	199 Å²	199	152.6 Å²	152.6	87%	0.865	83%	0.831	S	S	*	*	S	Bend	trans	-126	9.9	177.7	-105.1	-173.8	176.7	-176.5	0	115.3
7	Y	33.2	Very low	31.7	Very low	229 Å²	229	151.3 Å²	151.3	90%	0.898	82%	0.824	S	S	*	*	S	Bend	trans	-141.8	61.4	176.3	-92.1	-83.7	0	0	0	110.9
8	E	30	Very low	31.4	Very low	191 Å²	191	151.3 Å²	151.3	89%	0.893	82%	0.822	S	S	*	*			trans	-168.9	68.4	162.3	-115.7	167.9	-154	0	0	112.1
9	Q	29	Very low	31.2	Very low	203 Å²	203	150.1 Å²	150.1	95%	0.949	81%	0.813	S	S	*	*			trans	-138.7	57.4	167.6	-76.5	-162.2	-15.6	0	0	111.7
10	S	33.1	Very low	31.1	Very low	115 Å²	115	150.3 Å²	150.3	80%	0.804	81%	0.814	S	S	*	*			trans	-153.4	64.4	170.6	61.8	0	0	0	0	111.1
11	S	31.3	Very low	31.1	Very low	116 Å²	116	147 Å²	147	81%	0.811	80%	0.802	S	S	*	*			trans	-63.6	147	168	58	0	0	0	0	110.6
12	P	33.5	Very low	31.1	Very low	120 Å²	120	144.2 Å²	144.2	78%	0.779	79%	0.787	S	S	*	*				-135	165	84.1	34.1	-20.3	0	0	0	115.7
13	S	30	Very low	31	Very low	110 Å²	110	143.2 Å²	143.2	77%	0.769	78%	0.782	S	S	*	*			trans	-57.9	161.9	164.2	54.2	0	0	0	0	112.7
14	S	32.2	Very low	30.9	Very low	99 Å²	99	140 Å²	140	69%	0.692	78%	0.779	S	S	*	*			cis	-157.9	133.5	21.5	50.5	0	0	0	0	114.7
15	V	29.2	Very low	30.7	Very low	129 Å²	129	138.7 Å²	138.7	78%	0.782	77%	0.774	S	S	*	*				43.3	119.7	121.5	-174.2	0	0	0	0	120.5
16	S	28.8	Very low	30.5	Very low	95 Å²	95	138.1 Å²	138.1	66%	0.664	78%	0.775	S	S	*	*			trans	70.2	151.9	147.7	-69.4	0	0	0	0	120.2
17	D	28.6	Very low	30.2	Very low	131 Å²	131	136 Å²	136	70%	0.701	77%	0.773	S	S	*	*			cis	-168.1	166.4	-14.3	-111.9	-43.4	0	0	0	111
18	L	27	Very low	29.9	Very low	151 Å²	151	128.7 Å²	128.7	79%	0.791	76%	0.759	S	S	*	*			trans	64.3	169.9	161.7	-63.9	160	0	0	0	118.1
19	I	27.5	Very low	29.9	Very low	129 Å²	129	127.3 Å²	127.3	66%	0.662	76%	0.757	S	S	*	*				-168.8	161.1	-56.3	-117.4	-175.6	0	0	0	107.4
20	D	28.2	Very low	29.8	Very low	153 Å²	153	124.9 Å²	124.9	82%	0.818	75%	0.745	S	S	*	*			trans	64.9	155.5	171	-68.4	-20.2	0	0	0	118
21	S	30.5	Very low	29.5	Very low	83 Å²	83	127.4 Å²	127.4	58%	0.58	74%	0.744	S	S	*	*			cis	-163.3	164.9	-19.6	179.1	0	0	0	0	109.1
22	E	32.1	Very low	29.3	Very low	167 Å²	167	130.9 Å²	130.9	78%	0.78	74%	0.741	S	S	*	*			trans	65.2	152.8	158.2	-79.6	151.9	-106	0	0	120.7
23	N	29.5	Very low	29.1	Very low	137 Å²	137	130 Å²	130	73%	0.733	74%	0.738	S	S	*	*			cis	-167.8	171.7	-30.8	-142.7	-24.2	0	0	0	112.3
24	C	29.2	Very low	29	Very low	116 Å²	116	129.5 Å²	129.5	78%	0.784	73%	0.734	S	S	*	*			trans	72.8	140.6	154.4	-64.7	0	0	0	0	123.2
25	G	31.7	Very low	28.8	Very low	67 Å²	67	132.2 Å²	132.2	69%	0.691	74%	0.736	S	S	*	*			trans	86.5	106.6	162.3	0	0	0	0	0	115.2
26	I	29.2	Very low	28.8	Very low	161 Å²	161	134.1 Å²	134.1	83%	0.826	73%	0.734	S	S	*	*			cis	77.8	131.3	28.9	-52.8	-176.2	0	0	0	114.9
27	D	30.4	Very low	28.7	Very low	155 Å²	155	134.7 Å²	134.7	83%	0.829	74%	0.738	S	S	*	*			trans	93.8	133.6	-179.8	-64	-29.7	0	0	0	116.4
28	A	27.4	Very low	28.9	Very low	74 Å²	74	134.1 Å²	134.1	61%	0.612	74%	0.744	S	S	*	*			cis	153.3	165.3	-21.2	0	0	0	0	0	106.8
29	I	28.7	Very low	28.9	Very low	162 Å²	162	134.4 Å²	134.4	83%	0.831	75%	0.746	S	S	*	*			trans	71.6	149.3	172.8	-51.7	170.5	0	0	0	113.8
30	Q	27.2	Very low	29.1	Very low	153 Å²	153	136.5 Å²	136.5	72%	0.715	76%	0.757	S	S	*	*			cis	-170.8	-178.6	-38.1	-169.6	161.3	-52.9	0	0	106.4
31	E	28	Very low	29	Very low	167 Å²	167	139.1 Å²	139.1	78%	0.78	76%	0.761	S	S	*	*			trans	78.9	151.2	160.7	-62.6	-158	136	0	0	119.7
32	Y	27.4	Very low	29.1	Very low	190 Å²	190	138.9 Å²	138.9	75%	0.745	77%	0.772	S	S	*	*			cis	-169.1	138.5	-40.4	-140	-102.6	0	0	0	108.5
33	S	28.7	Very low	28.9	Very low	102 Å²	102	136.7 Å²	136.7	71%	0.713	78%	0.775	S	S	*	*			trans	61.7	171.3	156.1	70.8	0	0	0	0	119.5
34	S	26.7	Very low	28.8	Very low	99 Å²	99	137 Å²	137	69%	0.692	78%	0.781	S	S	*	*			cis	-170.8	165.8	-35.8	-90.5	0	0	0	0	112
35	Q	29	Very low	28.8	Very low	155 Å²	155	134.8 Å²	134.8	72%	0.724	78%	0.778	S	S	*	*			trans	83.6	138.3	143.5	-88	175.3	44.6	0	0	123.8
36	K	28.4	Very low	28.5	Very low	169 Å²	169	137.4 Å²	137.4	74%	0.735	79%	0.785	S	S	*	*			trans	88.9	78.8	138.2	-77.6	167.6	177.5	154.5	0	122.6
37	S	27.7	Very low	28.3	Very low	107 Å²	107	135 Å²	135	75%	0.748	78%	0.782	S	S	*	*				8.6	143.9	114.1	63.4	0	0	0	0	121.4
38	S	31.9	Very low	28	Very low	120 Å²	120	133 Å²	133	84%	0.839	78%	0.78	S	S	*	*			trans	-154.2	153.5	130.4	54.5	0	0	0	0	112.2
39	N	26.4	Very low	27.8	Very low	156 Å²	156	134.4 Å²	134.4	83%	0.834	79%	0.786	S	S	*	*			trans	-118.8	148.6	-179.3	-76.5	-55.8	0	0	0	110.5
40	I	32.6	Very low	27.8	Very low	174 Å²	174	133.6 Å²	133.6	89%	0.892	78%	0.781	S	S	*	*			trans	-134.6	144.6	157	-62.7	-174.5	0	0	0	109.4
41	K	26.3	Very low	27.8	Very low	208 Å²	208	133.6 Å²	133.6	90%	0.904	79%	0.785	S	S	*	*			trans	-103.5	158.5	-174	-61.3	176.2	178.1	178.9	0	112.4
42	G	31.8	Very low	27.9	Very low	77 Å²	77	131.2 Å²	131.2	79%	0.794	78%	0.784	S	S	*	*			trans	-161.7	143.6	165.8	0	0	0	0	0	111.7
43	S	27.7	Very low	28	Very low	122 Å²	122	130 Å²	130	85%	0.853	79%	0.79	S	S	*	*			trans	-169.6	164.9	-171.1	62.2	0	0	0	0	110.1
44	V	28.1	Very low	27.9	Very low	142 Å²	142	133 Å²	133	86%	0.861	79%	0.793	S	S	*	*			cis	-152	162.3	10.8	73.3	0	0	0	0	110.3
45	G	29.2	Very low	28.1	Very low	70 Å²	70	135.3 Å²	135.3	72%	0.722	80%	0.803	S	S	*	*			trans	-179	150.4	170.2	0	0	0	0	0	112.4
46	C	25.3	Very low	28.1	Very low	123 Å²	123	133 Å²	133	83%	0.831	80%	0.804	S	S	*	*			trans	-114.3	167.6	-171	-64.4	0	0	0	0	114.1
47	S	24.7	Very low	28.1	Very low	110 Å²	110	128.6 Å²	128.6	77%	0.769	79%	0.794	S	S	*	*			trans	90.6	96	152.7	-53.1	0	0	0	0	119.9
48	S	25.2	Very low	28.1	Very low	112 Å²	112	135.1 Å²	135.1	78%	0.783	80%	0.802	S	S	*	*			trans	54.7	100	132.8	62.4	0	0	0	0	120.9
49	S	23.2	Very low	27.8	Very low	105 Å²	105	138 Å²	138	73%	0.734	80%	0.8	S	S	*	*			trans	179.7	178.6	133	48.6	0	0	0	0	110.1
50	I	28.3	Very low	27.9	Very low	144 Å²	144	137.6 Å²	137.6	74%	0.738	80%	0.796	S	S	*	*			trans	72.7	105.3	167.5	-57.3	167.8	0	0	0	113.3
51	I	26.9	Very low	27.6	Very low	153 Å²	153	134.1 Å²	134.1	79%	0.785	79%	0.785	S	S	*	*				91.6	139.6	63.5	-73.9	167.6	0	0	0	111.3
52	P	30	Very low	27.8	Very low	117 Å²	117	130.8 Å²	130.8	76%	0.76	78%	0.776	S	S	*	*			trans	-102.3	176.4	-153.9	40.7	-34.7	0	0	0	113.9
53	D	29.5	Very low	27.6	Very low	165 Å²	165	130.6 Å²	130.6	88%	0.882	77%	0.774	S	S	*	*			trans	-139.8	158.9	167.8	-122.2	-38.3	0	0	0	112.3
54	E	26.7	Very low	27.5	Very low	165 Å²	165	129 Å²	129	77%	0.771	76%	0.763	S	S	*	*			trans	-81.9	143.8	-162.3	-60.9	-169.2	112.9	0	0	116.1
55	V	31.8	Very low	27.6	Very low	148 Å²	148	131.6 Å²	131.6	90%	0.897	76%	0.763	S	S	*	*			trans	-124.1	101.8	145.9	-179.3	0	0	0	0	107.9
56	S	29.4	Very low	27.4	Very low	107 Å²	107	134.9 Å²	134.9	75%	0.748	76%	0.763	S	S	*	*			trans	-63.9	141.1	-170.4	-163.4	0	0	0	0	113
57	S	28.1	Very low	27.4	Very low	76 Å²	76	135.3 Å²	135.3	53%	0.531	77%	0.768	S	S	.	*			trans	-98	155.2	-166.4	74	0	0	0	0	113.9
58	R	26.4	Very low	27.5	Very low	243 Å²	243	134.3 Å²	134.3	92%	0.917	76%	0.76	S	S	*	*			trans	-119	61.9	158.9	-67.4	-167.1	-170.6	178.9	5.9	110.7	I60	R58-I60 PolarHBondContact O-N 3.27Å
59	F	26.9	Very low	27.6	Very low	182 Å²	182	136.5 Å²	136.5	80%	0.798	76%	0.762	S	S	*	*			trans	-62.1	119.6	158.8	-80	-79	0	0	0	108.7	P61	F59-P61 VanDerWaalsContact O-CD 3.23Å; F59-P61 WeakPolarHBondContact O-CD 3.43Å
60	I	28.9	Very low	27.9	Very low	147 Å²	147	139.4 Å²	139.4	75%	0.754	77%	0.768	S	S	*	*			trans	-100.5	96.2	164.6	-59.8	179	0	0	0	106.6	R58 I62	R58-I60 PolarHBondContact O-N 3.27Å; I60-I62 PolarHBondContact O-N 2.94Å; I60-I62 VanDerWaalsContact O-N 3.14Å
61	P	25	Very low	27.9	Very low	101 Å²	101	140.6 Å²	140.6	66%	0.656	77%	0.771	S	S	*	*			trans	-71.3	109.2	174.7	28.9	-33.1	0	0	0	109	F59 G63	F59-P61 VanDerWaalsContact O-CD 3.23Å; F59-P61 WeakPolarHBondContact O-CD 3.43Å; P61-G63 PolarHBondContact O-N 3Å
62	I	30.6	Very low	28.1	Very low	138 Å²	138	138.7 Å²	138.7	71%	0.708	77%	0.768	S	S	*	*			trans	-77.8	60.8	167.4	-49.7	-177.5	0	0	0	108.5	I60 F65	I60-I62 PolarHBondContact O-N 2.94Å; I60-I62 VanDerWaalsContact O-N 3.14Å; I62-F65 HydrophobicContact CG2-CD2 4.13Å; I62-F65 HydrophobicContact CG2-CE2 4.09Å
63	G	26.8	Very low	28.4	Very low	73 Å²	73	140.5 Å²	140.5	75%	0.753	77%	0.77	S	S	*	*			trans	-123.9	29.6	-177	0	0	0	0	0	112.2	P61	P61-G63 PolarHBondContact O-N 3Å
64	S	27.2	Very low	28.6	Very low	89 Å²	89	138.2 Å²	138.2	62%	0.622	76%	0.764	S	S	*	*			trans	-143.7	20.5	-169.7	56.9	0	0	0	0	115.1	L66	S64-L66 PolarHBondContact O-N 2.94Å
65	F	29.2	Very low	28.7	Very low	196 Å²	196	138 Å²	138	86%	0.86	76%	0.763	S	S	*	*			trans	-77.3	66.6	162.6	-78.1	-67.4	0	0	0	111.2	I62	I62-F65 HydrophobicContact CG2-CD2 4.13Å; I62-F65 HydrophobicContact CG2-CE2 4.09Å
66	L	25.9	Very low	28.7	Very low	138 Å²	138	134.3 Å²	134.3	72%	0.723	76%	0.755	S	S	*	*			trans	-58.7	156.5	162.5	-76.3	168.7	0	0	0	110.4	S64 S68	S64-L66 PolarHBondContact O-N 2.94Å; L66-S68 PolarHBondContact O-N 2.77Å
67	S	24.9	Very low	28.7	Very low	133 Å²	133	139 Å²	139	93%	0.93	77%	0.765	S	S	*	*			trans	-70.5	70.9	172	-63.4	0	0	0	0	111.2
68	S	27.6	Very low	28.6	Very low	88 Å²	88	143.5 Å²	143.5	62%	0.615	78%	0.778	S	S	*	*			trans	-100.5	111.4	-176.2	-67.4	0	0	0	0	111.4	L66	L66-S68 PolarHBondContact O-N 2.77Å
69	I	25.9	Very low	28.7	Very low	158 Å²	158	140.6 Å²	140.6	81%	0.81	78%	0.779	S	S	*	*			trans	-50.2	129.9	173.4	-62.8	153.2	0	0	0	110.8
70	L	28.9	Very low	28.7	Very low	167 Å²	167	136 Å²	136	87%	0.874	78%	0.775	S	S	*	*			trans	-130.7	141	155.5	-88.7	102.9	0	0	0	109.9
71	E	30.2	Very low	28.7	Very low	169 Å²	169	136 Å²	136	79%	0.79	78%	0.782	S	S	*	*			trans	-81.4	157.5	-166.1	-70.1	177.4	99.9	0	0	114.1	I73	E71-I73 PolarHBondContact O-N 3.02Å
72	P	30.3	Very low	28.9	Very low	112 Å²	112	134.2 Å²	134.2	73%	0.727	78%	0.782	S	S	*	*			trans	-71.9	108.8	169.7	30.4	-33.4	0	0	0	110.6
73	I	35.3	Very low	28.6	Very low	156 Å²	156	132.3 Å²	132.3	80%	0.8	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-58.2	130.8	173.1	-61.2	176.7	0	0	0	109.5	E71	E71-I73 PolarHBondContact O-N 3.02Å
74	P	34.4	Very low	28.6	Very low	117 Å²	117	136.9 Å²	136.9	76%	0.76	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-67.2	140.1	-177.9	-20.5	32.7	0	0	0	113.2
75	Q	29.4	Very low	28.5	Very low	160 Å²	160	138 Å²	138	75%	0.748	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-87.9	118.6	159.3	-67.6	178	-83.5	0	0	108
76	G	30.8	Very low	28.4	Very low	71 Å²	71	135 Å²	135	73%	0.732	79%	0.791	S	S	*	*			trans	168.2	52.5	179.9	0	0	0	0	0	117.7
77	Q	28.9	Very low	28.5	Very low	204 Å²	204	133.1 Å²	133.1	95%	0.953	79%	0.79	S	S	*	*			trans	-153.2	143	144	-121	166.2	0.5	0	0	112.3
78	E	27.2	Very low	28.7	Very low	171 Å²	171	132.4 Å²	132.4	80%	0.799	78%	0.78	S	S	*	*			trans	-108.7	126.6	-172.3	176.8	175.7	-154.3	0	0	108.8
79	L	28	Very low	28.7	Very low	182 Å²	182	135.3 Å²	135.3	95%	0.953	79%	0.788	S	S	*	*			trans	-130.3	97	166.9	-83.5	176.8	0	0	0	108.8
80	A	28	Very low	28.8	Very low	86 Å²	86	135.8 Å²	135.8	71%	0.711	79%	0.787	S	S	*	*			trans	-92.9	109.5	176	0	0	0	0	0	110.7
81	V	28.2	Very low	28.9	Very low	147 Å²	147	132.2 Å²	132.2	89%	0.891	78%	0.777	S	S	*	*			trans	-136.5	128.1	147.5	-172	0	0	0	0	104.5
82	G	28.6	Very low	28.9	Very low	64 Å²	64	132.5 Å²	132.5	66%	0.66	78%	0.775	S	S	*	*			cis	125	116.5	19.1	0	0	0	0	0	106.2
83	A	25.8	Very low	28.7	Very low	97 Å²	97	135.6 Å²	135.6	80%	0.802	78%	0.777	S	S	*	*			trans	-76.4	-170.3	-176.5	0	0	0	0	0	111.6
84	M	26	Very low	28.3	Very low	170 Å²	170	133.1 Å²	133.1	84%	0.837	77%	0.77	S	S	*	*			trans	84.5	97.3	-178	-44.8	-86.6	-88.4	0	0	111
85	T	25.7	Very low	27.9	Very low	113 Å²	113	133.4 Å²	133.4	69%	0.693	77%	0.769	S	S	*	*				62.5	120.6	81.1	64.7	0	0	0	0	114.7
86	T	26	Very low	27.9	Very low	132 Å²	132	134.4 Å²	134.4	81%	0.81	77%	0.774	S	S	*	*			trans	67.8	149.5	162.2	52.1	0	0	0	0	119.5
87	S	28.9	Very low	27.7	Very low	98 Å²	98	137.7 Å²	137.7	69%	0.685	77%	0.774	S	S	*	*			trans	60	101.2	161.6	53.3	0	0	0	0	120.4
88	T	27.9	Very low	27.5	Very low	118 Å²	118	133.1 Å²	133.1	72%	0.724	76%	0.764	S	S	*	*				52.5	120.9	125.2	55.9	0	0	0	0	122.1
89	D	28.8	Very low	27.6	Very low	149 Å²	149	133 Å²	133	80%	0.797	76%	0.763	S	S	*	*			trans	79.7	127.2	130.5	-56.5	-8.8	0	0	0	123.3
90	E	27.8	Very low	27.7	Very low	168 Å²	168	129.7 Å²	129.7	79%	0.785	76%	0.755	S	S	*	*			trans	69.5	116.9	139.9	-73.3	-69.2	96.8	0	0	123.5
91	S	30.6	Very low	27.7	Very low	93 Å²	93	130.4 Å²	130.4	65%	0.65	76%	0.755	S	S	*	*				103.6	98.9	127.4	76.9	0	0	0	0	123.4
92	K	29.4	Very low	27.7	Very low	175 Å²	175	127.8 Å²	127.8	76%	0.761	74%	0.743	S	S	*	*				70.4	126.8	121	-69.2	-174.9	178	173	0	125.1
93	F	26.9	Very low	27.6	Very low	177 Å²	177	131.2 Å²	131.2	78%	0.776	75%	0.746	S	S	*	*			trans	74.1	151.7	133.5	-79.7	-129.1	0	0	0	120
94	T	26.6	Very low	27.9	Very low	104 Å²	104	135.5 Å²	135.5	64%	0.638	75%	0.749	S	S	*	*			cis	-168.2	143.5	-24.5	24.7	0	0	0	0	111.8
95	V	26.7	Very low	28	Very low	122 Å²	122	135.3 Å²	135.3	74%	0.739	75%	0.746	S	S	*	*			trans	46.3	129	135.8	-177.7	0	0	0	0	122
96	Q	29.7	Very low	28.2	Very low	182 Å²	182	137 Å²	137	85%	0.85	76%	0.757	S	S	*	*				177.6	174.9	103.3	-149	137.6	22.1	0	0	115.1
97	N	25.1	Very low	28.2	Very low	140 Å²	140	136 Å²	136	75%	0.749	75%	0.75	S	S	*	*			trans	-106	172.9	-167.7	-60.9	-25.7	0	0	0	114.6
98	C	25.7	Very low	28.3	Very low	108 Å²	108	138.2 Å²	138.2	73%	0.73	76%	0.76	S	S	*	*				163	116.7	113.7	-84.6	0	0	0	0	118.4
99	H	28.4	Very low	28.3	Very low	167 Å²	167	140.7 Å²	140.7	77%	0.773	76%	0.763	S	S	*	*			trans	53.5	147.3	134.2	-59.3	-65.6	0	0	0	128
100	S	30.3	Very low	28.4	Very low	114 Å²	114	141.2 Å²	141.2	80%	0.797	77%	0.765	S	S	*	*			trans	79.2	155.1	146.4	71.3	0	0	0	0	121.4
101	S	27.9	Very low	28.5	Very low	101 Å²	101	142.4 Å²	142.4	71%	0.706	77%	0.768	S	S	*	*			cis	-170.2	173.4	-34.3	59.9	0	0	0	0	112.5
102	S	29.4	Very low	28.5	Very low	91 Å²	91	145 Å²	145	64%	0.636	77%	0.774	S	S	*	*			trans	69.2	118.6	152.1	48.4	0	0	0	0	123.5
103	D	26.5	Very low	28.7	Very low	136 Å²	136	145.8 Å²	145.8	73%	0.727	78%	0.781	S	S	*	*				56.9	122.3	126.6	-47	-33.9	0	0	0	124.2
104	H	32.4	Very low	29.2	Very low	187 Å²	187	143.4 Å²	143.4	87%	0.866	78%	0.78	S	S	*	*				-177.1	165.9	94.7	-101.7	-72.1	0	0	0	114.6
105	H	27.5	Very low	29.5	Very low	166 Å²	166	143.9 Å²	143.9	77%	0.769	79%	0.786	S	S	*	*			trans	-88.4	154.8	-176	-76.8	-87.4	0	0	0	115.3
106	T	29.4	Very low	29.8	Very low	150 Å²	150	143.5 Å²	143.5	92%	0.92	79%	0.788	S	S	*	*			trans	-155.9	158.6	134.3	-7.1	0	0	0	0	111.6
107	T	26.2	Very low	30.2	Very low	109 Å²	109	140.1 Å²	140.1	67%	0.669	78%	0.782	S	S	*	*			trans	-139.1	135.6	-162.6	-52	0	0	0	0	112.9
108	T	30.5	Very low	30.7	Very low	145 Å²	145	138.8 Å²	138.8	89%	0.89	78%	0.782	S	S	*	*			trans	-142	154.8	158.5	34.8	0	0	0	0	110.6
109	Q	29	Very low	31.1	Very low	171 Å²	171	144.6 Å²	144.6	80%	0.799	79%	0.789	S	S	*	*			trans	-116.3	168.9	-162.1	-58.9	176.7	-4.5	0	0	113.7
110	L	30.3	Very low	31.1	Very low	160 Å²	160	144.3 Å²	144.3	84%	0.838	79%	0.792	S	S	*	*			trans	143.8	137.9	148.4	-78.3	160.2	0	0	0	109.4
111	K	30.4	Very low	31.2	Very low	193 Å²	193	143.9 Å²	143.9	84%	0.839	80%	0.796	S	S	*	*			cis	-154.3	153.8	4	-153.3	170.4	-173.6	-179.8	0	110
112	N	31.1	Very low	31.3	Very low	147 Å²	147	146 Å²	146	79%	0.786	80%	0.799	S	S	*	*			trans	-99.3	158.8	-178.2	-64.2	-24	0	0	0	113.4
113	E	32.7	Very low	31.5	Very low	192 Å²	192	147.3 Å²	147.3	90%	0.897	81%	0.808	S	S	*	*				-159.8	113.6	128.5	-63.4	-156.2	153.6	0	0	107.2
114	V	36.7	Very low	31.7	Very low	126 Å²	126	151.3 Å²	151.3	76%	0.764	81%	0.813	S	S	*	*				76	101.6	68.3	175.7	0	0	0	0	112.8
115	C	32.9	Very low	31.6	Very low	114 Å²	114	148.9 Å²	148.9	77%	0.77	81%	0.811	S	S	*	*				-172	167.7	93.6	-92.5	0	0	0	0	109
116	C	34.3	Very low	31.5	Very low	114 Å²	114	145.6 Å²	145.6	77%	0.77	80%	0.803	S	S	*	*			cis	-155.3	179.6	-4.7	-113.9	0	0	0	0	108.9
117	P	36.9	Very low	31.6	Very low	112 Å²	112	146.4 Å²	146.4	73%	0.727	80%	0.796	S	S	*	*			trans	-132.4	-171.3	-143.4	43.7	-27.6	0	0	0	118.9
118	C	36.3	Very low	31.6	Very low	111 Å²	111	147.9 Å²	147.9	75%	0.75	80%	0.795	S	S	*	*			trans	102.3	132	166.4	-63.6	0	0	0	0	116.7
119	R	33.2	Very low	31.3	Very low	231 Å²	231	150.4 Å²	150.4	87%	0.872	79%	0.789	S	S	*	*			cis	-154.8	157.6	-11.4	-127.6	-175.2	-165.8	-158.3	5	110.8
120	L	29.8	Very low	31.2	Very low	161 Å²	161	149.2 Å²	149.2	84%	0.843	79%	0.788	S	S	*	*			trans	-103.9	149.1	176.3	-136.1	81.2	0	0	0	110.9
121	A	32.4	Very low	31	Very low	105 Å²	105	151.3 Å²	151.3	87%	0.868	79%	0.786	S	S	*	*			trans	-142.4	129.4	158.2	0	0	0	0	0	108.8
122	N	30.4	Very low	31.1	Very low	145 Å²	145	147.8 Å²	147.8	78%	0.775	78%	0.783	S	S	*	*			trans	-158.7	134.8	-175.4	-158.7	-5.6	0	0	0	108
123	S	33.6	Very low	30.8	Very low	119 Å²	119	148 Å²	148	83%	0.832	78%	0.779	S	S	*	*			trans	-137.5	139.8	177.4	60	0	0	0	0	111.6
124	R	28.8	Very low	30.5	Very low	220 Å²	220	145.3 Å²	145.3	83%	0.83	77%	0.771	S	S	*	*			trans	-130.9	127.4	-179.6	-76.6	176.4	166.2	-177.2	-4.5	109.7	T126	R124-T126 HydrophobicContact CB-CG2 4.5Å
125	V	31.3	Very low	30.1	Very low	136 Å²	136	145.7 Å²	145.7	82%	0.824	77%	0.773	S	S	*	*			trans	-150.6	106.5	153.9	-177.2	0	0	0	0	104.1
126	T	26.2	Very low	29.7	Very low	96 Å²	96	143.3 Å²	143.3	59%	0.589	77%	0.768	S	S	*	*			cis	70.2	131.9	46.7	76.2	0	0	0	0	115.1	R124	R124-T126 HydrophobicContact CB-CG2 4.5Å
127	Q	30.2	Very low	29.6	Very low	168 Å²	168	146.9 Å²	146.9	79%	0.785	77%	0.773	S	S	*	*			trans	77.4	143.9	177.8	-47.7	-175.9	36.3	0	0	115.4
128	Q	26.1	Very low	28.9	Very low	140 Å²	140	147.9 Å²	147.9	65%	0.654	78%	0.777	S	S	*	*			cis	-162.7	165.6	-15.6	-120.5	-175	24.9	0	0	111.4
129	R	25	Very low	28.5	Very low	198 Å²	198	148.4 Å²	148.4	75%	0.747	78%	0.781	S	S	*	*			trans	75.2	115.2	151	-76.8	176.3	176.8	175	-0.9	121.8
130	N	27.8	Very low	28	Very low	146 Å²	146	145.4 Å²	145.4	78%	0.781	78%	0.782	S	S	*	*				98.6	115.3	124.6	-65.3	8	0	0	0	121.3
131	Y	26	Very low	28	Very low	203 Å²	203	142.2 Å²	142.2	80%	0.796	78%	0.779	S	S	*	*			trans	-53.9	162	147.8	-72.9	-91.5	0	0	0	111.8
132	P	31.2	Very low	27.6	Very low	120 Å²	120	144 Å²	144	78%	0.779	78%	0.779	S	S	*	*				-101.1	157.3	62.1	37	-38.9	0	0	0	112.6
133	Q	25.8	Very low	27.5	Very low	151 Å²	151	143.7 Å²	143.7	71%	0.706	78%	0.783	S	S	*	*			cis	79.9	147.1	24	-154.6	166.1	5.2	0	0	113.9
134	D	26.4	Very low	27.1	Very low	136 Å²	136	143 Å²	143	73%	0.727	78%	0.778	S	S	*	*			trans	63.7	143.9	-175.1	-57	-23.8	0	0	0	116.1
135	T	28.1	Very low	27.1	Very low	133 Å²	133	138.6 Å²	138.6	82%	0.816	78%	0.776	S	S	*	*			cis	-143	151.8	-15.3	7.3	0	0	0	0	109
136	G	24.9	Very low	26.9	Very low	64 Å²	64	137.2 Å²	137.2	66%	0.66	77%	0.768	S	S	*	*			trans	-83	160.8	176.6	0	0	0	0	0	113.1
137	H	31.3	Very low	27	Very low	189 Å²	189	137.5 Å²	137.5	88%	0.875	77%	0.769	S	S	*	*			trans	-145.4	122.9	150.1	-103.4	-71	0	0	0	110.9
138	T	23	Very low	27.1	Very low	133 Å²	133	136 Å²	136	82%	0.816	77%	0.766	S	S	*	*			trans	-76.7	128.8	170.5	47.6	0	0	0	0	110.7
139	C	26.9	Very low	27.2	Very low	122 Å²	122	135.4 Å²	135.4	82%	0.824	77%	0.767	S	S	*	*			trans	-138.3	109.9	162.4	-81.8	0	0	0	0	109.9
140	N	22.9	Very low	27.6	Very low	169 Å²	169	131.2 Å²	131.2	90%	0.904	76%	0.763	S	S	*	*			trans	-76.2	134.9	165.2	-70.6	-26.3	0	0	0	109
141	A	30.2	Very low	27.8	Very low	94 Å²	94	131.9 Å²	131.9	78%	0.777	76%	0.761	S	S	*	*			trans	-141.4	83.5	170.4	0	0	0	0	0	110.4
142	T	23.7	Very low	28.1	Very low	141 Å²	141	127.8 Å²	127.8	87%	0.865	76%	0.758	S	S	*	*			trans	-70	125.8	165.5	41.6	0	0	0	0	110.4
143	T	28.4	Very low	28.2	Very low	140 Å²	140	128 Å²	128	86%	0.859	76%	0.757	S	S	*	*			trans	-137.4	108.7	162	-36.5	0	0	0	0	110.5
144	S	24.3	Very low	28.4	Very low	104 Å²	104	126.2 Å²	126.2	73%	0.727	76%	0.757	S	S	*	*			trans	-108.6	137.4	174	54.8	0	0	0	0	110.7
145	V	28.6	Very low	28.7	Very low	128 Å²	128	127.9 Å²	127.9	78%	0.776	76%	0.757	S	S	*	*			trans	-154.9	115	162.3	149.4	0	0	0	0	105
146	T	27.2	Very low	28.8	Very low	107 Å²	107	128.9 Å²	128.9	66%	0.656	75%	0.753	S	S	*	*				67.6	137.7	58.1	68.3	0	0	0	0	113.7
147	T	28.4	Very low	28.9	Very low	102 Å²	102	132.9 Å²	132.9	63%	0.626	76%	0.758	S	S	*	*			cis	-161	169.8	-9.7	22.8	0	0	0	0	107	I149	T147-I149 HydrophobicContact CG2-CD1 4.41Å
148	N	32	Very low	28.8	Very low	135 Å²	135	131 Å²	131	72%	0.722	76%	0.76	S	S	*	*				-179.9	136.2	95.9	-77.4	-14.9	0	0	0	107.4
149	I	29.4	Very low	28.9	Very low	129 Å²	129	129.7 Å²	129.7	66%	0.662	76%	0.756	S	S	*	*				70.8	129.4	61	-61.4	165.3	0	0	0	109.6	T147	T147-I149 HydrophobicContact CG2-CD1 4.41Å
150	T	33.7	Very low	29.2	Very low	110 Å²	110	129.6 Å²	129.6	68%	0.675	76%	0.757	S	S	*	*			cis	-131.4	143.9	33.3	16.5	0	0	0	0	113.1
151	E	31.3	Very low	29.3	Very low	159 Å²	159	128.4 Å²	128.4	74%	0.743	75%	0.75	S	S	*	*				69.5	144.2	83.9	-63.1	-176	170.8	0	0	116.2
152	T	32.1	Very low	29.3	Very low	118 Å²	118	132.2 Å²	132.2	72%	0.724	75%	0.751	S	S	*	*			cis	-136.9	-149.5	-2	-2.4	0	0	0	0	109.8
153	T	33.8	Very low	29.6	Very low	123 Å²	123	130.8 Å²	130.8	76%	0.755	75%	0.745	S	S	*	*			cis	-156.1	-177.8	12.9	-23.9	0	0	0	0	112.2
154	T	30.1	Very low	29.6	Very low	114 Å²	114	132 Å²	132	70%	0.699	75%	0.745	S	S	*	*			trans	-97.3	176.9	-178.1	57.2	0	0	0	0	113.8
155	K	32.1	Very low	29.7	Very low	171 Å²	171	133.3 Å²	133.3	74%	0.743	74%	0.744	S	S	*	*			cis	-169.4	176.2	24.7	-133.5	158.6	-177.2	-177.2	0	107.6
156	Q	31.2	Very low	29.8	Very low	155 Å²	155	133.9 Å²	133.9	72%	0.724	75%	0.748	S	S	*	*			cis	-148.1	-146.6	0.3	-158.9	160.3	-92	0	0	109.5
157	I	25.8	Very low	29.8	Very low	148 Å²	148	137 Å²	137	76%	0.759	75%	0.754	S	S	*	*			trans	-148.1	143.1	-173.6	-64.8	162.7	0	0	0	108.9
158	T	30.1	Very low	29.9	Very low	149 Å²	149	135.8 Å²	135.8	91%	0.914	76%	0.762	S	S	*	*			trans	-164.2	157.3	142.9	13.7	0	0	0	0	111.8
159	S	25.9	Very low	29.8	Very low	106 Å²	106	138.3 Å²	138.3	74%	0.741	77%	0.769	S	S	*	*			trans	-134.4	155.6	-169.1	53.6	0	0	0	0	113.4
160	S	31.5	Very low	29.8	Very low	120 Å²	120	135.9 Å²	135.9	84%	0.839	78%	0.776	S	S	*	*			trans	-163.7	145.3	148.4	-14.8	0	0	0	0	114.1
161	N	26.5	Very low	29.6	Very low	143 Å²	143	136.5 Å²	136.5	77%	0.765	78%	0.775	S	S	*	*			trans	-60.7	165	170.3	-40.6	-36.5	0	0	0	111.2
162	H	29.2	Very low	29.5	Very low	174 Å²	174	134.8 Å²	134.8	81%	0.806	77%	0.771	S	S	*	*			cis	-172	155.5	45	-126.8	-71.5	0	0	0	110.9
163	P	29.4	Very low	29.5	Very low	111 Å²	111	136 Å²	136	72%	0.721	77%	0.768	S	S	*	*			trans	-111.4	140.9	179.2	37.7	-30.8	0	0	0	116.2
164	L	28.6	Very low	29.3	Very low	167 Å²	167	135 Å²	135	87%	0.874	76%	0.762	S	S	*	*			trans	-151.1	120.2	154.2	-70.2	179.6	0	0	0	106.7
165	N	25.9	Very low	29.3	Very low	130 Å²	130	136.6 Å²	136.6	70%	0.695	77%	0.766	S	S	*	*				71.6	100.8	60.5	-171.5	13.4	0	0	0	114.2
166	V	32	Very low	29	Very low	141 Å²	141	135.6 Å²	135.6	86%	0.855	77%	0.769	S	S	*	*			trans	-160.8	146.4	148.2	134.8	0	0	0	0	111
167	H	27.8	Very low	28.9	Very low	171 Å²	171	138.9 Å²	138.9	79%	0.792	78%	0.775	S	S	*	*			trans	-68	161.6	-170.5	-60.5	29.1	0	0	0	116.5
168	G	30.5	Very low	28.9	Very low	77 Å²	77	139.3 Å²	139.3	79%	0.794	78%	0.779	S	S	*	*			trans	-166.8	114.5	160.7	0	0	0	0	0	113.2
169	H	28.6	Very low	28.8	Very low	188 Å²	188	138 Å²	138	87%	0.87	78%	0.776	S	S	*	*			trans	-78	152.9	175.4	-94.3	-91.2	0	0	0	112.3
170	G	30.5	Very low	28.8	Very low	78 Å²	78	140.2 Å²	140.2	80%	0.804	79%	0.785	S	S	*	*			trans	179.1	95.4	171.1	0	0	0	0	0	112.8
171	D	29.3	Very low	28.6	Very low	123 Å²	123	139.7 Å²	139.7	66%	0.658	78%	0.781	S	S	*	*			trans	-86.7	138	-169.7	-78.6	-83.5	0	0	0	115.4
172	N	28.5	Very low	28.7	Very low	123 Å²	123	137.7 Å²	137.7	66%	0.658	78%	0.778	S	S	*	*			trans	65	155.6	139.1	-70.2	-38.9	0	0	0	120.1
173	H	32.3	Very low	28.6	Very low	144 Å²	144	141 Å²	141	67%	0.667	78%	0.784	S	S	*	*			cis	-155.4	139	-0.4	-128.6	-59	0	0	0	110
174	T	30.6	Very low	28.7	Very low	103 Å²	103	140.1 Å²	140.1	63%	0.632	78%	0.78	S	S	*	*			trans	35	150.5	139.6	51.8	0	0	0	0	122.5
175	N	29	Very low	29.1	Very low	146 Å²	146	136.9 Å²	136.9	78%	0.781	77%	0.771	S	S	*	*			cis	-169	147.3	16.2	-124.1	-18	0	0	0	111.1
176	N	25.2	Very low	29.4	Very low	151 Å²	151	137.7 Å²	137.7	81%	0.807	77%	0.765	S	S	*	*			trans	-169.7	161.6	135.8	-130.1	-43.9	0	0	0	115.3
177	R	29.3	Very low	29.6	Very low	223 Å²	223	133.4 Å²	133.4	84%	0.842	74%	0.744	S	S	*	*			trans	77.9	94.3	169	-63.3	-179.3	175.6	175.1	-0.9	119.8
178	N	25.6	Very low	29.9	Very low	157 Å²	157	134.8 Å²	134.8	84%	0.84	74%	0.742	S	S	*	*				34.9	112.1	122.6	-52.8	0	0	0	0	120
179	S	29.7	Very low	30.2	Very low	123 Å²	123	133 Å²	133	86%	0.86	72%	0.718	S	S	*	*			trans	-154	160.7	141.2	64.6	0	0	0	0	110.9
180	V	25.5	Very low	30.6	Very low	152 Å²	152	127.6 Å²	127.6	92%	0.921	70%	0.695	S	S	*	*			trans	-104	120.4	-172.6	175.3	0	0	0	0	110.5
181	S	27.7	Very low	30.9	Very low	108 Å²	108	130.4 Å²	130.4	76%	0.755	69%	0.685	S	S	*	*			trans	-159.9	168.5	171	-166	0	0	0	0	113.5
182	S	28.1	Very low	31.3	Very low	102 Å²	102	131.3 Å²	131.3	71%	0.713	69%	0.685	S	S	*	*			trans	71.6	66.8	165.8	72.5	0	0	0	0	120
183	R	27	Very low	31.6	Very low	244 Å²	244	134 Å²	134	92%	0.921	69%	0.686	S	S	*	*			trans	-132.3	44.5	156.6	-68.4	-166.8	74.6	177.7	1.5	114
184	S	31.8	Very low	31.7	Very low	92 Å²	92	132 Å²	132	64%	0.643	68%	0.68	S	S	*	*			trans	-132.6	12.8	-172.1	52.4	0	0	0	0	116.1
185	S	35.9	Very low	32	Very low	99 Å²	99	135.6 Å²	135.6	69%	0.692	68%	0.682	S	S	*	*			trans	-83.7	-25.5	-177.3	54.7	0	0	0	0	115.3	A187 R188	S185-A187 PolarHBondContact O-N 2.92Å; S185-R188 PolarHBondContact O-N 2.83Å
186	W	33.6	Very low	32.3	Very low	146 Å²	146	132.7 Å²	132.7	55%	0.553	68%	0.678	S	S	*	*	H	α-helix	trans	-63.7	-34.9	-168.3	77.3	-59.7	0	0	0	114.7	R188 S189 I190	W186-R188 PolarHBondContact O-N 3.29Å; W186-S189 PolarHBondContact O-N 3.35Å; W186-I190 HydrophobicContact CE3-CD1 3.65Å; W186-I190 HydrophobicContact CZ3-CD1 3.9Å; W186-I190 PolarHBondContact O-N 3.05Å; W186-I190 VanDerWaalsContact O-N 3.14Å
187	A	34.5	Very low	32.6	Very low	52 Å²	52	129.5 Å²	129.5	43%	0.43	67%	0.667	S	S	.	*	H	α-helix	trans	-62.9	-39.3	-178	0	0	0	0	0	113	S185 I190 F191	S185-A187 PolarHBondContact O-N 2.92Å; A187-I190 PolarHBondContact O-N 3.3Å; A187-F191 PolarHBondContact O-N 3.23Å
188	R	34	Very low	32.7	Very low	199 Å²	199	123.3 Å²	123.3	75%	0.751	66%	0.658	S	S	*	*	H	α-helix	trans	-65.4	-43.9	174.5	-75.5	-174.5	170.5	99.5	-5.8	111.3	S185 W186 I190 F191 E192	S185-R188 PolarHBondContact O-N 2.83Å; W186-R188 PolarHBondContact O-N 3.29Å; R188-I190 VanDerWaalsContact C-N 3.27Å; R188-I190 PolarHBondContact O-N 2.9Å; R188-F191 PolarHBondContact O-N 3.02Å; R188-F191 VanDerWaalsContact O-N 3.14Å; R188-E192 PolarHBondContact O-N 2.84Å
189	S	37.7	Very low	32.8	Very low	39 Å²	39	123.3 Å²	123.3	27%	0.273	66%	0.657	S	S	.	*	H	α-helix	trans	-60.2	-34.5	179.2	-169	0	0	0	0	113.1	W186 R193	W186-S189 PolarHBondContact O-N 3.35Å; S189-R193 VanDerWaalsContact O-CB 3.29Å; S189-R193 WeakPolarHBondContact O-CB 3.4Å; S189-R193 WeakPolarHBondContact O-CD 3.21Å; S189-R193 WeakPolarHBondContact O-CG 3.19Å; S189-R193 PolarHBondContact O-N 2.92Å
190	I	36.6	Very low	32.8	Very low	75 Å²	75	123.6 Å²	123.6	39%	0.385	65%	0.654	S	S	.	*	H	α-helix	trans	-72.1	-42.7	175.6	-67.1	173.4	0	0	0	111.3	W186 A187 R188 E192 R193 L194	W186-I190 HydrophobicContact CE3-CD1 3.65Å; W186-I190 HydrophobicContact CZ3-CD1 3.9Å; W186-I190 PolarHBondContact O-N 3.05Å; W186-I190 VanDerWaalsContact O-N 3.14Å; A187-I190 PolarHBondContact O-N 3.3Å; R188-I190 VanDerWaalsContact C-N 3.27Å; R188-I190 PolarHBondContact O-N 2.9Å; I190-E192 VanDerWaalsContact C-N 3.32Å; I190-E192 PolarHBondContact O-N 2.93Å; I190-R193 PolarHBondContact O-N 3.02Å; I190-L194 HydrophobicContact CG2-CD1 3.79Å; I190-L194 HydrophobicContact CG2-CG 4.31Å; I190-L194 WeakPolarHBondContact O-CB 3.33Å; I190-L194 VanDerWaalsContact O-CG 3.31Å; I190-L194 WeakPolarHBondContact O-CG 3.27Å; I190-L194 PolarHBondContact O-N 3.49Å
191	F	37.7	Very low	33	Very low	138 Å²	138	121.4 Å²	121.4	61%	0.605	65%	0.646	S	S	*	*	H	α-helix	trans	-70	-23.3	177.4	-88.3	-72.3	0	0	0	114.5	A187 R188 R195	A187-F191 PolarHBondContact O-N 3.23Å; R188-F191 PolarHBondContact O-N 3.02Å; R188-F191 VanDerWaalsContact O-N 3.14Å; F191-R195 WeakPolarHBondContact O-CG 3.36Å; F191-R195 PolarHBondContact O-NH1 3.03Å
192	E	38.1	Very low	33.1	Very low	141 Å²	141	121 Å²	121	66%	0.659	64%	0.643	S	S	*	*	H	α-helix	trans	-78.2	-46.1	167.1	-72.6	-170.8	158.5	0	0	111.9	R188 I190 L194 R195 A196	R188-E192 PolarHBondContact O-N 2.84Å; I190-E192 VanDerWaalsContact C-N 3.32Å; I190-E192 PolarHBondContact O-N 2.93Å; E192-L194 VanDerWaalsContact C-N 3.28Å; E192-L194 PolarHBondContact O-N 3.11Å; E192-R195 WeakPolarHBondContact O-CA 3.4Å; E192-R195 WeakPolarHBondContact O-CB 3.35Å; E192-R195 PolarHBondContact O-N 2.82Å; E192-A196 PolarHBondContact O-N 2.95Å
193	R	33.8	Very low	33.3	Very low	179 Å²	179	122.7 Å²	122.7	68%	0.675	65%	0.649	S	S	*	*	H	α-helix	trans	-62	-33.7	178.8	-75.1	171.3	178.8	176.8	1.9	112.9	S189 I190 A196 S197	S189-R193 VanDerWaalsContact O-CB 3.29Å; S189-R193 WeakPolarHBondContact O-CB 3.4Å; S189-R193 WeakPolarHBondContact O-CD 3.21Å; S189-R193 WeakPolarHBondContact O-CG 3.19Å; S189-R193 PolarHBondContact O-N 2.92Å; I190-R193 PolarHBondContact O-N 3.02Å; R193-A196 PolarHBondContact O-N 3.28Å; R193-S197 WeakPolarHBondContact O-CB 3.48Å; R193-S197 PolarHBondContact O-N 3.17Å; R193-S197 PolarHBondContact O-OG 3.27Å
194	L	35.2	Very low	33.4	Very low	104 Å²	104	118.5 Å²	118.5	55%	0.545	65%	0.645	S	S	.	*	H	α-helix	trans	-74	-24.2	173.6	-70.5	172.6	0	0	0	113.7	I190 E192 S197 S198	I190-L194 HydrophobicContact CG2-CD1 3.79Å; I190-L194 HydrophobicContact CG2-CG 4.31Å; I190-L194 WeakPolarHBondContact O-CB 3.33Å; I190-L194 VanDerWaalsContact O-CG 3.31Å; I190-L194 WeakPolarHBondContact O-CG 3.27Å; I190-L194 PolarHBondContact O-N 3.49Å; E192-L194 VanDerWaalsContact C-N 3.28Å; E192-L194 PolarHBondContact O-N 3.11Å; L194-S197 PolarHBondContact O-OG 3.04Å; L194-S198 PolarHBondContact O-OG 3.49Å
195	R	36.2	Very low	33.4	Very low	178 Å²	178	123.7 Å²	123.7	67%	0.672	66%	0.659	S	S	*	*	H	α-helix	trans	-75.1	-43	167.2	-80	-177.6	170.5	87.5	-6.4	111.3	F191 E192 S197	F191-R195 WeakPolarHBondContact O-CG 3.36Å; F191-R195 PolarHBondContact O-NH1 3.03Å; E192-R195 WeakPolarHBondContact O-CA 3.4Å; E192-R195 WeakPolarHBondContact O-CB 3.35Å; E192-R195 PolarHBondContact O-N 2.82Å; R195-S197 VanDerWaalsContact C-N 3.29Å; R195-S197 PolarHBondContact O-N 2.9Å
196	A	34.4	Very low	33.1	Very low	84 Å²	84	123.8 Å²	123.8	69%	0.694	66%	0.66	S	S	*	*	H	α-helix	trans	-67	-24.9	179.6	0	0	0	0	0	113.8	E192 R193 S198	E192-A196 PolarHBondContact O-N 2.95Å; R193-A196 PolarHBondContact O-N 3.28Å; A196-S198 VanDerWaalsContact C-N 3.32Å; A196-S198 PolarHBondContact O-N 3.15Å
197	S	31.6	Very low	33	Very low	84 Å²	84	126.5 Å²	126.5	59%	0.587	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	9.6	-174.5	65.5	0	0	0	0	115.9	R193 L194 R195	R193-S197 WeakPolarHBondContact O-CB 3.48Å; R193-S197 PolarHBondContact O-N 3.17Å; R193-S197 PolarHBondContact O-OG 3.27Å; L194-S197 PolarHBondContact O-OG 3.04Å; R195-S197 VanDerWaalsContact C-N 3.29Å; R195-S197 PolarHBondContact O-N 2.9Å
198	S	31.3	Very low	32.7	Very low	93 Å²	93	127.9 Å²	127.9	65%	0.65	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.6	13.5	-166.1	-56.1	0	0	0	0	115.5	L194 A196	L194-S198 PolarHBondContact O-OG 3.49Å; A196-S198 VanDerWaalsContact C-N 3.32Å; A196-S198 PolarHBondContact O-N 3.15Å
199	L	28.6	Very low	32.6	Very low	157 Å²	157	126.1 Å²	126.1	82%	0.822	69%	0.687	S	S	*	*			trans	-127.7	85.8	-179.6	-75.9	168.5	0	0	0	112.1
200	T	30	Very low	32.3	Very low	129 Å²	129	131.8 Å²	131.8	79%	0.791	71%	0.709	S	S	*	*			trans	-153.9	139.5	162.8	38.8	0	0	0	0	112.3
201	S	30.1	Very low	32	Very low	107 Å²	107	133.3 Å²	133.3	75%	0.748	73%	0.726	S	S	*	*			trans	66.8	142.4	169.5	68.6	0	0	0	0	118.6
202	S	29.4	Very low	31.7	Very low	99 Å²	99	132 Å²	132	69%	0.692	73%	0.734	S	S	*	*			cis	-176.1	134.3	-15.4	48	0	0	0	0	112.8
203	T	31.9	Very low	31.4	Very low	138 Å²	138	133 Å²	133	85%	0.847	74%	0.744	S	S	*	*			trans	-167.7	122.5	150	26.1	0	0	0	0	106
204	N	29.1	Very low	31.3	Very low	155 Å²	155	127.6 Å²	127.6	83%	0.829	74%	0.744	S	S	*	*				58.7	95.9	57.3	-76.1	12.9	0	0	0	114.7
205	E	31.7	Very low	31.2	Very low	201 Å²	201	131.1 Å²	131.1	94%	0.939	76%	0.758	S	S	*	*				-155.7	178.8	122.6	-123	178.8	-143.5	0	0	111.4
206	S	29.7	Very low	30.9	Very low	102 Å²	102	128.6 Å²	128.6	71%	0.713	76%	0.757	S	S	*	*			trans	-139.2	143	-147.7	60.3	0	0	0	0	117.8
207	K	31.3	Very low	30.9	Very low	203 Å²	203	131.5 Å²	131.5	88%	0.883	76%	0.757	S	S	*	*			trans	-173.8	112.7	144.9	-98.1	144.4	-172.6	170.7	0	107.6
208	A	28.7	Very low	30.9	Very low	80 Å²	80	135.1 Å²	135.1	66%	0.661	76%	0.762	S	S	*	*				85.2	110	77.1	0	0	0	0	0	112.7
209	H	31.3	Very low	30.9	Very low	163 Å²	163	136.4 Å²	136.4	76%	0.755	76%	0.761	S	S	*	*				-176.9	142.9	113	-101	-81.4	0	0	0	112.2
210	H	31.8	Very low	31	Very low	157 Å²	157	133.5 Å²	133.5	73%	0.727	75%	0.754	S	S	*	*			trans	50.7	119.1	159.5	-60.7	-59.7	0	0	0	123.2
211	S	30.2	Very low	31	Very low	108 Å²	108	136.5 Å²	136.5	76%	0.755	75%	0.751	S	S	*	*			trans	54.6	131.5	136.1	60.5	0	0	0	0	120.4
212	S	32.3	Very low	31	Very low	110 Å²	110	139.2 Å²	139.2	77%	0.769	75%	0.749	S	S	*	*			cis	-169.5	-176.6	-1.1	60.1	0	0	0	0	107.9
213	N	31.2	Very low	31	Very low	162 Å²	162	141.2 Å²	141.2	87%	0.866	75%	0.746	S	S	*	*			cis	-154.7	172.7	6.7	-158.4	-1.9	0	0	0	109.8
214	G	30.9	Very low	30.8	Very low	65 Å²	65	140.9 Å²	140.9	67%	0.67	73%	0.734	S	S	*	*			trans	131.7	114.4	165.3	0	0	0	0	0	115.8
215	Q	33.6	Very low	30.9	Very low	179 Å²	179	140.5 Å²	140.5	84%	0.836	73%	0.727	S	S	*	*			trans	-48	163	169.4	-63.1	149.1	-33.7	0	0	114.5
216	N	31	Very low	30.7	Very low	124 Å²	124	137.2 Å²	137.2	66%	0.663	72%	0.716	S	S	*	*			cis	-172.6	174.6	-9.4	-96.3	17.8	0	0	0	105
217	E	32.3	Very low	30.7	Very low	146 Å²	146	137.2 Å²	137.2	68%	0.682	72%	0.716	S	S	*	*			cis	-171.5	-177.2	-15.7	-98.2	178	134.3	0	0	106.2
218	F	31.6	Very low	30.5	Very low	160 Å²	160	134.1 Å²	134.1	70%	0.702	71%	0.709	S	S	*	*			cis	-148	144.2	2.9	-155.7	-121.5	0	0	0	112.5
219	L	31.6	Very low	30.5	Very low	119 Å²	119	139.6 Å²	139.6	62%	0.623	72%	0.721	S	S	*	*			trans	-6	134.7	154.8	-78.5	160.7	0	0	0	125
220	S	31.4	Very low	30.2	Very low	97 Å²	97	137.4 Å²	137.4	68%	0.678	72%	0.724	S	S	*	*				84.6	162.1	121	84.3	0	0	0	0	121
221	R	29	Very low	30.1	Very low	192 Å²	192	139.3 Å²	139.3	73%	0.725	73%	0.733	S	S	*	*			cis	-167.2	149.6	-5.2	-127.2	165.6	-166.9	178.2	4.5	111.3
222	F	30.3	Very low	30	Very low	163 Å²	163	139.5 Å²	139.5	72%	0.715	73%	0.734	S	S	*	*			trans	63.2	175.4	154.9	-63.5	-30.7	0	0	0	116.5
223	K	29.5	Very low	29.7	Very low	142 Å²	142	140.5 Å²	140.5	62%	0.617	74%	0.735	S	S	*	*			cis	-168.2	162.5	-23.1	-105.7	-177.9	-179.1	-71	0	106.8
224	E	27.5	Very low	29.4	Very low	130 Å²	130	140.6 Å²	140.6	61%	0.607	74%	0.735	S	S	*	*			cis	-167.7	-176.3	-14.8	-160.1	140.2	-104.5	0	0	110.3
225	H	32.1	Very low	29.3	Very low	147 Å²	147	144.3 Å²	144.3	68%	0.681	74%	0.738	S	S	*	*			trans	66.9	114.3	159.7	-81.9	-52.9	0	0	0	123.3
226	N	27.7	Very low	28.9	Very low	132 Å²	132	140.5 Å²	140.5	71%	0.706	73%	0.732	S	S	*	*				74.8	101.9	128.6	-64	9.6	0	0	0	122.9
227	S	28.5	Very low	28.8	Very low	103 Å²	103	139.5 Å²	139.5	72%	0.72	73%	0.734	S	S	*	*				99.8	145.7	120.4	77.6	0	0	0	0	121.3
228	N	28.6	Very low	28.7	Very low	138 Å²	138	139.2 Å²	139.2	74%	0.738	74%	0.738	S	S	*	*			trans	76.4	87.4	160.2	-59.1	-15.8	0	0	0	120.3
229	H	27.9	Very low	28.7	Very low	194 Å²	194	138.2 Å²	138.2	90%	0.898	74%	0.744	S	S	*	*			trans	49.7	93.1	138.1	-69.3	-62.9	0	0	0	120.6
230	S	26.1	Very low	28.7	Very low	117 Å²	117	139.8 Å²	139.8	82%	0.818	75%	0.752	S	S	*	*			trans	-147.6	161.5	143	63.6	0	0	0	0	111.8
231	H	28.3	Very low	28.7	Very low	198 Å²	198	138.2 Å²	138.2	92%	0.917	74%	0.736	S	S	*	*			trans	-58.8	135.5	-175.2	-59.1	-98	0	0	0	114.8
232	S	27.8	Very low	28.8	Very low	112 Å²	112	134.7 Å²	134.7	78%	0.783	74%	0.738	S	S	*	*			trans	-152	131.9	150.2	61.4	0	0	0	0	110.8
233	V	26	Very low	28.9	Very low	130 Å²	130	134.9 Å²	134.9	79%	0.788	73%	0.734	S	S	*	*			trans	-70.8	134.9	177.2	172.7	0	0	0	0	109.9	I235	V233-I235 HydrophobicContact CG1-CD1 4.37Å; V233-I235 HydrophobicContact CG1-CG1 3.87Å
234	N	26.2	Very low	29	Very low	164 Å²	164	138.4 Å²	138.4	88%	0.877	74%	0.743	S	S	*	*			trans	-124.6	116.4	171	-144.1	-4.1	0	0	0	109.4
235	I	27.6	Very low	29.2	Very low	143 Å²	143	139.5 Å²	139.5	73%	0.733	75%	0.753	S	S	*	*			trans	-97.6	101.8	-175.7	-63.1	168.9	0	0	0	108.2	V233	V233-I235 HydrophobicContact CG1-CD1 4.37Å; V233-I235 HydrophobicContact CG1-CG1 3.87Å
236	S	26.9	Very low	29.1	Very low	100 Å²	100	138.2 Å²	138.2	70%	0.699	76%	0.757	S	S	*	*			trans	-85	146.7	162.1	-166.3	0	0	0	0	109.9	D238	S236-D238 PolarHBondContact O-N 2.97Å
237	S	28.3	Very low	29.1	Very low	102 Å²	102	141.2 Å²	141.2	71%	0.713	76%	0.764	S	S	*	*			trans	-101.9	75.8	-172.9	-63.9	0	0	0	0	111.8	V239	S237-V239 PolarHBondContact O-N 3.09Å; S237-V239 VanDerWaalsContact O-N 3.15Å
238	D	30.5	Very low	29.2	Very low	141 Å²	141	141.1 Å²	141.1	75%	0.754	77%	0.769	S	S	*	*			trans	-70.6	108.9	174.1	-71.3	-30.9	0	0	0	110.8	S236 I240	S236-D238 PolarHBondContact O-N 2.97Å; D238-I240 PolarHBondContact O-N 2.93Å; D238-I240 VanDerWaalsContact O-N 3.09Å
239	V	31.6	Very low	29.4	Very low	139 Å²	139	142.4 Å²	142.4	84%	0.842	77%	0.77	S	S	*	*			trans	-73.4	97.6	174.4	178.8	0	0	0	0	108.6	S237 D241	S237-V239 PolarHBondContact O-N 3.09Å; S237-V239 VanDerWaalsContact O-N 3.15Å; V239-D241 PolarHBondContact O-N 2.72Å; V239-D241 VanDerWaalsContact O-N 3.12Å
240	I	30.5	Very low	29.5	Very low	151 Å²	151	135.1 Å²	135.1	77%	0.774	75%	0.748	S	S	*	*			trans	-66.5	111.5	175.4	-60.1	177.1	0	0	0	109.1	D238 P242	D238-I240 PolarHBondContact O-N 2.93Å; D238-I240 VanDerWaalsContact O-N 3.09Å; I240-P242 WeakPolarHBondContact O-CD 3.29Å
241	D	31.5	Very low	29.5	Very low	64 Å²	64	133.8 Å²	133.8	34%	0.342	74%	0.737	S	S	.	*			trans	-59.7	115.9	173.8	172.9	17.5	0	0	0	110.9	V239 R243 R244	V239-D241 PolarHBondContact O-N 2.72Å; V239-D241 VanDerWaalsContact O-N 3.12Å; D241-R243 PolarHBondContact O-N 3.33Å; D241-R243 VanDerWaalsContact OD1-CB 3.23Å; D241-R243 WeakPolarHBondContact OD1-CB 3.15Å; D241-R243 VanDerWaalsContact OD1-CG 3.28Å; D241-R243 WeakPolarHBondContact OD1-CG 3.36Å; D241-R243 PolarHBondContact OD1-N 3.4Å; D241-R244 PolarHBondContact O-N 3.11Å
242	P	31.8	Very low	29.8	Very low	118 Å²	118	129.1 Å²	129.1	77%	0.766	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	0.3	-179.2	30.7	-36	0	0	0	113.8	I240	I240-P242 WeakPolarHBondContact O-CD 3.29Å
243	R	32.2	Very low	30.1	Very low	168 Å²	168	126.2 Å²	126.2	63%	0.634	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.4	-1.5	-179.2	-57	168.3	-178.9	161.3	3.8	113.9	D241	D241-R243 PolarHBondContact O-N 3.33Å; D241-R243 VanDerWaalsContact OD1-CB 3.23Å; D241-R243 WeakPolarHBondContact OD1-CB 3.15Å; D241-R243 VanDerWaalsContact OD1-CG 3.28Å; D241-R243 WeakPolarHBondContact OD1-CG 3.36Å; D241-R243 PolarHBondContact OD1-N 3.4Å
244	R	31.1	Very low	30.3	Very low	215 Å²	215	126.3 Å²	126.3	81%	0.811	70%	0.697	S	S	*	*			trans	-102.8	25.6	-172.5	-79.2	-173.1	169.1	-128.1	-1.6	116.6	D241	D241-R244 PolarHBondContact O-N 3.11Å
245	L	32	Very low	30.7	Very low	154 Å²	154	121.1 Å²	121.1	81%	0.806	67%	0.673	S	S	*	*	S	Bend	trans	-104.4	133.7	172	-73.2	173.1	0	0	0	112.1
246	P	30	Very low	30.9	Very low	119 Å²	119	116.9 Å²	116.9	77%	0.773	65%	0.652	S	S	*	*			trans	-67.9	137.4	-179.5	-19.5	32.2	0	0	0	113.3	A248	P246-A248 PolarHBondContact O-N 3.06Å; P246-A248 VanDerWaalsContact O-N 3.12Å
247	K	28	Very low	30.9	Very low	196 Å²	196	121.5 Å²	121.5	85%	0.852	66%	0.662	S	S	*	*			trans	-76.6	90.8	169.2	-68.1	-178.7	-179.4	177.3	0	110.5
248	A	31.2	Very low	31	Very low	100 Å²	100	121.5 Å²	121.5	83%	0.826	65%	0.65	S	S	*	*			trans	-84.7	118	168.2	0	0	0	0	0	110.2	P246	P246-A248 PolarHBondContact O-N 3.06Å; P246-A248 VanDerWaalsContact O-N 3.12Å
249	H	31	Very low	30.8	Very low	165 Å²	165	120.1 Å²	120.1	76%	0.764	65%	0.651	S	S	*	*			trans	-86.7	151.7	173.7	-83.3	-107.6	0	0	0	111.5	H861	H249-H861 PolarHBondContact O-CD2 3.04Å
250	G	30.4	Very low	30.9	Very low	42 Å²	42	121.3 Å²	121.3	43%	0.433	65%	0.645	S	S	.	*			trans	154.8	139.7	171	0	0	0	0	0	111.8	V252	G250-V252 VanDerWaalsContact C-N 3.27Å; G250-V252 PolarHBondContact O-N 3.28Å
251	P	27.6	Very low	30.9	Very low	89 Å²	89	124.7 Å²	124.7	58%	0.578	65%	0.648	S	S	*	*			trans	-78.1	75.1	-178.3	32.8	-35.6	0	0	0	111.6
252	V	33.1	Very low	30.8	Very low	100 Å²	100	127 Å²	127	61%	0.606	67%	0.666	S	S	*	*			trans	-102	130.3	156.3	-173	0	0	0	0	106.3	G250	G250-V252 VanDerWaalsContact C-N 3.27Å; G250-V252 PolarHBondContact O-N 3.28Å
253	S	35.1	Very low	30.6	Very low	50 Å²	50	128 Å²	128	35%	0.35	66%	0.664	S	S	.	*			trans	-59.4	149.8	178	59	0	0	0	0	110.2	C255	S253-C255 PolarHBondContact O-N 2.92Å; S253-C255 PolarHBondContact OG-SG 3.38Å
254	N	29.4	Very low	30.4	Very low	133 Å²	133	128.4 Å²	128.4	71%	0.711	67%	0.674	S	S	*	*			trans	-70.5	38.5	175.4	-81	-65.1	0	0	0	113.1	L256 N445	N254-L256 PolarHBondContact O-N 3.41Å; N254-N445 PolarHBondContact ND2-O 2.91Å
255	C	34.7	Very low	30.4	Very low	55 Å²	55	127.2 Å²	127.2	37%	0.372	67%	0.674	S	S	.	*			trans	-77.8	94	171.7	-69.6	0	0	0	0	110.3	S253	S253-C255 PolarHBondContact O-N 2.92Å; S253-C255 PolarHBondContact OG-SG 3.38Å
256	L	32.6	Very low	30.3	Very low	53 Å²	53	124.6 Å²	124.6	28%	0.277	67%	0.669	S	S	.	*			trans	69.1	73	150.3	-47.3	179	0	0	0	115.2	N254 F258 A732	N254-L256 PolarHBondContact O-N 3.41Å; L256-F258 HydrophobicContact CB-CD2 3.83Å; L256-F258 HydrophobicContact CB-CE2 4.05Å; L256-F258 HydrophobicContact CD1-CD2 4.34Å; L256-F258 HydrophobicContact CD1-CE2 3.96Å; L256-F258 HydrophobicContact CD2-CD2 4.35Å; L256-F258 HydrophobicContact CD2-CE2 3.71Å; L256-F258 HydrophobicContact CD2-CZ 4.12Å; L256-F258 HydrophobicContact CG-CD2 4.39Å; L256-F258 HydrophobicContact CG-CE2 4.11Å; L256-F258 PolarHBondContact O-N 3.27Å; L256-A732 HydrophobicContact CD1-CB 3.2Å
257	E	26.8	Very low	30.2	Very low	198 Å²	198	123.3 Å²	123.3	93%	0.925	66%	0.655	S	S	*	*			trans	-71	80	149.8	-171	173.4	-148.7	0	0	109.6
258	F	30.7	Very low	30.3	Very low	102 Å²	102	121 Å²	121	45%	0.447	65%	0.652	S	S	.	*			trans	-90.7	119.1	168	-79.7	-53.2	0	0	0	110.6	L256 K260 L736	L256-F258 HydrophobicContact CB-CD2 3.83Å; L256-F258 HydrophobicContact CB-CE2 4.05Å; L256-F258 HydrophobicContact CD1-CD2 4.34Å; L256-F258 HydrophobicContact CD1-CE2 3.96Å; L256-F258 HydrophobicContact CD2-CD2 4.35Å; L256-F258 HydrophobicContact CD2-CE2 3.71Å; L256-F258 HydrophobicContact CD2-CZ 4.12Å; L256-F258 HydrophobicContact CG-CD2 4.39Å; L256-F258 HydrophobicContact CG-CE2 4.11Å; L256-F258 PolarHBondContact O-N 3.27Å; F258-K260 VanDerWaalsContact C-N 3.29Å; F258-K260 PolarHBondContact O-N 3.44Å; F258-L736 HydrophobicContact CD2-CD1 4.47Å; F258-L736 HydrophobicContact CE2-CD1 3.87Å; F258-L736 HydrophobicContact CZ-CD1 4.24Å
259	S	26	Very low	30.2	Very low	111 Å²	111	125.4 Å²	125.4	78%	0.776	65%	0.649	S	S	*	*			trans	-65.9	81.5	171.7	-179.4	0	0	0	0	111.5	R261	S259-R261 VanDerWaalsContact C-N 3.29Å; S259-R261 PolarHBondContact O-N 3.29Å
260	K	34.1	Very low	30.2	Very low	165 Å²	165	125.6 Å²	125.6	72%	0.717	66%	0.655	S	S	*	*			trans	-74.7	82.4	163.8	-75.5	-165.5	174.6	-170.1	0	109.3	F258 P262	F258-K260 VanDerWaalsContact C-N 3.29Å; F258-K260 PolarHBondContact O-N 3.44Å; K260-P262 WeakPolarHBondContact O-CD 3.36Å
261	R	28.8	Very low	30	Very low	222 Å²	222	130 Å²	130	84%	0.838	66%	0.663	S	S	*	*			trans	-64.9	119.4	152.7	-76.8	-171.3	176.6	-170.1	-0.6	107.1	S259 L263	S259-R261 VanDerWaalsContact C-N 3.29Å; S259-R261 PolarHBondContact O-N 3.29Å; R261-L263 PolarHBondContact O-N 2.94Å
262	P	29.6	Very low	30.2	Very low	112 Å²	112	131.4 Å²	131.4	73%	0.727	68%	0.676	S	S	*	*			trans	-68.2	122.3	172.6	28	-32.2	0	0	0	108.5	K260 Q264	K260-P262 WeakPolarHBondContact O-CD 3.36Å; P262-Q264 PolarHBondContact O-N 3.28Å
263	L	28.6	Very low	30.1	Very low	138 Å²	138	134.3 Å²	134.3	72%	0.723	68%	0.68	S	S	*	*			trans	-64.1	106.1	162.1	-75.3	173.2	0	0	0	107.2	R261 K265	R261-L263 PolarHBondContact O-N 2.94Å; L263-K265 PolarHBondContact O-N 2.87Å
264	Q	28.5	Very low	29.8	Very low	178 Å²	178	137 Å²	137	83%	0.832	70%	0.699	S	S	*	*			trans	-63.2	108.2	170.4	-74.9	-174	-23.5	0	0	107.8	P262 S266	P262-Q264 PolarHBondContact O-N 3.28Å; Q264-S266 VanDerWaalsContact C-N 3.35Å; Q264-S266 PolarHBondContact O-N 2.72Å
265	K	31.2	Very low	29.9	Very low	190 Å²	190	138 Å²	138	83%	0.826	70%	0.703	S	S	*	*			trans	-62.7	100.8	163.6	-75.8	-173.6	175.3	-179.9	0	107.8	L263 N267	L263-K265 PolarHBondContact O-N 2.87Å; K265-N267 PolarHBondContact O-N 2.74Å
266	S	28.1	Very low	29.7	Very low	98 Å²	98	140.5 Å²	140.5	69%	0.685	72%	0.718	S	S	*	*			trans	-65.6	99.3	171.1	35.6	0	0	0	0	108.6	Q264 N268	Q264-S266 VanDerWaalsContact C-N 3.35Å; Q264-S266 PolarHBondContact O-N 2.72Å; S266-N268 PolarHBondContact O-N 2.57Å
267	N	27.9	Very low	29.7	Very low	92 Å²	92	144.1 Å²	144.1	49%	0.492	74%	0.743	S	S	.	*			trans	-68.8	68.9	175.6	-83.6	-21.2	0	0	0	111.3	K265 Y269	K265-N267 PolarHBondContact O-N 2.74Å; N267-Y269 HydrophobicContact CB-CD2 4.35Å; N267-Y269 PolarHBondContact O-N 3.29Å
268	N	30.6	Very low	29.8	Very low	148 Å²	148	139.4 Å²	139.4	79%	0.791	73%	0.732	S	S	*	*			trans	-78	66.9	169.2	-76.8	2.9	0	0	0	109.9	S266 L270	S266-N268 PolarHBondContact O-N 2.57Å; N268-L270 VanDerWaalsContact C-N 3.34Å; N268-L270 PolarHBondContact O-N 3.28Å
269	Y	28.5	Very low	29.7	Very low	192 Å²	192	139.2 Å²	139.2	75%	0.753	74%	0.743	S	S	*	*			trans	-70	90.3	166.2	-91.6	-86.8	0	0	0	109.5	N267 H271	N267-Y269 HydrophobicContact CB-CD2 4.35Å; N267-Y269 PolarHBondContact O-N 3.29Å; Y269-H271 VanDerWaalsContact C-N 3.26Å; Y269-H271 PolarHBondContact O-N 2.83Å
270	L	31.1	Very low	30	Very low	169 Å²	169	139.8 Å²	139.8	89%	0.885	74%	0.742	S	S	*	*			trans	-71.5	89.2	162.7	-95.6	168.7	0	0	0	109.2	N268 S272	N268-L270 VanDerWaalsContact C-N 3.34Å; N268-L270 PolarHBondContact O-N 3.28Å; L270-S272 PolarHBondContact O-N 3.23Å
271	H	28.2	Very low	29.9	Very low	134 Å²	134	140.7 Å²	140.7	62%	0.62	75%	0.748	S	S	*	*			trans	-58.8	117.9	168.1	-110.8	88.2	0	0	0	109.9	Y269 K273	Y269-H271 VanDerWaalsContact C-N 3.26Å; Y269-H271 PolarHBondContact O-N 2.83Å; H271-K273 WeakPolarHBondContact NE2-CE 3.2Å
272	S	30.6	Very low	30.2	Very low	120 Å²	120	133.5 Å²	133.5	84%	0.839	74%	0.743	S	S	*	*			trans	-119	107.7	149.6	41	0	0	0	0	107.4	L270	L270-S272 PolarHBondContact O-N 3.23Å
273	K	30.4	Very low	30.3	Very low	160 Å²	160	134.9 Å²	134.9	70%	0.696	74%	0.744	S	S	*	*			trans	-95	161.4	173.6	-99.2	171.9	178.7	175	0	108.8	H271	H271-K273 WeakPolarHBondContact NE2-CE 3.2Å
274	S	29.4	Very low	30.5	Very low	108 Å²	108	134.7 Å²	134.7	76%	0.755	74%	0.743	S	S	*	*			trans	63.9	152.3	161.7	39.1	0	0	0	0	116.5
275	I	32.6	Very low	30.7	Very low	153 Å²	153	134.2 Å²	134.2	79%	0.785	74%	0.743	S	S	*	*			cis	-148.7	155.1	-8.1	-116	157.1	0	0	0	107.4
276	P	29.2	Very low	30.7	Very low	107 Å²	107	130.1 Å²	130.1	70%	0.695	74%	0.738	S	S	*	*			trans	-82.6	-178.7	177.5	34.6	-35.8	0	0	0	113.5
277	V	33.1	Very low	31.2	Very low	130 Å²	130	130.9 Å²	130.9	79%	0.788	74%	0.741	S	S	*	*			trans	99.5	103.5	165.9	-174.3	0	0	0	0	117
278	S	27.9	Very low	31.3	Very low	99 Å²	99	131 Å²	131	69%	0.692	75%	0.749	S	S	*	*			trans	40.2	137.8	148.7	68.8	0	0	0	0	124.6
279	S	30.4	Very low	31.4	Very low	98 Å²	98	131.5 Å²	131.5	69%	0.685	75%	0.751	S	S	*	*			trans	81.6	125.3	132.4	58	0	0	0	0	122.6
280	T	32.2	Very low	31.5	Very low	122 Å²	122	126.1 Å²	126.1	75%	0.748	74%	0.741	S	S	*	*			trans	73.8	108.1	139.3	48.9	0	0	0	0	122.2
