A0A087XKA2_POEFO Loading...

Chloride channel protein

AlphaFold DB , UniProt , Accession A0A087XKA2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 819 aa.

						>A0A087XKA2_POEFO|A0A087XKA2
MENPGYSSGFDGLHHPSDDDDDEMVDIAGATLDFSTTDDVPPLSSGGYDEYSAGSSSRAAGMNGSGPTKLVDPLEDPLPGVGTYEDFNTIDWVREKSKDRDRHREITNKSRESTVALLHSVSDAFSGWLLMLLVGLMAGSLAGGIDIAAHWMTDLKEGVCLIGFWFNHEHCCWTSNETTFQERDRCPQWKSWAELIAGTAQGPFAYIVNYLMYIFWALLFSFLAVTLVRAFAPYACGSGIPEIKTILSGFIIRGYLGKWTLIIKTITLVLAVSSGLSLGKEGPLVHVACCCANILCHLFTKYRKNEAKRREVLSAAAAVGVSVAFGAPIGGVLFSLEEVSYYFPLKTLWRSFFAALVAAFTLRSINPFGNSRLVLFYVEFHAPWHLLELAPFILLGIFGGLWGALFIKANIAWCRMRKTTRLGHYPVIEVLLVTAVTALIAFPNSYTRMSGAELISELFNDCSLLDSSQLCGYKQPVNTSETGVDNNLADRPAGAGLYTALWQLALALIFKILITVITFGMKVPSGLFIPSMAVGAIAGRLLGVGMEQLAYYNHDWLIFRGWCSPGADCITPGLYAMVGAAACLGGVTRMTVSLVVIMFELTGGLEYIVPLMAATMTSKWVADAFGREGIYEAHIRLNGYPFLEPKEEFEHSSLAVDVMRPRRGDPALAVLTQDSMTIGEVETLVESTHYSGFPVVVSQESQRLVGFVLRRDLLISIDNARKRQDGIVSASLVVFTEHCPAQPPEAPPPLRLRGIIDLSPFTVTDHTPMDITVDIFRKLGLRQCLVTHNGRLLGIITKKDILKHMAQIANRDPDSILFN
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35	Very low	31.2	Very low	224 Å²	224	141.3 Å²	141.3	100%	1.103	79%	0.793	S	S	*	*				0	82.9	0	-67.5	167.7	174.5	0	0	105.3
2	E	29.6	Very low	30.8	Very low	178 Å²	178	135.6 Å²	135.6	83%	0.832	79%	0.789	S	S	*	*				71.1	131.2	74.2	-67.3	175.8	148.1	0	0	111.7
3	N	31.5	Very low	30.5	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	80%	0.8	S	S	*	*			cis	-158.4	-159.4	-17.5	-147.3	8.9	0	0	0	108.5
4	P	49.6	Very low	30.2	Very low	106 Å²	106	141.8 Å²	141.8	69%	0.688	80%	0.803	S	S	*	*				-132.7	-167.5	-121.1	45.2	-25.6	0	0	0	116.6
5	G	30.1	Very low	29.9	Very low	67 Å²	67	143.2 Å²	143.2	69%	0.691	80%	0.8	S	S	*	*			trans	159.1	98.4	162.1	0	0	0	0	0	111
6	Y	30.6	Very low	30.1	Very low	231 Å²	231	141.4 Å²	141.4	91%	0.906	80%	0.796	S	S	*	*				49	130	65.1	-86.8	-94.1	0	0	0	112.9
7	S	28.4	Very low	29.8	Very low	97 Å²	97	138.6 Å²	138.6	68%	0.678	79%	0.788	S	S	*	*			cis	-161.5	-177.4	6.3	81.8	0	0	0	0	109.9
8	S	28.5	Very low	29.9	Very low	107 Å²	107	138.8 Å²	138.8	75%	0.748	79%	0.786	S	S	*	*			cis	-173.6	139.4	-5.4	32.6	0	0	0	0	111.7
9	G	26.7	Very low	29.8	Very low	70 Å²	70	139.8 Å²	139.8	72%	0.722	79%	0.789	S	S	*	*			trans	89.8	152.5	156.3	0	0	0	0	0	117.9
10	F	26.9	Very low	29.7	Very low	190 Å²	190	141.5 Å²	141.5	83%	0.833	80%	0.796	S	S	*	*			cis	-161.5	154.1	-1.6	-144	-106.8	0	0	0	111.2
11	D	26.5	Very low	29.8	Very low	136 Å²	136	142.8 Å²	142.8	73%	0.727	80%	0.801	S	S	*	*			trans	46.2	97.5	164.6	-66.1	-7	0	0	0	123.5
12	G	26.2	Very low	29.6	Very low	73 Å²	73	140.1 Å²	140.1	75%	0.753	79%	0.792	S	S	*	*				62.5	115.6	96.9	0	0	0	0	0	122.2
13	L	27.3	Very low	29.8	Very low	178 Å²	178	141.2 Å²	141.2	93%	0.932	80%	0.796	S	S	*	*			trans	-162.5	162.1	139.7	-110.1	155.3	0	0	0	112.1
14	H	26.4	Very low	29.8	Very low	180 Å²	180	142.6 Å²	142.6	83%	0.833	80%	0.801	S	S	*	*			trans	-78.2	149.7	-168.4	-86.7	-99.4	0	0	0	115.3
15	H	25.3	Very low	28.7	Very low	163 Å²	163	143 Å²	143	76%	0.755	80%	0.801	S	S	*	*			trans	-53.2	148.7	156.9	-99.9	-70.3	0	0	0	112
16	P	33.3	Very low	28.6	Very low	115 Å²	115	148.1 Å²	148.1	75%	0.747	81%	0.812	S	S	*	*				-137.1	131.4	74.7	40.6	-26.2	0	0	0	112.8
17	S	25.6	Very low	28.5	Very low	93 Å²	93	144.3 Å²	144.3	65%	0.65	81%	0.806	S	S	*	*				103.1	120.4	80.9	71.5	0	0	0	0	111.6
18	D	30.5	Very low	28.4	Very low	143 Å²	143	144.5 Å²	144.5	77%	0.765	81%	0.814	S	S	*	*			trans	-38.4	135.2	179.7	-43.3	-53.5	0	0	0	117
19	D	28.9	Very low	28.3	Very low	158 Å²	158	142.7 Å²	142.7	85%	0.845	81%	0.812	S	S	*	*				171.8	95.7	121.6	-93	-19.9	0	0	0	109.8
20	D	27.7	Very low	28.4	Very low	172 Å²	172	144.7 Å²	144.7	92%	0.92	82%	0.822	S	S	*	*			trans	-154	87	167.9	-104.1	-33.5	0	0	0	109.3
21	D	32	Very low	28.5	Very low	170 Å²	170	141.4 Å²	141.4	91%	0.909	82%	0.817	S	S	*	*			trans	-130.2	75.4	175.1	-112.6	-18.3	0	0	0	108.6
22	D	31	Very low	28.5	Very low	168 Å²	168	142.9 Å²	142.9	90%	0.898	82%	0.824	S	S	*	*			trans	-158.6	45.6	169.7	-126.1	-8.2	0	0	0	113.6
23	E	33.5	Very low	28.3	Very low	200 Å²	200	146.5 Å²	146.5	94%	0.935	83%	0.826	S	S	*	*			trans	-108.6	103.9	159.9	-95.2	-159.6	157.2	0	0	111.1
24	M	30.1	Very low	28.3	Very low	178 Å²	178	147.7 Å²	147.7	88%	0.877	82%	0.824	S	S	*	*			trans	-137.3	106.6	162.5	-99.4	-159.5	-76.8	0	0	113.3
25	V	27.7	Very low	28.2	Very low	114 Å²	114	144.3 Å²	144.3	69%	0.691	82%	0.821	S	S	*	*			trans	53.2	92.9	138	-165.3	0	0	0	0	117.7	I27	V25-I27 HydrophobicContact CG1-CG1 4.37Å
26	D	26.9	Very low	28.3	Very low	175 Å²	175	142.8 Å²	142.8	94%	0.936	82%	0.823	S	S	*	*			trans	-106.4	106.1	144.5	-96.5	-36.9	0	0	0	108.5
27	I	28.7	Very low	28.1	Very low	150 Å²	150	143.2 Å²	143.2	77%	0.769	82%	0.824	S	S	*	*			trans	-130.8	139.8	169.4	-67.2	-177	0	0	0	109.6	V25	V25-I27 HydrophobicContact CG1-CG1 4.37Å
28	A	27.3	Very low	28.1	Very low	102 Å²	102	146.4 Å²	146.4	84%	0.843	83%	0.834	S	S	*	*			trans	79.9	95.6	172.7	0	0	0	0	0	117.4
29	G	25.3	Very low	28	Very low	69 Å²	69	147.4 Å²	147.4	71%	0.711	84%	0.839	S	S	*	*			trans	175.3	78	166.4	0	0	0	0	0	111.3	T31	G29-T31 PolarHBondContact O-N 2.83Å
30	A	30.1	Very low	28	Very low	112 Å²	112	146.4 Å²	146.4	93%	0.926	84%	0.838	S	S	*	*			trans	-54.3	104.9	-167	0	0	0	0	0	114.4
31	T	27.7	Very low	28.1	Very low	120 Å²	120	143.4 Å²	143.4	74%	0.736	83%	0.828	S	S	*	*			trans	-95.5	134.5	158.8	47.6	0	0	0	0	109.1	G29 D33	G29-T31 PolarHBondContact O-N 2.83Å; T31-D33 PolarHBondContact O-N 3.08Å; T31-D33 VanDerWaalsContact O-N 3.16Å
32	L	27.1	Very low	28	Very low	168 Å²	168	141 Å²	141	88%	0.88	82%	0.822	S	S	*	*			trans	-64.1	111.3	177.3	-78.4	151.2	0	0	0	110.7	F34	L32-F34 PolarHBondContact O-N 3.25Å
33	D	21.9	Very low	27.9	Very low	149 Å²	149	140.8 Å²	140.8	80%	0.797	82%	0.82	S	S	*	*			trans	-68.6	122.7	171.6	-79.9	-36.8	0	0	0	111	T31	T31-D33 PolarHBondContact O-N 3.08Å; T31-D33 VanDerWaalsContact O-N 3.16Å
34	F	27.5	Very low	27.5	Very low	203 Å²	203	136.6 Å²	136.6	89%	0.89	81%	0.813	S	S	*	*			trans	-126.9	77.6	166.6	-102.9	-76.8	0	0	0	109.2	L32	L32-F34 PolarHBondContact O-N 3.25Å
35	S	25.3	Very low	27.4	Very low	109 Å²	109	133.9 Å²	133.9	76%	0.762	81%	0.811	S	S	*	*			trans	-160.5	67.5	163.7	62.9	0	0	0	0	113.3
36	T	25.5	Very low	27.4	Very low	131 Å²	131	131.9 Å²	131.9	80%	0.804	81%	0.814	S	S	*	*			trans	-93.3	112.2	148.9	48.3	0	0	0	0	108.5
37	T	29	Very low	27.2	Very low	124 Å²	124	126.6 Å²	126.6	76%	0.761	80%	0.8	S	S	*	*			trans	41.7	103.4	150.8	57.3	0	0	0	0	118.2
38	D	26.9	Very low	27.1	Very low	159 Å²	159	130.1 Å²	130.1	85%	0.85	81%	0.806	S	S	*	*				-159.2	138.1	122.1	-97.5	-26.9	0	0	0	109.8
39	D	28.3	Very low	27.1	Very low	165 Å²	165	132 Å²	132	88%	0.882	80%	0.802	S	S	*	*			trans	-74.4	133.5	-171.4	-70	-66.6	0	0	0	113.2
40	V	28.9	Very low	27.1	Very low	136 Å²	136	137.7 Å²	137.7	82%	0.824	81%	0.81	S	S	*	*			trans	-120	121.7	161.4	-177.5	0	0	0	0	108.2
41	P	30.1	Very low	26.8	Very low	109 Å²	109	143.1 Å²	143.1	71%	0.708	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-66.8	155.4	-174.3	-19.1	31.1	0	0	0	113.3
42	P	28.5	Very low	26.7	Very low	121 Å²	121	142.9 Å²	142.9	79%	0.786	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-69.7	141.6	176.8	29.4	-34.6	0	0	0	112.1	S44	P42-S44 PolarHBondContact O-N 3.22Å
43	L	30	Very low	26.6	Very low	162 Å²	162	139.8 Å²	139.8	85%	0.848	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-61.2	119.7	161.3	-83.2	161.2	0	0	0	108.9	S45	L43-S45 PolarHBondContact O-N 2.99Å
44	S	25.6	Very low	26.6	Very low	113 Å²	113	136.1 Å²	136.1	79%	0.79	81%	0.807	S	S	*	*			trans	-75.2	103	-171	56.8	0	0	0	0	112.8	P42 G46	P42-S44 PolarHBondContact O-N 3.22Å; S44-G46 PolarHBondContact O-N 3.26Å
45	S	28	Very low	26.4	Very low	120 Å²	120	132 Å²	132	84%	0.839	80%	0.804	S	S	*	*			trans	-76.9	95.8	155.7	57.7	0	0	0	0	108.8	L43 G47	L43-S45 PolarHBondContact O-N 2.99Å; S45-G47 PolarHBondContact O-N 3.31Å
46	G	26.4	Very low	26.3	Very low	72 Å²	72	131.6 Å²	131.6	74%	0.742	80%	0.801	S	S	*	*			trans	-66.1	113	175.8	0	0	0	0	0	110.9	S44	S44-G46 PolarHBondContact O-N 3.26Å
47	G	24.1	Very low	26.2	Very low	64 Å²	64	130.7 Å²	130.7	66%	0.66	80%	0.8	S	S	*	*			trans	-76.5	152	172.4	0	0	0	0	0	111.9	S45	S45-G47 PolarHBondContact O-N 3.31Å
48	Y	26.6	Very low	26.1	Very low	224 Å²	224	136.7 Å²	136.7	88%	0.878	81%	0.809	S	S	*	*			trans	-146.6	151.3	159.5	-87.3	-66.1	0	0	0	110.9
49	D	26.3	Very low	26	Very low	142 Å²	142	134.1 Å²	134.1	76%	0.759	81%	0.809	S	S	*	*			trans	-66.1	151.5	-160	-55.5	-84.8	0	0	0	116.5
50	E	24.7	Very low	26	Very low	188 Å²	188	131.6 Å²	131.6	88%	0.879	81%	0.811	S	S	*	*			trans	-86.9	116.6	174.5	-173.3	174.7	-158.9	0	0	110.5
51	Y	25	Very low	25.8	Very low	226 Å²	226	129 Å²	129	89%	0.886	81%	0.812	S	S	*	*			trans	-120.8	126.4	166.5	-94.4	-77.3	0	0	0	111
52	S	25.5	Very low	25.7	Very low	116 Å²	116	132.2 Å²	132.2	81%	0.811	82%	0.82	S	S	*	*			trans	-69.3	141.8	-179.6	-72.5	0	0	0	0	113.5
53	A	24.5	Very low	25.6	Very low	102 Å²	102	134.1 Å²	134.1	84%	0.843	82%	0.823	S	S	*	*				145.8	136.8	117.7	0	0	0	0	0	115
54	G	22.6	Very low	25.4	Very low	72 Å²	72	130.1 Å²	130.1	74%	0.742	82%	0.821	S	S	*	*			trans	81.1	103	132	0	0	0	0	0	120.8
55	S	23.3	Very low	25.6	Very low	117 Å²	117	131.1 Å²	131.1	82%	0.818	83%	0.828	S	S	*	*				49.5	119.9	123.1	175.3	0	0	0	0	121.3
56	S	22.6	Very low	25.5	Very low	101 Å²	101	128 Å²	128	71%	0.706	82%	0.815	S	S	*	*			trans	115	133.7	134	76.6	0	0	0	0	121.3
57	S	23.6	Very low	25.5	Very low	112 Å²	112	130.9 Å²	130.9	78%	0.783	82%	0.82	S	S	*	*			trans	57.5	131.1	146.1	47.2	0	0	0	0	123.9
58	R	27.6	Very low	25.7	Very low	250 Å²	250	133.5 Å²	133.5	94%	0.943	82%	0.824	S	S	*	*			trans	-38.5	139.3	162.1	-63.4	166.5	166.5	167.9	-5.9	116
59	A	24.3	Very low	25.7	Very low	105 Å²	105	132.5 Å²	132.5	87%	0.868	82%	0.824	S	S	*	*			trans	-158.3	154.6	136.1	0	0	0	0	0	110.5
60	A	28.2	Very low	25.9	Very low	112 Å²	112	133 Å²	133	93%	0.926	83%	0.826	S	S	*	*			trans	-99.9	148.5	175.6	0	0	0	0	0	111.2
61	G	24.3	Very low	26.1	Very low	81 Å²	81	129.9 Å²	129.9	84%	0.835	82%	0.82	S	S	*	*			trans	-165.2	137.8	175.6	0	0	0	0	0	111.6
62	M	28.9	Very low	26.5	Very low	176 Å²	176	123.5 Å²	123.5	87%	0.867	80%	0.801	S	S	*	*			trans	-100.8	160.8	-175.2	-95.6	149.2	57.3	0	0	113
63	N	25.8	Very low	26.8	Very low	162 Å²	162	120 Å²	120	87%	0.866	78%	0.775	S	S	*	*			trans	78.6	118.7	166.8	-62.2	-8.5	0	0	0	118.4
64	G	25.1	Very low	27.6	Very low	78 Å²	78	118.6 Å²	118.6	80%	0.804	75%	0.753	S	S	*	*			trans	176.7	99.4	168	0	0	0	0	0	110.6	G66	G64-G66 PolarHBondContact O-N 2.83Å
65	S	31.2	Very low	28.5	Very low	134 Å²	134	124 Å²	124	94%	0.937	76%	0.759	S	S	*	*			trans	-74.5	113.6	179.4	52.4	0	0	0	0	111.5
66	G	24.7	Very low	29.3	Very low	55 Å²	55	124.2 Å²	124.2	57%	0.567	75%	0.751	S	S	*	*			trans	-143.6	158.5	167.9	0	0	0	0	0	109.7	G64 T68	G64-G66 PolarHBondContact O-N 2.83Å; G66-T68 PolarHBondContact O-N 2.81Å
67	P	27.7	Very low	30.6	Very low	131 Å²	131	125.1 Å²	125.1	85%	0.851	76%	0.755	S	S	*	*			trans	-61.2	125.9	179.2	26.7	-33.3	0	0	0	109	K69	P67-K69 PolarHBondContact O-N 3.28Å
68	T	26.5	Very low	32	Very low	120 Å²	120	120.9 Å²	120.9	74%	0.736	72%	0.723	S	S	*	*			trans	-59.1	109.1	174.4	32.7	0	0	0	0	108.9	G66 L70	G66-T68 PolarHBondContact O-N 2.81Å; T68-L70 PolarHBondContact O-N 2.88Å
69	K	28.2	Very low	33	Very low	203 Å²	203	114.2 Å²	114.2	88%	0.883	71%	0.713	S	S	*	*			trans	-63.6	83.1	153.8	-80.2	-169.3	175	-174.4	0	106.8	P67 V71	P67-K69 PolarHBondContact O-N 3.28Å; K69-V71 PolarHBondContact O-N 2.98Å
70	L	29.8	Very low	34.4	Very low	151 Å²	151	110.4 Å²	110.4	79%	0.791	68%	0.683	S	S	*	*			trans	-55.8	108.8	162.8	-93.4	139.4	0	0	0	106.3	T68 D72	T68-L70 PolarHBondContact O-N 2.88Å; L70-D72 PolarHBondContact O-N 3.47Å; L70-D72 VanDerWaalsContact O-N 3.14Å
71	V	29.2	Very low	35.7	Very low	124 Å²	124	106.8 Å²	106.8	75%	0.752	65%	0.65	S	S	*	*			trans	-56.6	116.5	174	-179.9	0	0	0	0	106.7	K69 P73	K69-V71 PolarHBondContact O-N 2.98Å; V71-P73 WeakPolarHBondContact O-CD 3.4Å; V71-P73 WeakPolarHBondContact O-CG 3.48Å
72	D	32.5	Very low	37.2	Very low	91 Å²	91	103.4 Å²	103.4	49%	0.487	62%	0.615	S	S	.	*			trans	-70.8	108.4	176.4	-161.9	-21.3	0	0	0	107.7	L70 L74	L70-D72 PolarHBondContact O-N 3.47Å; L70-D72 VanDerWaalsContact O-N 3.14Å; D72-L74 PolarHBondContact O-N 2.97Å
73	P	32.5	Very low	38.6	Very low	43 Å²	43	98 Å²	98	28%	0.279	59%	0.591	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.1	15.9	-164.4	-15.4	32.6	0	0	0	114.3	V71	V71-P73 WeakPolarHBondContact O-CD 3.4Å; V71-P73 WeakPolarHBondContact O-CG 3.48Å
74	L	40.2	Very low	40.5	Very low	73 Å²	73	91.2 Å²	91.2	38%	0.382	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-101.4	-5.8	-170.9	-72.8	170.5	0	0	0	114.5	D72 D76	D72-L74 PolarHBondContact O-N 2.97Å; L74-D76 VanDerWaalsContact C-N 3.29Å; L74-D76 PolarHBondContact O-N 3.45Å
75	E	41.5	Very low	42.2	Very low	185 Å²	185	91.5 Å²	91.5	86%	0.864	54%	0.535	S	S	*	.	S	Bend	trans	-68.2	-26.8	174	-76.3	-172.7	135.7	0	0	113
76	D	40.3	Very low	43.9	Very low	121 Å²	121	87.7 Å²	87.7	65%	0.647	50%	0.504	S	S	*	.	S	Bend	trans	-88.2	117.5	170	-91.7	-34.4	0	0	0	110.8	L74 L78	L74-D76 VanDerWaalsContact C-N 3.29Å; L74-D76 PolarHBondContact O-N 3.45Å; D76-L78 PolarHBondContact O-N 3.37Å
77	P	50.2	Low	45.9	Very low	121 Å²	121	89 Å²	89	79%	0.786	49%	0.494	S	S	*	.			trans	-64.7	111.7	179	24.7	-33.1	0	0	0	111.2
78	L	53.2	Low	48.3	Very low	22 Å²	22	84.6 Å²	84.6	12%	0.115	46%	0.463	C	S	.	.			trans	-50.9	129.3	-175.4	-70.2	173.9	0	0	0	112.4	D76 G80 V81 N719	D76-L78 PolarHBondContact O-N 3.37Å; L78-G80 PolarHBondContact O-N 3.3Å; L78-V81 HydrophobicContact CB-CB 4.43Å; L78-V81 HydrophobicContact CB-CG2 3.69Å; L78-V81 HydrophobicContact CD1-CG2 4.36Å; L78-V81 PolarHBondContact O-N 3Å; L78-V81 VanDerWaalsContact O-N 3.16Å; L78-N719 HydrophobicContact CD1-CB 4.28Å; L78-N719 HydrophobicContact CD2-CB 4.12Å
79	P	49.3	Very low	50.8	Low	111 Å²	111	80 Å²	80	72%	0.721	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	112.1	-175.9	24.9	-33.4	0	0	0	111.3
80	G	52.5	Low	53.5	Low	25 Å²	25	70.5 Å²	70.5	26%	0.258	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	113	-16.5	178.4	0	0	0	0	0	114.8	L78 T83	L78-G80 PolarHBondContact O-N 3.3Å; G80-T83 PolarHBondContact O-N 3.29Å; G80-T83 PolarHBondContact O-OG1 3.47Å
81	V	56.2	Low	56	Low	36 Å²	36	64.5 Å²	64.5	22%	0.218	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66	137	172.5	174.1	0	0	0	0	109.9	L78 D712 I715 I755	L78-V81 HydrophobicContact CB-CB 4.43Å; L78-V81 HydrophobicContact CB-CG2 3.69Å; L78-V81 HydrophobicContact CD1-CG2 4.36Å; L78-V81 PolarHBondContact O-N 3Å; L78-V81 VanDerWaalsContact O-N 3.16Å; V81-D712 WeakPolarHBondContact CA-OD1 3.15Å; V81-D712 HydrophobicContact CG1-CB 4.11Å; V81-I715 HydrophobicContact CG2-CB 4.18Å; V81-I715 HydrophobicContact CG2-CG2 3.66Å; V81-I755 HydrophobicContact CG1-CG2 4.5Å
82	G	54.8	Low	58.5	Low	10 Å²	10	60.2 Å²	60.2	10%	0.103	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.7	27.6	-175.6	0	0	0	0	0	114.4	D712	G82-D712 PolarHBondContact N-OD1 2.04Å
83	T	59.1	Low	60.9	Low	61 Å²	61	59.3 Å²	59.3	37%	0.374	33%	0.33	S	S	.	.			trans	-107	133.1	169.4	58.9	0	0	0	0	111.1	G80 R711	G80-T83 PolarHBondContact O-N 3.29Å; G80-T83 PolarHBondContact O-OG1 3.47Å; T83-R711 WeakPolarHBondContact O-CD 3.31Å; T83-R711 PolarHBondContact O-NE 3.49Å; T83-R711 VanDerWaalsContact O-NE 3.09Å; T83-R711 PolarHBondContact OG1-NE 3.21Å; T83-R711 VanDerWaalsContact OG1-NE 3.16Å; T83-R711 PolarHBondContact OG1-NH2 2.84Å; T83-R711 VanDerWaalsContact OG1-NH2 3.12Å
84	Y	66.7	Low	63.2	Low	20 Å²	20	61.2 Å²	61.2	8%	0.078	33%	0.332	C	S	.	.			trans	-86.5	142.6	-179.1	-51.9	-86.7	0	0	0	111.8	I90 D91 E95 I251 R253 E306	Y84-I90 HydrophobicContact CD1-CG2 4.45Å; Y84-I90 HydrophobicContact CD2-CG2 3.87Å; Y84-I90 HydrophobicContact CE1-CB 4.25Å; Y84-I90 HydrophobicContact CE2-CB 4.17Å; Y84-I90 HydrophobicContact CE2-CG2 3.93Å; Y84-I90 HydrophobicContact CG-CG2 4.16Å; Y84-D91 HydrophobicContact CE1-CB 4.43Å; Y84-D91 PolarHBondContact OH-N 3.14Å; Y84-E95 HydrophobicContact CE2-CG 4.48Å; Y84-E95 WeakPolarHBondContact CE2-OE1 3.15Å; Y84-E95 PolarHBondContact OH-OE1 2.83Å; Y84-I251 HydrophobicContact CD2-CD1 4.05Å; Y84-I251 HydrophobicContact CG-CD1 3.89Å; Y84-R253 PolarHBondContact O-NH2 3Å; Y84-E306 HydrophobicContact CD2-CG 4.09Å; Y84-E306 HydrophobicContact CE2-CB 4.3Å; Y84-E306 HydrophobicContact CE2-CG 4.2Å
85	E	60.3	Low	65.3	Low	85 Å²	85	57.9 Å²	57.9	40%	0.397	31%	0.314	S	S	.	.			trans	-82.4	177.3	177.1	-55.7	-174.2	154.8	0	0	111.5	R711	E85-R711 WeakPolarHBondContact OE1-CD 3.42Å; E85-R711 IonicContact OE1-CZ 2.71Å; E85-R711 IonicContact OE1-NE 3.69Å; E85-R711 IonicContact OE1-NH1 2.67Å; E85-R711 PolarHBondContact OE1-NH1 3.49Å
86	D	65.8	Low	67.3	Low	54 Å²	54	53.5 Å²	53.5	29%	0.289	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	152.3	177.8	-147.5	0.3	0	0	0	111.1	N88 I252 R253	D86-N88 PolarHBondContact O-N 3.2Å; D86-I252 WeakPolarHBondContact OD1-CA 3.44Å; D86-R253 HydrophobicContact CB-CB 4.5Å; D86-R253 HydrophobicContact CB-CG 4.1Å; D86-R253 WeakPolarHBondContact OD1-CG 3.31Å; D86-R253 PolarHBondContact OD1-N 3.01Å
87	F	68.6	Low	69.4	Low	81 Å²	81	49.5 Å²	49.5	36%	0.355	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.8	23.5	-178.1	-58.5	-93.2	0	0	0	115	F250 I251 F818	F87-F250 HydrophobicContact CB-CE2 4.39Å; F87-F250 HydrophobicContact CB-CZ 3.83Å; F87-F250 AromaticContact CD1-CE1 3.83Å; F87-F250 HydrophobicContact CD1-CE1 3.83Å; F87-F250 AromaticContact CD1-CZ 3.72Å; F87-F250 HydrophobicContact CD1-CZ 3.72Å; F87-F250 HydrophobicContact CG-CZ 4.22Å; F87-F250 WeakPolarHBondContact O-CE2 3.5Å; F87-I251 WeakPolarHBondContact CA-O 3.43Å; F87-I251 PolarHBondContact N-O 3.09Å; F87-F818 HydrophobicContact CD1-CD1 4.4Å; F87-F818 HydrophobicContact CD1-CE1 4.2Å; F87-F818 HydrophobicContact CE1-CE1 4.39Å
88	N	76.8	Confident	70.9	Confident	39 Å²	39	48.3 Å²	48.3	21%	0.209	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-101.5	164.4	170.8	-88.2	-70.5	0	0	0	112	D86 I251	D86-N88 PolarHBondContact O-N 3.2Å; N88-I251 PolarHBondContact O-N 2.9Å
89	T	80	Confident	72.4	Confident	25 Å²	25	48.9 Å²	48.9	15%	0.153	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-99.2	141.4	172.9	43.8	0	0	0	0	111.2	G249 F250	T89-G249 CarbonylContact C-O 3.41Å; T89-G249 WeakPolarHBondContact CA-O 3.34Å; T89-F250 HydrophobicContact CG2-CD2 4.1Å
90	I	83.7	Confident	74.2	Confident	2 Å²	2	51.7 Å²	51.7	1%	0.01	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-71.5	158.3	172.6	66.1	164.4	0	0	0	111.6	Y84 W92 G249 I251 E306	Y84-I90 HydrophobicContact CD1-CG2 4.45Å; Y84-I90 HydrophobicContact CD2-CG2 3.87Å; Y84-I90 HydrophobicContact CE1-CB 4.25Å; Y84-I90 HydrophobicContact CE2-CB 4.17Å; Y84-I90 HydrophobicContact CE2-CG2 3.93Å; Y84-I90 HydrophobicContact CG-CG2 4.16Å; I90-W92 HydrophobicContact CD1-CD2 3.72Å; I90-W92 HydrophobicContact CD1-CE3 4.16Å; I90-W92 HydrophobicContact CD1-CG 4.1Å; I90-W92 HydrophobicContact CD1-CH2 4.38Å; I90-W92 HydrophobicContact CD1-CZ2 3.95Å; I90-W92 HydrophobicContact CD1-CZ3 4.46Å; I90-W92 HydrophobicContact CG1-CD2 4.37Å; I90-W92 HydrophobicContact CG1-CG 4.32Å; I90-G249 PolarHBondContact N-O 2.98Å; I90-I251 HydrophobicContact CG2-CD1 3.52Å; I90-I251 HydrophobicContact CG2-CG1 4.07Å; I90-E306 HydrophobicContact CG2-CB 4.08Å; I90-E306 HydrophobicContact CG2-CG 4.49Å
91	D	81.8	Confident	75.7	Confident	26 Å²	26	54.2 Å²	54.2	14%	0.139	26%	0.264	C	S	.	.			trans	-101.7	101.6	168.4	-172.2	-31.7	0	0	0	109.3	Y84 V93 R94 E95	Y84-D91 HydrophobicContact CE1-CB 4.43Å; Y84-D91 PolarHBondContact OH-N 3.14Å; D91-V93 VanDerWaalsContact C-N 3.25Å; D91-V93 PolarHBondContact O-N 3.28Å; D91-V93 WeakPolarHBondContact OD1-CB 3.39Å; D91-V93 PolarHBondContact OD1-N 3.42Å; D91-R94 HydrophobicContact CB-CB 3.91Å; D91-R94 PolarHBondContact O-N 2.92Å; D91-R94 PolarHBondContact OD1-N 2.93Å; D91-E95 WeakPolarHBondContact O-CG 3.39Å; D91-E95 PolarHBondContact O-N 2.9Å
92	W	82.7	Confident	77.1	Confident	34 Å²	34	55.9 Å²	55.9	13%	0.129	27%	0.266	C	S	.	.	H	α-helix	trans	-65.8	-26.8	-178.2	-69.3	86.2	0	0	0	113.2	I90 K96 L247 A307 R310 L779	I90-W92 HydrophobicContact CD1-CD2 3.72Å; I90-W92 HydrophobicContact CD1-CE3 4.16Å; I90-W92 HydrophobicContact CD1-CG 4.1Å; I90-W92 HydrophobicContact CD1-CH2 4.38Å; I90-W92 HydrophobicContact CD1-CZ2 3.95Å; I90-W92 HydrophobicContact CD1-CZ3 4.46Å; I90-W92 HydrophobicContact CG1-CD2 4.37Å; I90-W92 HydrophobicContact CG1-CG 4.32Å; W92-K96 VanDerWaalsContact O-CB 3.28Å; W92-K96 WeakPolarHBondContact O-CB 3.14Å; W92-K96 WeakPolarHBondContact O-CG 3.46Å; W92-K96 PolarHBondContact O-N 2.89Å; W92-K96 VanDerWaalsContact O-N 3.1Å; W92-L247 WeakPolarHBondContact CZ2-O 3.44Å; W92-A307 HydrophobicContact CE3-CB 3.89Å; W92-A307 HydrophobicContact CZ3-CB 4.03Å; W92-R310 HydrophobicContact CH2-CB 4.04Å; W92-R310 HydrophobicContact CH2-CG 4.46Å; W92-L779 WeakPolarHBondContact CB-O 3.23Å
93	V	82.4	Confident	78.5	Confident	71 Å²	71	60.7 Å²	60.7	43%	0.43	29%	0.286	S	S	.	.	H	α-helix	trans	-72.9	-47.7	178.5	-178.9	0	0	0	0	109.1	D91 E95 K96 S97 L781	D91-V93 VanDerWaalsContact C-N 3.25Å; D91-V93 PolarHBondContact O-N 3.28Å; D91-V93 WeakPolarHBondContact OD1-CB 3.39Å; D91-V93 PolarHBondContact OD1-N 3.42Å; V93-E95 PolarHBondContact O-N 2.98Å; V93-K96 PolarHBondContact O-N 3.28Å; V93-S97 PolarHBondContact O-N 3.19Å; V93-L781 HydrophobicContact CG2-CD2 3.82Å
94	R	81.5	Confident	79.8	Confident	83 Å²	83	66.2 Å²	66.2	31%	0.313	30%	0.3	S	S	.	.	H	α-helix	trans	-59.7	-46.7	176.1	-167.7	-179.5	-173.4	-171.8	5.5	112.3	D91 K96 S97 K98 L709 D712	D91-R94 HydrophobicContact CB-CB 3.91Å; D91-R94 PolarHBondContact O-N 2.92Å; D91-R94 PolarHBondContact OD1-N 2.93Å; R94-K96 PolarHBondContact O-N 3.04Å; R94-S97 PolarHBondContact O-N 2.89Å; R94-K98 WeakPolarHBondContact O-CB 3.43Å; R94-K98 PolarHBondContact O-N 2.85Å; R94-L709 VanDerWaalsContact NH1-CD1 3.31Å; R94-D712 IonicContact CZ-OD2 2.7Å; R94-D712 VanDerWaalsContact CZ-OD2 3.3Å; R94-D712 IonicContact NH1-OD2 3.92Å; R94-D712 PolarHBondContact NH1-OD2 3.37Å; R94-D712 IonicContact NH2-OD2 3.67Å; R94-D712 PolarHBondContact NH2-OD2 2.9Å
95	E	84.8	Confident	80.7	Confident	3 Å²	3	70.1 Å²	70.1	1%	0.014	32%	0.319	C	S	.	.	H	α-helix	trans	-65.5	-36.1	178.4	-64.8	-60.9	126.6	0	0	112.5	Y84 D91 V93 D99 N305 E306 A307	Y84-E95 HydrophobicContact CE2-CG 4.48Å; Y84-E95 WeakPolarHBondContact CE2-OE1 3.15Å; Y84-E95 PolarHBondContact OH-OE1 2.83Å; D91-E95 WeakPolarHBondContact O-CG 3.39Å; D91-E95 PolarHBondContact O-N 2.9Å; V93-E95 PolarHBondContact O-N 2.98Å; E95-D99 PolarHBondContact O-N 2.91Å; E95-D99 VanDerWaalsContact O-N 3.15Å; E95-N305 PolarHBondContact O-ND2 2.81Å; E95-N305 WeakPolarHBondContact OE2-CA 3.28Å; E95-N305 PolarHBondContact OE2-OD1 2.84Å; E95-E306 HydrophobicContact CG-CB 4.38Å; E95-E306 PolarHBondContact OE2-N 2.9Å; E95-A307 HydrophobicContact CB-CB 3.7Å; E95-A307 HydrophobicContact CG-CB 4.39Å
96	K	83.8	Confident	81.9	Confident	93 Å²	93	67.1 Å²	67.1	40%	0.404	31%	0.305	S	S	.	.	H	α-helix	trans	-69.4	-42.4	176.2	-78.5	174.9	-179.5	179.1	0	112.4	W92 V93 R94 D99 R100	W92-K96 VanDerWaalsContact O-CB 3.28Å; W92-K96 WeakPolarHBondContact O-CB 3.14Å; W92-K96 WeakPolarHBondContact O-CG 3.46Å; W92-K96 PolarHBondContact O-N 2.89Å; W92-K96 VanDerWaalsContact O-N 3.1Å; V93-K96 PolarHBondContact O-N 3.28Å; R94-K96 PolarHBondContact O-N 3.04Å; K96-D99 PolarHBondContact O-N 3.21Å; K96-R100 PolarHBondContact O-N 3.44Å; K96-R100 VanDerWaalsContact O-N 3.11Å
97	S	83.3	Confident	82.8	Confident	38 Å²	38	67.3 Å²	67.3	27%	0.266	31%	0.308	S	S	.	.	H	α-helix	trans	-62.4	-48.5	175.4	-162.2	0	0	0	0	110.5	V93 R94 D99 R100 D101	V93-S97 PolarHBondContact O-N 3.19Å; R94-S97 PolarHBondContact O-N 2.89Å; S97-D99 PolarHBondContact O-N 3.1Å; S97-D99 VanDerWaalsContact O-N 3.14Å; S97-R100 WeakPolarHBondContact O-CA 3.21Å; S97-R100 WeakPolarHBondContact O-CB 3.48Å; S97-R100 PolarHBondContact O-N 3.31Å; S97-R100 PolarHBondContact OG-NH2 3.26Å; S97-D101 VanDerWaalsContact C-OD2 3.29Å; S97-D101 PolarHBondContact O-N 2.99Å; S97-D101 PolarHBondContact OG-OD2 3.33Å
98	K	82.3	Confident	83.7	Confident	96 Å²	96	67.3 Å²	67.3	42%	0.417	31%	0.312	S	S	.	.	H	α-helix	trans	-56	-33.7	178.7	-168.9	-179	-174.2	-176.9	0	113.5	R94 R102	R94-K98 WeakPolarHBondContact O-CB 3.43Å; R94-K98 PolarHBondContact O-N 2.85Å; K98-R102 WeakPolarHBondContact O-CB 3.39Å; K98-R102 PolarHBondContact O-N 3.03Å
99	D	84.9	Confident	84	Confident	34 Å²	34	70.3 Å²	70.3	18%	0.182	32%	0.323	C	S	.	.	H	α-helix	trans	-71.1	-44.7	173.4	-151.6	56.2	0	0	0	112.2	E95 K96 S97 H103 N305 K308	E95-D99 PolarHBondContact O-N 2.91Å; E95-D99 VanDerWaalsContact O-N 3.15Å; K96-D99 PolarHBondContact O-N 3.21Å; S97-D99 PolarHBondContact O-N 3.1Å; S97-D99 VanDerWaalsContact O-N 3.14Å; D99-H103 WeakPolarHBondContact O-CB 3.38Å; D99-H103 PolarHBondContact O-N 3.48Å; D99-N305 WeakPolarHBondContact CB-ND2 3.3Å; D99-N305 PolarHBondContact OD1-ND2 3.11Å; D99-K308 WeakPolarHBondContact OD2-CE 3.45Å; D99-K308 IonicContact OD2-NZ 3.21Å
100	R	86.4	Confident	84.1	Confident	169 Å²	169	70 Å²	70	64%	0.638	32%	0.322	S	S	*	.	H	α-helix	trans	-61.9	-44.5	177.5	-179.7	179.6	63.2	-172.8	-4.5	111.8	K96 S97 H103 R104	K96-R100 PolarHBondContact O-N 3.44Å; K96-R100 VanDerWaalsContact O-N 3.11Å; S97-R100 WeakPolarHBondContact O-CA 3.21Å; S97-R100 WeakPolarHBondContact O-CB 3.48Å; S97-R100 PolarHBondContact O-N 3.31Å; S97-R100 PolarHBondContact OG-NH2 3.26Å; R100-H103 PolarHBondContact O-N 2.93Å; R100-R104 PolarHBondContact O-N 3.06Å
101	D	83.8	Confident	83.9	Confident	79 Å²	79	80.3 Å²	80.3	42%	0.422	36%	0.361	S	S	.	.	H	α-helix	trans	-66.9	-44.1	-178	-56.9	-33.2	0	0	0	110.2	S97 H103 R104 E105	S97-D101 VanDerWaalsContact C-OD2 3.29Å; S97-D101 PolarHBondContact O-N 2.99Å; S97-D101 PolarHBondContact OG-OD2 3.33Å; D101-H103 VanDerWaalsContact C-N 3.34Å; D101-H103 PolarHBondContact O-N 2.9Å; D101-R104 PolarHBondContact O-N 2.98Å; D101-E105 PolarHBondContact O-N 2.84Å
102	R	85.3	Confident	84	Confident	71 Å²	71	86.5 Å²	86.5	27%	0.268	39%	0.389	S	S	.	.	H	α-helix	trans	-59.4	-41.8	170.2	177.6	-178.1	179.1	-105.3	-7.2	112.4	K98 E105 I106 D123	K98-R102 WeakPolarHBondContact O-CB 3.39Å; K98-R102 PolarHBondContact O-N 3.03Å; R102-E105 PolarHBondContact O-N 2.97Å; R102-I106 HydrophobicContact CG-CD1 3.98Å; R102-I106 WeakPolarHBondContact O-CG1 3.29Å; R102-I106 PolarHBondContact O-N 3.21Å; R102-I106 VanDerWaalsContact O-N 3.09Å; R102-D123 IonicContact CZ-OD1 3.29Å; R102-D123 IonicContact NH1-OD1 2.8Å; R102-D123 PolarHBondContact NH1-OD1 2.87Å; R102-D123 IonicContact NH1-OD2 2.85Å; R102-D123 IonicContact NH2-OD1 3.32Å; R102-D123 PolarHBondContact NH2-OD1 3.27Å; R102-D123 IonicContact NH2-OD2 3.01Å
103	H	84.8	Confident	84.2	Confident	111 Å²	111	87.5 Å²	87.5	51%	0.514	40%	0.401	S	S	.	.	H	α-helix	trans	-66.3	-44.2	-179.3	-165.5	39.6	0	0	0	110.9	D99 R100 D101 E105 I106 T107	D99-H103 WeakPolarHBondContact O-CB 3.38Å; D99-H103 PolarHBondContact O-N 3.48Å; R100-H103 PolarHBondContact O-N 2.93Å; D101-H103 VanDerWaalsContact C-N 3.34Å; D101-H103 PolarHBondContact O-N 2.9Å; H103-E105 VanDerWaalsContact C-N 3.33Å; H103-E105 PolarHBondContact O-N 2.78Å; H103-I106 PolarHBondContact O-N 2.71Å; H103-T107 PolarHBondContact O-N 2.77Å; H103-T107 PolarHBondContact O-OG1 2.98Å; H103-T107 VanDerWaalsContact O-OG1 3.09Å
104	R	86.9	Confident	84.3	Confident	177 Å²	177	89.7 Å²	89.7	67%	0.668	42%	0.415	S	S	*	.	H	α-helix	trans	-57.9	-42.6	173.5	-173.4	-179.1	-177.2	-171.2	0.8	112.2	R100 D101 T107 N108	R100-R104 PolarHBondContact O-N 3.06Å; D101-R104 PolarHBondContact O-N 2.98Å; R104-T107 PolarHBondContact O-N 3.16Å; R104-N108 WeakPolarHBondContact O-CB 3.32Å; R104-N108 PolarHBondContact O-N 3.26Å
105	E	85.7	Confident	84.5	Confident	101 Å²	101	90.8 Å²	90.8	47%	0.472	43%	0.43	S	S	.	.	H	α-helix	trans	-61.2	-45	176.4	-164.6	-160.8	157.2	0	0	112	D101 R102 H103 K109	D101-E105 PolarHBondContact O-N 2.84Å; R102-E105 PolarHBondContact O-N 2.97Å; H103-E105 VanDerWaalsContact C-N 3.33Å; H103-E105 PolarHBondContact O-N 2.78Å; E105-K109 HydrophobicContact CG-CD 4.34Å; E105-K109 WeakPolarHBondContact O-CB 3.08Å; E105-K109 WeakPolarHBondContact O-CG 3.36Å; E105-K109 PolarHBondContact O-N 2.82Å; E105-K109 IonicContact OE1-NZ 3.74Å; E105-K109 PolarHBondContact OE1-NZ 2.7Å
106	I	84.6	Confident	84.4	Confident	23 Å²	23	91.8 Å²	91.8	12%	0.118	44%	0.439	C	S	.	.	H	α-helix	trans	-65.2	-44.9	177.4	-66.8	167.1	0	0	0	110.8	R102 H103 K109 S110	R102-I106 HydrophobicContact CG-CD1 3.98Å; R102-I106 WeakPolarHBondContact O-CG1 3.29Å; R102-I106 PolarHBondContact O-N 3.21Å; R102-I106 VanDerWaalsContact O-N 3.09Å; H103-I106 PolarHBondContact O-N 2.71Å; I106-K109 PolarHBondContact O-N 2.82Å; I106-S110 WeakPolarHBondContact O-CB 3.44Å; I106-S110 PolarHBondContact O-N 2.78Å; I106-S110 PolarHBondContact O-OG 3.28Å
107	T	84.9	Confident	84.4	Confident	57 Å²	57	91.9 Å²	91.9	35%	0.35	44%	0.444	S	S	.	.	H	α-helix	trans	-63.4	-43.3	179	-60.1	0	0	0	0	111.7	H103 R104 S110 R111	H103-T107 PolarHBondContact O-N 2.77Å; H103-T107 PolarHBondContact O-OG1 2.98Å; H103-T107 VanDerWaalsContact O-OG1 3.09Å; R104-T107 PolarHBondContact O-N 3.16Å; T107-S110 WeakPolarHBondContact CA-OG 3.35Å; T107-S110 PolarHBondContact O-N 3.44Å; T107-S110 PolarHBondContact O-OG 3.07Å; T107-R111 PolarHBondContact O-N 3.39Å
108	N	86.4	Confident	84.6	Confident	81 Å²	81	96 Å²	96	43%	0.433	46%	0.462	S	S	.	.	H	α-helix	trans	-59.7	-53.2	174.8	-76.7	3.4	0	0	0	111.1	R104 S110 R111	R104-N108 WeakPolarHBondContact O-CB 3.32Å; R104-N108 PolarHBondContact O-N 3.26Å; N108-S110 VanDerWaalsContact C-N 3.25Å; N108-S110 PolarHBondContact O-N 3.19Å; N108-R111 WeakPolarHBondContact O-CB 3.31Å; N108-R111 PolarHBondContact O-N 3.25Å; N108-R111 VanDerWaalsContact O-N 3.08Å
109	K	84.7	Confident	84.6	Confident	102 Å²	102	97 Å²	97	44%	0.443	47%	0.468	S	S	.	.	H	α-helix	trans	-61.3	-31.5	178.9	-72.6	175.4	175.4	175.4	0	113.1	E105 I106 R111 E112 S113 A116	E105-K109 HydrophobicContact CG-CD 4.34Å; E105-K109 WeakPolarHBondContact O-CB 3.08Å; E105-K109 WeakPolarHBondContact O-CG 3.36Å; E105-K109 PolarHBondContact O-N 2.82Å; E105-K109 IonicContact OE1-NZ 3.74Å; E105-K109 PolarHBondContact OE1-NZ 2.7Å; I106-K109 PolarHBondContact O-N 2.82Å; K109-R111 PolarHBondContact O-N 2.89Å; K109-E112 PolarHBondContact O-N 3.17Å; K109-E112 VanDerWaalsContact O-N 3.09Å; K109-S113 PolarHBondContact O-N 2.86Å; K109-A116 HydrophobicContact CB-CB 4.31Å; K109-A116 WeakPolarHBondContact O-CB 3.47Å
110	S	81.3	Confident	84.6	Confident	18 Å²	18	96.6 Å²	96.6	13%	0.126	47%	0.468	C	S	.	.	H	α-helix	trans	-66.6	-20.6	177.3	72.1	0	0	0	0	114.3	I106 T107 N108 E112	I106-S110 WeakPolarHBondContact O-CB 3.44Å; I106-S110 PolarHBondContact O-N 2.78Å; I106-S110 PolarHBondContact O-OG 3.28Å; T107-S110 WeakPolarHBondContact CA-OG 3.35Å; T107-S110 PolarHBondContact O-N 3.44Å; T107-S110 PolarHBondContact O-OG 3.07Å; N108-S110 VanDerWaalsContact C-N 3.25Å; N108-S110 PolarHBondContact O-N 3.19Å; S110-E112 VanDerWaalsContact C-N 3.35Å
111	R	80.6	Confident	84.6	Confident	220 Å²	220	92.8 Å²	92.8	83%	0.83	46%	0.463	S	S	*	.	H	α-helix	trans	-78.6	-19.1	172.2	-70.1	178.3	144.1	-173.8	-7.4	113.3	T107 N108 K109	T107-R111 PolarHBondContact O-N 3.39Å; N108-R111 WeakPolarHBondContact O-CB 3.31Å; N108-R111 PolarHBondContact O-N 3.25Å; N108-R111 VanDerWaalsContact O-N 3.08Å; K109-R111 PolarHBondContact O-N 2.89Å
112	E	83.4	Confident	84.7	Confident	155 Å²	155	92.6 Å²	92.6	72%	0.724	47%	0.468	S	S	*	.	H	α-helix	trans	-95.1	-22.9	-174.4	-63.2	167.4	171.8	0	0	112.6	K109 S110	K109-E112 PolarHBondContact O-N 3.17Å; K109-E112 VanDerWaalsContact O-N 3.09Å; S110-E112 VanDerWaalsContact C-N 3.35Å
113	S	86.6	Confident	84.8	Confident	56 Å²	56	90.1 Å²	90.1	39%	0.392	46%	0.46	S	S	.	.			trans	-151.9	138.5	-175.9	-176.7	0	0	0	0	114.1	K109 V115 A116 L117	K109-S113 PolarHBondContact O-N 2.86Å; S113-V115 VanDerWaalsContact C-N 3.25Å; S113-V115 PolarHBondContact O-N 3.1Å; S113-V115 PolarHBondContact OG-N 2.84Å; S113-A116 WeakPolarHBondContact O-CA 2.93Å; S113-A116 WeakPolarHBondContact O-CB 3.27Å; S113-A116 PolarHBondContact O-N 3.03Å; S113-L117 PolarHBondContact O-N 2.88Å
114	T	84.9	Confident	84.7	Confident	117 Å²	117	87.6 Å²	87.6	72%	0.718	46%	0.458	S	S	*	.	H	α-helix	trans	-61.9	-29.8	173.3	53.4	0	0	0	0	113.2	L117 L118	T114-L117 WeakPolarHBondContact O-CB 3.22Å; T114-L117 PolarHBondContact O-N 3.41Å; T114-L118 PolarHBondContact O-N 2.8Å
115	V	84.8	Confident	84.9	Confident	105 Å²	105	85 Å²	85	64%	0.636	45%	0.452	S	S	*	.	H	α-helix	trans	-70.3	-37.7	173.8	179.3	0	0	0	0	110.6	S113 L118 H119	S113-V115 VanDerWaalsContact C-N 3.25Å; S113-V115 PolarHBondContact O-N 3.1Å; S113-V115 PolarHBondContact OG-N 2.84Å; V115-L118 PolarHBondContact O-N 3.28Å; V115-H119 WeakPolarHBondContact O-CB 3.12Å; V115-H119 PolarHBondContact O-N 3.35Å
116	A	82.9	Confident	85.1	Confident	25 Å²	25	80.7 Å²	80.7	21%	0.207	43%	0.434	C	S	.	.	H	α-helix	trans	-70.9	-33.9	174.5	0	0	0	0	0	112	K109 S113 H119 S120	K109-A116 HydrophobicContact CB-CB 4.31Å; K109-A116 WeakPolarHBondContact O-CB 3.47Å; S113-A116 WeakPolarHBondContact O-CA 2.93Å; S113-A116 WeakPolarHBondContact O-CB 3.27Å; S113-A116 PolarHBondContact O-N 3.03Å; A116-H119 PolarHBondContact O-N 2.95Å; A116-S120 WeakPolarHBondContact O-CB 3.34Å; A116-S120 PolarHBondContact O-N 2.83Å
117	L	84.7	Confident	85.4	Confident	94 Å²	94	79.6 Å²	79.6	49%	0.492	43%	0.428	S	S	.	.	H	α-helix	trans	-60	-49.5	169.5	-172.9	70.3	0	0	0	111.4	S113 T114 H119 S120 V121	S113-L117 PolarHBondContact O-N 2.88Å; T114-L117 WeakPolarHBondContact O-CB 3.22Å; T114-L117 PolarHBondContact O-N 3.41Å; L117-H119 VanDerWaalsContact C-N 3.29Å; L117-H119 PolarHBondContact O-N 3.34Å; L117-S120 WeakPolarHBondContact O-CA 3.49Å; L117-S120 WeakPolarHBondContact O-CB 3.25Å; L117-S120 PolarHBondContact O-N 2.87Å; L117-V121 WeakPolarHBondContact O-CG2 3.36Å; L117-V121 PolarHBondContact O-N 3.01Å
118	L	85.9	Confident	85.9	Confident	126 Å²	126	81.7 Å²	81.7	66%	0.66	43%	0.429	S	S	*	.	H	α-helix	trans	-60.1	-38.8	176	-175.3	65.3	0	0	0	112.1	T114 V115 S122	T114-L118 PolarHBondContact O-N 2.8Å; V115-L118 PolarHBondContact O-N 3.28Å; L118-S122 WeakPolarHBondContact O-CB 3.42Å; L118-S122 PolarHBondContact O-N 2.89Å
119	H	84	Confident	86.3	Confident	117 Å²	117	80.8 Å²	80.8	54%	0.542	42%	0.424	S	S	.	.	H	α-helix	trans	-67	-34.8	174.4	-168.8	-70.5	0	0	0	112.5	V115 A116 L117 S122 D123	V115-H119 WeakPolarHBondContact O-CB 3.12Å; V115-H119 PolarHBondContact O-N 3.35Å; A116-H119 PolarHBondContact O-N 2.95Å; L117-H119 VanDerWaalsContact C-N 3.29Å; L117-H119 PolarHBondContact O-N 3.34Å; H119-S122 PolarHBondContact O-N 2.83Å; H119-D123 PolarHBondContact O-N 2.93Å
120	S	84.3	Confident	86.8	Confident	25 Å²	25	76 Å²	76	18%	0.175	40%	0.403	C	S	.	.	H	α-helix	trans	-65.1	-48.5	174.4	-169.4	0	0	0	0	111.5	A116 L117 S122 D123 A124	A116-S120 WeakPolarHBondContact O-CB 3.34Å; A116-S120 PolarHBondContact O-N 2.83Å; L117-S120 WeakPolarHBondContact O-CA 3.49Å; L117-S120 WeakPolarHBondContact O-CB 3.25Å; L117-S120 PolarHBondContact O-N 2.87Å; S120-S122 VanDerWaalsContact C-N 3.31Å; S120-S122 PolarHBondContact O-N 2.91Å; S120-D123 PolarHBondContact O-N 2.87Å; S120-D123 VanDerWaalsContact O-N 3.15Å; S120-A124 PolarHBondContact O-N 2.81Å
121	V	85.9	Confident	87.5	Confident	89 Å²	89	75.2 Å²	75.2	54%	0.539	40%	0.398	S	S	.	.	H	α-helix	trans	-59.2	-42.3	174.6	175.3	0	0	0	0	111.1	L117 A124 F125	L117-V121 WeakPolarHBondContact O-CG2 3.36Å; L117-V121 PolarHBondContact O-N 3.01Å; V121-A124 WeakPolarHBondContact O-CB 3.1Å; V121-A124 PolarHBondContact O-N 3.39Å; V121-F125 WeakPolarHBondContact O-CB 3.46Å; V121-F125 PolarHBondContact O-N 2.91Å
122	S	86.4	Confident	88.3	Confident	75 Å²	75	67.7 Å²	67.7	52%	0.524	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-42.2	174.8	-173.1	0	0	0	0	112.8	L118 H119 S120 A124 F125 S126	L118-S122 WeakPolarHBondContact O-CB 3.42Å; L118-S122 PolarHBondContact O-N 2.89Å; H119-S122 PolarHBondContact O-N 2.83Å; S120-S122 VanDerWaalsContact C-N 3.31Å; S120-S122 PolarHBondContact O-N 2.91Å; S122-A124 VanDerWaalsContact C-N 3.32Å; S122-A124 PolarHBondContact O-N 3.26Å; S122-F125 PolarHBondContact O-N 2.89Å; S122-S126 WeakPolarHBondContact O-CB 3.29Å; S122-S126 PolarHBondContact O-N 3.34Å
123	D	86	Confident	88.9	Confident	18 Å²	18	63.3 Å²	63.3	10%	0.096	36%	0.355	C	S	.	.	H	α-helix	trans	-67.2	-32	176.4	-165.8	83.5	0	0	0	112.3	R102 H119 S120 S126 K301	R102-D123 IonicContact CZ-OD1 3.29Å; R102-D123 IonicContact NH1-OD1 2.8Å; R102-D123 PolarHBondContact NH1-OD1 2.87Å; R102-D123 IonicContact NH1-OD2 2.85Å; R102-D123 IonicContact NH2-OD1 3.32Å; R102-D123 PolarHBondContact NH2-OD1 3.27Å; R102-D123 IonicContact NH2-OD2 3.01Å; H119-D123 PolarHBondContact O-N 2.93Å; S120-D123 PolarHBondContact O-N 2.87Å; S120-D123 VanDerWaalsContact O-N 3.15Å; D123-S126 PolarHBondContact O-OG 3.02Å; D123-K301 PolarHBondContact O-NZ 2.79Å; D123-K301 WeakPolarHBondContact OD2-CE 3.32Å; D123-K301 IonicContact OD2-NZ 2.99Å; D123-K301 PolarHBondContact OD2-NZ 3.25Å
