A0A087XQE7_POEFO Loading...

Mitogen-activated protein kinase kinase kinase 12

May be an activator of the JNK/SAPK pathway.

AlphaFold DB , UniProt , Accession A0A087XQE7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 945 aa.

						>A0A087XQE7_POEFO|A0A087XQE7
MALIHEPRASSPSLSGFNTPISDPPSFRRLDAETPCTPEMDLTPTQCVLRNVLSIDTGAAVEPGGGGGRGEGKTPGHNQTPGEEQQEHFANSVLKLHEHEGSSGRTEGEGQDPDRPVVRSQADDARLQCQSTGGGGGFLEGLFGCLRPVWTMIGKAYSTEHKHVLDEEWEVPFEEISDLQWVGSGAQGAVFLGKLHGQEVAVKKVRNIKETDIKHLRKLKHPNIITFKGICTQAPCYCIIMEYCAQGQLYEVLRAGRKITPSLLMDWAMGIAGGMNYLHLHKIIHRDLKSPNMLITYDDAVKISDFGTSKELNDKSTKMSFAGTVAWMAPEVIRNEPVSEKVDIWSFGVVLWEMLTGEVPYKDVDSSAIIWGVGNNSLQLPVPDSCPDSFKLLLKQCWNCKPRNRPSFRQILLHLDIASADILSTPQETYFQSQAEWRDEVRHNFEKIKSEGTCLHRLDEELIKRRREELRHALDIREHYERKLERANNLYMELNAIMLQLEIKEKELLKREQSLDKKYPSCFKHHSSRQSASSNSMEKLMKKRNVPQKLPSHSKRPDLLKSEVILPKLDSSMTQVTIPNKGSTSPGRSRRGKPRYRKAGKGSSSDLAQLKATLSSSLAMINATSSVPSSKHRLDPTAAIRGLQHDLLLKKMSSSSPDLISTTLEAEVRRRGQLRPGLDRAGSQSASAGLEDSGETEGPRDRQDVGVGGDDLVETPPRSDTPSEDAASIPFSSSPDSPCGRGAAAGRASVLGNARVSHEVEDKEEGTVITRSPRSQRRLTPAALLYRAAVTRSQRRGLSSEEEEGEVDSEVELPRRRRPVSISKCQSLSNFSLENLSVSDGEEGNTTDHSHSGTPDVVSTNTDERLDDKSDDLLSQGSEIPADPCDPSQLGSDGLSEREAEVRQVKTQLALSEHNCEGLYDDSDCDSAELDHSCCAELNQPPTNW
					

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	28	Very low	32.5	Very low	255 Å²	255	144.5 Å²	144.5	100%	1.256	80%	0.797	S	S	*	*				0	165.1	0	-82.1	178.2	165.6	0	0	108.6
2	A	31.3	Very low	34.4	Very low	86 Å²	86	142.5 Å²	142.5	71%	0.711	80%	0.796	S	S	*	*			trans	-100.3	-166.6	-164.4	0	0	0	0	0	113.9
3	L	30.7	Very low	34.2	Very low	156 Å²	156	139.4 Å²	139.4	82%	0.817	79%	0.79	S	S	*	*			trans	90.8	105.5	176.8	-57.5	147.9	0	0	0	112.9
4	I	36.2	Very low	33.9	Very low	129 Å²	129	139.9 Å²	139.9	66%	0.662	79%	0.788	S	S	*	*			cis	78.2	109.5	41.6	-51.8	158.2	0	0	0	112.6
5	H	30.5	Very low	33.6	Very low	176 Å²	176	137.3 Å²	137.3	82%	0.815	78%	0.783	S	S	*	*				-168.6	132.5	114.5	-117.7	-74.5	0	0	0	115.7
6	E	34.2	Very low	33.4	Very low	147 Å²	147	133.1 Å²	133.1	69%	0.687	78%	0.779	S	S	*	*			trans	-82.2	165	155.6	-149	-151	-118.3	0	0	108.8	R8	E6-R8 PolarHBondContact OE2-N 2.75Å
7	P	49.4	Very low	33.2	Very low	100 Å²	100	136.5 Å²	136.5	65%	0.649	78%	0.782	S	S	*	*				-157.9	153	81.4	40	-18.8	0	0	0	120.8
8	R	29.3	Very low	32.9	Very low	223 Å²	223	137.1 Å²	137.1	84%	0.842	78%	0.782	S	S	*	*			trans	63	165.9	140	-70.4	171.1	178.6	166.7	-2.1	121.3	E6	E6-R8 PolarHBondContact OE2-N 2.75Å
9	A	31.2	Very low	32.6	Very low	91 Å²	91	136.7 Å²	136.7	75%	0.752	78%	0.783	S	S	*	*			cis	-173.7	177.2	-28.7	0	0	0	0	0	107.4
10	S	27	Very low	33.6	Very low	113 Å²	113	135 Å²	135	79%	0.79	78%	0.777	S	S	*	*			cis	-159.7	158.9	17.5	54.3	0	0	0	0	113.7
11	S	29.9	Very low	33.3	Very low	113 Å²	113	135.6 Å²	135.6	79%	0.79	78%	0.776	S	S	*	*			trans	-80.6	-163.2	169	-35.6	0	0	0	0	112.1
12	P	54.5	Low	33.2	Very low	121 Å²	121	128.8 Å²	128.8	79%	0.786	75%	0.754	S	S	*	*			cis	-126.4	-165.3	33.7	39.7	-18.7	0	0	0	113.2
13	S	32.3	Very low	33	Very low	102 Å²	102	131.6 Å²	131.6	71%	0.713	76%	0.757	S	S	*	*			cis	-169.4	171.6	26.9	109.5	0	0	0	0	109.1
14	L	30.5	Very low	34.2	Very low	147 Å²	147	129.8 Å²	129.8	77%	0.77	76%	0.755	S	S	*	*			cis	178.3	160.1	-17.1	-90.1	167.6	0	0	0	105.3
15	S	29.4	Very low	34.8	Very low	101 Å²	101	128.5 Å²	128.5	71%	0.706	75%	0.754	S	S	*	*			cis	-175.3	128.6	-32.6	53.9	0	0	0	0	111.7
16	G	29.4	Very low	34.9	Very low	69 Å²	69	124.7 Å²	124.7	71%	0.711	75%	0.747	S	S	*	*			trans	100.3	159.5	164	0	0	0	0	0	117.2
17	F	30	Very low	34.7	Very low	192 Å²	192	125.5 Å²	125.5	84%	0.842	75%	0.749	S	S	*	*			cis	-164.1	156.1	-5.7	-121	-68.4	0	0	0	112.2
18	N	27.8	Very low	33.8	Very low	146 Å²	146	129.1 Å²	129.1	78%	0.781	75%	0.75	S	S	*	*			trans	76	156.7	159.6	-69.5	-19.6	0	0	0	122.4
19	T	28.7	Very low	33.7	Very low	130 Å²	130	129.1 Å²	129.1	80%	0.798	75%	0.75	S	S	*	*			trans	-128.1	-177.3	-174.7	54.4	0	0	0	0	109.5
20	P	52.4	Low	33.6	Very low	103 Å²	103	130.7 Å²	130.7	67%	0.669	75%	0.745	S	S	*	*			cis	-131.3	-155.7	-25.3	26.8	-1.4	0	0	0	112.2
21	I	26.2	Very low	33.7	Very low	148 Å²	148	132.1 Å²	132.1	76%	0.759	74%	0.744	S	S	*	*			trans	89.5	134.1	149.9	-70.5	164.7	0	0	0	121.3
22	S	25.8	Very low	33.7	Very low	111 Å²	111	131 Å²	131	78%	0.776	74%	0.741	S	S	*	*			trans	75.8	141.8	153.7	-73.5	0	0	0	0	125.4
23	D	27.4	Very low	32.5	Very low	145 Å²	145	133.3 Å²	133.3	78%	0.775	74%	0.742	S	S	*	*			trans	-82.5	-168.3	160.9	-43.4	-89.6	0	0	0	113.1
24	P	57	Low	32.5	Very low	119 Å²	119	133.6 Å²	133.6	77%	0.773	74%	0.739	S	S	*	*			cis	-125.6	-26.9	-35.9	13.6	6.1	0	0	0	121.9
25	P	48.4	Very low	32.6	Very low	101 Å²	101	132 Å²	132	66%	0.656	74%	0.738	S	S	*	*				-120	130.8	-109.3	38.1	-27.3	0	0	0	120.7
26	S	31.4	Very low	32.4	Very low	96 Å²	96	133.3 Å²	133.3	67%	0.671	75%	0.745	S	S	*	*				83.4	164.8	129.8	79.6	0	0	0	0	123.8
27	F	30	Very low	32.8	Very low	165 Å²	165	136.3 Å²	136.3	72%	0.724	75%	0.75	S	S	*	*			trans	83.1	138.5	166.1	-72.8	-53	0	0	0	119.8
28	R	31.5	Very low	33	Very low	176 Å²	176	133.1 Å²	133.1	66%	0.664	75%	0.749	S	S	*	*			cis	-152.2	149.7	-2.2	-161.8	161.4	-75.6	-173.7	-3.2	107.1	L30	R28-L30 HydrophobicContact CG-CD1 4.44Å
29	R	25.9	Very low	33	Very low	222 Å²	222	134.9 Å²	134.9	84%	0.838	75%	0.752	S	S	*	*				176.1	117	75.4	180	-171.8	-71.5	-179.3	-2.8	112.4
30	L	30.4	Very low	33.2	Very low	124 Å²	124	136.6 Å²	136.6	65%	0.649	75%	0.753	S	S	*	*				29.2	141.9	117.9	-52	170.8	0	0	0	118.3	R28	R28-L30 HydrophobicContact CG-CD1 4.44Å
31	D	28.1	Very low	32.1	Very low	143 Å²	143	138 Å²	138	77%	0.765	76%	0.755	S	S	*	*			cis	-172	167.6	-1	-85.7	-25.1	0	0	0	105.5
32	A	31	Very low	32.5	Very low	89 Å²	89	138.1 Å²	138.1	74%	0.736	76%	0.756	S	S	*	*			cis	-165.8	-171.6	-17.5	0	0	0	0	0	105.3
33	E	29.5	Very low	33.4	Very low	171 Å²	171	136.9 Å²	136.9	80%	0.799	74%	0.744	S	S	*	*			cis	-159.9	-163.7	2.9	-135.5	-85.7	-108.3	0	0	107.4
34	T	30.8	Very low	33.9	Very low	108 Å²	108	134.8 Å²	134.8	66%	0.663	74%	0.738	S	S	*	*			trans	-114	160.3	-166.2	-19.3	0	0	0	0	113.9
35	P	34.1	Very low	33	Very low	113 Å²	113	132.6 Å²	132.6	73%	0.734	72%	0.723	S	S	*	*				-151.7	152.1	85.4	39.3	-20.9	0	0	0	118.2
36	C	24.5	Very low	32.7	Very low	128 Å²	128	134.2 Å²	134.2	87%	0.865	72%	0.722	S	S	*	*			trans	51.4	150.2	147.8	-58.5	0	0	0	0	124
37	T	37.1	Very low	33.1	Very low	133 Å²	133	134.2 Å²	134.2	82%	0.816	72%	0.721	S	S	*	*			trans	-89.7	158.9	177.2	48.8	0	0	0	0	113.8
38	P	35.5	Very low	33.7	Very low	125 Å²	125	129.6 Å²	129.6	81%	0.812	71%	0.706	S	S	*	*				-143.3	-155.7	104.4	40.5	-24.7	0	0	0	114.6
39	E	27.5	Very low	33.9	Very low	183 Å²	183	125.6 Å²	125.6	86%	0.855	70%	0.697	S	S	*	*			trans	-98.2	-168.1	-159.3	-57.9	168.1	103	0	0	116.5
40	M	32.7	Very low	34.4	Very low	166 Å²	166	125 Å²	125	82%	0.818	70%	0.695	S	S	*	*			trans	81.7	144.5	170.4	-51.8	-178.7	78.9	0	0	117.6
41	D	28.7	Very low	34.6	Very low	131 Å²	131	126 Å²	126	70%	0.701	70%	0.701	S	S	*	*			cis	-164	133.2	-23.6	-105.5	-24.7	0	0	0	109.9
42	L	35.7	Very low	35.2	Very low	152 Å²	152	124.6 Å²	124.6	80%	0.796	70%	0.697	S	S	*	*			trans	-150.3	140.7	165.5	-79.8	-177.9	0	0	0	110.8
43	T	44.8	Very low	35.2	Very low	84 Å²	84	127.1 Å²	127.1	52%	0.515	70%	0.697	S	S	.	*			trans	-90.2	146.6	-166.2	52.8	0	0	0	0	114.8	T45 Q46	T43-T45 PolarHBondContact O-N 3.31Å; T43-Q46 PolarHBondContact O-N 3.36Å
44	P	36.7	Very low	35.1	Very low	101 Å²	101	124.2 Å²	124.2	66%	0.656	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.2	-25.7	-176.1	-28.1	35.8	0	0	0	115.7	Q46 C47	P44-Q46 PolarHBondContact O-N 3.38Å; P44-Q46 VanDerWaalsContact O-N 3.1Å; P44-C47 PolarHBondContact O-N 3.36Å
45	T	38.2	Very low	35.2	Very low	73 Å²	73	124.7 Å²	124.7	45%	0.448	69%	0.694	S	S	.	*	H	α-helix	trans	-53.7	-32	-177.9	-31.4	0	0	0	0	112.9	T43 F173	T43-T45 PolarHBondContact O-N 3.31Å; T45-F173 HydrophobicContact CG2-CD1 4.47Å; T45-F173 HydrophobicContact CG2-CE1 3.8Å
46	Q	41.5	Very low	34.8	Very low	135 Å²	135	124.7 Å²	124.7	63%	0.631	69%	0.687	S	S	*	*	H	α-helix	trans	-77.9	-22.7	-178	-62.2	-172.7	-4	0	0	113.7	T43 P44	T43-Q46 PolarHBondContact O-N 3.36Å; P44-Q46 PolarHBondContact O-N 3.38Å; P44-Q46 VanDerWaalsContact O-N 3.1Å
47	C	40.8	Very low	35	Very low	96 Å²	96	124.4 Å²	124.4	65%	0.649	68%	0.682	S	S	*	*	H	α-helix	trans	-84.5	-32.9	-179.7	-67.6	0	0	0	0	113.2	P44 L49	P44-C47 PolarHBondContact O-N 3.36Å; C47-L49 PolarHBondContact O-N 2.75Å
48	V	41.7	Very low	34.5	Very low	69 Å²	69	122 Å²	122	42%	0.418	68%	0.683	S	S	.	*	H	α-helix	trans	-70.5	-31.1	-171.7	178.9	0	0	0	0	112.9
49	L	37.4	Very low	34.1	Very low	91 Å²	91	120.7 Å²	120.7	48%	0.476	68%	0.683	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.3	-16.3	-171.9	-73.5	171.6	0	0	0	115.2	C47	C47-L49 PolarHBondContact O-N 2.75Å
50	R	34.8	Very low	34	Very low	211 Å²	211	116.7 Å²	116.7	80%	0.796	68%	0.681	S	S	*	*	S	Bend	trans	-89	-19.1	-172.3	-158.4	171	-172	165.6	3.3	115.1
51	N	34.7	Very low	33.6	Very low	145 Å²	145	115.3 Å²	115.3	78%	0.775	68%	0.682	S	S	*	*	S	Bend	trans	-105.7	16.8	-166.5	-68.8	-0.2	0	0	0	114.9
52	V	41.1	Very low	33.5	Very low	112 Å²	112	117.1 Å²	117.1	68%	0.679	69%	0.686	S	S	*	*	S	Bend	trans	-102.8	-27.8	-177.2	-178	0	0	0	0	113
53	L	31.1	Very low	33.8	Very low	142 Å²	142	115.3 Å²	115.3	74%	0.743	68%	0.683	S	S	*	*	S	Bend	trans	-150.3	132.6	172.6	-64	173.7	0	0	0	106.3
54	S	28	Very low	32.8	Very low	111 Å²	111	115 Å²	115	78%	0.776	70%	0.697	S	S	*	*			cis	-144.1	168.6	10.3	-60.5	0	0	0	0	111.1
55	I	31.9	Very low	32.3	Very low	118 Å²	118	114 Å²	114	61%	0.605	71%	0.705	S	S	*	*			trans	-119.1	113.8	161.2	-62.9	175.5	0	0	0	108.9	S832	I55-S832 PolarHBondContact O-OG 3.26Å; I55-S832 VanDerWaalsContact O-OG 3.06Å
56	D	27.4	Very low	31.8	Very low	113 Å²	113	114.8 Å²	114.8	60%	0.604	73%	0.727	S	S	*	*				-147.9	158.4	127.1	-126.8	-41	0	0	0	110.5	S832	D56-S832 WeakPolarHBondContact OD2-CB 3.16Å
57	T	28	Very low	31.2	Very low	122 Å²	122	112.1 Å²	112.1	75%	0.748	74%	0.737	S	S	*	*			trans	-130.5	124.1	-159	53.3	0	0	0	0	116.2
58	G	26.8	Very low	30.7	Very low	81 Å²	81	111 Å²	111	84%	0.835	74%	0.741	S	S	*	*			trans	92.7	162.7	159.1	0	0	0	0	0	116.2
59	A	26.3	Very low	30.1	Very low	99 Å²	99	119.8 Å²	119.8	82%	0.818	77%	0.766	S	S	*	*			cis	-162	167.5	-6.5	0	0	0	0	0	111.9
60	A	25	Very low	29.8	Very low	99 Å²	99	118.6 Å²	118.6	82%	0.818	78%	0.776	S	S	*	*			trans	68	153.3	176.8	0	0	0	0	0	114.8
61	V	26	Very low	29.7	Very low	137 Å²	137	118.5 Å²	118.5	83%	0.83	79%	0.785	S	S	*	*			cis	-143	128	32.6	166.9	0	0	0	0	112.3
62	E	25	Very low	29.5	Very low	169 Å²	169	115.3 Å²	115.3	79%	0.79	79%	0.786	S	S	*	*			trans	-82.9	158	151.9	-89.2	-98.2	-168.1	0	0	109
63	P	42.5	Very low	29	Very low	113 Å²	113	119.4 Å²	119.4	73%	0.734	80%	0.795	S	S	*	*			cis	-140.6	172.7	12.2	41.8	-24.3	0	0	0	117.4
64	G	25	Very low	28.8	Very low	78 Å²	78	118.7 Å²	118.7	80%	0.804	80%	0.796	S	S	*	*			trans	84.6	151.3	140.4	0	0	0	0	0	119.6
65	G	25.9	Very low	29.9	Very low	80 Å²	80	119.3 Å²	119.3	83%	0.825	80%	0.798	S	S	*	*			cis	165.1	151	-10.8	0	0	0	0	0	115.7
66	G	26.2	Very low	29.7	Very low	89 Å²	89	117.4 Å²	117.4	92%	0.918	81%	0.807	S	S	*	*			trans	81.8	136.6	161	0	0	0	0	0	117.9
67	G	28.9	Very low	29.9	Very low	80 Å²	80	120.7 Å²	120.7	83%	0.825	82%	0.819	S	S	*	*			trans	160.7	92.9	166.8	0	0	0	0	0	116.6
68	G	30.4	Very low	29.9	Very low	71 Å²	71	120.8 Å²	120.8	73%	0.732	81%	0.814	S	S	*	*			trans	79.6	141.1	173.2	0	0	0	0	0	114.1
69	R	30	Very low	29.9	Very low	254 Å²	254	124.7 Å²	124.7	96%	0.958	81%	0.811	S	S	*	*			cis	57	123.2	26.6	-55	-172.9	175.7	-158.1	0.7	114.1
70	G	30.7	Very low	30	Very low	66 Å²	66	125.9 Å²	125.9	68%	0.68	81%	0.808	S	S	*	*			cis	153.5	-178.5	-6.9	0	0	0	0	0	113.4
71	E	33.5	Very low	31.3	Very low	210 Å²	210	127.3 Å²	127.3	98%	0.981	81%	0.809	S	S	*	*			trans	67.9	150.8	167.9	-50.6	-172.1	92.1	0	0	117.3
72	G	29.7	Very low	31.3	Very low	78 Å²	78	123.8 Å²	123.8	80%	0.804	80%	0.8	S	S	*	*			trans	155.5	67	178.3	0	0	0	0	0	116.2
73	K	30.3	Very low	31.6	Very low	198 Å²	198	125 Å²	125	86%	0.861	81%	0.806	S	S	*	*			trans	-60.3	134.2	-175.6	-68.4	168	178	167.1	0	115.3
74	T	27.9	Very low	31.2	Very low	126 Å²	126	127.2 Å²	127.2	77%	0.773	81%	0.807	S	S	*	*				-6.8	166.6	126.2	51	0	0	0	0	119.5
75	P	50.8	Low	31.6	Very low	125 Å²	125	130.1 Å²	130.1	81%	0.812	80%	0.8	S	S	*	*			cis	-138.9	-173.6	-30.2	38.4	-20.7	0	0	0	113.3
76	G	28	Very low	31.9	Very low	78 Å²	78	132.8 Å²	132.8	80%	0.804	79%	0.79	S	S	*	*			trans	159.4	129.5	154.3	0	0	0	0	0	119.7
77	H	31.2	Very low	32.4	Very low	181 Å²	181	134 Å²	134	84%	0.838	77%	0.772	S	S	*	*			trans	-71.2	166.7	157.3	-79.6	-20.9	0	0	0	111.2
78	N	28.6	Very low	32.6	Very low	124 Å²	124	137.4 Å²	137.4	66%	0.663	77%	0.766	S	S	*	*			cis	-163.4	176.1	5.3	-126.1	-19	0	0	0	112
79	Q	26.5	Very low	32.6	Very low	164 Å²	164	141.1 Å²	141.1	77%	0.766	76%	0.762	S	S	*	*			trans	73.6	110.7	152.8	-74.8	166.1	15.9	0	0	122
80	T	26.8	Very low	32.9	Very low	124 Å²	124	132.1 Å²	132.1	76%	0.761	74%	0.743	S	S	*	*				30.8	159.8	119.2	53.3	0	0	0	0	123.1
81	P	52.5	Low	33	Very low	128 Å²	128	135.3 Å²	135.3	83%	0.831	74%	0.744	S	S	*	*			cis	-142	-165.7	-25	39.8	-19.4	0	0	0	114.5
82	G	26.4	Very low	33.1	Very low	63 Å²	63	129.8 Å²	129.8	65%	0.649	73%	0.729	S	S	*	*			trans	126.1	128.5	166.1	0	0	0	0	0	113.1
83	E	32.7	Very low	33	Very low	194 Å²	194	132.6 Å²	132.6	91%	0.907	73%	0.73	S	S	*	*			cis	77.1	148.4	47	-67	-174.7	152.9	0	0	114.5
84	E	33.3	Very low	33.2	Very low	160 Å²	160	130.6 Å²	130.6	75%	0.748	73%	0.728	S	S	*	*			cis	-104.2	-132.2	-1.4	-54.9	165.1	71.6	0	0	110.4
85	Q	33.5	Very low	33.2	Very low	140 Å²	140	133.9 Å²	133.9	65%	0.654	73%	0.731	S	S	*	*			cis	-168.7	164.9	-16.5	-124.8	-175.4	53.6	0	0	104.4
86	Q	32.3	Very low	31.9	Very low	135 Å²	135	136 Å²	136	63%	0.631	74%	0.735	S	S	*	*			cis	-165.8	147.2	-14.2	-153	40.6	23	0	0	106.3
87	E	36.5	Very low	31.8	Very low	115 Å²	115	140.4 Å²	140.4	54%	0.537	73%	0.734	S	S	.	*			cis	-125	-81.2	-4.9	-170.9	165.8	-100.1	0	0	111.1	F89	E87-F89 HydrophobicContact CG-CD2 4.1Å; E87-F89 HydrophobicContact CG-CE2 4.02Å; E87-F89 WeakPolarHBondContact OE2-CD2 3.45Å; E87-F89 WeakPolarHBondContact OE2-CE2 3.49Å; E87-F89 WeakPolarHBondContact OE2-CZ 3.42Å
88	H	32.2	Very low	31.6	Very low	152 Å²	152	141.2 Å²	141.2	70%	0.704	74%	0.739	S	S	*	*			cis	-163.5	141.1	-35.1	-152.5	58.8	0	0	0	105
89	F	30.5	Very low	31.5	Very low	148 Å²	148	143.6 Å²	143.6	65%	0.649	75%	0.745	S	S	*	*			cis	-171.3	169.8	-17.3	-121.2	-151.2	0	0	0	104.9	E87	E87-F89 HydrophobicContact CG-CD2 4.1Å; E87-F89 HydrophobicContact CG-CE2 4.02Å; E87-F89 WeakPolarHBondContact OE2-CD2 3.45Å; E87-F89 WeakPolarHBondContact OE2-CE2 3.49Å; E87-F89 WeakPolarHBondContact OE2-CZ 3.42Å
90	A	36	Very low	31.8	Very low	66 Å²	66	145.2 Å²	145.2	55%	0.545	75%	0.753	S	S	.	*			cis	179.5	160.3	-16.4	0	0	0	0	0	106
91	N	34.3	Very low	31.9	Very low	132 Å²	132	142.2 Å²	142.2	71%	0.706	75%	0.747	S	S	*	*			cis	-170.7	155.1	-15.3	-102.7	-27.4	0	0	0	107.4
92	S	34.7	Very low	30.8	Very low	94 Å²	94	141.8 Å²	141.8	66%	0.657	75%	0.747	S	S	*	*			cis	-175	164.1	-20.1	-121.7	0	0	0	0	111.4
93	V	29	Very low	31	Very low	138 Å²	138	144.5 Å²	144.5	84%	0.836	76%	0.756	S	S	*	*			trans	75	178.8	149.5	173.3	0	0	0	0	117.6
94	L	33.3	Very low	30.8	Very low	156 Å²	156	138.7 Å²	138.7	82%	0.817	75%	0.748	S	S	*	*			trans	-130	165.4	-136.8	-72.5	159.9	0	0	0	115.9
95	K	27.6	Very low	30.7	Very low	194 Å²	194	142.6 Å²	142.6	84%	0.843	76%	0.756	S	S	*	*			trans	84.9	115.2	140.4	-142.1	178.8	-168.6	-179.8	0	119
96	L	23.5	Very low	30.5	Very low	171 Å²	171	140.6 Å²	140.6	90%	0.895	75%	0.753	S	S	*	*				-175.3	-175.1	117.3	-102.6	167.4	0	0	0	113
97	H	26	Very low	30.4	Very low	169 Å²	169	142.9 Å²	142.9	78%	0.782	76%	0.764	S	S	*	*			trans	-133	138.3	-169.2	-155.6	94	0	0	0	108
98	E	26.9	Very low	30	Very low	199 Å²	199	141 Å²	141	93%	0.93	78%	0.776	S	S	*	*			trans	-178.3	171.2	150.4	-108.1	167.6	-169.6	0	0	112.5
99	H	27.3	Very low	29.9	Very low	173 Å²	173	143.7 Å²	143.7	80%	0.801	79%	0.789	S	S	*	*			trans	-157.4	126	-159.6	164.7	-66.9	0	0	0	113.4
100	E	31.7	Very low	29.8	Very low	198 Å²	198	140.1 Å²	140.1	93%	0.925	79%	0.793	S	S	*	*			trans	-172.2	148.7	155.2	-112	178.9	-163.6	0	0	110
101	G	29.1	Very low	29.4	Very low	62 Å²	62	146.7 Å²	146.7	64%	0.639	81%	0.813	S	S	*	*			cis	171.3	170.6	-10.7	0	0	0	0	0	114.7
102	S	30.9	Very low	29.3	Very low	118 Å²	118	147.7 Å²	147.7	83%	0.825	82%	0.818	S	S	*	*			trans	96.8	133.8	156.8	-154	0	0	0	0	122.6
103	S	30.9	Very low	30	Very low	121 Å²	121	147.7 Å²	147.7	85%	0.846	82%	0.816	S	S	*	*			trans	65.9	120.2	163.7	67.2	0	0	0	0	120.2
104	G	28.1	Very low	30	Very low	72 Å²	72	148.3 Å²	148.3	74%	0.742	81%	0.814	S	S	*	*			cis	152.6	155.4	-19.6	0	0	0	0	0	115.5
105	R	30.4	Very low	29.9	Very low	242 Å²	242	152.2 Å²	152.2	91%	0.913	82%	0.818	S	S	*	*			trans	59.1	139	157.2	-84.2	-172.3	173.3	172.3	-2.3	119.2
106	T	30.3	Very low	30.4	Very low	97 Å²	97	148.6 Å²	148.6	60%	0.595	81%	0.814	S	S	*	*			cis	-160.5	-179.8	-7.8	-7.4	0	0	0	0	109.5
107	E	29.8	Very low	30.7	Very low	184 Å²	184	146.5 Å²	146.5	86%	0.86	81%	0.809	S	S	*	*			trans	9.3	146.7	150.5	-64.3	136.2	-143.3	0	0	120.7
108	G	27.8	Very low	30.8	Very low	76 Å²	76	144.3 Å²	144.3	78%	0.784	81%	0.807	S	S	*	*			cis	174.7	-168.2	7.7	0	0	0	0	0	113.6
109	E	30	Very low	30.6	Very low	208 Å²	208	146.7 Å²	146.7	97%	0.972	81%	0.807	S	S	*	*			trans	-33.6	158.7	-175.7	-53.1	174.3	114.5	0	0	120.6
110	G	27.7	Very low	30.6	Very low	72 Å²	72	143.1 Å²	143.1	74%	0.742	80%	0.802	S	S	*	*			trans	136.6	72	139.5	0	0	0	0	0	122.3
111	Q	29.3	Very low	30.5	Very low	204 Å²	204	142.6 Å²	142.6	95%	0.953	80%	0.8	S	S	*	*			trans	58.7	160.6	139.4	-68	179.1	-3.1	0	0	123.9
112	D	30.9	Very low	30.5	Very low	153 Å²	153	144.2 Å²	144.2	82%	0.818	81%	0.806	S	S	*	*			trans	-60.6	175.2	176	-129.8	13.6	0	0	0	113.8
113	P	50.1	Low	30.5	Very low	94 Å²	94	145.8 Å²	145.8	61%	0.61	81%	0.806	S	S	*	*			cis	-143.6	-160.3	14.3	41.6	-19	0	0	0	117.2
114	D	28.5	Very low	30.5	Very low	151 Å²	151	147.6 Å²	147.6	81%	0.807	81%	0.806	S	S	*	*			trans	99	118	151.3	-73.7	-17.3	0	0	0	122.2
115	R	30.8	Very low	30.5	Very low	239 Å²	239	149 Å²	149	90%	0.902	81%	0.811	S	S	*	*			trans	-95.6	147.5	152.4	-96.3	-178.5	166.6	-171.5	-1.5	108.4
116	P	39	Very low	30.5	Very low	117 Å²	117	148 Å²	148	76%	0.76	81%	0.807	S	S	*	*				-152.3	147.2	108.7	31.2	-11.1	0	0	0	118.8
117	V	28.8	Very low	30.4	Very low	128 Å²	128	149.9 Å²	149.9	78%	0.776	81%	0.813	S	S	*	*			trans	70.4	103	134.8	179.4	0	0	0	0	122.3
118	V	27.7	Very low	30.3	Very low	123 Å²	123	149.3 Å²	149.3	75%	0.745	81%	0.81	S	S	*	*				36	122.8	123.1	-171.4	0	0	0	0	122
119	R	24.6	Very low	30	Very low	248 Å²	248	150.4 Å²	150.4	94%	0.936	80%	0.804	S	S	*	*			trans	-148.1	133.1	130.1	-90.2	173.3	175.1	145.7	-1.9	106.7
120	S	26.7	Very low	29.8	Very low	98 Å²	98	148.9 Å²	148.9	69%	0.685	80%	0.798	S	S	*	*			cis	101.8	140.6	21.9	-165.9	0	0	0	0	114
121	Q	29.3	Very low	29.8	Very low	188 Å²	188	150.7 Å²	150.7	88%	0.879	80%	0.799	S	S	*	*			trans	74.1	149.6	-173.8	-57.1	-177.7	-38	0	0	115.4
122	A	29	Very low	29.8	Very low	95 Å²	95	147.7 Å²	147.7	79%	0.785	79%	0.794	S	S	*	*			cis	-138	177.2	7.2	0	0	0	0	0	113.4
123	D	31.1	Very low	29.7	Very low	151 Å²	151	144.1 Å²	144.1	81%	0.807	79%	0.794	S	S	*	*			trans	-97.6	167.7	-163.6	-50.5	-87.5	0	0	0	117
124	D	31	Very low	28.6	Very low	159 Å²	159	143.5 Å²	143.5	85%	0.85	81%	0.805	S	S	*	*			trans	37.4	125.7	149	-103	-30.9	0	0	0	123.3
125	A	28.5	Very low	28.7	Very low	103 Å²	103	140.4 Å²	140.4	85%	0.851	81%	0.809	S	S	*	*				-164.2	159.5	126.1	0	0	0	0	0	111.2
126	R	29.3	Very low	28.8	Very low	221 Å²	221	133 Å²	133	83%	0.834	81%	0.807	S	S	*	*			trans	-140.9	149.1	-166.8	-140.6	-172.8	175	171	-2.1	113.5
127	L	28.5	Very low	28.5	Very low	136 Å²	136	130.7 Å²	130.7	71%	0.712	80%	0.804	S	S	*	*			trans	78.6	128.7	159.6	-61.2	165.7	0	0	0	120.8
128	Q	26.8	Very low	29	Very low	171 Å²	171	134.5 Å²	134.5	80%	0.799	81%	0.81	S	S	*	*				25.7	146.7	129.3	-65.7	172.9	-20	0	0	120.3
129	C	23.3	Very low	29.8	Very low	99 Å²	99	134.8 Å²	134.8	67%	0.669	81%	0.807	S	S	*	*			cis	-161.8	168.1	25.1	-146.1	0	0	0	0	115
130	Q	26	Very low	30.8	Very low	177 Å²	177	131.4 Å²	131.4	83%	0.827	80%	0.802	S	S	*	*			trans	54.6	109.8	151	-82.8	168.7	10.5	0	0	123.1
131	S	27.6	Very low	31.4	Very low	109 Å²	109	129.9 Å²	129.9	76%	0.762	80%	0.801	S	S	*	*				65.8	110.4	119.2	-175.1	0	0	0	0	122.3
132	T	28.6	Very low	32.3	Very low	141 Å²	141	127.4 Å²	127.4	87%	0.865	79%	0.793	S	S	*	*				-159.1	151.4	121.7	28.4	0	0	0	0	110.1
133	G	28.2	Very low	33.1	Very low	79 Å²	79	130.1 Å²	130.1	81%	0.814	79%	0.788	S	S	*	*			trans	-85.4	176.7	168.8	0	0	0	0	0	112.9
134	G	28.4	Very low	33.7	Very low	81 Å²	81	124.7 Å²	124.7	84%	0.835	77%	0.768	S	S	*	*			cis	175.2	175.5	-1.2	0	0	0	0	0	113
135	G	28.8	Very low	34.8	Very low	86 Å²	86	121.2 Å²	121.2	89%	0.887	76%	0.755	S	S	*	*			trans	93.1	134.3	-176.2	0	0	0	0	0	112.9
136	G	33.9	Very low	35.8	Very low	84 Å²	84	120.5 Å²	120.5	87%	0.866	74%	0.736	S	S	*	*			cis	172.5	124	-7.7	0	0	0	0	0	110
137	G	32.8	Very low	36.9	Very low	67 Å²	67	118.9 Å²	118.9	69%	0.691	73%	0.73	S	S	*	*			trans	-165.3	66.4	-164.2	0	0	0	0	0	117.2	L139	G137-L139 VanDerWaalsContact C-N 3.29Å; G137-L139 PolarHBondContact O-N 3.14Å
138	F	39.9	Very low	38	Very low	208 Å²	208	116.1 Å²	116.1	91%	0.912	72%	0.72	S	S	*	*	S	Bend	trans	61.6	-35.6	152.6	-160.4	-112.5	0	0	0	121
139	L	42.9	Very low	39.4	Very low	130 Å²	130	110.8 Å²	110.8	68%	0.681	70%	0.699	S	S	*	*	S	Bend	trans	-90.8	-14.5	-167.5	-74.1	172.1	0	0	0	116.2	G137 G141	G137-L139 VanDerWaalsContact C-N 3.29Å; G137-L139 PolarHBondContact O-N 3.14Å; L139-G141 VanDerWaalsContact C-N 3.3Å; L139-G141 PolarHBondContact O-N 2.87Å
140	E	46.1	Very low	40.8	Very low	176 Å²	176	116.2 Å²	116.2	82%	0.822	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-21.8	-175.4	-166.2	164.7	-165.6	0	0	113.5	L142	E140-L142 PolarHBondContact O-N 3.45Å
141	G	39.5	Very low	42	Very low	66 Å²	66	111.5 Å²	111.5	68%	0.68	69%	0.689	S	S	*	*	H	α-helix	trans	-67.4	-28.2	-177.3	0	0	0	0	0	115.2	L139	L139-G141 VanDerWaalsContact C-N 3.3Å; L139-G141 PolarHBondContact O-N 2.87Å
142	L	47.7	Very low	43.1	Very low	136 Å²	136	112.1 Å²	112.1	71%	0.712	68%	0.681	S	S	*	*	H	α-helix	trans	-89.5	-17.1	-171	-150.6	74.2	0	0	0	114.3	E140 C145	E140-L142 PolarHBondContact O-N 3.45Å; L142-C145 PolarHBondContact O-SG 3.14Å; L142-C145 VanDerWaalsContact O-SG 3.36Å
143	F	46.7	Very low	44.3	Very low	153 Å²	153	110.1 Å²	110.1	67%	0.671	66%	0.664	S	S	*	*	H	α-helix	trans	-101.5	-13.5	179.2	-74.3	-82	0	0	0	113.7
144	G	44.2	Very low	45.1	Very low	37 Å²	37	108.1 Å²	108.1	38%	0.381	64%	0.644	S	S	.	*	H	α-helix	trans	-63.8	-39.7	176.9	0	0	0	0	0	113.6	L146 R147	G144-L146 VanDerWaalsContact C-N 3.27Å; G144-L146 PolarHBondContact O-N 2.99Å; G144-R147 PolarHBondContact O-N 3.1Å
145	C	52.5	Low	46	Very low	85 Å²	85	110.9 Å²	110.9	57%	0.574	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.6	-13.4	-176.8	50.8	0	0	0	0	114.8	L142 P148	L142-C145 PolarHBondContact O-SG 3.14Å; L142-C145 VanDerWaalsContact O-SG 3.36Å; C145-P148 WeakPolarHBondContact O-CD 3.46Å
146	L	51.2	Low	46.9	Very low	88 Å²	88	108.9 Å²	108.9	46%	0.461	61%	0.608	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.3	-6.9	179.1	-66.8	175.6	0	0	0	114.1	G144 V149 W150	G144-L146 VanDerWaalsContact C-N 3.27Å; G144-L146 PolarHBondContact O-N 2.99Å; L146-V149 HydrophobicContact CD2-CB 4.46Å; L146-V149 HydrophobicContact CD2-CG2 4.36Å; L146-V149 PolarHBondContact O-N 2.91Å; L146-V149 VanDerWaalsContact O-N 3.14Å; L146-W150 PolarHBondContact O-N 2.82Å
147	R	52.3	Low	47.4	Very low	187 Å²	187	112.1 Å²	112.1	71%	0.706	60%	0.595	S	S	*	*	H	α-helix	trans	-57	-41.7	175.8	-81.4	-176.6	167.9	134.8	-0	114.4	G144 V149 T151	G144-R147 PolarHBondContact O-N 3.1Å; R147-V149 VanDerWaalsContact C-N 3.35Å; R147-T151 WeakPolarHBondContact O-CB 3.21Å; R147-T151 PolarHBondContact O-N 3.25Å; R147-T151 VanDerWaalsContact O-N 3.14Å; R147-T151 PolarHBondContact O-OG1 3.32Å
148	P	51.5	Low	48	Very low	78 Å²	78	112.3 Å²	112.3	51%	0.506	59%	0.586	S	S	.	*	H	α-helix	trans	-62.5	-42.7	173.8	-21.6	33.8	0	0	0	111.9	C145 T151 M152	C145-P148 WeakPolarHBondContact O-CD 3.46Å; P148-T151 PolarHBondContact O-N 3.34Å; P148-M152 WeakPolarHBondContact O-CG 3.43Å; P148-M152 PolarHBondContact O-N 3.29Å
149	V	55.7	Low	48.2	Very low	60 Å²	60	106.5 Å²	106.5	36%	0.364	57%	0.568	S	S	.	*	H	α-helix	trans	-65.1	-46.2	-178.8	-178.1	0	0	0	0	111.2	L146 R147 T151 M152 I153	L146-V149 HydrophobicContact CD2-CB 4.46Å; L146-V149 HydrophobicContact CD2-CG2 4.36Å; L146-V149 PolarHBondContact O-N 2.91Å; L146-V149 VanDerWaalsContact O-N 3.14Å; R147-V149 VanDerWaalsContact C-N 3.35Å; V149-T151 VanDerWaalsContact C-N 3.25Å; V149-T151 PolarHBondContact O-N 3.1Å; V149-M152 PolarHBondContact O-N 3.28Å; V149-M152 VanDerWaalsContact O-N 3.1Å; V149-I153 HydrophobicContact CG1-CD1 3.7Å; V149-I153 HydrophobicContact CG1-CG1 4.25Å; V149-I153 WeakPolarHBondContact O-CG1 3.46Å; V149-I153 PolarHBondContact O-N 2.98Å
150	W	51.5	Low	48.1	Very low	213 Å²	213	105.8 Å²	105.8	81%	0.807	56%	0.561	S	S	*	*	H	α-helix	trans	-61.9	-34.9	176	-155.5	-81.5	0	0	0	112.2	L146 G154	L146-W150 PolarHBondContact O-N 2.82Å; W150-G154 PolarHBondContact O-N 2.68Å
151	T	53.1	Low	47.8	Very low	78 Å²	78	103.1 Å²	103.1	48%	0.479	55%	0.548	S	S	.	.	H	α-helix	trans	-73.5	-29.3	175.9	-50.3	0	0	0	0	112.4	R147 P148 V149 K155	R147-T151 WeakPolarHBondContact O-CB 3.21Å; R147-T151 PolarHBondContact O-N 3.25Å; R147-T151 VanDerWaalsContact O-N 3.14Å; R147-T151 PolarHBondContact O-OG1 3.32Å; P148-T151 PolarHBondContact O-N 3.34Å; V149-T151 VanDerWaalsContact C-N 3.25Å; V149-T151 PolarHBondContact O-N 3.1Å; T151-K155 WeakPolarHBondContact O-CB 3.41Å; T151-K155 WeakPolarHBondContact O-CD 3.27Å; T151-K155 WeakPolarHBondContact O-CG 3.49Å; T151-K155 PolarHBondContact O-N 3.26Å
152	M	49.2	Very low	48.1	Very low	121 Å²	121	107.2 Å²	107.2	60%	0.596	55%	0.547	S	S	*	.	H	α-helix	trans	-78.7	-44.7	173.4	-72.8	-169.1	-64.1	0	0	112.3	P148 V149 K155 A156	P148-M152 WeakPolarHBondContact O-CG 3.43Å; P148-M152 PolarHBondContact O-N 3.29Å; V149-M152 PolarHBondContact O-N 3.28Å; V149-M152 VanDerWaalsContact O-N 3.1Å; M152-K155 CarbonylContact O-C 3.57Å; M152-K155 WeakPolarHBondContact O-CA 3.33Å; M152-K155 WeakPolarHBondContact O-CB 3.32Å; M152-K155 PolarHBondContact O-N 2.93Å; M152-K155 VanDerWaalsContact O-N 3.1Å; M152-A156 PolarHBondContact O-N 3.03Å
153	I	54.3	Low	47.9	Very low	99 Å²	99	106.8 Å²	106.8	51%	0.508	54%	0.541	S	S	.	.	H	α-helix	trans	-63.5	-44.3	177.3	-66.7	174.1	0	0	0	110.5	V149 K155 A156 Y157	V149-I153 HydrophobicContact CG1-CD1 3.7Å; V149-I153 HydrophobicContact CG1-CG1 4.25Å; V149-I153 WeakPolarHBondContact O-CG1 3.46Å; V149-I153 PolarHBondContact O-N 2.98Å; I153-K155 PolarHBondContact O-N 3.05Å; I153-A156 PolarHBondContact O-N 3.2Å; I153-Y157 PolarHBondContact O-N 2.78Å
154	G	45.7	Very low	47.7	Very low	37 Å²	37	104 Å²	104	38%	0.381	54%	0.536	S	S	.	.	H	α-helix	trans	-62	-28.6	173.8	0	0	0	0	0	113.5	W150 S158	W150-G154 PolarHBondContact O-N 2.68Å; G154-S158 VanDerWaalsContact O-CB 3.27Å; G154-S158 WeakPolarHBondContact O-CB 3.35Å; G154-S158 PolarHBondContact O-N 2.8Å; G154-S158 PolarHBondContact O-OG 3.29Å
155	K	46.8	Very low	48	Very low	140 Å²	140	106.4 Å²	106.4	61%	0.609	54%	0.54	S	S	*	.	H	α-helix	trans	-76.8	-43.3	171.6	-79.3	174.7	-178.4	-177.8	0	112.3	T151 M152 I153 S158 T159	T151-K155 WeakPolarHBondContact O-CB 3.41Å; T151-K155 WeakPolarHBondContact O-CD 3.27Å; T151-K155 WeakPolarHBondContact O-CG 3.49Å; T151-K155 PolarHBondContact O-N 3.26Å; M152-K155 CarbonylContact O-C 3.57Å; M152-K155 WeakPolarHBondContact O-CA 3.33Å; M152-K155 WeakPolarHBondContact O-CB 3.32Å; M152-K155 PolarHBondContact O-N 2.93Å; M152-K155 VanDerWaalsContact O-N 3.1Å; I153-K155 PolarHBondContact O-N 3.05Å; K155-S158 CarbonylContact O-C 3.6Å; K155-S158 WeakPolarHBondContact O-CA 3.48Å; K155-S158 WeakPolarHBondContact O-CB 3.47Å; K155-S158 PolarHBondContact O-N 2.79Å; K155-S158 VanDerWaalsContact O-N 3.12Å; K155-T159 PolarHBondContact O-N 3.12Å; K155-T159 PolarHBondContact O-OG1 2.86Å; K155-T159 VanDerWaalsContact O-OG1 3.05Å
156	A	47.9	Very low	48	Very low	44 Å²	44	105.3 Å²	105.3	36%	0.364	53%	0.529	S	S	.	.	H	α-helix	trans	-57.5	-52.4	177.5	0	0	0	0	0	111.3	M152 I153 S158 T159 E160	M152-A156 PolarHBondContact O-N 3.03Å; I153-A156 PolarHBondContact O-N 3.2Å; A156-S158 VanDerWaalsContact C-N 3.27Å; A156-S158 PolarHBondContact O-N 3.19Å; A156-T159 WeakPolarHBondContact CA-OG1 3.47Å; A156-T159 PolarHBondContact O-N 2.9Å; A156-T159 PolarHBondContact O-OG1 3.29Å; A156-E160 PolarHBondContact O-N 3.01Å
157	Y	43.7	Very low	48.1	Very low	151 Å²	151	106.8 Å²	106.8	59%	0.592	53%	0.533	S	S	*	.	H	α-helix	trans	-59.7	-36.2	174.3	-107.1	-109.2	0	0	0	112.6	I153 H161	I153-Y157 PolarHBondContact O-N 2.78Å; Y157-H161 WeakPolarHBondContact O-CB 3.5Å; Y157-H161 PolarHBondContact O-N 3.24Å; Y157-H161 PolarHBondContact O-ND1 3.19Å
158	S	46.4	Very low	48.9	Very low	71 Å²	71	104.5 Å²	104.5	50%	0.497	53%	0.531	S	S	.	.	H	α-helix	trans	-73.7	-24.5	175.7	-62.6	0	0	0	0	113.7	G154 K155 A156 K162	G154-S158 VanDerWaalsContact O-CB 3.27Å; G154-S158 WeakPolarHBondContact O-CB 3.35Å; G154-S158 PolarHBondContact O-N 2.8Å; G154-S158 PolarHBondContact O-OG 3.29Å; K155-S158 CarbonylContact O-C 3.6Å; K155-S158 WeakPolarHBondContact O-CA 3.48Å; K155-S158 WeakPolarHBondContact O-CB 3.47Å; K155-S158 PolarHBondContact O-N 2.79Å; K155-S158 VanDerWaalsContact O-N 3.12Å; A156-S158 VanDerWaalsContact C-N 3.27Å; A156-S158 PolarHBondContact O-N 3.19Å; S158-K162 WeakPolarHBondContact O-CB 3.06Å; S158-K162 VanDerWaalsContact O-CG 3.26Å; S158-K162 WeakPolarHBondContact O-CG 3.38Å; S158-K162 PolarHBondContact O-N 3.28Å
159	T	43.5	Very low	50.5	Low	87 Å²	87	101.5 Å²	101.5	53%	0.534	51%	0.509	S	S	.	.	H	α-helix	trans	-81.4	-40.3	172.3	42	0	0	0	0	111.3	K155 A156 K162 H163	K155-T159 PolarHBondContact O-N 3.12Å; K155-T159 PolarHBondContact O-OG1 2.86Å; K155-T159 VanDerWaalsContact O-OG1 3.05Å; A156-T159 WeakPolarHBondContact CA-OG1 3.47Å; A156-T159 PolarHBondContact O-N 2.9Å; A156-T159 PolarHBondContact O-OG1 3.29Å; T159-K162 CarbonylContact O-C 3.52Å; T159-K162 PolarHBondContact O-N 3.08Å; T159-H163 WeakPolarHBondContact O-CB 3.2Å; T159-H163 PolarHBondContact O-N 3.47Å
160	E	40	Very low	52.2	Low	114 Å²	114	102 Å²	102	53%	0.533	51%	0.508	S	S	.	.	H	α-helix	trans	-64	-47.9	173.9	-70.9	172.5	127.7	0	0	111.1	A156 K162 H163 V164	A156-E160 PolarHBondContact O-N 3.01Å; E160-K162 PolarHBondContact O-N 2.82Å; E160-H163 PolarHBondContact O-N 3.28Å; E160-H163 VanDerWaalsContact O-N 3.08Å; E160-V164 WeakPolarHBondContact O-CG2 3.25Å; E160-V164 PolarHBondContact O-N 3.38Å
161	H	41.2	Very low	54.2	Low	120 Å²	120	92.4 Å²	92.4	56%	0.556	47%	0.473	S	S	*	.	H	α-helix	trans	-63.4	-26.3	173.8	-83.5	59.5	0	0	0	113.1	Y157 L165	Y157-H161 WeakPolarHBondContact O-CB 3.5Å; Y157-H161 PolarHBondContact O-N 3.24Å; Y157-H161 PolarHBondContact O-ND1 3.19Å; H161-L165 VanDerWaalsContact O-CB 3.25Å; H161-L165 WeakPolarHBondContact O-CB 3.39Å; H161-L165 WeakPolarHBondContact O-CD1 3.4Å; H161-L165 WeakPolarHBondContact O-CG 3.49Å; H161-L165 PolarHBondContact O-N 3.24Å
162	K	44.2	Very low	56.1	Low	153 Å²	153	90.8 Å²	90.8	67%	0.665	46%	0.463	S	S	*	.	H	α-helix	trans	-75.9	-37	171	-88.2	-177.2	171.6	-169.7	0	112.8	S158 T159 E160 D166	S158-K162 WeakPolarHBondContact O-CB 3.06Å; S158-K162 VanDerWaalsContact O-CG 3.26Å; S158-K162 WeakPolarHBondContact O-CG 3.38Å; S158-K162 PolarHBondContact O-N 3.28Å; T159-K162 CarbonylContact O-C 3.52Å; T159-K162 PolarHBondContact O-N 3.08Å; E160-K162 PolarHBondContact O-N 2.82Å; K162-D166 PolarHBondContact O-N 3.35Å
163	H	43.5	Very low	58.2	Low	127 Å²	127	86.8 Å²	86.8	59%	0.588	44%	0.443	S	S	*	.	H	α-helix	trans	-66.2	-51.8	177.9	-138.2	-88.4	0	0	0	109.8	T159 E160 L165 D166 E167	T159-H163 WeakPolarHBondContact O-CB 3.2Å; T159-H163 PolarHBondContact O-N 3.47Å; E160-H163 PolarHBondContact O-N 3.28Å; E160-H163 VanDerWaalsContact O-N 3.08Å; H163-L165 VanDerWaalsContact C-N 3.28Å; H163-L165 PolarHBondContact O-N 3.19Å; H163-D166 PolarHBondContact O-N 2.94Å; H163-E167 IonicContact CE1-OE1 2.73Å; H163-E167 PolarHBondContact CE1-OE1 3.38Å; H163-E167 VanDerWaalsContact CE1-OE1 3.29Å; H163-E167 IonicContact CG-OE1 3.9Å; H163-E167 IonicContact ND1-OE1 3.29Å; H163-E167 PolarHBondContact ND1-OE1 2.85Å; H163-E167 WeakPolarHBondContact O-CB 3.26Å; H163-E167 PolarHBondContact O-N 3.44Å
164	V	43.7	Very low	60.1	Low	93 Å²	93	89 Å²	89	56%	0.564	45%	0.451	S	S	*	.	H	α-helix	trans	-56.7	-41.6	175.4	174.2	0	0	0	0	111.4	E160 E168	E160-V164 WeakPolarHBondContact O-CG2 3.25Å; E160-V164 PolarHBondContact O-N 3.38Å; V164-E168 WeakPolarHBondContact O-CB 3.28Å; V164-E168 PolarHBondContact O-N 3.02Å
165	L	50.6	Low	62.4	Low	88 Å²	88	91.1 Å²	91.1	46%	0.461	45%	0.451	S	S	.	.	H	α-helix	trans	-71.6	-26.2	177.1	-78.3	172.2	0	0	0	114.2	H161 H163 R217	H161-L165 VanDerWaalsContact O-CB 3.25Å; H161-L165 WeakPolarHBondContact O-CB 3.39Å; H161-L165 WeakPolarHBondContact O-CD1 3.4Å; H161-L165 WeakPolarHBondContact O-CG 3.49Å; H161-L165 PolarHBondContact O-N 3.24Å; H163-L165 VanDerWaalsContact C-N 3.28Å; H163-L165 PolarHBondContact O-N 3.19Å; L165-R217 PolarHBondContact O-NH1 2.98Å; L165-R217 PolarHBondContact O-NH2 3.42Å
166	D	52.4	Low	64.8	Low	63 Å²	63	85 Å²	85	34%	0.337	42%	0.424	S	S	.	.	H	α-helix	trans	-85.9	-30.2	173.2	-102.9	16.4	0	0	0	112	K162 H163 W169 E170 K214 R217	K162-D166 PolarHBondContact O-N 3.35Å; H163-D166 PolarHBondContact O-N 2.94Å; D166-W169 WeakPolarHBondContact O-CB 3.27Å; D166-W169 PolarHBondContact O-N 3.43Å; D166-W169 VanDerWaalsContact O-N 3.1Å; D166-E170 PolarHBondContact O-N 3.35Å; D166-K214 IonicContact OD2-NZ 3.79Å; D166-K214 PolarHBondContact OD2-NZ 3.28Å; D166-R217 IonicContact OD1-NH1 3.18Å; D166-R217 PolarHBondContact OD1-NH1 3.26Å
167	E	54.1	Low	67.1	Low	119 Å²	119	85.4 Å²	85.4	56%	0.556	43%	0.425	S	S	*	.	H	α-helix	trans	-64.4	-40	169.4	-75.8	176	-155.8	0	0	112.1	H163 W169 E170	H163-E167 IonicContact CE1-OE1 2.73Å; H163-E167 PolarHBondContact CE1-OE1 3.38Å; H163-E167 VanDerWaalsContact CE1-OE1 3.29Å; H163-E167 IonicContact CG-OE1 3.9Å; H163-E167 IonicContact ND1-OE1 3.29Å; H163-E167 PolarHBondContact ND1-OE1 2.85Å; H163-E167 WeakPolarHBondContact O-CB 3.26Å; H163-E167 PolarHBondContact O-N 3.44Å; E167-W169 PolarHBondContact O-N 3.1Å; E167-E170 PolarHBondContact O-N 2.96Å
168	E	68.2	Low	69.5	Low	139 Å²	139	82.3 Å²	82.3	65%	0.65	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-4.3	172	-160.5	-172	-153.7	0	0	113.2	V164	V164-E168 WeakPolarHBondContact O-CB 3.28Å; V164-E168 PolarHBondContact O-N 3.02Å
169	W	85.3	Confident	71.8	Confident	15 Å²	15	81.2 Å²	81.2	6%	0.057	41%	0.407	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.2	-27.6	176.5	-162.7	-112.4	0	0	0	114.5	D166 E167 V171 I213 R217 F227 K228 G229 I230	D166-W169 WeakPolarHBondContact O-CB 3.27Å; D166-W169 PolarHBondContact O-N 3.43Å; D166-W169 VanDerWaalsContact O-N 3.1Å; E167-W169 PolarHBondContact O-N 3.1Å; W169-V171 PolarHBondContact O-N 2.8Å; W169-I213 HydrophobicContact CZ2-CD1 4.02Å; W169-I213 HydrophobicContact CZ2-CG1 4.49Å; W169-R217 HydrophobicContact CD2-CG 4.11Å; W169-R217 VanDerWaalsContact CD2-NE 3.27Å; W169-R217 HydrophobicContact CE3-CG 4.13Å; W169-R217 HydrophobicContact CH2-CB 4.35Å; W169-R217 HydrophobicContact CH2-CG 3.76Å; W169-R217 HydrophobicContact CZ2-CB 4.04Å; W169-R217 HydrophobicContact CZ2-CG 3.79Å; W169-R217 HydrophobicContact CZ3-CG 3.96Å; W169-F227 HydrophobicContact CH2-CB 3.53Å; W169-F227 WeakPolarHBondContact CH2-O 3.16Å; W169-F227 HydrophobicContact CZ2-CB 3.85Å; W169-K228 WeakPolarHBondContact CZ3-O 3.31Å; W169-G229 CarbonylContact O-C 3.46Å; W169-G229 VanDerWaalsContact O-CA 3.31Å; W169-G229 WeakPolarHBondContact O-CA 3.33Å; W169-I230 PolarHBondContact O-N 3.47Å
170	E	91.7	Very high	74.2	Confident	70 Å²	70	82.9 Å²	82.9	33%	0.327	41%	0.409	S	S	.	.	B	Isolated β-bridge	trans	-95.8	87.9	-178.5	-64.5	-165.8	-154	0	0	109.2	D166 E167 K214 I230 T232	D166-E170 PolarHBondContact O-N 3.35Å; E167-E170 PolarHBondContact O-N 2.96Å; E170-K214 IonicContact OE1-NZ 2.71Å; E170-K214 PolarHBondContact OE1-NZ 2.82Å; E170-I230 CarbonylContact C-O 3.58Å; E170-I230 WeakPolarHBondContact CA-O 3.42Å; E170-I230 HydrophobicContact CG-CD1 4.16Å; E170-I230 HydrophobicContact CG-CG1 4.03Å; E170-T232 HydrophobicContact CG-CG2 4.25Å; E170-T232 WeakPolarHBondContact OE2-CB 3.43Å; E170-T232 WeakPolarHBondContact OE2-CG2 3.46Å; E170-T232 PolarHBondContact OE2-OG1 3.39Å
171	V	93.1	Very high	76.8	Confident	12 Å²	12	85.1 Å²	85.1	7%	0.073	41%	0.412	C	S	.	.			trans	-74.8	124.9	-174.5	176.4	0	0	0	0	110	W169 E175 I176 L195 I230 C231 I240	W169-V171 PolarHBondContact O-N 2.8Å; V171-E175 HydrophobicContact CG1-CB 4.19Å; V171-I176 HydrophobicContact CG1-CD1 4.43Å; V171-I176 HydrophobicContact CG1-CG1 4.09Å; V171-L195 HydrophobicContact CG1-CD1 3.6Å; V171-L195 HydrophobicContact CG1-CD2 4.12Å; V171-L195 HydrophobicContact CG2-CD2 4.1Å; V171-I230 PolarHBondContact N-O 3.33Å; V171-C231 PolarHBondContact O-SG 3.14Å; V171-I240 HydrophobicContact CB-CD1 3.67Å; V171-I240 HydrophobicContact CG1-CD1 3.78Å; V171-I240 HydrophobicContact CG2-CD1 3.9Å
172	P	93.4	Very high	79	Confident	44 Å²	44	82.9 Å²	82.9	29%	0.286	41%	0.407	S	S	.	.			trans	-58.6	140.2	172.2	-22.5	33.3	0	0	0	111.3	E174 E175	P172-E174 VanDerWaalsContact CB-OE2 3.32Å; P172-E174 WeakPolarHBondContact CB-OE2 3.21Å; P172-E174 PolarHBondContact O-N 3.31Å; P172-E175 HydrophobicContact CB-CG 4.31Å; P172-E175 HydrophobicContact CG-CG 4.41Å; P172-E175 PolarHBondContact O-N 3.11Å; P172-E175 VanDerWaalsContact O-N 3.08Å
173	F	93.6	Very high	80.8	Confident	37 Å²	37	76.7 Å²	76.7	16%	0.162	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-62.8	-27.5	-178.6	-174.7	-114.3	0	0	0	111.9	T45 E175 I176 L179 Q233 C236	T45-F173 HydrophobicContact CG2-CD1 4.47Å; T45-F173 HydrophobicContact CG2-CE1 3.8Å; F173-E175 PolarHBondContact O-N 2.94Å; F173-I176 HydrophobicContact CD2-CD1 4.19Å; F173-I176 WeakPolarHBondContact O-CB 3.24Å; F173-I176 PolarHBondContact O-N 2.92Å; F173-I176 VanDerWaalsContact O-N 3.08Å; F173-L179 HydrophobicContact CE2-CD1 3.73Å; F173-L179 HydrophobicContact CZ-CD1 3.71Å; F173-Q233 VanDerWaalsContact N-OE1 3.14Å; F173-C236 HydrophobicContact CB-CB 4.21Å; F173-C236 HydrophobicContact CD1-CB 4.16Å; F173-C236 HydrophobicContact CD2-CB 3.54Å; F173-C236 HydrophobicContact CE1-CB 4.44Å; F173-C236 VanDerWaalsContact CE1-SG 3.59Å; F173-C236 HydrophobicContact CE2-CB 3.88Å; F173-C236 HydrophobicContact CG-CB 3.7Å; F173-C236 HydrophobicContact CZ-CB 4.32Å
174	E	93.6	Very high	82.3	Confident	144 Å²	144	75 Å²	75	67%	0.673	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-61.2	-26.2	176.3	-61.8	73.1	-159.5	0	0	113.5	P172 I176 Q233	P172-E174 VanDerWaalsContact CB-OE2 3.32Å; P172-E174 WeakPolarHBondContact CB-OE2 3.21Å; P172-E174 PolarHBondContact O-N 3.31Å; E174-I176 VanDerWaalsContact C-N 3.31Å; E174-Q233 PolarHBondContact OE2-NE2 3.1Å; E174-Q233 PolarHBondContact OE2-OE1 3.35Å
175	E	94.6	Very high	83.2	Confident	82 Å²	82	72.8 Å²	72.8	38%	0.383	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-83	-9.4	177.2	-62.8	-175.1	-161.8	0	0	113	V171 P172 F173 S177 L195 H196	V171-E175 HydrophobicContact CG1-CB 4.19Å; P172-E175 HydrophobicContact CB-CG 4.31Å; P172-E175 HydrophobicContact CG-CG 4.41Å; P172-E175 PolarHBondContact O-N 3.11Å; P172-E175 VanDerWaalsContact O-N 3.08Å; F173-E175 PolarHBondContact O-N 2.94Å; E175-S177 PolarHBondContact O-N 2.92Å; E175-L195 HydrophobicContact CB-CD1 3.81Å; E175-H196 IonicContact OE2-CD2 3.6Å; E175-H196 IonicContact OE2-CE1 3.78Å; E175-H196 IonicContact OE2-NE2 3.7Å; E175-H196 PolarHBondContact OE2-NE2 2.94Å
176	I	95.8	Very high	83.5	Confident	11 Å²	11	73.8 Å²	73.8	6%	0.056	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	95.1	-178.8	-47.8	179.6	0	0	0	109.2	V171 F173 E174 L179 V202 C231 I240	V171-I176 HydrophobicContact CG1-CD1 4.43Å; V171-I176 HydrophobicContact CG1-CG1 4.09Å; F173-I176 HydrophobicContact CD2-CD1 4.19Å; F173-I176 WeakPolarHBondContact O-CB 3.24Å; F173-I176 PolarHBondContact O-N 2.92Å; F173-I176 VanDerWaalsContact O-N 3.08Å; E174-I176 VanDerWaalsContact C-N 3.31Å; I176-L179 HydrophobicContact CG2-CD1 4.14Å; I176-L179 HydrophobicContact CG2-CD2 3.8Å; I176-L179 HydrophobicContact CG2-CG 4.02Å; I176-V202 HydrophobicContact CG2-CG2 3.86Å; I176-C231 HydrophobicContact CD1-CB 4.42Å; I176-I240 HydrophobicContact CD1-CD1 3.6Å; I176-I240 HydrophobicContact CD1-CG1 4.26Å; I176-I240 HydrophobicContact CG1-CD1 4.18Å
177	S	95.6	Very high	83.9	Confident	54 Å²	54	74 Å²	74	38%	0.378	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	169.8	-176.4	54	0	0	0	0	112.9	E175 L179 G193 K194	E175-S177 PolarHBondContact O-N 2.92Å; S177-L179 VanDerWaalsContact C-N 3.3Å; S177-L179 PolarHBondContact O-N 3.18Å; S177-L179 VanDerWaalsContact O-N 3.16Å; S177-G193 CarbonylContact O-C 3.34Å; S177-G193 VanDerWaalsContact O-CA 3.28Å; S177-G193 WeakPolarHBondContact O-CA 3.41Å; S177-K194 PolarHBondContact N-O 3.41Å; S177-K194 PolarHBondContact O-N 3.29Å; S177-K194 WeakPolarHBondContact OG-CB 3.43Å; S177-K194 PolarHBondContact OG-O 2.81Å; S177-K194 VanDerWaalsContact OG-O 3.04Å
178	D	94.5	Very high	84.8	Confident	86 Å²	86	69.6 Å²	69.6	46%	0.46	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	51	38.5	172.7	-63.4	-4.2	0	0	0	115.8	Q180 K194	D178-Q180 PolarHBondContact O-N 2.73Å; D178-K194 HydrophobicContact CB-CD 4.25Å; D178-K194 HydrophobicContact CB-CG 4.4Å; D178-K194 WeakPolarHBondContact OD2-CD 3.43Å; D178-K194 VanDerWaalsContact OD2-CE 3.29Å; D178-K194 WeakPolarHBondContact OD2-CE 3.48Å; D178-K194 IonicContact OD2-NZ 2.67Å; D178-K194 PolarHBondContact OD2-NZ 3.18Å