281	H	31.7	Very low	31.5	Very low	185 Å²	185	125.5 Å²	125.5	86%	0.856	74%	0.739	S	S	*	*				65.3	110.2	129.6	-92.5	-87.3	0	0	0	121.8
282	G	33.7	Very low	31.7	Very low	70 Å²	70	123.8 Å²	123.8	72%	0.722	74%	0.742	S	S	*	*			trans	82.2	161.1	137.7	0	0	0	0	0	117.7
283	D	32.1	Very low	31.8	Very low	141 Å²	141	125.9 Å²	125.9	75%	0.754	74%	0.743	S	S	*	*			cis	-163.3	170.4	-21.5	-141.8	-34.5	0	0	0	110.1
284	L	33	Very low	31.6	Very low	135 Å²	135	126.7 Å²	126.7	71%	0.707	75%	0.749	S	S	*	*			trans	70.6	135	153.1	-67.5	164.3	0	0	0	121.9
285	M	33	Very low	31.8	Very low	167 Å²	167	126.2 Å²	126.2	82%	0.823	74%	0.744	S	S	*	*			trans	84.5	94.6	152.9	-62.5	-61.6	149.2	0	0	122.2
286	S	31	Very low	31.6	Very low	105 Å²	105	123.5 Å²	123.5	73%	0.734	74%	0.738	S	S	*	*			trans	-76.6	-165.6	135	67.3	0	0	0	0	109.7
287	P	39.5	Very low	31.6	Very low	114 Å²	114	124.9 Å²	124.9	74%	0.74	74%	0.74	S	S	*	*			cis	-139.2	-155.3	31	48.8	-28.2	0	0	0	111.3
288	S	30.2	Very low	31.3	Very low	94 Å²	94	123.9 Å²	123.9	66%	0.657	73%	0.734	S	S	*	*			cis	-166.7	-172.8	-32	42.7	0	0	0	0	109.4
289	L	32	Very low	31.5	Very low	158 Å²	158	125.8 Å²	125.8	83%	0.827	74%	0.736	S	S	*	*			trans	86.2	146.2	159.6	-50.7	-178.2	0	0	0	119.8
290	S	31	Very low	31.5	Very low	79 Å²	79	127 Å²	127	55%	0.552	74%	0.735	S	S	*	*			cis	-174.9	146.6	-31.6	54.7	0	0	0	0	112.4
291	N	31.3	Very low	31.4	Very low	156 Å²	156	126.7 Å²	126.7	83%	0.834	73%	0.729	S	S	*	*			trans	69.3	161.7	159	-50.5	-25.4	0	0	0	116.5
292	S	30.9	Very low	31.4	Very low	99 Å²	99	127 Å²	127	69%	0.692	73%	0.73	S	S	*	*			cis	-155.7	135.1	14.2	-157.9	0	0	0	0	115.7
293	L	32.2	Very low	31.2	Very low	163 Å²	163	129.7 Å²	129.7	85%	0.853	73%	0.727	S	S	*	*			trans	59	168.1	144.9	-78.5	160.2	0	0	0	124.1
294	Q	27.7	Very low	31.3	Very low	177 Å²	177	132.4 Å²	132.4	83%	0.827	73%	0.732	S	S	*	*			trans	-117	-157.8	-166.5	-56.4	-176.9	-35.1	0	0	110.1
295	P	33.9	Very low	31.1	Very low	99 Å²	99	132.5 Å²	132.5	64%	0.643	73%	0.729	S	S	*	*			cis	-147.2	168.3	-2.2	43.8	-23.5	0	0	0	120.4
296	S	27.3	Very low	31.1	Very low	95 Å²	95	136.6 Å²	136.6	66%	0.664	74%	0.735	S	S	*	*			trans	59	153.3	136.1	69	0	0	0	0	125.4
297	N	29	Very low	31	Very low	137 Å²	137	140.9 Å²	140.9	73%	0.733	74%	0.735	S	S	*	*			trans	82	117.2	165.5	-63.3	-24.7	0	0	0	117.3
298	T	28.3	Very low	30.4	Very low	109 Å²	109	147 Å²	147	67%	0.669	74%	0.743	S	S	*	*			cis	101.6	147.3	29.7	66.7	0	0	0	0	113.8
299	N	30.5	Very low	30.3	Very low	138 Å²	138	148.2 Å²	148.2	74%	0.738	74%	0.741	S	S	*	*			trans	71.8	143.1	-179.7	-63.3	-36.3	0	0	0	117.4
300	N	30.3	Very low	30.1	Very low	125 Å²	125	149.8 Å²	149.8	67%	0.668	74%	0.736	S	S	*	*			cis	-162.4	168.7	-32.4	-133	-31.4	0	0	0	111.4
301	N	31.4	Very low	29.9	Very low	114 Å²	114	156.3 Å²	156.3	61%	0.61	75%	0.749	S	S	*	*			trans	57.7	112.3	159.1	-60.1	-28.3	0	0	0	120.3
302	H	30.9	Very low	29.6	Very low	192 Å²	192	155.4 Å²	155.4	89%	0.889	74%	0.737	S	S	*	*				-160.4	109.8	101.3	-109.8	-72.9	0	0	0	111.7
303	I	30.8	Very low	29.5	Very low	126 Å²	126	155.5 Å²	155.5	65%	0.646	74%	0.738	S	S	*	*			trans	-91.4	124.7	-174.6	-62.4	169.9	0	0	0	110.5
304	K	32.4	Very low	29.3	Very low	198 Å²	198	155.4 Å²	155.4	86%	0.861	73%	0.733	S	S	*	*			trans	-102.9	97.7	163.3	-77.8	-171.3	175.7	-178.6	0	110.4	R306	K304-R306 PolarHBondContact O-N 3.43Å
305	H	30.2	Very low	29.4	Very low	138 Å²	138	151.7 Å²	151.7	64%	0.639	73%	0.727	S	S	*	*			trans	-66.3	125.5	176.9	-78.9	-80.2	0	0	0	112.7	R307	H305-R307 HydrophobicContact CB-CG 4.18Å
306	R	33.1	Very low	29.2	Very low	252 Å²	252	152.7 Å²	152.7	95%	0.951	73%	0.731	S	S	*	*			trans	-90.9	91.1	151.5	-91.1	-172.9	167.8	-179	-2.3	109.8	K304 R308	K304-R306 PolarHBondContact O-N 3.43Å; R306-R308 PolarHBondContact O-N 3.19Å
307	R	28.4	Very low	29.3	Very low	195 Å²	195	153.2 Å²	153.2	74%	0.736	74%	0.735	S	S	*	*			trans	-75.7	113.7	172.4	-69.5	-179.2	177.2	167	-1.9	110.2	H305 I309	H305-R307 HydrophobicContact CB-CG 4.18Å; R307-I309 HydrophobicContact CB-CG1 4.2Å
308	R	26.7	Very low	29.3	Very low	243 Å²	243	152.5 Å²	152.5	92%	0.917	74%	0.739	S	S	*	*			trans	-94.1	102.5	151.2	-176	179	-73.5	177.7	-2.8	106.9	R306 R310	R306-R308 PolarHBondContact O-N 3.19Å; R308-R310 PolarHBondContact O-N 3.28Å
309	I	28.4	Very low	29.3	Very low	120 Å²	120	154 Å²	154	62%	0.615	74%	0.743	S	S	*	*			trans	-71	113.8	-174.7	-59.9	174.8	0	0	0	109	R307	R307-I309 HydrophobicContact CB-CG1 4.2Å
310	R	27.9	Very low	29.5	Very low	191 Å²	191	154.1 Å²	154.1	72%	0.721	75%	0.749	S	S	*	*			trans	-97	111.7	167.4	-170.4	173.1	-172.3	172.2	3.3	107.4	R308 F312	R308-R310 PolarHBondContact O-N 3.28Å; R310-F312 HydrophobicContact CG-CD2 4.31Å; R310-F312 HydrophobicContact CG-CE2 4.14Å; R310-F312 PolarHBondContact O-N 2.81Å
311	W	25.4	Very low	29.4	Very low	215 Å²	215	151.6 Å²	151.6	81%	0.814	75%	0.753	S	S	*	*			trans	-71.6	93.8	178.8	-76.4	89.3	0	0	0	110.6
312	F	26.9	Very low	29.5	Very low	137 Å²	137	152.8 Å²	152.8	60%	0.601	77%	0.767	S	S	*	*			trans	-89.3	111.9	156	-78.6	-81.5	0	0	0	108.5	R310 H314	R310-F312 HydrophobicContact CG-CD2 4.31Å; R310-F312 HydrophobicContact CG-CE2 4.14Å; R310-F312 PolarHBondContact O-N 2.81Å; F312-H314 PolarHBondContact O-N 2.83Å
313	S	28.3	Very low	29.4	Very low	102 Å²	102	146.9 Å²	146.9	71%	0.713	76%	0.758	S	S	*	*			trans	-84.4	88.3	163.4	-59.6	0	0	0	0	108.5
314	H	27	Very low	29.3	Very low	160 Å²	160	148.6 Å²	148.6	74%	0.741	77%	0.768	S	S	*	*			trans	-82.3	128.4	158	-82.5	-84.4	0	0	0	108.5	F312	F312-H314 PolarHBondContact O-N 2.83Å
315	S	29.8	Very low	29.2	Very low	99 Å²	99	144.6 Å²	144.6	69%	0.692	76%	0.763	S	S	*	*			trans	-148.3	97.9	164.7	-52	0	0	0	0	105.6
316	T	30.3	Very low	29.2	Very low	120 Å²	120	143.8 Å²	143.8	74%	0.736	77%	0.767	S	S	*	*				53.2	119.8	83.7	66.9	0	0	0	0	112.4
317	S	28.5	Very low	29	Very low	107 Å²	107	139.6 Å²	139.6	75%	0.748	76%	0.763	S	S	*	*			cis	160	94.4	-13	38.7	0	0	0	0	104.8
318	C	29.4	Very low	29	Very low	121 Å²	121	134.8 Å²	134.8	82%	0.818	76%	0.759	S	S	*	*			trans	-178.6	141.3	170.5	51.3	0	0	0	0	109.1
319	D	29.7	Very low	29	Very low	140 Å²	140	128.5 Å²	128.5	75%	0.749	75%	0.752	S	S	*	*			cis	-161.9	141.7	-23.1	-148.2	-20.4	0	0	0	109
320	T	33	Very low	29.2	Very low	141 Å²	141	127.9 Å²	127.9	87%	0.865	76%	0.759	S	S	*	*			trans	55.2	151.3	177	64.6	0	0	0	0	117.9
321	G	28.1	Very low	29.2	Very low	72 Å²	72	123.8 Å²	123.8	74%	0.742	75%	0.751	S	S	*	*			cis	-166	169.7	-7.7	0	0	0	0	0	110.2
322	P	33.3	Very low	29.2	Very low	140 Å²	140	120 Å²	120	91%	0.909	74%	0.738	S	S	*	*			trans	-110.5	170	-166.9	40.7	-34.2	0	0	0	116.2
323	G	28.9	Very low	29.2	Very low	68 Å²	68	121.7 Å²	121.7	70%	0.701	75%	0.747	S	S	*	*			trans	115.2	144.9	170.4	0	0	0	0	0	113.7
324	D	28.9	Very low	29.2	Very low	162 Å²	162	122.8 Å²	122.8	87%	0.866	76%	0.755	S	S	*	*			cis	-154.3	160.4	-11.6	-119.9	-13.9	0	0	0	110.9
325	P	31.2	Very low	29.4	Very low	114 Å²	114	122.9 Å²	122.9	74%	0.74	76%	0.756	S	S	*	*			trans	-108.7	127.4	-172.3	36.9	-28.6	0	0	0	114.6
326	T	29.2	Very low	29.6	Very low	120 Å²	120	123.1 Å²	123.1	74%	0.736	75%	0.749	S	S	*	*			trans	-144.4	122.8	174.9	50.7	0	0	0	0	114.8
327	L	28.8	Very low	29.9	Very low	164 Å²	164	120.5 Å²	120.5	86%	0.859	74%	0.735	S	S	*	*			trans	62	145.9	156.1	-76.5	80.6	0	0	0	118.4
328	S	28.4	Very low	30.6	Very low	95 Å²	95	119.4 Å²	119.4	66%	0.664	73%	0.728	S	S	*	*			cis	-159.9	147.4	-14	48.5	0	0	0	0	111.6
329	S	28.6	Very low	31.7	Very low	110 Å²	110	116.5 Å²	116.5	77%	0.769	71%	0.709	S	S	*	*			trans	22.7	126.2	145.8	-51.6	0	0	0	0	118.7
330	S	30.6	Very low	32.3	Very low	108 Å²	108	111 Å²	111	76%	0.755	68%	0.682	S	S	*	*				-150.8	149.2	63.5	52.5	0	0	0	0	117
331	N	29.1	Very low	33.2	Very low	105 Å²	105	108.5 Å²	108.5	56%	0.561	66%	0.663	S	S	*	*			trans	-11	147.7	155.2	-43.4	-22.2	0	0	0	117.2
332	Y	24.5	Very low	34.3	Very low	136 Å²	136	111.5 Å²	111.5	53%	0.533	66%	0.658	S	S	.	*			cis	-141.8	136.5	26.6	-64.3	-97.9	0	0	0	112.3	L982	Y332-L982 HydrophobicContact CD1-CD1 3.74Å; Y332-L982 HydrophobicContact CD2-CB 4.35Å; Y332-L982 HydrophobicContact CE1-CD1 3.72Å; Y332-L982 HydrophobicContact CE2-CD1 4.5Å; Y332-L982 HydrophobicContact CG-CB 4.2Å; Y332-L982 HydrophobicContact CG-CD1 4.18Å
333	H	27.8	Very low	35	Very low	172 Å²	172	110.7 Å²	110.7	80%	0.796	64%	0.641	S	S	*	*			trans	-155.4	138.8	157.9	-119.8	-73.7	0	0	0	110.8	Q335	H333-Q335 HydrophobicContact CB-CG 4.33Å; H333-Q335 PolarHBondContact O-N 3.46Å
334	S	27.6	Very low	36.1	Very low	124 Å²	124	111.9 Å²	111.9	87%	0.867	63%	0.631	S	S	*	*			trans	-74.9	69.4	173.4	41.1	0	0	0	0	111.4
335	Q	32.6	Very low	37.3	Very low	163 Å²	163	109.6 Å²	109.6	76%	0.762	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-71	132.5	174.6	-64.1	-169.5	-1.5	0	0	110.7	H333	H333-Q335 HydrophobicContact CB-CG 4.33Å; H333-Q335 PolarHBondContact O-N 3.46Å
336	L	32.8	Very low	38.3	Very low	104 Å²	104	105.5 Å²	105.5	55%	0.545	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-54.1	140	155.9	-72.1	161.2	0	0	0	108	I341	L336-I341 HydrophobicContact CB-CD1 4.48Å; L336-I341 HydrophobicContact CB-CG1 4.13Å
337	S	37	Very low	39.4	Very low	65 Å²	65	101 Å²	101	46%	0.455	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-55.3	146.9	-178.9	60.9	0	0	0	0	111	S339 A340 I341	S337-S339 PolarHBondContact O-N 2.79Å; S337-S339 VanDerWaalsContact O-N 3.16Å; S337-S339 PolarHBondContact OG-OG 2.94Å; S337-A340 WeakPolarHBondContact O-CA 3.43Å; S337-A340 WeakPolarHBondContact O-CB 3.3Å; S337-A340 PolarHBondContact O-N 3.37Å; S337-A340 PolarHBondContact OG-N 3.18Å; S337-I341 PolarHBondContact O-N 3.05Å
338	S	43.3	Very low	40.5	Very low	84 Å²	84	96.7 Å²	96.7	59%	0.587	55%	0.549	S	S	*	.	H	α-helix	trans	-49.7	-42.1	175.4	46.1	0	0	0	0	111.5	A340 I341 E342	S338-A340 VanDerWaalsContact C-N 3.34Å; S338-A340 PolarHBondContact O-N 3.46Å; S338-I341 CarbonylContact O-C 3.55Å; S338-I341 PolarHBondContact O-N 3.09Å; S338-I341 VanDerWaalsContact O-N 3.16Å; S338-E342 WeakPolarHBondContact O-CB 3.37Å; S338-E342 WeakPolarHBondContact O-CG 3.25Å; S338-E342 PolarHBondContact O-N 3.29Å
339	S	51.4	Low	41.4	Very low	60 Å²	60	95 Å²	95	42%	0.42	54%	0.537	S	S	.	.	H	α-helix	trans	-57.3	-37.2	173	58.2	0	0	0	0	114.7	S337 E343	S337-S339 PolarHBondContact O-N 2.79Å; S337-S339 VanDerWaalsContact O-N 3.16Å; S337-S339 PolarHBondContact OG-OG 2.94Å; S339-E343 WeakPolarHBondContact O-CB 3.29Å; S339-E343 VanDerWaalsContact O-CG 3.3Å; S339-E343 WeakPolarHBondContact O-CG 3.37Å; S339-E343 PolarHBondContact O-N 2.91Å
340	A	42.7	Very low	42.4	Very low	23 Å²	23	95.9 Å²	95.9	19%	0.19	53%	0.532	C	S	.	.	H	α-helix	trans	-75.6	-34.3	177.4	0	0	0	0	0	111.5	S337 S338 I344	S337-A340 WeakPolarHBondContact O-CA 3.43Å; S337-A340 WeakPolarHBondContact O-CB 3.3Å; S337-A340 PolarHBondContact O-N 3.37Å; S337-A340 PolarHBondContact OG-N 3.18Å; S338-A340 VanDerWaalsContact C-N 3.34Å; S338-A340 PolarHBondContact O-N 3.46Å; A340-I344 WeakPolarHBondContact O-CB 3.2Å; A340-I344 WeakPolarHBondContact O-CD1 3.42Å; A340-I344 WeakPolarHBondContact O-CG1 3.16Å; A340-I344 PolarHBondContact O-N 3.47Å
341	I	52.4	Low	42.9	Very low	90 Å²	90	96.4 Å²	96.4	46%	0.462	53%	0.525	S	S	.	.	H	α-helix	trans	-67.4	-40.8	172.6	-61.7	175.8	0	0	0	110	L336 S337 S338 I344 Q345	L336-I341 HydrophobicContact CB-CD1 4.48Å; L336-I341 HydrophobicContact CB-CG1 4.13Å; S337-I341 PolarHBondContact O-N 3.05Å; S338-I341 CarbonylContact O-C 3.55Å; S338-I341 PolarHBondContact O-N 3.09Å; S338-I341 VanDerWaalsContact O-N 3.16Å; I341-I344 PolarHBondContact O-N 2.71Å; I341-Q345 WeakPolarHBondContact O-CB 3.36Å; I341-Q345 PolarHBondContact O-N 2.75Å
342	E	51.5	Low	43.8	Very low	135 Å²	135	94.7 Å²	94.7	63%	0.631	53%	0.526	S	S	*	.	H	α-helix	trans	-67.7	-39.4	174.3	-74.1	169.5	-169	0	0	112.7	S338 Q345 G346	S338-E342 WeakPolarHBondContact O-CB 3.37Å; S338-E342 WeakPolarHBondContact O-CG 3.25Å; S338-E342 PolarHBondContact O-N 3.29Å; E342-Q345 PolarHBondContact O-N 3.09Å; E342-G346 WeakPolarHBondContact O-CA 3.37Å; E342-G346 PolarHBondContact O-N 2.79Å
343	E	48.6	Very low	44.4	Very low	122 Å²	122	90.2 Å²	90.2	57%	0.57	52%	0.521	S	S	*	.	H	α-helix	trans	-64.7	-42.2	173.2	-80.9	178.9	177.6	0	0	111.7	S339 G346 A347	S339-E343 WeakPolarHBondContact O-CB 3.29Å; S339-E343 VanDerWaalsContact O-CG 3.3Å; S339-E343 WeakPolarHBondContact O-CG 3.37Å; S339-E343 PolarHBondContact O-N 2.91Å; E343-G346 PolarHBondContact O-N 2.98Å; E343-A347 PolarHBondContact O-N 3.41Å
344	I	50.3	Low	44.8	Very low	93 Å²	93	92.7 Å²	92.7	48%	0.477	52%	0.524	S	S	.	.	H	α-helix	trans	-67.3	-45.5	175.4	-69.9	166	0	0	0	110.5	A340 I341 G346 A347 V348	A340-I344 WeakPolarHBondContact O-CB 3.2Å; A340-I344 WeakPolarHBondContact O-CD1 3.42Å; A340-I344 WeakPolarHBondContact O-CG1 3.16Å; A340-I344 PolarHBondContact O-N 3.47Å; I341-I344 PolarHBondContact O-N 2.71Å; I344-G346 VanDerWaalsContact C-N 3.27Å; I344-G346 PolarHBondContact O-N 2.85Å; I344-A347 PolarHBondContact O-N 2.83Å; I344-V348 WeakPolarHBondContact O-CG2 3.41Å; I344-V348 PolarHBondContact O-N 3.5Å
345	Q	55.1	Low	45.2	Very low	114 Å²	114	94.2 Å²	94.2	53%	0.533	52%	0.517	S	S	.	.	H	α-helix	trans	-64.3	-33.1	176.2	-175.8	61	21.1	0	0	111.5	I341 E342 V348 S349	I341-Q345 WeakPolarHBondContact O-CB 3.36Å; I341-Q345 PolarHBondContact O-N 2.75Å; E342-Q345 PolarHBondContact O-N 3.09Å; Q345-V348 PolarHBondContact O-N 3.06Å; Q345-S349 VanDerWaalsContact O-CB 3.27Å; Q345-S349 WeakPolarHBondContact O-CB 3.43Å; Q345-S349 PolarHBondContact O-N 2.87Å; Q345-S349 PolarHBondContact O-OG 3.23Å
346	G	52.4	Low	45.2	Very low	28 Å²	28	93.3 Å²	93.3	29%	0.289	52%	0.522	S	S	.	.	H	α-helix	trans	-65.4	-47	171.8	0	0	0	0	0	111.8	E342 E343 I344 V348 S349 I350	E342-G346 WeakPolarHBondContact O-CA 3.37Å; E342-G346 PolarHBondContact O-N 2.79Å; E343-G346 PolarHBondContact O-N 2.98Å; I344-G346 VanDerWaalsContact C-N 3.27Å; I344-G346 PolarHBondContact O-N 2.85Å; G346-V348 VanDerWaalsContact C-N 3.34Å; G346-V348 PolarHBondContact O-N 3.09Å; G346-S349 PolarHBondContact O-N 3.12Å; G346-S349 VanDerWaalsContact O-N 3.15Å; G346-I350 VanDerWaalsContact O-CG1 3.3Å; G346-I350 WeakPolarHBondContact O-CG1 3.41Å; G346-I350 PolarHBondContact O-N 3.38Å
347	A	52.4	Low	45	Very low	26 Å²	26	96.3 Å²	96.3	22%	0.215	53%	0.531	C	S	.	.	H	α-helix	trans	-60.9	-41.4	173.6	0	0	0	0	0	112.2	E343 I344 I350 L351	E343-A347 PolarHBondContact O-N 3.41Å; I344-A347 PolarHBondContact O-N 2.83Å; A347-I350 PolarHBondContact O-N 3.12Å; A347-L351 WeakPolarHBondContact O-CG 3.24Å; A347-L351 PolarHBondContact O-N 3.15Å
348	V	52.3	Low	44.8	Very low	73 Å²	73	98.3 Å²	98.3	44%	0.442	54%	0.543	S	S	.	.	H	α-helix	trans	-64.3	-38.7	173	169.9	0	0	0	0	111.5	I344 Q345 G346 L351 A352	I344-V348 WeakPolarHBondContact O-CG2 3.41Å; I344-V348 PolarHBondContact O-N 3.5Å; Q345-V348 PolarHBondContact O-N 3.06Å; G346-V348 VanDerWaalsContact C-N 3.34Å; G346-V348 PolarHBondContact O-N 3.09Å; V348-L351 PolarHBondContact O-N 3.46Å; V348-A352 WeakPolarHBondContact O-CB 3.45Å; V348-A352 PolarHBondContact O-N 2.81Å
349	S	47.5	Very low	44	Very low	59 Å²	59	100.4 Å²	100.4	41%	0.413	56%	0.557	S	S	.	*	H	α-helix	trans	-68.9	-35.7	177	-61.5	0	0	0	0	112.4	Q345 G346 A352 G353	Q345-S349 VanDerWaalsContact O-CB 3.27Å; Q345-S349 WeakPolarHBondContact O-CB 3.43Å; Q345-S349 PolarHBondContact O-N 2.87Å; Q345-S349 PolarHBondContact O-OG 3.23Å; G346-S349 PolarHBondContact O-N 3.12Å; G346-S349 VanDerWaalsContact O-N 3.15Å; S349-A352 PolarHBondContact O-N 3.11Å; S349-G353 PolarHBondContact O-N 3.21Å
350	I	48.8	Very low	42.9	Very low	129 Å²	129	102.2 Å²	102.2	66%	0.662	57%	0.57	S	S	*	*	H	α-helix	trans	-65.1	-40.5	172	-69.4	162.7	0	0	0	110.7	G346 A347 A352	G346-I350 VanDerWaalsContact O-CG1 3.3Å; G346-I350 WeakPolarHBondContact O-CG1 3.41Å; G346-I350 PolarHBondContact O-N 3.38Å; A347-I350 PolarHBondContact O-N 3.12Å; I350-A352 VanDerWaalsContact C-N 3.34Å
351	L	41.8	Very low	42.4	Very low	119 Å²	119	109 Å²	109	62%	0.623	60%	0.601	S	S	*	*	H	α-helix	trans	-67.2	-33.1	174.2	-71	166.6	0	0	0	112.6	A347 V348	A347-L351 WeakPolarHBondContact O-CG 3.24Å; A347-L351 PolarHBondContact O-N 3.15Å; V348-L351 PolarHBondContact O-N 3.46Å
352	A	46.7	Very low	41.1	Very low	70 Å²	70	109.8 Å²	109.8	58%	0.579	62%	0.622	S	S	*	*	H	α-helix	trans	-77.2	-34.6	176	0	0	0	0	0	113.3	V348 S349 I350	V348-A352 WeakPolarHBondContact O-CB 3.45Å; V348-A352 PolarHBondContact O-N 2.81Å; S349-A352 PolarHBondContact O-N 3.11Å; I350-A352 VanDerWaalsContact C-N 3.34Å
353	G	38.6	Very low	40.1	Very low	42 Å²	42	109 Å²	109	43%	0.433	63%	0.629	S	S	.	*			trans	-109.7	93.3	-170.4	0	0	0	0	0	114.1	S349 Q355	S349-G353 PolarHBondContact O-N 3.21Å; G353-Q355 VanDerWaalsContact C-N 3.27Å; G353-Q355 PolarHBondContact O-N 3.02Å
354	R	34.6	Very low	39.2	Very low	224 Å²	224	108.8 Å²	108.8	85%	0.845	64%	0.641	S	S	*	*			trans	-68.8	79.3	166.4	-82.5	-173.5	169.5	175	-2.8	111.3	E377	R354-E377 IonicContact NH2-OE1 2.9Å; R354-E377 PolarHBondContact NH2-OE1 3.28Å
355	Q	36.2	Very low	38.4	Very low	155 Å²	155	115.5 Å²	115.5	72%	0.724	66%	0.661	S	S	*	*			trans	-125.3	133.3	158.2	-78.3	-164.4	-11.5	0	0	110.4	G353 F357	G353-Q355 VanDerWaalsContact C-N 3.27Å; G353-Q355 PolarHBondContact O-N 3.02Å; Q355-F357 HydrophobicContact CB-CE2 4.42Å
356	V	33.7	Very low	37.4	Very low	145 Å²	145	116.5 Å²	116.5	88%	0.879	68%	0.677	S	S	*	*			trans	-90.1	106	176.8	179	0	0	0	0	108
357	F	28.6	Very low	36.3	Very low	166 Å²	166	117.2 Å²	117.2	73%	0.728	68%	0.684	S	S	*	*			trans	-81.7	136.2	167.9	-79	-82.3	0	0	0	110.3	Q355	Q355-F357 HydrophobicContact CB-CE2 4.42Å
358	P	31.3	Very low	35.3	Very low	108 Å²	108	119.8 Å²	119.8	70%	0.701	69%	0.694	S	S	*	*			trans	-70.8	142.8	179.5	29	-34.4	0	0	0	111.6	S360	P358-S360 PolarHBondContact O-N 2.77Å; P358-S360 VanDerWaalsContact O-N 3.11Å
359	S	26.8	Very low	34.3	Very low	127 Å²	127	125.6 Å²	125.6	89%	0.888	71%	0.708	S	S	*	*	S	Bend	trans	-84.7	79.1	-170.4	55.9	0	0	0	0	113.4
360	S	28.7	Very low	33.6	Very low	98 Å²	98	127.9 Å²	127.9	69%	0.685	72%	0.719	S	S	*	*			trans	-157.4	58.3	174.9	66.9	0	0	0	0	116.4	P358	P358-S360 PolarHBondContact O-N 2.77Å; P358-S360 VanDerWaalsContact O-N 3.11Å
361	I	32.4	Very low	33	Very low	166 Å²	166	129.9 Å²	129.9	85%	0.851	72%	0.723	S	S	*	*			trans	-133.2	124	146.7	-74.6	96.2	0	0	0	107.7
362	A	25.8	Very low	32.7	Very low	107 Å²	107	129.5 Å²	129.5	88%	0.884	73%	0.73	S	S	*	*			trans	-99.7	121.5	169.6	0	0	0	0	0	109.2
363	C	29.9	Very low	32.1	Very low	118 Å²	118	129.1 Å²	129.1	80%	0.797	73%	0.727	S	S	*	*			trans	-138.9	129.3	166.6	-168.2	0	0	0	0	109	R365	C363-R365 PolarHBondContact O-N 3.45Å
364	S	30.2	Very low	32	Very low	117 Å²	117	131.9 Å²	131.9	82%	0.818	74%	0.739	S	S	*	*			trans	-86.5	107.4	-162.9	52.1	0	0	0	0	113
365	R	32.5	Very low	32	Very low	234 Å²	234	129 Å²	129	88%	0.883	74%	0.736	S	S	*	*			trans	-136	151.1	163.8	-73.7	-169.7	175.4	-174.4	-0.5	111	C363	C363-R365 PolarHBondContact O-N 3.45Å
366	P	33.9	Very low	32	Very low	136 Å²	136	124 Å²	124	88%	0.883	72%	0.718	S	S	*	*			trans	-81.1	122.3	-166.1	29.7	-35.1	0	0	0	114.7
367	G	28.8	Very low	32.2	Very low	42 Å²	42	124.1 Å²	124.1	43%	0.433	71%	0.709	S	S	.	*				102.5	23.3	121.6	0	0	0	0	0	121.1
368	I	33.1	Very low	32.9	Very low	81 Å²	81	122.9 Å²	122.9	42%	0.415	71%	0.705	S	S	.	*			trans	-108.6	110.2	159.2	-58.5	-175.8	0	0	0	109.8	V370 K384	I368-V370 HydrophobicContact CG2-CG2 4.37Å; I368-K384 HydrophobicContact CD1-CG 4.38Å; I368-K384 HydrophobicContact CG1-CG 4.34Å
369	R	29.9	Very low	33.3	Very low	195 Å²	195	121.6 Å²	121.6	74%	0.736	69%	0.692	S	S	*	*			trans	-99.4	90.9	177	-157	-166.9	-47.9	-112.6	4	109.1	K371	R369-K371 PolarHBondContact O-N 3.07Å
370	V	33.7	Very low	33.7	Very low	106 Å²	106	119.6 Å²	119.6	64%	0.642	67%	0.67	S	S	*	*			trans	-59.8	112.2	174.7	-179.4	0	0	0	0	108.7	I368 L380	I368-V370 HydrophobicContact CG2-CG2 4.37Å; V370-L380 HydrophobicContact CG1-CD2 3.92Å
371	K	35.7	Very low	34.2	Very low	171 Å²	171	120.8 Å²	120.8	74%	0.743	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-72.1	134.3	167.7	-70.2	-178.9	178.9	176.5	0	107.9	R369 A373	R369-K371 PolarHBondContact O-N 3.07Å; K371-A373 PolarHBondContact O-N 2.87Å
372	S	35.3	Very low	34.2	Very low	112 Å²	112	118.3 Å²	118.3	78%	0.783	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-54.5	125	176.2	49.6	0	0	0	0	110.7	S374	S372-S374 PolarHBondContact O-N 3.12Å; S372-S374 VanDerWaalsContact O-N 3.17Å
373	A	35.2	Very low	34.6	Very low	62 Å²	62	116.4 Å²	116.4	51%	0.512	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-62.6	116.3	177.1	0	0	0	0	0	110	K371 E375	K371-A373 PolarHBondContact O-N 2.87Å; A373-E375 PolarHBondContact O-N 2.87Å
374	S	35.5	Very low	34.7	Very low	99 Å²	99	117.7 Å²	117.7	69%	0.692	63%	0.633	S	S	*	*			trans	-84.4	97.2	180	-177.2	0	0	0	0	109.7	S372 S376	S372-S374 PolarHBondContact O-N 3.12Å; S372-S374 VanDerWaalsContact O-N 3.17Å; S374-S376 PolarHBondContact O-N 2.98Å
375	E	35.1	Very low	34.9	Very low	165 Å²	165	114.8 Å²	114.8	77%	0.771	61%	0.613	S	S	*	*	S	Bend	trans	64.5	-8.7	166.9	-53.8	-174.1	142.6	0	0	117.7	A373	A373-E375 PolarHBondContact O-N 2.87Å
376	S	35	Very low	34.9	Very low	50 Å²	50	111.5 Å²	111.5	35%	0.35	61%	0.612	S	S	.	*			trans	-99.1	104.2	171	52.4	0	0	0	0	112.2	S374 H378	S374-S376 PolarHBondContact O-N 2.98Å; S376-H378 PolarHBondContact O-N 3.02Å
377	E	39.3	Very low	35.1	Very low	147 Å²	147	109.1 Å²	109.1	69%	0.687	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.6	2.7	-173.1	-71.5	-159.5	112.5	0	0	116	R354	R354-E377 IonicContact NH2-OE1 2.9Å; R354-E377 PolarHBondContact NH2-OE1 3.28Å
378	H	42.3	Very low	35.1	Very low	140 Å²	140	115.3 Å²	115.3	65%	0.648	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.5	2.5	-165.1	-62.9	-40.5	0	0	0	117.5	S376	S376-H378 PolarHBondContact O-N 3.02Å
379	L	40.7	Very low	35.2	Very low	80 Å²	80	116.4 Å²	116.4	42%	0.419	64%	0.637	S	S	.	*			trans	-129.9	106.8	178.1	-78.5	174.1	0	0	0	113.3	E740	L379-E740 HydrophobicContact CD1-CB 4.11Å; L379-E740 WeakPolarHBondContact CD1-OE2 3.39Å
380	L	34.9	Very low	35.3	Very low	85 Å²	85	117.6 Å²	117.6	45%	0.445	65%	0.647	S	S	.	*			trans	-88.4	99.7	162.2	-81.3	170.7	0	0	0	109.6	V370 I382	V370-L380 HydrophobicContact CG1-CD2 3.92Å; L380-I382 VanDerWaalsContact C-N 3.33Å; L380-I382 PolarHBondContact O-N 3.41Å
381	V	40	Very low	35.4	Very low	123 Å²	123	121 Å²	121	75%	0.745	66%	0.656	S	S	*	*			trans	-75.1	87.2	170.5	-177.5	0	0	0	0	109.2	S383	V381-S383 PolarHBondContact O-N 3.04Å; V381-S383 PolarHBondContact O-OG 3.05Å
382	I	32.5	Very low	35.1	Very low	114 Å²	114	122.2 Å²	122.2	59%	0.585	66%	0.664	S	S	*	*			trans	-68.9	93	176.9	-55.3	178.7	0	0	0	109.1	L380	L380-I382 VanDerWaalsContact C-N 3.33Å; L380-I382 PolarHBondContact O-N 3.41Å
383	S	34	Very low	34.9	Very low	67 Å²	67	124.3 Å²	124.3	47%	0.469	67%	0.666	S	S	.	*			trans	-98.5	109.8	172.3	33.8	0	0	0	0	109.1	V381 S385	V381-S383 PolarHBondContact O-N 3.04Å; V381-S383 PolarHBondContact O-OG 3.05Å; S383-S385 PolarHBondContact O-N 3.21Å
384	K	31.1	Very low	34.5	Very low	145 Å²	145	125.5 Å²	125.5	63%	0.63	67%	0.671	S	S	*	*			trans	-65.2	108.2	171.4	-88.7	-172.3	173.9	-179.9	0	108.9	I368 L386	I368-K384 HydrophobicContact CD1-CG 4.38Å; I368-K384 HydrophobicContact CG1-CG 4.34Å; K384-L386 VanDerWaalsContact C-N 3.28Å; K384-L386 PolarHBondContact O-N 3.06Å
385	S	34	Very low	34.4	Very low	56 Å²	56	127 Å²	127	39%	0.392	68%	0.678	S	S	.	*			trans	-73.4	81	174.1	168.4	0	0	0	0	109.1	S383 S387	S383-S385 PolarHBondContact O-N 3.21Å; S385-S387 VanDerWaalsContact C-N 3.3Å; S385-S387 PolarHBondContact O-N 3.34Å
386	L	33.4	Very low	34.1	Very low	165 Å²	165	123.4 Å²	123.4	86%	0.864	67%	0.671	S	S	*	*			trans	-65.7	88.5	175.8	-165.6	74.6	0	0	0	109.9	K384 N388	K384-L386 VanDerWaalsContact C-N 3.28Å; K384-L386 PolarHBondContact O-N 3.06Å; L386-N388 PolarHBondContact O-N 2.81Å
387	S	36.9	Very low	33.8	Very low	87 Å²	87	126.1 Å²	126.1	61%	0.608	69%	0.69	S	S	*	*			trans	-75.1	121.5	177.2	51	0	0	0	0	110	S385 S389	S385-S387 VanDerWaalsContact C-N 3.3Å; S385-S387 PolarHBondContact O-N 3.34Å; S387-S389 PolarHBondContact O-N 2.9Å
388	N	29.3	Very low	33.6	Very low	171 Å²	171	127.2 Å²	127.2	91%	0.914	69%	0.693	S	S	*	*			trans	-36.3	101.2	-174.5	-64.5	-13.4	0	0	0	116	L386	L386-N388 PolarHBondContact O-N 2.81Å
389	S	36.6	Very low	33	Very low	105 Å²	105	123.6 Å²	123.6	73%	0.734	69%	0.694	S	S	*	*			trans	-128.7	121.4	148.4	53.9	0	0	0	0	107.2	S387 E391	S387-S389 PolarHBondContact O-N 2.9Å; S389-E391 PolarHBondContact O-N 3.3Å; S389-E391 VanDerWaalsContact O-N 3.11Å
390	K	30.6	Very low	32.8	Very low	220 Å²	220	127.9 Å²	127.9	96%	0.957	71%	0.711	S	S	*	*			trans	-72.6	101.9	177.8	-78.6	-173.8	173.6	-173.3	0	109.6
391	E	36.4	Very low	33.2	Very low	176 Å²	176	133.4 Å²	133.4	82%	0.822	73%	0.732	S	S	*	*			trans	-140.4	128.8	160.2	-124.8	167.7	-164	0	0	109.1	S389 L393	S389-E391 PolarHBondContact O-N 3.3Å; S389-E391 VanDerWaalsContact O-N 3.11Å; E391-L393 PolarHBondContact O-N 3.1Å
392	E	28.2	Very low	33.9	Very low	198 Å²	198	130.9 Å²	130.9	93%	0.925	71%	0.714	S	S	*	*			trans	-100.1	74.3	-160.1	-169.8	165.5	-160.9	0	0	110.4
393	L	32.5	Very low	35.3	Very low	156 Å²	156	131.6 Å²	131.6	82%	0.817	72%	0.715	S	S	*	*			trans	-90.5	138.1	167	-94.2	72.6	0	0	0	110.4	E391	E391-L393 PolarHBondContact O-N 3.1Å
394	S	26.5	Very low	36.6	Very low	87 Å²	87	131.6 Å²	131.6	61%	0.608	71%	0.71	S	S	*	*			trans	-64.2	143.7	-172.9	54.9	0	0	0	0	112.7	S396	S394-S396 PolarHBondContact O-N 3.24Å; S394-S396 PolarHBondContact OG-OG 3.46Å
395	P	32.5	Very low	38.6	Very low	130 Å²	130	128.6 Å²	128.6	84%	0.844	70%	0.698	S	S	*	*	S	Bend	trans	-65.1	3.9	179.4	-23.3	34.6	0	0	0	116	S397	P395-S397 VanDerWaalsContact C-N 3.31Å; P395-S397 PolarHBondContact O-N 3.21Å; P395-S397 VanDerWaalsContact O-N 3.12Å
396	S	28.7	Very low	40.8	Very low	90 Å²	90	127.5 Å²	127.5	63%	0.629	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	21.6	-158.7	55.7	0	0	0	0	115.8	S394	S394-S396 PolarHBondContact O-N 3.24Å; S394-S396 PolarHBondContact OG-OG 3.46Å
397	S	30.3	Very low	43.2	Very low	106 Å²	106	119.6 Å²	119.6	74%	0.741	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-146.6	12.5	-177.6	-61.7	0	0	0	0	115.9	P395	P395-S397 VanDerWaalsContact C-N 3.31Å; P395-S397 PolarHBondContact O-N 3.21Å; P395-S397 VanDerWaalsContact O-N 3.12Å
398	F	34.4	Very low	45.4	Very low	170 Å²	170	116.4 Å²	116.4	75%	0.746	62%	0.624	S	S	*	*	S	Bend	trans	-103.4	117.8	156.7	-83.9	-89.2	0	0	0	108.2
399	G	30.3	Very low	48	Very low	65 Å²	65	111.4 Å²	111.4	67%	0.67	60%	0.6	S	S	*	*			trans	-58.4	142.6	-173.3	0	0	0	0	0	112.9	F401	G399-F401 PolarHBondContact O-N 3.22Å; G399-F401 VanDerWaalsContact O-N 3.09Å
400	H	35.8	Very low	50.3	Low	170 Å²	170	107.6 Å²	107.6	79%	0.787	57%	0.571	S	S	*	*			trans	-57.4	112	-177.8	-156.3	-105.6	0	0	0	110.5	D402	H400-D402 IonicContact CE1-OD1 3.47Å; H400-D402 IonicContact CG-OD1 2.71Å; H400-D402 IonicContact ND1-OD1 3.54Å; H400-D402 PolarHBondContact ND1-OD1 2.86Å; H400-D402 PolarHBondContact O-N 3.16Å
401	F	44.4	Very low	53.1	Low	201 Å²	201	97.1 Å²	97.1	88%	0.882	53%	0.525	S	S	*	.			trans	-75.6	81.9	171.6	-93.5	-83.2	0	0	0	108.8	G399 E403	G399-F401 PolarHBondContact O-N 3.22Å; G399-F401 VanDerWaalsContact O-N 3.09Å; F401-E403 PolarHBondContact O-N 3.34Å
402	D	54.6	Low	55.5	Low	69 Å²	69	96.8 Å²	96.8	37%	0.369	52%	0.517	S	S	.	.			trans	-54.7	110.7	173.9	-91.5	11.7	0	0	0	110.9	H400 N404 H405	H400-D402 IonicContact CE1-OD1 3.47Å; H400-D402 IonicContact CG-OD1 2.71Å; H400-D402 IonicContact ND1-OD1 3.54Å; H400-D402 PolarHBondContact ND1-OD1 2.86Å; H400-D402 PolarHBondContact O-N 3.16Å; D402-N404 PolarHBondContact O-N 3.06Å; D402-N404 VanDerWaalsContact O-N 3.08Å; D402-H405 HydrophobicContact CB-CB 4.46Å; D402-H405 VanDerWaalsContact CB-ND1 3.25Å; D402-H405 WeakPolarHBondContact CB-ND1 3.32Å; D402-H405 PolarHBondContact O-N 3.41Å; D402-H405 IonicContact OD2-CE1 3.29Å; D402-H405 PolarHBondContact OD2-CE1 3.26Å; D402-H405 IonicContact OD2-ND1 2.75Å; D402-H405 PolarHBondContact OD2-ND1 3.07Å
403	E	60.2	Low	58.3	Low	130 Å²	130	94.2 Å²	94.2	61%	0.607	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-52.9	-34.5	176.1	-58.2	-174.6	152.3	0	0	111.1	F401 H405 V406 T744	F401-E403 PolarHBondContact O-N 3.34Å; E403-H405 PolarHBondContact O-N 3.13Å; E403-V406 VanDerWaalsContact O-CG2 3.27Å; E403-V406 WeakPolarHBondContact O-CG2 3.27Å; E403-V406 PolarHBondContact O-N 2.98Å; E403-T744 WeakPolarHBondContact O-CB 3.31Å; E403-T744 WeakPolarHBondContact O-CG2 3.44Å
404	N	62.2	Low	61	Low	66 Å²	66	87.2 Å²	87.2	35%	0.353	47%	0.469	S	S	.	.	G	3₁₀ helix	trans	-57.1	-19.8	176.5	-68.1	-46	0	0	0	115.1	D402 R746	D402-N404 PolarHBondContact O-N 3.06Å; D402-N404 VanDerWaalsContact O-N 3.08Å; N404-R746 PolarHBondContact O-NH1 3.09Å
405	H	72.1	Confident	64.2	Low	82 Å²	82	84.8 Å²	84.8	38%	0.38	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-102.4	3.6	-176.7	-67.4	111.2	0	0	0	114.3	D402 E403 Y407 T408 T409	D402-H405 HydrophobicContact CB-CB 4.46Å; D402-H405 VanDerWaalsContact CB-ND1 3.25Å; D402-H405 WeakPolarHBondContact CB-ND1 3.32Å; D402-H405 PolarHBondContact O-N 3.41Å; D402-H405 IonicContact OD2-CE1 3.29Å; D402-H405 PolarHBondContact OD2-CE1 3.26Å; D402-H405 IonicContact OD2-ND1 2.75Å; D402-H405 PolarHBondContact OD2-ND1 3.07Å; E403-H405 PolarHBondContact O-N 3.13Å; H405-Y407 PolarHBondContact O-N 2.91Å; H405-T408 PolarHBondContact O-N 3.01Å; H405-T409 WeakPolarHBondContact O-CB 3.45Å; H405-T409 PolarHBondContact O-N 3.04Å; H405-T409 PolarHBondContact O-OG1 3.39Å
406	V	81.6	Confident	66.9	Low	33 Å²	33	78.6 Å²	78.6	20%	0.2	41%	0.41	C	S	.	.	H	α-helix	trans	-59.3	-49.4	-177.9	168.9	0	0	0	0	112.7	E403 T409 L410 L741 P742 T744	E403-V406 VanDerWaalsContact O-CG2 3.27Å; E403-V406 WeakPolarHBondContact O-CG2 3.27Å; E403-V406 PolarHBondContact O-N 2.98Å; V406-T409 WeakPolarHBondContact O-CB 2.96Å; V406-T409 PolarHBondContact O-N 3Å; V406-L410 PolarHBondContact O-N 2.89Å; V406-L741 HydrophobicContact CG1-CB 4.09Å; V406-L741 HydrophobicContact CG1-CD1 4.28Å; V406-L741 HydrophobicContact CG1-CD2 3.81Å; V406-L741 HydrophobicContact CG1-CG 4.28Å; V406-P742 HydrophobicContact CG1-CG 4.09Å; V406-P742 HydrophobicContact CG2-CG 4.02Å; V406-T744 HydrophobicContact CB-CG2 3.92Å; V406-T744 HydrophobicContact CG2-CG2 4.36Å
407	Y	83.3	Confident	69.9	Low	0 Å²	0	81.1 Å²	81.1	0%	0	41%	0.407	C	S	.	.	H	α-helix	trans	-68.4	-36	178.7	-57.1	-61.6	0	0	0	112.6	H405 T409 L410 F411 L734 V738 L741 P742 T744 M747 V926	H405-Y407 PolarHBondContact O-N 2.91Å; Y407-T409 VanDerWaalsContact C-N 3.28Å; Y407-T409 PolarHBondContact O-N 2.95Å; Y407-L410 PolarHBondContact O-N 2.95Å; Y407-F411 PolarHBondContact O-N 3.44Å; Y407-F411 VanDerWaalsContact O-N 3.08Å; Y407-L734 HydrophobicContact CD1-CD1 3.7Å; Y407-L734 HydrophobicContact CE1-CD1 4.22Å; Y407-L734 HydrophobicContact CG-CD1 4.48Å; Y407-V738 HydrophobicContact CE1-CG2 4.15Å; Y407-L741 HydrophobicContact CD1-CD1 3.62Å; Y407-L741 HydrophobicContact CE1-CB 4.02Å; Y407-L741 HydrophobicContact CE1-CD1 3.69Å; Y407-P742 PolarHBondContact OH-O 3.14Å; Y407-T744 HydrophobicContact CD2-CG2 3.94Å; Y407-T744 HydrophobicContact CE2-CG2 3.48Å; Y407-T744 VanDerWaalsContact CE2-CG2 3.48Å; Y407-T744 WeakPolarHBondContact CE2-OG1 3.18Å; Y407-M747 HydrophobicContact CE1-CE 4.22Å; Y407-M747 HydrophobicContact CE2-CE 3.72Å; Y407-M747 VanDerWaalsContact CZ-CE 3.49Å; Y407-M747 VanDerWaalsContact OH-CE 3.29Å; Y407-M747 WeakPolarHBondContact OH-CE 3.24Å; Y407-V926 HydrophobicContact CD1-CG1 4.46Å; Y407-V926 HydrophobicContact CD2-CG1 3.35Å; Y407-V926 HydrophobicContact CE2-CG1 4.02Å; Y407-V926 HydrophobicContact CG-CG1 3.62Å
408	T	82.9	Confident	72.7	Confident	20 Å²	20	79.6 Å²	79.6	12%	0.123	39%	0.39	C	S	.	.	H	α-helix	trans	-61.5	-38.8	171.8	-45.9	0	0	0	0	111.1	H405 F411 R412 Q555 I927	H405-T408 PolarHBondContact O-N 3.01Å; T408-F411 PolarHBondContact O-N 2.9Å; T408-R412 WeakPolarHBondContact O-CB 3.03Å; T408-R412 PolarHBondContact O-N 2.79Å; T408-Q555 VanDerWaalsContact CG2-NE2 3.34Å; T408-I927 PolarHBondContact OG1-O 2.97Å
409	T	83.6	Confident	75.3	Confident	65 Å²	65	72 Å²	72	40%	0.399	36%	0.358	S	S	.	.	H	α-helix	trans	-69.8	-42	177.5	-57.2	0	0	0	0	111.6	H405 V406 Y407 F411 R412 H413	H405-T409 WeakPolarHBondContact O-CB 3.45Å; H405-T409 PolarHBondContact O-N 3.04Å; H405-T409 PolarHBondContact O-OG1 3.39Å; V406-T409 WeakPolarHBondContact O-CB 2.96Å; V406-T409 PolarHBondContact O-N 3Å; Y407-T409 VanDerWaalsContact C-N 3.28Å; Y407-T409 PolarHBondContact O-N 2.95Å; T409-F411 VanDerWaalsContact C-N 3.34Å; T409-F411 PolarHBondContact O-N 3.44Å; T409-R412 WeakPolarHBondContact O-CB 3.29Å; T409-R412 PolarHBondContact O-N 3.26Å; T409-R412 VanDerWaalsContact O-N 3.14Å; T409-H413 PolarHBondContact O-CD2 3.12Å; T409-H413 VanDerWaalsContact O-CD2 3.25Å; T409-H413 PolarHBondContact O-N 3.38Å; T409-H413 VanDerWaalsContact O-N 3.1Å
410	L	86	Confident	78	Confident	25 Å²	25	70.3 Å²	70.3	13%	0.131	33%	0.333	C	S	.	.	H	α-helix	trans	-53.3	-52.1	170.4	-177.6	82.7	0	0	0	110.8	V406 Y407 R412 H413 S414 Y733 L734 R737 L741	V406-L410 PolarHBondContact O-N 2.89Å; Y407-L410 PolarHBondContact O-N 2.95Å; L410-R412 VanDerWaalsContact C-N 3.27Å; L410-R412 PolarHBondContact O-N 2.79Å; L410-H413 PolarHBondContact O-N 2.96Å; L410-S414 VanDerWaalsContact O-CB 3.28Å; L410-S414 WeakPolarHBondContact O-CB 3.38Å; L410-S414 PolarHBondContact O-N 3.47Å; L410-S414 PolarHBondContact O-OG 3.5Å; L410-Y733 HydrophobicContact CD2-CE1 4.46Å; L410-L734 HydrophobicContact CD2-CD1 4.23Å; L410-R737 HydrophobicContact CD1-CB 4.2Å; L410-R737 HydrophobicContact CD1-CG 4.13Å; L410-R737 HydrophobicContact CD2-CB 3.88Å; L410-R737 HydrophobicContact CD2-CG 4.26Å; L410-L741 HydrophobicContact CB-CD1 4.34Å; L410-L741 HydrophobicContact CD1-CD1 4.37Å; L410-L741 HydrophobicContact CD2-CD1 4.02Å; L410-L741 HydrophobicContact CG-CD1 4.46Å
411	F	87.9	Confident	80.3	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-69.4	-23.1	-179.4	-87.1	-114.6	0	0	0	113.2	Y407 T408 T409 C553 L554 Q555 L558 L730 L734 L923 I927	Y407-F411 PolarHBondContact O-N 3.44Å; Y407-F411 VanDerWaalsContact O-N 3.08Å; T408-F411 PolarHBondContact O-N 2.9Å; T409-F411 VanDerWaalsContact C-N 3.34Å; T409-F411 PolarHBondContact O-N 3.44Å; F411-C553 PolarHBondContact O-SG 3.22Å; F411-L554 HydrophobicContact CB-CB 4.35Å; F411-L554 HydrophobicContact CD1-CB 3.64Å; F411-L554 HydrophobicContact CD1-CD1 4.38Å; F411-L554 HydrophobicContact CE1-CB 4.24Å; F411-L554 HydrophobicContact CE1-CD1 4.38Å; F411-L554 HydrophobicContact CG-CB 4.21Å; F411-L554 PolarHBondContact O-N 2.99Å; F411-Q555 HydrophobicContact CB-CB 4.14Å; F411-Q555 PolarHBondContact O-N 2.86Å; F411-L558 HydrophobicContact CD1-CD1 3.87Å; F411-L558 HydrophobicContact CE1-CD1 3.75Å; F411-L730 HydrophobicContact CE1-CB 4.24Å; F411-L730 HydrophobicContact CE1-CD2 4.02Å; F411-L734 HydrophobicContact CE2-CB 4.13Å; F411-L734 HydrophobicContact CE2-CD1 4.27Å; F411-L734 HydrophobicContact CZ-CB 4.3Å; F411-L923 HydrophobicContact CE1-CD2 4.45Å; F411-L923 HydrophobicContact CZ-CD2 4.13Å; F411-I927 HydrophobicContact CB-CG2 4.15Å; F411-I927 HydrophobicContact CD1-CD1 3.83Å; F411-I927 HydrophobicContact CD1-CG2 4.5Å; F411-I927 HydrophobicContact CD2-CD1 3.77Å; F411-I927 HydrophobicContact CD2-CG1 4.3Å; F411-I927 HydrophobicContact CE1-CD1 3.61Å; F411-I927 HydrophobicContact CE2-CD1 3.57Å; F411-I927 HydrophobicContact CE2-CG1 4.43Å; F411-I927 HydrophobicContact CG-CD1 3.92Å; F411-I927 HydrophobicContact CG-CG2 4.21Å; F411-I927 HydrophobicContact CZ-CD1 3.49Å; F411-I927 VanDerWaalsContact CZ-CD1 3.49Å
412	R	87.3	Confident	81.8	Confident	169 Å²	169	59.3 Å²	59.3	64%	0.638	31%	0.314	S	S	*	.	H	α-helix	trans	-70.7	-39.5	173.7	-173.3	176.1	178	171.3	-0.5	112.3	T408 T409 L410 C553	T408-R412 WeakPolarHBondContact O-CB 3.03Å; T408-R412 PolarHBondContact O-N 2.79Å; T409-R412 WeakPolarHBondContact O-CB 3.29Å; T409-R412 PolarHBondContact O-N 3.26Å; T409-R412 VanDerWaalsContact O-N 3.14Å; L410-R412 VanDerWaalsContact C-N 3.27Å; L410-R412 PolarHBondContact O-N 2.79Å; R412-C553 PolarHBondContact O-SG 2.76Å
413	H	86.3	Confident	82.9	Confident	145 Å²	145	61.2 Å²	61.2	67%	0.671	33%	0.333	S	S	*	.	H	α-helix	trans	-94	-18.8	-177.9	-67.7	-73.6	0	0	0	114.3	T409 L410	T409-H413 PolarHBondContact O-CD2 3.12Å; T409-H413 VanDerWaalsContact O-CD2 3.25Å; T409-H413 PolarHBondContact O-N 3.38Å; T409-H413 VanDerWaalsContact O-N 3.1Å; L410-H413 PolarHBondContact O-N 2.96Å
414	S	90.5	Very high	83.6	Confident	9 Å²	9	58.3 Å²	58.3	6%	0.063	34%	0.338	C	S	.	.			trans	-79.4	149.2	172.8	-53.7	0	0	0	0	111.7	L410 L554 Y733	L410-S414 VanDerWaalsContact O-CB 3.28Å; L410-S414 WeakPolarHBondContact O-CB 3.38Å; L410-S414 PolarHBondContact O-N 3.47Å; L410-S414 PolarHBondContact O-OG 3.5Å; S414-L554 VanDerWaalsContact CB-CD1 3.48Å; S414-L554 PolarHBondContact O-N 3.33Å; S414-Y733 WeakPolarHBondContact CB-OH 3.23Å; S414-Y733 PolarHBondContact OG-OH 3.18Å; S414-Y733 VanDerWaalsContact OG-OH 3.1Å
415	T	92.7	Very high	84.6	Confident	35 Å²	35	62.9 Å²	62.9	22%	0.215	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-115.2	161.8	-178.3	72.2	0	0	0	0	112.4	Y417 D418 P550 Y552 L554	T415-Y417 PolarHBondContact O-N 2.97Å; T415-Y417 VanDerWaalsContact O-N 3.15Å; T415-Y417 PolarHBondContact OG1-N 3.35Å; T415-D418 WeakPolarHBondContact CA-OD2 3.49Å; T415-D418 WeakPolarHBondContact CB-OD2 3.49Å; T415-D418 PolarHBondContact N-OD2 2.95Å; T415-D418 PolarHBondContact O-N 2.99Å; T415-D418 PolarHBondContact OG1-OD2 2.9Å; T415-P550 WeakPolarHBondContact CB-O 3.3Å; T415-P550 PolarHBondContact OG1-O 2.76Å; T415-Y552 CarbonylContact C-O 3.5Å; T415-Y552 WeakPolarHBondContact CA-O 3.27Å; T415-L554 VanDerWaalsContact C-CD2 3.43Å; T415-L554 VanDerWaalsContact O-CD2 3.31Å; T415-L554 WeakPolarHBondContact O-CD2 3.49Å
416	C	91	Very high	85.3	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	-53.1	-32.1	173.8	-72	0	0	0	0	112.9	V419 P550 Y552 V713	C416-V419 PolarHBondContact O-N 2.98Å; C416-P550 PolarHBondContact N-O 2.9Å; C416-Y552 PolarHBondContact N-O 3.43Å; C416-Y552 PolarHBondContact SG-O 2.77Å; C416-Y552 VanDerWaalsContact SG-O 3.36Å; C416-V713 HydrophobicContact CB-CG1 4.22Å; C416-V713 HydrophobicContact CB-CG2 4.34Å
417	Y	90.1	Very high	85.8	Confident	144 Å²	144	61 Å²	61	57%	0.565	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-64.2	-38	177.5	-165.5	-106.2	0	0	0	112.8	T415 V419 L420 P550	T415-Y417 PolarHBondContact O-N 2.97Å; T415-Y417 VanDerWaalsContact O-N 3.15Å; T415-Y417 PolarHBondContact OG1-N 3.35Å; Y417-V419 PolarHBondContact O-N 2.8Å; Y417-V419 VanDerWaalsContact O-N 3.13Å; Y417-L420 PolarHBondContact O-N 2.83Å; Y417-P550 HydrophobicContact CD2-CB 4.06Å; Y417-P550 HydrophobicContact CG-CB 4.44Å; Y417-P550 PolarHBondContact N-O 2.89Å
418	D	89.7	Confident	86.3	Confident	74 Å²	74	64.4 Å²	64.4	40%	0.396	36%	0.364	S	S	.	.	G	3₁₀ helix	trans	-66.8	-15.6	-178.2	-55.6	-64.4	0	0	0	113.1	T415 Y733	T415-D418 WeakPolarHBondContact CA-OD2 3.49Å; T415-D418 WeakPolarHBondContact CB-OD2 3.49Å; T415-D418 PolarHBondContact N-OD2 2.95Å; T415-D418 PolarHBondContact O-N 2.99Å; T415-D418 PolarHBondContact OG1-OD2 2.9Å; D418-Y733 HydrophobicContact CB-CE2 3.74Å; D418-Y733 WeakPolarHBondContact CB-OH 3.34Å; D418-Y733 WeakPolarHBondContact O-CD2 3.24Å; D418-Y733 WeakPolarHBondContact O-CE2 3.23Å
419	V	89.5	Confident	86.8	Confident	11 Å²	11	63.7 Å²	63.7	7%	0.067	36%	0.359	C	S	.	.	G	3₁₀ helix	trans	-97.5	-2.9	179.1	-174.7	0	0	0	0	111.8	C416 Y417 L554 L725 R729 L730 Y733	C416-V419 PolarHBondContact O-N 2.98Å; Y417-V419 PolarHBondContact O-N 2.8Å; Y417-V419 VanDerWaalsContact O-N 3.13Å; V419-L554 HydrophobicContact CB-CD2 4.49Å; V419-L554 HydrophobicContact CG2-CD1 3.39Å; V419-L554 HydrophobicContact CG2-CD2 3.56Å; V419-L554 HydrophobicContact CG2-CG 4.08Å; V419-L725 HydrophobicContact CB-CD1 4.05Å; V419-L725 HydrophobicContact CG1-CD1 3.53Å; V419-R729 HydrophobicContact CG1-CB 4.26Å; V419-R729 HydrophobicContact CG1-CG 3.63Å; V419-R729 PolarHBondContact O-NE 3.08Å; V419-L730 HydrophobicContact CG1-CD2 4.47Å; V419-L730 HydrophobicContact CG2-CD2 4.28Å; V419-Y733 HydrophobicContact CB-CD2 4.48Å; V419-Y733 HydrophobicContact CG2-CD1 4.21Å; V419-Y733 HydrophobicContact CG2-CD2 3.74Å; V419-Y733 HydrophobicContact CG2-CE2 4.21Å; V419-Y733 HydrophobicContact CG2-CG 3.72Å
420	L	87.1	Confident	87.3	Confident	29 Å²	29	62.8 Å²	62.8	15%	0.152	35%	0.352	C	S	.	.	S	Bend	trans	-89.6	135	171.4	-55.1	-175.1	0	0	0	110	Y417 V713 L722	Y417-L420 PolarHBondContact O-N 2.83Å; L420-V713 HydrophobicContact CD1-CG1 4.26Å; L420-V713 HydrophobicContact CD2-CG2 4.37Å; L420-L722 HydrophobicContact CD1-CB 3.8Å
421	P	82.6	Confident	87.6	Confident	44 Å²	44	61.9 Å²	61.9	29%	0.286	35%	0.348	S	S	.	.			trans	-68.2	153.3	171.1	32.8	-35.6	0	0	0	109.4	S423	P421-S423 WeakPolarHBondContact CG-O 3.22Å; P421-S423 PolarHBondContact O-N 3.03Å
422	G	76.2	Confident	87.9	Confident	95 Å²	95	67.5 Å²	67.5	98%	0.979	37%	0.369	S	S	*	.	S	Bend	trans	-60.1	-13.3	178	0	0	0	0	0	115
423	S	78.2	Confident	88.2	Confident	109 Å²	109	61.8 Å²	61.8	76%	0.762	35%	0.351	S	S	*	.	S	Bend	trans	-154.6	142.4	166.8	54.7	0	0	0	0	109.6	P421	P421-S423 WeakPolarHBondContact CG-O 3.22Å; P421-S423 PolarHBondContact O-N 3.03Å
424	G	74.8	Confident	88.5	Confident	69 Å²	69	56.7 Å²	56.7	71%	0.711	33%	0.331	S	S	*	.			trans	-162.6	160.1	174.6	0	0	0	0	0	112
425	K	82.6	Confident	88.5	Confident	162 Å²	162	56.3 Å²	56.3	70%	0.704	33%	0.328	S	S	*	.			trans	-89.1	127.8	173.8	-179.5	178.2	172.8	-175.2	0	109.4	N445	K425-N445 WeakPolarHBondContact CE-OD1 3.34Å; K425-N445 PolarHBondContact NZ-OD1 3.45Å
426	L	88.2	Confident	88.4	Confident	55 Å²	55	56 Å²	56	29%	0.288	33%	0.325	S	S	.	.			trans	-111.5	129.8	168.8	-177.8	60.3	0	0	0	108.6	I428 P451 A721 L724	L426-I428 HydrophobicContact CD2-CD1 4.14Å; L426-I428 HydrophobicContact CD2-CG1 4.17Å; L426-I428 HydrophobicContact CG-CD1 4.5Å; L426-I428 HydrophobicContact CG-CG1 4.07Å; L426-P451 HydrophobicContact CD1-CG 4.5Å; L426-A721 HydrophobicContact CD2-CB 3.76Å; L426-A721 VanDerWaalsContact CD2-O 3.3Å; L426-A721 WeakPolarHBondContact CD2-O 3.47Å; L426-L724 HydrophobicContact CD1-CG 4.46Å
427	V	91.6	Very high	88.5	Confident	20 Å²	20	63.7 Å²	63.7	12%	0.121	35%	0.354	C	S	.	.			trans	-91.4	134.9	168.6	178.9	0	0	0	0	107.5	L429 N445 V447 A450 P451	V427-L429 HydrophobicContact CG1-CD2 4.23Å; V427-N445 HydrophobicContact CG2-CB 3.86Å; V427-V447 HydrophobicContact CB-CG2 4.25Å; V427-V447 HydrophobicContact CG2-CG1 4.2Å; V427-V447 HydrophobicContact CG2-CG2 4.03Å; V427-A450 HydrophobicContact CB-CB 4.15Å; V427-A450 HydrophobicContact CG1-CB 4.01Å; V427-A450 WeakPolarHBondContact O-CB 3.38Å; V427-P451 VanDerWaalsContact O-CD 3.29Å; V427-P451 WeakPolarHBondContact O-CD 3.47Å
428	I	93.1	Very high	88.7	Confident	73 Å²	73	56.8 Å²	56.8	37%	0.374	33%	0.327	S	S	.	.			trans	-130.5	137.3	173.5	-58.9	176.3	0	0	0	106.6	L426 P451 W453 Y460 A721	L426-I428 HydrophobicContact CD2-CD1 4.14Å; L426-I428 HydrophobicContact CD2-CG1 4.17Å; L426-I428 HydrophobicContact CG-CD1 4.5Å; L426-I428 HydrophobicContact CG-CG1 4.07Å; I428-P451 WeakPolarHBondContact CA-O 3.45Å; I428-W453 HydrophobicContact CG2-CB 3.66Å; I428-Y460 HydrophobicContact CD1-CE1 4.29Å; I428-Y460 HydrophobicContact CG2-CE1 4.13Å; I428-A721 HydrophobicContact CD1-CB 4.47Å
429	L	94.1	Very high	88.8	Confident	5 Å²	5	53.3 Å²	53.3	3%	0.026	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.8	-175.5	-59.6	169.3	0	0	0	109.9	V427 L433 A438 A441 L442 A450 P451 V452 W453 F464 L527	V427-L429 HydrophobicContact CG1-CD2 4.23Å; L429-L433 HydrophobicContact CD2-CD2 4Å; L429-A438 HydrophobicContact CD1-CB 4.28Å; L429-A441 HydrophobicContact CD2-CB 3.92Å; L429-L442 HydrophobicContact CD1-CD2 4.29Å; L429-A450 HydrophobicContact CD1-CB 3.9Å; L429-A450 HydrophobicContact CG-CB 3.95Å; L429-P451 PolarHBondContact N-O 3.17Å; L429-V452 CarbonylContact O-C 3.54Å; L429-V452 WeakPolarHBondContact O-CA 3.3Å; L429-W453 PolarHBondContact O-N 3.43Å; L429-F464 HydrophobicContact CD1-CB 4.08Å; L429-F464 HydrophobicContact CD1-CD1 3.72Å; L429-F464 HydrophobicContact CD1-CG 4.38Å; L429-L527 HydrophobicContact CB-CD2 4Å; L429-L527 HydrophobicContact CD1-CD2 4.15Å
430	D	94.6	Very high	88.9	Confident	46 Å²	46	54.6 Å²	54.6	25%	0.246	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	135.6	172.2	-171.6	-66.5	0	0	0	109.8	R432 L433 W453 S455	D430-R432 PolarHBondContact O-N 3.45Å; D430-R432 VanDerWaalsContact OD1-CB 3.28Å; D430-R432 WeakPolarHBondContact OD1-CB 3.46Å; D430-R432 WeakPolarHBondContact OD1-CG 3.36Å; D430-R432 IonicContact OD1-CZ 3.67Å; D430-R432 PolarHBondContact OD1-N 2.79Å; D430-R432 IonicContact OD1-NE 3.88Å; D430-R432 PolarHBondContact OD1-NE 3.07Å; D430-R432 IonicContact OD1-NH2 3.65Å; D430-R432 IonicContact OD2-CZ 3.82Å; D430-R432 IonicContact OD2-NE 3.21Å; D430-R432 IonicContact OD2-NH2 2.75Å; D430-R432 PolarHBondContact OD2-NH2 3.46Å; D430-L433 WeakPolarHBondContact O-CB 2.88Å; D430-L433 PolarHBondContact O-N 2.76Å; D430-W453 CarbonylContact C-O 3.6Å; D430-W453 WeakPolarHBondContact CA-O 3.3Å; D430-S455 WeakPolarHBondContact OD2-CB 3.37Å; D430-S455 PolarHBondContact OD2-OG 3.5Å
431	S	92.2	Very high	89.2	Confident	6 Å²	6	54.3 Å²	54.3	4%	0.042	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-21.7	-179.6	65.3	0	0	0	0	113.9	W453 M461 L527 G528	S431-W453 PolarHBondContact N-O 2.97Å; S431-M461 VanDerWaalsContact CB-SD 3.5Å; S431-L527 PolarHBondContact O-N 3.36Å; S431-G528 PolarHBondContact O-N 2.79Å
432	R	93.4	Very high	89.6	Confident	117 Å²	117	52.2 Å²	52.2	44%	0.442	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-4.2	179.7	-58.5	165.3	-63.1	170.3	5.3	113.1	D430 S455	D430-R432 PolarHBondContact O-N 3.45Å; D430-R432 VanDerWaalsContact OD1-CB 3.28Å; D430-R432 WeakPolarHBondContact OD1-CB 3.46Å; D430-R432 WeakPolarHBondContact OD1-CG 3.36Å; D430-R432 IonicContact OD1-CZ 3.67Å; D430-R432 PolarHBondContact OD1-N 2.79Å; D430-R432 IonicContact OD1-NE 3.88Å; D430-R432 PolarHBondContact OD1-NE 3.07Å; D430-R432 IonicContact OD1-NH2 3.65Å; D430-R432 IonicContact OD2-CZ 3.82Å; D430-R432 IonicContact OD2-NE 3.21Å; D430-R432 IonicContact OD2-NH2 2.75Å; D430-R432 PolarHBondContact OD2-NH2 3.46Å; R432-S455 PolarHBondContact NH2-OG 3.02Å
433	L	93.8	Very high	90.4	Very high	49 Å²	49	49 Å²	49	26%	0.257	27%	0.266	S	S	.	.	S	Bend	trans	-66.4	135.2	173.8	-170.9	66.9	0	0	0	110.2	L429 D430 R437 A438 L527	L429-L433 HydrophobicContact CD2-CD2 4Å; D430-L433 WeakPolarHBondContact O-CB 2.88Å; D430-L433 PolarHBondContact O-N 2.76Å; L433-R437 HydrophobicContact CD1-CB 3.93Å; L433-R437 HydrophobicContact CG-CB 4.07Å; L433-A438 HydrophobicContact CD2-CB 3.87Å; L433-A438 HydrophobicContact CG-CB 4.39Å; L433-L527 WeakPolarHBondContact O-CB 3.35Å; L433-L527 PolarHBondContact O-N 3.39Å
434	P	93.1	Very high	91	Very high	39 Å²	39	50.1 Å²	50.1	25%	0.253	26%	0.263	S	S	.	.	B	Isolated β-bridge	trans	-58.4	139	171.7	-26	35.8	0	0	0	111.6	L436 R437 A438 G523	P434-L436 VanDerWaalsContact C-N 3.28Å; P434-L436 PolarHBondContact O-N 3.11Å; P434-R437 HydrophobicContact CB-CB 4.42Å; P434-R437 HydrophobicContact CB-CG 4.37Å; P434-R437 WeakPolarHBondContact O-CA 3.34Å; P434-R437 WeakPolarHBondContact O-CB 3.4Å; P434-R437 PolarHBondContact O-N 3.09Å; P434-A438 PolarHBondContact O-N 3.4Å; P434-G523 CarbonylContact C-O 3.56Å; P434-G523 WeakPolarHBondContact CB-O 3.22Å