124	A	84.6	Confident	89.4	Confident	58 Å²	58	60.7 Å²	60.7	48%	0.479	34%	0.336	S	S	.	.	H	α-helix	trans	-68.2	-49.8	171.8	0	0	0	0	0	112.1	S120 V121 S122 S126	S120-A124 PolarHBondContact O-N 2.81Å; V121-A124 WeakPolarHBondContact O-CB 3.1Å; V121-A124 PolarHBondContact O-N 3.39Å; S122-A124 VanDerWaalsContact C-N 3.32Å; S122-A124 PolarHBondContact O-N 3.26Å; A124-S126 VanDerWaalsContact C-N 3.32Å; A124-S126 PolarHBondContact O-N 3.46Å
125	F	90.1	Very high	90	Very high	122 Å²	122	55.1 Å²	55.1	54%	0.535	30%	0.302	S	S	.	.	H	α-helix	trans	-67.7	-28.5	179.4	-173.1	-106.2	0	0	0	113.4	V121 S122 G127 W128 L129	V121-F125 WeakPolarHBondContact O-CB 3.46Å; V121-F125 PolarHBondContact O-N 2.91Å; S122-F125 PolarHBondContact O-N 2.89Å; F125-G127 PolarHBondContact O-N 3.47Å; F125-W128 HydrophobicContact CD2-CB 4.41Å; F125-W128 HydrophobicContact CE2-CB 4.37Å; F125-W128 PolarHBondContact O-N 3.12Å; F125-L129 HydrophobicContact CD1-CB 4.19Å; F125-L129 HydrophobicContact CE1-CB 3.93Å; F125-L129 PolarHBondContact O-N 3.13Å; F125-L129 VanDerWaalsContact O-N 3.09Å
126	S	90.4	Very high	90.6	Very high	12 Å²	12	53.7 Å²	53.7	8%	0.084	29%	0.291	C	S	.	.	H	α-helix	trans	-51	-31.6	-177.9	70.8	0	0	0	0	114.3	S122 D123 A124 L130	S122-S126 WeakPolarHBondContact O-CB 3.29Å; S122-S126 PolarHBondContact O-N 3.34Å; D123-S126 PolarHBondContact O-OG 3.02Å; A124-S126 VanDerWaalsContact C-N 3.32Å; A124-S126 PolarHBondContact O-N 3.46Å; S126-L130 VanDerWaalsContact O-CB 3.28Å; S126-L130 WeakPolarHBondContact O-CB 3.45Å; S126-L130 PolarHBondContact O-N 2.88Å
127	G	90.8	Very high	91.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-68.9	-41	176.3	0	0	0	0	0	113.4	F125 L130 M131 Y302	F125-G127 PolarHBondContact O-N 3.47Å; G127-L130 PolarHBondContact O-N 3.44Å; G127-M131 WeakPolarHBondContact O-CG 3.35Å; G127-M131 PolarHBondContact O-N 2.98Å; G127-Y302 WeakPolarHBondContact CA-OH 3.45Å
128	W	94.3	Very high	91.9	Very high	100 Å²	100	50.9 Å²	50.9	38%	0.379	27%	0.273	S	S	.	.	H	α-helix	trans	-70.5	-41.6	177.2	-66.7	102.3	0	0	0	111.4	F125 L130 M131 L132 W349 F353	F125-W128 HydrophobicContact CD2-CB 4.41Å; F125-W128 HydrophobicContact CE2-CB 4.37Å; F125-W128 PolarHBondContact O-N 3.12Å; W128-L130 VanDerWaalsContact C-N 3.34Å; W128-L130 PolarHBondContact O-N 3.3Å; W128-M131 PolarHBondContact O-N 3.36Å; W128-L132 PolarHBondContact O-N 2.62Å; W128-W349 HydrophobicContact CH2-CB 4.43Å; W128-F353 HydrophobicContact CE3-CB 4.25Å; W128-F353 AromaticContact CE3-CD1 3.76Å; W128-F353 HydrophobicContact CE3-CD1 3.76Å; W128-F353 HydrophobicContact CE3-CE1 4.22Å; W128-F353 AromaticContact CE3-CG 3.92Å; W128-F353 HydrophobicContact CE3-CG 3.92Å; W128-F353 HydrophobicContact CZ3-CB 3.7Å; W128-F353 HydrophobicContact CZ3-CD1 4.1Å; W128-F353 HydrophobicContact CZ3-CD2 4.34Å; W128-F353 AromaticContact CZ3-CG 3.79Å; W128-F353 HydrophobicContact CZ3-CG 3.79Å
129	L	95.1	Very high	92.3	Very high	63 Å²	63	44.9 Å²	44.9	33%	0.33	24%	0.241	S	C	.	.	H	α-helix	trans	-60.9	-41.9	173.5	-177.8	60.9	0	0	0	112	F125 L132 L133 F299	F125-L129 HydrophobicContact CD1-CB 4.19Å; F125-L129 HydrophobicContact CE1-CB 3.93Å; F125-L129 PolarHBondContact O-N 3.13Å; F125-L129 VanDerWaalsContact O-N 3.09Å; L129-L132 HydrophobicContact CD1-CD2 4.43Å; L129-L132 PolarHBondContact O-N 3.18Å; L129-L133 HydrophobicContact CG-CD1 4.47Å; L129-L133 WeakPolarHBondContact O-CG 3.3Å; L129-L133 PolarHBondContact O-N 3.25Å; L129-L133 VanDerWaalsContact O-N 3.09Å; L129-F299 HydrophobicContact CD2-CE1 4.29Å; L129-F299 HydrophobicContact CD2-CZ 4.11Å; L129-F299 HydrophobicContact CG-CZ 4.21Å
130	L	95.8	Very high	92.9	Very high	0 Å²	0	42 Å²	42	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.8	-44.2	174.2	177.1	56.6	0	0	0	111.6	S126 G127 W128 L132 L133 V134 L295 F299 Y302 V312	S126-L130 VanDerWaalsContact O-CB 3.28Å; S126-L130 WeakPolarHBondContact O-CB 3.45Å; S126-L130 PolarHBondContact O-N 2.88Å; G127-L130 PolarHBondContact O-N 3.44Å; W128-L130 VanDerWaalsContact C-N 3.34Å; W128-L130 PolarHBondContact O-N 3.3Å; L130-L132 PolarHBondContact O-N 2.78Å; L130-L133 PolarHBondContact O-N 3.22Å; L130-V134 HydrophobicContact CD1-CG2 4.21Å; L130-V134 VanDerWaalsContact O-CG2 3.28Å; L130-V134 WeakPolarHBondContact O-CG2 3.16Å; L130-V134 PolarHBondContact O-N 3.19Å; L130-L295 HydrophobicContact CD1-CB 3.56Å; L130-F299 HydrophobicContact CB-CD2 4.23Å; L130-F299 HydrophobicContact CB-CE2 3.96Å; L130-F299 HydrophobicContact CB-CZ 4.41Å; L130-F299 HydrophobicContact CD1-CD2 3.91Å; L130-F299 HydrophobicContact CD1-CE2 3.88Å; L130-F299 HydrophobicContact CD2-CD2 4.31Å; L130-F299 HydrophobicContact CG-CD2 4.38Å; L130-F299 HydrophobicContact CG-CE2 4.41Å; L130-Y302 HydrophobicContact CD2-CD1 4.27Å; L130-Y302 HydrophobicContact CD2-CD2 3.46Å; L130-Y302 VanDerWaalsContact CD2-CD2 3.46Å; L130-Y302 HydrophobicContact CD2-CE1 4.47Å; L130-Y302 HydrophobicContact CD2-CE2 3.71Å; L130-Y302 HydrophobicContact CD2-CG 3.78Å; L130-V312 HydrophobicContact CD2-CG1 4.1Å; L130-V312 HydrophobicContact CD2-CG2 3.84Å; L130-V312 HydrophobicContact CG-CG1 4.44Å
131	M	96.1	Very high	93.5	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.015	24%	0.239	C	C	.	.	H	α-helix	trans	-60.3	-42.6	175.5	-72.2	-53.5	112.7	0	0	112.8	G127 W128 V134 G135 V312 A315 R350 F353 A354	G127-M131 WeakPolarHBondContact O-CG 3.35Å; G127-M131 PolarHBondContact O-N 2.98Å; W128-M131 PolarHBondContact O-N 3.36Å; M131-V134 PolarHBondContact O-N 3.08Å; M131-G135 PolarHBondContact O-N 3.46Å; M131-V312 HydrophobicContact CE-CB 4.12Å; M131-V312 HydrophobicContact CE-CG1 3.82Å; M131-V312 HydrophobicContact CE-CG2 3.77Å; M131-A315 HydrophobicContact CE-CB 4.27Å; M131-A315 HydrophobicContact SD-CB 3.7Å; M131-R350 HydrophobicContact CG-CB 3.83Å; M131-R350 HydrophobicContact CG-CG 4.25Å; M131-R350 HydrophobicContact SD-CB 4.18Å; M131-F353 HydrophobicContact CB-CD1 4.02Å; M131-F353 HydrophobicContact CB-CE1 4.41Å; M131-A354 HydrophobicContact CB-CB 3.98Å; M131-A354 HydrophobicContact CG-CB 4.33Å; M131-A354 HydrophobicContact SD-CB 3.92Å
132	L	97.1	Very high	93.9	Very high	62 Å²	62	39.1 Å²	39.1	33%	0.325	21%	0.213	S	C	.	.	H	α-helix	trans	-57.9	-49.8	175.7	179.4	70.5	0	0	0	111	W128 L129 L130 V134 G135 L136 F353 V357	W128-L132 PolarHBondContact O-N 2.62Å; L129-L132 HydrophobicContact CD1-CD2 4.43Å; L129-L132 PolarHBondContact O-N 3.18Å; L130-L132 PolarHBondContact O-N 2.78Å; L132-V134 VanDerWaalsContact C-N 3.34Å; L132-V134 PolarHBondContact O-N 3.38Å; L132-G135 PolarHBondContact O-N 3.24Å; L132-L136 HydrophobicContact CD1-CD1 4.33Å; L132-L136 HydrophobicContact CG-CD1 4.08Å; L132-L136 VanDerWaalsContact O-CG 3.31Å; L132-L136 WeakPolarHBondContact O-CG 3.44Å; L132-L136 PolarHBondContact O-N 3.14Å; L132-F353 HydrophobicContact CB-CE1 4.17Å; L132-F353 HydrophobicContact CD1-CZ 4.33Å; L132-V357 HydrophobicContact CD1-CG1 3.96Å; L132-V357 HydrophobicContact CD1-CG2 3.93Å
133	L	97.3	Very high	94.2	Very high	62 Å²	62	35.6 Å²	35.6	33%	0.325	19%	0.189	S	C	.	.	H	α-helix	trans	-63.3	-37.9	178.3	-67.9	171.5	0	0	0	112.4	L129 L130 M137 L295 F299	L129-L133 HydrophobicContact CG-CD1 4.47Å; L129-L133 WeakPolarHBondContact O-CG 3.3Å; L129-L133 PolarHBondContact O-N 3.25Å; L129-L133 VanDerWaalsContact O-N 3.09Å; L130-L133 PolarHBondContact O-N 3.22Å; L133-M137 VanDerWaalsContact O-CB 3.28Å; L133-M137 WeakPolarHBondContact O-CB 3.47Å; L133-M137 PolarHBondContact O-N 2.75Å; L133-L295 HydrophobicContact CB-CD1 3.91Å; L133-L295 HydrophobicContact CB-CD2 4.3Å; L133-F299 HydrophobicContact CD1-CE2 4.32Å; L133-F299 HydrophobicContact CD1-CZ 4.4Å
134	V	97.1	Very high	94.6	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-63.2	-47.1	174.7	170.5	0	0	0	0	110.9	L130 M131 L132 M137 A138 A292 L295 A316 V319	L130-V134 HydrophobicContact CD1-CG2 4.21Å; L130-V134 VanDerWaalsContact O-CG2 3.28Å; L130-V134 WeakPolarHBondContact O-CG2 3.16Å; L130-V134 PolarHBondContact O-N 3.19Å; M131-V134 PolarHBondContact O-N 3.08Å; L132-V134 VanDerWaalsContact C-N 3.34Å; L132-V134 PolarHBondContact O-N 3.38Å; V134-M137 PolarHBondContact O-N 3.18Å; V134-A138 WeakPolarHBondContact O-CB 3.16Å; V134-A138 PolarHBondContact O-N 3.01Å; V134-A292 HydrophobicContact CG1-CB 4.04Å; V134-A292 HydrophobicContact CG2-CB 3.7Å; V134-L295 HydrophobicContact CB-CD1 4.35Å; V134-L295 HydrophobicContact CG2-CD1 3.68Å; V134-A316 HydrophobicContact CG1-CB 4.22Å; V134-V319 HydrophobicContact CG1-CG2 4.44Å
135	G	97.3	Very high	95.1	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-61.6	-48.8	179.6	0	0	0	0	0	112.5	M131 L132 M137 G139 A358	M131-G135 PolarHBondContact O-N 3.46Å; L132-G135 PolarHBondContact O-N 3.24Å; G135-M137 PolarHBondContact O-N 2.74Å; G135-G139 PolarHBondContact O-N 2.97Å; G135-A358 WeakPolarHBondContact O-CA 3.41Å; G135-A358 WeakPolarHBondContact O-CB 3.49Å
136	L	97.6	Very high	95.2	Very high	75 Å²	75	28.3 Å²	28.3	39%	0.393	16%	0.157	S	C	.	.	H	α-helix	trans	-60.1	-45.6	177.4	-68.1	170.2	0	0	0	112	L132 S140 V357	L132-L136 HydrophobicContact CD1-CD1 4.33Å; L132-L136 HydrophobicContact CG-CD1 4.08Å; L132-L136 VanDerWaalsContact O-CG 3.31Å; L132-L136 WeakPolarHBondContact O-CG 3.44Å; L132-L136 PolarHBondContact O-N 3.14Å; L136-S140 WeakPolarHBondContact O-CB 3.48Å; L136-S140 PolarHBondContact O-N 3.2Å; L136-S140 VanDerWaalsContact O-N 3.11Å; L136-S140 PolarHBondContact O-OG 3.38Å; L136-V357 HydrophobicContact CD2-CG1 4.09Å; L136-V357 HydrophobicContact CG-CG1 3.94Å
137	M	96.8	Very high	95.2	Very high	56 Å²	56	31.7 Å²	31.7	28%	0.276	17%	0.173	S	C	.	.	H	α-helix	trans	-73.7	-37.1	-177.3	-165.5	166.1	78.1	0	0	112.7	L133 V134 G135 S140 L141 C291 L295	L133-M137 VanDerWaalsContact O-CB 3.28Å; L133-M137 WeakPolarHBondContact O-CB 3.47Å; L133-M137 PolarHBondContact O-N 2.75Å; V134-M137 PolarHBondContact O-N 3.18Å; G135-M137 PolarHBondContact O-N 2.74Å; M137-S140 PolarHBondContact O-OG 2.96Å; M137-L141 HydrophobicContact CG-CD1 4.23Å; M137-L141 WeakPolarHBondContact O-CB 3.38Å; M137-L141 WeakPolarHBondContact O-CD1 3.48Å; M137-L141 VanDerWaalsContact O-CG 3.31Å; M137-L141 WeakPolarHBondContact O-CG 3.47Å; M137-L141 PolarHBondContact O-N 3.48Å; M137-C291 VanDerWaalsContact CE-CA 3.45Å; M137-C291 HydrophobicContact CE-CB 3.4Å; M137-C291 VanDerWaalsContact CE-CB 3.4Å; M137-C291 WeakPolarHBondContact CE-O 3.3Å; M137-L295 HydrophobicContact CB-CD1 4.5Å; M137-L295 HydrophobicContact CE-CD1 3.73Å; M137-L295 HydrophobicContact CE-CD2 4.32Å; M137-L295 HydrophobicContact CE-CG 3.76Å; M137-L295 HydrophobicContact SD-CD1 4.46Å
138	A	96.5	Very high	95.3	Very high	5 Å²	5	32.9 Å²	32.9	4%	0.041	18%	0.183	C	C	.	.	H	α-helix	trans	-71.8	-43.4	176.4	0	0	0	0	0	112.1	V134 L141 A142 A288 V319	V134-A138 WeakPolarHBondContact O-CB 3.16Å; V134-A138 PolarHBondContact O-N 3.01Å; A138-L141 PolarHBondContact O-N 3.24Å; A138-A142 WeakPolarHBondContact O-CB 3.3Å; A138-A142 PolarHBondContact O-N 3.5Å; A138-A288 HydrophobicContact CB-CB 4.19Å; A138-V319 HydrophobicContact CB-CG1 3.54Å
139	G	95.9	Very high	95.2	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64	-40.8	178.1	0	0	0	0	0	113.2	G135 A142 G143	G135-G139 PolarHBondContact O-N 2.97Å; G139-A142 PolarHBondContact O-N 3.29Å; G139-G143 PolarHBondContact O-N 3.39Å
140	S	95.8	Very high	94.8	Very high	55 Å²	55	26.5 Å²	26.5	39%	0.385	16%	0.156	S	C	.	.	H	α-helix	trans	-68.1	-39.7	175.7	52.6	0	0	0	0	113.4	L136 M137 G144	L136-S140 WeakPolarHBondContact O-CB 3.48Å; L136-S140 PolarHBondContact O-N 3.2Å; L136-S140 VanDerWaalsContact O-N 3.11Å; L136-S140 PolarHBondContact O-OG 3.38Å; M137-S140 PolarHBondContact O-OG 2.96Å; S140-G144 PolarHBondContact O-N 2.92Å
141	L	96.1	Very high	94.5	Very high	54 Å²	54	28.6 Å²	28.6	28%	0.283	17%	0.165	S	C	.	.	H	α-helix	trans	-67.8	-37.5	174	-74.3	169.9	0	0	0	112.6	M137 A138 G144 I145 L261 C291	M137-L141 HydrophobicContact CG-CD1 4.23Å; M137-L141 WeakPolarHBondContact O-CB 3.38Å; M137-L141 WeakPolarHBondContact O-CD1 3.48Å; M137-L141 VanDerWaalsContact O-CG 3.31Å; M137-L141 WeakPolarHBondContact O-CG 3.47Å; M137-L141 PolarHBondContact O-N 3.48Å; A138-L141 PolarHBondContact O-N 3.24Å; L141-G144 PolarHBondContact O-N 3.18Å; L141-I145 WeakPolarHBondContact O-CB 3.4Å; L141-I145 WeakPolarHBondContact O-CD1 3.25Å; L141-I145 VanDerWaalsContact O-CG1 3.25Å; L141-I145 WeakPolarHBondContact O-CG1 3.42Å; L141-I145 PolarHBondContact O-N 2.9Å; L141-L261 HydrophobicContact CD1-CD1 4.46Å; L141-C291 WeakPolarHBondContact CD1-SG 3.39Å
142	A	95.1	Very high	94.3	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-64	-48.8	174.8	0	0	0	0	0	111.7	A138 G139 G144 I145 D146 L284 V323	A138-A142 WeakPolarHBondContact O-CB 3.3Å; A138-A142 PolarHBondContact O-N 3.5Å; G139-A142 PolarHBondContact O-N 3.29Å; A142-G144 VanDerWaalsContact C-N 3.29Å; A142-G144 PolarHBondContact O-N 2.71Å; A142-I145 WeakPolarHBondContact O-CB 3.34Å; A142-I145 PolarHBondContact O-N 3.24Å; A142-I145 VanDerWaalsContact O-N 3.09Å; A142-D146 PolarHBondContact O-N 2.94Å; A142-L284 HydrophobicContact CB-CD2 4.22Å; A142-V323 HydrophobicContact CB-CB 3.75Å; A142-V323 HydrophobicContact CB-CG1 4.48Å; A142-V323 HydrophobicContact CB-CG2 3.62Å
143	G	93.4	Very high	94	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.1	-39	175.6	0	0	0	0	0	113	G139 D146 I147	G139-G143 PolarHBondContact O-N 3.39Å; G143-D146 PolarHBondContact O-N 2.96Å; G143-I147 WeakPolarHBondContact O-CG1 3.01Å; G143-I147 PolarHBondContact O-N 3.22Å; G143-I147 VanDerWaalsContact O-N 3.07Å
144	G	94.4	Very high	93.7	Very high	40 Å²	40	25.7 Å²	25.7	41%	0.412	15%	0.15	S	C	.	.	H	α-helix	trans	-66.7	-36.5	173.8	0	0	0	0	0	114	S140 L141 A142 A148	S140-G144 PolarHBondContact O-N 2.92Å; L141-G144 PolarHBondContact O-N 3.18Å; A142-G144 VanDerWaalsContact C-N 3.29Å; A142-G144 PolarHBondContact O-N 2.71Å; G144-A148 VanDerWaalsContact O-CB 3.23Å; G144-A148 WeakPolarHBondContact O-CB 3.26Å; G144-A148 PolarHBondContact O-N 2.82Å
145	I	94.8	Very high	93.3	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.01	15%	0.152	C	C	.	.	H	α-helix	trans	-64.2	-44.6	173.1	-75.1	161.8	0	0	0	110.3	L141 A142 A148 A149 T265 L268 V269 K280 L284	L141-I145 WeakPolarHBondContact O-CB 3.4Å; L141-I145 WeakPolarHBondContact O-CD1 3.25Å; L141-I145 VanDerWaalsContact O-CG1 3.25Å; L141-I145 WeakPolarHBondContact O-CG1 3.42Å; L141-I145 PolarHBondContact O-N 2.9Å; A142-I145 WeakPolarHBondContact O-CB 3.34Å; A142-I145 PolarHBondContact O-N 3.24Å; A142-I145 VanDerWaalsContact O-N 3.09Å; I145-A148 PolarHBondContact O-N 2.92Å; I145-A149 WeakPolarHBondContact O-CB 3.41Å; I145-A149 PolarHBondContact O-N 3.06Å; I145-T265 HydrophobicContact CD1-CG2 4.05Å; I145-T265 HydrophobicContact CG1-CG2 3.87Å; I145-L268 HydrophobicContact CD1-CD2 4.4Å; I145-L268 HydrophobicContact CG2-CD2 4.28Å; I145-V269 HydrophobicContact CG1-CG2 4.44Å; I145-V269 HydrophobicContact CG2-CG2 4.43Å; I145-K280 HydrophobicContact CG2-CD 4.36Å; I145-L284 HydrophobicContact CD1-CD2 3.55Å
146	D	91.3	Very high	93	Very high	3 Å²	3	26.4 Å²	26.4	2%	0.016	15%	0.153	C	C	.	.	H	α-helix	trans	-67.9	-48.7	-175.4	-73.2	10.7	0	0	0	111.6	A142 G143 A148 A149 H150 K280 P367 F368	A142-D146 PolarHBondContact O-N 2.94Å; G143-D146 PolarHBondContact O-N 2.96Å; D146-A148 VanDerWaalsContact C-N 3.34Å; D146-A148 PolarHBondContact O-N 2.78Å; D146-A149 PolarHBondContact O-N 3.38Å; D146-H150 PolarHBondContact O-CD2 3.24Å; D146-H150 PolarHBondContact O-N 3.48Å; D146-K280 WeakPolarHBondContact OD1-CD 3.32Å; D146-K280 WeakPolarHBondContact OD1-CE 3.46Å; D146-K280 IonicContact OD1-NZ 3.91Å; D146-K280 PolarHBondContact OD1-NZ 3.3Å; D146-K280 IonicContact OD2-NZ 3.45Å; D146-K280 PolarHBondContact OD2-NZ 3.44Å; D146-P367 HydrophobicContact CB-CB 4.22Å; D146-F368 HydrophobicContact CB-CZ 4.43Å
147	I	90.8	Very high	92.4	Very high	83 Å²	83	26.2 Å²	26.2	43%	0.426	15%	0.15	S	C	.	.	H	α-helix	trans	-57.8	-47	175.7	-66.2	166.3	0	0	0	110.7	G143 A149 W151 I365 P367	G143-I147 WeakPolarHBondContact O-CG1 3.01Å; G143-I147 PolarHBondContact O-N 3.22Å; G143-I147 VanDerWaalsContact O-N 3.07Å; I147-A149 PolarHBondContact O-N 2.91Å; I147-W151 WeakPolarHBondContact O-CB 3.43Å; I147-W151 PolarHBondContact O-N 3Å; I147-W151 VanDerWaalsContact O-N 3.16Å; I147-I365 HydrophobicContact CD1-CG2 3.9Å; I147-P367 HydrophobicContact CD1-CB 4.25Å; I147-P367 HydrophobicContact CG1-CB 3.7Å
148	A	93.1	Very high	92	Very high	26 Å²	26	23.6 Å²	23.6	22%	0.215	14%	0.137	C	C	.	.	H	α-helix	trans	-68.3	-33.6	-179.8	0	0	0	0	0	112.7	G144 I145 D146 M152 V269	G144-A148 VanDerWaalsContact O-CB 3.23Å; G144-A148 WeakPolarHBondContact O-CB 3.26Å; G144-A148 PolarHBondContact O-N 2.82Å; I145-A148 PolarHBondContact O-N 2.92Å; D146-A148 VanDerWaalsContact C-N 3.34Å; D146-A148 PolarHBondContact O-N 2.78Å; A148-M152 HydrophobicContact CB-CE 4.16Å; A148-M152 WeakPolarHBondContact O-CB 3.26Å; A148-M152 PolarHBondContact O-N 3.09Å; A148-V269 VanDerWaalsContact C-CG1 3.43Å; A148-V269 HydrophobicContact CB-CG1 3.86Å; A148-V269 HydrophobicContact CB-CG2 4.44Å
149	A	91.9	Very high	91.6	Very high	6 Å²	6	24.4 Å²	24.4	5%	0.05	14%	0.141	C	C	.	.	H	α-helix	trans	-69.7	-43.8	-179.9	0	0	0	0	0	112	I145 D146 I147 T153 V269 S273	I145-A149 WeakPolarHBondContact O-CB 3.41Å; I145-A149 PolarHBondContact O-N 3.06Å; D146-A149 PolarHBondContact O-N 3.38Å; I147-A149 PolarHBondContact O-N 2.91Å; A149-T153 VanDerWaalsContact O-CB 3.3Å; A149-T153 WeakPolarHBondContact O-CB 3.33Å; A149-T153 PolarHBondContact O-N 3.01Å; A149-T153 PolarHBondContact O-OG1 3.31Å; A149-V269 HydrophobicContact CB-CG1 3.87Å; A149-V269 VanDerWaalsContact N-CG1 3.32Å; A149-S273 PolarHBondContact O-OG 2.81Å
150	H	87.5	Confident	91.1	Very high	22 Å²	22	24.5 Å²	24.5	10%	0.102	14%	0.142	C	C	.	.	H	α-helix	trans	-62.9	-54.2	174.5	-83.2	-76.7	0	0	0	110.7	D146 M152 T153 D154 F368 E453	D146-H150 PolarHBondContact O-CD2 3.24Å; D146-H150 PolarHBondContact O-N 3.48Å; H150-M152 PolarHBondContact O-N 2.6Å; H150-T153 WeakPolarHBondContact O-CA 3.47Å; H150-T153 WeakPolarHBondContact O-CB 3.4Å; H150-T153 PolarHBondContact O-N 3.3Å; H150-D154 PolarHBondContact O-N 2.88Å; H150-F368 AromaticContact CD2-CE1 3.76Å; H150-F368 AromaticContact NE2-CE1 3.57Å; H150-E453 IonicContact CE1-OE1 2.87Å; H150-E453 PolarHBondContact CE1-OE1 3.41Å; H150-E453 IonicContact ND1-OE1 3.59Å; H150-E453 PolarHBondContact ND1-OE1 3.21Å
151	W	89.6	Confident	90.5	Very high	45 Å²	45	26.7 Å²	26.7	17%	0.17	15%	0.149	C	C	.	.	H	α-helix	trans	-53.4	-49	178.7	169.5	62.6	0	0	0	113.7	I147 T153 D154 L155 F164 W165	I147-W151 WeakPolarHBondContact O-CB 3.43Å; I147-W151 PolarHBondContact O-N 3Å; I147-W151 VanDerWaalsContact O-N 3.16Å; W151-T153 VanDerWaalsContact C-N 3.29Å; W151-T153 PolarHBondContact O-N 2.81Å; W151-D154 PolarHBondContact O-N 3.28Å; W151-L155 HydrophobicContact CZ2-CD1 4.18Å; W151-L155 PolarHBondContact O-N 2.68Å; W151-F164 HydrophobicContact CH2-CE1 4.17Å; W151-F164 AromaticContact CZ2-CD1 3.95Å; W151-F164 HydrophobicContact CZ2-CD1 3.95Å; W151-F164 AromaticContact CZ2-CE1 3.55Å; W151-F164 HydrophobicContact CZ2-CE1 3.55Å; W151-F164 AromaticContact CZ2-CZ 3.99Å; W151-F164 HydrophobicContact CZ2-CZ 3.99Å; W151-F164 PolarHBondContact NE1-O 3.44Å; W151-W165 HydrophobicContact CH2-CE3 4.23Å; W151-W165 HydrophobicContact CH2-CZ3 4.34Å; W151-W165 HydrophobicContact CZ2-CE3 4.13Å
152	M	91.8	Very high	89.8	Confident	30 Å²	30	28.9 Å²	28.9	15%	0.148	16%	0.16	C	C	.	.	H	α-helix	trans	-71.4	-19.8	177.5	-85.9	-175.3	-85.2	0	0	114	A148 H150 L155 F220 V269 L270 S273	A148-M152 HydrophobicContact CB-CE 4.16Å; A148-M152 WeakPolarHBondContact O-CB 3.26Å; A148-M152 PolarHBondContact O-N 3.09Å; H150-M152 PolarHBondContact O-N 2.6Å; M152-L155 HydrophobicContact CG-CD1 4.25Å; M152-F220 HydrophobicContact CB-CZ 4.44Å; M152-F220 HydrophobicContact CG-CZ 4.49Å; M152-F220 VanDerWaalsContact O-CE2 3.23Å; M152-F220 WeakPolarHBondContact O-CE2 3.33Å; M152-V269 HydrophobicContact CE-CB 3.95Å; M152-V269 HydrophobicContact CE-CG1 3.34Å; M152-L270 HydrophobicContact SD-CD2 3.92Å; M152-S273 VanDerWaalsContact CB-OG 3.22Å; M152-S273 WeakPolarHBondContact CB-OG 3.12Å
153	T	90.8	Very high	89.2	Confident	12 Å²	12	29.5 Å²	29.5	7%	0.074	17%	0.166	C	C	.	.	H	α-helix	trans	-72.5	-44.1	173.4	-61.1	0	0	0	0	110.4	A149 H150 W151 L155 K156 S273	A149-T153 VanDerWaalsContact O-CB 3.3Å; A149-T153 WeakPolarHBondContact O-CB 3.33Å; A149-T153 PolarHBondContact O-N 3.01Å; A149-T153 PolarHBondContact O-OG1 3.31Å; H150-T153 WeakPolarHBondContact O-CA 3.47Å; H150-T153 WeakPolarHBondContact O-CB 3.4Å; H150-T153 PolarHBondContact O-N 3.3Å; W151-T153 VanDerWaalsContact C-N 3.29Å; W151-T153 PolarHBondContact O-N 2.81Å; T153-L155 VanDerWaalsContact C-N 3.27Å; T153-L155 PolarHBondContact O-N 3.36Å; T153-K156 WeakPolarHBondContact O-CB 3.29Å; T153-K156 WeakPolarHBondContact O-CE 3.48Å; T153-K156 PolarHBondContact O-N 2.78Å; T153-K156 VanDerWaalsContact O-N 3.15Å; T153-S273 PolarHBondContact N-OG 3.35Å; T153-S273 PolarHBondContact OG1-OG 3.15Å
154	D	89.4	Confident	88.8	Confident	24 Å²	24	34 Å²	34	13%	0.128	19%	0.186	C	C	.	.	H	α-helix	trans	-64.5	-30.3	-178.7	-60.9	-4.4	0	0	0	112.7	H150 W151 K156 E157 G158 N167 H168 W189	H150-D154 PolarHBondContact O-N 2.88Å; W151-D154 PolarHBondContact O-N 3.28Å; D154-K156 PolarHBondContact O-N 2.91Å; D154-E157 PolarHBondContact O-N 2.82Å; D154-G158 PolarHBondContact O-N 3.27Å; D154-N167 WeakPolarHBondContact OD2-CA 3.36Å; D154-N167 VanDerWaalsContact OD2-CB 3.23Å; D154-N167 WeakPolarHBondContact OD2-CB 3.41Å; D154-H168 PolarHBondContact OD2-N 2.85Å; D154-W189 HydrophobicContact CB-CH2 3.69Å; D154-W189 HydrophobicContact CB-CZ2 4.07Å
155	L	90.2	Very high	88.2	Confident	9 Å²	9	41.6 Å²	41.6	5%	0.047	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-19.6	174.1	-72.5	179.8	0	0	0	113.8	W151 M152 T153 G158 V159 F164 W192 F220	W151-L155 HydrophobicContact CZ2-CD1 4.18Å; W151-L155 PolarHBondContact O-N 2.68Å; M152-L155 HydrophobicContact CG-CD1 4.25Å; T153-L155 VanDerWaalsContact C-N 3.27Å; T153-L155 PolarHBondContact O-N 3.36Å; L155-G158 WeakPolarHBondContact CA-O 3.44Å; L155-V159 HydrophobicContact CD2-CG2 4.07Å; L155-F164 HydrophobicContact CD1-CZ 4.34Å; L155-F164 HydrophobicContact CD2-CD2 4.47Å; L155-F164 HydrophobicContact CD2-CE2 3.69Å; L155-F164 HydrophobicContact CD2-CZ 4.15Å; L155-W192 WeakPolarHBondContact O-CZ2 3.29Å; L155-W192 PolarHBondContact O-NE1 2.84Å; L155-F220 HydrophobicContact CB-CZ 4.37Å; L155-F220 HydrophobicContact CD1-CZ 4.34Å
156	K	89.7	Confident	87.6	Confident	6 Å²	6	46.2 Å²	46.2	3%	0.026	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-27.4	173	-64.7	180	-65.9	-172	0	113.4	T153 D154 Y213 W216 F220 S273	T153-K156 WeakPolarHBondContact O-CB 3.29Å; T153-K156 WeakPolarHBondContact O-CE 3.48Å; T153-K156 PolarHBondContact O-N 2.78Å; T153-K156 VanDerWaalsContact O-N 3.15Å; D154-K156 PolarHBondContact O-N 2.91Å; K156-Y213 HydrophobicContact CB-CD2 3.68Å; K156-Y213 HydrophobicContact CB-CE2 3.94Å; K156-Y213 HydrophobicContact CB-CG 4.49Å; K156-Y213 HydrophobicContact CD-CD2 4.34Å; K156-Y213 HydrophobicContact CD-CE2 3.95Å; K156-W216 HydrophobicContact CG-CB 3.92Å; K156-F220 HydrophobicContact CG-CE2 4.31Å; K156-S273 VanDerWaalsContact CD-O 3.24Å; K156-S273 WeakPolarHBondContact CD-O 3.3Å; K156-S273 WeakPolarHBondContact CE-O 3.4Å; K156-S273 PolarHBondContact NZ-O 3.05Å
157	E	85.4	Confident	87.1	Confident	72 Å²	72	46.8 Å²	46.8	34%	0.336	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	-37.3	-176.7	-55.9	-147.3	170.5	0	0	112.2	D154 R448	D154-E157 PolarHBondContact O-N 2.82Å; E157-R448 IonicContact OE1-CZ 2.74Å; E157-R448 IonicContact OE1-NE 3.65Å; E157-R448 PolarHBondContact OE1-NE 3.08Å; E157-R448 IonicContact OE1-NH2 2.69Å; E157-R448 PolarHBondContact OE1-NH2 2.87Å; E157-R448 IonicContact OE2-CZ 2.69Å; E157-R448 IonicContact OE2-NE 3.5Å; E157-R448 IonicContact OE2-NH2 3.2Å; E157-R448 PolarHBondContact OE2-NH2 2.81Å
158	G	87.8	Confident	86.5	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.2	-166.6	-179.8	0	0	0	0	0	114.4	D154 L155 W189 K190	D154-G158 PolarHBondContact O-N 3.27Å; L155-G158 WeakPolarHBondContact CA-O 3.44Å; G158-W189 WeakPolarHBondContact O-CH2 3.37Å; G158-W189 WeakPolarHBondContact O-CZ2 3.45Å; G158-K190 CarbonylContact C-O 3.45Å; G158-K190 WeakPolarHBondContact CA-O 3.36Å
159	V	88.9	Confident	85.6	Confident	22 Å²	22	48.9 Å²	48.9	13%	0.133	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	144.6	178.8	-177.4	0	0	0	0	110.3	L155 F164 K190 W192	L155-V159 HydrophobicContact CD2-CG2 4.07Å; V159-F164 HydrophobicContact CG1-CD2 3.83Å; V159-F164 HydrophobicContact CG1-CE2 4.4Å; V159-K190 PolarHBondContact N-O 3.08Å; V159-K190 PolarHBondContact O-N 3.23Å; V159-W192 HydrophobicContact CG2-CH2 3.6Å; V159-W192 HydrophobicContact CG2-CZ2 3.52Å; V159-W192 HydrophobicContact CG2-CZ3 4.34Å
160	C	86.4	Confident	85	Confident	3 Å²	3	52.3 Å²	52.3	2%	0.02	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	127.4	171.1	-171.9	0	0	0	0	111.5	F166 C171 W189	C160-F166 HydrophobicContact CB-CB 4.29Å; C160-C171 HydrophobicContact CB-CB 3.66Å; C160-C171 WeakPolarHBondContact CB-SG 3.36Å; C160-C171 WeakPolarHBondContact SG-CB 3.39Å; C160-C171 CovalentContact SG-SG 2.03Å; C160-C171 PolarHBondContact SG-SG 2.96Å; C160-W189 HydrophobicContact CB-CE3 3.92Å; C160-W189 HydrophobicContact CB-CZ3 3.97Å
161	L	82.6	Confident	84.6	Confident	101 Å²	101	51.3 Å²	51.3	53%	0.529	24%	0.24	S	C	.	.	S	Bend	trans	-73.8	-30.6	-179.3	-68.4	-179.2	0	0	0	114.1	G163 Q188 K190 L195	L161-G163 VanDerWaalsContact C-N 3.34Å; L161-Q188 PolarHBondContact N-O 3.16Å; L161-K190 HydrophobicContact CD1-CG 3.77Å; L161-K190 HydrophobicContact CD2-CG 4.45Å; L161-K190 HydrophobicContact CG-CG 3.99Å; L161-L195 HydrophobicContact CD2-CD1 4.14Å
162	I	82.1	Confident	83.9	Confident	99 Å²	99	50 Å²	50	51%	0.508	24%	0.237	S	C	.	.	S	Bend	trans	-67.8	-36.5	-179.2	-64.6	175.5	0	0	0	111.3	Q188	I162-Q188 HydrophobicContact CD1-CB 4.1Å; I162-Q188 HydrophobicContact CD1-CG 3.68Å; I162-Q188 HydrophobicContact CG1-CB 4.39Å; I162-Q188 HydrophobicContact CG1-CG 4.26Å
163	G	81.4	Confident	82.7	Confident	14 Å²	14	58.9 Å²	58.9	14%	0.144	27%	0.269	C	S	.	.			trans	-165.2	122.9	179.6	0	0	0	0	0	111.3	L161 W165 F166	L161-G163 VanDerWaalsContact C-N 3.34Å; G163-W165 PolarHBondContact O-N 3.32Å; G163-F166 PolarHBondContact O-N 3.24Å; G163-F166 VanDerWaalsContact O-N 3.11Å
164	F	84.4	Confident	81.1	Confident	95 Å²	95	62.9 Å²	62.9	42%	0.417	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-26.1	-178.7	179.3	-116.3	0	0	0	114.1	W151 L155 V159	W151-F164 HydrophobicContact CH2-CE1 4.17Å; W151-F164 AromaticContact CZ2-CD1 3.95Å; W151-F164 HydrophobicContact CZ2-CD1 3.95Å; W151-F164 AromaticContact CZ2-CE1 3.55Å; W151-F164 HydrophobicContact CZ2-CE1 3.55Å; W151-F164 AromaticContact CZ2-CZ 3.99Å; W151-F164 HydrophobicContact CZ2-CZ 3.99Å; W151-F164 PolarHBondContact NE1-O 3.44Å; L155-F164 HydrophobicContact CD1-CZ 4.34Å; L155-F164 HydrophobicContact CD2-CD2 4.47Å; L155-F164 HydrophobicContact CD2-CE2 3.69Å; L155-F164 HydrophobicContact CD2-CZ 4.15Å; V159-F164 HydrophobicContact CG1-CD2 3.83Å; V159-F164 HydrophobicContact CG1-CE2 4.4Å
165	W	83.1	Confident	79.6	Confident	200 Å²	200	62.6 Å²	62.6	76%	0.758	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-7.5	-175.8	-39.7	97.5	0	0	0	114.5	W151 G163	W151-W165 HydrophobicContact CH2-CE3 4.23Å; W151-W165 HydrophobicContact CH2-CZ3 4.34Å; W151-W165 HydrophobicContact CZ2-CE3 4.13Å; G163-W165 PolarHBondContact O-N 3.32Å
166	F	81.5	Confident	77.8	Confident	98 Å²	98	70.5 Å²	70.5	43%	0.43	34%	0.335	S	S	.	.			trans	-83.7	134.6	178.1	-66.4	-60.8	0	0	0	110.9	C160 G163 H170 C171	C160-F166 HydrophobicContact CB-CB 4.29Å; G163-F166 PolarHBondContact O-N 3.24Å; G163-F166 VanDerWaalsContact O-N 3.11Å; F166-H170 HydrophobicContact CB-CB 4.49Å; F166-H170 HydrophobicContact CD1-CB 4.06Å; F166-C171 HydrophobicContact CB-CB 4.4Å
167	N	80.7	Confident	75.9	Confident	15 Å²	15	77.9 Å²	77.9	8%	0.08	37%	0.37	C	S	.	.			trans	-70.6	170.6	166.4	87.2	-29	0	0	0	109.9	D154 E169 H170 C171	D154-N167 WeakPolarHBondContact OD2-CA 3.36Å; D154-N167 VanDerWaalsContact OD2-CB 3.23Å; D154-N167 WeakPolarHBondContact OD2-CB 3.41Å; N167-E169 PolarHBondContact O-N 3.49Å; N167-E169 PolarHBondContact OD1-N 2.96Å; N167-H170 PolarHBondContact O-N 3.35Å; N167-H170 VanDerWaalsContact OD1-CB 3.26Å; N167-H170 WeakPolarHBondContact OD1-CB 3.26Å; N167-H170 PolarHBondContact OD1-N 3.43Å; N167-H170 PolarHBondContact OD1-ND1 2.87Å; N167-C171 WeakPolarHBondContact O-CB 3.39Å; N167-C171 PolarHBondContact O-N 2.96Å
168	H	77.9	Confident	73.9	Confident	56 Å²	56	77.3 Å²	77.3	26%	0.259	37%	0.372	S	S	.	.	H	α-helix	trans	-53.7	-51.2	-178.9	179	-103.5	0	0	0	111.7	D154 H170 C171 C172 W189	D154-H168 PolarHBondContact OD2-N 2.85Å; H168-H170 PolarHBondContact O-N 3.18Å; H168-C171 WeakPolarHBondContact O-CB 3.21Å; H168-C171 PolarHBondContact O-N 3.23Å; H168-C172 PolarHBondContact O-N 3.32Å; H168-C172 VanDerWaalsContact O-N 3.16Å; H168-C172 PolarHBondContact O-SG 3.13Å; H168-W189 HydrophobicContact CB-CE3 4.42Å; H168-W189 HydrophobicContact CB-CH2 4.36Å; H168-W189 HydrophobicContact CB-CZ2 4.41Å; H168-W189 HydrophobicContact CB-CZ3 4.34Å; H168-W189 AromaticContact CD2-CD1 3.62Å; H168-W189 AromaticContact CD2-CD2 3.59Å; H168-W189 AromaticContact CD2-CE2 3.74Å; H168-W189 AromaticContact CD2-CG 3.54Å; H168-W189 AromaticContact CD2-NE1 3.73Å
169	E	75.4	Confident	71.7	Confident	98 Å²	98	81.5 Å²	81.5	46%	0.458	40%	0.398	S	S	.	.	H	α-helix	trans	-61.9	-48	-176.5	-60.7	-176.6	136.5	0	0	113.1	N167 C171 C172 W173	N167-E169 PolarHBondContact O-N 3.49Å; N167-E169 PolarHBondContact OD1-N 2.96Å; E169-C171 VanDerWaalsContact C-N 3.33Å; E169-C171 PolarHBondContact O-N 3.03Å; E169-C172 PolarHBondContact O-N 3.28Å; E169-W173 WeakPolarHBondContact O-CB 3.44Å; E169-W173 PolarHBondContact O-N 3.14Å
170	H	77.8	Confident	69.5	Low	78 Å²	78	89.2 Å²	89.2	36%	0.361	43%	0.43	S	S	.	.	H	α-helix	trans	-68.2	-32	178.7	-71.3	79.8	0	0	0	112.1	F166 N167 H168 C172	F166-H170 HydrophobicContact CB-CB 4.49Å; F166-H170 HydrophobicContact CD1-CB 4.06Å; N167-H170 PolarHBondContact O-N 3.35Å; N167-H170 VanDerWaalsContact OD1-CB 3.26Å; N167-H170 WeakPolarHBondContact OD1-CB 3.26Å; N167-H170 PolarHBondContact OD1-N 3.43Å; N167-H170 PolarHBondContact OD1-ND1 2.87Å; H168-H170 PolarHBondContact O-N 3.18Å; H170-C172 VanDerWaalsContact C-N 3.26Å; H170-C172 PolarHBondContact O-N 3.34Å
171	C	78.7	Confident	67.4	Low	1 Å²	1	98.1 Å²	98.1	1%	0.007	47%	0.471	C	S	.	.	H	α-helix	trans	-59.9	-40.3	173.1	-169	0	0	0	0	111.3	C160 F166 N167 H168 E169 T174 W189	C160-C171 HydrophobicContact CB-CB 3.66Å; C160-C171 WeakPolarHBondContact CB-SG 3.36Å; C160-C171 WeakPolarHBondContact SG-CB 3.39Å; C160-C171 CovalentContact SG-SG 2.03Å; C160-C171 PolarHBondContact SG-SG 2.96Å; F166-C171 HydrophobicContact CB-CB 4.4Å; N167-C171 WeakPolarHBondContact O-CB 3.39Å; N167-C171 PolarHBondContact O-N 2.96Å; H168-C171 WeakPolarHBondContact O-CB 3.21Å; H168-C171 PolarHBondContact O-N 3.23Å; E169-C171 VanDerWaalsContact C-N 3.33Å; E169-C171 PolarHBondContact O-N 3.03Å; C171-T174 PolarHBondContact O-OG1 3.22Å; C171-W189 HydrophobicContact CB-CE3 4.23Å
172	C	75	Confident	65.6	Low	16 Å²	16	97.4 Å²	97.4	11%	0.108	47%	0.465	C	S	.	.	H	α-helix	trans	-93.5	-15.9	-172.7	-52.5	0	0	0	0	113.4	H168 E169 H170 T174 S175 C186	H168-C172 PolarHBondContact O-N 3.32Å; H168-C172 VanDerWaalsContact O-N 3.16Å; H168-C172 PolarHBondContact O-SG 3.13Å; E169-C172 PolarHBondContact O-N 3.28Å; H170-C172 VanDerWaalsContact C-N 3.26Å; H170-C172 PolarHBondContact O-N 3.34Å; C172-T174 PolarHBondContact O-N 2.93Å; C172-S175 PolarHBondContact O-OG 3.04Å; C172-C186 WeakPolarHBondContact CA-SG 3.19Å; C172-C186 HydrophobicContact CB-CB 3.74Å; C172-C186 WeakPolarHBondContact CB-SG 3.42Å; C172-C186 WeakPolarHBondContact SG-CB 3.21Å; C172-C186 CovalentContact SG-SG 2.02Å; C172-C186 PolarHBondContact SG-SG 2.74Å
173	W	67.4	Low	63.9	Low	218 Å²	218	101.8 Å²	101.8	83%	0.826	48%	0.475	S	S	*	.	H	α-helix	trans	-61.2	-25.2	173.7	-168.8	-86.6	0	0	0	113.9	E169	E169-W173 WeakPolarHBondContact O-CB 3.44Å; E169-W173 PolarHBondContact O-N 3.14Å
174	T	57.7	Low	62.5	Low	95 Å²	95	107.1 Å²	107.1	58%	0.583	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-2.9	-173.4	57.1	0	0	0	0	114.9	C171 C172	C171-T174 PolarHBondContact O-OG1 3.22Å; C172-T174 PolarHBondContact O-N 2.93Å
175	S	57.7	Low	61	Low	18 Å²	18	110.4 Å²	110.4	13%	0.126	51%	0.51	C	S	.	.			trans	-89.2	109	-177.4	45.8	0	0	0	0	113.1	C172 E177 T178	C172-S175 PolarHBondContact O-OG 3.04Å; S175-E177 PolarHBondContact O-N 3.22Å; S175-T178 PolarHBondContact O-N 2.63Å; S175-T178 PolarHBondContact O-OG1 3.39Å; S175-T178 VanDerWaalsContact O-OG1 3.06Å; S175-T178 WeakPolarHBondContact OG-CG2 3.38Å
176	N	53	Low	60.3	Low	175 Å²	175	101.2 Å²	101.2	94%	0.936	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-10.6	175.2	-79.1	-11.5	0	0	0	115.6
177	E	48.2	Very low	59.7	Low	161 Å²	161	99.1 Å²	99.1	75%	0.752	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-2.5	-177.6	-63.8	-171	156.9	0	0	114	S175 T179	S175-E177 PolarHBondContact O-N 3.22Å; E177-T179 PolarHBondContact O-N 3.13Å
178	T	44.7	Very low	59.6	Low	60 Å²	60	101.6 Å²	101.6	37%	0.368	48%	0.483	S	S	.	.			trans	-73	89.6	175.7	51.3	0	0	0	0	111.1	S175	S175-T178 PolarHBondContact O-N 2.63Å; S175-T178 PolarHBondContact O-OG1 3.39Å; S175-T178 VanDerWaalsContact O-OG1 3.06Å; S175-T178 WeakPolarHBondContact OG-CG2 3.38Å
179	T	41	Very low	59.9	Low	89 Å²	89	100.5 Å²	100.5	55%	0.546	48%	0.477	S	S	.	.			trans	-67.1	147.5	163.4	47.7	0	0	0	0	110.2	E177 Q181 E182	E177-T179 PolarHBondContact O-N 3.13Å; T179-Q181 PolarHBondContact O-N 3.42Å; T179-E182 PolarHBondContact O-N 3.33Å
180	F	42.9	Very low	60.4	Low	184 Å²	184	98.5 Å²	98.5	81%	0.807	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-20	-173.1	-110.4	-97.9	0	0	0	114.9
181	Q	42.1	Very low	60.8	Low	189 Å²	189	95.6 Å²	95.6	88%	0.883	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-10.9	179.4	-69.4	179	-31.4	0	0	114.4	T179	T179-Q181 PolarHBondContact O-N 3.42Å
182	E	45.7	Very low	61.3	Low	86 Å²	86	97 Å²	97	40%	0.402	46%	0.46	S	S	.	.			trans	-126.4	36.4	-175.6	-70.9	-153.5	132.1	0	0	113.1	T179 D184 R185	T179-E182 PolarHBondContact O-N 3.33Å; E182-D184 PolarHBondContact O-N 3.02Å; E182-R185 HydrophobicContact CB-CB 4.29Å; E182-R185 PolarHBondContact O-N 2.95Å; E182-R185 VanDerWaalsContact OE1-CD 3.23Å; E182-R185 WeakPolarHBondContact OE1-CD 3.15Å; E182-R185 IonicContact OE1-CZ 3.97Å; E182-R185 IonicContact OE1-NE 2.77Å; E182-R185 IonicContact OE1-NH1 3.71Å; E182-R185 PolarHBondContact OE1-NH1 3.4Å
183	R	45.8	Very low	61.8	Low	192 Å²	192	96.2 Å²	96.2	73%	0.725	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-29	-179.6	-164.3	173.4	-177	177.2	-2.3	114.1
184	D	51.3	Low	62.7	Low	125 Å²	125	88.4 Å²	88.4	67%	0.668	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-11.1	177.7	-63.4	-31.7	0	0	0	114.6	E182 C186	E182-D184 PolarHBondContact O-N 3.02Å; D184-C186 PolarHBondContact O-N 3.43Å
185	R	54.3	Low	64.1	Low	164 Å²	164	88.4 Å²	88.4	62%	0.619	42%	0.424	S	S	*	.			trans	-102.9	54.4	-177.9	-72.2	180	175.1	171.9	0.7	112.1	E182 P187	E182-R185 HydrophobicContact CB-CB 4.29Å; E182-R185 PolarHBondContact O-N 2.95Å; E182-R185 VanDerWaalsContact OE1-CD 3.23Å; E182-R185 WeakPolarHBondContact OE1-CD 3.15Å; E182-R185 IonicContact OE1-CZ 3.97Å; E182-R185 IonicContact OE1-NE 2.77Å; E182-R185 IonicContact OE1-NH1 3.71Å; E182-R185 PolarHBondContact OE1-NH1 3.4Å; R185-P187 VanDerWaalsContact O-CD 3.26Å; R185-P187 WeakPolarHBondContact O-CD 3.33Å
186	C	66.8	Low	65.4	Low	8 Å²	8	92.4 Å²	92.4	5%	0.054	44%	0.442	C	S	.	.			trans	-65.3	110.7	173.4	180	0	0	0	0	111.1	C172 D184 Q188 W189	C172-C186 WeakPolarHBondContact CA-SG 3.19Å; C172-C186 HydrophobicContact CB-CB 3.74Å; C172-C186 WeakPolarHBondContact CB-SG 3.42Å; C172-C186 WeakPolarHBondContact SG-CB 3.21Å; C172-C186 CovalentContact SG-SG 2.02Å; C172-C186 PolarHBondContact SG-SG 2.74Å; D184-C186 PolarHBondContact O-N 3.43Å; C186-Q188 PolarHBondContact O-N 2.7Å; C186-Q188 VanDerWaalsContact O-N 3.17Å; C186-W189 HydrophobicContact CB-CB 4.11Å; C186-W189 PolarHBondContact O-N 3.33Å
187	P	69.8	Low	66.6	Low	53 Å²	53	85.4 Å²	85.4	34%	0.344	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-20.8	-172.6	26.6	-34.4	0	0	0	113.4	R185 K190	R185-P187 VanDerWaalsContact O-CD 3.26Å; R185-P187 WeakPolarHBondContact O-CD 3.33Å; P187-K190 WeakPolarHBondContact O-CE 3.18Å
188	Q	79	Confident	68.1	Low	68 Å²	68	80.9 Å²	80.9	32%	0.318	41%	0.406	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-19.8	-179.3	-59.6	-60.5	-30.1	0	0	113.5	L161 I162 C186	L161-Q188 PolarHBondContact N-O 3.16Å; I162-Q188 HydrophobicContact CD1-CB 4.1Å; I162-Q188 HydrophobicContact CD1-CG 3.68Å; I162-Q188 HydrophobicContact CG1-CB 4.39Å; I162-Q188 HydrophobicContact CG1-CG 4.26Å; C186-Q188 PolarHBondContact O-N 2.7Å; C186-Q188 VanDerWaalsContact O-N 3.17Å