179	L	95.2	Very high	85.7	Confident	48 Å²	48	64.1 Å²	64.1	25%	0.251	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	104.3	-178.2	-77.6	169.8	0	0	0	113	F173 I176 S177 F191 L192 V202	F173-L179 HydrophobicContact CE2-CD1 3.73Å; F173-L179 HydrophobicContact CZ-CD1 3.71Å; I176-L179 HydrophobicContact CG2-CD1 4.14Å; I176-L179 HydrophobicContact CG2-CD2 3.8Å; I176-L179 HydrophobicContact CG2-CG 4.02Å; S177-L179 VanDerWaalsContact C-N 3.3Å; S177-L179 PolarHBondContact O-N 3.18Å; S177-L179 VanDerWaalsContact O-N 3.16Å; L179-F191 HydrophobicContact CD2-CB 3.8Å; L179-F191 HydrophobicContact CD2-CG 4.45Å; L179-L192 CarbonylContact C-O 3.6Å; L179-L192 VanDerWaalsContact CA-O 3.32Å; L179-L192 WeakPolarHBondContact CA-O 3.46Å; L179-V202 HydrophobicContact CD2-CB 4.06Å; L179-V202 HydrophobicContact CD2-CG1 4.28Å; L179-V202 HydrophobicContact CD2-CG2 4Å
180	Q	94.8	Very high	86	Confident	122 Å²	122	65.6 Å²	65.6	57%	0.57	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.7	133.8	176	-64.8	178.3	13.2	0	0	110.3	D178 V182 F191 L192	D178-Q180 PolarHBondContact O-N 2.73Å; Q180-V182 PolarHBondContact O-N 2.71Å; Q180-F191 CarbonylContact O-C 3.57Å; Q180-F191 WeakPolarHBondContact O-CA 3.45Å; Q180-F191 WeakPolarHBondContact O-CB 3.42Å; Q180-L192 PolarHBondContact N-O 3.46Å; Q180-L192 PolarHBondContact O-N 3.4Å
181	W	93.3	Very high	86.2	Confident	161 Å²	161	64 Å²	64	61%	0.61	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.4	125.7	177.7	178	78.9	0	0	0	111.2	G183 F191	W181-G183 VanDerWaalsContact CZ2-CA 3.49Å; W181-G183 VanDerWaalsContact NE1-C 3.27Å; W181-G183 PolarHBondContact NE1-O 3.04Å; W181-F191 HydrophobicContact CB-CD1 4.01Å; W181-F191 HydrophobicContact CB-CE1 3.94Å; W181-F191 HydrophobicContact CG-CE1 4.43Å
182	V	88	Confident	86.3	Confident	73 Å²	73	64.6 Å²	64.6	44%	0.442	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	-31.6	179.8	174.1	0	0	0	0	111.5	Q180 V190 L192 Y243	Q180-V182 PolarHBondContact O-N 2.71Å; V182-V190 PolarHBondContact N-O 2.97Å; V182-L192 HydrophobicContact CG2-CB 3.56Å; V182-Y243 HydrophobicContact CG2-CE2 4.41Å
183	G	82.5	Confident	86.4	Confident	22 Å²	22	62.5 Å²	62.5	23%	0.227	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.1	174.4	177.6	0	0	0	0	0	114.2	W181 V190	W181-G183 VanDerWaalsContact CZ2-CA 3.49Å; W181-G183 VanDerWaalsContact NE1-C 3.27Å; W181-G183 PolarHBondContact NE1-O 3.04Å; G183-V190 PolarHBondContact N-O 2.83Å; G183-V190 PolarHBondContact O-N 3.21Å
184	S	74.4	Confident	86.6	Confident	92 Å²	92	64.4 Å²	64.4	64%	0.643	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.9	150.5	167.6	58.8	0	0	0	0	110.3	G188	S184-G188 WeakPolarHBondContact CA-O 3.44Å
185	G	63.2	Low	86.7	Confident	47 Å²	47	57.8 Å²	57.8	49%	0.485	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	-171.8	178.8	0	0	0	0	0	111.4	Q187 G188	G185-Q187 PolarHBondContact O-N 2.73Å; G185-G188 PolarHBondContact N-O 2.68Å; G185-G188 PolarHBondContact O-N 3.29Å; G185-G188 VanDerWaalsContact O-N 3.08Å
186	A	56.5	Low	86.5	Confident	109 Å²	109	61.1 Å²	61.1	90%	0.901	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-21	-177.5	0	0	0	0	0	114.2
187	Q	61.1	Low	86.2	Confident	67 Å²	67	63.9 Å²	63.9	31%	0.313	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	13.1	-177.3	-45.2	127.7	4.1	0	0	113.7	G185 K203 N292 D305	G185-Q187 PolarHBondContact O-N 2.73Å; Q187-K203 VanDerWaalsContact CB-NZ 3.26Å; Q187-K203 VanDerWaalsContact O-CE 3.25Å; Q187-K203 WeakPolarHBondContact O-CE 3.33Å; Q187-K203 VanDerWaalsContact OE1-NZ 3.17Å; Q187-N292 PolarHBondContact NE2-OD1 3.3Å; Q187-D305 WeakPolarHBondContact CG-OD2 3.41Å; Q187-D305 PolarHBondContact NE2-OD2 2.98Å
188	G	72.4	Confident	86.2	Confident	26 Å²	26	66.7 Å²	66.7	27%	0.268	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	116.4	-167.2	179	0	0	0	0	0	114.8	S184 G185	S184-G188 WeakPolarHBondContact CA-O 3.44Å; G185-G188 PolarHBondContact N-O 2.68Å; G185-G188 PolarHBondContact O-N 3.29Å; G185-G188 VanDerWaalsContact O-N 3.08Å
189	A	87.8	Confident	86.3	Confident	25 Å²	25	67.3 Å²	67.3	21%	0.207	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	139.9	177.9	0	0	0	0	0	110.6	F191 K204	A189-F191 HydrophobicContact CB-CE2 3.83Å; A189-F191 HydrophobicContact CB-CZ 4.27Å; A189-K204 PolarHBondContact O-N 3.23Å
190	V	91.8	Very high	86.3	Confident	46 Å²	46	65 Å²	65	28%	0.279	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	131.2	178.9	-175.5	0	0	0	0	109.4	V182 G183 A201 V202 K203	V182-V190 PolarHBondContact N-O 2.97Å; G183-V190 PolarHBondContact N-O 2.83Å; G183-V190 PolarHBondContact O-N 3.21Å; V190-A201 HydrophobicContact CG1-CB 4.34Å; V190-V202 WeakPolarHBondContact CA-O 3.39Å; V190-K203 HydrophobicContact CG2-CB 4.26Å; V190-K203 HydrophobicContact CG2-CG 4.27Å
191	F	94.3	Very high	86.4	Confident	37 Å²	37	59.7 Å²	59.7	16%	0.162	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	145.7	177.8	-58.1	-99.7	0	0	0	109.3	L179 Q180 W181 A189 A201 V202 K204	L179-F191 HydrophobicContact CD2-CB 3.8Å; L179-F191 HydrophobicContact CD2-CG 4.45Å; Q180-F191 CarbonylContact O-C 3.57Å; Q180-F191 WeakPolarHBondContact O-CA 3.45Å; Q180-F191 WeakPolarHBondContact O-CB 3.42Å; W181-F191 HydrophobicContact CB-CD1 4.01Å; W181-F191 HydrophobicContact CB-CE1 3.94Å; W181-F191 HydrophobicContact CG-CE1 4.43Å; A189-F191 HydrophobicContact CB-CE2 3.83Å; A189-F191 HydrophobicContact CB-CZ 4.27Å; F191-A201 CarbonylContact O-C 3.53Å; F191-A201 WeakPolarHBondContact O-CA 3.27Å; F191-V202 HydrophobicContact CB-CB 4.39Å; F191-V202 PolarHBondContact N-O 3.07Å; F191-V202 PolarHBondContact O-N 2.81Å; F191-K204 HydrophobicContact CE2-CB 4.13Å
192	L	96	Very high	86.4	Confident	23 Å²	23	52.2 Å²	52.2	12%	0.12	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	140.7	155.4	170.2	61.9	0	0	0	106.9	L179 Q180 V182 E199 Y243	L179-L192 CarbonylContact C-O 3.6Å; L179-L192 VanDerWaalsContact CA-O 3.32Å; L179-L192 WeakPolarHBondContact CA-O 3.46Å; Q180-L192 PolarHBondContact N-O 3.46Å; Q180-L192 PolarHBondContact O-N 3.4Å; V182-L192 HydrophobicContact CG2-CB 3.56Å; L192-E199 HydrophobicContact CD1-CB 3.99Å; L192-E199 HydrophobicContact CD1-CG 4.25Å; L192-Y243 HydrophobicContact CB-CE2 4.26Å; L192-Y243 HydrophobicContact CD1-CD1 3.79Å; L192-Y243 HydrophobicContact CD1-CD2 3.88Å; L192-Y243 HydrophobicContact CD1-CE1 3.97Å; L192-Y243 HydrophobicContact CD1-CE2 4.07Å; L192-Y243 HydrophobicContact CD1-CG 3.75Å; L192-Y243 HydrophobicContact CD2-CE1 4.35Å
193	G	96.3	Very high	86.7	Confident	1 Å²	1	49.8 Å²	49.8	1%	0.01	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	-174.5	168.5	0	0	0	0	0	110.4	S177 E199 V200	S177-G193 CarbonylContact O-C 3.34Å; S177-G193 VanDerWaalsContact O-CA 3.28Å; S177-G193 WeakPolarHBondContact O-CA 3.41Å; G193-E199 WeakPolarHBondContact O-CA 3.37Å; G193-V200 PolarHBondContact N-O 3.47Å; G193-V200 WeakPolarHBondContact O-CG2 3.5Å; G193-V200 PolarHBondContact O-N 2.92Å
194	K	96.6	Very high	87	Confident	76 Å²	76	52.5 Å²	52.5	33%	0.33	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	131.3	174.2	-66.6	173.8	-169.1	160	0	110.6	S177 D178 Q198	S177-K194 PolarHBondContact N-O 3.41Å; S177-K194 PolarHBondContact O-N 3.29Å; S177-K194 WeakPolarHBondContact OG-CB 3.43Å; S177-K194 PolarHBondContact OG-O 2.81Å; S177-K194 VanDerWaalsContact OG-O 3.04Å; D178-K194 HydrophobicContact CB-CD 4.25Å; D178-K194 HydrophobicContact CB-CG 4.4Å; D178-K194 WeakPolarHBondContact OD2-CD 3.43Å; D178-K194 VanDerWaalsContact OD2-CE 3.29Å; D178-K194 WeakPolarHBondContact OD2-CE 3.48Å; D178-K194 IonicContact OD2-NZ 2.67Å; D178-K194 PolarHBondContact OD2-NZ 3.18Å; K194-Q198 VanDerWaalsContact CA-O 3.32Å; K194-Q198 WeakPolarHBondContact CA-O 3.4Å
195	L	95.1	Very high	87.7	Confident	6 Å²	6	48.6 Å²	48.6	3%	0.031	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	123.9	171	177.9	60.9	0	0	0	108.1	V171 E175 G197 Q198 V200 I240	V171-L195 HydrophobicContact CG1-CD1 3.6Å; V171-L195 HydrophobicContact CG1-CD2 4.12Å; V171-L195 HydrophobicContact CG2-CD2 4.1Å; E175-L195 HydrophobicContact CB-CD1 3.81Å; L195-G197 PolarHBondContact O-N 3.42Å; L195-G197 VanDerWaalsContact O-N 3.11Å; L195-Q198 PolarHBondContact N-O 3.11Å; L195-Q198 PolarHBondContact O-N 3.23Å; L195-V200 HydrophobicContact CB-CG1 3.92Å; L195-V200 HydrophobicContact CB-CG2 4.07Å; L195-I240 HydrophobicContact CD2-CD1 4.17Å; L195-I240 HydrophobicContact CD2-CG2 4.14Å
196	H	91.8	Very high	88.7	Confident	151 Å²	151	56.6 Å²	56.6	70%	0.699	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	34	-175.5	-47.2	132.7	0	0	0	113.8	E175 Q198	E175-H196 IonicContact OE2-CD2 3.6Å; E175-H196 IonicContact OE2-CE1 3.78Å; E175-H196 IonicContact OE2-NE2 3.7Å; E175-H196 PolarHBondContact OE2-NE2 2.94Å; H196-Q198 VanDerWaalsContact C-N 3.31Å; H196-Q198 PolarHBondContact O-N 2.66Å
197	G	89.9	Confident	90	Very high	70 Å²	70	55.8 Å²	55.8	72%	0.722	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-6.6	-178	0	0	0	0	0	115.9	L195	L195-G197 PolarHBondContact O-N 3.42Å; L195-G197 VanDerWaalsContact O-N 3.11Å
198	Q	94.1	Very high	91.2	Very high	112 Å²	112	56.5 Å²	56.5	52%	0.523	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	140	174.7	-169.2	-179.8	8.6	0	0	111.3	K194 L195 H196	K194-Q198 VanDerWaalsContact CA-O 3.32Å; K194-Q198 WeakPolarHBondContact CA-O 3.4Å; L195-Q198 PolarHBondContact N-O 3.11Å; L195-Q198 PolarHBondContact O-N 3.23Å; H196-Q198 VanDerWaalsContact C-N 3.31Å; H196-Q198 PolarHBondContact O-N 2.66Å
199	E	96.7	Very high	91.8	Very high	100 Å²	100	64.2 Å²	64.2	47%	0.467	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	136.6	172.1	-65.9	-172.7	157.9	0	0	112.5	L192 G193 Y243	L192-E199 HydrophobicContact CD1-CB 3.99Å; L192-E199 HydrophobicContact CD1-CG 4.25Å; G193-E199 WeakPolarHBondContact O-CA 3.37Å; E199-Y243 HydrophobicContact CB-CD1 4.43Å
200	V	96.4	Very high	91.6	Very high	0 Å²	0	66.7 Å²	66.7	0%	0	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	146.5	-176.8	-66	0	0	0	0	112	G193 L195 V202 K228 I240 M241	G193-V200 PolarHBondContact N-O 3.47Å; G193-V200 WeakPolarHBondContact O-CG2 3.5Å; G193-V200 PolarHBondContact O-N 2.92Å; L195-V200 HydrophobicContact CB-CG1 3.92Å; L195-V200 HydrophobicContact CB-CG2 4.07Å; V200-V202 HydrophobicContact CG2-CG2 3.83Å; V200-K228 HydrophobicContact CB-CD 4.44Å; V200-K228 HydrophobicContact CG1-CD 3.4Å; V200-I240 HydrophobicContact CB-CG2 3.75Å; V200-I240 HydrophobicContact CG1-CG2 3.96Å; V200-I240 HydrophobicContact CG2-CG2 3.97Å; V200-M241 WeakPolarHBondContact CA-O 3.41Å; V200-M241 WeakPolarHBondContact CB-O 3.35Å
201	A	95.7	Very high	91.3	Very high	9 Å²	9	64.7 Å²	64.7	7%	0.074	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	119.5	166.7	0	0	0	0	0	109.5	V190 F191 M241 Y243	V190-A201 HydrophobicContact CG1-CB 4.34Å; F191-A201 CarbonylContact O-C 3.53Å; F191-A201 WeakPolarHBondContact O-CA 3.27Å; A201-M241 HydrophobicContact CB-CB 4.3Å; A201-M241 HydrophobicContact CB-CE 4.34Å; A201-M241 PolarHBondContact N-O 2.71Å; A201-M241 PolarHBondContact O-N 3.41Å; A201-Y243 HydrophobicContact CB-CD2 4.29Å
202	V	94.8	Very high	90.8	Very high	4 Å²	4	67.7 Å²	67.7	2%	0.024	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	103.4	-178.6	-175.8	0	0	0	0	108.7	I176 L179 V190 F191 V200 C238	I176-V202 HydrophobicContact CG2-CG2 3.86Å; L179-V202 HydrophobicContact CD2-CB 4.06Å; L179-V202 HydrophobicContact CD2-CG1 4.28Å; L179-V202 HydrophobicContact CD2-CG2 4Å; V190-V202 WeakPolarHBondContact CA-O 3.39Å; F191-V202 HydrophobicContact CB-CB 4.39Å; F191-V202 PolarHBondContact N-O 3.07Å; F191-V202 PolarHBondContact O-N 2.81Å; V200-V202 HydrophobicContact CG2-CG2 3.83Å; V202-C238 HydrophobicContact CG1-CB 3.75Å
203	K	92.7	Very high	90.2	Very high	22 Å²	22	67.1 Å²	67.1	10%	0.096	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	107.7	178.7	177.7	166.2	173.3	167.1	0	109.3	Q187 V190 V205 C238 I239 M241 D305	Q187-K203 VanDerWaalsContact CB-NZ 3.26Å; Q187-K203 VanDerWaalsContact O-CE 3.25Å; Q187-K203 WeakPolarHBondContact O-CE 3.33Å; Q187-K203 VanDerWaalsContact OE1-NZ 3.17Å; V190-K203 HydrophobicContact CG2-CB 4.26Å; V190-K203 HydrophobicContact CG2-CG 4.27Å; K203-V205 PolarHBondContact O-N 2.88Å; K203-C238 CarbonylContact O-C 2.86Å; K203-C238 WeakPolarHBondContact O-CA 3.48Å; K203-C238 VanDerWaalsContact O-CB 3.31Å; K203-C238 WeakPolarHBondContact O-CB 3.2Å; K203-I239 PolarHBondContact N-O 2.97Å; K203-I239 PolarHBondContact O-N 2.85Å; K203-M241 HydrophobicContact CB-CE 3.68Å; K203-M241 HydrophobicContact CD-CE 4.28Å; K203-D305 IonicContact NZ-OD1 3.83Å; K203-D305 PolarHBondContact NZ-OD1 2.95Å
204	K	90.5	Very high	89.4	Confident	79 Å²	79	70.6 Å²	70.6	34%	0.343	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	125.5	175.8	-176.8	167.3	-174.5	165.2	0	109.8	A189 F191	A189-K204 PolarHBondContact O-N 3.23Å; F191-K204 HydrophobicContact CE2-CB 4.13Å
205	V	87.7	Confident	88.5	Confident	10 Å²	10	70.6 Å²	70.6	6%	0.061	35%	0.345	C	S	.	.			trans	-106.5	165.9	177.9	-60.1	0	0	0	0	110.4	K203 E210 T211 Y237 I239	K203-V205 PolarHBondContact O-N 2.88Å; V205-E210 HydrophobicContact CB-CB 3.65Å; V205-E210 HydrophobicContact CB-CG 4.49Å; V205-E210 WeakPolarHBondContact CB-OE2 3.21Å; V205-E210 HydrophobicContact CG1-CB 3.99Å; V205-E210 HydrophobicContact CG2-CB 3.89Å; V205-T211 HydrophobicContact CG2-CG2 3.53Å; V205-Y237 WeakPolarHBondContact CG2-O 3.49Å; V205-Y237 PolarHBondContact N-O 2.82Å; V205-I239 HydrophobicContact CG1-CD1 4.02Å; V205-I239 HydrophobicContact CG1-CG1 4.22Å
206	R	84.4	Confident	87.8	Confident	215 Å²	215	70.5 Å²	70.5	81%	0.811	34%	0.344	S	S	*	.	S	Bend	trans	-87.6	-41.6	-175.6	-65	-178.7	-179.8	-178.1	0.1	112.6	E210	R206-E210 PolarHBondContact N-OE2 3.33Å
207	N	83.6	Confident	87.4	Confident	92 Å²	92	66.1 Å²	66.1	49%	0.492	32%	0.321	S	S	.	.	S	Bend	trans	-121.9	149	-175.7	-57.8	-88.2	0	0	0	110.9	K209 E210	N207-K209 PolarHBondContact O-N 2.96Å; N207-K209 VanDerWaalsContact O-N 3.09Å; N207-E210 WeakPolarHBondContact CB-OE1 3.29Å; N207-E210 PolarHBondContact N-OE1 3.36Å; N207-E210 PolarHBondContact ND2-OE1 3.44Å; N207-E210 WeakPolarHBondContact O-CB 3.4Å; N207-E210 PolarHBondContact O-N 2.78Å
208	I	87.3	Confident	87.1	Confident	83 Å²	83	71.4 Å²	71.4	43%	0.426	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-56.6	-25.2	171.2	-165.4	169.7	0	0	0	113.1	E210 T211 T232 Y237	I208-E210 PolarHBondContact O-N 3.38Å; I208-T211 PolarHBondContact O-N 3.42Å; I208-T211 VanDerWaalsContact O-N 3.09Å; I208-T211 PolarHBondContact O-OG1 2.96Å; I208-T232 HydrophobicContact CD1-CG2 4.39Å; I208-T232 HydrophobicContact CG1-CG2 4.41Å; I208-Y237 HydrophobicContact CB-CD1 4.03Å; I208-Y237 HydrophobicContact CB-CE1 3.82Å; I208-Y237 HydrophobicContact CD1-CE1 4.22Å; I208-Y237 HydrophobicContact CG1-CD1 4.32Å; I208-Y237 HydrophobicContact CG1-CE1 4.22Å
209	K	85.4	Confident	86.7	Confident	187 Å²	187	67 Å²	67	81%	0.813	30%	0.304	S	S	*	.	G	3₁₀ helix	trans	-65.2	-19.4	173.5	-65.9	177.3	-178.3	170.5	0	113.5	N207	N207-K209 PolarHBondContact O-N 2.96Å; N207-K209 VanDerWaalsContact O-N 3.09Å
210	E	83.1	Confident	86.5	Confident	78 Å²	78	70.3 Å²	70.3	36%	0.364	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-83.4	-14.5	174.8	-68.8	153.6	-122.6	0	0	112.3	V205 R206 N207 I208	V205-E210 HydrophobicContact CB-CB 3.65Å; V205-E210 HydrophobicContact CB-CG 4.49Å; V205-E210 WeakPolarHBondContact CB-OE2 3.21Å; V205-E210 HydrophobicContact CG1-CB 3.99Å; V205-E210 HydrophobicContact CG2-CB 3.89Å; R206-E210 PolarHBondContact N-OE2 3.33Å; N207-E210 WeakPolarHBondContact CB-OE1 3.29Å; N207-E210 PolarHBondContact N-OE1 3.36Å; N207-E210 PolarHBondContact ND2-OE1 3.44Å; N207-E210 WeakPolarHBondContact O-CB 3.4Å; N207-E210 PolarHBondContact O-N 2.78Å; I208-E210 PolarHBondContact O-N 3.38Å
211	T	84.2	Confident	86.5	Confident	4 Å²	4	72.4 Å²	72.4	3%	0.025	33%	0.327	C	S	.	.	S	Bend	trans	-86.8	-2.4	173.8	66.4	0	0	0	0	113.6	V205 I208 I213 I230	V205-T211 HydrophobicContact CG2-CG2 3.53Å; I208-T211 PolarHBondContact O-N 3.42Å; I208-T211 VanDerWaalsContact O-N 3.09Å; I208-T211 PolarHBondContact O-OG1 2.96Å; T211-I213 PolarHBondContact O-N 2.82Å; T211-I230 WeakPolarHBondContact O-CD1 3.48Å
212	D	83.9	Confident	86.5	Confident	99 Å²	99	76.3 Å²	76.3	53%	0.529	35%	0.352	S	S	.	.			trans	-76.7	69.6	176.1	-172.2	13.3	0	0	0	112.8	K214 H215	D212-K214 VanDerWaalsContact C-N 3.34Å; D212-K214 PolarHBondContact OD1-N 2.89Å; D212-H215 PolarHBondContact O-CE1 2.9Å; D212-H215 PolarHBondContact O-ND1 3.24Å
213	I	83.6	Confident	86.7	Confident	12 Å²	12	77.6 Å²	77.6	6%	0.062	36%	0.358	C	S	.	.			trans	-95.6	20.2	172.2	61.2	163.1	0	0	0	112	W169 T211 H215 L216 R217 F227 I230 I239	W169-I213 HydrophobicContact CZ2-CD1 4.02Å; W169-I213 HydrophobicContact CZ2-CG1 4.49Å; T211-I213 PolarHBondContact O-N 2.82Å; I213-H215 PolarHBondContact O-N 3.15Å; I213-H215 VanDerWaalsContact O-N 3.11Å; I213-L216 HydrophobicContact CB-CB 4.34Å; I213-L216 HydrophobicContact CB-CD1 4.03Å; I213-L216 HydrophobicContact CB-CG 4.39Å; I213-L216 HydrophobicContact CG2-CD1 3.96Å; I213-L216 WeakPolarHBondContact O-CA 3.32Å; I213-L216 WeakPolarHBondContact O-CB 3.48Å; I213-L216 PolarHBondContact O-N 3.47Å; I213-R217 PolarHBondContact O-N 2.91Å; I213-F227 HydrophobicContact CD1-CB 4.22Å; I213-F227 HydrophobicContact CD1-CD1 3.42Å; I213-F227 VanDerWaalsContact CD1-CD1 3.42Å; I213-F227 HydrophobicContact CD1-CE1 3.82Å; I213-F227 HydrophobicContact CD1-CG 3.82Å; I213-I230 HydrophobicContact CD1-CG2 3.8Å; I213-I230 HydrophobicContact CG1-CG2 3.78Å; I213-I239 HydrophobicContact CD1-CG2 3.7Å; I213-I239 HydrophobicContact CG2-CD1 4.04Å
214	K	79.6	Confident	86.8	Confident	74 Å²	74	76.7 Å²	76.7	32%	0.322	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-25.2	-176.4	-66.1	-166	177.6	-169.6	0	112.7	D166 E170 D212	D166-K214 IonicContact OD2-NZ 3.79Å; D166-K214 PolarHBondContact OD2-NZ 3.28Å; E170-K214 IonicContact OE1-NZ 2.71Å; E170-K214 PolarHBondContact OE1-NZ 2.82Å; D212-K214 VanDerWaalsContact C-N 3.34Å; D212-K214 PolarHBondContact OD1-N 2.89Å
215	H	77.8	Confident	87	Confident	76 Å²	76	73 Å²	73	35%	0.352	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	-31.4	171.3	64.8	-78.9	0	0	0	113.6	D212 I213	D212-H215 PolarHBondContact O-CE1 2.9Å; D212-H215 PolarHBondContact O-ND1 3.24Å; I213-H215 PolarHBondContact O-N 3.15Å; I213-H215 VanDerWaalsContact O-N 3.11Å
216	L	81.6	Confident	87.3	Confident	3 Å²	3	75.9 Å²	75.9	2%	0.016	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-23.2	179.8	-54	177.4	0	0	0	113.5	I213 K218 L219 F227 I283 F306	I213-L216 HydrophobicContact CB-CB 4.34Å; I213-L216 HydrophobicContact CB-CD1 4.03Å; I213-L216 HydrophobicContact CB-CG 4.39Å; I213-L216 HydrophobicContact CG2-CD1 3.96Å; I213-L216 WeakPolarHBondContact O-CA 3.32Å; I213-L216 WeakPolarHBondContact O-CB 3.48Å; I213-L216 PolarHBondContact O-N 3.47Å; L216-K218 PolarHBondContact O-N 3.17Å; L216-L219 HydrophobicContact CB-CD1 4.11Å; L216-L219 HydrophobicContact CD2-CD1 3.7Å; L216-L219 WeakPolarHBondContact O-CB 3.45Å; L216-L219 VanDerWaalsContact O-CG 3.31Å; L216-L219 WeakPolarHBondContact O-CG 3.15Å; L216-L219 PolarHBondContact O-N 3.05Å; L216-F227 HydrophobicContact CB-CD2 4.33Å; L216-F227 HydrophobicContact CB-CE2 3.91Å; L216-F227 HydrophobicContact CD1-CE2 4.03Å; L216-F227 HydrophobicContact CD1-CZ 3.93Å; L216-I283 HydrophobicContact CD2-CD1 4.19Å; L216-F306 HydrophobicContact CD1-CB 3.36Å; L216-F306 HydrophobicContact CD1-CG 4.04Å; L216-F306 HydrophobicContact CD2-CB 4.17Å; L216-F306 HydrophobicContact CD2-CD1 4.44Å; L216-F306 HydrophobicContact CD2-CG 4.35Å; L216-F306 HydrophobicContact CG-CB 4.43Å
217	R	82.3	Confident	87.7	Confident	60 Å²	60	66.9 Å²	66.9	23%	0.226	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-23	-177.3	-175	174.6	-175.9	-157.9	-0.9	114.9	L165 D166 W169 I213	L165-R217 PolarHBondContact O-NH1 2.98Å; L165-R217 PolarHBondContact O-NH2 3.42Å; D166-R217 IonicContact OD1-NH1 3.18Å; D166-R217 PolarHBondContact OD1-NH1 3.26Å; W169-R217 HydrophobicContact CD2-CG 4.11Å; W169-R217 VanDerWaalsContact CD2-NE 3.27Å; W169-R217 HydrophobicContact CE3-CG 4.13Å; W169-R217 HydrophobicContact CH2-CB 4.35Å; W169-R217 HydrophobicContact CH2-CG 3.76Å; W169-R217 HydrophobicContact CZ2-CB 4.04Å; W169-R217 HydrophobicContact CZ2-CG 3.79Å; W169-R217 HydrophobicContact CZ3-CG 3.96Å; I213-R217 PolarHBondContact O-N 2.91Å
218	K	83.6	Confident	88.1	Confident	180 Å²	180	65.2 Å²	65.2	78%	0.783	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-11.2	-179.6	-65.1	173.8	-174.3	166.2	0	114	L216 K220	L216-K218 PolarHBondContact O-N 3.17Å; K218-K220 PolarHBondContact O-N 3.16Å
219	L	86.9	Confident	88.3	Confident	19 Å²	19	61.3 Å²	61.3	10%	0.099	29%	0.291	C	S	.	.			trans	-75.4	117.9	-178.3	-56.2	172.8	0	0	0	109.6	L216 Y277 L278 H281 I283	L216-L219 HydrophobicContact CB-CD1 4.11Å; L216-L219 HydrophobicContact CD2-CD1 3.7Å; L216-L219 WeakPolarHBondContact O-CB 3.45Å; L216-L219 VanDerWaalsContact O-CG 3.31Å; L216-L219 WeakPolarHBondContact O-CG 3.15Å; L216-L219 PolarHBondContact O-N 3.05Å; L219-Y277 HydrophobicContact CB-CE1 4.13Å; L219-Y277 HydrophobicContact CD2-CE1 3.82Å; L219-L278 HydrophobicContact CD1-CD2 3.91Å; L219-H281 HydrophobicContact CD2-CB 4.27Å; L219-I283 HydrophobicContact CD1-CD1 3.66Å; L219-I283 HydrophobicContact CD2-CD1 3.76Å; L219-I283 HydrophobicContact CG-CD1 4.23Å
220	K	91.4	Very high	88.7	Confident	171 Å²	171	52.5 Å²	52.5	74%	0.743	25%	0.253	S	S	*	.			trans	-135.8	106.4	179.2	-64.7	-169.2	177.9	-170.6	0	109.5	K218 Y277	K218-K220 PolarHBondContact O-N 3.16Å; K220-Y277 PolarHBondContact N-OH 3.17Å; K220-Y277 WeakPolarHBondContact O-CE2 3.39Å; K220-Y277 PolarHBondContact O-OH 2.83Å
221	H	96	Very high	89.2	Confident	44 Å²	44	48.8 Å²	48.8	20%	0.204	24%	0.236	C	C	.	.			trans	-151.6	140	179.6	-176.2	-87	0	0	0	108.3	N223 I224 G274 Y277	H221-N223 PolarHBondContact CE1-OD1 3.1Å; H221-N223 PolarHBondContact ND1-N 2.91Å; H221-N223 VanDerWaalsContact ND1-N 3.17Å; H221-N223 PolarHBondContact O-N 2.78Å; H221-N223 VanDerWaalsContact O-N 3.16Å; H221-I224 HydrophobicContact CB-CB 4.18Å; H221-I224 HydrophobicContact CB-CD1 3.73Å; H221-I224 HydrophobicContact CB-CG1 3.91Å; H221-I224 PolarHBondContact O-N 3.37Å; H221-G274 VanDerWaalsContact CE1-CA 3.48Å; H221-G274 WeakPolarHBondContact CE1-CA 3.4Å; H221-G274 PolarHBondContact CE1-N 3.18Å; H221-G274 VanDerWaalsContact CE1-N 3.26Å; H221-G274 WeakPolarHBondContact ND1-CA 3.49Å; H221-Y277 HydrophobicContact CB-CD1 4.09Å; H221-Y277 HydrophobicContact CB-CD2 4.16Å; H221-Y277 HydrophobicContact CB-CE1 4.34Å; H221-Y277 HydrophobicContact CB-CE2 4.4Å; H221-Y277 HydrophobicContact CB-CG 3.99Å; H221-Y277 AromaticContact CD2-CD2 3.87Å; H221-Y277 AromaticContact CD2-CG 3.92Å
222	P	96.9	Very high	89.6	Confident	91 Å²	91	50.3 Å²	50.3	59%	0.591	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.7	-40.1	-175.6	18.7	-32.5	0	0	0	113.4	K302	P222-K302 VanDerWaalsContact O-CD 3.32Å; P222-K302 WeakPolarHBondContact O-CD 3.33Å; P222-K302 VanDerWaalsContact O-CE 3.31Å; P222-K302 WeakPolarHBondContact O-CE 3.25Å; P222-K302 PolarHBondContact O-NZ 2.82Å
223	N	97.9	Very high	90	Very high	30 Å²	30	48.9 Å²	48.9	16%	0.16	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.9	21.7	-179.9	-50.3	98.1	0	0	0	115.3	H221 G270 V301 I303	H221-N223 PolarHBondContact CE1-OD1 3.1Å; H221-N223 PolarHBondContact ND1-N 2.91Å; H221-N223 VanDerWaalsContact ND1-N 3.17Å; H221-N223 PolarHBondContact O-N 2.78Å; H221-N223 VanDerWaalsContact O-N 3.16Å; N223-G270 WeakPolarHBondContact CB-O 3.31Å; N223-G270 VanDerWaalsContact CG-CA 3.41Å; N223-G270 WeakPolarHBondContact ND2-CA 3.14Å; N223-V301 VanDerWaalsContact CA-O 3.25Å; N223-V301 WeakPolarHBondContact CA-O 3.32Å; N223-V301 WeakPolarHBondContact CB-O 3.31Å; N223-V301 PolarHBondContact ND2-O 2.79Å; N223-I303 WeakPolarHBondContact O-CB 3.34Å; N223-I303 WeakPolarHBondContact O-CG1 3.32Å; N223-I303 PolarHBondContact O-N 2.91Å
224	I	96.2	Very high	90.4	Very high	3 Å²	3	51.8 Å²	51.8	2%	0.015	26%	0.261	C	S	.	.	B	Isolated β-bridge	trans	-116.6	143.7	169.5	-65.9	177.5	0	0	0	107.5	H221 T226 Y277 L278 F306	H221-I224 HydrophobicContact CB-CB 4.18Å; H221-I224 HydrophobicContact CB-CD1 3.73Å; H221-I224 HydrophobicContact CB-CG1 3.91Å; H221-I224 PolarHBondContact O-N 3.37Å; I224-T226 PolarHBondContact O-N 2.98Å; I224-Y277 HydrophobicContact CD1-CD1 3.52Å; I224-Y277 HydrophobicContact CD1-CE1 4.08Å; I224-Y277 HydrophobicContact CD1-CG 4.34Å; I224-L278 HydrophobicContact CD1-CD1 4.14Å; I224-L278 HydrophobicContact CD1-CD2 3.96Å; I224-L278 HydrophobicContact CD1-CG 3.74Å; I224-F306 HydrophobicContact CG2-CE2 3.88Å; I224-F306 HydrophobicContact CG2-CZ 3.8Å
225	I	94.8	Very high	90.9	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	27%	0.271	C	S	.	.			trans	-62.5	126.3	178.5	-158	71	0	0	0	110.8	F227 M241 E242 C244 L294 K302 I303 F306	I225-F227 HydrophobicContact CG2-CE1 4.4Å; I225-F227 HydrophobicContact CG2-CE2 4.2Å; I225-F227 HydrophobicContact CG2-CZ 4.06Å; I225-F227 PolarHBondContact O-N 3.31Å; I225-M241 HydrophobicContact CG1-CB 4.02Å; I225-M241 HydrophobicContact CG1-CG 4.33Å; I225-M241 HydrophobicContact CG1-SD 4.22Å; I225-M241 HydrophobicContact CG2-SD 4.31Å; I225-E242 HydrophobicContact CD1-CG 3.54Å; I225-E242 HydrophobicContact CG1-CG 4.15Å; I225-C244 VanDerWaalsContact CD1-SG 3.51Å; I225-L294 HydrophobicContact CD1-CD1 4.13Å; I225-K302 HydrophobicContact CD1-CB 4.04Å; I225-K302 HydrophobicContact CD1-CG 4.36Å; I225-I303 WeakPolarHBondContact CB-O 3.4Å; I225-I303 PolarHBondContact N-O 3.39Å; I225-F306 HydrophobicContact CG2-CD2 4.47Å; I225-F306 HydrophobicContact CG2-CE2 4.16Å
226	T	92.5	Very high	91.5	Very high	72 Å²	72	49.2 Å²	49.2	44%	0.442	26%	0.259	S	S	.	.			trans	-78.6	106.6	178.3	-53.3	0	0	0	0	109	I224 M241 E242	I224-T226 PolarHBondContact O-N 2.98Å; T226-M241 CarbonylContact O-C 3.49Å; T226-M241 WeakPolarHBondContact O-CA 3.37Å; T226-E242 WeakPolarHBondContact CB-OE1 3.45Å; T226-E242 PolarHBondContact N-OE1 2.86Å; T226-E242 PolarHBondContact O-N 3.48Å; T226-E242 PolarHBondContact OG1-OE1 3.01Å
227	F	92.3	Very high	92	Very high	26 Å²	26	51.8 Å²	51.8	11%	0.114	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	133.6	166.3	-62.5	-76.4	0	0	0	109.9	W169 I213 L216 I225 I239 M241 F306	W169-F227 HydrophobicContact CH2-CB 3.53Å; W169-F227 WeakPolarHBondContact CH2-O 3.16Å; W169-F227 HydrophobicContact CZ2-CB 3.85Å; I213-F227 HydrophobicContact CD1-CB 4.22Å; I213-F227 HydrophobicContact CD1-CD1 3.42Å; I213-F227 VanDerWaalsContact CD1-CD1 3.42Å; I213-F227 HydrophobicContact CD1-CE1 3.82Å; I213-F227 HydrophobicContact CD1-CG 3.82Å; L216-F227 HydrophobicContact CB-CD2 4.33Å; L216-F227 HydrophobicContact CB-CE2 3.91Å; L216-F227 HydrophobicContact CD1-CE2 4.03Å; L216-F227 HydrophobicContact CD1-CZ 3.93Å; I225-F227 HydrophobicContact CG2-CE1 4.4Å; I225-F227 HydrophobicContact CG2-CE2 4.2Å; I225-F227 HydrophobicContact CG2-CZ 4.06Å; I225-F227 PolarHBondContact O-N 3.31Å; F227-I239 HydrophobicContact CD1-CG2 3.66Å; F227-I239 HydrophobicContact CE1-CG2 3.81Å; F227-M241 HydrophobicContact CD1-CG 3.72Å; F227-M241 HydrophobicContact CD1-SD 4.32Å; F227-M241 HydrophobicContact CE1-CG 4.03Å; F227-M241 HydrophobicContact CE1-SD 4Å; F227-F306 HydrophobicContact CE2-CD2 4.02Å; F227-F306 HydrophobicContact CE2-CE2 4.48Å; F227-F306 AromaticContact CZ-CD2 3.86Å; F227-F306 HydrophobicContact CZ-CD2 3.86Å
228	K	91.9	Very high	92.5	Very high	57 Å²	57	49.1 Å²	49.1	25%	0.248	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	-29.3	-179.6	-79.4	172.4	150.3	-78.9	0	113.2	W169 V200 I240	W169-K228 WeakPolarHBondContact CZ3-O 3.31Å; V200-K228 HydrophobicContact CB-CD 4.44Å; V200-K228 HydrophobicContact CG1-CD 3.4Å; K228-I240 HydrophobicContact CB-CB 4.39Å; K228-I240 HydrophobicContact CB-CG2 4.07Å; K228-I240 PolarHBondContact N-O 3.25Å
229	G	92.3	Very high	93	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.6	-174.9	-178.9	0	0	0	0	0	111.3	W169 I240	W169-G229 CarbonylContact O-C 3.46Å; W169-G229 VanDerWaalsContact O-CA 3.31Å; W169-G229 WeakPolarHBondContact O-CA 3.33Å; G229-I240 PolarHBondContact N-O 2.88Å; G229-I240 PolarHBondContact O-N 3.11Å
230	I	93.8	Very high	93.3	Very high	3 Å²	3	40.3 Å²	40.3	2%	0.015	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	155.8	172	59.4	179.4	0	0	0	109	W169 E170 V171 T211 I213 T232 C238 I239	W169-I230 PolarHBondContact O-N 3.47Å; E170-I230 CarbonylContact C-O 3.58Å; E170-I230 WeakPolarHBondContact CA-O 3.42Å; E170-I230 HydrophobicContact CG-CD1 4.16Å; E170-I230 HydrophobicContact CG-CG1 4.03Å; V171-I230 PolarHBondContact N-O 3.33Å; T211-I230 WeakPolarHBondContact O-CD1 3.48Å; I213-I230 HydrophobicContact CD1-CG2 3.8Å; I213-I230 HydrophobicContact CG1-CG2 3.78Å; I230-T232 HydrophobicContact CD1-CG2 3.9Å; I230-T232 HydrophobicContact CG1-CG2 4.25Å; I230-C238 CarbonylContact C-O 3.55Å; I230-C238 WeakPolarHBondContact CA-O 3.46Å; I230-I239 HydrophobicContact CG2-CG1 4.32Å
231	C	94.1	Very high	93.4	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.9	163.7	-165.6	0	0	0	0	109.2	V171 I176 Y237 C238	V171-C231 PolarHBondContact O-SG 3.14Å; I176-C231 HydrophobicContact CD1-CB 4.42Å; C231-Y237 WeakPolarHBondContact O-CA 3.36Å; C231-C238 WeakPolarHBondContact CB-SG 3.31Å; C231-C238 PolarHBondContact N-O 3.5Å; C231-C238 PolarHBondContact O-N 2.95Å
232	T	93.4	Very high	93.4	Very high	35 Å²	35	32.3 Å²	32.3	22%	0.215	19%	0.186	C	C	.	.			trans	-103.4	-5.6	-179.5	46.6	0	0	0	0	113	E170 I208 I230 Y237	E170-T232 HydrophobicContact CG-CG2 4.25Å; E170-T232 WeakPolarHBondContact OE2-CB 3.43Å; E170-T232 WeakPolarHBondContact OE2-CG2 3.46Å; E170-T232 PolarHBondContact OE2-OG1 3.39Å; I208-T232 HydrophobicContact CD1-CG2 4.39Å; I208-T232 HydrophobicContact CG1-CG2 4.41Å; I230-T232 HydrophobicContact CD1-CG2 3.9Å; I230-T232 HydrophobicContact CG1-CG2 4.25Å; T232-Y237 WeakPolarHBondContact O-CE1 3.34Å
233	Q	92.1	Very high	93.3	Very high	70 Å²	70	31 Å²	31	33%	0.327	17%	0.17	S	C	.	.	S	Bend	trans	-66.6	131.5	176.8	-62.2	176.8	-9.1	0	0	111.4	F173 E174 C236 Y237	F173-Q233 VanDerWaalsContact N-OE1 3.14Å; E174-Q233 PolarHBondContact OE2-NE2 3.1Å; E174-Q233 PolarHBondContact OE2-OE1 3.35Å; Q233-C236 CarbonylContact O-C 3.59Å; Q233-C236 WeakPolarHBondContact O-CA 3.48Å; Q233-C236 PolarHBondContact O-N 2.67Å; Q233-Y237 PolarHBondContact O-N 3.04Å
234	A	90.7	Very high	93.2	Very high	73 Å²	73	30 Å²	30	60%	0.603	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.5	138.7	172	0	0	0	0	0	110.7	Y237	A234-Y237 HydrophobicContact CB-CE1 4.07Å; A234-Y237 WeakPolarHBondContact CB-OH 3.48Å
235	P	89.6	Confident	93	Very high	83 Å²	83	32 Å²	32	54%	0.539	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	cis	-97.6	26.3	1	40.4	-36.2	0	0	0	113.3
236	C	90.6	Very high	93	Very high	13 Å²	13	35 Å²	35	9%	0.088	20%	0.196	C	C	.	.			trans	-101.5	25.5	-166.4	-67.6	0	0	0	0	114.2	F173 Q233 C238	F173-C236 HydrophobicContact CB-CB 4.21Å; F173-C236 HydrophobicContact CD1-CB 4.16Å; F173-C236 HydrophobicContact CD2-CB 3.54Å; F173-C236 HydrophobicContact CE1-CB 4.44Å; F173-C236 VanDerWaalsContact CE1-SG 3.59Å; F173-C236 HydrophobicContact CE2-CB 3.88Å; F173-C236 HydrophobicContact CG-CB 3.7Å; F173-C236 HydrophobicContact CZ-CB 4.32Å; Q233-C236 CarbonylContact O-C 3.59Å; Q233-C236 WeakPolarHBondContact O-CA 3.48Å; Q233-C236 PolarHBondContact O-N 2.67Å; C236-C238 PolarHBondContact O-N 2.78Å; C236-C238 VanDerWaalsContact O-N 3.12Å; C236-C238 PolarHBondContact O-SG 3.18Å; C236-C238 VanDerWaalsContact O-SG 3.36Å
237	Y	92.8	Very high	93	Very high	57 Å²	57	33 Å²	33	22%	0.224	19%	0.19	C	C	.	.			trans	-50.1	117.2	-179.6	-49.3	-52.3	0	0	0	112.2	V205 I208 C231 T232 Q233 A234	V205-Y237 WeakPolarHBondContact CG2-O 3.49Å; V205-Y237 PolarHBondContact N-O 2.82Å; I208-Y237 HydrophobicContact CB-CD1 4.03Å; I208-Y237 HydrophobicContact CB-CE1 3.82Å; I208-Y237 HydrophobicContact CD1-CE1 4.22Å; I208-Y237 HydrophobicContact CG1-CD1 4.32Å; I208-Y237 HydrophobicContact CG1-CE1 4.22Å; C231-Y237 WeakPolarHBondContact O-CA 3.36Å; T232-Y237 WeakPolarHBondContact O-CE1 3.34Å; Q233-Y237 PolarHBondContact O-N 3.04Å; A234-Y237 HydrophobicContact CB-CE1 4.07Å; A234-Y237 WeakPolarHBondContact CB-OH 3.48Å
238	C	93.3	Very high	93	Very high	3 Å²	3	35.3 Å²	35.3	2%	0.02	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.6	163.3	-179.8	62.7	0	0	0	0	113.7	V202 K203 I230 C231 C236	V202-C238 HydrophobicContact CG1-CB 3.75Å; K203-C238 CarbonylContact O-C 2.86Å; K203-C238 WeakPolarHBondContact O-CA 3.48Å; K203-C238 VanDerWaalsContact O-CB 3.31Å; K203-C238 WeakPolarHBondContact O-CB 3.2Å; I230-C238 CarbonylContact C-O 3.55Å; I230-C238 WeakPolarHBondContact CA-O 3.46Å; C231-C238 WeakPolarHBondContact CB-SG 3.31Å; C231-C238 PolarHBondContact N-O 3.5Å; C231-C238 PolarHBondContact O-N 2.95Å; C236-C238 PolarHBondContact O-N 2.78Å; C236-C238 VanDerWaalsContact O-N 3.12Å; C236-C238 PolarHBondContact O-SG 3.18Å; C236-C238 VanDerWaalsContact O-SG 3.36Å
239	I	92.9	Very high	93.2	Very high	15 Å²	15	32.6 Å²	32.6	8%	0.077	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	131	174.2	-59.1	168.9	0	0	0	108.4	K203 V205 I213 F227 I230 M241	K203-I239 PolarHBondContact N-O 2.97Å; K203-I239 PolarHBondContact O-N 2.85Å; V205-I239 HydrophobicContact CG1-CD1 4.02Å; V205-I239 HydrophobicContact CG1-CG1 4.22Å; I213-I239 HydrophobicContact CD1-CG2 3.7Å; I213-I239 HydrophobicContact CG2-CD1 4.04Å; F227-I239 HydrophobicContact CD1-CG2 3.66Å; F227-I239 HydrophobicContact CE1-CG2 3.81Å; I230-I239 HydrophobicContact CG2-CG1 4.32Å; I239-M241 HydrophobicContact CG2-CG 4.15Å; I239-M241 HydrophobicContact CG2-SD 4.45Å
240	I	94.1	Very high	93.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	128.9	-176.3	-46.2	174.9	0	0	0	109.1	V171 I176 L195 V200 K228 G229	V171-I240 HydrophobicContact CB-CD1 3.67Å; V171-I240 HydrophobicContact CG1-CD1 3.78Å; V171-I240 HydrophobicContact CG2-CD1 3.9Å; I176-I240 HydrophobicContact CD1-CD1 3.6Å; I176-I240 HydrophobicContact CD1-CG1 4.26Å; I176-I240 HydrophobicContact CG1-CD1 4.18Å; L195-I240 HydrophobicContact CD2-CD1 4.17Å; L195-I240 HydrophobicContact CD2-CG2 4.14Å; V200-I240 HydrophobicContact CB-CG2 3.75Å; V200-I240 HydrophobicContact CG1-CG2 3.96Å; V200-I240 HydrophobicContact CG2-CG2 3.97Å; K228-I240 HydrophobicContact CB-CB 4.39Å; K228-I240 HydrophobicContact CB-CG2 4.07Å; K228-I240 PolarHBondContact N-O 3.25Å; G229-I240 PolarHBondContact N-O 2.88Å; G229-I240 PolarHBondContact O-N 3.11Å
241	M	94.4	Very high	93.2	Very high	12 Å²	12	38.4 Å²	38.4	6%	0.059	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	165.4	-173.6	-63.2	169.4	-67.3	0	0	111	V200 A201 K203 I225 T226 F227 I239	V200-M241 WeakPolarHBondContact CA-O 3.41Å; V200-M241 WeakPolarHBondContact CB-O 3.35Å; A201-M241 HydrophobicContact CB-CB 4.3Å; A201-M241 HydrophobicContact CB-CE 4.34Å; A201-M241 PolarHBondContact N-O 2.71Å; A201-M241 PolarHBondContact O-N 3.41Å; K203-M241 HydrophobicContact CB-CE 3.68Å; K203-M241 HydrophobicContact CD-CE 4.28Å; I225-M241 HydrophobicContact CG1-CB 4.02Å; I225-M241 HydrophobicContact CG1-CG 4.33Å; I225-M241 HydrophobicContact CG1-SD 4.22Å; I225-M241 HydrophobicContact CG2-SD 4.31Å; T226-M241 CarbonylContact O-C 3.49Å; T226-M241 WeakPolarHBondContact O-CA 3.37Å; F227-M241 HydrophobicContact CD1-CG 3.72Å; F227-M241 HydrophobicContact CD1-SD 4.32Å; F227-M241 HydrophobicContact CE1-CG 4.03Å; F227-M241 HydrophobicContact CE1-SD 4Å; I239-M241 HydrophobicContact CG2-CG 4.15Å; I239-M241 HydrophobicContact CG2-SD 4.45Å
242	E	94.5	Very high	93.3	Very high	34 Å²	34	39 Å²	39	16%	0.159	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.5	140	165.3	68	-176.7	125.8	0	0	111.3	I225 T226 K302	I225-E242 HydrophobicContact CD1-CG 3.54Å; I225-E242 HydrophobicContact CG1-CG 4.15Å; T226-E242 WeakPolarHBondContact CB-OE1 3.45Å; T226-E242 PolarHBondContact N-OE1 2.86Å; T226-E242 PolarHBondContact O-N 3.48Å; T226-E242 PolarHBondContact OG1-OE1 3.01Å; E242-K302 WeakPolarHBondContact OE1-CE 3.32Å; E242-K302 IonicContact OE1-NZ 2.82Å; E242-K302 PolarHBondContact OE1-NZ 3.04Å; E242-K302 WeakPolarHBondContact OE2-CE 3.36Å; E242-K302 IonicContact OE2-NZ 2.68Å; E242-K302 PolarHBondContact OE2-NZ 3.4Å
243	Y	95.3	Very high	93.3	Very high	65 Å²	65	38 Å²	38	26%	0.255	21%	0.211	S	C	.	.			trans	-80.9	132.6	178.1	-176.9	-121.3	0	0	0	111.3	V182 L192 E199 A201 A245	V182-Y243 HydrophobicContact CG2-CE2 4.41Å; L192-Y243 HydrophobicContact CB-CE2 4.26Å; L192-Y243 HydrophobicContact CD1-CD1 3.79Å; L192-Y243 HydrophobicContact CD1-CD2 3.88Å; L192-Y243 HydrophobicContact CD1-CE1 3.97Å; L192-Y243 HydrophobicContact CD1-CE2 4.07Å; L192-Y243 HydrophobicContact CD1-CG 3.75Å; L192-Y243 HydrophobicContact CD2-CE1 4.35Å; E199-Y243 HydrophobicContact CB-CD1 4.43Å; A201-Y243 HydrophobicContact CB-CD2 4.29Å; Y243-A245 HydrophobicContact CD1-CB 4.38Å; Y243-A245 HydrophobicContact CE1-CB 3.98Å
244	C	95.3	Very high	93.3	Very high	7 Å²	7	42.2 Å²	42.2	5%	0.047	22%	0.224	C	C	.	.			trans	-110.8	93.8	179.7	-67.2	0	0	0	0	109.3	I225 Q246 G247 L294 I295	I225-C244 VanDerWaalsContact CD1-SG 3.51Å; C244-Q246 VanDerWaalsContact C-N 3.28Å; C244-Q246 PolarHBondContact O-N 3.41Å; C244-Q246 VanDerWaalsContact O-N 3.16Å; C244-G247 PolarHBondContact O-N 3.42Å; C244-L294 HydrophobicContact CB-CB 3.67Å; C244-L294 HydrophobicContact CB-CD1 4.26Å; C244-I295 CarbonylContact C-O 3.34Å; C244-I295 WeakPolarHBondContact CB-O 3.26Å
245	A	93.1	Very high	93.5	Very high	47 Å²	47	43 Å²	43	39%	0.388	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-23.3	-165.2	0	0	0	0	0	116	Y243 G247	Y243-A245 HydrophobicContact CD1-CB 4.38Å; Y243-A245 HydrophobicContact CE1-CB 3.98Å; A245-G247 VanDerWaalsContact C-N 3.34Å
246	Q	93.1	Very high	93.5	Very high	63 Å²	63	41.2 Å²	41.2	29%	0.294	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.3	1	174.8	-70.7	-173.9	70.6	0	0	113.2	C244 V252 I295 T296 D299	C244-Q246 VanDerWaalsContact C-N 3.28Å; C244-Q246 PolarHBondContact O-N 3.41Å; C244-Q246 VanDerWaalsContact O-N 3.16Å; Q246-V252 HydrophobicContact CB-CG2 4.22Å; Q246-V252 WeakPolarHBondContact O-CG2 3.15Å; Q246-I295 HydrophobicContact CB-CB 3.86Å; Q246-I295 HydrophobicContact CB-CG2 3.9Å; Q246-I295 WeakPolarHBondContact CB-O 3.38Å; Q246-I295 HydrophobicContact CG-CG2 4.39Å; Q246-I295 PolarHBondContact N-O 3.32Å; Q246-I295 VanDerWaalsContact N-O 3.09Å; Q246-T296 PolarHBondContact NE2-O 2.83Å; Q246-D299 PolarHBondContact NE2-OD1 3.02Å
247	G	92.6	Very high	93.6	Very high	30 Å²	30	43.8 Å²	43.8	31%	0.309	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	70.3	-137.3	177	0	0	0	0	0	112.8	C244 A245 L294 I295	C244-G247 PolarHBondContact O-N 3.42Å; A245-G247 VanDerWaalsContact C-N 3.34Å; G247-L294 CarbonylContact O-C 3.42Å; G247-L294 VanDerWaalsContact O-CA 3.22Å; G247-L294 WeakPolarHBondContact O-CA 3.28Å; G247-I295 PolarHBondContact O-N 3.38Å
248	Q	93.5	Very high	93.5	Very high	75 Å²	75	48 Å²	48	35%	0.35	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	138.6	-172.8	-57.7	174.7	21.2	0	0	111.6	Y250 E251 V252 P291 M293 L294	Q248-Y250 PolarHBondContact O-N 2.66Å; Q248-E251 HydrophobicContact CB-CG 4.41Å; Q248-E251 PolarHBondContact O-N 3.23Å; Q248-V252 WeakPolarHBondContact O-CG2 3.17Å; Q248-V252 PolarHBondContact O-N 2.6Å; Q248-P291 WeakPolarHBondContact CG-O 3.21Å; Q248-P291 PolarHBondContact OE1-O 3.11Å; Q248-M293 WeakPolarHBondContact CA-O 3.32Å; Q248-L294 HydrophobicContact CB-CD2 4.44Å; Q248-L294 HydrophobicContact CG-CD2 3.85Å
249	L	95.9	Very high	93.6	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-53.9	-38.3	174.6	174	60.9	0	0	0	112.1	E251 V252 L253 W267 I271 S290 M293 I295 V350 M354	L249-E251 VanDerWaalsContact C-N 3.31Å; L249-E251 PolarHBondContact O-N 3.1Å; L249-V252 PolarHBondContact O-N 2.96Å; L249-L253 HydrophobicContact CD1-CD1 4.06Å; L249-L253 HydrophobicContact CD1-CD2 4.49Å; L249-L253 HydrophobicContact CD1-CG 3.98Å; L249-L253 HydrophobicContact CG-CD1 4.03Å; L249-L253 HydrophobicContact CG-CG 4.39Å; L249-L253 WeakPolarHBondContact O-CB 3.25Å; L249-L253 VanDerWaalsContact O-CG 3.3Å; L249-L253 WeakPolarHBondContact O-CG 3.39Å; L249-L253 PolarHBondContact O-N 3.36Å; L249-W267 HydrophobicContact CD1-CD2 4.45Å; L249-W267 HydrophobicContact CD1-CE3 3.53Å; L249-W267 HydrophobicContact CD1-CH2 4.05Å; L249-W267 HydrophobicContact CD1-CZ3 3.28Å; L249-I271 HydrophobicContact CD2-CD1 4.41Å; L249-S290 PolarHBondContact N-O 3.06Å; L249-M293 HydrophobicContact CB-CB 3.85Å; L249-M293 HydrophobicContact CD2-CB 3.97Å; L249-M293 HydrophobicContact CD2-CG 4.19Å; L249-M293 PolarHBondContact N-O 2.99Å; L249-I295 HydrophobicContact CB-CD1 4.32Å; L249-I295 HydrophobicContact CB-CG1 4.29Å; L249-I295 HydrophobicContact CD1-CD1 4.28Å; L249-V350 HydrophobicContact CD2-CG1 3.85Å; L249-M354 HydrophobicContact CD1-CG 4.42Å; L249-M354 HydrophobicContact CD2-CG 4.14Å; L249-M354 HydrophobicContact CD2-SD 3.93Å
250	Y	93.7	Very high	93.8	Very high	53 Å²	53	48.7 Å²	48.7	21%	0.208	26%	0.259	C	S	.	.	H	α-helix	trans	-55.6	-44.4	174.8	-179.1	-102.6	0	0	0	112.6	Q248 R254 S290 P291 W327 V359	Q248-Y250 PolarHBondContact O-N 2.66Å; Y250-R254 VanDerWaalsContact O-CB 3.25Å; Y250-R254 WeakPolarHBondContact O-CB 3.35Å; Y250-R254 PolarHBondContact O-N 3.4Å; Y250-S290 PolarHBondContact N-O 3.31Å; Y250-P291 HydrophobicContact CD1-CG 4.46Å; Y250-P291 HydrophobicContact CD2-CG 4.43Å; Y250-P291 HydrophobicContact CG-CG 4.02Å; Y250-W327 HydrophobicContact CD2-CH2 4.47Å; Y250-W327 HydrophobicContact CD2-CZ2 4.45Å; Y250-W327 HydrophobicContact CE2-CH2 4.31Å; Y250-V359 HydrophobicContact CE2-CG1 4.4Å; Y250-V359 HydrophobicContact CE2-CG2 4.39Å