435	T	90.7	Very high	91.7	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-59.7	-36.3	-171.4	-57.3	0	0	0	0	112.5	A438 I439 F464 M472 W522 G523 K525 L527 V530	T435-A438 WeakPolarHBondContact O-CB 3.43Å; T435-A438 PolarHBondContact O-N 2.86Å; T435-I439 WeakPolarHBondContact O-CG1 3.41Å; T435-I439 PolarHBondContact O-N 3.15Å; T435-F464 HydrophobicContact CG2-CZ 4.33Å; T435-M472 HydrophobicContact CG2-CE 4.27Å; T435-W522 HydrophobicContact CG2-CE3 4.29Å; T435-W522 HydrophobicContact CG2-CH2 3.47Å; T435-W522 VanDerWaalsContact CG2-CH2 3.47Å; T435-W522 HydrophobicContact CG2-CZ2 4.06Å; T435-W522 HydrophobicContact CG2-CZ3 3.59Å; T435-G523 PolarHBondContact N-O 2.92Å; T435-G523 VanDerWaalsContact N-O 3.07Å; T435-K525 WeakPolarHBondContact CB-O 3.28Å; T435-K525 PolarHBondContact N-O 3.01Å; T435-K525 PolarHBondContact OG1-O 3.43Å; T435-L527 HydrophobicContact CG2-CD1 4.04Å; T435-V530 WeakPolarHBondContact OG1-CG2 3.46Å
436	L	90.6	Very high	91.9	Very high	30 Å²	30	42.7 Å²	42.7	16%	0.157	22%	0.222	C	C	.	.	H	α-helix	trans	-66	-41.6	174.5	-174.7	62.4	0	0	0	112.3	P434 A438 I439 C440 Y520 G523 I839	P434-L436 VanDerWaalsContact C-N 3.28Å; P434-L436 PolarHBondContact O-N 3.11Å; L436-A438 VanDerWaalsContact C-N 3.28Å; L436-A438 PolarHBondContact O-N 3.04Å; L436-I439 PolarHBondContact O-N 3.45Å; L436-I439 VanDerWaalsContact O-N 3.15Å; L436-C440 PolarHBondContact O-N 3.49Å; L436-C440 PolarHBondContact O-SG 2.92Å; L436-C440 VanDerWaalsContact O-SG 3.35Å; L436-Y520 HydrophobicContact CD2-CD1 3.62Å; L436-Y520 HydrophobicContact CD2-CE1 3.67Å; L436-G523 PolarHBondContact N-O 3.41Å; L436-I839 HydrophobicContact CD1-CD1 3.91Å; L436-I839 HydrophobicContact CD1-CG1 4.04Å; L436-I839 HydrophobicContact CD1-CG2 3.96Å
437	R	92.9	Very high	91.9	Very high	160 Å²	160	41.4 Å²	41.4	60%	0.604	22%	0.216	S	C	*	.	H	α-helix	trans	-65.1	-32.6	174.3	-69.1	-172.2	176.8	-162.8	-4.3	111.8	L433 P434 A441	L433-R437 HydrophobicContact CD1-CB 3.93Å; L433-R437 HydrophobicContact CG-CB 4.07Å; P434-R437 HydrophobicContact CB-CB 4.42Å; P434-R437 HydrophobicContact CB-CG 4.37Å; P434-R437 WeakPolarHBondContact O-CA 3.34Å; P434-R437 WeakPolarHBondContact O-CB 3.4Å; P434-R437 PolarHBondContact O-N 3.09Å; R437-A441 VanDerWaalsContact O-CB 3.3Å; R437-A441 WeakPolarHBondContact O-CB 3.42Å; R437-A441 PolarHBondContact O-N 2.94Å
438	A	93	Very high	91.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.7	-37.7	172.9	0	0	0	0	0	112.2	L429 L433 P434 T435 L436 L442 F464 L527	L429-A438 HydrophobicContact CD1-CB 4.28Å; L433-A438 HydrophobicContact CD2-CB 3.87Å; L433-A438 HydrophobicContact CG-CB 4.39Å; P434-A438 PolarHBondContact O-N 3.4Å; T435-A438 WeakPolarHBondContact O-CB 3.43Å; T435-A438 PolarHBondContact O-N 2.86Å; L436-A438 VanDerWaalsContact C-N 3.28Å; L436-A438 PolarHBondContact O-N 3.04Å; A438-L442 PolarHBondContact O-N 2.79Å; A438-F464 HydrophobicContact CB-CD1 4.21Å; A438-F464 HydrophobicContact CB-CE1 3.91Å; A438-L527 HydrophobicContact CB-CD1 4.03Å; A438-L527 HydrophobicContact CB-CD2 3.87Å; A438-L527 HydrophobicContact CB-CG 4.42Å
439	I	92.2	Very high	91.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-68.8	-48.7	175.3	-63.4	163.8	0	0	0	111.1	T435 L436 A441 L442 L443 F464 A469 W522 L835 I839	T435-I439 WeakPolarHBondContact O-CG1 3.41Å; T435-I439 PolarHBondContact O-N 3.15Å; L436-I439 PolarHBondContact O-N 3.45Å; L436-I439 VanDerWaalsContact O-N 3.15Å; I439-A441 PolarHBondContact O-N 2.88Å; I439-L442 WeakPolarHBondContact O-CB 3.34Å; I439-L442 PolarHBondContact O-N 2.85Å; I439-L443 HydrophobicContact CG2-CD1 4.08Å; I439-L443 HydrophobicContact CG2-CG 4.4Å; I439-L443 PolarHBondContact O-N 2.77Å; I439-L443 VanDerWaalsContact O-N 3.1Å; I439-F464 HydrophobicContact CD1-CZ 4.34Å; I439-F464 HydrophobicContact CG1-CE1 3.73Å; I439-F464 HydrophobicContact CG1-CZ 3.6Å; I439-A469 HydrophobicContact CD1-CB 4.01Å; I439-A469 HydrophobicContact CG1-CB 3.91Å; I439-W522 HydrophobicContact CD1-CZ3 4.29Å; I439-L835 HydrophobicContact CG2-CD1 3.95Å; I439-L835 HydrophobicContact CG2-CD2 3.59Å; I439-L835 HydrophobicContact CG2-CG 3.68Å; I439-I839 HydrophobicContact CB-CD1 4.04Å; I439-I839 HydrophobicContact CD1-CD1 4.2Å; I439-I839 HydrophobicContact CG2-CD1 3.29Å
440	C	92.7	Very high	91.4	Very high	39 Å²	39	39.6 Å²	39.6	26%	0.264	21%	0.206	S	C	.	.	H	α-helix	trans	-55.9	-43	175.2	-59.1	0	0	0	0	110.8	L436 L442 L443 D444	L436-C440 PolarHBondContact O-N 3.49Å; L436-C440 PolarHBondContact O-SG 2.92Å; L436-C440 VanDerWaalsContact O-SG 3.35Å; C440-L442 VanDerWaalsContact C-N 3.26Å; C440-L442 PolarHBondContact O-N 3.3Å; C440-L443 PolarHBondContact O-N 3.24Å; C440-D444 WeakPolarHBondContact O-CB 3.36Å; C440-D444 PolarHBondContact O-N 3.37Å
441	A	93	Very high	91.2	Very high	22 Å²	22	37.4 Å²	37.4	18%	0.182	20%	0.195	C	C	.	.	H	α-helix	trans	-60.5	-27.9	175.6	0	0	0	0	0	114.4	L429 R437 I439 N445	L429-A441 HydrophobicContact CD2-CB 3.92Å; R437-A441 VanDerWaalsContact O-CB 3.3Å; R437-A441 WeakPolarHBondContact O-CB 3.42Å; R437-A441 PolarHBondContact O-N 2.94Å; I439-A441 PolarHBondContact O-N 2.88Å; A441-N445 WeakPolarHBondContact O-CB 3.24Å; A441-N445 PolarHBondContact O-ND2 3.47Å
442	L	91.5	Very high	91.2	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-71.9	-47.3	169.9	-68	180	0	0	0	111.4	L429 A438 I439 C440 G446 V447 A450 F464 Q466	L429-L442 HydrophobicContact CD1-CD2 4.29Å; A438-L442 PolarHBondContact O-N 2.79Å; I439-L442 WeakPolarHBondContact O-CB 3.34Å; I439-L442 PolarHBondContact O-N 2.85Å; C440-L442 VanDerWaalsContact C-N 3.26Å; C440-L442 PolarHBondContact O-N 3.3Å; L442-G446 PolarHBondContact O-N 3.4Å; L442-V447 HydrophobicContact CB-CG2 4.43Å; L442-V447 HydrophobicContact CD2-CG2 3.81Å; L442-V447 WeakPolarHBondContact O-CG2 3.28Å; L442-V447 PolarHBondContact O-N 3.32Å; L442-A450 HydrophobicContact CD2-CB 3.7Å; L442-F464 HydrophobicContact CD1-CD1 3.67Å; L442-F464 HydrophobicContact CD1-CE1 3.9Å; L442-F464 HydrophobicContact CD1-CG 4.45Å; L442-F464 HydrophobicContact CG-CD1 4.31Å; L442-Q466 HydrophobicContact CD1-CG 4.36Å
443	L	91.4	Very high	91.1	Very high	28 Å²	28	34.4 Å²	34.4	15%	0.147	18%	0.182	C	C	.	.	H	α-helix	trans	-65.8	-52.4	-177	-63.6	175.4	0	0	0	112.1	I439 C440 N445 G446 L835 N836	I439-L443 HydrophobicContact CG2-CD1 4.08Å; I439-L443 HydrophobicContact CG2-CG 4.4Å; I439-L443 PolarHBondContact O-N 2.77Å; I439-L443 VanDerWaalsContact O-N 3.1Å; C440-L443 PolarHBondContact O-N 3.24Å; L443-N445 PolarHBondContact O-N 2.92Å; L443-N445 VanDerWaalsContact O-N 3.15Å; L443-G446 PolarHBondContact O-N 2.93Å; L443-L835 HydrophobicContact CD1-CG 4.42Å; L443-L835 HydrophobicContact CD2-CD2 4.39Å; L443-N836 HydrophobicContact CD1-CB 4.04Å; L443-N836 HydrophobicContact CD2-CB 4.22Å
444	D	91.5	Very high	91	Very high	132 Å²	132	32.5 Å²	32.5	71%	0.706	17%	0.173	S	C	*	.	H	α-helix	trans	-58.9	-28.1	-179.3	-65.2	-31.4	0	0	0	113.1	C440	C440-D444 WeakPolarHBondContact O-CB 3.36Å; C440-D444 PolarHBondContact O-N 3.37Å
445	N	90.5	Very high	90.8	Very high	48 Å²	48	32 Å²	32	26%	0.257	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-1.8	178.9	-71.5	-86.1	0	0	0	113.4	N254 K425 V427 A441 L443 V447	N254-N445 PolarHBondContact ND2-O 2.91Å; K425-N445 WeakPolarHBondContact CE-OD1 3.34Å; K425-N445 PolarHBondContact NZ-OD1 3.45Å; V427-N445 HydrophobicContact CG2-CB 3.86Å; A441-N445 WeakPolarHBondContact O-CB 3.24Å; A441-N445 PolarHBondContact O-ND2 3.47Å; L443-N445 PolarHBondContact O-N 2.92Å; L443-N445 VanDerWaalsContact O-N 3.15Å; N445-V447 VanDerWaalsContact C-N 3.27Å; N445-V447 HydrophobicContact CB-CG1 4.46Å; N445-V447 HydrophobicContact CB-CG2 4.09Å; N445-V447 PolarHBondContact O-N 3.08Å
446	G	86.2	Confident	90.7	Very high	28 Å²	28	38.9 Å²	38.9	29%	0.289	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	33.5	-178.1	0	0	0	0	0	113.4	L442 L443	L442-G446 PolarHBondContact O-N 3.4Å; L443-G446 PolarHBondContact O-N 2.93Å
447	V	87.5	Confident	90.6	Very high	28 Å²	28	41.9 Å²	41.9	17%	0.17	22%	0.223	C	C	.	.			trans	-111.7	130.9	-179.3	-65.7	0	0	0	0	110.8	V427 L442 N445 A449 Q466	V427-V447 HydrophobicContact CB-CG2 4.25Å; V427-V447 HydrophobicContact CG2-CG1 4.2Å; V427-V447 HydrophobicContact CG2-CG2 4.03Å; L442-V447 HydrophobicContact CB-CG2 4.43Å; L442-V447 HydrophobicContact CD2-CG2 3.81Å; L442-V447 WeakPolarHBondContact O-CG2 3.28Å; L442-V447 PolarHBondContact O-N 3.32Å; N445-V447 VanDerWaalsContact C-N 3.27Å; N445-V447 HydrophobicContact CB-CG1 4.46Å; N445-V447 HydrophobicContact CB-CG2 4.09Å; N445-V447 PolarHBondContact O-N 3.08Å; V447-A449 VanDerWaalsContact C-N 3.27Å; V447-A449 PolarHBondContact O-N 3.19Å; V447-Q466 PolarHBondContact O-NE2 3.48Å
448	M	86.3	Confident	90.4	Very high	50 Å²	50	40.2 Å²	40.2	25%	0.246	22%	0.222	C	C	.	.	S	Bend	trans	-71.5	-26.1	177.9	-62	172.7	68.7	0	0	112	S465 Q466 Y710	M448-S465 CarbonylContact O-C 3.57Å; M448-S465 VanDerWaalsContact O-CA 3.24Å; M448-S465 WeakPolarHBondContact O-CA 3.23Å; M448-S465 WeakPolarHBondContact O-CB 3.44Å; M448-Q466 PolarHBondContact O-N 3.49Å; M448-Y710 VanDerWaalsContact CB-OH 3.25Å; M448-Y710 WeakPolarHBondContact CB-OH 3.09Å
449	A	90	Very high	90.1	Very high	9 Å²	9	42.7 Å²	42.7	7%	0.074	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	160.4	-179.6	0	0	0	0	0	113.6	V447 V463 F464 Y710 L724	V447-A449 VanDerWaalsContact C-N 3.27Å; V447-A449 PolarHBondContact O-N 3.19Å; A449-V463 HydrophobicContact CB-CG1 3.63Å; A449-F464 CarbonylContact C-O 3.5Å; A449-F464 WeakPolarHBondContact CA-O 3.25Å; A449-F464 WeakPolarHBondContact CB-O 3.2Å; A449-Y710 HydrophobicContact CB-CD1 4.07Å; A449-Y710 HydrophobicContact CB-CD2 3.51Å; A449-Y710 HydrophobicContact CB-CE1 4Å; A449-Y710 HydrophobicContact CB-CE2 3.44Å; A449-Y710 VanDerWaalsContact CB-CE2 3.44Å; A449-Y710 HydrophobicContact CB-CG 3.87Å; A449-L724 HydrophobicContact CB-CD1 3.88Å; A449-L724 WeakPolarHBondContact O-CD1 3.17Å
450	A	91.7	Very high	89.9	Confident	0 Å²	0	44 Å²	44	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	143.6	176.2	0	0	0	0	0	111.2	V427 L429 L442 F464	V427-A450 HydrophobicContact CB-CB 4.15Å; V427-A450 HydrophobicContact CG1-CB 4.01Å; V427-A450 WeakPolarHBondContact O-CB 3.38Å; L429-A450 HydrophobicContact CD1-CB 3.9Å; L429-A450 HydrophobicContact CG-CB 3.95Å; L442-A450 HydrophobicContact CD2-CB 3.7Å; A450-F464 PolarHBondContact N-O 3.37Å; A450-F464 PolarHBondContact O-N 2.84Å
451	P	91.7	Very high	89.4	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	140.8	167.5	-22	34	0	0	0	112	L426 V427 I428 L429 Y460 G462 I712 A721 L724	L426-P451 HydrophobicContact CD1-CG 4.5Å; V427-P451 VanDerWaalsContact O-CD 3.29Å; V427-P451 WeakPolarHBondContact O-CD 3.47Å; I428-P451 WeakPolarHBondContact CA-O 3.45Å; L429-P451 PolarHBondContact N-O 3.17Å; P451-Y460 HydrophobicContact CB-CD1 3.72Å; P451-Y460 HydrophobicContact CB-CE1 3.88Å; P451-G462 WeakPolarHBondContact CA-O 3.24Å; P451-I712 HydrophobicContact CB-CD1 4.02Å; P451-I712 HydrophobicContact CG-CD1 4.3Å; P451-I712 HydrophobicContact CG-CG1 4.26Å; P451-I712 HydrophobicContact CG-CG2 4.26Å; P451-A721 HydrophobicContact CG-CB 4.48Å; P451-L724 HydrophobicContact CG-CD2 3.97Å
452	V	91.6	Very high	89	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	124.5	170.7	-178.1	0	0	0	0	109	L429 Y460 M461 G462 F464 L527 F531	L429-V452 CarbonylContact O-C 3.54Å; L429-V452 WeakPolarHBondContact O-CA 3.3Å; V452-Y460 CarbonylContact O-C 3.6Å; V452-Y460 VanDerWaalsContact O-CA 3.27Å; V452-Y460 WeakPolarHBondContact O-CA 3.19Å; V452-M461 HydrophobicContact CB-CB 4.35Å; V452-M461 HydrophobicContact CG1-CB 4.19Å; V452-M461 HydrophobicContact CG1-CG 4.43Å; V452-M461 HydrophobicContact CG1-SD 4.16Å; V452-M461 PolarHBondContact O-N 3.49Å; V452-G462 PolarHBondContact N-O 3.08Å; V452-F464 HydrophobicContact CG2-CB 3.65Å; V452-L527 HydrophobicContact CG1-CD2 4.05Å; V452-L527 HydrophobicContact CG2-CD2 3.75Å; V452-L527 HydrophobicContact CG2-CG 4.48Å; V452-F531 HydrophobicContact CB-CE1 4.46Å; V452-F531 HydrophobicContact CG2-CD2 4.49Å; V452-F531 HydrophobicContact CG2-CE1 3.95Å; V452-F531 HydrophobicContact CG2-CE2 3.89Å; V452-F531 HydrophobicContact CG2-CZ 3.61Å
453	W	91.6	Very high	88.8	Confident	60 Å²	60	43 Å²	43	23%	0.227	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	124.2	179.4	173.3	-97.3	0	0	0	110.6	I428 L429 D430 S431 S455 Q458 Y460	I428-W453 HydrophobicContact CG2-CB 3.66Å; L429-W453 PolarHBondContact O-N 3.43Å; D430-W453 CarbonylContact C-O 3.6Å; D430-W453 WeakPolarHBondContact CA-O 3.3Å; S431-W453 PolarHBondContact N-O 2.97Å; W453-S455 PolarHBondContact NE1-OG 3.35Å; W453-Q458 HydrophobicContact CH2-CB 4.26Å; W453-Q458 WeakPolarHBondContact CH2-O 3.25Å; W453-Q458 HydrophobicContact CZ2-CB 4.03Å; W453-Y460 HydrophobicContact CB-CD1 4.37Å; W453-Y460 HydrophobicContact CB-CE1 4.35Å; W453-Y460 AromaticContact CE3-CD1 3.94Å; W453-Y460 HydrophobicContact CE3-CD1 3.94Å; W453-Y460 HydrophobicContact CE3-CD2 4Å; W453-Y460 AromaticContact CE3-CE1 3.78Å; W453-Y460 HydrophobicContact CE3-CE1 3.78Å; W453-Y460 AromaticContact CE3-CE2 3.84Å; W453-Y460 HydrophobicContact CE3-CE2 3.84Å; W453-Y460 HydrophobicContact CE3-CG 4.05Å; W453-Y460 AromaticContact CE3-CZ 3.72Å; W453-Y460 HydrophobicContact CZ3-CD2 4.06Å; W453-Y460 AromaticContact CZ3-CE2 3.8Å; W453-Y460 HydrophobicContact CZ3-CE2 3.8Å
454	C	90.7	Very high	88.7	Confident	9 Å²	9	41.6 Å²	41.6	6%	0.061	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	110.8	170.1	-174.3	0	0	0	0	110.1	E456 T457 Q458 S459 M461	C454-E456 PolarHBondContact O-N 3.1Å; C454-T457 VanDerWaalsContact CB-OG1 3.24Å; C454-T457 WeakPolarHBondContact CB-OG1 3.45Å; C454-T457 PolarHBondContact SG-OG1 3.02Å; C454-T457 VanDerWaalsContact SG-OG1 3.33Å; C454-Q458 VanDerWaalsContact O-CA 3.3Å; C454-Q458 WeakPolarHBondContact O-CA 3.36Å; C454-Q458 PolarHBondContact O-N 3.26Å; C454-S459 PolarHBondContact N-O 3.41Å; C454-S459 PolarHBondContact O-N 3.4Å; C454-M461 HydrophobicContact CB-CG 3.66Å; C454-M461 HydrophobicContact CB-SD 3.81Å
455	S	90	Very high	88.5	Confident	29 Å²	29	35.9 Å²	35.9	20%	0.203	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-15.1	177.1	-75.5	0	0	0	0	113.9	D430 R432 W453 Q458	D430-S455 WeakPolarHBondContact OD2-CB 3.37Å; D430-S455 PolarHBondContact OD2-OG 3.5Å; R432-S455 PolarHBondContact NH2-OG 3.02Å; W453-S455 PolarHBondContact NE1-OG 3.35Å; S455-Q458 PolarHBondContact O-NE2 2.94Å
456	E	88.8	Confident	88.4	Confident	144 Å²	144	34.3 Å²	34.3	67%	0.673	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-46.8	176.1	-68.8	156.2	-153.6	0	0	111.2	C454	C454-E456 PolarHBondContact O-N 3.1Å
457	T	87.9	Confident	88.3	Confident	94 Å²	94	33.7 Å²	33.7	58%	0.577	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.8	-5.8	177.8	57.6	0	0	0	0	113.9	C454 S459	C454-T457 VanDerWaalsContact CB-OG1 3.24Å; C454-T457 WeakPolarHBondContact CB-OG1 3.45Å; C454-T457 PolarHBondContact SG-OG1 3.02Å; C454-T457 VanDerWaalsContact SG-OG1 3.33Å; T457-S459 VanDerWaalsContact C-N 3.28Å; T457-S459 WeakPolarHBondContact CB-OG 3.46Å; T457-S459 PolarHBondContact O-N 3.3Å; T457-S459 PolarHBondContact OG1-OG 2.71Å
458	Q	89.1	Confident	88	Confident	125 Å²	125	32.9 Å²	32.9	58%	0.584	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.3	45.8	-173.3	-62.8	-74.2	-64.8	0	0	112.2	W453 C454 S455	W453-Q458 HydrophobicContact CH2-CB 4.26Å; W453-Q458 WeakPolarHBondContact CH2-O 3.25Å; W453-Q458 HydrophobicContact CZ2-CB 4.03Å; C454-Q458 VanDerWaalsContact O-CA 3.3Å; C454-Q458 WeakPolarHBondContact O-CA 3.36Å; C454-Q458 PolarHBondContact O-N 3.26Å; S455-Q458 PolarHBondContact O-NE2 2.94Å
459	S	87.2	Confident	88	Confident	51 Å²	51	30.5 Å²	30.5	36%	0.357	16%	0.16	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	159.6	-175.8	65	0	0	0	0	112.9	C454 T457	C454-S459 PolarHBondContact N-O 3.41Å; C454-S459 PolarHBondContact O-N 3.4Å; T457-S459 VanDerWaalsContact C-N 3.28Å; T457-S459 WeakPolarHBondContact CB-OG 3.46Å; T457-S459 PolarHBondContact O-N 3.3Å; T457-S459 PolarHBondContact OG1-OG 2.71Å
460	Y	86.8	Confident	87.8	Confident	27 Å²	27	30.1 Å²	30.1	11%	0.106	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	130.6	174.9	-65	-80.9	0	0	0	111.3	I428 P451 V452 W453 F547 I714 G719 A721	I428-Y460 HydrophobicContact CD1-CE1 4.29Å; I428-Y460 HydrophobicContact CG2-CE1 4.13Å; P451-Y460 HydrophobicContact CB-CD1 3.72Å; P451-Y460 HydrophobicContact CB-CE1 3.88Å; V452-Y460 CarbonylContact O-C 3.6Å; V452-Y460 VanDerWaalsContact O-CA 3.27Å; V452-Y460 WeakPolarHBondContact O-CA 3.19Å; W453-Y460 HydrophobicContact CB-CD1 4.37Å; W453-Y460 HydrophobicContact CB-CE1 4.35Å; W453-Y460 AromaticContact CE3-CD1 3.94Å; W453-Y460 HydrophobicContact CE3-CD1 3.94Å; W453-Y460 HydrophobicContact CE3-CD2 4Å; W453-Y460 AromaticContact CE3-CE1 3.78Å; W453-Y460 HydrophobicContact CE3-CE1 3.78Å; W453-Y460 AromaticContact CE3-CE2 3.84Å; W453-Y460 HydrophobicContact CE3-CE2 3.84Å; W453-Y460 HydrophobicContact CE3-CG 4.05Å; W453-Y460 AromaticContact CE3-CZ 3.72Å; W453-Y460 HydrophobicContact CZ3-CD2 4.06Å; W453-Y460 AromaticContact CZ3-CE2 3.8Å; W453-Y460 HydrophobicContact CZ3-CE2 3.8Å; Y460-F547 HydrophobicContact CD2-CE1 4.5Å; Y460-F547 HydrophobicContact CG-CE1 4.4Å; Y460-I714 HydrophobicContact CD2-CD1 3.57Å; Y460-I714 HydrophobicContact CE2-CD1 3.82Å; Y460-I714 HydrophobicContact CG-CD1 4.45Å; Y460-G719 WeakPolarHBondContact CE2-O 3.5Å; Y460-A721 HydrophobicContact CE1-CB 4.09Å; Y460-A721 HydrophobicContact CE2-CB 4.27Å; Y460-A721 WeakPolarHBondContact OH-CB 3.25Å; Y460-A721 PolarHBondContact OH-N 3.41Å; Y460-A721 VanDerWaalsContact OH-N 3.15Å
461	M	83	Confident	87.2	Confident	25 Å²	25	30.4 Å²	30.4	12%	0.123	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-23.9	177.5	-58.9	-178	73.7	0	0	113.1	S431 V452 C454 F531 N532 F543	S431-M461 VanDerWaalsContact CB-SD 3.5Å; V452-M461 HydrophobicContact CB-CB 4.35Å; V452-M461 HydrophobicContact CG1-CB 4.19Å; V452-M461 HydrophobicContact CG1-CG 4.43Å; V452-M461 HydrophobicContact CG1-SD 4.16Å; V452-M461 PolarHBondContact O-N 3.49Å; C454-M461 HydrophobicContact CB-CG 3.66Å; C454-M461 HydrophobicContact CB-SD 3.81Å; M461-F531 HydrophobicContact CB-CD1 4.48Å; M461-F531 HydrophobicContact CE-CB 4.18Å; M461-N532 WeakPolarHBondContact CE-OD1 3.47Å; M461-F543 VanDerWaalsContact O-CE1 3.29Å; M461-F543 WeakPolarHBondContact O-CE1 3.44Å
462	G	84.9	Confident	86.6	Confident	2 Å²	2	31 Å²	31	2%	0.021	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	160.2	-160.8	-174.3	0	0	0	0	0	113	P451 V452	P451-G462 WeakPolarHBondContact CA-O 3.24Å; V452-G462 PolarHBondContact N-O 3.08Å
463	V	87.2	Confident	86.1	Confident	13 Å²	13	31 Å²	31	8%	0.079	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	130.1	169.6	173.2	0	0	0	0	108.5	A449 F531 L546 Y710 I712 L724	A449-V463 HydrophobicContact CB-CG1 3.63Å; V463-F531 WeakPolarHBondContact O-CZ 3.4Å; V463-L546 HydrophobicContact CG2-CD1 4.17Å; V463-L546 HydrophobicContact CG2-CD2 4.21Å; V463-L546 HydrophobicContact CG2-CG 4.43Å; V463-Y710 HydrophobicContact CG1-CD2 4.02Å; V463-Y710 HydrophobicContact CG1-CG 4.34Å; V463-I712 HydrophobicContact CG2-CD1 3.64Å; V463-I712 HydrophobicContact CG2-CG1 3.49Å; V463-I712 VanDerWaalsContact CG2-CG1 3.49Å; V463-L724 HydrophobicContact CG2-CD2 4.01Å
464	F	89.4	Confident	85.4	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	138.7	167.4	-173.6	-127	0	0	0	109.4	L429 T435 A438 I439 L442 A449 A450 V452 L468 A469 M472 L527 F531	L429-F464 HydrophobicContact CD1-CB 4.08Å; L429-F464 HydrophobicContact CD1-CD1 3.72Å; L429-F464 HydrophobicContact CD1-CG 4.38Å; T435-F464 HydrophobicContact CG2-CZ 4.33Å; A438-F464 HydrophobicContact CB-CD1 4.21Å; A438-F464 HydrophobicContact CB-CE1 3.91Å; I439-F464 HydrophobicContact CD1-CZ 4.34Å; I439-F464 HydrophobicContact CG1-CE1 3.73Å; I439-F464 HydrophobicContact CG1-CZ 3.6Å; L442-F464 HydrophobicContact CD1-CD1 3.67Å; L442-F464 HydrophobicContact CD1-CE1 3.9Å; L442-F464 HydrophobicContact CD1-CG 4.45Å; L442-F464 HydrophobicContact CG-CD1 4.31Å; A449-F464 CarbonylContact C-O 3.5Å; A449-F464 WeakPolarHBondContact CA-O 3.25Å; A449-F464 WeakPolarHBondContact CB-O 3.2Å; A450-F464 PolarHBondContact N-O 3.37Å; A450-F464 PolarHBondContact O-N 2.84Å; V452-F464 HydrophobicContact CG2-CB 3.65Å; F464-L468 HydrophobicContact CD2-CD2 4.17Å; F464-L468 HydrophobicContact CD2-CG 4.5Å; F464-A469 HydrophobicContact CE2-CB 4.23Å; F464-A469 HydrophobicContact CZ-CB 3.89Å; F464-M472 HydrophobicContact CE2-CE 3.96Å; F464-M472 HydrophobicContact CE2-SD 3.76Å; F464-L527 HydrophobicContact CD1-CD1 4.12Å; F464-L527 HydrophobicContact CD1-CD2 4.43Å; F464-L527 HydrophobicContact CD2-CD1 4.05Å; F464-L527 HydrophobicContact CE1-CD1 4.11Å; F464-L527 HydrophobicContact CE2-CD1 4.04Å; F464-L527 HydrophobicContact CG-CD1 4.08Å; F464-L527 HydrophobicContact CG-CD2 4.49Å; F464-L527 HydrophobicContact CZ-CD1 4.06Å; F464-F531 HydrophobicContact CB-CE2 3.85Å; F464-F531 HydrophobicContact CB-CZ 3.68Å; F464-F531 AromaticContact CD2-CE2 3.58Å; F464-F531 HydrophobicContact CD2-CE2 3.58Å; F464-F531 AromaticContact CD2-CZ 3.97Å; F464-F531 HydrophobicContact CD2-CZ 3.97Å; F464-F531 HydrophobicContact CE2-CE2 4.44Å; F464-F531 HydrophobicContact CG-CE2 4.01Å; F464-F531 HydrophobicContact CG-CZ 4.27Å
465	S	87.4	Confident	84.5	Confident	11 Å²	11	31.2 Å²	31.2	8%	0.077	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146	162.7	-173.2	82.5	0	0	0	0	112.9	M448 E467 L468 A469	M448-S465 CarbonylContact O-C 3.57Å; M448-S465 VanDerWaalsContact O-CA 3.24Å; M448-S465 WeakPolarHBondContact O-CA 3.23Å; M448-S465 WeakPolarHBondContact O-CB 3.44Å; S465-E467 VanDerWaalsContact C-N 3.26Å; S465-E467 WeakPolarHBondContact CB-OE2 3.44Å; S465-E467 PolarHBondContact O-N 2.84Å; S465-E467 PolarHBondContact OG-OE2 3.03Å; S465-L468 PolarHBondContact O-N 3.16Å; S465-L468 PolarHBondContact OG-N 2.96Å; S465-A469 WeakPolarHBondContact O-CB 3.18Å; S465-A469 PolarHBondContact O-N 3.17Å
466	Q	88	Confident	83.6	Confident	15 Å²	15	31.1 Å²	31.1	7%	0.07	16%	0.161	C	C	.	.	H	α-helix	trans	-64.1	-32.8	179.8	-64.7	176.2	3.4	0	0	112	L442 V447 M448 L470 P831 G832 L835	L442-Q466 HydrophobicContact CD1-CG 4.36Å; V447-Q466 PolarHBondContact O-NE2 3.48Å; M448-Q466 PolarHBondContact O-N 3.49Å; Q466-L470 PolarHBondContact O-N 2.91Å; Q466-L470 VanDerWaalsContact O-N 3.09Å; Q466-P831 HydrophobicContact CB-CB 4.01Å; Q466-G832 VanDerWaalsContact OE1-N 3.12Å; Q466-L835 HydrophobicContact CB-CD2 3.99Å; Q466-L835 HydrophobicContact CG-CD2 4.1Å
467	E	83.1	Confident	82.7	Confident	15 Å²	15	25.2 Å²	25.2	7%	0.07	13%	0.133	C	C	.	.	H	α-helix	trans	-63.4	-49	173.6	-53.5	82.9	177	0	0	110.8	S465 L470 D471 Y710 L803 P831	S465-E467 VanDerWaalsContact C-N 3.26Å; S465-E467 WeakPolarHBondContact CB-OE2 3.44Å; S465-E467 PolarHBondContact O-N 2.84Å; S465-E467 PolarHBondContact OG-OE2 3.03Å; E467-L470 PolarHBondContact O-N 3.12Å; E467-D471 PolarHBondContact O-N 2.93Å; E467-Y710 PolarHBondContact OE1-OH 3.04Å; E467-L803 HydrophobicContact CB-CD1 4.04Å; E467-L803 HydrophobicContact CB-CD2 3.65Å; E467-L803 HydrophobicContact CB-CG 4.46Å; E467-L803 HydrophobicContact CG-CD2 3.6Å; E467-L803 WeakPolarHBondContact O-CD1 3.37Å; E467-P831 HydrophobicContact CG-CG 4.06Å
468	L	82.7	Confident	81.9	Confident	12 Å²	12	23.1 Å²	23.1	6%	0.063	12%	0.115	C	C	.	.	H	α-helix	trans	-64.7	-40.7	179	-176.6	56.5	0	0	0	111.4	F464 S465 L470 D471 M472 F531 M534 Y704	F464-L468 HydrophobicContact CD2-CD2 4.17Å; F464-L468 HydrophobicContact CD2-CG 4.5Å; S465-L468 PolarHBondContact O-N 3.16Å; S465-L468 PolarHBondContact OG-N 2.96Å; L468-L470 PolarHBondContact O-N 3.2Å; L468-D471 PolarHBondContact O-N 2.99Å; L468-M472 HydrophobicContact CD1-SD 4.4Å; L468-M472 HydrophobicContact CG-SD 3.91Å; L468-M472 WeakPolarHBondContact O-CG 3.16Å; L468-M472 PolarHBondContact O-N 3.33Å; L468-F531 HydrophobicContact CD2-CZ 4.11Å; L468-M534 HydrophobicContact CD1-CE 4.37Å; L468-M534 HydrophobicContact CD1-SD 3.88Å; L468-M534 HydrophobicContact CD2-CE 4.03Å; L468-M534 HydrophobicContact CG-CE 4.33Å; L468-M534 HydrophobicContact CG-SD 4.37Å; L468-Y704 HydrophobicContact CD1-CE1 4.42Å
469	A	85.8	Confident	80.6	Confident	0 Å²	0	19.7 Å²	19.7	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61.3	-41	175.9	0	0	0	0	0	113	I439 F464 S465 I473 L835	I439-A469 HydrophobicContact CD1-CB 4.01Å; I439-A469 HydrophobicContact CG1-CB 3.91Å; F464-A469 HydrophobicContact CE2-CB 4.23Å; F464-A469 HydrophobicContact CZ-CB 3.89Å; S465-A469 WeakPolarHBondContact O-CB 3.18Å; S465-A469 PolarHBondContact O-N 3.17Å; A469-I473 VanDerWaalsContact O-CG1 3.28Å; A469-I473 WeakPolarHBondContact O-CG1 3.37Å; A469-I473 PolarHBondContact O-N 3.28Å; A469-I473 VanDerWaalsContact O-N 3.12Å; A469-L835 HydrophobicContact CB-CD1 3.99Å; A469-L835 HydrophobicContact CB-CD2 3.75Å
470	L	85.3	Confident	79.3	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-70.6	-36.7	174	-79.3	-173.7	0	0	0	113	Q466 E467 L468 M472 I473 G474 L796 L799 P831 L834 L835 I838	Q466-L470 PolarHBondContact O-N 2.91Å; Q466-L470 VanDerWaalsContact O-N 3.09Å; E467-L470 PolarHBondContact O-N 3.12Å; L468-L470 PolarHBondContact O-N 3.2Å; L470-M472 VanDerWaalsContact C-N 3.33Å; L470-I473 PolarHBondContact O-N 2.9Å; L470-G474 PolarHBondContact O-N 3.33Å; L470-L796 HydrophobicContact CB-CD1 4.25Å; L470-L796 HydrophobicContact CD2-CD1 4.05Å; L470-L799 HydrophobicContact CB-CD2 3.84Å; L470-L799 HydrophobicContact CD1-CD1 3.72Å; L470-L799 HydrophobicContact CD1-CD2 3.56Å; L470-L799 HydrophobicContact CD1-CG 4.32Å; L470-L799 HydrophobicContact CG-CD2 4.38Å; L470-P831 HydrophobicContact CD1-CB 3.93Å; L470-P831 WeakPolarHBondContact CD1-O 3.22Å; L470-L834 HydrophobicContact CD1-CB 3.9Å; L470-L834 HydrophobicContact CD2-CB 4.32Å; L470-L835 HydrophobicContact CD2-CB 3.9Å; L470-L835 HydrophobicContact CD2-CD1 3.78Å; L470-L835 HydrophobicContact CD2-CG 4.44Å; L470-L835 HydrophobicContact CG-CB 4.09Å; L470-L835 HydrophobicContact CG-CD1 4.17Å; L470-I838 HydrophobicContact CD2-CD1 4.17Å
471	D	78.9	Confident	78	Confident	7 Å²	7	20.1 Å²	20.1	4%	0.037	10%	0.104	C	C	.	.	H	α-helix	trans	-60	-44.7	174.6	-174.2	73.5	0	0	0	111.3	E467 L468 I473 G474 H475 Y704	E467-D471 PolarHBondContact O-N 2.93Å; L468-D471 PolarHBondContact O-N 2.99Å; D471-I473 PolarHBondContact O-N 2.93Å; D471-G474 PolarHBondContact O-N 2.87Å; D471-H475 WeakPolarHBondContact O-CB 3.34Å; D471-H475 PolarHBondContact O-CD2 2.93Å; D471-H475 PolarHBondContact O-N 2.9Å; D471-H475 IonicContact OD2-CD2 3.55Å; D471-H475 IonicContact OD2-NE2 3.58Å; D471-Y704 VanDerWaalsContact OD2-CE1 3.25Å; D471-Y704 WeakPolarHBondContact OD2-CE1 3.2Å; D471-Y704 VanDerWaalsContact OD2-CZ 3.3Å; D471-Y704 PolarHBondContact OD2-OH 2.74Å
472	M	79.2	Confident	76.8	Confident	13 Å²	13	22.5 Å²	22.5	6%	0.064	12%	0.117	C	C	.	.	H	α-helix	trans	-58.9	-46.6	173.2	-67	148.8	107.1	0	0	112.5	T435 F464 L468 L470 H475 L476 W522 V530 M534	T435-M472 HydrophobicContact CG2-CE 4.27Å; F464-M472 HydrophobicContact CE2-CE 3.96Å; F464-M472 HydrophobicContact CE2-SD 3.76Å; L468-M472 HydrophobicContact CD1-SD 4.4Å; L468-M472 HydrophobicContact CG-SD 3.91Å; L468-M472 WeakPolarHBondContact O-CG 3.16Å; L468-M472 PolarHBondContact O-N 3.33Å; L470-M472 VanDerWaalsContact C-N 3.33Å; M472-H475 PolarHBondContact O-N 2.73Å; M472-L476 WeakPolarHBondContact O-CG 3.46Å; M472-L476 PolarHBondContact O-N 3.36Å; M472-W522 HydrophobicContact CB-CH2 3.6Å; M472-W522 HydrophobicContact CB-CZ2 3.51Å; M472-W522 HydrophobicContact CE-CH2 3.71Å; M472-W522 HydrophobicContact CE-CZ2 3.46Å; M472-W522 VanDerWaalsContact CE-CZ2 3.46Å; M472-W522 HydrophobicContact CG-CH2 4.15Å; M472-W522 HydrophobicContact CG-CZ2 3.87Å; M472-W522 HydrophobicContact SD-CH2 3.94Å; M472-W522 HydrophobicContact SD-CZ2 4.03Å; M472-V530 HydrophobicContact CE-CB 4.26Å; M472-V530 HydrophobicContact CE-CG1 3.46Å; M472-V530 VanDerWaalsContact CE-CG1 3.46Å; M472-M534 HydrophobicContact CE-CE 3.43Å; M472-M534 VanDerWaalsContact CE-CE 3.43Å; M472-M534 HydrophobicContact CE-SD 3.6Å; M472-M534 HydrophobicContact CG-SD 3.68Å; M472-M534 HydrophobicContact SD-CE 4.15Å; M472-M534 HydrophobicContact SD-SD 3.87Å
473	I	81	Confident	75.3	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.3	-39.8	179.9	-68.4	169	0	0	0	111.4	A469 L470 D471 H475 L476 H477 F515 L519 L796 L835	A469-I473 VanDerWaalsContact O-CG1 3.28Å; A469-I473 WeakPolarHBondContact O-CG1 3.37Å; A469-I473 PolarHBondContact O-N 3.28Å; A469-I473 VanDerWaalsContact O-N 3.12Å; L470-I473 PolarHBondContact O-N 2.9Å; D471-I473 PolarHBondContact O-N 2.93Å; I473-H475 VanDerWaalsContact C-N 3.34Å; I473-L476 PolarHBondContact O-N 3.22Å; I473-H477 PolarHBondContact O-N 2.95Å; I473-H477 VanDerWaalsContact O-N 3.12Å; I473-F515 HydrophobicContact CG2-CE2 4.12Å; I473-F515 HydrophobicContact CG2-CZ 3.82Å; I473-L519 HydrophobicContact CD1-CD1 4.02Å; I473-L519 HydrophobicContact CG1-CD1 3.83Å; I473-L796 HydrophobicContact CG2-CD2 4.41Å; I473-L835 HydrophobicContact CD1-CD1 3.52Å
474	G	77.9	Confident	73.4	Confident	0 Å²	0	28 Å²	28	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-59.2	-45.7	171.9	0	0	0	0	0	111.5	L470 D471 L476 H477 Y478	L470-G474 PolarHBondContact O-N 3.33Å; D471-G474 PolarHBondContact O-N 2.87Å; G474-L476 PolarHBondContact O-N 3.22Å; G474-H477 PolarHBondContact O-N 2.83Å; G474-Y478 WeakPolarHBondContact O-CD2 3.39Å; G474-Y478 PolarHBondContact O-N 2.66Å
475	H	71.1	Confident	71.3	Confident	72 Å²	72	30.9 Å²	30.9	33%	0.333	16%	0.163	S	C	.	.	H	α-helix	trans	-60.9	-41.3	175.6	-90	-59.8	0	0	0	113.5	D471 M472 I473 Y478 T479 Y704	D471-H475 WeakPolarHBondContact O-CB 3.34Å; D471-H475 PolarHBondContact O-CD2 2.93Å; D471-H475 PolarHBondContact O-N 2.9Å; D471-H475 IonicContact OD2-CD2 3.55Å; D471-H475 IonicContact OD2-NE2 3.58Å; M472-H475 PolarHBondContact O-N 2.73Å; I473-H475 VanDerWaalsContact C-N 3.34Å; H475-Y478 PolarHBondContact O-N 2.8Å; H475-T479 WeakPolarHBondContact O-CG2 3.33Å; H475-T479 PolarHBondContact O-N 3.36Å; H475-T479 PolarHBondContact O-OG1 2.93Å; H475-Y704 PolarHBondContact NE2-OH 3.01Å
476	L	71.3	Confident	69.3	Low	27 Å²	27	34.8 Å²	34.8	14%	0.141	18%	0.183	C	C	.	.	H	α-helix	trans	-56.7	-56.6	173.4	-70	172.7	0	0	0	110.9	M472 I473 G474 Y478 T479 E480 W522	M472-L476 WeakPolarHBondContact O-CG 3.46Å; M472-L476 PolarHBondContact O-N 3.36Å; I473-L476 PolarHBondContact O-N 3.22Å; G474-L476 PolarHBondContact O-N 3.22Å; L476-Y478 VanDerWaalsContact C-N 3.34Å; L476-Y478 PolarHBondContact O-N 3.22Å; L476-T479 PolarHBondContact O-N 3.17Å; L476-T479 PolarHBondContact O-OG1 3.01Å; L476-E480 PolarHBondContact O-N 3.09Å; L476-W522 HydrophobicContact CD1-CB 4.01Å; L476-W522 HydrophobicContact CD1-CD2 3.76Å; L476-W522 HydrophobicContact CD1-CE3 4.02Å; L476-W522 HydrophobicContact CD1-CG 3.77Å; L476-W522 HydrophobicContact CD2-CB 4.4Å; L476-W522 HydrophobicContact CD2-CG 4.14Å
477	H	70.2	Confident	67.3	Low	20 Å²	20	36.7 Å²	36.7	9%	0.093	20%	0.198	C	C	.	.	H	α-helix	trans	-54.6	-45.9	179.5	177.4	-90.1	0	0	0	112.5	I473 G474 T479 E480 V481 F515 H797 L847	I473-H477 PolarHBondContact O-N 2.95Å; I473-H477 VanDerWaalsContact O-N 3.12Å; G474-H477 PolarHBondContact O-N 2.83Å; H477-T479 PolarHBondContact O-N 3.12Å; H477-E480 PolarHBondContact O-N 3.38Å; H477-V481 WeakPolarHBondContact O-CG2 3.4Å; H477-V481 PolarHBondContact O-N 2.97Å; H477-F515 HydrophobicContact CB-CD2 4.28Å; H477-F515 HydrophobicContact CB-CE2 4.12Å; H477-H797 AromaticContact CE1-CE1 3.77Å; H477-H797 AromaticContact CE1-NE2 3.81Å; H477-H797 AromaticContact ND1-CE1 3.62Å; H477-L847 WeakPolarHBondContact CD2-CD1 3.32Å
478	Y	69.3	Low	65.4	Low	50 Å²	50	40 Å²	40	20%	0.196	22%	0.216	C	C	.	.	H	α-helix	trans	-60.7	-40.8	175.1	-75.3	-59.1	0	0	0	112.8	G474 H475 L476 E480 V481 I482 L778 H797	G474-Y478 WeakPolarHBondContact O-CD2 3.39Å; G474-Y478 PolarHBondContact O-N 2.66Å; H475-Y478 PolarHBondContact O-N 2.8Å; L476-Y478 VanDerWaalsContact C-N 3.34Å; L476-Y478 PolarHBondContact O-N 3.22Å; Y478-E480 PolarHBondContact O-N 2.77Å; Y478-V481 PolarHBondContact O-N 3.19Å; Y478-I482 WeakPolarHBondContact O-CD1 3.33Å; Y478-I482 VanDerWaalsContact O-CG1 3.3Å; Y478-I482 WeakPolarHBondContact O-CG1 3.16Å; Y478-I482 PolarHBondContact O-N 2.84Å; Y478-I482 VanDerWaalsContact O-N 3.12Å; Y478-L778 HydrophobicContact CD1-CD1 4.48Å; Y478-L778 HydrophobicContact CE1-CD1 3.71Å; Y478-H797 AromaticContact CE1-CE1 3.68Å; Y478-H797 AromaticContact CE1-ND1 3.56Å; Y478-H797 AromaticContact CE2-ND1 3.92Å; Y478-H797 AromaticContact CZ-CE1 3.77Å; Y478-H797 AromaticContact CZ-ND1 3.2Å; Y478-H797 PolarHBondContact OH-ND1 2.94Å
479	T	63.5	Low	63.6	Low	54 Å²	54	44.1 Å²	44.1	33%	0.331	24%	0.237	S	C	.	.	H	α-helix	trans	-72.9	-13.2	177.9	62.2	0	0	0	0	114.3	H475 L476 H477 K483	H475-T479 WeakPolarHBondContact O-CG2 3.33Å; H475-T479 PolarHBondContact O-N 3.36Å; H475-T479 PolarHBondContact O-OG1 2.93Å; L476-T479 PolarHBondContact O-N 3.17Å; L476-T479 PolarHBondContact O-OG1 3.01Å; H477-T479 PolarHBondContact O-N 3.12Å; T479-K483 WeakPolarHBondContact O-CD 3.36Å; T479-K483 WeakPolarHBondContact O-CE 3.43Å; T479-K483 VanDerWaalsContact O-CG 3.27Å; T479-K483 WeakPolarHBondContact O-CG 3.39Å; T479-K483 PolarHBondContact O-NZ 3.16Å
480	E	59.6	Low	61.3	Low	25 Å²	25	50.5 Å²	50.5	12%	0.117	27%	0.267	C	S	.	.	H	α-helix	trans	-83.2	-51.9	169.1	-69.1	176.6	-115.9	0	0	110.1	L476 H477 Y478 I482 K483 S484 S514 F515 N518	L476-E480 PolarHBondContact O-N 3.09Å; H477-E480 PolarHBondContact O-N 3.38Å; Y478-E480 PolarHBondContact O-N 2.77Å; E480-I482 VanDerWaalsContact C-N 3.3Å; E480-I482 PolarHBondContact O-N 3.34Å; E480-K483 WeakPolarHBondContact O-CB 3.49Å; E480-K483 PolarHBondContact O-N 3.24Å; E480-S484 PolarHBondContact O-N 2.84Å; E480-S484 PolarHBondContact O-OG 3.13Å; E480-S514 VanDerWaalsContact OE2-C 3.3Å; E480-S514 VanDerWaalsContact OE2-CB 3.29Å; E480-S514 WeakPolarHBondContact OE2-CB 3.42Å; E480-S514 PolarHBondContact OE2-OG 2.86Å; E480-F515 WeakPolarHBondContact OE2-CA 3.38Å; E480-F515 PolarHBondContact OE2-N 3.43Å; E480-N518 WeakPolarHBondContact OE1-CB 3.35Å; E480-N518 PolarHBondContact OE1-ND2 3.05Å; E480-N518 PolarHBondContact OE2-ND2 3.26Å
481	V	59.5	Low	59.2	Low	61 Å²	61	55.6 Å²	55.6	37%	0.37	30%	0.298	S	S	.	.	H	α-helix	trans	-55.2	-41.6	179.9	172.6	0	0	0	0	112.7	H477 Y478 K483 S484 S485	H477-V481 WeakPolarHBondContact O-CG2 3.4Å; H477-V481 PolarHBondContact O-N 2.97Å; Y478-V481 PolarHBondContact O-N 3.19Å; V481-K483 VanDerWaalsContact C-N 3.34Å; V481-K483 PolarHBondContact O-N 3.23Å; V481-S484 WeakPolarHBondContact CA-OG 3.02Å; V481-S484 PolarHBondContact O-N 2.79Å; V481-S484 PolarHBondContact O-OG 3.05Å; V481-S485 PolarHBondContact O-N 2.86Å
482	I	56.6	Low	57.1	Low	75 Å²	75	62.4 Å²	62.4	39%	0.385	33%	0.334	S	S	.	.	H	α-helix	trans	-67.1	-33.7	179.5	-67	166.5	0	0	0	112	Y478 E480 S485 D486	Y478-I482 WeakPolarHBondContact O-CD1 3.33Å; Y478-I482 VanDerWaalsContact O-CG1 3.3Å; Y478-I482 WeakPolarHBondContact O-CG1 3.16Å; Y478-I482 PolarHBondContact O-N 2.84Å; Y478-I482 VanDerWaalsContact O-N 3.12Å; E480-I482 VanDerWaalsContact C-N 3.3Å; E480-I482 PolarHBondContact O-N 3.34Å; I482-S485 PolarHBondContact O-N 2.74Å; I482-S485 PolarHBondContact O-OG 3.4Å; I482-D486 PolarHBondContact O-N 3.37Å
483	K	55.1	Low	55.2	Low	101 Å²	101	66.4 Å²	66.4	44%	0.439	36%	0.363	S	S	.	.	H	α-helix	trans	-68.8	-37.7	178.4	-69.7	167.2	-170.1	157.1	0	111.8	T479 E480 V481 D486 S487	T479-K483 WeakPolarHBondContact O-CD 3.36Å; T479-K483 WeakPolarHBondContact O-CE 3.43Å; T479-K483 VanDerWaalsContact O-CG 3.27Å; T479-K483 WeakPolarHBondContact O-CG 3.39Å; T479-K483 PolarHBondContact O-NZ 3.16Å; E480-K483 WeakPolarHBondContact O-CB 3.49Å; E480-K483 PolarHBondContact O-N 3.24Å; V481-K483 VanDerWaalsContact C-N 3.34Å; V481-K483 PolarHBondContact O-N 3.23Å; K483-D486 PolarHBondContact O-N 2.83Å; K483-S487 PolarHBondContact O-N 3.16Å
484	S	46.7	Very low	53	Low	30 Å²	30	71.2 Å²	71.2	21%	0.21	40%	0.396	C	S	.	.	H	α-helix	trans	-64.3	-39.6	176	30.3	0	0	0	0	112.9	E480 V481 D486 S487 D488	E480-S484 PolarHBondContact O-N 2.84Å; E480-S484 PolarHBondContact O-OG 3.13Å; V481-S484 WeakPolarHBondContact CA-OG 3.02Å; V481-S484 PolarHBondContact O-N 2.79Å; V481-S484 PolarHBondContact O-OG 3.05Å; S484-D486 VanDerWaalsContact C-N 3.27Å; S484-D486 PolarHBondContact O-N 3.49Å; S484-S487 WeakPolarHBondContact CA-OG 3.19Å; S484-S487 PolarHBondContact O-N 2.79Å; S484-S487 PolarHBondContact O-OG 2.72Å; S484-D488 PolarHBondContact O-N 2.8Å
485	S	44.9	Very low	50.7	Low	61 Å²	61	75.1 Å²	75.1	43%	0.427	44%	0.437	S	S	.	.	H	α-helix	trans	-63.8	-31.9	176.7	43.8	0	0	0	0	113.2	V481 I482 I489	V481-S485 PolarHBondContact O-N 2.86Å; I482-S485 PolarHBondContact O-N 2.74Å; I482-S485 PolarHBondContact O-OG 3.4Å; S485-I489 WeakPolarHBondContact O-CD1 3.37Å; S485-I489 WeakPolarHBondContact O-CG1 3.09Å
486	D	45.1	Very low	48.8	Very low	93 Å²	93	77.1 Å²	77.1	50%	0.497	46%	0.459	S	S	.	.	H	α-helix	trans	-76.7	-27.9	176.4	-77.9	-17.6	0	0	0	113.1	I482 K483 S484 Q490	I482-D486 PolarHBondContact O-N 3.37Å; K483-D486 PolarHBondContact O-N 2.83Å; S484-D486 VanDerWaalsContact C-N 3.27Å; S484-D486 PolarHBondContact O-N 3.49Å; D486-Q490 WeakPolarHBondContact O-CG 3.47Å; D486-Q490 PolarHBondContact O-N 3.25Å; D486-Q490 PolarHBondContact O-NE2 3.1Å
487	S	47	Very low	47	Very low	54 Å²	54	82 Å²	82	38%	0.378	49%	0.489	S	S	.	.	H	α-helix	trans	-73.4	-42.4	177.8	51.9	0	0	0	0	112.4	K483 S484 I489 Q490 T491	K483-S487 PolarHBondContact O-N 3.16Å; S484-S487 WeakPolarHBondContact CA-OG 3.19Å; S484-S487 PolarHBondContact O-N 2.79Å; S484-S487 PolarHBondContact O-OG 2.72Å; S487-I489 VanDerWaalsContact C-N 3.3Å; S487-I489 PolarHBondContact O-N 2.91Å; S487-Q490 PolarHBondContact O-N 2.9Å; S487-Q490 VanDerWaalsContact O-N 3.09Å; S487-T491 PolarHBondContact O-N 3.48Å; S487-T491 PolarHBondContact O-OG1 2.98Å
488	D	43.5	Very low	45.4	Very low	85 Å²	85	87.3 Å²	87.3	46%	0.455	52%	0.523	S	S	.	.	H	α-helix	trans	-65.1	-37.1	-177.2	-63.4	-12.9	0	0	0	111.4	S484 Q490 T491 L492	S484-D488 PolarHBondContact O-N 2.8Å; D488-Q490 VanDerWaalsContact C-N 3.33Å; D488-Q490 PolarHBondContact O-N 3.3Å; D488-T491 PolarHBondContact O-N 2.82Å; D488-L492 WeakPolarHBondContact O-CG 3.47Å; D488-L492 PolarHBondContact O-N 2.79Å
489	I	43.6	Very low	43.6	Very low	98 Å²	98	91.7 Å²	91.7	50%	0.503	55%	0.55	S	S	.	*	H	α-helix	trans	-64.2	-36.4	174.6	-66	171	0	0	0	111.6	S485 S487 S493	S485-I489 WeakPolarHBondContact O-CD1 3.37Å; S485-I489 WeakPolarHBondContact O-CG1 3.09Å; S487-I489 VanDerWaalsContact C-N 3.3Å; S487-I489 PolarHBondContact O-N 2.91Å; I489-S493 PolarHBondContact O-OG 3.42Å
490	Q	38.1	Very low	42.1	Very low	134 Å²	134	95.6 Å²	95.6	63%	0.626	57%	0.574	S	S	*	*	H	α-helix	trans	-74.2	-38.6	178	-74.8	171.3	70.6	0	0	112.2	D486 S487 D488 L492 S493	D486-Q490 WeakPolarHBondContact O-CG 3.47Å; D486-Q490 PolarHBondContact O-N 3.25Å; D486-Q490 PolarHBondContact O-NE2 3.1Å; S487-Q490 PolarHBondContact O-N 2.9Å; S487-Q490 VanDerWaalsContact O-N 3.09Å; D488-Q490 VanDerWaalsContact C-N 3.33Å; D488-Q490 PolarHBondContact O-N 3.3Å; Q490-L492 PolarHBondContact O-N 2.89Å; Q490-S493 PolarHBondContact O-N 3.32Å
491	T	40.5	Very low	40.7	Very low	107 Å²	107	99.4 Å²	99.4	66%	0.656	60%	0.604	S	S	*	*	H	α-helix	trans	-67.8	-35.5	179.3	-55.3	0	0	0	0	112.4	S487 D488 S493 S494	S487-T491 PolarHBondContact O-N 3.48Å; S487-T491 PolarHBondContact O-OG1 2.98Å; D488-T491 PolarHBondContact O-N 2.82Å; T491-S493 PolarHBondContact O-N 3.37Å; T491-S493 VanDerWaalsContact O-N 3.16Å; T491-S494 PolarHBondContact O-N 3.14Å
492	L	36.4	Very low	39.3	Very low	151 Å²	151	103.5 Å²	103.5	79%	0.791	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-14.3	176	-73.8	168.5	0	0	0	114.5	D488 Q490	D488-L492 WeakPolarHBondContact O-CG 3.47Å; D488-L492 PolarHBondContact O-N 2.79Å; Q490-L492 PolarHBondContact O-N 2.89Å
493	S	37.7	Very low	38.1	Very low	97 Å²	97	104.9 Å²	104.9	68%	0.678	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.1	-1.4	-177.9	-60.3	0	0	0	0	114.5	I489 Q490 T491	I489-S493 PolarHBondContact O-OG 3.42Å; Q490-S493 PolarHBondContact O-N 3.32Å; T491-S493 PolarHBondContact O-N 3.37Å; T491-S493 VanDerWaalsContact O-N 3.16Å
494	S	35.8	Very low	36.8	Very low	100 Å²	100	106 Å²	106	70%	0.699	67%	0.667	S	S	*	*			trans	-122.6	56.4	-171.4	-59.8	0	0	0	0	113.3	T491	T491-S494 PolarHBondContact O-N 3.14Å
495	G	28.7	Very low	36	Very low	82 Å²	82	113 Å²	113	85%	0.845	70%	0.702	S	S	*	*			trans	-78.3	121.2	-177.6	0	0	0	0	0	114.8
496	S	32.8	Very low	35.2	Very low	114 Å²	114	114.1 Å²	114.1	80%	0.797	71%	0.71	S	S	*	*			trans	-128.5	121.1	157.2	64.2	0	0	0	0	109.8
497	V	32.8	Very low	34.5	Very low	129 Å²	129	114.7 Å²	114.7	78%	0.782	72%	0.721	S	S	*	*			trans	-84.3	123.3	-171.8	-179.5	0	0	0	0	111.5
498	T	37.1	Very low	34	Very low	132 Å²	132	116.4 Å²	116.4	81%	0.81	73%	0.734	S	S	*	*			trans	-148.4	126.9	152	47.9	0	0	0	0	109.3
499	D	30.8	Very low	33.5	Very low	143 Å²	143	117 Å²	117	77%	0.765	74%	0.744	S	S	*	*			trans	-74.6	151.3	-177.7	-46.6	-90.7	0	0	0	113.2
500	T	31.9	Very low	33	Very low	135 Å²	135	115 Å²	115	83%	0.828	75%	0.748	S	S	*	*				-170	138.4	122.8	-73.2	0	0	0	0	109.7	T502	T500-T502 PolarHBondContact O-N 3.08Å
501	S	31.1	Very low	32.7	Very low	106 Å²	106	114 Å²	114	74%	0.741	74%	0.742	S	S	*	*			trans	-77	115.6	-177.5	53.6	0	0	0	0	113.6
502	T	29.3	Very low	32.5	Very low	146 Å²	146	111.7 Å²	111.7	90%	0.896	72%	0.723	S	S	*	*			trans	-179.7	101	141.3	18.3	0	0	0	0	111.5	T500	T500-T502 PolarHBondContact O-N 3.08Å
503	A	30.9	Very low	32.8	Very low	104 Å²	104	107.2 Å²	107.2	86%	0.86	71%	0.708	S	S	*	*			trans	-149.3	121.9	168.8	0	0	0	0	0	110.3
504	T	28.3	Very low	34.1	Very low	125 Å²	125	104.7 Å²	104.7	77%	0.767	69%	0.69	S	S	*	*			trans	-92.9	151.2	178.8	43	0	0	0	0	111.7	S506	T504-S506 WeakPolarHBondContact O-CB 3.45Å; T504-S506 PolarHBondContact O-N 3.42Å; T504-S506 PolarHBondContact O-OG 2.71Å
505	N	28.8	Very low	35.6	Very low	176 Å²	176	100.2 Å²	100.2	94%	0.941	66%	0.658	S	S	*	*	S	Bend	trans	-50.9	106.1	-176.9	-63.1	-26	0	0	0	112.6
506	S	28.9	Very low	37.7	Very low	85 Å²	85	96.9 Å²	96.9	59%	0.594	62%	0.621	S	S	*	*			trans	-151	3.7	-171.8	50	0	0	0	0	115.4	T504 S508 S509	T504-S506 WeakPolarHBondContact O-CB 3.45Å; T504-S506 PolarHBondContact O-N 3.42Å; T504-S506 PolarHBondContact O-OG 2.71Å; S506-S508 PolarHBondContact O-N 3.46Å; S506-S509 PolarHBondContact O-OG 2.86Å
507	S	31.3	Very low	39.4	Very low	105 Å²	105	94.5 Å²	94.5	73%	0.734	61%	0.608	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78	-3.4	-168.5	48.5	0	0	0	0	116.7
508	S	35.2	Very low	41.2	Very low	91 Å²	91	91.8 Å²	91.8	64%	0.636	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	-9.5	-172.9	55.8	0	0	0	0	115.6	S506	S506-S508 PolarHBondContact O-N 3.46Å
509	S	33	Very low	43.2	Very low	96 Å²	96	85.7 Å²	85.7	67%	0.671	55%	0.552	S	S	*	*	S	Bend	trans	-81.1	-34.7	-173	54.1	0	0	0	0	114.3	S506 F511	S506-S509 PolarHBondContact O-OG 2.86Å; S509-F511 VanDerWaalsContact C-N 3.33Å; S509-F511 PolarHBondContact O-N 3.17Å
510	G	34.6	Very low	45.5	Very low	58 Å²	58	84.1 Å²	84.1	60%	0.598	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-27.2	-175	0	0	0	0	0	115	F512	G510-F512 PolarHBondContact O-N 2.65Å
511	F	31.9	Very low	47.6	Very low	113 Å²	113	79.4 Å²	79.4	50%	0.496	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-26.1	-172.5	-78	-88.4	0	0	0	115	S509 S514	S509-F511 VanDerWaalsContact C-N 3.33Å; S509-F511 PolarHBondContact O-N 3.17Å; F511-S514 PolarHBondContact O-OG 3.23Å
512	F	36	Very low	49.8	Very low	57 Å²	57	75.7 Å²	75.7	25%	0.25	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-19.1	-171.3	-71.5	-79.7	0	0	0	114.3	G510 S514 F515 D844 N848	G510-F512 PolarHBondContact O-N 2.65Å; F512-S514 PolarHBondContact O-N 2.77Å; F512-F515 PolarHBondContact O-N 3.48Å; F512-D844 HydrophobicContact CB-CB 3.98Å; F512-N848 WeakPolarHBondContact CE1-ND2 3.3Å; F512-N848 WeakPolarHBondContact CZ-ND2 3.5Å
513	A	43.1	Very low	52.2	Low	57 Å²	57	68.9 Å²	68.9	47%	0.471	44%	0.443	S	S	.	.	H	α-helix	trans	-62.8	-25.9	174.1	0	0	0	0	0	112.8	A517	A513-A517 WeakPolarHBondContact O-CB 3.41Å; A513-A517 PolarHBondContact O-N 3.36Å
514	S	63.8	Low	54.8	Low	45 Å²	45	68.7 Å²	68.7	32%	0.315	43%	0.431	S	S	.	.	H	α-helix	trans	-68.3	-43.1	176.7	73.1	0	0	0	0	112.2	E480 F511 F512 N516 A517 N518	E480-S514 VanDerWaalsContact OE2-C 3.3Å; E480-S514 VanDerWaalsContact OE2-CB 3.29Å; E480-S514 WeakPolarHBondContact OE2-CB 3.42Å; E480-S514 PolarHBondContact OE2-OG 2.86Å; F511-S514 PolarHBondContact O-OG 3.23Å; F512-S514 PolarHBondContact O-N 2.77Å; S514-N516 PolarHBondContact O-N 2.94Å; S514-A517 PolarHBondContact O-N 3.05Å; S514-N518 VanDerWaalsContact O-CB 3.3Å; S514-N518 WeakPolarHBondContact O-CB 3.32Å; S514-N518 PolarHBondContact O-N 2.99Å; S514-N518 PolarHBondContact O-ND2 3.17Å
515	F	68.1	Low	57.5	Low	5 Å²	5	65.8 Å²	65.8	2%	0.022	41%	0.408	C	S	.	.	H	α-helix	trans	-62.2	-47.3	-171.2	173.3	-100	0	0	0	112.1	I473 H477 E480 F512 N518 L519 I838 L847	I473-F515 HydrophobicContact CG2-CE2 4.12Å; I473-F515 HydrophobicContact CG2-CZ 3.82Å; H477-F515 HydrophobicContact CB-CD2 4.28Å; H477-F515 HydrophobicContact CB-CE2 4.12Å; E480-F515 WeakPolarHBondContact OE2-CA 3.38Å; E480-F515 PolarHBondContact OE2-N 3.43Å; F512-F515 PolarHBondContact O-N 3.48Å; F515-N518 PolarHBondContact O-N 3.15Å; F515-L519 HydrophobicContact CE1-CD2 4.03Å; F515-L519 HydrophobicContact CZ-CD2 4.16Å; F515-L519 VanDerWaalsContact O-CB 3.24Å; F515-L519 WeakPolarHBondContact O-CB 3.45Å; F515-L519 PolarHBondContact O-N 3.04Å; F515-I838 HydrophobicContact CE1-CG2 4.3Å; F515-I838 HydrophobicContact CZ-CG2 4.35Å; F515-L847 HydrophobicContact CD1-CD1 3.85Å; F515-L847 HydrophobicContact CD1-CG 4.34Å; F515-L847 HydrophobicContact CD2-CD1 4Å; F515-L847 HydrophobicContact CE1-CD1 3.8Å; F515-L847 HydrophobicContact CE1-CD2 4.33Å; F515-L847 HydrophobicContact CE1-CG 4.1Å; F515-L847 HydrophobicContact CE2-CD1 3.94Å; F515-L847 HydrophobicContact CG-CD1 3.94Å; F515-L847 HydrophobicContact CZ-CD1 3.84Å; F515-L847 HydrophobicContact CZ-CD2 4.37Å; F515-L847 HydrophobicContact CZ-CG 4.43Å
516	N	71.2	Confident	60.5	Low	12 Å²	12	60.5 Å²	60.5	6%	0.064	38%	0.378	C	S	.	.	H	α-helix	trans	-66	-43.1	177	-86.7	-23.2	0	0	0	111.2	S514 N518 L519 Y520 D844	S514-N516 PolarHBondContact O-N 2.94Å; N516-N518 VanDerWaalsContact C-N 3.31Å; N516-N518 PolarHBondContact O-N 2.88Å; N516-L519 PolarHBondContact O-N 3.13Å; N516-Y520 HydrophobicContact CB-CD2 4.44Å; N516-Y520 HydrophobicContact CB-CE2 4.37Å; N516-Y520 WeakPolarHBondContact O-CD2 3.48Å; N516-Y520 PolarHBondContact O-N 2.91Å; N516-D844 WeakPolarHBondContact ND2-CA 3.39Å; N516-D844 PolarHBondContact ND2-OD1 3.12Å
517	A	69.4	Low	63.3	Low	64 Å²	64	56.5 Å²	56.5	53%	0.529	35%	0.35	S	S	.	.	H	α-helix	trans	-59.3	-40.7	175.6	0	0	0	0	0	112.6	A513 S514 G521	A513-A517 WeakPolarHBondContact O-CB 3.41Å; A513-A517 PolarHBondContact O-N 3.36Å; S514-A517 PolarHBondContact O-N 3.05Å; A517-G521 PolarHBondContact O-N 3.4Å
518	N	71.5	Confident	65.9	Low	73 Å²	73	51.8 Å²	51.8	39%	0.39	32%	0.318	S	S	.	.	H	α-helix	trans	-71.7	-39.6	176.9	-76.3	-46.3	0	0	0	112.2	E480 S514 F515 N516 G521 W522	E480-N518 WeakPolarHBondContact OE1-CB 3.35Å; E480-N518 PolarHBondContact OE1-ND2 3.05Å; E480-N518 PolarHBondContact OE2-ND2 3.26Å; S514-N518 VanDerWaalsContact O-CB 3.3Å; S514-N518 WeakPolarHBondContact O-CB 3.32Å; S514-N518 PolarHBondContact O-N 2.99Å; S514-N518 PolarHBondContact O-ND2 3.17Å; F515-N518 PolarHBondContact O-N 3.15Å; N516-N518 VanDerWaalsContact C-N 3.31Å; N516-N518 PolarHBondContact O-N 2.88Å; N518-G521 PolarHBondContact O-N 2.88Å; N518-W522 WeakPolarHBondContact O-CB 3.4Å; N518-W522 PolarHBondContact O-N 3.03Å
519	L	79.1	Confident	68.2	Low	4 Å²	4	54.2 Å²	54.2	2%	0.021	32%	0.317	C	S	.	.	H	α-helix	trans	-63	-45.4	174.8	179.3	62.2	0	0	0	111.6	I473 F515 N516 G523 I838	I473-L519 HydrophobicContact CD1-CD1 4.02Å; I473-L519 HydrophobicContact CG1-CD1 3.83Å; F515-L519 HydrophobicContact CE1-CD2 4.03Å; F515-L519 HydrophobicContact CZ-CD2 4.16Å; F515-L519 VanDerWaalsContact O-CB 3.24Å; F515-L519 WeakPolarHBondContact O-CB 3.45Å; F515-L519 PolarHBondContact O-N 3.04Å; N516-L519 PolarHBondContact O-N 3.13Å; L519-G523 WeakPolarHBondContact O-CA 3.4Å; L519-G523 PolarHBondContact O-N 3.39Å; L519-I838 HydrophobicContact CD2-CG2 4.1Å