189	W	84.3	Confident	69.7	Low	33 Å²	33	81.3 Å²	81.3	13%	0.125	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	133	171	-171.5	-106.2	0	0	0	109.6	D154 G158 C160 H168 C171 C186	D154-W189 HydrophobicContact CB-CH2 3.69Å; D154-W189 HydrophobicContact CB-CZ2 4.07Å; G158-W189 WeakPolarHBondContact O-CH2 3.37Å; G158-W189 WeakPolarHBondContact O-CZ2 3.45Å; C160-W189 HydrophobicContact CB-CE3 3.92Å; C160-W189 HydrophobicContact CB-CZ3 3.97Å; H168-W189 HydrophobicContact CB-CE3 4.42Å; H168-W189 HydrophobicContact CB-CH2 4.36Å; H168-W189 HydrophobicContact CB-CZ2 4.41Å; H168-W189 HydrophobicContact CB-CZ3 4.34Å; H168-W189 AromaticContact CD2-CD1 3.62Å; H168-W189 AromaticContact CD2-CD2 3.59Å; H168-W189 AromaticContact CD2-CE2 3.74Å; H168-W189 AromaticContact CD2-CG 3.54Å; H168-W189 AromaticContact CD2-NE1 3.73Å; C171-W189 HydrophobicContact CB-CE3 4.23Å; C186-W189 HydrophobicContact CB-CB 4.11Å; C186-W189 PolarHBondContact O-N 3.33Å
190	K	86.2	Confident	71	Confident	56 Å²	56	79.9 Å²	79.9	24%	0.243	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	123.3	176.5	-68	-62.4	171	-152.2	0	111.7	G158 V159 L161 P187 E194 L195	G158-K190 CarbonylContact C-O 3.45Å; G158-K190 WeakPolarHBondContact CA-O 3.36Å; V159-K190 PolarHBondContact N-O 3.08Å; V159-K190 PolarHBondContact O-N 3.23Å; L161-K190 HydrophobicContact CD1-CG 3.77Å; L161-K190 HydrophobicContact CD2-CG 4.45Å; L161-K190 HydrophobicContact CG-CG 3.99Å; P187-K190 WeakPolarHBondContact O-CE 3.18Å; K190-E194 HydrophobicContact CD-CB 3.97Å; K190-E194 WeakPolarHBondContact CD-OE2 3.26Å; K190-E194 WeakPolarHBondContact CE-OE2 3.43Å; K190-E194 IonicContact NZ-OE2 3.81Å; K190-E194 PolarHBondContact NZ-OE2 3Å; K190-L195 HydrophobicContact CB-CD1 4.46Å
191	S	86.2	Confident	72.5	Confident	17 Å²	17	78.7 Å²	78.7	12%	0.119	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	153	167	65.4	0	0	0	0	110.4	A193 E194 L195	S191-A193 PolarHBondContact O-N 3.21Å; S191-E194 PolarHBondContact N-OE1 2.86Å; S191-E194 PolarHBondContact O-N 3.43Å; S191-E194 WeakPolarHBondContact OG-CG 3.4Å; S191-E194 PolarHBondContact OG-N 3.2Å; S191-E194 PolarHBondContact OG-OE1 2.83Å; S191-L195 PolarHBondContact O-N 3.02Å; S191-L195 VanDerWaalsContact O-N 3.13Å
192	W	88.8	Confident	74.4	Confident	30 Å²	30	71.6 Å²	71.6	11%	0.114	38%	0.38	C	S	.	.	H	α-helix	trans	-58.2	-33	179.4	-70.6	106.7	0	0	0	113	L155 V159 L195 I196 N209 M212 W216	L155-W192 WeakPolarHBondContact O-CZ2 3.29Å; L155-W192 PolarHBondContact O-NE1 2.84Å; V159-W192 HydrophobicContact CG2-CH2 3.6Å; V159-W192 HydrophobicContact CG2-CZ2 3.52Å; V159-W192 HydrophobicContact CG2-CZ3 4.34Å; W192-L195 HydrophobicContact CE3-CD2 4.5Å; W192-L195 HydrophobicContact CZ3-CD2 4.41Å; W192-L195 PolarHBondContact O-N 2.99Å; W192-I196 HydrophobicContact CB-CD1 4.47Å; W192-I196 HydrophobicContact CE3-CD1 4.37Å; W192-I196 VanDerWaalsContact O-CB 3.32Å; W192-I196 WeakPolarHBondContact O-CB 3.35Å; W192-I196 VanDerWaalsContact O-CG1 3.29Å; W192-I196 WeakPolarHBondContact O-CG1 3.34Å; W192-I196 PolarHBondContact O-N 3.18Å; W192-N209 PolarHBondContact N-OD1 3.01Å; W192-M212 HydrophobicContact CB-CB 3.93Å; W192-M212 HydrophobicContact CB-CG 3.84Å; W192-M212 HydrophobicContact CD2-CE 3.79Å; W192-M212 HydrophobicContact CE3-CE 3.76Å; W192-M212 HydrophobicContact CG-CB 3.86Å; W192-M212 HydrophobicContact CG-CE 4.24Å; W192-M212 HydrophobicContact CG-CG 4.09Å; W192-M212 HydrophobicContact CZ3-CE 4.16Å; W192-W216 AromaticContact CE2-NE1 3.39Å; W192-W216 AromaticContact CH2-CZ2 3.87Å; W192-W216 HydrophobicContact CH2-CZ2 3.87Å; W192-W216 AromaticContact CH2-NE1 3.83Å; W192-W216 AromaticContact CZ2-CE2 3.69Å; W192-W216 AromaticContact CZ2-CZ2 3.8Å; W192-W216 HydrophobicContact CZ2-CZ2 3.8Å; W192-W216 AromaticContact CZ2-NE1 3.13Å; W192-W216 AromaticContact NE1-CD1 3.9Å; W192-W216 AromaticContact NE1-NE1 3.68Å
193	A	86.3	Confident	76.3	Confident	0 Å²	0	72.8 Å²	72.8	0%	0	40%	0.395	C	S	.	.	H	α-helix	trans	-63.8	-41.8	173.1	0	0	0	0	0	113.5	S191 L195 A197 G198 A205 V208 N209	S191-A193 PolarHBondContact O-N 3.21Å; A193-L195 VanDerWaalsContact C-N 3.32Å; A193-L195 PolarHBondContact O-N 2.85Å; A193-A197 CarbonylContact O-C 3.54Å; A193-A197 VanDerWaalsContact O-CA 3.29Å; A193-A197 WeakPolarHBondContact O-CA 3.29Å; A193-A197 VanDerWaalsContact O-CB 3.24Å; A193-A197 WeakPolarHBondContact O-CB 3.44Å; A193-A197 PolarHBondContact O-N 2.8Å; A193-G198 PolarHBondContact O-N 3.19Å; A193-A205 HydrophobicContact CB-CB 3.67Å; A193-A205 WeakPolarHBondContact CB-O 3.25Å; A193-V208 HydrophobicContact CB-CB 4.31Å; A193-V208 HydrophobicContact CB-CG1 4.37Å; A193-N209 WeakPolarHBondContact CB-OD1 3.35Å; A193-N209 PolarHBondContact N-OD1 2.98Å
194	E	85.3	Confident	78.2	Confident	53 Å²	53	70 Å²	70	25%	0.248	39%	0.389	C	S	.	.	H	α-helix	trans	-65.2	-39.6	175.2	-74.1	168.6	-99.5	0	0	111.7	K190 S191 G198 A200	K190-E194 HydrophobicContact CD-CB 3.97Å; K190-E194 WeakPolarHBondContact CD-OE2 3.26Å; K190-E194 WeakPolarHBondContact CE-OE2 3.43Å; K190-E194 IonicContact NZ-OE2 3.81Å; K190-E194 PolarHBondContact NZ-OE2 3Å; S191-E194 PolarHBondContact N-OE1 2.86Å; S191-E194 PolarHBondContact O-N 3.43Å; S191-E194 WeakPolarHBondContact OG-CG 3.4Å; S191-E194 PolarHBondContact OG-N 3.2Å; S191-E194 PolarHBondContact OG-OE1 2.83Å; E194-G198 VanDerWaalsContact O-CA 3.27Å; E194-G198 WeakPolarHBondContact O-CA 3.29Å; E194-G198 PolarHBondContact O-N 2.96Å; E194-G198 VanDerWaalsContact O-N 3.12Å; E194-A200 HydrophobicContact CG-CB 3.58Å
195	L	86.2	Confident	79.9	Confident	95 Å²	95	64.2 Å²	64.2	50%	0.497	36%	0.358	S	S	.	.	H	α-helix	trans	-72.9	-34.7	-177.4	-160.1	118.3	0	0	0	113.1	L161 K190 S191 W192 A193	L161-L195 HydrophobicContact CD2-CD1 4.14Å; K190-L195 HydrophobicContact CB-CD1 4.46Å; S191-L195 PolarHBondContact O-N 3.02Å; S191-L195 VanDerWaalsContact O-N 3.13Å; W192-L195 HydrophobicContact CE3-CD2 4.5Å; W192-L195 HydrophobicContact CZ3-CD2 4.41Å; W192-L195 PolarHBondContact O-N 2.99Å; A193-L195 VanDerWaalsContact C-N 3.32Å; A193-L195 PolarHBondContact O-N 2.85Å
196	I	85.8	Confident	81.5	Confident	102 Å²	102	61.7 Å²	61.7	52%	0.523	35%	0.349	S	S	.	.	H	α-helix	trans	-96.9	-40.2	-176.3	-62.3	169	0	0	0	112.2	W192 V208 M212	W192-I196 HydrophobicContact CB-CD1 4.47Å; W192-I196 HydrophobicContact CE3-CD1 4.37Å; W192-I196 VanDerWaalsContact O-CB 3.32Å; W192-I196 WeakPolarHBondContact O-CB 3.35Å; W192-I196 VanDerWaalsContact O-CG1 3.29Å; W192-I196 WeakPolarHBondContact O-CG1 3.34Å; W192-I196 PolarHBondContact O-N 3.18Å; I196-V208 HydrophobicContact CB-CG1 4.3Å; I196-V208 HydrophobicContact CD1-CG1 4.15Å; I196-M212 HydrophobicContact CD1-CE 4.46Å; I196-M212 HydrophobicContact CD1-CG 4.18Å; I196-M212 HydrophobicContact CD1-SD 4.13Å
197	A	78.5	Confident	82.6	Confident	28 Å²	28	65.4 Å²	65.4	23%	0.231	37%	0.368	C	S	.	.	H	α-helix	trans	-110	1.1	-172.5	0	0	0	0	0	114	A193 T199 F204	A193-A197 CarbonylContact O-C 3.54Å; A193-A197 VanDerWaalsContact O-CA 3.29Å; A193-A197 WeakPolarHBondContact O-CA 3.29Å; A193-A197 VanDerWaalsContact O-CB 3.24Å; A193-A197 WeakPolarHBondContact O-CB 3.44Å; A193-A197 PolarHBondContact O-N 2.8Å; A197-T199 PolarHBondContact O-N 3.2Å; A197-T199 PolarHBondContact O-OG1 3.29Å; A197-T199 VanDerWaalsContact O-OG1 3.06Å; A197-F204 HydrophobicContact CB-CD1 3.82Å; A197-F204 HydrophobicContact CB-CE1 3.61Å
198	G	79	Confident	83.6	Confident	67 Å²	67	63.8 Å²	63.8	69%	0.691	36%	0.357	S	S	*	.	S	Bend	trans	62.8	11.1	177.5	0	0	0	0	0	115	A193 E194	A193-G198 PolarHBondContact O-N 3.19Å; E194-G198 VanDerWaalsContact O-CA 3.27Å; E194-G198 WeakPolarHBondContact O-CA 3.29Å; E194-G198 PolarHBondContact O-N 2.96Å; E194-G198 VanDerWaalsContact O-N 3.12Å
199	T	78.1	Confident	84.1	Confident	69 Å²	69	62.1 Å²	62.1	42%	0.423	35%	0.35	S	S	.	.			trans	-138.2	125	-171.7	43.7	0	0	0	0	110.7	A197	A197-T199 PolarHBondContact O-N 3.2Å; A197-T199 PolarHBondContact O-OG1 3.29Å; A197-T199 VanDerWaalsContact O-OG1 3.06Å
200	A	69	Low	84.5	Confident	58 Å²	58	63.1 Å²	63.1	48%	0.479	35%	0.354	S	S	.	.	S	Bend	trans	-80.7	-21.4	-179.2	0	0	0	0	0	113.8	E194	E194-A200 HydrophobicContact CG-CB 3.58Å
201	Q	73.5	Confident	84.8	Confident	160 Å²	160	65.6 Å²	65.6	75%	0.748	37%	0.369	S	S	*	.	S	Bend	trans	-135	134.7	-170.3	-63.2	-178.5	4.2	0	0	111
202	G	83.7	Confident	85.1	Confident	40 Å²	40	66.6 Å²	66.6	41%	0.412	37%	0.373	S	S	.	.	S	Bend	trans	139.9	167.6	174.3	0	0	0	0	0	113.3	F204 A205 Y206	G202-F204 VanDerWaalsContact C-N 3.28Å; G202-F204 PolarHBondContact O-N 3.49Å; G202-A205 PolarHBondContact O-N 3.48Å; G202-Y206 PolarHBondContact O-N 2.98Å; G202-Y206 VanDerWaalsContact O-N 3.11Å
203	P	84.8	Confident	85.3	Confident	111 Å²	111	65.4 Å²	65.4	72%	0.721	37%	0.368	S	S	*	.	H	α-helix	trans	-60	-37	-179.3	-24.1	34.3	0	0	0	113.2	Y206 I207	P203-Y206 PolarHBondContact O-N 3.02Å; P203-I207 WeakPolarHBondContact O-CD1 3.12Å; P203-I207 VanDerWaalsContact O-CG1 3.31Å; P203-I207 WeakPolarHBondContact O-CG1 3.41Å; P203-I207 PolarHBondContact O-N 2.95Å; P203-I207 VanDerWaalsContact O-N 3.12Å
204	F	86.3	Confident	85.7	Confident	133 Å²	133	67 Å²	67	58%	0.583	38%	0.377	S	S	*	.	H	α-helix	trans	-66.9	-43.7	177.8	-172.7	-108.3	0	0	0	112.1	A197 G202 Y206 I207 V208	A197-F204 HydrophobicContact CB-CD1 3.82Å; A197-F204 HydrophobicContact CB-CE1 3.61Å; G202-F204 VanDerWaalsContact C-N 3.28Å; G202-F204 PolarHBondContact O-N 3.49Å; F204-Y206 VanDerWaalsContact C-N 3.33Å; F204-Y206 PolarHBondContact O-N 3.44Å; F204-I207 PolarHBondContact O-N 3.29Å; F204-V208 HydrophobicContact CD1-CG2 4.27Å; F204-V208 HydrophobicContact CE1-CG2 3.95Å; F204-V208 HydrophobicContact CE2-CG2 4.5Å; F204-V208 HydrophobicContact CZ-CG2 4.07Å; F204-V208 WeakPolarHBondContact O-CG2 3.07Å; F204-V208 PolarHBondContact O-N 2.89Å
205	A	85.9	Confident	86.2	Confident	3 Å²	3	69.9 Å²	69.9	3%	0.025	39%	0.389	C	S	.	.	H	α-helix	trans	-59.8	-42.8	175.6	0	0	0	0	0	111.9	A193 G202 I207 V208 N209	A193-A205 HydrophobicContact CB-CB 3.67Å; A193-A205 WeakPolarHBondContact CB-O 3.25Å; G202-A205 PolarHBondContact O-N 3.48Å; A205-I207 PolarHBondContact O-N 3.4Å; A205-V208 PolarHBondContact O-N 3.1Å; A205-N209 PolarHBondContact O-N 2.87Å
206	Y	88	Confident	86.7	Confident	112 Å²	112	67.5 Å²	67.5	44%	0.439	37%	0.373	S	S	.	.	H	α-helix	trans	-59.6	-45.2	174.3	-177.1	-91	0	0	0	112.3	G202 P203 F204 N209 Y210 F442	G202-Y206 PolarHBondContact O-N 2.98Å; G202-Y206 VanDerWaalsContact O-N 3.11Å; P203-Y206 PolarHBondContact O-N 3.02Å; F204-Y206 VanDerWaalsContact C-N 3.33Å; F204-Y206 PolarHBondContact O-N 3.44Å; Y206-N209 PolarHBondContact O-N 3.49Å; Y206-Y210 VanDerWaalsContact O-CB 3.31Å; Y206-Y210 WeakPolarHBondContact O-CB 3.27Å; Y206-Y210 PolarHBondContact O-N 3.25Å; Y206-F442 HydrophobicContact CD2-CE1 4.13Å; Y206-F442 HydrophobicContact CE1-CD1 4.49Å; Y206-F442 HydrophobicContact CE1-CE1 4.12Å; Y206-F442 HydrophobicContact CE2-CD1 4.27Å; Y206-F442 AromaticContact CE2-CE1 3.61Å; Y206-F442 HydrophobicContact CE2-CE1 3.61Å; Y206-F442 AromaticContact CZ-CD1 3.91Å; Y206-F442 AromaticContact CZ-CE1 3.6Å
207	I	90.6	Very high	87.1	Confident	86 Å²	86	62.6 Å²	62.6	44%	0.441	35%	0.348	S	S	.	.	H	α-helix	trans	-63.6	-42.3	178.1	-67	163.2	0	0	0	111.5	P203 F204 A205 Y210 L211	P203-I207 WeakPolarHBondContact O-CD1 3.12Å; P203-I207 VanDerWaalsContact O-CG1 3.31Å; P203-I207 WeakPolarHBondContact O-CG1 3.41Å; P203-I207 PolarHBondContact O-N 2.95Å; P203-I207 VanDerWaalsContact O-N 3.12Å; F204-I207 PolarHBondContact O-N 3.29Å; A205-I207 PolarHBondContact O-N 3.4Å; I207-Y210 PolarHBondContact O-N 3.3Å; I207-L211 HydrophobicContact CG2-CD1 4Å; I207-L211 HydrophobicContact CG2-CG 4.4Å; I207-L211 WeakPolarHBondContact O-CG 3.39Å; I207-L211 PolarHBondContact O-N 3.08Å
208	V	90.9	Very high	88	Confident	18 Å²	18	63.7 Å²	63.7	11%	0.109	35%	0.35	C	S	.	.	H	α-helix	trans	-63	-49	177.7	172.6	0	0	0	0	111	A193 I196 F204 A205 Y210 L211 M212	A193-V208 HydrophobicContact CB-CB 4.31Å; A193-V208 HydrophobicContact CB-CG1 4.37Å; I196-V208 HydrophobicContact CB-CG1 4.3Å; I196-V208 HydrophobicContact CD1-CG1 4.15Å; F204-V208 HydrophobicContact CD1-CG2 4.27Å; F204-V208 HydrophobicContact CE1-CG2 3.95Å; F204-V208 HydrophobicContact CE2-CG2 4.5Å; F204-V208 HydrophobicContact CZ-CG2 4.07Å; F204-V208 WeakPolarHBondContact O-CG2 3.07Å; F204-V208 PolarHBondContact O-N 2.89Å; A205-V208 PolarHBondContact O-N 3.1Å; V208-Y210 VanDerWaalsContact C-N 3.28Å; V208-Y210 PolarHBondContact O-N 2.8Å; V208-L211 PolarHBondContact O-N 3.05Å; V208-M212 HydrophobicContact CG1-CG 4.42Å; V208-M212 WeakPolarHBondContact O-CB 3.3Å; V208-M212 VanDerWaalsContact O-CG 3.31Å; V208-M212 WeakPolarHBondContact O-CG 3.46Å; V208-M212 PolarHBondContact O-N 3.12Å
209	N	89.9	Confident	88.8	Confident	33 Å²	33	63.3 Å²	63.3	18%	0.176	33%	0.331	C	S	.	.	H	α-helix	trans	-59.8	-39.4	176.5	-76.3	-23.2	0	0	0	111.8	W192 A193 A205 Y206 M212 Y213 F442	W192-N209 PolarHBondContact N-OD1 3.01Å; A193-N209 WeakPolarHBondContact CB-OD1 3.35Å; A193-N209 PolarHBondContact N-OD1 2.98Å; A205-N209 PolarHBondContact O-N 2.87Å; Y206-N209 PolarHBondContact O-N 3.49Å; N209-M212 PolarHBondContact O-N 3.41Å; N209-Y213 WeakPolarHBondContact O-CB 3.29Å; N209-Y213 PolarHBondContact O-N 3.42Å; N209-F442 HydrophobicContact CB-CE2 4.46Å; N209-F442 HydrophobicContact CB-CZ 3.94Å
210	Y	91.9	Very high	89.7	Confident	54 Å²	54	60.5 Å²	60.5	21%	0.212	31%	0.313	C	S	.	.	H	α-helix	trans	-64.9	-46	178.2	-175.1	-153.5	0	0	0	112.9	Y206 I207 V208 Y213 I214 L439 F442	Y206-Y210 VanDerWaalsContact O-CB 3.31Å; Y206-Y210 WeakPolarHBondContact O-CB 3.27Å; Y206-Y210 PolarHBondContact O-N 3.25Å; I207-Y210 PolarHBondContact O-N 3.3Å; V208-Y210 VanDerWaalsContact C-N 3.28Å; V208-Y210 PolarHBondContact O-N 2.8Å; Y210-Y213 PolarHBondContact O-N 2.84Å; Y210-I214 HydrophobicContact CD2-CD1 3.84Å; Y210-I214 HydrophobicContact CD2-CG1 4.27Å; Y210-I214 HydrophobicContact CE2-CD1 3.57Å; Y210-I214 HydrophobicContact CE2-CG1 4.19Å; Y210-I214 HydrophobicContact CG-CD1 4.47Å; Y210-I214 WeakPolarHBondContact O-CG1 3.35Å; Y210-I214 PolarHBondContact O-N 2.82Å; Y210-I214 VanDerWaalsContact O-N 3.11Å; Y210-L439 WeakPolarHBondContact OH-CG 3.36Å; Y210-L439 PolarHBondContact OH-O 3.3Å; Y210-F442 HydrophobicContact CD2-CB 3.52Å; Y210-F442 AromaticContact CD2-CD1 3.34Å; Y210-F442 HydrophobicContact CD2-CD1 3.34Å; Y210-F442 HydrophobicContact CD2-CD2 4.14Å; Y210-F442 HydrophobicContact CD2-CE1 4.04Å; Y210-F442 AromaticContact CD2-CG 3.4Å; Y210-F442 HydrophobicContact CD2-CG 3.4Å; Y210-F442 VanDerWaalsContact CD2-CG 3.4Å; Y210-F442 HydrophobicContact CE2-CB 3.55Å; Y210-F442 HydrophobicContact CE2-CD1 4.02Å; Y210-F442 AromaticContact CE2-CG 3.98Å; Y210-F442 HydrophobicContact CE2-CG 3.98Å; Y210-F442 AromaticContact CG-CD1 3.71Å; Y210-F442 HydrophobicContact CG-CD1 3.71Å; Y210-F442 HydrophobicContact CG-CE1 4.01Å; Y210-F442 HydrophobicContact CG-CG 4.2Å
211	L	93	Very high	91	Very high	108 Å²	108	57.8 Å²	57.8	57%	0.565	29%	0.291	S	S	*	.	H	α-helix	trans	-64.5	-40.4	177	-70.8	174.1	0	0	0	111.8	I207 V208 I214 F215	I207-L211 HydrophobicContact CG2-CD1 4Å; I207-L211 HydrophobicContact CG2-CG 4.4Å; I207-L211 WeakPolarHBondContact O-CG 3.39Å; I207-L211 PolarHBondContact O-N 3.08Å; V208-L211 PolarHBondContact O-N 3.05Å; L211-I214 PolarHBondContact O-N 3.1Å; L211-F215 WeakPolarHBondContact O-CB 3.41Å; L211-F215 PolarHBondContact O-N 3.46Å
212	M	92.3	Very high	92.1	Very high	39 Å²	39	54.5 Å²	54.5	19%	0.192	27%	0.274	C	S	.	.	H	α-helix	trans	-68.3	-39.3	177.8	-69.7	-60.3	-62.4	0	0	112.2	W192 I196 V208 N209 I214 F215 W216	W192-M212 HydrophobicContact CB-CB 3.93Å; W192-M212 HydrophobicContact CB-CG 3.84Å; W192-M212 HydrophobicContact CD2-CE 3.79Å; W192-M212 HydrophobicContact CE3-CE 3.76Å; W192-M212 HydrophobicContact CG-CB 3.86Å; W192-M212 HydrophobicContact CG-CE 4.24Å; W192-M212 HydrophobicContact CG-CG 4.09Å; W192-M212 HydrophobicContact CZ3-CE 4.16Å; I196-M212 HydrophobicContact CD1-CE 4.46Å; I196-M212 HydrophobicContact CD1-CG 4.18Å; I196-M212 HydrophobicContact CD1-SD 4.13Å; V208-M212 HydrophobicContact CG1-CG 4.42Å; V208-M212 WeakPolarHBondContact O-CB 3.3Å; V208-M212 VanDerWaalsContact O-CG 3.31Å; V208-M212 WeakPolarHBondContact O-CG 3.46Å; V208-M212 PolarHBondContact O-N 3.12Å; N209-M212 PolarHBondContact O-N 3.41Å; M212-I214 PolarHBondContact O-N 3.07Å; M212-F215 PolarHBondContact O-N 2.88Å; M212-W216 VanDerWaalsContact O-CD1 3.26Å; M212-W216 PolarHBondContact O-N 3.11Å
213	Y	93.1	Very high	92.7	Very high	5 Å²	5	55.9 Å²	55.9	2%	0.02	27%	0.272	C	S	.	.	H	α-helix	trans	-58.9	-46.9	173.3	-175.2	-87.2	0	0	0	111.6	K156 N209 Y210 A217 A438 F442 R448	K156-Y213 HydrophobicContact CB-CD2 3.68Å; K156-Y213 HydrophobicContact CB-CE2 3.94Å; K156-Y213 HydrophobicContact CB-CG 4.49Å; K156-Y213 HydrophobicContact CD-CD2 4.34Å; K156-Y213 HydrophobicContact CD-CE2 3.95Å; N209-Y213 WeakPolarHBondContact O-CB 3.29Å; N209-Y213 PolarHBondContact O-N 3.42Å; Y210-Y213 PolarHBondContact O-N 2.84Å; Y213-A217 VanDerWaalsContact O-CB 3.31Å; Y213-A217 WeakPolarHBondContact O-CB 3.25Å; Y213-A217 PolarHBondContact O-N 3.41Å; Y213-A217 VanDerWaalsContact O-N 3.08Å; Y213-A438 HydrophobicContact CD1-CB 4.15Å; Y213-A438 HydrophobicContact CE1-CB 4.01Å; Y213-F442 HydrophobicContact CD1-CB 4.35Å; Y213-F442 AromaticContact CD1-CD2 3.96Å; Y213-F442 HydrophobicContact CD1-CD2 3.96Å; Y213-F442 HydrophobicContact CD2-CD2 4.01Å; Y213-F442 HydrophobicContact CD2-CE2 4.4Å; Y213-F442 AromaticContact CG-CD2 3.63Å; Y213-F442 HydrophobicContact CG-CD2 3.63Å; Y213-F442 HydrophobicContact CG-CE2 4.18Å; Y213-R448 HydrophobicContact CD2-CG 4.32Å; Y213-R448 HydrophobicContact CE2-CG 3.64Å; Y213-R448 PolarHBondContact OH-O 3.35Å
214	I	94.8	Very high	93.2	Very high	34 Å²	34	50.7 Å²	50.7	17%	0.174	24%	0.238	C	C	.	.	H	α-helix	trans	-63.9	-43.5	176.1	-67.4	168.1	0	0	0	111.1	Y210 L211 M212 A217 L218 A438	Y210-I214 HydrophobicContact CD2-CD1 3.84Å; Y210-I214 HydrophobicContact CD2-CG1 4.27Å; Y210-I214 HydrophobicContact CE2-CD1 3.57Å; Y210-I214 HydrophobicContact CE2-CG1 4.19Å; Y210-I214 HydrophobicContact CG-CD1 4.47Å; Y210-I214 WeakPolarHBondContact O-CG1 3.35Å; Y210-I214 PolarHBondContact O-N 2.82Å; Y210-I214 VanDerWaalsContact O-N 3.11Å; L211-I214 PolarHBondContact O-N 3.1Å; M212-I214 PolarHBondContact O-N 3.07Å; I214-A217 PolarHBondContact O-N 3.47Å; I214-L218 HydrophobicContact CG2-CD1 3.79Å; I214-L218 HydrophobicContact CG2-CG 4.34Å; I214-L218 WeakPolarHBondContact O-CB 3.4Å; I214-L218 WeakPolarHBondContact O-CG 3.38Å; I214-L218 PolarHBondContact O-N 3.48Å; I214-A438 HydrophobicContact CG1-CB 3.98Å
215	F	95.3	Very high	93.6	Very high	113 Å²	113	44.4 Å²	44.4	50%	0.496	21%	0.21	S	C	.	.	H	α-helix	trans	-59.5	-50.7	179.7	173.8	-98.1	0	0	0	112.1	L211 M212 L218 L219	L211-F215 WeakPolarHBondContact O-CB 3.41Å; L211-F215 PolarHBondContact O-N 3.46Å; M212-F215 PolarHBondContact O-N 2.88Å; F215-L218 PolarHBondContact O-N 3.15Å; F215-L219 HydrophobicContact CE1-CD2 4.24Å; F215-L219 HydrophobicContact CZ-CD2 4.44Å; F215-L219 WeakPolarHBondContact O-CB 3.47Å; F215-L219 PolarHBondContact O-N 3.25Å
216	W	95.4	Very high	94	Very high	44 Å²	44	46.9 Å²	46.9	17%	0.167	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-41.5	178.8	-78.1	114.8	0	0	0	112.5	K156 W192 M212 L218 L219 F220	K156-W216 HydrophobicContact CG-CB 3.92Å; W192-W216 AromaticContact CE2-NE1 3.39Å; W192-W216 AromaticContact CH2-CZ2 3.87Å; W192-W216 HydrophobicContact CH2-CZ2 3.87Å; W192-W216 AromaticContact CH2-NE1 3.83Å; W192-W216 AromaticContact CZ2-CE2 3.69Å; W192-W216 AromaticContact CZ2-CZ2 3.8Å; W192-W216 HydrophobicContact CZ2-CZ2 3.8Å; W192-W216 AromaticContact CZ2-NE1 3.13Å; W192-W216 AromaticContact NE1-CD1 3.9Å; W192-W216 AromaticContact NE1-NE1 3.68Å; M212-W216 VanDerWaalsContact O-CD1 3.26Å; M212-W216 PolarHBondContact O-N 3.11Å; W216-L218 VanDerWaalsContact C-N 3.35Å; W216-L218 PolarHBondContact O-N 3.14Å; W216-L219 HydrophobicContact CE3-CD2 3.87Å; W216-L219 HydrophobicContact CZ3-CD2 3.76Å; W216-L219 PolarHBondContact O-N 2.84Å; W216-F220 HydrophobicContact CB-CE2 4.2Å; W216-F220 HydrophobicContact CD2-CZ 4.32Å; W216-F220 AromaticContact CE3-CE1 3.67Å; W216-F220 HydrophobicContact CE3-CE1 3.67Å; W216-F220 HydrophobicContact CE3-CE2 4.18Å; W216-F220 AromaticContact CE3-CZ 3.48Å; W216-F220 HydrophobicContact CE3-CZ 3.48Å; W216-F220 VanDerWaalsContact CE3-CZ 3.48Å; W216-F220 AromaticContact CZ3-CE1 3.93Å; W216-F220 HydrophobicContact CZ3-CE1 3.93Å; W216-F220 AromaticContact CZ3-CZ 4Å; W216-F220 HydrophobicContact CZ3-CZ 4Å; W216-F220 VanDerWaalsContact O-CD2 3.27Å; W216-F220 WeakPolarHBondContact O-CD2 3.34Å; W216-F220 WeakPolarHBondContact O-CG 3.36Å; W216-F220 PolarHBondContact O-N 3.36Å
217	A	95.3	Very high	94.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.1	-45.2	174.6	0	0	0	0	0	112.2	Y213 I214 S221 S274 T434 A438	Y213-A217 VanDerWaalsContact O-CB 3.31Å; Y213-A217 WeakPolarHBondContact O-CB 3.25Å; Y213-A217 PolarHBondContact O-N 3.41Å; Y213-A217 VanDerWaalsContact O-N 3.08Å; I214-A217 PolarHBondContact O-N 3.47Å; A217-S221 WeakPolarHBondContact O-CB 3.21Å; A217-S221 PolarHBondContact O-N 2.95Å; A217-S221 VanDerWaalsContact O-N 3.08Å; A217-S221 PolarHBondContact O-OG 3.21Å; A217-S274 VanDerWaalsContact CB-O 3.31Å; A217-S274 WeakPolarHBondContact CB-O 3.25Å; A217-T434 HydrophobicContact CB-CG2 3.96Å; A217-T434 WeakPolarHBondContact O-CG2 3.29Å; A217-A438 HydrophobicContact CB-CB 4.06Å
218	L	96.7	Very high	94.4	Very high	51 Å²	51	39.7 Å²	39.7	27%	0.267	20%	0.195	S	C	.	.	H	α-helix	trans	-67.6	-38.9	176.4	-71.8	175.4	0	0	0	112.8	I214 F215 W216 S221 F222 L431 T434 A435	I214-L218 HydrophobicContact CG2-CD1 3.79Å; I214-L218 HydrophobicContact CG2-CG 4.34Å; I214-L218 WeakPolarHBondContact O-CB 3.4Å; I214-L218 WeakPolarHBondContact O-CG 3.38Å; I214-L218 PolarHBondContact O-N 3.48Å; F215-L218 PolarHBondContact O-N 3.15Å; W216-L218 VanDerWaalsContact C-N 3.35Å; W216-L218 PolarHBondContact O-N 3.14Å; L218-S221 WeakPolarHBondContact CA-OG 3.38Å; L218-S221 PolarHBondContact O-OG 2.88Å; L218-S221 VanDerWaalsContact O-OG 3.08Å; L218-F222 WeakPolarHBondContact O-CB 3.41Å; L218-F222 PolarHBondContact O-N 3.01Å; L218-L431 HydrophobicContact CD2-CB 4.48Å; L218-L431 HydrophobicContact CD2-CD2 4.2Å; L218-L431 WeakPolarHBondContact CD2-O 3.34Å; L218-T434 HydrophobicContact CD2-CG2 4.39Å; L218-A435 HydrophobicContact CD2-CB 4.05Å
219	L	96.7	Very high	94.5	Very high	58 Å²	58	46.3 Å²	46.3	30%	0.304	22%	0.218	S	C	.	.	H	α-helix	trans	-63.8	-48.1	177.1	-178.2	60.7	0	0	0	111.8	F215 W216 F222 L223	F215-L219 HydrophobicContact CE1-CD2 4.24Å; F215-L219 HydrophobicContact CZ-CD2 4.44Å; F215-L219 WeakPolarHBondContact O-CB 3.47Å; F215-L219 PolarHBondContact O-N 3.25Å; W216-L219 HydrophobicContact CE3-CD2 3.87Å; W216-L219 HydrophobicContact CZ3-CD2 3.76Å; W216-L219 PolarHBondContact O-N 2.84Å; L219-F222 PolarHBondContact O-N 3.39Å; L219-L223 HydrophobicContact CD1-CD1 4.19Å; L219-L223 HydrophobicContact CD1-CG 4.44Å; L219-L223 HydrophobicContact CG-CD1 4.21Å; L219-L223 VanDerWaalsContact O-CG 3.31Å; L219-L223 WeakPolarHBondContact O-CG 3.48Å; L219-L223 PolarHBondContact O-N 2.89Å
220	F	96.5	Very high	94.6	Very high	10 Å²	10	48.2 Å²	48.2	4%	0.044	24%	0.238	C	C	.	.	H	α-helix	trans	-65.6	-43.7	179.6	-62.1	-34.7	0	0	0	112.2	M152 L155 K156 W216 L223 A224 L270	M152-F220 HydrophobicContact CB-CZ 4.44Å; M152-F220 HydrophobicContact CG-CZ 4.49Å; M152-F220 VanDerWaalsContact O-CE2 3.23Å; M152-F220 WeakPolarHBondContact O-CE2 3.33Å; L155-F220 HydrophobicContact CB-CZ 4.37Å; L155-F220 HydrophobicContact CD1-CZ 4.34Å; K156-F220 HydrophobicContact CG-CE2 4.31Å; W216-F220 HydrophobicContact CB-CE2 4.2Å; W216-F220 HydrophobicContact CD2-CZ 4.32Å; W216-F220 AromaticContact CE3-CE1 3.67Å; W216-F220 HydrophobicContact CE3-CE1 3.67Å; W216-F220 HydrophobicContact CE3-CE2 4.18Å; W216-F220 AromaticContact CE3-CZ 3.48Å; W216-F220 HydrophobicContact CE3-CZ 3.48Å; W216-F220 VanDerWaalsContact CE3-CZ 3.48Å; W216-F220 AromaticContact CZ3-CE1 3.93Å; W216-F220 HydrophobicContact CZ3-CE1 3.93Å; W216-F220 AromaticContact CZ3-CZ 4Å; W216-F220 HydrophobicContact CZ3-CZ 4Å; W216-F220 VanDerWaalsContact O-CD2 3.27Å; W216-F220 WeakPolarHBondContact O-CD2 3.34Å; W216-F220 WeakPolarHBondContact O-CG 3.36Å; W216-F220 PolarHBondContact O-N 3.36Å; F220-L223 PolarHBondContact O-N 3.22Å; F220-A224 WeakPolarHBondContact O-CB 3.49Å; F220-A224 PolarHBondContact O-N 3.41Å; F220-L270 HydrophobicContact CB-CD2 4.36Å; F220-L270 HydrophobicContact CD1-CD2 3.83Å; F220-L270 HydrophobicContact CG-CD2 4.38Å
221	S	96	Very high	94.6	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.007	26%	0.257	C	S	.	.	H	α-helix	trans	-65.8	-37.9	176.8	59	0	0	0	0	112.7	A217 L218 A224 V225 T434	A217-S221 WeakPolarHBondContact O-CB 3.21Å; A217-S221 PolarHBondContact O-N 2.95Å; A217-S221 VanDerWaalsContact O-N 3.08Å; A217-S221 PolarHBondContact O-OG 3.21Å; L218-S221 WeakPolarHBondContact CA-OG 3.38Å; L218-S221 PolarHBondContact O-OG 2.88Å; L218-S221 VanDerWaalsContact O-OG 3.08Å; S221-A224 PolarHBondContact O-N 2.91Å; S221-V225 WeakPolarHBondContact O-CG1 3.03Å; S221-V225 PolarHBondContact O-N 3.09Å; S221-V225 VanDerWaalsContact O-N 3.08Å; S221-T434 VanDerWaalsContact CB-OG1 3.3Å; S221-T434 WeakPolarHBondContact CB-OG1 3.27Å; S221-T434 WeakPolarHBondContact OG-CG2 3.4Å; S221-T434 PolarHBondContact OG-OG1 3.25Å
222	F	96.3	Very high	94.4	Very high	92 Å²	92	47.2 Å²	47.2	40%	0.404	23%	0.231	S	C	.	.	H	α-helix	trans	-59.2	-49.6	173	-179	-114.5	0	0	0	112.2	L218 L219 V225 T226 V427 L431	L218-F222 WeakPolarHBondContact O-CB 3.41Å; L218-F222 PolarHBondContact O-N 3.01Å; L219-F222 PolarHBondContact O-N 3.39Å; F222-V225 WeakPolarHBondContact O-CG1 3.28Å; F222-T226 VanDerWaalsContact O-CB 3.23Å; F222-T226 WeakPolarHBondContact O-CB 3.43Å; F222-T226 PolarHBondContact O-N 3.45Å; F222-T226 PolarHBondContact O-OG1 3.09Å; F222-V427 HydrophobicContact CD2-CG1 4.26Å; F222-V427 HydrophobicContact CE2-CG1 4.26Å; F222-L431 HydrophobicContact CB-CD2 3.85Å; F222-L431 HydrophobicContact CD2-CD1 4.16Å; F222-L431 HydrophobicContact CD2-CD2 4.35Å
223	L	96.1	Very high	94.3	Very high	69 Å²	69	49.3 Å²	49.3	36%	0.361	25%	0.248	S	C	.	.	H	α-helix	trans	-63.9	-44.6	179.1	-69.5	170.7	0	0	0	110.8	L219 F220 T226 L227 L270	L219-L223 HydrophobicContact CD1-CD1 4.19Å; L219-L223 HydrophobicContact CD1-CG 4.44Å; L219-L223 HydrophobicContact CG-CD1 4.21Å; L219-L223 VanDerWaalsContact O-CG 3.31Å; L219-L223 WeakPolarHBondContact O-CG 3.48Å; L219-L223 PolarHBondContact O-N 2.89Å; F220-L223 PolarHBondContact O-N 3.22Å; L223-T226 PolarHBondContact O-N 3.06Å; L223-L227 WeakPolarHBondContact O-CB 3.18Å; L223-L227 VanDerWaalsContact O-CG 3.27Å; L223-L227 WeakPolarHBondContact O-CG 3.49Å; L223-L227 PolarHBondContact O-N 2.92Å; L223-L270 HydrophobicContact CB-CD1 3.99Å
224	A	95.6	Very high	94.1	Very high	1 Å²	1	53.5 Å²	53.5	1%	0.008	27%	0.265	C	S	.	.	H	α-helix	trans	-57.1	-54.8	178.6	0	0	0	0	0	112.4	F220 S221 T226 L227 V228 L270	F220-A224 WeakPolarHBondContact O-CB 3.49Å; F220-A224 PolarHBondContact O-N 3.41Å; S221-A224 PolarHBondContact O-N 2.91Å; A224-T226 VanDerWaalsContact C-N 3.34Å; A224-T226 PolarHBondContact O-N 3.4Å; A224-L227 PolarHBondContact O-N 3.43Å; A224-V228 WeakPolarHBondContact O-CG2 3.48Å; A224-V228 PolarHBondContact O-N 2.66Å; A224-V228 VanDerWaalsContact O-N 3.12Å; A224-L270 HydrophobicContact CB-CB 3.93Å
225	V	95	Very high	93.9	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-67.7	-33.9	-178.1	69.7	0	0	0	0	112.4	S221 F222 R229 V427 V430 V523	S221-V225 WeakPolarHBondContact O-CG1 3.03Å; S221-V225 PolarHBondContact O-N 3.09Å; S221-V225 VanDerWaalsContact O-N 3.08Å; F222-V225 WeakPolarHBondContact O-CG1 3.28Å; V225-R229 VanDerWaalsContact O-CB 3.26Å; V225-R229 WeakPolarHBondContact O-CB 3.37Å; V225-R229 PolarHBondContact O-N 3.44Å; V225-V427 HydrophobicContact CG1-CB 4.23Å; V225-V427 HydrophobicContact CG1-CG1 3.89Å; V225-V427 HydrophobicContact CG1-CG2 4.13Å; V225-V427 HydrophobicContact CG2-CG2 4.12Å; V225-V430 HydrophobicContact CB-CB 4.26Å; V225-V430 HydrophobicContact CB-CG1 4.17Å; V225-V430 HydrophobicContact CB-CG2 4.2Å; V225-V430 HydrophobicContact CG1-CB 4.35Å; V225-V430 HydrophobicContact CG1-CG1 4.32Å; V225-V430 HydrophobicContact CG2-CB 4.32Å; V225-V430 HydrophobicContact CG2-CG2 3.88Å; V225-V523 HydrophobicContact CB-CG1 4.01Å; V225-V523 HydrophobicContact CG2-CG1 4.45Å
226	T	94.3	Very high	93.7	Very high	55 Å²	55	48.2 Å²	48.2	34%	0.337	24%	0.244	S	C	.	.	H	α-helix	trans	-68.5	-45.4	179.2	-59	0	0	0	0	111.1	F222 L223 A224 R229 A230	F222-T226 VanDerWaalsContact O-CB 3.23Å; F222-T226 WeakPolarHBondContact O-CB 3.43Å; F222-T226 PolarHBondContact O-N 3.45Å; F222-T226 PolarHBondContact O-OG1 3.09Å; L223-T226 PolarHBondContact O-N 3.06Å; A224-T226 VanDerWaalsContact C-N 3.34Å; A224-T226 PolarHBondContact O-N 3.4Å; T226-R229 PolarHBondContact O-N 3.25Å; T226-A230 WeakPolarHBondContact O-CB 3.18Å; T226-A230 PolarHBondContact O-N 2.87Å
227	L	94.4	Very high	93.5	Very high	46 Å²	46	47 Å²	47	24%	0.241	25%	0.245	C	C	.	.	H	α-helix	trans	-63.2	-45.5	177.2	-73	173.3	0	0	0	112.2	L223 A224 R229 A230 F231 I266 T267 L270	L223-L227 WeakPolarHBondContact O-CB 3.18Å; L223-L227 VanDerWaalsContact O-CG 3.27Å; L223-L227 WeakPolarHBondContact O-CG 3.49Å; L223-L227 PolarHBondContact O-N 2.92Å; A224-L227 PolarHBondContact O-N 3.43Å; L227-R229 PolarHBondContact O-N 3.34Å; L227-A230 PolarHBondContact O-N 3.41Å; L227-F231 HydrophobicContact CD2-CD2 3.89Å; L227-F231 HydrophobicContact CD2-CE2 3.78Å; L227-F231 PolarHBondContact O-N 3.08Å; L227-I266 HydrophobicContact CD1-CG2 4.17Å; L227-T267 HydrophobicContact CB-CG2 3.47Å; L227-T267 VanDerWaalsContact CB-CG2 3.47Å; L227-T267 HydrophobicContact CD1-CG2 3.88Å; L227-T267 HydrophobicContact CG-CG2 4.34Å; L227-L270 HydrophobicContact CD1-CD1 4.06Å
228	V	93.6	Very high	93.2	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.012	25%	0.246	C	C	.	.	H	α-helix	trans	-60.4	-46.8	176.2	172.2	0	0	0	0	111.1	A224 A232 P233 A235 C236 I263 T267 P524	A224-V228 WeakPolarHBondContact O-CG2 3.48Å; A224-V228 PolarHBondContact O-N 2.66Å; A224-V228 VanDerWaalsContact O-N 3.12Å; V228-A232 CarbonylContact O-C 3.52Å; V228-A232 PolarHBondContact O-N 2.71Å; V228-P233 WeakPolarHBondContact O-CA 3.33Å; V228-P233 VanDerWaalsContact O-N 3.16Å; V228-A235 HydrophobicContact CG1-CB 4.37Å; V228-A235 HydrophobicContact CG2-CB 4.21Å; V228-C236 WeakPolarHBondContact CG1-SG 3.4Å; V228-I263 HydrophobicContact CG2-CG2 4.45Å; V228-T267 HydrophobicContact CG2-CG2 3.9Å; V228-T267 WeakPolarHBondContact CG2-OG1 3.33Å; V228-P524 HydrophobicContact CG2-CG 4.28Å
229	R	91.7	Very high	93	Very high	157 Å²	157	44.7 Å²	44.7	59%	0.592	23%	0.233	S	C	*	.	H	α-helix	trans	-68.2	-37.5	-178.5	-174.2	179	179.8	179.1	2.4	113.1	V225 T226 L227	V225-R229 VanDerWaalsContact O-CB 3.26Å; V225-R229 WeakPolarHBondContact O-CB 3.37Å; V225-R229 PolarHBondContact O-N 3.44Å; T226-R229 PolarHBondContact O-N 3.25Å; L227-R229 PolarHBondContact O-N 3.34Å
230	A	91.8	Very high	92.8	Very high	72 Å²	72	42 Å²	42	60%	0.595	22%	0.22	S	C	*	.	H	α-helix	trans	-81.2	-40.4	-174.8	0	0	0	0	0	113.4	T226 L227	T226-A230 WeakPolarHBondContact O-CB 3.18Å; T226-A230 PolarHBondContact O-N 2.87Å; L227-A230 PolarHBondContact O-N 3.41Å
231	F	91.9	Very high	92.7	Very high	137 Å²	137	41.9 Å²	41.9	60%	0.601	22%	0.22	S	C	*	.	H	α-helix	trans	-109.3	-36.5	-169.9	-65.7	-76.5	0	0	0	114.7	L227 I263	L227-F231 HydrophobicContact CD2-CD2 3.89Å; L227-F231 HydrophobicContact CD2-CE2 3.78Å; L227-F231 PolarHBondContact O-N 3.08Å; F231-I263 HydrophobicContact CB-CD1 3.62Å; F231-I263 HydrophobicContact CB-CG1 3.76Å; F231-I263 HydrophobicContact CD2-CD1 4.12Å; F231-I263 HydrophobicContact CG-CD1 4Å
232	A	90.6	Very high	92.5	Very high	4 Å²	4	43.1 Å²	43.1	3%	0.033	23%	0.225	C	C	.	.			trans	-154.2	81	-171.1	0	0	0	0	0	112.5	V228 Y234 A235 T260 I263	V228-A232 CarbonylContact O-C 3.52Å; V228-A232 PolarHBondContact O-N 2.71Å; A232-Y234 PolarHBondContact O-N 3.2Å; A232-Y234 VanDerWaalsContact O-N 3.15Å; A232-A235 HydrophobicContact CB-CB 4.36Å; A232-A235 VanDerWaalsContact O-CB 3.23Å; A232-A235 WeakPolarHBondContact O-CB 3.34Å; A232-A235 PolarHBondContact O-N 3.28Å; A232-T260 HydrophobicContact CB-CG2 4.25Å; A232-I263 HydrophobicContact CB-CB 3.79Å; A232-I263 HydrophobicContact CB-CG1 3.92Å; A232-I263 HydrophobicContact CB-CG2 3.94Å
233	P	88.8	Confident	92.3	Very high	83 Å²	83	39 Å²	39	54%	0.539	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-60.6	-28.5	-178.6	23.2	-33.8	0	0	0	113	V228 A235 C236	V228-P233 WeakPolarHBondContact O-CA 3.33Å; V228-P233 VanDerWaalsContact O-N 3.16Å; P233-A235 PolarHBondContact O-N 3.47Å; P233-A235 VanDerWaalsContact O-N 3.14Å; P233-C236 PolarHBondContact O-N 3.07Å; P233-C236 PolarHBondContact O-SG 2.75Å
234	Y	89.2	Confident	92.1	Very high	94 Å²	94	36.1 Å²	36.1	37%	0.369	19%	0.192	S	C	.	.	G	3₁₀ helix	trans	-64.3	-8.7	172.8	-65.7	-54.1	0	0	0	114.8	A232 C236 I252 Y255	A232-Y234 PolarHBondContact O-N 3.2Å; A232-Y234 VanDerWaalsContact O-N 3.15Å; Y234-C236 VanDerWaalsContact C-N 3.3Å; Y234-I252 HydrophobicContact CE1-CG2 4.44Å; Y234-Y255 AromaticContact CD1-CD2 3.91Å; Y234-Y255 HydrophobicContact CD1-CD2 3.91Å; Y234-Y255 HydrophobicContact CG-CD2 4.07Å; Y234-Y255 WeakPolarHBondContact O-CE2 3.31Å
235	A	90.3	Very high	91.8	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-74	-18	174.3	0	0	0	0	0	113.6	V228 A232 P233 I263 K264	V228-A235 HydrophobicContact CG1-CB 4.37Å; V228-A235 HydrophobicContact CG2-CB 4.21Å; A232-A235 HydrophobicContact CB-CB 4.36Å; A232-A235 VanDerWaalsContact O-CB 3.23Å; A232-A235 WeakPolarHBondContact O-CB 3.34Å; A232-A235 PolarHBondContact O-N 3.28Å; P233-A235 PolarHBondContact O-N 3.47Å; P233-A235 VanDerWaalsContact O-N 3.14Å; A235-I263 HydrophobicContact CB-CG2 4.32Å; A235-K264 HydrophobicContact CB-CB 3.89Å; A235-K264 HydrophobicContact CB-CG 4.31Å; A235-K264 WeakPolarHBondContact O-CE 3.46Å; A235-K264 PolarHBondContact O-NZ 3.07Å
236	C	90.7	Very high	91.6	Very high	35 Å²	35	36.6 Å²	36.6	24%	0.236	19%	0.194	C	C	.	.			trans	-52.4	156.3	178.6	-66	0	0	0	0	113.4	V228 P233 Y234 K264	V228-C236 WeakPolarHBondContact CG1-SG 3.4Å; P233-C236 PolarHBondContact O-N 3.07Å; P233-C236 PolarHBondContact O-SG 2.75Å; Y234-C236 VanDerWaalsContact C-N 3.3Å; C236-K264 PolarHBondContact O-NZ 3.12Å
237	G	91.1	Very high	91.4	Very high	18 Å²	18	34.3 Å²	34.3	19%	0.186	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	71.3	-173.5	169.5	0	0	0	0	0	114.6	K264 V523 S525	G237-K264 PolarHBondContact O-NZ 3.01Å; G237-V523 PolarHBondContact N-O 3.14Å; G237-S525 CarbonylContact C-O 3.56Å; G237-S525 VanDerWaalsContact CA-OG 3.31Å; G237-S525 WeakPolarHBondContact CA-OG 3.5Å; G237-S525 PolarHBondContact O-N 3.26Å
238	S	90.9	Very high	90.9	Very high	4 Å²	4	33 Å²	33	3%	0.028	17%	0.174	C	C	.	.			trans	-70.1	-48	175	-167.7	0	0	0	0	111	K264 G282 P283 S525	S238-K264 PolarHBondContact O-NZ 3.45Å; S238-G282 WeakPolarHBondContact OG-CA 3.34Å; S238-P283 WeakPolarHBondContact O-CA 3.37Å; S238-S525 WeakPolarHBondContact CA-O 3.41Å; S238-S525 VanDerWaalsContact CB-O 3.3Å; S238-S525 WeakPolarHBondContact CB-O 3.39Å; S238-S525 PolarHBondContact N-O 2.99Å
239	G	91.6	Very high	90.4	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	S	Bend	trans	95.1	-10.4	-174.2	0	0	0	0	0	115.4	E242 I243 Y255	G239-E242 VanDerWaalsContact CA-OE2 3.23Å; G239-E242 WeakPolarHBondContact CA-OE2 3.44Å; G239-E242 PolarHBondContact O-N 2.82Å; G239-I243 WeakPolarHBondContact O-CB 3.42Å; G239-I243 VanDerWaalsContact O-CD1 3.28Å; G239-I243 WeakPolarHBondContact O-CD1 3.4Å; G239-I243 WeakPolarHBondContact O-CG1 3.48Å; G239-I243 PolarHBondContact O-N 2.73Å; G239-Y255 WeakPolarHBondContact CA-OH 3.47Å
240	I	93.6	Very high	90.2	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.01	15%	0.147	C	C	.	.	H	α-helix	trans	-60.3	-44.4	173.1	-65.4	166.2	0	0	0	112	E242 I243 K244 V285 F334 F528 Y631	I240-E242 VanDerWaalsContact C-N 3.34Å; I240-E242 PolarHBondContact O-N 2.77Å; I240-I243 PolarHBondContact O-N 3.5Å; I240-K244 WeakPolarHBondContact O-CB 3.21Å; I240-K244 PolarHBondContact O-N 2.88Å; I240-V285 HydrophobicContact CD1-CG2 4.24Å; I240-V285 HydrophobicContact CG1-CB 4.22Å; I240-V285 HydrophobicContact CG1-CG1 4.4Å; I240-V285 HydrophobicContact CG1-CG2 4.34Å; I240-F334 HydrophobicContact CD1-CZ 4.22Å; I240-F528 HydrophobicContact CD1-CE2 4.25Å; I240-F528 HydrophobicContact CD1-CZ 3.82Å; I240-Y631 HydrophobicContact CB-CD1 4.13Å; I240-Y631 HydrophobicContact CB-CE1 3.96Å; I240-Y631 HydrophobicContact CD1-CE1 4.16Å; I240-Y631 HydrophobicContact CD1-CE2 4.37Å; I240-Y631 WeakPolarHBondContact CD1-OH 3.44Å; I240-Y631 HydrophobicContact CG2-CD1 4.04Å; I240-Y631 HydrophobicContact CG2-CD2 3.99Å; I240-Y631 HydrophobicContact CG2-CE1 4.14Å; I240-Y631 HydrophobicContact CG2-CE2 4.1Å; I240-Y631 HydrophobicContact CG2-CG 3.97Å
241	P	92.5	Very high	89.9	Confident	7 Å²	7	23.1 Å²	23.1	5%	0.045	12%	0.123	C	C	.	.	H	α-helix	trans	-52.6	-49.9	173.6	-29.3	37.9	0	0	0	112.8	K244 T245 Y631 H634 I635	P241-K244 PolarHBondContact O-N 2.69Å; P241-T245 WeakPolarHBondContact O-CG2 3.35Å; P241-T245 PolarHBondContact O-N 3.2Å; P241-Y631 HydrophobicContact CG-CD1 3.86Å; P241-H634 HydrophobicContact CB-CB 4.46Å; P241-H634 HydrophobicContact CG-CB 4.11Å; P241-I635 HydrophobicContact CB-CG1 3.82Å