251	E	93	Very high	93.9	Very high	72 Å²	72	49.2 Å²	49.2	34%	0.336	26%	0.263	S	S	.	.	H	α-helix	trans	-75.5	-35.5	179.1	-65.8	-59.9	159.8	0	0	112.1	Q248 L249 L253 R254 A255	Q248-E251 HydrophobicContact CB-CG 4.41Å; Q248-E251 PolarHBondContact O-N 3.23Å; L249-E251 VanDerWaalsContact C-N 3.31Å; L249-E251 PolarHBondContact O-N 3.1Å; E251-L253 VanDerWaalsContact C-N 3.33Å; E251-L253 PolarHBondContact O-N 3.46Å; E251-R254 PolarHBondContact O-N 3.43Å; E251-R254 IonicContact OE1-CZ 2.79Å; E251-R254 IonicContact OE1-NE 3.12Å; E251-R254 PolarHBondContact OE1-NE 2.81Å; E251-R254 IonicContact OE1-NH2 3.03Å; E251-R254 PolarHBondContact OE1-NH2 3.2Å; E251-R254 IonicContact OE2-CZ 3.38Å; E251-R254 IonicContact OE2-NE 2.84Å; E251-R254 PolarHBondContact OE2-NE 3.26Å; E251-R254 IonicContact OE2-NH2 3.94Å; E251-R254 PolarHBondContact OE2-NH2 3.45Å; E251-A255 VanDerWaalsContact O-CB 3.3Å; E251-A255 WeakPolarHBondContact O-CB 3.28Å; E251-A255 PolarHBondContact O-N 2.88Å
252	V	94.9	Very high	94	Very high	12 Å²	12	51.5 Å²	51.5	7%	0.073	28%	0.279	C	S	.	.	H	α-helix	trans	-60.8	-42	173.1	174.9	0	0	0	0	111.4	Q246 Q248 L249 R257 W267 I295	Q246-V252 HydrophobicContact CB-CG2 4.22Å; Q246-V252 WeakPolarHBondContact O-CG2 3.15Å; Q248-V252 WeakPolarHBondContact O-CG2 3.17Å; Q248-V252 PolarHBondContact O-N 2.6Å; L249-V252 PolarHBondContact O-N 2.96Å; V252-R257 HydrophobicContact CG1-CB 3.95Å; V252-R257 VanDerWaalsContact CG1-CD 3.42Å; V252-R257 HydrophobicContact CG1-CG 4.28Å; V252-R257 WeakPolarHBondContact O-CB 3.21Å; V252-R257 PolarHBondContact O-N 2.9Å; V252-W267 HydrophobicContact CG1-CH2 3.96Å; V252-I295 HydrophobicContact CG2-CG1 4.32Å
253	L	94.9	Very high	94.1	Very high	13 Å²	13	50.5 Å²	50.5	7%	0.068	28%	0.275	C	S	.	.	H	α-helix	trans	-68.1	-44.3	173.5	-67.8	170.9	0	0	0	111.4	L249 E251 A255 G256 I259 E353 M354	L249-L253 HydrophobicContact CD1-CD1 4.06Å; L249-L253 HydrophobicContact CD1-CD2 4.49Å; L249-L253 HydrophobicContact CD1-CG 3.98Å; L249-L253 HydrophobicContact CG-CD1 4.03Å; L249-L253 HydrophobicContact CG-CG 4.39Å; L249-L253 WeakPolarHBondContact O-CB 3.25Å; L249-L253 VanDerWaalsContact O-CG 3.3Å; L249-L253 WeakPolarHBondContact O-CG 3.39Å; L249-L253 PolarHBondContact O-N 3.36Å; E251-L253 VanDerWaalsContact C-N 3.33Å; E251-L253 PolarHBondContact O-N 3.46Å; L253-A255 VanDerWaalsContact C-N 3.31Å; L253-A255 PolarHBondContact O-N 3.41Å; L253-G256 PolarHBondContact O-N 3.49Å; L253-I259 HydrophobicContact CD2-CD1 4.09Å; L253-I259 HydrophobicContact CD2-CG1 3.64Å; L253-E353 HydrophobicContact CD1-CB 3.95Å; L253-M354 HydrophobicContact CD1-CG 4.44Å
254	R	92.1	Very high	94.2	Very high	160 Å²	160	47.4 Å²	47.4	60%	0.604	26%	0.263	S	S	*	.	H	α-helix	trans	-66.2	-29.3	-179.4	-168.6	169.9	74.3	124.2	-5.8	113.5	Y250 E251 G256	Y250-R254 VanDerWaalsContact O-CB 3.25Å; Y250-R254 WeakPolarHBondContact O-CB 3.35Å; Y250-R254 PolarHBondContact O-N 3.4Å; E251-R254 PolarHBondContact O-N 3.43Å; E251-R254 IonicContact OE1-CZ 2.79Å; E251-R254 IonicContact OE1-NE 3.12Å; E251-R254 PolarHBondContact OE1-NE 2.81Å; E251-R254 IonicContact OE1-NH2 3.03Å; E251-R254 PolarHBondContact OE1-NH2 3.2Å; E251-R254 IonicContact OE2-CZ 3.38Å; E251-R254 IonicContact OE2-NE 2.84Å; E251-R254 PolarHBondContact OE2-NE 3.26Å; E251-R254 IonicContact OE2-NH2 3.94Å; E251-R254 PolarHBondContact OE2-NH2 3.45Å; R254-G256 PolarHBondContact O-N 3.41Å
255	A	93.5	Very high	94.3	Very high	88 Å²	88	47.6 Å²	47.6	73%	0.727	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-1	170.5	0	0	0	0	0	113.6	E251 L253	E251-A255 VanDerWaalsContact O-CB 3.3Å; E251-A255 WeakPolarHBondContact O-CB 3.28Å; E251-A255 PolarHBondContact O-N 2.88Å; L253-A255 VanDerWaalsContact C-N 3.31Å; L253-A255 PolarHBondContact O-N 3.41Å
256	G	89.6	Confident	94.5	Very high	46 Å²	46	50.3 Å²	50.3	47%	0.474	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.4	20.9	178.7	0	0	0	0	0	113.7	L253 R254 K258	L253-G256 PolarHBondContact O-N 3.49Å; R254-G256 PolarHBondContact O-N 3.41Å; G256-K258 PolarHBondContact O-N 2.84Å
257	R	93.5	Very high	94.7	Very high	67 Å²	67	47.3 Å²	47.3	25%	0.253	26%	0.257	S	S	.	.			trans	-58.7	127.4	178.2	-171.1	-179.9	176.2	-169	-7.6	110.1	V252 I259 D299	V252-R257 HydrophobicContact CG1-CB 3.95Å; V252-R257 VanDerWaalsContact CG1-CD 3.42Å; V252-R257 HydrophobicContact CG1-CG 4.28Å; V252-R257 WeakPolarHBondContact O-CB 3.21Å; V252-R257 PolarHBondContact O-N 2.9Å; R257-I259 HydrophobicContact CB-CD1 4.14Å; R257-I259 HydrophobicContact CG-CD1 4.07Å; R257-I259 WeakPolarHBondContact O-CD1 3.38Å; R257-I259 PolarHBondContact O-N 3.05Å; R257-I259 VanDerWaalsContact O-N 3.08Å; R257-D299 IonicContact CZ-OD1 3.38Å; R257-D299 VanDerWaalsContact CZ-OD1 3.24Å; R257-D299 IonicContact CZ-OD2 2.7Å; R257-D299 IonicContact NH1-OD1 3.84Å; R257-D299 PolarHBondContact NH1-OD1 2.89Å; R257-D299 IonicContact NH1-OD2 3.55Å; R257-D299 IonicContact NH2-OD1 2.72Å; R257-D299 PolarHBondContact NH2-OD1 3.13Å; R257-D299 IonicContact NH2-OD2 2.71Å; R257-D299 PolarHBondContact NH2-OD2 3.26Å
258	K	91	Very high	95	Very high	146 Å²	146	45.9 Å²	45.9	64%	0.635	24%	0.243	S	C	*	.			trans	-72	98.2	175.9	-72.7	-169.8	178.6	-174.9	0	110.5	G256 T260 F431	G256-K258 PolarHBondContact O-N 2.84Å; K258-T260 PolarHBondContact O-N 3.23Å; K258-F431 HydrophobicContact CB-CE1 3.87Å; K258-F431 HydrophobicContact CB-CE2 4.28Å; K258-F431 HydrophobicContact CB-CZ 3.62Å; K258-F431 HydrophobicContact CD-CD2 4.35Å; K258-F431 HydrophobicContact CD-CE2 4Å; K258-F431 HydrophobicContact CD-CZ 4.17Å; K258-F431 HydrophobicContact CG-CE1 4.41Å; K258-F431 HydrophobicContact CG-CZ 4.29Å
259	I	94.8	Very high	95.2	Very high	2 Å²	2	45.3 Å²	45.3	1%	0.01	24%	0.24	C	C	.	.			trans	-76.9	114.6	177.8	-49	-45.9	0	0	0	108.9	L253 R257 L263 L264 W267 Y430 F431	L253-I259 HydrophobicContact CD2-CD1 4.09Å; L253-I259 HydrophobicContact CD2-CG1 3.64Å; R257-I259 HydrophobicContact CB-CD1 4.14Å; R257-I259 HydrophobicContact CG-CD1 4.07Å; R257-I259 WeakPolarHBondContact O-CD1 3.38Å; R257-I259 PolarHBondContact O-N 3.05Å; R257-I259 VanDerWaalsContact O-N 3.08Å; I259-L263 HydrophobicContact CD1-CD2 4.19Å; I259-L263 HydrophobicContact CG2-CB 4.2Å; I259-L263 HydrophobicContact CG2-CD2 4.28Å; I259-L263 HydrophobicContact CG2-CG 4.29Å; I259-L264 HydrophobicContact CG2-CB 4.06Å; I259-W267 HydrophobicContact CD1-CE3 4.5Å; I259-W267 HydrophobicContact CD1-CH2 3.68Å; I259-W267 HydrophobicContact CD1-CZ3 3.43Å; I259-W267 VanDerWaalsContact CD1-CZ3 3.43Å; I259-W267 HydrophobicContact CG1-CZ3 4.11Å; I259-W267 HydrophobicContact CG2-CE3 4.32Å; I259-W267 HydrophobicContact CG2-CZ3 4.25Å; I259-Y430 VanDerWaalsContact O-CE1 3.31Å; I259-Y430 WeakPolarHBondContact O-CE1 3.45Å; I259-F431 WeakPolarHBondContact O-CE1 2.92Å
260	T	96.1	Very high	95.3	Very high	31 Å²	31	45.5 Å²	45.5	19%	0.19	24%	0.243	C	C	.	.			trans	-74.7	162.4	-179.4	67.5	0	0	0	0	111.5	K258 S262 L263 L264 F431	K258-T260 PolarHBondContact O-N 3.23Å; T260-S262 PolarHBondContact O-N 2.89Å; T260-S262 PolarHBondContact OG1-OG 3.31Å; T260-L263 PolarHBondContact O-N 2.91Å; T260-L263 VanDerWaalsContact OG1-CB 3.3Å; T260-L263 WeakPolarHBondContact OG1-CB 3.41Å; T260-L263 PolarHBondContact OG1-N 3.26Å; T260-L264 WeakPolarHBondContact O-CB 3.31Å; T260-L264 PolarHBondContact O-N 3.25Å; T260-F431 HydrophobicContact CG2-CZ 4.43Å
261	P	96.1	Very high	95.6	Very high	11 Å²	11	43 Å²	43	7%	0.071	23%	0.233	C	C	.	.	H	α-helix	trans	-52.7	-38.2	170.8	-30.2	37.3	0	0	0	114	M265 I422 L423 Y430	P261-M265 WeakPolarHBondContact O-CG 3.49Å; P261-M265 PolarHBondContact O-N 2.84Å; P261-I422 HydrophobicContact CB-CG1 4.24Å; P261-I422 WeakPolarHBondContact CB-O 3.47Å; P261-L423 HydrophobicContact CB-CD2 4.27Å; P261-Y430 HydrophobicContact CG-CD1 3.9Å; P261-Y430 HydrophobicContact CG-CD2 4.09Å; P261-Y430 HydrophobicContact CG-CG 3.67Å
262	S	96.4	Very high	95.8	Very high	59 Å²	59	39.6 Å²	39.6	41%	0.413	22%	0.217	S	C	.	.	H	α-helix	trans	-66.2	-53.9	174.9	59.7	0	0	0	0	111.8	T260 L264 M265 D266	T260-S262 PolarHBondContact O-N 2.89Å; T260-S262 PolarHBondContact OG1-OG 3.31Å; S262-L264 VanDerWaalsContact C-N 3.26Å; S262-L264 PolarHBondContact O-N 3.26Å; S262-M265 CarbonylContact O-C 3.59Å; S262-M265 WeakPolarHBondContact O-CA 3.46Å; S262-M265 WeakPolarHBondContact O-CB 3.49Å; S262-M265 PolarHBondContact O-N 3.28Å; S262-D266 VanDerWaalsContact O-CG 3.32Å; S262-D266 PolarHBondContact O-N 2.85Å; S262-D266 VanDerWaalsContact O-OD2 3.09Å
263	L	96.6	Very high	96	Very high	14 Å²	14	39.6 Å²	39.6	7%	0.073	22%	0.22	C	C	.	.	H	α-helix	trans	-61.2	-35.8	-177.1	-169	65.9	0	0	0	112	I259 T260 W267 D299	I259-L263 HydrophobicContact CD1-CD2 4.19Å; I259-L263 HydrophobicContact CG2-CB 4.2Å; I259-L263 HydrophobicContact CG2-CD2 4.28Å; I259-L263 HydrophobicContact CG2-CG 4.29Å; T260-L263 PolarHBondContact O-N 2.91Å; T260-L263 VanDerWaalsContact OG1-CB 3.3Å; T260-L263 WeakPolarHBondContact OG1-CB 3.41Å; T260-L263 PolarHBondContact OG1-N 3.26Å; L263-W267 HydrophobicContact CD1-CD2 4.25Å; L263-W267 HydrophobicContact CD1-CZ2 3.72Å; L263-W267 HydrophobicContact CD2-CH2 3.79Å; L263-W267 HydrophobicContact CD2-CZ2 3.69Å; L263-W267 HydrophobicContact CD2-CZ3 4.33Å; L263-W267 HydrophobicContact CG-CD2 3.99Å; L263-W267 HydrophobicContact CG-CE3 4.36Å; L263-W267 HydrophobicContact CG-CH2 4.12Å; L263-W267 HydrophobicContact CG-CZ2 3.71Å; L263-W267 HydrophobicContact CG-CZ3 4.42Å; L263-W267 VanDerWaalsContact O-CB 3.3Å; L263-W267 WeakPolarHBondContact O-CB 3.5Å; L263-W267 VanDerWaalsContact O-CG 3.23Å; L263-W267 PolarHBondContact O-N 3.48Å; L263-D299 HydrophobicContact CD1-CB 3.94Å
264	L	97.4	Very high	96.2	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-43.1	171.2	176.8	67.6	0	0	0	111.9	I259 T260 S262 A268 M354 L355 I422	I259-L264 HydrophobicContact CG2-CB 4.06Å; T260-L264 WeakPolarHBondContact O-CB 3.31Å; T260-L264 PolarHBondContact O-N 3.25Å; S262-L264 VanDerWaalsContact C-N 3.26Å; S262-L264 PolarHBondContact O-N 3.26Å; L264-A268 WeakPolarHBondContact O-CB 3.28Å; L264-A268 PolarHBondContact O-N 2.92Å; L264-M354 HydrophobicContact CD1-CB 3.39Å; L264-L355 HydrophobicContact CD1-CG 4.39Å; L264-L355 HydrophobicContact CD2-CD2 3.68Å; L264-L355 HydrophobicContact CD2-CG 4.32Å; L264-I422 HydrophobicContact CD2-CD1 3.51Å
265	M	97.4	Very high	96.5	Very high	10 Å²	10	31.4 Å²	31.4	5%	0.049	19%	0.188	C	C	.	.	H	α-helix	trans	-71.3	-45.4	177.6	-69.3	-57.7	92.5	0	0	111.8	P261 S262 W267 A268 M269 F390 I422 L423	P261-M265 WeakPolarHBondContact O-CG 3.49Å; P261-M265 PolarHBondContact O-N 2.84Å; S262-M265 CarbonylContact O-C 3.59Å; S262-M265 WeakPolarHBondContact O-CA 3.46Å; S262-M265 WeakPolarHBondContact O-CB 3.49Å; S262-M265 PolarHBondContact O-N 3.28Å; M265-W267 VanDerWaalsContact C-N 3.3Å; M265-W267 PolarHBondContact O-N 2.84Å; M265-A268 PolarHBondContact O-N 3.35Å; M265-M269 WeakPolarHBondContact O-CB 3.49Å; M265-M269 VanDerWaalsContact O-CG 3.27Å; M265-M269 WeakPolarHBondContact O-CG 3.38Å; M265-M269 PolarHBondContact O-N 3.37Å; M265-F390 HydrophobicContact CE-CE1 3.6Å; M265-F390 HydrophobicContact CE-CE2 4.43Å; M265-F390 HydrophobicContact CE-CZ 3.32Å; M265-F390 HydrophobicContact SD-CE1 4.46Å; M265-F390 HydrophobicContact SD-CZ 3.87Å; M265-I422 HydrophobicContact CE-CG2 4.06Å; M265-I422 HydrophobicContact CG-CG2 3.9Å; M265-I422 HydrophobicContact SD-CG2 3.86Å; M265-L423 HydrophobicContact CG-CD1 4.5Å; M265-L423 HydrophobicContact CG-CD2 4.15Å; M265-L423 HydrophobicContact CG-CG 4.26Å
266	D	97.7	Very high	96.7	Very high	104 Å²	104	29 Å²	29	56%	0.556	16%	0.162	S	C	*	.	H	α-helix	trans	-58.6	-42.6	177.9	-63.1	-41.8	0	0	0	111	S262 G270	S262-D266 VanDerWaalsContact O-CG 3.32Å; S262-D266 PolarHBondContact O-N 2.85Å; S262-D266 VanDerWaalsContact O-OD2 3.09Å; D266-G270 WeakPolarHBondContact O-CA 3.13Å; D266-G270 PolarHBondContact O-N 3.2Å
267	W	98.4	Very high	97.1	Very high	1 Å²	1	29 Å²	29	0%	0.004	15%	0.149	C	C	.	.	H	α-helix	trans	-73.3	-45.5	176.3	-67.6	-4.4	0	0	0	113.2	L249 V252 I259 L263 M265 M269 G270 I271 I295 D299 V301 M354	L249-W267 HydrophobicContact CD1-CD2 4.45Å; L249-W267 HydrophobicContact CD1-CE3 3.53Å; L249-W267 HydrophobicContact CD1-CH2 4.05Å; L249-W267 HydrophobicContact CD1-CZ3 3.28Å; V252-W267 HydrophobicContact CG1-CH2 3.96Å; I259-W267 HydrophobicContact CD1-CE3 4.5Å; I259-W267 HydrophobicContact CD1-CH2 3.68Å; I259-W267 HydrophobicContact CD1-CZ3 3.43Å; I259-W267 VanDerWaalsContact CD1-CZ3 3.43Å; I259-W267 HydrophobicContact CG1-CZ3 4.11Å; I259-W267 HydrophobicContact CG2-CE3 4.32Å; I259-W267 HydrophobicContact CG2-CZ3 4.25Å; L263-W267 HydrophobicContact CD1-CD2 4.25Å; L263-W267 HydrophobicContact CD1-CZ2 3.72Å; L263-W267 HydrophobicContact CD2-CH2 3.79Å; L263-W267 HydrophobicContact CD2-CZ2 3.69Å; L263-W267 HydrophobicContact CD2-CZ3 4.33Å; L263-W267 HydrophobicContact CG-CD2 3.99Å; L263-W267 HydrophobicContact CG-CE3 4.36Å; L263-W267 HydrophobicContact CG-CH2 4.12Å; L263-W267 HydrophobicContact CG-CZ2 3.71Å; L263-W267 HydrophobicContact CG-CZ3 4.42Å; L263-W267 VanDerWaalsContact O-CB 3.3Å; L263-W267 WeakPolarHBondContact O-CB 3.5Å; L263-W267 VanDerWaalsContact O-CG 3.23Å; L263-W267 PolarHBondContact O-N 3.48Å; M265-W267 VanDerWaalsContact C-N 3.3Å; M265-W267 PolarHBondContact O-N 2.84Å; W267-M269 PolarHBondContact O-N 2.95Å; W267-G270 PolarHBondContact O-N 2.77Å; W267-I271 VanDerWaalsContact O-CG1 3.28Å; W267-I271 WeakPolarHBondContact O-CG1 3.33Å; W267-I271 PolarHBondContact O-N 3.06Å; W267-I295 HydrophobicContact CD2-CD1 4.18Å; W267-I295 HydrophobicContact CH2-CD1 4.34Å; W267-I295 HydrophobicContact CH2-CG1 4.47Å; W267-I295 HydrophobicContact CZ2-CD1 3.86Å; W267-I295 HydrophobicContact CZ2-CG1 4.21Å; W267-I295 HydrophobicContact CZ2-CG2 3.98Å; W267-D299 PolarHBondContact NE1-O 3.23Å; W267-V301 HydrophobicContact CB-CG1 4.39Å; W267-V301 HydrophobicContact CG-CB 4.28Å; W267-M354 HydrophobicContact CB-SD 3.69Å; W267-M354 HydrophobicContact CE3-SD 3.95Å
268	A	98.4	Very high	97.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.9	-43.6	179	0	0	0	0	0	112	L264 M265 A272 L351 M354 L415	L264-A268 WeakPolarHBondContact O-CB 3.28Å; L264-A268 PolarHBondContact O-N 2.92Å; M265-A268 PolarHBondContact O-N 3.35Å; A268-A272 WeakPolarHBondContact O-CB 3.14Å; A268-A272 PolarHBondContact O-N 3.3Å; A268-L351 HydrophobicContact CB-CD1 3.97Å; A268-M354 HydrophobicContact CB-CE 4.12Å; A268-L415 HydrophobicContact CB-CD1 4.02Å; A268-L415 HydrophobicContact CB-CD2 4.08Å
269	M	98.3	Very high	97.3	Very high	62 Å²	62	19.6 Å²	19.6	31%	0.305	11%	0.11	S	C	.	.	H	α-helix	trans	-68.8	-39.5	175.5	-69.4	-69.3	-87.2	0	0	111.6	M265 W267 A272 G273 L412 L415 D416	M265-M269 WeakPolarHBondContact O-CB 3.49Å; M265-M269 VanDerWaalsContact O-CG 3.27Å; M265-M269 WeakPolarHBondContact O-CG 3.38Å; M265-M269 PolarHBondContact O-N 3.37Å; W267-M269 PolarHBondContact O-N 2.95Å; M269-A272 PolarHBondContact O-N 2.92Å; M269-G273 PolarHBondContact O-N 3.23Å; M269-L412 HydrophobicContact CE-CD2 4.06Å; M269-L412 HydrophobicContact SD-CD2 3.71Å; M269-L415 HydrophobicContact CG-CB 4.35Å; M269-L415 HydrophobicContact CG-CD1 4.39Å; M269-L415 HydrophobicContact SD-CB 3.4Å; M269-L415 WeakPolarHBondContact SD-CB 3.45Å; M269-L415 HydrophobicContact SD-CD1 3.81Å; M269-L415 HydrophobicContact SD-CG 4.28Å; M269-D416 HydrophobicContact CE-CB 4.39Å
270	G	98.3	Very high	97.3	Very high	5 Å²	5	25.2 Å²	25.2	5%	0.052	14%	0.139	C	C	.	.	H	α-helix	trans	-61.1	-49.8	176.2	0	0	0	0	0	113	N223 D266 W267 G273 G274	N223-G270 WeakPolarHBondContact CB-O 3.31Å; N223-G270 VanDerWaalsContact CG-CA 3.41Å; N223-G270 WeakPolarHBondContact ND2-CA 3.14Å; D266-G270 WeakPolarHBondContact O-CA 3.13Å; D266-G270 PolarHBondContact O-N 3.2Å; W267-G270 PolarHBondContact O-N 2.77Å; G270-G273 PolarHBondContact O-N 3.37Å; G270-G274 PolarHBondContact O-N 2.99Å
271	I	98.6	Very high	97.1	Very high	1 Å²	1	28.5 Å²	28.5	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-63.1	-46.9	176.2	-61.6	166	0	0	0	110.1	L249 W267 G273 G274 M275 M293 V301 F347 V350 M354	L249-I271 HydrophobicContact CD2-CD1 4.41Å; W267-I271 VanDerWaalsContact O-CG1 3.28Å; W267-I271 WeakPolarHBondContact O-CG1 3.33Å; W267-I271 PolarHBondContact O-N 3.06Å; I271-G273 VanDerWaalsContact C-N 3.3Å; I271-G273 PolarHBondContact O-N 2.92Å; I271-G274 PolarHBondContact O-N 2.92Å; I271-M275 HydrophobicContact CG2-CG 4.3Å; I271-M275 WeakPolarHBondContact O-CB 3.38Å; I271-M275 WeakPolarHBondContact O-CG 3.38Å; I271-M275 PolarHBondContact O-N 3Å; I271-M293 HydrophobicContact CD1-CG 4.03Å; I271-M293 HydrophobicContact CD1-SD 3.92Å; I271-M293 HydrophobicContact CG1-CG 4.49Å; I271-M293 HydrophobicContact CG1-SD 3.79Å; I271-M293 HydrophobicContact CG2-SD 3.91Å; I271-V301 HydrophobicContact CD1-CG2 4.06Å; I271-V301 HydrophobicContact CG1-CG1 4Å; I271-V301 HydrophobicContact CG1-CG2 3.71Å; I271-F347 HydrophobicContact CB-CD2 4.43Å; I271-F347 HydrophobicContact CB-CE2 4.23Å; I271-F347 HydrophobicContact CG2-CD2 3.77Å; I271-F347 HydrophobicContact CG2-CE2 4.08Å; I271-V350 HydrophobicContact CD1-CG1 3.94Å; I271-M354 HydrophobicContact CD1-CE 4.2Å; I271-M354 HydrophobicContact CD1-SD 4.35Å
272	A	98.6	Very high	96.9	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-64	-34.5	179.4	0	0	0	0	0	112.6	A268 M269 N276 F347 F408 I411 L412 L415	A268-A272 WeakPolarHBondContact O-CB 3.14Å; A268-A272 PolarHBondContact O-N 3.3Å; M269-A272 PolarHBondContact O-N 2.92Å; A272-N276 WeakPolarHBondContact O-CB 3.36Å; A272-N276 PolarHBondContact O-N 3Å; A272-F347 HydrophobicContact CB-CE2 4.19Å; A272-F347 HydrophobicContact CB-CZ 4.29Å; A272-F408 HydrophobicContact CB-CD1 4.05Å; A272-I411 HydrophobicContact CB-CG2 4Å; A272-L412 HydrophobicContact CB-CD2 3.71Å; A272-L412 HydrophobicContact CB-CG 3.98Å; A272-L415 HydrophobicContact CB-CD1 4.05Å
273	G	98.6	Very high	96.6	Very high	12 Å²	12	30.7 Å²	30.7	12%	0.124	15%	0.154	C	C	.	.	H	α-helix	trans	-66.3	-51.2	175.2	0	0	0	0	0	112.5	M269 G270 I271 M275 N276 Y277	M269-G273 PolarHBondContact O-N 3.23Å; G270-G273 PolarHBondContact O-N 3.37Å; I271-G273 VanDerWaalsContact C-N 3.3Å; I271-G273 PolarHBondContact O-N 2.92Å; G273-M275 PolarHBondContact O-N 3.24Å; G273-N276 WeakPolarHBondContact O-CB 3.38Å; G273-N276 PolarHBondContact O-N 2.55Å; G273-Y277 PolarHBondContact O-N 3.33Å
274	G	98	Very high	96.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-63.3	-40.3	177.2	0	0	0	0	0	112.6	H221 G270 I271 Y277 L278	H221-G274 VanDerWaalsContact CE1-CA 3.48Å; H221-G274 WeakPolarHBondContact CE1-CA 3.4Å; H221-G274 PolarHBondContact CE1-N 3.18Å; H221-G274 VanDerWaalsContact CE1-N 3.26Å; H221-G274 WeakPolarHBondContact ND1-CA 3.49Å; G270-G274 PolarHBondContact O-N 2.99Å; I271-G274 PolarHBondContact O-N 2.92Å; G274-Y277 WeakPolarHBondContact O-CB 3.37Å; G274-Y277 PolarHBondContact O-N 3.06Å; G274-L278 WeakPolarHBondContact O-CG 3.47Å; G274-L278 PolarHBondContact O-N 3.42Å
275	M	98.3	Very high	96.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-67.8	-36.7	174.2	-74.5	-55	-46.7	0	0	113.2	I271 G273 Y277 L278 H279 H285 L288 I303 D343 F408	I271-M275 HydrophobicContact CG2-CG 4.3Å; I271-M275 WeakPolarHBondContact O-CB 3.38Å; I271-M275 WeakPolarHBondContact O-CG 3.38Å; I271-M275 PolarHBondContact O-N 3Å; G273-M275 PolarHBondContact O-N 3.24Å; M275-Y277 VanDerWaalsContact C-N 3.33Å; M275-L278 HydrophobicContact CE-CD1 4.3Å; M275-L278 PolarHBondContact O-N 2.86Å; M275-L278 HydrophobicContact SD-CD1 3.73Å; M275-H279 WeakPolarHBondContact CE-NE2 3.17Å; M275-H279 PolarHBondContact O-N 3.13Å; M275-H285 HydrophobicContact CE-CB 3.88Å; M275-H285 HydrophobicContact SD-CB 4.09Å; M275-L288 HydrophobicContact CG-CD1 4.36Å; M275-L288 HydrophobicContact CG-CD2 4.07Å; M275-L288 HydrophobicContact SD-CD1 3.92Å; M275-L288 HydrophobicContact SD-CD2 4.12Å; M275-I303 HydrophobicContact CG-CD1 3.8Å; M275-I303 HydrophobicContact SD-CD1 4Å; M275-D343 HydrophobicContact CE-CB 3.69Å; M275-D343 WeakPolarHBondContact CE-OD2 3.4Å; M275-F408 HydrophobicContact CB-CD1 3.73Å; M275-F408 HydrophobicContact CB-CD2 3.55Å; M275-F408 HydrophobicContact CB-CE1 3.62Å; M275-F408 HydrophobicContact CB-CE2 3.45Å; M275-F408 VanDerWaalsContact CB-CE2 3.45Å; M275-F408 HydrophobicContact CB-CG 3.71Å; M275-F408 HydrophobicContact CB-CZ 3.48Å; M275-F408 VanDerWaalsContact CB-CZ 3.48Å; M275-F408 HydrophobicContact CE-CE2 3.85Å; M275-F408 HydrophobicContact CE-CZ 4.27Å; M275-F408 HydrophobicContact CG-CE1 4.03Å; M275-F408 HydrophobicContact CG-CE2 4.04Å; M275-F408 HydrophobicContact CG-CZ 3.72Å
276	N	98.3	Very high	95.7	Very high	37 Å²	37	31.1 Å²	31.1	20%	0.198	15%	0.154	C	C	.	.	H	α-helix	trans	-61.2	-42.5	171.2	-177.9	68.9	0	0	0	111.5	A272 G273 H279 L280 F408 R409 L412	A272-N276 WeakPolarHBondContact O-CB 3.36Å; A272-N276 PolarHBondContact O-N 3Å; G273-N276 WeakPolarHBondContact O-CB 3.38Å; G273-N276 PolarHBondContact O-N 2.55Å; N276-H279 PolarHBondContact O-N 3.14Å; N276-L280 WeakPolarHBondContact O-CB 3.38Å; N276-L280 VanDerWaalsContact O-CG 3.24Å; N276-L280 WeakPolarHBondContact O-CG 3.22Å; N276-L280 PolarHBondContact O-N 2.9Å; N276-F408 HydrophobicContact CB-CB 3.66Å; N276-R409 PolarHBondContact OD1-N 3.09Å; N276-L412 HydrophobicContact CB-CD1 4.07Å
277	Y	97.2	Very high	95.3	Very high	47 Å²	47	27.6 Å²	27.6	18%	0.184	14%	0.135	C	C	.	.	H	α-helix	trans	-59.8	-45.1	174.6	178.2	-84.2	0	0	0	111.7	L219 K220 H221 I224 G273 G274 M275 L280 H281	L219-Y277 HydrophobicContact CB-CE1 4.13Å; L219-Y277 HydrophobicContact CD2-CE1 3.82Å; K220-Y277 PolarHBondContact N-OH 3.17Å; K220-Y277 WeakPolarHBondContact O-CE2 3.39Å; K220-Y277 PolarHBondContact O-OH 2.83Å; H221-Y277 HydrophobicContact CB-CD1 4.09Å; H221-Y277 HydrophobicContact CB-CD2 4.16Å; H221-Y277 HydrophobicContact CB-CE1 4.34Å; H221-Y277 HydrophobicContact CB-CE2 4.4Å; H221-Y277 HydrophobicContact CB-CG 3.99Å; H221-Y277 AromaticContact CD2-CD2 3.87Å; H221-Y277 AromaticContact CD2-CG 3.92Å; I224-Y277 HydrophobicContact CD1-CD1 3.52Å; I224-Y277 HydrophobicContact CD1-CE1 4.08Å; I224-Y277 HydrophobicContact CD1-CG 4.34Å; G273-Y277 PolarHBondContact O-N 3.33Å; G274-Y277 WeakPolarHBondContact O-CB 3.37Å; G274-Y277 PolarHBondContact O-N 3.06Å; M275-Y277 VanDerWaalsContact C-N 3.33Å; Y277-L280 PolarHBondContact O-N 3.28Å; Y277-H281 AromaticContact CD1-ND1 3.72Å; Y277-H281 AromaticContact CD2-CE1 3.82Å; Y277-H281 AromaticContact CE1-CE1 3.73Å; Y277-H281 AromaticContact CE1-ND1 3.6Å; Y277-H281 AromaticContact CE2-CE1 3.39Å; Y277-H281 WeakPolarHBondContact CE2-CE1 3.35Å; Y277-H281 AromaticContact CE2-ND1 3.96Å; Y277-H281 AromaticContact CG-ND1 3.96Å; Y277-H281 AromaticContact CZ-CE1 3.34Å; Y277-H281 AromaticContact CZ-ND1 3.72Å; Y277-H281 PolarHBondContact O-N 3.31Å; Y277-H281 VanDerWaalsContact O-N 3.1Å; Y277-H281 PolarHBondContact O-ND1 3.48Å
278	L	94.8	Very high	95.1	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-62.6	-46.5	177.7	-71.3	161.8	0	0	0	112.7	L219 I224 G274 M275 L280 H281 K282 I283 I303 F306	L219-L278 HydrophobicContact CD1-CD2 3.91Å; I224-L278 HydrophobicContact CD1-CD1 4.14Å; I224-L278 HydrophobicContact CD1-CD2 3.96Å; I224-L278 HydrophobicContact CD1-CG 3.74Å; G274-L278 WeakPolarHBondContact O-CG 3.47Å; G274-L278 PolarHBondContact O-N 3.42Å; M275-L278 HydrophobicContact CE-CD1 4.3Å; M275-L278 PolarHBondContact O-N 2.86Å; M275-L278 HydrophobicContact SD-CD1 3.73Å; L278-L280 VanDerWaalsContact C-N 3.33Å; L278-L280 PolarHBondContact O-N 3.19Å; L278-H281 CarbonylContact O-C 3.53Å; L278-H281 WeakPolarHBondContact O-CA 3.48Å; L278-H281 PolarHBondContact O-N 2.89Å; L278-H281 VanDerWaalsContact O-N 3.11Å; L278-K282 PolarHBondContact O-N 3.44Å; L278-K282 VanDerWaalsContact O-N 3.1Å; L278-I283 CarbonylContact C-O 3.6Å; L278-I283 HydrophobicContact CB-CB 4.49Å; L278-I283 HydrophobicContact CD2-CB 4.22Å; L278-I283 HydrophobicContact CD2-CD1 4.37Å; L278-I283 HydrophobicContact CD2-CG2 4.17Å; L278-I283 PolarHBondContact O-N 2.79Å; L278-I303 HydrophobicContact CD1-CD1 4.38Å; L278-I303 HydrophobicContact CD1-CG2 4.21Å; L278-F306 HydrophobicContact CD1-CE1 3.61Å; L278-F306 HydrophobicContact CD1-CZ 3.93Å; L278-F306 HydrophobicContact CD2-CD1 4.41Å; L278-F306 HydrophobicContact CD2-CE1 3.5Å; L278-F306 HydrophobicContact CD2-CZ 4.04Å; L278-F306 HydrophobicContact CG-CE1 4.21Å
279	H	95.1	Very high	94.9	Very high	15 Å²	15	28.3 Å²	28.3	7%	0.069	14%	0.138	C	C	.	.	H	α-helix	trans	-66.4	-33.8	179.5	-74.3	-165.3	0	0	0	112.6	M275 N276 H281 K282 I283 E340 D343 F408	M275-H279 WeakPolarHBondContact CE-NE2 3.17Å; M275-H279 PolarHBondContact O-N 3.13Å; N276-H279 PolarHBondContact O-N 3.14Å; H279-H281 VanDerWaalsContact C-N 3.35Å; H279-K282 PolarHBondContact O-N 3.23Å; H279-K282 VanDerWaalsContact O-N 3.14Å; H279-I283 PolarHBondContact CD2-O 3.04Å; H279-E340 PolarHBondContact CE1-O 2.78Å; H279-D343 IonicContact CD2-OD2 3.73Å; H279-D343 IonicContact CE1-OD2 2.79Å; H279-D343 IonicContact NE2-OD2 2.78Å; H279-D343 PolarHBondContact NE2-OD2 3.5Å; H279-F408 AromaticContact CE1-CD2 3.52Å; H279-F408 AromaticContact CE1-CE2 3.38Å; H279-F408 WeakPolarHBondContact CE1-CE2 3.32Å; H279-F408 AromaticContact ND1-CD2 3.48Å; H279-F408 WeakPolarHBondContact ND1-CD2 3.11Å; H279-F408 AromaticContact ND1-CE2 3.87Å; H279-F408 AromaticContact NE2-CE2 3.92Å
280	L	95.1	Very high	94.7	Very high	120 Å²	120	25.4 Å²	25.4	63%	0.628	12%	0.124	S	C	*	.	H	α-helix	trans	-64.4	-38.6	170.9	-73.2	170.1	0	0	0	111.9	N276 Y277 L278 K282	N276-L280 WeakPolarHBondContact O-CB 3.38Å; N276-L280 VanDerWaalsContact O-CG 3.24Å; N276-L280 WeakPolarHBondContact O-CG 3.22Å; N276-L280 PolarHBondContact O-N 2.9Å; Y277-L280 PolarHBondContact O-N 3.28Å; L278-L280 VanDerWaalsContact C-N 3.33Å; L278-L280 PolarHBondContact O-N 3.19Å; L280-K282 PolarHBondContact O-N 2.98Å
281	H	92	Very high	94.4	Very high	100 Å²	100	26.4 Å²	26.4	46%	0.463	13%	0.13	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	9.4	172.4	-69.1	86.6	0	0	0	114	L219 Y277 L278 H279 I283	L219-H281 HydrophobicContact CD2-CB 4.27Å; Y277-H281 AromaticContact CD1-ND1 3.72Å; Y277-H281 AromaticContact CD2-CE1 3.82Å; Y277-H281 AromaticContact CE1-CE1 3.73Å; Y277-H281 AromaticContact CE1-ND1 3.6Å; Y277-H281 AromaticContact CE2-CE1 3.39Å; Y277-H281 WeakPolarHBondContact CE2-CE1 3.35Å; Y277-H281 AromaticContact CE2-ND1 3.96Å; Y277-H281 AromaticContact CG-ND1 3.96Å; Y277-H281 AromaticContact CZ-CE1 3.34Å; Y277-H281 AromaticContact CZ-ND1 3.72Å; Y277-H281 PolarHBondContact O-N 3.31Å; Y277-H281 VanDerWaalsContact O-N 3.1Å; Y277-H281 PolarHBondContact O-ND1 3.48Å; L278-H281 CarbonylContact O-C 3.53Å; L278-H281 WeakPolarHBondContact O-CA 3.48Å; L278-H281 PolarHBondContact O-N 2.89Å; L278-H281 VanDerWaalsContact O-N 3.11Å; H279-H281 VanDerWaalsContact C-N 3.35Å; H281-I283 VanDerWaalsContact C-N 3.29Å; H281-I283 PolarHBondContact O-N 2.82Å
282	K	91.4	Very high	94.2	Very high	110 Å²	110	26.6 Å²	26.6	48%	0.478	13%	0.131	S	C	.	.	T	Hydrogen-bonded Turn	trans	61	30.1	178.6	-58.4	-57	178	-166.3	0	114.9	L278 H279 L280 E311 L312	L278-K282 PolarHBondContact O-N 3.44Å; L278-K282 VanDerWaalsContact O-N 3.1Å; H279-K282 PolarHBondContact O-N 3.23Å; H279-K282 VanDerWaalsContact O-N 3.14Å; L280-K282 PolarHBondContact O-N 2.98Å; K282-E311 CarbonylContact O-C 3.51Å; K282-E311 WeakPolarHBondContact O-CA 3.33Å; K282-L312 HydrophobicContact CB-CB 4.08Å; K282-L312 WeakPolarHBondContact O-CB 3.39Å; K282-L312 PolarHBondContact O-N 2.67Å
283	I	90.3	Very high	94.1	Very high	7 Å²	7	26.6 Å²	26.6	4%	0.036	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	126.8	172.1	-60.3	177.3	0	0	0	109.2	L216 L219 L278 H279 H281	L216-I283 HydrophobicContact CD2-CD1 4.19Å; L219-I283 HydrophobicContact CD1-CD1 3.66Å; L219-I283 HydrophobicContact CD2-CD1 3.76Å; L219-I283 HydrophobicContact CG-CD1 4.23Å; L278-I283 CarbonylContact C-O 3.6Å; L278-I283 HydrophobicContact CB-CB 4.49Å; L278-I283 HydrophobicContact CD2-CB 4.22Å; L278-I283 HydrophobicContact CD2-CD1 4.37Å; L278-I283 HydrophobicContact CD2-CG2 4.17Å; L278-I283 PolarHBondContact O-N 2.79Å; H279-I283 PolarHBondContact CD2-O 3.04Å; H281-I283 VanDerWaalsContact C-N 3.29Å; H281-I283 PolarHBondContact O-N 2.82Å
284	I	91.2	Very high	93.9	Very high	6 Å²	6	27.6 Å²	27.6	3%	0.031	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	130.2	168.3	-48.5	172.4	0	0	0	107.5	R286 S309 K310 L312 V342 D343	I284-R286 HydrophobicContact CB-CG 3.97Å; I284-R286 HydrophobicContact CG2-CG 3.57Å; I284-S309 VanDerWaalsContact O-CA 3.26Å; I284-S309 WeakPolarHBondContact O-CA 3.48Å; I284-S309 VanDerWaalsContact O-CB 3.32Å; I284-S309 WeakPolarHBondContact O-CB 3.49Å; I284-K310 PolarHBondContact N-O 2.88Å; I284-K310 PolarHBondContact O-N 2.75Å; I284-L312 HydrophobicContact CD1-CD1 4.04Å; I284-L312 HydrophobicContact CD1-CG 4.47Å; I284-L312 HydrophobicContact CG1-CD1 4.16Å; I284-V342 HydrophobicContact CG2-CG2 3.98Å; I284-D343 WeakPolarHBondContact CG2-OD2 3.37Å
285	H	92.1	Very high	93.9	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.133	C	C	.	.			trans	-72.9	-41	-177.8	-170.6	-27.1	0	0	0	112.1	M275 D287 L288 I303 S304 D305 T308 S309 D343	M275-H285 HydrophobicContact CE-CB 3.88Å; M275-H285 HydrophobicContact SD-CB 4.09Å; H285-D287 PolarHBondContact CE1-O 3.45Å; H285-D287 PolarHBondContact O-N 2.91Å; H285-L288 HydrophobicContact CB-CB 4.46Å; H285-I303 WeakPolarHBondContact NE2-CG2 3.49Å; H285-S304 PolarHBondContact CE1-O 2.95Å; H285-S304 PolarHBondContact NE2-O 3.43Å; H285-D305 PolarHBondContact CE1-O 2.95Å; H285-D305 VanDerWaalsContact CE1-O 3.25Å; H285-T308 PolarHBondContact O-OG1 2.9Å; H285-S309 WeakPolarHBondContact CA-OG 3.34Å; H285-S309 PolarHBondContact O-OG 2.94Å; H285-D343 PolarHBondContact N-OD1 3.48Å; H285-D343 PolarHBondContact N-OD2 3.26Å
286	R	89.8	Confident	93.8	Very high	26 Å²	26	27.9 Å²	27.9	10%	0.098	14%	0.135	C	C	.	.	S	Bend	trans	67.9	-25.1	174.8	-56.8	172.5	172.4	-136.2	4.9	117	I284 T308 T317 M319 D343	I284-R286 HydrophobicContact CB-CG 3.97Å; I284-R286 HydrophobicContact CG2-CG 3.57Å; R286-T308 WeakPolarHBondContact CD-O 3.43Å; R286-T317 PolarHBondContact NH2-OG1 2.95Å; R286-M319 HydrophobicContact CB-CE 3.97Å; R286-M319 PolarHBondContact NH1-SD 3.11Å; R286-D343 PolarHBondContact N-OD1 2.74Å
287	D	88.6	Confident	93.6	Very high	30 Å²	30	35.9 Å²	35.9	16%	0.16	16%	0.164	C	C	.	.			trans	-126.8	47.7	174.7	-171.6	37.1	0	0	0	110.7	H285 K289 N292 T308	H285-D287 PolarHBondContact CE1-O 3.45Å; H285-D287 PolarHBondContact O-N 2.91Å; D287-K289 PolarHBondContact O-N 2.95Å; D287-K289 WeakPolarHBondContact OD1-CE 3.36Å; D287-K289 IonicContact OD1-NZ 3.45Å; D287-K289 PolarHBondContact OD1-NZ 3.44Å; D287-K289 WeakPolarHBondContact OD2-CE 3.49Å; D287-K289 IonicContact OD2-NZ 3.6Å; D287-K289 PolarHBondContact OD2-NZ 3.04Å; D287-N292 PolarHBondContact O-ND2 3.39Å; D287-N292 PolarHBondContact OD2-ND2 2.88Å; D287-T308 HydrophobicContact CB-CG2 4.38Å; D287-T308 VanDerWaalsContact CB-OG1 3.23Å; D287-T308 WeakPolarHBondContact CB-OG1 3.46Å
288	L	94.5	Very high	93.5	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	19%	0.186	C	C	.	.			trans	-74.5	121	176.7	-176.9	69.2	0	0	0	109.7	M275 H285 M293 D343 S346 F347 F408	M275-L288 HydrophobicContact CG-CD1 4.36Å; M275-L288 HydrophobicContact CG-CD2 4.07Å; M275-L288 HydrophobicContact SD-CD1 3.92Å; M275-L288 HydrophobicContact SD-CD2 4.12Å; H285-L288 HydrophobicContact CB-CB 4.46Å; L288-M293 HydrophobicContact CD1-CE 3.4Å; L288-M293 HydrophobicContact CD1-SD 3.9Å; L288-D343 HydrophobicContact CD2-CB 4.31Å; L288-D343 WeakPolarHBondContact CD2-O 3.39Å; L288-S346 VanDerWaalsContact O-CB 3.23Å; L288-S346 WeakPolarHBondContact O-CB 3.5Å; L288-F347 HydrophobicContact CD2-CB 3.96Å; L288-F408 HydrophobicContact CD2-CZ 4.36Å
289	K	93.9	Very high	93.5	Very high	15 Å²	15	41.9 Å²	41.9	7%	0.065	20%	0.199	C	C	.	.			trans	-164	161.1	-178.3	57.7	-179.7	178.3	-136.9	0	111.4	D287 P291 N292 M293 W327	D287-K289 PolarHBondContact O-N 2.95Å; D287-K289 WeakPolarHBondContact OD1-CE 3.36Å; D287-K289 IonicContact OD1-NZ 3.45Å; D287-K289 PolarHBondContact OD1-NZ 3.44Å; D287-K289 WeakPolarHBondContact OD2-CE 3.49Å; D287-K289 IonicContact OD2-NZ 3.6Å; D287-K289 PolarHBondContact OD2-NZ 3.04Å; K289-P291 HydrophobicContact CD-CB 4.39Å; K289-P291 HydrophobicContact CD-CG 4.25Å; K289-P291 HydrophobicContact CG-CB 4.41Å; K289-P291 HydrophobicContact CG-CG 4.39Å; K289-N292 WeakPolarHBondContact CE-ND2 3.37Å; K289-N292 WeakPolarHBondContact CE-OD1 3.32Å; K289-N292 HydrophobicContact CG-CB 4.05Å; K289-N292 WeakPolarHBondContact O-CA 3.33Å; K289-N292 PolarHBondContact O-N 3.21Å; K289-M293 PolarHBondContact O-N 2.86Å; K289-W327 HydrophobicContact CB-CB 4.15Å; K289-W327 HydrophobicContact CB-CD2 3.74Å; K289-W327 HydrophobicContact CB-CE3 4.48Å; K289-W327 HydrophobicContact CB-CG 3.56Å
290	S	94.8	Very high	93.6	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-26.4	-178.9	58.6	0	0	0	0	115.2	L249 Y250 N292 M293 W327 E353	L249-S290 PolarHBondContact N-O 3.06Å; Y250-S290 PolarHBondContact N-O 3.31Å; S290-N292 VanDerWaalsContact C-N 3.28Å; S290-N292 PolarHBondContact O-N 2.96Å; S290-M293 PolarHBondContact O-N 3.08Å; S290-W327 WeakPolarHBondContact OG-CZ2 3.4Å; S290-E353 WeakPolarHBondContact CB-OE1 3.45Å; S290-E353 WeakPolarHBondContact CB-OE2 3.45Å; S290-E353 VanDerWaalsContact OG-CD 3.22Å; S290-E353 PolarHBondContact OG-OE1 2.91Å; S290-E353 PolarHBondContact OG-OE2 2.89Å
291	P	91.8	Very high	93.8	Very high	26 Å²	26	37 Å²	37	17%	0.169	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-25.5	166.1	-28.9	37.4	0	0	0	115.4	Q248 Y250 K289	Q248-P291 WeakPolarHBondContact CG-O 3.21Å; Q248-P291 PolarHBondContact OE1-O 3.11Å; Y250-P291 HydrophobicContact CD1-CG 4.46Å; Y250-P291 HydrophobicContact CD2-CG 4.43Å; Y250-P291 HydrophobicContact CG-CG 4.02Å; K289-P291 HydrophobicContact CD-CB 4.39Å; K289-P291 HydrophobicContact CD-CG 4.25Å; K289-P291 HydrophobicContact CG-CB 4.41Å; K289-P291 HydrophobicContact CG-CG 4.39Å
292	N	93.7	Very high	94	Very high	5 Å²	5	33.2 Å²	33.2	3%	0.027	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-8.6	-179.8	-72.9	-1.2	0	0	0	112.3	Q187 D287 K289 S290 S304 D305	Q187-N292 PolarHBondContact NE2-OD1 3.3Å; D287-N292 PolarHBondContact O-ND2 3.39Å; D287-N292 PolarHBondContact OD2-ND2 2.88Å; K289-N292 WeakPolarHBondContact CE-ND2 3.37Å; K289-N292 WeakPolarHBondContact CE-OD1 3.32Å; K289-N292 HydrophobicContact CG-CB 4.05Å; K289-N292 WeakPolarHBondContact O-CA 3.33Å; K289-N292 PolarHBondContact O-N 3.21Å; S290-N292 VanDerWaalsContact C-N 3.28Å; S290-N292 PolarHBondContact O-N 2.96Å; N292-S304 WeakPolarHBondContact O-CA 3.41Å; N292-S304 WeakPolarHBondContact O-CB 3.37Å; N292-S304 PolarHBondContact O-N 3.28Å; N292-D305 HydrophobicContact CB-CB 4.42Å
293	M	96.3	Very high	94.3	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	123.7	168.3	-54.4	-62.2	84.3	0	0	108.6	Q248 L249 I271 L288 K289 S290 V301 I303 V350	Q248-M293 WeakPolarHBondContact CA-O 3.32Å; L249-M293 HydrophobicContact CB-CB 3.85Å; L249-M293 HydrophobicContact CD2-CB 3.97Å; L249-M293 HydrophobicContact CD2-CG 4.19Å; L249-M293 PolarHBondContact N-O 2.99Å; I271-M293 HydrophobicContact CD1-CG 4.03Å; I271-M293 HydrophobicContact CD1-SD 3.92Å; I271-M293 HydrophobicContact CG1-CG 4.49Å; I271-M293 HydrophobicContact CG1-SD 3.79Å; I271-M293 HydrophobicContact CG2-SD 3.91Å; L288-M293 HydrophobicContact CD1-CE 3.4Å; L288-M293 HydrophobicContact CD1-SD 3.9Å; K289-M293 PolarHBondContact O-N 2.86Å; S290-M293 PolarHBondContact O-N 3.08Å; M293-V301 HydrophobicContact CB-CG2 4.23Å; M293-I303 HydrophobicContact CE-CB 4.12Å; M293-I303 HydrophobicContact CE-CG1 3.97Å; M293-I303 HydrophobicContact CE-CG2 3.99Å; M293-I303 HydrophobicContact SD-CG1 3.92Å; M293-V350 HydrophobicContact CG-CG1 4.41Å
294	L	95.7	Very high	94.3	Very high	33 Å²	33	28.1 Å²	28.1	17%	0.173	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	149	177.8	-54.9	-179.3	0	0	0	110.9	I225 C244 G247 Q248 V301 K302	I225-L294 HydrophobicContact CD1-CD1 4.13Å; C244-L294 HydrophobicContact CB-CB 3.67Å; C244-L294 HydrophobicContact CB-CD1 4.26Å; G247-L294 CarbonylContact O-C 3.42Å; G247-L294 VanDerWaalsContact O-CA 3.22Å; G247-L294 WeakPolarHBondContact O-CA 3.28Å; Q248-L294 HydrophobicContact CB-CD2 4.44Å; Q248-L294 HydrophobicContact CG-CD2 3.85Å; L294-V301 CarbonylContact O-C 3.56Å; L294-V301 WeakPolarHBondContact O-CA 3.31Å; L294-K302 HydrophobicContact CB-CB 4.33Å; L294-K302 PolarHBondContact N-O 2.68Å; L294-K302 PolarHBondContact O-N 2.71Å
295	I	97.1	Very high	93.9	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	128.7	179.9	-52.9	-60	0	0	0	109.4	C244 Q246 G247 L249 V252 W267 V301	C244-I295 CarbonylContact C-O 3.34Å; C244-I295 WeakPolarHBondContact CB-O 3.26Å; Q246-I295 HydrophobicContact CB-CB 3.86Å; Q246-I295 HydrophobicContact CB-CG2 3.9Å; Q246-I295 WeakPolarHBondContact CB-O 3.38Å; Q246-I295 HydrophobicContact CG-CG2 4.39Å; Q246-I295 PolarHBondContact N-O 3.32Å; Q246-I295 VanDerWaalsContact N-O 3.09Å; G247-I295 PolarHBondContact O-N 3.38Å; L249-I295 HydrophobicContact CB-CD1 4.32Å; L249-I295 HydrophobicContact CB-CG1 4.29Å; L249-I295 HydrophobicContact CD1-CD1 4.28Å; V252-I295 HydrophobicContact CG2-CG1 4.32Å; W267-I295 HydrophobicContact CD2-CD1 4.18Å; W267-I295 HydrophobicContact CH2-CD1 4.34Å; W267-I295 HydrophobicContact CH2-CG1 4.47Å; W267-I295 HydrophobicContact CZ2-CD1 3.86Å; W267-I295 HydrophobicContact CZ2-CG1 4.21Å; W267-I295 HydrophobicContact CZ2-CG2 3.98Å; I295-V301 HydrophobicContact CD1-CB 3.94Å; I295-V301 HydrophobicContact CD1-CG2 3.87Å
296	T	95.9	Very high	93.1	Very high	7 Å²	7	28.8 Å²	28.8	4%	0.043	14%	0.143	C	C	.	.			trans	-78.5	180	179.1	62.4	0	0	0	0	112.2	Q246 D298 A300 K302	Q246-T296 PolarHBondContact NE2-O 2.83Å; T296-D298 VanDerWaalsContact C-N 3.33Å; T296-D298 WeakPolarHBondContact CB-OD1 3.4Å; T296-D298 PolarHBondContact OG1-OD1 2.83Å; T296-A300 HydrophobicContact CG2-CB 4.38Å; T296-A300 PolarHBondContact N-O 3.14Å; T296-A300 WeakPolarHBondContact OG1-CB 3.26Å; T296-A300 PolarHBondContact OG1-N 3.05Å; T296-A300 PolarHBondContact OG1-O 3.46Å; T296-K302 HydrophobicContact CG2-CD 4.43Å; T296-K302 HydrophobicContact CG2-CG 3.79Å
297	Y	94.1	Very high	92	Very high	204 Å²	204	30.9 Å²	30.9	80%	0.8	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-39.1	173.1	-178.9	-96.7	0	0	0	111.9	D299	Y297-D299 VanDerWaalsContact C-N 3.26Å; Y297-D299 PolarHBondContact O-N 3.17Å
298	D	95.1	Very high	90.8	Very high	121 Å²	121	31.8 Å²	31.8	65%	0.647	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.6	25.9	-179.6	62.5	-47.2	0	0	0	114	T296 A300	T296-D298 VanDerWaalsContact C-N 3.33Å; T296-D298 WeakPolarHBondContact CB-OD1 3.4Å; T296-D298 PolarHBondContact OG1-OD1 2.83Å; D298-A300 PolarHBondContact O-N 2.88Å
299	D	95.9	Very high	89.8	Confident	53 Å²	53	32.1 Å²	32.1	28%	0.283	18%	0.182	S	C	.	.	S	Bend	trans	60.1	10.3	178.2	-82.2	-26.7	0	0	0	116.9	Q246 R257 L263 W267 Y297	Q246-D299 PolarHBondContact NE2-OD1 3.02Å; R257-D299 IonicContact CZ-OD1 3.38Å; R257-D299 VanDerWaalsContact CZ-OD1 3.24Å; R257-D299 IonicContact CZ-OD2 2.7Å; R257-D299 IonicContact NH1-OD1 3.84Å; R257-D299 PolarHBondContact NH1-OD1 2.89Å; R257-D299 IonicContact NH1-OD2 3.55Å; R257-D299 IonicContact NH2-OD1 2.72Å; R257-D299 PolarHBondContact NH2-OD1 3.13Å; R257-D299 IonicContact NH2-OD2 2.71Å; R257-D299 PolarHBondContact NH2-OD2 3.26Å; L263-D299 HydrophobicContact CD1-CB 3.94Å; W267-D299 PolarHBondContact NE1-O 3.23Å; Y297-D299 VanDerWaalsContact C-N 3.26Å; Y297-D299 PolarHBondContact O-N 3.17Å
300	A	96.9	Very high	88.5	Confident	30 Å²	30	36.3 Å²	36.3	25%	0.248	20%	0.2	C	C	.	.			trans	-73.9	134.6	174.2	0	0	0	0	0	111.6	T296 D298	T296-A300 HydrophobicContact CG2-CB 4.38Å; T296-A300 PolarHBondContact N-O 3.14Å; T296-A300 WeakPolarHBondContact OG1-CB 3.26Å; T296-A300 PolarHBondContact OG1-N 3.05Å; T296-A300 PolarHBondContact OG1-O 3.46Å; D298-A300 PolarHBondContact O-N 2.88Å
301	V	98	Very high	87.2	Confident	2 Å²	2	41.2 Å²	41.2	1%	0.012	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	136.9	174.7	66	0	0	0	0	111.8	N223 W267 I271 M293 L294 I295	N223-V301 VanDerWaalsContact CA-O 3.25Å; N223-V301 WeakPolarHBondContact CA-O 3.32Å; N223-V301 WeakPolarHBondContact CB-O 3.31Å; N223-V301 PolarHBondContact ND2-O 2.79Å; W267-V301 HydrophobicContact CB-CG1 4.39Å; W267-V301 HydrophobicContact CG-CB 4.28Å; I271-V301 HydrophobicContact CD1-CG2 4.06Å; I271-V301 HydrophobicContact CG1-CG1 4Å; I271-V301 HydrophobicContact CG1-CG2 3.71Å; M293-V301 HydrophobicContact CB-CG2 4.23Å; L294-V301 CarbonylContact O-C 3.56Å; L294-V301 WeakPolarHBondContact O-CA 3.31Å; I295-V301 HydrophobicContact CD1-CB 3.94Å; I295-V301 HydrophobicContact CD1-CG2 3.87Å
302	K	97.4	Very high	85.7	Confident	20 Å²	20	43.2 Å²	43.2	9%	0.087	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	122.3	-177.9	-62.1	-72.6	-174.3	161.1	0	110.8	P222 I225 E242 L294 T296	P222-K302 VanDerWaalsContact O-CD 3.32Å; P222-K302 WeakPolarHBondContact O-CD 3.33Å; P222-K302 VanDerWaalsContact O-CE 3.31Å; P222-K302 WeakPolarHBondContact O-CE 3.25Å; P222-K302 PolarHBondContact O-NZ 2.82Å; I225-K302 HydrophobicContact CD1-CB 4.04Å; I225-K302 HydrophobicContact CD1-CG 4.36Å; E242-K302 WeakPolarHBondContact OE1-CE 3.32Å; E242-K302 IonicContact OE1-NZ 2.82Å; E242-K302 PolarHBondContact OE1-NZ 3.04Å; E242-K302 WeakPolarHBondContact OE2-CE 3.36Å; E242-K302 IonicContact OE2-NZ 2.68Å; E242-K302 PolarHBondContact OE2-NZ 3.4Å; L294-K302 HydrophobicContact CB-CB 4.33Å; L294-K302 PolarHBondContact N-O 2.68Å; L294-K302 PolarHBondContact O-N 2.71Å; T296-K302 HydrophobicContact CG2-CD 4.43Å; T296-K302 HydrophobicContact CG2-CG 3.79Å
303	I	96.6	Very high	83.7	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	124.8	170.3	-63.7	163.9	0	0	0	109.1	N223 I225 M275 L278 H285 M293 F306	N223-I303 WeakPolarHBondContact O-CB 3.34Å; N223-I303 WeakPolarHBondContact O-CG1 3.32Å; N223-I303 PolarHBondContact O-N 2.91Å; I225-I303 WeakPolarHBondContact CB-O 3.4Å; I225-I303 PolarHBondContact N-O 3.39Å; M275-I303 HydrophobicContact CG-CD1 3.8Å; M275-I303 HydrophobicContact SD-CD1 4Å; L278-I303 HydrophobicContact CD1-CD1 4.38Å; L278-I303 HydrophobicContact CD1-CG2 4.21Å; H285-I303 WeakPolarHBondContact NE2-CG2 3.49Å; M293-I303 HydrophobicContact CE-CB 4.12Å; M293-I303 HydrophobicContact CE-CG1 3.97Å; M293-I303 HydrophobicContact CE-CG2 3.99Å; M293-I303 HydrophobicContact SD-CG1 3.92Å; I303-F306 HydrophobicContact CG2-CE1 4.3Å; I303-F306 HydrophobicContact CG2-CE2 4.37Å; I303-F306 HydrophobicContact CG2-CZ 3.71Å