520	Y	78.6	Confident	70.3	Confident	109 Å²	109	50 Å²	50	43%	0.427	29%	0.288	S	S	.	.	H	α-helix	trans	-68.7	-46.3	174.9	-74.1	-64.5	0	0	0	111.5	L436 N516 W522 G523 T524	L436-Y520 HydrophobicContact CD2-CD1 3.62Å; L436-Y520 HydrophobicContact CD2-CE1 3.67Å; N516-Y520 HydrophobicContact CB-CD2 4.44Å; N516-Y520 HydrophobicContact CB-CE2 4.37Å; N516-Y520 WeakPolarHBondContact O-CD2 3.48Å; N516-Y520 PolarHBondContact O-N 2.91Å; Y520-W522 PolarHBondContact O-N 3.09Å; Y520-G523 CarbonylContact O-C 3.47Å; Y520-G523 WeakPolarHBondContact O-CA 3.24Å; Y520-G523 PolarHBondContact O-N 2.73Å; Y520-T524 WeakPolarHBondContact O-CG2 3.35Å; Y520-T524 PolarHBondContact O-N 2.89Å
521	G	76.5	Confident	72.3	Confident	37 Å²	37	47.3 Å²	47.3	38%	0.381	26%	0.259	S	S	.	.	H	α-helix	trans	-59.1	-47.8	178.6	0	0	0	0	0	112.8	A517 N518 T524	A517-G521 PolarHBondContact O-N 3.4Å; N518-G521 PolarHBondContact O-N 2.88Å; G521-T524 PolarHBondContact O-N 3.17Å; G521-T524 PolarHBondContact O-OG1 3.21Å
522	W	76.5	Confident	74.3	Confident	27 Å²	27	45.8 Å²	45.8	10%	0.102	26%	0.256	C	S	.	.	H	α-helix	trans	-63.8	-40.3	170.2	177.8	93	0	0	0	111.9	T435 I439 M472 L476 N518 Y520 T524 K525 V530	T435-W522 HydrophobicContact CG2-CE3 4.29Å; T435-W522 HydrophobicContact CG2-CH2 3.47Å; T435-W522 VanDerWaalsContact CG2-CH2 3.47Å; T435-W522 HydrophobicContact CG2-CZ2 4.06Å; T435-W522 HydrophobicContact CG2-CZ3 3.59Å; I439-W522 HydrophobicContact CD1-CZ3 4.29Å; M472-W522 HydrophobicContact CB-CH2 3.6Å; M472-W522 HydrophobicContact CB-CZ2 3.51Å; M472-W522 HydrophobicContact CE-CH2 3.71Å; M472-W522 HydrophobicContact CE-CZ2 3.46Å; M472-W522 VanDerWaalsContact CE-CZ2 3.46Å; M472-W522 HydrophobicContact CG-CH2 4.15Å; M472-W522 HydrophobicContact CG-CZ2 3.87Å; M472-W522 HydrophobicContact SD-CH2 3.94Å; M472-W522 HydrophobicContact SD-CZ2 4.03Å; L476-W522 HydrophobicContact CD1-CB 4.01Å; L476-W522 HydrophobicContact CD1-CD2 3.76Å; L476-W522 HydrophobicContact CD1-CE3 4.02Å; L476-W522 HydrophobicContact CD1-CG 3.77Å; L476-W522 HydrophobicContact CD2-CB 4.4Å; L476-W522 HydrophobicContact CD2-CG 4.14Å; N518-W522 WeakPolarHBondContact O-CB 3.4Å; N518-W522 PolarHBondContact O-N 3.03Å; Y520-W522 PolarHBondContact O-N 3.09Å; W522-T524 PolarHBondContact O-N 3.17Å; W522-K525 VanDerWaalsContact O-CB 3.24Å; W522-K525 WeakPolarHBondContact O-CB 3.41Å; W522-K525 WeakPolarHBondContact O-CG 3.38Å; W522-K525 PolarHBondContact O-N 3.29Å; W522-V530 HydrophobicContact CZ2-CG1 3.87Å
523	G	80.7	Confident	75.8	Confident	3 Å²	3	49.1 Å²	49.1	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-60.5	-25.7	177.6	0	0	0	0	0	114.9	P434 T435 L436 L519 Y520 K525	P434-G523 CarbonylContact C-O 3.56Å; P434-G523 WeakPolarHBondContact CB-O 3.22Å; T435-G523 PolarHBondContact N-O 2.92Å; T435-G523 VanDerWaalsContact N-O 3.07Å; L436-G523 PolarHBondContact N-O 3.41Å; L519-G523 WeakPolarHBondContact O-CA 3.4Å; L519-G523 PolarHBondContact O-N 3.39Å; Y520-G523 CarbonylContact O-C 3.47Å; Y520-G523 WeakPolarHBondContact O-CA 3.24Å; Y520-G523 PolarHBondContact O-N 2.73Å; G523-K525 VanDerWaalsContact C-N 3.3Å
524	T	84.5	Confident	76.9	Confident	100 Å²	100	48.4 Å²	48.4	61%	0.613	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-24.5	171.2	70.6	0	0	0	0	113.2	Y520 G521 W522 Q526	Y520-T524 WeakPolarHBondContact O-CG2 3.35Å; Y520-T524 PolarHBondContact O-N 2.89Å; G521-T524 PolarHBondContact O-N 3.17Å; G521-T524 PolarHBondContact O-OG1 3.21Å; W522-T524 PolarHBondContact O-N 3.17Å; T524-Q526 PolarHBondContact O-N 3.42Å
525	K	85.9	Confident	76.9	Confident	64 Å²	64	49.6 Å²	49.6	28%	0.278	26%	0.256	S	S	.	.	S	Bend	trans	-66	136.6	-175.7	-61.8	-170.5	177.1	-165.4	0	110.6	T435 W522 G523 L527 V530 F687	T435-K525 WeakPolarHBondContact CB-O 3.28Å; T435-K525 PolarHBondContact N-O 3.01Å; T435-K525 PolarHBondContact OG1-O 3.43Å; W522-K525 VanDerWaalsContact O-CB 3.24Å; W522-K525 WeakPolarHBondContact O-CB 3.41Å; W522-K525 WeakPolarHBondContact O-CG 3.38Å; W522-K525 PolarHBondContact O-N 3.29Å; G523-K525 VanDerWaalsContact C-N 3.3Å; K525-L527 PolarHBondContact O-N 3Å; K525-V530 HydrophobicContact CB-CG2 3.9Å; K525-F687 VanDerWaalsContact NZ-CD2 3.32Å
526	Q	90.3	Very high	76	Confident	66 Å²	66	53.7 Å²	53.7	31%	0.308	29%	0.285	S	S	.	.	B	Isolated β-bridge	trans	-57.9	131.3	175.6	-65	174.8	-54.9	0	0	110.7	T524 G528 K529 V530	T524-Q526 PolarHBondContact O-N 3.42Å; Q526-G528 PolarHBondContact O-N 3.13Å; Q526-G528 VanDerWaalsContact O-N 3.15Å; Q526-K529 HydrophobicContact CB-CD 4.38Å; Q526-K529 HydrophobicContact CB-CG 4.38Å; Q526-K529 WeakPolarHBondContact O-CB 3.45Å; Q526-K529 PolarHBondContact O-N 3.34Å; Q526-V530 PolarHBondContact O-N 2.6Å
527	L	88.5	Confident	74.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-51.1	-41.9	-175.5	-172.3	66.4	0	0	0	112.4	L429 S431 L433 T435 A438 V452 F464 K525 K529 V530 F531	L429-L527 HydrophobicContact CB-CD2 4Å; L429-L527 HydrophobicContact CD1-CD2 4.15Å; S431-L527 PolarHBondContact O-N 3.36Å; L433-L527 WeakPolarHBondContact O-CB 3.35Å; L433-L527 PolarHBondContact O-N 3.39Å; T435-L527 HydrophobicContact CG2-CD1 4.04Å; A438-L527 HydrophobicContact CB-CD1 4.03Å; A438-L527 HydrophobicContact CB-CD2 3.87Å; A438-L527 HydrophobicContact CB-CG 4.42Å; V452-L527 HydrophobicContact CG1-CD2 4.05Å; V452-L527 HydrophobicContact CG2-CD2 3.75Å; V452-L527 HydrophobicContact CG2-CG 4.48Å; F464-L527 HydrophobicContact CD1-CD1 4.12Å; F464-L527 HydrophobicContact CD1-CD2 4.43Å; F464-L527 HydrophobicContact CD2-CD1 4.05Å; F464-L527 HydrophobicContact CE1-CD1 4.11Å; F464-L527 HydrophobicContact CE2-CD1 4.04Å; F464-L527 HydrophobicContact CG-CD1 4.08Å; F464-L527 HydrophobicContact CG-CD2 4.49Å; F464-L527 HydrophobicContact CZ-CD1 4.06Å; K525-L527 PolarHBondContact O-N 3Å; L527-K529 VanDerWaalsContact C-N 3.35Å; L527-K529 PolarHBondContact O-N 3.04Å; L527-V530 PolarHBondContact O-N 2.75Å; L527-F531 HydrophobicContact CD1-CD2 4Å; L527-F531 HydrophobicContact CD1-CE2 3.86Å; L527-F531 HydrophobicContact CG-CD2 3.9Å; L527-F531 HydrophobicContact CG-CE2 4Å; L527-F531 WeakPolarHBondContact O-CB 3.46Å; L527-F531 WeakPolarHBondContact O-CD2 3.14Å; L527-F531 PolarHBondContact O-N 3.07Å
528	G	84.9	Confident	73.1	Confident	7 Å²	7	62.8 Å²	62.8	7%	0.072	32%	0.323	C	S	.	.	H	α-helix	trans	-62.2	-34.7	177.9	0	0	0	0	0	114.3	S431 Q526 N532	S431-G528 PolarHBondContact O-N 2.79Å; Q526-G528 PolarHBondContact O-N 3.13Å; Q526-G528 VanDerWaalsContact O-N 3.15Å; G528-N532 WeakPolarHBondContact O-CB 3.37Å; G528-N532 VanDerWaalsContact O-CG 3.25Å; G528-N532 PolarHBondContact O-N 3.18Å
529	K	83.6	Confident	71.7	Confident	141 Å²	141	64.9 Å²	64.9	61%	0.613	34%	0.335	S	S	*	.	H	α-helix	trans	-69.6	-38.7	175.3	-69.5	179.5	174	165.3	0	110.9	Q526 L527 F533	Q526-K529 HydrophobicContact CB-CD 4.38Å; Q526-K529 HydrophobicContact CB-CG 4.38Å; Q526-K529 WeakPolarHBondContact O-CB 3.45Å; Q526-K529 PolarHBondContact O-N 3.34Å; L527-K529 VanDerWaalsContact C-N 3.35Å; L527-K529 PolarHBondContact O-N 3.04Å; K529-F533 PolarHBondContact O-N 3.34Å
530	V	78.6	Confident	69.9	Low	9 Å²	9	67.3 Å²	67.3	6%	0.055	34%	0.344	C	S	.	.	H	α-helix	trans	-72.5	-38.5	176.2	-164.7	0	0	0	0	111.1	T435 M472 W522 K525 Q526 L527 F533 M534	T435-V530 WeakPolarHBondContact OG1-CG2 3.46Å; M472-V530 HydrophobicContact CE-CB 4.26Å; M472-V530 HydrophobicContact CE-CG1 3.46Å; M472-V530 VanDerWaalsContact CE-CG1 3.46Å; W522-V530 HydrophobicContact CZ2-CG1 3.87Å; K525-V530 HydrophobicContact CB-CG2 3.9Å; Q526-V530 PolarHBondContact O-N 2.6Å; L527-V530 PolarHBondContact O-N 2.75Å; V530-F533 PolarHBondContact O-N 3.47Å; V530-M534 HydrophobicContact CG1-CE 4.46Å; V530-M534 WeakPolarHBondContact O-CG 3.34Å; V530-M534 PolarHBondContact O-N 3.23Å
531	F	74.9	Confident	68.1	Low	1 Å²	1	70.6 Å²	70.6	0%	0.004	36%	0.363	C	S	.	.	H	α-helix	trans	-57.4	-52.2	170.7	-98.8	-109.3	0	0	0	111.6	V452 M461 V463 F464 L468 L527 F533 M534 Y535	V452-F531 HydrophobicContact CB-CE1 4.46Å; V452-F531 HydrophobicContact CG2-CD2 4.49Å; V452-F531 HydrophobicContact CG2-CE1 3.95Å; V452-F531 HydrophobicContact CG2-CE2 3.89Å; V452-F531 HydrophobicContact CG2-CZ 3.61Å; M461-F531 HydrophobicContact CB-CD1 4.48Å; M461-F531 HydrophobicContact CE-CB 4.18Å; V463-F531 WeakPolarHBondContact O-CZ 3.4Å; F464-F531 HydrophobicContact CB-CE2 3.85Å; F464-F531 HydrophobicContact CB-CZ 3.68Å; F464-F531 AromaticContact CD2-CE2 3.58Å; F464-F531 HydrophobicContact CD2-CE2 3.58Å; F464-F531 AromaticContact CD2-CZ 3.97Å; F464-F531 HydrophobicContact CD2-CZ 3.97Å; F464-F531 HydrophobicContact CE2-CE2 4.44Å; F464-F531 HydrophobicContact CG-CE2 4.01Å; F464-F531 HydrophobicContact CG-CZ 4.27Å; L468-F531 HydrophobicContact CD2-CZ 4.11Å; L527-F531 HydrophobicContact CD1-CD2 4Å; L527-F531 HydrophobicContact CD1-CE2 3.86Å; L527-F531 HydrophobicContact CG-CD2 3.9Å; L527-F531 HydrophobicContact CG-CE2 4Å; L527-F531 WeakPolarHBondContact O-CB 3.46Å; L527-F531 WeakPolarHBondContact O-CD2 3.14Å; L527-F531 PolarHBondContact O-N 3.07Å; F531-F533 VanDerWaalsContact C-N 3.28Å; F531-F533 PolarHBondContact O-N 3.33Å; F531-M534 HydrophobicContact CD2-CE 3.94Å; F531-M534 HydrophobicContact CE2-CE 4.12Å; F531-M534 HydrophobicContact CG-CE 4.34Å; F531-M534 PolarHBondContact O-N 3.02Å; F531-M534 VanDerWaalsContact O-N 3.1Å; F531-Y535 HydrophobicContact CB-CD2 4.4Å; F531-Y535 AromaticContact CD1-CD2 3.7Å; F531-Y535 HydrophobicContact CD1-CD2 3.7Å; F531-Y535 AromaticContact CD1-CE2 3.44Å; F531-Y535 HydrophobicContact CD1-CE2 3.44Å; F531-Y535 VanDerWaalsContact CD1-CE2 3.44Å; F531-Y535 HydrophobicContact CE1-CD2 4.24Å; F531-Y535 AromaticContact CE1-CE2 3.5Å; F531-Y535 HydrophobicContact CE1-CE2 3.5Å; F531-Y535 HydrophobicContact CG-CD2 4.29Å; F531-Y535 HydrophobicContact CG-CE2 4.21Å; F531-Y535 HydrophobicContact CZ-CE2 4.31Å; F531-Y535 VanDerWaalsContact O-CD2 3.29Å; F531-Y535 WeakPolarHBondContact O-CD2 3.45Å; F531-Y535 PolarHBondContact O-N 3.32Å
532	N	74.1	Confident	66.8	Low	81 Å²	81	70.2 Å²	70.2	43%	0.433	35%	0.352	S	S	.	.	H	α-helix	trans	-59.5	-39.8	177.5	-71.7	-8.8	0	0	0	111.4	M461 G528 M534 S536	M461-N532 WeakPolarHBondContact CE-OD1 3.47Å; G528-N532 WeakPolarHBondContact O-CB 3.37Å; G528-N532 VanDerWaalsContact O-CG 3.25Å; G528-N532 PolarHBondContact O-N 3.18Å; N532-M534 PolarHBondContact O-N 3.18Å; N532-S536 WeakPolarHBondContact O-CB 3.27Å; N532-S536 PolarHBondContact O-N 3.4Å; N532-S536 PolarHBondContact O-OG 2.67Å
533	F	69.1	Low	65.7	Low	127 Å²	127	73.8 Å²	73.8	56%	0.557	37%	0.369	S	S	*	.	H	α-helix	trans	-61.9	-39.1	174.8	-178.3	-99.2	0	0	0	113.5	K529 V530 F531	K529-F533 PolarHBondContact O-N 3.34Å; V530-F533 PolarHBondContact O-N 3.47Å; F531-F533 VanDerWaalsContact C-N 3.28Å; F531-F533 PolarHBondContact O-N 3.33Å
534	M	65.6	Low	64.4	Low	42 Å²	42	77.7 Å²	77.7	21%	0.207	40%	0.395	C	S	.	.	H	α-helix	trans	-74.2	-42.3	178.1	-67.5	-176.7	-59.3	0	0	113.1	L468 M472 V530 F531 N532	L468-M534 HydrophobicContact CD1-CE 4.37Å; L468-M534 HydrophobicContact CD1-SD 3.88Å; L468-M534 HydrophobicContact CD2-CE 4.03Å; L468-M534 HydrophobicContact CG-CE 4.33Å; L468-M534 HydrophobicContact CG-SD 4.37Å; M472-M534 HydrophobicContact CE-CE 3.43Å; M472-M534 VanDerWaalsContact CE-CE 3.43Å; M472-M534 HydrophobicContact CE-SD 3.6Å; M472-M534 HydrophobicContact CG-SD 3.68Å; M472-M534 HydrophobicContact SD-CE 4.15Å; M472-M534 HydrophobicContact SD-SD 3.87Å; V530-M534 HydrophobicContact CG1-CE 4.46Å; V530-M534 WeakPolarHBondContact O-CG 3.34Å; V530-M534 PolarHBondContact O-N 3.23Å; F531-M534 HydrophobicContact CD2-CE 3.94Å; F531-M534 HydrophobicContact CE2-CE 4.12Å; F531-M534 HydrophobicContact CG-CE 4.34Å; F531-M534 PolarHBondContact O-N 3.02Å; F531-M534 VanDerWaalsContact O-N 3.1Å; N532-M534 PolarHBondContact O-N 3.18Å
535	Y	63.8	Low	63.5	Low	69 Å²	69	75.7 Å²	75.7	27%	0.271	38%	0.381	S	S	.	.	H	α-helix	trans	-94.2	-20.1	-170.8	-70.4	-74.7	0	0	0	114.6	F531 R537 L542	F531-Y535 HydrophobicContact CB-CD2 4.4Å; F531-Y535 AromaticContact CD1-CD2 3.7Å; F531-Y535 HydrophobicContact CD1-CD2 3.7Å; F531-Y535 AromaticContact CD1-CE2 3.44Å; F531-Y535 HydrophobicContact CD1-CE2 3.44Å; F531-Y535 VanDerWaalsContact CD1-CE2 3.44Å; F531-Y535 HydrophobicContact CE1-CD2 4.24Å; F531-Y535 AromaticContact CE1-CE2 3.5Å; F531-Y535 HydrophobicContact CE1-CE2 3.5Å; F531-Y535 HydrophobicContact CG-CD2 4.29Å; F531-Y535 HydrophobicContact CG-CE2 4.21Å; F531-Y535 HydrophobicContact CZ-CE2 4.31Å; F531-Y535 VanDerWaalsContact O-CD2 3.29Å; F531-Y535 WeakPolarHBondContact O-CD2 3.45Å; F531-Y535 PolarHBondContact O-N 3.32Å; Y535-R537 PolarHBondContact O-N 3.29Å; Y535-R537 VanDerWaalsContact O-N 3.14Å; Y535-L542 HydrophobicContact CD1-CD1 3.74Å; Y535-L542 HydrophobicContact CE1-CD1 3.79Å
536	S	48.4	Very low	63.2	Low	91 Å²	91	73.8 Å²	73.8	64%	0.636	37%	0.374	S	S	*	.			trans	-78.3	15.9	178.1	-62.6	0	0	0	0	114.7	N532	N532-S536 WeakPolarHBondContact O-CB 3.27Å; N532-S536 PolarHBondContact O-N 3.4Å; N532-S536 PolarHBondContact O-OG 2.67Å
537	R	45.9	Very low	63	Low	127 Å²	127	72.8 Å²	72.8	48%	0.479	37%	0.368	S	S	.	.	S	Bend	trans	-70.6	129.5	165.3	-76.6	-177.4	166.2	163.6	-3.1	108.3	Y535 D539	Y535-R537 PolarHBondContact O-N 3.29Å; Y535-R537 VanDerWaalsContact O-N 3.14Å; R537-D539 PolarHBondContact O-N 2.96Å
538	P	35.4	Very low	63	Low	140 Å²	140	72.8 Å²	72.8	91%	0.909	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	6.4	-151.3	26.6	-37.4	0	0	0	117
539	D	41	Very low	63.3	Low	118 Å²	118	78 Å²	78	63%	0.631	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	7.6	-163.1	-140.5	16.9	0	0	0	113.3	R537 T701	R537-D539 PolarHBondContact O-N 2.96Å; D539-T701 HydrophobicContact CB-CG2 4.27Å
540	R	40.9	Very low	63.6	Low	54 Å²	54	71.6 Å²	71.6	20%	0.204	36%	0.36	C	S	.	.			trans	-147.6	118.8	-168.6	-68.8	-162.6	-178.4	-162.1	8.4	117.2	L542 T701 Y704 T705	R540-L542 VanDerWaalsContact C-N 3.28Å; R540-L542 HydrophobicContact CB-CD1 4.21Å; R540-L542 HydrophobicContact CB-CG 4.09Å; R540-L542 VanDerWaalsContact CD-CD1 3.46Å; R540-L542 HydrophobicContact CG-CD1 4.5Å; R540-L542 PolarHBondContact O-N 3.27Å; R540-T701 HydrophobicContact CG-CG2 4.27Å; R540-T701 VanDerWaalsContact NE-CG2 3.31Å; R540-T701 PolarHBondContact NH2-O 3.47Å; R540-Y704 VanDerWaalsContact NH1-C 3.27Å; R540-Y704 PolarHBondContact NH1-O 2.85Å; R540-Y704 VanDerWaalsContact NH2-C 3.26Å; R540-T705 PolarHBondContact NH2-OG1 3.39Å
541	Q	40.6	Very low	64.1	Low	178 Å²	178	79 Å²	79	83%	0.832	39%	0.393	S	S	*	.			trans	-88.9	47.1	164.9	-63.9	-175.7	-12.1	0	0	112.4	F543	Q541-F543 PolarHBondContact O-N 3.38Å
542	L	49.8	Very low	64.8	Low	30 Å²	30	81.8 Å²	81.8	16%	0.157	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-56.6	-26.3	-169.4	-96.4	166.5	0	0	0	116.1	Y535 R540 S544 D545	Y535-L542 HydrophobicContact CD1-CD1 3.74Å; Y535-L542 HydrophobicContact CE1-CD1 3.79Å; R540-L542 VanDerWaalsContact C-N 3.28Å; R540-L542 HydrophobicContact CB-CD1 4.21Å; R540-L542 HydrophobicContact CB-CG 4.09Å; R540-L542 VanDerWaalsContact CD-CD1 3.46Å; R540-L542 HydrophobicContact CG-CD1 4.5Å; R540-L542 PolarHBondContact O-N 3.27Å; L542-S544 VanDerWaalsContact C-N 3.28Å; L542-S544 PolarHBondContact O-N 3.15Å; L542-D545 PolarHBondContact O-N 3.45Å
543	F	52.6	Low	65.5	Low	102 Å²	102	79 Å²	79	45%	0.447	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-58.2	-37	-170.1	-57.7	-84.5	0	0	0	113	M461 Q541 D545 F547	M461-F543 VanDerWaalsContact O-CE1 3.29Å; M461-F543 WeakPolarHBondContact O-CE1 3.44Å; Q541-F543 PolarHBondContact O-N 3.38Å; F543-D545 PolarHBondContact O-N 3.31Å; F543-F547 WeakPolarHBondContact O-CD2 3.43Å; F543-F547 WeakPolarHBondContact O-CE2 3.31Å
544	S	53.8	Low	66.6	Low	85 Å²	85	73 Å²	73	59%	0.594	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-72.2	-24.2	-173.8	-56.3	0	0	0	0	115.1	L542 R560	L542-S544 VanDerWaalsContact C-N 3.28Å; L542-S544 PolarHBondContact O-N 3.15Å; S544-R560 PolarHBondContact O-NH2 3.04Å
545	D	65.7	Low	67.6	Low	58 Å²	58	72.7 Å²	72.7	31%	0.31	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-23.8	-173.5	-73.9	-48.2	0	0	0	113.8	L542 F543 F547 R560 H564 L711	L542-D545 PolarHBondContact O-N 3.45Å; F543-D545 PolarHBondContact O-N 3.31Å; D545-F547 VanDerWaalsContact C-N 3.26Å; D545-F547 PolarHBondContact O-N 2.59Å; D545-R560 PolarHBondContact O-NH1 2.93Å; D545-R560 IonicContact OD1-CZ 3.67Å; D545-R560 VanDerWaalsContact OD1-CZ 3.29Å; D545-R560 IonicContact OD1-NE 3Å; D545-R560 PolarHBondContact OD1-NE 3.38Å; D545-R560 IonicContact OD1-NH2 3.39Å; D545-R560 PolarHBondContact OD1-NH2 3.18Å; D545-H564 WeakPolarHBondContact CB-NE2 3.35Å; D545-H564 IonicContact OD2-CE1 2.87Å; D545-L711 WeakPolarHBondContact O-CD2 3.28Å
546	L	79.5	Confident	68.6	Low	24 Å²	24	75.2 Å²	75.2	13%	0.126	38%	0.375	C	S	.	.	S	Bend	trans	-67.4	-23.4	179.9	-171.4	64.3	0	0	0	113.6	V463 V708 Y710 L711 I712	V463-L546 HydrophobicContact CG2-CD1 4.17Å; V463-L546 HydrophobicContact CG2-CD2 4.21Å; V463-L546 HydrophobicContact CG2-CG 4.43Å; L546-V708 HydrophobicContact CD1-CG1 3.76Å; L546-Y710 VanDerWaalsContact CD1-O 3.26Å; L546-Y710 WeakPolarHBondContact CD1-O 3.44Å; L546-L711 WeakPolarHBondContact O-CA 3.33Å; L546-I712 HydrophobicContact CD2-CD1 4.07Å; L546-I712 HydrophobicContact CG-CD1 4.23Å; L546-I712 HydrophobicContact CG-CG1 4.38Å; L546-I712 PolarHBondContact O-N 2.98Å
547	F	85.9	Confident	70.4	Confident	44 Å²	44	70.9 Å²	70.9	19%	0.193	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	141.1	-178.1	-55.4	-63.7	0	0	0	112.4	Y460 F543 D545 R560 I712 I714	Y460-F547 HydrophobicContact CD2-CE1 4.5Å; Y460-F547 HydrophobicContact CG-CE1 4.4Å; F543-F547 WeakPolarHBondContact O-CD2 3.43Å; F543-F547 WeakPolarHBondContact O-CE2 3.31Å; D545-F547 VanDerWaalsContact C-N 3.26Å; D545-F547 PolarHBondContact O-N 2.59Å; F547-R560 PolarHBondContact O-NH1 2.75Å; F547-I712 WeakPolarHBondContact CA-O 3.4Å; F547-I712 HydrophobicContact CD1-CB 3.96Å; F547-I712 HydrophobicContact CD1-CD1 4.11Å; F547-I712 HydrophobicContact CD1-CG2 4.41Å; F547-I712 HydrophobicContact CE1-CB 4.33Å; F547-I712 HydrophobicContact CE1-CD1 3.63Å; F547-I714 HydrophobicContact CD1-CD1 3.29Å; F547-I714 HydrophobicContact CD1-CG1 3.97Å; F547-I714 HydrophobicContact CE1-CD1 3.51Å; F547-I714 HydrophobicContact CG-CD1 4.17Å
548	V	89	Confident	72.3	Confident	1 Å²	1	64.9 Å²	64.9	1%	0.006	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	152.1	168	-68.6	0	0	0	0	110.6	Y552 L711 I712 V713 I714	V548-Y552 HydrophobicContact CB-CD1 4.03Å; V548-Y552 HydrophobicContact CB-CG 4.2Å; V548-Y552 HydrophobicContact CG1-CD1 3.67Å; V548-Y552 HydrophobicContact CG1-CE1 3.8Å; V548-Y552 HydrophobicContact CG1-CG 4.22Å; V548-L711 HydrophobicContact CG1-CD1 3.9Å; V548-L711 HydrophobicContact CG2-CB 4.12Å; V548-I712 PolarHBondContact N-O 2.83Å; V548-V713 HydrophobicContact CG2-CG2 4.05Å; V548-V713 CarbonylContact O-C 3.49Å; V548-V713 VanDerWaalsContact O-CA 3.26Å; V548-V713 WeakPolarHBondContact O-CA 3.36Å; V548-I714 PolarHBondContact O-N 3.01Å
549	Y	90.9	Very high	74.5	Confident	116 Å²	116	63.2 Å²	63.2	46%	0.455	30%	0.298	S	S	.	.			trans	-92.4	157.7	178.7	-56.9	-65.6	0	0	0	111.8	H551 Y552 I714 D716	Y549-H551 PolarHBondContact O-N 3.39Å; Y549-Y552 WeakPolarHBondContact O-CB 3.29Å; Y549-Y552 PolarHBondContact O-N 2.95Å; Y549-I714 WeakPolarHBondContact CD1-O 3.37Å; Y549-D716 HydrophobicContact CD1-CB 3.74Å; Y549-D716 HydrophobicContact CE1-CB 3.97Å; Y549-D716 HydrophobicContact CG-CB 4.5Å
550	P	89.7	Confident	76.4	Confident	7 Å²	7	60.7 Å²	60.7	5%	0.045	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46	-44.6	174.2	-35.4	36.6	0	0	0	114.5	T415 C416 Y417 Y552 V713 I714 L722	T415-P550 WeakPolarHBondContact CB-O 3.3Å; T415-P550 PolarHBondContact OG1-O 2.76Å; C416-P550 PolarHBondContact N-O 2.9Å; Y417-P550 HydrophobicContact CD2-CB 4.06Å; Y417-P550 HydrophobicContact CG-CB 4.44Å; Y417-P550 PolarHBondContact N-O 2.89Å; P550-Y552 PolarHBondContact O-N 3.41Å; P550-V713 HydrophobicContact CG-CG1 4.36Å; P550-I714 WeakPolarHBondContact CD-O 3.24Å; P550-L722 HydrophobicContact CG-CD1 3.52Å
551	H	90.1	Very high	78.2	Confident	163 Å²	163	58.6 Å²	58.6	76%	0.755	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	2	-177.4	-51	-56	0	0	0	113.6	Y549 C553	Y549-H551 PolarHBondContact O-N 3.39Å; H551-C553 PolarHBondContact O-N 3.06Å
552	Y	89	Confident	79.9	Confident	60 Å²	60	51.5 Å²	51.5	24%	0.235	24%	0.239	C	C	.	.	S	Bend	trans	-70.6	130.2	178	-160.2	-103.2	0	0	0	109.8	T415 C416 V548 Y549 P550 K556 A557	T415-Y552 CarbonylContact C-O 3.5Å; T415-Y552 WeakPolarHBondContact CA-O 3.27Å; C416-Y552 PolarHBondContact N-O 3.43Å; C416-Y552 PolarHBondContact SG-O 2.77Å; C416-Y552 VanDerWaalsContact SG-O 3.36Å; V548-Y552 HydrophobicContact CB-CD1 4.03Å; V548-Y552 HydrophobicContact CB-CG 4.2Å; V548-Y552 HydrophobicContact CG1-CD1 3.67Å; V548-Y552 HydrophobicContact CG1-CE1 3.8Å; V548-Y552 HydrophobicContact CG1-CG 4.22Å; Y549-Y552 WeakPolarHBondContact O-CB 3.29Å; Y549-Y552 PolarHBondContact O-N 2.95Å; P550-Y552 PolarHBondContact O-N 3.41Å; Y552-K556 HydrophobicContact CD1-CB 4.07Å; Y552-K556 HydrophobicContact CE1-CB 3.41Å; Y552-K556 VanDerWaalsContact CE1-CB 3.41Å; Y552-K556 HydrophobicContact CE2-CD 4.47Å; Y552-A557 HydrophobicContact CD1-CB 4.1Å; Y552-A557 HydrophobicContact CE1-CB 4.36Å
553	C	89.5	Confident	80.5	Confident	23 Å²	23	54 Å²	54	16%	0.155	25%	0.25	C	C	.	.	B	Isolated β-bridge	trans	-62	134.3	-177.9	165.2	0	0	0	0	111.8	F411 R412 H551 Q555 K556 A557	F411-C553 PolarHBondContact O-SG 3.22Å; R412-C553 PolarHBondContact O-SG 2.76Å; H551-C553 PolarHBondContact O-N 3.06Å; C553-Q555 VanDerWaalsContact C-N 3.29Å; C553-Q555 PolarHBondContact O-N 2.85Å; C553-K556 HydrophobicContact CB-CB 4.38Å; C553-K556 HydrophobicContact CB-CD 4.28Å; C553-K556 HydrophobicContact CB-CG 4.1Å; C553-K556 WeakPolarHBondContact O-CB 3.36Å; C553-K556 PolarHBondContact O-N 2.89Å; C553-A557 PolarHBondContact O-N 3.09Å
554	L	90.7	Very high	80.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-35.5	-178.3	-67.2	-171.9	0	0	0	113.1	F411 S414 T415 V419 K556 A557 L558 L730 Y733	F411-L554 HydrophobicContact CB-CB 4.35Å; F411-L554 HydrophobicContact CD1-CB 3.64Å; F411-L554 HydrophobicContact CD1-CD1 4.38Å; F411-L554 HydrophobicContact CE1-CB 4.24Å; F411-L554 HydrophobicContact CE1-CD1 4.38Å; F411-L554 HydrophobicContact CG-CB 4.21Å; F411-L554 PolarHBondContact O-N 2.99Å; S414-L554 VanDerWaalsContact CB-CD1 3.48Å; S414-L554 PolarHBondContact O-N 3.33Å; T415-L554 VanDerWaalsContact C-CD2 3.43Å; T415-L554 VanDerWaalsContact O-CD2 3.31Å; T415-L554 WeakPolarHBondContact O-CD2 3.49Å; V419-L554 HydrophobicContact CB-CD2 4.49Å; V419-L554 HydrophobicContact CG2-CD1 3.39Å; V419-L554 HydrophobicContact CG2-CD2 3.56Å; V419-L554 HydrophobicContact CG2-CG 4.08Å; L554-K556 VanDerWaalsContact C-N 3.29Å; L554-K556 PolarHBondContact O-N 3.43Å; L554-A557 PolarHBondContact O-N 3.4Å; L554-L558 VanDerWaalsContact O-CB 3.25Å; L554-L558 WeakPolarHBondContact O-CB 3.29Å; L554-L558 PolarHBondContact O-N 3.44Å; L554-L730 HydrophobicContact CB-CD2 4.49Å; L554-L730 HydrophobicContact CD1-CD2 4.22Å; L554-L730 HydrophobicContact CD2-CD2 3.85Å; L554-L730 HydrophobicContact CG-CD2 4.42Å; L554-Y733 HydrophobicContact CD1-CD1 3.79Å; L554-Y733 HydrophobicContact CD1-CE1 3.73Å; L554-Y733 HydrophobicContact CD1-CG 4.47Å
555	Q	86.6	Confident	79.6	Confident	36 Å²	36	52.8 Å²	52.8	17%	0.168	24%	0.24	C	C	.	.	H	α-helix	trans	-58.4	-44	174.5	-167.3	-171	4.8	0	0	110.6	T408 F411 C553 L558 Y559	T408-Q555 VanDerWaalsContact CG2-NE2 3.34Å; F411-Q555 HydrophobicContact CB-CB 4.14Å; F411-Q555 PolarHBondContact O-N 2.86Å; C553-Q555 VanDerWaalsContact C-N 3.29Å; C553-Q555 PolarHBondContact O-N 2.85Å; Q555-L558 PolarHBondContact O-N 3Å; Q555-Y559 HydrophobicContact CG-CD2 4.16Å; Q555-Y559 HydrophobicContact CG-CE2 3.89Å; Q555-Y559 WeakPolarHBondContact O-CD2 3.35Å; Q555-Y559 PolarHBondContact O-N 2.93Å
556	K	85.2	Confident	78	Confident	123 Å²	123	58 Å²	58	54%	0.535	26%	0.262	S	S	.	.	H	α-helix	trans	-67.8	-39.3	177	-62.9	-172.7	178.4	-175.1	0	112.1	Y552 C553 L554 L558 Y559 R560	Y552-K556 HydrophobicContact CD1-CB 4.07Å; Y552-K556 HydrophobicContact CE1-CB 3.41Å; Y552-K556 VanDerWaalsContact CE1-CB 3.41Å; Y552-K556 HydrophobicContact CE2-CD 4.47Å; C553-K556 HydrophobicContact CB-CB 4.38Å; C553-K556 HydrophobicContact CB-CD 4.28Å; C553-K556 HydrophobicContact CB-CG 4.1Å; C553-K556 WeakPolarHBondContact O-CB 3.36Å; C553-K556 PolarHBondContact O-N 2.89Å; L554-K556 VanDerWaalsContact C-N 3.29Å; L554-K556 PolarHBondContact O-N 3.43Å; K556-L558 VanDerWaalsContact C-N 3.35Å; K556-Y559 PolarHBondContact O-N 2.9Å; K556-R560 PolarHBondContact O-N 2.73Å
557	A	86.2	Confident	75.4	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.3	-41.4	175.7	0	0	0	0	0	111.9	Y552 C553 L554 R560 L561 L711 L725	Y552-A557 HydrophobicContact CD1-CB 4.1Å; Y552-A557 HydrophobicContact CE1-CB 4.36Å; C553-A557 PolarHBondContact O-N 3.09Å; L554-A557 PolarHBondContact O-N 3.4Å; A557-R560 PolarHBondContact O-N 2.9Å; A557-L561 WeakPolarHBondContact O-CG 3.44Å; A557-L561 PolarHBondContact O-N 2.99Å; A557-L711 HydrophobicContact CB-CD1 4.28Å; A557-L711 WeakPolarHBondContact O-CD1 3.27Å; A557-L725 HydrophobicContact CB-CD2 3.69Å
558	L	86.3	Confident	72.5	Confident	0 Å²	0	69.6 Å²	69.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-66.2	-39.8	176.6	-173.6	156.7	0	0	0	111.7	F411 L554 Q555 K556 L561 F562 L730 L923 I927 L928	F411-L558 HydrophobicContact CD1-CD1 3.87Å; F411-L558 HydrophobicContact CE1-CD1 3.75Å; L554-L558 VanDerWaalsContact O-CB 3.25Å; L554-L558 WeakPolarHBondContact O-CB 3.29Å; L554-L558 PolarHBondContact O-N 3.44Å; Q555-L558 PolarHBondContact O-N 3Å; K556-L558 VanDerWaalsContact C-N 3.35Å; L558-L561 PolarHBondContact O-N 3.47Å; L558-F562 HydrophobicContact CD1-CE2 4.21Å; L558-F562 HydrophobicContact CD2-CD2 3.48Å; L558-F562 VanDerWaalsContact CD2-CD2 3.48Å; L558-F562 HydrophobicContact CD2-CE2 3.5Å; L558-F562 HydrophobicContact CD2-CG 4.42Å; L558-F562 HydrophobicContact CD2-CZ 4.43Å; L558-F562 HydrophobicContact CG-CD2 3.97Å; L558-F562 HydrophobicContact CG-CE2 3.61Å; L558-F562 HydrophobicContact CG-CZ 4.08Å; L558-F562 WeakPolarHBondContact O-CB 3.48Å; L558-F562 WeakPolarHBondContact O-CG 3.44Å; L558-F562 PolarHBondContact O-N 3.19Å; L558-F562 VanDerWaalsContact O-N 3.15Å; L558-L730 HydrophobicContact CB-CD1 4.25Å; L558-L730 HydrophobicContact CD1-CD1 4.45Å; L558-L730 HydrophobicContact CG-CD1 4.5Å; L558-L923 HydrophobicContact CD1-CB 4.2Å; L558-L923 HydrophobicContact CD1-CD2 4.28Å; L558-I927 HydrophobicContact CD1-CB 4.4Å; L558-I927 HydrophobicContact CD1-CD1 3.58Å; L558-I927 HydrophobicContact CD1-CG2 4.3Å; L558-L928 HydrophobicContact CD2-CD1 3.63Å; L558-L928 HydrophobicContact CD2-CD2 3.74Å; L558-L928 HydrophobicContact CD2-CG 3.59Å
559	Y	82.5	Confident	69.5	Low	106 Å²	106	78.4 Å²	78.4	42%	0.416	36%	0.356	S	S	.	.	H	α-helix	trans	-59.2	-46.1	169.7	-84.4	-67.4	0	0	0	112.1	Q555 K556 L561 F562 H563 L928	Q555-Y559 HydrophobicContact CG-CD2 4.16Å; Q555-Y559 HydrophobicContact CG-CE2 3.89Å; Q555-Y559 WeakPolarHBondContact O-CD2 3.35Å; Q555-Y559 PolarHBondContact O-N 2.93Å; K556-Y559 PolarHBondContact O-N 2.9Å; Y559-L561 PolarHBondContact O-N 2.95Å; Y559-F562 PolarHBondContact O-N 3.22Å; Y559-H563 AromaticContact CD1-CD2 3.88Å; Y559-H563 PolarHBondContact O-N 3.29Å; Y559-L928 HydrophobicContact CD1-CD1 4.15Å; Y559-L928 HydrophobicContact CD1-CD2 4.18Å; Y559-L928 HydrophobicContact CD2-CD2 4.34Å; Y559-L928 HydrophobicContact CE1-CD1 4.03Å; Y559-L928 HydrophobicContact CE1-CD2 3.67Å; Y559-L928 HydrophobicContact CE1-CG 4.46Å; Y559-L928 HydrophobicContact CE2-CD2 3.86Å; Y559-L928 HydrophobicContact CG-CD2 4.49Å; Y559-L928 VanDerWaalsContact CZ-CD2 3.48Å
560	R	80.4	Confident	66.5	Low	65 Å²	65	80.4 Å²	80.4	25%	0.245	37%	0.37	C	S	.	.	H	α-helix	trans	-60	-43	176.1	-85.8	-171.3	158.8	-169.6	-7.4	113	S544 D545 F547 K556 A557 F562 L711	S544-R560 PolarHBondContact O-NH2 3.04Å; D545-R560 PolarHBondContact O-NH1 2.93Å; D545-R560 IonicContact OD1-CZ 3.67Å; D545-R560 VanDerWaalsContact OD1-CZ 3.29Å; D545-R560 IonicContact OD1-NE 3Å; D545-R560 PolarHBondContact OD1-NE 3.38Å; D545-R560 IonicContact OD1-NH2 3.39Å; D545-R560 PolarHBondContact OD1-NH2 3.18Å; F547-R560 PolarHBondContact O-NH1 2.75Å; K556-R560 PolarHBondContact O-N 2.73Å; A557-R560 PolarHBondContact O-N 2.9Å; R560-F562 VanDerWaalsContact C-N 3.28Å; R560-F562 PolarHBondContact O-N 2.86Å; R560-L711 HydrophobicContact CB-CD1 3.97Å
561	L	79.2	Confident	63.5	Low	10 Å²	10	88 Å²	88	5%	0.052	41%	0.405	C	S	.	.	H	α-helix	trans	-63.1	-29.6	176.4	-76.9	165.9	0	0	0	113.6	A557 L558 Y559 V708 L711 L730	A557-L561 WeakPolarHBondContact O-CG 3.44Å; A557-L561 PolarHBondContact O-N 2.99Å; L558-L561 PolarHBondContact O-N 3.47Å; Y559-L561 PolarHBondContact O-N 2.95Å; L561-V708 WeakPolarHBondContact CD2-O 3.41Å; L561-L711 HydrophobicContact CD1-CD1 4.42Å; L561-L711 HydrophobicContact CD2-CD1 4.2Å; L561-L711 HydrophobicContact CD2-CG 3.79Å; L561-L711 HydrophobicContact CG-CD1 3.77Å; L561-L711 HydrophobicContact CG-CG 3.96Å; L561-L730 HydrophobicContact CD1-CD1 3.57Å
562	F	74.6	Confident	60.3	Low	28 Å²	28	90.8 Å²	90.8	12%	0.123	41%	0.408	C	S	.	.	H	α-helix	trans	-110.1	-27.6	-167.5	-65	-5.5	0	0	0	115	L558 Y559 R560 A727 K920 L923 H924 L928	L558-F562 HydrophobicContact CD1-CE2 4.21Å; L558-F562 HydrophobicContact CD2-CD2 3.48Å; L558-F562 VanDerWaalsContact CD2-CD2 3.48Å; L558-F562 HydrophobicContact CD2-CE2 3.5Å; L558-F562 HydrophobicContact CD2-CG 4.42Å; L558-F562 HydrophobicContact CD2-CZ 4.43Å; L558-F562 HydrophobicContact CG-CD2 3.97Å; L558-F562 HydrophobicContact CG-CE2 3.61Å; L558-F562 HydrophobicContact CG-CZ 4.08Å; L558-F562 WeakPolarHBondContact O-CB 3.48Å; L558-F562 WeakPolarHBondContact O-CG 3.44Å; L558-F562 PolarHBondContact O-N 3.19Å; L558-F562 VanDerWaalsContact O-N 3.15Å; Y559-F562 PolarHBondContact O-N 3.22Å; R560-F562 VanDerWaalsContact C-N 3.28Å; R560-F562 PolarHBondContact O-N 2.86Å; F562-A727 HydrophobicContact CE1-CB 4.41Å; F562-K920 HydrophobicContact CD1-CD 4.11Å; F562-K920 HydrophobicContact CD1-CG 3.87Å; F562-K920 HydrophobicContact CE1-CB 4.17Å; F562-K920 HydrophobicContact CE1-CD 4.19Å; F562-K920 HydrophobicContact CE1-CG 3.65Å; F562-K920 HydrophobicContact CG-CG 4.48Å; F562-K920 HydrophobicContact CZ-CB 4.35Å; F562-K920 HydrophobicContact CZ-CG 4.04Å; F562-L923 HydrophobicContact CE2-CB 3.78Å; F562-L923 HydrophobicContact CZ-CB 3.78Å; F562-L923 HydrophobicContact CZ-CD1 3.99Å; F562-H924 HydrophobicContact CD2-CB 4.21Å; F562-H924 HydrophobicContact CE2-CB 4.17Å; F562-L928 HydrophobicContact CD2-CD1 4.14Å
563	H	64	Low	57.4	Low	83 Å²	83	92.2 Å²	92.2	38%	0.384	43%	0.425	S	S	.	.			trans	-124.9	37.6	-167	-72.4	-80.8	0	0	0	114.1	Y559 N565 H566 H924 L928	Y559-H563 AromaticContact CD1-CD2 3.88Å; Y559-H563 PolarHBondContact O-N 3.29Å; H563-N565 PolarHBondContact O-N 3.36Å; H563-H566 PolarHBondContact O-N 3.25Å; H563-H924 AromaticContact CE1-NE2 3.65Å; H563-H924 AromaticContact NE2-CD2 3.78Å; H563-H924 AromaticContact NE2-NE2 3.33Å; H563-H924 PolarHBondContact NE2-NE2 3.43Å; H563-L928 WeakPolarHBondContact NE2-CD1 3.45Å
564	H	52.4	Low	54.2	Low	45 Å²	45	101.7 Å²	101.7	21%	0.208	46%	0.459	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	19.5	-172.7	-147.5	-48.3	0	0	0	116.2	D545	D545-H564 WeakPolarHBondContact CB-NE2 3.35Å; D545-H564 IonicContact OD2-CE1 2.87Å
565	N	33.9	Very low	51.3	Low	116 Å²	116	109.7 Å²	109.7	62%	0.62	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-150.9	11.2	-175.5	-125.4	10.1	0	0	0	115.4	H563 T705	H563-N565 PolarHBondContact O-N 3.36Å; N565-T705 HydrophobicContact CB-CG2 4.4Å
566	H	32.5	Very low	48.4	Very low	167 Å²	167	115.6 Å²	115.6	77%	0.773	52%	0.524	S	S	*	.			trans	-132.4	58.5	179.1	-89.7	16.7	0	0	0	112.6	H563	H563-H566 PolarHBondContact O-N 3.25Å
567	Y	24.5	Very low	45.8	Very low	227 Å²	227	114.4 Å²	114.4	89%	0.89	53%	0.531	S	S	*	.			trans	-78.6	122.6	137	-99.3	-85	0	0	0	107
568	P	25.1	Very low	43.1	Very low	86 Å²	86	122.2 Å²	122.2	56%	0.558	57%	0.567	S	S	*	*			trans	-69.3	133.7	161.3	30.7	-31.8	0	0	0	108	Q570	P568-Q570 HydrophobicContact CB-CG 4.26Å; P568-Q570 HydrophobicContact CG-CG 4.46Å; P568-Q570 PolarHBondContact O-N 3Å
569	E	26.1	Very low	40.2	Very low	185 Å²	185	131 Å²	131	86%	0.864	61%	0.608	S	S	*	*			trans	-71.1	70.9	162.2	-82.9	-141.8	126.9	0	0	109.6	H571	E569-H571 PolarHBondContact O-N 3.42Å
570	Q	27.4	Very low	37.9	Very low	158 Å²	158	131.6 Å²	131.6	74%	0.738	63%	0.625	S	S	*	*			trans	-81.4	100.4	164.5	-83	-178.5	-6.6	0	0	108.7	P568	P568-Q570 HydrophobicContact CB-CG 4.26Å; P568-Q570 HydrophobicContact CG-CG 4.46Å; P568-Q570 PolarHBondContact O-N 3Å
571	H	26.9	Very low	35.6	Very low	167 Å²	167	136.4 Å²	136.4	77%	0.773	65%	0.65	S	S	*	*			trans	53.9	76.4	161.4	-59.5	-87.4	0	0	0	115.9	E569 P573	E569-H571 PolarHBondContact O-N 3.42Å; H571-P573 WeakPolarHBondContact O-CD 3.29Å
572	R	24.1	Very low	33.2	Very low	221 Å²	221	143.7 Å²	143.7	83%	0.834	68%	0.683	S	S	*	*			trans	-67.4	117.3	133.2	-161.8	176.6	-160.7	161.7	5.4	106.5	Y574	R572-Y574 PolarHBondContact O-N 3.31Å
573	P	26.2	Very low	31.1	Very low	90 Å²	90	149.6 Å²	149.6	58%	0.584	71%	0.711	S	S	*	*			trans	-64.7	125.9	-177.6	-21.8	34.1	0	0	0	110.1	H571 H575	H571-P573 WeakPolarHBondContact O-CD 3.29Å; P573-H575 VanDerWaalsContact C-N 3.35Å; P573-H575 PolarHBondContact O-N 3.04Å
574	Y	23.5	Very low	29.4	Very low	223 Å²	223	151.6 Å²	151.6	88%	0.875	73%	0.725	S	S	*	*			trans	-64.4	102.1	156.6	-102.5	-96.8	0	0	0	106.5	R572 Q576	R572-Y574 PolarHBondContact O-N 3.31Å; Y574-Q576 PolarHBondContact O-N 2.86Å
575	H	29.6	Very low	28.4	Very low	168 Å²	168	154.5 Å²	154.5	78%	0.778	75%	0.75	S	S	*	*			trans	-70.3	83.9	169	-103.6	-80.3	0	0	0	108.9	P573 S577	P573-H575 VanDerWaalsContact C-N 3.35Å; P573-H575 PolarHBondContact O-N 3.04Å; H575-S577 PolarHBondContact O-N 3.44Å
576	Q	26.3	Very low	28.1	Very low	160 Å²	160	156.8 Å²	156.8	75%	0.748	76%	0.761	S	S	*	*			trans	-82.6	58.3	179.3	-166.6	176.9	-5.3	0	0	110.4	Y574 Q578	Y574-Q576 PolarHBondContact O-N 2.86Å; Q576-Q578 WeakPolarHBondContact O-CG 3.18Å; Q576-Q578 PolarHBondContact O-N 2.99Å
577	S	29.2	Very low	27.9	Very low	98 Å²	98	153.9 Å²	153.9	69%	0.685	76%	0.76	S	S	*	*			trans	-78.6	91	159.2	52	0	0	0	0	107	H575	H575-S577 PolarHBondContact O-N 3.44Å
578	Q	29.9	Very low	28.3	Very low	164 Å²	164	150.6 Å²	150.6	77%	0.766	75%	0.752	S	S	*	*				40.7	104.5	77	-71.9	-170.9	1.9	0	0	111.3	Q576 P580	Q576-Q578 WeakPolarHBondContact O-CG 3.18Å; Q576-Q578 PolarHBondContact O-N 2.99Å; Q578-P580 WeakPolarHBondContact O-CD 3.47Å
579	H	26.9	Very low	28.5	Very low	185 Å²	185	153.3 Å²	153.3	86%	0.856	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-60.5	125.7	167.1	-88.4	-97	0	0	0	110.3
580	P	32.8	Very low	28.7	Very low	118 Å²	118	150.5 Å²	150.5	77%	0.766	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-75.6	146.6	150.7	-7.4	26.9	0	0	0	109	Q578	Q578-P580 WeakPolarHBondContact O-CD 3.47Å
581	H	32.1	Very low	28.9	Very low	166 Å²	166	149.2 Å²	149.2	77%	0.769	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-84.9	136.9	173.2	-83.9	-93.6	0	0	0	111.3
582	H	29.4	Very low	28.9	Very low	162 Å²	162	147.4 Å²	147.4	75%	0.75	75%	0.747	S	S	*	*			trans	62.1	145.3	141	-84.1	-68	0	0	0	123
583	Q	30.4	Very low	29	Very low	152 Å²	152	145 Å²	145	71%	0.71	74%	0.742	S	S	*	*			trans	85.5	100.6	147.8	-72.8	-176.6	-81	0	0	121.3
584	D	28.6	Very low	29.1	Very low	126 Å²	126	147.8 Å²	147.8	67%	0.674	75%	0.745	S	S	*	*				89.8	137.2	116.6	-56.4	-15.2	0	0	0	121.5
585	S	30.2	Very low	29.4	Very low	106 Å²	106	141.1 Å²	141.1	74%	0.741	73%	0.732	S	S	*	*			trans	67.8	112.5	166.8	-50.9	0	0	0	0	117.3
586	L	27.4	Very low	29.3	Very low	163 Å²	163	140.6 Å²	140.6	85%	0.853	73%	0.727	S	S	*	*				78.3	136.9	58	-75.8	163.4	0	0	0	115
587	S	29.7	Very low	29.5	Very low	106 Å²	106	140 Å²	140	74%	0.741	72%	0.722	S	S	*	*			trans	71.1	147.6	168.9	82.6	0	0	0	0	116.5
588	H	31.5	Very low	29.5	Very low	158 Å²	158	140.4 Å²	140.4	73%	0.731	73%	0.725	S	S	*	*			cis	-158.6	164.9	-22.6	-129.8	-86.8	0	0	0	110.4
589	H	31.4	Very low	29.5	Very low	144 Å²	144	137.7 Å²	137.7	67%	0.667	72%	0.716	S	S	*	*			trans	64.7	107	157.7	-74.2	-51.6	0	0	0	122.9
590	D	28.9	Very low	29.8	Very low	125 Å²	125	134.7 Å²	134.7	67%	0.668	71%	0.711	S	S	*	*				10.1	127.8	121.2	-44.8	-76.9	0	0	0	119.8
591	T	31.5	Very low	29.7	Very low	131 Å²	131	139.3 Å²	139.3	80%	0.804	71%	0.713	S	S	*	*				175.4	125.1	102	30.6	0	0	0	0	109.3
592	L	26.9	Very low	29.7	Very low	130 Å²	130	136.7 Å²	136.7	68%	0.681	70%	0.704	S	S	*	*				44.5	108.7	74.2	-69.8	176.3	0	0	0	112.2
593	F	26.1	Very low	29.9	Very low	169 Å²	169	135.5 Å²	135.5	74%	0.741	70%	0.699	S	S	*	*			cis	-147	139.6	49.6	-95.1	-115.4	0	0	0	109.9
594	K	29.4	Very low	29.8	Very low	149 Å²	149	138.2 Å²	138.2	65%	0.648	70%	0.703	S	S	*	*			cis	81.4	108.9	48.2	-172.7	-170	-174.1	176.3	0	113.8
595	S	29.2	Very low	29.8	Very low	84 Å²	84	136.7 Å²	136.7	59%	0.587	70%	0.702	S	S	*	*			trans	68	144.4	152.7	68.6	0	0	0	0	119.5
596	K	28.5	Very low	29.8	Very low	157 Å²	157	136.3 Å²	136.3	68%	0.683	70%	0.699	S	S	*	*				167.7	162.5	109.6	-88.6	153.2	-177.9	176.8	0	110.5
597	F	28.6	Very low	29.9	Very low	148 Å²	148	139 Å²	139	65%	0.649	70%	0.699	S	S	*	*			cis	-137.8	-165.4	-8.2	-116	-42.5	0	0	0	106.7	N599	F597-N599 WeakPolarHBondContact CD1-OD1 3.33Å; F597-N599 VanDerWaalsContact CE1-OD1 3.24Å; F597-N599 WeakPolarHBondContact CE1-OD1 3.22Å
598	S	30.2	Very low	30.3	Very low	105 Å²	105	139.7 Å²	139.7	73%	0.734	70%	0.702	S	S	*	*			cis	-169.3	167.4	24.3	3.1	0	0	0	0	107.8
599	N	29.5	Very low	30.3	Very low	108 Å²	108	138.6 Å²	138.6	58%	0.578	70%	0.701	S	S	*	*			cis	-168.5	132.3	-26.3	-96.8	-19.6	0	0	0	103.2	F597	F597-N599 WeakPolarHBondContact CD1-OD1 3.33Å; F597-N599 VanDerWaalsContact CE1-OD1 3.24Å; F597-N599 WeakPolarHBondContact CE1-OD1 3.22Å
600	T	32.6	Very low	30.4	Very low	122 Å²	122	138.9 Å²	138.9	75%	0.748	71%	0.708	S	S	*	*				172.2	160.3	83.3	44.5	0	0	0	0	106
601	R	31.4	Very low	30.6	Very low	214 Å²	214	137.8 Å²	137.8	81%	0.808	71%	0.71	S	S	*	*			cis	-167.9	166.6	-1.3	-116.8	-166.4	165.6	112.7	2.7	105.5
602	D	31.9	Very low	30.7	Very low	111 Å²	111	136.9 Å²	136.9	59%	0.594	70%	0.704	S	S	*	*			cis	-158.5	179	-14.7	-133.3	-30.4	0	0	0	103.5
603	H	33.7	Very low	30.9	Very low	137 Å²	137	139.7 Å²	139.7	63%	0.634	71%	0.711	S	S	*	*			cis	-149.3	-64.9	4.9	-166	49.7	0	0	0	114.7
604	R	28.3	Very low	31.2	Very low	209 Å²	209	139.5 Å²	139.5	79%	0.789	71%	0.714	S	S	*	*			trans	-161.1	159.8	-159.4	-85.8	-173.3	171.7	-176.5	-6.7	111.3
605	S	29.4	Very low	31.6	Very low	94 Å²	94	137 Å²	137	66%	0.657	71%	0.713	S	S	*	*			cis	-172	162.8	-10.4	48	0	0	0	0	113.2
606	S	30.6	Very low	31.8	Very low	99 Å²	99	140.7 Å²	140.7	69%	0.692	72%	0.723	S	S	*	*			trans	64.6	130.1	157.4	42	0	0	0	0	120.1
607	Y	29.3	Very low	32.1	Very low	218 Å²	218	140.1 Å²	140.1	86%	0.855	73%	0.728	S	S	*	*			cis	90.2	150.3	38.9	-79.1	-54.9	0	0	0	114.6
608	P	36.7	Very low	32.4	Very low	122 Å²	122	140 Å²	140	79%	0.792	73%	0.734	S	S	*	*			cis	-137.9	-161	1.1	39	-16.5	0	0	0	117.5
609	N	32	Very low	32.6	Very low	134 Å²	134	141.6 Å²	141.6	72%	0.717	73%	0.734	S	S	*	*			trans	-86.8	168	-163.7	-49	-25.1	0	0	0	119.3
610	N	34.5	Very low	33	Very low	151 Å²	151	141.3 Å²	141.3	81%	0.807	74%	0.738	S	S	*	*				170.3	128.1	117.6	-82.4	-22.9	0	0	0	111.6
611	S	33.1	Very low	33	Very low	101 Å²	101	142.5 Å²	142.5	71%	0.706	74%	0.74	S	S	*	*				74.6	131	73.1	-162.9	0	0	0	0	114.2
612	T	32.5	Very low	33.1	Very low	112 Å²	112	141.9 Å²	141.9	69%	0.687	74%	0.739	S	S	*	*				176.8	155.9	65.1	-50.1	0	0	0	0	114.1
613	K	32.4	Very low	33.1	Very low	190 Å²	190	143.7 Å²	143.7	83%	0.826	74%	0.742	S	S	*	*			trans	71.4	144.3	166	-77.4	146.9	-173.4	-177.8	0	120
614	M	31.4	Very low	32.9	Very low	165 Å²	165	144.6 Å²	144.6	81%	0.813	74%	0.744	S	S	*	*			cis	97.9	153.4	11	-70	-164.6	95.8	0	0	118.1
615	P	38.4	Very low	32.9	Very low	96 Å²	96	140.7 Å²	140.7	62%	0.623	74%	0.739	S	S	*	*			cis	-150.3	-173.5	-32	44.2	-24.9	0	0	0	117.9
616	M	32.4	Very low	32.9	Very low	162 Å²	162	145.4 Å²	145.4	80%	0.798	74%	0.742	S	S	*	*			trans	54.7	164.9	156.3	-55	-35.6	-161.3	0	0	121.4
617	D	35.1	Very low	32.9	Very low	144 Å²	144	148.3 Å²	148.3	77%	0.77	75%	0.745	S	S	*	*			cis	-147.7	160.4	31.1	-67	-53.2	0	0	0	116.5
618	D	35.4	Very low	32.8	Very low	146 Å²	146	143.3 Å²	143.3	78%	0.781	74%	0.742	S	S	*	*			trans	47.5	156.1	140.3	-77.8	11.4	0	0	0	125.8
619	N	33.1	Very low	32.9	Very low	138 Å²	138	142.8 Å²	142.8	74%	0.738	74%	0.738	S	S	*	*			cis	-172.7	147.2	-23.5	-162.2	2.6	0	0	0	108.8
620	P	39.3	Very low	32.7	Very low	103 Å²	103	141.2 Å²	141.2	67%	0.669	74%	0.738	S	S	*	*			trans	-116.5	170.9	-171.1	40.6	-30.7	0	0	0	116
621	N	32.9	Very low	32.6	Very low	147 Å²	147	140.8 Å²	140.8	79%	0.786	74%	0.74	S	S	*	*			trans	-178.7	169.7	149.1	-110.8	-66	0	0	0	118.1
622	Y	33.4	Very low	32.5	Very low	200 Å²	200	143.5 Å²	143.5	78%	0.784	75%	0.746	S	S	*	*			trans	68.9	156.6	167.9	-70.2	-90.6	0	0	0	121.6
623	K	30.4	Very low	32.7	Very low	149 Å²	149	144.1 Å²	144.1	65%	0.648	75%	0.752	S	S	*	*				-171.8	158.5	-53.7	-136.1	164.8	176.4	170.3	0	113.3
624	F	29.5	Very low	32.6	Very low	157 Å²	157	138.2 Å²	138.2	69%	0.689	75%	0.745	S	S	*	*			trans	75.8	130.3	148.8	-85	-55	0	0	0	124.6
625	N	30.2	Very low	32.7	Very low	127 Å²	127	139.2 Å²	139.2	68%	0.679	75%	0.748	S	S	*	*			trans	64.5	154.7	135.3	-79.6	-8.7	0	0	0	122.1
626	R	28	Very low	32.4	Very low	193 Å²	193	139.7 Å²	139.7	73%	0.728	75%	0.753	S	S	*	*			cis	-170.5	165.1	-28.8	-136.1	-177.8	179.7	-146.4	5.1	110.1
627	Q	31.7	Very low	32.4	Very low	159 Å²	159	136 Å²	136	74%	0.743	74%	0.743	S	S	*	*			trans	76.8	147.6	152.6	-75.6	161	-72.6	0	0	121.4
628	S	27	Very low	32.3	Very low	114 Å²	114	137.6 Å²	137.6	80%	0.797	75%	0.746	S	S	*	*			trans	-110	-162.7	179.7	-35.9	0	0	0	0	108.9
629	P	37.3	Very low	32	Very low	110 Å²	110	135.4 Å²	135.4	71%	0.714	74%	0.742	S	S	*	*			cis	-139.8	-177	-7	35.8	-13.8	0	0	0	116.3
630	S	29.3	Very low	31.8	Very low	102 Å²	102	133.8 Å²	133.8	71%	0.713	74%	0.742	S	S	*	*			trans	58.5	136.5	142.6	62.8	0	0	0	0	123.2
631	V	32.4	Very low	31.3	Very low	141 Å²	141	134.1 Å²	134.1	86%	0.855	75%	0.747	S	S	*	*				173	148	117	151.9	0	0	0	0	111.6
632	L	30.8	Very low	31	Very low	159 Å²	159	137.8 Å²	137.8	83%	0.832	75%	0.749	S	S	*	*			trans	-103.6	-175.1	175.2	-84.3	166.1	0	0	0	109.9
633	P	36.2	Very low	30.6	Very low	125 Å²	125	135.5 Å²	135.5	81%	0.812	75%	0.75	S	S	*	*			cis	-141.3	-162.9	9.5	44.8	-25.3	0	0	0	115.2
634	G	31.1	Very low	30.3	Very low	66 Å²	66	132.6 Å²	132.6	68%	0.68	75%	0.748	S	S	*	*			trans	135.6	101.3	137.6	0	0	0	0	0	120.6
635	Q	33.9	Very low	30.1	Very low	186 Å²	186	134.2 Å²	134.2	87%	0.869	76%	0.755	S	S	*	*			trans	41.4	121.1	137.6	-60.5	-174.6	2	0	0	121
636	S	31.3	Very low	29.9	Very low	105 Å²	105	132.2 Å²	132.2	73%	0.734	75%	0.752	S	S	*	*				81.5	148.6	85.7	104.8	0	0	0	0	114
637	S	31.7	Very low	29.9	Very low	84 Å²	84	130.8 Å²	130.8	59%	0.587	75%	0.753	S	S	*	*			cis	-167.4	166.1	-1.9	49.6	0	0	0	0	111.5
638	H	33.8	Very low	29.8	Very low	178 Å²	178	129.4 Å²	129.4	82%	0.824	75%	0.751	S	S	*	*			trans	63.7	157.8	161.7	-59	-56	0	0	0	118.9
639	S	29.2	Very low	29.9	Very low	101 Å²	101	130.9 Å²	130.9	71%	0.706	75%	0.75	S	S	*	*			cis	-165.1	159.9	-23.2	52.8	0	0	0	0	112.6
640	S	29.1	Very low	29.6	Very low	104 Å²	104	129 Å²	129	73%	0.727	75%	0.75	S	S	*	*			trans	68.2	99.7	148	-60.7	0	0	0	0	123.6
641	S	28.4	Very low	29.5	Very low	110 Å²	110	129.4 Å²	129.4	77%	0.769	75%	0.753	S	S	*	*				90.2	140.5	112.8	79	0	0	0	0	123.6
642	R	26.1	Very low	29.3	Very low	223 Å²	223	129 Å²	129	84%	0.842	75%	0.751	S	S	*	*			trans	73.8	120.7	156.8	-75.5	-176.8	168.3	-179.7	-3.4	121
643	L	25.2	Very low	29.2	Very low	152 Å²	152	127.8 Å²	127.8	80%	0.796	75%	0.75	S	S	*	*				44.7	134.5	122.7	-56.1	173.1	0	0	0	119.1
644	S	24.3	Very low	28.8	Very low	88 Å²	88	129.4 Å²	129.4	62%	0.615	75%	0.751	S	S	*	*			cis	-176.9	162.3	2.7	49.4	0	0	0	0	112.3
645	F	24.8	Very low	29	Very low	191 Å²	191	131 Å²	131	84%	0.838	75%	0.749	S	S	*	*			trans	69.3	143.5	163.4	-81.8	-77.8	0	0	0	119.6
646	S	26.7	Very low	28.8	Very low	86 Å²	86	132.8 Å²	132.8	60%	0.601	75%	0.75	S	S	*	*			trans	40.6	142.2	143.2	-65.7	0	0	0	0	122
647	E	28.5	Very low	28.7	Very low	163 Å²	163	132.8 Å²	132.8	76%	0.762	75%	0.75	S	S	*	*			cis	-166	177.8	-10.4	-122.8	156.3	137.7	0	0	108.8
648	D	29.6	Very low	28.8	Very low	129 Å²	129	133.9 Å²	133.9	69%	0.69	76%	0.755	S	S	*	*			trans	66	118.4	153.9	-87.2	13.4	0	0	0	123.9
649	N	28.2	Very low	28.4	Very low	146 Å²	146	132.7 Å²	132.7	78%	0.781	75%	0.754	S	S	*	*				68.2	121.9	129.7	-62.7	-40.4	0	0	0	121.8
650	G	30.5	Very low	28.4	Very low	70 Å²	70	135.8 Å²	135.8	72%	0.722	76%	0.761	S	S	*	*			trans	-173.3	22	179.3	0	0	0	0	0	121.3
651	S	28.2	Very low	28.2	Very low	111 Å²	111	136.2 Å²	136.2	78%	0.776	76%	0.764	S	S	*	*			trans	50.8	127.5	158.5	63.5	0	0	0	0	123.4
652	V	27.1	Very low	28.3	Very low	132 Å²	132	136.8 Å²	136.8	80%	0.8	77%	0.768	S	S	*	*			trans	68.8	122.7	137.7	179.2	0	0	0	0	117.3
653	T	28.9	Very low	28.4	Very low	134 Å²	134	137.9 Å²	137.9	82%	0.822	77%	0.773	S	S	*	*				-159.3	164.9	66.8	-38.4	0	0	0	0	113.5
654	L	28.4	Very low	28.5	Very low	159 Å²	159	136.1 Å²	136.1	83%	0.832	77%	0.773	S	S	*	*			trans	-94	-166.3	-177.7	-63.1	163.7	0	0	0	112.7
655	P	34.4	Very low	29	Very low	99 Å²	99	138.2 Å²	138.2	64%	0.643	79%	0.785	S	S	*	*				-128.7	-173.7	-71.5	40.4	-25	0	0	0	112.6
656	Y	30	Very low	29.1	Very low	223 Å²	223	132.4 Å²	132.4	88%	0.875	78%	0.778	S	S	*	*				167.2	158.6	129.6	-103.2	-79.8	0	0	0	114.3
657	S	29	Very low	29.2	Very low	105 Å²	105	139.8 Å²	139.8	73%	0.734	79%	0.794	S	S	*	*			trans	-127.7	-164.2	166.5	-53.4	0	0	0	0	107.4
658	P	33.7	Very low	29	Very low	107 Å²	107	140.2 Å²	140.2	70%	0.695	80%	0.796	S	S	*	*			cis	-147.7	-171.1	2.9	44.4	-23	0	0	0	117.5
659	L	25.8	Very low	29	Very low	153 Å²	153	141.8 Å²	141.8	80%	0.801	80%	0.803	S	S	*	*			trans	55.6	123.3	144.3	-75.7	161.9	0	0	0	124.4
660	L	29.3	Very low	29.1	Very low	166 Å²	166	143.6 Å²	143.6	87%	0.869	81%	0.805	S	S	*	*				173.2	125.4	127.1	-114	69.7	0	0	0	107.5
661	S	25.1	Very low	28.9	Very low	113 Å²	113	147.1 Å²	147.1	79%	0.79	81%	0.807	S	S	*	*			cis	88.1	114.4	41.4	-164.8	0	0	0	0	115.4
662	S	31.5	Very low	29.2	Very low	122 Å²	122	147.7 Å²	147.7	85%	0.853	81%	0.811	S	S	*	*			trans	-149.1	161.1	162.2	75.2	0	0	0	0	110.7
663	R	27.9	Very low	29.3	Very low	247 Å²	247	147.8 Å²	147.8	93%	0.932	81%	0.807	S	S	*	*			trans	-98.6	146.9	-154	-79	175.2	163.3	173.3	-6.7	116.6
664	S	27.6	Very low	29.4	Very low	115 Å²	115	150.6 Å²	150.6	80%	0.804	81%	0.808	S	S	*	*			trans	-106.7	158.8	151.1	-44.5	0	0	0	0	111
665	P	33.5	Very low	29.6	Very low	132 Å²	132	147 Å²	147	86%	0.857	80%	0.796	S	S	*	*			trans	-111.1	144.2	149.5	35.6	-27	0	0	0	110.8
666	G	26.8	Very low	29.5	Very low	68 Å²	68	149.6 Å²	149.6	70%	0.701	80%	0.804	S	S	*	*			cis	147.2	85.3	-5	0	0	0	0	0	112.8
667	Y	28.7	Very low	29.7	Very low	241 Å²	241	147.1 Å²	147.1	95%	0.945	81%	0.806	S	S	*	*			trans	-141.9	126	164	-95.3	-82.3	0	0	0	109.5
668	Q	25.2	Very low	29.7	Very low	172 Å²	172	146.7 Å²	146.7	80%	0.804	81%	0.809	S	S	*	*			trans	-124.9	145	175.6	-67.5	-179.3	-11.2	0	0	109.4
669	I	29.7	Very low	29.7	Very low	163 Å²	163	149.4 Å²	149.4	84%	0.836	82%	0.816	S	S	*	*			trans	-140.7	101.5	143.7	-60	-172.6	0	0	0	109.6
670	F	30	Very low	29.6	Very low	184 Å²	184	147.6 Å²	147.6	81%	0.807	82%	0.816	S	S	*	*			trans	41.9	129.9	147.7	-74.6	-89.9	0	0	0	124.4
671	N	27	Very low	29.5	Very low	143 Å²	143	142.7 Å²	142.7	77%	0.765	81%	0.805	S	S	*	*			trans	-89.4	167.5	159.5	-78.7	10	0	0	0	112.7