242	E	91.9	Very high	89.6	Confident	27 Å²	27	17.2 Å²	17.2	13%	0.126	10%	0.098	C	C	.	.	H	α-helix	trans	-67.5	-42.7	-177.5	-65.4	72.8	-160.2	0	0	111.1	G239 I240 K244 T245 I246 Y255 Y640	G239-E242 VanDerWaalsContact CA-OE2 3.23Å; G239-E242 WeakPolarHBondContact CA-OE2 3.44Å; G239-E242 PolarHBondContact O-N 2.82Å; I240-E242 VanDerWaalsContact C-N 3.34Å; I240-E242 PolarHBondContact O-N 2.77Å; E242-K244 PolarHBondContact O-N 3.27Å; E242-T245 PolarHBondContact O-N 3.44Å; E242-T245 PolarHBondContact O-OG1 3.1Å; E242-I246 WeakPolarHBondContact O-CG1 3.45Å; E242-I246 PolarHBondContact O-N 3.37Å; E242-Y255 HydrophobicContact CB-CD1 4.28Å; E242-Y255 HydrophobicContact CB-CD2 4.5Å; E242-Y255 HydrophobicContact CB-CE1 3.59Å; E242-Y255 HydrophobicContact CB-CE2 3.87Å; E242-Y255 HydrophobicContact CG-CE1 4.42Å; E242-Y255 HydrophobicContact CG-CE2 3.78Å; E242-Y640 HydrophobicContact CG-CE2 4.32Å
243	I	93.4	Very high	89.3	Confident	4 Å²	4	23 Å²	23	2%	0.021	12%	0.119	C	C	.	.	H	α-helix	trans	-61.3	-43.8	174.8	-64.9	158.8	0	0	0	111.1	G239 I240 T245 I246 L247 V285 H286 C289 V339	G239-I243 WeakPolarHBondContact O-CB 3.42Å; G239-I243 VanDerWaalsContact O-CD1 3.28Å; G239-I243 WeakPolarHBondContact O-CD1 3.4Å; G239-I243 WeakPolarHBondContact O-CG1 3.48Å; G239-I243 PolarHBondContact O-N 2.73Å; I240-I243 PolarHBondContact O-N 3.5Å; I243-T245 VanDerWaalsContact C-N 3.29Å; I243-T245 PolarHBondContact O-N 3.5Å; I243-I246 PolarHBondContact O-N 2.79Å; I243-I246 VanDerWaalsContact O-N 3.11Å; I243-L247 HydrophobicContact CG2-CD1 4.27Å; I243-L247 HydrophobicContact CG2-CG 4.31Å; I243-L247 WeakPolarHBondContact O-CG 3.29Å; I243-L247 PolarHBondContact O-N 3.47Å; I243-V285 HydrophobicContact CD1-CG1 4.19Å; I243-H286 HydrophobicContact CD1-CB 3.91Å; I243-C289 HydrophobicContact CD1-CB 4.29Å; I243-V339 HydrophobicContact CG2-CG1 3.7Å
244	K	91.6	Very high	89	Confident	9 Å²	9	21.4 Å²	21.4	4%	0.039	12%	0.117	C	C	.	.	H	α-helix	trans	-59.8	-38.4	176	-170.2	168.5	-178.1	170.1	0	111	I240 P241 E242 S248 E338 E632 I635 F642	I240-K244 WeakPolarHBondContact O-CB 3.21Å; I240-K244 PolarHBondContact O-N 2.88Å; P241-K244 PolarHBondContact O-N 2.69Å; E242-K244 PolarHBondContact O-N 3.27Å; K244-S248 WeakPolarHBondContact O-CB 3.38Å; K244-S248 PolarHBondContact O-N 2.82Å; K244-E338 WeakPolarHBondContact CD-O 3.46Å; K244-E338 WeakPolarHBondContact CE-O 3.13Å; K244-E338 PolarHBondContact NZ-O 3.11Å; K244-E338 IonicContact NZ-OE2 3.25Å; K244-E338 PolarHBondContact NZ-OE2 3.39Å; K244-E632 IonicContact NZ-OE1 2.68Å; K244-E632 PolarHBondContact NZ-OE1 2.71Å; K244-I635 HydrophobicContact CB-CD1 4.12Å; K244-I635 HydrophobicContact CD-CD1 4.08Å; K244-I635 HydrophobicContact CG-CD1 4.13Å; K244-F642 HydrophobicContact CD-CE1 4.5Å; K244-F642 HydrophobicContact CD-CZ 4.09Å; K244-F642 HydrophobicContact CG-CE1 4.46Å; K244-F642 HydrophobicContact CG-CE2 3.87Å; K244-F642 HydrophobicContact CG-CZ 3.7Å
245	T	89.8	Confident	89.1	Confident	1 Å²	1	17.2 Å²	17.2	1%	0.006	10%	0.101	C	C	.	.	H	α-helix	trans	-69.2	-39.2	172.1	67.7	0	0	0	0	113.5	P241 E242 I243 S248 F250 I635 Y640 F642	P241-T245 WeakPolarHBondContact O-CG2 3.35Å; P241-T245 PolarHBondContact O-N 3.2Å; E242-T245 PolarHBondContact O-N 3.44Å; E242-T245 PolarHBondContact O-OG1 3.1Å; I243-T245 VanDerWaalsContact C-N 3.29Å; I243-T245 PolarHBondContact O-N 3.5Å; T245-S248 WeakPolarHBondContact O-CB 3.35Å; T245-S248 PolarHBondContact O-N 3.16Å; T245-F250 VanDerWaalsContact O-CB 3.23Å; T245-F250 WeakPolarHBondContact O-CB 3.24Å; T245-F250 PolarHBondContact O-N 3.16Å; T245-F250 VanDerWaalsContact O-N 3.14Å; T245-I635 HydrophobicContact CG2-CD1 4.01Å; T245-I635 HydrophobicContact CG2-CG1 3.86Å; T245-I635 HydrophobicContact CG2-CG2 4.02Å; T245-Y640 HydrophobicContact CG2-CD2 4Å; T245-Y640 HydrophobicContact CG2-CG 3.98Å; T245-F642 HydrophobicContact CG2-CB 4.44Å
246	I	91.1	Very high	89.2	Confident	11 Å²	11	18 Å²	18	6%	0.056	11%	0.105	C	C	.	.	H	α-helix	trans	-65.2	-43.9	178	-69.5	165.2	0	0	0	110.4	E242 I243 S248 G249 F250 I252 Y255 L256 R310 L313	E242-I246 WeakPolarHBondContact O-CG1 3.45Å; E242-I246 PolarHBondContact O-N 3.37Å; I243-I246 PolarHBondContact O-N 2.79Å; I243-I246 VanDerWaalsContact O-N 3.11Å; I246-S248 VanDerWaalsContact C-N 3.31Å; I246-S248 PolarHBondContact O-N 3.36Å; I246-G249 WeakPolarHBondContact O-CA 3.19Å; I246-G249 PolarHBondContact O-N 2.86Å; I246-F250 WeakPolarHBondContact CA-O 3.21Å; I246-I252 HydrophobicContact CD1-CB 4.48Å; I246-I252 HydrophobicContact CG1-CD1 4.36Å; I246-I252 HydrophobicContact CG1-CG1 4.33Å; I246-Y255 HydrophobicContact CD1-CD1 3.74Å; I246-Y255 HydrophobicContact CD1-CE1 4.45Å; I246-Y255 HydrophobicContact CD1-CG 4.4Å; I246-L256 HydrophobicContact CD1-CD1 4.38Å; I246-L256 HydrophobicContact CD1-CG 4.4Å; I246-R310 PolarHBondContact O-NE 3.19Å; I246-L313 HydrophobicContact CG2-CD1 4.33Å
247	L	89.7	Confident	89.2	Confident	8 Å²	8	17.3 Å²	17.3	4%	0.042	10%	0.104	C	C	.	.	H	α-helix	trans	-69	-25.2	175.6	-66.4	-172.4	0	0	0	113.2	W92 I243 G249 R310 L313 V339	W92-L247 WeakPolarHBondContact CZ2-O 3.44Å; I243-L247 HydrophobicContact CG2-CD1 4.27Å; I243-L247 HydrophobicContact CG2-CG 4.31Å; I243-L247 WeakPolarHBondContact O-CG 3.29Å; I243-L247 PolarHBondContact O-N 3.47Å; L247-G249 PolarHBondContact O-N 3.02Å; L247-R310 HydrophobicContact CD2-CB 3.96Å; L247-R310 HydrophobicContact CD2-CG 4.1Å; L247-R310 WeakPolarHBondContact CD2-O 3.08Å; L247-L313 HydrophobicContact CD2-CB 3.89Å; L247-V339 HydrophobicContact CD1-CB 4.4Å; L247-V339 HydrophobicContact CD1-CG1 3.73Å
248	S	84.3	Confident	89.3	Confident	18 Å²	18	23 Å²	23	13%	0.126	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	-2.6	166.5	-166.3	0	0	0	0	113.6	K244 T245 I246 K798	K244-S248 WeakPolarHBondContact O-CB 3.38Å; K244-S248 PolarHBondContact O-N 2.82Å; T245-S248 WeakPolarHBondContact O-CB 3.35Å; T245-S248 PolarHBondContact O-N 3.16Å; I246-S248 VanDerWaalsContact C-N 3.31Å; I246-S248 PolarHBondContact O-N 3.36Å; S248-K798 PolarHBondContact OG-NZ 3.45Å
249	G	83.1	Confident	89.3	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.01	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.6	2.3	177.8	0	0	0	0	0	114.8	T89 I90 I246 L247	T89-G249 CarbonylContact C-O 3.41Å; T89-G249 WeakPolarHBondContact CA-O 3.34Å; I90-G249 PolarHBondContact N-O 2.98Å; I246-G249 WeakPolarHBondContact O-CA 3.19Å; I246-G249 PolarHBondContact O-N 2.86Å; L247-G249 PolarHBondContact O-N 3.02Å
250	F	86.1	Confident	89.4	Confident	4 Å²	4	30.9 Å²	30.9	2%	0.018	15%	0.153	C	C	.	.	B	Isolated β-bridge	trans	-72	157	171.9	-159.4	-125.1	0	0	0	110.9	F87 T89 T245 I246 I252 R310 Y640 P641	F87-F250 HydrophobicContact CB-CE2 4.39Å; F87-F250 HydrophobicContact CB-CZ 3.83Å; F87-F250 AromaticContact CD1-CE1 3.83Å; F87-F250 HydrophobicContact CD1-CE1 3.83Å; F87-F250 AromaticContact CD1-CZ 3.72Å; F87-F250 HydrophobicContact CD1-CZ 3.72Å; F87-F250 HydrophobicContact CG-CZ 4.22Å; F87-F250 WeakPolarHBondContact O-CE2 3.5Å; T89-F250 HydrophobicContact CG2-CD2 4.1Å; T245-F250 VanDerWaalsContact O-CB 3.23Å; T245-F250 WeakPolarHBondContact O-CB 3.24Å; T245-F250 PolarHBondContact O-N 3.16Å; T245-F250 VanDerWaalsContact O-N 3.14Å; I246-F250 WeakPolarHBondContact CA-O 3.21Å; F250-I252 HydrophobicContact CD1-CD1 4.13Å; F250-I252 HydrophobicContact CD1-CG1 3.7Å; F250-I252 HydrophobicContact CE1-CD1 4.39Å; F250-I252 HydrophobicContact CE1-CG1 3.92Å; F250-R310 PolarHBondContact O-NH2 2.85Å; F250-Y640 HydrophobicContact CD1-CD1 4.36Å; F250-Y640 AromaticContact CE1-CD1 3.87Å; F250-Y640 HydrophobicContact CE1-CD1 3.87Å; F250-Y640 HydrophobicContact CE1-CE1 4.3Å; F250-P641 HydrophobicContact CD2-CG 3.58Å; F250-P641 HydrophobicContact CE2-CG 3.44Å; F250-P641 VanDerWaalsContact CE2-CG 3.44Å; F250-P641 HydrophobicContact CG-CG 4.27Å; F250-P641 HydrophobicContact CZ-CG 4.03Å
251	I	86	Confident	89.5	Confident	19 Å²	19	31.7 Å²	31.7	10%	0.097	16%	0.157	C	C	.	.			trans	-122.2	125	176.2	-71.2	172.9	0	0	0	109.2	Y84 F87 N88 I90 R253 R310	Y84-I251 HydrophobicContact CD2-CD1 4.05Å; Y84-I251 HydrophobicContact CG-CD1 3.89Å; F87-I251 WeakPolarHBondContact CA-O 3.43Å; F87-I251 PolarHBondContact N-O 3.09Å; N88-I251 PolarHBondContact O-N 2.9Å; I90-I251 HydrophobicContact CG2-CD1 3.52Å; I90-I251 HydrophobicContact CG2-CG1 4.07Å; I251-R253 HydrophobicContact CG2-CG 4.01Å; I251-R310 VanDerWaalsContact CG1-NH2 3.3Å
252	I	86.5	Confident	89.7	Confident	12 Å²	12	35.4 Å²	35.4	6%	0.062	18%	0.176	C	C	.	.			trans	-124.5	102.9	172.1	-49.8	176.1	0	0	0	106.7	D86 Y234 I246 F250 Y255 Y640	D86-I252 WeakPolarHBondContact OD1-CA 3.44Å; Y234-I252 HydrophobicContact CE1-CG2 4.44Å; I246-I252 HydrophobicContact CD1-CB 4.48Å; I246-I252 HydrophobicContact CG1-CD1 4.36Å; I246-I252 HydrophobicContact CG1-CG1 4.33Å; F250-I252 HydrophobicContact CD1-CD1 4.13Å; F250-I252 HydrophobicContact CD1-CG1 3.7Å; F250-I252 HydrophobicContact CE1-CD1 4.39Å; F250-I252 HydrophobicContact CE1-CG1 3.92Å; I252-Y255 HydrophobicContact CG2-CG 4.49Å; I252-Y640 HydrophobicContact CD1-CE1 4.01Å
253	R	83.1	Confident	89.9	Confident	127 Å²	127	34.8 Å²	34.8	48%	0.479	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.2	149.3	-178	-64.6	-178.2	172.3	-164.5	-4	110.6	Y84 D86 I251 Y255	Y84-R253 PolarHBondContact O-NH2 3Å; D86-R253 HydrophobicContact CB-CB 4.5Å; D86-R253 HydrophobicContact CB-CG 4.1Å; D86-R253 WeakPolarHBondContact OD1-CG 3.31Å; D86-R253 PolarHBondContact OD1-N 3.01Å; I251-R253 HydrophobicContact CG2-CG 4.01Å; R253-Y255 PolarHBondContact O-N 2.66Å
254	G	83.7	Confident	90	Very high	49 Å²	49	34.6 Å²	34.6	51%	0.505	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	-20.1	-177.8	0	0	0	0	0	115.4	G257 T260	G254-G257 PolarHBondContact O-N 3.02Å; G254-G257 VanDerWaalsContact O-N 3.16Å; G254-T260 WeakPolarHBondContact O-CG2 3.43Å
255	Y	90.4	Very high	90.2	Very high	6 Å²	6	35.4 Å²	35.4	2%	0.024	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-53	179.7	-167.8	-100.5	0	0	0	112.5	Y234 G239 E242 I246 I252 R253 G257 T260 H286	Y234-Y255 AromaticContact CD1-CD2 3.91Å; Y234-Y255 HydrophobicContact CD1-CD2 3.91Å; Y234-Y255 HydrophobicContact CG-CD2 4.07Å; Y234-Y255 WeakPolarHBondContact O-CE2 3.31Å; G239-Y255 WeakPolarHBondContact CA-OH 3.47Å; E242-Y255 HydrophobicContact CB-CD1 4.28Å; E242-Y255 HydrophobicContact CB-CD2 4.5Å; E242-Y255 HydrophobicContact CB-CE1 3.59Å; E242-Y255 HydrophobicContact CB-CE2 3.87Å; E242-Y255 HydrophobicContact CG-CE1 4.42Å; E242-Y255 HydrophobicContact CG-CE2 3.78Å; I246-Y255 HydrophobicContact CD1-CD1 3.74Å; I246-Y255 HydrophobicContact CD1-CE1 4.45Å; I246-Y255 HydrophobicContact CD1-CG 4.4Å; I252-Y255 HydrophobicContact CG2-CG 4.49Å; R253-Y255 PolarHBondContact O-N 2.66Å; Y255-G257 PolarHBondContact O-N 3.26Å; Y255-T260 WeakPolarHBondContact O-CB 3.32Å; Y255-T260 PolarHBondContact O-OG1 2.82Å; Y255-H286 AromaticContact CD1-NE2 3.4Å; Y255-H286 WeakPolarHBondContact CD1-NE2 3.29Å; Y255-H286 AromaticContact CE1-CD2 3.5Å; Y255-H286 VanDerWaalsContact CE1-CD2 3.5Å; Y255-H286 WeakPolarHBondContact CE1-CD2 3.46Å; Y255-H286 AromaticContact CE1-CE1 3.47Å; Y255-H286 VanDerWaalsContact CE1-CE1 3.47Å; Y255-H286 WeakPolarHBondContact CE1-CE1 3.46Å; Y255-H286 AromaticContact CE1-NE2 3.02Å; Y255-H286 WeakPolarHBondContact CE1-NE2 3.33Å; Y255-H286 AromaticContact CZ-CE1 3.48Å; Y255-H286 VanDerWaalsContact CZ-CE1 3.48Å; Y255-H286 AromaticContact CZ-NE2 3.57Å; Y255-H286 PolarHBondContact O-NE2 2.96Å
256	L	92.1	Very high	90.5	Very high	16 Å²	16	39.4 Å²	39.4	8%	0.084	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	31	176.6	-59	173	0	0	0	113.3	I246 C289 N293 L313	I246-L256 HydrophobicContact CD1-CD1 4.38Å; I246-L256 HydrophobicContact CD1-CG 4.4Å; L256-C289 HydrophobicContact CD2-CB 3.93Å; L256-N293 HydrophobicContact CB-CB 3.85Å; L256-N293 HydrophobicContact CD1-CB 4.34Å; L256-N293 PolarHBondContact O-ND2 2.95Å; L256-L313 HydrophobicContact CD1-CD1 3.69Å; L256-L313 HydrophobicContact CD1-CD2 3.85Å; L256-L313 HydrophobicContact CD1-CG 4.45Å
257	G	90.6	Very high	90.7	Very high	21 Å²	21	38.9 Å²	38.9	22%	0.216	20%	0.196	C	C	.	.			trans	-80.4	163	-174.2	0	0	0	0	0	115.1	G254 Y255 W259 T260 L261	G254-G257 PolarHBondContact O-N 3.02Å; G254-G257 VanDerWaalsContact O-N 3.16Å; Y255-G257 PolarHBondContact O-N 3.26Å; G257-W259 VanDerWaalsContact C-N 3.29Å; G257-W259 PolarHBondContact O-N 3.42Å; G257-T260 PolarHBondContact N-OG1 3.19Å; G257-T260 VanDerWaalsContact N-OG1 3.08Å; G257-T260 PolarHBondContact O-N 2.94Å; G257-T260 PolarHBondContact O-OG1 2.69Å; G257-L261 PolarHBondContact O-N 3.17Å
258	K	92.7	Very high	91	Very high	137 Å²	137	38.5 Å²	38.5	60%	0.596	19%	0.194	S	C	*	.	H	α-helix	trans	-63.4	-33.4	172.8	66.2	178.5	-177	175.5	0	113.5	I262 I294	K258-I262 WeakPolarHBondContact O-CG1 3.34Å; K258-I262 PolarHBondContact O-N 2.96Å; K258-I262 VanDerWaalsContact O-N 3.16Å; K258-I294 HydrophobicContact CB-CD1 4.03Å
259	W	92.2	Very high	91.5	Very high	164 Å²	164	38 Å²	38	62%	0.621	19%	0.19	S	C	*	.	H	α-helix	trans	-73.4	-37.5	177.7	-69.6	121.4	0	0	0	112.4	G257 I263	G257-W259 VanDerWaalsContact C-N 3.29Å; G257-W259 PolarHBondContact O-N 3.42Å; W259-I263 WeakPolarHBondContact O-CB 3.48Å; W259-I263 WeakPolarHBondContact O-CG1 3.46Å; W259-I263 PolarHBondContact O-N 3.26Å
260	T	94.2	Very high	92.2	Very high	6 Å²	6	38.7 Å²	38.7	4%	0.037	19%	0.194	C	C	.	.	H	α-helix	trans	-68.2	-37.4	174.9	55.7	0	0	0	0	110.9	A232 G254 Y255 G257 K264	A232-T260 HydrophobicContact CB-CG2 4.25Å; G254-T260 WeakPolarHBondContact O-CG2 3.43Å; Y255-T260 WeakPolarHBondContact O-CB 3.32Å; Y255-T260 PolarHBondContact O-OG1 2.82Å; G257-T260 PolarHBondContact N-OG1 3.19Å; G257-T260 VanDerWaalsContact N-OG1 3.08Å; G257-T260 PolarHBondContact O-N 2.94Å; G257-T260 PolarHBondContact O-OG1 2.69Å; T260-K264 WeakPolarHBondContact O-CA 3.47Å; T260-K264 WeakPolarHBondContact O-CB 3.32Å; T260-K264 PolarHBondContact O-N 3.34Å
261	L	95.6	Very high	92.6	Very high	18 Å²	18	38.6 Å²	38.6	9%	0.094	19%	0.193	C	C	.	.	H	α-helix	trans	-55.2	-59.9	170.3	178.2	59.4	0	0	0	111.9	L141 G257 I263 K264 T265 V287 C290 I294	L141-L261 HydrophobicContact CD1-CD1 4.46Å; G257-L261 PolarHBondContact O-N 3.17Å; L261-I263 PolarHBondContact O-N 3.05Å; L261-K264 PolarHBondContact O-N 3.14Å; L261-T265 WeakPolarHBondContact O-CB 3.22Å; L261-T265 PolarHBondContact O-N 2.9Å; L261-T265 PolarHBondContact O-OG1 2.98Å; L261-T265 VanDerWaalsContact O-OG1 3.13Å; L261-V287 HydrophobicContact CD1-CB 4.34Å; L261-V287 HydrophobicContact CD1-CG1 3.76Å; L261-C290 HydrophobicContact CB-CB 3.98Å; L261-C290 HydrophobicContact CD1-CB 4.04Å; L261-C290 HydrophobicContact CG-CB 4.42Å; L261-I294 HydrophobicContact CD2-CD1 3.52Å
262	I	95.6	Very high	92.9	Very high	85 Å²	85	39.2 Å²	39.2	44%	0.436	20%	0.198	S	C	.	.	H	α-helix	trans	-58.8	-49.5	-175.5	-66.3	164.7	0	0	0	111.3	K258 I266	K258-I262 WeakPolarHBondContact O-CG1 3.34Å; K258-I262 PolarHBondContact O-N 2.96Å; K258-I262 VanDerWaalsContact O-N 3.16Å; I262-I266 HydrophobicContact CG2-CD1 4.05Å; I262-I266 WeakPolarHBondContact O-CG1 3.37Å; I262-I266 PolarHBondContact O-N 3.16Å
263	I	95.7	Very high	93.3	Very high	14 Å²	14	38.6 Å²	38.6	7%	0.072	20%	0.195	C	C	.	.	H	α-helix	trans	-67.7	-42.6	-178.7	-62	-64.6	0	0	0	110.8	V228 F231 A232 A235 W259 L261 I266 T267	V228-I263 HydrophobicContact CG2-CG2 4.45Å; F231-I263 HydrophobicContact CB-CD1 3.62Å; F231-I263 HydrophobicContact CB-CG1 3.76Å; F231-I263 HydrophobicContact CD2-CD1 4.12Å; F231-I263 HydrophobicContact CG-CD1 4Å; A232-I263 HydrophobicContact CB-CB 3.79Å; A232-I263 HydrophobicContact CB-CG1 3.92Å; A232-I263 HydrophobicContact CB-CG2 3.94Å; A235-I263 HydrophobicContact CB-CG2 4.32Å; W259-I263 WeakPolarHBondContact O-CB 3.48Å; W259-I263 WeakPolarHBondContact O-CG1 3.46Å; W259-I263 PolarHBondContact O-N 3.26Å; L261-I263 PolarHBondContact O-N 3.05Å; I263-I266 PolarHBondContact O-N 2.64Å; I263-T267 HydrophobicContact CG2-CG2 3.98Å; I263-T267 VanDerWaalsContact O-CB 3.31Å; I263-T267 WeakPolarHBondContact O-CB 3.36Å; I263-T267 VanDerWaalsContact O-CG2 3.3Å; I263-T267 WeakPolarHBondContact O-CG2 3.41Å; I263-T267 PolarHBondContact O-N 3.46Å; I263-T267 PolarHBondContact O-OG1 3.22Å
264	K	96.4	Very high	93.8	Very high	1 Å²	1	32.7 Å²	32.7	0%	0.004	17%	0.173	C	C	.	.	H	α-helix	trans	-65.2	-41.1	179.5	-166.6	166.8	-174.7	128.2	0	111.3	A235 C236 G237 S238 T260 L261 L268 H286 P524	A235-K264 HydrophobicContact CB-CB 3.89Å; A235-K264 HydrophobicContact CB-CG 4.31Å; A235-K264 WeakPolarHBondContact O-CE 3.46Å; A235-K264 PolarHBondContact O-NZ 3.07Å; C236-K264 PolarHBondContact O-NZ 3.12Å; G237-K264 PolarHBondContact O-NZ 3.01Å; S238-K264 PolarHBondContact O-NZ 3.45Å; T260-K264 WeakPolarHBondContact O-CA 3.47Å; T260-K264 WeakPolarHBondContact O-CB 3.32Å; T260-K264 PolarHBondContact O-N 3.34Å; L261-K264 PolarHBondContact O-N 3.14Å; K264-L268 WeakPolarHBondContact O-CB 3.47Å; K264-L268 PolarHBondContact O-N 2.69Å; K264-H286 HydrophobicContact CD-CB 4.37Å; K264-H286 VanDerWaalsContact CD-ND1 3.28Å; K264-H286 WeakPolarHBondContact CD-ND1 3.45Å; K264-P524 HydrophobicContact CG-CB 4.28Å; K264-P524 HydrophobicContact CG-CG 4.37Å
265	T	95.7	Very high	94.1	Very high	25 Å²	25	31.5 Å²	31.5	15%	0.153	16%	0.161	C	C	.	.	H	α-helix	trans	-56	-56.8	173.6	-66.1	0	0	0	0	111.1	I145 L261 T267 L268 V269	I145-T265 HydrophobicContact CD1-CG2 4.05Å; I145-T265 HydrophobicContact CG1-CG2 3.87Å; L261-T265 WeakPolarHBondContact O-CB 3.22Å; L261-T265 PolarHBondContact O-N 2.9Å; L261-T265 PolarHBondContact O-OG1 2.98Å; L261-T265 VanDerWaalsContact O-OG1 3.13Å; T265-T267 PolarHBondContact O-N 2.83Å; T265-L268 PolarHBondContact O-N 2.87Å; T265-V269 WeakPolarHBondContact O-CG2 3.31Å; T265-V269 PolarHBondContact O-N 3.4Å
266	I	96.2	Very high	94.2	Very high	85 Å²	85	31.7 Å²	31.7	44%	0.436	16%	0.162	S	C	.	.	H	α-helix	trans	-62.2	-46.4	-177.7	-64.1	167.2	0	0	0	111.7	L227 I262 I263 L268 V269 L270	L227-I266 HydrophobicContact CD1-CG2 4.17Å; I262-I266 HydrophobicContact CG2-CD1 4.05Å; I262-I266 WeakPolarHBondContact O-CG1 3.37Å; I262-I266 PolarHBondContact O-N 3.16Å; I263-I266 PolarHBondContact O-N 2.64Å; I266-L268 VanDerWaalsContact C-N 3.33Å; I266-L268 PolarHBondContact O-N 2.96Å; I266-V269 PolarHBondContact O-N 3.48Å; I266-L270 HydrophobicContact CG2-CD1 4.17Å; I266-L270 PolarHBondContact O-N 3.03Å
267	T	95.6	Very high	94.1	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-76.1	-20.4	-175	58.2	0	0	0	0	113.3	L227 V228 I263 T265 A271 P524	L227-T267 HydrophobicContact CB-CG2 3.47Å; L227-T267 VanDerWaalsContact CB-CG2 3.47Å; L227-T267 HydrophobicContact CD1-CG2 3.88Å; L227-T267 HydrophobicContact CG-CG2 4.34Å; V228-T267 HydrophobicContact CG2-CG2 3.9Å; V228-T267 WeakPolarHBondContact CG2-OG1 3.33Å; I263-T267 HydrophobicContact CG2-CG2 3.98Å; I263-T267 VanDerWaalsContact O-CB 3.31Å; I263-T267 WeakPolarHBondContact O-CB 3.36Å; I263-T267 VanDerWaalsContact O-CG2 3.3Å; I263-T267 WeakPolarHBondContact O-CG2 3.41Å; I263-T267 PolarHBondContact O-N 3.46Å; I263-T267 PolarHBondContact O-OG1 3.22Å; T265-T267 PolarHBondContact O-N 2.83Å; T267-A271 WeakPolarHBondContact O-CB 3.45Å; T267-A271 PolarHBondContact O-N 2.83Å; T267-P524 VanDerWaalsContact OG1-CG 3.24Å; T267-P524 WeakPolarHBondContact OG1-CG 3.32Å
268	L	95.1	Very high	94.2	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-65.6	-46.1	170.4	-176.4	62.6	0	0	0	111.1	I145 K264 T265 I266 A271 V272 K280 P283 P524	I145-L268 HydrophobicContact CD1-CD2 4.4Å; I145-L268 HydrophobicContact CG2-CD2 4.28Å; K264-L268 WeakPolarHBondContact O-CB 3.47Å; K264-L268 PolarHBondContact O-N 2.69Å; T265-L268 PolarHBondContact O-N 2.87Å; I266-L268 VanDerWaalsContact C-N 3.33Å; I266-L268 PolarHBondContact O-N 2.96Å; L268-A271 PolarHBondContact O-N 3.1Å; L268-V272 WeakPolarHBondContact O-CG2 3.36Å; L268-V272 PolarHBondContact O-N 2.88Å; L268-K280 HydrophobicContact CD1-CB 4.4Å; L268-K280 HydrophobicContact CD2-CB 4.07Å; L268-K280 HydrophobicContact CG-CB 4.21Å; L268-P283 HydrophobicContact CD1-CB 3.47Å; L268-P283 VanDerWaalsContact CD1-CB 3.47Å; L268-P283 HydrophobicContact CD1-CG 3.56Å; L268-P283 HydrophobicContact CD2-CB 3.71Å; L268-P283 HydrophobicContact CG-CB 4.2Å; L268-P524 HydrophobicContact CB-CB 4.38Å; L268-P524 HydrophobicContact CD1-CB 3.92Å
269	V	95.9	Very high	94.2	Very high	8 Å²	8	24.8 Å²	24.8	5%	0.048	13%	0.128	C	C	.	.	H	α-helix	trans	-61.2	-51.3	178.5	-160.8	0	0	0	0	110.1	I145 A148 A149 M152 T265 I266 A271 V272 S273	I145-V269 HydrophobicContact CG1-CG2 4.44Å; I145-V269 HydrophobicContact CG2-CG2 4.43Å; A148-V269 VanDerWaalsContact C-CG1 3.43Å; A148-V269 HydrophobicContact CB-CG1 3.86Å; A148-V269 HydrophobicContact CB-CG2 4.44Å; A149-V269 HydrophobicContact CB-CG1 3.87Å; A149-V269 VanDerWaalsContact N-CG1 3.32Å; M152-V269 HydrophobicContact CE-CB 3.95Å; M152-V269 HydrophobicContact CE-CG1 3.34Å; T265-V269 WeakPolarHBondContact O-CG2 3.31Å; T265-V269 PolarHBondContact O-N 3.4Å; I266-V269 PolarHBondContact O-N 3.48Å; V269-A271 VanDerWaalsContact C-N 3.31Å; V269-A271 PolarHBondContact O-N 3.05Å; V269-V272 PolarHBondContact O-N 3.41Å; V269-S273 WeakPolarHBondContact O-CB 3.39Å; V269-S273 PolarHBondContact O-N 2.98Å; V269-S273 PolarHBondContact O-OG 3.12Å; V269-S273 VanDerWaalsContact O-OG 3.1Å
270	L	96	Very high	94.2	Very high	15 Å²	15	18 Å²	18	8%	0.079	10%	0.103	C	C	.	.	H	α-helix	trans	-58.1	-39.5	176.6	-66.5	170.1	0	0	0	113	M152 F220 L223 A224 L227 I266 S274	M152-L270 HydrophobicContact SD-CD2 3.92Å; F220-L270 HydrophobicContact CB-CD2 4.36Å; F220-L270 HydrophobicContact CD1-CD2 3.83Å; F220-L270 HydrophobicContact CG-CD2 4.38Å; L223-L270 HydrophobicContact CB-CD1 3.99Å; A224-L270 HydrophobicContact CB-CB 3.93Å; L227-L270 HydrophobicContact CD1-CD1 4.06Å; I266-L270 HydrophobicContact CG2-CD1 4.17Å; I266-L270 PolarHBondContact O-N 3.03Å; L270-S274 WeakPolarHBondContact O-CB 3.48Å; L270-S274 PolarHBondContact O-N 2.83Å
271	A	94.9	Very high	94	Very high	1 Å²	1	17.9 Å²	17.9	1%	0.008	10%	0.102	C	C	.	.	H	α-helix	trans	-67.1	-41.9	179.2	0	0	0	0	0	112.3	T267 L268 V269 S274 L278	T267-A271 WeakPolarHBondContact O-CB 3.45Å; T267-A271 PolarHBondContact O-N 2.83Å; L268-A271 PolarHBondContact O-N 3.1Å; V269-A271 VanDerWaalsContact C-N 3.31Å; V269-A271 PolarHBondContact O-N 3.05Å; A271-S274 PolarHBondContact O-OG 3.31Å; A271-L278 HydrophobicContact CB-CD1 4.43Å
272	V	93.6	Very high	93.8	Very high	32 Å²	32	17 Å²	17	19%	0.194	10%	0.098	C	C	.	.	H	α-helix	trans	-68.6	-49.5	175.8	173.4	0	0	0	0	110.7	L268 V269 S274 G275 K280	L268-V272 WeakPolarHBondContact O-CG2 3.36Å; L268-V272 PolarHBondContact O-N 2.88Å; V269-V272 PolarHBondContact O-N 3.41Å; V272-S274 PolarHBondContact O-N 2.68Å; V272-S274 VanDerWaalsContact O-N 3.16Å; V272-G275 PolarHBondContact O-N 3.23Å; V272-K280 HydrophobicContact CG2-CB 4.2Å
273	S	93.6	Very high	93.8	Very high	0 Å²	0	13 Å²	13	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-61.3	-27.8	-179.8	-58	0	0	0	0	113	A149 M152 T153 K156 V269 G275	A149-S273 PolarHBondContact O-OG 2.81Å; M152-S273 VanDerWaalsContact CB-OG 3.22Å; M152-S273 WeakPolarHBondContact CB-OG 3.12Å; T153-S273 PolarHBondContact N-OG 3.35Å; T153-S273 PolarHBondContact OG1-OG 3.15Å; K156-S273 VanDerWaalsContact CD-O 3.24Å; K156-S273 WeakPolarHBondContact CD-O 3.3Å; K156-S273 WeakPolarHBondContact CE-O 3.4Å; K156-S273 PolarHBondContact NZ-O 3.05Å; V269-S273 WeakPolarHBondContact O-CB 3.39Å; V269-S273 PolarHBondContact O-N 2.98Å; V269-S273 PolarHBondContact O-OG 3.12Å; V269-S273 VanDerWaalsContact O-OG 3.1Å; S273-G275 PolarHBondContact O-N 2.87Å
274	S	94	Very high	93.8	Very high	2 Å²	2	12.4 Å²	12.4	1%	0.014	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-14.3	173.8	78	0	0	0	0	115.1	A217 L270 A271 V272 L276	A217-S274 VanDerWaalsContact CB-O 3.31Å; A217-S274 WeakPolarHBondContact CB-O 3.25Å; L270-S274 WeakPolarHBondContact O-CB 3.48Å; L270-S274 PolarHBondContact O-N 2.83Å; A271-S274 PolarHBondContact O-OG 3.31Å; V272-S274 PolarHBondContact O-N 2.68Å; V272-S274 VanDerWaalsContact O-N 3.16Å; S274-L276 VanDerWaalsContact C-N 3.28Å; S274-L276 PolarHBondContact O-N 3.35Å; S274-L276 WeakPolarHBondContact OG-CG 2.86Å
275	G	90.1	Very high	93.8	Very high	25 Å²	25	12.4 Å²	12.4	26%	0.258	7%	0.074	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	8	-179.9	0	0	0	0	0	114.6	V272 S273 T437	V272-G275 PolarHBondContact O-N 3.23Å; S273-G275 PolarHBondContact O-N 2.87Å; G275-T437 WeakPolarHBondContact O-CG2 3.03Å
276	L	91.5	Very high	93.8	Very high	10 Å²	10	11.2 Å²	11.2	5%	0.052	7%	0.067	C	C	.	.			trans	-58.3	147.5	165.7	-74.1	171	0	0	0	110.4	S274 L278 V433 T434 T518 M521	S274-L276 VanDerWaalsContact C-N 3.28Å; S274-L276 PolarHBondContact O-N 3.35Å; S274-L276 WeakPolarHBondContact OG-CG 2.86Å; L276-L278 HydrophobicContact CB-CD1 3.76Å; L276-L278 HydrophobicContact CB-CG 3.89Å; L276-L278 HydrophobicContact CD1-CD1 3.99Å; L276-L278 PolarHBondContact O-N 3.4Å; L276-V433 HydrophobicContact CD2-CG1 3.96Å; L276-T434 WeakPolarHBondContact CD2-OG1 3.29Å; L276-T518 HydrophobicContact CD2-CG2 4.11Å; L276-M521 HydrophobicContact CD1-CE 4.25Å; L276-M521 HydrophobicContact CD2-CE 4.44Å
277	S	91.9	Very high	93.8	Very high	11 Å²	11	7.4 Å²	7.4	8%	0.077	5%	0.048	C	C	.	.	S	Bend	trans	-74.3	80	175.9	-169	0	0	0	0	110.7	T515 T518	S277-T515 PolarHBondContact OG-OG1 3.41Å; S277-T518 PolarHBondContact O-OG1 3.08Å
278	L	92.3	Very high	93.9	Very high	13 Å²	13	7.4 Å²	7.4	7%	0.068	5%	0.048	C	C	.	.			trans	-144	155.4	-174.1	-62.2	178.4	0	0	0	109.3	A271 L276 V523	A271-L278 HydrophobicContact CB-CD1 4.43Å; L276-L278 HydrophobicContact CB-CD1 3.76Å; L276-L278 HydrophobicContact CB-CG 3.89Å; L276-L278 HydrophobicContact CD1-CD1 3.99Å; L276-L278 PolarHBondContact O-N 3.4Å; L278-V523 HydrophobicContact CD1-CG2 3.97Å
279	G	91.3	Very high	94	Very high	4 Å²	4	7.4 Å²	7.4	4%	0.041	5%	0.048	C	C	.	.	B	Isolated β-bridge	trans	-121.8	157.3	172.8	0	0	0	0	0	113.6	G526	G279-G526 PolarHBondContact N-O 2.83Å; G279-G526 WeakPolarHBondContact O-CA 3.27Å; G279-G526 PolarHBondContact O-N 3.19Å
280	K	92.5	Very high	94	Very high	21 Å²	21	7.1 Å²	7.1	9%	0.091	5%	0.046	C	C	.	.	S	Bend	trans	-79.5	-28.1	175.2	62.6	-171.2	179.6	71.7	0	113.9	I145 D146 L268 V272 G282 P283 L284	I145-K280 HydrophobicContact CG2-CD 4.36Å; D146-K280 WeakPolarHBondContact OD1-CD 3.32Å; D146-K280 WeakPolarHBondContact OD1-CE 3.46Å; D146-K280 IonicContact OD1-NZ 3.91Å; D146-K280 PolarHBondContact OD1-NZ 3.3Å; D146-K280 IonicContact OD2-NZ 3.45Å; D146-K280 PolarHBondContact OD2-NZ 3.44Å; L268-K280 HydrophobicContact CD1-CB 4.4Å; L268-K280 HydrophobicContact CD2-CB 4.07Å; L268-K280 HydrophobicContact CG-CB 4.21Å; V272-K280 HydrophobicContact CG2-CB 4.2Å; K280-G282 PolarHBondContact O-N 3.35Å; K280-P283 VanDerWaalsContact O-CD 3.27Å; K280-P283 WeakPolarHBondContact O-CD 3.19Å; K280-L284 HydrophobicContact CG-CD1 4.41Å; K280-L284 PolarHBondContact O-N 3.09Å
281	E	91.3	Very high	94	Very high	4 Å²	4	6.4 Å²	6.4	2%	0.019	4%	0.042	C	C	.	.	H	α-helix	trans	-59.9	-40.3	-167.9	-50.5	-25.2	138.4	0	0	114.8	L284 A324 F325 F528 I529	E281-L284 PolarHBondContact O-N 2.9Å; E281-L284 WeakPolarHBondContact OE2-CD1 3.48Å; E281-A324 HydrophobicContact CB-CB 3.76Å; E281-A324 HydrophobicContact CG-CB 4.14Å; E281-A324 VanDerWaalsContact OE2-CA 3.27Å; E281-A324 WeakPolarHBondContact OE2-CA 3.49Å; E281-A324 VanDerWaalsContact OE2-CB 3.24Å; E281-A324 WeakPolarHBondContact OE2-CB 3.5Å; E281-F325 HydrophobicContact CB-CE2 4.19Å; E281-F325 HydrophobicContact CB-CZ 4.13Å; E281-F325 HydrophobicContact CG-CE1 4.32Å; E281-F325 HydrophobicContact CG-CZ 4.23Å; E281-F528 HydrophobicContact CB-CD2 3.84Å; E281-I529 HydrophobicContact CG-CD1 4.27Å; E281-I529 HydrophobicContact CG-CG1 3.91Å
282	G	91.4	Very high	94.1	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	4%	0.042	C	C	.	.	H	α-helix	trans	-66.3	-50.7	177.4	0	0	0	0	0	113.1	S238 K280 L284 V285	S238-G282 WeakPolarHBondContact OG-CA 3.34Å; K280-G282 PolarHBondContact O-N 3.35Å; G282-L284 VanDerWaalsContact C-N 3.3Å; G282-L284 PolarHBondContact O-N 3.06Å; G282-V285 WeakPolarHBondContact O-CB 3.2Å; G282-V285 PolarHBondContact O-N 3.33Å
283	P	95.3	Very high	94.2	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-56.3	-30.9	170.2	-35.3	40.5	0	0	0	116.3	S238 L268 K280 V285 H286 V287 P524 G526	S238-P283 WeakPolarHBondContact O-CA 3.37Å; L268-P283 HydrophobicContact CD1-CB 3.47Å; L268-P283 VanDerWaalsContact CD1-CB 3.47Å; L268-P283 HydrophobicContact CD1-CG 3.56Å; L268-P283 HydrophobicContact CD2-CB 3.71Å; L268-P283 HydrophobicContact CG-CB 4.2Å; K280-P283 VanDerWaalsContact O-CD 3.27Å; K280-P283 WeakPolarHBondContact O-CD 3.19Å; P283-V285 VanDerWaalsContact C-N 3.26Å; P283-V285 PolarHBondContact O-N 2.9Å; P283-H286 PolarHBondContact O-N 3.32Å; P283-V287 PolarHBondContact O-N 3.32Å; P283-P524 HydrophobicContact CG-CB 4.49Å; P283-G526 VanDerWaalsContact CD-CA 3.42Å
284	L	95.1	Very high	94.2	Very high	3 Å²	3	7.9 Å²	7.9	2%	0.016	5%	0.049	C	C	.	.	H	α-helix	trans	-61.2	-33	176.2	-76.9	174.8	0	0	0	112.6	A142 I145 K280 E281 G282 H286 V287 A288 A324	A142-L284 HydrophobicContact CB-CD2 4.22Å; I145-L284 HydrophobicContact CD1-CD2 3.55Å; K280-L284 HydrophobicContact CG-CD1 4.41Å; K280-L284 PolarHBondContact O-N 3.09Å; E281-L284 PolarHBondContact O-N 2.9Å; E281-L284 WeakPolarHBondContact OE2-CD1 3.48Å; G282-L284 VanDerWaalsContact C-N 3.3Å; G282-L284 PolarHBondContact O-N 3.06Å; L284-H286 VanDerWaalsContact C-N 3.31Å; L284-H286 PolarHBondContact O-N 3.11Å; L284-V287 PolarHBondContact O-N 3.07Å; L284-A288 WeakPolarHBondContact O-CB 3.43Å; L284-A288 PolarHBondContact O-N 3.19Å; L284-A324 HydrophobicContact CB-CB 4.38Å; L284-A324 HydrophobicContact CD1-CB 3.92Å
285	V	96	Very high	94.3	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-57.5	-44.6	171.2	-169.8	0	0	0	0	111.1	I240 I243 G282 P283 A288 C289 A317 V321	I240-V285 HydrophobicContact CD1-CG2 4.24Å; I240-V285 HydrophobicContact CG1-CB 4.22Å; I240-V285 HydrophobicContact CG1-CG1 4.4Å; I240-V285 HydrophobicContact CG1-CG2 4.34Å; I243-V285 HydrophobicContact CD1-CG1 4.19Å; G282-V285 WeakPolarHBondContact O-CB 3.2Å; G282-V285 PolarHBondContact O-N 3.33Å; P283-V285 VanDerWaalsContact C-N 3.26Å; P283-V285 PolarHBondContact O-N 2.9Å; V285-A288 PolarHBondContact O-N 3.21Å; V285-C289 PolarHBondContact O-N 3.02Å; V285-C289 PolarHBondContact O-SG 2.98Å; V285-C289 VanDerWaalsContact O-SG 3.34Å; V285-A317 HydrophobicContact CG1-CB 3.84Å; V285-V321 HydrophobicContact CG2-CG2 3.52Å
286	H	96.3	Very high	94.4	Very high	1 Å²	1	7.4 Å²	7.4	1%	0.005	4%	0.04	C	C	.	.	H	α-helix	trans	-69.7	-40.1	177.2	-173.7	-145.2	0	0	0	112.7	I243 Y255 K264 P283 L284 A288 C289 C290	I243-H286 HydrophobicContact CD1-CB 3.91Å; Y255-H286 AromaticContact CD1-NE2 3.4Å; Y255-H286 WeakPolarHBondContact CD1-NE2 3.29Å; Y255-H286 AromaticContact CE1-CD2 3.5Å; Y255-H286 VanDerWaalsContact CE1-CD2 3.5Å; Y255-H286 WeakPolarHBondContact CE1-CD2 3.46Å; Y255-H286 AromaticContact CE1-CE1 3.47Å; Y255-H286 VanDerWaalsContact CE1-CE1 3.47Å; Y255-H286 WeakPolarHBondContact CE1-CE1 3.46Å; Y255-H286 AromaticContact CE1-NE2 3.02Å; Y255-H286 WeakPolarHBondContact CE1-NE2 3.33Å; Y255-H286 AromaticContact CZ-CE1 3.48Å; Y255-H286 VanDerWaalsContact CZ-CE1 3.48Å; Y255-H286 AromaticContact CZ-NE2 3.57Å; Y255-H286 PolarHBondContact O-NE2 2.96Å; K264-H286 HydrophobicContact CD-CB 4.37Å; K264-H286 VanDerWaalsContact CD-ND1 3.28Å; K264-H286 WeakPolarHBondContact CD-ND1 3.45Å; P283-H286 PolarHBondContact O-N 3.32Å; L284-H286 VanDerWaalsContact C-N 3.31Å; L284-H286 PolarHBondContact O-N 3.11Å; H286-A288 VanDerWaalsContact C-N 3.33Å; H286-A288 PolarHBondContact O-N 2.97Å; H286-C289 PolarHBondContact O-N 2.96Å; H286-C290 PolarHBondContact NE2-SG 3.41Å; H286-C290 PolarHBondContact O-N 3.25Å; H286-C290 PolarHBondContact O-SG 3.31Å; H286-C290 VanDerWaalsContact O-SG 3.4Å
287	V	96.8	Very high	94.3	Very high	4 Å²	4	11.4 Å²	11.4	2%	0.024	6%	0.058	C	C	.	.	H	α-helix	trans	-56.8	-47.6	174.2	168.9	0	0	0	0	110.4	L261 P283 L284 C290 C291	L261-V287 HydrophobicContact CD1-CB 4.34Å; L261-V287 HydrophobicContact CD1-CG1 3.76Å; P283-V287 PolarHBondContact O-N 3.32Å; L284-V287 PolarHBondContact O-N 3.07Å; V287-C290 WeakPolarHBondContact O-CB 3.34Å; V287-C290 PolarHBondContact O-N 3.5Å; V287-C291 PolarHBondContact O-N 3.21Å; V287-C291 PolarHBondContact O-SG 2.9Å
288	A	97	Very high	94.2	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.008	9%	0.085	C	C	.	.	H	α-helix	trans	-63.3	-43.4	177.4	0	0	0	0	0	112.8	A138 L284 V285 H286 C290 C291 A292 A316	A138-A288 HydrophobicContact CB-CB 4.19Å; L284-A288 WeakPolarHBondContact O-CB 3.43Å; L284-A288 PolarHBondContact O-N 3.19Å; V285-A288 PolarHBondContact O-N 3.21Å; H286-A288 VanDerWaalsContact C-N 3.33Å; H286-A288 PolarHBondContact O-N 2.97Å; A288-C290 PolarHBondContact O-N 2.64Å; A288-C291 WeakPolarHBondContact O-CB 3.34Å; A288-C291 PolarHBondContact O-N 3Å; A288-A292 PolarHBondContact O-N 3.35Å; A288-A316 WeakPolarHBondContact CB-O 3.27Å
289	C	96.6	Very high	94.1	Very high	1 Å²	1	18 Å²	18	1%	0.007	9%	0.09	C	C	.	.	H	α-helix	trans	-62.5	-38.5	174	-68.4	0	0	0	0	112.9	I243 L256 V285 H286 N293 L313	I243-C289 HydrophobicContact CD1-CB 4.29Å; L256-C289 HydrophobicContact CD2-CB 3.93Å; V285-C289 PolarHBondContact O-N 3.02Å; V285-C289 PolarHBondContact O-SG 2.98Å; V285-C289 VanDerWaalsContact O-SG 3.34Å; H286-C289 PolarHBondContact O-N 2.96Å; C289-N293 VanDerWaalsContact O-CB 3.29Å; C289-N293 WeakPolarHBondContact O-CB 3.34Å; C289-N293 PolarHBondContact O-N 3.18Å; C289-L313 HydrophobicContact CB-CD2 4.16Å; C289-L313 VanDerWaalsContact O-CD2 3.3Å; C289-L313 WeakPolarHBondContact O-CD2 3.22Å; C289-L313 PolarHBondContact SG-O 3.36Å; C289-L313 VanDerWaalsContact SG-O 3.4Å
290	C	96.2	Very high	93.8	Very high	1 Å²	1	21.5 Å²	21.5	1%	0.007	11%	0.111	C	C	.	.	H	α-helix	trans	-63.1	-43	172.4	-75.5	0	0	0	0	112	L261 H286 V287 A288 N293 I294	L261-C290 HydrophobicContact CB-CB 3.98Å; L261-C290 HydrophobicContact CD1-CB 4.04Å; L261-C290 HydrophobicContact CG-CB 4.42Å; H286-C290 PolarHBondContact NE2-SG 3.41Å; H286-C290 PolarHBondContact O-N 3.25Å; H286-C290 PolarHBondContact O-SG 3.31Å; H286-C290 VanDerWaalsContact O-SG 3.4Å; V287-C290 WeakPolarHBondContact O-CB 3.34Å; V287-C290 PolarHBondContact O-N 3.5Å; A288-C290 PolarHBondContact O-N 2.64Å; C290-N293 WeakPolarHBondContact O-CB 3.4Å; C290-N293 PolarHBondContact O-N 2.93Å; C290-I294 WeakPolarHBondContact O-CG1 3.45Å; C290-I294 PolarHBondContact O-N 2.94Å
291	C	96.4	Very high	93.5	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-58.1	-50.7	176.5	-70	0	0	0	0	111.4	M137 L141 V287 A288 N293 I294 L295	M137-C291 VanDerWaalsContact CE-CA 3.45Å; M137-C291 HydrophobicContact CE-CB 3.4Å; M137-C291 VanDerWaalsContact CE-CB 3.4Å; M137-C291 WeakPolarHBondContact CE-O 3.3Å; L141-C291 WeakPolarHBondContact CD1-SG 3.39Å; V287-C291 PolarHBondContact O-N 3.21Å; V287-C291 PolarHBondContact O-SG 2.9Å; A288-C291 WeakPolarHBondContact O-CB 3.34Å; A288-C291 PolarHBondContact O-N 3Å; C291-N293 VanDerWaalsContact C-N 3.33Å; C291-N293 PolarHBondContact O-N 2.7Å; C291-I294 PolarHBondContact O-N 3.12Å; C291-L295 WeakPolarHBondContact O-CG 3.43Å; C291-L295 PolarHBondContact O-N 3.3Å; C291-L295 VanDerWaalsContact O-N 3.08Å
292	A	96.3	Very high	93.4	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-62.8	-38.6	176.7	0	0	0	0	0	112.7	V134 A288 I294 L295 C296 V312 A316	V134-A292 HydrophobicContact CG1-CB 4.04Å; V134-A292 HydrophobicContact CG2-CB 3.7Å; A288-A292 PolarHBondContact O-N 3.35Å; A292-I294 VanDerWaalsContact C-N 3.35Å; A292-I294 PolarHBondContact O-N 3.45Å; A292-L295 PolarHBondContact O-N 3.36Å; A292-C296 PolarHBondContact O-N 3.04Å; A292-C296 PolarHBondContact O-SG 3.43Å; A292-V312 HydrophobicContact CB-CG1 4.02Å; A292-A316 HydrophobicContact CB-CB 3.35Å
293	N	95.4	Very high	93.2	Very high	8 Å²	8	27.5 Å²	27.5	4%	0.043	13%	0.134	C	C	.	.	H	α-helix	trans	-61.2	-41.7	176.1	-171.5	58.6	0	0	0	113	L256 C289 C290 C291 C296 H297 R309 L313	L256-N293 HydrophobicContact CB-CB 3.85Å; L256-N293 HydrophobicContact CD1-CB 4.34Å; L256-N293 PolarHBondContact O-ND2 2.95Å; C289-N293 VanDerWaalsContact O-CB 3.29Å; C289-N293 WeakPolarHBondContact O-CB 3.34Å; C289-N293 PolarHBondContact O-N 3.18Å; C290-N293 WeakPolarHBondContact O-CB 3.4Å; C290-N293 PolarHBondContact O-N 2.93Å; C291-N293 VanDerWaalsContact C-N 3.33Å; C291-N293 PolarHBondContact O-N 2.7Å; N293-C296 PolarHBondContact O-N 2.97Å; N293-H297 PolarHBondContact O-CD2 2.72Å; N293-R309 PolarHBondContact OD1-NE 2.95Å; N293-R309 PolarHBondContact OD1-NH2 2.99Å; N293-L313 HydrophobicContact CB-CD2 4.14Å
294	I	94.7	Very high	92.7	Very high	57 Å²	57	34.8 Å²	34.8	29%	0.292	17%	0.165	S	C	.	.	H	α-helix	trans	-65.1	-44.9	176.5	-66.8	164.4	0	0	0	110.3	K258 L261 C290 C291 A292 C296 H297	K258-I294 HydrophobicContact CB-CD1 4.03Å; L261-I294 HydrophobicContact CD2-CD1 3.52Å; C290-I294 WeakPolarHBondContact O-CG1 3.45Å; C290-I294 PolarHBondContact O-N 2.94Å; C291-I294 PolarHBondContact O-N 3.12Å; A292-I294 VanDerWaalsContact C-N 3.35Å; A292-I294 PolarHBondContact O-N 3.45Å; I294-C296 PolarHBondContact O-N 2.87Å; I294-H297 WeakPolarHBondContact O-CB 3.23Å; I294-H297 PolarHBondContact O-N 2.91Å; I294-H297 VanDerWaalsContact O-N 3.16Å