304	S	91.8	Very high	81.3	Confident	10 Å²	10	56.9 Å²	56.9	7%	0.07	31%	0.305	C	S	.	.			trans	-134	179.4	-178.1	-163.7	0	0	0	0	112.1	H285 N292	H285-S304 PolarHBondContact CE1-O 2.95Å; H285-S304 PolarHBondContact NE2-O 3.43Å; N292-S304 WeakPolarHBondContact O-CA 3.41Å; N292-S304 WeakPolarHBondContact O-CB 3.37Å; N292-S304 PolarHBondContact O-N 3.28Å
305	D	82.3	Confident	78.8	Confident	12 Å²	12	63.9 Å²	63.9	6%	0.064	33%	0.334	C	S	.	.			trans	51	75.9	-169.9	-166.7	56.2	0	0	0	116.2	Q187 K203 H285 N292 G307	Q187-D305 WeakPolarHBondContact CG-OD2 3.41Å; Q187-D305 PolarHBondContact NE2-OD2 2.98Å; K203-D305 IonicContact NZ-OD1 3.83Å; K203-D305 PolarHBondContact NZ-OD1 2.95Å; H285-D305 PolarHBondContact CE1-O 2.95Å; H285-D305 VanDerWaalsContact CE1-O 3.25Å; N292-D305 HydrophobicContact CB-CB 4.42Å; D305-G307 PolarHBondContact O-N 3.16Å
306	F	75.1	Confident	76.5	Confident	9 Å²	9	67.1 Å²	67.1	4%	0.039	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-80.3	8.5	168.8	-65.5	-82.6	0	0	0	113.8	L216 I224 I225 F227 L278 I303 T308 S309	L216-F306 HydrophobicContact CD1-CB 3.36Å; L216-F306 HydrophobicContact CD1-CG 4.04Å; L216-F306 HydrophobicContact CD2-CB 4.17Å; L216-F306 HydrophobicContact CD2-CD1 4.44Å; L216-F306 HydrophobicContact CD2-CG 4.35Å; L216-F306 HydrophobicContact CG-CB 4.43Å; I224-F306 HydrophobicContact CG2-CE2 3.88Å; I224-F306 HydrophobicContact CG2-CZ 3.8Å; I225-F306 HydrophobicContact CG2-CD2 4.47Å; I225-F306 HydrophobicContact CG2-CE2 4.16Å; F227-F306 HydrophobicContact CE2-CD2 4.02Å; F227-F306 HydrophobicContact CE2-CE2 4.48Å; F227-F306 AromaticContact CZ-CD2 3.86Å; F227-F306 HydrophobicContact CZ-CD2 3.86Å; L278-F306 HydrophobicContact CD1-CE1 3.61Å; L278-F306 HydrophobicContact CD1-CZ 3.93Å; L278-F306 HydrophobicContact CD2-CD1 4.41Å; L278-F306 HydrophobicContact CD2-CE1 3.5Å; L278-F306 HydrophobicContact CD2-CZ 4.04Å; L278-F306 HydrophobicContact CG-CE1 4.21Å; I303-F306 HydrophobicContact CG2-CE1 4.3Å; I303-F306 HydrophobicContact CG2-CE2 4.37Å; I303-F306 HydrophobicContact CG2-CZ 3.71Å; F306-T308 PolarHBondContact O-N 3.42Å; F306-T308 VanDerWaalsContact O-N 3.11Å; F306-S309 WeakPolarHBondContact CA-OG 3.3Å; F306-S309 VanDerWaalsContact O-CB 3.28Å; F306-S309 WeakPolarHBondContact O-CB 3.08Å; F306-S309 PolarHBondContact O-N 2.72Å; F306-S309 PolarHBondContact O-OG 2.77Å
307	G	66.7	Low	74.2	Confident	70 Å²	70	68.8 Å²	68.8	72%	0.722	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-63.5	-19.2	-173.1	0	0	0	0	0	115.2	D305	D305-G307 PolarHBondContact O-N 3.16Å
308	T	64.1	Low	72	Confident	48 Å²	48	66.6 Å²	66.6	29%	0.294	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-105.4	-8.4	172.4	63.1	0	0	0	0	113.6	H285 R286 D287 F306	H285-T308 PolarHBondContact O-OG1 2.9Å; R286-T308 WeakPolarHBondContact CD-O 3.43Å; D287-T308 HydrophobicContact CB-CG2 4.38Å; D287-T308 VanDerWaalsContact CB-OG1 3.23Å; D287-T308 WeakPolarHBondContact CB-OG1 3.46Å; F306-T308 PolarHBondContact O-N 3.42Å; F306-T308 VanDerWaalsContact O-N 3.11Å
309	S	71.8	Confident	69.9	Low	10 Å²	10	62.8 Å²	62.8	7%	0.07	34%	0.34	C	S	.	.			trans	-68.4	151.4	-175.2	-57.6	0	0	0	0	111.8	I284 H285 F306	I284-S309 VanDerWaalsContact O-CA 3.26Å; I284-S309 WeakPolarHBondContact O-CA 3.48Å; I284-S309 VanDerWaalsContact O-CB 3.32Å; I284-S309 WeakPolarHBondContact O-CB 3.49Å; H285-S309 WeakPolarHBondContact CA-OG 3.34Å; H285-S309 PolarHBondContact O-OG 2.94Å; F306-S309 WeakPolarHBondContact CA-OG 3.3Å; F306-S309 VanDerWaalsContact O-CB 3.28Å; F306-S309 WeakPolarHBondContact O-CB 3.08Å; F306-S309 PolarHBondContact O-N 2.72Å; F306-S309 PolarHBondContact O-OG 2.77Å
310	K	68.6	Low	67.6	Low	103 Å²	103	65 Å²	65	45%	0.448	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.5	147.5	177.1	-59.2	-165.4	179.3	-160.8	0	111.7	I284 T317	I284-K310 PolarHBondContact N-O 2.88Å; I284-K310 PolarHBondContact O-N 2.75Å; K310-T317 HydrophobicContact CD-CG2 4.41Å
311	E	65.8	Low	65.4	Low	102 Å²	102	69.4 Å²	69.4	48%	0.477	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	144.5	162.4	-63.6	-177.6	177.9	0	0	110.7	K282 N313	K282-E311 CarbonylContact O-C 3.51Å; K282-E311 WeakPolarHBondContact O-CA 3.33Å; E311-N313 VanDerWaalsContact C-N 3.33Å; E311-N313 PolarHBondContact O-N 3.3Å
312	L	60.9	Low	62.5	Low	69 Å²	69	73.2 Å²	73.2	36%	0.361	41%	0.405	S	S	.	.			trans	-78.4	79.8	-175.2	-166.1	142.1	0	0	0	110.6	K282 I284	K282-L312 HydrophobicContact CB-CB 4.08Å; K282-L312 WeakPolarHBondContact O-CB 3.39Å; K282-L312 PolarHBondContact O-N 2.67Å; I284-L312 HydrophobicContact CD1-CD1 4.04Å; I284-L312 HydrophobicContact CD1-CG 4.47Å; I284-L312 HydrophobicContact CG1-CD1 4.16Å
313	N	52	Low	60.4	Low	124 Å²	124	74.2 Å²	74.2	66%	0.663	42%	0.421	S	S	*	.			trans	-79.7	142.4	167	-73.6	-38.5	0	0	0	110.7	E311 K315	E311-N313 VanDerWaalsContact C-N 3.33Å; E311-N313 PolarHBondContact O-N 3.3Å; N313-K315 PolarHBondContact O-N 2.84Å
314	D	46.2	Very low	59.1	Low	167 Å²	167	78 Å²	78	89%	0.893	45%	0.445	S	S	*	.	S	Bend	trans	-60.2	-6.7	-179	-62.3	-53.4	0	0	0	115	S316	D314-S316 PolarHBondContact O-N 2.92Å
315	K	43.4	Very low	58.9	Low	180 Å²	180	78 Å²	78	78%	0.783	44%	0.444	S	S	*	.	S	Bend	trans	-93.8	96.7	177.1	-67.8	-179.5	-178.6	175.2	0	110.8	N313 T317	N313-K315 PolarHBondContact O-N 2.84Å; K315-T317 PolarHBondContact O-N 3.06Å; K315-T317 PolarHBondContact O-OG1 3.37Å
316	S	48.4	Very low	59.3	Low	68 Å²	68	77.7 Å²	77.7	48%	0.476	44%	0.443	S	S	.	.			trans	-29.3	104.4	164.1	162.6	0	0	0	0	112.7	D314 P337	D314-S316 PolarHBondContact O-N 2.92Å; S316-P337 VanDerWaalsContact OG-CA 3.31Å; S316-P337 WeakPolarHBondContact OG-CA 3.18Å; S316-P337 VanDerWaalsContact OG-CB 3.26Å; S316-P337 WeakPolarHBondContact OG-CB 3.41Å; S316-P337 WeakPolarHBondContact OG-CG 3.43Å
317	T	47.2	Very low	60.3	Low	42 Å²	42	77.9 Å²	77.9	26%	0.258	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-91	121.5	-178.9	-27.2	0	0	0	0	110.2	R286 K310 K315	R286-T317 PolarHBondContact NH2-OG1 2.95Å; K310-T317 HydrophobicContact CD-CG2 4.41Å; K315-T317 PolarHBondContact O-N 3.06Å; K315-T317 PolarHBondContact O-OG1 3.37Å
318	K	47.5	Very low	61.5	Low	158 Å²	158	76 Å²	76	69%	0.687	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-64.3	148.1	166.2	-70.7	-173.2	176.7	-176.4	0	110.5	N335	K318-N335 WeakPolarHBondContact CB-OD1 3.39Å
319	M	51.5	Low	63	Low	41 Å²	41	73.8 Å²	73.8	20%	0.202	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-101.4	145.6	175	-65.8	-63.6	-72.2	0	0	110.4	R286 V332 N335 V338	R286-M319 HydrophobicContact CB-CE 3.97Å; R286-M319 PolarHBondContact NH1-SD 3.11Å; M319-V332 HydrophobicContact CB-CG1 4.48Å; M319-V332 HydrophobicContact CG-CG1 4.33Å; M319-N335 PolarHBondContact N-OD1 3.19Å; M319-V338 HydrophobicContact CG-CG1 4.35Å
320	S	47.7	Very low	64	Low	99 Å²	99	73.3 Å²	73.3	69%	0.692	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-69.9	133.2	163.3	48.5	0	0	0	0	109.3	A322	S320-A322 VanDerWaalsContact C-N 3.35Å; S320-A322 PolarHBondContact O-N 3.33Å
321	F	50.1	Low	65.1	Low	123 Å²	123	68.6 Å²	68.6	54%	0.539	38%	0.379	S	S	.	.	S	Bend	trans	-75.5	86.8	178.6	-167.5	-89.7	0	0	0	110.4	V325 M328 I370	F321-V325 HydrophobicContact CE1-CG1 4.5Å; F321-V325 HydrophobicContact CE2-CG1 4.42Å; F321-V325 HydrophobicContact CZ-CG1 3.72Å; F321-M328 HydrophobicContact CE2-CE 4.38Å; F321-I370 HydrophobicContact CE1-CD1 4.24Å; F321-I370 HydrophobicContact CE2-CD1 4.45Å; F321-I370 HydrophobicContact CZ-CD1 3.56Å; F321-I370 HydrophobicContact CZ-CG1 3.96Å
322	A	36.5	Very low	66.3	Low	82 Å²	82	64.5 Å²	64.5	68%	0.678	36%	0.361	S	S	*	.			trans	-149.5	111.2	177.3	0	0	0	0	0	109.3	S320	S320-A322 VanDerWaalsContact C-N 3.35Å; S320-A322 PolarHBondContact O-N 3.33Å
323	G	54.2	Low	67.6	Low	42 Å²	42	62.1 Å²	62.1	43%	0.433	35%	0.349	S	S	.	.	S	Bend	trans	154.9	166.3	-179	0	0	0	0	0	113.2	V325	G323-V325 PolarHBondContact O-N 3.35Å
324	T	69.9	Low	69.3	Low	80 Å²	80	60.3 Å²	60.3	49%	0.491	33%	0.333	S	S	.	.			trans	-79.1	111.1	-179.3	-24.8	0	0	0	0	109.6	A326 W327	T324-A326 PolarHBondContact O-N 2.85Å; T324-W327 HydrophobicContact CG2-CE3 4.31Å; T324-W327 HydrophobicContact CG2-CZ3 3.65Å
325	V	86.9	Confident	71.2	Confident	8 Å²	8	55.8 Å²	55.8	5%	0.048	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-63.7	-18.4	-163.3	-64.2	0	0	0	0	115.7	F321 G323 W327 M328 I369 I370	F321-V325 HydrophobicContact CE1-CG1 4.5Å; F321-V325 HydrophobicContact CE2-CG1 4.42Å; F321-V325 HydrophobicContact CZ-CG1 3.72Å; G323-V325 PolarHBondContact O-N 3.35Å; V325-W327 VanDerWaalsContact C-N 3.3Å; V325-W327 PolarHBondContact O-N 3.32Å; V325-M328 HydrophobicContact CB-SD 4.36Å; V325-M328 HydrophobicContact CG1-SD 4.05Å; V325-M328 PolarHBondContact O-N 3.26Å; V325-I369 HydrophobicContact CB-CG2 4.39Å; V325-I369 HydrophobicContact CG2-CB 3.9Å; V325-I369 HydrophobicContact CG2-CD1 4.2Å; V325-I369 HydrophobicContact CG2-CG2 3.82Å; V325-I370 HydrophobicContact CB-CG1 4.2Å; V325-I370 HydrophobicContact CG1-CD1 4.07Å; V325-I370 HydrophobicContact CG1-CG1 3.77Å; V325-I370 HydrophobicContact CG2-CG1 4.38Å
326	A	91.9	Very high	73.3	Confident	7 Å²	7	50.8 Å²	50.8	6%	0.058	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-59.5	-33.2	-178.2	0	0	0	0	0	114.5	T324 P360 Y361	T324-A326 PolarHBondContact O-N 2.85Å; A326-P360 HydrophobicContact CB-CB 4.08Å; A326-P360 HydrophobicContact CB-CG 3.94Å; A326-Y361 HydrophobicContact CB-CD2 3.68Å; A326-Y361 HydrophobicContact CB-CE2 4.21Å
327	W	94.8	Very high	75	Confident	12 Å²	12	51.8 Å²	51.8	5%	0.045	29%	0.293	C	S	.	.	G	3₁₀ helix	trans	-89.7	-8	179.9	-66.1	-96.4	0	0	0	113.7	Y250 K289 S290 T324 V325 S346 V349 E353 P360	Y250-W327 HydrophobicContact CD2-CH2 4.47Å; Y250-W327 HydrophobicContact CD2-CZ2 4.45Å; Y250-W327 HydrophobicContact CE2-CH2 4.31Å; K289-W327 HydrophobicContact CB-CB 4.15Å; K289-W327 HydrophobicContact CB-CD2 3.74Å; K289-W327 HydrophobicContact CB-CE3 4.48Å; K289-W327 HydrophobicContact CB-CG 3.56Å; S290-W327 WeakPolarHBondContact OG-CZ2 3.4Å; T324-W327 HydrophobicContact CG2-CE3 4.31Å; T324-W327 HydrophobicContact CG2-CZ3 3.65Å; V325-W327 VanDerWaalsContact C-N 3.3Å; V325-W327 PolarHBondContact O-N 3.32Å; W327-S346 WeakPolarHBondContact O-CB 3.47Å; W327-S346 PolarHBondContact O-OG 3.27Å; W327-V349 VanDerWaalsContact CD1-CG1 3.45Å; W327-V349 HydrophobicContact CD2-CG1 4.36Å; W327-V349 HydrophobicContact CG-CB 4.4Å; W327-V349 HydrophobicContact CG-CG1 3.98Å; W327-E353 WeakPolarHBondContact CZ2-OE1 3.42Å; W327-E353 PolarHBondContact NE1-OE2 3.49Å; W327-P360 HydrophobicContact CH2-CG 3.71Å; W327-P360 HydrophobicContact CZ2-CG 3.59Å; W327-P360 HydrophobicContact CZ3-CG 4.25Å
328	M	92.9	Very high	76.8	Confident	32 Å²	32	50.8 Å²	50.8	16%	0.158	29%	0.287	C	S	.	.			trans	-80.5	134.8	-171.5	-63.3	177.1	70.5	0	0	111.9	F321 V325 V332 I333 W345	F321-M328 HydrophobicContact CE2-CE 4.38Å; V325-M328 HydrophobicContact CB-SD 4.36Å; V325-M328 HydrophobicContact CG1-SD 4.05Å; V325-M328 PolarHBondContact O-N 3.26Å; M328-V332 HydrophobicContact CE-CB 4.21Å; M328-V332 HydrophobicContact CE-CG1 3.55Å; M328-I333 HydrophobicContact CB-CD1 4.02Å; M328-I333 HydrophobicContact CB-CG1 3.72Å; M328-I333 HydrophobicContact CE-CG1 4.38Å; M328-W345 PolarHBondContact O-NE1 2.67Å; M328-W345 VanDerWaalsContact O-NE1 3.13Å
329	A	94.1	Very high	78.9	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.008	27%	0.268	C	S	.	.			trans	-71.3	151.8	174.9	0	0	0	0	0	111.6	E331 V332 I333 V342 W345	A329-E331 HydrophobicContact CB-CG 4.5Å; A329-E331 WeakPolarHBondContact CB-OE2 3.4Å; A329-E331 PolarHBondContact O-N 3.12Å; A329-E331 VanDerWaalsContact O-N 3.14Å; A329-V332 HydrophobicContact CB-CG2 4.1Å; A329-V332 WeakPolarHBondContact O-CB 3.4Å; A329-V332 PolarHBondContact O-N 3.06Å; A329-I333 PolarHBondContact O-N 3.07Å; A329-I333 VanDerWaalsContact O-N 3.12Å; A329-V342 HydrophobicContact CB-CB 4.31Å; A329-V342 HydrophobicContact CB-CG1 4.41Å; A329-W345 HydrophobicContact CB-CB 3.7Å; A329-W345 HydrophobicContact CB-CD2 4.14Å; A329-W345 HydrophobicContact CB-CG 3.67Å
330	P	93.1	Very high	80.9	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-52.5	-38.3	-177.8	-28.1	33.5	0	0	0	114.3	I333 R334 W345 V373 N376	P330-I333 PolarHBondContact O-N 2.86Å; P330-R334 WeakPolarHBondContact O-CG 3.34Å; P330-R334 PolarHBondContact O-N 3.06Å; P330-W345 VanDerWaalsContact CD-CE3 3.5Å; P330-W345 HydrophobicContact CG-CE3 4.15Å; P330-W345 HydrophobicContact CG-CH2 3.6Å; P330-W345 HydrophobicContact CG-CZ2 4.1Å; P330-W345 HydrophobicContact CG-CZ3 3.61Å; P330-V373 HydrophobicContact CB-CG1 4.49Å; P330-V373 WeakPolarHBondContact CB-O 3Å; P330-V373 HydrophobicContact CG-CG1 3.86Å; P330-N376 WeakPolarHBondContact CB-OD1 3.21Å
331	E	92.1	Very high	83.3	Confident	3 Å²	3	42.1 Å²	42.1	1%	0.014	24%	0.241	C	C	.	.	H	α-helix	trans	-67.7	-32.7	176.5	65.9	-88.3	-152.2	0	0	113.1	A329 R334 N335 E336 V342 P402 R405	A329-E331 HydrophobicContact CB-CG 4.5Å; A329-E331 WeakPolarHBondContact CB-OE2 3.4Å; A329-E331 PolarHBondContact O-N 3.12Å; A329-E331 VanDerWaalsContact O-N 3.14Å; E331-R334 PolarHBondContact O-N 3.33Å; E331-N335 PolarHBondContact O-N 2.86Å; E331-N335 VanDerWaalsContact O-N 3.14Å; E331-E336 HydrophobicContact CB-CB 3.99Å; E331-E336 WeakPolarHBondContact CB-OE2 3.3Å; E331-E336 WeakPolarHBondContact O-CB 3.21Å; E331-E336 PolarHBondContact O-N 3.28Å; E331-V342 HydrophobicContact CG-CG1 4.04Å; E331-P402 VanDerWaalsContact CD-CG 3.46Å; E331-P402 HydrophobicContact CG-CG 4.21Å; E331-P402 VanDerWaalsContact OE1-CG 3.22Å; E331-P402 WeakPolarHBondContact OE1-CG 3.44Å; E331-R405 IonicContact OE1-CZ 3.76Å; E331-R405 IonicContact OE1-NH1 2.68Å; E331-R405 PolarHBondContact OE1-NH1 3.46Å; E331-R405 IonicContact OE1-NH2 3.24Å; E331-R405 PolarHBondContact OE1-NH2 3.12Å; E331-R405 IonicContact OE2-CZ 2.94Å; E331-R405 IonicContact OE2-NH1 3.59Å; E331-R405 PolarHBondContact OE2-NH1 3.21Å; E331-R405 IonicContact OE2-NH2 3.93Å; E331-R405 PolarHBondContact OE2-NH2 2.89Å
332	V	90	Very high	85.4	Confident	16 Å²	16	36.4 Å²	36.4	10%	0.097	22%	0.216	C	C	.	.	H	α-helix	trans	-70.7	-42.2	176.4	-168.9	0	0	0	0	109.7	M319 M328 A329 R334 N335 V338 V342	M319-V332 HydrophobicContact CB-CG1 4.48Å; M319-V332 HydrophobicContact CG-CG1 4.33Å; M328-V332 HydrophobicContact CE-CB 4.21Å; M328-V332 HydrophobicContact CE-CG1 3.55Å; A329-V332 HydrophobicContact CB-CG2 4.1Å; A329-V332 WeakPolarHBondContact O-CB 3.4Å; A329-V332 PolarHBondContact O-N 3.06Å; V332-R334 VanDerWaalsContact C-N 3.33Å; V332-R334 PolarHBondContact O-N 3.11Å; V332-N335 PolarHBondContact O-N 3.45Å; V332-V338 HydrophobicContact CG2-CG1 4Å; V332-V342 HydrophobicContact CG2-CB 3.89Å; V332-V342 HydrophobicContact CG2-CG1 3.52Å
333	I	88.7	Confident	88.3	Confident	20 Å²	20	32.5 Å²	32.5	10%	0.103	18%	0.184	C	C	.	.	H	α-helix	trans	-62.8	-39.4	176.4	-65.8	169.1	0	0	0	111.1	M328 A329 P330 N335 I370 V373	M328-I333 HydrophobicContact CB-CD1 4.02Å; M328-I333 HydrophobicContact CB-CG1 3.72Å; M328-I333 HydrophobicContact CE-CG1 4.38Å; A329-I333 PolarHBondContact O-N 3.07Å; A329-I333 VanDerWaalsContact O-N 3.12Å; P330-I333 PolarHBondContact O-N 2.86Å; I333-N335 PolarHBondContact O-N 3.21Å; I333-I370 HydrophobicContact CG2-CB 4.4Å; I333-I370 HydrophobicContact CG2-CG2 3.9Å; I333-I370 WeakPolarHBondContact CG2-O 3.43Å; I333-V373 HydrophobicContact CD1-CB 3.79Å; I333-V373 HydrophobicContact CD1-CG1 3.64Å
334	R	88	Confident	90.4	Very high	86 Å²	86	30.5 Å²	30.5	33%	0.325	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-1.2	173.6	-66.6	-170.7	-57	-86.5	-10.5	114.4	P330 E331 V332 E336 G374 N376	P330-R334 WeakPolarHBondContact O-CG 3.34Å; P330-R334 PolarHBondContact O-N 3.06Å; E331-R334 PolarHBondContact O-N 3.33Å; V332-R334 VanDerWaalsContact C-N 3.33Å; V332-R334 PolarHBondContact O-N 3.11Å; R334-E336 HydrophobicContact CB-CG 3.91Å; R334-E336 IonicContact CZ-OE1 3.19Å; R334-E336 IonicContact CZ-OE2 3.65Å; R334-E336 IonicContact NE-OE1 2.66Å; R334-E336 PolarHBondContact NE-OE1 3.23Å; R334-E336 IonicContact NE-OE2 3.06Å; R334-E336 PolarHBondContact NE-OE2 2.85Å; R334-E336 IonicContact NH2-OE1 2.85Å; R334-E336 IonicContact NH2-OE2 2.7Å; R334-E336 PolarHBondContact NH2-OE2 3.43Å; R334-E336 PolarHBondContact O-N 2.92Å; R334-G374 WeakPolarHBondContact CD-O 3.16Å; R334-G374 PolarHBondContact NH1-O 3.17Å; R334-N376 PolarHBondContact NH1-ND2 2.77Å; R334-N376 PolarHBondContact NH1-OD1 2.77Å
335	N	86.1	Confident	91.7	Very high	71 Å²	71	26.8 Å²	26.8	38%	0.38	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	38.9	-174.4	-158.4	1.3	0	0	0	113.3	K318 M319 E331 V332 I333	K318-N335 WeakPolarHBondContact CB-OD1 3.39Å; M319-N335 PolarHBondContact N-OD1 3.19Å; E331-N335 PolarHBondContact O-N 2.86Å; E331-N335 VanDerWaalsContact O-N 3.14Å; V332-N335 PolarHBondContact O-N 3.45Å; I333-N335 PolarHBondContact O-N 3.21Å
336	E	87.2	Confident	92.2	Very high	75 Å²	75	26.8 Å²	26.8	35%	0.35	14%	0.141	S	C	.	.			trans	-84.2	170.3	175.3	-75.9	173.9	179	0	0	111.8	E331 R334 V338	E331-E336 HydrophobicContact CB-CB 3.99Å; E331-E336 WeakPolarHBondContact CB-OE2 3.3Å; E331-E336 WeakPolarHBondContact O-CB 3.21Å; E331-E336 PolarHBondContact O-N 3.28Å; R334-E336 HydrophobicContact CB-CG 3.91Å; R334-E336 IonicContact CZ-OE1 3.19Å; R334-E336 IonicContact CZ-OE2 3.65Å; R334-E336 IonicContact NE-OE1 2.66Å; R334-E336 PolarHBondContact NE-OE1 3.23Å; R334-E336 IonicContact NE-OE2 3.06Å; R334-E336 PolarHBondContact NE-OE2 2.85Å; R334-E336 IonicContact NH2-OE1 2.85Å; R334-E336 IonicContact NH2-OE2 2.7Å; R334-E336 PolarHBondContact NH2-OE2 3.43Å; R334-E336 PolarHBondContact O-N 2.92Å; E336-V338 PolarHBondContact O-N 2.84Å
337	P	83.7	Confident	92.6	Very high	90 Å²	90	26.4 Å²	26.4	58%	0.584	14%	0.138	S	C	*	.			trans	-54	109.1	172.7	-29.2	37.4	0	0	0	114.1	S316	S316-P337 VanDerWaalsContact OG-CA 3.31Å; S316-P337 WeakPolarHBondContact OG-CA 3.18Å; S316-P337 VanDerWaalsContact OG-CB 3.26Å; S316-P337 WeakPolarHBondContact OG-CB 3.41Å; S316-P337 WeakPolarHBondContact OG-CG 3.43Å
338	V	86.8	Confident	92.7	Very high	21 Å²	21	25.9 Å²	25.9	13%	0.127	14%	0.136	C	C	.	.			trans	-75.1	152.3	175.2	-58	0	0	0	0	112.1	M319 V332 E336 V342	M319-V338 HydrophobicContact CG-CG1 4.35Å; V332-V338 HydrophobicContact CG2-CG1 4Å; E336-V338 PolarHBondContact O-N 2.84Å; V338-V342 HydrophobicContact CB-CG1 3.94Å; V338-V342 HydrophobicContact CG1-CG1 4.12Å
339	S	91.4	Very high	93	Very high	42 Å²	42	24.3 Å²	24.3	29%	0.294	13%	0.128	S	C	.	.			trans	-141.2	175.6	173.9	63	0	0	0	0	109.6	K341 V342	S339-K341 PolarHBondContact O-N 2.93Å; S339-K341 PolarHBondContact OG-N 2.79Å; S339-V342 WeakPolarHBondContact O-CG2 3.29Å; S339-V342 PolarHBondContact O-N 3.49Å
340	E	93.8	Very high	93.2	Very high	48 Å²	48	24.3 Å²	24.3	22%	0.224	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-47.5	-26.4	173.1	70	179.2	-144.5	0	0	113.4	H279 V342 D343	H279-E340 PolarHBondContact CE1-O 2.78Å; E340-V342 PolarHBondContact O-N 2.67Å; E340-D343 PolarHBondContact O-N 2.9Å
341	K	96.8	Very high	93.4	Very high	26 Å²	26	24.3 Å²	24.3	11%	0.113	13%	0.128	C	C	.	.	H	α-helix	trans	-71.1	-8.9	-177.9	-56.8	-64.1	177.7	164	0	114.6	S339 I344 P402 R405 P406	S339-K341 PolarHBondContact O-N 2.93Å; S339-K341 PolarHBondContact OG-N 2.79Å; K341-I344 HydrophobicContact CD-CG1 4.12Å; K341-P402 HydrophobicContact CB-CB 3.78Å; K341-P402 WeakPolarHBondContact CB-O 3.34Å; K341-P402 HydrophobicContact CG-CB 4.47Å; K341-P402 WeakPolarHBondContact CG-O 3.43Å; K341-R405 HydrophobicContact CD-CB 4.39Å; K341-R405 PolarHBondContact NZ-O 3.27Å; K341-R405 WeakPolarHBondContact O-CD 3.39Å; K341-R405 PolarHBondContact O-NH1 3.4Å; K341-P406 PolarHBondContact NZ-O 3.39Å
342	V	95.3	Very high	93.7	Very high	2 Å²	2	24.1 Å²	24.1	1%	0.012	13%	0.127	C	C	.	.	H	α-helix	trans	-67.4	-44.6	170.1	-55.7	0	0	0	0	110.3	I284 A329 E331 V332 V338 S339 E340 I344 W345 S346	I284-V342 HydrophobicContact CG2-CG2 3.98Å; A329-V342 HydrophobicContact CB-CB 4.31Å; A329-V342 HydrophobicContact CB-CG1 4.41Å; E331-V342 HydrophobicContact CG-CG1 4.04Å; V332-V342 HydrophobicContact CG2-CB 3.89Å; V332-V342 HydrophobicContact CG2-CG1 3.52Å; V338-V342 HydrophobicContact CB-CG1 3.94Å; V338-V342 HydrophobicContact CG1-CG1 4.12Å; S339-V342 WeakPolarHBondContact O-CG2 3.29Å; S339-V342 PolarHBondContact O-N 3.49Å; E340-V342 PolarHBondContact O-N 2.67Å; V342-I344 PolarHBondContact O-N 3.25Å; V342-W345 WeakPolarHBondContact O-CB 3.42Å; V342-W345 PolarHBondContact O-N 2.96Å; V342-S346 PolarHBondContact O-N 2.72Å; V342-S346 PolarHBondContact O-OG 3.22Å
343	D	96.8	Very high	94.1	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-62.2	-29.4	179.4	-54	-22.8	0	0	0	111.6	M275 H279 I284 H285 R286 L288 E340 S346 F347 F408	M275-D343 HydrophobicContact CE-CB 3.69Å; M275-D343 WeakPolarHBondContact CE-OD2 3.4Å; H279-D343 IonicContact CD2-OD2 3.73Å; H279-D343 IonicContact CE1-OD2 2.79Å; H279-D343 IonicContact NE2-OD2 2.78Å; H279-D343 PolarHBondContact NE2-OD2 3.5Å; I284-D343 WeakPolarHBondContact CG2-OD2 3.37Å; H285-D343 PolarHBondContact N-OD1 3.48Å; H285-D343 PolarHBondContact N-OD2 3.26Å; R286-D343 PolarHBondContact N-OD1 2.74Å; L288-D343 HydrophobicContact CD2-CB 4.31Å; L288-D343 WeakPolarHBondContact CD2-O 3.39Å; E340-D343 PolarHBondContact O-N 2.9Å; D343-S346 PolarHBondContact O-N 2.69Å; D343-F347 WeakPolarHBondContact O-CB 3.44Å; D343-F347 PolarHBondContact O-N 3.43Å; D343-F408 HydrophobicContact CB-CE2 4.1Å; D343-F408 HydrophobicContact CB-CZ 4.37Å
344	I	98.4	Very high	94.5	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-66.9	-39.5	176.5	-59.1	-72.4	0	0	0	112	K341 V342 G348 C397 R405 P406 F408 I411	K341-I344 HydrophobicContact CD-CG1 4.12Å; V342-I344 PolarHBondContact O-N 3.25Å; I344-G348 PolarHBondContact O-N 3.32Å; I344-G348 VanDerWaalsContact O-N 3.17Å; I344-C397 HydrophobicContact CG2-CB 4.3Å; I344-R405 HydrophobicContact CB-CB 4.34Å; I344-R405 HydrophobicContact CG2-CB 3.71Å; I344-P406 VanDerWaalsContact CD1-O 3.29Å; I344-P406 WeakPolarHBondContact CD1-O 3.48Å; I344-P406 WeakPolarHBondContact CG1-O 3.39Å; I344-P406 HydrophobicContact CG2-CG 4.22Å; I344-F408 HydrophobicContact CD1-CD1 4.16Å; I344-F408 HydrophobicContact CD1-CD2 3.4Å; I344-F408 HydrophobicContact CD1-CE1 4.15Å; I344-F408 HydrophobicContact CD1-CE2 3.36Å; I344-F408 HydrophobicContact CD1-CG 3.81Å; I344-F408 HydrophobicContact CD1-CZ 3.76Å; I344-F408 HydrophobicContact CG1-CD2 4.48Å; I344-F408 HydrophobicContact CG1-CE2 4.12Å; I344-I411 HydrophobicContact CD1-CD1 3.62Å; I344-I411 HydrophobicContact CG2-CD1 4.07Å
345	W	98	Very high	94.9	Very high	3 Å²	3	18.7 Å²	18.7	1%	0.011	10%	0.104	C	C	.	.	H	α-helix	trans	-64.3	-47	174.7	173.3	-76	0	0	0	110.2	M328 A329 P330 V342 G348 V349 V373 Q379 W398	M328-W345 PolarHBondContact O-NE1 2.67Å; M328-W345 VanDerWaalsContact O-NE1 3.13Å; A329-W345 HydrophobicContact CB-CB 3.7Å; A329-W345 HydrophobicContact CB-CD2 4.14Å; A329-W345 HydrophobicContact CB-CG 3.67Å; P330-W345 VanDerWaalsContact CD-CE3 3.5Å; P330-W345 HydrophobicContact CG-CE3 4.15Å; P330-W345 HydrophobicContact CG-CH2 3.6Å; P330-W345 HydrophobicContact CG-CZ2 4.1Å; P330-W345 HydrophobicContact CG-CZ3 3.61Å; V342-W345 WeakPolarHBondContact O-CB 3.42Å; V342-W345 PolarHBondContact O-N 2.96Å; W345-G348 WeakPolarHBondContact O-CA 3.41Å; W345-G348 PolarHBondContact O-N 2.95Å; W345-V349 PolarHBondContact O-N 2.85Å; W345-V373 HydrophobicContact CH2-CG1 4.11Å; W345-V373 HydrophobicContact CZ2-CG1 3.57Å; W345-Q379 HydrophobicContact CH2-CG 4.35Å; W345-W398 AromaticContact CD2-CD1 3.71Å; W345-W398 HydrophobicContact CD2-CG 4.47Å; W345-W398 AromaticContact CE2-CD1 3.9Å; W345-W398 HydrophobicContact CE3-CB 4.03Å; W345-W398 AromaticContact CE3-CD1 3.98Å; W345-W398 HydrophobicContact CE3-CG 4.38Å; W345-W398 HydrophobicContact CH2-CB 4.09Å; W345-W398 HydrophobicContact CH2-CG 4.48Å; W345-W398 HydrophobicContact CZ3-CB 3.76Å; W345-W398 HydrophobicContact CZ3-CG 4.39Å; W345-W398 WeakPolarHBondContact CZ3-O 3.46Å; W345-W398 PolarHBondContact O-NE1 2.87Å
346	S	97.4	Very high	95.3	Very high	7 Å²	7	15.3 Å²	15.3	5%	0.049	9%	0.086	C	C	.	.	H	α-helix	trans	-65.6	-37.5	-179	-50	0	0	0	0	112.6	L288 W327 V342 D343 G348 V349 V350	L288-S346 VanDerWaalsContact O-CB 3.23Å; L288-S346 WeakPolarHBondContact O-CB 3.5Å; W327-S346 WeakPolarHBondContact O-CB 3.47Å; W327-S346 PolarHBondContact O-OG 3.27Å; V342-S346 PolarHBondContact O-N 2.72Å; V342-S346 PolarHBondContact O-OG 3.22Å; D343-S346 PolarHBondContact O-N 2.69Å; S346-G348 VanDerWaalsContact C-N 3.3Å; S346-G348 PolarHBondContact O-N 3.14Å; S346-V349 WeakPolarHBondContact O-CB 3.22Å; S346-V349 PolarHBondContact O-N 3.14Å; S346-V349 VanDerWaalsContact O-N 3.11Å; S346-V350 PolarHBondContact O-N 2.89Å
347	F	98.6	Very high	95.7	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-59.6	-40.4	169.1	171.1	-94.5	0	0	0	111.9	I271 A272 L288 D343 V349 V350 L351 F408 I411 L415	I271-F347 HydrophobicContact CB-CD2 4.43Å; I271-F347 HydrophobicContact CB-CE2 4.23Å; I271-F347 HydrophobicContact CG2-CD2 3.77Å; I271-F347 HydrophobicContact CG2-CE2 4.08Å; A272-F347 HydrophobicContact CB-CE2 4.19Å; A272-F347 HydrophobicContact CB-CZ 4.29Å; L288-F347 HydrophobicContact CD2-CB 3.96Å; D343-F347 WeakPolarHBondContact O-CB 3.44Å; D343-F347 PolarHBondContact O-N 3.43Å; F347-V349 PolarHBondContact O-N 2.76Å; F347-V350 PolarHBondContact O-N 3.48Å; F347-L351 HydrophobicContact CE1-CB 4.24Å; F347-L351 HydrophobicContact CE1-CD2 3.98Å; F347-L351 HydrophobicContact CZ-CB 4.31Å; F347-L351 HydrophobicContact CZ-CD2 4.32Å; F347-L351 WeakPolarHBondContact O-CB 3.43Å; F347-L351 PolarHBondContact O-N 2.65Å; F347-F408 HydrophobicContact CB-CE1 3.69Å; F347-F408 HydrophobicContact CB-CZ 3.8Å; F347-F408 HydrophobicContact CD1-CE1 4.18Å; F347-F408 AromaticContact CD2-CE1 3.84Å; F347-F408 HydrophobicContact CD2-CE1 3.84Å; F347-F408 AromaticContact CG-CE1 3.61Å; F347-F408 HydrophobicContact CG-CE1 3.61Å; F347-F408 HydrophobicContact CG-CZ 4.25Å; F347-I411 HydrophobicContact CD1-CD1 3.88Å; F347-I411 HydrophobicContact CD1-CG2 4.2Å; F347-I411 HydrophobicContact CE1-CD1 4.19Å; F347-I411 HydrophobicContact CE1-CG2 3.45Å; F347-I411 VanDerWaalsContact CE1-CG2 3.45Å; F347-I411 HydrophobicContact CZ-CG2 3.81Å; F347-L415 HydrophobicContact CZ-CD1 4.18Å
348	G	98.3	Very high	96.2	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-57.1	-38.2	173.6	0	0	0	0	0	112.5	I344 W345 S346 W352 L394 W398	I344-G348 PolarHBondContact O-N 3.32Å; I344-G348 VanDerWaalsContact O-N 3.17Å; W345-G348 WeakPolarHBondContact O-CA 3.41Å; W345-G348 PolarHBondContact O-N 2.95Å; S346-G348 VanDerWaalsContact C-N 3.3Å; S346-G348 PolarHBondContact O-N 3.14Å; G348-W352 WeakPolarHBondContact O-CB 3.42Å; G348-W352 PolarHBondContact O-N 2.87Å; G348-L394 WeakPolarHBondContact O-CD2 3.49Å; G348-W398 VanDerWaalsContact O-CZ2 3.29Å; G348-W398 WeakPolarHBondContact O-CZ2 3.39Å
349	V	98.3	Very high	96.6	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-66	-48.4	174	-179.3	0	0	0	0	111.2	W327 W345 S346 F347 L351 W352 E353 P360 L380 W398	W327-V349 VanDerWaalsContact CD1-CG1 3.45Å; W327-V349 HydrophobicContact CD2-CG1 4.36Å; W327-V349 HydrophobicContact CG-CB 4.4Å; W327-V349 HydrophobicContact CG-CG1 3.98Å; W345-V349 PolarHBondContact O-N 2.85Å; S346-V349 WeakPolarHBondContact O-CB 3.22Å; S346-V349 PolarHBondContact O-N 3.14Å; S346-V349 VanDerWaalsContact O-N 3.11Å; F347-V349 PolarHBondContact O-N 2.76Å; V349-L351 VanDerWaalsContact C-N 3.32Å; V349-L351 PolarHBondContact O-N 3.33Å; V349-W352 WeakPolarHBondContact O-CB 3.41Å; V349-W352 PolarHBondContact O-N 3.04Å; V349-W352 VanDerWaalsContact O-N 3.11Å; V349-E353 WeakPolarHBondContact O-CG 3.23Å; V349-E353 PolarHBondContact O-N 3.34Å; V349-P360 HydrophobicContact CG1-CB 3.92Å; V349-P360 HydrophobicContact CG1-CG 4.07Å; V349-L380 HydrophobicContact CB-CD1 4.31Å; V349-L380 HydrophobicContact CG1-CD1 3.87Å; V349-L380 HydrophobicContact CG2-CD1 4.01Å; V349-W398 HydrophobicContact CG2-CZ2 4.39Å
350	V	98.2	Very high	96.8	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-63.3	-36.6	178.7	-178.5	0	0	0	0	112.4	L249 I271 M293 S346 F347 E353 M354	L249-V350 HydrophobicContact CD2-CG1 3.85Å; I271-V350 HydrophobicContact CD1-CG1 3.94Å; M293-V350 HydrophobicContact CG-CG1 4.41Å; S346-V350 PolarHBondContact O-N 2.89Å; F347-V350 PolarHBondContact O-N 3.48Å; V350-E353 WeakPolarHBondContact CA-OE2 3.46Å; V350-E353 PolarHBondContact O-N 2.79Å; V350-M354 HydrophobicContact CG1-CE 4.34Å; V350-M354 WeakPolarHBondContact O-CG 3.23Å; V350-M354 PolarHBondContact O-N 3.36Å
351	L	98.3	Very high	96.7	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-64.1	-41.1	173.3	179.4	59.9	0	0	0	111.8	A268 F347 V349 M354 L355 F390 L393 L394 L415	A268-L351 HydrophobicContact CB-CD1 3.97Å; F347-L351 HydrophobicContact CE1-CB 4.24Å; F347-L351 HydrophobicContact CE1-CD2 3.98Å; F347-L351 HydrophobicContact CZ-CB 4.31Å; F347-L351 HydrophobicContact CZ-CD2 4.32Å; F347-L351 WeakPolarHBondContact O-CB 3.43Å; F347-L351 PolarHBondContact O-N 2.65Å; V349-L351 VanDerWaalsContact C-N 3.32Å; V349-L351 PolarHBondContact O-N 3.33Å; L351-M354 HydrophobicContact CD1-CE 4.37Å; L351-M354 PolarHBondContact O-N 2.87Å; L351-L355 HydrophobicContact CD1-CD1 4.27Å; L351-L355 HydrophobicContact CD1-CG 4.48Å; L351-L355 HydrophobicContact CG-CD1 4.02Å; L351-L355 WeakPolarHBondContact O-CB 3.37Å; L351-L355 WeakPolarHBondContact O-CG 3.48Å; L351-L355 PolarHBondContact O-N 2.8Å; L351-F390 HydrophobicContact CD1-CD1 4.45Å; L351-F390 HydrophobicContact CD2-CD1 4.45Å; L351-L393 HydrophobicContact CD2-CD2 3.78Å; L351-L393 HydrophobicContact CD2-CG 4.16Å; L351-L394 HydrophobicContact CB-CD2 4.17Å; L351-L394 HydrophobicContact CD2-CD2 4.04Å; L351-L394 HydrophobicContact CG-CD2 4.09Å; L351-L415 HydrophobicContact CD2-CD2 4.46Å
352	W	98.3	Very high	96.4	Very high	0 Å²	0	8.1 Å²	8.1	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-65.4	-38.1	174.5	176.5	95.6	0	0	0	112.4	G348 V349 L355 T356 E358 P360 L380 P381 L394 W398 V441 F445	G348-W352 WeakPolarHBondContact O-CB 3.42Å; G348-W352 PolarHBondContact O-N 2.87Å; V349-W352 WeakPolarHBondContact O-CB 3.41Å; V349-W352 PolarHBondContact O-N 3.04Å; V349-W352 VanDerWaalsContact O-N 3.11Å; W352-L355 PolarHBondContact O-N 2.91Å; W352-T356 HydrophobicContact CD2-CG2 4.22Å; W352-T356 HydrophobicContact CG-CG2 4.45Å; W352-T356 HydrophobicContact CZ2-CG2 4.23Å; W352-T356 WeakPolarHBondContact O-CB 3.38Å; W352-T356 WeakPolarHBondContact O-CG2 3.29Å; W352-T356 PolarHBondContact O-N 2.82Å; W352-T356 PolarHBondContact O-OG1 3.16Å; W352-E358 HydrophobicContact CH2-CB 4.23Å; W352-E358 WeakPolarHBondContact CZ3-O 3.4Å; W352-P360 HydrophobicContact CE3-CB 4.28Å; W352-P360 HydrophobicContact CZ3-CB 3.87Å; W352-L380 HydrophobicContact CD2-CB 4.26Å; W352-L380 HydrophobicContact CD2-CD1 3.88Å; W352-L380 HydrophobicContact CD2-CG 4.45Å; W352-L380 HydrophobicContact CE3-CD1 3.89Å; W352-L380 HydrophobicContact CE3-CD2 4.46Å; W352-L380 HydrophobicContact CG-CB 4.43Å; W352-L380 HydrophobicContact CG-CD1 4.2Å; W352-L380 HydrophobicContact CH2-CD2 4.12Å; W352-L380 HydrophobicContact CZ2-CB 4.42Å; W352-L380 HydrophobicContact CZ2-CD2 4.14Å; W352-L380 HydrophobicContact CZ3-CD1 4.45Å; W352-L380 HydrophobicContact CZ3-CD2 4.27Å; W352-P381 PolarHBondContact NE1-O 3.49Å; W352-L394 HydrophobicContact CB-CD1 4.44Å; W352-L394 HydrophobicContact CB-CD2 4.08Å; W352-W398 HydrophobicContact CB-CH2 3.81Å; W352-W398 HydrophobicContact CB-CZ2 3.92Å; W352-W398 AromaticContact CD1-CH2 3.74Å; W352-W398 AromaticContact CG-CH2 3.87Å; W352-W398 HydrophobicContact CG-CH2 3.87Å; W352-W398 HydrophobicContact CG-CZ2 4.37Å; W352-V441 HydrophobicContact CH2-CG1 3.8Å; W352-V441 HydrophobicContact CZ2-CB 4.37Å; W352-V441 HydrophobicContact CZ2-CG1 3.52Å; W352-V441 HydrophobicContact CZ2-CG2 3.86Å; W352-F445 AromaticContact CH2-CE2 3.94Å; W352-F445 HydrophobicContact CH2-CE2 3.94Å; W352-F445 AromaticContact CH2-CZ 3.67Å; W352-F445 HydrophobicContact CH2-CZ 3.67Å; W352-F445 HydrophobicContact CZ2-CE2 4.36Å; W352-F445 AromaticContact CZ2-CZ 3.87Å; W352-F445 HydrophobicContact CZ2-CZ 3.87Å
353	E	97.6	Very high	96.1	Very high	4 Å²	4	14.1 Å²	14.1	2%	0.019	8%	0.076	C	C	.	.	H	α-helix	trans	-62.5	-42.8	174.4	-71.3	177.4	86.6	0	0	111.9	L253 S290 W327 V349 V350 G357 P360	L253-E353 HydrophobicContact CD1-CB 3.95Å; S290-E353 WeakPolarHBondContact CB-OE1 3.45Å; S290-E353 WeakPolarHBondContact CB-OE2 3.45Å; S290-E353 VanDerWaalsContact OG-CD 3.22Å; S290-E353 PolarHBondContact OG-OE1 2.91Å; S290-E353 PolarHBondContact OG-OE2 2.89Å; W327-E353 WeakPolarHBondContact CZ2-OE1 3.42Å; W327-E353 PolarHBondContact NE1-OE2 3.49Å; V349-E353 WeakPolarHBondContact O-CG 3.23Å; V349-E353 PolarHBondContact O-N 3.34Å; V350-E353 WeakPolarHBondContact CA-OE2 3.46Å; V350-E353 PolarHBondContact O-N 2.79Å; E353-G357 VanDerWaalsContact O-CA 3.23Å; E353-G357 WeakPolarHBondContact O-CA 3.49Å; E353-G357 PolarHBondContact O-N 3.36Å; E353-P360 HydrophobicContact CG-CG 4.23Å
354	M	97.3	Very high	95.6	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-72.6	-34.6	178.1	-62.7	-177.4	-61.5	0	0	112.6	L249 L253 L264 W267 A268 I271 V350 L351	L249-M354 HydrophobicContact CD1-CG 4.42Å; L249-M354 HydrophobicContact CD2-CG 4.14Å; L249-M354 HydrophobicContact CD2-SD 3.93Å; L253-M354 HydrophobicContact CD1-CG 4.44Å; L264-M354 HydrophobicContact CD1-CB 3.39Å; W267-M354 HydrophobicContact CB-SD 3.69Å; W267-M354 HydrophobicContact CE3-SD 3.95Å; A268-M354 HydrophobicContact CB-CE 4.12Å; I271-M354 HydrophobicContact CD1-CE 4.2Å; I271-M354 HydrophobicContact CD1-SD 4.35Å; V350-M354 HydrophobicContact CG1-CE 4.34Å; V350-M354 WeakPolarHBondContact O-CG 3.23Å; V350-M354 PolarHBondContact O-N 3.36Å; L351-M354 HydrophobicContact CD1-CE 4.37Å; L351-M354 PolarHBondContact O-N 2.87Å
355	L	95.9	Very high	94.9	Very high	3 Å²	3	18.8 Å²	18.8	2%	0.016	10%	0.101	C	C	.	.	H	α-helix	trans	-66.1	-44.9	175.2	-82.7	164	0	0	0	112.3	L264 L351 W352 F390 L394 I422 Q434 W437	L264-L355 HydrophobicContact CD1-CG 4.39Å; L264-L355 HydrophobicContact CD2-CD2 3.68Å; L264-L355 HydrophobicContact CD2-CG 4.32Å; L351-L355 HydrophobicContact CD1-CD1 4.27Å; L351-L355 HydrophobicContact CD1-CG 4.48Å; L351-L355 HydrophobicContact CG-CD1 4.02Å; L351-L355 WeakPolarHBondContact O-CB 3.37Å; L351-L355 WeakPolarHBondContact O-CG 3.48Å; L351-L355 PolarHBondContact O-N 2.8Å; W352-L355 PolarHBondContact O-N 2.91Å; L355-F390 HydrophobicContact CD1-CB 4.05Å; L355-F390 HydrophobicContact CD1-CD1 4.11Å; L355-F390 HydrophobicContact CD1-CG 4.26Å; L355-F390 HydrophobicContact CD2-CD1 4.33Å; L355-F390 HydrophobicContact CD2-CG 4.2Å; L355-L394 HydrophobicContact CD1-CD1 4.06Å; L355-I422 HydrophobicContact CD2-CD1 4.31Å; L355-Q434 WeakPolarHBondContact O-CG 3.33Å; L355-Q434 PolarHBondContact O-NE2 3.32Å; L355-W437 HydrophobicContact CD2-CZ3 4.49Å
356	T	95.8	Very high	94.3	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.006	12%	0.123	C	C	.	.	H	α-helix	trans	-92.2	-40.6	-174.5	60.7	0	0	0	0	112.9	W352 E358 P383 Q434 R438 V441	W352-T356 HydrophobicContact CD2-CG2 4.22Å; W352-T356 HydrophobicContact CG-CG2 4.45Å; W352-T356 HydrophobicContact CZ2-CG2 4.23Å; W352-T356 WeakPolarHBondContact O-CB 3.38Å; W352-T356 WeakPolarHBondContact O-CG2 3.29Å; W352-T356 PolarHBondContact O-N 2.82Å; W352-T356 PolarHBondContact O-OG1 3.16Å; T356-E358 VanDerWaalsContact C-N 3.32Å; T356-E358 PolarHBondContact OG1-N 3.08Å; T356-P383 HydrophobicContact CG2-CG 4.32Å; T356-Q434 WeakPolarHBondContact O-CG 3.36Å; T356-R438 WeakPolarHBondContact O-CG 3.3Å; T356-R438 VanDerWaalsContact O-CZ 3.27Å; T356-R438 PolarHBondContact O-NE 3.38Å; T356-V441 HydrophobicContact CG2-CG2 4.06Å
357	G	95.1	Very high	93.6	Very high	12 Å²	12	24.1 Å²	24.1	12%	0.124	14%	0.14	C	C	.	.			trans	71.8	20.8	-167.2	0	0	0	0	0	114.4	E353 R438	E353-G357 VanDerWaalsContact O-CA 3.23Å; E353-G357 WeakPolarHBondContact O-CA 3.49Å; E353-G357 PolarHBondContact O-N 3.36Å; G357-R438 PolarHBondContact O-NH1 2.96Å
358	E	95.1	Very high	92.9	Very high	18 Å²	18	24.4 Å²	24.4	8%	0.084	14%	0.141	C	C	.	.	S	Bend	trans	-107.2	159.5	172.1	-80.9	-77.7	-168.2	0	0	111.8	W352 T356 K362 R438 V441 R442	W352-E358 HydrophobicContact CH2-CB 4.23Å; W352-E358 WeakPolarHBondContact CZ3-O 3.4Å; T356-E358 VanDerWaalsContact C-N 3.32Å; T356-E358 PolarHBondContact OG1-N 3.08Å; E358-K362 IonicContact OE1-NZ 2.67Å; E358-K362 VanDerWaalsContact OE2-CD 3.3Å; E358-K362 WeakPolarHBondContact OE2-CD 3.28Å; E358-K362 IonicContact OE2-NZ 3.49Å; E358-K362 PolarHBondContact OE2-NZ 2.98Å; E358-R438 HydrophobicContact CG-CB 4.01Å; E358-R438 HydrophobicContact CG-CG 3.97Å; E358-V441 HydrophobicContact CB-CG1 4.15Å; E358-V441 HydrophobicContact CG-CG1 4.39Å; E358-R442 IonicContact OE1-CZ 2.72Å; E358-R442 IonicContact OE1-NE 2.7Å; E358-R442 PolarHBondContact OE1-NE 3.09Å; E358-R442 IonicContact OE1-NH2 2.79Å; E358-R442 PolarHBondContact OE1-NH2 2.92Å
359	V	93.9	Very high	92.4	Very high	41 Å²	41	24.7 Å²	24.7	25%	0.248	14%	0.143	C	C	.	.			trans	-76.9	132.9	177.5	176.9	0	0	0	0	109.7	Y250 Y361 K362	Y250-V359 HydrophobicContact CE2-CG1 4.4Å; Y250-V359 HydrophobicContact CE2-CG2 4.39Å; V359-Y361 PolarHBondContact O-N 2.89Å; V359-K362 HydrophobicContact CB-CB 4.24Å; V359-K362 HydrophobicContact CB-CD 4.48Å; V359-K362 HydrophobicContact CB-CG 4.24Å; V359-K362 PolarHBondContact O-N 3.18Å
360	P	94.9	Very high	91.9	Very high	7 Å²	7	27.2 Å²	27.2	5%	0.045	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.6	125.1	-175.8	27.7	-33.6	0	0	0	111.1	A326 W327 V349 W352 E353 K362 L380	A326-P360 HydrophobicContact CB-CB 4.08Å; A326-P360 HydrophobicContact CB-CG 3.94Å; W327-P360 HydrophobicContact CH2-CG 3.71Å; W327-P360 HydrophobicContact CZ2-CG 3.59Å; W327-P360 HydrophobicContact CZ3-CG 4.25Å; V349-P360 HydrophobicContact CG1-CB 3.92Å; V349-P360 HydrophobicContact CG1-CG 4.07Å; W352-P360 HydrophobicContact CE3-CB 4.28Å; W352-P360 HydrophobicContact CZ3-CB 3.87Å; E353-P360 HydrophobicContact CG-CG 4.23Å; P360-K362 VanDerWaalsContact C-N 3.33Å; P360-K362 PolarHBondContact O-N 3.47Å; P360-L380 HydrophobicContact CB-CD1 3.97Å; P360-L380 HydrophobicContact CB-CD2 3.82Å
361	Y	92.4	Very high	91.3	Very high	7 Å²	7	32.3 Å²	32.3	3%	0.027	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	39.5	-173.5	-48.6	-75.1	0	0	0	114.3	A326 V359 D363 V364 I369 L378 Q379 L380 F445	A326-Y361 HydrophobicContact CB-CD2 3.68Å; A326-Y361 HydrophobicContact CB-CE2 4.21Å; V359-Y361 PolarHBondContact O-N 2.89Å; Y361-D363 PolarHBondContact O-N 3.24Å; Y361-V364 WeakPolarHBondContact O-CB 3.22Å; Y361-V364 WeakPolarHBondContact O-CG2 3.31Å; Y361-V364 PolarHBondContact O-N 3.12Å; Y361-I369 HydrophobicContact CD1-CG1 4.48Å; Y361-I369 HydrophobicContact CD2-CD1 4.18Å; Y361-I369 HydrophobicContact CD2-CG1 4.25Å; Y361-I369 HydrophobicContact CD2-CG2 4.02Å; Y361-I369 HydrophobicContact CE2-CG2 4.09Å; Y361-I369 HydrophobicContact CG-CD1 4.02Å; Y361-I369 HydrophobicContact CG-CG1 3.98Å; Y361-L378 HydrophobicContact CD1-CD2 4.2Å; Y361-L378 HydrophobicContact CE1-CD1 4.29Å; Y361-L378 HydrophobicContact CE1-CD2 3.88Å; Y361-L378 HydrophobicContact CE1-CG 3.81Å; Y361-Q379 WeakPolarHBondContact OH-CA 3.25Å; Y361-L380 HydrophobicContact CD1-CD2 3.78Å; Y361-L380 HydrophobicContact CD2-CD2 3.81Å; Y361-L380 HydrophobicContact CD2-CG 4.46Å; Y361-L380 HydrophobicContact CE1-CD2 3.69Å; Y361-L380 HydrophobicContact CE1-CG 4.02Å; Y361-L380 HydrophobicContact CE2-CD1 4.5Å; Y361-L380 HydrophobicContact CE2-CD2 3.73Å; Y361-L380 HydrophobicContact CE2-CG 3.89Å; Y361-L380 HydrophobicContact CG-CD2 3.84Å; Y361-L380 PolarHBondContact OH-N 2.9Å; Y361-F445 HydrophobicContact CD1-CE1 4.04Å; Y361-F445 VanDerWaalsContact N-CZ 3.25Å
362	K	91.3	Very high	90.8	Very high	66 Å²	66	32.7 Å²	32.7	29%	0.287	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-44	119.7	-179.9	-165.2	176.2	-173.7	176.2	0	113.5	E358 V359 P360 V364 F445 K449	E358-K362 IonicContact OE1-NZ 2.67Å; E358-K362 VanDerWaalsContact OE2-CD 3.3Å; E358-K362 WeakPolarHBondContact OE2-CD 3.28Å; E358-K362 IonicContact OE2-NZ 3.49Å; E358-K362 PolarHBondContact OE2-NZ 2.98Å; V359-K362 HydrophobicContact CB-CB 4.24Å; V359-K362 HydrophobicContact CB-CD 4.48Å; V359-K362 HydrophobicContact CB-CG 4.24Å; V359-K362 PolarHBondContact O-N 3.18Å; P360-K362 VanDerWaalsContact C-N 3.33Å; P360-K362 PolarHBondContact O-N 3.47Å; K362-V364 PolarHBondContact O-N 3.44Å; K362-V364 VanDerWaalsContact O-N 3.1Å; K362-F445 HydrophobicContact CB-CD2 3.98Å; K362-F445 HydrophobicContact CB-CE2 4.2Å; K362-K449 WeakPolarHBondContact O-CE 3.33Å; K362-K449 PolarHBondContact O-NZ 3.32Å
363	D	88.4	Confident	90.4	Very high	127 Å²	127	32.8 Å²	32.8	68%	0.679	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.3	19.3	-176.9	-2.1	-74.8	0	0	0	115.8	Y361 K449	Y361-D363 PolarHBondContact O-N 3.24Å; D363-K449 VanDerWaalsContact C-CE 3.45Å; D363-K449 WeakPolarHBondContact O-CE 3.33Å; D363-K449 IonicContact OD2-NZ 3.42Å; D363-K449 PolarHBondContact OD2-NZ 2.72Å
364	V	86.1	Confident	90	Very high	14 Å²	14	33 Å²	33	9%	0.085	18%	0.183	C	C	.	.			trans	-82.7	138.6	166.3	-175.8	0	0	0	0	108.3	Y361 K362 A368 I369 F445 I448 K449	Y361-V364 WeakPolarHBondContact O-CB 3.22Å; Y361-V364 WeakPolarHBondContact O-CG2 3.31Å; Y361-V364 PolarHBondContact O-N 3.12Å; K362-V364 PolarHBondContact O-N 3.44Å; K362-V364 VanDerWaalsContact O-N 3.1Å; V364-A368 HydrophobicContact CG1-CB 4.22Å; V364-I369 HydrophobicContact CB-CD1 4.35Å; V364-I369 HydrophobicContact CB-CG1 4.35Å; V364-I369 HydrophobicContact CG1-CG1 4.04Å; V364-F445 HydrophobicContact CG2-CB 4.45Å; V364-F445 HydrophobicContact CG2-CD1 4.46Å; V364-I448 HydrophobicContact CG1-CG2 3.99Å; V364-I448 HydrophobicContact CG2-CG2 4.18Å; V364-K449 HydrophobicContact CG2-CG 4.32Å