672	S	33.1	Very low	29.6	Very low	124 Å²	124	144.6 Å²	144.6	87%	0.867	81%	0.812	S	S	*	*			trans	-143.2	137.8	142.9	57.1	0	0	0	0	110
673	N	29.6	Very low	29.4	Very low	133 Å²	133	146.6 Å²	146.6	71%	0.711	81%	0.811	S	S	*	*			trans	-106.7	156.7	-162.3	-51.3	-18.4	0	0	0	114
674	K	32	Very low	29.3	Very low	194 Å²	194	139 Å²	139	84%	0.843	80%	0.797	S	S	*	*			trans	161.2	123.5	137.5	-87.8	-166.8	174.9	-171.3	0	107.8
675	S	31.8	Very low	29.5	Very low	83 Å²	83	138.9 Å²	138.9	58%	0.58	78%	0.783	S	S	*	*				70.2	125.3	55	79	0	0	0	0	113.5
676	D	32.2	Very low	29.3	Very low	153 Å²	153	137.8 Å²	137.8	82%	0.818	77%	0.77	S	S	*	*			cis	-158.3	158.6	-9.3	-86.7	-40.6	0	0	0	107.8
677	D	34.9	Very low	29.5	Very low	172 Å²	172	141.3 Å²	141.3	92%	0.92	77%	0.766	S	S	*	*			trans	-171.7	142.3	142.1	-112.1	-27.4	0	0	0	111.2
678	A	29.3	Very low	29.6	Very low	95 Å²	95	137.6 Å²	137.6	79%	0.785	76%	0.758	S	S	*	*			trans	-148.5	119	-172	0	0	0	0	0	114
679	I	31.9	Very low	29.8	Very low	164 Å²	164	136.2 Å²	136.2	84%	0.841	75%	0.745	S	S	*	*			trans	-130.6	109.1	166.7	-63.7	-175.9	0	0	0	110
680	S	25	Very low	30	Very low	115 Å²	115	132.1 Å²	132.1	80%	0.804	73%	0.728	S	S	*	*			trans	21.6	125.7	158.7	61.7	0	0	0	0	121.1
681	G	25.9	Very low	30.3	Very low	63 Å²	63	126.4 Å²	126.4	65%	0.649	71%	0.71	S	S	*	*			trans	-164.5	26.9	174.1	0	0	0	0	0	118.8	I683	G681-I683 WeakPolarHBondContact O-CG1 3.18Å
682	V	27.8	Very low	30.5	Very low	154 Å²	154	124 Å²	124	93%	0.933	71%	0.705	S	S	*	*			trans	48.7	73.8	170.1	-166.1	0	0	0	0	115.7
683	I	26.7	Very low	30.3	Very low	163 Å²	163	127.3 Å²	127.3	84%	0.836	70%	0.704	S	S	*	*			trans	-143.5	104.4	171.7	-43.1	176.3	0	0	0	110	G681	G681-I683 WeakPolarHBondContact O-CG1 3.18Å
684	S	26.7	Very low	30.2	Very low	89 Å²	89	124.3 Å²	124.3	62%	0.622	69%	0.692	S	S	*	*			trans	-158.6	147.4	168	-139.2	0	0	0	0	117.1	D686	S684-D686 PolarHBondContact O-N 2.96Å
685	E	31.9	Very low	30	Very low	111 Å²	111	120.1 Å²	120.1	52%	0.519	69%	0.686	S	S	.	*	S	Bend	trans	64.6	-40.9	148.4	-73.3	154.6	-113.7	0	0	124.5	F687 E688 R689	E685-F687 PolarHBondContact O-N 3.15Å; E685-E688 PolarHBondContact O-N 3.4Å; E685-R689 IonicContact OE2-CZ 3.68Å; E685-R689 IonicContact OE2-NH1 3.81Å; E685-R689 IonicContact OE2-NH2 2.68Å; E685-R689 PolarHBondContact OE2-NH2 3.35Å
686	D	29.6	Very low	29.7	Very low	110 Å²	110	122 Å²	122	59%	0.588	70%	0.697	S	S	*	*	H	α-helix	trans	-65.2	-21.4	-162.5	-77.3	-28.6	0	0	0	115.4	S684 R689 V690	S684-D686 PolarHBondContact O-N 2.96Å; D686-R689 IonicContact OD1-NH1 3.4Å; D686-R689 PolarHBondContact OD1-NH1 3.27Å; D686-V690 WeakPolarHBondContact O-CG2 3.39Å
687	F	31.1	Very low	29.6	Very low	141 Å²	141	119.9 Å²	119.9	62%	0.618	69%	0.685	S	S	*	*	H	α-helix	trans	-75.6	-21.7	-178.8	-123.6	-86.8	0	0	0	114.9	K525 E685	K525-F687 VanDerWaalsContact NZ-CD2 3.32Å; E685-F687 PolarHBondContact O-N 3.15Å
688	E	30.9	Very low	29.3	Very low	164 Å²	164	117.3 Å²	117.3	77%	0.766	68%	0.68	S	S	*	*	H	α-helix	trans	-85.5	-38	175.4	-63.4	-166.9	139.1	0	0	111.5	E685 V690 S691	E685-E688 PolarHBondContact O-N 3.4Å; E688-V690 VanDerWaalsContact C-N 3.26Å; E688-V690 PolarHBondContact O-N 3.33Å; E688-S691 PolarHBondContact O-N 3.27Å
689	R	28.8	Very low	29.3	Very low	142 Å²	142	117.3 Å²	117.3	54%	0.536	67%	0.667	S	S	.	*	H	α-helix	trans	-67.9	-23.7	-173.9	-158.8	173.4	-73	135.9	-7	113.4	E685 D686	E685-R689 IonicContact OE2-CZ 3.68Å; E685-R689 IonicContact OE2-NH1 3.81Å; E685-R689 IonicContact OE2-NH2 2.68Å; E685-R689 PolarHBondContact OE2-NH2 3.35Å; D686-R689 IonicContact OD1-NH1 3.4Å; D686-R689 PolarHBondContact OD1-NH1 3.27Å
690	V	33.5	Very low	29.4	Very low	77 Å²	77	111.3 Å²	111.3	47%	0.467	64%	0.639	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83.9	-25.1	-179.6	171.1	0	0	0	0	113.5	D686 E688	D686-V690 WeakPolarHBondContact O-CG2 3.39Å; E688-V690 VanDerWaalsContact C-N 3.26Å; E688-V690 PolarHBondContact O-N 3.33Å
691	S	37.5	Very low	29.7	Very low	64 Å²	64	107.4 Å²	107.4	45%	0.448	61%	0.61	S	S	.	*	S	Bend	trans	-90.9	-6.8	-172.3	-170.6	0	0	0	0	115	E688	E688-S691 PolarHBondContact O-N 3.27Å
692	S	30	Very low	29.9	Very low	93 Å²	93	106.5 Å²	106.5	65%	0.65	59%	0.594	S	S	*	*	S	Bend	trans	-98.2	-2.3	-167.6	53.8	0	0	0	0	115.3
693	K	29.8	Very low	30	Very low	194 Å²	194	100.5 Å²	100.5	84%	0.843	56%	0.556	S	S	*	*	S	Bend	trans	-119.7	-12.2	179.5	-71.3	-173.1	176.1	-177.5	0	115.5
694	C	27.5	Very low	30.5	Very low	69 Å²	69	95.3 Å²	95.3	47%	0.466	53%	0.527	S	S	.	.	S	Bend	trans	-66.3	140.3	176.3	-61.1	0	0	0	0	110.8
695	C	26.9	Very low	30.9	Very low	106 Å²	106	91.8 Å²	91.8	72%	0.716	50%	0.501	S	S	*	.			trans	-50.8	142	-173.7	-57.5	0	0	0	0	113.1	L697	C695-L697 PolarHBondContact O-N 3.02Å
696	P	26.2	Very low	31.1	Very low	124 Å²	124	88.8 Å²	88.8	81%	0.805	49%	0.493	S	S	*	.			trans	-69	96.2	174	29.6	-33.9	0	0	0	109.6	S698	P696-S698 PolarHBondContact O-N 2.86Å
697	L	30.9	Very low	32.1	Very low	107 Å²	107	85.4 Å²	85.4	56%	0.56	47%	0.474	S	S	*	.			trans	-54.3	113.3	154	-105.5	74.8	0	0	0	106.2	C695 N699 P700	C695-L697 PolarHBondContact O-N 3.02Å; L697-N699 PolarHBondContact O-N 2.83Å; L697-P700 WeakPolarHBondContact O-CD 3.32Å
698	S	27	Very low	33.3	Very low	118 Å²	118	79.3 Å²	79.3	83%	0.825	45%	0.448	S	S	*	.	S	Bend	trans	-67.3	98.1	-170.7	33.9	0	0	0	0	110.3	P696	P696-S698 PolarHBondContact O-N 2.86Å
699	N	29.5	Very low	35.1	Very low	96 Å²	96	73.8 Å²	73.8	51%	0.513	43%	0.427	S	S	.	.			trans	70.9	75.1	177.2	-149.8	5.3	0	0	0	115.4	L697 T701 S702	L697-N699 PolarHBondContact O-N 2.83Å; N699-T701 PolarHBondContact O-N 2.9Å; N699-T701 WeakPolarHBondContact OD1-CB 3.26Å; N699-T701 PolarHBondContact OD1-OG1 3.28Å; N699-S702 PolarHBondContact O-N 3.35Å; N699-S702 VanDerWaalsContact O-N 3.1Å; N699-S702 PolarHBondContact O-OG 3.04Å
700	P	34.7	Very low	37.8	Very low	38 Å²	38	67.9 Å²	67.9	25%	0.247	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-56.9	-22.5	169.3	27.2	-36.2	0	0	0	112.2	L697 S702 L703 Y704	L697-P700 WeakPolarHBondContact O-CD 3.32Å; P700-S702 PolarHBondContact O-N 3.36Å; P700-L703 PolarHBondContact O-N 3.44Å; P700-L703 VanDerWaalsContact O-N 3.16Å; P700-Y704 HydrophobicContact CB-CE2 4.38Å; P700-Y704 VanDerWaalsContact O-CD2 3.3Å; P700-Y704 WeakPolarHBondContact O-CD2 3.44Å
701	T	31	Very low	40.5	Very low	33 Å²	33	64.2 Å²	64.2	20%	0.202	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-62.1	-2.6	174.7	-31.3	0	0	0	0	113.9	D539 R540 N699 T705	D539-T701 HydrophobicContact CB-CG2 4.27Å; R540-T701 HydrophobicContact CG-CG2 4.27Å; R540-T701 VanDerWaalsContact NE-CG2 3.31Å; R540-T701 PolarHBondContact NH2-O 3.47Å; N699-T701 PolarHBondContact O-N 2.9Å; N699-T701 WeakPolarHBondContact OD1-CB 3.26Å; N699-T701 PolarHBondContact OD1-OG1 3.28Å; T701-T705 PolarHBondContact O-OG1 3.48Å
702	S	30.6	Very low	43	Very low	43 Å²	43	61.2 Å²	61.2	30%	0.301	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-85.6	-36.6	168.8	73	0	0	0	0	113.7	N699 P700 T705 S765	N699-S702 PolarHBondContact O-N 3.35Å; N699-S702 VanDerWaalsContact O-N 3.1Å; N699-S702 PolarHBondContact O-OG 3.04Å; P700-S702 PolarHBondContact O-N 3.36Å; S702-T705 PolarHBondContact O-OG1 2.88Å; S702-S765 WeakPolarHBondContact CB-OG 3.39Å; S702-S765 PolarHBondContact OG-OG 3.4Å
703	L	29.1	Very low	45.9	Very low	28 Å²	28	56.8 Å²	56.8	15%	0.147	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	-72.4	-46.1	-176.9	-65	175.4	0	0	0	110.5	P700 T705	P700-L703 PolarHBondContact O-N 3.44Å; P700-L703 VanDerWaalsContact O-N 3.16Å; L703-T705 PolarHBondContact O-N 3.1Å; L703-T705 VanDerWaalsContact O-N 3.07Å
704	Y	38.4	Very low	48.8	Very low	55 Å²	55	48.4 Å²	48.4	22%	0.216	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-69.8	-1.5	-178.1	-61.8	-70.8	0	0	0	115	L468 D471 H475 R540 P700 L707	L468-Y704 HydrophobicContact CD1-CE1 4.42Å; D471-Y704 VanDerWaalsContact OD2-CE1 3.25Å; D471-Y704 WeakPolarHBondContact OD2-CE1 3.2Å; D471-Y704 VanDerWaalsContact OD2-CZ 3.3Å; D471-Y704 PolarHBondContact OD2-OH 2.74Å; H475-Y704 PolarHBondContact NE2-OH 3.01Å; R540-Y704 VanDerWaalsContact NH1-C 3.27Å; R540-Y704 PolarHBondContact NH1-O 2.85Å; R540-Y704 VanDerWaalsContact NH2-C 3.26Å; P700-Y704 HydrophobicContact CB-CE2 4.38Å; P700-Y704 VanDerWaalsContact O-CD2 3.3Å; P700-Y704 WeakPolarHBondContact O-CD2 3.44Å; Y704-L707 HydrophobicContact CD1-CD1 3.78Å; Y704-L707 HydrophobicContact CE1-CD1 4.21Å
705	T	33.1	Very low	51.8	Low	15 Å²	15	47.1 Å²	47.1	9%	0.092	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-91.4	-25	-179.3	-7.3	0	0	0	0	114.1	R540 N565 T701 S702 L703 L707	R540-T705 PolarHBondContact NH2-OG1 3.39Å; N565-T705 HydrophobicContact CB-CG2 4.4Å; T701-T705 PolarHBondContact O-OG1 3.48Å; S702-T705 PolarHBondContact O-OG1 2.88Å; L703-T705 PolarHBondContact O-N 3.1Å; L703-T705 VanDerWaalsContact O-N 3.07Å; T705-L707 VanDerWaalsContact C-N 3.3Å
706	S	37.1	Very low	54.7	Low	48 Å²	48	47.5 Å²	47.5	34%	0.336	28%	0.278	S	S	.	.	S	Bend	trans	-86.9	-6.2	169.9	-171.1	0	0	0	0	111.8	V708 P804 K920	S706-V708 PolarHBondContact O-N 2.81Å; S706-V708 VanDerWaalsContact O-N 3.12Å; S706-P804 PolarHBondContact OG-O 3.12Å; S706-K920 PolarHBondContact OG-NZ 3.4Å
707	L	50	Low	57.6	Low	38 Å²	38	51.7 Å²	51.7	20%	0.199	28%	0.278	C	S	.	.			trans	-84.8	44.1	179	-65.6	-179	0	0	0	113.9	Y704 T705 P709 P804	Y704-L707 HydrophobicContact CD1-CD1 3.78Å; Y704-L707 HydrophobicContact CE1-CD1 4.21Å; T705-L707 VanDerWaalsContact C-N 3.3Å; L707-P709 WeakPolarHBondContact O-CD 3.38Å; L707-P804 HydrophobicContact CD2-CB 4.12Å; L707-P804 HydrophobicContact CD2-CG 4.13Å; L707-P804 HydrophobicContact CG-CB 4.47Å; L707-P804 HydrophobicContact CG-CG 4.41Å
708	V	56.6	Low	60.4	Low	13 Å²	13	48.3 Å²	48.3	8%	0.079	26%	0.263	C	S	.	.			trans	-116.8	65.1	160	-169.1	0	0	0	0	110.5	L546 L561 S706 Y710 L711	L546-V708 HydrophobicContact CD1-CG1 3.76Å; L561-V708 WeakPolarHBondContact CD2-O 3.41Å; S706-V708 PolarHBondContact O-N 2.81Å; S706-V708 VanDerWaalsContact O-N 3.12Å; V708-Y710 WeakPolarHBondContact CG1-O 3.28Å; V708-Y710 PolarHBondContact O-N 2.56Å; V708-L711 HydrophobicContact CG1-CD2 4.02Å
709	P	69.8	Low	63.2	Low	48 Å²	48	44.5 Å²	44.5	31%	0.312	24%	0.243	S	C	.	.			trans	-73.6	-8.2	172.5	27.8	-31.7	0	0	0	113.8	L707 C726	L707-P709 WeakPolarHBondContact O-CD 3.38Å; P709-C726 WeakPolarHBondContact O-CA 3.47Å; P709-C726 VanDerWaalsContact O-CB 3.31Å; P709-C726 WeakPolarHBondContact O-CB 3.47Å
710	Y	85.3	Confident	66	Low	19 Å²	19	43.9 Å²	43.9	8%	0.075	24%	0.239	C	C	.	.			trans	-129.1	126.9	-178.8	-50	-73.8	0	0	0	110.6	M448 A449 V463 E467 L546 V708 L724 L725 C726	M448-Y710 VanDerWaalsContact CB-OH 3.25Å; M448-Y710 WeakPolarHBondContact CB-OH 3.09Å; A449-Y710 HydrophobicContact CB-CD1 4.07Å; A449-Y710 HydrophobicContact CB-CD2 3.51Å; A449-Y710 HydrophobicContact CB-CE1 4Å; A449-Y710 HydrophobicContact CB-CE2 3.44Å; A449-Y710 VanDerWaalsContact CB-CE2 3.44Å; A449-Y710 HydrophobicContact CB-CG 3.87Å; V463-Y710 HydrophobicContact CG1-CD2 4.02Å; V463-Y710 HydrophobicContact CG1-CG 4.34Å; E467-Y710 PolarHBondContact OE1-OH 3.04Å; L546-Y710 VanDerWaalsContact CD1-O 3.26Å; L546-Y710 WeakPolarHBondContact CD1-O 3.44Å; V708-Y710 WeakPolarHBondContact CG1-O 3.28Å; V708-Y710 PolarHBondContact O-N 2.56Å; Y710-L724 HydrophobicContact CD1-CD1 4.46Å; Y710-L725 WeakPolarHBondContact CA-O 3.35Å; Y710-C726 HydrophobicContact CD1-CB 3.87Å; Y710-C726 HydrophobicContact CE1-CB 4.07Å
711	L	88.9	Confident	68.7	Low	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	140.6	162.9	-66	173.3	0	0	0	109.6	D545 L546 V548 A557 R560 L561 V708 L724 L725	D545-L711 WeakPolarHBondContact O-CD2 3.28Å; L546-L711 WeakPolarHBondContact O-CA 3.33Å; V548-L711 HydrophobicContact CG1-CD1 3.9Å; V548-L711 HydrophobicContact CG2-CB 4.12Å; A557-L711 HydrophobicContact CB-CD1 4.28Å; A557-L711 WeakPolarHBondContact O-CD1 3.27Å; R560-L711 HydrophobicContact CB-CD1 3.97Å; L561-L711 HydrophobicContact CD1-CD1 4.42Å; L561-L711 HydrophobicContact CD2-CD1 4.2Å; L561-L711 HydrophobicContact CD2-CG 3.79Å; L561-L711 HydrophobicContact CG-CD1 3.77Å; L561-L711 HydrophobicContact CG-CG 3.96Å; V708-L711 HydrophobicContact CG1-CD2 4.02Å; L711-L724 CarbonylContact O-C 3.59Å; L711-L724 WeakPolarHBondContact O-CA 3.35Å; L711-L725 HydrophobicContact CB-CB 4.43Å; L711-L725 PolarHBondContact N-O 2.94Å; L711-L725 PolarHBondContact O-N 3.3Å
712	I	90.1	Very high	71.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	120.8	175.3	-53	168.6	0	0	0	108.4	P451 V463 L546 F547 V548 I714 A721 L724	P451-I712 HydrophobicContact CB-CD1 4.02Å; P451-I712 HydrophobicContact CG-CD1 4.3Å; P451-I712 HydrophobicContact CG-CG1 4.26Å; P451-I712 HydrophobicContact CG-CG2 4.26Å; V463-I712 HydrophobicContact CG2-CD1 3.64Å; V463-I712 HydrophobicContact CG2-CG1 3.49Å; V463-I712 VanDerWaalsContact CG2-CG1 3.49Å; L546-I712 HydrophobicContact CD2-CD1 4.07Å; L546-I712 HydrophobicContact CG-CD1 4.23Å; L546-I712 HydrophobicContact CG-CG1 4.38Å; L546-I712 PolarHBondContact O-N 2.98Å; F547-I712 WeakPolarHBondContact CA-O 3.4Å; F547-I712 HydrophobicContact CD1-CB 3.96Å; F547-I712 HydrophobicContact CD1-CD1 4.11Å; F547-I712 HydrophobicContact CD1-CG2 4.41Å; F547-I712 HydrophobicContact CE1-CB 4.33Å; F547-I712 HydrophobicContact CE1-CD1 3.63Å; V548-I712 PolarHBondContact N-O 2.83Å; I712-I714 HydrophobicContact CB-CG1 4.48Å; I712-I714 HydrophobicContact CG2-CD1 4.16Å; I712-I714 HydrophobicContact CG2-CG1 3.66Å; I712-I714 PolarHBondContact O-N 2.76Å; I712-A721 HydrophobicContact CG2-CB 3.81Å; I712-L724 HydrophobicContact CB-CD2 4.36Å; I712-L724 HydrophobicContact CG1-CD2 3.76Å
713	V	91.6	Very high	74.3	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	112.3	170.6	-169.1	0	0	0	0	108.4	C416 L420 V548 P550 A721 L722 G723 L725	C416-V713 HydrophobicContact CB-CG1 4.22Å; C416-V713 HydrophobicContact CB-CG2 4.34Å; L420-V713 HydrophobicContact CD1-CG1 4.26Å; L420-V713 HydrophobicContact CD2-CG2 4.37Å; V548-V713 HydrophobicContact CG2-CG2 4.05Å; V548-V713 CarbonylContact O-C 3.49Å; V548-V713 VanDerWaalsContact O-CA 3.26Å; V548-V713 WeakPolarHBondContact O-CA 3.36Å; P550-V713 HydrophobicContact CG-CG1 4.36Å; V713-A721 WeakPolarHBondContact O-CA 3.33Å; V713-L722 HydrophobicContact CG1-CD1 4.48Å; V713-L722 PolarHBondContact O-N 2.79Å; V713-G723 PolarHBondContact N-O 3.1Å; V713-L725 HydrophobicContact CG2-CB 4.14Å
714	I	91.2	Very high	77.2	Confident	19 Å²	19	42.5 Å²	42.5	10%	0.097	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	133.6	179.7	-65.9	-167.2	0	0	0	110.5	Y460 F547 V548 Y549 P550 I712 D716 N720	Y460-I714 HydrophobicContact CD2-CD1 3.57Å; Y460-I714 HydrophobicContact CE2-CD1 3.82Å; Y460-I714 HydrophobicContact CG-CD1 4.45Å; F547-I714 HydrophobicContact CD1-CD1 3.29Å; F547-I714 HydrophobicContact CD1-CG1 3.97Å; F547-I714 HydrophobicContact CE1-CD1 3.51Å; F547-I714 HydrophobicContact CG-CD1 4.17Å; V548-I714 PolarHBondContact O-N 3.01Å; Y549-I714 WeakPolarHBondContact CD1-O 3.37Å; P550-I714 WeakPolarHBondContact CD-O 3.24Å; I712-I714 HydrophobicContact CB-CG1 4.48Å; I712-I714 HydrophobicContact CG2-CD1 4.16Å; I712-I714 HydrophobicContact CG2-CG1 3.66Å; I712-I714 PolarHBondContact O-N 2.76Å; I714-D716 PolarHBondContact O-N 2.78Å; I714-N720 WeakPolarHBondContact CA-O 3.48Å
715	D	90.3	Very high	79.6	Confident	41 Å²	41	39.9 Å²	39.9	22%	0.219	22%	0.217	C	C	.	.			trans	-68.8	112.6	166.2	175	39.5	0	0	0	110.9	R717 S718 G719 N720 L722	D715-R717 PolarHBondContact O-N 2.97Å; D715-R717 VanDerWaalsContact O-N 3.12Å; D715-R717 PolarHBondContact OD1-N 2.91Å; D715-S718 PolarHBondContact O-N 3.26Å; D715-S718 WeakPolarHBondContact OD2-CB 3.48Å; D715-S718 PolarHBondContact OD2-N 3.21Å; D715-S718 PolarHBondContact OD2-OG 3.05Å; D715-G719 WeakPolarHBondContact O-CA 3.45Å; D715-G719 PolarHBondContact O-N 3.27Å; D715-N720 PolarHBondContact N-O 3.22Å; D715-L722 HydrophobicContact CB-CD1 4Å; D715-L722 HydrophobicContact CB-CD2 4.38Å; D715-L722 HydrophobicContact CB-CG 4.21Å
716	D	86.6	Confident	82.2	Confident	114 Å²	114	40.2 Å²	40.2	61%	0.61	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.8	-34.6	176.4	-176.1	52	0	0	0	113.1	Y549 I714	Y549-D716 HydrophobicContact CD1-CB 3.74Å; Y549-D716 HydrophobicContact CE1-CB 3.97Å; Y549-D716 HydrophobicContact CG-CB 4.5Å; I714-D716 PolarHBondContact O-N 2.78Å
717	R	87.9	Confident	84.5	Confident	212 Å²	212	38.7 Å²	38.7	80%	0.8	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-29.6	-173.7	-64.4	-175.2	175.3	-152	-3.2	114.8	D715	D715-R717 PolarHBondContact O-N 2.97Å; D715-R717 VanDerWaalsContact O-N 3.12Å; D715-R717 PolarHBondContact OD1-N 2.91Å
718	S	88.6	Confident	86	Confident	37 Å²	37	38.8 Å²	38.8	26%	0.259	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.6	-6.7	-175	68.3	0	0	0	0	114.3	D715 N720	D715-S718 PolarHBondContact O-N 3.26Å; D715-S718 WeakPolarHBondContact OD2-CB 3.48Å; D715-S718 PolarHBondContact OD2-N 3.21Å; D715-S718 PolarHBondContact OD2-OG 3.05Å; S718-N720 VanDerWaalsContact CB-ND2 3.29Å; S718-N720 WeakPolarHBondContact CB-ND2 3.35Å; S718-N720 PolarHBondContact O-N 3.47Å; S718-N720 PolarHBondContact OG-ND2 3.21Å
719	G	85.9	Confident	87.4	Confident	38 Å²	38	40.9 Å²	40.9	39%	0.392	22%	0.218	S	C	.	.			trans	70.2	1.9	-176.5	0	0	0	0	0	114.4	Y460 D715	Y460-G719 WeakPolarHBondContact CE2-O 3.5Å; D715-G719 WeakPolarHBondContact O-CA 3.45Å; D715-G719 PolarHBondContact O-N 3.27Å
720	N	89.5	Confident	88.3	Confident	83 Å²	83	38.6 Å²	38.6	44%	0.444	20%	0.203	S	C	.	.			trans	-77.4	133.4	-176.8	-70.4	-66.8	0	0	0	111.8	I714 D715 S718 L722	I714-N720 WeakPolarHBondContact CA-O 3.48Å; D715-N720 PolarHBondContact N-O 3.22Å; S718-N720 VanDerWaalsContact CB-ND2 3.29Å; S718-N720 WeakPolarHBondContact CB-ND2 3.35Å; S718-N720 PolarHBondContact O-N 3.47Å; S718-N720 PolarHBondContact OG-ND2 3.21Å; N720-L722 PolarHBondContact O-N 3.04Å
721	A	90.3	Very high	88.3	Confident	14 Å²	14	37.9 Å²	37.9	12%	0.116	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	124.3	164.7	0	0	0	0	0	110.6	L426 I428 P451 Y460 I712 V713	L426-A721 HydrophobicContact CD2-CB 3.76Å; L426-A721 VanDerWaalsContact CD2-O 3.3Å; L426-A721 WeakPolarHBondContact CD2-O 3.47Å; I428-A721 HydrophobicContact CD1-CB 4.47Å; P451-A721 HydrophobicContact CG-CB 4.48Å; Y460-A721 HydrophobicContact CE1-CB 4.09Å; Y460-A721 HydrophobicContact CE2-CB 4.27Å; Y460-A721 WeakPolarHBondContact OH-CB 3.25Å; Y460-A721 PolarHBondContact OH-N 3.41Å; Y460-A721 VanDerWaalsContact OH-N 3.15Å; I712-A721 HydrophobicContact CG2-CB 3.81Å; V713-A721 WeakPolarHBondContact O-CA 3.33Å
722	L	90.8	Very high	88.1	Confident	77 Å²	77	38.6 Å²	38.6	40%	0.403	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	-21.5	179.8	-60.9	171.6	0	0	0	112.6	L420 P550 V713 D715 N720	L420-L722 HydrophobicContact CD1-CB 3.8Å; P550-L722 HydrophobicContact CG-CD1 3.52Å; V713-L722 HydrophobicContact CG1-CD1 4.48Å; V713-L722 PolarHBondContact O-N 2.79Å; D715-L722 HydrophobicContact CB-CD1 4Å; D715-L722 HydrophobicContact CB-CD2 4.38Å; D715-L722 HydrophobicContact CB-CG 4.21Å; N720-L722 PolarHBondContact O-N 3.04Å
723	G	90	Very high	88	Confident	4 Å²	4	39.3 Å²	39.3	4%	0.041	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.5	173.7	177.3	0	0	0	0	0	113.5	V713	V713-G723 PolarHBondContact N-O 3.1Å
724	L	89.3	Confident	87.8	Confident	18 Å²	18	39.4 Å²	39.4	9%	0.094	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	136.5	169.6	-65.6	179.8	0	0	0	110.8	L426 A449 P451 V463 Y710 L711 I712 R729	L426-L724 HydrophobicContact CD1-CG 4.46Å; A449-L724 HydrophobicContact CB-CD1 3.88Å; A449-L724 WeakPolarHBondContact O-CD1 3.17Å; P451-L724 HydrophobicContact CG-CD2 3.97Å; V463-L724 HydrophobicContact CG2-CD2 4.01Å; Y710-L724 HydrophobicContact CD1-CD1 4.46Å; L711-L724 CarbonylContact O-C 3.59Å; L711-L724 WeakPolarHBondContact O-CA 3.35Å; I712-L724 HydrophobicContact CB-CD2 4.36Å; I712-L724 HydrophobicContact CG1-CD2 3.76Å; L724-R729 WeakPolarHBondContact O-CD 3.43Å; L724-R729 PolarHBondContact O-NH1 2.97Å
725	L	89.4	Confident	87.3	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	123.8	174.4	-173.1	66.4	0	0	0	109.6	V419 A557 Y710 L711 V713 L730	V419-L725 HydrophobicContact CB-CD1 4.05Å; V419-L725 HydrophobicContact CG1-CD1 3.53Å; A557-L725 HydrophobicContact CB-CD2 3.69Å; Y710-L725 WeakPolarHBondContact CA-O 3.35Å; L711-L725 HydrophobicContact CB-CB 4.43Å; L711-L725 PolarHBondContact N-O 2.94Å; L711-L725 PolarHBondContact O-N 3.3Å; V713-L725 HydrophobicContact CG2-CB 4.14Å; L725-L730 HydrophobicContact CD1-CD2 3.75Å; L725-L730 HydrophobicContact CD1-CG 3.97Å; L725-L730 HydrophobicContact CD2-CD2 4.31Å; L725-L730 HydrophobicContact CG-CD2 4.27Å; L725-L730 HydrophobicContact CG-CG 4.3Å
726	C	86	Confident	87	Confident	21 Å²	21	43.3 Å²	43.3	14%	0.142	23%	0.226	C	C	.	.			trans	-134.4	171.8	179.6	64.6	0	0	0	0	111.2	P709 Y710 D728 R729 L730	P709-C726 WeakPolarHBondContact O-CA 3.47Å; P709-C726 VanDerWaalsContact O-CB 3.31Å; P709-C726 WeakPolarHBondContact O-CB 3.47Å; Y710-C726 HydrophobicContact CD1-CB 3.87Å; Y710-C726 HydrophobicContact CE1-CB 4.07Å; C726-D728 PolarHBondContact O-N 2.81Å; C726-R729 PolarHBondContact O-N 3.45Å; C726-L730 PolarHBondContact O-N 3.49Å; C726-L730 VanDerWaalsContact O-N 3.17Å
727	A	85.5	Confident	86.8	Confident	17 Å²	17	40.3 Å²	40.3	14%	0.14	21%	0.206	C	C	.	.	H	α-helix	trans	-55.4	-48.8	179.5	0	0	0	0	0	112.7	F562 R729 L730 L731 A919 K920 L923	F562-A727 HydrophobicContact CE1-CB 4.41Å; A727-R729 PolarHBondContact O-N 3.07Å; A727-L730 PolarHBondContact O-N 3.38Å; A727-L730 VanDerWaalsContact O-N 3.17Å; A727-L731 WeakPolarHBondContact O-CB 3.45Å; A727-L731 PolarHBondContact O-N 2.91Å; A727-A919 HydrophobicContact CB-CB 4.15Å; A727-K920 HydrophobicContact CB-CB 4.38Å; A727-L923 HydrophobicContact CB-CD1 4.17Å; A727-L923 VanDerWaalsContact O-CD1 3.27Å; A727-L923 WeakPolarHBondContact O-CD1 3.37Å
728	D	82.8	Confident	86.5	Confident	40 Å²	40	31 Å²	31	21%	0.214	17%	0.172	C	C	.	.	H	α-helix	trans	-61.3	-34	-176.9	-50.8	-52.5	0	0	0	112.7	C726 L731 A732 P889 A919	C726-D728 PolarHBondContact O-N 2.81Å; D728-L731 PolarHBondContact O-N 3.32Å; D728-A732 WeakPolarHBondContact O-CB 3.44Å; D728-A732 PolarHBondContact O-N 3.33Å; D728-P889 WeakPolarHBondContact OD1-CB 3.43Å; D728-A919 WeakPolarHBondContact OD1-CB 3.41Å
729	R	85.3	Confident	85.9	Confident	56 Å²	56	34.9 Å²	34.9	21%	0.211	19%	0.191	C	C	.	.	H	α-helix	trans	-72.4	-40.2	178.9	-156.7	-171.5	-175.5	127.3	1.6	112	V419 L724 C726 A727 Y733	V419-R729 HydrophobicContact CG1-CB 4.26Å; V419-R729 HydrophobicContact CG1-CG 3.63Å; V419-R729 PolarHBondContact O-NE 3.08Å; L724-R729 WeakPolarHBondContact O-CD 3.43Å; L724-R729 PolarHBondContact O-NH1 2.97Å; C726-R729 PolarHBondContact O-N 3.45Å; A727-R729 PolarHBondContact O-N 3.07Å; R729-Y733 PolarHBondContact O-N 3.05Å
730	L	88.4	Confident	85.5	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-66.6	-40.2	171.9	-70.1	173.9	0	0	0	111.5	F411 V419 L554 L558 L561 L725 C726 A727 Y733 L734 L923	F411-L730 HydrophobicContact CE1-CB 4.24Å; F411-L730 HydrophobicContact CE1-CD2 4.02Å; V419-L730 HydrophobicContact CG1-CD2 4.47Å; V419-L730 HydrophobicContact CG2-CD2 4.28Å; L554-L730 HydrophobicContact CB-CD2 4.49Å; L554-L730 HydrophobicContact CD1-CD2 4.22Å; L554-L730 HydrophobicContact CD2-CD2 3.85Å; L554-L730 HydrophobicContact CG-CD2 4.42Å; L558-L730 HydrophobicContact CB-CD1 4.25Å; L558-L730 HydrophobicContact CD1-CD1 4.45Å; L558-L730 HydrophobicContact CG-CD1 4.5Å; L561-L730 HydrophobicContact CD1-CD1 3.57Å; L725-L730 HydrophobicContact CD1-CD2 3.75Å; L725-L730 HydrophobicContact CD1-CG 3.97Å; L725-L730 HydrophobicContact CD2-CD2 4.31Å; L725-L730 HydrophobicContact CG-CD2 4.27Å; L725-L730 HydrophobicContact CG-CG 4.3Å; C726-L730 PolarHBondContact O-N 3.49Å; C726-L730 VanDerWaalsContact O-N 3.17Å; A727-L730 PolarHBondContact O-N 3.38Å; A727-L730 VanDerWaalsContact O-N 3.17Å; L730-Y733 PolarHBondContact O-N 2.89Å; L730-L734 PolarHBondContact O-N 2.96Å; L730-L923 HydrophobicContact CB-CD1 3.74Å; L730-L923 HydrophobicContact CB-CD2 4.33Å
731	L	86.5	Confident	85	Confident	5 Å²	5	35.2 Å²	35.2	3%	0.026	18%	0.18	C	C	.	.	H	α-helix	trans	-62.6	-44.9	176.7	-170.3	77.7	0	0	0	110.6	A727 D728 L734 R735 L880 M883 F884 A919 V922 L923	A727-L731 WeakPolarHBondContact O-CB 3.45Å; A727-L731 PolarHBondContact O-N 2.91Å; D728-L731 PolarHBondContact O-N 3.32Å; L731-L734 WeakPolarHBondContact O-CB 3.39Å; L731-L734 PolarHBondContact O-N 3.43Å; L731-R735 PolarHBondContact O-N 2.86Å; L731-L880 HydrophobicContact CD1-CD2 3.63Å; L731-L880 HydrophobicContact CG-CD2 4.37Å; L731-M883 HydrophobicContact CD2-CE 3.72Å; L731-F884 HydrophobicContact CB-CE1 4.4Å; L731-F884 HydrophobicContact CD1-CZ 4.24Å; L731-F884 HydrophobicContact CD2-CE1 3.86Å; L731-F884 HydrophobicContact CD2-CZ 4.06Å; L731-F884 HydrophobicContact CG-CE1 3.66Å; L731-F884 HydrophobicContact CG-CZ 3.61Å; L731-F884 WeakPolarHBondContact O-CE1 3.42Å; L731-F884 VanDerWaalsContact O-CZ 3.22Å; L731-F884 WeakPolarHBondContact O-CZ 3.29Å; L731-A919 HydrophobicContact CB-CB 4.31Å; L731-A919 HydrophobicContact CD2-CB 3.67Å; L731-A919 HydrophobicContact CG-CB 4.41Å; L731-V922 HydrophobicContact CD1-CB 4.36Å; L731-L923 HydrophobicContact CB-CD1 4.21Å; L731-L923 HydrophobicContact CB-CD2 4.46Å; L731-L923 HydrophobicContact CB-CG 4.28Å; L731-L923 HydrophobicContact CD1-CD2 4.2Å; L731-L923 HydrophobicContact CD1-CG 3.92Å
732	A	84.2	Confident	84.3	Confident	15 Å²	15	38 Å²	38	12%	0.124	20%	0.197	C	C	.	.	H	α-helix	trans	-69.8	-33.2	176.8	0	0	0	0	0	113.4	L256 D728 L734 R735 L736	L256-A732 HydrophobicContact CD1-CB 3.2Å; D728-A732 WeakPolarHBondContact O-CB 3.44Å; D728-A732 PolarHBondContact O-N 3.33Å; A732-L734 VanDerWaalsContact C-N 3.32Å; A732-R735 PolarHBondContact O-N 3.36Å; A732-R735 VanDerWaalsContact O-N 3.16Å; A732-L736 PolarHBondContact O-N 2.97Å
733	Y	88	Confident	83.1	Confident	15 Å²	15	38.6 Å²	38.6	6%	0.059	20%	0.201	C	C	.	.	H	α-helix	trans	-60.4	-43.1	169.6	-177.9	-96.9	0	0	0	111.4	L410 S414 D418 V419 L554 R729 L730 R735 L736 R737	L410-Y733 HydrophobicContact CD2-CE1 4.46Å; S414-Y733 WeakPolarHBondContact CB-OH 3.23Å; S414-Y733 PolarHBondContact OG-OH 3.18Å; S414-Y733 VanDerWaalsContact OG-OH 3.1Å; D418-Y733 HydrophobicContact CB-CE2 3.74Å; D418-Y733 WeakPolarHBondContact CB-OH 3.34Å; D418-Y733 WeakPolarHBondContact O-CD2 3.24Å; D418-Y733 WeakPolarHBondContact O-CE2 3.23Å; V419-Y733 HydrophobicContact CB-CD2 4.48Å; V419-Y733 HydrophobicContact CG2-CD1 4.21Å; V419-Y733 HydrophobicContact CG2-CD2 3.74Å; V419-Y733 HydrophobicContact CG2-CE2 4.21Å; V419-Y733 HydrophobicContact CG2-CG 3.72Å; L554-Y733 HydrophobicContact CD1-CD1 3.79Å; L554-Y733 HydrophobicContact CD1-CE1 3.73Å; L554-Y733 HydrophobicContact CD1-CG 4.47Å; R729-Y733 PolarHBondContact O-N 3.05Å; L730-Y733 PolarHBondContact O-N 2.89Å; Y733-R735 VanDerWaalsContact C-N 3.31Å; Y733-R735 PolarHBondContact O-N 3.25Å; Y733-L736 PolarHBondContact O-N 2.98Å; Y733-R737 PolarHBondContact OH-NH1 3.46Å
734	L	86.2	Confident	82	Confident	2 Å²	2	38.4 Å²	38.4	1%	0.01	20%	0.199	C	C	.	.	H	α-helix	trans	-58.3	-40.8	172.3	176.9	61.7	0	0	0	111.4	Y407 L410 F411 L730 L731 A732 L736 R737 V738 L923 V926	Y407-L734 HydrophobicContact CD1-CD1 3.7Å; Y407-L734 HydrophobicContact CE1-CD1 4.22Å; Y407-L734 HydrophobicContact CG-CD1 4.48Å; L410-L734 HydrophobicContact CD2-CD1 4.23Å; F411-L734 HydrophobicContact CE2-CB 4.13Å; F411-L734 HydrophobicContact CE2-CD1 4.27Å; F411-L734 HydrophobicContact CZ-CB 4.3Å; L730-L734 PolarHBondContact O-N 2.96Å; L731-L734 WeakPolarHBondContact O-CB 3.39Å; L731-L734 PolarHBondContact O-N 3.43Å; A732-L734 VanDerWaalsContact C-N 3.32Å; L734-L736 VanDerWaalsContact C-N 3.31Å; L734-L736 PolarHBondContact O-N 3.42Å; L734-R737 CarbonylContact O-C 3.56Å; L734-R737 PolarHBondContact O-N 2.93Å; L734-V738 WeakPolarHBondContact O-CB 3.4Å; L734-V738 PolarHBondContact O-N 3.37Å; L734-L923 HydrophobicContact CD2-CD2 4.4Å; L734-V926 HydrophobicContact CD2-CG1 4.36Å
735	R	82.6	Confident	81	Confident	58 Å²	58	39.4 Å²	39.4	22%	0.219	21%	0.214	C	C	.	.	H	α-helix	trans	-62.6	-33	177.2	-169	50.6	173.9	120.2	-16.4	114.2	L731 A732 Y733 R737 D739 D881 F884	L731-R735 PolarHBondContact O-N 2.86Å; A732-R735 PolarHBondContact O-N 3.36Å; A732-R735 VanDerWaalsContact O-N 3.16Å; Y733-R735 VanDerWaalsContact C-N 3.31Å; Y733-R735 PolarHBondContact O-N 3.25Å; R735-R737 PolarHBondContact O-N 2.95Å; R735-D739 IonicContact CZ-OD1 3.44Å; R735-D739 IonicContact NH1-OD1 3.38Å; R735-D739 PolarHBondContact NH1-OD1 3.01Å; R735-D739 IonicContact NH1-OD2 2.76Å; R735-D739 PolarHBondContact NH1-OD2 3.37Å; R735-D739 IonicContact NH2-OD1 2.85Å; R735-D881 IonicContact CZ-OD1 2.87Å; R735-D881 IonicContact NE-OD1 3.98Å; R735-D881 IonicContact NH2-OD1 3.78Å; R735-D881 PolarHBondContact NH2-OD1 3.42Å; R735-F884 HydrophobicContact CB-CD1 3.85Å; R735-F884 HydrophobicContact CB-CD2 3.8Å; R735-F884 HydrophobicContact CB-CE1 3.67Å; R735-F884 HydrophobicContact CB-CE2 3.6Å; R735-F884 HydrophobicContact CB-CG 3.92Å; R735-F884 HydrophobicContact CB-CZ 3.54Å; R735-F884 VanDerWaalsContact CD-CE2 3.5Å; R735-F884 HydrophobicContact CG-CB 4.1Å; R735-F884 HydrophobicContact CG-CD1 4.01Å; R735-F884 HydrophobicContact CG-CD2 3.43Å; R735-F884 VanDerWaalsContact CG-CD2 3.43Å; R735-F884 HydrophobicContact CG-CE1 4.29Å; R735-F884 HydrophobicContact CG-CE2 3.74Å; R735-F884 HydrophobicContact CG-CG 3.57Å; R735-F884 HydrophobicContact CG-CZ 4.16Å
736	L	82.5	Confident	80.3	Confident	84 Å²	84	41.9 Å²	41.9	44%	0.44	22%	0.223	S	C	.	.	H	α-helix	trans	-68.5	-18.2	176.7	-65.3	176.7	0	0	0	112.8	F258 A732 Y733 L734	F258-L736 HydrophobicContact CD2-CD1 4.47Å; F258-L736 HydrophobicContact CE2-CD1 3.87Å; F258-L736 HydrophobicContact CZ-CD1 4.24Å; A732-L736 PolarHBondContact O-N 2.97Å; Y733-L736 PolarHBondContact O-N 2.98Å; L734-L736 VanDerWaalsContact C-N 3.31Å; L734-L736 PolarHBondContact O-N 3.42Å
737	R	83.3	Confident	80	Confident	50 Å²	50	41 Å²	41	19%	0.189	22%	0.217	C	C	.	.	H	α-helix	trans	-114.2	-17	-178.2	-65.4	-70.1	177.8	62.7	0.9	114.1	L410 Y733 L734 R735 D739 E740 L741	L410-R737 HydrophobicContact CD1-CB 4.2Å; L410-R737 HydrophobicContact CD1-CG 4.13Å; L410-R737 HydrophobicContact CD2-CB 3.88Å; L410-R737 HydrophobicContact CD2-CG 4.26Å; Y733-R737 PolarHBondContact OH-NH1 3.46Å; L734-R737 CarbonylContact O-C 3.56Å; L734-R737 PolarHBondContact O-N 2.93Å; R735-R737 PolarHBondContact O-N 2.95Å; R737-D739 VanDerWaalsContact C-N 3.28Å; R737-D739 PolarHBondContact O-N 3.42Å; R737-E740 WeakPolarHBondContact CD-OE2 3.31Å; R737-E740 IonicContact NE-OE2 2.73Å; R737-E740 WeakPolarHBondContact O-CA 3.39Å; R737-E740 WeakPolarHBondContact O-CB 3.48Å; R737-E740 PolarHBondContact O-N 3.43Å; R737-L741 HydrophobicContact CB-CD1 4.48Å; R737-L741 WeakPolarHBondContact O-CG 3.4Å; R737-L741 PolarHBondContact O-N 2.83Å
738	V	80.4	Confident	79.9	Confident	16 Å²	16	44.2 Å²	44.2	10%	0.097	23%	0.232	C	C	.	.	H	α-helix	trans	-62	-34.7	-174.2	76	0	0	0	0	112.6	Y407 L734 E740 L741 M747	Y407-V738 HydrophobicContact CE1-CG2 4.15Å; L734-V738 WeakPolarHBondContact O-CB 3.4Å; L734-V738 PolarHBondContact O-N 3.37Å; V738-E740 PolarHBondContact O-N 3.39Å; V738-L741 PolarHBondContact O-N 2.84Å; V738-M747 HydrophobicContact CG2-CE 3.91Å
739	D	76.4	Confident	80	Confident	120 Å²	120	44 Å²	44	64%	0.642	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-13.6	175.8	-57	-40.8	0	0	0	113	R735 R737	R735-D739 IonicContact CZ-OD1 3.44Å; R735-D739 IonicContact NH1-OD1 3.38Å; R735-D739 PolarHBondContact NH1-OD1 3.01Å; R735-D739 IonicContact NH1-OD2 2.76Å; R735-D739 PolarHBondContact NH1-OD2 3.37Å; R735-D739 IonicContact NH2-OD1 2.85Å; R737-D739 VanDerWaalsContact C-N 3.28Å; R737-D739 PolarHBondContact O-N 3.42Å
740	E	78.9	Confident	80.1	Confident	91 Å²	91	43.7 Å²	43.7	43%	0.425	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-7	177.4	-53.6	-174	145.5	0	0	112.7	L379 R737 V738	L379-E740 HydrophobicContact CD1-CB 4.11Å; L379-E740 WeakPolarHBondContact CD1-OE2 3.39Å; R737-E740 WeakPolarHBondContact CD-OE2 3.31Å; R737-E740 IonicContact NE-OE2 2.73Å; R737-E740 WeakPolarHBondContact O-CA 3.39Å; R737-E740 WeakPolarHBondContact O-CB 3.48Å; R737-E740 PolarHBondContact O-N 3.43Å; V738-E740 PolarHBondContact O-N 3.39Å
741	L	78.1	Confident	80.2	Confident	36 Å²	36	43.8 Å²	43.8	19%	0.188	24%	0.237	C	C	.	.	S	Bend	trans	-112.2	147	-174.2	-64.5	175.2	0	0	0	111.1	V406 Y407 L410 R737 V738 N743	V406-L741 HydrophobicContact CG1-CB 4.09Å; V406-L741 HydrophobicContact CG1-CD1 4.28Å; V406-L741 HydrophobicContact CG1-CD2 3.81Å; V406-L741 HydrophobicContact CG1-CG 4.28Å; Y407-L741 HydrophobicContact CD1-CD1 3.62Å; Y407-L741 HydrophobicContact CE1-CB 4.02Å; Y407-L741 HydrophobicContact CE1-CD1 3.69Å; L410-L741 HydrophobicContact CB-CD1 4.34Å; L410-L741 HydrophobicContact CD1-CD1 4.37Å; L410-L741 HydrophobicContact CD2-CD1 4.02Å; L410-L741 HydrophobicContact CG-CD1 4.46Å; R737-L741 HydrophobicContact CB-CD1 4.48Å; R737-L741 WeakPolarHBondContact O-CG 3.4Å; R737-L741 PolarHBondContact O-N 2.83Å; V738-L741 PolarHBondContact O-N 2.84Å; L741-N743 PolarHBondContact O-N 3.26Å
742	P	74.8	Confident	80.1	Confident	73 Å²	73	44.2 Å²	44.2	47%	0.474	24%	0.243	S	C	.	.			trans	-61.4	134.3	171.4	26.6	-35.6	0	0	0	111	V406 Y407 T744	V406-P742 HydrophobicContact CG1-CG 4.09Å; V406-P742 HydrophobicContact CG2-CG 4.02Å; Y407-P742 PolarHBondContact OH-O 3.14Å; P742-T744 VanDerWaalsContact O-CG2 3.32Å; P742-T744 WeakPolarHBondContact O-CG2 3.4Å; P742-T744 PolarHBondContact O-N 3.05Å
743	N	67.3	Low	80.1	Confident	89 Å²	89	46.8 Å²	46.8	48%	0.476	26%	0.26	S	S	.	.			trans	-67.6	102.6	173.5	-81.3	2.4	0	0	0	110	L741	L741-N743 PolarHBondContact O-N 3.26Å
744	T	66.5	Low	79.9	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.006	26%	0.259	C	S	.	.			trans	-77.3	163.8	-175	83	0	0	0	0	111.8	E403 V406 Y407 P742 R746 M747	E403-T744 WeakPolarHBondContact O-CB 3.31Å; E403-T744 WeakPolarHBondContact O-CG2 3.44Å; V406-T744 HydrophobicContact CB-CG2 3.92Å; V406-T744 HydrophobicContact CG2-CG2 4.36Å; Y407-T744 HydrophobicContact CD2-CG2 3.94Å; Y407-T744 HydrophobicContact CE2-CG2 3.48Å; Y407-T744 VanDerWaalsContact CE2-CG2 3.48Å; Y407-T744 WeakPolarHBondContact CE2-OG1 3.18Å; P742-T744 VanDerWaalsContact O-CG2 3.32Å; P742-T744 WeakPolarHBondContact O-CG2 3.4Å; P742-T744 PolarHBondContact O-N 3.05Å; T744-R746 PolarHBondContact O-N 3.27Å; T744-R746 VanDerWaalsContact O-N 3.1Å; T744-M747 VanDerWaalsContact O-CB 3.27Å; T744-M747 WeakPolarHBondContact O-CB 3.39Å; T744-M747 PolarHBondContact O-N 2.72Å
745	G	68.6	Low	79.6	Confident	39 Å²	39	52 Å²	52	40%	0.402	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-51.4	-36.6	178.1	0	0	0	0	0	114.2	M747 N748	G745-M747 VanDerWaalsContact C-N 3.25Å; G745-M747 PolarHBondContact O-N 3.2Å; G745-N748 PolarHBondContact O-N 3.04Å
746	R	74.4	Confident	79.6	Confident	52 Å²	52	49.9 Å²	49.9	20%	0.196	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-63.3	-26.9	176.8	-65.7	-173.6	-175.6	161.7	5.2	114.1	N404 T744 V926	N404-R746 PolarHBondContact O-NH1 3.09Å; T744-R746 PolarHBondContact O-N 3.27Å; T744-R746 VanDerWaalsContact O-N 3.1Å; R746-V926 PolarHBondContact NH1-O 3.22Å
747	M	79.9	Confident	79.7	Confident	2 Å²	2	46 Å²	46	1%	0.01	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-75.3	-29.8	-179.8	-169.2	61.4	76	0	0	111.9	Y407 V738 T744 G745 V749 V876 D877 L880	Y407-M747 HydrophobicContact CE1-CE 4.22Å; Y407-M747 HydrophobicContact CE2-CE 3.72Å; Y407-M747 VanDerWaalsContact CZ-CE 3.49Å; Y407-M747 VanDerWaalsContact OH-CE 3.29Å; Y407-M747 WeakPolarHBondContact OH-CE 3.24Å; V738-M747 HydrophobicContact CG2-CE 3.91Å; T744-M747 VanDerWaalsContact O-CB 3.27Å; T744-M747 WeakPolarHBondContact O-CB 3.39Å; T744-M747 PolarHBondContact O-N 2.72Å; G745-M747 VanDerWaalsContact C-N 3.25Å; G745-M747 PolarHBondContact O-N 3.2Å; M747-V749 VanDerWaalsContact C-N 3.34Å; M747-V876 WeakPolarHBondContact O-CB 3.08Å; M747-V876 PolarHBondContact O-N 3.28Å; M747-V876 HydrophobicContact SD-CB 4.38Å; M747-V876 HydrophobicContact SD-CG1 4.03Å; M747-D877 HydrophobicContact CG-CB 3.73Å; M747-D877 PolarHBondContact O-N 2.98Å; M747-D877 HydrophobicContact SD-CB 3.88Å; M747-L880 HydrophobicContact CE-CD1 3.77Å; M747-L880 HydrophobicContact SD-CD1 3.6Å; M747-L880 VanDerWaalsContact SD-CD1 3.6Å
748	N	82.3	Confident	79.9	Confident	85 Å²	85	46.8 Å²	46.8	46%	0.455	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-89.9	5.1	-179.2	-54.2	-37.3	0	0	0	113	G745 T875	G745-N748 PolarHBondContact O-N 3.04Å; N748-T875 VanDerWaalsContact O-CG2 3.29Å; N748-T875 WeakPolarHBondContact O-CG2 3.25Å
749	V	85.3	Confident	80.1	Confident	34 Å²	34	46.8 Å²	46.8	21%	0.206	26%	0.262	C	S	.	.	S	Bend	trans	-70.3	134.2	176.1	173.8	0	0	0	0	109.3	M747 V754 T875 V876	M747-V749 VanDerWaalsContact C-N 3.34Å; V749-V754 HydrophobicContact CG1-CG2 4.3Å; V749-T875 WeakPolarHBondContact O-CA 3.37Å; V749-V876 PolarHBondContact O-N 3.33Å; V749-V876 VanDerWaalsContact O-N 3.13Å
750	P	88.6	Confident	80.3	Confident	51 Å²	51	45.3 Å²	45.3	33%	0.331	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-66.9	132.5	171.4	27.9	-33.9	0	0	0	110.3	G752 S753	P750-G752 PolarHBondContact O-N 3.39Å; P750-G752 VanDerWaalsContact O-N 3.09Å; P750-S753 WeakPolarHBondContact O-CB 2.98Å; P750-S753 PolarHBondContact O-N 3.04Å
751	I	89	Confident	80.3	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-57.5	-31.3	-173.4	-163.7	64.6	0	0	0	112.4	S753 V754 L757 F871 E874 V876 V879 M893 V917	I751-S753 PolarHBondContact O-N 3.48Å; I751-V754 HydrophobicContact CD1-CG2 4.39Å; I751-V754 WeakPolarHBondContact O-CB 3.29Å; I751-V754 PolarHBondContact O-N 2.88Å; I751-V754 VanDerWaalsContact O-N 3.08Å; I751-L757 HydrophobicContact CD1-CD1 3.61Å; I751-L757 HydrophobicContact CG1-CD1 3.65Å; I751-L757 WeakPolarHBondContact O-CD1 3.42Å; I751-F871 VanDerWaalsContact CG2-O 3.22Å; I751-F871 WeakPolarHBondContact CG2-O 3.45Å; I751-E874 WeakPolarHBondContact CB-O 3.48Å; I751-E874 VanDerWaalsContact CG2-O 3.3Å; I751-E874 WeakPolarHBondContact CG2-O 3.45Å; I751-E874 PolarHBondContact N-O 2.8Å; I751-V876 HydrophobicContact CD1-CG2 4.08Å; I751-V879 HydrophobicContact CB-CG2 4.06Å; I751-V879 HydrophobicContact CD1-CG1 4.31Å; I751-V879 HydrophobicContact CG1-CG1 4.45Å; I751-V879 HydrophobicContact CG1-CG2 4.14Å; I751-V879 HydrophobicContact CG2-CG2 4.18Å; I751-M893 HydrophobicContact CG2-SD 4.12Å; I751-V917 HydrophobicContact CD1-CG1 3.97Å; I751-V917 HydrophobicContact CD1-CG2 4.33Å; I751-V917 HydrophobicContact CG1-CG1 4.38Å; I751-V917 HydrophobicContact CG1-CG2 3.81Å
752	G	85.1	Confident	80.2	Confident	14 Å²	14	42.9 Å²	42.9	14%	0.144	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-69.6	-6.6	177.4	0	0	0	0	0	116.5	P750 R758 V872	P750-G752 PolarHBondContact O-N 3.39Å; P750-G752 VanDerWaalsContact O-N 3.09Å; G752-R758 PolarHBondContact O-NH2 2.87Å; G752-V872 VanDerWaalsContact CA-O 3.28Å; G752-V872 WeakPolarHBondContact CA-O 3.49Å; G752-V872 PolarHBondContact N-O 3.21Å
753	S	84.4	Confident	79.6	Confident	69 Å²	69	46.5 Å²	46.5	48%	0.483	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-95.1	-8	170.3	-64.7	0	0	0	0	113.3	P750 I751 H755	P750-S753 WeakPolarHBondContact O-CB 2.98Å; P750-S753 PolarHBondContact O-N 3.04Å; I751-S753 PolarHBondContact O-N 3.48Å; S753-H755 PolarHBondContact O-N 2.56Å
754	V	84.1	Confident	79.1	Confident	6 Å²	6	43.1 Å²	43.1	4%	0.036	25%	0.246	C	C	.	.	S	Bend	trans	-81.8	110.5	179.7	178.1	0	0	0	0	109.6	V749 I751 L757 T925	V749-V754 HydrophobicContact CG1-CG2 4.3Å; I751-V754 HydrophobicContact CD1-CG2 4.39Å; I751-V754 WeakPolarHBondContact O-CB 3.29Å; I751-V754 PolarHBondContact O-N 2.88Å; I751-V754 VanDerWaalsContact O-N 3.08Å; V754-L757 HydrophobicContact CB-CD1 3.69Å; V754-L757 HydrophobicContact CB-CG 4.22Å; V754-L757 HydrophobicContact CG1-CD1 3.86Å; V754-L757 HydrophobicContact CG1-CG 4.04Å; V754-L757 WeakPolarHBondContact O-CG 3.42Å; V754-T925 HydrophobicContact CG1-CG2 3.95Å; V754-T925 WeakPolarHBondContact CG1-OG1 3.46Å; V754-T925 HydrophobicContact CG2-CG2 3.78Å
755	H	79.9	Confident	78.2	Confident	121 Å²	121	46.5 Å²	46.5	56%	0.56	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	136.7	-178.1	-65.1	-54.3	0	0	0	113.7	S753	S753-H755 PolarHBondContact O-N 2.56Å
756	G	80.9	Confident	77.2	Confident	12 Å²	12	48.6 Å²	48.6	12%	0.124	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	97	9.1	177.9	0	0	0	0	0	113.6	E761 R762	G756-E761 WeakPolarHBondContact CA-OE2 3.09Å; G756-E761 PolarHBondContact N-OE2 2.92Å; G756-R762 WeakPolarHBondContact O-CG 3.45Å; G756-R762 PolarHBondContact O-NE 2.9Å; G756-R762 PolarHBondContact O-NH1 3.36Å; G756-R762 PolarHBondContact O-NH2 2.98Å
757	L	86.4	Confident	75.6	Confident	2 Å²	2	55 Å²	55	1%	0.01	30%	0.297	C	S	.	.			trans	-95.6	-32.7	179.2	-65.5	-172.1	0	0	0	113	I751 V754 E761 M893 G915 M916 V917 D921	I751-L757 HydrophobicContact CD1-CD1 3.61Å; I751-L757 HydrophobicContact CG1-CD1 3.65Å; I751-L757 WeakPolarHBondContact O-CD1 3.42Å; V754-L757 HydrophobicContact CB-CD1 3.69Å; V754-L757 HydrophobicContact CB-CG 4.22Å; V754-L757 HydrophobicContact CG1-CD1 3.86Å; V754-L757 HydrophobicContact CG1-CG 4.04Å; V754-L757 WeakPolarHBondContact O-CG 3.42Å; L757-E761 PolarHBondContact N-OE2 3.37Å; L757-M893 HydrophobicContact CB-CE 3.87Å; L757-G915 WeakPolarHBondContact O-CA 3.49Å; L757-M916 PolarHBondContact O-N 3Å; L757-V917 HydrophobicContact CD1-CG1 4.38Å; L757-V917 HydrophobicContact CD1-CG2 4.25Å; L757-V917 HydrophobicContact CD2-CG1 4.37Å; L757-D921 HydrophobicContact CD2-CB 3.47Å; L757-D921 VanDerWaalsContact CD2-CB 3.47Å
758	R	85.9	Confident	73.5	Confident	67 Å²	67	59.6 Å²	59.6	25%	0.253	33%	0.327	S	S	.	.	B	Isolated β-bridge	trans	-74.5	151.3	177.3	-53.3	-171.8	-178.3	-115.2	-1.8	110.6	G752 A760 E761 R762 M893 D895 V914	G752-R758 PolarHBondContact O-NH2 2.87Å; R758-A760 VanDerWaalsContact C-N 3.3Å; R758-A760 PolarHBondContact O-N 2.92Å; R758-E761 HydrophobicContact CB-CB 4.46Å; R758-E761 HydrophobicContact CB-CG 3.97Å; R758-E761 WeakPolarHBondContact CD-OE1 3.36Å; R758-E761 WeakPolarHBondContact CG-OE1 3.16Å; R758-E761 PolarHBondContact N-OE2 3.22Å; R758-E761 VanDerWaalsContact N-OE2 3.13Å; R758-E761 IonicContact NE-OE1 3.66Å; R758-E761 WeakPolarHBondContact O-CB 3.34Å; R758-E761 PolarHBondContact O-N 3.26Å; R758-R762 PolarHBondContact O-N 2.91Å; R758-M893 HydrophobicContact CG-CE 3.81Å; R758-D895 IonicContact NH1-OD2 3.09Å; R758-D895 PolarHBondContact NH1-OD2 2.74Å; R758-V914 CarbonylContact C-O 3.54Å; R758-V914 WeakPolarHBondContact CA-O 3.49Å; R758-V914 HydrophobicContact CB-CG1 4.32Å; R758-V914 HydrophobicContact CG-CG1 3.96Å
759	W	86	Confident	71.4	Confident	17 Å²	17	60.8 Å²	60.8	6%	0.064	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-57.7	-42.3	178.7	-54.4	129.4	0	0	0	112.4	E761 R762 I783 P784 V785 L806 P810 P913 V914 G915 M916	W759-E761 PolarHBondContact O-N 3.5Å; W759-R762 PolarHBondContact O-N 3.48Å; W759-R762 VanDerWaalsContact O-N 3.1Å; W759-I783 HydrophobicContact CG-CG2 4.21Å; W759-P784 HydrophobicContact CD2-CG 4.19Å; W759-P784 HydrophobicContact CE3-CG 3.56Å; W759-P784 HydrophobicContact CH2-CG 3.85Å; W759-P784 HydrophobicContact CZ2-CG 4.44Å; W759-P784 HydrophobicContact CZ3-CG 3.38Å; W759-V785 HydrophobicContact CZ2-CG2 3.81Å; W759-L806 HydrophobicContact CZ3-CD1 3.96Å; W759-L806 HydrophobicContact CZ3-CD2 4.33Å; W759-P810 HydrophobicContact CH2-CG 4.24Å; W759-P810 HydrophobicContact CZ2-CG 4.31Å; W759-P913 VanDerWaalsContact CD1-O 3.32Å; W759-P913 PolarHBondContact NE1-O 2.96Å; W759-V914 VanDerWaalsContact CD1-C 3.42Å; W759-V914 VanDerWaalsContact CD1-O 3.24Å; W759-V914 PolarHBondContact N-O 2.91Å; W759-G915 VanDerWaalsContact CE2-CA 3.48Å; W759-G915 VanDerWaalsContact CZ2-C 3.48Å; W759-G915 WeakPolarHBondContact CZ2-O 3.29Å; W759-M916 HydrophobicContact CH2-CB 3.48Å; W759-M916 VanDerWaalsContact CH2-CB 3.48Å; W759-M916 HydrophobicContact CZ2-CB 4.25Å; W759-M916 HydrophobicContact CZ3-CB 4Å
760	A	80.8	Confident	69	Low	88 Å²	88	66.7 Å²	66.7	73%	0.727	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-63.7	-18.8	177.1	0	0	0	0	0	114.5	R758 H763	R758-A760 VanDerWaalsContact C-N 3.3Å; R758-A760 PolarHBondContact O-N 2.92Å; A760-H763 PolarHBondContact O-CE1 3.4Å
761	E	78.8	Confident	66.5	Low	66 Å²	66	68.9 Å²	68.9	31%	0.308	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-94.2	-11	178.3	-60	164.5	-178.6	0	0	112.5	G756 L757 R758 W759	G756-E761 WeakPolarHBondContact CA-OE2 3.09Å; G756-E761 PolarHBondContact N-OE2 2.92Å; L757-E761 PolarHBondContact N-OE2 3.37Å; R758-E761 HydrophobicContact CB-CB 4.46Å; R758-E761 HydrophobicContact CB-CG 3.97Å; R758-E761 WeakPolarHBondContact CD-OE1 3.36Å; R758-E761 WeakPolarHBondContact CG-OE1 3.16Å; R758-E761 PolarHBondContact N-OE2 3.22Å; R758-E761 VanDerWaalsContact N-OE2 3.13Å; R758-E761 IonicContact NE-OE1 3.66Å; R758-E761 WeakPolarHBondContact O-CB 3.34Å; R758-E761 PolarHBondContact O-N 3.26Å; W759-E761 PolarHBondContact O-N 3.5Å
762	R	75	Confident	63.8	Low	11 Å²	11	78.8 Å²	78.8	4%	0.042	42%	0.423	C	S	.	.			trans	-103.2	106.7	177.9	-65.5	-169.9	-169.4	-92.9	8.9	109.9	G756 R758 W759 W802 M916 D921	G756-R762 WeakPolarHBondContact O-CG 3.45Å; G756-R762 PolarHBondContact O-NE 2.9Å; G756-R762 PolarHBondContact O-NH1 3.36Å; G756-R762 PolarHBondContact O-NH2 2.98Å; R758-R762 PolarHBondContact O-N 2.91Å; W759-R762 PolarHBondContact O-N 3.48Å; W759-R762 VanDerWaalsContact O-N 3.1Å; R762-W802 HydrophobicContact CB-CH2 4.24Å; R762-W802 HydrophobicContact CB-CZ3 3.76Å; R762-W802 WeakPolarHBondContact O-CH2 3.38Å; R762-M916 PolarHBondContact NH2-O 2.96Å; R762-D921 IonicContact CZ-OD1 3.47Å; R762-D921 IonicContact CZ-OD2 3.57Å; R762-D921 IonicContact NH1-OD1 3.56Å; R762-D921 PolarHBondContact NH1-OD1 3.22Å; R762-D921 IonicContact NH1-OD2 2.76Å; R762-D921 VanDerWaalsContact NH2-CG 3.3Å; R762-D921 IonicContact NH2-OD1 3.99Å; R762-D921 PolarHBondContact NH2-OD1 3.35Å; R762-D921 IonicContact NH2-OD2 3.67Å; R762-D921 PolarHBondContact NH2-OD2 3.43Å
763	H	63.4	Low	61.3	Low	149 Å²	149	83.3 Å²	83.3	69%	0.69	45%	0.448	S	S	*	.			trans	-95	133.3	173.1	-52.9	-39	0	0	0	110.5	A760 Q805	A760-H763 PolarHBondContact O-CE1 3.4Å; H763-Q805 PolarHBondContact O-NE2 2.85Å
764	T	56.7	Low	58.8	Low	18 Å²	18	86.1 Å²	86.1	11%	0.11	46%	0.463	C	S	.	.			trans	-73.9	164.7	165.3	81.6	0	0	0	0	109.8	K766 F780 W802	T764-K766 PolarHBondContact O-N 2.78Å; T764-K766 VanDerWaalsContact O-N 3.13Å; T764-K766 PolarHBondContact OG1-N 3.15Å; T764-K766 PolarHBondContact OG1-O 2.88Å; T764-F780 HydrophobicContact CG2-CE2 4.16Å; T764-F780 HydrophobicContact CG2-CZ 3.75Å; T764-W802 HydrophobicContact CG2-CD2 3.93Å; T764-W802 HydrophobicContact CG2-CE3 4.34Å; T764-W802 HydrophobicContact CG2-CG 4.41Å; T764-W802 HydrophobicContact CG2-CH2 4.31Å; T764-W802 HydrophobicContact CG2-CZ2 3.88Å
765	S	47	Very low	56.2	Low	71 Å²	71	90 Å²	90	50%	0.497	50%	0.496	S	S	.	.	S	Bend	trans	-67.3	-10.2	177.5	-172.7	0	0	0	0	113.6	S702	S702-S765 WeakPolarHBondContact CB-OG 3.39Å; S702-S765 PolarHBondContact OG-OG 3.4Å
766	K	46.7	Very low	54.1	Low	84 Å²	84	93.7 Å²	93.7	37%	0.365	51%	0.513	S	S	.	.			trans	-96.9	99.4	175.6	-63.2	176	-173.5	167.8	0	108.4	T764 N801	T764-K766 PolarHBondContact O-N 2.78Å; T764-K766 VanDerWaalsContact O-N 3.13Å; T764-K766 PolarHBondContact OG1-N 3.15Å; T764-K766 PolarHBondContact OG1-O 2.88Å; K766-N801 WeakPolarHBondContact CD-OD1 3.12Å; K766-N801 WeakPolarHBondContact CE-OD1 3.45Å; K766-N801 PolarHBondContact NZ-OD1 2.73Å
767	K	40.7	Very low	51.9	Low	186 Å²	186	97.5 Å²	97.5	81%	0.809	54%	0.537	S	S	*	.	P	Polyproline II helix	trans	-65.3	139.6	150	-84	-167.9	171.5	-170	0	107.3	T769	K767-T769 PolarHBondContact O-N 3.32Å