295	L	94.9	Very high	92.3	Very high	16 Å²	16	35 Å²	35	8%	0.084	17%	0.167	C	C	.	.	H	α-helix	trans	-66.6	-33.3	178.5	-67	169.6	0	0	0	112.7	L130 L133 V134 M137 C291 A292 H297 L298	L130-L295 HydrophobicContact CD1-CB 3.56Å; L133-L295 HydrophobicContact CB-CD1 3.91Å; L133-L295 HydrophobicContact CB-CD2 4.3Å; V134-L295 HydrophobicContact CB-CD1 4.35Å; V134-L295 HydrophobicContact CG2-CD1 3.68Å; M137-L295 HydrophobicContact CB-CD1 4.5Å; M137-L295 HydrophobicContact CE-CD1 3.73Å; M137-L295 HydrophobicContact CE-CD2 4.32Å; M137-L295 HydrophobicContact CE-CG 3.76Å; M137-L295 HydrophobicContact SD-CD1 4.46Å; C291-L295 WeakPolarHBondContact O-CG 3.43Å; C291-L295 PolarHBondContact O-N 3.3Å; C291-L295 VanDerWaalsContact O-N 3.08Å; A292-L295 PolarHBondContact O-N 3.36Å; L295-H297 PolarHBondContact O-N 3.44Å; L295-H297 VanDerWaalsContact O-N 3.17Å; L295-L298 HydrophobicContact CD2-CD1 3.84Å; L295-L298 WeakPolarHBondContact O-CB 3.44Å; L295-L298 PolarHBondContact O-N 3.29Å; L295-L298 VanDerWaalsContact O-N 3.07Å
296	C	93.8	Very high	91.9	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.007	17%	0.173	C	C	.	.	H	α-helix	trans	-57.4	-27.7	172.2	-75.2	0	0	0	0	113.3	A292 N293 I294 L298 F299 V312	A292-C296 PolarHBondContact O-N 3.04Å; A292-C296 PolarHBondContact O-SG 3.43Å; N293-C296 PolarHBondContact O-N 2.97Å; I294-C296 PolarHBondContact O-N 2.87Å; C296-L298 VanDerWaalsContact C-N 3.27Å; C296-L298 PolarHBondContact O-N 2.97Å; C296-F299 PolarHBondContact O-N 3.26Å; C296-V312 VanDerWaalsContact SG-CG1 3.52Å
297	H	89.7	Confident	91.5	Very high	93 Å²	93	36.7 Å²	36.7	43%	0.431	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-20.7	178.1	-76.2	-76.2	0	0	0	113.8	N293 I294 L295 R303	N293-H297 PolarHBondContact O-CD2 2.72Å; I294-H297 WeakPolarHBondContact O-CB 3.23Å; I294-H297 PolarHBondContact O-N 2.91Å; I294-H297 VanDerWaalsContact O-N 3.16Å; L295-H297 PolarHBondContact O-N 3.44Å; L295-H297 VanDerWaalsContact O-N 3.17Å; H297-R303 PolarHBondContact O-NH1 3.47Å
298	L	89.8	Confident	91.1	Very high	123 Å²	123	38.6 Å²	38.6	64%	0.644	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-33.2	174.6	-58	174.7	0	0	0	111.6	L295 C296	L295-L298 HydrophobicContact CD2-CD1 3.84Å; L295-L298 WeakPolarHBondContact O-CB 3.44Å; L295-L298 PolarHBondContact O-N 3.29Å; L295-L298 VanDerWaalsContact O-N 3.07Å; C296-L298 VanDerWaalsContact C-N 3.27Å; C296-L298 PolarHBondContact O-N 2.97Å
299	F	89.4	Confident	90.9	Very high	39 Å²	39	40.9 Å²	40.9	17%	0.171	19%	0.191	C	C	.	.			trans	-102.9	112.8	-176.2	-64.3	-86.8	0	0	0	111.3	L129 L130 L133 C296 K301 Y302 R303	L129-F299 HydrophobicContact CD2-CE1 4.29Å; L129-F299 HydrophobicContact CD2-CZ 4.11Å; L129-F299 HydrophobicContact CG-CZ 4.21Å; L130-F299 HydrophobicContact CB-CD2 4.23Å; L130-F299 HydrophobicContact CB-CE2 3.96Å; L130-F299 HydrophobicContact CB-CZ 4.41Å; L130-F299 HydrophobicContact CD1-CD2 3.91Å; L130-F299 HydrophobicContact CD1-CE2 3.88Å; L130-F299 HydrophobicContact CD2-CD2 4.31Å; L130-F299 HydrophobicContact CG-CD2 4.38Å; L130-F299 HydrophobicContact CG-CE2 4.41Å; L133-F299 HydrophobicContact CD1-CE2 4.32Å; L133-F299 HydrophobicContact CD1-CZ 4.4Å; C296-F299 PolarHBondContact O-N 3.26Å; F299-K301 PolarHBondContact O-N 2.82Å; F299-K301 VanDerWaalsContact O-N 3.15Å; F299-Y302 HydrophobicContact CB-CD2 3.77Å; F299-Y302 HydrophobicContact CG-CD2 4.44Å; F299-Y302 PolarHBondContact O-N 3.5Å; F299-Y302 VanDerWaalsContact O-N 3.11Å; F299-R303 WeakPolarHBondContact O-CB 3.18Å; F299-R303 PolarHBondContact O-N 2.91Å
300	T	84.9	Confident	90.6	Very high	78 Å²	78	41.2 Å²	41.2	48%	0.479	19%	0.193	S	C	.	.	H	α-helix	trans	-56.9	-34.1	-177.1	55.2	0	0	0	0	113.5	R303 K304	T300-R303 PolarHBondContact O-N 3.41Å; T300-K304 WeakPolarHBondContact O-CB 3.34Å; T300-K304 PolarHBondContact O-N 2.85Å
301	K	86.7	Confident	90.4	Very high	30 Å²	30	42.8 Å²	42.8	13%	0.13	20%	0.2	C	C	.	.	H	α-helix	trans	-50.1	-55.9	171.6	176	169.7	-171.5	158.8	0	112.7	D123 F299	D123-K301 PolarHBondContact O-NZ 2.79Å; D123-K301 WeakPolarHBondContact OD2-CE 3.32Å; D123-K301 IonicContact OD2-NZ 2.99Å; D123-K301 PolarHBondContact OD2-NZ 3.25Å; F299-K301 PolarHBondContact O-N 2.82Å; F299-K301 VanDerWaalsContact O-N 3.15Å
302	Y	88.9	Confident	90.4	Very high	2 Å²	2	43 Å²	43	1%	0.008	20%	0.201	C	C	.	.	H	α-helix	trans	-82.3	-22.9	-177.1	-59.8	-79.3	0	0	0	112.8	G127 L130 F299 K308 V312	G127-Y302 WeakPolarHBondContact CA-OH 3.45Å; L130-Y302 HydrophobicContact CD2-CD1 4.27Å; L130-Y302 HydrophobicContact CD2-CD2 3.46Å; L130-Y302 VanDerWaalsContact CD2-CD2 3.46Å; L130-Y302 HydrophobicContact CD2-CE1 4.47Å; L130-Y302 HydrophobicContact CD2-CE2 3.71Å; L130-Y302 HydrophobicContact CD2-CG 3.78Å; F299-Y302 HydrophobicContact CB-CD2 3.77Å; F299-Y302 HydrophobicContact CG-CD2 4.44Å; F299-Y302 PolarHBondContact O-N 3.5Å; F299-Y302 VanDerWaalsContact O-N 3.11Å; Y302-K308 HydrophobicContact CD1-CB 3.96Å; Y302-K308 HydrophobicContact CE1-CB 4.22Å; Y302-V312 HydrophobicContact CD1-CG2 3.48Å; Y302-V312 VanDerWaalsContact CD1-CG2 3.48Å; Y302-V312 HydrophobicContact CE1-CG2 3.55Å; Y302-V312 HydrophobicContact CG-CG2 4.25Å
303	R	87.6	Confident	90.3	Very high	120 Å²	120	43.2 Å²	43.2	45%	0.453	20%	0.202	S	C	.	.	H	α-helix	trans	-74	-32.6	175.5	-168.7	177.7	74.7	-158.5	8.7	113.9	H297 F299 T300	H297-R303 PolarHBondContact O-NH1 3.47Å; F299-R303 WeakPolarHBondContact O-CB 3.18Å; F299-R303 PolarHBondContact O-N 2.91Å; T300-R303 PolarHBondContact O-N 3.41Å
304	K	83.6	Confident	90.3	Very high	152 Å²	152	43 Å²	43	66%	0.661	20%	0.202	S	C	*	.	H	α-helix	trans	-96	-12.4	-176.1	-73.1	-170.3	176.6	-173.1	0	114.7	T300	T300-K304 WeakPolarHBondContact O-CB 3.34Å; T300-K304 PolarHBondContact O-N 2.85Å
305	N	87.8	Confident	90.3	Very high	9 Å²	9	40.4 Å²	40.4	5%	0.048	19%	0.188	C	C	.	.			trans	-121.5	113.6	-178.2	-177.1	-34.7	0	0	0	110.2	E95 D99 A307 K308 R309	E95-N305 PolarHBondContact O-ND2 2.81Å; E95-N305 WeakPolarHBondContact OE2-CA 3.28Å; E95-N305 PolarHBondContact OE2-OD1 2.84Å; D99-N305 WeakPolarHBondContact CB-ND2 3.3Å; D99-N305 PolarHBondContact OD1-ND2 3.11Å; N305-A307 WeakPolarHBondContact OD1-CB 3.14Å; N305-A307 PolarHBondContact OD1-N 2.93Å; N305-K308 HydrophobicContact CB-CB 4.13Å; N305-K308 HydrophobicContact CB-CG 4.32Å; N305-K308 PolarHBondContact OD1-N 2.73Å; N305-R309 WeakPolarHBondContact O-CB 3.12Å; N305-R309 PolarHBondContact O-N 3.01Å
306	E	86.4	Confident	90.4	Very high	30 Å²	30	39.6 Å²	39.6	14%	0.14	18%	0.184	C	C	.	.	H	α-helix	trans	-76.2	-23.9	-174.7	-82.6	-65	135.1	0	0	113.4	Y84 I90 E95 R309 R310	Y84-E306 HydrophobicContact CD2-CG 4.09Å; Y84-E306 HydrophobicContact CE2-CB 4.3Å; Y84-E306 HydrophobicContact CE2-CG 4.2Å; I90-E306 HydrophobicContact CG2-CB 4.08Å; I90-E306 HydrophobicContact CG2-CG 4.49Å; E95-E306 HydrophobicContact CG-CB 4.38Å; E95-E306 PolarHBondContact OE2-N 2.9Å; E306-R309 WeakPolarHBondContact OE1-CD 3.25Å; E306-R309 IonicContact OE1-CZ 2.7Å; E306-R309 IonicContact OE1-NE 3.4Å; E306-R309 IonicContact OE1-NH1 3.38Å; E306-R309 PolarHBondContact OE1-NH1 3.19Å; E306-R309 IonicContact OE2-NH1 2.95Å; E306-R310 WeakPolarHBondContact O-CG 3.22Å; E306-R310 PolarHBondContact O-N 3.38Å; E306-R310 PolarHBondContact O-NH1 2.92Å; E306-R310 IonicContact OE2-CZ 2.84Å; E306-R310 IonicContact OE2-NH1 3.92Å; E306-R310 PolarHBondContact OE2-NH1 2.71Å; E306-R310 IonicContact OE2-NH2 2.66Å
307	A	88.3	Confident	90.5	Very high	5 Å²	5	39.6 Å²	39.6	4%	0.041	18%	0.184	C	C	.	.	H	α-helix	trans	-74	-45.9	172.5	0	0	0	0	0	110.9	W92 E95 N305 R309 R310 E311	W92-A307 HydrophobicContact CE3-CB 3.89Å; W92-A307 HydrophobicContact CZ3-CB 4.03Å; E95-A307 HydrophobicContact CB-CB 3.7Å; E95-A307 HydrophobicContact CG-CB 4.39Å; N305-A307 WeakPolarHBondContact OD1-CB 3.14Å; N305-A307 PolarHBondContact OD1-N 2.93Å; A307-R309 VanDerWaalsContact C-N 3.31Å; A307-R309 PolarHBondContact O-N 2.79Å; A307-R310 WeakPolarHBondContact O-CB 3.04Å; A307-R310 PolarHBondContact O-N 3.04Å; A307-E311 PolarHBondContact O-N 3.1Å; A307-E311 VanDerWaalsContact O-N 3.1Å
308	K	89.2	Confident	90.8	Very high	44 Å²	44	35.1 Å²	35.1	19%	0.191	16%	0.163	C	C	.	.	H	α-helix	trans	-65	-33.1	175.4	-68.9	-53.2	-173.3	-170.2	0	113.1	D99 Y302 N305 R310 E311 V312	D99-K308 WeakPolarHBondContact OD2-CE 3.45Å; D99-K308 IonicContact OD2-NZ 3.21Å; Y302-K308 HydrophobicContact CD1-CB 3.96Å; Y302-K308 HydrophobicContact CE1-CB 4.22Å; N305-K308 HydrophobicContact CB-CB 4.13Å; N305-K308 HydrophobicContact CB-CG 4.32Å; N305-K308 PolarHBondContact OD1-N 2.73Å; K308-R310 VanDerWaalsContact C-N 3.31Å; K308-R310 PolarHBondContact O-N 2.77Å; K308-E311 VanDerWaalsContact CD-CD 3.48Å; K308-E311 WeakPolarHBondContact CD-OE1 3.42Å; K308-E311 WeakPolarHBondContact CD-OE2 3.49Å; K308-E311 IonicContact NZ-OE1 2.76Å; K308-E311 PolarHBondContact NZ-OE1 3.32Å; K308-E311 IonicContact NZ-OE2 2.98Å; K308-E311 PolarHBondContact NZ-OE2 3.19Å; K308-E311 PolarHBondContact O-N 2.66Å; K308-V312 PolarHBondContact O-N 3Å
309	R	91.8	Very high	91.2	Very high	49 Å²	49	29.3 Å²	29.3	19%	0.185	13%	0.133	C	C	.	.	H	α-helix	trans	-59.6	-40.4	169.4	-168.9	176.4	176.1	-172.6	-2.1	111.9	N293 N305 E306 A307 V312 L313	N293-R309 PolarHBondContact OD1-NE 2.95Å; N293-R309 PolarHBondContact OD1-NH2 2.99Å; N305-R309 WeakPolarHBondContact O-CB 3.12Å; N305-R309 PolarHBondContact O-N 3.01Å; E306-R309 WeakPolarHBondContact OE1-CD 3.25Å; E306-R309 IonicContact OE1-CZ 2.7Å; E306-R309 IonicContact OE1-NE 3.4Å; E306-R309 IonicContact OE1-NH1 3.38Å; E306-R309 PolarHBondContact OE1-NH1 3.19Å; E306-R309 IonicContact OE2-NH1 2.95Å; A307-R309 VanDerWaalsContact C-N 3.31Å; A307-R309 PolarHBondContact O-N 2.79Å; R309-V312 PolarHBondContact O-N 3.46Å; R309-L313 HydrophobicContact CG-CD1 4.44Å; R309-L313 WeakPolarHBondContact O-CG 3.5Å; R309-L313 PolarHBondContact O-N 3.49Å
310	R	91.5	Very high	91.5	Very high	8 Å²	8	27.4 Å²	27.4	3%	0.03	13%	0.125	C	C	.	.	H	α-helix	trans	-70.4	-35.5	178	-75.6	171	177.6	69.7	2	113.6	W92 I246 L247 F250 I251 E306 A307 K308 V312 L313 S314	W92-R310 HydrophobicContact CH2-CB 4.04Å; W92-R310 HydrophobicContact CH2-CG 4.46Å; I246-R310 PolarHBondContact O-NE 3.19Å; L247-R310 HydrophobicContact CD2-CB 3.96Å; L247-R310 HydrophobicContact CD2-CG 4.1Å; L247-R310 WeakPolarHBondContact CD2-O 3.08Å; F250-R310 PolarHBondContact O-NH2 2.85Å; I251-R310 VanDerWaalsContact CG1-NH2 3.3Å; E306-R310 WeakPolarHBondContact O-CG 3.22Å; E306-R310 PolarHBondContact O-N 3.38Å; E306-R310 PolarHBondContact O-NH1 2.92Å; E306-R310 IonicContact OE2-CZ 2.84Å; E306-R310 IonicContact OE2-NH1 3.92Å; E306-R310 PolarHBondContact OE2-NH1 2.71Å; E306-R310 IonicContact OE2-NH2 2.66Å; A307-R310 WeakPolarHBondContact O-CB 3.04Å; A307-R310 PolarHBondContact O-N 3.04Å; K308-R310 VanDerWaalsContact C-N 3.31Å; K308-R310 PolarHBondContact O-N 2.77Å; R310-V312 VanDerWaalsContact C-N 3.27Å; R310-V312 PolarHBondContact O-N 3.43Å; R310-L313 PolarHBondContact O-N 3.05Å; R310-S314 WeakPolarHBondContact O-CB 3.32Å; R310-S314 PolarHBondContact O-N 2.95Å
311	E	92.4	Very high	91.9	Very high	35 Å²	35	23.7 Å²	23.7	16%	0.164	10%	0.102	C	C	.	.	H	α-helix	trans	-55	-44.7	168.9	-72.6	174.8	-164.6	0	0	111.1	A307 K308 A315 P344 T347	A307-E311 PolarHBondContact O-N 3.1Å; A307-E311 VanDerWaalsContact O-N 3.1Å; K308-E311 VanDerWaalsContact CD-CD 3.48Å; K308-E311 WeakPolarHBondContact CD-OE1 3.42Å; K308-E311 WeakPolarHBondContact CD-OE2 3.49Å; K308-E311 IonicContact NZ-OE1 2.76Å; K308-E311 PolarHBondContact NZ-OE1 3.32Å; K308-E311 IonicContact NZ-OE2 2.98Å; K308-E311 PolarHBondContact NZ-OE2 3.19Å; K308-E311 PolarHBondContact O-N 2.66Å; E311-A315 PolarHBondContact O-N 3.32Å; E311-A315 VanDerWaalsContact O-N 3.13Å; E311-P344 HydrophobicContact CG-CG 4.46Å; E311-T347 HydrophobicContact CB-CG2 4.34Å; E311-T347 WeakPolarHBondContact O-CG2 3.33Å
312	V	94.8	Very high	92.3	Very high	3 Å²	3	22.3 Å²	22.3	2%	0.018	10%	0.096	C	C	.	.	H	α-helix	trans	-68.5	-40.7	177.2	173.5	0	0	0	0	112.4	L130 M131 A292 C296 Y302 K308 R309 R310 S314 A315 A316	L130-V312 HydrophobicContact CD2-CG1 4.1Å; L130-V312 HydrophobicContact CD2-CG2 3.84Å; L130-V312 HydrophobicContact CG-CG1 4.44Å; M131-V312 HydrophobicContact CE-CB 4.12Å; M131-V312 HydrophobicContact CE-CG1 3.82Å; M131-V312 HydrophobicContact CE-CG2 3.77Å; A292-V312 HydrophobicContact CB-CG1 4.02Å; C296-V312 VanDerWaalsContact SG-CG1 3.52Å; Y302-V312 HydrophobicContact CD1-CG2 3.48Å; Y302-V312 VanDerWaalsContact CD1-CG2 3.48Å; Y302-V312 HydrophobicContact CE1-CG2 3.55Å; Y302-V312 HydrophobicContact CG-CG2 4.25Å; K308-V312 PolarHBondContact O-N 3Å; R309-V312 PolarHBondContact O-N 3.46Å; R310-V312 VanDerWaalsContact C-N 3.27Å; R310-V312 PolarHBondContact O-N 3.43Å; V312-S314 VanDerWaalsContact C-N 3.32Å; V312-S314 PolarHBondContact O-N 3.17Å; V312-A315 PolarHBondContact O-N 3.28Å; V312-A316 WeakPolarHBondContact O-CB 3.35Å; V312-A316 PolarHBondContact O-N 3.1Å
313	L	95.1	Very high	92.6	Very high	5 Å²	5	22.3 Å²	22.3	3%	0.026	10%	0.096	C	C	.	.	H	α-helix	trans	-65.4	-35	177.4	-69.3	172.6	0	0	0	112.6	I246 L247 L256 C289 N293 R309 R310 A316 A317	I246-L313 HydrophobicContact CG2-CD1 4.33Å; L247-L313 HydrophobicContact CD2-CB 3.89Å; L256-L313 HydrophobicContact CD1-CD1 3.69Å; L256-L313 HydrophobicContact CD1-CD2 3.85Å; L256-L313 HydrophobicContact CD1-CG 4.45Å; C289-L313 HydrophobicContact CB-CD2 4.16Å; C289-L313 VanDerWaalsContact O-CD2 3.3Å; C289-L313 WeakPolarHBondContact O-CD2 3.22Å; C289-L313 PolarHBondContact SG-O 3.36Å; C289-L313 VanDerWaalsContact SG-O 3.4Å; N293-L313 HydrophobicContact CB-CD2 4.14Å; R309-L313 HydrophobicContact CG-CD1 4.44Å; R309-L313 WeakPolarHBondContact O-CG 3.5Å; R309-L313 PolarHBondContact O-N 3.49Å; R310-L313 PolarHBondContact O-N 3.05Å; L313-A316 PolarHBondContact O-N 3.31Å; L313-A317 PolarHBondContact O-N 3.1Å
314	S	94.3	Very high	92.8	Very high	5 Å²	5	16.7 Å²	16.7	4%	0.035	8%	0.075	C	C	.	.	H	α-helix	trans	-66.8	-43	173.6	172.1	0	0	0	0	112	R310 V312 A316 A317 A318 S335 S340 F343	R310-S314 WeakPolarHBondContact O-CB 3.32Å; R310-S314 PolarHBondContact O-N 2.95Å; V312-S314 VanDerWaalsContact C-N 3.32Å; V312-S314 PolarHBondContact O-N 3.17Å; S314-A316 VanDerWaalsContact C-N 3.31Å; S314-A316 PolarHBondContact O-N 2.72Å; S314-A317 PolarHBondContact O-N 2.88Å; S314-A318 PolarHBondContact O-N 3.38Å; S314-S335 PolarHBondContact O-OG 2.83Å; S314-S335 PolarHBondContact OG-OG 3.38Å; S314-S340 PolarHBondContact OG-OG 3.29Å; S314-F343 WeakPolarHBondContact OG-CD2 3.28Å; S314-F343 WeakPolarHBondContact OG-CE2 3.42Å
315	A	95.6	Very high	93.2	Very high	1 Å²	1	9.7 Å²	9.7	1%	0.008	5%	0.045	C	C	.	.	H	α-helix	trans	-61.9	-39.6	171.3	0	0	0	0	0	112	M131 E311 V312 A317 A318 V319 T347	M131-A315 HydrophobicContact CE-CB 4.27Å; M131-A315 HydrophobicContact SD-CB 3.7Å; E311-A315 PolarHBondContact O-N 3.32Å; E311-A315 VanDerWaalsContact O-N 3.13Å; V312-A315 PolarHBondContact O-N 3.28Å; A315-A317 VanDerWaalsContact C-N 3.34Å; A315-A317 PolarHBondContact O-N 3.27Å; A315-A318 WeakPolarHBondContact O-CB 3.48Å; A315-A318 PolarHBondContact O-N 2.83Å; A315-V319 WeakPolarHBondContact O-CG2 3.31Å; A315-V319 PolarHBondContact O-N 3.38Å; A315-T347 HydrophobicContact CB-CG2 4.48Å
316	A	96.6	Very high	93.3	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-67.1	-31.6	176.4	0	0	0	0	0	113.4	V134 A288 A292 V312 L313 S314 A318 V319 G320	V134-A316 HydrophobicContact CG1-CB 4.22Å; A288-A316 WeakPolarHBondContact CB-O 3.27Å; A292-A316 HydrophobicContact CB-CB 3.35Å; V312-A316 WeakPolarHBondContact O-CB 3.35Å; V312-A316 PolarHBondContact O-N 3.1Å; L313-A316 PolarHBondContact O-N 3.31Å; S314-A316 VanDerWaalsContact C-N 3.31Å; S314-A316 PolarHBondContact O-N 2.72Å; A316-A318 VanDerWaalsContact C-N 3.34Å; A316-V319 WeakPolarHBondContact O-CB 3.47Å; A316-V319 PolarHBondContact O-N 3.05Å; A316-G320 PolarHBondContact O-N 3.33Å
317	A	95.9	Very high	93.6	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-64.4	-40	172.8	0	0	0	0	0	111.5	V285 L313 S314 A315 G320 V321 V339	V285-A317 HydrophobicContact CG1-CB 3.84Å; L313-A317 PolarHBondContact O-N 3.1Å; S314-A317 PolarHBondContact O-N 2.88Å; A315-A317 VanDerWaalsContact C-N 3.34Å; A315-A317 PolarHBondContact O-N 3.27Å; A317-G320 PolarHBondContact O-N 3.4Å; A317-V321 PolarHBondContact O-N 2.86Å; A317-V339 HydrophobicContact CB-CG1 4.08Å; A317-V339 HydrophobicContact CB-CG2 4.46Å
318	A	96.2	Very high	93.9	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-62.6	-44.4	172.9	0	0	0	0	0	112.2	S314 A315 A316 G320 V321 S322 G331 V332	S314-A318 PolarHBondContact O-N 3.38Å; A315-A318 WeakPolarHBondContact O-CB 3.48Å; A315-A318 PolarHBondContact O-N 2.83Å; A316-A318 VanDerWaalsContact C-N 3.34Å; A318-G320 VanDerWaalsContact C-N 3.32Å; A318-G320 PolarHBondContact O-N 3.11Å; A318-V321 PolarHBondContact O-N 3.21Å; A318-S322 WeakPolarHBondContact O-CB 3.44Å; A318-S322 PolarHBondContact O-N 3.34Å; A318-G331 VanDerWaalsContact CA-O 3.29Å; A318-G331 WeakPolarHBondContact CA-O 3.17Å; A318-G331 WeakPolarHBondContact CB-O 3.39Å; A318-V332 HydrophobicContact CB-CG2 4.13Å
319	V	97.3	Very high	94.2	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-56.2	-46	173.7	171.2	0	0	0	0	111.4	V134 A138 A315 A316 V321 S322 V323 A354 A358	V134-V319 HydrophobicContact CG1-CG2 4.44Å; A138-V319 HydrophobicContact CB-CG1 3.54Å; A315-V319 WeakPolarHBondContact O-CG2 3.31Å; A315-V319 PolarHBondContact O-N 3.38Å; A316-V319 WeakPolarHBondContact O-CB 3.47Å; A316-V319 PolarHBondContact O-N 3.05Å; V319-V321 VanDerWaalsContact C-N 3.33Å; V319-V321 PolarHBondContact O-N 3.47Å; V319-S322 WeakPolarHBondContact O-CB 3.47Å; V319-S322 PolarHBondContact O-N 2.91Å; V319-V323 WeakPolarHBondContact O-CG2 3.45Å; V319-V323 PolarHBondContact O-N 3.41Å; V319-A354 HydrophobicContact CG2-CB 3.42Å; V319-A354 VanDerWaalsContact CG2-CB 3.42Å; V319-A358 HydrophobicContact CG1-CB 3.64Å
320	G	96	Very high	94.3	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-61.9	-36.6	-179.7	0	0	0	0	0	113.9	A316 A317 A318 V323 A324	A316-G320 PolarHBondContact O-N 3.33Å; A317-G320 PolarHBondContact O-N 3.4Å; A318-G320 VanDerWaalsContact C-N 3.32Å; A318-G320 PolarHBondContact O-N 3.11Å; G320-V323 WeakPolarHBondContact O-CG2 3.12Å; G320-A324 VanDerWaalsContact O-CB 3.25Å; G320-A324 WeakPolarHBondContact O-CB 3.5Å; G320-A324 PolarHBondContact O-N 3.16Å
321	V	94.8	Very high	94.4	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-75.9	-37.3	173.4	177.7	0	0	0	0	111.6	V285 A317 A318 V319 V323 A324 F325 F334 I597	V285-V321 HydrophobicContact CG2-CG2 3.52Å; A317-V321 PolarHBondContact O-N 2.86Å; A318-V321 PolarHBondContact O-N 3.21Å; V319-V321 VanDerWaalsContact C-N 3.33Å; V319-V321 PolarHBondContact O-N 3.47Å; V321-V323 PolarHBondContact O-N 2.92Å; V321-A324 PolarHBondContact O-N 2.68Å; V321-F325 HydrophobicContact CG1-CD2 3.71Å; V321-F325 HydrophobicContact CG1-CE2 4.1Å; V321-F325 PolarHBondContact O-N 2.76Å; V321-F334 HydrophobicContact CB-CD1 4.4Å; V321-F334 HydrophobicContact CB-CG 4.31Å; V321-F334 HydrophobicContact CG1-CB 4.05Å; V321-F334 HydrophobicContact CG1-CD2 4.06Å; V321-F334 HydrophobicContact CG1-CG 3.99Å; V321-F334 HydrophobicContact CG2-CB 4.44Å; V321-F334 HydrophobicContact CG2-CD1 3.5Å; V321-F334 VanDerWaalsContact CG2-CD1 3.5Å; V321-F334 HydrophobicContact CG2-CD2 4.09Å; V321-F334 HydrophobicContact CG2-CE1 3.68Å; V321-F334 HydrophobicContact CG2-CE2 4.29Å; V321-F334 HydrophobicContact CG2-CG 3.76Å; V321-F334 HydrophobicContact CG2-CZ 4.12Å; V321-I597 HydrophobicContact CG1-CD1 4.03Å
322	S	95.3	Very high	94.6	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-60.7	-41.5	176.2	173	0	0	0	0	112.8	A318 V319 G326 A327 P328 A355	A318-S322 WeakPolarHBondContact O-CB 3.44Å; A318-S322 PolarHBondContact O-N 3.34Å; V319-S322 WeakPolarHBondContact O-CB 3.47Å; V319-S322 PolarHBondContact O-N 2.91Å; S322-G326 CarbonylContact O-C 3.59Å; S322-G326 WeakPolarHBondContact O-CA 3.5Å; S322-G326 PolarHBondContact O-N 3.13Å; S322-A327 WeakPolarHBondContact CA-O 3.45Å; S322-A327 PolarHBondContact O-N 3.25Å; S322-P328 WeakPolarHBondContact OG-CA 3.31Å; S322-A355 PolarHBondContact OG-O 3.47Å
323	V	94.3	Very high	94.6	Very high	3 Å²	3	9 Å²	9	2%	0.018	5%	0.051	C	C	.	.	H	α-helix	trans	-77.1	-25.3	175.5	-59.4	0	0	0	0	113.2	A142 V319 G320 V321 A358 L362	A142-V323 HydrophobicContact CB-CB 3.75Å; A142-V323 HydrophobicContact CB-CG1 4.48Å; A142-V323 HydrophobicContact CB-CG2 3.62Å; V319-V323 WeakPolarHBondContact O-CG2 3.45Å; V319-V323 PolarHBondContact O-N 3.41Å; G320-V323 WeakPolarHBondContact O-CG2 3.12Å; V321-V323 PolarHBondContact O-N 2.92Å; V323-A358 HydrophobicContact CG1-CB 3.46Å; V323-A358 VanDerWaalsContact CG1-CB 3.46Å; V323-L362 HydrophobicContact CB-CD2 4.4Å; V323-L362 WeakPolarHBondContact O-CD2 3.48Å
324	A	92.8	Very high	94.6	Very high	1 Å²	1	8.9 Å²	8.9	1%	0.008	5%	0.05	C	C	.	.	H	α-helix	trans	-72.6	-38.7	177.4	0	0	0	0	0	113.2	E281 L284 G320 V321	E281-A324 HydrophobicContact CB-CB 3.76Å; E281-A324 HydrophobicContact CG-CB 4.14Å; E281-A324 VanDerWaalsContact OE2-CA 3.27Å; E281-A324 WeakPolarHBondContact OE2-CA 3.49Å; E281-A324 VanDerWaalsContact OE2-CB 3.24Å; E281-A324 WeakPolarHBondContact OE2-CB 3.5Å; L284-A324 HydrophobicContact CB-CB 4.38Å; L284-A324 HydrophobicContact CD1-CB 3.92Å; G320-A324 VanDerWaalsContact O-CB 3.25Å; G320-A324 WeakPolarHBondContact O-CB 3.5Å; G320-A324 PolarHBondContact O-N 3.16Å; V321-A324 PolarHBondContact O-N 2.68Å
325	F	91.2	Very high	94.6	Very high	5 Å²	5	8.6 Å²	8.6	2%	0.022	5%	0.049	C	C	.	.	H	α-helix	trans	-115.1	4.7	-176.3	-64.8	-80.5	0	0	0	114.2	E281 V321 A327 V374 F376 F528 M532 I597 L601	E281-F325 HydrophobicContact CB-CE2 4.19Å; E281-F325 HydrophobicContact CB-CZ 4.13Å; E281-F325 HydrophobicContact CG-CE1 4.32Å; E281-F325 HydrophobicContact CG-CZ 4.23Å; V321-F325 HydrophobicContact CG1-CD2 3.71Å; V321-F325 HydrophobicContact CG1-CE2 4.1Å; V321-F325 PolarHBondContact O-N 2.76Å; F325-A327 HydrophobicContact CB-CB 3.93Å; F325-A327 PolarHBondContact O-N 3.39Å; F325-A327 VanDerWaalsContact O-N 3.11Å; F325-V374 WeakPolarHBondContact O-CG2 3.45Å; F325-F376 HydrophobicContact CD1-CZ 4.41Å; F325-F528 AromaticContact CE2-CD2 3.59Å; F325-F528 HydrophobicContact CE2-CD2 3.59Å; F325-F528 AromaticContact CE2-CE2 3.92Å; F325-F528 HydrophobicContact CE2-CE2 3.92Å; F325-F528 HydrophobicContact CE2-CG 4.47Å; F325-F528 HydrophobicContact CZ-CB 3.87Å; F325-F528 AromaticContact CZ-CD2 3.41Å; F325-F528 HydrophobicContact CZ-CD2 3.41Å; F325-F528 VanDerWaalsContact CZ-CD2 3.41Å; F325-F528 HydrophobicContact CZ-CE2 4.16Å; F325-F528 AromaticContact CZ-CG 3.88Å; F325-F528 HydrophobicContact CZ-CG 3.88Å; F325-M532 HydrophobicContact CE1-CE 3.86Å; F325-M532 HydrophobicContact CE1-SD 4.21Å; F325-I597 HydrophobicContact CB-CG2 3.87Å; F325-I597 HydrophobicContact CD1-CG2 4Å; F325-I597 HydrophobicContact CD2-CG2 4.48Å; F325-I597 HydrophobicContact CG-CG2 3.89Å; F325-L601 WeakPolarHBondContact O-CD2 3.45Å
326	G	90.1	Very high	94.3	Very high	10 Å²	10	11.5 Å²	11.5	10%	0.103	6%	0.064	C	C	.	.	S	Bend	trans	61.8	15.8	-174.1	0	0	0	0	0	114.1	S322 P328 L373	S322-G326 CarbonylContact O-C 3.59Å; S322-G326 WeakPolarHBondContact O-CA 3.5Å; S322-G326 PolarHBondContact O-N 3.13Å; G326-P328 VanDerWaalsContact O-CD 3.27Å; G326-P328 WeakPolarHBondContact O-CD 3.25Å; G326-L373 VanDerWaalsContact O-CD1 3.26Å; G326-L373 WeakPolarHBondContact O-CD1 3.45Å
327	A	92.8	Very high	94	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.072	C	C	.	.			trans	-116.9	86.2	-163	0	0	0	0	0	110.3	S322 F325 G331 I597 E600	S322-A327 WeakPolarHBondContact CA-O 3.45Å; S322-A327 PolarHBondContact O-N 3.25Å; F325-A327 HydrophobicContact CB-CB 3.93Å; F325-A327 PolarHBondContact O-N 3.39Å; F325-A327 VanDerWaalsContact O-N 3.11Å; A327-G331 PolarHBondContact O-N 3.48Å; A327-I597 HydrophobicContact CB-CB 4.4Å; A327-I597 HydrophobicContact CB-CG1 4.16Å; A327-I597 HydrophobicContact CB-CG2 4.22Å; A327-E600 WeakPolarHBondContact CA-OE2 3.41Å; A327-E600 HydrophobicContact CB-CB 4.02Å; A327-E600 VanDerWaalsContact CB-OE2 3.24Å; A327-E600 WeakPolarHBondContact CB-OE2 3.28Å
328	P	94.9	Very high	93.6	Very high	21 Å²	21	13.8 Å²	13.8	14%	0.136	7%	0.074	C	C	.	.	H	α-helix	trans	-68.3	-41.3	-174.6	26.7	-34.2	0	0	0	113.8	S322 G326 V332 A355 E600	S322-P328 WeakPolarHBondContact OG-CA 3.31Å; G326-P328 VanDerWaalsContact O-CD 3.27Å; G326-P328 WeakPolarHBondContact O-CD 3.25Å; P328-V332 WeakPolarHBondContact O-CG2 3.39Å; P328-V332 PolarHBondContact O-N 3.04Å; P328-A355 HydrophobicContact CB-CB 4.14Å; P328-E600 VanDerWaalsContact CD-OE1 3.3Å; P328-E600 WeakPolarHBondContact CD-OE1 3.44Å
329	I	94.7	Very high	93.2	Very high	79 Å²	79	13.9 Å²	13.9	41%	0.405	8%	0.075	S	C	.	.	H	α-helix	trans	-70.6	-45.2	178.2	-56.3	168.3	0	0	0	109.1	G331 V332 L333 F352 V596 E600	I329-G331 VanDerWaalsContact C-N 3.3Å; I329-G331 PolarHBondContact O-N 2.96Å; I329-V332 PolarHBondContact O-N 3.04Å; I329-L333 HydrophobicContact CG2-CD1 4.16Å; I329-L333 WeakPolarHBondContact O-CG 3.38Å; I329-L333 PolarHBondContact O-N 3.42Å; I329-F352 HydrophobicContact CG1-CE2 3.97Å; I329-V596 HydrophobicContact CB-CG1 4.1Å; I329-V596 HydrophobicContact CG2-CG1 3.88Å; I329-E600 VanDerWaalsContact CB-OE1 3.3Å; I329-E600 WeakPolarHBondContact CB-OE1 3.2Å; I329-E600 VanDerWaalsContact CG1-OE1 3.26Å; I329-E600 WeakPolarHBondContact CG1-OE1 3.19Å; I329-E600 PolarHBondContact N-OE1 3.29Å; I329-E600 PolarHBondContact N-OE2 3Å; I329-E600 VanDerWaalsContact N-OE2 3.13Å
330	G	93.7	Very high	92.6	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-58	-39.5	176.1	0	0	0	0	0	112.9	L333 F334 E600	G330-L333 PolarHBondContact O-N 3.43Å; G330-F334 WeakPolarHBondContact O-CB 3.44Å; G330-F334 PolarHBondContact O-N 3.39Å; G330-E600 PolarHBondContact N-OE2 3.3Å
331	G	94.6	Very high	91.5	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66.3	-39.2	175.7	0	0	0	0	0	114.1	A318 A327 I329 F334 S335	A318-G331 VanDerWaalsContact CA-O 3.29Å; A318-G331 WeakPolarHBondContact CA-O 3.17Å; A318-G331 WeakPolarHBondContact CB-O 3.39Å; A327-G331 PolarHBondContact O-N 3.48Å; I329-G331 VanDerWaalsContact C-N 3.3Å; I329-G331 PolarHBondContact O-N 2.96Å; G331-F334 WeakPolarHBondContact O-CB 3.42Å; G331-F334 PolarHBondContact O-N 3.02Å; G331-S335 PolarHBondContact O-N 3.29Å; G331-S335 VanDerWaalsContact O-N 3.16Å
332	V	95.9	Very high	90.8	Very high	7 Å²	7	23.7 Å²	23.7	4%	0.042	12%	0.116	C	C	.	.	H	α-helix	trans	-66.3	-45.4	174.2	174.5	0	0	0	0	110.8	A318 P328 I329 F334 S335 L336 F343 L348 F352 A355	A318-V332 HydrophobicContact CB-CG2 4.13Å; P328-V332 WeakPolarHBondContact O-CG2 3.39Å; P328-V332 PolarHBondContact O-N 3.04Å; I329-V332 PolarHBondContact O-N 3.04Å; V332-F334 VanDerWaalsContact C-N 3.31Å; V332-F334 PolarHBondContact O-N 2.71Å; V332-S335 PolarHBondContact O-N 3.14Å; V332-L336 HydrophobicContact CG1-CD1 4.23Å; V332-L336 PolarHBondContact O-N 2.71Å; V332-L336 VanDerWaalsContact O-N 3.11Å; V332-F343 HydrophobicContact CG1-CZ 4.42Å; V332-L348 HydrophobicContact CG1-CG 4.35Å; V332-F352 HydrophobicContact CG2-CB 4.17Å; V332-F352 HydrophobicContact CG2-CD2 4.47Å; V332-A355 HydrophobicContact CG2-CB 4.47Å
333	L	94.9	Very high	90.2	Very high	51 Å²	51	25.3 Å²	25.3	27%	0.267	12%	0.123	S	C	.	.	H	α-helix	trans	-63.3	-35.3	175.9	-67.8	174.8	0	0	0	112.3	I329 G330 L336 E337 S593 V596	I329-L333 HydrophobicContact CG2-CD1 4.16Å; I329-L333 WeakPolarHBondContact O-CG 3.38Å; I329-L333 PolarHBondContact O-N 3.42Å; G330-L333 PolarHBondContact O-N 3.43Å; L333-L336 HydrophobicContact CD2-CD1 4.26Å; L333-L336 WeakPolarHBondContact O-CB 3.46Å; L333-L336 PolarHBondContact O-N 2.96Å; L333-E337 VanDerWaalsContact O-CB 3.31Å; L333-E337 WeakPolarHBondContact O-CB 3.32Å; L333-E337 PolarHBondContact O-N 2.8Å; L333-S593 VanDerWaalsContact C-CB 3.5Å; L333-V596 HydrophobicContact CD1-CB 3.93Å; L333-V596 HydrophobicContact CD1-CG1 4Å; L333-V596 HydrophobicContact CD1-CG2 3.68Å
334	F	94.2	Very high	89.8	Confident	3 Å²	3	26.5 Å²	26.5	1%	0.013	13%	0.131	C	C	.	.	H	α-helix	trans	-59.9	-46.3	173.2	177.9	-74.3	0	0	0	111.7	I240 V321 G330 G331 V332 L336 E337 E338 V339 F528 M590	I240-F334 HydrophobicContact CD1-CZ 4.22Å; V321-F334 HydrophobicContact CB-CD1 4.4Å; V321-F334 HydrophobicContact CB-CG 4.31Å; V321-F334 HydrophobicContact CG1-CB 4.05Å; V321-F334 HydrophobicContact CG1-CD2 4.06Å; V321-F334 HydrophobicContact CG1-CG 3.99Å; V321-F334 HydrophobicContact CG2-CB 4.44Å; V321-F334 HydrophobicContact CG2-CD1 3.5Å; V321-F334 VanDerWaalsContact CG2-CD1 3.5Å; V321-F334 HydrophobicContact CG2-CD2 4.09Å; V321-F334 HydrophobicContact CG2-CE1 3.68Å; V321-F334 HydrophobicContact CG2-CE2 4.29Å; V321-F334 HydrophobicContact CG2-CG 3.76Å; V321-F334 HydrophobicContact CG2-CZ 4.12Å; G330-F334 WeakPolarHBondContact O-CB 3.44Å; G330-F334 PolarHBondContact O-N 3.39Å; G331-F334 WeakPolarHBondContact O-CB 3.42Å; G331-F334 PolarHBondContact O-N 3.02Å; V332-F334 VanDerWaalsContact C-N 3.31Å; V332-F334 PolarHBondContact O-N 2.71Å; F334-L336 VanDerWaalsContact C-N 3.27Å; F334-L336 PolarHBondContact O-N 3.31Å; F334-E337 PolarHBondContact O-N 2.67Å; F334-E338 PolarHBondContact O-N 2.71Å; F334-V339 HydrophobicContact CD1-CG2 3.56Å; F334-V339 HydrophobicContact CE1-CG2 3.27Å; F334-V339 HydrophobicContact CZ-CG2 4.37Å; F334-F528 HydrophobicContact CE2-CE1 4.31Å; F334-F528 HydrophobicContact CE2-CE2 4.12Å; F334-F528 AromaticContact CE2-CZ 3.49Å; F334-F528 HydrophobicContact CE2-CZ 3.49Å; F334-F528 VanDerWaalsContact CE2-CZ 3.49Å; F334-F528 HydrophobicContact CZ-CE2 4.38Å; F334-F528 AromaticContact CZ-CZ 3.72Å; F334-F528 HydrophobicContact CZ-CZ 3.72Å; F334-M590 HydrophobicContact CB-CE 4.26Å; F334-M590 HydrophobicContact CD2-CE 3.06Å; F334-M590 HydrophobicContact CD2-SD 3.85Å; F334-M590 HydrophobicContact CE2-CE 3.32Å; F334-M590 HydrophobicContact CE2-SD 3.51Å; F334-M590 VanDerWaalsContact CE2-SD 3.51Å; F334-M590 HydrophobicContact CG-CE 3.75Å; F334-M590 HydrophobicContact CZ-CE 4.22Å; F334-M590 HydrophobicContact CZ-SD 4.43Å
335	S	94.1	Very high	89.7	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.16	C	C	.	.	I	π-helix	trans	-65.1	-34.7	179.8	-166.8	0	0	0	0	112.1	S314 G331 V332 V339 S340	S314-S335 PolarHBondContact O-OG 2.83Å; S314-S335 PolarHBondContact OG-OG 3.38Å; G331-S335 PolarHBondContact O-N 3.29Å; G331-S335 VanDerWaalsContact O-N 3.16Å; V332-S335 PolarHBondContact O-N 3.14Å; S335-V339 PolarHBondContact O-N 2.9Å; S335-S340 WeakPolarHBondContact O-CB 3.17Å; S335-S340 PolarHBondContact O-N 3.44Å; S335-S340 PolarHBondContact O-OG 2.97Å; S335-S340 PolarHBondContact OG-OG 3.15Å
336	L	91.2	Very high	89.5	Confident	62 Å²	62	39.9 Å²	39.9	33%	0.325	19%	0.194	S	C	.	.	I	π-helix	trans	-67.4	-47.6	172.6	-91.8	160.6	0	0	0	113.7	V332 L333 F334 F343 L348	V332-L336 HydrophobicContact CG1-CD1 4.23Å; V332-L336 PolarHBondContact O-N 2.71Å; V332-L336 VanDerWaalsContact O-N 3.11Å; L333-L336 HydrophobicContact CD2-CD1 4.26Å; L333-L336 WeakPolarHBondContact O-CB 3.46Å; L333-L336 PolarHBondContact O-N 2.96Å; F334-L336 VanDerWaalsContact C-N 3.27Å; F334-L336 PolarHBondContact O-N 3.31Å; L336-F343 HydrophobicContact CD1-CD1 4.16Å; L336-F343 HydrophobicContact CD1-CE1 3.86Å; L336-F343 HydrophobicContact CD2-CB 3.71Å; L336-F343 HydrophobicContact CD2-CD1 3.3Å; L336-F343 HydrophobicContact CD2-CD2 4.5Å; L336-F343 HydrophobicContact CD2-CE1 3.87Å; L336-F343 HydrophobicContact CD2-CG 3.62Å; L336-F343 HydrophobicContact CG-CD1 3.61Å; L336-F343 HydrophobicContact CG-CD2 4.48Å; L336-F343 HydrophobicContact CG-CE1 3.62Å; L336-F343 HydrophobicContact CG-CG 4Å; L336-F343 HydrophobicContact CG-CZ 4.14Å; L336-L348 HydrophobicContact CD1-CD1 4.09Å
337	E	89.8	Confident	89.6	Confident	38 Å²	38	39.6 Å²	39.6	18%	0.178	19%	0.19	C	C	.	.	I	π-helix	trans	-80.4	-34.5	-170.5	-168.7	178.2	153.2	0	0	113.1	L333 F334 M590 T591 V592 S593 K646	L333-E337 VanDerWaalsContact O-CB 3.31Å; L333-E337 WeakPolarHBondContact O-CB 3.32Å; L333-E337 PolarHBondContact O-N 2.8Å; F334-E337 PolarHBondContact O-N 2.67Å; E337-M590 WeakPolarHBondContact OE1-CA 3.35Å; E337-T591 PolarHBondContact OE1-N 3.43Å; E337-T591 PolarHBondContact OE1-OG1 2.9Å; E337-V592 PolarHBondContact OE2-N 3.3Å; E337-S593 PolarHBondContact OE2-N 2.71Å; E337-S593 PolarHBondContact OE2-OG 3.18Å; E337-K646 PolarHBondContact O-NZ 2.82Å
338	E	87.8	Confident	89.6	Confident	9 Å²	9	42 Å²	42	4%	0.042	20%	0.203	C	C	.	.	I	π-helix	trans	-122.3	-35.2	-170.3	-83.6	-52.4	125.9	0	0	116.8	K244 F334 M590 K646	K244-E338 WeakPolarHBondContact CD-O 3.46Å; K244-E338 WeakPolarHBondContact CE-O 3.13Å; K244-E338 PolarHBondContact NZ-O 3.11Å; K244-E338 IonicContact NZ-OE2 3.25Å; K244-E338 PolarHBondContact NZ-OE2 3.39Å; F334-E338 PolarHBondContact O-N 2.71Å; E338-M590 HydrophobicContact CB-CE 3.95Å; E338-M590 HydrophobicContact CG-CE 3.44Å; E338-M590 VanDerWaalsContact CG-CE 3.44Å; E338-M590 HydrophobicContact CG-CG 3.52Å; E338-M590 HydrophobicContact CG-SD 3.82Å; E338-K646 IonicContact OE1-NZ 3.39Å; E338-K646 PolarHBondContact OE1-NZ 3.47Å
339	V	86.8	Confident	89.5	Confident	3 Å²	3	48 Å²	48	2%	0.018	22%	0.223	C	C	.	.	I	π-helix	trans	-94.4	-38	-168.4	-158.1	0	0	0	0	111.8	I243 L247 A317 F334 S335	I243-V339 HydrophobicContact CG2-CG1 3.7Å; L247-V339 HydrophobicContact CD1-CB 4.4Å; L247-V339 HydrophobicContact CD1-CG1 3.73Å; A317-V339 HydrophobicContact CB-CG1 4.08Å; A317-V339 HydrophobicContact CB-CG2 4.46Å; F334-V339 HydrophobicContact CD1-CG2 3.56Å; F334-V339 HydrophobicContact CE1-CG2 3.27Å; F334-V339 HydrophobicContact CZ-CG2 4.37Å; S335-V339 PolarHBondContact O-N 2.9Å
340	S	84.1	Confident	89.4	Confident	19 Å²	19	46.3 Å²	46.3	13%	0.133	21%	0.211	C	C	.	.			trans	-101.3	132.6	-170.2	-55	0	0	0	0	112.5	S314 S335	S314-S340 PolarHBondContact OG-OG 3.29Å; S335-S340 WeakPolarHBondContact O-CB 3.17Å; S335-S340 PolarHBondContact O-N 3.44Å; S335-S340 PolarHBondContact O-OG 2.97Å; S335-S340 PolarHBondContact OG-OG 3.15Å
341	Y	74	Confident	89.5	Confident	68 Å²	68	46.3 Å²	46.3	27%	0.267	21%	0.211	S	C	.	.	S	Bend	trans	-77.2	-38.4	170.2	174.7	-84.4	0	0	0	112	P645 R777 K778	Y341-P645 HydrophobicContact CD2-CB 3.89Å; Y341-P645 HydrophobicContact CD2-CG 4.07Å; Y341-P645 HydrophobicContact CE2-CB 3.68Å; Y341-P645 HydrophobicContact CE2-CG 4.36Å; Y341-R777 WeakPolarHBondContact CE1-O 3.48Å; Y341-R777 HydrophobicContact CE2-CB 3.95Å; Y341-R777 HydrophobicContact CE2-CG 4.39Å; Y341-R777 WeakPolarHBondContact OH-CB 3.41Å; Y341-R777 PolarHBondContact OH-O 2.95Å; Y341-K778 VanDerWaalsContact OH-CA 3.3Å; Y341-K778 WeakPolarHBondContact OH-CA 3.46Å; Y341-K778 PolarHBondContact OH-N 2.74Å; Y341-K778 VanDerWaalsContact OH-N 3.13Å
342	Y	78.9	Confident	89.6	Confident	119 Å²	119	49.8 Å²	49.8	47%	0.467	23%	0.227	S	C	.	.			trans	-137.5	132.7	-178.8	172.4	-99.5	0	0	0	109.2	P344	Y342-P344 HydrophobicContact CE1-CB 4.1Å; Y342-P344 HydrophobicContact CE1-CG 3.98Å
343	F	83.4	Confident	89.6	Confident	33 Å²	33	52.6 Å²	52.6	15%	0.145	24%	0.239	C	C	.	.			trans	-142.4	96.7	-172.6	-164.5	-95.3	0	0	0	110.7	S314 V332 L336 T347 L348	S314-F343 WeakPolarHBondContact OG-CD2 3.28Å; S314-F343 WeakPolarHBondContact OG-CE2 3.42Å; V332-F343 HydrophobicContact CG1-CZ 4.42Å; L336-F343 HydrophobicContact CD1-CD1 4.16Å; L336-F343 HydrophobicContact CD1-CE1 3.86Å; L336-F343 HydrophobicContact CD2-CB 3.71Å; L336-F343 HydrophobicContact CD2-CD1 3.3Å; L336-F343 HydrophobicContact CD2-CD2 4.5Å; L336-F343 HydrophobicContact CD2-CE1 3.87Å; L336-F343 HydrophobicContact CD2-CG 3.62Å; L336-F343 HydrophobicContact CG-CD1 3.61Å; L336-F343 HydrophobicContact CG-CD2 4.48Å; L336-F343 HydrophobicContact CG-CE1 3.62Å; L336-F343 HydrophobicContact CG-CG 4Å; L336-F343 HydrophobicContact CG-CZ 4.14Å; F343-T347 HydrophobicContact CD2-CG2 4.31Å; F343-T347 HydrophobicContact CE2-CG2 3.97Å; F343-T347 HydrophobicContact CZ-CG2 4.33Å; F343-L348 HydrophobicContact CD1-CB 4.11Å; F343-L348 HydrophobicContact CE1-CB 3.46Å; F343-L348 VanDerWaalsContact CE1-CB 3.46Å; F343-L348 HydrophobicContact CE1-CD1 4.17Å; F343-L348 HydrophobicContact CE1-CG 3.8Å; F343-L348 HydrophobicContact CZ-CB 4.37Å
344	P	87	Confident	89.8	Confident	28 Å²	28	50.2 Å²	50.2	18%	0.182	23%	0.226	C	C	.	.			trans	-75.7	150.4	-177.6	30	-32.7	0	0	0	111.3	E311 Y342 K346 T347 L348	E311-P344 HydrophobicContact CG-CG 4.46Å; Y342-P344 HydrophobicContact CE1-CB 4.1Å; Y342-P344 HydrophobicContact CE1-CG 3.98Å; P344-K346 PolarHBondContact O-N 3.39Å; P344-K346 VanDerWaalsContact O-N 3.12Å; P344-T347 WeakPolarHBondContact CG-OG1 3.46Å; P344-T347 WeakPolarHBondContact O-CA 3.35Å; P344-T347 WeakPolarHBondContact O-CB 3.5Å; P344-T347 PolarHBondContact O-N 2.96Å; P344-L348 PolarHBondContact O-N 3.49Å; P344-L348 VanDerWaalsContact O-N 3.15Å
345	L	88.7	Confident	89.9	Confident	116 Å²	116	50 Å²	50	61%	0.607	23%	0.225	S	C	*	.	H	α-helix	trans	-55.4	-34.4	-176.7	-173	63.9	0	0	0	113.6	T347 L348 W349	L345-T347 VanDerWaalsContact C-N 3.26Å; L345-T347 PolarHBondContact O-N 3.05Å; L345-L348 HydrophobicContact CD1-CB 4.38Å; L345-L348 HydrophobicContact CD1-CD1 4.26Å; L345-L348 VanDerWaalsContact O-CB 3.29Å; L345-L348 WeakPolarHBondContact O-CB 3.5Å; L345-L348 PolarHBondContact O-N 3.44Å; L345-L348 VanDerWaalsContact O-N 3.14Å; L345-W349 PolarHBondContact O-N 2.96Å