365	D	84.4	Confident	89.4	Confident	84 Å²	84	37.7 Å²	37.7	45%	0.449	21%	0.208	S	C	.	.			trans	-59.4	143.6	179.9	171.2	53.4	0	0	0	112.9	S367 A368 I369	D365-S367 PolarHBondContact O-N 3.09Å; D365-S367 PolarHBondContact OD1-OG 2.86Å; D365-S367 VanDerWaalsContact OD2-CA 3.26Å; D365-S367 WeakPolarHBondContact OD2-CA 3.43Å; D365-S367 WeakPolarHBondContact OD2-CB 3.47Å; D365-S367 PolarHBondContact OD2-N 3.48Å; D365-S367 PolarHBondContact OD2-OG 3.22Å; D365-A368 HydrophobicContact CB-CB 4.13Å; D365-A368 WeakPolarHBondContact O-CB 3.49Å; D365-A368 PolarHBondContact O-N 3.43Å; D365-A368 PolarHBondContact OD2-N 2.94Å; D365-I369 WeakPolarHBondContact O-CG1 3.32Å; D365-I369 PolarHBondContact O-N 2.96Å
366	S	84.6	Confident	88.9	Confident	66 Å²	66	40.7 Å²	40.7	46%	0.462	22%	0.224	S	C	.	.	H	α-helix	trans	-65	-39	179.3	-70.1	0	0	0	0	112.4	A368 I369 I370	S366-A368 VanDerWaalsContact C-N 3.29Å; S366-A368 PolarHBondContact O-N 3.24Å; S366-I369 PolarHBondContact O-N 3.22Å; S366-I370 WeakPolarHBondContact O-CB 3.33Å; S366-I370 VanDerWaalsContact O-CD1 3.31Å; S366-I370 WeakPolarHBondContact O-CD1 3.38Å; S366-I370 WeakPolarHBondContact O-CG1 3.41Å; S366-I370 PolarHBondContact O-N 2.85Å
367	S	82.6	Confident	88.4	Confident	57 Å²	57	44.4 Å²	44.4	40%	0.399	25%	0.25	S	S	.	.	H	α-helix	trans	-63	-37.5	175.7	-19.4	0	0	0	0	111.4	D365 W371	D365-S367 PolarHBondContact O-N 3.09Å; D365-S367 PolarHBondContact OD1-OG 2.86Å; D365-S367 VanDerWaalsContact OD2-CA 3.26Å; D365-S367 WeakPolarHBondContact OD2-CA 3.43Å; D365-S367 WeakPolarHBondContact OD2-CB 3.47Å; D365-S367 PolarHBondContact OD2-N 3.48Å; D365-S367 PolarHBondContact OD2-OG 3.22Å; S367-W371 WeakPolarHBondContact O-CB 3.5Å; S367-W371 PolarHBondContact O-N 3.38Å
368	A	84.1	Confident	88	Confident	5 Å²	5	45 Å²	45	4%	0.041	25%	0.251	C	S	.	.	H	α-helix	trans	-65.5	-42.3	173.3	0	0	0	0	0	113.4	V364 D365 S366 W371 G372 T453	V364-A368 HydrophobicContact CG1-CB 4.22Å; D365-A368 HydrophobicContact CB-CB 4.13Å; D365-A368 WeakPolarHBondContact O-CB 3.49Å; D365-A368 PolarHBondContact O-N 3.43Å; D365-A368 PolarHBondContact OD2-N 2.94Å; S366-A368 VanDerWaalsContact C-N 3.29Å; S366-A368 PolarHBondContact O-N 3.24Å; A368-W371 PolarHBondContact O-N 3.39Å; A368-G372 PolarHBondContact O-N 3.06Å; A368-T453 HydrophobicContact CB-CG2 3.37Å
369	I	87.5	Confident	87.8	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.036	26%	0.262	C	S	.	.	H	α-helix	trans	-65	-46.4	175.6	-61.4	160.1	0	0	0	110.1	V325 Y361 V364 D365 S366 W371 G372 V373	V325-I369 HydrophobicContact CB-CG2 4.39Å; V325-I369 HydrophobicContact CG2-CB 3.9Å; V325-I369 HydrophobicContact CG2-CD1 4.2Å; V325-I369 HydrophobicContact CG2-CG2 3.82Å; Y361-I369 HydrophobicContact CD1-CG1 4.48Å; Y361-I369 HydrophobicContact CD2-CD1 4.18Å; Y361-I369 HydrophobicContact CD2-CG1 4.25Å; Y361-I369 HydrophobicContact CD2-CG2 4.02Å; Y361-I369 HydrophobicContact CE2-CG2 4.09Å; Y361-I369 HydrophobicContact CG-CD1 4.02Å; Y361-I369 HydrophobicContact CG-CG1 3.98Å; V364-I369 HydrophobicContact CB-CD1 4.35Å; V364-I369 HydrophobicContact CB-CG1 4.35Å; V364-I369 HydrophobicContact CG1-CG1 4.04Å; D365-I369 WeakPolarHBondContact O-CG1 3.32Å; D365-I369 PolarHBondContact O-N 2.96Å; S366-I369 PolarHBondContact O-N 3.22Å; I369-W371 PolarHBondContact O-N 2.79Å; I369-G372 PolarHBondContact O-N 2.84Å; I369-V373 HydrophobicContact CG2-CG2 3.99Å; I369-V373 WeakPolarHBondContact O-CB 3.34Å; I369-V373 WeakPolarHBondContact O-CG2 3.38Å; I369-V373 PolarHBondContact O-N 3.48Å
370	I	87.4	Confident	87.8	Confident	53 Å²	53	45.7 Å²	45.7	27%	0.272	25%	0.251	S	S	.	.	H	α-helix	trans	-53.3	-52	174.7	-71.2	160.8	0	0	0	110.7	F321 V325 I333 S366 G374	F321-I370 HydrophobicContact CE1-CD1 4.24Å; F321-I370 HydrophobicContact CE2-CD1 4.45Å; F321-I370 HydrophobicContact CZ-CD1 3.56Å; F321-I370 HydrophobicContact CZ-CG1 3.96Å; V325-I370 HydrophobicContact CB-CG1 4.2Å; V325-I370 HydrophobicContact CG1-CD1 4.07Å; V325-I370 HydrophobicContact CG1-CG1 3.77Å; V325-I370 HydrophobicContact CG2-CG1 4.38Å; I333-I370 HydrophobicContact CG2-CB 4.4Å; I333-I370 HydrophobicContact CG2-CG2 3.9Å; I333-I370 WeakPolarHBondContact CG2-O 3.43Å; S366-I370 WeakPolarHBondContact O-CB 3.33Å; S366-I370 VanDerWaalsContact O-CD1 3.31Å; S366-I370 WeakPolarHBondContact O-CD1 3.38Å; S366-I370 WeakPolarHBondContact O-CG1 3.41Å; S366-I370 PolarHBondContact O-N 2.85Å; I370-G374 VanDerWaalsContact O-CA 3.32Å; I370-G374 WeakPolarHBondContact O-CA 3.38Å; I370-G374 PolarHBondContact O-N 2.94Å
371	W	85.5	Confident	87.8	Confident	107 Å²	107	46.2 Å²	46.2	41%	0.405	26%	0.255	S	S	.	.	H	α-helix	trans	-66.4	-48.7	-179	-175.8	-101.5	0	0	0	112.1	S367 A368 I369 N375 L458	S367-W371 WeakPolarHBondContact O-CB 3.5Å; S367-W371 PolarHBondContact O-N 3.38Å; A368-W371 PolarHBondContact O-N 3.39Å; I369-W371 PolarHBondContact O-N 2.79Å; W371-N375 WeakPolarHBondContact O-CB 3.37Å; W371-N375 PolarHBondContact O-N 2.84Å; W371-L458 HydrophobicContact CH2-CD1 4.32Å; W371-L458 HydrophobicContact CZ2-CD1 3.48Å; W371-L458 VanDerWaalsContact CZ2-CD1 3.48Å
372	G	88.1	Confident	88	Confident	7 Å²	7	47 Å²	47	7%	0.072	26%	0.26	C	S	.	.	H	α-helix	trans	-65.3	-51.2	-176.4	0	0	0	0	0	112.9	A368 I369 N376 S377 L378	A368-G372 PolarHBondContact O-N 3.06Å; I369-G372 PolarHBondContact O-N 2.84Å; G372-N376 PolarHBondContact O-N 3.08Å; G372-N376 VanDerWaalsContact O-N 3.15Å; G372-S377 PolarHBondContact O-N 2.95Å; G372-S377 PolarHBondContact O-OG 3.06Å; G372-L378 VanDerWaalsContact C-CB 3.49Å; G372-L378 PolarHBondContact O-N 2.78Å; G372-L378 VanDerWaalsContact O-N 3.08Å
373	V	91	Very high	88.2	Confident	2 Å²	2	44 Å²	44	1%	0.012	25%	0.247	C	C	.	.	H	α-helix	trans	-70.9	-41.8	179.5	-179.1	0	0	0	0	110.1	P330 I333 W345 I369 N375 N376 L378	P330-V373 HydrophobicContact CB-CG1 4.49Å; P330-V373 WeakPolarHBondContact CB-O 3Å; P330-V373 HydrophobicContact CG-CG1 3.86Å; I333-V373 HydrophobicContact CD1-CB 3.79Å; I333-V373 HydrophobicContact CD1-CG1 3.64Å; W345-V373 HydrophobicContact CH2-CG1 4.11Å; W345-V373 HydrophobicContact CZ2-CG1 3.57Å; I369-V373 HydrophobicContact CG2-CG2 3.99Å; I369-V373 WeakPolarHBondContact O-CB 3.34Å; I369-V373 WeakPolarHBondContact O-CG2 3.38Å; I369-V373 PolarHBondContact O-N 3.48Å; V373-N375 VanDerWaalsContact C-N 3.33Å; V373-N375 PolarHBondContact O-N 3.18Å; V373-N376 WeakPolarHBondContact O-CA 3.06Å; V373-N376 PolarHBondContact O-N 3.37Å; V373-L378 HydrophobicContact CG2-CB 4.37Å; V373-L378 HydrophobicContact CG2-CD2 4.42Å; V373-L378 HydrophobicContact CG2-CG 4.49Å
374	G	87.9	Confident	88.4	Confident	10 Å²	10	44.2 Å²	44.2	10%	0.103	25%	0.248	C	C	.	.	H	α-helix	trans	-59.5	-38.3	176.3	0	0	0	0	0	113.4	R334 I370 N376	R334-G374 WeakPolarHBondContact CD-O 3.16Å; R334-G374 PolarHBondContact NH1-O 3.17Å; I370-G374 VanDerWaalsContact O-CA 3.32Å; I370-G374 WeakPolarHBondContact O-CA 3.38Å; I370-G374 PolarHBondContact O-N 2.94Å; G374-N376 VanDerWaalsContact C-N 3.3Å
375	N	86.2	Confident	88.7	Confident	98 Å²	98	46.5 Å²	46.5	52%	0.524	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-0.5	174.3	-164	45.3	0	0	0	113.5	W371 V373 S377	W371-N375 WeakPolarHBondContact O-CB 3.37Å; W371-N375 PolarHBondContact O-N 2.84Å; V373-N375 VanDerWaalsContact C-N 3.33Å; V373-N375 PolarHBondContact O-N 3.18Å; N375-S377 PolarHBondContact O-N 3.43Å
376	N	85.8	Confident	89.2	Confident	65 Å²	65	42.6 Å²	42.6	35%	0.348	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	26.4	-175.7	-35.8	-94.9	0	0	0	113.9	P330 R334 G372 V373 G374 C400	P330-N376 WeakPolarHBondContact CB-OD1 3.21Å; R334-N376 PolarHBondContact NH1-ND2 2.77Å; R334-N376 PolarHBondContact NH1-OD1 2.77Å; G372-N376 PolarHBondContact O-N 3.08Å; G372-N376 VanDerWaalsContact O-N 3.15Å; V373-N376 WeakPolarHBondContact O-CA 3.06Å; V373-N376 PolarHBondContact O-N 3.37Å; G374-N376 VanDerWaalsContact C-N 3.3Å; N376-C400 HydrophobicContact CB-CB 4.18Å
377	S	83.4	Confident	89.7	Confident	79 Å²	79	41 Å²	41	55%	0.552	23%	0.233	S	C	*	.			trans	-106.6	5.7	178.5	66.1	0	0	0	0	113.8	G372 N375	G372-S377 PolarHBondContact O-N 2.95Å; G372-S377 PolarHBondContact O-OG 3.06Å; N375-S377 PolarHBondContact O-N 3.43Å
378	L	87.2	Confident	90.3	Very high	26 Å²	26	43.8 Å²	43.8	14%	0.136	24%	0.243	C	C	.	.			trans	-138.5	139.1	174.2	-176.3	65.7	0	0	0	109.8	Y361 G372 V373 I448	Y361-L378 HydrophobicContact CD1-CD2 4.2Å; Y361-L378 HydrophobicContact CE1-CD1 4.29Å; Y361-L378 HydrophobicContact CE1-CD2 3.88Å; Y361-L378 HydrophobicContact CE1-CG 3.81Å; G372-L378 VanDerWaalsContact C-CB 3.49Å; G372-L378 PolarHBondContact O-N 2.78Å; G372-L378 VanDerWaalsContact O-N 3.08Å; V373-L378 HydrophobicContact CG2-CB 4.37Å; V373-L378 HydrophobicContact CG2-CD2 4.42Å; V373-L378 HydrophobicContact CG2-CG 4.49Å; L378-I448 HydrophobicContact CD1-CD1 3.88Å; L378-I448 HydrophobicContact CD1-CG1 4.27Å; L378-I448 HydrophobicContact CD1-CG2 4.36Å
379	Q	90.8	Very high	90.8	Very high	66 Å²	66	45.4 Å²	45.4	31%	0.308	25%	0.254	S	S	.	.			trans	-143.5	169.6	169.7	-61.6	-166.3	-14.4	0	0	107.9	W345 Y361 W398	W345-Q379 HydrophobicContact CH2-CG 4.35Å; Y361-Q379 WeakPolarHBondContact OH-CA 3.25Å; Q379-W398 PolarHBondContact NE2-O 2.72Å
380	L	95.1	Very high	91.1	Very high	7 Å²	7	45.1 Å²	45.1	4%	0.037	25%	0.253	C	S	.	.	P	Polyproline II helix	trans	-70.4	140.6	173.4	-70.1	164.2	0	0	0	110.3	V349 W352 P360 Y361 V382 W398 F445	V349-L380 HydrophobicContact CB-CD1 4.31Å; V349-L380 HydrophobicContact CG1-CD1 3.87Å; V349-L380 HydrophobicContact CG2-CD1 4.01Å; W352-L380 HydrophobicContact CD2-CB 4.26Å; W352-L380 HydrophobicContact CD2-CD1 3.88Å; W352-L380 HydrophobicContact CD2-CG 4.45Å; W352-L380 HydrophobicContact CE3-CD1 3.89Å; W352-L380 HydrophobicContact CE3-CD2 4.46Å; W352-L380 HydrophobicContact CG-CB 4.43Å; W352-L380 HydrophobicContact CG-CD1 4.2Å; W352-L380 HydrophobicContact CH2-CD2 4.12Å; W352-L380 HydrophobicContact CZ2-CB 4.42Å; W352-L380 HydrophobicContact CZ2-CD2 4.14Å; W352-L380 HydrophobicContact CZ3-CD1 4.45Å; W352-L380 HydrophobicContact CZ3-CD2 4.27Å; P360-L380 HydrophobicContact CB-CD1 3.97Å; P360-L380 HydrophobicContact CB-CD2 3.82Å; Y361-L380 HydrophobicContact CD1-CD2 3.78Å; Y361-L380 HydrophobicContact CD2-CD2 3.81Å; Y361-L380 HydrophobicContact CD2-CG 4.46Å; Y361-L380 HydrophobicContact CE1-CD2 3.69Å; Y361-L380 HydrophobicContact CE1-CG 4.02Å; Y361-L380 HydrophobicContact CE2-CD1 4.5Å; Y361-L380 HydrophobicContact CE2-CD2 3.73Å; Y361-L380 HydrophobicContact CE2-CG 3.89Å; Y361-L380 HydrophobicContact CG-CD2 3.84Å; Y361-L380 PolarHBondContact OH-N 2.9Å; L380-V382 PolarHBondContact O-N 3.11Å; L380-W398 HydrophobicContact CB-CH2 3.64Å; L380-W398 HydrophobicContact CB-CZ2 4.22Å; L380-W398 HydrophobicContact CB-CZ3 3.98Å; L380-W398 HydrophobicContact CD1-CH2 4.08Å; L380-W398 HydrophobicContact CD1-CZ2 3.86Å; L380-W398 HydrophobicContact CG-CH2 4.44Å; L380-F445 HydrophobicContact CD2-CE1 4.02Å; L380-F445 HydrophobicContact CD2-CZ 3.81Å
381	P	94.8	Very high	91.5	Very high	18 Å²	18	43.6 Å²	43.6	12%	0.117	24%	0.244	C	C	.	.	P	Polyproline II helix	trans	-65.7	126.3	176.4	26.4	-32.4	0	0	0	110.1	W352 V441 N444 F445	W352-P381 PolarHBondContact NE1-O 3.49Å; P381-V441 HydrophobicContact CG-CB 4.48Å; P381-V441 HydrophobicContact CG-CG1 4.37Å; P381-V441 HydrophobicContact CG-CG2 4.2Å; P381-N444 HydrophobicContact CB-CB 3.75Å; P381-N444 HydrophobicContact CG-CB 3.82Å; P381-F445 HydrophobicContact CG-CD1 4.45Å; P381-F445 HydrophobicContact CG-CE1 3.94Å; P381-F445 HydrophobicContact CG-CZ 4.28Å
382	V	96.1	Very high	92.1	Very high	24 Å²	24	43.2 Å²	43.2	15%	0.145	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-95.8	116.4	174.6	178.5	0	0	0	0	107.7	L380 K391 L394 W398	L380-V382 PolarHBondContact O-N 3.11Å; V382-K391 HydrophobicContact CG1-CB 4Å; V382-K391 HydrophobicContact CG1-CD 4.19Å; V382-K391 HydrophobicContact CG1-CG 3.77Å; V382-L394 HydrophobicContact CG1-CD1 4.23Å; V382-L394 HydrophobicContact CG2-CB 4.3Å; V382-L394 HydrophobicContact CG2-CD1 4.13Å; V382-W398 HydrophobicContact CG2-CE3 4.48Å; V382-W398 HydrophobicContact CG2-CH2 4.46Å; V382-W398 HydrophobicContact CG2-CZ3 3.65Å
383	P	95.1	Very high	92.5	Very high	2 Å²	2	43 Å²	43	1%	0.013	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-57.8	141	-174.6	-23.4	30.5	0	0	0	113.5	T356 S385 C386 K391 W437 E440 V441	T356-P383 HydrophobicContact CG2-CG 4.32Å; P383-S385 VanDerWaalsContact C-N 3.32Å; P383-S385 PolarHBondContact O-N 3.28Å; P383-C386 HydrophobicContact CB-CB 4.15Å; P383-C386 WeakPolarHBondContact O-CB 3.43Å; P383-C386 PolarHBondContact O-N 3.16Å; P383-K391 WeakPolarHBondContact O-CE 3.41Å; P383-W437 HydrophobicContact CB-CB 3.9Å; P383-W437 HydrophobicContact CB-CD2 4.44Å; P383-W437 HydrophobicContact CB-CG 3.61Å; P383-W437 HydrophobicContact CG-CB 3.63Å; P383-W437 HydrophobicContact CG-CD2 4.48Å; P383-W437 HydrophobicContact CG-CG 3.74Å; P383-E440 WeakPolarHBondContact CA-OE1 3.47Å; P383-E440 VanDerWaalsContact CA-OE2 3.25Å; P383-E440 WeakPolarHBondContact CA-OE2 3.31Å; P383-E440 WeakPolarHBondContact CB-OE2 3.35Å; P383-V441 HydrophobicContact CG-CG2 4.13Å
384	D	92.3	Very high	92.8	Very high	131 Å²	131	42.9 Å²	42.9	70%	0.701	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-26.2	-173.5	-95	-21.5	0	0	0	112.9	K391 E440	D384-K391 VanDerWaalsContact C-CE 3.5Å; D384-K391 WeakPolarHBondContact O-CE 3.47Å; D384-K391 PolarHBondContact O-NZ 3.39Å; D384-E440 PolarHBondContact N-OE2 2.9Å
385	S	93.9	Very high	93.2	Very high	62 Å²	62	48 Å²	48	43%	0.434	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	2	173.3	62.9	0	0	0	0	114.8	P383 W437	P383-S385 VanDerWaalsContact C-N 3.32Å; P383-S385 PolarHBondContact O-N 3.28Å; S385-W437 VanDerWaalsContact OG-CD1 3.28Å; S385-W437 PolarHBondContact OG-NE1 3.09Å
386	C	94.4	Very high	93.8	Very high	3 Å²	3	45.8 Å²	45.8	2%	0.02	25%	0.252	C	S	.	.	S	Bend	trans	-63.5	142.1	172.9	-176.3	0	0	0	0	111	P383 D388 K391 W437	P383-C386 HydrophobicContact CB-CB 4.15Å; P383-C386 WeakPolarHBondContact O-CB 3.43Å; P383-C386 PolarHBondContact O-N 3.16Å; C386-D388 PolarHBondContact O-N 3.13Å; C386-K391 HydrophobicContact CB-CG 4.06Å; C386-K391 WeakPolarHBondContact O-CE 3.45Å; C386-K391 WeakPolarHBondContact O-CG 3.2Å; C386-K391 PolarHBondContact O-NZ 2.97Å; C386-W437 HydrophobicContact CB-CZ2 4.4Å
387	P	94.7	Very high	94.4	Very high	33 Å²	33	42.7 Å²	42.7	21%	0.214	24%	0.235	C	C	.	.			trans	-60.7	136.1	-177.9	-20.6	31.1	0	0	0	112.2	S389 F390 K391	P387-S389 PolarHBondContact O-N 2.55Å; P387-S389 VanDerWaalsContact O-N 3.13Å; P387-F390 HydrophobicContact CB-CD2 4.15Å; P387-F390 HydrophobicContact CG-CD2 4.35Å; P387-F390 WeakPolarHBondContact O-CA 3.49Å; P387-F390 PolarHBondContact O-N 3.19Å; P387-K391 PolarHBondContact O-N 3.48Å
388	D	94.5	Very high	95	Very high	114 Å²	114	39.2 Å²	39.2	61%	0.61	21%	0.21	S	C	*	.	H	α-helix	trans	-62.3	-27.9	-168.7	-75.6	-32.5	0	0	0	113.7	C386 F390 K391 L392	C386-D388 PolarHBondContact O-N 3.13Å; D388-F390 VanDerWaalsContact C-N 3.3Å; D388-F390 PolarHBondContact O-N 3.43Å; D388-K391 PolarHBondContact O-N 2.71Å; D388-K391 WeakPolarHBondContact OD1-CD 3.42Å; D388-K391 IonicContact OD1-NZ 3.36Å; D388-K391 PolarHBondContact OD1-NZ 3.34Å; D388-L392 VanDerWaalsContact O-CB 3.28Å; D388-L392 WeakPolarHBondContact O-CB 3.23Å; D388-L392 PolarHBondContact O-N 3.17Å
389	S	94	Very high	95.5	Very high	40 Å²	40	40.4 Å²	40.4	28%	0.28	22%	0.217	S	C	.	.	H	α-helix	trans	-55.7	-42.2	170.5	-54	0	0	0	0	112.1	P387 L393 D421	P387-S389 PolarHBondContact O-N 2.55Å; P387-S389 VanDerWaalsContact O-N 3.13Å; S389-L393 WeakPolarHBondContact O-CB 3.47Å; S389-L393 PolarHBondContact O-N 3.37Å; S389-D421 WeakPolarHBondContact CB-OD2 3.08Å; S389-D421 PolarHBondContact OG-OD2 3Å
390	F	95.8	Very high	95.6	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-77.5	-40.7	173.6	-69.3	-76.5	0	0	0	112.5	M265 L351 L355 P387 D388 L392 L393 L394 L415 A418 I422	M265-F390 HydrophobicContact CE-CE1 3.6Å; M265-F390 HydrophobicContact CE-CE2 4.43Å; M265-F390 HydrophobicContact CE-CZ 3.32Å; M265-F390 HydrophobicContact SD-CE1 4.46Å; M265-F390 HydrophobicContact SD-CZ 3.87Å; L351-F390 HydrophobicContact CD1-CD1 4.45Å; L351-F390 HydrophobicContact CD2-CD1 4.45Å; L355-F390 HydrophobicContact CD1-CB 4.05Å; L355-F390 HydrophobicContact CD1-CD1 4.11Å; L355-F390 HydrophobicContact CD1-CG 4.26Å; L355-F390 HydrophobicContact CD2-CD1 4.33Å; L355-F390 HydrophobicContact CD2-CG 4.2Å; P387-F390 HydrophobicContact CB-CD2 4.15Å; P387-F390 HydrophobicContact CG-CD2 4.35Å; P387-F390 WeakPolarHBondContact O-CA 3.49Å; P387-F390 PolarHBondContact O-N 3.19Å; D388-F390 VanDerWaalsContact C-N 3.3Å; D388-F390 PolarHBondContact O-N 3.43Å; F390-L392 PolarHBondContact O-N 3.4Å; F390-L393 PolarHBondContact O-N 3.17Å; F390-L394 WeakPolarHBondContact O-CG 3.34Å; F390-L394 PolarHBondContact O-N 3.29Å; F390-L415 HydrophobicContact CE1-CD2 3.86Å; F390-A418 HydrophobicContact CD2-CB 4.29Å; F390-A418 HydrophobicContact CE1-CB 4.1Å; F390-A418 HydrophobicContact CE2-CB 3.65Å; F390-A418 HydrophobicContact CZ-CB 3.52Å; F390-I422 HydrophobicContact CD2-CD1 4.16Å; F390-I422 HydrophobicContact CE2-CB 3.98Å; F390-I422 HydrophobicContact CE2-CD1 3.66Å; F390-I422 HydrophobicContact CE2-CG1 4.46Å; F390-I422 HydrophobicContact CE2-CG2 4.02Å; F390-I422 HydrophobicContact CZ-CD1 4.16Å; F390-I422 HydrophobicContact CZ-CG2 4.13Å
391	K	95.9	Very high	95.5	Very high	22 Å²	22	45.4 Å²	45.4	10%	0.096	24%	0.243	C	C	.	.	H	α-helix	trans	-55.3	-42.7	175.3	-60.3	-157.5	-171.4	89.2	0	111.7	V382 P383 D384 C386 P387 D388 K395	V382-K391 HydrophobicContact CG1-CB 4Å; V382-K391 HydrophobicContact CG1-CD 4.19Å; V382-K391 HydrophobicContact CG1-CG 3.77Å; P383-K391 WeakPolarHBondContact O-CE 3.41Å; D384-K391 VanDerWaalsContact C-CE 3.5Å; D384-K391 WeakPolarHBondContact O-CE 3.47Å; D384-K391 PolarHBondContact O-NZ 3.39Å; C386-K391 HydrophobicContact CB-CG 4.06Å; C386-K391 WeakPolarHBondContact O-CE 3.45Å; C386-K391 WeakPolarHBondContact O-CG 3.2Å; C386-K391 PolarHBondContact O-NZ 2.97Å; P387-K391 PolarHBondContact O-N 3.48Å; D388-K391 PolarHBondContact O-N 2.71Å; D388-K391 WeakPolarHBondContact OD1-CD 3.42Å; D388-K391 IonicContact OD1-NZ 3.36Å; D388-K391 PolarHBondContact OD1-NZ 3.34Å; K391-K395 WeakPolarHBondContact O-CB 3.45Å; K391-K395 WeakPolarHBondContact O-CD 3.41Å; K391-K395 WeakPolarHBondContact O-CG 3.35Å; K391-K395 PolarHBondContact O-N 3.19Å; K391-K395 VanDerWaalsContact O-N 3.16Å
392	L	96.3	Very high	95.5	Very high	98 Å²	98	46.1 Å²	46.1	51%	0.513	25%	0.248	S	C	.	.	H	α-helix	trans	-67.5	-45.8	178.8	-180	59.6	0	0	0	111.3	D388 F390 K395 Q396	D388-L392 VanDerWaalsContact O-CB 3.28Å; D388-L392 WeakPolarHBondContact O-CB 3.23Å; D388-L392 PolarHBondContact O-N 3.17Å; F390-L392 PolarHBondContact O-N 3.4Å; L392-K395 PolarHBondContact O-N 3.15Å; L392-Q396 HydrophobicContact CD1-CG 4.32Å; L392-Q396 WeakPolarHBondContact O-CB 3.3Å; L392-Q396 VanDerWaalsContact O-CG 3.31Å; L392-Q396 WeakPolarHBondContact O-CG 3.49Å; L392-Q396 PolarHBondContact O-N 2.96Å
393	L	97.4	Very high	95.5	Very high	2 Å²	2	54.8 Å²	54.8	1%	0.01	28%	0.278	C	S	.	.	H	α-helix	trans	-61.1	-45.3	179.2	-176.9	56.4	0	0	0	112	L351 S389 F390 Q396 C397 I411 H414 L415	L351-L393 HydrophobicContact CD2-CD2 3.78Å; L351-L393 HydrophobicContact CD2-CG 4.16Å; S389-L393 WeakPolarHBondContact O-CB 3.47Å; S389-L393 PolarHBondContact O-N 3.37Å; F390-L393 PolarHBondContact O-N 3.17Å; L393-Q396 PolarHBondContact O-N 3.46Å; L393-C397 PolarHBondContact O-N 3.47Å; L393-C397 PolarHBondContact O-SG 2.65Å; L393-C397 VanDerWaalsContact O-SG 3.37Å; L393-I411 HydrophobicContact CD1-CG1 4.19Å; L393-I411 HydrophobicContact CD1-CG2 4.41Å; L393-I411 HydrophobicContact CD2-CG2 4.46Å; L393-H414 HydrophobicContact CD1-CB 4.05Å; L393-H414 HydrophobicContact CD2-CB 4.46Å; L393-L415 HydrophobicContact CD2-CD2 3.57Å; L393-L415 HydrophobicContact CD2-CG 3.88Å
394	L	97.7	Very high	95.6	Very high	1 Å²	1	58.6 Å²	58.6	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-59.6	-48.2	174.8	-68.1	175.3	0	0	0	111.7	G348 L351 W352 L355 V382 F390 Q396 C397 W398	G348-L394 WeakPolarHBondContact O-CD2 3.49Å; L351-L394 HydrophobicContact CB-CD2 4.17Å; L351-L394 HydrophobicContact CD2-CD2 4.04Å; L351-L394 HydrophobicContact CG-CD2 4.09Å; W352-L394 HydrophobicContact CB-CD1 4.44Å; W352-L394 HydrophobicContact CB-CD2 4.08Å; L355-L394 HydrophobicContact CD1-CD1 4.06Å; V382-L394 HydrophobicContact CG1-CD1 4.23Å; V382-L394 HydrophobicContact CG2-CB 4.3Å; V382-L394 HydrophobicContact CG2-CD1 4.13Å; F390-L394 WeakPolarHBondContact O-CG 3.34Å; F390-L394 PolarHBondContact O-N 3.29Å; L394-Q396 VanDerWaalsContact C-N 3.26Å; L394-Q396 PolarHBondContact O-N 2.82Å; L394-C397 PolarHBondContact O-N 3.45Å; L394-W398 HydrophobicContact CB-CE3 4.36Å; L394-W398 HydrophobicContact CB-CH2 4.28Å; L394-W398 HydrophobicContact CB-CZ3 4.09Å; L394-W398 HydrophobicContact CD1-CH2 4.37Å; L394-W398 HydrophobicContact CD2-CH2 4.06Å; L394-W398 HydrophobicContact CD2-CZ2 4.06Å; L394-W398 HydrophobicContact CG-CH2 4.48Å; L394-W398 PolarHBondContact O-N 2.89Å
395	K	96.4	Very high	95.9	Very high	116 Å²	116	52.5 Å²	52.5	50%	0.504	27%	0.265	S	S	.	.	H	α-helix	trans	-63.8	-27.3	177.6	-71.2	169.1	-175.5	174.4	0	113.1	K391 L392	K391-K395 WeakPolarHBondContact O-CB 3.45Å; K391-K395 WeakPolarHBondContact O-CD 3.41Å; K391-K395 WeakPolarHBondContact O-CG 3.35Å; K391-K395 PolarHBondContact O-N 3.19Å; K391-K395 VanDerWaalsContact O-N 3.16Å; L392-K395 PolarHBondContact O-N 3.15Å
396	Q	97.6	Very high	96.1	Very high	53 Å²	53	49.9 Å²	49.9	25%	0.248	25%	0.247	C	C	.	.	H	α-helix	trans	-76.1	-43.5	171.8	-74.3	-179.3	14	0	0	112.3	L392 L393 L394 W398 N399 P406	L392-Q396 HydrophobicContact CD1-CG 4.32Å; L392-Q396 WeakPolarHBondContact O-CB 3.3Å; L392-Q396 VanDerWaalsContact O-CG 3.31Å; L392-Q396 WeakPolarHBondContact O-CG 3.49Å; L392-Q396 PolarHBondContact O-N 2.96Å; L393-Q396 PolarHBondContact O-N 3.46Å; L394-Q396 VanDerWaalsContact C-N 3.26Å; L394-Q396 PolarHBondContact O-N 2.82Å; Q396-W398 VanDerWaalsContact C-N 3.33Å; Q396-W398 PolarHBondContact O-N 2.77Å; Q396-N399 PolarHBondContact O-N 2.99Å; Q396-P406 HydrophobicContact CB-CG 4.36Å
397	C	98.3	Very high	96.3	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.6	-38.2	175.9	-71.1	0	0	0	0	112.1	I344 L393 L394 N399 R405	I344-C397 HydrophobicContact CG2-CB 4.3Å; L393-C397 PolarHBondContact O-N 3.47Å; L393-C397 PolarHBondContact O-SG 2.65Å; L393-C397 VanDerWaalsContact O-SG 3.37Å; L394-C397 PolarHBondContact O-N 3.45Å; C397-N399 VanDerWaalsContact C-N 3.29Å; C397-N399 PolarHBondContact O-N 2.9Å; C397-R405 WeakPolarHBondContact O-CD 3.35Å; C397-R405 WeakPolarHBondContact O-CG 3.46Å; C397-R405 PolarHBondContact O-NE 3.12Å
398	W	97.6	Very high	96.5	Very high	5 Å²	5	49.7 Å²	49.7	2%	0.019	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	27.2	177	-55.4	-34.7	0	0	0	114.5	W345 G348 V349 W352 Q379 L380 V382 L394 Q396 C400	W345-W398 AromaticContact CD2-CD1 3.71Å; W345-W398 HydrophobicContact CD2-CG 4.47Å; W345-W398 AromaticContact CE2-CD1 3.9Å; W345-W398 HydrophobicContact CE3-CB 4.03Å; W345-W398 AromaticContact CE3-CD1 3.98Å; W345-W398 HydrophobicContact CE3-CG 4.38Å; W345-W398 HydrophobicContact CH2-CB 4.09Å; W345-W398 HydrophobicContact CH2-CG 4.48Å; W345-W398 HydrophobicContact CZ3-CB 3.76Å; W345-W398 HydrophobicContact CZ3-CG 4.39Å; W345-W398 WeakPolarHBondContact CZ3-O 3.46Å; W345-W398 PolarHBondContact O-NE1 2.87Å; G348-W398 VanDerWaalsContact O-CZ2 3.29Å; G348-W398 WeakPolarHBondContact O-CZ2 3.39Å; V349-W398 HydrophobicContact CG2-CZ2 4.39Å; W352-W398 HydrophobicContact CB-CH2 3.81Å; W352-W398 HydrophobicContact CB-CZ2 3.92Å; W352-W398 AromaticContact CD1-CH2 3.74Å; W352-W398 AromaticContact CG-CH2 3.87Å; W352-W398 HydrophobicContact CG-CH2 3.87Å; W352-W398 HydrophobicContact CG-CZ2 4.37Å; Q379-W398 PolarHBondContact NE2-O 2.72Å; L380-W398 HydrophobicContact CB-CH2 3.64Å; L380-W398 HydrophobicContact CB-CZ2 4.22Å; L380-W398 HydrophobicContact CB-CZ3 3.98Å; L380-W398 HydrophobicContact CD1-CH2 4.08Å; L380-W398 HydrophobicContact CD1-CZ2 3.86Å; L380-W398 HydrophobicContact CG-CH2 4.44Å; V382-W398 HydrophobicContact CG2-CE3 4.48Å; V382-W398 HydrophobicContact CG2-CH2 4.46Å; V382-W398 HydrophobicContact CG2-CZ3 3.65Å; L394-W398 HydrophobicContact CB-CE3 4.36Å; L394-W398 HydrophobicContact CB-CH2 4.28Å; L394-W398 HydrophobicContact CB-CZ3 4.09Å; L394-W398 HydrophobicContact CD1-CH2 4.37Å; L394-W398 HydrophobicContact CD2-CH2 4.06Å; L394-W398 HydrophobicContact CD2-CZ2 4.06Å; L394-W398 HydrophobicContact CG-CH2 4.48Å; L394-W398 PolarHBondContact O-N 2.89Å; Q396-W398 VanDerWaalsContact C-N 3.33Å; Q396-W398 PolarHBondContact O-N 2.77Å; W398-C400 PolarHBondContact O-N 2.93Å
399	N	96.8	Very high	96.7	Very high	52 Å²	52	53.5 Å²	53.5	28%	0.278	25%	0.252	S	S	.	.			trans	-66.3	128.4	173	-154	-81.2	0	0	0	110.9	Q396 C397 K401 N404 R405	Q396-N399 PolarHBondContact O-N 2.99Å; C397-N399 VanDerWaalsContact C-N 3.29Å; C397-N399 PolarHBondContact O-N 2.9Å; N399-K401 PolarHBondContact O-N 2.81Å; N399-K401 VanDerWaalsContact O-N 3.12Å; N399-K401 PolarHBondContact OD1-N 3.04Å; N399-N404 HydrophobicContact CB-CB 4.07Å; N399-N404 VanDerWaalsContact OD1-CB 3.31Å; N399-N404 WeakPolarHBondContact OD1-CB 3.47Å; N399-N404 PolarHBondContact OD1-ND2 3.02Å; N399-N404 VanDerWaalsContact OD1-ND2 3.14Å; N399-R405 HydrophobicContact CB-CG 3.97Å; N399-R405 PolarHBondContact O-NE 3.05Å; N399-R405 PolarHBondContact O-NH2 3.38Å
400	C	92.3	Very high	96.9	Very high	51 Å²	51	56.2 Å²	56.2	35%	0.345	26%	0.26	S	S	.	.	S	Bend	trans	-62.5	-22.1	-177.2	-44.5	0	0	0	0	113.2	N376 W398	N376-C400 HydrophobicContact CB-CB 4.18Å; W398-C400 PolarHBondContact O-N 2.93Å
401	K	93.5	Very high	97	Very high	126 Å²	126	56.2 Å²	56.2	55%	0.548	26%	0.26	S	S	.	.	S	Bend	trans	-97.9	111.8	174.5	-69.4	174.1	-177.7	171.7	0	108.5	N399 R403 N404	N399-K401 PolarHBondContact O-N 2.81Å; N399-K401 VanDerWaalsContact O-N 3.12Å; N399-K401 PolarHBondContact OD1-N 3.04Å; K401-R403 VanDerWaalsContact C-N 3.27Å; K401-R403 PolarHBondContact O-N 2.86Å; K401-R403 VanDerWaalsContact O-N 3.13Å; K401-N404 HydrophobicContact CB-CB 4.32Å; K401-N404 WeakPolarHBondContact O-CB 3.39Å; K401-N404 PolarHBondContact O-N 2.89Å
402	P	95.6	Very high	97.1	Very high	34 Å²	34	56.9 Å²	56.9	22%	0.221	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-58	-37.5	-170	-26.4	34.9	0	0	0	113.6	E331 K341 N404 R405	E331-P402 VanDerWaalsContact CD-CG 3.46Å; E331-P402 HydrophobicContact CG-CG 4.21Å; E331-P402 VanDerWaalsContact OE1-CG 3.22Å; E331-P402 WeakPolarHBondContact OE1-CG 3.44Å; K341-P402 HydrophobicContact CB-CB 3.78Å; K341-P402 WeakPolarHBondContact CB-O 3.34Å; K341-P402 HydrophobicContact CG-CB 4.47Å; K341-P402 WeakPolarHBondContact CG-O 3.43Å; P402-N404 PolarHBondContact O-N 2.73Å; P402-N404 VanDerWaalsContact O-N 3.15Å; P402-R405 WeakPolarHBondContact O-CB 3.39Å; P402-R405 PolarHBondContact O-N 3Å
403	R	95.6	Very high	97.2	Very high	206 Å²	206	57 Å²	57	78%	0.777	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-59.5	-21.6	175.7	78.1	-175	-166.6	-177.5	6.7	114.9	K401	K401-R403 VanDerWaalsContact C-N 3.27Å; K401-R403 PolarHBondContact O-N 2.86Å; K401-R403 VanDerWaalsContact O-N 3.13Å
404	N	97.1	Very high	97.2	Very high	81 Å²	81	59.8 Å²	59.8	43%	0.433	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-87.8	-12.7	179.8	-67	6.3	0	0	0	111.9	N399 K401 P402	N399-N404 HydrophobicContact CB-CB 4.07Å; N399-N404 VanDerWaalsContact OD1-CB 3.31Å; N399-N404 WeakPolarHBondContact OD1-CB 3.47Å; N399-N404 PolarHBondContact OD1-ND2 3.02Å; N399-N404 VanDerWaalsContact OD1-ND2 3.14Å; K401-N404 HydrophobicContact CB-CB 4.32Å; K401-N404 WeakPolarHBondContact O-CB 3.39Å; K401-N404 PolarHBondContact O-N 2.89Å; P402-N404 PolarHBondContact O-N 2.73Å; P402-N404 VanDerWaalsContact O-N 3.15Å
405	R	98.3	Very high	97.2	Very high	3 Å²	3	59.8 Å²	59.8	1%	0.011	28%	0.278	C	S	.	.	S	Bend	trans	-73.8	145	176.3	-55.2	176	-169.5	145.4	10.9	109.6	E331 K341 I344 C397 N399 P402	E331-R405 IonicContact OE1-CZ 3.76Å; E331-R405 IonicContact OE1-NH1 2.68Å; E331-R405 PolarHBondContact OE1-NH1 3.46Å; E331-R405 IonicContact OE1-NH2 3.24Å; E331-R405 PolarHBondContact OE1-NH2 3.12Å; E331-R405 IonicContact OE2-CZ 2.94Å; E331-R405 IonicContact OE2-NH1 3.59Å; E331-R405 PolarHBondContact OE2-NH1 3.21Å; E331-R405 IonicContact OE2-NH2 3.93Å; E331-R405 PolarHBondContact OE2-NH2 2.89Å; K341-R405 HydrophobicContact CD-CB 4.39Å; K341-R405 PolarHBondContact NZ-O 3.27Å; K341-R405 WeakPolarHBondContact O-CD 3.39Å; K341-R405 PolarHBondContact O-NH1 3.4Å; I344-R405 HydrophobicContact CB-CB 4.34Å; I344-R405 HydrophobicContact CG2-CB 3.71Å; C397-R405 WeakPolarHBondContact O-CD 3.35Å; C397-R405 WeakPolarHBondContact O-CG 3.46Å; C397-R405 PolarHBondContact O-NE 3.12Å; N399-R405 HydrophobicContact CB-CG 3.97Å; N399-R405 PolarHBondContact O-NE 3.05Å; N399-R405 PolarHBondContact O-NH2 3.38Å; P402-R405 WeakPolarHBondContact O-CB 3.39Å; P402-R405 PolarHBondContact O-N 3Å
406	P	98.3	Very high	97.2	Very high	7 Å²	7	58.8 Å²	58.8	5%	0.045	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-60.8	165.2	179.5	24.5	-33.6	0	0	0	112.1	K341 I344 Q396 Q410 I411	K341-P406 PolarHBondContact NZ-O 3.39Å; I344-P406 VanDerWaalsContact CD1-O 3.29Å; I344-P406 WeakPolarHBondContact CD1-O 3.48Å; I344-P406 WeakPolarHBondContact CG1-O 3.39Å; I344-P406 HydrophobicContact CG2-CG 4.22Å; Q396-P406 HydrophobicContact CB-CG 4.36Å; P406-Q410 HydrophobicContact CB-CB 3.83Å; P406-I411 HydrophobicContact CB-CG1 4.01Å; P406-I411 HydrophobicContact CG-CD1 4.16Å; P406-I411 HydrophobicContact CG-CG1 3.72Å
407	S	98.4	Very high	97	Very high	32 Å²	32	61 Å²	61	22%	0.224	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-86.5	161.2	159.7	63.6	0	0	0	0	110	R409 Q410 I411	S407-R409 PolarHBondContact O-N 3.39Å; S407-Q410 WeakPolarHBondContact O-CA 3.34Å; S407-Q410 WeakPolarHBondContact O-CB 3.25Å; S407-Q410 PolarHBondContact O-N 3Å; S407-Q410 PolarHBondContact OG-OE1 3.2Å; S407-I411 PolarHBondContact O-N 3.03Å
408	F	98.6	Very high	96.8	Very high	1 Å²	1	61 Å²	61	0%	0.004	29%	0.291	C	S	.	.	H	α-helix	trans	-59.3	-30.1	177.3	-77.7	-75.3	0	0	0	113.2	A272 M275 N276 H279 L288 D343 I344 F347 Q410 I411 L412	A272-F408 HydrophobicContact CB-CD1 4.05Å; M275-F408 HydrophobicContact CB-CD1 3.73Å; M275-F408 HydrophobicContact CB-CD2 3.55Å; M275-F408 HydrophobicContact CB-CE1 3.62Å; M275-F408 HydrophobicContact CB-CE2 3.45Å; M275-F408 VanDerWaalsContact CB-CE2 3.45Å; M275-F408 HydrophobicContact CB-CG 3.71Å; M275-F408 HydrophobicContact CB-CZ 3.48Å; M275-F408 VanDerWaalsContact CB-CZ 3.48Å; M275-F408 HydrophobicContact CE-CE2 3.85Å; M275-F408 HydrophobicContact CE-CZ 4.27Å; M275-F408 HydrophobicContact CG-CE1 4.03Å; M275-F408 HydrophobicContact CG-CE2 4.04Å; M275-F408 HydrophobicContact CG-CZ 3.72Å; N276-F408 HydrophobicContact CB-CB 3.66Å; H279-F408 AromaticContact CE1-CD2 3.52Å; H279-F408 AromaticContact CE1-CE2 3.38Å; H279-F408 WeakPolarHBondContact CE1-CE2 3.32Å; H279-F408 AromaticContact ND1-CD2 3.48Å; H279-F408 WeakPolarHBondContact ND1-CD2 3.11Å; H279-F408 AromaticContact ND1-CE2 3.87Å; H279-F408 AromaticContact NE2-CE2 3.92Å; L288-F408 HydrophobicContact CD2-CZ 4.36Å; D343-F408 HydrophobicContact CB-CE2 4.1Å; D343-F408 HydrophobicContact CB-CZ 4.37Å; I344-F408 HydrophobicContact CD1-CD1 4.16Å; I344-F408 HydrophobicContact CD1-CD2 3.4Å; I344-F408 HydrophobicContact CD1-CE1 4.15Å; I344-F408 HydrophobicContact CD1-CE2 3.36Å; I344-F408 HydrophobicContact CD1-CG 3.81Å; I344-F408 HydrophobicContact CD1-CZ 3.76Å; I344-F408 HydrophobicContact CG1-CD2 4.48Å; I344-F408 HydrophobicContact CG1-CE2 4.12Å; F347-F408 HydrophobicContact CB-CE1 3.69Å; F347-F408 HydrophobicContact CB-CZ 3.8Å; F347-F408 HydrophobicContact CD1-CE1 4.18Å; F347-F408 AromaticContact CD2-CE1 3.84Å; F347-F408 HydrophobicContact CD2-CE1 3.84Å; F347-F408 AromaticContact CG-CE1 3.61Å; F347-F408 HydrophobicContact CG-CE1 3.61Å; F347-F408 HydrophobicContact CG-CZ 4.25Å; F408-Q410 VanDerWaalsContact C-N 3.31Å; F408-Q410 PolarHBondContact O-N 3.41Å; F408-I411 HydrophobicContact CD1-CD1 3.75Å; F408-I411 HydrophobicContact CE1-CD1 3.96Å; F408-I411 HydrophobicContact CG-CD1 4.35Å; F408-I411 PolarHBondContact O-N 2.95Å; F408-L412 WeakPolarHBondContact O-CG 3.35Å; F408-L412 PolarHBondContact O-N 3.4Å
409	R	98.3	Very high	96.7	Very high	193 Å²	193	62 Å²	62	73%	0.728	30%	0.299	S	S	*	.	H	α-helix	trans	-58.8	-36.7	168.3	-175.9	178.8	174.9	-160.3	-2.6	113.7	N276 S407 L413	N276-R409 PolarHBondContact OD1-N 3.09Å; S407-R409 PolarHBondContact O-N 3.39Å; R409-L413 PolarHBondContact O-N 3.39Å
410	Q	98.4	Very high	96.4	Very high	97 Å²	97	62.6 Å²	62.6	45%	0.453	31%	0.311	S	S	.	.	H	α-helix	trans	-77.4	-36.2	175.4	-65.9	172.7	-74	0	0	111.4	P406 S407 F408 L413 H414	P406-Q410 HydrophobicContact CB-CB 3.83Å; S407-Q410 WeakPolarHBondContact O-CA 3.34Å; S407-Q410 WeakPolarHBondContact O-CB 3.25Å; S407-Q410 PolarHBondContact O-N 3Å; S407-Q410 PolarHBondContact OG-OE1 3.2Å; F408-Q410 VanDerWaalsContact C-N 3.31Å; F408-Q410 PolarHBondContact O-N 3.41Å; Q410-L413 PolarHBondContact O-N 3.25Å; Q410-H414 PolarHBondContact O-CD2 3.27Å; Q410-H414 PolarHBondContact O-N 3.05Å
411	I	98.6	Very high	96.3	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-59.6	-47.6	173.9	-66	174.7	0	0	0	110.4	A272 I344 F347 L393 P406 S407 F408 L413 H414 L415	A272-I411 HydrophobicContact CB-CG2 4Å; I344-I411 HydrophobicContact CD1-CD1 3.62Å; I344-I411 HydrophobicContact CG2-CD1 4.07Å; F347-I411 HydrophobicContact CD1-CD1 3.88Å; F347-I411 HydrophobicContact CD1-CG2 4.2Å; F347-I411 HydrophobicContact CE1-CD1 4.19Å; F347-I411 HydrophobicContact CE1-CG2 3.45Å; F347-I411 VanDerWaalsContact CE1-CG2 3.45Å; F347-I411 HydrophobicContact CZ-CG2 3.81Å; L393-I411 HydrophobicContact CD1-CG1 4.19Å; L393-I411 HydrophobicContact CD1-CG2 4.41Å; L393-I411 HydrophobicContact CD2-CG2 4.46Å; P406-I411 HydrophobicContact CB-CG1 4.01Å; P406-I411 HydrophobicContact CG-CD1 4.16Å; P406-I411 HydrophobicContact CG-CG1 3.72Å; S407-I411 PolarHBondContact O-N 3.03Å; F408-I411 HydrophobicContact CD1-CD1 3.75Å; F408-I411 HydrophobicContact CE1-CD1 3.96Å; F408-I411 HydrophobicContact CG-CD1 4.35Å; F408-I411 PolarHBondContact O-N 2.95Å; I411-L413 VanDerWaalsContact C-N 3.3Å; I411-L413 PolarHBondContact O-N 2.9Å; I411-H414 CarbonylContact O-C 3.32Å; I411-H414 PolarHBondContact O-N 3.25Å; I411-H414 VanDerWaalsContact O-N 3.07Å; I411-L415 HydrophobicContact CG2-CD1 3.78Å; I411-L415 HydrophobicContact CG2-CG 4.12Å; I411-L415 WeakPolarHBondContact O-CB 3.47Å; I411-L415 WeakPolarHBondContact O-CG 3.34Å; I411-L415 PolarHBondContact O-N 2.89Å
412	L	98.4	Very high	96.2	Very high	37 Å²	37	57.4 Å²	57.4	19%	0.194	29%	0.285	C	S	.	.	H	α-helix	trans	-55.7	-43.2	176.1	-73.6	165.5	0	0	0	112.1	M269 A272 N276 F408 L415 D416	M269-L412 HydrophobicContact CE-CD2 4.06Å; M269-L412 HydrophobicContact SD-CD2 3.71Å; A272-L412 HydrophobicContact CB-CD2 3.71Å; A272-L412 HydrophobicContact CB-CG 3.98Å; N276-L412 HydrophobicContact CB-CD1 4.07Å; F408-L412 WeakPolarHBondContact O-CG 3.35Å; F408-L412 PolarHBondContact O-N 3.4Å; L412-L415 PolarHBondContact O-N 3.4Å; L412-D416 VanDerWaalsContact O-CB 3.27Å; L412-D416 WeakPolarHBondContact O-CB 3.43Å; L412-D416 PolarHBondContact O-N 2.99Å
413	L	97.7	Very high	96.1	Very high	100 Å²	100	60.2 Å²	60.2	52%	0.524	30%	0.298	S	S	.	.	H	α-helix	trans	-65.9	-38	175.5	179.3	63.7	0	0	0	112.6	R409 Q410 I411 I417	R409-L413 PolarHBondContact O-N 3.39Å; Q410-L413 PolarHBondContact O-N 3.25Å; I411-L413 VanDerWaalsContact C-N 3.3Å; I411-L413 PolarHBondContact O-N 2.9Å; L413-I417 HydrophobicContact CD1-CD1 4.31Å; L413-I417 HydrophobicContact CG-CD1 4.28Å; L413-I417 WeakPolarHBondContact O-CD1 3.11Å; L413-I417 VanDerWaalsContact O-CG1 3.28Å; L413-I417 WeakPolarHBondContact O-CG1 3.22Å; L413-I417 PolarHBondContact O-N 3.18Å
414	H	97.3	Very high	96	Very high	61 Å²	61	54.8 Å²	54.8	28%	0.282	29%	0.292	S	S	.	.	H	α-helix	trans	-73.1	-34.3	177.3	-73.1	-53.8	0	0	0	112.8	L393 Q410 I411 A418	L393-H414 HydrophobicContact CD1-CB 4.05Å; L393-H414 HydrophobicContact CD2-CB 4.46Å; Q410-H414 PolarHBondContact O-CD2 3.27Å; Q410-H414 PolarHBondContact O-N 3.05Å; I411-H414 CarbonylContact O-C 3.32Å; I411-H414 PolarHBondContact O-N 3.25Å; I411-H414 VanDerWaalsContact O-N 3.07Å; H414-A418 WeakPolarHBondContact O-CB 3.28Å; H414-A418 PolarHBondContact O-N 2.95Å
415	L	97.3	Very high	95.8	Very high	0 Å²	0	53 Å²	53	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-68.8	-42.9	173	-72.4	173.4	0	0	0	111.7	A268 M269 A272 F347 L351 F390 L393 I411 L412 I417 A418 S419	A268-L415 HydrophobicContact CB-CD1 4.02Å; A268-L415 HydrophobicContact CB-CD2 4.08Å; M269-L415 HydrophobicContact CG-CB 4.35Å; M269-L415 HydrophobicContact CG-CD1 4.39Å; M269-L415 HydrophobicContact SD-CB 3.4Å; M269-L415 WeakPolarHBondContact SD-CB 3.45Å; M269-L415 HydrophobicContact SD-CD1 3.81Å; M269-L415 HydrophobicContact SD-CG 4.28Å; A272-L415 HydrophobicContact CB-CD1 4.05Å; F347-L415 HydrophobicContact CZ-CD1 4.18Å; L351-L415 HydrophobicContact CD2-CD2 4.46Å; F390-L415 HydrophobicContact CE1-CD2 3.86Å; L393-L415 HydrophobicContact CD2-CD2 3.57Å; L393-L415 HydrophobicContact CD2-CG 3.88Å; I411-L415 HydrophobicContact CG2-CD1 3.78Å; I411-L415 HydrophobicContact CG2-CG 4.12Å; I411-L415 WeakPolarHBondContact O-CB 3.47Å; I411-L415 WeakPolarHBondContact O-CG 3.34Å; I411-L415 PolarHBondContact O-N 2.89Å; L412-L415 PolarHBondContact O-N 3.4Å; L415-I417 VanDerWaalsContact C-N 3.33Å; L415-I417 PolarHBondContact O-N 3.32Å; L415-A418 CarbonylContact O-C 3.56Å; L415-A418 PolarHBondContact O-N 3.25Å; L415-S419 WeakPolarHBondContact O-CB 3.43Å; L415-S419 PolarHBondContact O-N 3.46Å
416	D	96.2	Very high	95.7	Very high	95 Å²	95	56.8 Å²	56.8	51%	0.508	31%	0.309	S	S	.	.	H	α-helix	trans	-55.5	-47.2	174.9	-176.2	63.8	0	0	0	111.1	M269 L412 S419	M269-D416 HydrophobicContact CE-CB 4.39Å; L412-D416 VanDerWaalsContact O-CB 3.27Å; L412-D416 WeakPolarHBondContact O-CB 3.43Å; L412-D416 PolarHBondContact O-N 2.99Å; D416-S419 WeakPolarHBondContact O-CB 3.43Å; D416-S419 PolarHBondContact O-N 2.83Å; D416-S419 PolarHBondContact O-OG 3.4Å
417	I	94.9	Very high	95.5	Very high	99 Å²	99	61.5 Å²	61.5	51%	0.508	33%	0.33	S	S	.	.	H	α-helix	trans	-64.2	-46.6	173.9	-65.3	165	0	0	0	111.7	L413 L415 S419 A420	L413-I417 HydrophobicContact CD1-CD1 4.31Å; L413-I417 HydrophobicContact CG-CD1 4.28Å; L413-I417 WeakPolarHBondContact O-CD1 3.11Å; L413-I417 VanDerWaalsContact O-CG1 3.28Å; L413-I417 WeakPolarHBondContact O-CG1 3.22Å; L413-I417 PolarHBondContact O-N 3.18Å; L415-I417 VanDerWaalsContact C-N 3.33Å; L415-I417 PolarHBondContact O-N 3.32Å; I417-S419 PolarHBondContact O-N 2.99Å; I417-A420 PolarHBondContact O-N 3.08Å
418	A	93.8	Very high	95.3	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-68.2	-19.2	-179	0	0	0	0	0	113.7	F390 H414 L415 A420 D421 I422	F390-A418 HydrophobicContact CD2-CB 4.29Å; F390-A418 HydrophobicContact CE1-CB 4.1Å; F390-A418 HydrophobicContact CE2-CB 3.65Å; F390-A418 HydrophobicContact CZ-CB 3.52Å; H414-A418 WeakPolarHBondContact O-CB 3.28Å; H414-A418 PolarHBondContact O-N 2.95Å; L415-A418 CarbonylContact O-C 3.56Å; L415-A418 PolarHBondContact O-N 3.25Å; A418-A420 VanDerWaalsContact C-N 3.27Å; A418-A420 PolarHBondContact O-N 3.43Å; A418-D421 PolarHBondContact O-N 3.38Å; A418-I422 PolarHBondContact O-N 3.44Å
419	S	94.6	Very high	95.1	Very high	27 Å²	27	70.1 Å²	70.1	19%	0.189	37%	0.371	C	S	.	.	H	α-helix	trans	-62.7	-35.1	179.3	77.8	0	0	0	0	111.8	L415 D416 I417 D421 I422 L423	L415-S419 WeakPolarHBondContact O-CB 3.43Å; L415-S419 PolarHBondContact O-N 3.46Å; D416-S419 WeakPolarHBondContact O-CB 3.43Å; D416-S419 PolarHBondContact O-N 2.83Å; D416-S419 PolarHBondContact O-OG 3.4Å; I417-S419 PolarHBondContact O-N 2.99Å; S419-D421 PolarHBondContact O-N 2.71Å; S419-I422 PolarHBondContact O-N 2.9Å; S419-L423 WeakPolarHBondContact O-CB 3.39Å; S419-L423 WeakPolarHBondContact O-CG 3.25Å; S419-L423 PolarHBondContact O-N 2.93Å
420	A	91.4	Very high	95	Very high	64 Å²	64	61.1 Å²	61.1	53%	0.529	34%	0.338	S	S	.	.	H	α-helix	trans	-60.5	-44.9	179.4	0	0	0	0	0	112.1	I417 A418 S424	I417-A420 PolarHBondContact O-N 3.08Å; A418-A420 VanDerWaalsContact C-N 3.27Å; A418-A420 PolarHBondContact O-N 3.43Å; A420-S424 VanDerWaalsContact O-CB 3.25Å; A420-S424 WeakPolarHBondContact O-CB 3.3Å; A420-S424 PolarHBondContact O-N 2.82Å; A420-S424 PolarHBondContact O-OG 2.88Å
421	D	89.4	Confident	94.8	Very high	67 Å²	67	58.4 Å²	58.4	36%	0.358	32%	0.324	S	S	.	.	H	α-helix	trans	-60.4	-53.1	179	-56.4	-35	0	0	0	110.6	S389 A418 S419 S424 T425	S389-D421 WeakPolarHBondContact CB-OD2 3.08Å; S389-D421 PolarHBondContact OG-OD2 3Å; A418-D421 PolarHBondContact O-N 3.38Å; S419-D421 PolarHBondContact O-N 2.71Å; D421-S424 PolarHBondContact O-N 2.79Å; D421-S424 PolarHBondContact O-OG 3.42Å; D421-T425 PolarHBondContact O-N 2.85Å; D421-T425 PolarHBondContact O-OG1 3.03Å
422	I	91.8	Very high	94.7	Very high	1 Å²	1	64.1 Å²	64.1	1%	0.005	35%	0.351	C	S	.	.	H	α-helix	trans	-80	-33.8	-168.7	-158.4	155.2	0	0	0	112.9	P261 L264 M265 L355 F390 A418 S419 S424 T425 Y430	P261-I422 HydrophobicContact CB-CG1 4.24Å; P261-I422 WeakPolarHBondContact CB-O 3.47Å; L264-I422 HydrophobicContact CD2-CD1 3.51Å; M265-I422 HydrophobicContact CE-CG2 4.06Å; M265-I422 HydrophobicContact CG-CG2 3.9Å; M265-I422 HydrophobicContact SD-CG2 3.86Å; L355-I422 HydrophobicContact CD2-CD1 4.31Å; F390-I422 HydrophobicContact CD2-CD1 4.16Å; F390-I422 HydrophobicContact CE2-CB 3.98Å; F390-I422 HydrophobicContact CE2-CD1 3.66Å; F390-I422 HydrophobicContact CE2-CG1 4.46Å; F390-I422 HydrophobicContact CE2-CG2 4.02Å; F390-I422 HydrophobicContact CZ-CD1 4.16Å; F390-I422 HydrophobicContact CZ-CG2 4.13Å; A418-I422 PolarHBondContact O-N 3.44Å; S419-I422 PolarHBondContact O-N 2.9Å; I422-S424 VanDerWaalsContact C-N 3.33Å; I422-T425 WeakPolarHBondContact O-CB 3.44Å; I422-T425 PolarHBondContact O-N 3.44Å; I422-Y430 HydrophobicContact CD1-CD2 4.42Å; I422-Y430 HydrophobicContact CD1-CE2 3.89Å; I422-Y430 HydrophobicContact CG1-CD2 4.21Å; I422-Y430 HydrophobicContact CG1-CE2 4.14Å