768	P	36.8	Very low	50.2	Low	99 Å²	99	100.5 Å²	100.5	64%	0.643	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-61.3	120.4	164.1	27.4	-32.1	0	0	0	107.9
769	T	38.7	Very low	48.6	Very low	109 Å²	109	106.6 Å²	106.6	67%	0.669	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-89.1	126.7	163.6	46.1	0	0	0	0	107.5	K767 T771	K767-T769 PolarHBondContact O-N 3.32Å; T769-T771 PolarHBondContact O-N 3.3Å
770	D	34.6	Very low	47.4	Very low	159 Å²	159	109.2 Å²	109.2	85%	0.85	60%	0.596	S	S	*	*			trans	-70.1	71.9	-176.3	-67.6	-69.7	0	0	0	113.2
771	T	35.5	Very low	46.8	Very low	97 Å²	97	109.2 Å²	109.2	60%	0.595	58%	0.577	S	S	*	*			trans	-105.5	93.8	172.1	52.5	0	0	0	0	109.7	T769 T773	T769-T771 PolarHBondContact O-N 3.3Å; T771-T773 VanDerWaalsContact C-N 3.27Å; T771-T773 PolarHBondContact O-N 2.92Å
772	K	32.1	Very low	46.6	Very low	209 Å²	209	113 Å²	113	91%	0.909	60%	0.595	S	S	*	*			trans	-73.5	73.4	176.8	-66.4	177.6	-179.5	172.1	0	111.5
773	T	32	Very low	47	Very low	109 Å²	109	116.6 Å²	116.6	67%	0.669	61%	0.614	S	S	*	*			trans	-140.8	134.3	179.3	29.8	0	0	0	0	111.7	T771	T771-T773 VanDerWaalsContact C-N 3.27Å; T771-T773 PolarHBondContact O-N 2.92Å
774	T	32.5	Very low	48.1	Very low	128 Å²	128	109.5 Å²	109.5	79%	0.785	58%	0.581	S	S	*	*	S	Bend	trans	57.9	140.7	178.6	49.5	0	0	0	0	117.6
775	A	29.7	Very low	49.7	Very low	88 Å²	88	109.3 Å²	109.3	73%	0.727	58%	0.579	S	S	*	*	S	Bend	trans	-87	171.5	-168.4	0	0	0	0	0	113.3	C777	A775-C777 PolarHBondContact O-N 3.42Å
776	E	35.4	Very low	51.8	Low	199 Å²	199	106 Å²	106	93%	0.93	56%	0.557	S	S	*	*	S	Bend	trans	58.7	-10.7	171.7	-54.2	-157.6	146.2	0	0	118.4	L778	E776-L778 VanDerWaalsContact C-N 3.31Å; E776-L778 PolarHBondContact O-N 2.96Å
777	C	35.7	Very low	53.8	Low	91 Å²	91	104.6 Å²	104.6	62%	0.615	55%	0.551	S	S	*	*	S	Bend	trans	-76.8	74	-175.2	-156.8	0	0	0	0	113.8	A775	A775-C777 PolarHBondContact O-N 3.42Å
778	L	50.7	Low	56.2	Low	65 Å²	65	96.6 Å²	96.6	34%	0.34	52%	0.518	S	S	.	.			trans	52.8	80.2	154.3	-62.6	168.3	0	0	0	116.1	Y478 E776 F780 H797	Y478-L778 HydrophobicContact CD1-CD1 4.48Å; Y478-L778 HydrophobicContact CE1-CD1 3.71Å; E776-L778 VanDerWaalsContact C-N 3.31Å; E776-L778 PolarHBondContact O-N 2.96Å; L778-F780 PolarHBondContact O-N 3.48Å; L778-H797 WeakPolarHBondContact CD1-NE2 3.48Å; L778-H797 VanDerWaalsContact CD2-CD2 3.49Å; L778-H797 WeakPolarHBondContact CD2-CD2 3.42Å
779	Q	52.4	Low	58.7	Low	195 Å²	195	97.2 Å²	97.2	91%	0.911	52%	0.516	S	S	*	.			trans	-51.3	124.8	172.6	-170.5	173.1	7.9	0	0	112	R781	Q779-R781 PolarHBondContact O-N 3.14Å
780	F	60.2	Low	61.2	Low	72 Å²	72	93.4 Å²	93.4	32%	0.316	49%	0.492	S	S	.	.			trans	-64.6	124	-177.4	175.4	-95.5	0	0	0	111.6	T764 L778 E782 N801	T764-F780 HydrophobicContact CG2-CE2 4.16Å; T764-F780 HydrophobicContact CG2-CZ 3.75Å; L778-F780 PolarHBondContact O-N 3.48Å; F780-E782 HydrophobicContact CD1-CG 4.11Å; F780-E782 HydrophobicContact CE1-CG 4.16Å; F780-E782 PolarHBondContact O-N 2.81Å; F780-N801 HydrophobicContact CE2-CB 4.15Å
781	R	69	Low	63.9	Low	89 Å²	89	91 Å²	91	34%	0.336	47%	0.47	S	S	.	.			trans	-88.2	103.7	-179.8	-157.7	-175	-175.2	135.5	-13.3	110.3	Q779 I783 V785 D790 V798 W802	Q779-R781 PolarHBondContact O-N 3.14Å; R781-I783 WeakPolarHBondContact CG-O 3.38Å; R781-I783 PolarHBondContact O-N 2.95Å; R781-V785 PolarHBondContact NE-O 2.87Å; R781-V785 PolarHBondContact NH2-O 3.37Å; R781-D790 IonicContact CZ-OD2 3.8Å; R781-D790 VanDerWaalsContact NH1-CG 3.34Å; R781-D790 IonicContact NH1-OD1 3.28Å; R781-D790 PolarHBondContact NH1-OD1 3.25Å; R781-D790 IonicContact NH1-OD2 3.63Å; R781-D790 PolarHBondContact NH1-OD2 3.12Å; R781-D790 IonicContact NH2-OD1 3.07Å; R781-D790 IonicContact NH2-OD2 3.62Å; R781-D790 PolarHBondContact NH2-OD2 2.83Å; R781-V798 HydrophobicContact CB-CG2 4.11Å; R781-W802 PolarHBondContact O-NE1 3.26Å
782	E	73.2	Confident	66.5	Low	146 Å²	146	86.3 Å²	86.3	68%	0.682	44%	0.442	S	S	*	.	S	Bend	trans	-64	-22.8	-178.6	-59.4	-172.4	146.5	0	0	114.3	F780 W802	F780-E782 HydrophobicContact CD1-CG 4.11Å; F780-E782 HydrophobicContact CE1-CG 4.16Å; F780-E782 PolarHBondContact O-N 2.81Å; E782-W802 VanDerWaalsContact O-CZ2 3.29Å; E782-W802 WeakPolarHBondContact O-CZ2 3.48Å
783	I	83.7	Confident	69.1	Low	86 Å²	86	79.9 Å²	79.9	44%	0.441	41%	0.412	S	S	.	.	S	Bend	trans	-115.3	119	177.8	-58.7	178.5	0	0	0	108.7	W759 R781 V785	W759-I783 HydrophobicContact CG-CG2 4.21Å; R781-I783 WeakPolarHBondContact CG-O 3.38Å; R781-I783 PolarHBondContact O-N 2.95Å; I783-V785 HydrophobicContact CG2-CB 3.92Å; I783-V785 HydrophobicContact CG2-CG2 3.65Å; I783-V785 PolarHBondContact O-N 2.87Å
784	P	87.6	Confident	71.8	Confident	0 Å²	0	76.5 Å²	76.5	0%	0	39%	0.39	C	S	.	.			trans	-79.3	34.1	-175.6	33.6	-36.3	0	0	0	113.4	W759 V798 W802 L806 L809 P810	W759-P784 HydrophobicContact CD2-CG 4.19Å; W759-P784 HydrophobicContact CE3-CG 3.56Å; W759-P784 HydrophobicContact CH2-CG 3.85Å; W759-P784 HydrophobicContact CZ2-CG 4.44Å; W759-P784 HydrophobicContact CZ3-CG 3.38Å; P784-V798 HydrophobicContact CB-CG1 3.9Å; P784-W802 HydrophobicContact CB-CB 4.35Å; P784-W802 HydrophobicContact CB-CD2 3.72Å; P784-W802 HydrophobicContact CB-CE3 4.28Å; P784-W802 HydrophobicContact CB-CG 3.74Å; P784-W802 HydrophobicContact CG-CD2 3.84Å; P784-W802 HydrophobicContact CG-CE3 3.92Å; P784-W802 HydrophobicContact CG-CG 4.36Å; P784-W802 HydrophobicContact CG-CH2 4.3Å; P784-W802 HydrophobicContact CG-CZ2 4.23Å; P784-W802 HydrophobicContact CG-CZ3 4.15Å; P784-L806 HydrophobicContact CB-CD1 3.87Å; P784-L806 HydrophobicContact CG-CD1 3.59Å; P784-L809 HydrophobicContact CB-CD2 4.12Å; P784-P810 WeakPolarHBondContact O-CD 3.42Å
785	V	88.6	Confident	74.5	Confident	13 Å²	13	70.4 Å²	70.4	8%	0.079	35%	0.352	C	S	.	.			trans	-104.5	121	179.6	176.7	0	0	0	0	108.6	W759 R781 I783 P810 V812 P913	W759-V785 HydrophobicContact CZ2-CG2 3.81Å; R781-V785 PolarHBondContact NE-O 2.87Å; R781-V785 PolarHBondContact NH2-O 3.37Å; I783-V785 HydrophobicContact CG2-CB 3.92Å; I783-V785 HydrophobicContact CG2-CG2 3.65Å; I783-V785 PolarHBondContact O-N 2.87Å; V785-P810 HydrophobicContact CG2-CG 3.87Å; V785-V812 HydrophobicContact CG1-CB 4.15Å; V785-V812 HydrophobicContact CG1-CG2 3.82Å; V785-P913 HydrophobicContact CB-CG 4.44Å; V785-P913 HydrophobicContact CG1-CG 4.03Å; V785-P913 HydrophobicContact CG2-CB 4.38Å; V785-P913 HydrophobicContact CG2-CG 3.75Å
786	L	91.3	Very high	77.2	Confident	3 Å²	3	66.2 Å²	66.2	2%	0.016	32%	0.318	C	S	.	.	B	Isolated β-bridge	trans	-94.1	157.9	-177.6	-64.9	161.2	0	0	0	111.5	D790 A795 V798 L809 P810 V811 V812 I829 I851	L786-D790 WeakPolarHBondContact CA-OD2 3.19Å; L786-D790 HydrophobicContact CD2-CB 4.29Å; L786-A795 HydrophobicContact CD1-CB 4.16Å; L786-A795 HydrophobicContact CD2-CB 4.43Å; L786-V798 HydrophobicContact CD2-CG2 4.24Å; L786-L809 HydrophobicContact CD1-CB 3.67Å; L786-L809 HydrophobicContact CD1-CD1 3.64Å; L786-L809 HydrophobicContact CD1-CG 4.33Å; L786-L809 HydrophobicContact CG-CD1 4.43Å; L786-P810 PolarHBondContact N-O 3.31Å; L786-V811 HydrophobicContact CB-CB 4.45Å; L786-V811 HydrophobicContact CB-CG1 4.09Å; L786-V811 HydrophobicContact CB-CG2 4.2Å; L786-V811 HydrophobicContact CD1-CG2 4.5Å; L786-V811 WeakPolarHBondContact O-CA 3.42Å; L786-V811 WeakPolarHBondContact O-CG1 3.44Å; L786-V812 PolarHBondContact O-N 3.47Å; L786-I829 HydrophobicContact CD1-CD1 3.78Å; L786-I851 HydrophobicContact CB-CD1 4.19Å; L786-I851 HydrophobicContact CD1-CD1 3.97Å; L786-I851 HydrophobicContact CD2-CD1 4.03Å; L786-I851 HydrophobicContact CG-CD1 4.29Å
787	H	90.1	Very high	79.4	Confident	54 Å²	54	57.4 Å²	57.4	25%	0.25	28%	0.276	C	S	.	.			trans	-105.3	150.5	167.6	-167.4	-111.6	0	0	0	109.4	N789 D790 V812 H813	H787-N789 PolarHBondContact O-N 3.31Å; H787-N789 VanDerWaalsContact O-N 3.09Å; H787-D790 PolarHBondContact N-OD2 3.37Å; H787-D790 WeakPolarHBondContact O-CB 3.4Å; H787-D790 PolarHBondContact O-N 3.13Å; H787-V812 PolarHBondContact CD2-O 3.34Å; H787-H813 AromaticContact NE2-CD2 3.77Å
788	P	90.3	Very high	81.7	Confident	18 Å²	18	53.4 Å²	53.4	12%	0.117	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.7	178	-27.1	36.6	0	0	0	114.8	V811 H813 I851 S852	P788-V811 HydrophobicContact CG-CG1 4.14Å; P788-H813 HydrophobicContact CG-CB 4.04Å; P788-I851 CarbonylContact O-C 3.58Å; P788-I851 PolarHBondContact O-N 2.93Å; P788-S852 PolarHBondContact O-N 3.42Å
789	N	90.3	Very high	83	Confident	111 Å²	111	50.5 Å²	50.5	59%	0.594	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-4.8	178.5	-57.2	-10.8	0	0	0	113.8	H787	H787-N789 PolarHBondContact O-N 3.31Å; H787-N789 VanDerWaalsContact O-N 3.09Å
790	D	91.3	Very high	84	Confident	30 Å²	30	41.8 Å²	41.8	16%	0.16	19%	0.194	C	C	.	.	S	Bend	trans	-64.7	148.7	171	-67.5	-25.4	0	0	0	109.3	R781 L786 H787 I851	R781-D790 IonicContact CZ-OD2 3.8Å; R781-D790 VanDerWaalsContact NH1-CG 3.34Å; R781-D790 IonicContact NH1-OD1 3.28Å; R781-D790 PolarHBondContact NH1-OD1 3.25Å; R781-D790 IonicContact NH1-OD2 3.63Å; R781-D790 PolarHBondContact NH1-OD2 3.12Å; R781-D790 IonicContact NH2-OD1 3.07Å; R781-D790 IonicContact NH2-OD2 3.62Å; R781-D790 PolarHBondContact NH2-OD2 2.83Å; L786-D790 WeakPolarHBondContact CA-OD2 3.19Å; L786-D790 HydrophobicContact CD2-CB 4.29Å; H787-D790 PolarHBondContact N-OD2 3.37Å; H787-D790 WeakPolarHBondContact O-CB 3.4Å; H787-D790 PolarHBondContact O-N 3.13Å; D790-I851 HydrophobicContact CB-CD1 3.71Å; D790-I851 WeakPolarHBondContact O-CB 3.47Å; D790-I851 WeakPolarHBondContact O-CD1 3.48Å; D790-I851 VanDerWaalsContact O-CG1 3.24Å; D790-I851 WeakPolarHBondContact O-CG1 3.41Å; D790-I851 PolarHBondContact O-N 3.26Å
791	R	90.8	Very high	84.7	Confident	107 Å²	107	39.2 Å²	39.2	40%	0.404	18%	0.184	S	C	.	.	B	Isolated β-bridge	trans	-85.2	156.9	-175.7	-52.2	179.1	-173.9	-166.6	1.6	111.6	R793 D794 A795 E849	R791-R793 VanDerWaalsContact C-N 3.26Å; R791-R793 HydrophobicContact CB-CG 4.14Å; R791-R793 PolarHBondContact O-N 2.99Å; R791-D794 VanDerWaalsContact CB-OD2 3.22Å; R791-D794 WeakPolarHBondContact CB-OD2 3.22Å; R791-D794 WeakPolarHBondContact CG-OD2 3.42Å; R791-D794 PolarHBondContact N-OD2 2.73Å; R791-D794 WeakPolarHBondContact O-CA 3.47Å; R791-D794 WeakPolarHBondContact O-CB 3.46Å; R791-D794 PolarHBondContact O-N 3.2Å; R791-A795 PolarHBondContact O-N 2.98Å; R791-E849 WeakPolarHBondContact CA-O 3.22Å
792	V	90.7	Very high	85.1	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-55.1	-37.9	176.8	167.5	0	0	0	0	112.8	A795 L796 L834 F837 I838 V846 L847 E849 I854	V792-A795 WeakPolarHBondContact O-CB 3.49Å; V792-A795 PolarHBondContact O-N 3.09Å; V792-L796 PolarHBondContact O-N 2.99Å; V792-L834 HydrophobicContact CG1-CD2 3.87Å; V792-F837 HydrophobicContact CG2-CD1 3.96Å; V792-F837 HydrophobicContact CG2-CE1 3.78Å; V792-I838 HydrophobicContact CG1-CD1 4.25Å; V792-I838 HydrophobicContact CG1-CG1 4.02Å; V792-V846 WeakPolarHBondContact CB-O 3.3Å; V792-L847 HydrophobicContact CG1-CD2 3.96Å; V792-E849 WeakPolarHBondContact CG2-O 3.23Å; V792-E849 PolarHBondContact N-O 3.41Å; V792-I854 HydrophobicContact CG2-CD1 4.05Å
793	R	86.5	Confident	84.9	Confident	73 Å²	73	29 Å²	29	28%	0.275	14%	0.14	S	C	.	.	H	α-helix	trans	-62	-42.8	172.4	73.9	-160.3	-167.6	168.8	19.1	112.2	R791 A795 L796 H797 L847 N848	R791-R793 VanDerWaalsContact C-N 3.26Å; R791-R793 HydrophobicContact CB-CG 4.14Å; R791-R793 PolarHBondContact O-N 2.99Å; R793-A795 VanDerWaalsContact C-N 3.29Å; R793-A795 PolarHBondContact O-N 2.92Å; R793-L796 CarbonylContact O-C 3.57Å; R793-L796 WeakPolarHBondContact O-CA 3.48Å; R793-L796 WeakPolarHBondContact O-CB 3.39Å; R793-L796 PolarHBondContact O-N 3.15Å; R793-L796 VanDerWaalsContact O-N 3.07Å; R793-H797 PolarHBondContact O-CD2 3.35Å; R793-H797 PolarHBondContact O-N 3.03Å; R793-H797 PolarHBondContact O-NE2 2.92Å; R793-L847 HydrophobicContact CB-CB 4.17Å; R793-L847 WeakPolarHBondContact CB-O 3.44Å; R793-L847 WeakPolarHBondContact CG-O 3.36Å; R793-L847 PolarHBondContact N-O 3.27Å; R793-N848 PolarHBondContact NH1-OD1 3.13Å
794	D	87.7	Confident	84.1	Confident	38 Å²	38	25.8 Å²	25.8	20%	0.203	13%	0.125	C	C	.	.	H	α-helix	trans	-66.9	-38	-178.4	-44.7	-33	0	0	0	109.4	R791 H797 V798	R791-D794 VanDerWaalsContact CB-OD2 3.22Å; R791-D794 WeakPolarHBondContact CB-OD2 3.22Å; R791-D794 WeakPolarHBondContact CG-OD2 3.42Å; R791-D794 PolarHBondContact N-OD2 2.73Å; R791-D794 WeakPolarHBondContact O-CA 3.47Å; R791-D794 WeakPolarHBondContact O-CB 3.46Å; R791-D794 PolarHBondContact O-N 3.2Å; D794-H797 PolarHBondContact O-N 2.76Å; D794-V798 WeakPolarHBondContact O-CG2 3.46Å; D794-V798 PolarHBondContact O-N 3.35Å
795	A	89	Confident	83.3	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.9	-43.5	169.8	0	0	0	0	0	112.5	L786 R791 V792 R793 H797 V798 L799 L834 I851	L786-A795 HydrophobicContact CD1-CB 4.16Å; L786-A795 HydrophobicContact CD2-CB 4.43Å; R791-A795 PolarHBondContact O-N 2.98Å; V792-A795 WeakPolarHBondContact O-CB 3.49Å; V792-A795 PolarHBondContact O-N 3.09Å; R793-A795 VanDerWaalsContact C-N 3.29Å; R793-A795 PolarHBondContact O-N 2.92Å; A795-H797 VanDerWaalsContact C-N 3.33Å; A795-H797 PolarHBondContact O-N 3.25Å; A795-V798 PolarHBondContact O-N 3.41Å; A795-L799 WeakPolarHBondContact O-CB 3.47Å; A795-L799 PolarHBondContact O-N 3.29Å; A795-L834 HydrophobicContact CB-CD1 4.04Å; A795-L834 HydrophobicContact CB-CD2 4.1Å; A795-I851 HydrophobicContact CB-CD1 3.68Å; A795-I851 HydrophobicContact CB-CG1 4.24Å
796	L	86.2	Confident	83	Confident	0 Å²	0	28 Å²	28	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.9	-37.3	176	-173.7	62	0	0	0	112	L470 I473 V792 R793 L799 T800	L470-L796 HydrophobicContact CB-CD1 4.25Å; L470-L796 HydrophobicContact CD2-CD1 4.05Å; I473-L796 HydrophobicContact CG2-CD2 4.41Å; V792-L796 PolarHBondContact O-N 2.99Å; R793-L796 CarbonylContact O-C 3.57Å; R793-L796 WeakPolarHBondContact O-CA 3.48Å; R793-L796 WeakPolarHBondContact O-CB 3.39Å; R793-L796 PolarHBondContact O-N 3.15Å; R793-L796 VanDerWaalsContact O-N 3.07Å; L796-L799 PolarHBondContact O-N 2.83Å; L796-T800 WeakPolarHBondContact O-CB 3.1Å; L796-T800 WeakPolarHBondContact O-CG2 3.21Å; L796-T800 PolarHBondContact O-N 3.29Å; L796-T800 PolarHBondContact O-OG1 3.47Å
797	H	81.3	Confident	82.5	Confident	14 Å²	14	29.4 Å²	29.4	7%	0.065	14%	0.144	C	C	.	.	H	α-helix	trans	-70.5	-38.8	175.5	-59.2	-35.4	0	0	0	112.5	H477 Y478 L778 R793 D794 A795 T800 N801	H477-H797 AromaticContact CE1-CE1 3.77Å; H477-H797 AromaticContact CE1-NE2 3.81Å; H477-H797 AromaticContact ND1-CE1 3.62Å; Y478-H797 AromaticContact CE1-CE1 3.68Å; Y478-H797 AromaticContact CE1-ND1 3.56Å; Y478-H797 AromaticContact CE2-ND1 3.92Å; Y478-H797 AromaticContact CZ-CE1 3.77Å; Y478-H797 AromaticContact CZ-ND1 3.2Å; Y478-H797 PolarHBondContact OH-ND1 2.94Å; L778-H797 WeakPolarHBondContact CD1-NE2 3.48Å; L778-H797 VanDerWaalsContact CD2-CD2 3.49Å; L778-H797 WeakPolarHBondContact CD2-CD2 3.42Å; R793-H797 PolarHBondContact O-CD2 3.35Å; R793-H797 PolarHBondContact O-N 3.03Å; R793-H797 PolarHBondContact O-NE2 2.92Å; D794-H797 PolarHBondContact O-N 2.76Å; A795-H797 VanDerWaalsContact C-N 3.33Å; A795-H797 PolarHBondContact O-N 3.25Å; H797-T800 PolarHBondContact O-OG1 2.97Å; H797-N801 PolarHBondContact O-ND2 2.87Å
798	V	84.1	Confident	82.4	Confident	8 Å²	8	27.4 Å²	27.4	5%	0.048	14%	0.136	C	C	.	.	H	α-helix	trans	-66.6	-45.5	170.2	176.7	0	0	0	0	110.1	R781 P784 L786 D794 A795 N801 W802 L809	R781-V798 HydrophobicContact CB-CG2 4.11Å; P784-V798 HydrophobicContact CB-CG1 3.9Å; L786-V798 HydrophobicContact CD2-CG2 4.24Å; D794-V798 WeakPolarHBondContact O-CG2 3.46Å; D794-V798 PolarHBondContact O-N 3.35Å; A795-V798 PolarHBondContact O-N 3.41Å; V798-N801 PolarHBondContact O-N 3.12Å; V798-W802 WeakPolarHBondContact O-CB 3.26Å; V798-W802 VanDerWaalsContact O-CD1 3.29Å; V798-W802 PolarHBondContact O-N 2.84Å; V798-L809 HydrophobicContact CB-CD1 3.87Å; V798-L809 HydrophobicContact CG1-CD1 3.63Å; V798-L809 HydrophobicContact CG1-CD2 3.87Å; V798-L809 HydrophobicContact CG1-CG 4.41Å
799	L	78.4	Confident	82.4	Confident	4 Å²	4	26.8 Å²	26.8	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-62.7	-48.8	-174.8	-175.9	143	0	0	0	111.6	L470 A795 L796 N801 W802 L803 L809 P831 L834	L470-L799 HydrophobicContact CB-CD2 3.84Å; L470-L799 HydrophobicContact CD1-CD1 3.72Å; L470-L799 HydrophobicContact CD1-CD2 3.56Å; L470-L799 HydrophobicContact CD1-CG 4.32Å; L470-L799 HydrophobicContact CG-CD2 4.38Å; A795-L799 WeakPolarHBondContact O-CB 3.47Å; A795-L799 PolarHBondContact O-N 3.29Å; L796-L799 PolarHBondContact O-N 2.83Å; L799-N801 PolarHBondContact O-N 3.24Å; L799-W802 PolarHBondContact O-N 2.86Å; L799-W802 VanDerWaalsContact O-N 3.13Å; L799-L803 HydrophobicContact CD2-CD1 3.48Å; L799-L803 VanDerWaalsContact CD2-CD1 3.48Å; L799-L803 HydrophobicContact CD2-CD2 4.03Å; L799-L803 HydrophobicContact CD2-CG 3.49Å; L799-L803 VanDerWaalsContact CD2-CG 3.49Å; L799-L803 HydrophobicContact CG-CD1 4.39Å; L799-L803 HydrophobicContact CG-CD2 4.21Å; L799-L803 HydrophobicContact CG-CG 3.85Å; L799-L803 WeakPolarHBondContact O-CA 3.2Å; L799-L803 WeakPolarHBondContact O-CB 3.29Å; L799-L803 VanDerWaalsContact O-CG 3.28Å; L799-L803 WeakPolarHBondContact O-CG 3.3Å; L799-L803 PolarHBondContact O-N 3.26Å; L799-L809 HydrophobicContact CB-CD1 3.85Å; L799-L809 HydrophobicContact CB-CG 4.5Å; L799-P831 HydrophobicContact CD1-CG 4.43Å; L799-L834 HydrophobicContact CD1-CD1 3.71Å
800	T	72.8	Confident	82.4	Confident	12 Å²	12	21.5 Å²	21.5	7%	0.074	10%	0.103	C	C	.	.	H	α-helix	trans	-57.8	-31.9	176.5	44.7	0	0	0	0	113.7	L796 H797	L796-T800 WeakPolarHBondContact O-CB 3.1Å; L796-T800 WeakPolarHBondContact O-CG2 3.21Å; L796-T800 PolarHBondContact O-N 3.29Å; L796-T800 PolarHBondContact O-OG1 3.47Å; H797-T800 PolarHBondContact O-OG1 2.97Å
801	N	75.5	Confident	82.4	Confident	18 Å²	18	20.1 Å²	20.1	10%	0.096	10%	0.096	C	C	.	.	H	α-helix	trans	-81.9	-27.6	177.4	-71.6	-60.5	0	0	0	114	K766 F780 H797 V798 L799	K766-N801 WeakPolarHBondContact CD-OD1 3.12Å; K766-N801 WeakPolarHBondContact CE-OD1 3.45Å; K766-N801 PolarHBondContact NZ-OD1 2.73Å; F780-N801 HydrophobicContact CE2-CB 4.15Å; H797-N801 PolarHBondContact O-ND2 2.87Å; V798-N801 PolarHBondContact O-N 3.12Å; L799-N801 PolarHBondContact O-N 3.24Å
802	W	78.2	Confident	82.3	Confident	4 Å²	4	15 Å²	15	2%	0.015	8%	0.077	C	C	.	.	H	α-helix	trans	-110.7	-14	-172.1	-73.4	93.4	0	0	0	115	R762 T764 R781 E782 P784 V798 L799 P804 Q805 L806 L809	R762-W802 HydrophobicContact CB-CH2 4.24Å; R762-W802 HydrophobicContact CB-CZ3 3.76Å; R762-W802 WeakPolarHBondContact O-CH2 3.38Å; T764-W802 HydrophobicContact CG2-CD2 3.93Å; T764-W802 HydrophobicContact CG2-CE3 4.34Å; T764-W802 HydrophobicContact CG2-CG 4.41Å; T764-W802 HydrophobicContact CG2-CH2 4.31Å; T764-W802 HydrophobicContact CG2-CZ2 3.88Å; R781-W802 PolarHBondContact O-NE1 3.26Å; E782-W802 VanDerWaalsContact O-CZ2 3.29Å; E782-W802 WeakPolarHBondContact O-CZ2 3.48Å; P784-W802 HydrophobicContact CB-CB 4.35Å; P784-W802 HydrophobicContact CB-CD2 3.72Å; P784-W802 HydrophobicContact CB-CE3 4.28Å; P784-W802 HydrophobicContact CB-CG 3.74Å; P784-W802 HydrophobicContact CG-CD2 3.84Å; P784-W802 HydrophobicContact CG-CE3 3.92Å; P784-W802 HydrophobicContact CG-CG 4.36Å; P784-W802 HydrophobicContact CG-CH2 4.3Å; P784-W802 HydrophobicContact CG-CZ2 4.23Å; P784-W802 HydrophobicContact CG-CZ3 4.15Å; V798-W802 WeakPolarHBondContact O-CB 3.26Å; V798-W802 VanDerWaalsContact O-CD1 3.29Å; V798-W802 PolarHBondContact O-N 2.84Å; L799-W802 PolarHBondContact O-N 2.86Å; L799-W802 VanDerWaalsContact O-N 3.13Å; W802-P804 VanDerWaalsContact C-N 3.34Å; W802-Q805 PolarHBondContact O-N 3.31Å; W802-L806 HydrophobicContact CB-CD1 4.1Å; W802-L806 HydrophobicContact CB-CG 4.48Å; W802-L806 HydrophobicContact CD2-CD1 4.32Å; W802-L806 HydrophobicContact CE3-CD1 3.82Å; W802-L806 HydrophobicContact CE3-CG 4.24Å; W802-L806 HydrophobicContact CG-CD1 4.48Å; W802-L806 PolarHBondContact O-N 2.84Å; W802-L809 HydrophobicContact CB-CD2 4.4Å
803	L	68.3	Low	82	Confident	16 Å²	16	18.1 Å²	18.1	8%	0.084	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-42.9	-46	176.5	-104	-177.4	0	0	0	114.7	E467 L799 Q805 P831	E467-L803 HydrophobicContact CB-CD1 4.04Å; E467-L803 HydrophobicContact CB-CD2 3.65Å; E467-L803 HydrophobicContact CB-CG 4.46Å; E467-L803 HydrophobicContact CG-CD2 3.6Å; E467-L803 WeakPolarHBondContact O-CD1 3.37Å; L799-L803 HydrophobicContact CD2-CD1 3.48Å; L799-L803 VanDerWaalsContact CD2-CD1 3.48Å; L799-L803 HydrophobicContact CD2-CD2 4.03Å; L799-L803 HydrophobicContact CD2-CG 3.49Å; L799-L803 VanDerWaalsContact CD2-CG 3.49Å; L799-L803 HydrophobicContact CG-CD1 4.39Å; L799-L803 HydrophobicContact CG-CD2 4.21Å; L799-L803 HydrophobicContact CG-CG 3.85Å; L799-L803 WeakPolarHBondContact O-CA 3.2Å; L799-L803 WeakPolarHBondContact O-CB 3.29Å; L799-L803 VanDerWaalsContact O-CG 3.28Å; L799-L803 WeakPolarHBondContact O-CG 3.3Å; L799-L803 PolarHBondContact O-N 3.26Å; L803-Q805 PolarHBondContact O-N 3.3Å; L803-P831 HydrophobicContact CD2-CG 3.92Å
804	P	67.4	Low	81.8	Confident	19 Å²	19	16.4 Å²	16.4	12%	0.123	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-1.1	-175.3	-15.5	30	0	0	0	114.1	S706 L707 W802	S706-P804 PolarHBondContact OG-O 3.12Å; L707-P804 HydrophobicContact CD2-CB 4.12Å; L707-P804 HydrophobicContact CD2-CG 4.13Å; L707-P804 HydrophobicContact CG-CB 4.47Å; L707-P804 HydrophobicContact CG-CG 4.41Å; W802-P804 VanDerWaalsContact C-N 3.34Å
805	Q	70.3	Confident	81.2	Confident	52 Å²	52	19.4 Å²	19.4	24%	0.243	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.6	-30.3	-178.5	-54.7	-168.8	45.2	0	0	113.8	H763 W802 L803	H763-Q805 PolarHBondContact O-NE2 2.85Å; W802-Q805 PolarHBondContact O-N 3.31Å; L803-Q805 PolarHBondContact O-N 3.3Å
806	L	82	Confident	80.1	Confident	6 Å²	6	22.6 Å²	22.6	3%	0.031	12%	0.118	C	C	.	.			trans	-123.5	129.4	-171.9	-51.5	-177	0	0	0	111.7	W759 P784 W802 C808 M916	W759-L806 HydrophobicContact CZ3-CD1 3.96Å; W759-L806 HydrophobicContact CZ3-CD2 4.33Å; P784-L806 HydrophobicContact CB-CD1 3.87Å; P784-L806 HydrophobicContact CG-CD1 3.59Å; W802-L806 HydrophobicContact CB-CD1 4.1Å; W802-L806 HydrophobicContact CB-CG 4.48Å; W802-L806 HydrophobicContact CD2-CD1 4.32Å; W802-L806 HydrophobicContact CE3-CD1 3.82Å; W802-L806 HydrophobicContact CE3-CG 4.24Å; W802-L806 HydrophobicContact CG-CD1 4.48Å; W802-L806 PolarHBondContact O-N 2.84Å; L806-C808 VanDerWaalsContact C-N 3.3Å; L806-C808 PolarHBondContact O-N 3.48Å; L806-M916 HydrophobicContact CB-CE 3.76Å; L806-M916 HydrophobicContact CD1-CE 4.18Å; L806-M916 HydrophobicContact CD2-CE 3.74Å; L806-M916 HydrophobicContact CG-CE 4.08Å
807	P	81.9	Confident	78.9	Confident	34 Å²	34	30.5 Å²	30.5	22%	0.221	16%	0.16	C	C	.	.	S	Bend	trans	-75.2	-15.7	-178.3	30.9	-36.4	0	0	0	114.1	P831 P889 C890 T918	P807-P831 WeakPolarHBondContact O-CD 3.5Å; P807-P889 HydrophobicContact CB-CG 4.45Å; P807-P889 HydrophobicContact CG-CB 4.34Å; P807-P889 HydrophobicContact CG-CG 4.31Å; P807-C890 HydrophobicContact CG-CB 4.17Å; P807-T918 HydrophobicContact CG-CG2 4.25Å
808	C	87.9	Confident	77.8	Confident	12 Å²	12	36.2 Å²	36.2	8%	0.081	19%	0.191	C	C	.	.	S	Bend	trans	-162.5	159.5	177.3	57.3	0	0	0	0	109.6	L806 I829 C890 M916	L806-C808 VanDerWaalsContact C-N 3.3Å; L806-C808 PolarHBondContact O-N 3.48Å; C808-I829 CarbonylContact C-O 3.54Å; C808-I829 VanDerWaalsContact CA-O 3.28Å; C808-I829 WeakPolarHBondContact CA-O 3.26Å; C808-I829 WeakPolarHBondContact CB-O 3.43Å; C808-C890 PolarHBondContact SG-SG 3.46Å; C808-M916 WeakPolarHBondContact O-CE 3.32Å
809	L	89.8	Confident	76.5	Confident	4 Å²	4	40.9 Å²	40.9	2%	0.021	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	130.2	175	-60.8	-177.3	0	0	0	111.1	P784 L786 V798 L799 W802 F828 I829	P784-L809 HydrophobicContact CB-CD2 4.12Å; L786-L809 HydrophobicContact CD1-CB 3.67Å; L786-L809 HydrophobicContact CD1-CD1 3.64Å; L786-L809 HydrophobicContact CD1-CG 4.33Å; L786-L809 HydrophobicContact CG-CD1 4.43Å; V798-L809 HydrophobicContact CB-CD1 3.87Å; V798-L809 HydrophobicContact CG1-CD1 3.63Å; V798-L809 HydrophobicContact CG1-CD2 3.87Å; V798-L809 HydrophobicContact CG1-CG 4.41Å; L799-L809 HydrophobicContact CB-CD1 3.85Å; L799-L809 HydrophobicContact CB-CG 4.5Å; W802-L809 HydrophobicContact CB-CD2 4.4Å; L809-F828 WeakPolarHBondContact O-CA 3.41Å; L809-I829 PolarHBondContact N-O 2.77Å; L809-I829 PolarHBondContact O-N 2.69Å
810	P	90.9	Very high	75.4	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	141.9	170.8	29.8	-35.4	0	0	0	111.8	W759 P784 V785 L786 I892	W759-P810 HydrophobicContact CH2-CG 4.24Å; W759-P810 HydrophobicContact CZ2-CG 4.31Å; P784-P810 WeakPolarHBondContact O-CD 3.42Å; V785-P810 HydrophobicContact CG2-CG 3.87Å; L786-P810 PolarHBondContact N-O 3.31Å; P810-I892 HydrophobicContact CB-CD1 3.47Å; P810-I892 VanDerWaalsContact CB-CD1 3.47Å; P810-I892 HydrophobicContact CB-CG1 3.84Å
811	V	90.8	Very high	74.7	Confident	2 Å²	2	49.3 Å²	49.3	1%	0.012	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	134.8	171.7	-159.9	0	0	0	0	109	L786 P788 S827 I829 I851 I855	L786-V811 HydrophobicContact CB-CB 4.45Å; L786-V811 HydrophobicContact CB-CG1 4.09Å; L786-V811 HydrophobicContact CB-CG2 4.2Å; L786-V811 HydrophobicContact CD1-CG2 4.5Å; L786-V811 WeakPolarHBondContact O-CA 3.42Å; L786-V811 WeakPolarHBondContact O-CG1 3.44Å; P788-V811 HydrophobicContact CG-CG1 4.14Å; V811-S827 PolarHBondContact N-O 2.82Å; V811-S827 PolarHBondContact O-N 2.86Å; V811-I829 HydrophobicContact CG2-CD1 3.69Å; V811-I829 HydrophobicContact CG2-CG1 3.6Å; V811-I851 HydrophobicContact CG1-CG2 4.17Å; V811-I851 HydrophobicContact CG2-CG2 4.27Å; V811-I855 HydrophobicContact CB-CD1 4.03Å; V811-I855 HydrophobicContact CG1-CD1 3.81Å; V811-I855 HydrophobicContact CG2-CD1 4.12Å
812	V	88.2	Confident	74.2	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	124	-177.8	178.5	0	0	0	0	109.9	V785 L786 H787 Y814 I823 P913	V785-V812 HydrophobicContact CG1-CB 4.15Å; V785-V812 HydrophobicContact CG1-CG2 3.82Å; L786-V812 PolarHBondContact O-N 3.47Å; H787-V812 PolarHBondContact CD2-O 3.34Å; V812-Y814 HydrophobicContact CB-CE2 4.23Å; V812-Y814 HydrophobicContact CG1-CD1 4.19Å; V812-Y814 HydrophobicContact CG1-CD2 4.2Å; V812-Y814 HydrophobicContact CG1-CE1 3.73Å; V812-Y814 HydrophobicContact CG1-CE2 3.74Å; V812-Y814 HydrophobicContact CG1-CG 4.4Å; V812-Y814 VanDerWaalsContact CG1-CZ 3.49Å; V812-I823 HydrophobicContact CG1-CB 4.38Å; V812-I823 HydrophobicContact CG1-CD1 3.59Å; V812-I823 HydrophobicContact CG1-CG1 3.71Å; V812-I823 HydrophobicContact CG1-CG2 3.87Å; V812-P913 HydrophobicContact CG2-CG 4.46Å
813	H	85.4	Confident	73.9	Confident	65 Å²	65	49.2 Å²	49.2	30%	0.301	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	128.7	166.6	-168.7	-131.3	0	0	0	109	H787 P788 D824 Q825	H787-H813 AromaticContact NE2-CD2 3.77Å; P788-H813 HydrophobicContact CG-CB 4.04Å; H813-D824 HydrophobicContact CB-CB 4.3Å; H813-D824 IonicContact CE1-OD2 2.93Å; H813-D824 IonicContact ND1-OD2 3.43Å; H813-D824 PolarHBondContact ND1-OD2 2.86Å; H813-D824 PolarHBondContact O-N 2.83Å; H813-Q825 HydrophobicContact CB-CB 4.12Å; H813-Q825 PolarHBondContact N-O 3.26Å; H813-Q825 PolarHBondContact O-N 2.8Å
814	Y	81.9	Confident	74.2	Confident	37 Å²	37	50.9 Å²	50.9	15%	0.145	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	146.3	175	-60.5	-84.1	0	0	0	109.4	V812 D816 S822 I823	V812-Y814 HydrophobicContact CB-CE2 4.23Å; V812-Y814 HydrophobicContact CG1-CD1 4.19Å; V812-Y814 HydrophobicContact CG1-CD2 4.2Å; V812-Y814 HydrophobicContact CG1-CE1 3.73Å; V812-Y814 HydrophobicContact CG1-CE2 3.74Å; V812-Y814 HydrophobicContact CG1-CG 4.4Å; V812-Y814 VanDerWaalsContact CG1-CZ 3.49Å; Y814-D816 VanDerWaalsContact C-N 3.33Å; Y814-S822 WeakPolarHBondContact CA-O 3.5Å; Y814-I823 HydrophobicContact CD1-CG1 3.81Å; Y814-I823 HydrophobicContact CE1-CD1 4.16Å; Y814-I823 HydrophobicContact CE1-CG1 3.73Å
815	L	74.2	Confident	74.8	Confident	100 Å²	100	53 Å²	53	52%	0.524	28%	0.275	S	S	.	.	S	Bend	trans	-76.8	-24.9	174.4	-66.5	167	0	0	0	112.2	S822 D824	L815-S822 WeakPolarHBondContact CB-OG 3.29Å; L815-S822 PolarHBondContact N-O 3.21Å; L815-D824 HydrophobicContact CD2-CB 3.62Å; L815-D824 HydrophobicContact CG-CB 3.81Å
816	D	67.1	Low	75.4	Confident	68 Å²	68	50.6 Å²	50.6	36%	0.364	26%	0.264	S	S	.	.	S	Bend	trans	-112.2	126	-176.2	-44.7	-74.5	0	0	0	110.1	Y814 N818 Q819 S822	Y814-D816 VanDerWaalsContact C-N 3.33Å; D816-N818 PolarHBondContact O-N 3.46Å; D816-Q819 PolarHBondContact O-N 2.76Å; D816-S822 PolarHBondContact OD2-N 3.31Å; D816-S822 PolarHBondContact OD2-OG 3.41Å
817	D	61	Low	75.7	Confident	166 Å²	166	50.5 Å²	50.5	89%	0.888	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-25.6	176.9	-69	-54.7	0	0	0	113.2	Q819	D817-Q819 PolarHBondContact O-N 3.14Å; D817-Q819 VanDerWaalsContact O-N 3.11Å
818	N	58	Low	76	Confident	133 Å²	133	49.8 Å²	49.8	71%	0.711	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.9	6.6	175.4	-69.3	-42	0	0	0	114.1	D816 S820	D816-N818 PolarHBondContact O-N 3.46Å; N818-S820 WeakPolarHBondContact O-CB 3.46Å; N818-S820 PolarHBondContact O-N 3.21Å; N818-S820 PolarHBondContact O-OG 3.42Å
819	Q	57	Low	76.1	Confident	107 Å²	107	49.3 Å²	49.3	50%	0.5	25%	0.254	S	S	.	.	S	Bend	trans	49.7	30.4	170.5	-55.2	-179.8	7.5	0	0	115.6	D816 D817 R912	D816-Q819 PolarHBondContact O-N 2.76Å; D817-Q819 PolarHBondContact O-N 3.14Å; D817-Q819 VanDerWaalsContact O-N 3.11Å; Q819-R912 PolarHBondContact O-NE 3.27Å; Q819-R912 PolarHBondContact O-NH2 3.47Å; Q819-R912 VanDerWaalsContact O-NH2 3.08Å
820	S	55.9	Low	76	Confident	60 Å²	60	50.6 Å²	50.6	42%	0.42	26%	0.264	S	S	.	.	S	Bend	trans	-126.4	-27.2	-158.2	39.3	0	0	0	0	117.2	N818	N818-S820 WeakPolarHBondContact O-CB 3.46Å; N818-S820 PolarHBondContact O-N 3.21Å; N818-S820 PolarHBondContact O-OG 3.42Å
821	Q	56.4	Low	75.9	Confident	133 Å²	133	50.7 Å²	50.7	62%	0.621	26%	0.264	S	S	*	.	S	Bend	trans	-132.3	-29.1	-168.3	-56.6	-158.5	38.7	0	0	116.6	P909	Q821-P909 WeakPolarHBondContact O-CA 3.34Å; Q821-P909 WeakPolarHBondContact O-CB 3.3Å
822	S	65.3	Low	75.7	Confident	18 Å²	18	51 Å²	51	13%	0.126	27%	0.268	C	S	.	.			trans	-140.8	129.8	-178.7	67.5	0	0	0	0	114.4	Y814 L815 D816	Y814-S822 WeakPolarHBondContact CA-O 3.5Å; L815-S822 WeakPolarHBondContact CB-OG 3.29Å; L815-S822 PolarHBondContact N-O 3.21Å; D816-S822 PolarHBondContact OD2-N 3.31Å; D816-S822 PolarHBondContact OD2-OG 3.41Å
823	I	72.3	Confident	75.8	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	128.1	176	-68.4	-179.6	0	0	0	108.9	V812 Y814 I826 F894 K908 F910	V812-I823 HydrophobicContact CG1-CB 4.38Å; V812-I823 HydrophobicContact CG1-CD1 3.59Å; V812-I823 HydrophobicContact CG1-CG1 3.71Å; V812-I823 HydrophobicContact CG1-CG2 3.87Å; Y814-I823 HydrophobicContact CD1-CG1 3.81Å; Y814-I823 HydrophobicContact CE1-CD1 4.16Å; Y814-I823 HydrophobicContact CE1-CG1 3.73Å; I823-I826 HydrophobicContact CG2-CD1 4.25Å; I823-I826 HydrophobicContact CG2-CG1 3.7Å; I823-F894 HydrophobicContact CD1-CE1 3.57Å; I823-F894 HydrophobicContact CD1-CZ 3.91Å; I823-K908 VanDerWaalsContact O-CD 3.27Å; I823-K908 WeakPolarHBondContact O-CD 3.11Å; I823-K908 WeakPolarHBondContact O-CE 3.49Å; I823-F910 HydrophobicContact CB-CB 4.17Å; I823-F910 HydrophobicContact CB-CD2 4.3Å; I823-F910 HydrophobicContact CD1-CB 3.7Å; I823-F910 HydrophobicContact CG1-CB 4.04Å
824	D	74.7	Confident	76	Confident	50 Å²	50	48.6 Å²	48.6	27%	0.267	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	-57.5	174.3	-174.2	33.7	0	0	0	112.2	H813 L815 K908	H813-D824 HydrophobicContact CB-CB 4.3Å; H813-D824 IonicContact CE1-OD2 2.93Å; H813-D824 IonicContact ND1-OD2 3.43Å; H813-D824 PolarHBondContact ND1-OD2 2.86Å; H813-D824 PolarHBondContact O-N 2.83Å; L815-D824 HydrophobicContact CD2-CB 3.62Å; L815-D824 HydrophobicContact CG-CB 3.81Å; D824-K908 WeakPolarHBondContact O-CE 3.3Å; D824-K908 PolarHBondContact O-NZ 3.33Å; D824-K908 IonicContact OD1-NZ 2.93Å; D824-K908 PolarHBondContact OD1-NZ 3.14Å
825	Q	79	Confident	76.4	Confident	64 Å²	64	46.8 Å²	46.8	30%	0.299	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	136.2	-173.5	169.4	169.8	-15	0	0	111.6	H813 S827 I855	H813-Q825 HydrophobicContact CB-CB 4.12Å; H813-Q825 PolarHBondContact N-O 3.26Å; H813-Q825 PolarHBondContact O-N 2.8Å; Q825-S827 PolarHBondContact NE2-OG 3.07Å; Q825-I855 VanDerWaalsContact NE2-CG2 3.32Å
826	I	84.8	Confident	77.2	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	129.4	170.5	-62.3	178	0	0	0	108.9	I823 F828 Q865 V869 I892 F894	I823-I826 HydrophobicContact CG2-CD1 4.25Å; I823-I826 HydrophobicContact CG2-CG1 3.7Å; I826-F828 HydrophobicContact CG2-CE2 3.98Å; I826-F828 HydrophobicContact CG2-CZ 4.37Å; I826-Q865 WeakPolarHBondContact O-CB 3.25Å; I826-V869 HydrophobicContact CD1-CG1 3.5Å; I826-I892 HydrophobicContact CG2-CD1 3.54Å; I826-F894 HydrophobicContact CD1-CE2 4.11Å; I826-F894 HydrophobicContact CD1-CZ 3.91Å
827	S	87.2	Confident	78.3	Confident	4 Å²	4	43.2 Å²	43.2	3%	0.028	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	170.4	177.3	-75.9	0	0	0	0	111.8	V811 Q825 Q865	V811-S827 PolarHBondContact N-O 2.82Å; V811-S827 PolarHBondContact O-N 2.86Å; Q825-S827 PolarHBondContact NE2-OG 3.07Å; S827-Q865 VanDerWaalsContact CA-OE1 3.24Å; S827-Q865 PolarHBondContact OG-OE1 3.1Å
828	F	88.6	Confident	79.7	Confident	20 Å²	20	35.4 Å²	35.4	9%	0.088	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	137.7	-177.6	-62.4	-101.3	0	0	0	111.7	L809 I826 K858 C868 I892 M916	L809-F828 WeakPolarHBondContact O-CA 3.41Å; I826-F828 HydrophobicContact CG2-CE2 3.98Å; I826-F828 HydrophobicContact CG2-CZ 4.37Å; F828-K858 PolarHBondContact O-NZ 3.26Å; F828-C868 HydrophobicContact CE2-CB 3.5Å; F828-C868 HydrophobicContact CZ-CB 3.61Å; F828-I892 HydrophobicContact CE1-CD1 3.79Å; F828-I892 HydrophobicContact CE1-CG1 3.66Å; F828-I892 HydrophobicContact CE2-CD1 4.29Å; F828-I892 HydrophobicContact CZ-CD1 3.53Å; F828-I892 HydrophobicContact CZ-CG1 3.65Å; F828-M916 HydrophobicContact CE1-SD 4.43Å
829	I	89.5	Confident	81	Confident	1 Å²	1	30 Å²	30	1%	0.005	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	111.4	173.8	-54	173.8	0	0	0	108.8	L786 C808 L809 V811 D833 L834 I851	L786-I829 HydrophobicContact CD1-CD1 3.78Å; C808-I829 CarbonylContact C-O 3.54Å; C808-I829 VanDerWaalsContact CA-O 3.28Å; C808-I829 WeakPolarHBondContact CA-O 3.26Å; C808-I829 WeakPolarHBondContact CB-O 3.43Å; L809-I829 PolarHBondContact N-O 2.77Å; L809-I829 PolarHBondContact O-N 2.69Å; V811-I829 HydrophobicContact CG2-CD1 3.69Å; V811-I829 HydrophobicContact CG2-CG1 3.6Å; I829-D833 HydrophobicContact CG2-CB 4.18Å; I829-L834 HydrophobicContact CG2-CB 4.42Å; I829-L834 HydrophobicContact CG2-CD1 3.5Å; I829-L834 VanDerWaalsContact CG2-CD1 3.5Å; I829-L834 HydrophobicContact CG2-CG 3.5Å; I829-L834 VanDerWaalsContact CG2-CG 3.5Å; I829-I851 HydrophobicContact CD1-CB 4.4Å; I829-I851 HydrophobicContact CD1-CD1 3.99Å; I829-I851 HydrophobicContact CD1-CG1 4.03Å; I829-I851 HydrophobicContact CD1-CG2 3.53Å; I829-I851 HydrophobicContact CG1-CG2 4.46Å
830	S	88	Confident	82.4	Confident	32 Å²	32	29.2 Å²	29.2	22%	0.224	17%	0.165	C	C	.	.			trans	-82	162.1	169	73.2	0	0	0	0	110.9	G832 D833 L834	S830-G832 PolarHBondContact O-N 3Å; S830-G832 PolarHBondContact OG-N 2.8Å; S830-D833 WeakPolarHBondContact CA-OD2 3.48Å; S830-D833 VanDerWaalsContact CB-OD2 3.26Å; S830-D833 WeakPolarHBondContact CB-OD2 3.36Å; S830-D833 PolarHBondContact N-OD2 3.33Å; S830-D833 PolarHBondContact O-N 2.95Å; S830-D833 VanDerWaalsContact OG-CG 3.31Å; S830-D833 PolarHBondContact OG-N 3.16Å; S830-D833 PolarHBondContact OG-OD2 3.18Å; S830-L834 PolarHBondContact O-N 2.99Å
831	P	87.7	Confident	83.7	Confident	1 Å²	1	27.4 Å²	27.4	1%	0.006	15%	0.153	C	C	.	.	H	α-helix	trans	-49.7	-42.4	169.6	-29.1	35.7	0	0	0	112.9	Q466 E467 L470 L799 L803 P807 D833 L834 L835	Q466-P831 HydrophobicContact CB-CB 4.01Å; E467-P831 HydrophobicContact CG-CG 4.06Å; L470-P831 HydrophobicContact CD1-CB 3.93Å; L470-P831 WeakPolarHBondContact CD1-O 3.22Å; L799-P831 HydrophobicContact CD1-CG 4.43Å; L803-P831 HydrophobicContact CD2-CG 3.92Å; P807-P831 WeakPolarHBondContact O-CD 3.5Å; P831-D833 VanDerWaalsContact C-N 3.35Å; P831-D833 PolarHBondContact O-N 3.48Å; P831-L834 PolarHBondContact O-N 2.86Å; P831-L835 WeakPolarHBondContact O-CB 3.48Å; P831-L835 PolarHBondContact O-N 3.07Å
832	G	88.1	Confident	84.4	Confident	9 Å²	9	27.6 Å²	27.6	9%	0.093	16%	0.163	C	C	.	.	H	α-helix	trans	-61.5	-36.3	177.1	0	0	0	0	0	114.4	Q466 S830 N836	Q466-G832 VanDerWaalsContact OE1-N 3.12Å; S830-G832 PolarHBondContact O-N 3Å; S830-G832 PolarHBondContact OG-N 2.8Å; G832-N836 WeakPolarHBondContact O-CB 3.47Å; G832-N836 PolarHBondContact O-N 3.06Å
833	D	89.7	Confident	85	Confident	14 Å²	14	29 Å²	29	8%	0.075	17%	0.172	C	C	.	.	H	α-helix	trans	-67	-44.8	179.9	-58.1	-74.2	0	0	0	111.6	I829 S830 P831 F837 I854 K858	I829-D833 HydrophobicContact CG2-CB 4.18Å; S830-D833 WeakPolarHBondContact CA-OD2 3.48Å; S830-D833 VanDerWaalsContact CB-OD2 3.26Å; S830-D833 WeakPolarHBondContact CB-OD2 3.36Å; S830-D833 PolarHBondContact N-OD2 3.33Å; S830-D833 PolarHBondContact O-N 2.95Å; S830-D833 VanDerWaalsContact OG-CG 3.31Å; S830-D833 PolarHBondContact OG-N 3.16Å; S830-D833 PolarHBondContact OG-OD2 3.18Å; P831-D833 VanDerWaalsContact C-N 3.35Å; P831-D833 PolarHBondContact O-N 3.48Å; D833-F837 WeakPolarHBondContact O-CB 3.3Å; D833-F837 PolarHBondContact O-N 2.62Å; D833-I854 HydrophobicContact CB-CG2 3.93Å; D833-K858 VanDerWaalsContact CG-NZ 3.28Å; D833-K858 WeakPolarHBondContact OD1-CD 3.4Å; D833-K858 WeakPolarHBondContact OD1-CE 3.28Å; D833-K858 IonicContact OD1-NZ 2.69Å; D833-K858 PolarHBondContact OD1-NZ 3.37Å; D833-K858 IonicContact OD2-NZ 3.09Å; D833-K858 PolarHBondContact OD2-NZ 2.78Å
834	L	90.1	Very high	85	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-68	-45.8	176.6	-88	160.6	0	0	0	111.6	L470 V792 A795 L799 I829 S830 P831 N836 F837 I838 I854	L470-L834 HydrophobicContact CD1-CB 3.9Å; L470-L834 HydrophobicContact CD2-CB 4.32Å; V792-L834 HydrophobicContact CG1-CD2 3.87Å; A795-L834 HydrophobicContact CB-CD1 4.04Å; A795-L834 HydrophobicContact CB-CD2 4.1Å; L799-L834 HydrophobicContact CD1-CD1 3.71Å; I829-L834 HydrophobicContact CG2-CB 4.42Å; I829-L834 HydrophobicContact CG2-CD1 3.5Å; I829-L834 VanDerWaalsContact CG2-CD1 3.5Å; I829-L834 HydrophobicContact CG2-CG 3.5Å; I829-L834 VanDerWaalsContact CG2-CG 3.5Å; S830-L834 PolarHBondContact O-N 2.99Å; P831-L834 PolarHBondContact O-N 2.86Å; L834-N836 VanDerWaalsContact C-N 3.32Å; L834-N836 PolarHBondContact O-N 3.23Å; L834-F837 PolarHBondContact O-N 3.39Å; L834-I838 VanDerWaalsContact O-CG1 3.3Å; L834-I838 WeakPolarHBondContact O-CG1 3.48Å; L834-I838 PolarHBondContact O-N 3.5Å; L834-I854 HydrophobicContact CD2-CD1 3.75Å; L834-I854 HydrophobicContact CG-CD1 4.28Å
835	L	89.7	Confident	85.3	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-61.4	-42.7	-178.8	-170.9	61.1	0	0	0	111.2	I439 L443 Q466 A469 L470 I473 P831 I839	I439-L835 HydrophobicContact CG2-CD1 3.95Å; I439-L835 HydrophobicContact CG2-CD2 3.59Å; I439-L835 HydrophobicContact CG2-CG 3.68Å; L443-L835 HydrophobicContact CD1-CG 4.42Å; L443-L835 HydrophobicContact CD2-CD2 4.39Å; Q466-L835 HydrophobicContact CB-CD2 3.99Å; Q466-L835 HydrophobicContact CG-CD2 4.1Å; A469-L835 HydrophobicContact CB-CD1 3.99Å; A469-L835 HydrophobicContact CB-CD2 3.75Å; L470-L835 HydrophobicContact CD2-CB 3.9Å; L470-L835 HydrophobicContact CD2-CD1 3.78Å; L470-L835 HydrophobicContact CD2-CG 4.44Å; L470-L835 HydrophobicContact CG-CB 4.09Å; L470-L835 HydrophobicContact CG-CD1 4.17Å; I473-L835 HydrophobicContact CD1-CD1 3.52Å; P831-L835 WeakPolarHBondContact O-CB 3.48Å; P831-L835 PolarHBondContact O-N 3.07Å; L835-I839 HydrophobicContact CD1-CD1 3.82Å; L835-I839 HydrophobicContact CG-CD1 4.08Å; L835-I839 WeakPolarHBondContact O-CB 3.38Å; L835-I839 WeakPolarHBondContact O-CG1 3.38Å; L835-I839 PolarHBondContact O-N 2.98Å
836	N	90.7	Very high	85.6	Confident	75 Å²	75	29.9 Å²	29.9	40%	0.401	18%	0.182	S	C	.	.	H	α-helix	trans	-68.1	-39	174.4	-169.6	79.1	0	0	0	112.4	L443 G832 L834 C840	L443-N836 HydrophobicContact CD1-CB 4.04Å; L443-N836 HydrophobicContact CD2-CB 4.22Å; G832-N836 WeakPolarHBondContact O-CB 3.47Å; G832-N836 PolarHBondContact O-N 3.06Å; L834-N836 VanDerWaalsContact C-N 3.32Å; L834-N836 PolarHBondContact O-N 3.23Å; N836-C840 WeakPolarHBondContact O-CB 3.39Å; N836-C840 PolarHBondContact O-N 2.99Å; N836-C840 PolarHBondContact O-SG 2.91Å; N836-C840 VanDerWaalsContact O-SG 3.36Å
837	F	90.8	Very high	85.7	Confident	18 Å²	18	29.9 Å²	29.9	8%	0.079	18%	0.182	C	C	.	.	H	α-helix	trans	-66.6	-40.4	176.9	-173.1	-93	0	0	0	112.7	V792 D833 L834 S841 V846 E849 R853 I854	V792-F837 HydrophobicContact CG2-CD1 3.96Å; V792-F837 HydrophobicContact CG2-CE1 3.78Å; D833-F837 WeakPolarHBondContact O-CB 3.3Å; D833-F837 PolarHBondContact O-N 2.62Å; L834-F837 PolarHBondContact O-N 3.39Å; F837-S841 WeakPolarHBondContact O-CB 3.28Å; F837-S841 PolarHBondContact O-N 2.95Å; F837-V846 HydrophobicContact CD1-CG2 3.69Å; F837-V846 HydrophobicContact CE1-CG2 3.54Å; F837-E849 HydrophobicContact CE1-CB 4.32Å; F837-E849 HydrophobicContact CZ-CB 4.34Å; F837-R853 HydrophobicContact CE2-CB 3.98Å; F837-R853 HydrophobicContact CZ-CB 4.11Å; F837-I854 HydrophobicContact CB-CD1 3.97Å; F837-I854 HydrophobicContact CB-CG1 3.95Å; F837-I854 HydrophobicContact CD1-CD1 4.11Å; F837-I854 HydrophobicContact CD1-CG1 4.08Å; F837-I854 HydrophobicContact CD2-CD1 4.38Å; F837-I854 HydrophobicContact CD2-CG1 3.55Å; F837-I854 HydrophobicContact CE1-CG1 4.48Å; F837-I854 HydrophobicContact CE2-CG1 3.98Å; F837-I854 HydrophobicContact CG-CD1 3.91Å; F837-I854 HydrophobicContact CG-CG1 3.59Å; F837-I854 HydrophobicContact CZ-CG1 4.43Å
838	I	89.3	Confident	85.7	Confident	1 Å²	1	31.6 Å²	31.6	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-65.8	-50	177.2	-67.6	165.5	0	0	0	110.2	L470 F515 L519 V792 L834 S841 L847	L470-I838 HydrophobicContact CD2-CD1 4.17Å; F515-I838 HydrophobicContact CE1-CG2 4.3Å; F515-I838 HydrophobicContact CZ-CG2 4.35Å; L519-I838 HydrophobicContact CD2-CG2 4.1Å; V792-I838 HydrophobicContact CG1-CD1 4.25Å; V792-I838 HydrophobicContact CG1-CG1 4.02Å; L834-I838 VanDerWaalsContact O-CG1 3.3Å; L834-I838 WeakPolarHBondContact O-CG1 3.48Å; L834-I838 PolarHBondContact O-N 3.5Å; I838-S841 PolarHBondContact O-N 3.37Å; I838-L847 HydrophobicContact CD1-CD2 4.18Å; I838-L847 HydrophobicContact CG1-CD2 4.15Å
839	I	87.1	Confident	85.8	Confident	21 Å²	21	32.2 Å²	32.2	11%	0.108	19%	0.194	C	C	.	.	H	α-helix	trans	-75	-32.2	-174	-69.9	169.3	0	0	0	113.1	L436 I439 L835 S841	L436-I839 HydrophobicContact CD1-CD1 3.91Å; L436-I839 HydrophobicContact CD1-CG1 4.04Å; L436-I839 HydrophobicContact CD1-CG2 3.96Å; I439-I839 HydrophobicContact CB-CD1 4.04Å; I439-I839 HydrophobicContact CD1-CD1 4.2Å; I439-I839 HydrophobicContact CG2-CD1 3.29Å; L835-I839 HydrophobicContact CD1-CD1 3.82Å; L835-I839 HydrophobicContact CG-CD1 4.08Å; L835-I839 WeakPolarHBondContact O-CB 3.38Å; L835-I839 WeakPolarHBondContact O-CG1 3.38Å; L835-I839 PolarHBondContact O-N 2.98Å; I839-S841 VanDerWaalsContact C-N 3.27Å; I839-S841 PolarHBondContact O-N 3.29Å
840	C	85.3	Confident	85.9	Confident	90 Å²	90	34 Å²	34	61%	0.608	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.6	7.4	175.6	-60.8	0	0	0	0	113.7	N836	N836-C840 WeakPolarHBondContact O-CB 3.39Å; N836-C840 PolarHBondContact O-N 2.99Å; N836-C840 PolarHBondContact O-SG 2.91Å; N836-C840 VanDerWaalsContact O-SG 3.36Å
841	S	83.2	Confident	86.1	Confident	22 Å²	22	32.4 Å²	32.4	15%	0.154	19%	0.194	C	C	.	.			trans	-90.2	129.6	173.5	-177.2	0	0	0	0	111.4	F837 I838 I839 S843 V846	F837-S841 WeakPolarHBondContact O-CB 3.28Å; F837-S841 PolarHBondContact O-N 2.95Å; I838-S841 PolarHBondContact O-N 3.37Å; I839-S841 VanDerWaalsContact C-N 3.27Å; I839-S841 PolarHBondContact O-N 3.29Å; S841-S843 VanDerWaalsContact C-N 3.35Å; S841-S843 PolarHBondContact OG-N 2.94Å; S841-S843 PolarHBondContact OG-O 3.49Å; S841-V846 WeakPolarHBondContact OG-CB 3.4Å
842	T	71.7	Confident	86.3	Confident	137 Å²	137	33.7 Å²	33.7	84%	0.84	20%	0.203	S	C	*	.			trans	-91	2.3	167.3	59.3	0	0	0	0	112.9
843	S	77.6	Confident	86.3	Confident	46 Å²	46	38.6 Å²	38.6	32%	0.322	22%	0.219	S	C	.	.			trans	-100.9	131.5	179.2	-171.1	0	0	0	0	111.9	S841 T845 V846	S841-S843 VanDerWaalsContact C-N 3.35Å; S841-S843 PolarHBondContact OG-N 2.94Å; S841-S843 PolarHBondContact OG-O 3.49Å; S843-T845 PolarHBondContact O-N 3.31Å; S843-T845 PolarHBondContact OG-N 2.81Å; S843-T845 PolarHBondContact OG-OG1 3.2Å; S843-V846 WeakPolarHBondContact O-CB 3.48Å; S843-V846 PolarHBondContact O-N 3.44Å
844	D	72.2	Confident	86.3	Confident	72 Å²	72	38.3 Å²	38.3	39%	0.385	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-62.9	-21.3	169.7	-52.9	-52.5	0	0	0	112.1	F512 N516 V846	F512-D844 HydrophobicContact CB-CB 3.98Å; N516-D844 WeakPolarHBondContact ND2-CA 3.39Å; N516-D844 PolarHBondContact ND2-OD1 3.12Å; D844-V846 PolarHBondContact O-N 3.06Å
845	T	81.2	Confident	86.1	Confident	64 Å²	64	39 Å²	39	39%	0.393	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-73.7	-5.3	176.6	66.6	0	0	0	0	114.3	S843 L847 N848 E849	S843-T845 PolarHBondContact O-N 3.31Å; S843-T845 PolarHBondContact OG-N 2.81Å; S843-T845 PolarHBondContact OG-OG1 3.2Å; T845-L847 PolarHBondContact O-N 2.89Å; T845-N848 WeakPolarHBondContact O-CA 3.39Å; T845-N848 WeakPolarHBondContact O-CB 3.49Å; T845-N848 PolarHBondContact O-N 3.28Å; T845-E849 PolarHBondContact O-N 2.8Å; T845-E849 PolarHBondContact OG1-OE1 3.37Å
846	V	86	Confident	85.8	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-49.9	-37.8	-167.5	65.8	0	0	0	0	114.8	V792 F837 S841 S843 D844 N848 E849	V792-V846 WeakPolarHBondContact CB-O 3.3Å; F837-V846 HydrophobicContact CD1-CG2 3.69Å; F837-V846 HydrophobicContact CE1-CG2 3.54Å; S841-V846 WeakPolarHBondContact OG-CB 3.4Å; S843-V846 WeakPolarHBondContact O-CB 3.48Å; S843-V846 PolarHBondContact O-N 3.44Å; D844-V846 PolarHBondContact O-N 3.06Å; V846-N848 VanDerWaalsContact C-N 3.29Å; V846-N848 PolarHBondContact O-N 2.81Å; V846-E849 WeakPolarHBondContact O-CB 3.11Å; V846-E849 PolarHBondContact O-N 2.81Å
847	L	85.6	Confident	85.3	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-74.2	-19	-178.7	-63.1	-174.2	0	0	0	113.4	H477 F515 V792 R793 I838 T845	H477-L847 WeakPolarHBondContact CD2-CD1 3.32Å; F515-L847 HydrophobicContact CD1-CD1 3.85Å; F515-L847 HydrophobicContact CD1-CG 4.34Å; F515-L847 HydrophobicContact CD2-CD1 4Å; F515-L847 HydrophobicContact CE1-CD1 3.8Å; F515-L847 HydrophobicContact CE1-CD2 4.33Å; F515-L847 HydrophobicContact CE1-CG 4.1Å; F515-L847 HydrophobicContact CE2-CD1 3.94Å; F515-L847 HydrophobicContact CG-CD1 3.94Å; F515-L847 HydrophobicContact CZ-CD1 3.84Å; F515-L847 HydrophobicContact CZ-CD2 4.37Å; F515-L847 HydrophobicContact CZ-CG 4.43Å; V792-L847 HydrophobicContact CG1-CD2 3.96Å; R793-L847 HydrophobicContact CB-CB 4.17Å; R793-L847 WeakPolarHBondContact CB-O 3.44Å; R793-L847 WeakPolarHBondContact CG-O 3.36Å; R793-L847 PolarHBondContact N-O 3.27Å; I838-L847 HydrophobicContact CD1-CD2 4.18Å; I838-L847 HydrophobicContact CG1-CD2 4.15Å; T845-L847 PolarHBondContact O-N 2.89Å
848	N	87.8	Confident	84.7	Confident	40 Å²	40	48.1 Å²	48.1	21%	0.214	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-93.7	-10.2	175.7	-63.1	-54.8	0	0	0	113.4	F512 R793 T845 V846	F512-N848 WeakPolarHBondContact CE1-ND2 3.3Å; F512-N848 WeakPolarHBondContact CZ-ND2 3.5Å; R793-N848 PolarHBondContact NH1-OD1 3.13Å; T845-N848 WeakPolarHBondContact O-CA 3.39Å; T845-N848 WeakPolarHBondContact O-CB 3.49Å; T845-N848 PolarHBondContact O-N 3.28Å; V846-N848 VanDerWaalsContact C-N 3.29Å; V846-N848 PolarHBondContact O-N 2.81Å