346	K	88.5	Confident	89.9	Confident	172 Å²	172	54.4 Å²	54.4	75%	0.748	25%	0.248	S	C	*	.	H	α-helix	trans	-65.1	-27.1	174.6	-64	-173.8	179.4	-176.6	0	113	P344 R350	P344-K346 PolarHBondContact O-N 3.39Å; P344-K346 VanDerWaalsContact O-N 3.12Å; K346-R350 WeakPolarHBondContact O-CD 3.34Å; K346-R350 VanDerWaalsContact O-CG 3.28Å; K346-R350 WeakPolarHBondContact O-CG 3.46Å
347	T	90.7	Very high	90.2	Very high	4 Å²	4	52.3 Å²	52.3	3%	0.025	24%	0.238	C	C	.	.	H	α-helix	trans	-80.8	-32.6	172.2	-61.2	0	0	0	0	111.4	E311 A315 F343 P344 L345 R350 S351	E311-T347 HydrophobicContact CB-CG2 4.34Å; E311-T347 WeakPolarHBondContact O-CG2 3.33Å; A315-T347 HydrophobicContact CB-CG2 4.48Å; F343-T347 HydrophobicContact CD2-CG2 4.31Å; F343-T347 HydrophobicContact CE2-CG2 3.97Å; F343-T347 HydrophobicContact CZ-CG2 4.33Å; P344-T347 WeakPolarHBondContact CG-OG1 3.46Å; P344-T347 WeakPolarHBondContact O-CA 3.35Å; P344-T347 WeakPolarHBondContact O-CB 3.5Å; P344-T347 PolarHBondContact O-N 2.96Å; L345-T347 VanDerWaalsContact C-N 3.26Å; L345-T347 PolarHBondContact O-N 3.05Å; T347-R350 PolarHBondContact O-N 2.99Å; T347-S351 WeakPolarHBondContact O-CB 3.49Å; T347-S351 PolarHBondContact O-N 3.35Å; T347-S351 PolarHBondContact O-OG 3.06Å
348	L	93.2	Very high	90.5	Very high	50 Å²	50	50.5 Å²	50.5	26%	0.262	23%	0.229	S	C	.	.	H	α-helix	trans	-55.1	-58.9	173.6	-166.8	155	0	0	0	111.3	V332 L336 F343 P344 L345 R350 S351 F352	V332-L348 HydrophobicContact CG1-CG 4.35Å; L336-L348 HydrophobicContact CD1-CD1 4.09Å; F343-L348 HydrophobicContact CD1-CB 4.11Å; F343-L348 HydrophobicContact CE1-CB 3.46Å; F343-L348 VanDerWaalsContact CE1-CB 3.46Å; F343-L348 HydrophobicContact CE1-CD1 4.17Å; F343-L348 HydrophobicContact CE1-CG 3.8Å; F343-L348 HydrophobicContact CZ-CB 4.37Å; P344-L348 PolarHBondContact O-N 3.49Å; P344-L348 VanDerWaalsContact O-N 3.15Å; L345-L348 HydrophobicContact CD1-CB 4.38Å; L345-L348 HydrophobicContact CD1-CD1 4.26Å; L345-L348 VanDerWaalsContact O-CB 3.29Å; L345-L348 WeakPolarHBondContact O-CB 3.5Å; L345-L348 PolarHBondContact O-N 3.44Å; L345-L348 VanDerWaalsContact O-N 3.14Å; L348-R350 VanDerWaalsContact C-N 3.31Å; L348-R350 PolarHBondContact O-N 3.01Å; L348-S351 PolarHBondContact O-N 3.22Å; L348-S351 VanDerWaalsContact O-N 3.11Å; L348-S351 PolarHBondContact O-OG 3.39Å; L348-F352 PolarHBondContact O-N 3.43Å
349	W	93.4	Very high	90.8	Very high	146 Å²	146	50.4 Å²	50.4	55%	0.553	23%	0.23	S	C	*	.	H	α-helix	trans	-58.7	-40.4	179.5	-71.6	113.6	0	0	0	113.3	W128 L345 F352 F353	W128-W349 HydrophobicContact CH2-CB 4.43Å; L345-W349 PolarHBondContact O-N 2.96Å; W349-F352 PolarHBondContact O-N 3.04Å; W349-F353 WeakPolarHBondContact O-CB 3.27Å; W349-F353 PolarHBondContact O-N 3.05Å
350	R	93.7	Very high	91.1	Very high	44 Å²	44	57 Å²	57	17%	0.166	26%	0.259	C	S	.	.	H	α-helix	trans	-64.1	-40.8	175.6	-78.5	176	177.8	170.8	-0.5	113	M131 K346 T347 L348 A354	M131-R350 HydrophobicContact CG-CB 3.83Å; M131-R350 HydrophobicContact CG-CG 4.25Å; M131-R350 HydrophobicContact SD-CB 4.18Å; K346-R350 WeakPolarHBondContact O-CD 3.34Å; K346-R350 VanDerWaalsContact O-CG 3.28Å; K346-R350 WeakPolarHBondContact O-CG 3.46Å; T347-R350 PolarHBondContact O-N 2.99Å; L348-R350 VanDerWaalsContact C-N 3.31Å; L348-R350 PolarHBondContact O-N 3.01Å; R350-A354 WeakPolarHBondContact O-CB 3.35Å; R350-A354 PolarHBondContact O-N 3.33Å
351	S	95.4	Very high	91.7	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68.1	-39.6	177.6	72.1	0	0	0	0	112.3	T347 L348 A354 A355	T347-S351 WeakPolarHBondContact O-CB 3.49Å; T347-S351 PolarHBondContact O-N 3.35Å; T347-S351 PolarHBondContact O-OG 3.06Å; L348-S351 PolarHBondContact O-N 3.22Å; L348-S351 VanDerWaalsContact O-N 3.11Å; L348-S351 PolarHBondContact O-OG 3.39Å; S351-A354 PolarHBondContact O-N 2.94Å; S351-A355 VanDerWaalsContact O-CB 3.3Å; S351-A355 WeakPolarHBondContact O-CB 3.28Å; S351-A355 PolarHBondContact O-N 3.42Å
352	F	96	Very high	92.5	Very high	74 Å²	74	53.7 Å²	53.7	33%	0.325	25%	0.245	S	C	.	.	H	α-helix	trans	-63.4	-46.4	175.4	-179.8	-104.9	0	0	0	111.7	I329 V332 L348 W349 A355 L356	I329-F352 HydrophobicContact CG1-CE2 3.97Å; V332-F352 HydrophobicContact CG2-CB 4.17Å; V332-F352 HydrophobicContact CG2-CD2 4.47Å; L348-F352 PolarHBondContact O-N 3.43Å; W349-F352 PolarHBondContact O-N 3.04Å; F352-A355 PolarHBondContact O-N 3.44Å; F352-L356 WeakPolarHBondContact O-CB 3.4Å; F352-L356 PolarHBondContact O-N 2.9Å
353	F	97	Very high	93	Very high	66 Å²	66	55.4 Å²	55.4	29%	0.289	25%	0.25	S	S	.	.	H	α-helix	trans	-60.3	-45.7	173.8	174.6	-101.5	0	0	0	112.5	W128 M131 L132 W349 A355 L356 V357	W128-F353 HydrophobicContact CE3-CB 4.25Å; W128-F353 AromaticContact CE3-CD1 3.76Å; W128-F353 HydrophobicContact CE3-CD1 3.76Å; W128-F353 HydrophobicContact CE3-CE1 4.22Å; W128-F353 AromaticContact CE3-CG 3.92Å; W128-F353 HydrophobicContact CE3-CG 3.92Å; W128-F353 HydrophobicContact CZ3-CB 3.7Å; W128-F353 HydrophobicContact CZ3-CD1 4.1Å; W128-F353 HydrophobicContact CZ3-CD2 4.34Å; W128-F353 AromaticContact CZ3-CG 3.79Å; W128-F353 HydrophobicContact CZ3-CG 3.79Å; M131-F353 HydrophobicContact CB-CD1 4.02Å; M131-F353 HydrophobicContact CB-CE1 4.41Å; L132-F353 HydrophobicContact CB-CE1 4.17Å; L132-F353 HydrophobicContact CD1-CZ 4.33Å; W349-F353 WeakPolarHBondContact O-CB 3.27Å; W349-F353 PolarHBondContact O-N 3.05Å; F353-A355 VanDerWaalsContact C-N 3.34Å; F353-A355 PolarHBondContact O-N 3.47Å; F353-L356 PolarHBondContact O-N 2.74Å; F353-V357 HydrophobicContact CE1-CG2 4.17Å; F353-V357 HydrophobicContact CE2-CG2 4.15Å; F353-V357 HydrophobicContact CZ-CG2 3.96Å; F353-V357 WeakPolarHBondContact O-CG2 3.27Å; F353-V357 PolarHBondContact O-N 2.77Å
354	A	97.1	Very high	93.4	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-61.7	-41.4	177.6	0	0	0	0	0	112.2	M131 V319 R350 S351 V357 A358	M131-A354 HydrophobicContact CB-CB 3.98Å; M131-A354 HydrophobicContact CG-CB 4.33Å; M131-A354 HydrophobicContact SD-CB 3.92Å; V319-A354 HydrophobicContact CG2-CB 3.42Å; V319-A354 VanDerWaalsContact CG2-CB 3.42Å; R350-A354 WeakPolarHBondContact O-CB 3.35Å; R350-A354 PolarHBondContact O-N 3.33Å; S351-A354 PolarHBondContact O-N 2.94Å; A354-V357 PolarHBondContact O-N 3.27Å; A354-A358 WeakPolarHBondContact O-CB 3.28Å; A354-A358 PolarHBondContact O-N 3.38Å
355	A	96.7	Very high	93.5	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.9	-44.8	177.4	0	0	0	0	0	111.5	S322 P328 V332 S351 F352 F353 V357 A358 A359	S322-A355 PolarHBondContact OG-O 3.47Å; P328-A355 HydrophobicContact CB-CB 4.14Å; V332-A355 HydrophobicContact CG2-CB 4.47Å; S351-A355 VanDerWaalsContact O-CB 3.3Å; S351-A355 WeakPolarHBondContact O-CB 3.28Å; S351-A355 PolarHBondContact O-N 3.42Å; F352-A355 PolarHBondContact O-N 3.44Å; F353-A355 VanDerWaalsContact C-N 3.34Å; F353-A355 PolarHBondContact O-N 3.47Å; A355-V357 PolarHBondContact O-N 3.02Å; A355-A358 PolarHBondContact O-N 2.81Å; A355-A359 WeakPolarHBondContact O-CB 3.47Å; A355-A359 PolarHBondContact O-N 2.97Å
356	L	95.4	Very high	93.4	Very high	91 Å²	91	56.2 Å²	56.2	48%	0.476	26%	0.261	S	S	.	.	H	α-helix	trans	-59.5	-45	175.6	-177.3	65.4	0	0	0	112.1	F352 F353 A358 A359 F360	F352-L356 WeakPolarHBondContact O-CB 3.4Å; F352-L356 PolarHBondContact O-N 2.9Å; F353-L356 PolarHBondContact O-N 2.74Å; L356-A358 VanDerWaalsContact C-N 3.33Å; L356-A358 PolarHBondContact O-N 3.37Å; L356-A359 PolarHBondContact O-N 2.97Å; L356-F360 WeakPolarHBondContact O-CB 3.15Å; L356-F360 PolarHBondContact O-N 3Å
357	V	97.2	Very high	93	Very high	19 Å²	19	48.5 Å²	48.5	12%	0.115	23%	0.229	C	C	.	.	H	α-helix	trans	-60.6	-42.4	174.9	169.1	0	0	0	0	111.2	L132 L136 F353 A354 A355 F360 T361	L132-V357 HydrophobicContact CD1-CG1 3.96Å; L132-V357 HydrophobicContact CD1-CG2 3.93Å; L136-V357 HydrophobicContact CD2-CG1 4.09Å; L136-V357 HydrophobicContact CG-CG1 3.94Å; F353-V357 HydrophobicContact CE1-CG2 4.17Å; F353-V357 HydrophobicContact CE2-CG2 4.15Å; F353-V357 HydrophobicContact CZ-CG2 3.96Å; F353-V357 WeakPolarHBondContact O-CG2 3.27Å; F353-V357 PolarHBondContact O-N 2.77Å; A354-V357 PolarHBondContact O-N 3.27Å; A355-V357 PolarHBondContact O-N 3.02Å; V357-F360 PolarHBondContact O-N 3.31Å; V357-T361 WeakPolarHBondContact O-CB 3.15Å; V357-T361 PolarHBondContact O-N 3.32Å; V357-T361 PolarHBondContact O-OG1 3.47Å
358	A	96.6	Very high	92.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-68.3	-43.5	-179.4	0	0	0	0	0	112.3	G135 V319 V323 A354 A355 L356 T361 L362	G135-A358 WeakPolarHBondContact O-CA 3.41Å; G135-A358 WeakPolarHBondContact O-CB 3.49Å; V319-A358 HydrophobicContact CG1-CB 3.64Å; V323-A358 HydrophobicContact CG1-CB 3.46Å; V323-A358 VanDerWaalsContact CG1-CB 3.46Å; A354-A358 WeakPolarHBondContact O-CB 3.28Å; A354-A358 PolarHBondContact O-N 3.38Å; A355-A358 PolarHBondContact O-N 2.81Å; L356-A358 VanDerWaalsContact C-N 3.33Å; L356-A358 PolarHBondContact O-N 3.37Å; A358-T361 WeakPolarHBondContact O-CB 3.24Å; A358-T361 PolarHBondContact O-N 3.24Å; A358-L362 PolarHBondContact O-N 3.49Å
359	A	92.8	Very high	91.3	Very high	7 Å²	7	48.6 Å²	48.6	6%	0.058	24%	0.237	C	C	.	.	H	α-helix	trans	-62.2	-43.6	173.6	0	0	0	0	0	111.5	A355 L356 T361 L362 R363 L373	A355-A359 WeakPolarHBondContact O-CB 3.47Å; A355-A359 PolarHBondContact O-N 2.97Å; L356-A359 PolarHBondContact O-N 2.97Å; A359-T361 VanDerWaalsContact C-N 3.32Å; A359-T361 PolarHBondContact O-N 3.25Å; A359-L362 PolarHBondContact O-N 3.43Å; A359-R363 WeakPolarHBondContact O-CB 3.36Å; A359-R363 PolarHBondContact O-N 2.8Å; A359-L373 HydrophobicContact CB-CD1 4.33Å; A359-L373 VanDerWaalsContact O-CD2 3.28Å; A359-L373 WeakPolarHBondContact O-CD2 3.48Å
360	F	93.9	Very high	90.2	Very high	141 Å²	141	45 Å²	45	62%	0.618	23%	0.228	S	C	*	.	H	α-helix	trans	-60.3	-41.1	173.7	179.2	-96.3	0	0	0	112.2	L356 V357 R363 S364	L356-F360 WeakPolarHBondContact O-CB 3.15Å; L356-F360 PolarHBondContact O-N 3Å; V357-F360 PolarHBondContact O-N 3.31Å; F360-R363 PolarHBondContact O-N 3.35Å; F360-S364 WeakPolarHBondContact O-CB 3.34Å; F360-S364 PolarHBondContact O-N 3.43Å; F360-S364 PolarHBondContact O-OG 3.14Å
361	T	95.1	Very high	89.3	Confident	17 Å²	17	45.9 Å²	45.9	10%	0.104	24%	0.242	C	C	.	.	H	α-helix	trans	-62.3	-46.8	175.6	-54	0	0	0	0	111.4	V357 A358 A359 S364 I365	V357-T361 WeakPolarHBondContact O-CB 3.15Å; V357-T361 PolarHBondContact O-N 3.32Å; V357-T361 PolarHBondContact O-OG1 3.47Å; A358-T361 WeakPolarHBondContact O-CB 3.24Å; A358-T361 PolarHBondContact O-N 3.24Å; A359-T361 VanDerWaalsContact C-N 3.32Å; A359-T361 PolarHBondContact O-N 3.25Å; T361-S364 PolarHBondContact O-N 2.87Å; T361-I365 HydrophobicContact CG2-CD1 4.22Å; T361-I365 WeakPolarHBondContact O-CG1 3.2Å; T361-I365 PolarHBondContact O-N 3.39Å; T361-I365 VanDerWaalsContact O-N 3.1Å
362	L	91.3	Very high	88.4	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.005	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-44.1	177.6	-174.6	62.8	0	0	0	111.4	V323 A358 A359 S364 I365 N366 P367 L373	V323-L362 HydrophobicContact CB-CD2 4.4Å; V323-L362 WeakPolarHBondContact O-CD2 3.48Å; A358-L362 PolarHBondContact O-N 3.49Å; A359-L362 PolarHBondContact O-N 3.43Å; L362-S364 VanDerWaalsContact C-N 3.3Å; L362-S364 PolarHBondContact O-N 3.39Å; L362-I365 PolarHBondContact O-N 2.86Å; L362-N366 PolarHBondContact O-N 3.38Å; L362-P367 HydrophobicContact CD1-CG 4.02Å; L362-L373 HydrophobicContact CB-CD2 4.21Å; L362-L373 HydrophobicContact CD2-CD2 4.31Å; L362-L373 HydrophobicContact CG-CD2 4.32Å
363	R	90.1	Very high	87.3	Confident	154 Å²	154	48.9 Å²	48.9	58%	0.581	25%	0.254	S	S	*	.	H	α-helix	trans	-60.7	-37.7	174.4	-167.6	173.5	-176.4	173.8	-0.5	112.9	A359 F360 I365 N366 L373	A359-R363 WeakPolarHBondContact O-CB 3.36Å; A359-R363 PolarHBondContact O-N 2.8Å; F360-R363 PolarHBondContact O-N 3.35Å; R363-I365 VanDerWaalsContact C-N 3.3Å; R363-N366 PolarHBondContact O-N 2.99Å; R363-L373 HydrophobicContact CB-CD2 3.76Å
364	S	91.3	Very high	86.3	Confident	78 Å²	78	46.3 Å²	46.3	55%	0.545	24%	0.243	S	C	.	.	H	α-helix	trans	-70.2	-27.4	178.3	-58.3	0	0	0	0	112.8	F360 T361 L362	F360-S364 WeakPolarHBondContact O-CB 3.34Å; F360-S364 PolarHBondContact O-N 3.43Å; F360-S364 PolarHBondContact O-OG 3.14Å; T361-S364 PolarHBondContact O-N 2.87Å; L362-S364 VanDerWaalsContact C-N 3.3Å; L362-S364 PolarHBondContact O-N 3.39Å
365	I	89.9	Confident	84.8	Confident	65 Å²	65	47.6 Å²	47.6	33%	0.333	25%	0.25	S	C	.	.	H	α-helix	trans	-78.8	-31.2	173.3	-68.6	166.3	0	0	0	111.2	I147 T361 L362 R363	I147-I365 HydrophobicContact CD1-CG2 3.9Å; T361-I365 HydrophobicContact CG2-CD1 4.22Å; T361-I365 WeakPolarHBondContact O-CG1 3.2Å; T361-I365 PolarHBondContact O-N 3.39Å; T361-I365 VanDerWaalsContact O-N 3.1Å; L362-I365 PolarHBondContact O-N 2.86Å; R363-I365 VanDerWaalsContact C-N 3.3Å
366	N	85.7	Confident	83.7	Confident	51 Å²	51	47.8 Å²	47.8	27%	0.273	25%	0.251	S	S	.	.			trans	50.5	60.4	178.4	-170.8	21.7	0	0	0	113.3	L362 R363 F368 G369 S371	L362-N366 PolarHBondContact O-N 3.38Å; R363-N366 PolarHBondContact O-N 2.99Å; N366-F368 PolarHBondContact O-N 3.5Å; N366-G369 VanDerWaalsContact ND2-C 3.33Å; N366-G369 WeakPolarHBondContact ND2-CA 3.35Å; N366-G369 PolarHBondContact ND2-O 2.77Å; N366-G369 PolarHBondContact O-N 3.38Å; N366-G369 VanDerWaalsContact O-N 3.1Å; N366-G369 VanDerWaalsContact OD1-C 3.29Å; N366-G369 WeakPolarHBondContact OD1-CA 3.49Å; N366-G369 PolarHBondContact OD1-N 3.2Å; N366-S371 VanDerWaalsContact OD1-CA 3.31Å; N366-S371 WeakPolarHBondContact OD1-CA 3.23Å; N366-S371 PolarHBondContact OD1-N 2.86Å
367	P	80.8	Confident	82.9	Confident	11 Å²	11	46.3 Å²	46.3	7%	0.071	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-23.4	-170.2	25.8	-36.2	0	0	0	114.8	D146 I147 L362	D146-P367 HydrophobicContact CB-CB 4.22Å; I147-P367 HydrophobicContact CD1-CB 4.25Å; I147-P367 HydrophobicContact CG1-CB 3.7Å; L362-P367 HydrophobicContact CD1-CG 4.02Å
368	F	75.4	Confident	81.9	Confident	19 Å²	19	46.1 Å²	46.1	8%	0.083	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.6	2.1	-178.6	-50.3	-65.8	0	0	0	113.7	D146 H150 N366 N370 L375	D146-F368 HydrophobicContact CB-CZ 4.43Å; H150-F368 AromaticContact CD2-CE1 3.76Å; H150-F368 AromaticContact NE2-CE1 3.57Å; N366-F368 PolarHBondContact O-N 3.5Å; F368-N370 PolarHBondContact O-N 2.95Å; F368-L375 HydrophobicContact CD1-CB 4.37Å; F368-L375 HydrophobicContact CD1-CD1 4.11Å; F368-L375 HydrophobicContact CE1-CB 4.17Å; F368-L375 HydrophobicContact CG-CD1 4.45Å; F368-L375 HydrophobicContact CZ-CB 4.33Å
369	G	71.9	Confident	81	Confident	37 Å²	37	50.2 Å²	50.2	38%	0.381	26%	0.257	S	S	.	.	S	Bend	trans	70.1	-26.2	-174.4	0	0	0	0	0	115.5	N366 S371	N366-G369 VanDerWaalsContact ND2-C 3.33Å; N366-G369 WeakPolarHBondContact ND2-CA 3.35Å; N366-G369 PolarHBondContact ND2-O 2.77Å; N366-G369 PolarHBondContact O-N 3.38Å; N366-G369 VanDerWaalsContact O-N 3.1Å; N366-G369 VanDerWaalsContact OD1-C 3.29Å; N366-G369 WeakPolarHBondContact OD1-CA 3.49Å; N366-G369 PolarHBondContact OD1-N 3.2Å; G369-S371 VanDerWaalsContact C-N 3.3Å; G369-S371 PolarHBondContact O-N 3.4Å
370	N	71.1	Confident	80.1	Confident	69 Å²	69	50.6 Å²	50.6	37%	0.369	26%	0.258	S	S	.	.	S	Bend	trans	-77.3	1.4	-173.1	70.7	9.9	0	0	0	116.1	F368 R372	F368-N370 PolarHBondContact O-N 2.95Å; N370-R372 PolarHBondContact O-N 3.43Å; N370-R372 VanDerWaalsContact O-N 3.12Å; N370-R372 WeakPolarHBondContact OD1-CB 3.49Å; N370-R372 PolarHBondContact OD1-N 2.95Å; N370-R372 PolarHBondContact OD1-O 2.63Å
371	S	74.3	Confident	78.9	Confident	64 Å²	64	52 Å²	52	45%	0.448	27%	0.266	S	S	.	.	S	Bend	trans	63.7	2.2	-176.5	79.8	0	0	0	0	116.8	N366 G369	N366-S371 VanDerWaalsContact OD1-CA 3.31Å; N366-S371 WeakPolarHBondContact OD1-CA 3.23Å; N366-S371 PolarHBondContact OD1-N 2.86Å; G369-S371 VanDerWaalsContact C-N 3.3Å; G369-S371 PolarHBondContact O-N 3.4Å
372	R	77.5	Confident	77.8	Confident	97 Å²	97	52.3 Å²	52.3	37%	0.366	27%	0.27	S	S	.	.	S	Bend	trans	-87	158	171.2	-56.9	-66.2	-175.5	160.4	5.7	109.6	N370 Y377 E379	N370-R372 PolarHBondContact O-N 3.43Å; N370-R372 VanDerWaalsContact O-N 3.12Å; N370-R372 WeakPolarHBondContact OD1-CB 3.49Å; N370-R372 PolarHBondContact OD1-N 2.95Å; N370-R372 PolarHBondContact OD1-O 2.63Å; R372-Y377 HydrophobicContact CG-CD1 4.25Å; R372-Y377 HydrophobicContact CG-CG 4.45Å; R372-Y377 PolarHBondContact NH1-OH 2.93Å; R372-E379 IonicContact CZ-OE1 3.75Å; R372-E379 VanDerWaalsContact CZ-OE1 3.25Å; R372-E379 IonicContact NH1-OE1 2.73Å; R372-E379 PolarHBondContact NH1-OE1 3.06Å; R372-E379 IonicContact NH2-OE1 3.57Å; R372-E379 PolarHBondContact NH2-OE1 2.99Å
373	L	72.3	Confident	77.1	Confident	40 Å²	40	56.1 Å²	56.1	21%	0.209	30%	0.295	C	S	.	.	S	Bend	trans	-78.7	-22.7	-178.4	-71.3	168.9	0	0	0	113.5	G326 A359 L362 R363	G326-L373 VanDerWaalsContact O-CD1 3.26Å; G326-L373 WeakPolarHBondContact O-CD1 3.45Å; A359-L373 HydrophobicContact CB-CD1 4.33Å; A359-L373 VanDerWaalsContact O-CD2 3.28Å; A359-L373 WeakPolarHBondContact O-CD2 3.48Å; L362-L373 HydrophobicContact CB-CD2 4.21Å; L362-L373 HydrophobicContact CD2-CD2 4.31Å; L362-L373 HydrophobicContact CG-CD2 4.32Å; R363-L373 HydrophobicContact CB-CD2 3.76Å
374	V	76.2	Confident	76.9	Confident	11 Å²	11	51.2 Å²	51.2	7%	0.067	28%	0.276	C	S	.	.	S	Bend	trans	-145.2	149.3	-173	-179.5	0	0	0	0	109.8	F325 F376 L601	F325-V374 WeakPolarHBondContact O-CG2 3.45Å; V374-F376 HydrophobicContact CG1-CD1 3.59Å; V374-F376 HydrophobicContact CG1-CD2 3.97Å; V374-F376 HydrophobicContact CG1-CE1 3.33Å; V374-F376 HydrophobicContact CG1-CE2 3.75Å; V374-F376 HydrophobicContact CG1-CG 3.9Å; V374-F376 HydrophobicContact CG1-CZ 3.42Å; V374-F376 VanDerWaalsContact CG1-CZ 3.42Å; V374-F376 PolarHBondContact O-N 3.18Å; V374-L601 HydrophobicContact CB-CD2 4.13Å; V374-L601 HydrophobicContact CG1-CD2 4.19Å; V374-L601 HydrophobicContact CG2-CD2 4.25Å
375	L	65.8	Low	76.6	Confident	27 Å²	27	50.6 Å²	50.6	14%	0.141	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-23.7	-176.1	-171.1	63.1	0	0	0	115.4	F368 A452 E453 S456	F368-L375 HydrophobicContact CD1-CB 4.37Å; F368-L375 HydrophobicContact CD1-CD1 4.11Å; F368-L375 HydrophobicContact CE1-CB 4.17Å; F368-L375 HydrophobicContact CG-CD1 4.45Å; F368-L375 HydrophobicContact CZ-CB 4.33Å; L375-A452 HydrophobicContact CD2-CB 4.22Å; L375-E453 HydrophobicContact CD2-CG 3.99Å; L375-S456 WeakPolarHBondContact O-CB 3.37Å; L375-S456 PolarHBondContact O-OG 2.9Å
376	F	73.8	Confident	76.3	Confident	5 Å²	5	53.8 Å²	53.8	2%	0.022	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	32.2	-175.7	52.2	-97.1	0	0	0	113.2	F325 V374 A452 I455 F459 I529 M532 L601	F325-F376 HydrophobicContact CD1-CZ 4.41Å; V374-F376 HydrophobicContact CG1-CD1 3.59Å; V374-F376 HydrophobicContact CG1-CD2 3.97Å; V374-F376 HydrophobicContact CG1-CE1 3.33Å; V374-F376 HydrophobicContact CG1-CE2 3.75Å; V374-F376 HydrophobicContact CG1-CG 3.9Å; V374-F376 HydrophobicContact CG1-CZ 3.42Å; V374-F376 VanDerWaalsContact CG1-CZ 3.42Å; V374-F376 PolarHBondContact O-N 3.18Å; F376-A452 HydrophobicContact CD1-CB 4.49Å; F376-I455 HydrophobicContact CB-CG2 3.98Å; F376-I455 HydrophobicContact CD1-CG2 4.38Å; F376-I455 HydrophobicContact CD2-CG2 4.23Å; F376-I455 HydrophobicContact CG-CG2 3.96Å; F376-F459 HydrophobicContact CB-CD2 4.3Å; F376-F459 HydrophobicContact CD2-CE2 4.2Å; F376-I529 HydrophobicContact CE1-CD1 3.97Å; F376-I529 HydrophobicContact CZ-CD1 4.29Å; F376-M532 HydrophobicContact CZ-CE 4.41Å; F376-L601 HydrophobicContact CD2-CD1 4.4Å; F376-L601 HydrophobicContact CD2-CD2 4.16Å; F376-L601 HydrophobicContact CE2-CD1 3.75Å; F376-L601 HydrophobicContact CE2-CD2 3.82Å; F376-L601 HydrophobicContact CE2-CG 4.43Å
377	Y	78.4	Confident	76.3	Confident	59 Å²	59	55.9 Å²	55.9	23%	0.231	29%	0.292	C	S	.	.			trans	-76.6	125.1	170.7	178	-81.1	0	0	0	110	R372 E379 L601	R372-Y377 HydrophobicContact CG-CD1 4.25Å; R372-Y377 HydrophobicContact CG-CG 4.45Å; R372-Y377 PolarHBondContact NH1-OH 2.93Å; Y377-E379 HydrophobicContact CE1-CG 3.67Å; Y377-E379 VanDerWaalsContact CE1-OE1 3.24Å; Y377-E379 WeakPolarHBondContact CE1-OE1 3.48Å; Y377-E379 WeakPolarHBondContact OH-CG 3.21Å; Y377-E379 PolarHBondContact OH-OE1 3.49Å; Y377-L601 WeakPolarHBondContact CD2-O 3.47Å; Y377-L601 WeakPolarHBondContact CE2-O 3.44Å
378	V	76.8	Confident	76.6	Confident	15 Å²	15	55.6 Å²	55.6	9%	0.091	29%	0.29	C	S	.	.			trans	-138.6	131.3	-178.1	-175.6	0	0	0	0	110.4	F380 F459 T602	V378-F380 HydrophobicContact CB-CE2 3.78Å; V378-F380 HydrophobicContact CB-CZ 4.1Å; V378-F380 HydrophobicContact CG1-CD2 4.14Å; V378-F380 HydrophobicContact CG1-CE1 4.14Å; V378-F380 HydrophobicContact CG1-CE2 3.51Å; V378-F380 HydrophobicContact CG1-CZ 3.53Å; V378-F459 HydrophobicContact CG2-CB 3.74Å; V378-T602 WeakPolarHBondContact O-CA 3.45Å
379	E	76.2	Confident	77.4	Confident	87 Å²	87	56.7 Å²	56.7	41%	0.407	30%	0.297	S	S	.	.			trans	-99.2	124.6	173.3	-76.6	165.2	-142.8	0	0	109.1	R372 Y377	R372-E379 IonicContact CZ-OE1 3.75Å; R372-E379 VanDerWaalsContact CZ-OE1 3.25Å; R372-E379 IonicContact NH1-OE1 2.73Å; R372-E379 PolarHBondContact NH1-OE1 3.06Å; R372-E379 IonicContact NH2-OE1 3.57Å; R372-E379 PolarHBondContact NH2-OE1 2.99Å; Y377-E379 HydrophobicContact CE1-CG 3.67Å; Y377-E379 VanDerWaalsContact CE1-OE1 3.24Å; Y377-E379 WeakPolarHBondContact CE1-OE1 3.48Å; Y377-E379 WeakPolarHBondContact OH-CG 3.21Å; Y377-E379 PolarHBondContact OH-OE1 3.49Å
380	F	74.9	Confident	78.3	Confident	15 Å²	15	58.1 Å²	58.1	7%	0.066	31%	0.305	C	S	.	.			trans	-104.1	139.7	176.1	-62.7	-92.5	0	0	0	109.6	V378 F459 D461 M577 Y607	V378-F380 HydrophobicContact CB-CE2 3.78Å; V378-F380 HydrophobicContact CB-CZ 4.1Å; V378-F380 HydrophobicContact CG1-CD2 4.14Å; V378-F380 HydrophobicContact CG1-CE1 4.14Å; V378-F380 HydrophobicContact CG1-CE2 3.51Å; V378-F380 HydrophobicContact CG1-CZ 3.53Å; F380-F459 VanDerWaalsContact CZ-O 3.29Å; F380-F459 WeakPolarHBondContact CZ-O 3.5Å; F380-D461 WeakPolarHBondContact CD1-OD2 3.26Å; F380-D461 VanDerWaalsContact CE1-OD2 3.31Å; F380-D461 WeakPolarHBondContact CE1-OD2 3.28Å; F380-M577 HydrophobicContact CD2-CE 3.6Å; F380-M577 HydrophobicContact CD2-SD 4.39Å; F380-M577 HydrophobicContact CE2-CE 3.1Å; F380-M577 HydrophobicContact CE2-SD 3.44Å; F380-M577 WeakPolarHBondContact CE2-SD 3.16Å; F380-M577 HydrophobicContact CZ-CE 3.71Å; F380-M577 HydrophobicContact CZ-CG 4.49Å; F380-M577 HydrophobicContact CZ-SD 3.97Å; F380-Y607 HydrophobicContact CB-CE2 3.75Å; F380-Y607 VanDerWaalsContact CB-OH 3.26Å; F380-Y607 WeakPolarHBondContact CB-OH 3.21Å; F380-Y607 PolarHBondContact O-OH 2.82Å
381	H	67.6	Low	79.4	Confident	170 Å²	170	55.5 Å²	55.5	79%	0.787	29%	0.292	S	S	*	.			trans	-112.7	-6.4	-175.2	-59.4	-42.4	0	0	0	114.1
382	A	72.3	Confident	80.4	Confident	24 Å²	24	52.5 Å²	52.5	20%	0.198	27%	0.271	C	S	.	.	S	Bend	trans	-96.2	132.5	178.4	0	0	0	0	0	111.2	T571 Y607	A382-T571 HydrophobicContact CB-CG2 3.94Å; A382-Y607 PolarHBondContact O-OH 2.93Å
383	P	77.7	Confident	81.3	Confident	80 Å²	80	51 Å²	51	52%	0.519	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-71.2	148.7	173.5	31.3	-34.9	0	0	0	110.6
384	W	84.4	Confident	82.5	Confident	51 Å²	51	53.7 Å²	53.7	19%	0.193	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-92.4	153.7	174.9	70	-83.1	0	0	0	111.2	F392 L574 E606 Y607 V609 P610	W384-F392 HydrophobicContact CE3-CE2 4.38Å; W384-L574 HydrophobicContact CB-CD2 4.01Å; W384-E606 PolarHBondContact NE1-O 2.92Å; W384-Y607 AromaticContact CD1-CD1 3.96Å; W384-V609 HydrophobicContact CH2-CB 4.28Å; W384-V609 HydrophobicContact CH2-CG1 3.88Å; W384-V609 HydrophobicContact CZ2-CB 3.77Å; W384-V609 HydrophobicContact CZ2-CG1 3.88Å; W384-P610 HydrophobicContact CD2-CG 4.06Å; W384-P610 HydrophobicContact CG-CG 4.28Å
385	H	85.1	Confident	83.5	Confident	66 Å²	66	53.4 Å²	53.4	31%	0.306	28%	0.281	S	S	.	.			trans	-111.3	149.3	-177.2	-66.9	-94.1	0	0	0	113.3	L387 E388 W562	H385-L387 PolarHBondContact O-N 3.23Å; H385-E388 HydrophobicContact CB-CG 4.5Å; H385-E388 PolarHBondContact N-OE1 3.09Å; H385-E388 VanDerWaalsContact O-CB 3.27Å; H385-E388 WeakPolarHBondContact O-CB 3.33Å; H385-E388 PolarHBondContact O-N 3.49Å; H385-W562 HydrophobicContact CB-CD2 4.2Å; H385-W562 HydrophobicContact CB-CE3 3.56Å; H385-W562 HydrophobicContact CB-CH2 3.9Å; H385-W562 HydrophobicContact CB-CZ3 3.39Å; H385-W562 AromaticContact CD2-CE3 3.29Å; H385-W562 AromaticContact CD2-CZ3 3.55Å; H385-W562 AromaticContact CE1-CE3 3.96Å; H385-W562 AromaticContact CG-CD2 3.98Å; H385-W562 AromaticContact CG-CE3 3.22Å; H385-W562 AromaticContact CG-CZ3 3.52Å; H385-W562 AromaticContact ND1-CE3 3.67Å; H385-W562 AromaticContact NE2-CE3 3.76Å
386	L	85.1	Confident	85	Confident	132 Å²	132	52.1 Å²	52.1	69%	0.691	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-55.8	-29.7	-173.5	-173.5	64.8	0	0	0	114.4	E388 L389	L386-E388 VanDerWaalsContact C-N 3.29Å; L386-E388 PolarHBondContact O-N 2.97Å; L386-L389 HydrophobicContact CD1-CD2 4.22Å; L386-L389 WeakPolarHBondContact O-CB 3.21Å; L386-L389 PolarHBondContact O-N 3.35Å
387	L	85	Confident	86.1	Confident	94 Å²	94	55.3 Å²	55.3	49%	0.492	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-71.3	-24	178.7	-71.5	168.9	0	0	0	113	H385 L389 A390 I558 W562	H385-L387 PolarHBondContact O-N 3.23Å; L387-L389 PolarHBondContact O-N 3.33Å; L387-A390 PolarHBondContact O-N 2.95Å; L387-I558 HydrophobicContact CD1-CG2 4.17Å; L387-I558 WeakPolarHBondContact CD1-O 3.42Å; L387-W562 HydrophobicContact CB-CH2 4.3Å; L387-W562 HydrophobicContact CB-CZ2 3.84Å; L387-W562 HydrophobicContact CD1-CZ2 3.77Å; L387-W562 HydrophobicContact CG-CZ2 4.4Å
388	E	87.6	Confident	87	Confident	5 Å²	5	55.9 Å²	55.9	2%	0.023	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-69.8	-15.5	173.1	-56.6	-173.3	-98.2	0	0	112.6	H385 L386 A390 P391 F392 W562 Y575	H385-E388 HydrophobicContact CB-CG 4.5Å; H385-E388 PolarHBondContact N-OE1 3.09Å; H385-E388 VanDerWaalsContact O-CB 3.27Å; H385-E388 WeakPolarHBondContact O-CB 3.33Å; H385-E388 PolarHBondContact O-N 3.49Å; L386-E388 VanDerWaalsContact C-N 3.29Å; L386-E388 PolarHBondContact O-N 2.97Å; E388-A390 PolarHBondContact O-N 2.94Å; E388-P391 WeakPolarHBondContact O-CD 3.37Å; E388-P391 WeakPolarHBondContact O-CG 3.39Å; E388-F392 HydrophobicContact CB-CD2 4.19Å; E388-F392 HydrophobicContact CB-CE2 3.61Å; E388-F392 HydrophobicContact CB-CZ 3.98Å; E388-F392 WeakPolarHBondContact O-CD2 3.26Å; E388-F392 WeakPolarHBondContact O-CG 3.27Å; E388-F392 PolarHBondContact O-N 3.32Å; E388-W562 HydrophobicContact CG-CH2 4.06Å; E388-W562 HydrophobicContact CG-CZ3 4.33Å; E388-Y575 WeakPolarHBondContact CB-OH 3.1Å; E388-Y575 WeakPolarHBondContact CG-OH 3.38Å; E388-Y575 WeakPolarHBondContact OE2-CE2 3.47Å; E388-Y575 PolarHBondContact OE2-OH 2.88Å
389	L	90.8	Very high	88	Confident	42 Å²	42	55.1 Å²	55.1	22%	0.22	29%	0.291	C	S	.	.	H	α-helix	trans	-58.2	-30.7	172.3	-167	63.7	0	0	0	112.2	L386 L387 F392 I393 A613	L386-L389 HydrophobicContact CD1-CD2 4.22Å; L386-L389 WeakPolarHBondContact O-CB 3.21Å; L386-L389 PolarHBondContact O-N 3.35Å; L387-L389 PolarHBondContact O-N 3.33Å; L389-F392 PolarHBondContact O-N 3.18Å; L389-I393 HydrophobicContact CG-CD1 4.02Å; L389-I393 HydrophobicContact CG-CG1 4.48Å; L389-I393 WeakPolarHBondContact O-CB 3.36Å; L389-I393 WeakPolarHBondContact O-CD1 3.35Å; L389-I393 VanDerWaalsContact O-CG1 3.22Å; L389-I393 WeakPolarHBondContact O-CG1 3.3Å; L389-I393 PolarHBondContact O-N 3.48Å; L389-A613 HydrophobicContact CD1-CB 3.63Å
390	A	92.6	Very high	89	Confident	67 Å²	67	51 Å²	51	55%	0.554	27%	0.271	S	S	*	.	H	α-helix	trans	-64.9	-54	177.8	0	0	0	0	0	113.2	L387 E388 F392 I393 L394	L387-A390 PolarHBondContact O-N 2.95Å; E388-A390 PolarHBondContact O-N 2.94Å; A390-F392 VanDerWaalsContact C-N 3.33Å; A390-F392 PolarHBondContact O-N 3.06Å; A390-I393 PolarHBondContact O-N 3.3Å; A390-L394 PolarHBondContact O-N 3.48Å
391	P	93.4	Very high	90	Very high	15 Å²	15	54.2 Å²	54.2	10%	0.097	29%	0.289	C	S	.	.	H	α-helix	trans	-66.3	-29.6	172.9	24.9	-34.2	0	0	0	113.5	E388 L394 L395 L542 M546 Y575	E388-P391 WeakPolarHBondContact O-CD 3.37Å; E388-P391 WeakPolarHBondContact O-CG 3.39Å; P391-L394 WeakPolarHBondContact O-CB 3.33Å; P391-L394 PolarHBondContact O-N 3.07Å; P391-L395 PolarHBondContact O-N 2.88Å; P391-L542 HydrophobicContact CB-CD2 3.87Å; P391-M546 HydrophobicContact CB-CG 4.38Å; P391-M546 HydrophobicContact CB-SD 4.38Å; P391-M546 HydrophobicContact CG-CE 4.16Å; P391-M546 HydrophobicContact CG-SD 4.4Å; P391-Y575 HydrophobicContact CB-CE1 3.94Å; P391-Y575 HydrophobicContact CG-CE1 3.85Å
392	F	95.6	Very high	91.3	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-40.4	171.2	-62.8	-35.4	0	0	0	112.6	W384 E388 L389 A390 L394 L395 G396 L574 Y575 V578 P610 A614	W384-F392 HydrophobicContact CE3-CE2 4.38Å; E388-F392 HydrophobicContact CB-CD2 4.19Å; E388-F392 HydrophobicContact CB-CE2 3.61Å; E388-F392 HydrophobicContact CB-CZ 3.98Å; E388-F392 WeakPolarHBondContact O-CD2 3.26Å; E388-F392 WeakPolarHBondContact O-CG 3.27Å; E388-F392 PolarHBondContact O-N 3.32Å; L389-F392 PolarHBondContact O-N 3.18Å; A390-F392 VanDerWaalsContact C-N 3.33Å; A390-F392 PolarHBondContact O-N 3.06Å; F392-L394 VanDerWaalsContact C-N 3.31Å; F392-L394 PolarHBondContact O-N 3.48Å; F392-L395 PolarHBondContact O-N 2.86Å; F392-G396 PolarHBondContact O-N 3.34Å; F392-L574 HydrophobicContact CZ-CD2 3.98Å; F392-L574 HydrophobicContact CZ-CG 4.17Å; F392-Y575 HydrophobicContact CD1-CD1 4.21Å; F392-Y575 HydrophobicContact CD1-CE1 4.17Å; F392-Y575 AromaticContact CE1-CD1 3.84Å; F392-Y575 HydrophobicContact CE1-CD1 3.84Å; F392-Y575 AromaticContact CE1-CD2 3.77Å; F392-Y575 HydrophobicContact CE1-CD2 3.77Å; F392-Y575 AromaticContact CE1-CE1 3.78Å; F392-Y575 HydrophobicContact CE1-CE1 3.78Å; F392-Y575 AromaticContact CE1-CE2 3.67Å; F392-Y575 HydrophobicContact CE1-CE2 3.67Å; F392-Y575 AromaticContact CE1-CG 3.83Å; F392-Y575 HydrophobicContact CE1-CG 3.83Å; F392-Y575 AromaticContact CE1-CZ 3.67Å; F392-Y575 HydrophobicContact CZ-CD2 4.29Å; F392-Y575 AromaticContact CZ-CE2 3.86Å; F392-Y575 HydrophobicContact CZ-CE2 3.86Å; F392-Y575 AromaticContact CZ-CZ 3.97Å; F392-V578 HydrophobicContact CB-CG1 3.99Å; F392-V578 HydrophobicContact CD1-CB 4.01Å; F392-V578 HydrophobicContact CD1-CG1 3.74Å; F392-V578 HydrophobicContact CD1-CG2 4.01Å; F392-V578 HydrophobicContact CE1-CB 4.37Å; F392-V578 HydrophobicContact CE1-CG2 4.08Å; F392-V578 HydrophobicContact CG-CG1 4.07Å; F392-P610 HydrophobicContact CD2-CB 3.29Å; F392-P610 HydrophobicContact CD2-CG 4.41Å; F392-P610 HydrophobicContact CE2-CB 3.57Å; F392-P610 HydrophobicContact CE2-CG 4.24Å; F392-P610 HydrophobicContact CG-CB 4.02Å; F392-P610 HydrophobicContact CZ-CB 4.47Å; F392-A614 WeakPolarHBondContact O-CB 3.43Å
393	I	96.4	Very high	92.5	Very high	65 Å²	65	45.5 Å²	45.5	33%	0.333	24%	0.244	S	C	.	.	H	α-helix	trans	-63.1	-38	171.6	-73.2	166.9	0	0	0	110.7	L389 A390 G396 I397 T617	L389-I393 HydrophobicContact CG-CD1 4.02Å; L389-I393 HydrophobicContact CG-CG1 4.48Å; L389-I393 WeakPolarHBondContact O-CB 3.36Å; L389-I393 WeakPolarHBondContact O-CD1 3.35Å; L389-I393 VanDerWaalsContact O-CG1 3.22Å; L389-I393 WeakPolarHBondContact O-CG1 3.3Å; L389-I393 PolarHBondContact O-N 3.48Å; A390-I393 PolarHBondContact O-N 3.3Å; I393-G396 CarbonylContact O-C 3.45Å; I393-G396 VanDerWaalsContact O-CA 3.32Å; I393-G396 WeakPolarHBondContact O-CA 3.05Å; I393-G396 PolarHBondContact O-N 2.9Å; I393-G396 VanDerWaalsContact O-N 3.1Å; I393-I397 HydrophobicContact CG2-CD1 4.27Å; I393-I397 WeakPolarHBondContact O-CG1 3.27Å; I393-I397 PolarHBondContact O-N 2.69Å; I393-T617 HydrophobicContact CG2-CG2 4.09Å
394	L	96.6	Very high	93.3	Very high	98 Å²	98	42 Å²	42	51%	0.513	22%	0.221	S	C	.	.	H	α-helix	trans	-64.5	-39.7	175.5	-174.6	145.3	0	0	0	112.4	A390 P391 F392 G396 I397 F398 L542	A390-L394 PolarHBondContact O-N 3.48Å; P391-L394 WeakPolarHBondContact O-CB 3.33Å; P391-L394 PolarHBondContact O-N 3.07Å; F392-L394 VanDerWaalsContact C-N 3.31Å; F392-L394 PolarHBondContact O-N 3.48Å; L394-G396 VanDerWaalsContact C-N 3.29Å; L394-G396 PolarHBondContact O-N 2.96Å; L394-I397 PolarHBondContact O-N 2.93Å; L394-F398 PolarHBondContact O-N 3.35Å; L394-L542 HydrophobicContact CD2-CD2 4.04Å
395	L	96.8	Very high	93.8	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-62.6	-37.3	169.2	-68.8	174.4	0	0	0	111.8	P391 F392 F398 G399 L542 Y575 V578 A582	P391-L395 PolarHBondContact O-N 2.88Å; F392-L395 PolarHBondContact O-N 2.86Å; L395-F398 PolarHBondContact O-N 2.91Å; L395-G399 PolarHBondContact O-N 3.24Å; L395-L542 HydrophobicContact CD1-CD2 4.06Å; L395-L542 HydrophobicContact CD2-CB 4.17Å; L395-L542 HydrophobicContact CD2-CD2 3.66Å; L395-L542 HydrophobicContact CG-CD2 3.56Å; L395-Y575 HydrophobicContact CD1-CD1 4.3Å; L395-Y575 WeakPolarHBondContact CD1-O 3.39Å; L395-V578 HydrophobicContact CD1-CB 4.48Å; L395-V578 HydrophobicContact CD1-CG1 4.32Å; L395-A582 WeakPolarHBondContact O-CB 3.42Å
396	G	97.5	Very high	94.3	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-54.4	-54.8	169.1	0	0	0	0	0	112.3	F392 I393 L394 F398 G399 G400 A614 S618	F392-G396 PolarHBondContact O-N 3.34Å; I393-G396 CarbonylContact O-C 3.45Å; I393-G396 VanDerWaalsContact O-CA 3.32Å; I393-G396 WeakPolarHBondContact O-CA 3.05Å; I393-G396 PolarHBondContact O-N 2.9Å; I393-G396 VanDerWaalsContact O-N 3.1Å; L394-G396 VanDerWaalsContact C-N 3.29Å; L394-G396 PolarHBondContact O-N 2.96Å; G396-F398 VanDerWaalsContact C-N 3.34Å; G396-F398 PolarHBondContact O-N 2.92Å; G396-G399 PolarHBondContact O-N 3.45Å; G396-G400 PolarHBondContact O-N 3.4Å; G396-A614 VanDerWaalsContact CA-O 3.27Å; G396-A614 WeakPolarHBondContact CA-O 3.37Å; G396-S618 WeakPolarHBondContact O-CA 3.33Å; G396-S618 VanDerWaalsContact O-CB 3.25Å; G396-S618 WeakPolarHBondContact O-CB 3.45Å
397	I	98.1	Very high	94.8	Very high	73 Å²	73	35.8 Å²	35.8	37%	0.374	19%	0.194	S	C	.	.	H	α-helix	trans	-58.7	-45.1	178.7	-63.7	165.7	0	0	0	111.1	I393 L394 G400 L401 T617 V621	I393-I397 HydrophobicContact CG2-CD1 4.27Å; I393-I397 WeakPolarHBondContact O-CG1 3.27Å; I393-I397 PolarHBondContact O-N 2.69Å; L394-I397 PolarHBondContact O-N 2.93Å; I397-G400 PolarHBondContact O-N 2.88Å; I397-L401 HydrophobicContact CG2-CD1 3.91Å; I397-L401 HydrophobicContact CG2-CG 4.43Å; I397-L401 WeakPolarHBondContact O-CB 3.28Å; I397-L401 WeakPolarHBondContact O-CG 3.43Å; I397-L401 PolarHBondContact O-N 2.94Å; I397-T617 HydrophobicContact CG1-CG2 3.75Å; I397-V621 HydrophobicContact CG1-CG2 4.19Å
398	F	97.1	Very high	95.2	Very high	70 Å²	70	36.7 Å²	36.7	31%	0.307	19%	0.194	S	C	.	.	H	α-helix	trans	-59.3	-48	175.8	174.6	-97.2	0	0	0	111.9	L394 L395 G396 G400 L401 W402 A538	L394-F398 PolarHBondContact O-N 3.35Å; L395-F398 PolarHBondContact O-N 2.91Å; G396-F398 VanDerWaalsContact C-N 3.34Å; G396-F398 PolarHBondContact O-N 2.92Å; F398-G400 VanDerWaalsContact C-N 3.3Å; F398-G400 PolarHBondContact O-N 3.47Å; F398-L401 PolarHBondContact O-N 3.32Å; F398-W402 VanDerWaalsContact O-CB 3.28Å; F398-W402 WeakPolarHBondContact O-CB 3.03Å; F398-W402 PolarHBondContact O-N 3.23Å; F398-A538 HydrophobicContact CD1-CB 3.89Å; F398-A538 HydrophobicContact CE1-CB 3.39Å; F398-A538 HydrophobicContact CZ-CB 3.95Å
399	G	96.7	Very high	95.6	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.3	-37	178.5	0	0	0	0	0	113.3	L395 G396 G403 S618	L395-G399 PolarHBondContact O-N 3.24Å; G396-G399 PolarHBondContact O-N 3.45Å; G399-G403 PolarHBondContact O-N 3.46Å; G399-S618 VanDerWaalsContact C-OG 3.24Å
400	G	96.8	Very high	95.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-71.1	-44.7	177.5	0	0	0	0	0	112.9	G396 I397 F398 G403 A404 S618 A622	G396-G400 PolarHBondContact O-N 3.4Å; I397-G400 PolarHBondContact O-N 2.88Å; F398-G400 VanDerWaalsContact C-N 3.3Å; F398-G400 PolarHBondContact O-N 3.47Å; G400-G403 PolarHBondContact O-N 3.49Å; G400-A404 WeakPolarHBondContact O-CB 3.22Å; G400-A404 PolarHBondContact O-N 3.01Å; G400-S618 WeakPolarHBondContact CA-O 3.41Å; G400-S618 WeakPolarHBondContact CA-OG 3.2Å; G400-S618 PolarHBondContact N-OG 3.06Å; G400-A622 WeakPolarHBondContact O-CB 3.35Å
401	L	96.8	Very high	95.7	Very high	83 Å²	83	34.6 Å²	34.6	44%	0.435	18%	0.179	S	C	.	.	H	α-helix	trans	-61.6	-44.9	174.1	-72.8	170.7	0	0	0	111.5	I397 F398 L405 V621 F625	I397-L401 HydrophobicContact CG2-CD1 3.91Å; I397-L401 HydrophobicContact CG2-CG 4.43Å; I397-L401 WeakPolarHBondContact O-CB 3.28Å; I397-L401 WeakPolarHBondContact O-CG 3.43Å; I397-L401 PolarHBondContact O-N 2.94Å; F398-L401 PolarHBondContact O-N 3.32Å; L401-L405 WeakPolarHBondContact O-CB 3.46Å; L401-L405 PolarHBondContact O-N 2.92Å; L401-V621 HydrophobicContact CD2-CG1 4.21Å; L401-V621 HydrophobicContact CG-CG1 3.96Å; L401-F625 HydrophobicContact CD2-CD2 4.35Å; L401-F625 HydrophobicContact CD2-CE2 3.46Å; L401-F625 VanDerWaalsContact CD2-CE2 3.46Å; L401-F625 HydrophobicContact CD2-CZ 3.84Å