423	L	94.3	Very high	94.6	Very high	93 Å²	93	63.8 Å²	63.8	49%	0.487	35%	0.352	S	S	.	.	H	α-helix	trans	-75.3	-21.4	174.8	-61.5	174.3	0	0	0	112.6	P261 M265 S419 T425	P261-L423 HydrophobicContact CB-CD2 4.27Å; M265-L423 HydrophobicContact CG-CD1 4.5Å; M265-L423 HydrophobicContact CG-CD2 4.15Å; M265-L423 HydrophobicContact CG-CG 4.26Å; S419-L423 WeakPolarHBondContact O-CB 3.39Å; S419-L423 WeakPolarHBondContact O-CG 3.25Å; S419-L423 PolarHBondContact O-N 2.93Å; L423-T425 VanDerWaalsContact C-N 3.31Å
424	S	93.8	Very high	94.5	Very high	93 Å²	93	59.3 Å²	59.3	65%	0.65	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-16.1	169.9	77.7	0	0	0	0	113.5	A420 D421 I422	A420-S424 VanDerWaalsContact O-CB 3.25Å; A420-S424 WeakPolarHBondContact O-CB 3.3Å; A420-S424 PolarHBondContact O-N 2.82Å; A420-S424 PolarHBondContact O-OG 2.88Å; D421-S424 PolarHBondContact O-N 2.79Å; D421-S424 PolarHBondContact O-OG 3.42Å; I422-S424 VanDerWaalsContact C-N 3.33Å
425	T	92.6	Very high	94.4	Very high	44 Å²	44	58.7 Å²	58.7	27%	0.27	33%	0.334	S	S	.	.	S	Bend	trans	-79.5	125.4	-178	-59.6	0	0	0	0	110.5	D421 I422 L423 Q427 T429	D421-T425 PolarHBondContact O-N 2.85Å; D421-T425 PolarHBondContact O-OG1 3.03Å; I422-T425 WeakPolarHBondContact O-CB 3.44Å; I422-T425 PolarHBondContact O-N 3.44Å; L423-T425 VanDerWaalsContact C-N 3.31Å; T425-Q427 PolarHBondContact O-N 2.89Å; T425-T429 HydrophobicContact CG2-CG2 4.44Å
426	P	94.9	Very high	94.4	Very high	81 Å²	81	64.2 Å²	64.2	53%	0.526	36%	0.359	S	S	.	.			trans	-57.2	138.1	175.8	-25.5	34.9	0	0	0	112.1	E428 T429 Y430	P426-E428 PolarHBondContact O-N 3.35Å; P426-E428 VanDerWaalsContact O-N 3.14Å; P426-T429 WeakPolarHBondContact O-CB 3.17Å; P426-T429 PolarHBondContact O-N 3.2Å; P426-Y430 PolarHBondContact O-N 3.43Å
427	Q	94	Very high	94.4	Very high	106 Å²	106	60 Å²	60	50%	0.495	34%	0.336	S	S	.	.	H	α-helix	trans	-56.8	-33.9	-174.2	-177.3	177.2	1.1	0	0	113.4	T425 F431	T425-Q427 PolarHBondContact O-N 2.89Å; Q427-F431 HydrophobicContact CG-CD2 3.95Å; Q427-F431 HydrophobicContact CG-CE2 3.39Å; Q427-F431 HydrophobicContact CG-CZ 3.9Å; Q427-F431 WeakPolarHBondContact O-CD2 3.42Å; Q427-F431 WeakPolarHBondContact O-CG 3.44Å; Q427-F431 PolarHBondContact O-N 3.45Å
428	E	94.1	Very high	94.4	Very high	151 Å²	151	57.9 Å²	57.9	71%	0.706	32%	0.322	S	S	*	.	H	α-helix	trans	-66.8	-48.7	175.4	-63.1	179.8	173.8	0	0	112	P426 Y430 F431 Q432	P426-E428 PolarHBondContact O-N 3.35Å; P426-E428 VanDerWaalsContact O-N 3.14Å; E428-Y430 VanDerWaalsContact C-N 3.33Å; E428-Y430 PolarHBondContact O-N 3.05Å; E428-F431 PolarHBondContact O-N 3Å; E428-Q432 WeakPolarHBondContact O-CG 3.32Å; E428-Q432 PolarHBondContact O-N 2.94Å
429	T	94.9	Very high	94.5	Very high	63 Å²	63	62.1 Å²	62.1	39%	0.387	35%	0.345	S	S	.	.	H	α-helix	trans	-61.2	-42.6	175.7	-48.7	0	0	0	0	111	T425 P426 F431 Q432 S433	T425-T429 HydrophobicContact CG2-CG2 4.44Å; P426-T429 WeakPolarHBondContact O-CB 3.17Å; P426-T429 PolarHBondContact O-N 3.2Å; T429-F431 VanDerWaalsContact C-N 3.35Å; T429-F431 PolarHBondContact O-N 3.08Å; T429-Q432 WeakPolarHBondContact O-CB 3.39Å; T429-Q432 PolarHBondContact O-N 2.98Å; T429-S433 PolarHBondContact O-N 3.05Å; T429-S433 PolarHBondContact O-OG 3.05Å
430	Y	95.8	Very high	94.6	Very high	5 Å²	5	63.5 Å²	63.5	2%	0.02	35%	0.348	C	S	.	.	H	α-helix	trans	-58.8	-43.6	174.7	174.3	-95.9	0	0	0	112.2	I259 P261 I422 P426 E428 S433 Q434 W437	I259-Y430 VanDerWaalsContact O-CE1 3.31Å; I259-Y430 WeakPolarHBondContact O-CE1 3.45Å; P261-Y430 HydrophobicContact CG-CD1 3.9Å; P261-Y430 HydrophobicContact CG-CD2 4.09Å; P261-Y430 HydrophobicContact CG-CG 3.67Å; I422-Y430 HydrophobicContact CD1-CD2 4.42Å; I422-Y430 HydrophobicContact CD1-CE2 3.89Å; I422-Y430 HydrophobicContact CG1-CD2 4.21Å; I422-Y430 HydrophobicContact CG1-CE2 4.14Å; P426-Y430 PolarHBondContact O-N 3.43Å; E428-Y430 VanDerWaalsContact C-N 3.33Å; E428-Y430 PolarHBondContact O-N 3.05Å; Y430-S433 PolarHBondContact O-N 3.1Å; Y430-Q434 WeakPolarHBondContact O-CB 3.33Å; Y430-Q434 PolarHBondContact O-N 3.35Å; Y430-Q434 PolarHBondContact OH-NE2 2.66Å; Y430-Q434 VanDerWaalsContact OH-NE2 3.17Å; Y430-W437 HydrophobicContact CD2-CH2 4.31Å; Y430-W437 AromaticContact CE2-CH2 3.97Å; Y430-W437 HydrophobicContact CE2-CH2 3.97Å; Y430-W437 AromaticContact CE2-CZ3 3.85Å; Y430-W437 HydrophobicContact CE2-CZ3 3.85Å
431	F	96.1	Very high	94.8	Very high	40 Å²	40	60.4 Å²	60.4	18%	0.175	32%	0.323	C	S	.	.	H	α-helix	trans	-71.2	-30	177.1	-68.7	-40.1	0	0	0	113.7	K258 I259 T260 Q427 E428 T429 A435	K258-F431 HydrophobicContact CB-CE1 3.87Å; K258-F431 HydrophobicContact CB-CE2 4.28Å; K258-F431 HydrophobicContact CB-CZ 3.62Å; K258-F431 HydrophobicContact CD-CD2 4.35Å; K258-F431 HydrophobicContact CD-CE2 4Å; K258-F431 HydrophobicContact CD-CZ 4.17Å; K258-F431 HydrophobicContact CG-CE1 4.41Å; K258-F431 HydrophobicContact CG-CZ 4.29Å; I259-F431 WeakPolarHBondContact O-CE1 2.92Å; T260-F431 HydrophobicContact CG2-CZ 4.43Å; Q427-F431 HydrophobicContact CG-CD2 3.95Å; Q427-F431 HydrophobicContact CG-CE2 3.39Å; Q427-F431 HydrophobicContact CG-CZ 3.9Å; Q427-F431 WeakPolarHBondContact O-CD2 3.42Å; Q427-F431 WeakPolarHBondContact O-CG 3.44Å; Q427-F431 PolarHBondContact O-N 3.45Å; E428-F431 PolarHBondContact O-N 3Å; T429-F431 VanDerWaalsContact C-N 3.35Å; T429-F431 PolarHBondContact O-N 3.08Å; F431-A435 PolarHBondContact O-N 2.87Å
432	Q	95.4	Very high	95	Very high	120 Å²	120	61.5 Å²	61.5	56%	0.561	32%	0.322	S	S	*	.	H	α-helix	trans	-64	-52.1	171	-70.6	164.2	8	0	0	110.2	E428 T429 Q434 A435 E436	E428-Q432 WeakPolarHBondContact O-CG 3.32Å; E428-Q432 PolarHBondContact O-N 2.94Å; T429-Q432 WeakPolarHBondContact O-CB 3.39Å; T429-Q432 PolarHBondContact O-N 2.98Å; Q432-Q434 VanDerWaalsContact C-N 3.33Å; Q432-Q434 PolarHBondContact O-N 3.4Å; Q432-A435 WeakPolarHBondContact O-CB 3.1Å; Q432-A435 PolarHBondContact O-N 2.84Å; Q432-A435 VanDerWaalsContact O-N 3.09Å; Q432-E436 PolarHBondContact O-N 3.23Å; Q432-E436 VanDerWaalsContact O-N 3.12Å
433	S	95.8	Very high	95.1	Very high	30 Å²	30	67.2 Å²	67.2	21%	0.21	35%	0.348	C	S	.	.	H	α-helix	trans	-60.1	-40.4	175.1	-56.9	0	0	0	0	112.3	T429 Y430 A435 E436 W437	T429-S433 PolarHBondContact O-N 3.05Å; T429-S433 PolarHBondContact O-OG 3.05Å; Y430-S433 PolarHBondContact O-N 3.1Å; S433-A435 VanDerWaalsContact C-N 3.31Å; S433-A435 PolarHBondContact O-N 2.99Å; S433-E436 WeakPolarHBondContact O-CB 2.89Å; S433-E436 PolarHBondContact O-N 2.96Å; S433-W437 PolarHBondContact O-N 2.98Å; S433-W437 PolarHBondContact O-NE1 3.27Å
434	Q	95.8	Very high	95	Very high	6 Å²	6	65 Å²	65	3%	0.028	34%	0.337	C	S	.	.	H	α-helix	trans	-63.5	-34.7	175.4	-171.7	-179.4	86.1	0	0	112.3	L355 T356 Y430 Q432 W437 R438	L355-Q434 WeakPolarHBondContact O-CG 3.33Å; L355-Q434 PolarHBondContact O-NE2 3.32Å; T356-Q434 WeakPolarHBondContact O-CG 3.36Å; Y430-Q434 WeakPolarHBondContact O-CB 3.33Å; Y430-Q434 PolarHBondContact O-N 3.35Å; Y430-Q434 PolarHBondContact OH-NE2 2.66Å; Y430-Q434 VanDerWaalsContact OH-NE2 3.17Å; Q432-Q434 VanDerWaalsContact C-N 3.33Å; Q432-Q434 PolarHBondContact O-N 3.4Å; Q434-W437 HydrophobicContact CB-CE3 4.1Å; Q434-W437 HydrophobicContact CB-CZ3 4.36Å; Q434-W437 HydrophobicContact CG-CE3 4.28Å; Q434-W437 PolarHBondContact O-N 2.97Å; Q434-R438 VanDerWaalsContact O-CG 3.28Å; Q434-R438 WeakPolarHBondContact O-CG 3.49Å; Q434-R438 PolarHBondContact O-N 3.01Å
435	A	95.6	Very high	94.8	Very high	48 Å²	48	60.8 Å²	60.8	40%	0.397	31%	0.307	S	S	.	.	H	α-helix	trans	-64.5	-46.3	174.3	0	0	0	0	0	111.4	F431 Q432 S433 W437 R438 D439	F431-A435 PolarHBondContact O-N 2.87Å; Q432-A435 WeakPolarHBondContact O-CB 3.1Å; Q432-A435 PolarHBondContact O-N 2.84Å; Q432-A435 VanDerWaalsContact O-N 3.09Å; S433-A435 VanDerWaalsContact C-N 3.31Å; S433-A435 PolarHBondContact O-N 2.99Å; A435-W437 VanDerWaalsContact C-N 3.31Å; A435-W437 PolarHBondContact O-N 3.49Å; A435-R438 PolarHBondContact O-N 3.43Å; A435-D439 PolarHBondContact O-N 3.26Å
436	E	96.6	Very high	94.7	Very high	115 Å²	115	63.2 Å²	63.2	54%	0.537	32%	0.315	S	S	.	.	H	α-helix	trans	-56.6	-44.6	172.9	-63.8	173.3	172.6	0	0	111.5	Q432 S433 R438 D439 E440	Q432-E436 PolarHBondContact O-N 3.23Å; Q432-E436 VanDerWaalsContact O-N 3.12Å; S433-E436 WeakPolarHBondContact O-CB 2.89Å; S433-E436 PolarHBondContact O-N 2.96Å; E436-R438 PolarHBondContact O-N 3.49Å; E436-D439 PolarHBondContact O-N 2.93Å; E436-E440 WeakPolarHBondContact O-CB 3.34Å; E436-E440 PolarHBondContact O-N 2.84Å
437	W	96.5	Very high	94.3	Very high	6 Å²	6	63.9 Å²	63.9	2%	0.023	31%	0.31	C	S	.	.	H	α-helix	trans	-60.2	-40.6	177.5	-61.4	-13	0	0	0	112.8	L355 P383 S385 C386 Y430 S433 Q434 A435 D439 V441	L355-W437 HydrophobicContact CD2-CZ3 4.49Å; P383-W437 HydrophobicContact CB-CB 3.9Å; P383-W437 HydrophobicContact CB-CD2 4.44Å; P383-W437 HydrophobicContact CB-CG 3.61Å; P383-W437 HydrophobicContact CG-CB 3.63Å; P383-W437 HydrophobicContact CG-CD2 4.48Å; P383-W437 HydrophobicContact CG-CG 3.74Å; S385-W437 VanDerWaalsContact OG-CD1 3.28Å; S385-W437 PolarHBondContact OG-NE1 3.09Å; C386-W437 HydrophobicContact CB-CZ2 4.4Å; Y430-W437 HydrophobicContact CD2-CH2 4.31Å; Y430-W437 AromaticContact CE2-CH2 3.97Å; Y430-W437 HydrophobicContact CE2-CH2 3.97Å; Y430-W437 AromaticContact CE2-CZ3 3.85Å; Y430-W437 HydrophobicContact CE2-CZ3 3.85Å; S433-W437 PolarHBondContact O-N 2.98Å; S433-W437 PolarHBondContact O-NE1 3.27Å; Q434-W437 HydrophobicContact CB-CE3 4.1Å; Q434-W437 HydrophobicContact CB-CZ3 4.36Å; Q434-W437 HydrophobicContact CG-CE3 4.28Å; Q434-W437 PolarHBondContact O-N 2.97Å; A435-W437 VanDerWaalsContact C-N 3.31Å; A435-W437 PolarHBondContact O-N 3.49Å; W437-D439 VanDerWaalsContact C-N 3.34Å; W437-V441 VanDerWaalsContact O-CB 3.22Å; W437-V441 WeakPolarHBondContact O-CB 3.3Å; W437-V441 WeakPolarHBondContact O-CG2 3.3Å; W437-V441 PolarHBondContact O-N 3.13Å
438	R	95	Very high	93.9	Very high	56 Å²	56	60.4 Å²	60.4	21%	0.211	29%	0.294	C	S	.	.	H	α-helix	trans	-62.8	-41.9	177.5	-69.1	169.8	-171.5	-106.2	2.3	111.4	T356 G357 E358 Q434 A435 E436 R442	T356-R438 WeakPolarHBondContact O-CG 3.3Å; T356-R438 VanDerWaalsContact O-CZ 3.27Å; T356-R438 PolarHBondContact O-NE 3.38Å; G357-R438 PolarHBondContact O-NH1 2.96Å; E358-R438 HydrophobicContact CG-CB 4.01Å; E358-R438 HydrophobicContact CG-CG 3.97Å; Q434-R438 VanDerWaalsContact O-CG 3.28Å; Q434-R438 WeakPolarHBondContact O-CG 3.49Å; Q434-R438 PolarHBondContact O-N 3.01Å; A435-R438 PolarHBondContact O-N 3.43Å; E436-R438 PolarHBondContact O-N 3.49Å; R438-R442 WeakPolarHBondContact O-CB 3.39Å; R438-R442 PolarHBondContact O-N 2.7Å
439	D	95.8	Very high	93.4	Very high	89 Å²	89	57 Å²	57	48%	0.476	28%	0.277	S	S	.	.	H	α-helix	trans	-75.9	-38.3	-177.4	-68.3	-8	0	0	0	111.6	A435 E436 W437 R442 H443	A435-D439 PolarHBondContact O-N 3.26Å; E436-D439 PolarHBondContact O-N 2.93Å; W437-D439 VanDerWaalsContact C-N 3.34Å; D439-R442 PolarHBondContact O-N 3.48Å; D439-R442 IonicContact OD1-CZ 2.68Å; D439-R442 IonicContact OD1-NH1 3.58Å; D439-R442 PolarHBondContact OD1-NH1 2.94Å; D439-R442 IonicContact OD1-NH2 3.3Å; D439-R442 PolarHBondContact OD1-NH2 3.23Å; D439-H443 PolarHBondContact O-N 3.31Å
440	E	96.6	Very high	92.5	Very high	55 Å²	55	58.6 Å²	58.6	26%	0.257	29%	0.291	S	S	.	.	H	α-helix	trans	-60.6	-45	170.9	-161.9	-151.2	125.6	0	0	111.5	P383 D384 E436 H443 N444	P383-E440 WeakPolarHBondContact CA-OE1 3.47Å; P383-E440 VanDerWaalsContact CA-OE2 3.25Å; P383-E440 WeakPolarHBondContact CA-OE2 3.31Å; P383-E440 WeakPolarHBondContact CB-OE2 3.35Å; D384-E440 PolarHBondContact N-OE2 2.9Å; E436-E440 WeakPolarHBondContact O-CB 3.34Å; E436-E440 PolarHBondContact O-N 2.84Å; E440-H443 PolarHBondContact O-N 3.06Å; E440-N444 PolarHBondContact O-N 3.24Å; E440-N444 PolarHBondContact O-ND2 3Å
441	V	95.6	Very high	91.2	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-60.9	-45	175.2	161.2	0	0	0	0	111.4	W352 T356 E358 P381 P383 W437 N444 F445	W352-V441 HydrophobicContact CH2-CG1 3.8Å; W352-V441 HydrophobicContact CZ2-CB 4.37Å; W352-V441 HydrophobicContact CZ2-CG1 3.52Å; W352-V441 HydrophobicContact CZ2-CG2 3.86Å; T356-V441 HydrophobicContact CG2-CG2 4.06Å; E358-V441 HydrophobicContact CB-CG1 4.15Å; E358-V441 HydrophobicContact CG-CG1 4.39Å; P381-V441 HydrophobicContact CG-CB 4.48Å; P381-V441 HydrophobicContact CG-CG1 4.37Å; P381-V441 HydrophobicContact CG-CG2 4.2Å; P383-V441 HydrophobicContact CG-CG2 4.13Å; W437-V441 VanDerWaalsContact O-CB 3.22Å; W437-V441 WeakPolarHBondContact O-CB 3.3Å; W437-V441 WeakPolarHBondContact O-CG2 3.3Å; W437-V441 PolarHBondContact O-N 3.13Å; V441-N444 PolarHBondContact O-N 3.24Å; V441-F445 HydrophobicContact CG1-CD2 3.89Å; V441-F445 HydrophobicContact CG1-CE2 3.36Å; V441-F445 HydrophobicContact CG1-CZ 3.84Å; V441-F445 PolarHBondContact O-N 3.41Å
442	R	94.1	Very high	89.3	Confident	89 Å²	89	64.2 Å²	64.2	34%	0.336	33%	0.326	S	S	.	.	H	α-helix	trans	-63.3	-45.5	-179.6	-164.1	178.8	-49.4	114.9	20	111.5	E358 R438 D439 N444 F445 E446	E358-R442 IonicContact OE1-CZ 2.72Å; E358-R442 IonicContact OE1-NE 2.7Å; E358-R442 PolarHBondContact OE1-NE 3.09Å; E358-R442 IonicContact OE1-NH2 2.79Å; E358-R442 PolarHBondContact OE1-NH2 2.92Å; R438-R442 WeakPolarHBondContact O-CB 3.39Å; R438-R442 PolarHBondContact O-N 2.7Å; D439-R442 PolarHBondContact O-N 3.48Å; D439-R442 IonicContact OD1-CZ 2.68Å; D439-R442 IonicContact OD1-NH1 3.58Å; D439-R442 PolarHBondContact OD1-NH1 2.94Å; D439-R442 IonicContact OD1-NH2 3.3Å; D439-R442 PolarHBondContact OD1-NH2 3.23Å; R442-N444 VanDerWaalsContact C-N 3.33Å; R442-N444 PolarHBondContact O-N 3.03Å; R442-F445 PolarHBondContact O-N 3.48Å; R442-F445 VanDerWaalsContact O-N 3.13Å; R442-E446 WeakPolarHBondContact O-CG 3.38Å; R442-E446 PolarHBondContact O-N 3.49Å
443	H	93.5	Very high	87.5	Confident	121 Å²	121	60.4 Å²	60.4	56%	0.56	31%	0.312	S	S	*	.	H	α-helix	trans	-62.4	-38.8	175.8	-172.7	59	0	0	0	112.3	D439 E440 F445 E446 K447	D439-H443 PolarHBondContact O-N 3.31Å; E440-H443 PolarHBondContact O-N 3.06Å; H443-F445 PolarHBondContact O-N 2.9Å; H443-E446 IonicContact ND1-OE2 2.67Å; H443-E446 PolarHBondContact O-N 3.43Å; H443-K447 WeakPolarHBondContact O-CB 3.4Å; H443-K447 PolarHBondContact O-N 2.91Å
444	N	92	Very high	85.7	Confident	48 Å²	48	62.3 Å²	62.3	26%	0.257	32%	0.324	S	S	.	.	H	α-helix	trans	-63.5	-38	172.7	-84	-74	0	0	0	112.6	P381 E440 V441 R442 K447 I448	P381-N444 HydrophobicContact CB-CB 3.75Å; P381-N444 HydrophobicContact CG-CB 3.82Å; E440-N444 PolarHBondContact O-N 3.24Å; E440-N444 PolarHBondContact O-ND2 3Å; V441-N444 PolarHBondContact O-N 3.24Å; R442-N444 VanDerWaalsContact C-N 3.33Å; R442-N444 PolarHBondContact O-N 3.03Å; N444-K447 WeakPolarHBondContact O-CB 3.14Å; N444-K447 PolarHBondContact O-N 2.86Å; N444-I448 WeakPolarHBondContact O-CD1 3.46Å; N444-I448 VanDerWaalsContact O-CG1 3.3Å; N444-I448 WeakPolarHBondContact O-CG1 3.45Å; N444-I448 PolarHBondContact O-N 3.47Å
445	F	91.1	Very high	83.9	Confident	3 Å²	3	64.1 Å²	64.1	1%	0.013	33%	0.333	C	S	.	.	H	α-helix	trans	-69.4	-37.1	173.2	-65.2	-33.7	0	0	0	112.8	W352 Y361 K362 V364 L380 P381 V441 R442 H443 K447 I448 K449	W352-F445 AromaticContact CH2-CE2 3.94Å; W352-F445 HydrophobicContact CH2-CE2 3.94Å; W352-F445 AromaticContact CH2-CZ 3.67Å; W352-F445 HydrophobicContact CH2-CZ 3.67Å; W352-F445 HydrophobicContact CZ2-CE2 4.36Å; W352-F445 AromaticContact CZ2-CZ 3.87Å; W352-F445 HydrophobicContact CZ2-CZ 3.87Å; Y361-F445 HydrophobicContact CD1-CE1 4.04Å; Y361-F445 VanDerWaalsContact N-CZ 3.25Å; K362-F445 HydrophobicContact CB-CD2 3.98Å; K362-F445 HydrophobicContact CB-CE2 4.2Å; V364-F445 HydrophobicContact CG2-CB 4.45Å; V364-F445 HydrophobicContact CG2-CD1 4.46Å; L380-F445 HydrophobicContact CD2-CE1 4.02Å; L380-F445 HydrophobicContact CD2-CZ 3.81Å; P381-F445 HydrophobicContact CG-CD1 4.45Å; P381-F445 HydrophobicContact CG-CE1 3.94Å; P381-F445 HydrophobicContact CG-CZ 4.28Å; V441-F445 HydrophobicContact CG1-CD2 3.89Å; V441-F445 HydrophobicContact CG1-CE2 3.36Å; V441-F445 HydrophobicContact CG1-CZ 3.84Å; V441-F445 PolarHBondContact O-N 3.41Å; R442-F445 PolarHBondContact O-N 3.48Å; R442-F445 VanDerWaalsContact O-N 3.13Å; H443-F445 PolarHBondContact O-N 2.9Å; F445-K447 VanDerWaalsContact C-N 3.31Å; F445-K447 PolarHBondContact O-N 3.13Å; F445-I448 HydrophobicContact CD1-CD1 4.09Å; F445-I448 PolarHBondContact O-N 3.29Å; F445-K449 WeakPolarHBondContact O-CD 3.46Å; F445-K449 VanDerWaalsContact O-CG 3.24Å; F445-K449 WeakPolarHBondContact O-CG 3.48Å; F445-K449 PolarHBondContact O-N 3.37Å
446	E	89.7	Confident	82.3	Confident	96 Å²	96	67.4 Å²	67.4	45%	0.449	34%	0.34	S	S	.	.	H	α-helix	trans	-61.3	-39.2	171.4	-72.5	165.6	-167.9	0	0	112	R442 H443 K449 S450	R442-E446 WeakPolarHBondContact O-CG 3.38Å; R442-E446 PolarHBondContact O-N 3.49Å; H443-E446 IonicContact ND1-OE2 2.67Å; H443-E446 PolarHBondContact O-N 3.43Å; E446-K449 PolarHBondContact O-N 2.95Å; E446-S450 WeakPolarHBondContact O-CB 3.37Å; E446-S450 PolarHBondContact O-N 2.68Å; E446-S450 PolarHBondContact O-OG 3.31Å
447	K	87.4	Confident	80.9	Confident	95 Å²	95	69.5 Å²	69.5	41%	0.413	34%	0.343	S	S	.	.	H	α-helix	trans	-62.3	-47.9	171.3	-176.3	179.5	175.5	-177.5	0	112	H443 N444 F445 K449 S450 E451	H443-K447 WeakPolarHBondContact O-CB 3.4Å; H443-K447 PolarHBondContact O-N 2.91Å; N444-K447 WeakPolarHBondContact O-CB 3.14Å; N444-K447 PolarHBondContact O-N 2.86Å; F445-K447 VanDerWaalsContact C-N 3.31Å; F445-K447 PolarHBondContact O-N 3.13Å; K447-K449 PolarHBondContact O-N 3.27Å; K447-S450 WeakPolarHBondContact CA-OG 3.31Å; K447-S450 PolarHBondContact O-N 2.82Å; K447-S450 VanDerWaalsContact O-N 3.13Å; K447-S450 PolarHBondContact O-OG 2.92Å; K447-E451 WeakPolarHBondContact CE-OE1 3.46Å; K447-E451 VanDerWaalsContact CE-OE2 3.3Å; K447-E451 WeakPolarHBondContact CE-OE2 3.46Å; K447-E451 HydrophobicContact CG-CG 3.91Å; K447-E451 IonicContact NZ-OE1 3.4Å; K447-E451 WeakPolarHBondContact O-CB 3.06Å; K447-E451 WeakPolarHBondContact O-CG 3.49Å; K447-E451 PolarHBondContact O-N 3.28Å
448	I	84.4	Confident	79.4	Confident	33 Å²	33	72 Å²	72	17%	0.169	36%	0.357	C	S	.	.	H	α-helix	trans	-60.5	-33.3	177	-70.6	157.9	0	0	0	112.1	V364 L378 N444 F445	V364-I448 HydrophobicContact CG1-CG2 3.99Å; V364-I448 HydrophobicContact CG2-CG2 4.18Å; L378-I448 HydrophobicContact CD1-CD1 3.88Å; L378-I448 HydrophobicContact CD1-CG1 4.27Å; L378-I448 HydrophobicContact CD1-CG2 4.36Å; N444-I448 WeakPolarHBondContact O-CD1 3.46Å; N444-I448 VanDerWaalsContact O-CG1 3.3Å; N444-I448 WeakPolarHBondContact O-CG1 3.45Å; N444-I448 PolarHBondContact O-N 3.47Å; F445-I448 HydrophobicContact CD1-CD1 4.09Å; F445-I448 PolarHBondContact O-N 3.29Å
449	K	83	Confident	78.3	Confident	79 Å²	79	72.9 Å²	72.9	34%	0.343	37%	0.366	S	S	.	.	H	α-helix	trans	-70.6	-44.8	172.9	-67.4	162.3	-167.1	175	0	112	K362 D363 V364 F445 E446 K447	K362-K449 WeakPolarHBondContact O-CE 3.33Å; K362-K449 PolarHBondContact O-NZ 3.32Å; D363-K449 VanDerWaalsContact C-CE 3.45Å; D363-K449 WeakPolarHBondContact O-CE 3.33Å; D363-K449 IonicContact OD2-NZ 3.42Å; D363-K449 PolarHBondContact OD2-NZ 2.72Å; V364-K449 HydrophobicContact CG2-CG 4.32Å; F445-K449 WeakPolarHBondContact O-CD 3.46Å; F445-K449 VanDerWaalsContact O-CG 3.24Å; F445-K449 WeakPolarHBondContact O-CG 3.48Å; F445-K449 PolarHBondContact O-N 3.37Å; E446-K449 PolarHBondContact O-N 2.95Å; K447-K449 PolarHBondContact O-N 3.27Å
450	S	77.3	Confident	77.4	Confident	96 Å²	96	73 Å²	73	67%	0.671	36%	0.363	S	S	*	.	H	α-helix	trans	-87.1	-28.3	-169.6	55.3	0	0	0	0	115.6	E446 K447 G452	E446-S450 WeakPolarHBondContact O-CB 3.37Å; E446-S450 PolarHBondContact O-N 2.68Å; E446-S450 PolarHBondContact O-OG 3.31Å; K447-S450 WeakPolarHBondContact CA-OG 3.31Å; K447-S450 PolarHBondContact O-N 2.82Å; K447-S450 VanDerWaalsContact O-N 3.13Å; K447-S450 PolarHBondContact O-OG 2.92Å; S450-G452 PolarHBondContact O-N 3.1Å; S450-G452 VanDerWaalsContact O-N 3.15Å
451	E	67.7	Low	76.6	Confident	131 Å²	131	75.7 Å²	75.7	61%	0.612	38%	0.376	S	S	*	.	S	Bend	trans	-66.9	-11.4	173.4	-72.8	-172.9	143.3	0	0	112.8	K447	K447-E451 WeakPolarHBondContact CE-OE1 3.46Å; K447-E451 VanDerWaalsContact CE-OE2 3.3Å; K447-E451 WeakPolarHBondContact CE-OE2 3.46Å; K447-E451 HydrophobicContact CG-CG 3.91Å; K447-E451 IonicContact NZ-OE1 3.4Å; K447-E451 WeakPolarHBondContact O-CB 3.06Å; K447-E451 WeakPolarHBondContact O-CG 3.49Å; K447-E451 PolarHBondContact O-N 3.28Å
452	G	56.8	Low	76.1	Confident	32 Å²	32	79.6 Å²	79.6	33%	0.33	40%	0.397	S	S	.	.			trans	75.6	114	-175.7	0	0	0	0	0	110	S450 C454	S450-G452 PolarHBondContact O-N 3.1Å; S450-G452 VanDerWaalsContact O-N 3.15Å; G452-C454 PolarHBondContact O-N 3.46Å
453	T	57.2	Low	75.7	Confident	41 Å²	41	78.4 Å²	78.4	25%	0.252	40%	0.396	S	S	.	.			trans	-60.2	142.4	178.4	65	0	0	0	0	108.3	A368 L455 H456	A368-T453 HydrophobicContact CB-CG2 3.37Å; T453-L455 CarbonylContact O-C 3.59Å; T453-L455 PolarHBondContact O-N 3.43Å; T453-H456 PolarHBondContact O-N 3.1Å
454	C	58.1	Low	75.6	Confident	69 Å²	69	78.4 Å²	78.4	47%	0.466	39%	0.394	S	S	.	.	H	α-helix	trans	-54.3	-26.1	-169.6	-174.3	0	0	0	0	113	G452 R457 L458	G452-C454 PolarHBondContact O-N 3.46Å; C454-R457 PolarHBondContact O-N 3.45Å; C454-L458 VanDerWaalsContact O-CG 3.31Å; C454-L458 WeakPolarHBondContact O-CG 3.24Å; C454-L458 PolarHBondContact O-N 2.74Å
455	L	58.5	Low	75.5	Confident	44 Å²	44	83.8 Å²	83.8	23%	0.23	41%	0.411	C	S	.	.	H	α-helix	trans	-54.5	-50.6	170.1	-172.4	62.1	0	0	0	113.5	T453 R457 L458 D459	T453-L455 CarbonylContact O-C 3.59Å; T453-L455 PolarHBondContact O-N 3.43Å; L455-R457 VanDerWaalsContact C-N 3.27Å; L455-R457 PolarHBondContact O-N 2.85Å; L455-L458 CarbonylContact O-C 3.49Å; L455-L458 PolarHBondContact O-N 2.93Å; L455-L458 VanDerWaalsContact O-N 3.1Å; L455-D459 WeakPolarHBondContact O-CB 3.31Å; L455-D459 PolarHBondContact O-N 3.43Å
456	H	61	Low	75.6	Confident	117 Å²	117	91.6 Å²	91.6	54%	0.542	44%	0.441	S	S	.	.	H	α-helix	trans	-62.9	-34	179.9	-169.8	-41.2	0	0	0	112	T453 E460	T453-H456 PolarHBondContact O-N 3.1Å; H456-E460 PolarHBondContact O-N 2.99Å
457	R	66.9	Low	75.7	Confident	159 Å²	159	93.8 Å²	93.8	60%	0.6	45%	0.445	S	S	*	.	H	α-helix	trans	-69.6	-41.5	174.2	-71.6	-175.2	56.6	172.4	-4.2	112	C454 L455 E460 E461	C454-R457 PolarHBondContact O-N 3.45Å; L455-R457 VanDerWaalsContact C-N 3.27Å; L455-R457 PolarHBondContact O-N 2.85Å; R457-E460 PolarHBondContact O-N 2.87Å; R457-E461 WeakPolarHBondContact O-CB 2.96Å; R457-E461 WeakPolarHBondContact O-CG 3.41Å; R457-E461 PolarHBondContact O-N 3.37Å
458	L	65.4	Low	76	Confident	60 Å²	60	93.4 Å²	93.4	31%	0.314	44%	0.444	S	S	.	.	H	α-helix	trans	-66.4	-36.4	175.1	-72.4	165.9	0	0	0	112.2	W371 C454 L455 E461 L462	W371-L458 HydrophobicContact CH2-CD1 4.32Å; W371-L458 HydrophobicContact CZ2-CD1 3.48Å; W371-L458 VanDerWaalsContact CZ2-CD1 3.48Å; C454-L458 VanDerWaalsContact O-CG 3.31Å; C454-L458 WeakPolarHBondContact O-CG 3.24Å; C454-L458 PolarHBondContact O-N 2.74Å; L455-L458 CarbonylContact O-C 3.49Å; L455-L458 PolarHBondContact O-N 2.93Å; L455-L458 VanDerWaalsContact O-N 3.1Å; L458-E461 PolarHBondContact O-N 3.49Å; L458-L462 WeakPolarHBondContact O-CB 3.26Å; L458-L462 WeakPolarHBondContact O-CG 3.33Å; L458-L462 PolarHBondContact O-N 2.83Å
459	D	72.4	Confident	76.4	Confident	73 Å²	73	97 Å²	97	39%	0.39	46%	0.461	S	S	.	.	H	α-helix	trans	-69.3	-42.2	175.2	-80.3	-33	0	0	0	111.7	L455 E461 L462 I463	L455-D459 WeakPolarHBondContact O-CB 3.31Å; L455-D459 PolarHBondContact O-N 3.43Å; D459-E461 VanDerWaalsContact C-N 3.35Å; D459-E461 PolarHBondContact O-N 3.42Å; D459-L462 PolarHBondContact O-N 3.32Å; D459-I463 VanDerWaalsContact O-CB 3.27Å; D459-I463 WeakPolarHBondContact O-CB 3.35Å; D459-I463 WeakPolarHBondContact O-CD1 3.4Å; D459-I463 WeakPolarHBondContact O-CG1 3.47Å; D459-I463 PolarHBondContact O-N 3.41Å
460	E	76	Confident	76.9	Confident	91 Å²	91	98.5 Å²	98.5	43%	0.425	47%	0.472	S	S	.	.	H	α-helix	trans	-62.5	-39.8	170.8	-85.1	-63.4	150.4	0	0	112.1	H456 R457 I463 K464	H456-E460 PolarHBondContact O-N 2.99Å; R457-E460 PolarHBondContact O-N 2.87Å; E460-I463 PolarHBondContact O-N 2.78Å; E460-K464 WeakPolarHBondContact O-CB 3.34Å; E460-K464 PolarHBondContact O-N 3.27Å
461	E	81.1	Confident	77.8	Confident	113 Å²	113	100.4 Å²	100.4	53%	0.528	46%	0.464	S	S	.	.	H	α-helix	trans	-65.8	-37.5	174.1	-74.7	175.9	-158.9	0	0	112.4	R457 L458 D459 R465	R457-E461 WeakPolarHBondContact O-CB 2.96Å; R457-E461 WeakPolarHBondContact O-CG 3.41Å; R457-E461 PolarHBondContact O-N 3.37Å; L458-E461 PolarHBondContact O-N 3.49Å; D459-E461 VanDerWaalsContact C-N 3.35Å; D459-E461 PolarHBondContact O-N 3.42Å; E461-R465 WeakPolarHBondContact O-CB 3.45Å; E461-R465 PolarHBondContact O-N 3.15Å
462	L	83.8	Confident	79.1	Confident	82 Å²	82	99.8 Å²	99.8	43%	0.429	46%	0.461	S	S	.	.	H	α-helix	trans	-68.9	-43	173.4	-83.7	165.2	0	0	0	112.6	L458 D459 K464 R465 R466	L458-L462 WeakPolarHBondContact O-CB 3.26Å; L458-L462 WeakPolarHBondContact O-CG 3.33Å; L458-L462 PolarHBondContact O-N 2.83Å; D459-L462 PolarHBondContact O-N 3.32Å; L462-K464 VanDerWaalsContact C-N 3.35Å; L462-R465 PolarHBondContact O-N 3.4Å; L462-R466 WeakPolarHBondContact O-CB 3.16Å; L462-R466 WeakPolarHBondContact O-CG 3.27Å; L462-R466 PolarHBondContact O-N 3.18Å
463	I	86.6	Confident	80.9	Confident	63 Å²	63	100.8 Å²	100.8	32%	0.323	47%	0.466	S	S	.	.	H	α-helix	trans	-63.4	-43.9	175.4	-72.9	164	0	0	0	109.5	D459 E460 R466 R467	D459-I463 VanDerWaalsContact O-CB 3.27Å; D459-I463 WeakPolarHBondContact O-CB 3.35Å; D459-I463 WeakPolarHBondContact O-CD1 3.4Å; D459-I463 WeakPolarHBondContact O-CG1 3.47Å; D459-I463 PolarHBondContact O-N 3.41Å; E460-I463 PolarHBondContact O-N 2.78Å; I463-R466 PolarHBondContact O-N 2.95Å; I463-R467 WeakPolarHBondContact O-CB 3.42Å; I463-R467 VanDerWaalsContact O-CG 3.24Å; I463-R467 WeakPolarHBondContact O-CG 3.15Å; I463-R467 PolarHBondContact O-N 3.28Å
464	K	90.8	Very high	82.6	Confident	121 Å²	121	102.7 Å²	102.7	53%	0.526	47%	0.474	S	S	.	.	H	α-helix	trans	-61.1	-49.1	174.8	-179.4	177.4	173.7	-177.5	0	111.6	E460 L462 R466 R467 E468	E460-K464 WeakPolarHBondContact O-CB 3.34Å; E460-K464 PolarHBondContact O-N 3.27Å; L462-K464 VanDerWaalsContact C-N 3.35Å; K464-R466 PolarHBondContact O-N 3.48Å; K464-R467 WeakPolarHBondContact O-CB 3.38Å; K464-R467 PolarHBondContact O-N 2.98Å; K464-E468 WeakPolarHBondContact CE-OE1 3.48Å; K464-E468 WeakPolarHBondContact CG-OE1 3.43Å; K464-E468 WeakPolarHBondContact O-CG 3.42Å; K464-E468 PolarHBondContact O-N 3.49Å
465	R	91.2	Very high	84.4	Confident	161 Å²	161	103.7 Å²	103.7	61%	0.608	48%	0.475	S	S	*	.	H	α-helix	trans	-58.3	-47.3	175.7	176.3	176.8	-72.4	-160	-0.2	111.5	E461 L462 R467 E468 E469	E461-R465 WeakPolarHBondContact O-CB 3.45Å; E461-R465 PolarHBondContact O-N 3.15Å; L462-R465 PolarHBondContact O-N 3.4Å; R465-R467 VanDerWaalsContact C-N 3.3Å; R465-R467 PolarHBondContact O-N 2.91Å; R465-E468 WeakPolarHBondContact O-CA 2.98Å; R465-E468 WeakPolarHBondContact O-CB 3.4Å; R465-E468 PolarHBondContact O-N 2.81Å; R465-E469 WeakPolarHBondContact CD-OE1 3.33Å; R465-E469 HydrophobicContact CG-CG 4.27Å; R465-E469 VanDerWaalsContact CG-OE1 3.26Å; R465-E469 WeakPolarHBondContact CG-OE1 3.4Å; R465-E469 WeakPolarHBondContact O-CG 3.26Å; R465-E469 PolarHBondContact O-N 3.44Å
466	R	91.5	Very high	86.2	Confident	167 Å²	167	105.2 Å²	105.2	63%	0.63	48%	0.483	S	S	*	.	H	α-helix	trans	-62.5	-34.9	177.5	-74.9	174.6	176	168.5	1.5	112.7	L462 I463 K464 L470	L462-R466 WeakPolarHBondContact O-CB 3.16Å; L462-R466 WeakPolarHBondContact O-CG 3.27Å; L462-R466 PolarHBondContact O-N 3.18Å; I463-R466 PolarHBondContact O-N 2.95Å; K464-R466 PolarHBondContact O-N 3.48Å; R466-L470 VanDerWaalsContact O-CB 3.27Å; R466-L470 WeakPolarHBondContact O-CB 3.41Å; R466-L470 PolarHBondContact O-N 2.7Å
467	R	92.1	Very high	87.9	Confident	142 Å²	142	106.1 Å²	106.1	54%	0.536	48%	0.481	S	S	.	.	H	α-helix	trans	-67.3	-35.6	172	-74.3	168	175.4	164.5	1.1	111.9	I463 K464 R465 R471	I463-R467 WeakPolarHBondContact O-CB 3.42Å; I463-R467 VanDerWaalsContact O-CG 3.24Å; I463-R467 WeakPolarHBondContact O-CG 3.15Å; I463-R467 PolarHBondContact O-N 3.28Å; K464-R467 WeakPolarHBondContact O-CB 3.38Å; K464-R467 PolarHBondContact O-N 2.98Å; R465-R467 VanDerWaalsContact C-N 3.3Å; R465-R467 PolarHBondContact O-N 2.91Å; R467-R471 WeakPolarHBondContact O-CG 3.46Å; R467-R471 PolarHBondContact O-N 3.28Å
468	E	93.5	Very high	89.3	Confident	87 Å²	87	102.8 Å²	102.8	41%	0.407	47%	0.473	S	S	.	.	H	α-helix	trans	-70.7	-44.9	175.3	-73.8	164.4	-174.7	0	0	111.8	K464 R465 L470 R471 H472	K464-E468 WeakPolarHBondContact CE-OE1 3.48Å; K464-E468 WeakPolarHBondContact CG-OE1 3.43Å; K464-E468 WeakPolarHBondContact O-CG 3.42Å; K464-E468 PolarHBondContact O-N 3.49Å; R465-E468 WeakPolarHBondContact O-CA 2.98Å; R465-E468 WeakPolarHBondContact O-CB 3.4Å; R465-E468 PolarHBondContact O-N 2.81Å; E468-L470 VanDerWaalsContact C-N 3.35Å; E468-L470 PolarHBondContact O-N 3.46Å; E468-R471 PolarHBondContact O-N 2.76Å; E468-R471 IonicContact OE1-NH2 3.78Å; E468-H472 PolarHBondContact O-N 3.43Å
469	E	93.7	Very high	90.7	Very high	110 Å²	110	104.1 Å²	104.1	51%	0.514	48%	0.477	S	S	.	.	H	α-helix	trans	-59	-42.9	172.4	-70.6	166.2	177.6	0	0	111.8	R465 H472 A473	R465-E469 WeakPolarHBondContact CD-OE1 3.33Å; R465-E469 HydrophobicContact CG-CG 4.27Å; R465-E469 VanDerWaalsContact CG-OE1 3.26Å; R465-E469 WeakPolarHBondContact CG-OE1 3.4Å; R465-E469 WeakPolarHBondContact O-CG 3.26Å; R465-E469 PolarHBondContact O-N 3.44Å; E469-H472 PolarHBondContact O-N 2.89Å; E469-A473 WeakPolarHBondContact O-CB 3.37Å; E469-A473 PolarHBondContact O-N 3.06Å
470	L	93.6	Very high	91.8	Very high	109 Å²	109	108 Å²	108	57%	0.571	49%	0.487	S	S	*	.	H	α-helix	trans	-66.2	-42.8	177	-179.8	60.8	0	0	0	112.5	R466 E468 A473 L474	R466-L470 VanDerWaalsContact O-CB 3.27Å; R466-L470 WeakPolarHBondContact O-CB 3.41Å; R466-L470 PolarHBondContact O-N 2.7Å; E468-L470 VanDerWaalsContact C-N 3.35Å; E468-L470 PolarHBondContact O-N 3.46Å; L470-A473 PolarHBondContact O-N 3.21Å; L470-L474 HydrophobicContact CG-CD1 4.33Å; L470-L474 WeakPolarHBondContact O-CG 3.46Å; L470-L474 PolarHBondContact O-N 2.85Å
471	R	95	Very high	92.7	Very high	137 Å²	137	107.7 Å²	107.7	52%	0.517	49%	0.486	S	S	.	.	H	α-helix	trans	-58.7	-50.4	173.7	-79	-170.7	-65.2	-105.7	5.7	110.8	R467 E468 A473 L474 D475	R467-R471 WeakPolarHBondContact O-CG 3.46Å; R467-R471 PolarHBondContact O-N 3.28Å; E468-R471 PolarHBondContact O-N 2.76Å; E468-R471 IonicContact OE1-NH2 3.78Å; R471-A473 VanDerWaalsContact C-N 3.27Å; R471-A473 PolarHBondContact O-N 2.97Å; R471-L474 WeakPolarHBondContact O-CA 3.24Å; R471-L474 WeakPolarHBondContact O-CB 3.41Å; R471-L474 PolarHBondContact O-N 2.66Å; R471-D475 PolarHBondContact O-N 3.05Å
472	H	95.1	Very high	93.5	Very high	117 Å²	117	107.3 Å²	107.3	54%	0.542	48%	0.48	S	S	.	.	H	α-helix	trans	-58.9	-38.4	179.4	-170.1	46.2	0	0	0	112.8	E468 E469 L474 D475 I476	E468-H472 PolarHBondContact O-N 3.43Å; E469-H472 PolarHBondContact O-N 2.89Å; H472-L474 VanDerWaalsContact C-N 3.34Å; H472-L474 PolarHBondContact O-N 3.07Å; H472-D475 PolarHBondContact O-N 2.93Å; H472-I476 WeakPolarHBondContact O-CB 3.27Å; H472-I476 WeakPolarHBondContact O-CD1 3.44Å; H472-I476 VanDerWaalsContact O-CG1 3.24Å; H472-I476 WeakPolarHBondContact O-CG1 3.43Å; H472-I476 PolarHBondContact O-N 3.37Å
473	A	95	Very high	94	Very high	54 Å²	54	108.2 Å²	108.2	45%	0.446	48%	0.48	S	S	.	.	H	α-helix	trans	-66.7	-31.9	174.3	0	0	0	0	0	113.5	E469 L470 R471 R477	E469-A473 WeakPolarHBondContact O-CB 3.37Å; E469-A473 PolarHBondContact O-N 3.06Å; L470-A473 PolarHBondContact O-N 3.21Å; R471-A473 VanDerWaalsContact C-N 3.27Å; R471-A473 PolarHBondContact O-N 2.97Å; A473-R477 PolarHBondContact O-N 2.84Å; A473-R477 VanDerWaalsContact O-N 3.14Å
474	L	93.7	Very high	94.5	Very high	80 Å²	80	110.2 Å²	110.2	42%	0.419	49%	0.491	S	S	.	.	H	α-helix	trans	-73.2	-45.1	173.6	-69.2	168.6	0	0	0	111.4	L470 R471 H472 I476 R477 E478	L470-L474 HydrophobicContact CG-CD1 4.33Å; L470-L474 WeakPolarHBondContact O-CG 3.46Å; L470-L474 PolarHBondContact O-N 2.85Å; R471-L474 WeakPolarHBondContact O-CA 3.24Å; R471-L474 WeakPolarHBondContact O-CB 3.41Å; R471-L474 PolarHBondContact O-N 2.66Å; H472-L474 VanDerWaalsContact C-N 3.34Å; H472-L474 PolarHBondContact O-N 3.07Å; L474-I476 VanDerWaalsContact C-N 3.26Å; L474-I476 PolarHBondContact O-N 3.19Å; L474-R477 WeakPolarHBondContact O-CB 3.41Å; L474-R477 PolarHBondContact O-N 2.99Å; L474-E478 WeakPolarHBondContact O-CB 3.24Å; L474-E478 PolarHBondContact O-N 3Å
475	D	95.9	Very high	94.7	Very high	91 Å²	91	109.9 Å²	109.9	49%	0.487	49%	0.491	S	S	.	.	H	α-helix	trans	-56.3	-42.7	175.7	-53.7	-28.4	0	0	0	111	R471 H472 H479	R471-D475 PolarHBondContact O-N 3.05Å; H472-D475 PolarHBondContact O-N 2.93Å; D475-H479 WeakPolarHBondContact O-CB 3.49Å; D475-H479 PolarHBondContact O-N 3.25Å
476	I	96.6	Very high	94.9	Very high	75 Å²	75	109 Å²	109	39%	0.385	49%	0.488	S	S	.	.	H	α-helix	trans	-62.2	-47.7	174	-71.5	166.1	0	0	0	110.8	H472 L474 E478 H479 Y480	H472-I476 WeakPolarHBondContact O-CB 3.27Å; H472-I476 WeakPolarHBondContact O-CD1 3.44Å; H472-I476 VanDerWaalsContact O-CG1 3.24Å; H472-I476 WeakPolarHBondContact O-CG1 3.43Å; H472-I476 PolarHBondContact O-N 3.37Å; L474-I476 VanDerWaalsContact C-N 3.26Å; L474-I476 PolarHBondContact O-N 3.19Å; I476-E478 VanDerWaalsContact C-N 3.34Å; I476-E478 PolarHBondContact O-N 2.9Å; I476-H479 PolarHBondContact O-N 3.46Å; I476-Y480 HydrophobicContact CG2-CD2 3.83Å; I476-Y480 HydrophobicContact CG2-CE2 3.86Å; I476-Y480 VanDerWaalsContact O-CD2 3.31Å; I476-Y480 WeakPolarHBondContact O-CD2 3.46Å; I476-Y480 PolarHBondContact O-N 3.42Å
477	R	95.6	Very high	95	Very high	136 Å²	136	103.5 Å²	103.5	51%	0.513	48%	0.479	S	S	.	.	H	α-helix	trans	-59.2	-46.7	-179.7	-156	-163.5	87	-148.9	-4.1	111	A473 L474 H479 Y480 E481	A473-R477 PolarHBondContact O-N 2.84Å; A473-R477 VanDerWaalsContact O-N 3.14Å; L474-R477 WeakPolarHBondContact O-CB 3.41Å; L474-R477 PolarHBondContact O-N 2.99Å; R477-H479 VanDerWaalsContact C-N 3.34Å; R477-H479 PolarHBondContact O-N 3.35Å; R477-Y480 PolarHBondContact O-N 3.26Å; R477-Y480 VanDerWaalsContact O-N 3.15Å; R477-E481 IonicContact CZ-OE1 2.65Å; R477-E481 VanDerWaalsContact CZ-OE1 3.3Å; R477-E481 IonicContact CZ-OE2 2.65Å; R477-E481 IonicContact NE-OE1 2.65Å; R477-E481 PolarHBondContact NE-OE1 3.33Å; R477-E481 IonicContact NE-OE2 2.72Å; R477-E481 PolarHBondContact NE-OE2 3.34Å; R477-E481 IonicContact NH2-OE1 2.79Å; R477-E481 PolarHBondContact NH2-OE1 3.47Å; R477-E481 VanDerWaalsContact NH2-OE1 3.07Å; R477-E481 IonicContact NH2-OE2 3.17Å; R477-E481 PolarHBondContact NH2-OE2 2.95Å; R477-E481 WeakPolarHBondContact O-CG 3.36Å; R477-E481 PolarHBondContact O-N 3.14Å
478	E	96.1	Very high	95.2	Very high	89 Å²	89	100.7 Å²	100.7	42%	0.416	47%	0.474	S	S	.	.	H	α-helix	trans	-65.2	-35.1	179.4	-162	-154.9	-156.9	0	0	112.1	L474 I476 E481 R482	L474-E478 WeakPolarHBondContact O-CB 3.24Å; L474-E478 PolarHBondContact O-N 3Å; I476-E478 VanDerWaalsContact C-N 3.34Å; I476-E478 PolarHBondContact O-N 2.9Å; E478-E481 PolarHBondContact O-N 3.46Å; E478-R482 WeakPolarHBondContact O-CG 3.31Å; E478-R482 PolarHBondContact O-N 3.04Å; E478-R482 IonicContact OE1-CZ 3.13Å; E478-R482 IonicContact OE1-NH1 2.69Å; E478-R482 IonicContact OE1-NH2 2.71Å; E478-R482 PolarHBondContact OE1-NH2 3.5Å; E478-R482 IonicContact OE2-CZ 2.62Å; E478-R482 IonicContact OE2-NH1 2.93Å; E478-R482 PolarHBondContact OE2-NH1 2.88Å; E478-R482 IonicContact OE2-NH2 3.07Å; E478-R482 PolarHBondContact OE2-NH2 3.48Å
479	H	95.8	Very high	95.3	Very high	89 Å²	89	100.2 Å²	100.2	41%	0.412	47%	0.474	S	S	.	.	H	α-helix	trans	-67.9	-35.9	171.9	-177.1	62.9	0	0	0	113	D475 I476 R477 K483	D475-H479 WeakPolarHBondContact O-CB 3.49Å; D475-H479 PolarHBondContact O-N 3.25Å; I476-H479 PolarHBondContact O-N 3.46Å; R477-H479 VanDerWaalsContact C-N 3.34Å; R477-H479 PolarHBondContact O-N 3.35Å; H479-K483 WeakPolarHBondContact NE2-CE 3.46Å; H479-K483 PolarHBondContact NE2-NZ 3.05Å; H479-K483 WeakPolarHBondContact O-CG 3.41Å; H479-K483 PolarHBondContact O-N 2.94Å
480	Y	95.5	Very high	95.4	Very high	154 Å²	154	100.2 Å²	100.2	60%	0.604	48%	0.477	S	S	*	.	H	α-helix	trans	-70.6	-38.4	171.6	-85.8	-77	0	0	0	112.2	I476 R477 K483 L484	I476-Y480 HydrophobicContact CG2-CD2 3.83Å; I476-Y480 HydrophobicContact CG2-CE2 3.86Å; I476-Y480 VanDerWaalsContact O-CD2 3.31Å; I476-Y480 WeakPolarHBondContact O-CD2 3.46Å; I476-Y480 PolarHBondContact O-N 3.42Å; R477-Y480 PolarHBondContact O-N 3.26Å; R477-Y480 VanDerWaalsContact O-N 3.15Å; Y480-K483 WeakPolarHBondContact O-CB 3.42Å; Y480-K483 PolarHBondContact O-N 3.01Å; Y480-K483 VanDerWaalsContact O-N 3.1Å; Y480-L484 WeakPolarHBondContact O-CB 3.41Å; Y480-L484 PolarHBondContact O-N 3.45Å
481	E	95.6	Very high	95.5	Very high	85 Å²	85	102.2 Å²	102.2	40%	0.397	48%	0.478	S	S	.	.	H	α-helix	trans	-60.9	-50.4	174.9	-75	165.3	173.2	0	0	110.7	R477 E478 K483 L484 E485	R477-E481 IonicContact CZ-OE1 2.65Å; R477-E481 VanDerWaalsContact CZ-OE1 3.3Å; R477-E481 IonicContact CZ-OE2 2.65Å; R477-E481 IonicContact NE-OE1 2.65Å; R477-E481 PolarHBondContact NE-OE1 3.33Å; R477-E481 IonicContact NE-OE2 2.72Å; R477-E481 PolarHBondContact NE-OE2 3.34Å; R477-E481 IonicContact NH2-OE1 2.79Å; R477-E481 PolarHBondContact NH2-OE1 3.47Å; R477-E481 VanDerWaalsContact NH2-OE1 3.07Å; R477-E481 IonicContact NH2-OE2 3.17Å; R477-E481 PolarHBondContact NH2-OE2 2.95Å; R477-E481 WeakPolarHBondContact O-CG 3.36Å; R477-E481 PolarHBondContact O-N 3.14Å; E478-E481 PolarHBondContact O-N 3.46Å; E481-K483 PolarHBondContact O-N 2.84Å; E481-K483 VanDerWaalsContact O-N 3.12Å; E481-L484 PolarHBondContact O-N 3.03Å; E481-L484 VanDerWaalsContact O-N 3.17Å; E481-E485 WeakPolarHBondContact O-CB 3.38Å; E481-E485 PolarHBondContact O-N 3.04Å
482	R	96.3	Very high	95.5	Very high	104 Å²	104	101.6 Å²	101.6	39%	0.392	48%	0.483	S	S	.	.	H	α-helix	trans	-62.7	-16.3	172.6	-68.7	-171.6	-164.4	95.8	-10.3	114.7	E478 R486	E478-R482 WeakPolarHBondContact O-CG 3.31Å; E478-R482 PolarHBondContact O-N 3.04Å; E478-R482 IonicContact OE1-CZ 3.13Å; E478-R482 IonicContact OE1-NH1 2.69Å; E478-R482 IonicContact OE1-NH2 2.71Å; E478-R482 PolarHBondContact OE1-NH2 3.5Å; E478-R482 IonicContact OE2-CZ 2.62Å; E478-R482 IonicContact OE2-NH1 2.93Å; E478-R482 PolarHBondContact OE2-NH1 2.88Å; E478-R482 IonicContact OE2-NH2 3.07Å; E478-R482 PolarHBondContact OE2-NH2 3.48Å; R482-R486 PolarHBondContact O-NE 3.46Å; R482-R486 PolarHBondContact O-NH2 2.97Å
483	K	95.4	Very high	95.5	Very high	101 Å²	101	101.6 Å²	101.6	44%	0.439	48%	0.483	S	S	.	.	H	α-helix	trans	-87.1	-42.7	173.3	-84.2	175.9	170.1	-179	0	111.2	H479 Y480 E481 R486 A487	H479-K483 WeakPolarHBondContact NE2-CE 3.46Å; H479-K483 PolarHBondContact NE2-NZ 3.05Å; H479-K483 WeakPolarHBondContact O-CG 3.41Å; H479-K483 PolarHBondContact O-N 2.94Å; Y480-K483 WeakPolarHBondContact O-CB 3.42Å; Y480-K483 PolarHBondContact O-N 3.01Å; Y480-K483 VanDerWaalsContact O-N 3.1Å; E481-K483 PolarHBondContact O-N 2.84Å; E481-K483 VanDerWaalsContact O-N 3.12Å; K483-R486 PolarHBondContact O-N 3.44Å; K483-A487 PolarHBondContact O-N 3.43Å
484	L	95.7	Very high	95.5	Very high	106 Å²	106	103.6 Å²	103.6	56%	0.555	49%	0.486	S	S	*	.	H	α-helix	trans	-62.8	-42.6	175.8	-179.8	60.3	0	0	0	111.3	Y480 E481 A487 N488	Y480-L484 WeakPolarHBondContact O-CB 3.41Å; Y480-L484 PolarHBondContact O-N 3.45Å; E481-L484 PolarHBondContact O-N 3.03Å; E481-L484 VanDerWaalsContact O-N 3.17Å; L484-A487 PolarHBondContact O-N 2.87Å; L484-N488 WeakPolarHBondContact O-CB 3.38Å; L484-N488 PolarHBondContact O-N 3.03Å; L484-N488 PolarHBondContact O-ND2 2.79Å
485	E	95.4	Very high	95.6	Very high	114 Å²	114	102.9 Å²	102.9	53%	0.533	48%	0.482	S	S	.	.	H	α-helix	trans	-57.7	-48.8	173.8	-177.8	178.8	-142.7	0	0	112.1	E481 A487 N488 N489	E481-E485 WeakPolarHBondContact O-CB 3.38Å; E481-E485 PolarHBondContact O-N 3.04Å; E485-A487 VanDerWaalsContact C-N 3.34Å; E485-A487 PolarHBondContact O-N 2.85Å; E485-N488 PolarHBondContact O-N 2.68Å; E485-N489 VanDerWaalsContact O-CG 3.28Å; E485-N489 PolarHBondContact O-N 3.15Å; E485-N489 PolarHBondContact O-OD1 3.37Å
486	R	95.3	Very high	95.6	Very high	142 Å²	142	100.9 Å²	100.9	54%	0.536	48%	0.479	S	S	.	.	H	α-helix	trans	-61.7	-38.9	175.1	-83	179.4	-78.7	-171.6	-7.9	112.9	R482 K483 N489 L490	R482-R486 PolarHBondContact O-NE 3.46Å; R482-R486 PolarHBondContact O-NH2 2.97Å; K483-R486 PolarHBondContact O-N 3.44Å; R486-N489 PolarHBondContact O-N 3.22Å; R486-L490 WeakPolarHBondContact O-CG 3.42Å; R486-L490 PolarHBondContact O-N 2.98Å; R486-L490 VanDerWaalsContact O-N 3.09Å
487	A	95	Very high	95.5	Very high	52 Å²	52	101.9 Å²	101.9	43%	0.43	48%	0.483	S	S	.	.	H	α-helix	trans	-66.2	-39.7	174.8	0	0	0	0	0	112.3	K483 L484 E485 L490 Y491	K483-A487 PolarHBondContact O-N 3.43Å; L484-A487 PolarHBondContact O-N 2.87Å; E485-A487 VanDerWaalsContact C-N 3.34Å; E485-A487 PolarHBondContact O-N 2.85Å; A487-L490 PolarHBondContact O-N 3.1Å; A487-Y491 WeakPolarHBondContact O-CB 3.45Å; A487-Y491 PolarHBondContact O-N 2.87Å
488	N	95	Very high	95.4	Very high	82 Å²	82	100.6 Å²	100.6	44%	0.439	49%	0.485	S	S	.	.	H	α-helix	trans	-65.2	-40.5	176.1	-70.7	-17.2	0	0	0	111.9	L484 E485 Y491 M492	L484-N488 WeakPolarHBondContact O-CB 3.38Å; L484-N488 PolarHBondContact O-N 3.03Å; L484-N488 PolarHBondContact O-ND2 2.79Å; E485-N488 PolarHBondContact O-N 2.68Å; N488-Y491 WeakPolarHBondContact O-CB 3.45Å; N488-Y491 PolarHBondContact O-N 2.91Å; N488-M492 PolarHBondContact O-N 2.8Å