849	E	89.5	Confident	83.3	Confident	33 Å²	33	50.8 Å²	50.8	15%	0.154	28%	0.277	C	S	.	.	S	Bend	trans	-67.1	149.6	179.2	-65.8	-69.4	-167.9	0	0	111.8	R791 V792 F837 T845 V846 R853	R791-E849 WeakPolarHBondContact CA-O 3.22Å; V792-E849 WeakPolarHBondContact CG2-O 3.23Å; V792-E849 PolarHBondContact N-O 3.41Å; F837-E849 HydrophobicContact CE1-CB 4.32Å; F837-E849 HydrophobicContact CZ-CB 4.34Å; T845-E849 PolarHBondContact O-N 2.8Å; T845-E849 PolarHBondContact OG1-OE1 3.37Å; V846-E849 WeakPolarHBondContact O-CB 3.11Å; V846-E849 PolarHBondContact O-N 2.81Å; E849-R853 IonicContact OE1-CZ 3.5Å; E849-R853 IonicContact OE1-NH1 3.47Å; E849-R853 PolarHBondContact OE1-NH1 3.48Å; E849-R853 IonicContact OE1-NH2 2.79Å; E849-R853 PolarHBondContact OE1-NH2 3.4Å; E849-R853 IonicContact OE2-CZ 3.87Å; E849-R853 IonicContact OE2-NE 2.66Å; E849-R853 IonicContact OE2-NH1 3.22Å; E849-R853 PolarHBondContact OE2-NH1 3.27Å; E849-R853 VanDerWaalsContact OE2-NH1 3.09Å; E849-R853 IonicContact OE2-NH2 3.37Å; E849-R853 PolarHBondContact OE2-NH2 3.3Å
850	P	92.7	Very high	81.8	Confident	37 Å²	37	55.3 Å²	55.3	24%	0.24	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-75	146.6	178.5	31.5	-34.2	0	0	0	111.5	S852 R853	P850-S852 PolarHBondContact O-N 3.3Å; P850-S852 VanDerWaalsContact O-N 3.13Å; P850-R853 HydrophobicContact CG-CG 4.5Å; P850-R853 PolarHBondContact O-N 3.3Å
851	I	92	Very high	80.4	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-26.8	176.3	-79.7	168.1	0	0	0	113.4	L786 P788 D790 A795 V811 I829 R853 I854 I855	L786-I851 HydrophobicContact CB-CD1 4.19Å; L786-I851 HydrophobicContact CD1-CD1 3.97Å; L786-I851 HydrophobicContact CD2-CD1 4.03Å; L786-I851 HydrophobicContact CG-CD1 4.29Å; P788-I851 CarbonylContact O-C 3.58Å; P788-I851 PolarHBondContact O-N 2.93Å; D790-I851 HydrophobicContact CB-CD1 3.71Å; D790-I851 WeakPolarHBondContact O-CB 3.47Å; D790-I851 WeakPolarHBondContact O-CD1 3.48Å; D790-I851 VanDerWaalsContact O-CG1 3.24Å; D790-I851 WeakPolarHBondContact O-CG1 3.41Å; D790-I851 PolarHBondContact O-N 3.26Å; A795-I851 HydrophobicContact CB-CD1 3.68Å; A795-I851 HydrophobicContact CB-CG1 4.24Å; V811-I851 HydrophobicContact CG1-CG2 4.17Å; V811-I851 HydrophobicContact CG2-CG2 4.27Å; I829-I851 HydrophobicContact CD1-CB 4.4Å; I829-I851 HydrophobicContact CD1-CD1 3.99Å; I829-I851 HydrophobicContact CD1-CG1 4.03Å; I829-I851 HydrophobicContact CD1-CG2 3.53Å; I829-I851 HydrophobicContact CG1-CG2 4.46Å; I851-R853 PolarHBondContact O-N 3.38Å; I851-I854 WeakPolarHBondContact O-CB 3.29Å; I851-I854 PolarHBondContact O-N 3.36Å; I851-I855 HydrophobicContact CG2-CD1 3.72Å; I851-I855 HydrophobicContact CG2-CG1 4.17Å; I851-I855 PolarHBondContact O-N 3.5Å
852	S	90.9	Very high	79.3	Confident	27 Å²	27	56.8 Å²	56.8	19%	0.189	31%	0.306	C	S	.	.	H	α-helix	trans	-49.9	-41.1	176.6	81.8	0	0	0	0	112.2	P788 P850 I854 I855 E856	P788-S852 PolarHBondContact O-N 3.42Å; P850-S852 PolarHBondContact O-N 3.3Å; P850-S852 VanDerWaalsContact O-N 3.13Å; S852-I854 PolarHBondContact O-N 3.29Å; S852-I855 CarbonylContact O-C 3.51Å; S852-I855 WeakPolarHBondContact O-CA 3.39Å; S852-I855 WeakPolarHBondContact O-CB 3.41Å; S852-I855 PolarHBondContact O-N 3Å; S852-E856 VanDerWaalsContact C-OE1 3.25Å; S852-E856 VanDerWaalsContact CB-OE1 3.24Å; S852-E856 WeakPolarHBondContact CB-OE1 3.27Å; S852-E856 WeakPolarHBondContact O-CB 3.45Å; S852-E856 VanDerWaalsContact O-CG 3.24Å; S852-E856 WeakPolarHBondContact O-CG 3Å; S852-E856 PolarHBondContact O-N 3.37Å; S852-E856 PolarHBondContact OG-OE1 3.05Å
853	R	89.6	Confident	78.7	Confident	112 Å²	112	55 Å²	55	42%	0.423	30%	0.297	S	S	.	.	H	α-helix	trans	-64.6	-22.5	179.3	-66.8	-168.2	-176.5	171.3	17	114.2	F837 E849 P850 I851 K857	F837-R853 HydrophobicContact CE2-CB 3.98Å; F837-R853 HydrophobicContact CZ-CB 4.11Å; E849-R853 IonicContact OE1-CZ 3.5Å; E849-R853 IonicContact OE1-NH1 3.47Å; E849-R853 PolarHBondContact OE1-NH1 3.48Å; E849-R853 IonicContact OE1-NH2 2.79Å; E849-R853 PolarHBondContact OE1-NH2 3.4Å; E849-R853 IonicContact OE2-CZ 3.87Å; E849-R853 IonicContact OE2-NE 2.66Å; E849-R853 IonicContact OE2-NH1 3.22Å; E849-R853 PolarHBondContact OE2-NH1 3.27Å; E849-R853 VanDerWaalsContact OE2-NH1 3.09Å; E849-R853 IonicContact OE2-NH2 3.37Å; E849-R853 PolarHBondContact OE2-NH2 3.3Å; P850-R853 HydrophobicContact CG-CG 4.5Å; P850-R853 PolarHBondContact O-N 3.3Å; I851-R853 PolarHBondContact O-N 3.38Å; R853-K857 WeakPolarHBondContact O-CG 3.36Å
854	I	89.5	Confident	78	Confident	9 Å²	9	59.4 Å²	59.4	5%	0.046	31%	0.307	C	S	.	.	H	α-helix	trans	-78.1	-44.5	170.6	-58.5	179.2	0	0	0	109.3	V792 D833 L834 F837 I851 S852 K857 K858	V792-I854 HydrophobicContact CG2-CD1 4.05Å; D833-I854 HydrophobicContact CB-CG2 3.93Å; L834-I854 HydrophobicContact CD2-CD1 3.75Å; L834-I854 HydrophobicContact CG-CD1 4.28Å; F837-I854 HydrophobicContact CB-CD1 3.97Å; F837-I854 HydrophobicContact CB-CG1 3.95Å; F837-I854 HydrophobicContact CD1-CD1 4.11Å; F837-I854 HydrophobicContact CD1-CG1 4.08Å; F837-I854 HydrophobicContact CD2-CD1 4.38Å; F837-I854 HydrophobicContact CD2-CG1 3.55Å; F837-I854 HydrophobicContact CE1-CG1 4.48Å; F837-I854 HydrophobicContact CE2-CG1 3.98Å; F837-I854 HydrophobicContact CG-CD1 3.91Å; F837-I854 HydrophobicContact CG-CG1 3.59Å; F837-I854 HydrophobicContact CZ-CG1 4.43Å; I851-I854 WeakPolarHBondContact O-CB 3.29Å; I851-I854 PolarHBondContact O-N 3.36Å; S852-I854 PolarHBondContact O-N 3.29Å; I854-K857 PolarHBondContact O-N 3.27Å; I854-K858 WeakPolarHBondContact O-CB 3.41Å; I854-K858 PolarHBondContact O-N 2.81Å; I854-K858 VanDerWaalsContact O-N 3.12Å
855	I	86.5	Confident	78	Confident	15 Å²	15	56.6 Å²	56.6	8%	0.077	29%	0.292	C	S	.	.	H	α-helix	trans	-65.3	-41.2	-178.9	-62.3	173.5	0	0	0	111.3	V811 Q825 I851 S852 K857 K858 S859	V811-I855 HydrophobicContact CB-CD1 4.03Å; V811-I855 HydrophobicContact CG1-CD1 3.81Å; V811-I855 HydrophobicContact CG2-CD1 4.12Å; Q825-I855 VanDerWaalsContact NE2-CG2 3.32Å; I851-I855 HydrophobicContact CG2-CD1 3.72Å; I851-I855 HydrophobicContact CG2-CG1 4.17Å; I851-I855 PolarHBondContact O-N 3.5Å; S852-I855 CarbonylContact O-C 3.51Å; S852-I855 WeakPolarHBondContact O-CA 3.39Å; S852-I855 WeakPolarHBondContact O-CB 3.41Å; S852-I855 PolarHBondContact O-N 3Å; I855-K857 PolarHBondContact O-N 2.77Å; I855-K858 CarbonylContact O-C 3.59Å; I855-K858 PolarHBondContact O-N 2.81Å; I855-S859 WeakPolarHBondContact O-CB 3.49Å; I855-S859 PolarHBondContact O-N 2.8Å; I855-S859 PolarHBondContact O-OG 2.72Å
856	E	83.4	Confident	77.9	Confident	112 Å²	112	57.7 Å²	57.7	52%	0.523	29%	0.292	S	S	.	.	H	α-helix	trans	-59.2	-42.9	176.5	-71.5	153.8	-146.4	0	0	112	S852 K858 S859	S852-E856 VanDerWaalsContact C-OE1 3.25Å; S852-E856 VanDerWaalsContact CB-OE1 3.24Å; S852-E856 WeakPolarHBondContact CB-OE1 3.27Å; S852-E856 WeakPolarHBondContact O-CB 3.45Å; S852-E856 VanDerWaalsContact O-CG 3.24Å; S852-E856 WeakPolarHBondContact O-CG 3Å; S852-E856 PolarHBondContact O-N 3.37Å; S852-E856 PolarHBondContact OG-OE1 3.05Å; E856-K858 VanDerWaalsContact C-N 3.3Å; E856-K858 PolarHBondContact O-N 3.42Å; E856-S859 PolarHBondContact O-OG 3.23Å
857	K	79.2	Confident	77.6	Confident	139 Å²	139	61.9 Å²	61.9	60%	0.604	31%	0.312	S	S	*	.	H	α-helix	trans	-67.6	-30.1	174.2	-68.9	176.3	-179.2	-177.8	0	112.4	R853 I854 I855 H861	R853-K857 WeakPolarHBondContact O-CG 3.36Å; I854-K857 PolarHBondContact O-N 3.27Å; I855-K857 PolarHBondContact O-N 2.77Å; K857-H861 PolarHBondContact O-ND1 2.62Å
858	K	77.3	Confident	77.6	Confident	32 Å²	32	62 Å²	62	14%	0.139	31%	0.313	C	S	.	.	H	α-helix	trans	-89.5	-31.3	-175.1	-169.6	174.6	-173.3	170.7	0	114.4	F828 D833 I854 I855 E856 V860 H861 C862	F828-K858 PolarHBondContact O-NZ 3.26Å; D833-K858 VanDerWaalsContact CG-NZ 3.28Å; D833-K858 WeakPolarHBondContact OD1-CD 3.4Å; D833-K858 WeakPolarHBondContact OD1-CE 3.28Å; D833-K858 IonicContact OD1-NZ 2.69Å; D833-K858 PolarHBondContact OD1-NZ 3.37Å; D833-K858 IonicContact OD2-NZ 3.09Å; D833-K858 PolarHBondContact OD2-NZ 2.78Å; I854-K858 WeakPolarHBondContact O-CB 3.41Å; I854-K858 PolarHBondContact O-N 2.81Å; I854-K858 VanDerWaalsContact O-N 3.12Å; I855-K858 CarbonylContact O-C 3.59Å; I855-K858 PolarHBondContact O-N 2.81Å; E856-K858 VanDerWaalsContact C-N 3.3Å; E856-K858 PolarHBondContact O-N 3.42Å; K858-V860 VanDerWaalsContact C-N 3.29Å; K858-V860 PolarHBondContact O-N 3.38Å; K858-H861 PolarHBondContact O-N 3.38Å; K858-C862 PolarHBondContact O-N 3.3Å
859	S	60.8	Low	77.7	Confident	57 Å²	57	60.8 Å²	60.8	40%	0.399	31%	0.307	S	S	.	.	H	α-helix	trans	-61.2	-38.3	-175.2	61.8	0	0	0	0	112.1	I855 E856 H861 C862	I855-S859 WeakPolarHBondContact O-CB 3.49Å; I855-S859 PolarHBondContact O-N 2.8Å; I855-S859 PolarHBondContact O-OG 2.72Å; E856-S859 PolarHBondContact O-OG 3.23Å; S859-H861 PolarHBondContact O-N 3.03Å; S859-H861 VanDerWaalsContact O-N 3.12Å; S859-C862 PolarHBondContact O-N 3.1Å
860	V	55.6	Low	77.8	Confident	117 Å²	117	59.2 Å²	59.2	71%	0.709	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-28.6	172.2	-178.9	0	0	0	0	112.9	K858	K858-V860 VanDerWaalsContact C-N 3.29Å; K858-V860 PolarHBondContact O-N 3.38Å
861	H	56.6	Low	77.8	Confident	97 Å²	97	58 Å²	58	45%	0.449	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	-5.1	-170.2	-61.8	94.6	0	0	0	114.3	H249 K857 K858 S859	H249-H861 PolarHBondContact O-CD2 3.04Å; K857-H861 PolarHBondContact O-ND1 2.62Å; K858-H861 PolarHBondContact O-N 3.38Å; S859-H861 PolarHBondContact O-N 3.03Å; S859-H861 VanDerWaalsContact O-N 3.12Å
862	C	59.7	Low	77.7	Confident	46 Å²	46	59 Å²	59	31%	0.311	30%	0.296	S	S	.	.			trans	-148.4	76.6	-168.9	-166.5	0	0	0	0	113.1	K858 S859 Y864 Q865	K858-C862 PolarHBondContact O-N 3.3Å; S859-C862 PolarHBondContact O-N 3.1Å; C862-Y864 VanDerWaalsContact C-N 3.26Å; C862-Y864 PolarHBondContact O-N 3.37Å; C862-Q865 HydrophobicContact CB-CG 4.36Å
863	P	58.6	Low	77.6	Confident	100 Å²	100	61.9 Å²	61.9	65%	0.649	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-11.5	-171.9	28.7	-36.1	0	0	0	115
864	Y	64.1	Low	77.6	Confident	137 Å²	137	57.7 Å²	57.7	54%	0.537	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-0.2	-170.8	-58.8	-66.4	0	0	0	115.3	C862 Q866 Q867 C868	C862-Y864 VanDerWaalsContact C-N 3.26Å; C862-Y864 PolarHBondContact O-N 3.37Å; Y864-Q866 PolarHBondContact O-N 2.83Å; Y864-Q866 VanDerWaalsContact O-N 3.11Å; Y864-Q867 WeakPolarHBondContact O-CB 3.19Å; Y864-Q867 PolarHBondContact O-N 2.86Å; Y864-C868 PolarHBondContact O-SG 2.87Å
865	Q	72.4	Confident	77.7	Confident	13 Å²	13	58.9 Å²	58.9	6%	0.061	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-55.3	-34.7	-173.3	-66	179.6	8.8	0	0	114	I826 S827 C862 Q867 C868	I826-Q865 WeakPolarHBondContact O-CB 3.25Å; S827-Q865 VanDerWaalsContact CA-OE1 3.24Å; S827-Q865 PolarHBondContact OG-OE1 3.1Å; C862-Q865 HydrophobicContact CB-CG 4.36Å; Q865-Q867 PolarHBondContact O-N 3.33Å; Q865-C868 WeakPolarHBondContact O-CB 3.18Å; Q865-C868 PolarHBondContact O-N 3.05Å; Q865-C868 VanDerWaalsContact O-N 3.15Å
866	Q	77.3	Confident	77.8	Confident	88 Å²	88	58.2 Å²	58.2	41%	0.411	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-66.4	-17.3	177.3	-52.5	-68.7	4	0	0	113.6	Y864	Y864-Q866 PolarHBondContact O-N 2.83Å; Y864-Q866 VanDerWaalsContact O-N 3.11Å
867	Q	80.5	Confident	78	Confident	87 Å²	87	55.4 Å²	55.4	41%	0.407	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-90.9	-10	177.2	-56	-169.4	23	0	0	112.8	Y864 Q865 V869 L886	Y864-Q867 WeakPolarHBondContact O-CB 3.19Å; Y864-Q867 PolarHBondContact O-N 2.86Å; Q865-Q867 PolarHBondContact O-N 3.33Å; Q867-V869 PolarHBondContact O-N 2.86Å; Q867-L886 HydrophobicContact CB-CD1 3.86Å; Q867-L886 HydrophobicContact CB-CD2 3.73Å; Q867-L886 HydrophobicContact CB-CG 4.48Å; Q867-L886 VanDerWaalsContact O-CD1 3.24Å; Q867-L886 WeakPolarHBondContact O-CD1 3.3Å
868	C	86.1	Confident	78.4	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.034	28%	0.28	C	S	.	.			trans	-78.7	44.4	-172.8	-56.9	0	0	0	0	113.2	F828 Y864 Q865 L891 I892	F828-C868 HydrophobicContact CE2-CB 3.5Å; F828-C868 HydrophobicContact CZ-CB 3.61Å; Y864-C868 PolarHBondContact O-SG 2.87Å; Q865-C868 WeakPolarHBondContact O-CB 3.18Å; Q865-C868 PolarHBondContact O-N 3.05Å; Q865-C868 VanDerWaalsContact O-N 3.15Å; C868-L891 VanDerWaalsContact C-CD2 3.46Å; C868-L891 VanDerWaalsContact CA-CD2 3.49Å; C868-L891 HydrophobicContact CB-CD2 4.11Å; C868-L891 WeakPolarHBondContact O-CA 3.47Å; C868-I892 PolarHBondContact O-N 2.76Å
869	V	90	Very high	79.1	Confident	13 Å²	13	50.7 Å²	50.7	8%	0.079	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	153.7	-174.1	-58.8	0	0	0	0	110.9	I826 Q867 R882 I892 F894 F910	I826-V869 HydrophobicContact CD1-CG1 3.5Å; Q867-V869 PolarHBondContact O-N 2.86Å; V869-R882 WeakPolarHBondContact O-CD 3.05Å; V869-R882 PolarHBondContact O-NH1 2.83Å; V869-I892 CarbonylContact C-O 3.52Å; V869-I892 WeakPolarHBondContact CA-O 3.24Å; V869-F894 HydrophobicContact CB-CD2 4.19Å; V869-F894 HydrophobicContact CB-CE2 4.03Å; V869-F894 HydrophobicContact CG1-CD2 4.34Å; V869-F894 HydrophobicContact CG1-CE2 3.68Å; V869-F910 HydrophobicContact CG1-CE1 4.49Å; V869-F910 HydrophobicContact CG2-CE1 4.13Å; V869-F910 HydrophobicContact CG2-CZ 4.38Å
870	C	91.7	Very high	80.4	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	163.1	170.5	61.2	0	0	0	0	110.6	E874 V879 L891 I892 M893 F894	C870-E874 WeakPolarHBondContact CA-OE2 3.04Å; C870-E874 WeakPolarHBondContact CB-OE2 3.47Å; C870-V879 HydrophobicContact CB-CG2 4.16Å; C870-L891 HydrophobicContact CB-CB 4.35Å; C870-L891 HydrophobicContact CB-CD1 4.29Å; C870-I892 PolarHBondContact N-O 3.21Å; C870-I892 PolarHBondContact SG-O 3.15Å; C870-I892 VanDerWaalsContact SG-O 3.39Å; C870-M893 CarbonylContact O-C 3.55Å; C870-M893 WeakPolarHBondContact O-CA 3.38Å; C870-F894 PolarHBondContact O-N 2.78Å
871	F	90.9	Very high	81.9	Confident	13 Å²	13	45.7 Å²	45.7	6%	0.057	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146.1	178.1	-61.5	-86.4	0	0	0	110.6	I751 T873 E874 F894 R897 F910	I751-F871 VanDerWaalsContact CG2-O 3.22Å; I751-F871 WeakPolarHBondContact CG2-O 3.45Å; F871-T873 PolarHBondContact O-N 2.86Å; F871-E874 HydrophobicContact CB-CG 4.16Å; F871-E874 PolarHBondContact N-OE2 3.19Å; F871-E874 PolarHBondContact O-N 3.43Å; F871-F894 WeakPolarHBondContact CA-O 3.48Å; F871-F894 HydrophobicContact CD1-CB 4.04Å; F871-F894 HydrophobicContact CE1-CB 4.12Å; F871-R897 HydrophobicContact CD1-CG 3.85Å; F871-R897 HydrophobicContact CD2-CG 4.32Å; F871-R897 HydrophobicContact CE1-CG 3.43Å; F871-R897 VanDerWaalsContact CE1-CG 3.43Å; F871-R897 HydrophobicContact CE2-CG 3.96Å; F871-R897 HydrophobicContact CG-CG 4.27Å; F871-R897 HydrophobicContact CZ-CG 3.5Å; F871-R897 VanDerWaalsContact CZ-CG 3.5Å; F871-F910 HydrophobicContact CE1-CD1 4.39Å; F871-F910 HydrophobicContact CE1-CE1 4.44Å; F871-F910 HydrophobicContact CZ-CD1 4.25Å; F871-F910 AromaticContact CZ-CE1 3.86Å; F871-F910 HydrophobicContact CZ-CE1 3.86Å
872	V	90.2	Very high	83.4	Confident	19 Å²	19	42.5 Å²	42.5	12%	0.115	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-44.8	-29.7	174.6	159	0	0	0	0	113.6	G752 M893 F894	G752-V872 VanDerWaalsContact CA-O 3.28Å; G752-V872 WeakPolarHBondContact CA-O 3.49Å; G752-V872 PolarHBondContact N-O 3.21Å; V872-M893 HydrophobicContact CG2-CE 4.48Å; V872-M893 HydrophobicContact CG2-CG 3.98Å; V872-M893 HydrophobicContact CG2-SD 3.97Å; V872-F894 WeakPolarHBondContact CG2-O 3.34Å; V872-F894 PolarHBondContact N-O 3.36Å
873	T	89.2	Confident	84.8	Confident	88 Å²	88	40.4 Å²	40.4	54%	0.54	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	-5.8	-178.5	55.7	0	0	0	0	115.5	F871 T896	F871-T873 PolarHBondContact O-N 2.86Å; T873-T896 HydrophobicContact CG2-CG2 3.8Å
874	E	90.8	Very high	86	Confident	24 Å²	24	37.6 Å²	37.6	11%	0.112	19%	0.185	C	C	.	.	S	Bend	trans	-82.8	143.7	-179.5	-67.8	176.2	141.9	0	0	111.1	I751 C870 F871 I878 V879 R882	I751-E874 WeakPolarHBondContact CB-O 3.48Å; I751-E874 VanDerWaalsContact CG2-O 3.3Å; I751-E874 WeakPolarHBondContact CG2-O 3.45Å; I751-E874 PolarHBondContact N-O 2.8Å; C870-E874 WeakPolarHBondContact CA-OE2 3.04Å; C870-E874 WeakPolarHBondContact CB-OE2 3.47Å; F871-E874 HydrophobicContact CB-CG 4.16Å; F871-E874 PolarHBondContact N-OE2 3.19Å; F871-E874 PolarHBondContact O-N 3.43Å; E874-I878 HydrophobicContact CB-CG2 4.32Å; E874-I878 HydrophobicContact CG-CG2 4.47Å; E874-V879 HydrophobicContact CB-CG2 4.22Å; E874-R882 VanDerWaalsContact CD-NH1 3.31Å; E874-R882 VanDerWaalsContact CD-NH2 3.31Å; E874-R882 IonicContact OE1-CZ 3.68Å; E874-R882 IonicContact OE1-NH1 3.36Å; E874-R882 PolarHBondContact OE1-NH1 3.49Å; E874-R882 VanDerWaalsContact OE1-NH1 3.09Å; E874-R882 IonicContact OE1-NH2 3.84Å; E874-R882 PolarHBondContact OE1-NH2 3.07Å; E874-R882 IonicContact OE2-CZ 2.72Å; E874-R882 IonicContact OE2-NH1 3.5Å; E874-R882 PolarHBondContact OE2-NH1 3.49Å; E874-R882 IonicContact OE2-NH2 2.74Å; E874-R882 PolarHBondContact OE2-NH2 3.37Å
875	T	89.9	Confident	87	Confident	35 Å²	35	38.6 Å²	38.6	22%	0.215	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-81.9	159.9	-177.6	45.8	0	0	0	0	112.9	N748 V749 D877 I878 V879	N748-T875 VanDerWaalsContact O-CG2 3.29Å; N748-T875 WeakPolarHBondContact O-CG2 3.25Å; V749-T875 WeakPolarHBondContact O-CA 3.37Å; T875-D877 VanDerWaalsContact C-N 3.28Å; T875-D877 WeakPolarHBondContact CB-OD1 3.45Å; T875-D877 PolarHBondContact O-N 3.27Å; T875-D877 PolarHBondContact OG1-OD1 2.78Å; T875-I878 PolarHBondContact O-N 3.49Å; T875-I878 VanDerWaalsContact O-N 3.09Å; T875-I878 WeakPolarHBondContact OG1-CD1 3.42Å; T875-V879 WeakPolarHBondContact O-CG2 3.34Å; T875-V879 PolarHBondContact O-N 2.74Å
876	V	89	Confident	87.5	Confident	1 Å²	1	39 Å²	39	1%	0.006	19%	0.19	C	C	.	.	H	α-helix	trans	-60.4	-33.2	-174.1	173.7	0	0	0	0	112.6	M747 V749 I751 L880 V922 V926	M747-V876 WeakPolarHBondContact O-CB 3.08Å; M747-V876 PolarHBondContact O-N 3.28Å; M747-V876 HydrophobicContact SD-CB 4.38Å; M747-V876 HydrophobicContact SD-CG1 4.03Å; V749-V876 PolarHBondContact O-N 3.33Å; V749-V876 VanDerWaalsContact O-N 3.13Å; I751-V876 HydrophobicContact CD1-CG2 4.08Å; V876-L880 HydrophobicContact CG1-CD1 3.92Å; V876-L880 HydrophobicContact CG1-CG 4.28Å; V876-L880 VanDerWaalsContact O-CB 3.23Å; V876-L880 WeakPolarHBondContact O-CB 3.24Å; V876-L880 VanDerWaalsContact O-CG 3.24Å; V876-L880 WeakPolarHBondContact O-CG 3.44Å; V876-L880 PolarHBondContact O-N 3.4Å; V876-V922 HydrophobicContact CG1-CG1 3.81Å; V876-V926 HydrophobicContact CG1-CG2 3.86Å
877	D	87.4	Confident	87.8	Confident	52 Å²	52	41.9 Å²	41.9	28%	0.278	20%	0.202	S	C	.	.	H	α-helix	trans	-62	-46.5	171.2	61.1	-29.9	0	0	0	113.4	M747 T875 V879 L880 D881	M747-D877 HydrophobicContact CG-CB 3.73Å; M747-D877 PolarHBondContact O-N 2.98Å; M747-D877 HydrophobicContact SD-CB 3.88Å; T875-D877 VanDerWaalsContact C-N 3.28Å; T875-D877 WeakPolarHBondContact CB-OD1 3.45Å; T875-D877 PolarHBondContact O-N 3.27Å; T875-D877 PolarHBondContact OG1-OD1 2.78Å; D877-V879 VanDerWaalsContact C-N 3.31Å; D877-V879 PolarHBondContact O-N 3.33Å; D877-L880 PolarHBondContact O-N 3.38Å; D877-D881 PolarHBondContact O-N 2.93Å
878	I	89.2	Confident	87.8	Confident	73 Å²	73	39.3 Å²	39.3	37%	0.374	19%	0.192	S	C	.	.	H	α-helix	trans	-64.4	-39.4	-179.9	-65.1	175.5	0	0	0	110.4	E874 T875 R882	E874-I878 HydrophobicContact CB-CG2 4.32Å; E874-I878 HydrophobicContact CG-CG2 4.47Å; T875-I878 PolarHBondContact O-N 3.49Å; T875-I878 VanDerWaalsContact O-N 3.09Å; T875-I878 WeakPolarHBondContact OG1-CD1 3.42Å; I878-R882 VanDerWaalsContact CG2-NH2 3.32Å; I878-R882 VanDerWaalsContact O-CB 3.29Å; I878-R882 WeakPolarHBondContact O-CB 3.43Å; I878-R882 PolarHBondContact O-N 3.24Å
879	V	90.5	Very high	87.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-67.3	-45.5	175.6	173.1	0	0	0	0	110.6	I751 C870 E874 T875 D877 R882 M883 L891 V917	I751-V879 HydrophobicContact CB-CG2 4.06Å; I751-V879 HydrophobicContact CD1-CG1 4.31Å; I751-V879 HydrophobicContact CG1-CG1 4.45Å; I751-V879 HydrophobicContact CG1-CG2 4.14Å; I751-V879 HydrophobicContact CG2-CG2 4.18Å; C870-V879 HydrophobicContact CB-CG2 4.16Å; E874-V879 HydrophobicContact CB-CG2 4.22Å; T875-V879 WeakPolarHBondContact O-CG2 3.34Å; T875-V879 PolarHBondContact O-N 2.74Å; D877-V879 VanDerWaalsContact C-N 3.31Å; D877-V879 PolarHBondContact O-N 3.33Å; V879-R882 PolarHBondContact O-N 3.43Å; V879-M883 HydrophobicContact CG1-SD 4.36Å; V879-M883 WeakPolarHBondContact O-CG 3.05Å; V879-M883 PolarHBondContact O-N 3.28Å; V879-L891 HydrophobicContact CG1-CD1 4.15Å; V879-V917 HydrophobicContact CG1-CB 4.47Å; V879-V917 HydrophobicContact CG1-CG1 4.06Å; V879-V917 HydrophobicContact CG1-CG2 4.47Å
880	L	88.6	Confident	87.5	Confident	8 Å²	8	40.7 Å²	40.7	4%	0.042	20%	0.201	C	C	.	.	H	α-helix	trans	-59	-56.2	175.4	-85	170.8	0	0	0	112.2	L731 M747 V876 D877 R882 M883 F884 V922	L731-L880 HydrophobicContact CD1-CD2 3.63Å; L731-L880 HydrophobicContact CG-CD2 4.37Å; M747-L880 HydrophobicContact CE-CD1 3.77Å; M747-L880 HydrophobicContact SD-CD1 3.6Å; M747-L880 VanDerWaalsContact SD-CD1 3.6Å; V876-L880 HydrophobicContact CG1-CD1 3.92Å; V876-L880 HydrophobicContact CG1-CG 4.28Å; V876-L880 VanDerWaalsContact O-CB 3.23Å; V876-L880 WeakPolarHBondContact O-CB 3.24Å; V876-L880 VanDerWaalsContact O-CG 3.24Å; V876-L880 WeakPolarHBondContact O-CG 3.44Å; V876-L880 PolarHBondContact O-N 3.4Å; D877-L880 PolarHBondContact O-N 3.38Å; L880-R882 PolarHBondContact O-N 2.92Å; L880-M883 WeakPolarHBondContact O-CB 3.15Å; L880-M883 PolarHBondContact O-N 3Å; L880-F884 HydrophobicContact CB-CD2 4.43Å; L880-F884 HydrophobicContact CB-CE2 3.89Å; L880-F884 HydrophobicContact CD2-CE2 3.69Å; L880-F884 HydrophobicContact CD2-CZ 3.84Å; L880-F884 HydrophobicContact CG-CE2 4.37Å; L880-F884 WeakPolarHBondContact O-CD2 3.36Å; L880-F884 WeakPolarHBondContact O-CE2 3.47Å; L880-F884 PolarHBondContact O-N 3.47Å; L880-V922 HydrophobicContact CD1-CG1 4.1Å; L880-V922 HydrophobicContact CD2-CB 4.43Å; L880-V922 HydrophobicContact CD2-CG1 3.56Å; L880-V922 HydrophobicContact CG-CG1 3.77Å
881	D	87.1	Confident	87.5	Confident	60 Å²	60	40.7 Å²	40.7	32%	0.321	20%	0.201	S	C	.	.	H	α-helix	trans	-55.4	-41.7	-179.5	-175.6	68.8	0	0	0	111.2	R735 D877 F884 R885	R735-D881 IonicContact CZ-OD1 2.87Å; R735-D881 IonicContact NE-OD1 3.98Å; R735-D881 IonicContact NH2-OD1 3.78Å; R735-D881 PolarHBondContact NH2-OD1 3.42Å; D877-D881 PolarHBondContact O-N 2.93Å; D881-F884 PolarHBondContact O-N 2.94Å; D881-R885 WeakPolarHBondContact O-CB 3.3Å; D881-R885 PolarHBondContact O-N 2.73Å
882	R	89.2	Confident	87.5	Confident	31 Å²	31	40 Å²	40	12%	0.117	20%	0.198	C	C	.	.	H	α-helix	trans	-62.2	-45.7	176.2	-169.3	173.8	-53.6	161.6	10.4	112.6	V869 E874 I878 V879 L880 F884 R885 L886 L891	V869-R882 WeakPolarHBondContact O-CD 3.05Å; V869-R882 PolarHBondContact O-NH1 2.83Å; E874-R882 VanDerWaalsContact CD-NH1 3.31Å; E874-R882 VanDerWaalsContact CD-NH2 3.31Å; E874-R882 IonicContact OE1-CZ 3.68Å; E874-R882 IonicContact OE1-NH1 3.36Å; E874-R882 PolarHBondContact OE1-NH1 3.49Å; E874-R882 VanDerWaalsContact OE1-NH1 3.09Å; E874-R882 IonicContact OE1-NH2 3.84Å; E874-R882 PolarHBondContact OE1-NH2 3.07Å; E874-R882 IonicContact OE2-CZ 2.72Å; E874-R882 IonicContact OE2-NH1 3.5Å; E874-R882 PolarHBondContact OE2-NH1 3.49Å; E874-R882 IonicContact OE2-NH2 2.74Å; E874-R882 PolarHBondContact OE2-NH2 3.37Å; I878-R882 VanDerWaalsContact CG2-NH2 3.32Å; I878-R882 VanDerWaalsContact O-CB 3.29Å; I878-R882 WeakPolarHBondContact O-CB 3.43Å; I878-R882 PolarHBondContact O-N 3.24Å; V879-R882 PolarHBondContact O-N 3.43Å; L880-R882 PolarHBondContact O-N 2.92Å; R882-F884 VanDerWaalsContact C-N 3.32Å; R882-F884 PolarHBondContact O-N 3.06Å; R882-R885 PolarHBondContact O-N 3.46Å; R882-L886 HydrophobicContact CG-CD1 3.74Å; R882-L886 HydrophobicContact CG-CG 4.32Å; R882-L886 WeakPolarHBondContact O-CB 3.48Å; R882-L886 VanDerWaalsContact O-CG 3.25Å; R882-L886 WeakPolarHBondContact O-CG 3.29Å; R882-L886 PolarHBondContact O-N 2.84Å; R882-L891 HydrophobicContact CB-CD1 4.03Å; R882-L891 HydrophobicContact CG-CD1 3.99Å; R882-L891 HydrophobicContact CG-CD2 4.31Å
883	M	88.4	Confident	87.6	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-56.8	-44.9	174.8	-72.4	176.1	70.4	0	0	111.6	L731 V879 L880 K887 T888 P889 L891 A919 V922	L731-M883 HydrophobicContact CD2-CE 3.72Å; V879-M883 HydrophobicContact CG1-SD 4.36Å; V879-M883 WeakPolarHBondContact O-CG 3.05Å; V879-M883 PolarHBondContact O-N 3.28Å; L880-M883 WeakPolarHBondContact O-CB 3.15Å; L880-M883 PolarHBondContact O-N 3Å; M883-K887 CarbonylContact O-C 3.5Å; M883-K887 WeakPolarHBondContact O-CA 3.49Å; M883-K887 PolarHBondContact O-N 2.79Å; M883-T888 PolarHBondContact O-N 2.98Å; M883-P889 WeakPolarHBondContact CE-O 3.39Å; M883-L891 HydrophobicContact CG-CD1 3.63Å; M883-L891 HydrophobicContact CG-CD2 4.48Å; M883-L891 HydrophobicContact CG-CG 3.71Å; M883-A919 HydrophobicContact CE-CB 4.28Å; M883-V922 HydrophobicContact SD-CG2 4.27Å
884	F	83.8	Confident	87.6	Confident	41 Å²	41	35 Å²	35	18%	0.18	17%	0.167	C	C	.	.	H	α-helix	trans	-71	-40.5	179.1	-58.6	-59.4	0	0	0	113.4	L731 R735 L880 D881 R882 L886 K887	L731-F884 HydrophobicContact CB-CE1 4.4Å; L731-F884 HydrophobicContact CD1-CZ 4.24Å; L731-F884 HydrophobicContact CD2-CE1 3.86Å; L731-F884 HydrophobicContact CD2-CZ 4.06Å; L731-F884 HydrophobicContact CG-CE1 3.66Å; L731-F884 HydrophobicContact CG-CZ 3.61Å; L731-F884 WeakPolarHBondContact O-CE1 3.42Å; L731-F884 VanDerWaalsContact O-CZ 3.22Å; L731-F884 WeakPolarHBondContact O-CZ 3.29Å; R735-F884 HydrophobicContact CB-CD1 3.85Å; R735-F884 HydrophobicContact CB-CD2 3.8Å; R735-F884 HydrophobicContact CB-CE1 3.67Å; R735-F884 HydrophobicContact CB-CE2 3.6Å; R735-F884 HydrophobicContact CB-CG 3.92Å; R735-F884 HydrophobicContact CB-CZ 3.54Å; R735-F884 VanDerWaalsContact CD-CE2 3.5Å; R735-F884 HydrophobicContact CG-CB 4.1Å; R735-F884 HydrophobicContact CG-CD1 4.01Å; R735-F884 HydrophobicContact CG-CD2 3.43Å; R735-F884 VanDerWaalsContact CG-CD2 3.43Å; R735-F884 HydrophobicContact CG-CE1 4.29Å; R735-F884 HydrophobicContact CG-CE2 3.74Å; R735-F884 HydrophobicContact CG-CG 3.57Å; R735-F884 HydrophobicContact CG-CZ 4.16Å; L880-F884 HydrophobicContact CB-CD2 4.43Å; L880-F884 HydrophobicContact CB-CE2 3.89Å; L880-F884 HydrophobicContact CD2-CE2 3.69Å; L880-F884 HydrophobicContact CD2-CZ 3.84Å; L880-F884 HydrophobicContact CG-CE2 4.37Å; L880-F884 WeakPolarHBondContact O-CD2 3.36Å; L880-F884 WeakPolarHBondContact O-CE2 3.47Å; L880-F884 PolarHBondContact O-N 3.47Å; D881-F884 PolarHBondContact O-N 2.94Å; R882-F884 VanDerWaalsContact C-N 3.32Å; R882-F884 PolarHBondContact O-N 3.06Å; F884-L886 VanDerWaalsContact C-N 3.3Å; F884-L886 PolarHBondContact O-N 3.12Å; F884-K887 PolarHBondContact O-N 3.25Å
885	R	84.8	Confident	87.1	Confident	158 Å²	158	37.2 Å²	37.2	60%	0.596	18%	0.18	S	C	*	.	H	α-helix	trans	-65.5	-34.6	179.8	-168	-179.4	78	-161.5	8.7	112.1	D881 R882	D881-R885 WeakPolarHBondContact O-CB 3.3Å; D881-R885 PolarHBondContact O-N 2.73Å; R882-R885 PolarHBondContact O-N 3.46Å
886	L	83.9	Confident	86.1	Confident	21 Å²	21	39.2 Å²	39.2	11%	0.11	19%	0.192	C	C	.	.	H	α-helix	trans	-89.1	-9.5	175.3	-58.2	177.7	0	0	0	113.2	Q867 R882 F884 T888 L891	Q867-L886 HydrophobicContact CB-CD1 3.86Å; Q867-L886 HydrophobicContact CB-CD2 3.73Å; Q867-L886 HydrophobicContact CB-CG 4.48Å; Q867-L886 VanDerWaalsContact O-CD1 3.24Å; Q867-L886 WeakPolarHBondContact O-CD1 3.3Å; R882-L886 HydrophobicContact CG-CD1 3.74Å; R882-L886 HydrophobicContact CG-CG 4.32Å; R882-L886 WeakPolarHBondContact O-CB 3.48Å; R882-L886 VanDerWaalsContact O-CG 3.25Å; R882-L886 WeakPolarHBondContact O-CG 3.29Å; R882-L886 PolarHBondContact O-N 2.84Å; F884-L886 VanDerWaalsContact C-N 3.3Å; F884-L886 PolarHBondContact O-N 3.12Å; L886-T888 VanDerWaalsContact C-N 3.3Å; L886-T888 HydrophobicContact CB-CG2 4.08Å; L886-T888 PolarHBondContact O-N 2.78Å; L886-L891 HydrophobicContact CD1-CD2 4.06Å
887	K	82.2	Confident	84.7	Confident	150 Å²	150	46.9 Å²	46.9	65%	0.652	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	39.4	-171.1	-57.6	-171.2	177.4	-168	0	113.7	M883 F884	M883-K887 CarbonylContact O-C 3.5Å; M883-K887 WeakPolarHBondContact O-CA 3.49Å; M883-K887 PolarHBondContact O-N 2.79Å; F884-K887 PolarHBondContact O-N 3.25Å
888	T	81.5	Confident	82.9	Confident	32 Å²	32	51.9 Å²	51.9	20%	0.196	24%	0.24	C	C	.	.			trans	-105.8	142.9	-179.4	59.9	0	0	0	0	113.3	M883 L886 C890	M883-T888 PolarHBondContact O-N 2.98Å; L886-T888 VanDerWaalsContact C-N 3.3Å; L886-T888 HydrophobicContact CB-CG2 4.08Å; L886-T888 PolarHBondContact O-N 2.78Å; T888-C890 WeakPolarHBondContact CB-O 3.28Å; T888-C890 PolarHBondContact O-N 2.8Å; T888-C890 PolarHBondContact OG1-O 3.07Å
889	P	78.8	Confident	80.7	Confident	44 Å²	44	55.5 Å²	55.5	29%	0.286	26%	0.26	S	S	.	.	S	Bend	trans	-75.2	-7.3	175.9	33.4	-37.4	0	0	0	112.9	D728 P807 M883 T918 A919	D728-P889 WeakPolarHBondContact OD1-CB 3.43Å; P807-P889 HydrophobicContact CB-CG 4.45Å; P807-P889 HydrophobicContact CG-CB 4.34Å; P807-P889 HydrophobicContact CG-CG 4.31Å; M883-P889 WeakPolarHBondContact CE-O 3.39Å; P889-T918 CarbonylContact O-C 3.58Å; P889-T918 WeakPolarHBondContact O-CA 3.36Å; P889-A919 PolarHBondContact O-N 2.94Å
890	C	89.8	Confident	78.1	Confident	3 Å²	3	59.1 Å²	59.1	2%	0.02	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	167.7	-177.8	61.7	0	0	0	0	113.8	P807 C808 T888 M916 V917 T918	P807-C890 HydrophobicContact CG-CB 4.17Å; C808-C890 PolarHBondContact SG-SG 3.46Å; T888-C890 WeakPolarHBondContact CB-O 3.28Å; T888-C890 PolarHBondContact O-N 2.8Å; T888-C890 PolarHBondContact OG1-O 3.07Å; C890-M916 HydrophobicContact CB-CE 4.39Å; C890-M916 HydrophobicContact CB-CG 3.97Å; C890-M916 HydrophobicContact CB-SD 3.79Å; C890-V917 CarbonylContact C-O 3.6Å; C890-V917 WeakPolarHBondContact CA-O 3.24Å; C890-V917 WeakPolarHBondContact CB-O 3.03Å; C890-T918 HydrophobicContact CB-CG2 4.35Å
891	L	92.2	Very high	75.8	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	138.9	170.7	-61.1	173.1	0	0	0	110.3	C868 C870 V879 R882 M883 L886 M916 V917	C868-L891 VanDerWaalsContact C-CD2 3.46Å; C868-L891 VanDerWaalsContact CA-CD2 3.49Å; C868-L891 HydrophobicContact CB-CD2 4.11Å; C868-L891 WeakPolarHBondContact O-CA 3.47Å; C870-L891 HydrophobicContact CB-CB 4.35Å; C870-L891 HydrophobicContact CB-CD1 4.29Å; V879-L891 HydrophobicContact CG1-CD1 4.15Å; R882-L891 HydrophobicContact CB-CD1 4.03Å; R882-L891 HydrophobicContact CG-CD1 3.99Å; R882-L891 HydrophobicContact CG-CD2 4.31Å; M883-L891 HydrophobicContact CG-CD1 3.63Å; M883-L891 HydrophobicContact CG-CD2 4.48Å; M883-L891 HydrophobicContact CG-CG 3.71Å; L886-L891 HydrophobicContact CD1-CD2 4.06Å; L891-M916 WeakPolarHBondContact O-CA 3.49Å; L891-M916 WeakPolarHBondContact O-CG 3.47Å; L891-V917 PolarHBondContact N-O 3.44Å; L891-V917 PolarHBondContact O-N 2.9Å
892	I	91.6	Very high	73.2	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	133.4	175	-60.6	166.4	0	0	0	109.2	P810 I826 F828 C868 V869 C870 F894 P913	P810-I892 HydrophobicContact CB-CD1 3.47Å; P810-I892 VanDerWaalsContact CB-CD1 3.47Å; P810-I892 HydrophobicContact CB-CG1 3.84Å; I826-I892 HydrophobicContact CG2-CD1 3.54Å; F828-I892 HydrophobicContact CE1-CD1 3.79Å; F828-I892 HydrophobicContact CE1-CG1 3.66Å; F828-I892 HydrophobicContact CE2-CD1 4.29Å; F828-I892 HydrophobicContact CZ-CD1 3.53Å; F828-I892 HydrophobicContact CZ-CG1 3.65Å; C868-I892 PolarHBondContact O-N 2.76Å; V869-I892 CarbonylContact C-O 3.52Å; V869-I892 WeakPolarHBondContact CA-O 3.24Å; C870-I892 PolarHBondContact N-O 3.21Å; C870-I892 PolarHBondContact SG-O 3.15Å; C870-I892 VanDerWaalsContact SG-O 3.39Å; I892-F894 HydrophobicContact CB-CE2 3.97Å; I892-F894 HydrophobicContact CG2-CD2 4.18Å; I892-F894 HydrophobicContact CG2-CE1 4.49Å; I892-F894 HydrophobicContact CG2-CE2 3.49Å; I892-F894 VanDerWaalsContact CG2-CE2 3.49Å; I892-F894 HydrophobicContact CG2-CZ 3.69Å; I892-P913 HydrophobicContact CG2-CB 3.6Å
893	M	92	Very high	70.3	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	129.6	-179.7	-173.4	172.4	61.1	0	0	111.2	I751 L757 R758 C870 V872 V914 G915 V917	I751-M893 HydrophobicContact CG2-SD 4.12Å; L757-M893 HydrophobicContact CB-CE 3.87Å; R758-M893 HydrophobicContact CG-CE 3.81Å; C870-M893 CarbonylContact O-C 3.55Å; C870-M893 WeakPolarHBondContact O-CA 3.38Å; V872-M893 HydrophobicContact CG2-CE 4.48Å; V872-M893 HydrophobicContact CG2-CG 3.98Å; V872-M893 HydrophobicContact CG2-SD 3.97Å; M893-V914 HydrophobicContact CE-CG1 4.45Å; M893-V914 PolarHBondContact O-N 3.3Å; M893-G915 PolarHBondContact N-O 2.66Å; M893-G915 PolarHBondContact O-N 3.03Å; M893-V917 HydrophobicContact CB-CG2 4.47Å
894	F	89.7	Confident	67.7	Low	0 Å²	0	74.6 Å²	74.6	0%	0	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	151.6	176.3	-67.8	-86.9	0	0	0	111.3	I823 I826 V869 C870 F871 V872 I892 F910 G911 P913	I823-F894 HydrophobicContact CD1-CE1 3.57Å; I823-F894 HydrophobicContact CD1-CZ 3.91Å; I826-F894 HydrophobicContact CD1-CE2 4.11Å; I826-F894 HydrophobicContact CD1-CZ 3.91Å; V869-F894 HydrophobicContact CB-CD2 4.19Å; V869-F894 HydrophobicContact CB-CE2 4.03Å; V869-F894 HydrophobicContact CG1-CD2 4.34Å; V869-F894 HydrophobicContact CG1-CE2 3.68Å; C870-F894 PolarHBondContact O-N 2.78Å; F871-F894 WeakPolarHBondContact CA-O 3.48Å; F871-F894 HydrophobicContact CD1-CB 4.04Å; F871-F894 HydrophobicContact CE1-CB 4.12Å; V872-F894 WeakPolarHBondContact CG2-O 3.34Å; V872-F894 PolarHBondContact N-O 3.36Å; I892-F894 HydrophobicContact CB-CE2 3.97Å; I892-F894 HydrophobicContact CG2-CD2 4.18Å; I892-F894 HydrophobicContact CG2-CE1 4.49Å; I892-F894 HydrophobicContact CG2-CE2 3.49Å; I892-F894 VanDerWaalsContact CG2-CE2 3.49Å; I892-F894 HydrophobicContact CG2-CZ 3.69Å; F894-F910 HydrophobicContact CD1-CB 4.3Å; F894-F910 HydrophobicContact CD1-CD1 4.44Å; F894-F910 HydrophobicContact CD2-CD1 4.19Å; F894-F910 HydrophobicContact CE1-CB 4.17Å; F894-F910 HydrophobicContact CE2-CD1 4.31Å; F894-F910 HydrophobicContact CG-CD1 4.25Å; F894-F910 HydrophobicContact CZ-CD1 4.49Å; F894-G911 VanDerWaalsContact CD1-O 3.24Å; F894-G911 WeakPolarHBondContact CD1-O 3.44Å; F894-G911 VanDerWaalsContact CE1-O 3.25Å; F894-G911 WeakPolarHBondContact CE1-O 3.43Å; F894-P913 HydrophobicContact CD1-CB 4.42Å; F894-P913 HydrophobicContact CE1-CB 3.86Å; F894-P913 HydrophobicContact CZ-CB 4.16Å
895	D	80.1	Confident	65.3	Low	71 Å²	71	77.8 Å²	77.8	38%	0.38	44%	0.439	S	S	.	.	S	Bend	trans	-69.1	168.3	163.9	-133.9	-67.2	0	0	0	111.1	R758 V914	R758-D895 IonicContact NH1-OD2 3.09Å; R758-D895 PolarHBondContact NH1-OD2 2.74Å; D895-V914 HydrophobicContact CB-CG2 3.89Å
896	T	68.5	Low	62.7	Low	77 Å²	77	75.7 Å²	75.7	47%	0.472	46%	0.456	S	S	.	.			trans	-41.8	142.7	-165.4	50.5	0	0	0	0	116.2	T873 K898	T873-T896 HydrophobicContact CG2-CG2 3.8Å; T896-K898 PolarHBondContact O-N 3.41Å; T896-K898 VanDerWaalsContact O-N 3.09Å
897	R	58.6	Low	60.7	Low	162 Å²	162	78.5 Å²	78.5	61%	0.611	48%	0.477	S	S	*	.			trans	-59.5	115.3	164	-65.8	-171.9	-168	-167.3	8	108.5	F871 N899	F871-R897 HydrophobicContact CD1-CG 3.85Å; F871-R897 HydrophobicContact CD2-CG 4.32Å; F871-R897 HydrophobicContact CE1-CG 3.43Å; F871-R897 VanDerWaalsContact CE1-CG 3.43Å; F871-R897 HydrophobicContact CE2-CG 3.96Å; F871-R897 HydrophobicContact CG-CG 4.27Å; F871-R897 HydrophobicContact CZ-CG 3.5Å; F871-R897 VanDerWaalsContact CZ-CG 3.5Å; R897-N899 PolarHBondContact O-N 3.35Å
898	K	50.9	Low	59.3	Low	158 Å²	158	75.8 Å²	75.8	69%	0.687	47%	0.465	S	S	*	.			trans	-64.8	102.1	168.3	-72.5	-175.8	177.2	179.6	0	108.6	T896 S900	T896-K898 PolarHBondContact O-N 3.41Å; T896-K898 VanDerWaalsContact O-N 3.09Å; K898-S900 PolarHBondContact O-N 3.46Å
899	N	42.5	Very low	58	Low	148 Å²	148	77.6 Å²	77.6	79%	0.791	48%	0.477	S	S	*	.			trans	-70.2	79.4	173.5	-82.3	-8.9	0	0	0	110.3	R897 A901	R897-N899 PolarHBondContact O-N 3.35Å; N899-A901 PolarHBondContact O-N 2.82Å
900	S	36.8	Very low	57.2	Low	77 Å²	77	77.8 Å²	77.8	54%	0.538	47%	0.474	S	S	.	.			trans	-69.8	83.2	165.9	56.1	0	0	0	0	109.2	K898 S902	K898-S900 PolarHBondContact O-N 3.46Å; S900-S902 PolarHBondContact O-N 3.48Å
901	A	39.7	Very low	56.2	Low	107 Å²	107	79.4 Å²	79.4	88%	0.884	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	21.9	-178.8	0	0	0	0	0	114.4	N899	N899-A901 PolarHBondContact O-N 2.82Å
902	S	32.9	Very low	55.5	Low	108 Å²	108	86 Å²	86	76%	0.755	52%	0.516	S	S	*	.	T	Hydrogen-bonded Turn	trans	-143.6	33.6	-169.1	58.9	0	0	0	0	113.5	S900	S900-S902 PolarHBondContact O-N 3.48Å
903	C	28.3	Very low	55.3	Low	96 Å²	96	86.5 Å²	86.5	65%	0.649	52%	0.519	S	S	*	.			trans	-153.3	129.6	161.5	-135.7	0	0	0	0	112.4	V905	C903-V905 PolarHBondContact O-N 3.31Å
904	A	32.3	Very low	55.1	Low	114 Å²	114	88 Å²	88	94%	0.942	53%	0.528	S	S	*	.	S	Bend	trans	-79.3	23.4	-178.6	0	0	0	0	0	114
905	V	34.8	Very low	55.1	Low	107 Å²	107	88 Å²	88	65%	0.648	53%	0.528	S	S	*	.			trans	-127.8	83.1	-178.4	-173.3	0	0	0	0	108.3	C903 S907	C903-V905 PolarHBondContact O-N 3.31Å; V905-S907 VanDerWaalsContact C-N 3.3Å; V905-S907 PolarHBondContact O-N 2.92Å
906	A	30.5	Very low	55.7	Low	115 Å²	115	84.7 Å²	84.7	95%	0.95	51%	0.51	S	S	*	.			trans	-79.5	68.8	-172.1	0	0	0	0	0	112.9
907	S	41.2	Very low	56.7	Low	79 Å²	79	81 Å²	81	55%	0.552	49%	0.488	S	S	*	.			trans	-132.5	121.7	176.9	59.2	0	0	0	0	112.6	V905	V905-S907 VanDerWaalsContact C-N 3.3Å; V905-S907 PolarHBondContact O-N 2.92Å
908	K	52.4	Low	58.2	Low	93 Å²	93	73.5 Å²	73.5	40%	0.404	46%	0.46	S	S	.	.			trans	49.9	91	160.6	-62.1	168.3	161.2	-175.9	0	115.8	I823 D824	I823-K908 VanDerWaalsContact O-CD 3.27Å; I823-K908 WeakPolarHBondContact O-CD 3.11Å; I823-K908 WeakPolarHBondContact O-CE 3.49Å; D824-K908 WeakPolarHBondContact O-CE 3.3Å; D824-K908 PolarHBondContact O-NZ 3.33Å; D824-K908 IonicContact OD1-NZ 2.93Å; D824-K908 PolarHBondContact OD1-NZ 3.14Å
909	P	53.4	Low	59.9	Low	70 Å²	70	66 Å²	66	46%	0.455	43%	0.428	S	S	.	.				-128.3	92.8	118.4	34.8	-29.1	0	0	0	111.7	Q821	Q821-P909 WeakPolarHBondContact O-CA 3.34Å; Q821-P909 WeakPolarHBondContact O-CB 3.3Å
910	F	62.8	Low	61.9	Low	49 Å²	49	61.5 Å²	61.5	22%	0.215	40%	0.401	C	S	.	.			trans	-72.7	134.6	160.4	-69	-82.4	0	0	0	108.6	I823 V869 F871 F894	I823-F910 HydrophobicContact CB-CB 4.17Å; I823-F910 HydrophobicContact CB-CD2 4.3Å; I823-F910 HydrophobicContact CD1-CB 3.7Å; I823-F910 HydrophobicContact CG1-CB 4.04Å; V869-F910 HydrophobicContact CG1-CE1 4.49Å; V869-F910 HydrophobicContact CG2-CE1 4.13Å; V869-F910 HydrophobicContact CG2-CZ 4.38Å; F871-F910 HydrophobicContact CE1-CD1 4.39Å; F871-F910 HydrophobicContact CE1-CE1 4.44Å; F871-F910 HydrophobicContact CZ-CD1 4.25Å; F871-F910 AromaticContact CZ-CE1 3.86Å; F871-F910 HydrophobicContact CZ-CE1 3.86Å; F894-F910 HydrophobicContact CD1-CB 4.3Å; F894-F910 HydrophobicContact CD1-CD1 4.44Å; F894-F910 HydrophobicContact CD2-CD1 4.19Å; F894-F910 HydrophobicContact CE1-CB 4.17Å; F894-F910 HydrophobicContact CE2-CD1 4.31Å; F894-F910 HydrophobicContact CG-CD1 4.25Å; F894-F910 HydrophobicContact CZ-CD1 4.49Å
911	G	69	Low	64.3	Low	36 Å²	36	58.7 Å²	58.7	37%	0.371	38%	0.38	S	S	.	.			trans	-69.8	-174.6	167.9	0	0	0	0	0	112.2	F894	F894-G911 VanDerWaalsContact CD1-O 3.24Å; F894-G911 WeakPolarHBondContact CD1-O 3.44Å; F894-G911 VanDerWaalsContact CE1-O 3.25Å; F894-G911 WeakPolarHBondContact CE1-O 3.43Å
912	R	77.2	Confident	66.6	Low	139 Å²	139	53.6 Å²	53.6	53%	0.525	34%	0.338	S	S	.	.			trans	-62.6	143.2	170.6	-70	-176.9	176.6	-178.6	-1.3	110.7	Q819 V914	Q819-R912 PolarHBondContact O-NE 3.27Å; Q819-R912 PolarHBondContact O-NH2 3.47Å; Q819-R912 VanDerWaalsContact O-NH2 3.08Å; R912-V914 PolarHBondContact O-N 2.81Å
913	P	87.3	Confident	69.1	Low	11 Å²	11	48.5 Å²	48.5	7%	0.071	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	126	175.7	27.2	-35.2	0	0	0	110.9	W759 V785 V812 I892 F894	W759-P913 VanDerWaalsContact CD1-O 3.32Å; W759-P913 PolarHBondContact NE1-O 2.96Å; V785-P913 HydrophobicContact CB-CG 4.44Å; V785-P913 HydrophobicContact CG1-CG 4.03Å; V785-P913 HydrophobicContact CG2-CB 4.38Å; V785-P913 HydrophobicContact CG2-CG 3.75Å; V812-P913 HydrophobicContact CG2-CG 4.46Å; I892-P913 HydrophobicContact CG2-CB 3.6Å; F894-P913 HydrophobicContact CD1-CB 4.42Å; F894-P913 HydrophobicContact CE1-CB 3.86Å; F894-P913 HydrophobicContact CZ-CB 4.16Å
914	V	88.1	Confident	71.6	Confident	32 Å²	32	45 Å²	45	19%	0.194	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	-26.4	-172.9	176.2	0	0	0	0	112.4	R758 W759 M893 D895 R912	R758-V914 CarbonylContact C-O 3.54Å; R758-V914 WeakPolarHBondContact CA-O 3.49Å; R758-V914 HydrophobicContact CB-CG1 4.32Å; R758-V914 HydrophobicContact CG-CG1 3.96Å; W759-V914 VanDerWaalsContact CD1-C 3.42Å; W759-V914 VanDerWaalsContact CD1-O 3.24Å; W759-V914 PolarHBondContact N-O 2.91Å; M893-V914 HydrophobicContact CE-CG1 4.45Å; M893-V914 PolarHBondContact O-N 3.3Å; D895-V914 HydrophobicContact CB-CG2 3.89Å; R912-V914 PolarHBondContact O-N 2.81Å
915	G	90.5	Very high	74	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.1	-168.6	-176.9	0	0	0	0	0	112.5	L757 W759 M893	L757-G915 WeakPolarHBondContact O-CA 3.49Å; W759-G915 VanDerWaalsContact CE2-CA 3.48Å; W759-G915 VanDerWaalsContact CZ2-C 3.48Å; W759-G915 WeakPolarHBondContact CZ2-O 3.29Å; M893-G915 PolarHBondContact N-O 2.66Å; M893-G915 PolarHBondContact O-N 3.03Å
916	M	91.1	Very high	76.2	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	140.7	169.9	-178.4	163.7	72.9	0	0	109.6	L757 W759 R762 L806 C808 F828 C890 L891 T918	L757-M916 PolarHBondContact O-N 3Å; W759-M916 HydrophobicContact CH2-CB 3.48Å; W759-M916 VanDerWaalsContact CH2-CB 3.48Å; W759-M916 HydrophobicContact CZ2-CB 4.25Å; W759-M916 HydrophobicContact CZ3-CB 4Å; R762-M916 PolarHBondContact NH2-O 2.96Å; L806-M916 HydrophobicContact CB-CE 3.76Å; L806-M916 HydrophobicContact CD1-CE 4.18Å; L806-M916 HydrophobicContact CD2-CE 3.74Å; L806-M916 HydrophobicContact CG-CE 4.08Å; C808-M916 WeakPolarHBondContact O-CE 3.32Å; F828-M916 HydrophobicContact CE1-SD 4.43Å; C890-M916 HydrophobicContact CB-CE 4.39Å; C890-M916 HydrophobicContact CB-CG 3.97Å; C890-M916 HydrophobicContact CB-SD 3.79Å; L891-M916 WeakPolarHBondContact O-CA 3.49Å; L891-M916 WeakPolarHBondContact O-CG 3.47Å; M916-T918 HydrophobicContact CE-CG2 4.31Å
917	V	91.1	Very high	78.5	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	131.1	174.3	-165.2	0	0	0	0	108.4	I751 L757 V879 C890 L891 M893 V922	I751-V917 HydrophobicContact CD1-CG1 3.97Å; I751-V917 HydrophobicContact CD1-CG2 4.33Å; I751-V917 HydrophobicContact CG1-CG1 4.38Å; I751-V917 HydrophobicContact CG1-CG2 3.81Å; L757-V917 HydrophobicContact CD1-CG1 4.38Å; L757-V917 HydrophobicContact CD1-CG2 4.25Å; L757-V917 HydrophobicContact CD2-CG1 4.37Å; V879-V917 HydrophobicContact CG1-CB 4.47Å; V879-V917 HydrophobicContact CG1-CG1 4.06Å; V879-V917 HydrophobicContact CG1-CG2 4.47Å; C890-V917 CarbonylContact C-O 3.6Å; C890-V917 WeakPolarHBondContact CA-O 3.24Å; C890-V917 WeakPolarHBondContact CB-O 3.03Å; L891-V917 PolarHBondContact N-O 3.44Å; L891-V917 PolarHBondContact O-N 2.9Å; M893-V917 HydrophobicContact CB-CG2 4.47Å; V917-V922 HydrophobicContact CG1-CG2 3.48Å; V917-V922 VanDerWaalsContact CG1-CG2 3.48Å
918	T	89.2	Confident	80	Confident	4 Å²	4	27.3 Å²	27.3	3%	0.025	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	160.7	175.7	77.3	0	0	0	0	112	P807 P889 C890 M916 K920 D921 V922	P807-T918 HydrophobicContact CG-CG2 4.25Å; P889-T918 CarbonylContact O-C 3.58Å; P889-T918 WeakPolarHBondContact O-CA 3.36Å; C890-T918 HydrophobicContact CB-CG2 4.35Å; M916-T918 HydrophobicContact CE-CG2 4.31Å; T918-K920 PolarHBondContact O-N 3Å; T918-K920 VanDerWaalsContact O-N 3.16Å; T918-K920 PolarHBondContact OG1-N 2.88Å; T918-D921 VanDerWaalsContact CB-OD2 3.29Å; T918-D921 WeakPolarHBondContact CB-OD2 3.05Å; T918-D921 WeakPolarHBondContact CG2-OD2 3.38Å; T918-D921 PolarHBondContact N-OD2 2.87Å; T918-D921 PolarHBondContact O-N 3.04Å; T918-D921 VanDerWaalsContact OG1-CG 3.25Å; T918-D921 PolarHBondContact OG1-N 3.47Å; T918-D921 PolarHBondContact OG1-OD2 3.33Å; T918-V922 PolarHBondContact O-N 2.87Å; T918-V922 VanDerWaalsContact O-N 3.12Å
919	A	86.9	Confident	80.7	Confident	2 Å²	2	23.3 Å²	23.3	2%	0.017	13%	0.126	C	C	.	.	H	α-helix	trans	-52.6	-35.5	174.3	0	0	0	0	0	113.4	A727 D728 L731 M883 P889 L923	A727-A919 HydrophobicContact CB-CB 4.15Å; D728-A919 WeakPolarHBondContact OD1-CB 3.41Å; L731-A919 HydrophobicContact CB-CB 4.31Å; L731-A919 HydrophobicContact CD2-CB 3.67Å; L731-A919 HydrophobicContact CG-CB 4.41Å; M883-A919 HydrophobicContact CE-CB 4.28Å; P889-A919 PolarHBondContact O-N 2.94Å; A919-L923 WeakPolarHBondContact O-CB 3.46Å; A919-L923 VanDerWaalsContact O-CG 3.3Å; A919-L923 WeakPolarHBondContact O-CG 3.1Å; A919-L923 PolarHBondContact O-N 3.37Å; A919-L923 VanDerWaalsContact O-N 3.09Å
920	K	85.2	Confident	80.8	Confident	52 Å²	52	23.7 Å²	23.7	23%	0.226	12%	0.121	C	C	.	.	H	α-helix	trans	-64.9	-45.3	176.1	176.4	164.9	-179.2	175	0	111.6	F562 S706 A727 T918 H924	F562-K920 HydrophobicContact CD1-CD 4.11Å; F562-K920 HydrophobicContact CD1-CG 3.87Å; F562-K920 HydrophobicContact CE1-CB 4.17Å; F562-K920 HydrophobicContact CE1-CD 4.19Å; F562-K920 HydrophobicContact CE1-CG 3.65Å; F562-K920 HydrophobicContact CG-CG 4.48Å; F562-K920 HydrophobicContact CZ-CB 4.35Å; F562-K920 HydrophobicContact CZ-CG 4.04Å; S706-K920 PolarHBondContact OG-NZ 3.4Å; A727-K920 HydrophobicContact CB-CB 4.38Å; T918-K920 PolarHBondContact O-N 3Å; T918-K920 VanDerWaalsContact O-N 3.16Å; T918-K920 PolarHBondContact OG1-N 2.88Å; K920-H924 VanDerWaalsContact O-CB 3.29Å; K920-H924 WeakPolarHBondContact O-CB 3.15Å; K920-H924 PolarHBondContact O-N 3.46Å
921	D	86.9	Confident	80	Confident	18 Å²	18	28.6 Å²	28.6	10%	0.096	14%	0.138	C	C	.	.	H	α-helix	trans	-68.6	-40	-178.7	-45.6	-64.6	0	0	0	111.7	L757 R762 T918 H924 T925	L757-D921 HydrophobicContact CD2-CB 3.47Å; L757-D921 VanDerWaalsContact CD2-CB 3.47Å; R762-D921 IonicContact CZ-OD1 3.47Å; R762-D921 IonicContact CZ-OD2 3.57Å; R762-D921 IonicContact NH1-OD1 3.56Å; R762-D921 PolarHBondContact NH1-OD1 3.22Å; R762-D921 IonicContact NH1-OD2 2.76Å; R762-D921 VanDerWaalsContact NH2-CG 3.3Å; R762-D921 IonicContact NH2-OD1 3.99Å; R762-D921 PolarHBondContact NH2-OD1 3.35Å; R762-D921 IonicContact NH2-OD2 3.67Å; R762-D921 PolarHBondContact NH2-OD2 3.43Å; T918-D921 VanDerWaalsContact CB-OD2 3.29Å; T918-D921 WeakPolarHBondContact CB-OD2 3.05Å; T918-D921 WeakPolarHBondContact CG2-OD2 3.38Å; T918-D921 PolarHBondContact N-OD2 2.87Å; T918-D921 PolarHBondContact O-N 3.04Å; T918-D921 VanDerWaalsContact OG1-CG 3.25Å; T918-D921 PolarHBondContact OG1-N 3.47Å; T918-D921 PolarHBondContact OG1-OD2 3.33Å; D921-H924 PolarHBondContact O-N 3.18Å; D921-T925 WeakPolarHBondContact O-CB 3.27Å; D921-T925 PolarHBondContact O-N 3.02Å; D921-T925 PolarHBondContact O-OG1 3.18Å
922	V	86.7	Confident	78.4	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-70.2	-43.3	179.8	-172.1	0	0	0	0	111.7	L731 V876 L880 M883 V917 T918 H924 T925 V926	L731-V922 HydrophobicContact CD1-CB 4.36Å; V876-V922 HydrophobicContact CG1-CG1 3.81Å; L880-V922 HydrophobicContact CD1-CG1 4.1Å; L880-V922 HydrophobicContact CD2-CB 4.43Å; L880-V922 HydrophobicContact CD2-CG1 3.56Å; L880-V922 HydrophobicContact CG-CG1 3.77Å; M883-V922 HydrophobicContact SD-CG2 4.27Å; V917-V922 HydrophobicContact CG1-CG2 3.48Å; V917-V922 VanDerWaalsContact CG1-CG2 3.48Å; T918-V922 PolarHBondContact O-N 2.87Å; T918-V922 VanDerWaalsContact O-N 3.12Å; V922-H924 VanDerWaalsContact C-N 3.3Å; V922-H924 PolarHBondContact O-N 3.22Å; V922-T925 PolarHBondContact O-N 3.26Å; V922-V926 HydrophobicContact CG1-CG2 4.06Å; V922-V926 WeakPolarHBondContact O-CB 3.33Å; V922-V926 WeakPolarHBondContact O-CG2 3.32Å; V922-V926 PolarHBondContact O-N 3.36Å