402	W	95.7	Very high	95.7	Very high	11 Å²	11	36.6 Å²	36.6	4%	0.042	20%	0.196	C	C	.	.	H	α-helix	trans	-60.2	-49.1	174.6	167.9	-124.6	0	0	0	111.5	F398 A404 L405 F406 I512 V516 V534	F398-W402 VanDerWaalsContact O-CB 3.28Å; F398-W402 WeakPolarHBondContact O-CB 3.03Å; F398-W402 PolarHBondContact O-N 3.23Å; W402-A404 PolarHBondContact O-N 3.35Å; W402-L405 PolarHBondContact O-N 3.44Å; W402-F406 HydrophobicContact CD2-CB 4.36Å; W402-F406 HydrophobicContact CE3-CB 4.34Å; W402-F406 HydrophobicContact CH2-CB 4.03Å; W402-F406 AromaticContact CH2-CD2 3.79Å; W402-F406 HydrophobicContact CH2-CD2 3.79Å; W402-F406 HydrophobicContact CH2-CG 4.36Å; W402-F406 HydrophobicContact CZ2-CB 4.05Å; W402-F406 AromaticContact CZ2-CD2 3.77Å; W402-F406 HydrophobicContact CZ2-CD2 3.77Å; W402-F406 HydrophobicContact CZ2-CG 4.21Å; W402-F406 HydrophobicContact CZ3-CB 4.16Å; W402-F406 VanDerWaalsContact O-CB 3.24Å; W402-F406 WeakPolarHBondContact O-CB 3.48Å; W402-F406 PolarHBondContact O-N 3.42Å; W402-I512 HydrophobicContact CD2-CG1 4.42Å; W402-I512 HydrophobicContact CE3-CG1 4.16Å; W402-I512 HydrophobicContact CE3-CG2 4.35Å; W402-I512 HydrophobicContact CH2-CB 4.01Å; W402-I512 HydrophobicContact CH2-CG1 3.94Å; W402-I512 HydrophobicContact CH2-CG2 3.87Å; W402-I512 WeakPolarHBondContact CH2-O 3.32Å; W402-I512 HydrophobicContact CZ2-CG1 4.18Å; W402-I512 HydrophobicContact CZ3-CB 4.11Å; W402-I512 HydrophobicContact CZ3-CG1 3.94Å; W402-I512 HydrophobicContact CZ3-CG2 3.57Å; W402-V516 HydrophobicContact CH2-CG2 4.02Å; W402-V534 HydrophobicContact CD2-CG1 4.33Å; W402-V534 HydrophobicContact CG-CG1 4.37Å; W402-V534 HydrophobicContact CZ2-CG1 4.4Å; W402-V534 HydrophobicContact CZ2-CG2 4.41Å
403	G	95.8	Very high	95.5	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-57.9	-47	178.9	0	0	0	0	0	113	G399 G400 F406 I407	G399-G403 PolarHBondContact O-N 3.46Å; G400-G403 PolarHBondContact O-N 3.49Å; G403-F406 PolarHBondContact O-N 2.85Å; G403-I407 WeakPolarHBondContact O-CB 3.34Å; G403-I407 WeakPolarHBondContact O-CD1 3.4Å; G403-I407 WeakPolarHBondContact O-CG1 3.29Å; G403-I407 PolarHBondContact O-N 3.42Å
404	A	95.6	Very high	95.2	Very high	6 Å²	6	38.2 Å²	38.2	5%	0.05	20%	0.2	C	C	.	.	H	α-helix	trans	-63.5	-41.8	176.9	0	0	0	0	0	113.2	G400 W402 K408 F625	G400-A404 WeakPolarHBondContact O-CB 3.22Å; G400-A404 PolarHBondContact O-N 3.01Å; W402-A404 PolarHBondContact O-N 3.35Å; A404-K408 WeakPolarHBondContact O-CG 3.48Å; A404-K408 PolarHBondContact O-N 3.28Å; A404-F625 HydrophobicContact CB-CB 3.59Å; A404-F625 HydrophobicContact CB-CD2 4.11Å; A404-F625 HydrophobicContact CB-CG 4.09Å
405	L	95.1	Very high	94.9	Very high	109 Å²	109	40.9 Å²	40.9	57%	0.571	20%	0.203	S	C	*	.	H	α-helix	trans	-64.4	-48.5	175.7	177.7	62.8	0	0	0	111.1	L401 W402 I407 K408 A409	L401-L405 WeakPolarHBondContact O-CB 3.46Å; L401-L405 PolarHBondContact O-N 2.92Å; W402-L405 PolarHBondContact O-N 3.44Å; L405-I407 PolarHBondContact O-N 3.47Å; L405-K408 PolarHBondContact O-N 3.24Å; L405-A409 VanDerWaalsContact O-CB 3.27Å; L405-A409 WeakPolarHBondContact O-CB 3.15Å; L405-A409 PolarHBondContact O-N 3.27Å
406	F	95.9	Very high	94.5	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-56.6	-50.6	179	173.6	-93.6	0	0	0	111.4	W402 G403 K408 A409 N410 T515 V516 F519 L527 V587 I630	W402-F406 HydrophobicContact CD2-CB 4.36Å; W402-F406 HydrophobicContact CE3-CB 4.34Å; W402-F406 HydrophobicContact CH2-CB 4.03Å; W402-F406 AromaticContact CH2-CD2 3.79Å; W402-F406 HydrophobicContact CH2-CD2 3.79Å; W402-F406 HydrophobicContact CH2-CG 4.36Å; W402-F406 HydrophobicContact CZ2-CB 4.05Å; W402-F406 AromaticContact CZ2-CD2 3.77Å; W402-F406 HydrophobicContact CZ2-CD2 3.77Å; W402-F406 HydrophobicContact CZ2-CG 4.21Å; W402-F406 HydrophobicContact CZ3-CB 4.16Å; W402-F406 VanDerWaalsContact O-CB 3.24Å; W402-F406 WeakPolarHBondContact O-CB 3.48Å; W402-F406 PolarHBondContact O-N 3.42Å; G403-F406 PolarHBondContact O-N 2.85Å; F406-K408 PolarHBondContact O-N 3.2Å; F406-A409 PolarHBondContact O-N 3.46Å; F406-N410 HydrophobicContact CE1-CB 4.37Å; F406-N410 HydrophobicContact CE2-CB 4.46Å; F406-N410 HydrophobicContact CZ-CB 4.19Å; F406-N410 WeakPolarHBondContact O-CB 3.33Å; F406-N410 PolarHBondContact O-N 3.47Å; F406-T515 HydrophobicContact CE2-CG2 3.83Å; F406-T515 HydrophobicContact CZ-CG2 4.44Å; F406-V516 HydrophobicContact CD2-CG2 3.59Å; F406-V516 HydrophobicContact CE2-CG2 4Å; F406-F519 HydrophobicContact CZ-CB 4.21Å; F406-F519 HydrophobicContact CZ-CD1 4.19Å; F406-F519 HydrophobicContact CZ-CG 4.44Å; F406-L527 HydrophobicContact CE1-CD1 4.02Å; F406-L527 HydrophobicContact CE1-CD2 3.71Å; F406-L527 HydrophobicContact CE1-CG 4.48Å; F406-L527 HydrophobicContact CE2-CD1 4.28Å; F406-L527 HydrophobicContact CZ-CD1 3.57Å; F406-L527 HydrophobicContact CZ-CD2 4.04Å; F406-L527 HydrophobicContact CZ-CG 4.46Å; F406-V587 HydrophobicContact CD1-CG1 3.9Å; F406-V587 HydrophobicContact CD1-CG2 4.13Å; F406-V587 HydrophobicContact CE1-CG1 4.01Å; F406-V587 HydrophobicContact CG-CG2 4.44Å; F406-I630 HydrophobicContact CD1-CD1 4.41Å; F406-I630 HydrophobicContact CE1-CD1 3.81Å; F406-I630 HydrophobicContact CE1-CG1 4.07Å
407	I	94.8	Very high	94	Very high	10 Å²	10	46.4 Å²	46.4	5%	0.051	23%	0.229	C	C	.	.	H	α-helix	trans	-58.2	-51.4	-179.9	-68.9	164.8	0	0	0	110.1	G403 L405 N410 I411 I630 A633	G403-I407 WeakPolarHBondContact O-CB 3.34Å; G403-I407 WeakPolarHBondContact O-CD1 3.4Å; G403-I407 WeakPolarHBondContact O-CG1 3.29Å; G403-I407 PolarHBondContact O-N 3.42Å; L405-I407 PolarHBondContact O-N 3.47Å; I407-N410 PolarHBondContact O-N 3.37Å; I407-I411 HydrophobicContact CG2-CD1 3.58Å; I407-I411 HydrophobicContact CG2-CG1 4.46Å; I407-I411 VanDerWaalsContact O-CD1 3.29Å; I407-I411 WeakPolarHBondContact O-CD1 3.49Å; I407-I411 WeakPolarHBondContact O-CG1 3.4Å; I407-I411 PolarHBondContact O-N 3.23Å; I407-I630 HydrophobicContact CG1-CB 4.15Å; I407-I630 HydrophobicContact CG1-CD1 4.22Å; I407-A633 HydrophobicContact CG2-CB 4.4Å
408	K	93.9	Very high	93.3	Very high	113 Å²	113	48.6 Å²	48.6	49%	0.491	24%	0.236	S	C	.	.	H	α-helix	trans	-62.9	-46.4	-179	-72	177.3	-178.2	175.9	0	112.4	A404 L405 F406 A412 F625	A404-K408 WeakPolarHBondContact O-CG 3.48Å; A404-K408 PolarHBondContact O-N 3.28Å; L405-K408 PolarHBondContact O-N 3.24Å; F406-K408 PolarHBondContact O-N 3.2Å; K408-A412 WeakPolarHBondContact O-CB 3.48Å; K408-A412 PolarHBondContact O-N 3.32Å; K408-F625 WeakPolarHBondContact CE-O 3.12Å; K408-F625 PolarHBondContact NZ-O 2.98Å
409	A	94.8	Very high	92.7	Very high	36 Å²	36	50.5 Å²	50.5	30%	0.298	25%	0.253	S	S	.	.	H	α-helix	trans	-65.2	-44.8	179.8	0	0	0	0	0	111.9	L405 F406 A412 W413 V516	L405-A409 VanDerWaalsContact O-CB 3.27Å; L405-A409 WeakPolarHBondContact O-CB 3.15Å; L405-A409 PolarHBondContact O-N 3.27Å; F406-A409 PolarHBondContact O-N 3.46Å; A409-A412 PolarHBondContact O-N 3.4Å; A409-W413 WeakPolarHBondContact O-CB 3.28Å; A409-W413 PolarHBondContact O-N 2.95Å; A409-V516 HydrophobicContact CB-CG1 3.76Å; A409-V516 HydrophobicContact CB-CG2 4.44Å
410	N	94.7	Very high	92.2	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.2	-40.4	178.9	176.9	78.7	0	0	0	112.3	F406 I407 W413 C414 V516 F519 H634	F406-N410 HydrophobicContact CE1-CB 4.37Å; F406-N410 HydrophobicContact CE2-CB 4.46Å; F406-N410 HydrophobicContact CZ-CB 4.19Å; F406-N410 WeakPolarHBondContact O-CB 3.33Å; F406-N410 PolarHBondContact O-N 3.47Å; I407-N410 PolarHBondContact O-N 3.37Å; N410-W413 PolarHBondContact O-N 2.76Å; N410-C414 WeakPolarHBondContact O-CB 3.32Å; N410-C414 PolarHBondContact O-N 3.35Å; N410-C414 PolarHBondContact O-SG 2.89Å; N410-V516 HydrophobicContact CB-CG1 4.49Å; N410-V516 PolarHBondContact OD1-O 3.07Å; N410-F519 PolarHBondContact OD1-O 3.33Å; N410-H634 PolarHBondContact ND2-NE2 2.95Å
411	I	92.3	Very high	91.3	Very high	34 Å²	34	62.8 Å²	62.8	17%	0.174	31%	0.305	C	S	.	.	H	α-helix	trans	-63.7	-44.2	174.7	-63.7	158.5	0	0	0	110.4	I407 W413 C414 R415 A633	I407-I411 HydrophobicContact CG2-CD1 3.58Å; I407-I411 HydrophobicContact CG2-CG1 4.46Å; I407-I411 VanDerWaalsContact O-CD1 3.29Å; I407-I411 WeakPolarHBondContact O-CD1 3.49Å; I407-I411 WeakPolarHBondContact O-CG1 3.4Å; I407-I411 PolarHBondContact O-N 3.23Å; I411-W413 VanDerWaalsContact C-N 3.34Å; I411-W413 PolarHBondContact O-N 2.99Å; I411-C414 PolarHBondContact O-N 3.11Å; I411-R415 VanDerWaalsContact O-CB 3.28Å; I411-R415 WeakPolarHBondContact O-CB 3.46Å; I411-R415 PolarHBondContact O-N 3.15Å; I411-A633 HydrophobicContact CD1-CB 3.52Å; I411-A633 HydrophobicContact CG1-CB 3.93Å
412	A	92.4	Very high	90.3	Very high	56 Å²	56	62.8 Å²	62.8	46%	0.463	31%	0.305	S	S	.	.	H	α-helix	trans	-60.4	-44.2	177.6	0	0	0	0	0	111.4	K408 A409 R415 M416	K408-A412 WeakPolarHBondContact O-CB 3.48Å; K408-A412 PolarHBondContact O-N 3.32Å; A409-A412 PolarHBondContact O-N 3.4Å; A412-R415 PolarHBondContact O-N 3.34Å; A412-M416 WeakPolarHBondContact O-CB 3.37Å; A412-M416 PolarHBondContact O-N 3.27Å
413	W	92.3	Very high	89.1	Confident	92 Å²	92	63.3 Å²	63.3	35%	0.348	31%	0.313	S	S	.	.	H	α-helix	trans	-63.6	-47	175.4	-172.3	-111.7	0	0	0	112.6	A409 N410 I411 R415 M416 R417 I517	A409-W413 WeakPolarHBondContact O-CB 3.28Å; A409-W413 PolarHBondContact O-N 2.95Å; N410-W413 PolarHBondContact O-N 2.76Å; I411-W413 VanDerWaalsContact C-N 3.34Å; I411-W413 PolarHBondContact O-N 2.99Å; W413-R415 VanDerWaalsContact C-N 3.33Å; W413-R415 PolarHBondContact O-N 3.02Å; W413-M416 WeakPolarHBondContact O-CB 3.3Å; W413-M416 PolarHBondContact O-N 2.85Å; W413-R417 VanDerWaalsContact NE1-NH2 3.11Å; W413-R417 PolarHBondContact O-N 3.35Å; W413-I517 HydrophobicContact CZ2-CG2 4.21Å
414	C	90.4	Very high	88.5	Confident	8 Å²	8	69.8 Å²	69.8	5%	0.054	34%	0.343	C	S	.	.	H	α-helix	trans	-67.1	-31.7	177.4	-66.7	0	0	0	0	112.7	N410 I411 R417 K418 L637	N410-C414 WeakPolarHBondContact O-CB 3.32Å; N410-C414 PolarHBondContact O-N 3.35Å; N410-C414 PolarHBondContact O-SG 2.89Å; I411-C414 PolarHBondContact O-N 3.11Å; C414-R417 WeakPolarHBondContact O-CB 3.44Å; C414-R417 PolarHBondContact O-N 3.38Å; C414-K418 PolarHBondContact O-N 2.88Å; C414-L637 HydrophobicContact CB-CD2 3.45Å; C414-L637 VanDerWaalsContact CB-CD2 3.45Å
415	R	89.4	Confident	88.2	Confident	154 Å²	154	76.6 Å²	76.6	58%	0.581	37%	0.369	S	S	*	.	H	α-helix	trans	-66	-44.9	170.2	-172.5	-179.4	-66	169.8	-0.7	110.7	I411 A412 W413 R417 K418 T419 L637	I411-R415 VanDerWaalsContact O-CB 3.28Å; I411-R415 WeakPolarHBondContact O-CB 3.46Å; I411-R415 PolarHBondContact O-N 3.15Å; A412-R415 PolarHBondContact O-N 3.34Å; W413-R415 VanDerWaalsContact C-N 3.33Å; W413-R415 PolarHBondContact O-N 3.02Å; R415-R417 VanDerWaalsContact C-N 3.31Å; R415-R417 PolarHBondContact O-N 2.89Å; R415-K418 PolarHBondContact O-N 3.28Å; R415-T419 PolarHBondContact O-N 3.49Å; R415-T419 PolarHBondContact O-OG1 3.11Å; R415-L637 HydrophobicContact CB-CD1 4.31Å
416	M	88.6	Confident	87.8	Confident	101 Å²	101	71.6 Å²	71.6	50%	0.498	34%	0.343	S	S	.	.	H	α-helix	trans	-57.9	-41.4	174.5	-163.9	70.3	73.8	0	0	111.8	A412 W413 K418 T419 T420	A412-M416 WeakPolarHBondContact O-CB 3.37Å; A412-M416 PolarHBondContact O-N 3.27Å; W413-M416 WeakPolarHBondContact O-CB 3.3Å; W413-M416 PolarHBondContact O-N 2.85Å; M416-K418 VanDerWaalsContact C-N 3.3Å; M416-K418 PolarHBondContact O-N 2.89Å; M416-T419 PolarHBondContact O-N 2.89Å; M416-T419 PolarHBondContact O-OG1 3.06Å; M416-T420 HydrophobicContact CG-CG2 3.79Å; M416-T420 VanDerWaalsContact O-CB 3.31Å; M416-T420 WeakPolarHBondContact O-CB 3.39Å; M416-T420 WeakPolarHBondContact O-CG2 3.26Å; M416-T420 PolarHBondContact O-N 3.31Å; M416-T420 PolarHBondContact O-OG1 3.01Å; M416-T420 HydrophobicContact SD-CG2 3.49Å; M416-T420 WeakPolarHBondContact SD-CG2 3.4Å
417	R	87.6	Confident	87.7	Confident	18 Å²	18	72.9 Å²	72.9	7%	0.068	35%	0.35	C	S	.	.	H	α-helix	trans	-58.5	-37.2	173.3	-75.4	174.8	161.8	142.7	5.8	113.4	W413 C414 R415 G423 E429 I517 F519 M521	W413-R417 VanDerWaalsContact NE1-NH2 3.11Å; W413-R417 PolarHBondContact O-N 3.35Å; C414-R417 WeakPolarHBondContact O-CB 3.44Å; C414-R417 PolarHBondContact O-N 3.38Å; R415-R417 VanDerWaalsContact C-N 3.31Å; R415-R417 PolarHBondContact O-N 2.89Å; R417-G423 VanDerWaalsContact O-CA 3.29Å; R417-G423 WeakPolarHBondContact O-CA 3.28Å; R417-G423 PolarHBondContact O-N 2.78Å; R417-E429 IonicContact CZ-OE1 3.7Å; R417-E429 IonicContact NE-OE1 3.33Å; R417-E429 PolarHBondContact NE-OE1 2.98Å; R417-E429 IonicContact NE-OE2 2.71Å; R417-E429 IonicContact NH2-OE1 3.38Å; R417-E429 PolarHBondContact NH2-OE1 3.43Å; R417-I517 PolarHBondContact NH1-O 3.22Å; R417-I517 PolarHBondContact NH2-O 3.36Å; R417-F519 PolarHBondContact NH1-O 3.24Å; R417-M521 VanDerWaalsContact NH2-CG 3.3Å
418	K	83.3	Confident	87.6	Confident	120 Å²	120	77.3 Å²	77.3	52%	0.522	37%	0.373	S	S	.	.	H	α-helix	trans	-76.5	-34.2	179.2	-70.2	-171.2	-178.7	-166.9	0	112.9	C414 R415 M416 L637 N638	C414-K418 PolarHBondContact O-N 2.88Å; R415-K418 PolarHBondContact O-N 3.28Å; M416-K418 VanDerWaalsContact C-N 3.3Å; M416-K418 PolarHBondContact O-N 2.89Å; K418-L637 PolarHBondContact NZ-O 2.7Å; K418-N638 PolarHBondContact NZ-OD1 3.37Å
419	T	83.8	Confident	87.5	Confident	109 Å²	109	72.9 Å²	72.9	67%	0.669	35%	0.354	S	S	*	.	H	α-helix	trans	-92.1	-23.2	-176.2	57.1	0	0	0	0	114.6	R415 M416	R415-T419 PolarHBondContact O-N 3.49Å; R415-T419 PolarHBondContact O-OG1 3.11Å; M416-T419 PolarHBondContact O-N 2.89Å; M416-T419 PolarHBondContact O-OG1 3.06Å
420	T	86.2	Confident	87.4	Confident	45 Å²	45	71.1 Å²	71.1	28%	0.276	34%	0.34	S	S	.	.	S	Bend	trans	-103	167.5	-176.3	67.7	0	0	0	0	113.4	M416 L422 G423	M416-T420 HydrophobicContact CG-CG2 3.79Å; M416-T420 VanDerWaalsContact O-CB 3.31Å; M416-T420 WeakPolarHBondContact O-CB 3.39Å; M416-T420 WeakPolarHBondContact O-CG2 3.26Å; M416-T420 PolarHBondContact O-N 3.31Å; M416-T420 PolarHBondContact O-OG1 3.01Å; M416-T420 HydrophobicContact SD-CG2 3.49Å; M416-T420 WeakPolarHBondContact SD-CG2 3.4Å; T420-L422 PolarHBondContact O-N 2.8Å; T420-L422 WeakPolarHBondContact OG1-CD1 3.3Å; T420-G423 PolarHBondContact O-N 3.3Å
421	R	78.7	Confident	87.5	Confident	214 Å²	214	73.3 Å²	73.3	81%	0.808	35%	0.351	S	S	*	.	G	3₁₀ helix	trans	-60.3	-14.7	178.7	-67.8	-173.4	178.5	-174.2	0.2	114.7	G423 H424	R421-G423 PolarHBondContact O-N 3.03Å; R421-H424 PolarHBondContact O-N 2.92Å
422	L	75.3	Confident	87.6	Confident	83 Å²	83	77 Å²	77	44%	0.435	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-57	-37.8	174.9	-79.1	104.6	0	0	0	111.9	T420 H424 Y425	T420-L422 PolarHBondContact O-N 2.8Å; T420-L422 WeakPolarHBondContact OG1-CD1 3.3Å; L422-H424 PolarHBondContact O-N 2.98Å; L422-H424 VanDerWaalsContact O-N 3.07Å; L422-Y425 PolarHBondContact O-N 3.33Å; L422-Y425 VanDerWaalsContact O-N 3.08Å
423	G	70.8	Confident	87.7	Confident	21 Å²	21	74.8 Å²	74.8	22%	0.216	35%	0.351	C	S	.	.	G	3₁₀ helix	trans	-59.6	-22.9	-178.6	0	0	0	0	0	115.3	R417 T420 R421 K522	R417-G423 VanDerWaalsContact O-CA 3.29Å; R417-G423 WeakPolarHBondContact O-CA 3.28Å; R417-G423 PolarHBondContact O-N 2.78Å; T420-G423 PolarHBondContact O-N 3.3Å; R421-G423 PolarHBondContact O-N 3.03Å; G423-K522 PolarHBondContact O-NZ 3.45Å
424	H	82.1	Confident	87.8	Confident	136 Å²	136	70.4 Å²	70.4	63%	0.63	34%	0.335	S	S	*	.	G	3₁₀ helix	trans	-78.9	-24.7	178.1	-66.6	-59.9	0	0	0	113.9	R421 L422 P426	R421-H424 PolarHBondContact O-N 2.92Å; L422-H424 PolarHBondContact O-N 2.98Å; L422-H424 VanDerWaalsContact O-N 3.07Å; H424-P426 WeakPolarHBondContact O-CD 3.43Å
425	Y	89.3	Confident	88.1	Confident	150 Å²	150	71.6 Å²	71.6	59%	0.588	35%	0.345	S	S	*	.			trans	-118.8	55.5	-174.2	-62.8	-79.6	0	0	0	113.2	L422 V427 I428 E429	L422-Y425 PolarHBondContact O-N 3.33Å; L422-Y425 VanDerWaalsContact O-N 3.08Å; Y425-V427 VanDerWaalsContact C-N 3.26Å; Y425-V427 PolarHBondContact O-N 3.23Å; Y425-I428 HydrophobicContact CD1-CD1 4Å; Y425-I428 HydrophobicContact CG-CD1 4.37Å; Y425-I428 PolarHBondContact O-N 3.02Å; Y425-I428 VanDerWaalsContact O-N 3.14Å; Y425-E429 PolarHBondContact O-N 3.46Å; Y425-E429 VanDerWaalsContact O-N 3.08Å
426	P	87.9	Confident	88.3	Confident	4 Å²	4	67.3 Å²	67.3	3%	0.026	34%	0.336	C	S	.	.	H	α-helix	trans	-64.9	-26.4	-172.5	28.9	-37.4	0	0	0	114	H424 V430 K522	H424-P426 WeakPolarHBondContact O-CD 3.43Å; P426-V430 WeakPolarHBondContact O-CG2 3.32Å; P426-V430 PolarHBondContact O-N 2.85Å; P426-K522 HydrophobicContact CB-CB 4.12Å; P426-K522 HydrophobicContact CB-CD 3.51Å; P426-K522 HydrophobicContact CB-CG 3.93Å; P426-K522 HydrophobicContact CG-CD 3.92Å
427	V	92.4	Very high	88.6	Confident	26 Å²	26	62.8 Å²	62.8	16%	0.158	31%	0.314	C	S	.	.	H	α-helix	trans	-67.5	-45.5	176.3	179	0	0	0	0	110.3	F222 V225 Y425 V430 L431	F222-V427 HydrophobicContact CD2-CG1 4.26Å; F222-V427 HydrophobicContact CE2-CG1 4.26Å; V225-V427 HydrophobicContact CG1-CB 4.23Å; V225-V427 HydrophobicContact CG1-CG1 3.89Å; V225-V427 HydrophobicContact CG1-CG2 4.13Å; V225-V427 HydrophobicContact CG2-CG2 4.12Å; Y425-V427 VanDerWaalsContact C-N 3.26Å; Y425-V427 PolarHBondContact O-N 3.23Å; V427-V430 PolarHBondContact O-N 2.67Å; V427-L431 HydrophobicContact CG1-CD1 4.21Å; V427-L431 VanDerWaalsContact O-CG 3.31Å; V427-L431 WeakPolarHBondContact O-CG 3.37Å; V427-L431 PolarHBondContact O-N 3.25Å
428	I	92.6	Very high	88.9	Confident	103 Å²	103	62.1 Å²	62.1	53%	0.528	31%	0.312	S	S	.	.	H	α-helix	trans	-67.2	-40.2	179.4	-57.4	179.2	0	0	0	110.1	Y425 L431 L432	Y425-I428 HydrophobicContact CD1-CD1 4Å; Y425-I428 HydrophobicContact CG-CD1 4.37Å; Y425-I428 PolarHBondContact O-N 3.02Å; Y425-I428 VanDerWaalsContact O-N 3.14Å; I428-L431 PolarHBondContact O-N 3.09Å; I428-L432 VanDerWaalsContact O-CB 3.31Å; I428-L432 WeakPolarHBondContact O-CB 3.34Å; I428-L432 PolarHBondContact O-N 2.92Å
429	E	92.6	Very high	89.3	Confident	20 Å²	20	60.9 Å²	60.9	9%	0.093	31%	0.311	C	S	.	.	H	α-helix	trans	-57.1	-49.7	173.3	-179.5	179.3	-159	0	0	111.8	R417 Y425 L431 L432 V433	R417-E429 IonicContact CZ-OE1 3.7Å; R417-E429 IonicContact NE-OE1 3.33Å; R417-E429 PolarHBondContact NE-OE1 2.98Å; R417-E429 IonicContact NE-OE2 2.71Å; R417-E429 IonicContact NH2-OE1 3.38Å; R417-E429 PolarHBondContact NH2-OE1 3.43Å; Y425-E429 PolarHBondContact O-N 3.46Å; Y425-E429 VanDerWaalsContact O-N 3.08Å; E429-L431 PolarHBondContact O-N 2.9Å; E429-L432 PolarHBondContact O-N 3.5Å; E429-V433 HydrophobicContact CG-CG2 4.45Å; E429-V433 WeakPolarHBondContact O-CG2 3.35Å; E429-V433 PolarHBondContact O-N 2.98Å
430	V	93.8	Very high	89.7	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.6	-43.6	-179.6	171.7	0	0	0	0	111.8	V225 P426 V427 T434 M521 V523	V225-V430 HydrophobicContact CB-CB 4.26Å; V225-V430 HydrophobicContact CB-CG1 4.17Å; V225-V430 HydrophobicContact CB-CG2 4.2Å; V225-V430 HydrophobicContact CG1-CB 4.35Å; V225-V430 HydrophobicContact CG1-CG1 4.32Å; V225-V430 HydrophobicContact CG2-CB 4.32Å; V225-V430 HydrophobicContact CG2-CG2 3.88Å; P426-V430 WeakPolarHBondContact O-CG2 3.32Å; P426-V430 PolarHBondContact O-N 2.85Å; V427-V430 PolarHBondContact O-N 2.67Å; V430-T434 WeakPolarHBondContact O-CB 3.5Å; V430-T434 PolarHBondContact O-N 2.91Å; V430-T434 PolarHBondContact O-OG1 2.93Å; V430-M521 HydrophobicContact CB-CE 3.84Å; V430-M521 HydrophobicContact CG1-CE 3.95Å; V430-M521 HydrophobicContact CG2-CE 3.53Å; V430-V523 HydrophobicContact CG1-CG1 4.08Å; V430-V523 HydrophobicContact CG2-CG1 4.04Å
431	L	95.4	Very high	89.9	Confident	46 Å²	46	57.6 Å²	57.6	24%	0.241	29%	0.287	C	S	.	.	H	α-helix	trans	-64.5	-41.5	176.7	-66.8	173.7	0	0	0	112.5	L218 F222 V427 I428 E429 T434 A435	L218-L431 HydrophobicContact CD2-CB 4.48Å; L218-L431 HydrophobicContact CD2-CD2 4.2Å; L218-L431 WeakPolarHBondContact CD2-O 3.34Å; F222-L431 HydrophobicContact CB-CD2 3.85Å; F222-L431 HydrophobicContact CD2-CD1 4.16Å; F222-L431 HydrophobicContact CD2-CD2 4.35Å; V427-L431 HydrophobicContact CG1-CD1 4.21Å; V427-L431 VanDerWaalsContact O-CG 3.31Å; V427-L431 WeakPolarHBondContact O-CG 3.37Å; V427-L431 PolarHBondContact O-N 3.25Å; I428-L431 PolarHBondContact O-N 3.09Å; E429-L431 PolarHBondContact O-N 2.9Å; L431-T434 PolarHBondContact O-N 3.18Å; L431-A435 WeakPolarHBondContact O-CB 3.49Å; L431-A435 PolarHBondContact O-N 3.47Å
432	L	94.6	Very high	90.4	Very high	110 Å²	110	48 Å²	48	58%	0.576	25%	0.251	S	S	*	.	H	α-helix	trans	-66.7	-45.4	179.8	-173.2	152.8	0	0	0	111.4	I428 E429 T434 A435 V436	I428-L432 VanDerWaalsContact O-CB 3.31Å; I428-L432 WeakPolarHBondContact O-CB 3.34Å; I428-L432 PolarHBondContact O-N 2.92Å; E429-L432 PolarHBondContact O-N 3.5Å; L432-T434 VanDerWaalsContact C-N 3.32Å; L432-T434 PolarHBondContact O-N 3.37Å; L432-A435 PolarHBondContact O-N 3.36Å; L432-V436 HydrophobicContact CD2-CG2 4.25Å; L432-V436 WeakPolarHBondContact O-CG2 3.32Å; L432-V436 PolarHBondContact O-N 2.91Å
433	V	94.4	Very high	91.1	Very high	10 Å²	10	47.9 Å²	47.9	6%	0.061	26%	0.255	C	S	.	.	H	α-helix	trans	-63.3	-40.3	175.9	176.4	0	0	0	0	110.5	L276 E429 T437 I514 I517 T518 M521	L276-V433 HydrophobicContact CD2-CG1 3.96Å; E429-V433 HydrophobicContact CG-CG2 4.45Å; E429-V433 WeakPolarHBondContact O-CG2 3.35Å; E429-V433 PolarHBondContact O-N 2.98Å; V433-T437 VanDerWaalsContact O-CB 3.31Å; V433-T437 WeakPolarHBondContact O-CB 3.31Å; V433-T437 PolarHBondContact O-N 3.03Å; V433-T437 PolarHBondContact O-OG1 3.42Å; V433-I514 HydrophobicContact CG1-CD1 4.11Å; V433-I517 HydrophobicContact CG1-CG2 4.2Å; V433-I517 HydrophobicContact CG2-CG2 3.83Å; V433-T518 HydrophobicContact CG1-CG2 3.99Å; V433-M521 HydrophobicContact CB-CE 3.98Å; V433-M521 HydrophobicContact CB-SD 4.16Å; V433-M521 HydrophobicContact CG1-CE 4.16Å; V433-M521 HydrophobicContact CG1-SD 3.84Å; V433-M521 HydrophobicContact CG2-CE 4.44Å; V433-M521 HydrophobicContact CG2-SD 4.34Å
434	T	95.6	Very high	92	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.006	25%	0.25	C	S	.	.	H	α-helix	trans	-66.3	-42.4	176.3	-51.7	0	0	0	0	112	A217 L218 S221 L276 V430 L431 L432 T437 A438	A217-T434 HydrophobicContact CB-CG2 3.96Å; A217-T434 WeakPolarHBondContact O-CG2 3.29Å; L218-T434 HydrophobicContact CD2-CG2 4.39Å; S221-T434 VanDerWaalsContact CB-OG1 3.3Å; S221-T434 WeakPolarHBondContact CB-OG1 3.27Å; S221-T434 WeakPolarHBondContact OG-CG2 3.4Å; S221-T434 PolarHBondContact OG-OG1 3.25Å; L276-T434 WeakPolarHBondContact CD2-OG1 3.29Å; V430-T434 WeakPolarHBondContact O-CB 3.5Å; V430-T434 PolarHBondContact O-N 2.91Å; V430-T434 PolarHBondContact O-OG1 2.93Å; L431-T434 PolarHBondContact O-N 3.18Å; L432-T434 VanDerWaalsContact C-N 3.32Å; L432-T434 PolarHBondContact O-N 3.37Å; T434-T437 PolarHBondContact O-N 3.42Å; T434-A438 WeakPolarHBondContact O-CB 3.49Å; T434-A438 PolarHBondContact O-N 3.41Å
435	A	95.5	Very high	92.2	Very high	32 Å²	32	43.3 Å²	43.3	26%	0.264	23%	0.234	S	C	.	.	H	α-helix	trans	-58.5	-50.5	176	0	0	0	0	0	111.5	L218 L431 L432 T437 A438 L439	L218-A435 HydrophobicContact CD2-CB 4.05Å; L431-A435 WeakPolarHBondContact O-CB 3.49Å; L431-A435 PolarHBondContact O-N 3.47Å; L432-A435 PolarHBondContact O-N 3.36Å; A435-T437 VanDerWaalsContact C-N 3.32Å; A435-T437 PolarHBondContact O-N 3.34Å; A435-A438 PolarHBondContact O-N 2.85Å; A435-L439 WeakPolarHBondContact O-CB 3.45Å; A435-L439 PolarHBondContact O-N 3.49Å
436	V	94.4	Very high	92.1	Very high	65 Å²	65	36.6 Å²	36.6	39%	0.394	21%	0.207	S	C	.	.	H	α-helix	trans	-62.9	-40.7	177.5	172.8	0	0	0	0	110.9	L432 I440	L432-V436 HydrophobicContact CD2-CG2 4.25Å; L432-V436 WeakPolarHBondContact O-CG2 3.32Å; L432-V436 PolarHBondContact O-N 2.91Å; V436-I440 HydrophobicContact CG1-CD1 3.75Å; V436-I440 WeakPolarHBondContact O-CG1 3.42Å; V436-I440 PolarHBondContact O-N 2.84Å; V436-I440 VanDerWaalsContact O-N 3.12Å
437	T	93.8	Very high	92	Very high	6 Å²	6	36.8 Å²	36.8	4%	0.037	21%	0.209	C	C	.	.	H	α-helix	trans	-62.3	-51.2	177.4	-55.3	0	0	0	0	111	G275 V433 T434 A435 L439 I440 A441 F510 I514	G275-T437 WeakPolarHBondContact O-CG2 3.03Å; V433-T437 VanDerWaalsContact O-CB 3.31Å; V433-T437 WeakPolarHBondContact O-CB 3.31Å; V433-T437 PolarHBondContact O-N 3.03Å; V433-T437 PolarHBondContact O-OG1 3.42Å; T434-T437 PolarHBondContact O-N 3.42Å; A435-T437 VanDerWaalsContact C-N 3.32Å; A435-T437 PolarHBondContact O-N 3.34Å; T437-L439 PolarHBondContact O-N 3.2Å; T437-I440 PolarHBondContact O-N 3.36Å; T437-A441 WeakPolarHBondContact O-CB 3.4Å; T437-A441 PolarHBondContact O-N 3.06Å; T437-F510 HydrophobicContact CG2-CZ 4.21Å; T437-I514 HydrophobicContact CG2-CG1 4.37Å; T437-I514 WeakPolarHBondContact OG1-CD1 3.26Å
438	A	93.6	Very high	91.8	Very high	4 Å²	4	39.2 Å²	39.2	3%	0.033	22%	0.215	C	C	.	.	H	α-helix	trans	-66.5	-38.6	-177.6	0	0	0	0	0	112.9	Y213 I214 A217 T434 A435 F442	Y213-A438 HydrophobicContact CD1-CB 4.15Å; Y213-A438 HydrophobicContact CE1-CB 4.01Å; I214-A438 HydrophobicContact CG1-CB 3.98Å; A217-A438 HydrophobicContact CB-CB 4.06Å; T434-A438 WeakPolarHBondContact O-CB 3.49Å; T434-A438 PolarHBondContact O-N 3.41Å; A435-A438 PolarHBondContact O-N 2.85Å; A438-F442 PolarHBondContact O-N 3.43Å
439	L	93.4	Very high	91.4	Very high	94 Å²	94	37.7 Å²	37.7	49%	0.492	21%	0.206	S	C	.	.	H	α-helix	trans	-62.3	-43.3	176.7	-173.1	157	0	0	0	111.6	Y210 A435 T437 P443	Y210-L439 WeakPolarHBondContact OH-CG 3.36Å; Y210-L439 PolarHBondContact OH-O 3.3Å; A435-L439 WeakPolarHBondContact O-CB 3.45Å; A435-L439 PolarHBondContact O-N 3.49Å; T437-L439 PolarHBondContact O-N 3.2Å; L439-P443 WeakPolarHBondContact O-CD 3.38Å
440	I	91.5	Very high	91.1	Very high	82 Å²	82	37.6 Å²	37.6	42%	0.421	21%	0.208	S	C	.	.	H	α-helix	trans	-83.8	-28	-179.2	-60.3	170.6	0	0	0	112.1	V436 T437 P443 F510	V436-I440 HydrophobicContact CG1-CD1 3.75Å; V436-I440 WeakPolarHBondContact O-CG1 3.42Å; V436-I440 PolarHBondContact O-N 2.84Å; V436-I440 VanDerWaalsContact O-N 3.12Å; T437-I440 PolarHBondContact O-N 3.36Å; I440-P443 WeakPolarHBondContact O-CD 3.33Å; I440-F510 HydrophobicContact CB-CD2 4.24Å; I440-F510 HydrophobicContact CB-CE2 3.63Å; I440-F510 HydrophobicContact CB-CZ 3.96Å; I440-F510 HydrophobicContact CD1-CE2 4.05Å; I440-F510 HydrophobicContact CG1-CE2 4.44Å; I440-F510 HydrophobicContact CG2-CD2 3.49Å; I440-F510 VanDerWaalsContact CG2-CD2 3.49Å; I440-F510 HydrophobicContact CG2-CE2 3.41Å; I440-F510 VanDerWaalsContact CG2-CE2 3.41Å; I440-F510 HydrophobicContact CG2-CG 4.12Å; I440-F510 HydrophobicContact CG2-CZ 3.97Å
441	A	90.3	Very high	90.7	Very high	2 Å²	2	38.8 Å²	38.8	2%	0.017	22%	0.22	C	C	.	.	H	α-helix	trans	-77	-34.6	-176.2	0	0	0	0	0	114.2	T437 N444 T447 R448 F510	T437-A441 WeakPolarHBondContact O-CB 3.4Å; T437-A441 PolarHBondContact O-N 3.06Å; A441-N444 PolarHBondContact O-N 3.05Å; A441-T447 WeakPolarHBondContact CA-OG1 3.22Å; A441-T447 PolarHBondContact O-OG1 3.25Å; A441-R448 PolarHBondContact O-N 3.45Å; A441-F510 HydrophobicContact CB-CE1 4.33Å
442	F	89.4	Confident	90.3	Very high	14 Å²	14	37.3 Å²	37.3	6%	0.061	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-38.9	-173.8	-172.1	-92.5	0	0	0	115.2	Y206 N209 Y210 Y213 A438 N444 R448	Y206-F442 HydrophobicContact CD2-CE1 4.13Å; Y206-F442 HydrophobicContact CE1-CD1 4.49Å; Y206-F442 HydrophobicContact CE1-CE1 4.12Å; Y206-F442 HydrophobicContact CE2-CD1 4.27Å; Y206-F442 AromaticContact CE2-CE1 3.61Å; Y206-F442 HydrophobicContact CE2-CE1 3.61Å; Y206-F442 AromaticContact CZ-CD1 3.91Å; Y206-F442 AromaticContact CZ-CE1 3.6Å; N209-F442 HydrophobicContact CB-CE2 4.46Å; N209-F442 HydrophobicContact CB-CZ 3.94Å; Y210-F442 HydrophobicContact CD2-CB 3.52Å; Y210-F442 AromaticContact CD2-CD1 3.34Å; Y210-F442 HydrophobicContact CD2-CD1 3.34Å; Y210-F442 HydrophobicContact CD2-CD2 4.14Å; Y210-F442 HydrophobicContact CD2-CE1 4.04Å; Y210-F442 AromaticContact CD2-CG 3.4Å; Y210-F442 HydrophobicContact CD2-CG 3.4Å; Y210-F442 VanDerWaalsContact CD2-CG 3.4Å; Y210-F442 HydrophobicContact CE2-CB 3.55Å; Y210-F442 HydrophobicContact CE2-CD1 4.02Å; Y210-F442 AromaticContact CE2-CG 3.98Å; Y210-F442 HydrophobicContact CE2-CG 3.98Å; Y210-F442 AromaticContact CG-CD1 3.71Å; Y210-F442 HydrophobicContact CG-CD1 3.71Å; Y210-F442 HydrophobicContact CG-CE1 4.01Å; Y210-F442 HydrophobicContact CG-CG 4.2Å; Y213-F442 HydrophobicContact CD1-CB 4.35Å; Y213-F442 AromaticContact CD1-CD2 3.96Å; Y213-F442 HydrophobicContact CD1-CD2 3.96Å; Y213-F442 HydrophobicContact CD2-CD2 4.01Å; Y213-F442 HydrophobicContact CD2-CE2 4.4Å; Y213-F442 AromaticContact CG-CD2 3.63Å; Y213-F442 HydrophobicContact CG-CD2 3.63Å; Y213-F442 HydrophobicContact CG-CE2 4.18Å; A438-F442 PolarHBondContact O-N 3.43Å; F442-N444 PolarHBondContact O-N 3.16Å; F442-R448 HydrophobicContact CD2-CG 4.37Å
443	P	89.9	Confident	89.8	Confident	80 Å²	80	34.7 Å²	34.7	52%	0.519	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-15.6	179.5	-23.5	35.7	0	0	0	115.7	L439 I440	L439-P443 WeakPolarHBondContact O-CD 3.38Å; I440-P443 WeakPolarHBondContact O-CD 3.33Å
444	N	89.4	Confident	89.6	Confident	20 Å²	20	34.3 Å²	34.3	11%	0.107	20%	0.197	C	C	.	.	S	Bend	trans	-121	118.4	-179.4	171.7	0.7	0	0	0	109.5	A441 F442 Y446 T447 R448 Q503	A441-N444 PolarHBondContact O-N 3.05Å; F442-N444 PolarHBondContact O-N 3.16Å; N444-Y446 VanDerWaalsContact C-N 3.35Å; N444-Y446 PolarHBondContact O-N 3.02Å; N444-Y446 PolarHBondContact OD1-N 3.4Å; N444-T447 VanDerWaalsContact CB-OG1 3.27Å; N444-T447 WeakPolarHBondContact CB-OG1 3.49Å; N444-T447 PolarHBondContact O-N 3.22Å; N444-T447 PolarHBondContact O-OG1 3.35Å; N444-R448 PolarHBondContact O-N 3.4Å; N444-R448 VanDerWaalsContact O-N 3.08Å; N444-Q503 PolarHBondContact ND2-O 3.27Å
445	S	85.5	Confident	89.4	Confident	41 Å²	41	34.2 Å²	34.2	29%	0.287	20%	0.196	S	C	.	.	H	α-helix	trans	-50	-50.6	-177	41.9	0	0	0	0	112.5	T447 R448 M449 Q503	S445-T447 VanDerWaalsContact C-N 3.25Å; S445-T447 PolarHBondContact O-N 3.07Å; S445-R448 WeakPolarHBondContact O-CB 3.38Å; S445-R448 PolarHBondContact O-N 3.18Å; S445-R448 VanDerWaalsContact O-N 3.09Å; S445-M449 WeakPolarHBondContact O-CG 2.97Å; S445-M449 PolarHBondContact O-N 3.12Å; S445-M449 VanDerWaalsContact O-N 3.13Å; S445-Q503 PolarHBondContact OG-OE1 3.35Å
446	Y	87.3	Confident	89	Confident	9 Å²	9	33.6 Å²	33.6	4%	0.035	19%	0.19	C	C	.	.	H	α-helix	trans	-66.6	-23.6	-178.1	-56	-69.3	0	0	0	113.7	N444 L454 L470 A500 Q503 L504	N444-Y446 VanDerWaalsContact C-N 3.35Å; N444-Y446 PolarHBondContact O-N 3.02Å; N444-Y446 PolarHBondContact OD1-N 3.4Å; Y446-L454 HydrophobicContact CD1-CD1 3.99Å; Y446-L454 HydrophobicContact CG-CD1 4.43Å; Y446-L454 WeakPolarHBondContact O-CD2 3.47Å; Y446-L470 HydrophobicContact CE1-CD1 3.45Å; Y446-L470 VanDerWaalsContact CE1-CD1 3.45Å; Y446-L470 VanDerWaalsContact CZ-CD1 3.49Å; Y446-L470 WeakPolarHBondContact OH-CD1 3.4Å; Y446-A500 HydrophobicContact CE2-CB 4.37Å; Y446-A500 WeakPolarHBondContact OH-CB 3.48Å; Y446-Q503 HydrophobicContact CD2-CB 3.77Å; Y446-Q503 HydrophobicContact CE2-CB 3.85Å; Y446-L504 HydrophobicContact CD1-CD2 3.87Å; Y446-L504 HydrophobicContact CD2-CD2 4.01Å; Y446-L504 HydrophobicContact CD2-CG 4.16Å; Y446-L504 HydrophobicContact CE1-CD2 4.33Å; Y446-L504 HydrophobicContact CE2-CD2 4.46Å; Y446-L504 HydrophobicContact CE2-CG 4.27Å; Y446-L504 HydrophobicContact CG-CD2 3.7Å; Y446-L504 HydrophobicContact CG-CG 4.35Å
447	T	86.8	Confident	88.6	Confident	8 Å²	8	33 Å²	33	5%	0.049	18%	0.183	C	C	.	.	H	α-helix	trans	-86.5	-24.4	173.9	49.5	0	0	0	0	113.2	A441 N444 S445 A507 F510	A441-T447 WeakPolarHBondContact CA-OG1 3.22Å; A441-T447 PolarHBondContact O-OG1 3.25Å; N444-T447 VanDerWaalsContact CB-OG1 3.27Å; N444-T447 WeakPolarHBondContact CB-OG1 3.49Å; N444-T447 PolarHBondContact O-N 3.22Å; N444-T447 PolarHBondContact O-OG1 3.35Å; S445-T447 VanDerWaalsContact C-N 3.25Å; S445-T447 PolarHBondContact O-N 3.07Å; T447-A507 HydrophobicContact CG2-CB 3.59Å; T447-F510 HydrophobicContact CG2-CD1 3.65Å; T447-F510 HydrophobicContact CG2-CE1 4.29Å
448	R	87.8	Confident	88.3	Confident	76 Å²	76	32.8 Å²	32.8	29%	0.287	18%	0.181	S	C	.	.	H	α-helix	trans	-77	-39.2	179.4	-162.4	-177.9	78.1	-163.9	6.4	113	E157 Y213 A441 F442 N444 S445	E157-R448 IonicContact OE1-CZ 2.74Å; E157-R448 IonicContact OE1-NE 3.65Å; E157-R448 PolarHBondContact OE1-NE 3.08Å; E157-R448 IonicContact OE1-NH2 2.69Å; E157-R448 PolarHBondContact OE1-NH2 2.87Å; E157-R448 IonicContact OE2-CZ 2.69Å; E157-R448 IonicContact OE2-NE 3.5Å; E157-R448 IonicContact OE2-NH2 3.2Å; E157-R448 PolarHBondContact OE2-NH2 2.81Å; Y213-R448 HydrophobicContact CD2-CG 4.32Å; Y213-R448 HydrophobicContact CE2-CG 3.64Å; Y213-R448 PolarHBondContact OH-O 3.35Å; A441-R448 PolarHBondContact O-N 3.45Å; F442-R448 HydrophobicContact CD2-CG 4.37Å; N444-R448 PolarHBondContact O-N 3.4Å; N444-R448 VanDerWaalsContact O-N 3.08Å; S445-R448 WeakPolarHBondContact O-CB 3.38Å; S445-R448 PolarHBondContact O-N 3.18Å; S445-R448 VanDerWaalsContact O-N 3.09Å
449	M	85.3	Confident	88.1	Confident	71 Å²	71	32.8 Å²	32.8	35%	0.35	18%	0.181	S	C	.	.	S	Bend	trans	-55.5	154.6	176.4	-74.7	167	155.4	0	0	113.2	S445	S445-M449 WeakPolarHBondContact O-CG 2.97Å; S445-M449 PolarHBondContact O-N 3.12Å; S445-M449 VanDerWaalsContact O-N 3.13Å
450	S	85.4	Confident	87.5	Confident	19 Å²	19	31.3 Å²	31.3	13%	0.133	17%	0.173	C	C	.	.			trans	-66.6	156.3	174.8	96.7	0	0	0	0	111.2	A452 E453 L454	S450-A452 PolarHBondContact O-N 2.89Å; S450-E453 VanDerWaalsContact CB-CD 3.45Å; S450-E453 VanDerWaalsContact CB-OE1 3.31Å; S450-E453 WeakPolarHBondContact CB-OE1 3.42Å; S450-E453 WeakPolarHBondContact CB-OE2 3.02Å; S450-E453 PolarHBondContact N-OE2 2.66Å; S450-E453 PolarHBondContact O-N 3.42Å; S450-E453 PolarHBondContact OG-N 3.49Å; S450-E453 PolarHBondContact OG-OE1 3.05Å; S450-E453 PolarHBondContact OG-OE2 3.29Å; S450-E453 VanDerWaalsContact OG-OE2 3.1Å; S450-L454 VanDerWaalsContact O-CB 3.28Å; S450-L454 WeakPolarHBondContact O-CB 3.4Å; S450-L454 PolarHBondContact O-N 3.36Å
451	G	85.8	Confident	86.7	Confident	24 Å²	24	30.2 Å²	30.2	25%	0.247	17%	0.168	C	C	.	.	H	α-helix	trans	-64.6	-27.3	-177.4	0	0	0	0	0	114	I455	G451-I455 WeakPolarHBondContact O-CD1 3.5Å; G451-I455 VanDerWaalsContact O-CG1 3.27Å; G451-I455 WeakPolarHBondContact O-CG1 3.28Å; G451-I455 PolarHBondContact O-N 3.31Å
452	A	85.8	Confident	85.7	Confident	15 Å²	15	31.1 Å²	31.1	12%	0.124	17%	0.174	C	C	.	.	H	α-helix	trans	-83.6	-41.9	179.3	0	0	0	0	0	111.9	L375 F376 S450 L454 I455 S456	L375-A452 HydrophobicContact CD2-CB 4.22Å; F376-A452 HydrophobicContact CD1-CB 4.49Å; S450-A452 PolarHBondContact O-N 2.89Å; A452-L454 VanDerWaalsContact C-N 3.35Å; A452-I455 PolarHBondContact O-N 3.06Å; A452-S456 PolarHBondContact O-N 3.42Å
453	E	85.5	Confident	84.4	Confident	56 Å²	56	33.3 Å²	33.3	26%	0.262	19%	0.191	S	C	.	.	H	α-helix	trans	-58.5	-46.7	171.6	-73.9	136	-134.7	0	0	111	H150 L375 S450 I455 S456 E457	H150-E453 IonicContact CE1-OE1 2.87Å; H150-E453 PolarHBondContact CE1-OE1 3.41Å; H150-E453 IonicContact ND1-OE1 3.59Å; H150-E453 PolarHBondContact ND1-OE1 3.21Å; L375-E453 HydrophobicContact CD2-CG 3.99Å; S450-E453 VanDerWaalsContact CB-CD 3.45Å; S450-E453 VanDerWaalsContact CB-OE1 3.31Å; S450-E453 WeakPolarHBondContact CB-OE1 3.42Å; S450-E453 WeakPolarHBondContact CB-OE2 3.02Å; S450-E453 PolarHBondContact N-OE2 2.66Å; S450-E453 PolarHBondContact O-N 3.42Å; S450-E453 PolarHBondContact OG-N 3.49Å; S450-E453 PolarHBondContact OG-OE1 3.05Å; S450-E453 PolarHBondContact OG-OE2 3.29Å; S450-E453 VanDerWaalsContact OG-OE2 3.1Å; E453-I455 VanDerWaalsContact C-N 3.3Å; E453-I455 PolarHBondContact O-N 3.45Å; E453-S456 WeakPolarHBondContact O-CB 3.33Å; E453-S456 PolarHBondContact O-N 2.91Å; E453-S456 VanDerWaalsContact O-N 3.15Å; E453-E457 WeakPolarHBondContact O-CB 3.39Å; E453-E457 PolarHBondContact O-N 2.88Å
454	L	89.6	Confident	82.4	Confident	1 Å²	1	33.9 Å²	33.9	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-58.8	-41	178.6	-178.8	66.3	0	0	0	112.1	Y446 S450 A452 L458 I537	Y446-L454 HydrophobicContact CD1-CD1 3.99Å; Y446-L454 HydrophobicContact CG-CD1 4.43Å; Y446-L454 WeakPolarHBondContact O-CD2 3.47Å; S450-L454 VanDerWaalsContact O-CB 3.28Å; S450-L454 WeakPolarHBondContact O-CB 3.4Å; S450-L454 PolarHBondContact O-N 3.36Å; A452-L454 VanDerWaalsContact C-N 3.35Å; L454-L458 HydrophobicContact CD1-CD1 3.62Å; L454-L458 HydrophobicContact CG-CD1 4.16Å; L454-L458 WeakPolarHBondContact O-CB 3.5Å; L454-L458 WeakPolarHBondContact O-CD1 3.22Å; L454-L458 PolarHBondContact O-N 3.39Å; L454-L458 VanDerWaalsContact O-N 3.11Å; L454-I537 HydrophobicContact CD2-CD1 4.35Å
455	I	91.2	Very high	80.5	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.9	-42.1	177.1	-70.4	169.8	0	0	0	110.7	F376 G451 A452 E453 L458 F459 I529 M532 A533	F376-I455 HydrophobicContact CB-CG2 3.98Å; F376-I455 HydrophobicContact CD1-CG2 4.38Å; F376-I455 HydrophobicContact CD2-CG2 4.23Å; F376-I455 HydrophobicContact CG-CG2 3.96Å; G451-I455 WeakPolarHBondContact O-CD1 3.5Å; G451-I455 VanDerWaalsContact O-CG1 3.27Å; G451-I455 WeakPolarHBondContact O-CG1 3.28Å; G451-I455 PolarHBondContact O-N 3.31Å; A452-I455 PolarHBondContact O-N 3.06Å; E453-I455 VanDerWaalsContact C-N 3.3Å; E453-I455 PolarHBondContact O-N 3.45Å; I455-L458 PolarHBondContact O-N 2.94Å; I455-F459 HydrophobicContact CG2-CD1 4.25Å; I455-F459 HydrophobicContact CG2-CD2 3.88Å; I455-F459 HydrophobicContact CG2-CE1 3.86Å; I455-F459 HydrophobicContact CG2-CE2 3.45Å; I455-F459 VanDerWaalsContact CG2-CE2 3.45Å; I455-F459 HydrophobicContact CG2-CG 4.26Å; I455-F459 HydrophobicContact CG2-CZ 3.45Å; I455-F459 VanDerWaalsContact CG2-CZ 3.45Å; I455-F459 WeakPolarHBondContact O-CD1 3.36Å; I455-F459 VanDerWaalsContact O-CG 3.3Å; I455-F459 WeakPolarHBondContact O-CG 3.3Å; I455-F459 PolarHBondContact O-N 3.27Å; I455-I529 HydrophobicContact CD1-CD1 4.15Å; I455-I529 HydrophobicContact CD1-CG2 4.11Å; I455-M532 HydrophobicContact CD1-CB 3.8Å; I455-M532 HydrophobicContact CD1-CE 4.12Å; I455-A533 HydrophobicContact CD1-CB 4.28Å; I455-A533 HydrophobicContact CG1-CB 4.19Å