489	N	96.1	Very high	95.4	Very high	77 Å²	77	101 Å²	101	41%	0.412	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-47.2	176.6	-67.6	-10.5	0	0	0	111.2	E485 R486 Y491 M492 E493	E485-N489 VanDerWaalsContact O-CG 3.28Å; E485-N489 PolarHBondContact O-N 3.15Å; E485-N489 PolarHBondContact O-OD1 3.37Å; R486-N489 PolarHBondContact O-N 3.22Å; N489-Y491 VanDerWaalsContact C-N 3.28Å; N489-Y491 PolarHBondContact O-N 3.07Å; N489-M492 WeakPolarHBondContact O-CB 3.48Å; N489-M492 PolarHBondContact O-N 3.12Å; N489-M492 VanDerWaalsContact O-N 3.1Å; N489-E493 WeakPolarHBondContact O-CG 3.37Å; N489-E493 PolarHBondContact O-N 2.7Å
490	L	95.8	Very high	95.3	Very high	111 Å²	111	102.1 Å²	102.1	58%	0.581	50%	0.495	S	S	*	.	H	α-helix	trans	-60.2	-37.2	173.8	-71.1	168.6	0	0	0	112.4	R486 A487 E493 L494	R486-L490 WeakPolarHBondContact O-CG 3.42Å; R486-L490 PolarHBondContact O-N 2.98Å; R486-L490 VanDerWaalsContact O-N 3.09Å; A487-L490 PolarHBondContact O-N 3.1Å; L490-E493 PolarHBondContact O-N 2.78Å; L490-L494 WeakPolarHBondContact O-CB 3.48Å; L490-L494 PolarHBondContact O-N 2.84Å
491	Y	95.3	Very high	95.1	Very high	150 Å²	150	99.9 Å²	99.9	59%	0.588	49%	0.493	S	S	*	.	H	α-helix	trans	-66.1	-39.5	173.9	177.4	-105.3	0	0	0	112	A487 N488 N489 N495	A487-Y491 WeakPolarHBondContact O-CB 3.45Å; A487-Y491 PolarHBondContact O-N 2.87Å; N488-Y491 WeakPolarHBondContact O-CB 3.45Å; N488-Y491 PolarHBondContact O-N 2.91Å; N489-Y491 VanDerWaalsContact C-N 3.28Å; N489-Y491 PolarHBondContact O-N 3.07Å; Y491-N495 WeakPolarHBondContact CD1-ND2 3.46Å; Y491-N495 WeakPolarHBondContact CE1-ND2 3.39Å; Y491-N495 WeakPolarHBondContact CE2-ND2 3.49Å; Y491-N495 WeakPolarHBondContact O-CB 3.34Å; Y491-N495 PolarHBondContact O-N 3.27Å; Y491-N495 PolarHBondContact O-ND2 2.84Å
492	M	94.7	Very high	95	Very high	125 Å²	125	100 Å²	100	62%	0.616	49%	0.493	S	S	*	.	H	α-helix	trans	-64.7	-44.4	173.6	-78.8	171.7	42.6	0	0	112.2	N488 N489 N495 A496	N488-M492 PolarHBondContact O-N 2.8Å; N489-M492 WeakPolarHBondContact O-CB 3.48Å; N489-M492 PolarHBondContact O-N 3.12Å; N489-M492 VanDerWaalsContact O-N 3.1Å; M492-N495 PolarHBondContact O-N 3.24Å; M492-A496 PolarHBondContact O-N 2.92Å
493	E	95.7	Very high	94.9	Very high	117 Å²	117	99.6 Å²	99.6	55%	0.547	50%	0.498	S	S	.	.	H	α-helix	trans	-59.4	-46.7	175	-72.2	173.5	-163.8	0	0	111.6	N489 L490 N495 A496 I497	N489-E493 WeakPolarHBondContact O-CG 3.37Å; N489-E493 PolarHBondContact O-N 2.7Å; L490-E493 PolarHBondContact O-N 2.78Å; E493-N495 PolarHBondContact O-N 2.9Å; E493-A496 PolarHBondContact O-N 3.17Å; E493-I497 WeakPolarHBondContact O-CG1 3.35Å; E493-I497 PolarHBondContact O-N 3.44Å
494	L	95.1	Very high	94.7	Very high	96 Å²	96	100.5 Å²	100.5	50%	0.503	50%	0.502	S	S	.	.	H	α-helix	trans	-59.6	-45.5	176.6	178.9	60.9	0	0	0	111.9	L490 A496 I497 M498	L490-L494 WeakPolarHBondContact O-CB 3.48Å; L490-L494 PolarHBondContact O-N 2.84Å; L494-A496 VanDerWaalsContact C-N 3.34Å; L494-A496 PolarHBondContact O-N 2.97Å; L494-I497 PolarHBondContact O-N 3.1Å; L494-M498 HydrophobicContact CD1-CG 4.42Å; L494-M498 HydrophobicContact CG-SD 4.34Å; L494-M498 WeakPolarHBondContact O-CG 3.47Å; L494-M498 PolarHBondContact O-N 3.41Å
495	N	95.3	Very high	94.4	Very high	65 Å²	65	101.1 Å²	101.1	35%	0.348	50%	0.502	S	S	.	.	H	α-helix	trans	-63.1	-38.9	176.8	-79.3	-64.8	0	0	0	112.3	Y491 M492 E493 M498 L499	Y491-N495 WeakPolarHBondContact CD1-ND2 3.46Å; Y491-N495 WeakPolarHBondContact CE1-ND2 3.39Å; Y491-N495 WeakPolarHBondContact CE2-ND2 3.49Å; Y491-N495 WeakPolarHBondContact O-CB 3.34Å; Y491-N495 PolarHBondContact O-N 3.27Å; Y491-N495 PolarHBondContact O-ND2 2.84Å; M492-N495 PolarHBondContact O-N 3.24Å; E493-N495 PolarHBondContact O-N 2.9Å; N495-M498 PolarHBondContact O-N 3.36Å; N495-L499 WeakPolarHBondContact O-CB 3.4Å; N495-L499 PolarHBondContact O-N 3.44Å
496	A	95.9	Very high	94.2	Very high	49 Å²	49	100.6 Å²	100.6	41%	0.405	50%	0.498	S	S	.	.	H	α-helix	trans	-64.1	-41.2	175.7	0	0	0	0	0	111.8	M492 E493 L494 L499 Q500	M492-A496 PolarHBondContact O-N 2.92Å; E493-A496 PolarHBondContact O-N 3.17Å; L494-A496 VanDerWaalsContact C-N 3.34Å; L494-A496 PolarHBondContact O-N 2.97Å; A496-L499 PolarHBondContact O-N 3.49Å; A496-Q500 WeakPolarHBondContact O-CG 3.48Å; A496-Q500 PolarHBondContact O-N 3.48Å
497	I	94.9	Very high	93.9	Very high	95 Å²	95	97.8 Å²	97.8	49%	0.487	49%	0.491	S	S	.	.	H	α-helix	trans	-66.1	-44.1	175.2	-67.1	166.5	0	0	0	110.9	E493 L494 L499 Q500 L501	E493-I497 WeakPolarHBondContact O-CG1 3.35Å; E493-I497 PolarHBondContact O-N 3.44Å; L494-I497 PolarHBondContact O-N 3.1Å; I497-L499 VanDerWaalsContact C-N 3.33Å; I497-L499 PolarHBondContact O-N 3.4Å; I497-Q500 PolarHBondContact O-N 3.42Å; I497-L501 HydrophobicContact CG2-CD1 4.18Å; I497-L501 WeakPolarHBondContact O-CG 3.38Å; I497-L501 PolarHBondContact O-N 3.02Å
498	M	93.9	Very high	93.4	Very high	109 Å²	109	100.5 Å²	100.5	54%	0.537	50%	0.497	S	S	.	.	H	α-helix	trans	-59.4	-42.5	175.9	-75.3	-177.6	65.1	0	0	112.1	L494 N495 L501 E502	L494-M498 HydrophobicContact CD1-CG 4.42Å; L494-M498 HydrophobicContact CG-SD 4.34Å; L494-M498 WeakPolarHBondContact O-CG 3.47Å; L494-M498 PolarHBondContact O-N 3.41Å; N495-M498 PolarHBondContact O-N 3.36Å; M498-L501 PolarHBondContact O-N 3.3Å; M498-E502 PolarHBondContact O-N 3.04Å
499	L	94.9	Very high	92.9	Very high	98 Å²	98	100.2 Å²	100.2	51%	0.513	50%	0.496	S	S	.	.	H	α-helix	trans	-64.5	-40.6	176.1	-176.7	62.8	0	0	0	112	N495 A496 I497 L501 E502 I503	N495-L499 WeakPolarHBondContact O-CB 3.4Å; N495-L499 PolarHBondContact O-N 3.44Å; A496-L499 PolarHBondContact O-N 3.49Å; I497-L499 VanDerWaalsContact C-N 3.33Å; I497-L499 PolarHBondContact O-N 3.4Å; L499-L501 VanDerWaalsContact C-N 3.33Å; L499-L501 PolarHBondContact O-N 2.98Å; L499-E502 PolarHBondContact O-N 2.97Å; L499-I503 HydrophobicContact CD1-CD1 4.4Å; L499-I503 HydrophobicContact CG-CD1 4.1Å; L499-I503 WeakPolarHBondContact O-CD1 3.34Å; L499-I503 VanDerWaalsContact O-CG1 3.26Å; L499-I503 WeakPolarHBondContact O-CG1 3.48Å; L499-I503 PolarHBondContact O-N 2.95Å
500	Q	93.8	Very high	92.4	Very high	113 Å²	113	103.2 Å²	103.2	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-63.6	-36.9	173.8	-72.3	-179.1	30.2	0	0	112.7	A496 I497 K504	A496-Q500 WeakPolarHBondContact O-CG 3.48Å; A496-Q500 PolarHBondContact O-N 3.48Å; I497-Q500 PolarHBondContact O-N 3.42Å; Q500-K504 WeakPolarHBondContact O-CB 3.46Å; Q500-K504 WeakPolarHBondContact O-CG 3.45Å; Q500-K504 PolarHBondContact O-N 3.27Å
501	L	92.6	Very high	91.7	Very high	107 Å²	107	104.2 Å²	104.2	56%	0.56	50%	0.501	S	S	*	.	H	α-helix	trans	-66.4	-45.7	174.8	-72.3	171.1	0	0	0	111.4	I497 M498 L499 I503 K504 E505	I497-L501 HydrophobicContact CG2-CD1 4.18Å; I497-L501 WeakPolarHBondContact O-CG 3.38Å; I497-L501 PolarHBondContact O-N 3.02Å; M498-L501 PolarHBondContact O-N 3.3Å; L499-L501 VanDerWaalsContact C-N 3.33Å; L499-L501 PolarHBondContact O-N 2.98Å; L501-I503 VanDerWaalsContact C-N 3.31Å; L501-I503 PolarHBondContact O-N 3.49Å; L501-K504 PolarHBondContact O-N 2.93Å; L501-K504 VanDerWaalsContact O-N 3.16Å; L501-E505 WeakPolarHBondContact O-CB 3.41Å; L501-E505 PolarHBondContact O-N 3.36Å
502	E	93.3	Very high	90.8	Very high	86 Å²	86	103.2 Å²	103.2	40%	0.402	50%	0.501	S	S	.	.	H	α-helix	trans	-62.5	-37.4	177.6	-158.2	-153.1	-177.6	0	0	111.9	M498 L499 K506	M498-E502 PolarHBondContact O-N 3.04Å; L499-E502 PolarHBondContact O-N 2.97Å; E502-K506 WeakPolarHBondContact O-CB 3.22Å; E502-K506 WeakPolarHBondContact O-CD 3.49Å; E502-K506 VanDerWaalsContact O-CG 3.26Å; E502-K506 WeakPolarHBondContact O-CG 3.44Å; E502-K506 PolarHBondContact O-N 3.09Å; E502-K506 VanDerWaalsContact OE1-CE 3.24Å; E502-K506 WeakPolarHBondContact OE1-CE 3.22Å; E502-K506 IonicContact OE1-NZ 3.44Å; E502-K506 PolarHBondContact OE1-NZ 2.92Å; E502-K506 IonicContact OE2-NZ 3.55Å; E502-K506 PolarHBondContact OE2-NZ 2.76Å
503	I	93.4	Very high	89.9	Confident	97 Å²	97	102 Å²	102	50%	0.497	49%	0.494	S	S	.	.	H	α-helix	trans	-64.4	-46.8	173.2	-70.2	165.7	0	0	0	110.7	L499 L501 K506 E507	L499-I503 HydrophobicContact CD1-CD1 4.4Å; L499-I503 HydrophobicContact CG-CD1 4.1Å; L499-I503 WeakPolarHBondContact O-CD1 3.34Å; L499-I503 VanDerWaalsContact O-CG1 3.26Å; L499-I503 WeakPolarHBondContact O-CG1 3.48Å; L499-I503 PolarHBondContact O-N 2.95Å; L501-I503 VanDerWaalsContact C-N 3.31Å; L501-I503 PolarHBondContact O-N 3.49Å; I503-K506 PolarHBondContact O-N 3.48Å; I503-E507 WeakPolarHBondContact O-CB 3.4Å; I503-E507 PolarHBondContact O-N 3.21Å
504	K	91.1	Very high	88.9	Confident	120 Å²	120	99.5 Å²	99.5	52%	0.522	49%	0.49	S	S	.	.	H	α-helix	trans	-64.5	-38.2	177.2	-78.8	176.7	177.6	173.2	0	112.6	Q500 L501 E507 L508	Q500-K504 WeakPolarHBondContact O-CB 3.46Å; Q500-K504 WeakPolarHBondContact O-CG 3.45Å; Q500-K504 PolarHBondContact O-N 3.27Å; L501-K504 PolarHBondContact O-N 2.93Å; L501-K504 VanDerWaalsContact O-N 3.16Å; K504-E507 CarbonylContact O-C 3.47Å; K504-E507 WeakPolarHBondContact O-CB 3.39Å; K504-E507 PolarHBondContact O-N 3.1Å; K504-L508 WeakPolarHBondContact O-CB 3.37Å; K504-L508 VanDerWaalsContact O-CG 3.32Å; K504-L508 WeakPolarHBondContact O-CG 3.26Å; K504-L508 PolarHBondContact O-N 2.88Å
505	E	89.6	Confident	87.5	Confident	118 Å²	118	100 Å²	100	55%	0.551	49%	0.493	S	S	*	.	H	α-helix	trans	-62.6	-47	174.9	-176.6	174.9	-154.7	0	0	110.9	L501 E507 L508 L509	L501-E505 WeakPolarHBondContact O-CB 3.41Å; L501-E505 PolarHBondContact O-N 3.36Å; E505-E507 PolarHBondContact O-N 3.29Å; E505-L508 PolarHBondContact O-N 3.49Å; E505-L508 VanDerWaalsContact O-N 3.16Å; E505-L509 HydrophobicContact CG-CD1 4.05Å; E505-L509 WeakPolarHBondContact O-CD1 3.49Å; E505-L509 PolarHBondContact O-N 2.94Å
506	K	91.4	Very high	85.8	Confident	103 Å²	103	102.6 Å²	102.6	45%	0.448	51%	0.506	S	S	.	.	H	α-helix	trans	-61.4	-30.4	172.9	-70.6	165.3	-174.6	168.3	0	112.6	E502 I503 K510	E502-K506 WeakPolarHBondContact O-CB 3.22Å; E502-K506 WeakPolarHBondContact O-CD 3.49Å; E502-K506 VanDerWaalsContact O-CG 3.26Å; E502-K506 WeakPolarHBondContact O-CG 3.44Å; E502-K506 PolarHBondContact O-N 3.09Å; E502-K506 VanDerWaalsContact OE1-CE 3.24Å; E502-K506 WeakPolarHBondContact OE1-CE 3.22Å; E502-K506 IonicContact OE1-NZ 3.44Å; E502-K506 PolarHBondContact OE1-NZ 2.92Å; E502-K506 IonicContact OE2-NZ 3.55Å; E502-K506 PolarHBondContact OE2-NZ 2.76Å; I503-K506 PolarHBondContact O-N 3.48Å; K506-K510 WeakPolarHBondContact O-CD 3.39Å; K506-K510 VanDerWaalsContact O-CG 3.23Å; K506-K510 WeakPolarHBondContact O-CG 3.32Å; K506-K510 PolarHBondContact O-N 3.08Å
507	E	89.8	Confident	84.2	Confident	83 Å²	83	107.9 Å²	107.9	39%	0.388	52%	0.52	S	S	.	.	H	α-helix	trans	-75.6	-37.7	174.7	-152.7	-163.6	150.1	0	0	112.4	I503 K504 E505 K510 R511	I503-E507 WeakPolarHBondContact O-CB 3.4Å; I503-E507 PolarHBondContact O-N 3.21Å; K504-E507 CarbonylContact O-C 3.47Å; K504-E507 WeakPolarHBondContact O-CB 3.39Å; K504-E507 PolarHBondContact O-N 3.1Å; E505-E507 PolarHBondContact O-N 3.29Å; E507-K510 PolarHBondContact O-N 3.47Å; E507-R511 PolarHBondContact O-N 2.62Å; E507-R511 IonicContact OE1-CZ 2.87Å; E507-R511 IonicContact OE1-NH1 3.16Å; E507-R511 PolarHBondContact OE1-NH1 3.28Å; E507-R511 IonicContact OE1-NH2 2.93Å; E507-R511 PolarHBondContact OE1-NH2 2.98Å; E507-R511 IonicContact OE2-NH1 2.66Å
508	L	83.4	Confident	82.6	Confident	109 Å²	109	110.8 Å²	110.8	57%	0.571	53%	0.529	S	S	*	.	H	α-helix	trans	-67.5	-46	174.4	-73.6	170.7	0	0	0	111.4	K504 E505 K510 R511 E512	K504-L508 WeakPolarHBondContact O-CB 3.37Å; K504-L508 VanDerWaalsContact O-CG 3.32Å; K504-L508 WeakPolarHBondContact O-CG 3.26Å; K504-L508 PolarHBondContact O-N 2.88Å; E505-L508 PolarHBondContact O-N 3.49Å; E505-L508 VanDerWaalsContact O-N 3.16Å; L508-K510 VanDerWaalsContact C-N 3.26Å; L508-K510 PolarHBondContact O-N 2.87Å; L508-R511 CarbonylContact O-C 3.56Å; L508-R511 WeakPolarHBondContact O-CA 3.43Å; L508-R511 WeakPolarHBondContact O-CB 3.42Å; L508-R511 PolarHBondContact O-N 3.49Å; L508-E512 WeakPolarHBondContact O-CB 3.47Å; L508-E512 PolarHBondContact O-N 3.02Å
509	L	85.3	Confident	80.9	Confident	77 Å²	77	114.1 Å²	114.1	40%	0.403	54%	0.537	S	S	.	.	H	α-helix	trans	-56.9	-39.8	172.6	-97.3	77	0	0	0	111.7	E505 E512 Q513	E505-L509 HydrophobicContact CG-CD1 4.05Å; E505-L509 WeakPolarHBondContact O-CD1 3.49Å; E505-L509 PolarHBondContact O-N 2.94Å; L509-E512 PolarHBondContact O-N 2.88Å; L509-Q513 WeakPolarHBondContact O-CB 3.46Å; L509-Q513 VanDerWaalsContact O-CG 3.22Å; L509-Q513 WeakPolarHBondContact O-CG 3.43Å; L509-Q513 PolarHBondContact O-N 2.97Å
510	K	86.1	Confident	79	Confident	139 Å²	139	114.4 Å²	114.4	60%	0.604	55%	0.545	S	S	*	.	H	α-helix	trans	-64.6	-37.4	174.7	-76.3	169.6	-176.2	176.8	0	112.4	K506 E507 L508 S514	K506-K510 WeakPolarHBondContact O-CD 3.39Å; K506-K510 VanDerWaalsContact O-CG 3.23Å; K506-K510 WeakPolarHBondContact O-CG 3.32Å; K506-K510 PolarHBondContact O-N 3.08Å; E507-K510 PolarHBondContact O-N 3.47Å; L508-K510 VanDerWaalsContact C-N 3.26Å; L508-K510 PolarHBondContact O-N 2.87Å; K510-S514 VanDerWaalsContact O-CB 3.31Å; K510-S514 WeakPolarHBondContact O-CB 3.24Å; K510-S514 PolarHBondContact O-N 2.95Å; K510-S514 PolarHBondContact O-OG 3.34Å
511	R	80.5	Confident	77	Confident	133 Å²	133	115 Å²	115	50%	0.502	56%	0.561	S	S	.	*	H	α-helix	trans	-67.4	-46.8	173.3	-74.7	-172.1	177.1	87.3	7.9	111.6	E507 L508 S514 L515	E507-R511 PolarHBondContact O-N 2.62Å; E507-R511 IonicContact OE1-CZ 2.87Å; E507-R511 IonicContact OE1-NH1 3.16Å; E507-R511 PolarHBondContact OE1-NH1 3.28Å; E507-R511 IonicContact OE1-NH2 2.93Å; E507-R511 PolarHBondContact OE1-NH2 2.98Å; E507-R511 IonicContact OE2-NH1 2.66Å; L508-R511 CarbonylContact O-C 3.56Å; L508-R511 WeakPolarHBondContact O-CA 3.43Å; L508-R511 WeakPolarHBondContact O-CB 3.42Å; L508-R511 PolarHBondContact O-N 3.49Å; R511-S514 CarbonylContact O-C 3.57Å; R511-S514 WeakPolarHBondContact O-CA 3.26Å; R511-S514 WeakPolarHBondContact O-CB 3.39Å; R511-S514 PolarHBondContact O-N 3.4Å; R511-L515 WeakPolarHBondContact O-CG 3.44Å; R511-L515 PolarHBondContact O-N 3.42Å
512	E	76.7	Confident	75	Confident	128 Å²	128	114.8 Å²	114.8	60%	0.598	57%	0.568	S	S	*	*	H	α-helix	trans	-57.5	-52.9	177.6	-175.1	174.3	-140.7	0	0	111.2	L508 L509 S514 L515 D516	L508-E512 WeakPolarHBondContact O-CB 3.47Å; L508-E512 PolarHBondContact O-N 3.02Å; L509-E512 PolarHBondContact O-N 2.88Å; E512-S514 PolarHBondContact O-N 3.46Å; E512-L515 PolarHBondContact O-N 3.22Å; E512-D516 WeakPolarHBondContact O-CB 3.47Å; E512-D516 PolarHBondContact O-N 3.46Å
513	Q	75.6	Confident	72.9	Confident	100 Å²	100	119.2 Å²	119.2	47%	0.467	59%	0.586	S	S	.	*	H	α-helix	trans	-59.9	-20	173.6	-69.9	175.3	17.4	0	0	113.8	L509 K517	L509-Q513 WeakPolarHBondContact O-CB 3.46Å; L509-Q513 VanDerWaalsContact O-CG 3.22Å; L509-Q513 WeakPolarHBondContact O-CG 3.43Å; L509-Q513 PolarHBondContact O-N 2.97Å; Q513-K517 WeakPolarHBondContact O-CB 3.47Å; Q513-K517 WeakPolarHBondContact O-CD 3.23Å; Q513-K517 WeakPolarHBondContact O-CE 3.42Å; Q513-K517 WeakPolarHBondContact O-CG 3.49Å
514	S	74.2	Confident	70.4	Confident	64 Å²	64	124.6 Å²	124.6	45%	0.448	61%	0.606	S	S	.	*	H	α-helix	trans	-91.8	-18.9	176	-59.5	0	0	0	0	113.3	K510 R511 E512 K518	K510-S514 VanDerWaalsContact O-CB 3.31Å; K510-S514 WeakPolarHBondContact O-CB 3.24Å; K510-S514 PolarHBondContact O-N 2.95Å; K510-S514 PolarHBondContact O-OG 3.34Å; R511-S514 CarbonylContact O-C 3.57Å; R511-S514 WeakPolarHBondContact O-CA 3.26Å; R511-S514 WeakPolarHBondContact O-CB 3.39Å; R511-S514 PolarHBondContact O-N 3.4Å; E512-S514 PolarHBondContact O-N 3.46Å; S514-K518 WeakPolarHBondContact O-CG 3.47Å
515	L	65.4	Low	68.1	Low	108 Å²	108	126.5 Å²	126.5	57%	0.565	62%	0.616	S	S	*	*	H	α-helix	trans	-85.1	-42.7	171.7	-70.7	169.7	0	0	0	110.8	R511 E512 K517 K518 Y519	R511-L515 WeakPolarHBondContact O-CG 3.44Å; R511-L515 PolarHBondContact O-N 3.42Å; E512-L515 PolarHBondContact O-N 3.22Å; L515-K517 VanDerWaalsContact C-N 3.3Å; L515-K517 PolarHBondContact O-N 3.26Å; L515-K518 WeakPolarHBondContact O-CA 3.49Å; L515-K518 WeakPolarHBondContact O-CB 3.22Å; L515-K518 PolarHBondContact O-N 2.94Å; L515-Y519 PolarHBondContact O-N 3.22Å
516	D	60.8	Low	65.8	Low	119 Å²	119	129.2 Å²	129.2	64%	0.636	63%	0.629	S	S	*	*	H	α-helix	trans	-60.7	-40	176.7	-164	45.5	0	0	0	111.3	E512 K518 Y519	E512-D516 WeakPolarHBondContact O-CB 3.47Å; E512-D516 PolarHBondContact O-N 3.46Å; D516-K518 PolarHBondContact O-N 2.93Å; D516-Y519 CarbonylContact O-C 3.52Å; D516-Y519 PolarHBondContact O-N 3.32Å
517	K	62.3	Low	63.9	Low	160 Å²	160	130.6 Å²	130.6	70%	0.696	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66	-16.2	170.2	-73.7	172.3	-167.3	166.5	0	114.9	Q513 L515	Q513-K517 WeakPolarHBondContact O-CB 3.47Å; Q513-K517 WeakPolarHBondContact O-CD 3.23Å; Q513-K517 WeakPolarHBondContact O-CE 3.42Å; Q513-K517 WeakPolarHBondContact O-CG 3.49Å; L515-K517 VanDerWaalsContact C-N 3.3Å; L515-K517 PolarHBondContact O-N 3.26Å
518	K	60.1	Low	61.7	Low	156 Å²	156	131.4 Å²	131.4	68%	0.678	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.8	-22.6	178.2	-78.5	-179.8	175.8	-176.7	0	113.4	S514 L515 D516	S514-K518 WeakPolarHBondContact O-CG 3.47Å; L515-K518 WeakPolarHBondContact O-CA 3.49Å; L515-K518 WeakPolarHBondContact O-CB 3.22Å; L515-K518 PolarHBondContact O-N 2.94Å; D516-K518 PolarHBondContact O-N 2.93Å
519	Y	58.1	Low	59.9	Low	179 Å²	179	138 Å²	138	70%	0.702	68%	0.683	S	S	*	*	S	Bend	trans	-134	59.4	-180	-68	-79.9	0	0	0	112.8	L515 D516 S521	L515-Y519 PolarHBondContact O-N 3.22Å; D516-Y519 CarbonylContact O-C 3.52Å; D516-Y519 PolarHBondContact O-N 3.32Å; Y519-S521 PolarHBondContact O-N 3.16Å; Y519-S521 VanDerWaalsContact O-N 3.17Å
520	P	54.9	Low	57.7	Low	104 Å²	104	143.4 Å²	143.4	68%	0.675	71%	0.706	S	S	*	*			trans	-61	121.1	174.5	26.8	-34.1	0	0	0	110.4
521	S	51.9	Low	55.9	Low	124 Å²	124	141.5 Å²	141.5	87%	0.867	71%	0.71	S	S	*	*	S	Bend	trans	67.2	72.3	178.1	-178.4	0	0	0	0	117.1	Y519	Y519-S521 PolarHBondContact O-N 3.16Å; Y519-S521 VanDerWaalsContact O-N 3.17Å
522	C	51.7	Low	54.5	Low	104 Å²	104	140.3 Å²	140.3	70%	0.703	73%	0.729	S	S	*	*			trans	-143.5	26.9	155.1	-142.4	0	0	0	0	117.2
523	F	48	Very low	53.3	Low	178 Å²	178	138.8 Å²	138.8	78%	0.781	73%	0.733	S	S	*	*			trans	-131.9	98.8	169.5	-75.2	-73.6	0	0	0	113	H525	F523-H525 PolarHBondContact O-N 3.06Å; F523-H525 VanDerWaalsContact O-N 3.16Å
524	K	41.7	Very low	52.3	Low	211 Å²	211	138.5 Å²	138.5	92%	0.917	74%	0.742	S	S	*	*			trans	-74.2	94.4	158.4	-76.1	-174.4	178.1	179.9	0	108.1	H526	K524-H526 PolarHBondContact O-N 3.47Å
525	H	42.5	Very low	51.4	Low	160 Å²	160	141 Å²	141	74%	0.741	75%	0.75	S	S	*	*			trans	-64.5	124.9	171.3	-83.9	-87.9	0	0	0	110.5	F523 S527	F523-H525 PolarHBondContact O-N 3.06Å; F523-H525 VanDerWaalsContact O-N 3.16Å; H525-S527 PolarHBondContact O-N 3.48Å
526	H	42.3	Very low	50.9	Low	175 Å²	175	140.1 Å²	140.1	81%	0.81	75%	0.753	S	S	*	*			trans	-61.3	133.1	160.9	-87.5	-68.8	0	0	0	109.3	K524 S528	K524-H526 PolarHBondContact O-N 3.47Å; H526-S528 VanDerWaalsContact C-N 3.33Å; H526-S528 PolarHBondContact O-N 3Å
527	S	50.1	Low	50.5	Low	132 Å²	132	140.7 Å²	140.7	92%	0.923	75%	0.754	S	S	*	*			trans	-70.9	84.1	177.6	-59.7	0	0	0	0	111.9	H525	H525-S527 PolarHBondContact O-N 3.48Å
528	S	44.6	Very low	50	Low	100 Å²	100	137.6 Å²	137.6	70%	0.699	74%	0.741	S	S	*	*			trans	-131.9	105.1	165	59.9	0	0	0	0	110.2	H526	H526-S528 VanDerWaalsContact C-N 3.33Å; H526-S528 PolarHBondContact O-N 3Å
529	R	44.2	Very low	49.8	Very low	248 Å²	248	137.8 Å²	137.8	94%	0.936	74%	0.742	S	S	*	*			trans	68.4	57.6	175.9	-63.7	-175.6	168.2	-173.4	-4	117.8
530	Q	40.6	Very low	49.6	Very low	189 Å²	189	136 Å²	136	88%	0.883	74%	0.744	S	S	*	*				-78.3	148.1	121.2	-68.3	-178.2	2.8	0	0	107.9
531	S	48.5	Very low	49.5	Very low	99 Å²	99	136.3 Å²	136.3	69%	0.692	74%	0.738	S	S	*	*			cis	-159.5	117.1	-13.4	40.6	0	0	0	0	108.8
532	A	51.1	Low	49.6	Very low	108 Å²	108	138.1 Å²	138.1	89%	0.893	73%	0.73	S	S	*	*	S	Bend	trans	-154	52.5	-171.9	0	0	0	0	0	114.5
533	S	51.1	Low	49.5	Very low	97 Å²	97	142.5 Å²	142.5	68%	0.678	74%	0.737	S	S	*	*	S	Bend	trans	-156.3	-40.6	165.6	-168.9	0	0	0	0	114.5	N535 S536	S533-N535 PolarHBondContact O-N 3.39Å; S533-S536 WeakPolarHBondContact O-CB 3.43Å; S533-S536 PolarHBondContact O-N 2.99Å
534	S	54.3	Low	49.8	Very low	94 Å²	94	144.8 Å²	144.8	66%	0.657	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	-23.8	-175.1	54.3	0	0	0	0	115.3	S536	S534-S536 PolarHBondContact O-N 2.81Å
535	N	54.7	Low	49.7	Very low	116 Å²	116	142.2 Å²	142.2	62%	0.62	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-4.7	175.2	-83.2	-32.7	0	0	0	115.2	S533 K539	S533-N535 PolarHBondContact O-N 3.39Å; N535-K539 WeakPolarHBondContact O-CD 3.31Å; N535-K539 WeakPolarHBondContact O-CG 3.33Å
536	S	55.3	Low	49.5	Very low	89 Å²	89	141 Å²	141	62%	0.622	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	-50.2	178.5	-159.5	0	0	0	0	112	S533 S534 K539 L540	S533-S536 WeakPolarHBondContact O-CB 3.43Å; S533-S536 PolarHBondContact O-N 2.99Å; S534-S536 PolarHBondContact O-N 2.81Å; S536-K539 PolarHBondContact O-N 2.8Å; S536-L540 PolarHBondContact O-N 3.18Å
537	M	52.9	Low	49.3	Very low	132 Å²	132	138.4 Å²	138.4	65%	0.65	74%	0.739	S	S	*	*	H	α-helix	trans	-68.5	-44.9	-174.6	-154.3	-172.2	-162.3	0	0	112.4	K539 L540 M541	M537-K539 VanDerWaalsContact C-N 3.27Å; M537-K539 PolarHBondContact O-N 3.16Å; M537-L540 WeakPolarHBondContact O-CB 3.41Å; M537-L540 PolarHBondContact O-N 3.04Å; M537-M541 HydrophobicContact CE-CE 3.95Å; M537-M541 HydrophobicContact CG-CE 3.86Å; M537-M541 WeakPolarHBondContact O-CG 3.37Å; M537-M541 PolarHBondContact O-N 2.65Å; M537-M541 VanDerWaalsContact O-N 3.1Å; M537-M541 HydrophobicContact SD-CE 3.73Å
538	E	52.1	Low	48.7	Very low	94 Å²	94	141.1 Å²	141.1	44%	0.439	74%	0.737	S	S	.	*	H	α-helix	trans	-66.8	-28.6	-177.8	-152.1	-168.3	148.8	0	0	112.6	L540 M541 K542	E538-L540 VanDerWaalsContact C-N 3.32Å; E538-M541 PolarHBondContact O-N 2.87Å; E538-K542 HydrophobicContact CG-CD 4.41Å; E538-K542 WeakPolarHBondContact O-CB 3.4Å; E538-K542 PolarHBondContact O-N 3.39Å; E538-K542 WeakPolarHBondContact OE1-CE 3.45Å; E538-K542 IonicContact OE1-NZ 3Å; E538-K542 PolarHBondContact OE1-NZ 3.29Å
539	K	54.4	Low	47.9	Very low	160 Å²	160	145.8 Å²	145.8	70%	0.696	75%	0.745	S	S	*	*	H	α-helix	trans	-69.7	-26.4	172.3	-82.7	-173.8	176.5	180	0	113.3	N535 S536 M537	N535-K539 WeakPolarHBondContact O-CD 3.31Å; N535-K539 WeakPolarHBondContact O-CG 3.33Å; S536-K539 PolarHBondContact O-N 2.8Å; M537-K539 VanDerWaalsContact C-N 3.27Å; M537-K539 PolarHBondContact O-N 3.16Å
540	L	54.2	Low	47.8	Very low	141 Å²	141	141 Å²	141	74%	0.738	74%	0.738	S	S	*	*	H	α-helix	trans	-75.9	-43.5	171.9	-131.2	74.7	0	0	0	110.8	S536 M537 E538 K543	S536-L540 PolarHBondContact O-N 3.18Å; M537-L540 WeakPolarHBondContact O-CB 3.41Å; M537-L540 PolarHBondContact O-N 3.04Å; E538-L540 VanDerWaalsContact C-N 3.32Å; L540-K543 PolarHBondContact O-N 2.93Å
541	M	53.8	Low	47.5	Very low	111 Å²	111	138 Å²	138	55%	0.547	73%	0.734	S	S	.	*	H	α-helix	trans	-62.5	-49.2	179.6	-66.5	167.3	168.2	0	0	112.5	M537 E538 K543 R544	M537-M541 HydrophobicContact CE-CE 3.95Å; M537-M541 HydrophobicContact CG-CE 3.86Å; M537-M541 WeakPolarHBondContact O-CG 3.37Å; M537-M541 PolarHBondContact O-N 2.65Å; M537-M541 VanDerWaalsContact O-N 3.1Å; M537-M541 HydrophobicContact SD-CE 3.73Å; E538-M541 PolarHBondContact O-N 2.87Å; M541-K543 PolarHBondContact O-N 3.16Å; M541-K543 VanDerWaalsContact O-N 3.08Å; M541-R544 PolarHBondContact O-N 2.74Å
542	K	52.7	Low	46.5	Very low	163 Å²	163	138 Å²	138	71%	0.709	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-2.3	-177.9	-81.1	175	170	167.8	0	114.9	E538	E538-K542 HydrophobicContact CG-CD 4.41Å; E538-K542 WeakPolarHBondContact O-CB 3.4Å; E538-K542 PolarHBondContact O-N 3.39Å; E538-K542 WeakPolarHBondContact OE1-CE 3.45Å; E538-K542 IonicContact OE1-NZ 3Å; E538-K542 PolarHBondContact OE1-NZ 3.29Å
543	K	51.5	Low	45.7	Very low	196 Å²	196	141.6 Å²	141.6	85%	0.852	73%	0.732	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	0.2	169.3	-110.5	-174.3	176.8	-173.3	0	114.4	L540 M541	L540-K543 PolarHBondContact O-N 2.93Å; M541-K543 PolarHBondContact O-N 3.16Å; M541-K543 VanDerWaalsContact O-N 3.08Å
544	R	54.2	Low	44.7	Very low	225 Å²	225	143 Å²	143	85%	0.849	74%	0.742	S	S	*	*	S	Bend	trans	-128.2	45.5	-175.9	-155.3	174.7	-174.8	135.8	0.7	114.2	M541	M541-R544 PolarHBondContact O-N 2.74Å
545	N	38.8	Very low	43.6	Very low	158 Å²	158	146.7 Å²	146.7	85%	0.845	75%	0.746	S	S	*	*			trans	-154.6	94.2	160.5	-109.5	-29.1	0	0	0	112.1
546	V	38.8	Very low	43	Very low	134 Å²	134	150 Å²	150	81%	0.812	75%	0.75	S	S	*	*			trans	-127.3	134.9	158.8	175.1	0	0	0	0	106.1	Q548	V546-Q548 PolarHBondContact O-N 3.36Å
547	P	38.4	Very low	42.2	Very low	121 Å²	121	151.6 Å²	151.6	79%	0.786	76%	0.758	S	S	*	*			trans	-78.2	127.7	-165.6	-11.8	28.3	0	0	0	112.3
548	Q	35.7	Very low	40.9	Very low	188 Å²	188	151 Å²	151	88%	0.879	76%	0.758	S	S	*	*			trans	-102.2	103.5	157.6	-77.1	-163.1	-18.6	0	0	109.7	V546	V546-Q548 PolarHBondContact O-N 3.36Å
549	K	28.4	Very low	40	Very low	198 Å²	198	154.6 Å²	154.6	86%	0.861	78%	0.779	S	S	*	*			trans	-105.6	114.2	163.5	-163.8	178.5	-174.4	-177	0	107.2
550	L	43.2	Very low	39	Very low	149 Å²	149	155 Å²	155	78%	0.78	79%	0.788	S	S	*	*			trans	-65.4	157.2	173.7	-72.4	78.2	0	0	0	110.2
551	P	32.3	Very low	37.7	Very low	125 Å²	125	157.9 Å²	157.9	81%	0.812	80%	0.795	S	S	*	*			trans	-132.4	170.8	130.3	37.8	-28.9	0	0	0	114.6
552	S	28.2	Very low	36.4	Very low	98 Å²	98	157.6 Å²	157.6	69%	0.685	80%	0.804	S	S	*	*			trans	-77.5	145.3	-169.5	46.6	0	0	0	0	117.1
553	H	35.1	Very low	35.2	Very low	184 Å²	184	158.6 Å²	158.6	85%	0.852	81%	0.811	S	S	*	*			trans	36.6	118.5	138.9	-60.1	-78.1	0	0	0	121.4
554	S	29.5	Very low	34	Very low	128 Å²	128	154.7 Å²	154.7	90%	0.895	80%	0.803	S	S	*	*				-170.1	172.1	120.2	47.3	0	0	0	0	113.5
555	K	30.8	Very low	32.7	Very low	170 Å²	170	150.8 Å²	150.8	74%	0.739	80%	0.798	S	S	*	*			trans	-73.8	120.3	-152.1	-59.5	160.5	179	170.5	0	117.2
556	R	42.7	Very low	32.3	Very low	185 Å²	185	150.2 Å²	150.2	70%	0.698	79%	0.794	S	S	*	*			trans	11.5	132.7	133	-179.6	-176.2	-178.6	161	2.6	120.6	D558	R556-D558 IonicContact CZ-OD1 3.6Å; R556-D558 IonicContact NE-OD1 2.91Å; R556-D558 PolarHBondContact NE-OD1 3.01Å; R556-D558 IonicContact NH2-OD1 2.76Å; R556-D558 PolarHBondContact NH2-OD1 2.95Å
557	P	37.4	Very low	31.8	Very low	123 Å²	123	149.7 Å²	149.7	80%	0.799	79%	0.793	S	S	*	*			trans	-118.4	-178.4	136.6	38.3	-28.7	0	0	0	112.9
558	D	27.3	Very low	31.1	Very low	120 Å²	120	153.2 Å²	153.2	64%	0.642	80%	0.796	S	S	*	*			trans	-112.2	172.7	-165.5	-62.3	-70.6	0	0	0	115.8	R556	R556-D558 IonicContact CZ-OD1 3.6Å; R556-D558 IonicContact NE-OD1 2.91Å; R556-D558 PolarHBondContact NE-OD1 3.01Å; R556-D558 IonicContact NH2-OD1 2.76Å; R556-D558 PolarHBondContact NH2-OD1 2.95Å
559	L	31.9	Very low	30.6	Very low	169 Å²	169	152.9 Å²	152.9	89%	0.885	80%	0.8	S	S	*	*			trans	-133.7	118	172.5	-77.2	175.2	0	0	0	111.2
560	L	34.3	Very low	30.4	Very low	170 Å²	170	150.3 Å²	150.3	89%	0.89	80%	0.795	S	S	*	*			trans	-151.4	120.2	161.2	-79	-177.8	0	0	0	110.3
561	K	26	Very low	29.7	Very low	200 Å²	200	149 Å²	149	87%	0.87	80%	0.798	S	S	*	*			trans	177.9	148.8	138	-103.8	167.2	-177.9	-179.9	0	113.1
562	S	27.8	Very low	29.5	Very low	106 Å²	106	148 Å²	148	74%	0.741	79%	0.794	S	S	*	*			trans	63.6	112.3	150.7	-59.1	0	0	0	0	117.1
563	E	27.6	Very low	29.4	Very low	183 Å²	183	150.8 Å²	150.8	86%	0.855	80%	0.798	S	S	*	*			cis	48.6	130.6	48.9	-114.3	-179.2	-142.6	0	0	112.1
564	V	25.3	Very low	29.1	Very low	115 Å²	115	148.6 Å²	148.6	70%	0.697	80%	0.798	S	S	*	*			cis	-151.9	-174	23.6	-159.4	0	0	0	0	109.4
565	I	27.6	Very low	29	Very low	143 Å²	143	150.9 Å²	150.9	73%	0.733	80%	0.795	S	S	*	*			trans	81.4	104.9	161.2	-63.6	165.8	0	0	0	115.1
566	L	29.8	Very low	28.7	Very low	146 Å²	146	149.8 Å²	149.8	76%	0.764	80%	0.802	S	S	*	*				76.6	134.7	73.6	-77.8	165.5	0	0	0	113.7
567	P	29.1	Very low	27.8	Very low	122 Å²	122	146.3 Å²	146.3	79%	0.792	80%	0.801	S	S	*	*				-142.6	149.9	78.3	38.8	-22.9	0	0	0	118
568	K	23	Very low	27.4	Very low	195 Å²	195	147.5 Å²	147.5	85%	0.848	80%	0.799	S	S	*	*			trans	29.1	110.7	148.5	-63.8	-176.5	177	-177.9	0	119.1
569	L	25.2	Very low	27.8	Very low	182 Å²	182	146.5 Å²	146.5	95%	0.953	80%	0.799	S	S	*	*			trans	-103.5	119	133.7	-134.6	83.3	0	0	0	107.6
570	D	24	Very low	27.6	Very low	144 Å²	144	145.7 Å²	145.7	77%	0.77	80%	0.796	S	S	*	*			trans	-161.5	131.8	132.9	-148.2	-12.3	0	0	0	111.3
571	S	27.8	Very low	27.3	Very low	121 Å²	121	147.7 Å²	147.7	85%	0.846	80%	0.797	S	S	*	*			trans	175	92.8	168.7	-81.4	0	0	0	0	108.9
572	S	28.9	Very low	27.2	Very low	103 Å²	103	142 Å²	142	72%	0.72	80%	0.796	S	S	*	*			trans	-61	162.1	170.8	62.7	0	0	0	0	112.8
573	M	27.3	Very low	27.2	Very low	158 Å²	158	142.1 Å²	142.1	78%	0.778	80%	0.797	S	S	*	*			cis	-168	158.6	-7.2	-118.1	-73.6	168.9	0	0	107.9
574	T	27.9	Very low	27.3	Very low	137 Å²	137	139.6 Å²	139.6	84%	0.84	79%	0.794	S	S	*	*			trans	-160.3	129.6	148.8	-9.2	0	0	0	0	111.4
575	Q	26.7	Very low	27.6	Very low	177 Å²	177	140 Å²	140	83%	0.827	80%	0.802	S	S	*	*			trans	-81.5	148.3	172.3	-66.7	-175.3	-4.1	0	0	110.6
576	V	25.2	Very low	28.3	Very low	146 Å²	146	139.1 Å²	139.1	89%	0.885	81%	0.805	S	S	*	*			trans	-78.2	130	-176.2	175.6	0	0	0	0	111.1
577	T	22.9	Very low	28.2	Very low	112 Å²	112	135.7 Å²	135.7	69%	0.687	81%	0.805	S	S	*	*			trans	-154.9	113.7	171.4	-66.8	0	0	0	0	111.7
578	I	30.1	Very low	28.2	Very low	149 Å²	149	141.5 Å²	141.5	76%	0.764	81%	0.811	S	S	*	*			trans	68	168.7	156.8	-76.1	170.4	0	0	0	113.7
579	P	36.3	Very low	28.4	Very low	98 Å²	98	136.6 Å²	136.6	64%	0.636	80%	0.801	S	S	*	*			cis	-132.4	159.8	5.1	20.2	5.4	0	0	0	119.5
580	N	25.8	Very low	28.7	Very low	152 Å²	152	139 Å²	139	81%	0.813	80%	0.798	S	S	*	*			trans	60.2	161.5	136.7	-65.5	-27.5	0	0	0	120.6
581	K	28.4	Very low	29.1	Very low	212 Å²	212	144.5 Å²	144.5	92%	0.922	81%	0.808	S	S	*	*			cis	-145.9	152.6	31.3	-59.5	164.4	-177	172	0	113.7
582	G	24.8	Very low	29	Very low	82 Å²	82	142.3 Å²	142.3	85%	0.845	80%	0.804	S	S	*	*			trans	171.7	95.4	167.7	0	0	0	0	0	112
583	S	27.7	Very low	29.5	Very low	108 Å²	108	145.9 Å²	145.9	76%	0.755	81%	0.807	S	S	*	*			trans	-98.2	145.5	-173.3	51.5	0	0	0	0	113.5
584	T	29.1	Very low	30.3	Very low	129 Å²	129	144.1 Å²	144.1	79%	0.791	81%	0.807	S	S	*	*				152.2	154.3	125.5	47	0	0	0	0	112.7
585	S	32.4	Very low	30.8	Very low	123 Å²	123	146 Å²	146	86%	0.86	80%	0.799	S	S	*	*			trans	-157.3	121.7	162.4	-78.8	0	0	0	0	110.2
586	P	42.3	Very low	31.3	Very low	125 Å²	125	145.8 Å²	145.8	81%	0.812	79%	0.792	S	S	*	*			trans	-136.3	162.5	158.8	38	-24.5	0	0	0	113.6
587	G	26.7	Very low	31.9	Very low	74 Å²	74	149.5 Å²	149.5	76%	0.763	79%	0.79	S	S	*	*			trans	106.6	71	143.3	0	0	0	0	0	120.3
588	R	29	Very low	32.6	Very low	245 Å²	245	153.5 Å²	153.5	93%	0.925	80%	0.798	S	S	*	*				25	128.3	129.3	-85.1	-178.7	167.3	-174.2	-2	120.8
589	S	28.9	Very low	32.8	Very low	91 Å²	91	150.9 Å²	150.9	64%	0.636	80%	0.798	S	S	*	*				92.1	109.5	115.9	-178.1	0	0	0	0	123.4
590	R	30.6	Very low	32.6	Very low	233 Å²	233	149.4 Å²	149.4	88%	0.879	80%	0.801	S	S	*	*				54	112.2	129.6	-55.1	172	172.9	178.5	-2.8	121.4
591	R	31.7	Very low	33	Very low	260 Å²	260	152.2 Å²	152.2	98%	0.981	81%	0.806	S	S	*	*				171.1	155.9	119.8	-96.7	171	171.3	-178.8	-2.6	109.4
592	G	26	Very low	33.1	Very low	74 Å²	74	145.1 Å²	145.1	76%	0.763	79%	0.793	S	S	*	*			cis	-174.3	153.8	-4.4	0	0	0	0	0	113.5
593	K	39.7	Very low	33.6	Very low	179 Å²	179	146.8 Å²	146.8	78%	0.778	79%	0.791	S	S	*	*			trans	-65.9	157.7	177.2	-66	166.9	175.2	167.1	0	112.1
594	P	44.6	Very low	34	Very low	121 Å²	121	146.5 Å²	146.5	79%	0.786	79%	0.79	S	S	*	*				-125	157	67.5	7.7	16.6	0	0	0	113.8
595	R	38.6	Very low	34.2	Very low	176 Å²	176	145.8 Å²	145.8	66%	0.664	79%	0.79	S	S	*	*			cis	71.2	138.9	45.5	-82.8	178.8	164.9	174.5	-6	113.9
596	Y	35.9	Very low	34.2	Very low	173 Å²	173	146.9 Å²	146.9	68%	0.678	79%	0.786	S	S	*	*			cis	-146.9	-174	7.9	-121.4	-40.5	0	0	0	108.7
597	R	37.7	Very low	33.5	Very low	224 Å²	224	149.1 Å²	149.1	85%	0.845	79%	0.79	S	S	*	*			cis	-160.2	177.9	15.5	-113.6	153.9	-178.2	171	-1.2	104.9
598	K	38.6	Very low	33.5	Very low	196 Å²	196	149.6 Å²	149.6	85%	0.852	79%	0.787	S	S	*	*			cis	-168.9	139.4	-5.6	158.2	-163.2	169.6	-169.6	0	104.6
599	A	34.7	Very low	33.3	Very low	93 Å²	93	146.3 Å²	146.3	77%	0.769	78%	0.782	S	S	*	*			cis	-117.7	-112.3	-10.2	0	0	0	0	0	109.7
600	G	30.8	Very low	33.3	Very low	68 Å²	68	148.9 Å²	148.9	70%	0.701	79%	0.788	S	S	*	*			cis	90	139.6	-9.1	0	0	0	0	0	116.1
601	K	34	Very low	33	Very low	210 Å²	210	147.8 Å²	147.8	91%	0.913	79%	0.79	S	S	*	*			cis	-84.4	-171.7	-6.9	-48.5	-176.6	179.2	179.8	0	111.2
602	G	30.9	Very low	32.8	Very low	63 Å²	63	139.1 Å²	139.1	65%	0.649	77%	0.773	S	S	*	*			cis	100.8	145	-8.1	0	0	0	0	0	116.4
603	S	36.5	Very low	33	Very low	117 Å²	117	141.6 Å²	141.6	82%	0.818	77%	0.774	S	S	*	*			cis	-167.1	136.7	-9.5	-153.7	0	0	0	0	113.2
604	S	35	Very low	32.4	Very low	103 Å²	103	140.6 Å²	140.6	72%	0.72	78%	0.776	S	S	*	*			trans	35.5	132.6	133.9	-158.9	0	0	0	0	122.9
605	S	34.4	Very low	31.6	Very low	113 Å²	113	139.1 Å²	139.1	79%	0.79	77%	0.769	S	S	*	*				170.3	167.4	101.1	64.9	0	0	0	0	114.5
606	D	31.1	Very low	31.1	Very low	147 Å²	147	135.7 Å²	135.7	79%	0.786	77%	0.772	S	S	*	*			trans	-97.4	169.4	-173.8	-51.1	-88.3	0	0	0	116.7
607	L	28	Very low	30.8	Very low	172 Å²	172	133 Å²	133	90%	0.901	78%	0.779	S	S	*	*			trans	80.8	140.3	142	-144	73	0	0	0	122.9
608	A	25.9	Very low	30.3	Very low	84 Å²	84	129.5 Å²	129.5	69%	0.694	78%	0.775	S	S	*	*			trans	68.4	114.2	151	0	0	0	0	0	124.1
609	Q	26.2	Very low	29.8	Very low	175 Å²	175	124.4 Å²	124.4	82%	0.818	77%	0.77	S	S	*	*				43	135.1	129.3	-83.3	-175.1	-19.9	0	0	125.4
610	L	27.5	Very low	29.6	Very low	145 Å²	145	127.8 Å²	127.8	76%	0.759	77%	0.772	S	S	*	*			trans	72.8	106.2	137.8	-72	167.7	0	0	0	122.2
611	K	25.4	Very low	29.5	Very low	211 Å²	211	130.5 Å²	130.5	92%	0.917	77%	0.769	S	S	*	*			trans	172.6	162.2	131.3	-95.1	158.5	-176.5	176	0	109.9
612	A	28.4	Very low	29.3	Very low	77 Å²	77	127.4 Å²	127.4	64%	0.636	76%	0.763	S	S	*	*			cis	-178.7	160.2	-41.5	0	0	0	0	0	109.1
613	T	29.3	Very low	29.1	Very low	126 Å²	126	127.8 Å²	127.8	77%	0.773	76%	0.76	S	S	*	*			trans	69.6	127.6	156	43.6	0	0	0	0	123.5
614	L	27.8	Very low	28.7	Very low	159 Å²	159	128.3 Å²	128.3	83%	0.832	76%	0.758	S	S	*	*			trans	77.5	140.9	139.3	-68.1	168.9	0	0	0	119.9
615	S	27.1	Very low	28.3	Very low	90 Å²	90	128.6 Å²	128.6	63%	0.629	76%	0.76	S	S	*	*			cis	-158.7	156.5	-2.3	-160.1	0	0	0	0	114.3
616	S	28.1	Very low	28	Very low	104 Å²	104	128.4 Å²	128.4	73%	0.727	76%	0.759	S	S	*	*			trans	62.6	132.3	155.4	-51.9	0	0	0	0	118.9
617	S	28.7	Very low	28.1	Very low	117 Å²	117	127.8 Å²	127.8	82%	0.818	76%	0.76	S	S	*	*			cis	-148.4	169.7	49.1	-64.2	0	0	0	0	115.6
618	L	28	Very low	28.6	Very low	149 Å²	149	124.7 Å²	124.7	78%	0.78	75%	0.75	S	S	*	*			trans	-66.5	153.3	172.4	-76.7	61.7	0	0	0	110.9
619	A	28.3	Very low	28.7	Very low	89 Å²	89	125.7 Å²	125.7	74%	0.736	75%	0.752	S	S	*	*			cis	87.5	154.1	28.1	0	0	0	0	0	115.6
620	M	29.7	Very low	28.8	Very low	164 Å²	164	121.9 Å²	121.9	81%	0.808	75%	0.745	S	S	*	*			trans	87.5	142.2	170.2	-65.1	-162.4	170.5	0	0	119.2
621	I	29.6	Very low	28.9	Very low	125 Å²	125	123.3 Å²	123.3	64%	0.641	75%	0.745	S	S	*	*			cis	-168	166.6	-19.4	-147.6	165.9	0	0	0	112
622	N	28.5	Very low	29.1	Very low	146 Å²	146	121.8 Å²	121.8	78%	0.781	74%	0.741	S	S	*	*			trans	67	158.3	159.8	-79.2	0.2	0	0	0	120.4
623	A	28.2	Very low	29.1	Very low	71 Å²	71	128.2 Å²	128.2	59%	0.587	75%	0.748	S	S	*	*			cis	-169.5	162.9	-16.1	0	0	0	0	0	112.8
624	T	26.6	Very low	29.1	Very low	128 Å²	128	129.3 Å²	129.3	79%	0.785	75%	0.749	S	S	*	*			trans	42.2	128.5	145.7	57.2	0	0	0	0	122.2
625	S	28.2	Very low	29.2	Very low	108 Å²	108	128.8 Å²	128.8	76%	0.755	75%	0.747	S	S	*	*				153.4	159.2	95.9	60.8	0	0	0	0	115.9
626	S	28	Very low	30	Very low	110 Å²	110	129.8 Å²	129.8	77%	0.769	75%	0.751	S	S	*	*			trans	72.5	127.1	155.8	72.4	0	0	0	0	120.7
627	V	33.1	Very low	30	Very low	133 Å²	133	130.7 Å²	130.7	81%	0.806	75%	0.753	S	S	*	*			trans	-121.1	143.1	161.8	169.9	0	0	0	0	106.7
628	P	37.9	Very low	30.1	Very low	107 Å²	107	129.7 Å²	129.7	70%	0.695	75%	0.751	S	S	*	*			trans	-122.5	135.2	133.3	37.7	-30.9	0	0	0	108.5
629	S	27.1	Very low	30.2	Very low	105 Å²	105	127.8 Å²	127.8	73%	0.734	76%	0.757	S	S	*	*				57.8	129.5	55.7	91.1	0	0	0	0	111.6
630	S	29.8	Very low	30.3	Very low	95 Å²	95	131 Å²	131	66%	0.664	76%	0.76	S	S	*	*			cis	-158.4	164.4	8.8	74.7	0	0	0	0	112.4
631	K	29.5	Very low	30.4	Very low	175 Å²	175	135 Å²	135	76%	0.761	77%	0.766	S	S	*	*			trans	29.8	128.9	145.4	-52	162.9	-178.3	176.9	0	118.8
632	H	29.4	Very low	30.3	Very low	180 Å²	180	132.8 Å²	132.8	83%	0.833	78%	0.775	S	S	*	*				-164	-168.5	92.1	-117.5	-88.3	0	0	0	112.7
633	R	28	Very low	30.4	Very low	211 Å²	211	133.6 Å²	133.6	80%	0.796	78%	0.778	S	S	*	*			trans	-138.6	155.7	-159.5	-159	-164.1	-167.2	-169.7	5.2	108.9
634	L	29.1	Very low	30.5	Very low	150 Å²	150	139.4 Å²	139.4	79%	0.785	79%	0.793	S	S	*	*			trans	82	120.6	163.7	-55.2	170.2	0	0	0	118.6
635	D	30.7	Very low	30.7	Very low	147 Å²	147	140.1 Å²	140.1	79%	0.786	79%	0.787	S	S	*	*			trans	-59.5	161.3	141.4	-112.3	-51.3	0	0	0	110.4
636	P	43.3	Very low	30.9	Very low	112 Å²	112	140.1 Å²	140.1	73%	0.727	78%	0.779	S	S	*	*				-152.4	163.7	52.5	41.2	-20	0	0	0	119.8
637	T	28.8	Very low	31	Very low	123 Å²	123	141.4 Å²	141.4	76%	0.755	78%	0.776	S	S	*	*			trans	53.4	104.7	138.1	-53.7	0	0	0	0	121.6
638	A	30.6	Very low	30.8	Very low	96 Å²	96	140.9 Å²	140.9	79%	0.793	77%	0.768	S	S	*	*			trans	39.7	126	135.5	0	0	0	0	0	122.9
639	A	29.4	Very low	30.4	Very low	108 Å²	108	142.7 Å²	142.7	89%	0.893	77%	0.771	S	S	*	*			trans	-147.3	136.8	151.3	0	0	0	0	0	112.5
640	I	31.5	Very low	30.4	Very low	156 Å²	156	146.3 Å²	146.3	80%	0.8	77%	0.774	S	S	*	*			trans	-100.2	134.8	-168.5	-53.6	160	0	0	0	112
641	R	30.9	Very low	30.2	Very low	248 Å²	248	150.1 Å²	150.1	94%	0.936	78%	0.778	S	S	*	*				171.5	145	129.8	-99.1	170.8	-83.4	-161.3	-4.4	114.3
642	G	28	Very low	29.9	Very low	80 Å²	80	149 Å²	149	83%	0.825	78%	0.777	S	S	*	*			trans	158.7	60.2	173.5	0	0	0	0	0	114.4
643	L	31.3	Very low	29.7	Very low	162 Å²	162	145.4 Å²	145.4	85%	0.848	77%	0.773	S	S	*	*			trans	-83	147	-179.8	-87.2	163.3	0	0	0	112.8
644	Q	29.5	Very low	29.5	Very low	194 Å²	194	141 Å²	141	91%	0.907	77%	0.774	S	S	*	*			trans	-138.2	107	149.6	-160.6	163.1	15.6	0	0	110.8
645	H	30.6	Very low	29.3	Very low	142 Å²	142	139.1 Å²	139.1	66%	0.657	77%	0.774	S	S	*	*			trans	-75	169.7	164.2	-109.1	-140.6	0	0	0	108.8
646	D	32.4	Very low	29.4	Very low	109 Å²	109	135.5 Å²	135.5	58%	0.583	76%	0.76	S	S	*	*			cis	-161.9	169.2	20.9	-138.1	-28	0	0	0	114
647	L	29.4	Very low	29.5	Very low	136 Å²	136	132.8 Å²	132.8	71%	0.712	74%	0.743	S	S	*	*			trans	30.4	162.8	138.9	-82.8	167.5	0	0	0	122.6
648	L	30.2	Very low	29.5	Very low	122 Å²	122	131.6 Å²	131.6	64%	0.639	73%	0.731	S	S	*	*			cis	-161.9	171.1	29.3	-135.6	178.9	0	0	0	111.7
649	L	28.9	Very low	29.5	Very low	146 Å²	146	132.1 Å²	132.1	76%	0.764	72%	0.721	S	S	*	*			trans	73.8	104.6	164.8	-59.9	173.2	0	0	0	117.6
650	K	27	Very low	29.3	Very low	180 Å²	180	134.4 Å²	134.4	78%	0.783	72%	0.716	S	S	*	*			cis	95.6	136.4	18	-160	-179.3	-177.8	171.6	0	115
651	K	25.6	Very low	29	Very low	176 Å²	176	131.8 Å²	131.8	77%	0.765	71%	0.711	S	S	*	*			trans	90	139.1	176.4	-59.4	177.8	166.1	-171.2	0	115.4
652	M	24.2	Very low	28.8	Very low	150 Å²	150	125.9 Å²	125.9	74%	0.739	70%	0.703	S	S	*	*			cis	-160.1	169.1	-16.4	-118.6	-172.5	-49.8	0	0	110.7
653	S	23.5	Very low	28.8	Very low	105 Å²	105	127.9 Å²	127.9	73%	0.734	70%	0.699	S	S	*	*			trans	7	152.6	150.3	-37.8	0	0	0	0	120.4
654	S	25.5	Very low	28.7	Very low	119 Å²	119	127.8 Å²	127.8	83%	0.832	70%	0.699	S	S	*	*			cis	-165.6	-166.9	41.3	57.6	0	0	0	0	114.5
655	S	25.2	Very low	28.7	Very low	111 Å²	111	127.5 Å²	127.5	78%	0.776	70%	0.698	S	S	*	*			trans	-93.5	172.5	-170.6	55.6	0	0	0	0	117.1
656	S	31	Very low	28.8	Very low	71 Å²	71	125 Å²	125	50%	0.497	70%	0.701	S	S	.	*			trans	-60.3	177.7	158.5	-40.1	0	0	0	0	113.4
657	P	46.8	Very low	28.7	Very low	55 Å²	55	125.9 Å²	125.9	36%	0.357	70%	0.702	S	S	.	*				-159.9	134.7	76.3	38.9	-16.2	0	0	0	120.6	A727 S728	P657-A727 CarbonylContact O-C 3.53Å; P657-A727 WeakPolarHBondContact O-CA 3.42Å; P657-A727 PolarHBondContact O-N 3.04Å; P657-S728 VanDerWaalsContact C-CA 3.42Å; P657-S728 CarbonylContact O-C 3.58Å; P657-S728 WeakPolarHBondContact O-CA 3.47Å; P657-S728 PolarHBondContact O-N 2.82Å
658	D	29.2	Very low	28.8	Very low	97 Å²	97	124.4 Å²	124.4	52%	0.519	70%	0.699	S	S	.	*			trans	81.6	-147.8	149.7	-51.4	-22.3	0	0	0	124.3	S728 I729	D658-S728 WeakPolarHBondContact O-CA 3.5Å; D658-I729 PolarHBondContact O-N 3.07Å
659	L	29.1	Very low	28.9	Very low	108 Å²	108	126.1 Å²	126.1	57%	0.565	70%	0.697	S	S	*	*			trans	-74.1	-176.8	-139.5	-46.5	105.5	0	0	0	117.6	A726 S728	L659-A726 HydrophobicContact CD1-CB 4.32Å; L659-S728 PolarHBondContact O-OG 2.98Å
660	I	26.7	Very low	29	Very low	156 Å²	156	128.7 Å²	128.7	80%	0.8	70%	0.696	S	S	*	*			cis	-142	151.2	16.5	-60	174.3	0	0	0	113.8
661	S	24.2	Very low	29.1	Very low	100 Å²	100	131.3 Å²	131.3	70%	0.699	70%	0.701	S	S	*	*			trans	-33.4	152.7	165.3	-177.6	0	0	0	0	120.8
662	T	27.5	Very low	29.2	Very low	125 Å²	125	126.3 Å²	126.3	77%	0.767	70%	0.7	S	S	*	*				-168.6	140.3	129.4	11.9	0	0	0	0	116
663	T	27.5	Very low	29.3	Very low	121 Å²	121	127.7 Å²	127.7	74%	0.742	70%	0.704	S	S	*	*			trans	43.3	138.9	152	53.7	0	0	0	0	122.9
664	L	29.2	Very low	29.4	Very low	161 Å²	161	129.7 Å²	129.7	84%	0.843	71%	0.706	S	S	*	*			cis	94	151.1	30.1	-82.3	173.1	0	0	0	117.8
665	E	29.9	Very low	29.3	Very low	188 Å²	188	135.1 Å²	135.1	88%	0.879	71%	0.708	S	S	*	*			trans	69.5	152.7	169.6	-69.2	-165.3	-175.2	0	0	117.7
666	A	30.9	Very low	30.2	Very low	89 Å²	89	136 Å²	136	74%	0.736	71%	0.711	S	S	*	*			cis	-136.9	-176.7	-0.4	0	0	0	0	0	109.1