923	L	85.6	Confident	76.2	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.6	-42.3	173	-78.9	172.2	0	0	0	111.9	F411 L558 F562 A727 L730 L731 L734 A919 I927	F411-L923 HydrophobicContact CE1-CD2 4.45Å; F411-L923 HydrophobicContact CZ-CD2 4.13Å; L558-L923 HydrophobicContact CD1-CB 4.2Å; L558-L923 HydrophobicContact CD1-CD2 4.28Å; F562-L923 HydrophobicContact CE2-CB 3.78Å; F562-L923 HydrophobicContact CZ-CB 3.78Å; F562-L923 HydrophobicContact CZ-CD1 3.99Å; A727-L923 HydrophobicContact CB-CD1 4.17Å; A727-L923 VanDerWaalsContact O-CD1 3.27Å; A727-L923 WeakPolarHBondContact O-CD1 3.37Å; L730-L923 HydrophobicContact CB-CD1 3.74Å; L730-L923 HydrophobicContact CB-CD2 4.33Å; L731-L923 HydrophobicContact CB-CD1 4.21Å; L731-L923 HydrophobicContact CB-CD2 4.46Å; L731-L923 HydrophobicContact CB-CG 4.28Å; L731-L923 HydrophobicContact CD1-CD2 4.2Å; L731-L923 HydrophobicContact CD1-CG 3.92Å; L734-L923 HydrophobicContact CD2-CD2 4.4Å; A919-L923 WeakPolarHBondContact O-CB 3.46Å; A919-L923 VanDerWaalsContact O-CG 3.3Å; A919-L923 WeakPolarHBondContact O-CG 3.1Å; A919-L923 PolarHBondContact O-N 3.37Å; A919-L923 VanDerWaalsContact O-N 3.09Å; L923-I927 HydrophobicContact CB-CD1 4.46Å; L923-I927 HydrophobicContact CD2-CD1 3.47Å; L923-I927 VanDerWaalsContact CD2-CD1 3.47Å; L923-I927 VanDerWaalsContact O-CB 3.29Å; L923-I927 WeakPolarHBondContact O-CB 3.37Å; L923-I927 PolarHBondContact O-N 3.36Å
924	H	82.1	Confident	73.3	Confident	23 Å²	23	41.7 Å²	41.7	11%	0.106	21%	0.205	C	C	.	.	I	π-helix	trans	-60.5	-52.5	175.9	-170.7	-73	0	0	0	110.6	F562 H563 K920 D921 V922 V926 L928 G929	F562-H924 HydrophobicContact CD2-CB 4.21Å; F562-H924 HydrophobicContact CE2-CB 4.17Å; H563-H924 AromaticContact CE1-NE2 3.65Å; H563-H924 AromaticContact NE2-CD2 3.78Å; H563-H924 AromaticContact NE2-NE2 3.33Å; H563-H924 PolarHBondContact NE2-NE2 3.43Å; K920-H924 VanDerWaalsContact O-CB 3.29Å; K920-H924 WeakPolarHBondContact O-CB 3.15Å; K920-H924 PolarHBondContact O-N 3.46Å; D921-H924 PolarHBondContact O-N 3.18Å; V922-H924 VanDerWaalsContact C-N 3.3Å; V922-H924 PolarHBondContact O-N 3.22Å; H924-V926 PolarHBondContact O-N 3.22Å; H924-L928 CarbonylContact O-C 3.54Å; H924-L928 WeakPolarHBondContact O-CA 3.05Å; H924-L928 WeakPolarHBondContact O-CB 3.24Å; H924-L928 PolarHBondContact O-N 3.01Å; H924-G929 PolarHBondContact CE1-O 3.47Å; H924-G929 VanDerWaalsContact CE1-O 3.26Å; H924-G929 PolarHBondContact ND1-O 3.09Å; H924-G929 VanDerWaalsContact ND1-O 3.17Å; H924-G929 PolarHBondContact O-N 2.9Å
925	T	82	Confident	70.6	Confident	8 Å²	8	43.4 Å²	43.4	5%	0.049	22%	0.218	C	C	.	.	I	π-helix	trans	-56.6	-48.5	-180	-55.5	0	0	0	0	113.3	V754 D921 V922 G929	V754-T925 HydrophobicContact CG1-CG2 3.95Å; V754-T925 WeakPolarHBondContact CG1-OG1 3.46Å; V754-T925 HydrophobicContact CG2-CG2 3.78Å; D921-T925 WeakPolarHBondContact O-CB 3.27Å; D921-T925 PolarHBondContact O-N 3.02Å; D921-T925 PolarHBondContact O-OG1 3.18Å; V922-T925 PolarHBondContact O-N 3.26Å; T925-G929 PolarHBondContact O-N 3.24Å
926	V	81.1	Confident	67.6	Low	0 Å²	0	49.1 Å²	49.1	0%	0	26%	0.258	C	S	.	.	I	π-helix	trans	-74.1	-45.1	-174.5	174.7	0	0	0	0	111.4	Y407 L734 R746 V876 V922 H924	Y407-V926 HydrophobicContact CD1-CG1 4.46Å; Y407-V926 HydrophobicContact CD2-CG1 3.35Å; Y407-V926 HydrophobicContact CE2-CG1 4.02Å; Y407-V926 HydrophobicContact CG-CG1 3.62Å; L734-V926 HydrophobicContact CD2-CG1 4.36Å; R746-V926 PolarHBondContact NH1-O 3.22Å; V876-V926 HydrophobicContact CG1-CG2 3.86Å; V922-V926 HydrophobicContact CG1-CG2 4.06Å; V922-V926 WeakPolarHBondContact O-CB 3.33Å; V922-V926 WeakPolarHBondContact O-CG2 3.32Å; V922-V926 PolarHBondContact O-N 3.36Å; H924-V926 PolarHBondContact O-N 3.22Å
927	I	78.6	Confident	64.6	Low	2 Å²	2	56.5 Å²	56.5	1%	0.01	30%	0.297	C	S	.	.	I	π-helix	trans	-98.9	-38.3	-166	-58.8	161.1	0	0	0	112.4	T408 F411 L558 L923	T408-I927 PolarHBondContact OG1-O 2.97Å; F411-I927 HydrophobicContact CB-CG2 4.15Å; F411-I927 HydrophobicContact CD1-CD1 3.83Å; F411-I927 HydrophobicContact CD1-CG2 4.5Å; F411-I927 HydrophobicContact CD2-CD1 3.77Å; F411-I927 HydrophobicContact CD2-CG1 4.3Å; F411-I927 HydrophobicContact CE1-CD1 3.61Å; F411-I927 HydrophobicContact CE2-CD1 3.57Å; F411-I927 HydrophobicContact CE2-CG1 4.43Å; F411-I927 HydrophobicContact CG-CD1 3.92Å; F411-I927 HydrophobicContact CG-CG2 4.21Å; F411-I927 HydrophobicContact CZ-CD1 3.49Å; F411-I927 VanDerWaalsContact CZ-CD1 3.49Å; L558-I927 HydrophobicContact CD1-CB 4.4Å; L558-I927 HydrophobicContact CD1-CD1 3.58Å; L558-I927 HydrophobicContact CD1-CG2 4.3Å; L923-I927 HydrophobicContact CB-CD1 4.46Å; L923-I927 HydrophobicContact CD2-CD1 3.47Å; L923-I927 VanDerWaalsContact CD2-CD1 3.47Å; L923-I927 VanDerWaalsContact O-CB 3.29Å; L923-I927 WeakPolarHBondContact O-CB 3.37Å; L923-I927 PolarHBondContact O-N 3.36Å
928	L	72.7	Confident	61.6	Low	34 Å²	34	64.8 Å²	64.8	18%	0.178	34%	0.335	C	S	.	.	I	π-helix	trans	-98.1	-25.1	-179.3	-57.4	-169.1	0	0	0	113.4	L558 Y559 F562 H563 H924	L558-L928 HydrophobicContact CD2-CD1 3.63Å; L558-L928 HydrophobicContact CD2-CD2 3.74Å; L558-L928 HydrophobicContact CD2-CG 3.59Å; Y559-L928 HydrophobicContact CD1-CD1 4.15Å; Y559-L928 HydrophobicContact CD1-CD2 4.18Å; Y559-L928 HydrophobicContact CD2-CD2 4.34Å; Y559-L928 HydrophobicContact CE1-CD1 4.03Å; Y559-L928 HydrophobicContact CE1-CD2 3.67Å; Y559-L928 HydrophobicContact CE1-CG 4.46Å; Y559-L928 HydrophobicContact CE2-CD2 3.86Å; Y559-L928 HydrophobicContact CG-CD2 4.49Å; Y559-L928 VanDerWaalsContact CZ-CD2 3.48Å; F562-L928 HydrophobicContact CD2-CD1 4.14Å; H563-L928 WeakPolarHBondContact NE2-CD1 3.45Å; H924-L928 CarbonylContact O-C 3.54Å; H924-L928 WeakPolarHBondContact O-CA 3.05Å; H924-L928 WeakPolarHBondContact O-CB 3.24Å; H924-L928 PolarHBondContact O-N 3.01Å
929	G	66.7	Low	58.7	Low	9 Å²	9	70 Å²	70	9%	0.093	37%	0.369	C	S	.	.			trans	90.4	175.6	-173.7	0	0	0	0	0	112.8	H924 T925	H924-G929 PolarHBondContact CE1-O 3.47Å; H924-G929 VanDerWaalsContact CE1-O 3.26Å; H924-G929 PolarHBondContact ND1-O 3.09Å; H924-G929 VanDerWaalsContact ND1-O 3.17Å; H924-G929 PolarHBondContact O-N 2.9Å; T925-G929 PolarHBondContact O-N 3.24Å
930	H	56.2	Low	55.9	Low	78 Å²	78	77.4 Å²	77.4	36%	0.361	40%	0.403	S	S	.	.	S	Bend	trans	-66.1	147.6	-175.4	-69.9	37.5	0	0	0	111.6	H932	H930-H932 PolarHBondContact O-N 3.18Å
931	R	45.3	Very low	53.1	Low	152 Å²	152	80.8 Å²	80.8	57%	0.574	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-61.5	128	176.7	-70	-174.1	179.3	-168.7	3.5	110.8
932	H	36.5	Very low	50.6	Low	185 Å²	185	85.4 Å²	85.4	86%	0.856	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-66	142.9	165	-81	-87.3	0	0	0	111.1	H930	H930-H932 PolarHBondContact O-N 3.18Å
933	H	30	Very low	48	Very low	149 Å²	149	93.7 Å²	93.7	69%	0.69	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-77.5	130.6	-171.5	-147.8	-44.6	0	0	0	111.6	S935	H933-S935 VanDerWaalsContact CE1-CB 3.44Å; H933-S935 WeakPolarHBondContact CE1-CB 3.42Å; H933-S935 PolarHBondContact CE1-OG 3.5Å; H933-S935 VanDerWaalsContact CE1-OG 3.27Å; H933-S935 WeakPolarHBondContact ND1-CB 3.36Å; H933-S935 PolarHBondContact ND1-OG 3.29Å; H933-S935 PolarHBondContact O-N 3Å
934	P	26.8	Very low	45.2	Very low	126 Å²	126	102.3 Å²	102.3	82%	0.818	54%	0.537	S	S	*	.	S	Bend	trans	-73.3	15.8	172.2	-19.6	33.8	0	0	0	115
935	S	30.3	Very low	42.9	Very low	68 Å²	68	108.4 Å²	108.4	48%	0.476	57%	0.57	S	S	.	*			trans	-135.4	38.7	-158.9	-39.6	0	0	0	0	114.1	H933 L937	H933-S935 VanDerWaalsContact CE1-CB 3.44Å; H933-S935 WeakPolarHBondContact CE1-CB 3.42Å; H933-S935 PolarHBondContact CE1-OG 3.5Å; H933-S935 VanDerWaalsContact CE1-OG 3.27Å; H933-S935 WeakPolarHBondContact ND1-CB 3.36Å; H933-S935 PolarHBondContact ND1-OG 3.29Å; H933-S935 PolarHBondContact O-N 3Å; S935-L937 PolarHBondContact O-N 3.4Å
936	S	28.1	Very low	40.5	Very low	120 Å²	120	114.5 Å²	114.5	84%	0.839	60%	0.602	S	S	*	*			trans	-73.6	53.9	161.9	64.5	0	0	0	0	111.3
937	L	28.2	Very low	38	Very low	155 Å²	155	123 Å²	123	81%	0.812	64%	0.641	S	S	*	*			trans	-115.2	93.6	171.2	-82.1	168	0	0	0	106.9	S935 P939	S935-L937 PolarHBondContact O-N 3.4Å; L937-P939 WeakPolarHBondContact O-CD 3.5Å
938	H	28.1	Very low	35.7	Very low	174 Å²	174	127.9 Å²	127.9	81%	0.806	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-58.5	126.6	176.6	-92.8	-86.5	0	0	0	111	H940	H938-H940 PolarHBondContact O-N 3.16Å
939	P	29.2	Very low	33.8	Very low	114 Å²	114	133.4 Å²	133.4	74%	0.74	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-66.2	126	151.7	-10.7	27.6	0	0	0	107.8	L937	L937-P939 WeakPolarHBondContact O-CD 3.5Å
940	H	27.7	Very low	31.8	Very low	158 Å²	158	139.6 Å²	139.6	73%	0.731	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-68.2	135.6	171.1	-98.1	-86.9	0	0	0	109.9	H938 T942	H938-H940 PolarHBondContact O-N 3.16Å; H940-T942 PolarHBondContact O-N 3.27Å
941	P	27	Very low	30.5	Very low	122 Å²	122	142.2 Å²	142.2	79%	0.792	76%	0.757	S	S	*	*			trans	-80.2	109.3	171.9	31.1	-31.5	0	0	0	109.9
942	T	33	Very low	29.6	Very low	116 Å²	116	139.5 Å²	139.5	71%	0.712	76%	0.762	S	S	*	*			trans	-131.5	101.7	173.1	51	0	0	0	0	111.2	H940	H940-T942 PolarHBondContact O-N 3.27Å
943	H	31.7	Very low	29.3	Very low	175 Å²	175	139.6 Å²	139.6	81%	0.81	76%	0.762	S	S	*	*			trans	38.8	110.5	155.4	-68.7	-86.3	0	0	0	119.5
944	H	27.5	Very low	29.1	Very low	180 Å²	180	139.7 Å²	139.7	83%	0.833	77%	0.768	S	S	*	*			trans	-60.4	138.1	145.3	-89.5	-98.5	0	0	0	110.3
945	I	34.4	Very low	29.3	Very low	152 Å²	152	141.7 Å²	141.7	78%	0.779	77%	0.77	S	S	*	*			trans	-130.7	150.9	148.8	-64.8	-177.2	0	0	0	105.5
946	D	30.8	Very low	29.1	Very low	136 Å²	136	143.9 Å²	143.9	73%	0.727	79%	0.785	S	S	*	*			trans	-78.2	169.1	-153	-59.8	-67.8	0	0	0	117.5
947	E	28.4	Very low	29.3	Very low	177 Å²	177	141.8 Å²	141.8	83%	0.827	78%	0.783	S	S	*	*			trans	-1.5	131	155.2	-52.2	-177.9	129.8	0	0	116.5
948	S	31.7	Very low	29.3	Very low	105 Å²	105	142.2 Å²	142.2	73%	0.734	79%	0.786	S	S	*	*				178	159.9	80.9	42.9	0	0	0	0	113.8
949	L	31.9	Very low	29.5	Very low	150 Å²	150	141.1 Å²	141.1	79%	0.785	79%	0.786	S	S	*	*			trans	53.4	123	150	-69.5	162.8	0	0	0	121.5
950	N	24.7	Very low	29.3	Very low	140 Å²	140	146.1 Å²	146.1	75%	0.749	79%	0.792	S	S	*	*			trans	5	138.1	138	-49.9	-21.3	0	0	0	116.8
951	T	28.5	Very low	29.4	Very low	132 Å²	132	144.5 Å²	144.5	81%	0.81	79%	0.787	S	S	*	*				-169.6	165.5	64	-54.2	0	0	0	0	110.8
952	S	26.3	Very low	29.4	Very low	95 Å²	95	144.1 Å²	144.1	66%	0.664	79%	0.785	S	S	*	*			trans	-47.7	148.1	177.4	60.4	0	0	0	0	116.8
953	Q	31	Very low	29.1	Very low	187 Å²	187	148 Å²	148	87%	0.874	79%	0.788	S	S	*	*				-167	164.8	110.3	-104.1	170.3	23.4	0	0	113.1
954	N	25.4	Very low	28.7	Very low	151 Å²	151	151.8 Å²	151.8	81%	0.807	80%	0.795	S	S	*	*			trans	-78.6	159	178.6	-50	-67.8	0	0	0	111.6
955	I	31.9	Very low	28.8	Very low	168 Å²	168	147.1 Å²	147.1	86%	0.862	78%	0.783	S	S	*	*				-174.9	157.3	119.5	-95.3	155.6	0	0	0	110.8
956	S	26.5	Very low	28.4	Very low	114 Å²	114	149.6 Å²	149.6	80%	0.797	79%	0.788	S	S	*	*			trans	-77.1	157	-174.8	51.4	0	0	0	0	115.4
957	G	32	Very low	28.3	Very low	77 Å²	77	151.1 Å²	151.1	79%	0.794	79%	0.794	S	S	*	*			trans	-178.2	109	161.1	0	0	0	0	0	112.1
958	D	27.9	Very low	28.1	Very low	163 Å²	163	152.9 Å²	152.9	87%	0.872	79%	0.793	S	S	*	*			trans	-75.6	145.4	167.8	-61.2	-76.6	0	0	0	110.5
959	D	31.5	Very low	27.8	Very low	152 Å²	152	154 Å²	154	81%	0.813	79%	0.791	S	S	*	*			trans	-158.1	148.3	144.8	-134	-27.7	0	0	0	112.8
960	Y	24.8	Very low	27.6	Very low	218 Å²	218	154 Å²	154	86%	0.855	79%	0.792	S	S	*	*			trans	-130.9	97.2	-163.7	-153	-81.6	0	0	0	111.6
961	I	29.9	Very low	27.6	Very low	124 Å²	124	158.1 Å²	158.1	64%	0.636	80%	0.798	S	S	*	*			trans	-123.8	114.6	-175.6	-55.9	-177.7	0	0	0	112.2	Y963	I961-Y963 HydrophobicContact CG2-CD2 4.05Å; I961-Y963 HydrophobicContact CG2-CE2 4.15Å; I961-Y963 PolarHBondContact O-N 2.82Å
962	P	26.7	Very low	27.5	Very low	114 Å²	114	161.1 Å²	161.1	74%	0.74	80%	0.8	S	S	*	*			trans	-84.2	104.6	-178.9	32.2	-33.5	0	0	0	112.4	R964	P962-R964 PolarHBondContact O-N 3.29Å
963	Y	27.9	Very low	27.6	Very low	199 Å²	199	167.8 Å²	167.8	78%	0.78	81%	0.811	S	S	*	*			trans	-83.2	97.2	-174.8	-115.9	-81.6	0	0	0	114.6	I961 S965	I961-Y963 HydrophobicContact CG2-CD2 4.05Å; I961-Y963 HydrophobicContact CG2-CE2 4.15Å; I961-Y963 PolarHBondContact O-N 2.82Å; Y963-S965 WeakPolarHBondContact CD1-OG 3.42Å
964	R	23.3	Very low	27.3	Very low	253 Å²	253	164 Å²	164	96%	0.955	80%	0.801	S	S	*	*			trans	-101.4	71.1	168.2	-168.6	-169.6	-170.9	-168	5.6	110.7	P962	P962-R964 PolarHBondContact O-N 3.29Å
965	S	28.3	Very low	27.3	Very low	83 Å²	83	163.8 Å²	163.8	58%	0.58	81%	0.805	S	S	*	*			trans	-112.5	157.4	177.6	68.4	0	0	0	0	113	Y963	Y963-S965 WeakPolarHBondContact CD1-OG 3.42Å
966	K	26.5	Very low	27	Very low	204 Å²	204	159.5 Å²	159.5	89%	0.887	79%	0.79	S	S	*	*			trans	-85.6	130.5	-172.6	-54.9	159.6	-174.8	169.1	0	109.8
967	I	28.1	Very low	27	Very low	167 Å²	167	163.2 Å²	163.2	86%	0.856	79%	0.792	S	S	*	*			trans	-124.2	112.2	149.1	-60	-178	0	0	0	107.3
968	R	25	Very low	26.9	Very low	215 Å²	215	167.4 Å²	167.4	81%	0.811	79%	0.791	S	S	*	*			trans	-117	148.1	164.9	-168.9	-164.9	-89.9	-179.4	-8.9	105.9
969	D	26.7	Very low	27	Very low	128 Å²	128	164.7 Å²	164.7	68%	0.684	78%	0.784	S	S	*	*	S	Bend	trans	62.3	81.3	170.9	-51.2	-43.1	0	0	0	115.6
970	N	25.9	Very low	26.8	Very low	150 Å²	150	160.3 Å²	160.3	80%	0.802	78%	0.775	S	S	*	*				-178.7	118.8	126.3	-96.5	-51.8	0	0	0	112.1
971	Y	26.6	Very low	27	Very low	226 Å²	226	156.3 Å²	156.3	89%	0.886	77%	0.773	S	S	*	*				174.8	105.2	122.1	-105.2	-73.8	0	0	0	109.8
972	K	25.5	Very low	27	Very low	195 Å²	195	155.7 Å²	155.7	85%	0.848	77%	0.771	S	S	*	*			trans	-127.7	83.8	-175	-176	-175.6	179.5	-179.9	0	110.4
973	R	27.5	Very low	26.9	Very low	235 Å²	235	155.7 Å²	155.7	89%	0.887	77%	0.773	S	S	*	*			trans	-167.7	128.2	161.2	-117.1	171.6	-89.4	-169	-5.8	114.7
974	T	25.4	Very low	26.9	Very low	108 Å²	108	150.3 Å²	150.3	66%	0.663	77%	0.765	S	S	*	*			trans	52.1	106.8	141	-44.6	0	0	0	0	120.9
975	V	26.5	Very low	27.1	Very low	147 Å²	147	143.8 Å²	143.8	89%	0.891	76%	0.758	S	S	*	*				-126.9	135.7	105.8	-179	0	0	0	0	107.2
976	S	23.9	Very low	27	Very low	78 Å²	78	146.3 Å²	146.3	55%	0.545	77%	0.774	S	S	.	*			trans	-131.1	139	-176.7	-55.1	0	0	0	0	110.5
977	F	27.9	Very low	27	Very low	191 Å²	191	144.4 Å²	144.4	84%	0.838	77%	0.768	S	S	*	*			trans	-165.6	97.7	146.7	-86.2	-64.5	0	0	0	104.9
978	E	29	Very low	26.9	Very low	166 Å²	166	143.6 Å²	143.6	78%	0.776	77%	0.766	S	S	*	*				72.1	138.5	81.4	-75.5	-160.8	143.2	0	0	113.5
979	S	29.2	Very low	27	Very low	105 Å²	105	137.2 Å²	137.2	73%	0.734	77%	0.767	S	S	*	*			cis	-157.1	150.4	-3.4	179.5	0	0	0	0	109
980	G	29.2	Very low	27	Very low	60 Å²	60	136.5 Å²	136.5	62%	0.619	77%	0.772	S	S	*	*			cis	158	-167.1	-2.4	0	0	0	0	0	111.7
981	V	28.9	Very low	27.2	Very low	135 Å²	135	138.5 Å²	138.5	82%	0.818	78%	0.776	S	S	*	*			trans	55.9	140	162.6	-95.7	0	0	0	0	119.2
982	L	28.7	Very low	27.1	Very low	111 Å²	111	135 Å²	135	58%	0.581	77%	0.773	S	S	*	*			cis	-129.4	162.6	8.8	-93	164.2	0	0	0	111.6	Y332	Y332-L982 HydrophobicContact CD1-CD1 3.74Å; Y332-L982 HydrophobicContact CD2-CB 4.35Å; Y332-L982 HydrophobicContact CE1-CD1 3.72Å; Y332-L982 HydrophobicContact CE2-CD1 4.5Å; Y332-L982 HydrophobicContact CG-CB 4.2Å; Y332-L982 HydrophobicContact CG-CD1 4.18Å
983	S	24	Very low	27.2	Very low	114 Å²	114	133.5 Å²	133.5	80%	0.797	77%	0.773	S	S	*	*			trans	-130.3	137.9	173.9	58.8	0	0	0	0	111.6
984	S	29.9	Very low	27.2	Very low	86 Å²	86	131 Å²	131	60%	0.601	77%	0.768	S	S	*	*			trans	-142.4	136.3	165.4	46.7	0	0	0	0	110.9
985	S	25.6	Very low	27.4	Very low	115 Å²	115	133.4 Å²	133.4	80%	0.804	78%	0.777	S	S	*	*			trans	-98.8	148	-174.7	52.3	0	0	0	0	112.7
986	C	27.6	Very low	27.6	Very low	137 Å²	137	130.6 Å²	130.6	93%	0.926	77%	0.769	S	S	*	*			trans	-142.9	154.8	151.5	-97.9	0	0	0	0	109.7
987	Q	25.6	Very low	28.1	Very low	164 Å²	164	132 Å²	132	77%	0.766	78%	0.777	S	S	*	*			trans	-121.3	165.5	177.3	-70.1	173.5	-138.5	0	0	110.2
988	D	25.6	Very low	28.3	Very low	150 Å²	150	130.7 Å²	130.7	80%	0.802	78%	0.778	S	S	*	*			trans	64.8	165.6	157.3	-50.9	-39.5	0	0	0	116.8
989	G	27.9	Very low	28.3	Very low	81 Å²	81	126.1 Å²	126.1	84%	0.835	78%	0.776	S	S	*	*			trans	113.1	74.2	179.9	0	0	0	0	0	114.6
990	S	25.7	Very low	28.3	Very low	113 Å²	113	130.1 Å²	130.1	79%	0.79	78%	0.783	S	S	*	*			trans	-90.8	121.4	161.3	56.3	0	0	0	0	109.9
991	E	30.1	Very low	28.2	Very low	191 Å²	191	132.8 Å²	132.8	89%	0.893	79%	0.787	S	S	*	*			trans	-154.4	141.4	161.3	-122.2	154.7	-136	0	0	111.8
992	N	25	Very low	28.1	Very low	153 Å²	153	134.6 Å²	134.6	82%	0.818	78%	0.784	S	S	*	*			trans	-92.5	154.7	168.1	-43.8	-84.4	0	0	0	107.8
993	I	28.9	Very low	28	Very low	164 Å²	164	135.3 Å²	135.3	84%	0.841	79%	0.788	S	S	*	*			trans	-166.7	151	143	-105.2	150.4	0	0	0	110.4
994	F	25.9	Very low	28	Very low	182 Å²	182	136.8 Å²	136.8	80%	0.798	78%	0.782	S	S	*	*			trans	-82.9	154	173.6	-83.9	-132.4	0	0	0	110.3
995	D	30.9	Very low	27.9	Very low	158 Å²	158	140.1 Å²	140.1	85%	0.845	79%	0.788	S	S	*	*				169.1	164.3	103.1	-94.5	-45.8	0	0	0	113
996	A	30	Very low	28.1	Very low	88 Å²	88	139.9 Å²	139.9	73%	0.727	79%	0.786	S	S	*	*			trans	-99.7	-174.5	171.6	0	0	0	0	0	109.5
997	P	35.4	Very low	28	Very low	108 Å²	108	142.2 Å²	142.2	70%	0.701	78%	0.784	S	S	*	*			cis	-146.2	178.6	41.4	41.4	-19.5	0	0	0	117.7
998	D	31.1	Very low	28.1	Very low	163 Å²	163	141.9 Å²	141.9	87%	0.872	78%	0.782	S	S	*	*			trans	23.9	147.6	144.2	-56.6	-32.5	0	0	0	123.2
999	G	29.5	Very low	28.2	Very low	70 Å²	70	143 Å²	143	72%	0.722	78%	0.78	S	S	*	*			trans	146.7	54.6	133.7	0	0	0	0	0	123.4
1000	Q	28.9	Very low	28.3	Very low	189 Å²	189	147.5 Å²	147.5	88%	0.883	78%	0.777	S	S	*	*			trans	57	128.8	141.3	-70.5	-166.4	19.4	0	0	123.9
1001	V	27.2	Very low	28.4	Very low	117 Å²	117	146.9 Å²	146.9	71%	0.709	77%	0.772	S	S	*	*				86.9	93.7	128.1	174.5	0	0	0	0	121.3
1002	K	25.6	Very low	28.3	Very low	172 Å²	172	148.8 Å²	148.8	75%	0.748	77%	0.771	S	S	*	*				83.2	141.5	109.2	-159.6	-164.3	174.5	-165.6	0	121.7
1003	L	26.9	Very low	28.5	Very low	127 Å²	127	146.5 Å²	146.5	67%	0.665	77%	0.767	S	S	*	*			trans	71.7	151.3	169.7	-67.2	129	0	0	0	116.8
1004	E	25.8	Very low	28.7	Very low	144 Å²	144	142.9 Å²	142.9	67%	0.673	76%	0.761	S	S	*	*			cis	-166.8	154.3	-31.4	-125.7	-172.7	-139	0	0	111.4
1005	H	27.5	Very low	28.9	Very low	156 Å²	156	138.8 Å²	138.8	72%	0.722	76%	0.755	S	S	*	*			trans	50.2	158.2	152.3	-72.1	119.3	0	0	0	125.7
1006	S	28.2	Very low	28.9	Very low	110 Å²	110	141 Å²	141	77%	0.769	76%	0.758	S	S	*	*			trans	65.4	137.3	169.1	56.4	0	0	0	0	117.9
1007	E	25.4	Very low	29	Very low	187 Å²	187	139.6 Å²	139.6	87%	0.874	75%	0.752	S	S	*	*			cis	118.7	155.7	12.8	-84.7	-145.6	118.1	0	0	112.5
1008	E	29.1	Very low	28.8	Very low	156 Å²	156	140 Å²	140	73%	0.729	76%	0.757	S	S	*	*			trans	69.4	159.2	179.5	-55.9	-135.2	105.8	0	0	116.8
1009	K	27.8	Very low	28.8	Very low	174 Å²	174	139.9 Å²	139.9	76%	0.757	76%	0.756	S	S	*	*			cis	167.9	177.6	-39.4	-107.3	177	-175.3	161.8	0	107
1010	F	28.7	Very low	29	Very low	176 Å²	176	141.5 Å²	141.5	77%	0.772	75%	0.754	S	S	*	*			trans	81.2	123.1	-178.8	-68.4	-92.8	0	0	0	115.6
1011	S	27.6	Very low	29.2	Very low	99 Å²	99	137.7 Å²	137.7	69%	0.692	75%	0.748	S	S	*	*			cis	102.3	114.4	15.4	-57.9	0	0	0	0	115.7
1012	R	29.6	Very low	29.2	Very low	232 Å²	232	138.2 Å²	138.2	88%	0.875	76%	0.757	S	S	*	*			trans	171	127.2	153.3	-91.3	146.4	-168.5	-157.2	3.5	107.4
1013	S	29.6	Very low	29.4	Very low	105 Å²	105	134 Å²	134	73%	0.734	76%	0.762	S	S	*	*			cis	87.9	138.7	43.8	73.3	0	0	0	0	114
1014	A	31.7	Very low	29.3	Very low	87 Å²	87	134.3 Å²	134.3	72%	0.719	77%	0.769	S	S	*	*			cis	-176	171.7	-12.5	0	0	0	0	0	111.1
1015	S	30.7	Very low	29.4	Very low	96 Å²	96	137.5 Å²	137.5	67%	0.671	78%	0.781	S	S	*	*			trans	70.9	151.8	157.9	80.3	0	0	0	0	118.1
1016	F	31.4	Very low	29.3	Very low	204 Å²	204	135.3 Å²	135.3	90%	0.895	78%	0.783	S	S	*	*			cis	-146.5	174.8	-3.1	-85.1	-60.3	0	0	0	108.5
1017	G	30.8	Very low	29.4	Very low	60 Å²	60	136.6 Å²	136.6	62%	0.619	79%	0.786	S	S	*	*			cis	134.9	132.4	-7.7	0	0	0	0	0	115.3
1018	S	31.4	Very low	29.4	Very low	115 Å²	115	133.2 Å²	133.2	80%	0.804	78%	0.784	S	S	*	*			trans	86.9	150.3	170.1	-43.5	0	0	0	0	118.5
1019	L	31.5	Very low	29.5	Very low	162 Å²	162	130.8 Å²	130.8	85%	0.848	78%	0.784	S	S	*	*			cis	-163.6	-177.2	-17.4	-103.5	170	0	0	0	107.4
1020	P	34.4	Very low	29.7	Very low	104 Å²	104	127.4 Å²	127.4	68%	0.675	78%	0.782	S	S	*	*			trans	-125.1	-178.2	-143.3	46	-34.3	0	0	0	116.7
1021	S	32.2	Very low	29.6	Very low	108 Å²	108	126.5 Å²	126.5	76%	0.755	79%	0.785	S	S	*	*				160.1	141.7	115.2	55.8	0	0	0	0	116.7
1022	S	27.5	Very low	29.9	Very low	129 Å²	129	127.7 Å²	127.7	90%	0.902	79%	0.793	S	S	*	*			trans	28.8	125.6	144.4	-51.4	0	0	0	0	123.1
1023	G	30.1	Very low	29.7	Very low	82 Å²	82	125.3 Å²	125.3	85%	0.845	79%	0.792	S	S	*	*			trans	-170.5	117	156.8	0	0	0	0	0	113.2
1024	T	25	Very low	29.8	Very low	134 Å²	134	127.1 Å²	127.1	82%	0.822	80%	0.799	S	S	*	*			trans	-104.3	132.4	178.2	49	0	0	0	0	111.7
1025	F	28.2	Very low	29.5	Very low	211 Å²	211	130.5 Å²	130.5	93%	0.925	80%	0.802	S	S	*	*			trans	-147.1	149.8	162.6	-102.3	-79.5	0	0	0	111.9
1026	S	24.4	Very low	29.5	Very low	110 Å²	110	135.2 Å²	135.2	77%	0.769	81%	0.813	S	S	*	*			trans	-128.8	137	179.2	54.6	0	0	0	0	110.1
1027	V	30.5	Very low	29.2	Very low	137 Å²	137	130.2 Å²	130.2	83%	0.83	80%	0.803	S	S	*	*			trans	-139.9	145.1	177.6	-178.4	0	0	0	0	109.9
1028	S	24.6	Very low	29.1	Very low	117 Å²	117	135.8 Å²	135.8	82%	0.818	82%	0.817	S	S	*	*			trans	-142.6	120.2	-177.9	56.3	0	0	0	0	111.8
1029	S	31.6	Very low	28.9	Very low	104 Å²	104	134.5 Å²	134.5	73%	0.727	81%	0.808	S	S	*	*			trans	-175.8	150	179	51.7	0	0	0	0	111.6
1030	S	31.6	Very low	28.7	Very low	103 Å²	103	133.7 Å²	133.7	72%	0.72	81%	0.805	S	S	*	*			cis	-171.7	145.4	-17.7	49.7	0	0	0	0	111.1
1031	N	28.3	Very low	28.3	Very low	158 Å²	158	136.8 Å²	136.8	85%	0.845	81%	0.81	S	S	*	*			trans	5.2	137	156.9	-53.8	-0.6	0	0	0	121.3
1032	S	32.4	Very low	28	Very low	123 Å²	123	142.4 Å²	142.4	86%	0.86	82%	0.815	S	S	*	*				-159.4	132.6	127.2	63.1	0	0	0	0	111.6
1033	E	25.6	Very low	27.9	Very low	182 Å²	182	145.8 Å²	145.8	85%	0.85	81%	0.814	S	S	*	*			trans	-98	150.9	-179.9	-54.9	150.1	110.3	0	0	111.9
1034	V	31.4	Very low	27.8	Very low	143 Å²	143	148.2 Å²	148.2	87%	0.867	81%	0.812	S	S	*	*			trans	-146	128.3	142.4	-177.9	0	0	0	0	108.2
1035	M	26.3	Very low	28	Very low	159 Å²	159	146.3 Å²	146.3	78%	0.783	80%	0.804	S	S	*	*			trans	-90	150.3	168.2	-72	-158.1	-66	0	0	111.2
1036	H	31	Very low	27.8	Very low	195 Å²	195	142.6 Å²	142.6	90%	0.903	80%	0.799	S	S	*	*			trans	-152.4	135.9	132.2	-104.8	-69.4	0	0	0	111.2
1037	S	24.8	Very low	27.9	Very low	98 Å²	98	143.6 Å²	143.6	69%	0.685	81%	0.805	S	S	*	*			trans	-88.6	146.3	-174.6	-30.1	0	0	0	0	112.2
1038	L	29.3	Very low	27.7	Very low	177 Å²	177	143.8 Å²	143.8	93%	0.927	81%	0.806	S	S	*	*			trans	-167.5	157.7	135.9	-105.5	164.1	0	0	0	110.4
1039	S	26.4	Very low	27.9	Very low	88 Å²	88	145.7 Å²	145.7	62%	0.615	81%	0.807	S	S	*	*			trans	-116.1	128.4	-164.4	53	0	0	0	0	113.3
1040	N	27.3	Very low	27.8	Very low	145 Å²	145	146.2 Å²	146.2	78%	0.775	81%	0.807	S	S	*	*				176.5	150	116.7	-88.2	-11.7	0	0	0	113.8
1041	E	26.4	Very low	27.7	Very low	169 Å²	169	147.6 Å²	147.6	79%	0.79	81%	0.81	S	S	*	*			trans	27.2	104.2	155.9	-56.6	-168.8	172	0	0	120.7
1042	R	25.5	Very low	27.8	Very low	227 Å²	227	146.9 Å²	146.9	86%	0.857	81%	0.812	S	S	*	*				175.8	156.2	118.7	-94.2	160	-170.6	-165.1	4.1	113.1
1043	F	25.6	Very low	27.7	Very low	200 Å²	200	152.1 Å²	152.1	88%	0.877	81%	0.813	S	S	*	*			trans	23.8	109.2	158.7	-75.7	-92.9	0	0	0	120.2
1044	T	27.6	Very low	27.8	Very low	132 Å²	132	151.8 Å²	151.8	81%	0.81	80%	0.804	S	S	*	*			trans	-132.6	127.9	148	44.4	0	0	0	0	107.2
1045	S	29.2	Very low	27.8	Very low	94 Å²	94	152 Å²	152	66%	0.657	80%	0.8	S	S	*	*			cis	84.1	93.4	46.2	79.4	0	0	0	0	113.7
1046	T	24.7	Very low	28	Very low	133 Å²	133	153.6 Å²	153.6	82%	0.816	81%	0.805	S	S	*	*			trans	13.4	120.1	149.8	50.8	0	0	0	0	119
1047	C	26.9	Very low	28	Very low	132 Å²	132	150.2 Å²	150.2	89%	0.892	80%	0.802	S	S	*	*			trans	-135.9	101.5	146.4	-81.7	0	0	0	0	108.9
1048	T	24.9	Very low	28.1	Very low	140 Å²	140	153 Å²	153	86%	0.859	81%	0.81	S	S	*	*			trans	-91.7	118.5	158.1	46.3	0	0	0	0	107.3
1049	D	29.7	Very low	28.3	Very low	157 Å²	157	150.7 Å²	150.7	84%	0.84	81%	0.806	S	S	*	*			trans	-137.9	160.3	171.8	-138.8	-29.3	0	0	0	112
1050	T	29.6	Very low	28.4	Very low	116 Å²	116	153 Å²	153	71%	0.712	82%	0.817	S	S	*	*			trans	-120	143.4	-149.6	52.7	0	0	0	0	115.4
1051	V	28.7	Very low	28.6	Very low	131 Å²	131	152.2 Å²	152.2	79%	0.794	82%	0.821	S	S	*	*			trans	38.7	112.9	143	-176.2	0	0	0	0	118.1
1052	T	31.7	Very low	28.7	Very low	144 Å²	144	152.8 Å²	152.8	88%	0.883	82%	0.824	S	S	*	*				-164	177	127.6	11.1	0	0	0	0	112.2
1053	R	28.6	Very low	29.1	Very low	232 Å²	232	151.1 Å²	151.1	88%	0.875	83%	0.825	S	S	*	*			trans	-97.5	157.4	-177.6	-66.4	175.9	175.5	173.9	-0.4	111.8
1054	R	27.3	Very low	29.3	Very low	175 Å²	175	150.6 Å²	150.6	66%	0.66	82%	0.823	S	S	*	*			trans	3.9	130.1	149.8	-59.4	177.2	174	158.2	-7.6	117.1
1055	D	32.3	Very low	29.4	Very low	149 Å²	149	150.6 Å²	150.6	80%	0.797	83%	0.825	S	S	*	*				-158.7	-176.6	91	-91	-28.9	0	0	0	110.6
1056	H	30.1	Very low	29.5	Very low	192 Å²	192	151 Å²	151	89%	0.889	83%	0.827	S	S	*	*			trans	-74.5	143.5	-163.6	-64.6	-85.4	0	0	0	115.5
1057	C	30.5	Very low	29.7	Very low	123 Å²	123	150.4 Å²	150.4	83%	0.831	83%	0.829	S	S	*	*			trans	-149.6	142.1	149.5	-165.7	0	0	0	0	111.1
1058	N	28.4	Very low	29.9	Very low	158 Å²	158	150.9 Å²	150.9	85%	0.845	82%	0.821	S	S	*	*			trans	-93	131.4	173.9	-85.6	-20.2	0	0	0	110.2
1059	C	32.6	Very low	30	Very low	127 Å²	127	151.7 Å²	151.7	86%	0.858	82%	0.82	S	S	*	*			trans	-153.8	134.5	157.1	-110.9	0	0	0	0	110.5
1060	T	28.6	Very low	30.1	Very low	136 Å²	136	151.4 Å²	151.4	83%	0.834	82%	0.818	S	S	*	*			trans	-112	112.6	-170.7	48.3	0	0	0	0	112.3
1061	C	31.7	Very low	30	Very low	129 Å²	129	152 Å²	152	87%	0.872	82%	0.817	S	S	*	*			trans	-131.8	91.1	174	-64.3	0	0	0	0	110.9
1062	H	29.1	Very low	30.3	Very low	182 Å²	182	154.8 Å²	154.8	84%	0.843	82%	0.821	S	S	*	*			trans	-76.7	136.4	166	-89.3	-78.4	0	0	0	110.3
1063	H	33.4	Very low	30.2	Very low	192 Å²	192	155.1 Å²	155.1	89%	0.889	81%	0.812	S	S	*	*			trans	-151.1	138.8	143	-108	-79.5	0	0	0	110.9
1064	K	29.7	Very low	30.3	Very low	188 Å²	188	152.2 Å²	152.2	82%	0.817	81%	0.809	S	S	*	*			trans	-91.3	148.3	174.3	-70.4	178.2	176.9	176.4	0	110.3
1065	P	30.8	Very low	30.4	Very low	132 Å²	132	147.7 Å²	147.7	86%	0.857	80%	0.804	S	S	*	*			trans	-72.5	130.6	159.7	31.4	-31.9	0	0	0	109.8
1066	S	30.7	Very low	30.6	Very low	102 Å²	102	147.5 Å²	147.5	71%	0.713	80%	0.798	S	S	*	*			trans	-110.9	114.7	175.6	53.8	0	0	0	0	110.6
1067	S	28	Very low	30.9	Very low	122 Å²	122	146.1 Å²	146.1	85%	0.853	79%	0.791	S	S	*	*			trans	-73.5	122.1	167.5	53.8	0	0	0	0	110.1
1068	I	31.1	Very low	31.1	Very low	142 Å²	142	145.4 Å²	145.4	73%	0.728	79%	0.788	S	S	*	*			trans	-123.7	126.5	165.3	-62.1	179.3	0	0	0	107.4
1069	L	27.6	Very low	31.4	Very low	157 Å²	157	146.1 Å²	146.1	82%	0.822	78%	0.784	S	S	*	*			trans	-131.4	110.9	168.5	-179.8	85.8	0	0	0	105.7
1070	D	32	Very low	31.4	Very low	150 Å²	150	145.3 Å²	145.3	80%	0.802	77%	0.771	S	S	*	*			trans	-132	143.6	171.4	-100.6	-50.3	0	0	0	109.9
1071	N	27.5	Very low	31.7	Very low	129 Å²	129	144 Å²	144	69%	0.69	76%	0.763	S	S	*	*			trans	-101.5	141.5	-177.8	-62.4	-91.1	0	0	0	109.1
1072	H	35.3	Very low	31.7	Very low	189 Å²	189	146.5 Å²	146.5	88%	0.875	76%	0.762	S	S	*	*			trans	-147.3	139.2	141.4	-107.8	-70.6	0	0	0	113.3
1073	Q	28.5	Very low	31.8	Very low	152 Å²	152	142.8 Å²	142.8	71%	0.71	76%	0.756	S	S	*	*			trans	-73.4	-178.7	-166	-59.8	159.6	-33.5	0	0	115.3
1074	Q	31.6	Very low	31.8	Very low	171 Å²	171	138.8 Å²	138.8	80%	0.799	75%	0.747	S	S	*	*			trans	82.2	143.2	156	-67.9	166.8	16.8	0	0	118.1
1075	S	29.7	Very low	31.8	Very low	80 Å²	80	135.9 Å²	135.9	56%	0.559	75%	0.745	S	S	*	*			cis	-169.9	166.4	-33.3	39.2	0	0	0	0	111.1
1076	H	35.9	Very low	31.8	Very low	145 Å²	145	136.4 Å²	136.4	67%	0.671	74%	0.741	S	S	*	*			trans	99.8	120.6	160.7	-58.5	-69.1	0	0	0	120.2
1077	H	35.6	Very low	32.3	Very low	162 Å²	162	136.3 Å²	136.3	75%	0.75	74%	0.738	S	S	*	*			trans	32.8	132.1	143.1	-42.2	-59.7	0	0	0	119.1
1078	S	34.8	Very low	32.5	Very low	109 Å²	109	135.7 Å²	135.7	76%	0.762	73%	0.733	S	S	*	*			cis	-164.9	171.8	37.7	-38.4	0	0	0	0	110.5
1079	K	34.5	Very low	32.5	Very low	173 Å²	173	135.1 Å²	135.1	75%	0.752	74%	0.736	S	S	*	*			cis	-156.5	-146.4	-3.7	-140.7	-168.3	166.7	-124.6	0	112.2
1080	D	34.1	Very low	32.6	Very low	110 Å²	110	130.7 Å²	130.7	59%	0.588	73%	0.729	S	S	*	*			trans	-48.8	160.7	178.6	-39.1	-35.6	0	0	0	116.2
1081	T	33.5	Very low	32.4	Very low	109 Å²	109	133.6 Å²	133.6	67%	0.669	73%	0.734	S	S	*	*			cis	-154.6	126.8	27.9	-43.2	0	0	0	0	113.5
1082	Q	32.5	Very low	32.4	Very low	181 Å²	181	134 Å²	134	85%	0.846	74%	0.736	S	S	*	*			trans	50.9	149.2	150.3	-62.7	170.1	16.9	0	0	120.7
1083	S	31	Very low	32.2	Very low	103 Å²	103	132.5 Å²	132.5	72%	0.72	73%	0.734	S	S	*	*			cis	-173.2	-178	-13.8	56.9	0	0	0	0	108.1
1084	P	33.7	Very low	32.1	Very low	108 Å²	108	132.8 Å²	132.8	70%	0.701	73%	0.733	S	S	*	*				-131.5	147.4	-59.9	36.9	-21.4	0	0	0	116
1085	V	30	Very low	32.1	Very low	127 Å²	127	132.6 Å²	132.6	77%	0.77	74%	0.736	S	S	*	*			trans	62.7	125.4	134.7	173.6	0	0	0	0	120.5
1086	N	30.7	Very low	32	Very low	144 Å²	144	135.5 Å²	135.5	77%	0.77	74%	0.74	S	S	*	*			cis	84.9	160.8	46.4	-89.5	-8.5	0	0	0	115.9
1087	P	40.8	Very low	31.7	Very low	100 Å²	100	135.4 Å²	135.4	65%	0.649	75%	0.745	S	S	*	*			cis	-147.8	-147.4	-43.8	43.6	-23.4	0	0	0	113.5
1088	S	31.8	Very low	31.2	Very low	109 Å²	109	138.8 Å²	138.8	76%	0.762	75%	0.751	S	S	*	*			trans	84.8	151.4	154.9	84.9	0	0	0	0	117.7
1089	V	32.2	Very low	30.8	Very low	129 Å²	129	138.1 Å²	138.1	78%	0.782	75%	0.746	S	S	*	*			cis	-144	154.4	-0	-174.4	0	0	0	0	107.6
1090	G	28.3	Very low	30.5	Very low	65 Å²	65	137.9 Å²	137.9	67%	0.67	75%	0.752	S	S	*	*			cis	128.9	70.4	-10.2	0	0	0	0	0	116.9
1091	F	29.4	Very low	30.2	Very low	210 Å²	210	141.2 Å²	141.2	92%	0.921	76%	0.764	S	S	*	*			trans	-140.4	147.1	172.2	-111.6	-84.5	0	0	0	116.1
1092	L	26.4	Very low	30.1	Very low	139 Å²	139	139.9 Å²	139.9	73%	0.728	77%	0.772	S	S	*	*			trans	-103.1	162	175.7	-84.6	139.9	0	0	0	110.9
1093	D	30.5	Very low	29.8	Very low	156 Å²	156	137 Å²	137	83%	0.834	77%	0.772	S	S	*	*				-145.6	157.2	127.4	-144	-19.5	0	0	0	112.6
1094	K	27.2	Very low	29.8	Very low	158 Å²	158	135.5 Å²	135.5	69%	0.687	77%	0.772	S	S	*	*			trans	-132	128.9	-178.8	-72.2	176.7	177.3	175	0	110
1095	I	32.1	Very low	29.5	Very low	168 Å²	168	138.5 Å²	138.5	86%	0.862	78%	0.777	S	S	*	*			trans	-129	136	156.2	-63	-174.5	0	0	0	109.8
1096	H	27.4	Very low	29.3	Very low	141 Å²	141	139.8 Å²	139.8	65%	0.653	78%	0.775	S	S	*	*			trans	-89.9	153	178.5	-77.5	21.7	0	0	0	111.9
1097	N	29.2	Very low	29.2	Very low	143 Å²	143	145.1 Å²	145.1	77%	0.765	78%	0.784	S	S	*	*				174.8	132.9	113.1	-84	-31	0	0	0	107.7
1098	R	26	Very low	28.4	Very low	232 Å²	232	147 Å²	147	88%	0.875	80%	0.798	S	S	*	*				49.1	135	67.5	-76.7	-165.8	175.8	-153.5	1.1	112.4
1099	S	25.1	Very low	28.4	Very low	95 Å²	95	146.9 Å²	146.9	66%	0.664	80%	0.804	S	S	*	*			cis	-176	145.1	-9.3	170	0	0	0	0	106.5
1100	L	29	Very low	28.1	Very low	169 Å²	169	146.3 Å²	146.3	89%	0.885	80%	0.797	S	S	*	*			trans	-173	153.9	141.1	-104.5	158.5	0	0	0	111.9
1101	H	27.4	Very low	28.1	Very low	179 Å²	179	152.6 Å²	152.6	83%	0.829	80%	0.8	S	S	*	*			trans	-89.4	149.1	178	-87	-118	0	0	0	111.4
1102	G	30.3	Very low	27.9	Very low	82 Å²	82	153 Å²	153	85%	0.845	80%	0.795	S	S	*	*			trans	-146.7	123.4	160.1	0	0	0	0	0	108.9
1103	S	27.7	Very low	27.9	Very low	121 Å²	121	151.2 Å²	151.2	85%	0.846	80%	0.795	S	S	*	*			trans	-128.4	121	-172.3	55.3	0	0	0	0	112.3
1104	G	29.9	Very low	27.7	Very low	70 Å²	70	149.9 Å²	149.9	72%	0.722	80%	0.797	S	S	*	*			trans	-157.5	106.5	162.1	0	0	0	0	0	106.5
1105	Q	29.1	Very low	27.7	Very low	172 Å²	172	148 Å²	148	80%	0.804	80%	0.799	S	S	*	*				57.9	109.2	83.8	-89.1	-170.1	-81.8	0	0	114.5
1106	E	25.7	Very low	27.8	Very low	153 Å²	153	144.3 Å²	144.3	72%	0.715	79%	0.786	S	S	*	*			trans	56.2	124.7	140.8	-58.7	175.4	120.3	0	0	119.4
1107	W	27	Very low	27.9	Very low	256 Å²	256	147.9 Å²	147.9	97%	0.97	80%	0.795	S	S	*	*				-161.4	132.8	103.4	-102.6	30.8	0	0	0	109.6
1108	C	25.7	Very low	27.7	Very low	140 Å²	140	146.5 Å²	146.5	95%	0.946	79%	0.792	S	S	*	*			trans	-101.6	111.2	176.4	-69.5	0	0	0	0	110.7
1109	A	30.6	Very low	27.8	Very low	106 Å²	106	140.6 Å²	140.6	88%	0.876	78%	0.782	S	S	*	*			trans	-96.9	103.6	172	0	0	0	0	0	111
1110	D	26.6	Very low	27.8	Very low	118 Å²	118	145.9 Å²	145.9	63%	0.631	79%	0.793	S	S	*	*			trans	-71.4	171.1	166.5	173.1	37.5	0	0	0	110.8
1111	R	28	Very low	27.9	Very low	196 Å²	196	142.3 Å²	142.3	74%	0.74	79%	0.788	S	S	*	*			trans	88.2	100.5	160.5	-48.8	-178.7	-176.6	176.9	2.1	118.5	S1113	R1111-S1113 PolarHBondContact O-N 3.04Å
1112	R	25.4	Very low	27.9	Very low	218 Å²	218	141.3 Å²	141.3	82%	0.823	79%	0.789	S	S	*	*				33.7	81.5	114.8	-61.7	-178.4	174	-153.4	-3.6	117
1113	S	25.8	Very low	27.9	Very low	103 Å²	103	146 Å²	146	72%	0.72	79%	0.791	S	S	*	*			trans	-157.9	144.9	134.7	73	0	0	0	0	112.5	R1111	R1111-S1113 PolarHBondContact O-N 3.04Å
1114	S	27.4	Very low	27.9	Very low	127 Å²	127	151.4 Å²	151.4	89%	0.888	79%	0.792	S	S	*	*			trans	-147.8	50.7	159.9	50.6	0	0	0	0	109.3
1115	V	26	Very low	27.9	Very low	120 Å²	120	151.3 Å²	151.3	73%	0.727	79%	0.792	S	S	*	*			trans	-71.4	167.3	160.5	-113.7	0	0	0	0	108.8
1116	P	35.3	Very low	27.9	Very low	89 Å²	89	149.6 Å²	149.6	58%	0.578	79%	0.788	S	S	*	*			trans	-81.6	163.1	-150.6	34.8	-39.5	0	0	0	113.8
1117	Y	28.3	Very low	28.2	Very low	217 Å²	217	149.8 Å²	149.8	85%	0.851	79%	0.793	S	S	*	*			trans	-118.8	100.7	158	-100.6	-67.7	0	0	0	112.3	T1119	Y1117-T1119 WeakPolarHBondContact CD1-OG1 3.33Å
1118	T	25	Very low	28.4	Very low	114 Å²	114	144.2 Å²	144.2	70%	0.699	78%	0.782	S	S	*	*			trans	-106.7	97.1	159.1	51.6	0	0	0	0	108.4
1119	T	28.9	Very low	28.6	Very low	108 Å²	108	143.6 Å²	143.6	66%	0.663	77%	0.774	S	S	*	*			trans	-109.7	108.2	174.7	-54.1	0	0	0	0	110.1	Y1117	Y1117-T1119 WeakPolarHBondContact CD1-OG1 3.33Å
1120	K	24.8	Very low	28.7	Very low	205 Å²	205	143.8 Å²	143.8	89%	0.891	77%	0.767	S	S	*	*			trans	-80.2	129.3	152.8	-71.6	179.7	177.1	178.1	0	107.2
1121	A	30.8	Very low	28.8	Very low	94 Å²	94	146.5 Å²	146.5	78%	0.777	78%	0.775	S	S	*	*			trans	-122.8	107.4	165.1	0	0	0	0	0	108.1
1122	N	27.6	Very low	29	Very low	159 Å²	159	143.1 Å²	143.1	85%	0.85	77%	0.772	S	S	*	*			trans	-120.1	98	-177.3	-135.7	23	0	0	0	107.9
1123	M	31.2	Very low	29.4	Very low	180 Å²	180	141.1 Å²	141.1	89%	0.887	77%	0.769	S	S	*	*			trans	-145.4	109.3	169.9	-63.8	-64.5	-164.4	0	0	105.1
1124	R	26.5	Very low	29.4	Very low	234 Å²	234	147.7 Å²	147.7	88%	0.883	78%	0.778	S	S	*	*				60.4	130.9	56.6	-91.3	-172.9	175.9	-112.6	5.2	114.5
1125	G	31.1	Very low	29.7	Very low	69 Å²	69	151.4 Å²	151.4	71%	0.711	78%	0.778	S	S	*	*			trans	105.8	73.4	-167.1	0	0	0	0	0	110.9
1126	D	27.5	Very low	29.7	Very low	136 Å²	136	149.7 Å²	149.7	73%	0.727	77%	0.772	S	S	*	*				59.5	110.9	61.3	-66.2	-53.4	0	0	0	114
1127	L	32	Very low	29.4	Very low	156 Å²	156	153 Å²	153	82%	0.817	78%	0.783	S	S	*	*			trans	143.7	94.8	160.9	-80.3	164.6	0	0	0	109.8
1128	N	31	Very low	29.4	Very low	139 Å²	139	148.1 Å²	148.1	74%	0.743	78%	0.778	S	S	*	*				73.1	107.2	93	-78.7	-13.5	0	0	0	114.4
1129	V	30.5	Very low	29.3	Very low	127 Å²	127	150.8 Å²	150.8	77%	0.77	78%	0.783	S	S	*	*				95.4	138.9	73.8	144.2	0	0	0	0	111.9
1130	P	32.6	Very low	29.4	Very low	111 Å²	111	152.1 Å²	152.1	72%	0.721	79%	0.79	S	S	*	*			cis	-133.3	-174.2	-12.3	34.5	-13	0	0	0	116.5
1131	E	28.4	Very low	29.4	Very low	174 Å²	174	149.4 Å²	149.4	81%	0.813	79%	0.785	S	S	*	*			trans	-47.1	160.6	172.2	-42.3	169.4	112.7	0	0	117.8
1132	N	32.1	Very low	29.5	Very low	126 Å²	126	150 Å²	150	67%	0.674	78%	0.783	S	S	*	*				-169.9	145.2	117.4	-111.2	-89.6	0	0	0	116.8
1133	K	33.7	Very low	29.5	Very low	176 Å²	176	149.4 Å²	149.4	77%	0.765	78%	0.781	S	S	*	*			trans	63.7	88.8	147.8	-73.8	156.2	-174.1	160.3	0	123.2
1134	R	27.5	Very low	29.4	Very low	240 Å²	240	151.9 Å²	151.9	91%	0.906	78%	0.78	S	S	*	*				35	117.7	117.7	-63	-179.4	177.9	179.9	-0.7	121
1135	K	31.9	Very low	29.4	Very low	205 Å²	205	145.6 Å²	145.6	89%	0.891	77%	0.772	S	S	*	*			trans	161	151.8	130.4	-92.1	170.3	-179.7	-176.6	0	109.1
1136	S	27.7	Very low	29.4	Very low	85 Å²	85	152.2 Å²	152.2	59%	0.594	78%	0.781	S	S	*	*			cis	175.3	135.5	-34.4	46.8	0	0	0	0	108
1137	I	28.8	Very low	29.3	Very low	158 Å²	158	154 Å²	154	81%	0.81	79%	0.785	S	S	*	*			trans	72.2	141.6	162.8	-55.9	156.8	0	0	0	115.5
1138	P	27.8	Very low	29.1	Very low	114 Å²	114	154.3 Å²	154.3	74%	0.74	79%	0.787	S	S	*	*			cis	-128.5	-153	-25.8	39.9	-20.9	0	0	0	112.2
1139	E	23.9	Very low	28.9	Very low	171 Å²	171	153 Å²	153	80%	0.799	78%	0.784	S	S	*	*			trans	-70.5	152.4	173.2	-59.7	164.3	122.3	0	0	113.6
1140	V	29.8	Very low	28.9	Very low	135 Å²	135	152.6 Å²	152.6	82%	0.818	78%	0.782	S	S	*	*			trans	-131.9	107.8	164	177.2	0	0	0	0	109.1	S1142	V1140-S1142 PolarHBondContact O-N 3.4Å
1141	N	25.9	Very low	28.7	Very low	148 Å²	148	153.5 Å²	153.5	79%	0.791	79%	0.787	S	S	*	*			trans	-69.7	116.2	168.4	-83.7	-40.7	0	0	0	109.8	N1143	N1141-N1143 PolarHBondContact O-N 3.32Å
1142	S	32.2	Very low	28.6	Very low	106 Å²	106	152.1 Å²	152.1	74%	0.741	79%	0.786	S	S	*	*			trans	-93.3	66.9	171.2	-155.3	0	0	0	0	111.2	V1140 R1144	V1140-S1142 PolarHBondContact O-N 3.4Å; S1142-R1144 PolarHBondContact O-N 3.03Å
1143	N	26.8	Very low	28.4	Very low	148 Å²	148	149.7 Å²	149.7	79%	0.791	78%	0.783	S	S	*	*			trans	-68.4	85.2	163.9	-89	-11.8	0	0	0	108.8	N1141 S1145	N1141-N1143 PolarHBondContact O-N 3.32Å; N1143-S1145 PolarHBondContact O-N 2.68Å
1144	R	29.2	Very low	28.1	Very low	231 Å²	231	152.5 Å²	152.5	87%	0.872	79%	0.79	S	S	*	*			trans	-90.6	79	177.2	-159	173.6	-167.9	-175.4	3.6	110.8	S1142	S1142-R1144 PolarHBondContact O-N 3.03Å
1145	S	26.4	Very low	28	Very low	102 Å²	102	147.6 Å²	147.6	71%	0.713	78%	0.78	S	S	*	*			trans	-49.7	134.8	177.9	-50.7	0	0	0	0	112.9	N1143	N1143-S1145 PolarHBondContact O-N 2.68Å
1146	K	31.6	Very low	28	Very low	209 Å²	209	146.5 Å²	146.5	91%	0.909	78%	0.779	S	S	*	*			trans	-91.9	96	153.8	-82.6	-169.8	174.2	-176.6	0	108.6
1147	Q	25.5	Very low	28	Very low	174 Å²	174	148.7 Å²	148.7	81%	0.813	78%	0.784	S	S	*	*			trans	-86.4	117.2	171.7	-177.1	-179.8	19.7	0	0	108.8
1148	L	28	Very low	28.2	Very low	161 Å²	161	146.8 Å²	146.8	84%	0.843	78%	0.775	S	S	*	*			trans	-158.5	80.8	170.2	-103.1	151.2	0	0	0	106.2
1149	T	27.4	Very low	28.3	Very low	113 Å²	113	147.7 Å²	147.7	69%	0.693	77%	0.774	S	S	*	*				94.6	112.8	79	-69.7	0	0	0	0	110.6
1150	V	30.1	Very low	28.8	Very low	118 Å²	118	145.3 Å²	145.3	72%	0.715	77%	0.767	S	S	*	*			trans	-77.9	146	178.2	174.4	0	0	0	0	110.4	N1152	V1150-N1152 HydrophobicContact CG1-CB 3.97Å
1151	P	29.1	Very low	29	Very low	129 Å²	129	145.3 Å²	145.3	84%	0.838	76%	0.761	S	S	*	*			trans	-112	140.5	135	-6.6	26.1	0	0	0	110.6
1152	N	25.8	Very low	29	Very low	146 Å²	146	145.2 Å²	145.2	78%	0.781	76%	0.761	S	S	*	*			trans	-118.8	141.6	-174.5	-161.3	9.9	0	0	0	110	V1150	V1150-N1152 HydrophobicContact CG1-CB 3.97Å
1153	A	27.4	Very low	29	Very low	74 Å²	74	145.3 Å²	145.3	61%	0.612	76%	0.762	S	S	*	*			trans	54.7	137.3	168.4	0	0	0	0	0	119.8
1154	Y	27.6	Very low	29.2	Very low	235 Å²	235	144 Å²	144	92%	0.922	76%	0.764	S	S	*	*				-145.6	152.2	128	-122.6	-83.1	0	0	0	110.2
1155	I	25.9	Very low	29	Very low	137 Å²	137	140.8 Å²	140.8	70%	0.703	76%	0.763	S	S	*	*			trans	-117.2	139.1	-170.9	-62.2	165.5	0	0	0	109.1
1156	Q	31.3	Very low	29.2	Very low	183 Å²	183	144.7 Å²	144.7	86%	0.855	77%	0.77	S	S	*	*			trans	161.7	146	148.7	-92.9	167.2	8.7	0	0	110.3
1157	N	28	Very low	28.9	Very low	130 Å²	130	141.7 Å²	141.7	70%	0.695	76%	0.763	S	S	*	*			cis	-164.8	179.4	-20.2	-148.9	38	0	0	0	111.3
1158	N	32.4	Very low	28.9	Very low	119 Å²	119	139.4 Å²	139.4	64%	0.636	76%	0.755	S	S	*	*			trans	90.4	112.6	157.9	-60.1	-5.1	0	0	0	119.4
1159	N	30.8	Very low	28.8	Very low	133 Å²	133	137.9 Å²	137.9	71%	0.711	75%	0.748	S	S	*	*				76.3	135	129.9	-64.3	32	0	0	0	119.2
1160	D	34.8	Very low	28.7	Very low	121 Å²	121	139.8 Å²	139.8	65%	0.647	75%	0.754	S	S	*	*			cis	-133.1	122.1	2.1	-81.7	-48	0	0	0	110.5
1161	L	33.1	Very low	28.8	Very low	135 Å²	135	139.1 Å²	139.1	71%	0.707	76%	0.755	S	S	*	*				81.4	112.6	97.6	-69.9	175	0	0	0	116.7
1162	N	26.3	Very low	28.6	Very low	145 Å²	145	141.2 Å²	141.2	78%	0.775	75%	0.751	S	S	*	*			trans	43.6	142.9	138.6	-51.8	-17	0	0	0	119.9
1163	S	30.9	Very low	29	Very low	109 Å²	109	142 Å²	142	76%	0.762	76%	0.755	S	S	*	*			cis	-167.4	169.3	26	-9.6	0	0	0	0	108.1
1164	S	31.3	Very low	29.2	Very low	119 Å²	119	141.4 Å²	141.4	83%	0.832	76%	0.756	S	S	*	*			cis	-155.7	161	2.6	-100.4	0	0	0	0	110.1
1165	L	24.8	Very low	29.2	Very low	164 Å²	164	136.6 Å²	136.6	86%	0.859	75%	0.745	S	S	*	*			trans	-89.5	143.9	172.2	-78.1	162.7	0	0	0	112.8
1166	Q	30.9	Very low	29.5	Very low	184 Å²	184	136.4 Å²	136.4	86%	0.86	75%	0.746	S	S	*	*			trans	-178.2	156.4	151.3	-102.3	161	54.8	0	0	108.6
1167	L	24.8	Very low	29.4	Very low	146 Å²	146	135.8 Å²	135.8	76%	0.764	74%	0.743	S	S	*	*			cis	180	159.8	-43.6	-114.4	167.5	0	0	0	107.2
1168	I	26.6	Very low	29.7	Very low	127 Å²	127	135.4 Å²	135.4	65%	0.651	75%	0.75	S	S	*	*			trans	75.1	96.8	160.1	-60.1	152.2	0	0	0	118.1
1169	D	24.7	Very low	29.6	Very low	129 Å²	129	137.6 Å²	137.6	69%	0.69	76%	0.762	S	S	*	*				53.2	149.8	116.5	-41.4	-31.2	0	0	0	125
1170	N	26.8	Very low	29.7	Very low	152 Å²	152	138 Å²	138	81%	0.813	77%	0.769	S	S	*	*			trans	78.4	142.7	158.2	-56	-48.7	0	0	0	118.1
1171	S	30.8	Very low	29.7	Very low	105 Å²	105	135.2 Å²	135.2	73%	0.734	77%	0.769	S	S	*	*			cis	-156.9	148.4	-3.5	45.7	0	0	0	0	114.3
1172	F	26.7	Very low	29.7	Very low	173 Å²	173	135.1 Å²	135.1	76%	0.759	77%	0.769	S	S	*	*			trans	-6.7	147.5	151.5	-82.4	-100.7	0	0	0	122
1173	D	32.3	Very low	29.8	Very low	161 Å²	161	135.2 Å²	135.2	86%	0.861	77%	0.768	S	S	*	*				-167.3	152.9	108.4	-107	-24.9	0	0	0	115.2
1174	G	32.2	Very low	29.8	Very low	63 Å²	63	135.2 Å²	135.2	65%	0.649	77%	0.768	S	S	*	*			trans	42.3	112.6	167	0	0	0	0	0	121
1175	I	28.8	Very low	29.7	Very low	133 Å²	133	136.8 Å²	136.8	68%	0.682	77%	0.766	S	S	*	*			cis	86.9	133.1	19.8	-39.3	172.3	0	0	0	116.5
1176	N	31.7	Very low	29.8	Very low	134 Å²	134	137.2 Å²	137.2	72%	0.717	76%	0.764	S	S	*	*			trans	106.5	136.3	170.8	-66.2	-4.7	0	0	0	116.1
1177	E	29.4	Very low	29.6	Very low	170 Å²	170	136.7 Å²	136.7	79%	0.794	77%	0.766	S	S	*	*			cis	-162.1	143.4	-7.5	-123.4	176.6	-177	0	0	110.5
1178	S	34.4	Very low	29.6	Very low	121 Å²	121	135.9 Å²	135.9	85%	0.846	76%	0.763	S	S	*	*			trans	159.5	83.5	149.4	44.8	0	0	0	0	114.2
1179	N	28.8	Very low	29.6	Very low	166 Å²	166	135.1 Å²	135.1	89%	0.888	76%	0.76	S	S	*	*			trans	-161.2	113.1	165.2	-144.5	2.4	0	0	0	112.5
1180	V	34.2	Very low	29.7	Very low	140 Å²	140	135 Å²	135	85%	0.848	76%	0.759	S	S	*	*			trans	-155	139.4	176	-177.3	0	0	0	0	106.9
1181	G	33.5	Very low	29.8	Very low	63 Å²	63	133.9 Å²	133.9	65%	0.649	75%	0.753	S	S	*	*			cis	-171.4	179.1	-1.5	0	0	0	0	0	107.2
1182	D	33.9	Very low	29.7	Very low	134 Å²	134	135 Å²	135	72%	0.717	75%	0.751	S	S	*	*			cis	-147.5	137.3	-2.4	-71.5	-50.8	0	0	0	106.5
1183	I	29.2	Very low	29.8	Very low	146 Å²	146	133.8 Å²	133.8	75%	0.749	75%	0.752	S	S	*	*				58.7	98.3	72.4	-53.1	175.5	0	0	0	114.4
1184	S	30.5	Very low	29.7	Very low	109 Å²	109	134 Å²	134	76%	0.762	75%	0.745	S	S	*	*			trans	162.7	148.3	136.1	-80.2	0	0	0	0	112
1185	L	27.6	Very low	29.6	Very low	153 Å²	153	137.1 Å²	137.1	80%	0.801	75%	0.746	S	S	*	*			cis	-160	169.5	-31.5	-124.4	173.1	0	0	0	107.1
1186	Q	27.4	Very low	29.7	Very low	173 Å²	173	139.4 Å²	139.4	81%	0.808	75%	0.751	S	S	*	*			trans	-70.5	150.7	175.8	-58.3	173.3	3	0	0	111.2
1187	L	28	Very low	29.6	Very low	172 Å²	172	139.1 Å²	139.1	90%	0.901	75%	0.749	S	S	*	*				-170.5	151.3	125.2	-102.5	166.4	0	0	0	114.7
1188	N	24.1	Very low	29.6	Very low	130 Å²	130	135.9 Å²	135.9	70%	0.695	74%	0.737	S	S	*	*			trans	-77	-176.1	-164.1	-164.1	6.3	0	0	0	115.6
1189	N	26.8	Very low	29.4	Very low	111 Å²	111	138 Å²	138	59%	0.594	73%	0.732	S	S	*	*			trans	89.8	98.9	155.4	-65	-31.6	0	0	0	121.3
1190	N	26.8	Very low	29.4	Very low	126 Å²	126	137.1 Å²	137.1	67%	0.674	73%	0.726	S	S	*	*				84.9	138.6	112.2	-64.1	-22.7	0	0	0	123.6
1191	N	28.7	Very low	29.2	Very low	129 Å²	129	135.8 Å²	135.8	69%	0.69	72%	0.718	S	S	*	*			trans	84.8	102.1	137.3	-76	-23.1	0	0	0	122.6
1192	N	28.1	Very low	28.9	Very low	129 Å²	129	138.3 Å²	138.3	69%	0.69	72%	0.721	S	S	*	*				62.7	101.5	109.8	-82.5	-48.4	0	0	0	121.2
1193	L	30.4	Very low	28.6	Very low	147 Å²	147	138.7 Å²	138.7	77%	0.77	72%	0.718	S	S	*	*				172.9	129.9	107	-111.5	57.8	0	0	0	107.7
1194	K	28.7	Very low	28.8	Very low	166 Å²	166	138.9 Å²	138.9	72%	0.722	72%	0.716	S	S	*	*			cis	87.6	131.2	34.6	-167.3	-171.8	178.7	177.5	0	113.8
1195	N	31.4	Very low	28.9	Very low	127 Å²	127	141.5 Å²	141.5	68%	0.679	72%	0.716	S	S	*	*			trans	73.7	154.7	-178.1	-42.1	-61.2	0	0	0	113.5
1196	K	30.1	Very low	29	Very low	181 Å²	181	140.9 Å²	140.9	79%	0.787	71%	0.713	S	S	*	*			cis	-160.6	179.8	-5.9	-130.8	178.1	177.6	-173.5	0	106.9
1197	L	30.4	Very low	29.4	Very low	128 Å²	128	139.6 Å²	139.6	67%	0.67	71%	0.712	S	S	*	*			cis	-156.8	118.4	1.8	-178.4	74.8	0	0	0	104.2
1198	D	29.5	Very low	29.5	Very low	102 Å²	102	136.5 Å²	136.5	55%	0.545	70%	0.701	S	S	.	*				75	110.9	75.3	-164.9	35.7	0	0	0	115.4
1199	K	29.4	Very low	30	Very low	167 Å²	167	136.8 Å²	136.8	73%	0.726	71%	0.707	S	S	*	*			trans	69	160.3	166.5	-62	147.6	-172.1	147.4	0	117.4
1200	L	29.5	Very low	30.1	Very low	147 Å²	147	140.7 Å²	140.7	77%	0.77	72%	0.719	S	S	*	*			cis	-149.9	158.5	32.3	-79.2	164.9	0	0	0	113.9
1201	V	28.9	Very low	30.4	Very low	111 Å²	111	140.1 Å²	140.1	67%	0.673	72%	0.722	S	S	*	*			trans	48.8	112.4	131.6	177.2	0	0	0	0	117.5
1202	T	27.8	Very low	30.4	Very low	116 Å²	116	142.1 Å²	142.1	71%	0.712	73%	0.729	S	S	*	*				54.1	153.2	82.9	70	0	0	0	0	114.3
1203	Q	28	Very low	30.5	Very low	142 Å²	142	147.3 Å²	147.3	66%	0.664	76%	0.757	S	S	*	*			cis	-153.4	-159.7	12	-153.4	162.7	-72.1	0	0	109.4
1204	E	32.3	Very low	30.5	Very low	151 Å²	151	147.4 Å²	147.4	71%	0.706	76%	0.757	S	S	*	*			trans	70.5	147.5	153.2	-73.7	148.5	-132.3	0	0	119.4
1205	E	32.3	Very low	30.6	Very low	164 Å²	164	146.4 Å²	146.4	77%	0.766	76%	0.758	S	S	*	*			cis	-158.2	-170.8	-29.9	-137.8	159.7	-134.2	0	0	111.2
1206	D	30.6	Very low	30.5	Very low	139 Å²	139	147.4 Å²	147.4	74%	0.743	76%	0.763	S	S	*	*			trans	-69.7	153.5	-169.6	-65.9	-57.1	0	0	0	116.8
1207	D	36.3	Very low	30.6	Very low	146 Å²	146	145.5 Å²	145.5	78%	0.781	76%	0.761	S	S	*	*			trans	-172.4	104.6	130.5	-105.7	-28.3	0	0	0	109.4
1208	T	30.4	Very low	30.6	Very low	108 Å²	108	146.6 Å²	146.6	66%	0.663	77%	0.767	S	S	*	*				86.7	159.5	73.3	68.1	0	0	0	0	115.5
1209	V	34.2	Very low	30.7	Very low	135 Å²	135	149.5 Å²	149.5	82%	0.818	78%	0.782	S	S	*	*			trans	76.2	91.5	172.5	-165.4	0	0	0	0	118.8
1210	F	27.5	Very low	30.7	Very low	193 Å²	193	148.3 Å²	148.3	85%	0.846	79%	0.786	S	S	*	*			trans	-69.9	155.8	150.8	-97.7	-85.8	0	0	0	110.9
1211	P	34.6	Very low	30.8	Very low	114 Å²	114	148.4 Å²	148.4	74%	0.74	79%	0.787	S	S	*	*				-151.2	148.3	83.6	38.8	-19.6	0	0	0	118.9
1212	M	27.3	Very low	31	Very low	171 Å²	171	151.5 Å²	151.5	84%	0.842	80%	0.797	S	S	*	*			trans	27.8	119.8	137.5	-57.1	-90	-85.1	0	0	120.6
1213	D	30.6	Very low	31.3	Very low	239 Å²	239	154.7 Å²	154.7	100%	1.278	80%	0.804	S	S	*	*				-149	0	109.4	-126.8	8.8	0	0	0	109.3

Retrieved 1,213 of 1,213 residues in 1828.7 ms (Link to these results)

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