667	E	30.9	Very low	29.9	Very low	127 Å²	127	135.9 Å²	135.9	59%	0.593	72%	0.721	S	S	*	*			cis	-155.9	158.5	8	94.7	139.4	173.5	0	0	107	R669	E667-R669 IonicContact OE1-CZ 3.37Å; E667-R669 IonicContact OE1-NH1 3.27Å; E667-R669 PolarHBondContact OE1-NH1 3.28Å; E667-R669 IonicContact OE1-NH2 3.92Å; E667-R669 PolarHBondContact OE1-NH2 3.3Å; E667-R669 IonicContact OE2-CZ 2.78Å; E667-R669 IonicContact OE2-NE 3.51Å; E667-R669 IonicContact OE2-NH1 3.58Å; E667-R669 IonicContact OE2-NH2 2.84Å; E667-R669 PolarHBondContact OE2-NH2 3.4Å
668	V	30.9	Very low	29.1	Very low	106 Å²	106	141 Å²	141	64%	0.642	74%	0.744	S	S	*	*			cis	179.9	-152.1	3.7	65.9	0	0	0	0	107.1
669	R	33.6	Very low	29.3	Very low	158 Å²	158	142.9 Å²	142.9	60%	0.596	75%	0.754	S	S	*	*			cis	-157.5	158.7	2.8	-114.4	154.1	-155.8	136.5	12.2	106.1	E667	E667-R669 IonicContact OE1-CZ 3.37Å; E667-R669 IonicContact OE1-NH1 3.27Å; E667-R669 PolarHBondContact OE1-NH1 3.28Å; E667-R669 IonicContact OE1-NH2 3.92Å; E667-R669 PolarHBondContact OE1-NH2 3.3Å; E667-R669 IonicContact OE2-CZ 2.78Å; E667-R669 IonicContact OE2-NE 3.51Å; E667-R669 IonicContact OE2-NH1 3.58Å; E667-R669 IonicContact OE2-NH2 2.84Å; E667-R669 PolarHBondContact OE2-NH2 3.4Å
670	R	30.7	Very low	29.4	Very low	199 Å²	199	149.4 Å²	149.4	75%	0.751	77%	0.772	S	S	*	*			cis	-155.7	152.9	-5.7	-147.8	171.2	-141.5	178.4	6.8	109.6
671	R	29.9	Very low	29.7	Very low	236 Å²	236	146.7 Å²	146.7	89%	0.891	77%	0.773	S	S	*	*			trans	-9.5	154.4	154.8	-53.2	172.5	179.2	-173.9	-3.6	118.1
672	G	27.2	Very low	30	Very low	71 Å²	71	145.2 Å²	145.2	73%	0.732	77%	0.773	S	S	*	*			cis	178.6	-168	7.9	0	0	0	0	0	108.8
673	Q	26.4	Very low	30.2	Very low	178 Å²	178	145.5 Å²	145.5	83%	0.832	78%	0.78	S	S	*	*			cis	-158.5	150.8	18.4	-71.7	172.5	-88.5	0	0	112.1
674	L	24.9	Very low	30.3	Very low	147 Å²	147	149.1 Å²	149.1	77%	0.77	79%	0.789	S	S	*	*			trans	38.5	125	134.1	-67.1	151.4	0	0	0	124.5
675	R	23.1	Very low	30.4	Very low	233 Å²	233	146.8 Å²	146.8	88%	0.879	79%	0.786	S	S	*	*				10.5	162.4	126.1	-74	-176.5	178.9	-173.4	-0.3	121.1
676	P	44.1	Very low	30.4	Very low	130 Å²	130	142.1 Å²	142.1	84%	0.844	78%	0.78	S	S	*	*			cis	-140.8	-177.3	-15.9	37.3	-16.5	0	0	0	116.5
677	G	24.8	Very low	30.5	Very low	68 Å²	68	143.1 Å²	143.1	70%	0.701	78%	0.781	S	S	*	*			trans	131.2	128.3	170.6	0	0	0	0	0	112.4
678	L	31.3	Very low	30.5	Very low	162 Å²	162	141.8 Å²	141.8	85%	0.848	79%	0.792	S	S	*	*				51.2	129.4	74	-92	69.5	0	0	0	113.7
679	D	33.1	Very low	30.6	Very low	137 Å²	137	139.7 Å²	139.7	73%	0.733	79%	0.792	S	S	*	*			cis	-151.5	163.7	26.8	-107.7	-44.1	0	0	0	115.6
680	R	31	Very low	30.6	Very low	245 Å²	245	139.1 Å²	139.1	93%	0.925	80%	0.8	S	S	*	*			trans	63.1	150.3	165.2	-73.1	178	162.6	161.7	-4.9	119.1
681	A	31.8	Very low	30.5	Very low	100 Å²	100	138.5 Å²	138.5	83%	0.826	81%	0.805	S	S	*	*			cis	-167.9	160.3	-18.9	0	0	0	0	0	108.3
682	G	31.3	Very low	30.4	Very low	69 Å²	69	133.2 Å²	133.2	71%	0.711	80%	0.795	S	S	*	*			cis	173.4	-173.6	-3.1	0	0	0	0	0	112.6
683	S	31.6	Very low	30.6	Very low	131 Å²	131	134.8 Å²	134.8	92%	0.916	79%	0.794	S	S	*	*			trans	83.4	150.1	170.6	-56.4	0	0	0	0	119.9
684	Q	29.7	Very low	30.7	Very low	197 Å²	197	129.4 Å²	129.4	92%	0.921	79%	0.787	S	S	*	*			trans	-151.5	139.8	-169.1	-62.4	173.2	-24.1	0	0	112.6
685	S	31	Very low	30.8	Very low	111 Å²	111	131.1 Å²	131.1	78%	0.776	79%	0.791	S	S	*	*			trans	173.2	133.1	154.8	52.2	0	0	0	0	107.9
686	A	30.8	Very low	31	Very low	91 Å²	91	125.8 Å²	125.8	75%	0.752	78%	0.784	S	S	*	*				66.3	129.9	53	0	0	0	0	0	111.7
687	S	32	Very low	30.2	Very low	110 Å²	110	128.7 Å²	128.7	77%	0.769	79%	0.787	S	S	*	*			cis	-159.7	163.6	13.9	-48.5	0	0	0	0	113
688	A	32	Very low	30.3	Very low	98 Å²	98	128.7 Å²	128.7	81%	0.81	79%	0.787	S	S	*	*			trans	53.4	164.8	136.2	0	0	0	0	0	121.5
689	G	32.8	Very low	31.1	Very low	62 Å²	62	125.9 Å²	125.9	64%	0.639	78%	0.778	S	S	*	*			cis	-149.4	164.9	2.9	0	0	0	0	0	111.7
690	L	32.5	Very low	30.9	Very low	147 Å²	147	129.8 Å²	129.8	77%	0.77	78%	0.783	S	S	*	*				75.7	147.7	74.3	-67	159.7	0	0	0	111.8
691	E	28.8	Very low	30.9	Very low	185 Å²	185	123.1 Å²	123.1	86%	0.864	77%	0.766	S	S	*	*			cis	-121.9	155.6	26.1	-73.4	158.2	170.6	0	0	112.1
692	D	28.4	Very low	30.9	Very low	125 Å²	125	127.7 Å²	127.7	67%	0.668	76%	0.762	S	S	*	*			cis	82.4	115.7	47.8	-140.1	63.3	0	0	0	112.6
693	S	30.8	Very low	30.8	Very low	104 Å²	104	132 Å²	132	73%	0.727	76%	0.763	S	S	*	*				62.1	142.4	96.6	118	0	0	0	0	115.4
694	G	27.9	Very low	30.8	Very low	66 Å²	66	131.6 Å²	131.6	68%	0.68	75%	0.751	S	S	*	*			cis	-176.1	-143.3	1.3	0	0	0	0	0	112.5
695	E	27.6	Very low	31	Very low	183 Å²	183	129.5 Å²	129.5	86%	0.855	75%	0.751	S	S	*	*			trans	76.3	131.9	157.6	-54.6	-154.7	117.2	0	0	124.5
696	T	27.9	Very low	30.9	Very low	120 Å²	120	127 Å²	127	74%	0.736	74%	0.742	S	S	*	*			trans	73.5	128.3	138.3	49.4	0	0	0	0	126.2
697	E	28.1	Very low	31.1	Very low	191 Å²	191	130.2 Å²	130.2	89%	0.893	75%	0.753	S	S	*	*			trans	66.2	156.5	144.9	-62.1	-157.1	158.3	0	0	122.9
698	G	25.5	Very low	31	Very low	69 Å²	69	128.6 Å²	128.6	71%	0.711	75%	0.753	S	S	*	*			trans	-96.3	-145.6	176	0	0	0	0	0	112.4
699	P	48.7	Very low	30.9	Very low	102 Å²	102	127 Å²	127	66%	0.662	75%	0.747	S	S	*	*			cis	-142.2	-164.2	21.1	40.7	-19.4	0	0	0	115.4
700	R	28.4	Very low	31.1	Very low	219 Å²	219	131.7 Å²	131.7	83%	0.826	76%	0.757	S	S	*	*			trans	76.2	153.9	162.6	-65.9	168	-159	169.3	8.4	116.7
701	D	30.6	Very low	31.3	Very low	106 Å²	106	131.4 Å²	131.4	57%	0.567	76%	0.756	S	S	*	*			cis	-150.1	147.5	2.6	-128.4	-45.5	0	0	0	111.2
702	R	31.7	Very low	31.6	Very low	196 Å²	196	129.3 Å²	129.3	74%	0.74	75%	0.75	S	S	*	*			trans	58.5	135.8	155.6	-68.4	151.9	-153.9	-136.8	-2	119.9
703	Q	30.3	Very low	32	Very low	158 Å²	158	128.8 Å²	128.8	74%	0.738	75%	0.752	S	S	*	*				65.2	136.5	54	-63.6	-172.5	-77.1	0	0	113.9
704	D	30.4	Very low	32.1	Very low	123 Å²	123	132.6 Å²	132.6	66%	0.658	76%	0.758	S	S	*	*			cis	-157.1	152.3	-7.1	-114.8	-34.6	0	0	0	110.2
705	V	33.9	Very low	32.5	Very low	153 Å²	153	135.5 Å²	135.5	93%	0.927	76%	0.763	S	S	*	*			trans	-135.2	102.1	161.4	-179.7	0	0	0	0	107.2
706	G	30.6	Very low	33.7	Very low	58 Å²	58	132.1 Å²	132.1	60%	0.598	76%	0.756	S	S	*	*			trans	-116.3	144.1	-166.3	0	0	0	0	0	115.1
707	V	34.2	Very low	34.9	Very low	160 Å²	160	132.2 Å²	132.2	97%	0.97	76%	0.759	S	S	*	*			trans	71.5	129.3	157.7	-167.6	0	0	0	0	116.3
708	G	29.1	Very low	35.1	Very low	75 Å²	75	133.9 Å²	133.9	77%	0.773	76%	0.757	S	S	*	*			cis	161.6	178.4	-4.9	0	0	0	0	0	112.7
709	G	30.6	Very low	35.5	Very low	66 Å²	66	134.8 Å²	134.8	68%	0.68	75%	0.753	S	S	*	*			trans	123.7	88.8	168.9	0	0	0	0	0	116.1
710	D	37.7	Very low	34.7	Very low	160 Å²	160	136.5 Å²	136.5	86%	0.856	76%	0.756	S	S	*	*				33	148.2	128.5	-38.1	-32.8	0	0	0	120.2
711	D	36.5	Very low	34.7	Very low	140 Å²	140	132.5 Å²	132.5	75%	0.749	76%	0.756	S	S	*	*			cis	-163.2	173.1	26.7	-154.8	-8.9	0	0	0	113.8
712	L	35.2	Very low	35.5	Very low	141 Å²	141	133.5 Å²	133.5	74%	0.738	77%	0.768	S	S	*	*			trans	81.5	111.5	154.8	-68.5	167.5	0	0	0	124
713	V	36.7	Very low	35.5	Very low	115 Å²	115	129.3 Å²	129.3	70%	0.697	77%	0.769	S	S	*	*			trans	93.7	98.6	135.7	-178.1	0	0	0	0	121.9
714	E	32.4	Very low	35.6	Very low	183 Å²	183	131 Å²	131	86%	0.855	78%	0.777	S	S	*	*			trans	63.8	165.6	137.9	-62.4	-162	120.1	0	0	123.2
715	T	36	Very low	35.6	Very low	128 Å²	128	132.5 Å²	132.5	79%	0.785	79%	0.785	S	S	*	*			trans	-149.3	-150.7	-145.8	51.5	0	0	0	0	112.1
716	P	53.1	Low	35.5	Very low	111 Å²	111	128.4 Å²	128.4	72%	0.721	77%	0.768	S	S	*	*				-117.9	-151.2	-87.4	39.9	-20.5	0	0	0	110.2
717	P	53.6	Low	35.7	Very low	122 Å²	122	128 Å²	128	79%	0.792	76%	0.759	S	S	*	*			cis	-134.1	-168.2	-5.1	41.8	-21.6	0	0	0	116.5
718	R	32.6	Very low	35.6	Very low	226 Å²	226	123.8 Å²	123.8	85%	0.853	74%	0.736	S	S	*	*			trans	-85.8	172.7	-169.2	-54.9	165.9	165.8	174.2	-7.2	115.1
719	S	32.5	Very low	35.7	Very low	89 Å²	89	124.9 Å²	124.9	62%	0.622	72%	0.723	S	S	*	*				79	123.8	127.8	57.7	0	0	0	0	123.7
720	D	31.7	Very low	37.2	Very low	138 Å²	138	126.3 Å²	126.3	74%	0.738	72%	0.721	S	S	*	*				87.1	118.9	124.3	-61.2	-4.7	0	0	0	124.2
721	T	30.3	Very low	37.1	Very low	134 Å²	134	128 Å²	128	82%	0.822	72%	0.721	S	S	*	*			trans	69.8	166.6	144.5	63.7	0	0	0	0	120
722	P	45.9	Very low	36.9	Very low	127 Å²	127	126.5 Å²	126.5	83%	0.825	72%	0.721	S	S	*	*			cis	-123.5	-150.3	-29.6	26.4	-3.3	0	0	0	112.3
723	S	31.9	Very low	36.6	Very low	108 Å²	108	125.2 Å²	125.2	76%	0.755	72%	0.724	S	S	*	*			trans	-100.4	152.5	-167.9	54.7	0	0	0	0	116.9
724	E	32.5	Very low	36.2	Very low	193 Å²	193	125 Å²	125	90%	0.902	73%	0.728	S	S	*	*			trans	-168.3	171.9	143.2	-111.5	167.6	-163.2	0	0	113.7
725	D	31.4	Very low	37.5	Very low	155 Å²	155	121.4 Å²	121.4	83%	0.829	72%	0.72	S	S	*	*			trans	-64.4	157.9	-154.7	-63.3	-35.2	0	0	0	123.9
726	A	31.6	Very low	37.3	Very low	68 Å²	68	122.6 Å²	122.6	56%	0.562	72%	0.722	S	S	*	*			trans	69.4	148.2	137.3	0	0	0	0	0	125.9	L659	L659-A726 HydrophobicContact CD1-CB 4.32Å
727	A	35	Very low	36.2	Very low	49 Å²	49	122 Å²	122	41%	0.405	72%	0.72	S	S	.	*				108.1	113.4	122.8	0	0	0	0	0	120.8	P657	P657-A727 CarbonylContact O-C 3.53Å; P657-A727 WeakPolarHBondContact O-CA 3.42Å; P657-A727 PolarHBondContact O-N 3.04Å
728	S	31.5	Very low	36.2	Very low	72 Å²	72	121.7 Å²	121.7	50%	0.503	72%	0.718	S	S	.	*			cis	-137	172.3	-15.1	-75.1	0	0	0	0	110.7	P657 D658 L659	P657-S728 VanDerWaalsContact C-CA 3.42Å; P657-S728 CarbonylContact O-C 3.58Å; P657-S728 WeakPolarHBondContact O-CA 3.47Å; P657-S728 PolarHBondContact O-N 2.82Å; D658-S728 WeakPolarHBondContact O-CA 3.5Å; L659-S728 PolarHBondContact O-OG 2.98Å
729	I	31.6	Very low	36.1	Very low	97 Å²	97	117 Å²	117	50%	0.497	72%	0.719	S	S	.	*			trans	-85.1	-168.6	173.2	-27	177.8	0	0	0	113.2	D658	D658-I729 PolarHBondContact O-N 3.07Å
730	P	62.1	Low	35.9	Very low	97 Å²	97	116.7 Å²	116.7	63%	0.63	73%	0.73	S	S	*	*				-105.4	-171.8	-124.2	42.8	-26.2	0	0	0	115.1
731	F	34.7	Very low	35.7	Very low	195 Å²	195	122.7 Å²	122.7	86%	0.855	74%	0.742	S	S	*	*				175.7	170.6	121.8	-112.7	-80.9	0	0	0	116.8
732	S	32.3	Very low	35.5	Very low	109 Å²	109	120.1 Å²	120.1	76%	0.762	74%	0.742	S	S	*	*			trans	103.6	146	161.2	80.7	0	0	0	0	115.8
733	S	28.9	Very low	34.5	Very low	114 Å²	114	118.9 Å²	118.9	80%	0.797	74%	0.742	S	S	*	*			cis	-148	164.1	30	54.1	0	0	0	0	117.5
734	S	28.9	Very low	34.2	Very low	110 Å²	110	118.3 Å²	118.3	77%	0.769	75%	0.745	S	S	*	*			trans	-68	-160.3	172.1	-25.4	0	0	0	0	112.9
735	P	59.3	Low	33.9	Very low	107 Å²	107	114.1 Å²	114.1	70%	0.695	74%	0.743	S	S	*	*			cis	-125.6	-173	7.8	37.6	-14.3	0	0	0	113.1
736	D	31.7	Very low	33.5	Very low	154 Å²	154	110.1 Å²	110.1	82%	0.824	74%	0.738	S	S	*	*			cis	-162.8	-178.6	43.9	-131.2	-37.1	0	0	0	116.6
737	S	31.2	Very low	33.3	Very low	98 Å²	98	119 Å²	119	69%	0.685	76%	0.757	S	S	*	*			trans	-120.3	-167.6	-169.3	-125.8	0	0	0	0	112.7
738	P	52.9	Low	32.7	Very low	116 Å²	116	120.5 Å²	120.5	75%	0.753	77%	0.77	S	S	*	*			cis	-141.4	157.1	18.5	41.9	-21.2	0	0	0	120.6
739	C	29.2	Very low	32.4	Very low	127 Å²	127	122.8 Å²	122.8	86%	0.858	79%	0.785	S	S	*	*			trans	23.2	134.8	139.6	-56	0	0	0	0	124
740	G	28.7	Very low	32.2	Very low	83 Å²	83	124 Å²	124	86%	0.856	80%	0.797	S	S	*	*			trans	-163.6	114.4	158.8	0	0	0	0	0	114.5
741	R	27.8	Very low	30.6	Very low	263 Å²	263	127.4 Å²	127.4	99%	0.992	81%	0.809	S	S	*	*			trans	-81.5	151.7	-169.9	-57.8	174.4	179.3	-172.7	-1.3	114.4
742	G	25.7	Very low	30.2	Very low	80 Å²	80	121.6 Å²	121.6	83%	0.825	80%	0.804	S	S	*	*			trans	-165.5	160.3	168.3	0	0	0	0	0	112.2
743	A	26.7	Very low	29.8	Very low	101 Å²	101	124.2 Å²	124.2	84%	0.835	81%	0.81	S	S	*	*			trans	-145.3	154.6	-167.4	0	0	0	0	0	116.5
744	A	25.6	Very low	29.7	Very low	97 Å²	97	123 Å²	123	80%	0.802	81%	0.807	S	S	*	*			trans	53.1	125.4	147.1	0	0	0	0	0	122.9
745	A	25.3	Very low	29.5	Very low	104 Å²	104	129.1 Å²	129.1	86%	0.86	81%	0.813	S	S	*	*			trans	65.4	102.8	134.6	0	0	0	0	0	122
746	G	23.6	Very low	27.7	Very low	71 Å²	71	130.1 Å²	130.1	73%	0.732	82%	0.817	S	S	*	*				108.5	139.6	105.6	0	0	0	0	0	119.8
747	R	25.6	Very low	27.3	Very low	254 Å²	254	127.4 Å²	127.4	96%	0.958	81%	0.81	S	S	*	*			trans	68.4	151.2	169.4	-63.2	177	170.1	-176.3	-3.8	116.4
748	A	24.2	Very low	27.2	Very low	82 Å²	82	131.4 Å²	131.4	68%	0.678	82%	0.817	S	S	*	*			cis	-167.2	163.5	-23.3	0	0	0	0	0	109.7
749	S	25.3	Very low	25.9	Very low	119 Å²	119	133.2 Å²	133.2	83%	0.832	82%	0.816	S	S	*	*			trans	68.3	156.1	-179.8	81.2	0	0	0	0	114.3
750	V	27	Very low	25.8	Very low	123 Å²	123	133.3 Å²	133.3	75%	0.745	81%	0.812	S	S	*	*			cis	-125.2	148.4	15	173.7	0	0	0	0	112.6
751	L	27.7	Very low	25.8	Very low	168 Å²	168	136.7 Å²	136.7	88%	0.88	81%	0.806	S	S	*	*			trans	-9.2	122.7	166.5	-66.5	157.5	0	0	0	118.4
752	G	25.7	Very low	25.8	Very low	73 Å²	73	129.6 Å²	129.6	75%	0.753	79%	0.787	S	S	*	*			trans	-107.8	112.7	156	0	0	0	0	0	111.5
753	N	24.8	Very low	26	Very low	164 Å²	164	132.5 Å²	132.5	88%	0.877	78%	0.777	S	S	*	*			trans	-172.2	137.9	144.6	-110.4	-12.5	0	0	0	113.3
754	A	27.7	Very low	26.3	Very low	89 Å²	89	134.5 Å²	134.5	74%	0.736	77%	0.769	S	S	*	*			trans	36.8	98.3	153.8	0	0	0	0	0	120.4
755	R	23.9	Very low	26.5	Very low	239 Å²	239	138.8 Å²	138.8	90%	0.902	77%	0.773	S	S	*	*			trans	-134	138.4	139.8	-73	-169	175.3	167	-1.4	108.4
756	V	22.1	Very low	26.6	Very low	128 Å²	128	136.6 Å²	136.6	78%	0.776	76%	0.76	S	S	*	*			cis	95.6	136.7	32.2	172	0	0	0	0	112.8
757	S	21.8	Very low	26.8	Very low	96 Å²	96	139.2 Å²	139.2	67%	0.671	76%	0.762	S	S	*	*			trans	80.6	116	169.5	-72.9	0	0	0	0	120.5
758	H	29.1	Very low	26.8	Very low	183 Å²	183	133 Å²	133	85%	0.847	75%	0.752	S	S	*	*			trans	-61.3	156.6	135.4	-106	-106	0	0	0	110.6
759	E	27.1	Very low	26.9	Very low	154 Å²	154	136.8 Å²	136.8	72%	0.72	76%	0.759	S	S	*	*			trans	-174.7	149.3	137.2	-96.7	134.8	-146.2	0	0	106	E761	E759-E761 HydrophobicContact CG-CG 4.3Å
760	V	26.5	Very low	26.9	Very low	128 Å²	128	136.2 Å²	136.2	78%	0.776	75%	0.751	S	S	*	*			cis	-127.1	122	46.3	177.5	0	0	0	0	108.4
761	E	28.9	Very low	26.8	Very low	155 Å²	155	141.4 Å²	141.4	72%	0.724	76%	0.757	S	S	*	*				59.6	132.3	89.5	-65.8	-171.8	127.7	0	0	114.4	E759	E759-E761 HydrophobicContact CG-CG 4.3Å
762	D	28.4	Very low	26.6	Very low	113 Å²	113	138.5 Å²	138.5	60%	0.604	75%	0.751	S	S	*	*			cis	-152.7	-157.5	1.6	-162.3	15.6	0	0	0	108
763	K	28.7	Very low	27.6	Very low	141 Å²	141	140 Å²	140	61%	0.613	75%	0.747	S	S	*	*			cis	-168.3	148.7	3.3	-170.1	167.7	-99.5	-36.3	0	106.6
764	E	34.2	Very low	27.7	Very low	143 Å²	143	143.1 Å²	143.1	67%	0.668	75%	0.747	S	S	*	*			cis	-158.6	-179.9	-14.7	-110.4	160.1	173.2	0	0	105.4
765	E	28.9	Very low	27.7	Very low	188 Å²	188	143.4 Å²	143.4	88%	0.879	74%	0.744	S	S	*	*			cis	-109.5	-123.2	-2.1	-59	174.8	48.1	0	0	109.7
766	G	28.3	Very low	28.1	Very low	58 Å²	58	141.1 Å²	141.1	60%	0.598	74%	0.743	S	S	*	*			cis	179.3	94.3	-3.6	0	0	0	0	0	114.7
767	T	26.9	Very low	28.6	Very low	126 Å²	126	146.9 Å²	146.9	77%	0.773	75%	0.751	S	S	*	*			trans	44.7	92.1	154.9	-47	0	0	0	0	117.7
768	V	26.4	Very low	29.2	Very low	124 Å²	124	154 Å²	154	75%	0.752	76%	0.763	S	S	*	*				63.1	120	88.2	179.2	0	0	0	0	113
769	I	26.4	Very low	29.6	Very low	160 Å²	160	152.7 Å²	152.7	82%	0.821	76%	0.761	S	S	*	*				-148.5	150.7	88.1	-84.3	172.9	0	0	0	113.2
770	T	24.6	Very low	30.6	Very low	107 Å²	107	150.1 Å²	150.1	66%	0.656	76%	0.756	S	S	*	*			trans	-53.5	171.2	177.5	64.9	0	0	0	0	116.4
771	R	24.8	Very low	31.1	Very low	233 Å²	233	149.2 Å²	149.2	88%	0.879	75%	0.753	S	S	*	*			cis	-167.8	168.1	32.6	-142.9	158.4	-168	178.9	4.7	112.4
772	S	24	Very low	31.7	Very low	107 Å²	107	145.4 Å²	145.4	75%	0.748	75%	0.748	S	S	*	*			trans	-137.2	-175.8	172.4	-153.7	0	0	0	0	108.3
773	P	46.9	Very low	32.5	Very low	103 Å²	103	141.9 Å²	141.9	67%	0.669	74%	0.735	S	S	*	*			cis	-131.9	-177.8	-13.8	25.7	-1.8	0	0	0	114
774	R	27.1	Very low	33.2	Very low	230 Å²	230	141.7 Å²	141.7	87%	0.868	74%	0.739	S	S	*	*				149.3	120.7	123.1	-83.8	-171.2	169.9	171.3	-2.5	117.8
775	S	27.4	Very low	33.6	Very low	96 Å²	96	141.5 Å²	141.5	67%	0.671	74%	0.742	S	S	*	*			trans	39.2	125.9	136.5	64.7	0	0	0	0	124
776	Q	32.4	Very low	34.1	Very low	190 Å²	190	141.3 Å²	141.3	89%	0.888	74%	0.735	S	S	*	*			trans	66.2	116.4	140.4	-64.7	-177.4	8.7	0	0	121.2
777	R	31	Very low	34.6	Very low	249 Å²	249	148.5 Å²	148.5	94%	0.94	74%	0.744	S	S	*	*				-153.4	155.1	128.8	-112.4	172.8	-174.1	-161.2	-0.4	111
778	R	35.9	Very low	35.2	Very low	246 Å²	246	145.7 Å²	145.7	93%	0.928	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-77	146.8	178.9	-57.9	-178.2	-173.8	-141.9	2.1	110.2
779	L	36.9	Very low	36	Very low	156 Å²	156	143 Å²	143	82%	0.817	72%	0.724	S	S	*	*	P	Polyproline II helix	trans	-99.4	142.1	171.3	-72.3	167.8	0	0	0	110.4	A783	L779-A783 HydrophobicContact CB-CB 4.2Å; L779-A783 HydrophobicContact CD2-CB 4.03Å
780	T	47.8	Very low	36.6	Very low	99 Å²	99	140.4 Å²	140.4	61%	0.607	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-88.7	161.9	178.4	50.1	0	0	0	0	111.6	A782 A783	T780-A782 PolarHBondContact O-N 2.9Å; T780-A782 VanDerWaalsContact O-N 3.07Å; T780-A783 WeakPolarHBondContact O-CB 3.17Å; T780-A783 PolarHBondContact O-N 3.43Å
781	P	38.2	Very low	37.1	Very low	109 Å²	109	141.5 Å²	141.5	71%	0.708	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.1	-32.3	-174.6	-30.2	37	0	0	0	115.4	A783 L784	P781-A783 PolarHBondContact O-N 2.9Å; P781-L784 PolarHBondContact O-N 3.17Å
782	A	41.2	Very low	37.7	Very low	75 Å²	75	141.5 Å²	141.5	62%	0.62	72%	0.723	S	S	*	*	H	α-helix	trans	-59.5	-28.1	176.8	0	0	0	0	0	113.8	T780 L784	T780-A782 PolarHBondContact O-N 2.9Å; T780-A782 VanDerWaalsContact O-N 3.07Å; A782-L784 VanDerWaalsContact C-N 3.32Å; A782-L784 PolarHBondContact O-N 2.69Å
783	A	43.9	Very low	38	Very low	39 Å²	39	141.5 Å²	141.5	32%	0.322	72%	0.723	S	S	.	*	H	α-helix	trans	-73.6	-19.4	-177.7	0	0	0	0	0	114	L779 T780 P781	L779-A783 HydrophobicContact CB-CB 4.2Å; L779-A783 HydrophobicContact CD2-CB 4.03Å; T780-A783 WeakPolarHBondContact O-CB 3.17Å; T780-A783 PolarHBondContact O-N 3.43Å; P781-A783 PolarHBondContact O-N 2.9Å
784	L	43.9	Very low	37.2	Very low	137 Å²	137	144.4 Å²	144.4	72%	0.717	73%	0.727	S	S	*	*	H	α-helix	trans	-80	-40.2	177.4	-74.3	169.7	0	0	0	112	P781 A782 Y786 R787 A788	P781-L784 PolarHBondContact O-N 3.17Å; A782-L784 VanDerWaalsContact C-N 3.32Å; A782-L784 PolarHBondContact O-N 2.69Å; L784-Y786 VanDerWaalsContact C-N 3.33Å; L784-Y786 PolarHBondContact O-N 3Å; L784-R787 PolarHBondContact O-N 3.19Å; L784-A788 PolarHBondContact O-N 3.04Å
785	L	43.5	Very low	37.2	Very low	139 Å²	139	144 Å²	144	73%	0.728	73%	0.725	S	S	*	*	H	α-helix	trans	-62.3	-38.4	179.5	-73.1	167.9	0	0	0	112.3	R787 A788 A789	L785-R787 VanDerWaalsContact C-N 3.27Å; L785-R787 PolarHBondContact O-N 2.66Å; L785-A788 PolarHBondContact O-N 3.4Å; L785-A789 PolarHBondContact O-N 2.92Å
786	Y	39.4	Very low	37.4	Very low	185 Å²	185	151.8 Å²	151.8	73%	0.725	74%	0.74	S	S	*	*	H	α-helix	trans	-64	-31.4	178	-157.5	-95.8	0	0	0	112.7	L784	L784-Y786 VanDerWaalsContact C-N 3.33Å; L784-Y786 PolarHBondContact O-N 3Å
787	R	38.8	Very low	37.4	Very low	208 Å²	208	145.9 Å²	145.9	79%	0.785	73%	0.73	S	S	*	*	H	α-helix	trans	-75.5	-25.8	179.8	-161.1	171.5	-173.5	169.8	1.8	113.1	L784 L785	L784-R787 PolarHBondContact O-N 3.19Å; L785-R787 VanDerWaalsContact C-N 3.27Å; L785-R787 PolarHBondContact O-N 2.66Å
788	A	39.4	Very low	37.4	Very low	68 Å²	68	142.3 Å²	142.3	56%	0.562	73%	0.729	S	S	*	*	H	α-helix	trans	-77.9	-24.8	175.4	0	0	0	0	0	113.4	L784 L785	L784-A788 PolarHBondContact O-N 3.04Å; L785-A788 PolarHBondContact O-N 3.4Å
789	A	41.6	Very low	37.2	Very low	67 Å²	67	134.9 Å²	134.9	55%	0.554	72%	0.715	S	S	*	*	H	α-helix	trans	-73.1	-30	-179.8	0	0	0	0	0	113.6	L785 T791	L785-A789 PolarHBondContact O-N 2.92Å; A789-T791 PolarHBondContact O-N 3.4Å
790	V	40.1	Very low	36.9	Very low	106 Å²	106	132.5 Å²	132.5	64%	0.642	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-74.8	-22.6	-170.1	175.7	0	0	0	0	113.4	R792	V790-R792 VanDerWaalsContact C-N 3.32Å; V790-R792 PolarHBondContact O-N 2.89Å
791	T	35.9	Very low	36.1	Very low	129 Å²	129	136.9 Å²	136.9	79%	0.791	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-86.1	5.9	-179.8	51.4	0	0	0	0	114.5	A789	A789-T791 PolarHBondContact O-N 3.4Å
792	R	35.7	Very low	36.1	Very low	234 Å²	234	141.2 Å²	141.2	88%	0.883	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-116.3	17.3	-173.5	-137.4	179	-166	-174.3	4.3	115.5	V790	V790-R792 VanDerWaalsContact C-N 3.32Å; V790-R792 PolarHBondContact O-N 2.89Å
793	S	31.7	Very low	35.5	Very low	107 Å²	107	147 Å²	147	75%	0.748	75%	0.75	S	S	*	*			trans	-145.9	83.2	178.9	-162.1	0	0	0	0	114.8
794	Q	29.7	Very low	35.2	Very low	163 Å²	163	154.7 Å²	154.7	76%	0.762	78%	0.779	S	S	*	*			trans	-166.7	126.7	153	-102.9	-166.5	88.4	0	0	106.9
795	R	28	Very low	34.5	Very low	221 Å²	221	152 Å²	152	83%	0.834	78%	0.784	S	S	*	*			cis	-138.7	161.3	0.6	-70	-177.1	178.2	-163.8	-3.4	111.7
796	R	31.6	Very low	33.9	Very low	260 Å²	260	154.4 Å²	154.4	98%	0.981	79%	0.792	S	S	*	*			trans	-97.6	166.2	167.5	-83.4	-179.9	167.2	-178.4	-5.2	111.7
797	G	30.9	Very low	33.6	Very low	66 Å²	66	151.3 Å²	151.3	68%	0.68	79%	0.792	S	S	*	*			trans	134.5	137.9	156	0	0	0	0	0	112.5
798	L	31.1	Very low	33.1	Very low	175 Å²	175	148.7 Å²	148.7	92%	0.916	79%	0.794	S	S	*	*			cis	-156.2	164.6	1.4	-72.2	174.4	0	0	0	108
799	S	31.2	Very low	32.9	Very low	89 Å²	89	150.2 Å²	150.2	62%	0.622	80%	0.8	S	S	*	*			cis	-177.5	145.4	-23.6	176.6	0	0	0	0	108.9
800	S	31.9	Very low	32.4	Very low	106 Å²	106	155.9 Å²	155.9	74%	0.741	82%	0.815	S	S	*	*			trans	60	161.6	162.2	46.2	0	0	0	0	116.3
801	E	30.2	Very low	32	Very low	192 Å²	192	158 Å²	158	90%	0.897	83%	0.828	S	S	*	*			cis	-125.2	-168.3	10.9	-69.7	174.8	124.7	0	0	112.2
802	E	37.5	Very low	31.6	Very low	200 Å²	200	160.4 Å²	160.4	94%	0.935	83%	0.83	S	S	*	*			trans	-103.6	137	-178.2	-59.3	172.4	135.3	0	0	111.7
803	E	30.5	Very low	31.4	Very low	196 Å²	196	157.2 Å²	157.2	92%	0.916	83%	0.83	S	S	*	*			trans	-153.9	138.1	161.2	-165.5	165.4	-154.1	0	0	110.3
804	E	36.6	Very low	31.5	Very low	200 Å²	200	157.8 Å²	157.8	94%	0.935	83%	0.831	S	S	*	*			trans	-90.2	135.4	172.3	-67.4	-170.2	135.5	0	0	110.2
805	G	29.7	Very low	31.6	Very low	81 Å²	81	161.9 Å²	161.9	84%	0.835	84%	0.84	S	S	*	*			trans	-137.2	121.4	-179.2	0	0	0	0	0	112.5
806	E	29.6	Very low	31.7	Very low	190 Å²	190	163.2 Å²	163.2	89%	0.888	85%	0.845	S	S	*	*			trans	-97.8	175	-179.6	-164.2	179.5	-162	0	0	111.5
807	V	34	Very low	31.6	Very low	120 Å²	120	162.4 Å²	162.4	73%	0.727	84%	0.842	S	S	*	*			trans	83.7	84.5	164.8	-164.8	0	0	0	0	117.6
808	D	29	Very low	31.5	Very low	153 Å²	153	169.7 Å²	169.7	82%	0.818	85%	0.849	S	S	*	*				51	143.1	114.1	-102	-10.9	0	0	0	124.7
809	S	35.3	Very low	31.5	Very low	100 Å²	100	167.6 Å²	167.6	70%	0.699	85%	0.845	S	S	*	*			trans	94.3	132.4	143.9	-67.2	0	0	0	0	123
810	E	31.2	Very low	31.5	Very low	186 Å²	186	169.1 Å²	169.1	87%	0.869	85%	0.851	S	S	*	*			trans	55.9	99.3	154.1	-62.1	-169.6	149.2	0	0	121.5
811	V	29.7	Very low	31.2	Very low	151 Å²	151	168.4 Å²	168.4	92%	0.915	85%	0.846	S	S	*	*			trans	-131	136.4	132.9	179.3	0	0	0	0	109.7
812	E	29.4	Very low	31.4	Very low	179 Å²	179	167.1 Å²	167.1	84%	0.836	84%	0.843	S	S	*	*			trans	-80.6	140.4	-171.5	-171.8	177.9	-164	0	0	113.5
813	L	31	Very low	31	Very low	166 Å²	166	163.2 Å²	163.2	87%	0.869	84%	0.838	S	S	*	*			trans	-110.5	108.3	176.1	-83.1	174.4	0	0	0	112.2
814	P	33.5	Very low	30.9	Very low	120 Å²	120	163.6 Å²	163.6	78%	0.779	84%	0.836	S	S	*	*			trans	-73.8	129.7	-179.5	28.2	-33.9	0	0	0	112.7
815	R	31.6	Very low	30.6	Very low	249 Å²	249	160 Å²	160	94%	0.94	83%	0.832	S	S	*	*			trans	-70.7	129.3	177.3	-69.1	171.3	164.8	143	-7.1	112.4
816	R	30.5	Very low	30.4	Very low	249 Å²	249	165.8 Å²	165.8	94%	0.94	84%	0.837	S	S	*	*			trans	-132.2	163	149.4	-86.1	-162.6	169.9	-159.6	-2.7	112
817	R	29.5	Very low	30.5	Very low	243 Å²	243	161.6 Å²	161.6	92%	0.917	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-96	153.8	-154.2	-64.5	-179	173.4	-166.8	-1.6	114.5
818	R	28.5	Very low	30.1	Very low	219 Å²	219	164.1 Å²	164.1	83%	0.826	84%	0.838	S	S	*	*	P	Polyproline II helix	trans	-72.3	157.8	159.8	-64.6	-178.8	179.6	169.3	-1.7	111.5	V820	R818-V820 HydrophobicContact CB-CG2 4.31Å
819	P	31.1	Very low	30.1	Very low	130 Å²	130	161.1 Å²	161.1	84%	0.844	83%	0.829	S	S	*	*	P	Polyproline II helix		-100	163.2	128.3	-16.7	33	0	0	0	112.6
820	V	30.2	Very low	29.7	Very low	122 Å²	122	163.8 Å²	163.8	74%	0.739	84%	0.835	S	S	*	*			trans	-129.7	167	179.9	177.7	0	0	0	0	109.7	R818	R818-V820 HydrophobicContact CB-CG2 4.31Å
821	S	27.4	Very low	29.4	Very low	91 Å²	91	164 Å²	164	64%	0.636	83%	0.834	S	S	*	*			trans	-96.4	152.4	-155.6	55.9	0	0	0	0	117.8
822	I	33.4	Very low	29.3	Very low	165 Å²	165	159.8 Å²	159.8	85%	0.846	81%	0.811	S	S	*	*				29.1	117.1	129.4	-47.6	168.9	0	0	0	118.8
823	S	28.8	Very low	29.5	Very low	117 Å²	117	158.4 Å²	158.4	82%	0.818	81%	0.809	S	S	*	*			trans	179.5	151.9	141.4	53.7	0	0	0	0	109.6
824	K	28.2	Very low	29.3	Very low	204 Å²	204	158.6 Å²	158.6	89%	0.887	81%	0.805	S	S	*	*			cis	-154.6	166.8	-27.1	-165.1	176	-179.7	-174.1	0	106.8
825	C	30.6	Very low	29.2	Very low	125 Å²	125	159.7 Å²	159.7	85%	0.845	80%	0.804	S	S	*	*			trans	-70.1	149.1	-168.8	-45	0	0	0	0	115.9
826	Q	26.1	Very low	29	Very low	202 Å²	202	156.3 Å²	156.3	94%	0.944	80%	0.804	S	S	*	*			trans	-150	167	140.6	-117.6	172.2	3.5	0	0	110.3
827	S	30.8	Very low	28.8	Very low	103 Å²	103	149 Å²	149	72%	0.72	79%	0.791	S	S	*	*			trans	-114.5	142.8	-158.8	52.6	0	0	0	0	114.2
828	L	26.2	Very low	28.7	Very low	172 Å²	172	144.2 Å²	144.2	90%	0.901	79%	0.789	S	S	*	*				179.3	175.1	124.9	-97	164.6	0	0	0	111.7
829	S	30	Very low	28.7	Very low	90 Å²	90	139 Å²	139	63%	0.629	79%	0.785	S	S	*	*			trans	-84.1	146.9	-174.8	51.7	0	0	0	0	114.4
830	N	25.2	Very low	29	Very low	157 Å²	157	140.8 Å²	140.8	84%	0.84	79%	0.788	S	S	*	*				179.3	172.5	123.9	-91.2	-5.1	0	0	0	113.7
831	F	25.7	Very low	29	Very low	190 Å²	190	138 Å²	138	83%	0.833	78%	0.783	S	S	*	*			trans	-59	171.3	159.2	-85.8	-127.4	0	0	0	110.9
832	S	27.4	Very low	29.5	Very low	63 Å²	63	142.2 Å²	142.2	44%	0.441	79%	0.793	S	S	.	*			cis	-144	-168.8	18.4	-153.3	0	0	0	0	113.2	I55 D56	I55-S832 PolarHBondContact O-OG 3.26Å; I55-S832 VanDerWaalsContact O-OG 3.06Å; D56-S832 WeakPolarHBondContact OD2-CB 3.16Å
833	L	32.9	Very low	29.7	Very low	150 Å²	150	143.1 Å²	143.1	79%	0.785	79%	0.794	S	S	*	*			trans	-93.5	141.1	174.1	-89.8	160.4	0	0	0	112
834	E	28.8	Very low	29.8	Very low	169 Å²	169	140.4 Å²	140.4	79%	0.79	79%	0.785	S	S	*	*			trans	-141.9	160.7	157.5	-97.1	-99.8	89.6	0	0	110
835	N	30	Very low	30	Very low	144 Å²	144	138.2 Å²	138.2	77%	0.77	78%	0.783	S	S	*	*			trans	-95.4	153.3	-158.2	-58.7	-84.5	0	0	0	114.1
836	L	28.2	Very low	30.1	Very low	177 Å²	177	138.7 Å²	138.7	93%	0.927	78%	0.782	S	S	*	*			trans	-141.1	136.9	141.5	-105.7	178.6	0	0	0	110.7
837	S	25.9	Very low	30.6	Very low	96 Å²	96	134.6 Å²	134.6	67%	0.671	77%	0.771	S	S	*	*			trans	-99.9	155	-170.2	45	0	0	0	0	112.9
838	V	27.9	Very low	30.6	Very low	143 Å²	143	135.6 Å²	135.6	87%	0.867	77%	0.768	S	S	*	*			trans	-131.8	123.2	153.4	179.7	0	0	0	0	106.1
839	S	28.1	Very low	30.8	Very low	108 Å²	108	135 Å²	135	76%	0.755	76%	0.761	S	S	*	*			trans	-99.8	132	177.2	-54.5	0	0	0	0	110
840	D	36.8	Very low	30.9	Very low	168 Å²	168	133.7 Å²	133.7	90%	0.898	75%	0.751	S	S	*	*			trans	-87.3	154.5	157.4	-72.2	-50.5	0	0	0	109.6
841	G	30.2	Very low	31.2	Very low	63 Å²	63	134.3 Å²	134.3	65%	0.649	75%	0.748	S	S	*	*			trans	-151.8	118.1	164.8	0	0	0	0	0	107.5
842	E	38	Very low	31.3	Very low	180 Å²	180	131.3 Å²	131.3	84%	0.841	75%	0.751	S	S	*	*				66.9	97.8	79.5	-68.8	-171	165.5	0	0	111.2
843	E	38.4	Very low	31.2	Very low	184 Å²	184	132.1 Å²	132.1	86%	0.86	77%	0.77	S	S	*	*				105.8	148.7	91.6	-80.1	-148.3	145.9	0	0	109.4
844	G	30.7	Very low	31.2	Very low	61 Å²	61	131.7 Å²	131.7	63%	0.629	77%	0.773	S	S	*	*			cis	175.9	170	-5.9	0	0	0	0	0	110.6
845	N	32.6	Very low	32.2	Very low	158 Å²	158	128.7 Å²	128.7	85%	0.845	77%	0.769	S	S	*	*			trans	54.7	149.4	162.6	-61.5	-26.2	0	0	0	118.9
846	T	32.8	Very low	32.1	Very low	134 Å²	134	129.8 Å²	129.8	82%	0.822	78%	0.775	S	S	*	*			cis	-138.2	173.7	39.6	60.3	0	0	0	0	114.5
847	T	35.2	Very low	32.3	Very low	116 Å²	116	126.9 Å²	126.9	71%	0.712	76%	0.764	S	S	*	*			trans	-73.6	169.4	162.7	67.6	0	0	0	0	110.3
848	D	31.7	Very low	32.4	Very low	125 Å²	125	128.7 Å²	128.7	67%	0.668	77%	0.771	S	S	*	*			cis	-142.4	-162.7	24	-120.2	-88.5	0	0	0	109.4
849	H	30.2	Very low	32.4	Very low	160 Å²	160	126.5 Å²	126.5	74%	0.741	76%	0.762	S	S	*	*			cis	-153.1	151.3	15	-154.1	37.1	0	0	0	115.8
850	S	31.9	Very low	32.5	Very low	61 Å²	61	126.9 Å²	126.9	43%	0.427	76%	0.76	S	S	.	*			trans	17.2	114.5	150	-68.3	0	0	0	0	124.6
851	H	31.3	Very low	32.1	Very low	170 Å²	170	125.4 Å²	125.4	79%	0.787	75%	0.752	S	S	*	*				93.1	108.7	118.1	-65.3	-34.3	0	0	0	124.1
852	S	28	Very low	32.2	Very low	128 Å²	128	128.7 Å²	128.7	90%	0.895	76%	0.759	S	S	*	*				89.4	139.3	127	76.9	0	0	0	0	120.4
853	G	26.6	Very low	31.8	Very low	80 Å²	80	126.9 Å²	126.9	83%	0.825	76%	0.755	S	S	*	*			trans	143.7	77	172.5	0	0	0	0	0	115.7
854	T	32.9	Very low	31.6	Very low	140 Å²	140	125.3 Å²	125.3	86%	0.859	75%	0.748	S	S	*	*			trans	-129.1	165.9	164.2	61.1	0	0	0	0	108.4
855	P	48.2	Very low	31.6	Very low	107 Å²	107	131.5 Å²	131.5	70%	0.695	75%	0.752	S	S	*	*			cis	-128.8	-170	-2.1	41.1	-24.7	0	0	0	113.4
856	D	29.1	Very low	31.8	Very low	167 Å²	167	129.8 Å²	129.8	89%	0.893	74%	0.743	S	S	*	*			trans	-60	145.2	159.4	-91.1	-53.2	0	0	0	112.3
857	V	31.3	Very low	32	Very low	116 Å²	116	130.1 Å²	130.1	70%	0.703	74%	0.739	S	S	*	*			trans	-137.2	138.5	174.9	179.4	0	0	0	0	110.1
858	V	28.4	Very low	31.9	Very low	134 Å²	134	130 Å²	130	81%	0.812	73%	0.734	S	S	*	*			trans	-112.1	118	173	173.2	0	0	0	0	110.4
859	S	29.2	Very low	32	Very low	97 Å²	97	131.7 Å²	131.7	68%	0.678	74%	0.736	S	S	*	*			trans	70.2	144.6	171.4	-54	0	0	0	0	116
860	T	29.8	Very low	32.3	Very low	116 Å²	116	127.9 Å²	127.9	71%	0.712	73%	0.727	S	S	*	*			cis	-137.3	139.6	19.5	51.8	0	0	0	0	115.1
861	N	27.6	Very low	32.4	Very low	137 Å²	137	131.3 Å²	131.3	73%	0.733	74%	0.741	S	S	*	*			trans	59.3	144.6	139.1	-58.8	-7.6	0	0	0	123
862	T	32.3	Very low	32.8	Very low	131 Å²	131	129.4 Å²	129.4	80%	0.804	74%	0.736	S	S	*	*			trans	62.8	143.2	153.8	45.9	0	0	0	0	118.7
863	D	29.8	Very low	33.1	Very low	143 Å²	143	129.6 Å²	129.6	77%	0.765	73%	0.727	S	S	*	*			cis	-164.8	172.9	-22.9	-148.6	-37.7	0	0	0	107.2
864	E	34.3	Very low	33.5	Very low	151 Å²	151	132.7 Å²	132.7	71%	0.706	72%	0.724	S	S	*	*			trans	64.8	155.6	171	-65.6	-141	107.8	0	0	118.1
865	R	31.4	Very low	33.6	Very low	190 Å²	190	130.3 Å²	130.3	72%	0.717	71%	0.713	S	S	*	*			cis	-172.9	154.9	-30.5	-160.5	-162.1	-177.4	101	4.1	109.9
866	L	35.8	Very low	33	Very low	123 Å²	123	134.2 Å²	134.2	64%	0.644	72%	0.721	S	S	*	*			trans	72.4	128.4	168.9	-49.9	-178.5	0	0	0	114.6
867	D	36.3	Very low	33	Very low	140 Å²	140	129 Å²	129	75%	0.749	71%	0.707	S	S	*	*				70.8	141.2	65.9	-52.2	-41.9	0	0	0	112
868	D	34.8	Very low	33.1	Very low	114 Å²	114	128.6 Å²	128.6	61%	0.61	71%	0.709	S	S	*	*			cis	-158.7	178.9	17.1	-153.2	-3.2	0	0	0	112.5
869	K	33	Very low	33.4	Very low	160 Å²	160	129.6 Å²	129.6	70%	0.696	71%	0.705	S	S	*	*			trans	12.7	160.6	148.5	-77.3	167.6	-159.1	72.4	0	123.6
870	S	35.8	Very low	33.6	Very low	80 Å²	80	132 Å²	132	56%	0.559	71%	0.709	S	S	*	*			cis	-179.8	175.5	-20.8	59.8	0	0	0	0	112.3
871	D	35.4	Very low	34.5	Very low	133 Å²	133	132.5 Å²	132.5	71%	0.711	71%	0.714	S	S	*	*			trans	66.5	128.9	146.4	-50.1	-30.8	0	0	0	124.6
872	D	38.1	Very low	34.7	Very low	130 Å²	130	130 Å²	130	70%	0.695	71%	0.713	S	S	*	*				86.3	110.9	125.5	-76.2	3.2	0	0	0	127
873	L	35.3	Very low	34.4	Very low	133 Å²	133	131.2 Å²	131.2	70%	0.696	71%	0.714	S	S	*	*				89.7	123.5	116.2	-68.5	173.9	0	0	0	125
874	L	34.3	Very low	35.4	Very low	145 Å²	145	129.3 Å²	129.3	76%	0.759	71%	0.71	S	S	*	*				94.6	138.1	129.1	-76.1	167.3	0	0	0	124.7
875	S	35.3	Very low	35	Very low	90 Å²	90	128.1 Å²	128.1	63%	0.629	72%	0.717	S	S	*	*			trans	71.1	146.2	155.8	-63.6	0	0	0	0	119.4
876	Q	35.3	Very low	34.9	Very low	188 Å²	188	126.3 Å²	126.3	88%	0.879	72%	0.721	S	S	*	*			cis	-164.5	176.6	-10.9	-112.5	169.8	84.6	0	0	107.7
877	G	30.6	Very low	35.4	Very low	57 Å²	57	125.3 Å²	125.3	59%	0.588	72%	0.722	S	S	*	*			cis	168	172.6	0.9	0	0	0	0	0	110.9
878	S	32.8	Very low	35	Very low	108 Å²	108	123.8 Å²	123.8	76%	0.755	72%	0.723	S	S	*	*			trans	63.6	169.8	172.1	-69.2	0	0	0	0	117.8
879	E	34.7	Very low	34.7	Very low	155 Å²	155	127.3 Å²	127.3	72%	0.724	74%	0.735	S	S	*	*			cis	-156.8	152.4	-29.9	-98.9	166.4	85.3	0	0	106.2
880	I	34	Very low	34.6	Very low	148 Å²	148	128.3 Å²	128.3	76%	0.759	75%	0.747	S	S	*	*			cis	83.8	139.6	41.9	-61	174.9	0	0	0	112.7
881	P	47.7	Very low	34.3	Very low	126 Å²	126	127.3 Å²	127.3	82%	0.818	75%	0.749	S	S	*	*			cis	-126.4	-143.3	-10.8	40.6	-21	0	0	0	114.9
882	A	31.8	Very low	34.1	Very low	86 Å²	86	126 Å²	126	71%	0.711	75%	0.751	S	S	*	*			trans	-158.9	175.8	-135.4	0	0	0	0	0	115
883	D	26.9	Very low	33.7	Very low	156 Å²	156	127.1 Å²	127.1	83%	0.834	76%	0.757	S	S	*	*			trans	62.3	172.9	153.4	-92.4	-10.3	0	0	0	119.9
884	P	50.3	Low	33.4	Very low	102 Å²	102	124.6 Å²	124.6	66%	0.662	76%	0.763	S	S	*	*			cis	-140.4	-174	-35.3	39.4	-21.7	0	0	0	115.5
885	C	25.4	Very low	33.2	Very low	126 Å²	126	125.8 Å²	125.8	85%	0.851	77%	0.769	S	S	*	*			trans	85.6	142.3	149.9	-71.2	0	0	0	0	124.2
886	D	28.8	Very low	33	Very low	153 Å²	153	126.8 Å²	126.8	82%	0.818	78%	0.776	S	S	*	*			trans	-84.1	179.8	167.7	-151.5	36	0	0	0	109.8
887	P	46.7	Very low	32.7	Very low	101 Å²	101	126.7 Å²	126.7	66%	0.656	78%	0.776	S	S	*	*			cis	-150	-173	18.4	45	-22.9	0	0	0	119.9
888	S	27.6	Very low	32.8	Very low	109 Å²	109	134.2 Å²	134.2	76%	0.762	79%	0.786	S	S	*	*			trans	110	121.9	138.3	74.6	0	0	0	0	123.1
889	Q	29.3	Very low	32.6	Very low	187 Å²	187	138.5 Å²	138.5	87%	0.874	79%	0.794	S	S	*	*			trans	-2.8	140.4	158.2	-56.3	177.3	2.4	0	0	123.5
890	L	31.5	Very low	32.4	Very low	181 Å²	181	135.6 Å²	135.6	95%	0.948	80%	0.797	S	S	*	*				-152.5	167.2	123.8	-136.5	71.7	0	0	0	111.8
891	G	27.6	Very low	32.3	Very low	59 Å²	59	135.9 Å²	135.9	61%	0.608	80%	0.795	S	S	*	*			trans	-73	155.3	-172.6	0	0	0	0	0	115.8
892	S	31.6	Very low	31.5	Very low	107 Å²	107	136.9 Å²	136.9	75%	0.748	80%	0.798	S	S	*	*				88.7	146.3	70.4	90.1	0	0	0	0	111.7
893	D	30.8	Very low	31.6	Very low	153 Å²	153	141.4 Å²	141.4	82%	0.818	80%	0.797	S	S	*	*			cis	-140.2	164.9	9.2	-79.3	-77.7	0	0	0	111.5
894	G	28.8	Very low	31.9	Very low	79 Å²	79	140.9 Å²	140.9	81%	0.814	79%	0.79	S	S	*	*			trans	168.4	83.7	173	0	0	0	0	0	115.5
895	L	29.3	Very low	31.1	Very low	171 Å²	171	143.3 Å²	143.3	90%	0.895	80%	0.802	S	S	*	*			trans	-96.1	133.4	-178	-64.3	167.9	0	0	0	112.9
896	S	31.6	Very low	31.6	Very low	110 Å²	110	146.8 Å²	146.8	77%	0.769	80%	0.803	S	S	*	*				-175.4	130.5	121.5	56	0	0	0	0	114.7
897	E	29.6	Very low	31.9	Very low	187 Å²	187	144.9 Å²	144.9	87%	0.874	80%	0.797	S	S	*	*			trans	40.5	98.6	139.7	-55.9	-174.6	142.3	0	0	121.4
898	R	31.5	Very low	31.1	Very low	214 Å²	214	148.4 Å²	148.4	81%	0.808	80%	0.804	S	S	*	*				-163.9	78.3	126.9	-113.8	177.4	-178.5	-90.4	-4.4	113	E901	R898-E901 IonicContact CZ-OE2 2.74Å; R898-E901 IonicContact NH1-OE2 3.84Å; R898-E901 PolarHBondContact NH1-OE2 3.19Å
899	E	29.7	Very low	31.3	Very low	199 Å²	199	151.9 Å²	151.9	93%	0.93	81%	0.814	S	S	*	*			trans	-129.1	64.9	172.1	-164.1	-169.1	-178.7	0	0	111.2
900	A	28.9	Very low	31.3	Very low	93 Å²	93	147 Å²	147	77%	0.769	81%	0.805	S	S	*	*			trans	-151	23.8	-167.3	0	0	0	0	0	117.8
901	E	32.5	Very low	31.2	Very low	154 Å²	154	146.7 Å²	146.7	72%	0.72	80%	0.803	S	S	*	*			trans	-130.6	22.2	-165.6	-139.1	146.9	-133.7	0	0	117.7	R898	R898-E901 IonicContact CZ-OE2 2.74Å; R898-E901 IonicContact NH1-OE2 3.84Å; R898-E901 PolarHBondContact NH1-OE2 3.19Å
902	V	31.4	Very low	31.3	Very low	147 Å²	147	149 Å²	149	89%	0.891	81%	0.81	S	S	*	*	S	Bend	trans	-128.2	50.4	166.5	-160.9	0	0	0	0	112.5
903	R	34.7	Very low	31.1	Very low	181 Å²	181	152.7 Å²	152.7	68%	0.683	82%	0.816	S	S	*	*	S	Bend	trans	-139.4	20.7	170.2	-84.1	-163.6	174.8	88.1	-0	114.8
904	Q	31.9	Very low	31	Very low	146 Å²	146	154.4 Å²	154.4	68%	0.682	82%	0.818	S	S	*	*			trans	-141.3	39	-169.2	-153.9	156.3	-11.2	0	0	116.7
905	V	33.2	Very low	30.8	Very low	152 Å²	152	157.4 Å²	157.4	92%	0.921	82%	0.816	S	S	*	*	S	Bend	trans	-126.7	41.8	164.1	-157.7	0	0	0	0	111.6
906	K	36	Very low	30.6	Very low	200 Å²	200	153.7 Å²	153.7	87%	0.87	80%	0.803	S	S	*	*	S	Bend	trans	-141.4	22.4	168	-151	176.7	179.3	175	0	113.3
907	T	36.6	Very low	30.4	Very low	113 Å²	113	157.1 Å²	157.1	69%	0.693	81%	0.807	S	S	*	*	S	Bend	trans	-154.4	47.8	-173.3	13.4	0	0	0	0	110.8
908	Q	29.8	Very low	30.3	Very low	174 Å²	174	150.9 Å²	150.9	81%	0.813	79%	0.793	S	S	*	*	S	Bend	trans	-149.2	49.7	170.8	-144.6	170	32	0	0	112.1
909	L	30.8	Very low	30.2	Very low	183 Å²	183	147.9 Å²	147.9	96%	0.958	79%	0.793	S	S	*	*	S	Bend	trans	-146.9	32.2	168	-122.9	172.3	0	0	0	110.9
910	A	30.4	Very low	30.2	Very low	84 Å²	84	148.5 Å²	148.5	69%	0.694	79%	0.788	S	S	*	*	S	Bend	trans	-149.2	143.9	173.7	0	0	0	0	0	107.6
911	L	29	Very low	30.3	Very low	174 Å²	174	151.3 Å²	151.3	91%	0.911	79%	0.79	S	S	*	*	S	Bend	trans	71.9	43.9	-178.9	-47.8	-178.4	0	0	0	116.2
912	S	28.6	Very low	30.2	Very low	108 Å²	108	151.7 Å²	151.7	76%	0.755	80%	0.797	S	S	*	*	S	Bend		-103.7	157.7	123.3	56.6	0	0	0	0	108.3
913	E	27	Very low	30.3	Very low	185 Å²	185	150.5 Å²	150.5	86%	0.864	80%	0.795	S	S	*	*			trans	65.7	73.2	175.1	-56.7	-171.7	169.2	0	0	116.5
914	H	28.6	Very low	30.3	Very low	188 Å²	188	149.4 Å²	149.4	87%	0.87	80%	0.803	S	S	*	*			trans	-137.8	104.1	135.9	-115.6	-80.5	0	0	0	108.7
915	N	25.9	Very low	30.4	Very low	142 Å²	142	147.9 Å²	147.9	76%	0.759	81%	0.807	S	S	*	*				-167.9	143.3	124.9	-133.1	26.3	0	0	0	112.8
916	C	24.8	Very low	30.2	Very low	94 Å²	94	147.1 Å²	147.1	64%	0.635	80%	0.797	S	S	*	*			trans	61.3	131.8	166.2	-50.9	0	0	0	0	117.7
917	E	27.6	Very low	30.1	Very low	181 Å²	181	142.5 Å²	142.5	85%	0.846	79%	0.791	S	S	*	*			cis	-173.4	162.3	-18.3	-121.3	148	-97.8	0	0	107.1
918	G	26.8	Very low	29.9	Very low	57 Å²	57	142 Å²	142	59%	0.588	80%	0.797	S	S	*	*			cis	169.6	173.9	-0.2	0	0	0	0	0	110.4
919	L	29.3	Very low	30.3	Very low	151 Å²	151	142.5 Å²	142.5	79%	0.791	80%	0.8	S	S	*	*			trans	70.5	141.4	-178.1	-49.2	164.2	0	0	0	114.3
920	Y	29.7	Very low	30.4	Very low	212 Å²	212	142.1 Å²	142.1	83%	0.831	80%	0.798	S	S	*	*			cis	-125.4	168.5	12.9	-90.5	-93.8	0	0	0	113.3
921	D	30.6	Very low	30.6	Very low	152 Å²	152	144.7 Å²	144.7	81%	0.813	80%	0.8	S	S	*	*			trans	-69.6	150.2	-176	-75.9	-65.2	0	0	0	116.6
922	D	31.1	Very low	30.7	Very low	162 Å²	162	144.3 Å²	144.3	87%	0.866	79%	0.793	S	S	*	*			trans	-83	151.8	151.4	-81.1	-49.5	0	0	0	110.5
923	S	33.4	Very low	30.8	Very low	122 Å²	122	143.7 Å²	143.7	85%	0.853	79%	0.789	S	S	*	*			trans	-152.5	126.1	150.9	41.1	0	0	0	0	112.4
924	D	35.8	Very low	30.8	Very low	158 Å²	158	140.6 Å²	140.6	85%	0.845	79%	0.787	S	S	*	*			trans	-84.9	171.4	174.1	-91.9	-48.9	0	0	0	112.3
925	C	32.8	Very low	30.8	Very low	113 Å²	113	137.8 Å²	137.8	76%	0.764	79%	0.787	S	S	*	*			trans	71.9	155.3	162.5	-79	0	0	0	0	117.3
926	D	29	Very low	31	Very low	136 Å²	136	135.1 Å²	135.1	73%	0.727	78%	0.784	S	S	*	*			cis	-146.2	-179.4	-0.5	-138.5	-51.4	0	0	0	113.1
927	S	34.8	Very low	31.2	Very low	104 Å²	104	139 Å²	139	73%	0.727	79%	0.793	S	S	*	*			trans	-68.6	143.6	-179.2	-39.8	0	0	0	0	114.4
928	A	32.6	Very low	31.3	Very low	101 Å²	101	136.4 Å²	136.4	84%	0.835	78%	0.784	S	S	*	*			trans	-165.7	143.5	144.8	0	0	0	0	0	112.4
929	E	38.4	Very low	31.5	Very low	185 Å²	185	140.6 Å²	140.6	86%	0.864	79%	0.793	S	S	*	*			trans	-83.7	156.5	162.7	-58.6	170.9	122.2	0	0	110.4
930	L	32.5	Very low	31.6	Very low	175 Å²	175	142.2 Å²	142.2	92%	0.916	80%	0.797	S	S	*	*			trans	-175.1	153.1	136.4	-103	165.1	0	0	0	112.5
931	D	33.4	Very low	32.4	Very low	139 Å²	139	137.5 Å²	137.5	74%	0.743	79%	0.792	S	S	*	*			trans	-91.9	176.4	-171.2	-77.5	-66	0	0	0	115.8
932	H	31.3	Very low	33.3	Very low	166 Å²	166	135.4 Å²	135.4	77%	0.769	79%	0.787	S	S	*	*			trans	86.1	88.2	148.8	-76.5	-62	0	0	0	122
933	S	30.9	Very low	33.3	Very low	94 Å²	94	133.3 Å²	133.3	66%	0.657	78%	0.78	S	S	*	*				47.8	111.8	115.9	63	0	0	0	0	122.5
934	C	27.3	Very low	33.4	Very low	121 Å²	121	134.2 Å²	134.2	82%	0.818	78%	0.775	S	S	*	*				-177.6	133.2	124.1	-91.6	0	0	0	0	108.7
935	C	28.7	Very low	33.3	Very low	129 Å²	129	142.2 Å²	142.2	87%	0.872	79%	0.794	S	S	*	*				78.2	77.2	59.6	-69.4	0	0	0	0	115.5
936	A	30.6	Very low	33.4	Very low	86 Å²	86	143.7 Å²	143.7	71%	0.711	80%	0.796	S	S	*	*			trans	-157.2	127.1	150.7	0	0	0	0	0	105.8
937	E	28.8	Very low	33.6	Very low	174 Å²	174	144.1 Å²	144.1	81%	0.813	80%	0.799	S	S	*	*				61.6	130.8	74.5	-65.8	-158.6	126.4	0	0	113.2
938	L	29.8	Very low	33.5	Very low	127 Å²	127	146.3 Å²	146.3	67%	0.665	80%	0.803	S	S	*	*			cis	-161	167.7	5.5	-116.8	166.8	0	0	0	111.2
939	N	29.8	Very low	33.6	Very low	146 Å²	146	149 Å²	149	78%	0.781	80%	0.801	S	S	*	*			trans	73.3	137.4	155.6	-69.8	-32.1	0	0	0	123.3
940	Q	31.5	Very low	33.3	Very low	184 Å²	184	146.8 Å²	146.8	86%	0.86	80%	0.797	S	S	*	*			trans	-69.9	175.3	-179.1	-88.5	-178.6	-4.2	0	0	115.7
941	P	48.2	Very low	33.3	Very low	114 Å²	114	144.9 Å²	144.9	74%	0.74	79%	0.789	S	S	*	*			trans	-91.7	-169.4	-162.8	40.6	-38.5	0	0	0	113.3
942	P	48	Very low	33.3	Very low	107 Å²	107	145.3 Å²	145.3	70%	0.695	79%	0.793	S	S	*	*				-151.9	-176.7	93.4	42.8	-25.9	0	0	0	116.5
943	T	32.1	Very low	33.5	Very low	118 Å²	118	143.7 Å²	143.7	72%	0.724	80%	0.795	S	S	*	*			trans	68.2	124.7	157.5	47.7	0	0	0	0	121.2
944	N	34.2	Very low	33.7	Very low	142 Å²	142	147.8 Å²	147.8	76%	0.759	81%	0.806	S	S	*	*			trans	30.1	137	136.3	-48.7	9.6	0	0	0	118.8
945	W	35.3	Very low	34.3	Very low	326 Å²	326	150.3 Å²	150.3	100%	1.235	81%	0.805	S	S	*	*			cis	-116.1	0	26.2	-76.9	51.5	0	0	0	114.2

Retrieved 945 of 945 residues in 834.4 ms (Link to these results)

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