456	S	87.1	Confident	79.3	Confident	18 Å²	18	40.7 Å²	40.7	13%	0.126	22%	0.222	C	C	.	.	H	α-helix	trans	-58.7	-50.9	176.6	-166.3	0	0	0	0	111.3	L375 A452 E453 L458 F459 N460	L375-S456 WeakPolarHBondContact O-CB 3.37Å; L375-S456 PolarHBondContact O-OG 2.9Å; A452-S456 PolarHBondContact O-N 3.42Å; E453-S456 WeakPolarHBondContact O-CB 3.33Å; E453-S456 PolarHBondContact O-N 2.91Å; E453-S456 VanDerWaalsContact O-N 3.15Å; S456-L458 VanDerWaalsContact C-N 3.26Å; S456-L458 PolarHBondContact O-N 3.22Å; S456-F459 PolarHBondContact O-N 3.02Å; S456-F459 VanDerWaalsContact O-N 3.08Å; S456-N460 PolarHBondContact O-N 3.28Å; S456-N460 PolarHBondContact O-ND2 3.49Å
457	E	85.6	Confident	77.7	Confident	53 Å²	53	45.1 Å²	45.1	25%	0.248	26%	0.255	C	S	.	.	H	α-helix	trans	-60.2	-32.6	177.5	-175.5	61.4	-163.3	0	0	113.2	E453 S468	E453-E457 WeakPolarHBondContact O-CB 3.39Å; E453-E457 PolarHBondContact O-N 2.88Å; E457-S468 WeakPolarHBondContact OE1-CB 3.38Å; E457-S468 PolarHBondContact OE1-OG 2.89Å
458	L	88.2	Confident	76.7	Confident	1 Å²	1	46 Å²	46	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-80.9	-23.3	177.1	-92.9	74.7	0	0	0	113.8	L454 I455 S456 L470 L504 A536 I537 R540 A576	L454-L458 HydrophobicContact CD1-CD1 3.62Å; L454-L458 HydrophobicContact CG-CD1 4.16Å; L454-L458 WeakPolarHBondContact O-CB 3.5Å; L454-L458 WeakPolarHBondContact O-CD1 3.22Å; L454-L458 PolarHBondContact O-N 3.39Å; L454-L458 VanDerWaalsContact O-N 3.11Å; I455-L458 PolarHBondContact O-N 2.94Å; S456-L458 VanDerWaalsContact C-N 3.26Å; S456-L458 PolarHBondContact O-N 3.22Å; L458-L470 HydrophobicContact CD1-CD2 4.45Å; L458-L470 HydrophobicContact CG-CD2 4.49Å; L458-L504 HydrophobicContact CD1-CD2 4.21Å; L458-A536 HydrophobicContact CB-CB 4.35Å; L458-A536 VanDerWaalsContact CD2-C 3.46Å; L458-A536 HydrophobicContact CD2-CB 3.95Å; L458-I537 VanDerWaalsContact CD2-CA 3.47Å; L458-I537 HydrophobicContact CD2-CB 4.14Å; L458-I537 HydrophobicContact CD2-CG1 3.65Å; L458-R540 HydrophobicContact CD2-CB 4.07Å; L458-R540 HydrophobicContact CG-CB 4.23Å; L458-R540 HydrophobicContact CG-CG 4.34Å; L458-R540 PolarHBondContact O-NH1 3.15Å; L458-A576 HydrophobicContact CB-CB 4.42Å; L458-A576 VanDerWaalsContact O-CB 3.25Å; L458-A576 WeakPolarHBondContact O-CB 3.45Å
459	F	88.4	Confident	75.7	Confident	5 Å²	5	47 Å²	47	2%	0.022	27%	0.269	C	S	.	.	H	α-helix	trans	-85.6	-30.3	176.4	-69.6	-0	0	0	0	111.9	F376 V378 F380 I455 S456 D461 A536 G573 A576 M577 A580	F376-F459 HydrophobicContact CB-CD2 4.3Å; F376-F459 HydrophobicContact CD2-CE2 4.2Å; V378-F459 HydrophobicContact CG2-CB 3.74Å; F380-F459 VanDerWaalsContact CZ-O 3.29Å; F380-F459 WeakPolarHBondContact CZ-O 3.5Å; I455-F459 HydrophobicContact CG2-CD1 4.25Å; I455-F459 HydrophobicContact CG2-CD2 3.88Å; I455-F459 HydrophobicContact CG2-CE1 3.86Å; I455-F459 HydrophobicContact CG2-CE2 3.45Å; I455-F459 VanDerWaalsContact CG2-CE2 3.45Å; I455-F459 HydrophobicContact CG2-CG 4.26Å; I455-F459 HydrophobicContact CG2-CZ 3.45Å; I455-F459 VanDerWaalsContact CG2-CZ 3.45Å; I455-F459 WeakPolarHBondContact O-CD1 3.36Å; I455-F459 VanDerWaalsContact O-CG 3.3Å; I455-F459 WeakPolarHBondContact O-CG 3.3Å; I455-F459 PolarHBondContact O-N 3.27Å; S456-F459 PolarHBondContact O-N 3.02Å; S456-F459 VanDerWaalsContact O-N 3.08Å; F459-D461 PolarHBondContact O-N 3.46Å; F459-A536 HydrophobicContact CE1-CB 4.01Å; F459-G573 WeakPolarHBondContact O-CA 3.27Å; F459-A576 HydrophobicContact CD1-CB 3.88Å; F459-A576 HydrophobicContact CE1-CB 4.2Å; F459-M577 HydrophobicContact CB-CG 4.39Å; F459-M577 HydrophobicContact CD1-CG 3.65Å; F459-M577 HydrophobicContact CD2-CG 3.8Å; F459-M577 HydrophobicContact CD2-SD 4.23Å; F459-M577 HydrophobicContact CE1-CB 4.26Å; F459-M577 HydrophobicContact CE1-CG 3.73Å; F459-M577 HydrophobicContact CE2-CG 3.87Å; F459-M577 HydrophobicContact CE2-SD 4.46Å; F459-M577 HydrophobicContact CG-CG 3.69Å; F459-M577 HydrophobicContact CG-SD 4.47Å; F459-M577 HydrophobicContact CZ-CB 4.33Å; F459-M577 HydrophobicContact CZ-CG 3.83Å; F459-A580 HydrophobicContact CE1-CB 4.04Å; F459-A580 HydrophobicContact CZ-CB 3.87Å
460	N	82.4	Confident	75	Confident	62 Å²	62	43.9 Å²	43.9	33%	0.332	25%	0.253	S	S	.	.	S	Bend	trans	-60.4	134.9	178.2	-70.3	-26.2	0	0	0	112.5	S456 R540	S456-N460 PolarHBondContact O-N 3.28Å; S456-N460 PolarHBondContact O-ND2 3.49Å; N460-R540 PolarHBondContact O-NH1 3.07Å; N460-R540 PolarHBondContact O-NH2 3.41Å
461	D	74.4	Confident	74.3	Confident	59 Å²	59	44.2 Å²	44.2	32%	0.316	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-83.2	154.1	165.8	-70.2	-32.7	0	0	0	110.2	F380 F459 G573	F380-D461 WeakPolarHBondContact CD1-OD2 3.26Å; F380-D461 VanDerWaalsContact CE1-OD2 3.31Å; F380-D461 WeakPolarHBondContact CE1-OD2 3.28Å; F459-D461 PolarHBondContact O-N 3.46Å; D461-G573 PolarHBondContact OD1-N 3.09Å
462	C	69.6	Low	73.5	Confident	21 Å²	21	44.3 Å²	44.3	14%	0.142	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-85.4	118.5	-170.3	-76.7	0	0	0	0	112.9	C471 Y473	C462-C471 VanDerWaalsContact CA-SG 3.5Å; C462-C471 HydrophobicContact CB-CB 3.63Å; C462-C471 WeakPolarHBondContact CB-SG 3.46Å; C462-C471 WeakPolarHBondContact SG-CA 3.5Å; C462-C471 WeakPolarHBondContact SG-CB 3.35Å; C462-C471 CovalentContact SG-SG 2.04Å; C462-C471 PolarHBondContact SG-SG 2.93Å; C462-Y473 HydrophobicContact CB-CE2 4.49Å
463	S	60.5	Low	72.9	Confident	61 Å²	61	45 Å²	45	43%	0.427	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-82.9	162.1	170.5	-170.2	0	0	0	0	112.5	L465 D466	S463-L465 PolarHBondContact O-N 3.43Å; S463-L465 VanDerWaalsContact O-N 3.1Å; S463-D466 WeakPolarHBondContact CA-OD2 3.43Å; S463-D466 WeakPolarHBondContact CB-OD2 3.49Å; S463-D466 PolarHBondContact N-OD2 2.9Å; S463-D466 PolarHBondContact O-N 3.28Å
464	L	49.1	Very low	72.1	Confident	91 Å²	91	48 Å²	48	48%	0.476	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	-22.8	169.9	-79	172	0	0	0	113.8	L488	L464-L488 HydrophobicContact CB-CD1 4.38Å; L464-L488 HydrophobicContact CD2-CD1 3.39Å; L464-L488 HydrophobicContact CG-CD1 3.49Å; L464-L488 VanDerWaalsContact CG-CD1 3.49Å
465	L	49.3	Very low	70.9	Confident	132 Å²	132	54.7 Å²	54.7	69%	0.691	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.9	-7.2	-172.4	-69.1	163.9	0	0	0	113.6	S463	S463-L465 PolarHBondContact O-N 3.43Å; S463-L465 VanDerWaalsContact O-N 3.1Å
466	D	59.2	Low	69.3	Low	72 Å²	72	58 Å²	58	39%	0.385	32%	0.321	S	S	.	.			trans	-83.4	121	-174.9	-65.8	-41.4	0	0	0	111.6	S463 S468 C471	S463-D466 WeakPolarHBondContact CA-OD2 3.43Å; S463-D466 WeakPolarHBondContact CB-OD2 3.49Å; S463-D466 PolarHBondContact N-OD2 2.9Å; S463-D466 PolarHBondContact O-N 3.28Å; D466-S468 PolarHBondContact O-N 3.47Å; D466-C471 HydrophobicContact CB-CB 4.45Å
467	S	54.9	Low	67.5	Low	103 Å²	103	63.9 Å²	63.9	72%	0.72	36%	0.356	S	S	*	.			trans	-79.7	1.4	179	53.9	0	0	0	0	114.1
468	S	65.4	Low	65.8	Low	27 Å²	27	68.4 Å²	68.4	19%	0.189	38%	0.382	C	S	.	.			trans	-62.5	143.9	-175.9	153.1	0	0	0	0	112.4	E457 D466 L470 C471 G472	E457-S468 WeakPolarHBondContact OE1-CB 3.38Å; E457-S468 PolarHBondContact OE1-OG 2.89Å; D466-S468 PolarHBondContact O-N 3.47Å; S468-L470 PolarHBondContact O-N 2.94Å; S468-L470 PolarHBondContact OG-N 3.09Å; S468-C471 CarbonylContact O-C 3.55Å; S468-C471 WeakPolarHBondContact O-CA 3.29Å; S468-C471 PolarHBondContact O-N 2.68Å; S468-G472 PolarHBondContact O-N 3.4Å
469	Q	65.9	Low	63.9	Low	97 Å²	97	73.9 Å²	73.9	45%	0.453	42%	0.415	S	S	.	.	G	3₁₀ helix	trans	-68	-18.7	178.8	-62.9	-168	3.2	0	0	113.1	C471 G472 A500	Q469-C471 PolarHBondContact O-N 3.17Å; Q469-G472 PolarHBondContact O-N 3.46Å; Q469-A500 HydrophobicContact CB-CB 4.13Å
470	L	72.4	Confident	61.9	Low	4 Å²	4	78.1 Å²	78.1	2%	0.021	45%	0.446	C	S	.	.	G	3₁₀ helix	trans	-68.8	-22.6	168.4	-92.9	64.6	0	0	0	111.9	Y446 L458 S468 Y473 L497 A500 L504 R540	Y446-L470 HydrophobicContact CE1-CD1 3.45Å; Y446-L470 VanDerWaalsContact CE1-CD1 3.45Å; Y446-L470 VanDerWaalsContact CZ-CD1 3.49Å; Y446-L470 WeakPolarHBondContact OH-CD1 3.4Å; L458-L470 HydrophobicContact CD1-CD2 4.45Å; L458-L470 HydrophobicContact CG-CD2 4.49Å; S468-L470 PolarHBondContact O-N 2.94Å; S468-L470 PolarHBondContact OG-N 3.09Å; L470-Y473 WeakPolarHBondContact O-CE2 3.29Å; L470-L497 WeakPolarHBondContact O-CD1 3.4Å; L470-A500 HydrophobicContact CD1-CB 4.26Å; L470-L504 HydrophobicContact CD1-CD1 4.2Å; L470-R540 HydrophobicContact CD2-CG 4.23Å
471	C	70.5	Confident	60.1	Low	26 Å²	26	84.7 Å²	84.7	18%	0.176	47%	0.474	C	S	.	.	G	3₁₀ helix	trans	-100.9	11.5	-178.9	-52.6	0	0	0	0	112.8	C462 D466 S468 Q469 Y473	C462-C471 VanDerWaalsContact CA-SG 3.5Å; C462-C471 HydrophobicContact CB-CB 3.63Å; C462-C471 WeakPolarHBondContact CB-SG 3.46Å; C462-C471 WeakPolarHBondContact SG-CA 3.5Å; C462-C471 WeakPolarHBondContact SG-CB 3.35Å; C462-C471 CovalentContact SG-SG 2.04Å; C462-C471 PolarHBondContact SG-SG 2.93Å; D466-C471 HydrophobicContact CB-CB 4.45Å; S468-C471 CarbonylContact O-C 3.55Å; S468-C471 WeakPolarHBondContact O-CA 3.29Å; S468-C471 PolarHBondContact O-N 2.68Å; Q469-C471 PolarHBondContact O-N 3.17Å; C471-Y473 PolarHBondContact O-N 3.44Å
472	G	68.3	Low	58.3	Low	26 Å²	26	88.4 Å²	88.4	27%	0.268	50%	0.499	S	S	.	.			trans	-71.8	45.4	178.4	0	0	0	0	0	115.2	S468 Q469 G494	S468-G472 PolarHBondContact O-N 3.4Å; Q469-G472 PolarHBondContact O-N 3.46Å; G472-G494 WeakPolarHBondContact O-CA 3.37Å; G472-G494 PolarHBondContact O-N 3.4Å
473	Y	73.3	Confident	57.2	Low	29 Å²	29	90.7 Å²	90.7	11%	0.114	53%	0.527	C	S	.	.	B	Isolated β-bridge	trans	-73.7	156.5	173.5	-66.4	-88.5	0	0	0	111.7	C462 L470 C471 Q475 R491 L497 E547	C462-Y473 HydrophobicContact CB-CE2 4.49Å; L470-Y473 WeakPolarHBondContact O-CE2 3.29Å; C471-Y473 PolarHBondContact O-N 3.44Å; Y473-Q475 PolarHBondContact O-N 3.24Å; Y473-R491 HydrophobicContact CD1-CB 3.83Å; Y473-R491 WeakPolarHBondContact CD1-O 3.38Å; Y473-R491 HydrophobicContact CG-CB 4.06Å; Y473-L497 HydrophobicContact CD1-CD2 3.81Å; Y473-L497 HydrophobicContact CE1-CD2 3.38Å; Y473-L497 HydrophobicContact CE2-CD2 4.19Å; Y473-L497 HydrophobicContact CG-CD2 4.39Å; Y473-E547 WeakPolarHBondContact CE1-OE1 3.16Å; Y473-E547 PolarHBondContact OH-OE1 2.88Å; Y473-E547 PolarHBondContact OH-OE2 3.4Å
474	K	68.6	Low	56.2	Low	121 Å²	121	94.1 Å²	94.1	53%	0.526	55%	0.545	S	S	.	.	P	Polyproline II helix	trans	-73.8	117.5	173.1	-63.6	177.9	-176.3	167.2	0	109.5	P492 A493	K474-P492 HydrophobicContact CB-CG 4.32Å; K474-P492 PolarHBondContact N-O 3.45Å; K474-P492 VanDerWaalsContact N-O 3.11Å; K474-A493 WeakPolarHBondContact CE-O 3.46Å
475	Q	64.8	Low	55.8	Low	140 Å²	140	96.2 Å²	96.2	65%	0.654	56%	0.557	S	S	*	*	P	Polyproline II helix	trans	-68.9	137.4	171	-68.5	-178	-14.3	0	0	110.3	Y473	Y473-Q475 PolarHBondContact O-N 3.24Å
476	P	57.3	Low	55.6	Low	71 Å²	71	97 Å²	97	46%	0.461	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-66.5	139.1	169.4	28.6	-33.1	0	0	0	110	N478	P476-N478 PolarHBondContact O-N 3.46Å
477	V	50.1	Low	54.9	Low	141 Å²	141	99.9 Å²	99.9	86%	0.855	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.5	-10	-166.8	179.6	0	0	0	0	114.2
478	N	48.8	Very low	54.9	Low	148 Å²	148	96.6 Å²	96.6	79%	0.791	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.3	24.7	-165	-70.2	2.5	0	0	0	115.6	P476	P476-N478 PolarHBondContact O-N 3.46Å
479	T	49.6	Very low	54.5	Low	115 Å²	115	96.9 Å²	96.9	71%	0.706	56%	0.555	S	S	*	*			trans	-110.9	79.9	172	39.8	0	0	0	0	112.1
480	S	44.8	Very low	54.3	Low	95 Å²	95	93.2 Å²	93.2	66%	0.664	54%	0.538	S	S	*	.			trans	-102.2	124.5	164.5	55.4	0	0	0	0	110.7	T482	S480-T482 PolarHBondContact O-N 3.2Å
481	E	44.9	Very low	54.3	Low	199 Å²	199	95 Å²	95	93%	0.93	55%	0.545	S	S	*	.	S	Bend	trans	69.7	7.8	151.5	-56.8	-169.1	148.2	0	0	121.4
482	T	37.1	Very low	54.5	Low	137 Å²	137	95 Å²	95	84%	0.84	55%	0.545	S	S	*	.			trans	-112.3	106.5	166	57.5	0	0	0	0	111.6	S480	S480-T482 PolarHBondContact O-N 3.2Å
483	G	46.5	Very low	55	Low	69 Å²	69	93.9 Å²	93.9	71%	0.711	53%	0.533	S	S	*	.			trans	-76.3	-174.4	174.9	0	0	0	0	0	113.8
484	V	40.3	Very low	55.3	Low	134 Å²	134	92.7 Å²	92.7	81%	0.812	53%	0.53	S	S	*	.			trans	77.1	60	-171.5	-160.6	0	0	0	0	113.5
485	D	39	Very low	55.9	Low	135 Å²	135	90.7 Å²	90.7	72%	0.722	54%	0.536	S	S	*	.				-166.2	130.3	115.9	-89.4	-25.4	0	0	0	108.8
486	N	45.2	Very low	56.6	Low	149 Å²	149	85.4 Å²	85.4	80%	0.797	52%	0.518	S	S	*	.			trans	-90.5	0.2	-173.4	-74.1	-10	0	0	0	113.8
487	N	46.2	Very low	57.9	Low	132 Å²	132	82.1 Å²	82.1	71%	0.706	50%	0.497	S	S	*	.			trans	-87.2	131.1	-177.2	-64.4	4.9	0	0	0	109.7	A489	N487-A489 PolarHBondContact O-N 2.88Å
488	L	54.3	Low	59.6	Low	33 Å²	33	81.4 Å²	81.4	17%	0.173	48%	0.48	C	S	.	.			trans	-106	73.5	-160.4	-167.9	105.4	0	0	0	112.2	L464 D490 R491 D568	L464-L488 HydrophobicContact CB-CD1 4.38Å; L464-L488 HydrophobicContact CD2-CD1 3.39Å; L464-L488 HydrophobicContact CG-CD1 3.49Å; L464-L488 VanDerWaalsContact CG-CD1 3.49Å; L488-D490 PolarHBondContact O-N 3Å; L488-R491 VanDerWaalsContact CD1-CZ 3.5Å; L488-R491 VanDerWaalsContact CD1-NH2 3.33Å; L488-D568 PolarHBondContact N-OD1 2.79Å; L488-D568 PolarHBondContact N-OD2 2.82Å
489	A	57.5	Low	61.4	Low	33 Å²	33	77.8 Å²	77.8	27%	0.273	46%	0.463	S	S	.	.			trans	-20.6	121.8	168.2	0	0	0	0	0	114.7	N487 R491 G566 D568	N487-A489 PolarHBondContact O-N 2.88Å; A489-R491 WeakPolarHBondContact O-CG 3.21Å; A489-R491 PolarHBondContact O-N 3.21Å; A489-G566 WeakPolarHBondContact CB-O 3.43Å; A489-D568 WeakPolarHBondContact CA-OD1 3.37Å; A489-D568 PolarHBondContact N-OD1 3.31Å
490	D	61.6	Low	63.2	Low	20 Å²	20	72.3 Å²	72.3	11%	0.107	43%	0.43	C	S	.	.			trans	-41.2	131.1	179.7	-70.4	3.1	0	0	0	112.9	L488 Y551 C569	L488-D490 PolarHBondContact O-N 3Å; D490-Y551 HydrophobicContact CB-CD2 4.13Å; D490-Y551 WeakPolarHBondContact O-CD2 3.49Å; D490-Y551 VanDerWaalsContact O-CE2 3.29Å; D490-Y551 WeakPolarHBondContact O-CE2 3.21Å; D490-C569 PolarHBondContact OD1-N 2.74Å; D490-C569 WeakPolarHBondContact OD2-CB 3.38Å
491	R	70.7	Confident	65.3	Low	41 Å²	41	69.4 Å²	69.4	16%	0.155	41%	0.407	C	S	.	.			trans	-122.8	150.8	-172.7	-78.6	161	-162.9	-157.6	-2.4	113	Y473 L488 A489 Q548	Y473-R491 HydrophobicContact CD1-CB 3.83Å; Y473-R491 WeakPolarHBondContact CD1-O 3.38Å; Y473-R491 HydrophobicContact CG-CB 4.06Å; L488-R491 VanDerWaalsContact CD1-CZ 3.5Å; L488-R491 VanDerWaalsContact CD1-NH2 3.33Å; A489-R491 WeakPolarHBondContact O-CG 3.21Å; A489-R491 PolarHBondContact O-N 3.21Å; R491-Q548 PolarHBondContact O-NE2 2.87Å
492	P	76.1	Confident	67.5	Low	28 Å²	28	68.3 Å²	68.3	18%	0.182	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-70.5	136.3	172.6	28.2	-29.2	0	0	0	110.6	K474 G494 Y551	K474-P492 HydrophobicContact CB-CG 4.32Å; K474-P492 PolarHBondContact N-O 3.45Å; K474-P492 VanDerWaalsContact N-O 3.11Å; P492-G494 PolarHBondContact O-N 3.3Å; P492-Y551 HydrophobicContact CB-CD1 4.37Å; P492-Y551 HydrophobicContact CB-CE1 3.78Å; P492-Y551 HydrophobicContact CG-CE1 4.17Å
493	A	78.5	Confident	70.1	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.008	37%	0.366	C	S	.	.	B	Isolated β-bridge	trans	-53.5	129.5	179.9	0	0	0	0	0	112.5	K474 L497 Y498 Q548	K474-A493 WeakPolarHBondContact CE-O 3.46Å; A493-L497 HydrophobicContact CB-CB 4.44Å; A493-L497 HydrophobicContact CB-CD2 3.85Å; A493-L497 HydrophobicContact CB-CG 4.36Å; A493-Y498 HydrophobicContact CB-CD2 4.22Å; A493-Y498 HydrophobicContact CB-CE1 4.28Å; A493-Y498 HydrophobicContact CB-CE2 3.6Å; A493-Q548 HydrophobicContact CB-CG 4.37Å
494	G	80.2	Confident	72.3	Confident	5 Å²	5	61.1 Å²	61.1	5%	0.052	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-85.1	169.3	171	0	0	0	0	0	112.2	G472 P492 G496 L497 Y498	G472-G494 WeakPolarHBondContact O-CA 3.37Å; G472-G494 PolarHBondContact O-N 3.4Å; P492-G494 PolarHBondContact O-N 3.3Å; G494-G496 PolarHBondContact O-N 3.25Å; G494-L497 PolarHBondContact O-N 3.42Å; G494-L497 VanDerWaalsContact O-N 3.15Å; G494-Y498 WeakPolarHBondContact O-CD2 3.25Å; G494-Y498 PolarHBondContact O-N 3.35Å; G494-Y498 VanDerWaalsContact O-N 3.16Å
495	A	80.5	Confident	74.8	Confident	79 Å²	79	56.2 Å²	56.2	65%	0.653	31%	0.306	S	S	*	.	H	α-helix	trans	-58.8	-35	177.6	0	0	0	0	0	112.2	Y498 T499	A495-Y498 PolarHBondContact O-N 2.95Å; A495-T499 PolarHBondContact O-N 3.44Å; A495-T499 PolarHBondContact O-OG1 3.08Å
496	G	79.4	Confident	77.4	Confident	28 Å²	28	53.6 Å²	53.6	29%	0.289	29%	0.292	S	S	.	.	H	α-helix	trans	-60.7	-45.4	174.6	0	0	0	0	0	112.9	G494 T499 A500	G494-G496 PolarHBondContact O-N 3.25Å; G496-T499 WeakPolarHBondContact CA-OG1 3.47Å; G496-T499 PolarHBondContact O-N 2.84Å; G496-T499 PolarHBondContact O-OG1 3.17Å; G496-A500 WeakPolarHBondContact O-CB 3.36Å; G496-A500 PolarHBondContact O-N 3.16Å
497	L	84.6	Confident	79.6	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.01	25%	0.254	C	S	.	.	H	α-helix	trans	-64	-42.6	176.9	-177.1	54	0	0	0	111.9	L470 Y473 A493 G494 T499 A500 L501 V544	L470-L497 WeakPolarHBondContact O-CD1 3.4Å; Y473-L497 HydrophobicContact CD1-CD2 3.81Å; Y473-L497 HydrophobicContact CE1-CD2 3.38Å; Y473-L497 HydrophobicContact CE2-CD2 4.19Å; Y473-L497 HydrophobicContact CG-CD2 4.39Å; A493-L497 HydrophobicContact CB-CB 4.44Å; A493-L497 HydrophobicContact CB-CD2 3.85Å; A493-L497 HydrophobicContact CB-CG 4.36Å; G494-L497 PolarHBondContact O-N 3.42Å; G494-L497 VanDerWaalsContact O-N 3.15Å; L497-T499 VanDerWaalsContact C-N 3.33Å; L497-T499 PolarHBondContact O-N 3.28Å; L497-A500 PolarHBondContact O-N 2.93Å; L497-L501 HydrophobicContact CD1-CD1 4.47Å; L497-L501 HydrophobicContact CD1-CG 4.15Å; L497-L501 HydrophobicContact CG-CD1 4.21Å; L497-L501 HydrophobicContact CG-CG 4.38Å; L497-L501 VanDerWaalsContact O-CG 3.29Å; L497-L501 WeakPolarHBondContact O-CG 3.21Å; L497-L501 PolarHBondContact O-N 2.96Å; L497-V544 HydrophobicContact CD1-CG1 4.35Å; L497-V544 HydrophobicContact CD2-CG1 3.95Å; L497-V544 HydrophobicContact CG-CG1 4.37Å
498	Y	85.6	Confident	82	Confident	127 Å²	127	41.4 Å²	41.4	50%	0.498	23%	0.226	S	C	.	.	H	α-helix	trans	-61.4	-38.9	174.5	-72.3	-66.9	0	0	0	112.9	A493 G494 A495 W502	A493-Y498 HydrophobicContact CB-CD2 4.22Å; A493-Y498 HydrophobicContact CB-CE1 4.28Å; A493-Y498 HydrophobicContact CB-CE2 3.6Å; G494-Y498 WeakPolarHBondContact O-CD2 3.25Å; G494-Y498 PolarHBondContact O-N 3.35Å; G494-Y498 VanDerWaalsContact O-N 3.16Å; A495-Y498 PolarHBondContact O-N 2.95Å; Y498-W502 PolarHBondContact O-N 3.15Å; Y498-W502 VanDerWaalsContact O-N 3.14Å
499	T	87	Confident	83.9	Confident	72 Å²	72	44.7 Å²	44.7	44%	0.442	24%	0.243	S	C	.	.	H	α-helix	trans	-66.7	-38.8	173.9	45.4	0	0	0	0	112.3	A495 G496 L497 W502 Q503	A495-T499 PolarHBondContact O-N 3.44Å; A495-T499 PolarHBondContact O-OG1 3.08Å; G496-T499 WeakPolarHBondContact CA-OG1 3.47Å; G496-T499 PolarHBondContact O-N 2.84Å; G496-T499 PolarHBondContact O-OG1 3.17Å; L497-T499 VanDerWaalsContact C-N 3.33Å; L497-T499 PolarHBondContact O-N 3.28Å; T499-W502 PolarHBondContact O-N 3.15Å; T499-Q503 VanDerWaalsContact O-CG 3.31Å; T499-Q503 WeakPolarHBondContact O-CG 3.47Å; T499-Q503 PolarHBondContact O-N 2.79Å
500	A	86.4	Confident	85.6	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.4	-46.8	175.5	0	0	0	0	0	112	Y446 Q469 L470 G496 L497 W502 Q503 L504	Y446-A500 HydrophobicContact CE2-CB 4.37Å; Y446-A500 WeakPolarHBondContact OH-CB 3.48Å; Q469-A500 HydrophobicContact CB-CB 4.13Å; L470-A500 HydrophobicContact CD1-CB 4.26Å; G496-A500 WeakPolarHBondContact O-CB 3.36Å; G496-A500 PolarHBondContact O-N 3.16Å; L497-A500 PolarHBondContact O-N 2.93Å; A500-W502 VanDerWaalsContact C-N 3.3Å; A500-W502 PolarHBondContact O-N 3.46Å; A500-Q503 PolarHBondContact O-N 3.07Å; A500-Q503 VanDerWaalsContact O-N 3.17Å; A500-L504 WeakPolarHBondContact O-CB 3.36Å; A500-L504 WeakPolarHBondContact O-CG 3.43Å; A500-L504 PolarHBondContact O-N 3.46Å
501	L	89.8	Confident	87.1	Confident	34 Å²	34	44.5 Å²	44.5	18%	0.178	24%	0.235	C	C	.	.	H	α-helix	trans	-58.6	-40.3	176.6	-68.6	171.8	0	0	0	112	L497 L504 A505 L541 V544	L497-L501 HydrophobicContact CD1-CD1 4.47Å; L497-L501 HydrophobicContact CD1-CG 4.15Å; L497-L501 HydrophobicContact CG-CD1 4.21Å; L497-L501 HydrophobicContact CG-CG 4.38Å; L497-L501 VanDerWaalsContact O-CG 3.29Å; L497-L501 WeakPolarHBondContact O-CG 3.21Å; L497-L501 PolarHBondContact O-N 2.96Å; L501-L504 PolarHBondContact O-N 3.07Å; L501-A505 WeakPolarHBondContact O-CB 3.34Å; L501-A505 PolarHBondContact O-N 3.45Å; L501-L541 HydrophobicContact CB-CD2 4.27Å; L501-L541 HydrophobicContact CD2-CD2 3.71Å; L501-V544 HydrophobicContact CD1-CG1 4.01Å; L501-V544 HydrophobicContact CD2-CB 4.09Å; L501-V544 HydrophobicContact CD2-CG1 4.05Å; L501-V544 HydrophobicContact CD2-CG2 4.42Å
502	W	90.8	Very high	88.2	Confident	175 Å²	175	44.4 Å²	44.4	66%	0.663	24%	0.237	S	C	*	.	H	α-helix	trans	-66.9	-42.9	175.1	-179.1	-106.7	0	0	0	112.6	Y498 T499 A500 L504 A505 L506	Y498-W502 PolarHBondContact O-N 3.15Å; Y498-W502 VanDerWaalsContact O-N 3.14Å; T499-W502 PolarHBondContact O-N 3.15Å; A500-W502 VanDerWaalsContact C-N 3.3Å; A500-W502 PolarHBondContact O-N 3.46Å; W502-L504 VanDerWaalsContact C-N 3.34Å; W502-L504 PolarHBondContact O-N 3.11Å; W502-A505 PolarHBondContact O-N 3.28Å; W502-L506 HydrophobicContact CZ2-CD2 4.45Å; W502-L506 WeakPolarHBondContact O-CG 3.01Å; W502-L506 PolarHBondContact O-N 3.13Å
503	Q	91.2	Very high	89.1	Confident	54 Å²	54	48.3 Å²	48.3	25%	0.252	26%	0.256	S	S	.	.	H	α-helix	trans	-64.4	-37.2	175.2	-71.4	173.2	3.1	0	0	112.2	N444 S445 Y446 T499 A500 L506 A507	N444-Q503 PolarHBondContact ND2-O 3.27Å; S445-Q503 PolarHBondContact OG-OE1 3.35Å; Y446-Q503 HydrophobicContact CD2-CB 3.77Å; Y446-Q503 HydrophobicContact CE2-CB 3.85Å; T499-Q503 VanDerWaalsContact O-CG 3.31Å; T499-Q503 WeakPolarHBondContact O-CG 3.47Å; T499-Q503 PolarHBondContact O-N 2.79Å; A500-Q503 PolarHBondContact O-N 3.07Å; A500-Q503 VanDerWaalsContact O-N 3.17Å; Q503-L506 PolarHBondContact O-N 3.19Å; Q503-A507 WeakPolarHBondContact O-CB 3.4Å; Q503-A507 PolarHBondContact O-N 2.95Å
504	L	92.4	Very high	89.8	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-65.8	-41.7	172.7	-75.7	175.1	0	0	0	112	Y446 L458 L470 A500 L501 W502 L506 A507 L508 I537 L541	Y446-L504 HydrophobicContact CD1-CD2 3.87Å; Y446-L504 HydrophobicContact CD2-CD2 4.01Å; Y446-L504 HydrophobicContact CD2-CG 4.16Å; Y446-L504 HydrophobicContact CE1-CD2 4.33Å; Y446-L504 HydrophobicContact CE2-CD2 4.46Å; Y446-L504 HydrophobicContact CE2-CG 4.27Å; Y446-L504 HydrophobicContact CG-CD2 3.7Å; Y446-L504 HydrophobicContact CG-CG 4.35Å; L458-L504 HydrophobicContact CD1-CD2 4.21Å; L470-L504 HydrophobicContact CD1-CD1 4.2Å; A500-L504 WeakPolarHBondContact O-CB 3.36Å; A500-L504 WeakPolarHBondContact O-CG 3.43Å; A500-L504 PolarHBondContact O-N 3.46Å; L501-L504 PolarHBondContact O-N 3.07Å; W502-L504 VanDerWaalsContact C-N 3.34Å; W502-L504 PolarHBondContact O-N 3.11Å; L504-L506 PolarHBondContact O-N 3.11Å; L504-A507 CarbonylContact O-C 3.52Å; L504-A507 WeakPolarHBondContact O-CB 3.47Å; L504-A507 PolarHBondContact O-N 3.44Å; L504-L508 PolarHBondContact O-N 3.29Å; L504-I537 HydrophobicContact CB-CG2 4.14Å; L504-I537 HydrophobicContact CD2-CG1 4.44Å; L504-I537 HydrophobicContact CD2-CG2 4.36Å; L504-I537 WeakPolarHBondContact O-CG2 3.35Å; L504-L541 HydrophobicContact CB-CD2 4Å; L504-L541 HydrophobicContact CB-CG 4.45Å
505	A	93.6	Very high	90.4	Very high	31 Å²	31	48.5 Å²	48.5	26%	0.256	26%	0.255	S	S	.	.	H	α-helix	trans	-62.7	-40.8	175.4	0	0	0	0	0	112.2	L501 W502 L508 I509 L541	L501-A505 WeakPolarHBondContact O-CB 3.34Å; L501-A505 PolarHBondContact O-N 3.45Å; W502-A505 PolarHBondContact O-N 3.28Å; A505-L508 WeakPolarHBondContact O-CB 3.21Å; A505-L508 PolarHBondContact O-N 3.34Å; A505-I509 PolarHBondContact O-N 2.74Å; A505-L541 HydrophobicContact CB-CD1 4.46Å
506	L	93.3	Very high	91.1	Very high	81 Å²	81	45.8 Å²	45.8	42%	0.424	23%	0.231	S	C	.	.	H	α-helix	trans	-65.7	-39.9	171.6	-69.1	175.6	0	0	0	112	W502 Q503 L504 L508 I509 F510	W502-L506 HydrophobicContact CZ2-CD2 4.45Å; W502-L506 WeakPolarHBondContact O-CG 3.01Å; W502-L506 PolarHBondContact O-N 3.13Å; Q503-L506 PolarHBondContact O-N 3.19Å; L504-L506 PolarHBondContact O-N 3.11Å; L506-L508 VanDerWaalsContact C-N 3.34Å; L506-L508 PolarHBondContact O-N 3.43Å; L506-I509 PolarHBondContact O-N 2.91Å; L506-F510 WeakPolarHBondContact O-CB 3.47Å; L506-F510 PolarHBondContact O-N 3.29Å
507	A	92.8	Very high	91.7	Very high	0 Å²	0	47 Å²	47	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.2	-39.7	175.3	0	0	0	0	0	111.9	T447 Q503 L504 F510 K511 I537	T447-A507 HydrophobicContact CG2-CB 3.59Å; Q503-A507 WeakPolarHBondContact O-CB 3.4Å; Q503-A507 PolarHBondContact O-N 2.95Å; L504-A507 CarbonylContact O-C 3.52Å; L504-A507 WeakPolarHBondContact O-CB 3.47Å; L504-A507 PolarHBondContact O-N 3.44Å; A507-F510 PolarHBondContact O-N 3.25Å; A507-K511 VanDerWaalsContact O-CB 3.31Å; A507-K511 WeakPolarHBondContact O-CB 3.24Å; A507-K511 WeakPolarHBondContact O-CG 3.16Å; A507-K511 PolarHBondContact O-N 3.46Å; A507-I537 HydrophobicContact CB-CD1 4.39Å
508	L	94.9	Very high	92.1	Very high	24 Å²	24	46.9 Å²	46.9	13%	0.126	23%	0.229	C	C	.	.	H	α-helix	trans	-58.5	-52.4	177.1	-177.7	62	0	0	0	111.4	L504 A505 L506 F510 K511 I512 V534 I537 A538 L541	L504-L508 PolarHBondContact O-N 3.29Å; A505-L508 WeakPolarHBondContact O-CB 3.21Å; A505-L508 PolarHBondContact O-N 3.34Å; L506-L508 VanDerWaalsContact C-N 3.34Å; L506-L508 PolarHBondContact O-N 3.43Å; L508-F510 VanDerWaalsContact C-N 3.34Å; L508-F510 PolarHBondContact O-N 3.02Å; L508-K511 PolarHBondContact O-N 3.48Å; L508-I512 HydrophobicContact CD1-CD1 4.04Å; L508-I512 HydrophobicContact CG-CD1 4.01Å; L508-I512 WeakPolarHBondContact O-CB 3.36Å; L508-I512 WeakPolarHBondContact O-CG1 3.49Å; L508-I512 PolarHBondContact O-N 3.48Å; L508-V534 HydrophobicContact CD1-CG1 3.86Å; L508-V534 WeakPolarHBondContact CD1-O 3.28Å; L508-I537 HydrophobicContact CB-CG2 3.8Å; L508-I537 HydrophobicContact CD1-CB 4.22Å; L508-I537 HydrophobicContact CD1-CG2 4.24Å; L508-I537 HydrophobicContact CG-CG2 4.46Å; L508-A538 HydrophobicContact CD1-CB 4.38Å; L508-A538 HydrophobicContact CD2-CB 4.41Å; L508-L541 HydrophobicContact CD2-CD1 4.19Å
509	I	94.5	Very high	92.4	Very high	102 Å²	102	41.3 Å²	41.3	52%	0.523	21%	0.208	S	C	.	.	H	α-helix	trans	-60.7	-44.8	179.4	-63	168.6	0	0	0	110.4	A505 L506 L513	A505-I509 PolarHBondContact O-N 2.74Å; L506-I509 PolarHBondContact O-N 2.91Å; I509-L513 HydrophobicContact CG2-CD1 4.28Å; I509-L513 WeakPolarHBondContact O-CG 3.38Å; I509-L513 PolarHBondContact O-N 3.01Å; I509-L513 VanDerWaalsContact O-N 3.14Å
510	F	93.3	Very high	92.4	Very high	29 Å²	29	39.2 Å²	39.2	13%	0.127	20%	0.201	C	C	.	.	H	α-helix	trans	-64.5	-48.3	178.6	175.9	-112.2	0	0	0	112.5	T437 I440 A441 T447 L506 A507 L508 I512 L513 I514	T437-F510 HydrophobicContact CG2-CZ 4.21Å; I440-F510 HydrophobicContact CB-CD2 4.24Å; I440-F510 HydrophobicContact CB-CE2 3.63Å; I440-F510 HydrophobicContact CB-CZ 3.96Å; I440-F510 HydrophobicContact CD1-CE2 4.05Å; I440-F510 HydrophobicContact CG1-CE2 4.44Å; I440-F510 HydrophobicContact CG2-CD2 3.49Å; I440-F510 VanDerWaalsContact CG2-CD2 3.49Å; I440-F510 HydrophobicContact CG2-CE2 3.41Å; I440-F510 VanDerWaalsContact CG2-CE2 3.41Å; I440-F510 HydrophobicContact CG2-CG 4.12Å; I440-F510 HydrophobicContact CG2-CZ 3.97Å; A441-F510 HydrophobicContact CB-CE1 4.33Å; T447-F510 HydrophobicContact CG2-CD1 3.65Å; T447-F510 HydrophobicContact CG2-CE1 4.29Å; L506-F510 WeakPolarHBondContact O-CB 3.47Å; L506-F510 PolarHBondContact O-N 3.29Å; A507-F510 PolarHBondContact O-N 3.25Å; L508-F510 VanDerWaalsContact C-N 3.34Å; L508-F510 PolarHBondContact O-N 3.02Å; F510-I512 VanDerWaalsContact C-N 3.34Å; F510-I512 PolarHBondContact O-N 2.9Å; F510-L513 PolarHBondContact O-N 3.36Å; F510-I514 HydrophobicContact CE1-CG2 4.36Å; F510-I514 HydrophobicContact CE2-CB 4.36Å; F510-I514 HydrophobicContact CZ-CB 4.41Å; F510-I514 HydrophobicContact CZ-CG1 4.43Å; F510-I514 HydrophobicContact CZ-CG2 4.44Å; F510-I514 WeakPolarHBondContact O-CB 3.28Å; F510-I514 VanDerWaalsContact O-CG2 3.3Å; F510-I514 WeakPolarHBondContact O-CG2 3.49Å; F510-I514 PolarHBondContact O-N 2.87Å
511	K	93.8	Very high	92.6	Very high	21 Å²	21	39.4 Å²	39.4	9%	0.091	20%	0.202	C	C	.	.	H	α-helix	trans	-62	-40.8	178.9	-67.2	-77.9	-175.4	179.3	0	110.8	A507 L508 T515 V534 I537	A507-K511 VanDerWaalsContact O-CB 3.31Å; A507-K511 WeakPolarHBondContact O-CB 3.24Å; A507-K511 WeakPolarHBondContact O-CG 3.16Å; A507-K511 PolarHBondContact O-N 3.46Å; L508-K511 PolarHBondContact O-N 3.48Å; K511-T515 VanDerWaalsContact O-CB 3.26Å; K511-T515 WeakPolarHBondContact O-CB 3.45Å; K511-T515 PolarHBondContact O-N 3.09Å; K511-T515 PolarHBondContact O-OG1 3.27Å; K511-V534 HydrophobicContact CB-CG2 3.95Å; K511-I537 HydrophobicContact CG-CD1 4.4Å
512	I	94	Very high	92.6	Very high	38 Å²	38	42.1 Å²	42.1	20%	0.195	21%	0.212	C	C	.	.	H	α-helix	trans	-54.1	-53.6	172.7	-83.1	170	0	0	0	111.4	W402 L508 F510 V534	W402-I512 HydrophobicContact CD2-CG1 4.42Å; W402-I512 HydrophobicContact CE3-CG1 4.16Å; W402-I512 HydrophobicContact CE3-CG2 4.35Å; W402-I512 HydrophobicContact CH2-CB 4.01Å; W402-I512 HydrophobicContact CH2-CG1 3.94Å; W402-I512 HydrophobicContact CH2-CG2 3.87Å; W402-I512 WeakPolarHBondContact CH2-O 3.32Å; W402-I512 HydrophobicContact CZ2-CG1 4.18Å; W402-I512 HydrophobicContact CZ3-CB 4.11Å; W402-I512 HydrophobicContact CZ3-CG1 3.94Å; W402-I512 HydrophobicContact CZ3-CG2 3.57Å; L508-I512 HydrophobicContact CD1-CD1 4.04Å; L508-I512 HydrophobicContact CG-CD1 4.01Å; L508-I512 WeakPolarHBondContact O-CB 3.36Å; L508-I512 WeakPolarHBondContact O-CG1 3.49Å; L508-I512 PolarHBondContact O-N 3.48Å; F510-I512 VanDerWaalsContact C-N 3.34Å; F510-I512 PolarHBondContact O-N 2.9Å; I512-V534 HydrophobicContact CD1-CG1 4.22Å; I512-V534 HydrophobicContact CG1-CG1 3.77Å; I512-V534 HydrophobicContact CG1-CG2 4.25Å
513	L	93.9	Very high	92.7	Very high	111 Å²	111	33.9 Å²	33.9	58%	0.581	18%	0.181	S	C	*	.	H	α-helix	trans	-68.6	-44.8	-176.6	-67.6	173.4	0	0	0	112.2	I509 F510	I509-L513 HydrophobicContact CG2-CD1 4.28Å; I509-L513 WeakPolarHBondContact O-CG 3.38Å; I509-L513 PolarHBondContact O-N 3.01Å; I509-L513 VanDerWaalsContact O-N 3.14Å; F510-L513 PolarHBondContact O-N 3.36Å
514	I	93.5	Very high	92.8	Very high	10 Å²	10	31.3 Å²	31.3	5%	0.051	17%	0.169	C	C	.	.	H	α-helix	trans	-72.2	-34.9	-174.6	-159.7	58.9	0	0	0	111.9	V433 T437 F510 V516 I517 T518	V433-I514 HydrophobicContact CG1-CD1 4.11Å; T437-I514 HydrophobicContact CG2-CG1 4.37Å; T437-I514 WeakPolarHBondContact OG1-CD1 3.26Å; F510-I514 HydrophobicContact CE1-CG2 4.36Å; F510-I514 HydrophobicContact CE2-CB 4.36Å; F510-I514 HydrophobicContact CZ-CB 4.41Å; F510-I514 HydrophobicContact CZ-CG1 4.43Å; F510-I514 HydrophobicContact CZ-CG2 4.44Å; F510-I514 WeakPolarHBondContact O-CB 3.28Å; F510-I514 VanDerWaalsContact O-CG2 3.3Å; F510-I514 WeakPolarHBondContact O-CG2 3.49Å; F510-I514 PolarHBondContact O-N 2.87Å; I514-V516 VanDerWaalsContact C-N 3.3Å; I514-V516 PolarHBondContact O-N 3.32Å; I514-I517 PolarHBondContact O-N 3.17Å; I514-T518 HydrophobicContact CD1-CG2 4.41Å; I514-T518 HydrophobicContact CG1-CG2 3.99Å; I514-T518 WeakPolarHBondContact O-CG2 3.28Å; I514-T518 PolarHBondContact O-N 3.44Å; I514-T518 PolarHBondContact O-OG1 3.02Å
515	T	93.4	Very high	92.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.7	-35.5	179.2	-54.1	0	0	0	0	112.2	S277 F406 K511 I517 T518 F519 L527 P530	S277-T515 PolarHBondContact OG-OG1 3.41Å; F406-T515 HydrophobicContact CE2-CG2 3.83Å; F406-T515 HydrophobicContact CZ-CG2 4.44Å; K511-T515 VanDerWaalsContact O-CB 3.26Å; K511-T515 WeakPolarHBondContact O-CB 3.45Å; K511-T515 PolarHBondContact O-N 3.09Å; K511-T515 PolarHBondContact O-OG1 3.27Å; T515-I517 VanDerWaalsContact C-N 3.28Å; T515-I517 PolarHBondContact O-N 2.95Å; T515-T518 WeakPolarHBondContact CA-OG1 3.3Å; T515-T518 PolarHBondContact O-OG1 2.78Å; T515-F519 PolarHBondContact O-N 2.68Å; T515-L527 HydrophobicContact CG2-CD1 3.93Å; T515-P530 HydrophobicContact CG2-CB 3.54Å
516	V	94.5	Very high	92.7	Very high	22 Å²	22	29.9 Å²	29.9	13%	0.133	16%	0.157	C	C	.	.	H	α-helix	trans	-64.4	-33.5	174.9	173.7	0	0	0	0	111.8	W402 F406 A409 N410 I514	W402-V516 HydrophobicContact CH2-CG2 4.02Å; F406-V516 HydrophobicContact CD2-CG2 3.59Å; F406-V516 HydrophobicContact CE2-CG2 4Å; A409-V516 HydrophobicContact CB-CG1 3.76Å; A409-V516 HydrophobicContact CB-CG2 4.44Å; N410-V516 HydrophobicContact CB-CG1 4.49Å; N410-V516 PolarHBondContact OD1-O 3.07Å; I514-V516 VanDerWaalsContact C-N 3.3Å; I514-V516 PolarHBondContact O-N 3.32Å
517	I	93.1	Very high	92.7	Very high	52 Å²	52	26.1 Å²	26.1	27%	0.267	14%	0.138	S	C	.	.	H	α-helix	trans	-84.9	-37	-179.3	-61.7	170.2	0	0	0	110.8	W413 R417 V433 I514 T515	W413-I517 HydrophobicContact CZ2-CG2 4.21Å; R417-I517 PolarHBondContact NH1-O 3.22Å; R417-I517 PolarHBondContact NH2-O 3.36Å; V433-I517 HydrophobicContact CG1-CG2 4.2Å; V433-I517 HydrophobicContact CG2-CG2 3.83Å; I514-I517 PolarHBondContact O-N 3.17Å; T515-I517 VanDerWaalsContact C-N 3.28Å; T515-I517 PolarHBondContact O-N 2.95Å
518	T	92.4	Very high	92.8	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	14%	0.138	C	C	.	.	H	α-helix	trans	-73.3	-35.6	-175.1	54.1	0	0	0	0	113.4	L276 S277 V433 I514 T515 M521	L276-T518 HydrophobicContact CD2-CG2 4.11Å; S277-T518 PolarHBondContact O-OG1 3.08Å; V433-T518 HydrophobicContact CG1-CG2 3.99Å; I514-T518 HydrophobicContact CD1-CG2 4.41Å; I514-T518 HydrophobicContact CG1-CG2 3.99Å; I514-T518 WeakPolarHBondContact O-CG2 3.28Å; I514-T518 PolarHBondContact O-N 3.44Å; I514-T518 PolarHBondContact O-OG1 3.02Å; T515-T518 WeakPolarHBondContact CA-OG1 3.3Å; T515-T518 PolarHBondContact O-OG1 2.78Å; T518-M521 WeakPolarHBondContact CA-SD 3.35Å; T518-M521 HydrophobicContact CG2-SD 4.27Å; T518-M521 WeakPolarHBondContact O-CB 3.37Å; T518-M521 VanDerWaalsContact O-CG 3.27Å; T518-M521 WeakPolarHBondContact O-CG 3.42Å; T518-M521 PolarHBondContact O-N 2.76Å
519	F	91.6	Very high	92.7	Very high	9 Å²	9	25.5 Å²	25.5	4%	0.039	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.9	140.1	176.9	-162.9	-121.9	0	0	0	110.9	F406 N410 R417 T515 M521 L527 I630 H634	F406-F519 HydrophobicContact CZ-CB 4.21Å; F406-F519 HydrophobicContact CZ-CD1 4.19Å; F406-F519 HydrophobicContact CZ-CG 4.44Å; N410-F519 PolarHBondContact OD1-O 3.33Å; R417-F519 PolarHBondContact NH1-O 3.24Å; T515-F519 PolarHBondContact O-N 2.68Å; F519-M521 PolarHBondContact O-N 2.79Å; F519-L527 HydrophobicContact CD1-CD2 4.19Å; F519-L527 HydrophobicContact CD2-CB 4.18Å; F519-L527 HydrophobicContact CD2-CD1 4.37Å; F519-L527 HydrophobicContact CE1-CD2 3.98Å; F519-L527 HydrophobicContact CE2-CB 3.94Å; F519-L527 HydrophobicContact CE2-CD2 4.34Å; F519-L527 HydrophobicContact CG-CD1 4.32Å; F519-L527 HydrophobicContact CG-CD2 4.47Å; F519-L527 HydrophobicContact CZ-CB 4.37Å; F519-L527 HydrophobicContact CZ-CD2 4.07Å; F519-I630 HydrophobicContact CD1-CD1 4.32Å; F519-I630 HydrophobicContact CD1-CG1 4.3Å; F519-I630 HydrophobicContact CE1-CD1 4.01Å; F519-I630 HydrophobicContact CE1-CG1 3.64Å; F519-I630 HydrophobicContact CZ-CG1 4.46Å; F519-H634 AromaticContact CD1-NE2 3.65Å; F519-H634 AromaticContact CE1-CD2 3.73Å; F519-H634 AromaticContact CE1-CE1 3.89Å; F519-H634 AromaticContact CE1-NE2 3.27Å; F519-H634 VanDerWaalsContact CE1-NE2 3.27Å; F519-H634 WeakPolarHBondContact CE1-NE2 3.45Å
520	G	87.1	Confident	92.7	Very high	29 Å²	29	21 Å²	21	30%	0.299	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.2	9.8	-174.7	0	0	0	0	0	116.3
521	M	90.3	Very high	92.8	Very high	4 Å²	4	19.6 Å²	19.6	2%	0.02	11%	0.105	C	C	.	.	S	Bend	trans	-70	158.2	166.7	-70.9	172.1	60.1	0	0	111.6	L276 R417 V430 V433 T518 F519 V523	L276-M521 HydrophobicContact CD1-CE 4.25Å; L276-M521 HydrophobicContact CD2-CE 4.44Å; R417-M521 VanDerWaalsContact NH2-CG 3.3Å; V430-M521 HydrophobicContact CB-CE 3.84Å; V430-M521 HydrophobicContact CG1-CE 3.95Å; V430-M521 HydrophobicContact CG2-CE 3.53Å; V433-M521 HydrophobicContact CB-CE 3.98Å; V433-M521 HydrophobicContact CB-SD 4.16Å; V433-M521 HydrophobicContact CG1-CE 4.16Å; V433-M521 HydrophobicContact CG1-SD 3.84Å; V433-M521 HydrophobicContact CG2-CE 4.44Å; V433-M521 HydrophobicContact CG2-SD 4.34Å; T518-M521 WeakPolarHBondContact CA-SD 3.35Å; T518-M521 HydrophobicContact CG2-SD 4.27Å; T518-M521 WeakPolarHBondContact O-CB 3.37Å; T518-M521 VanDerWaalsContact O-CG 3.27Å; T518-M521 WeakPolarHBondContact O-CG 3.42Å; T518-M521 PolarHBondContact O-N 2.76Å; F519-M521 PolarHBondContact O-N 2.79Å; M521-V523 HydrophobicContact CB-CG2 3.98Å; M521-V523 PolarHBondContact O-N 3.25Å
522	K	90.1	Very high	92.8	Very high	90 Å²	90	18.7 Å²	18.7	39%	0.391	10%	0.102	S	C	.	.	S	Bend	trans	-79.2	49.1	179	-56.8	-164.7	-162.6	166.5	0	113.3	G423 P426	G423-K522 PolarHBondContact O-NZ 3.45Å; P426-K522 HydrophobicContact CB-CB 4.12Å; P426-K522 HydrophobicContact CB-CD 3.51Å; P426-K522 HydrophobicContact CB-CG 3.93Å; P426-K522 HydrophobicContact CG-CD 3.92Å
523	V	92.9	Very high	92.9	Very high	2 Å²	2	17 Å²	17	1%	0.012	9%	0.093	C	C	.	.	S	Bend	trans	-136.5	158.6	174.5	-67.7	0	0	0	0	109.4	V225 G237 L278 V430 M521 S525	V225-V523 HydrophobicContact CB-CG1 4.01Å; V225-V523 HydrophobicContact CG2-CG1 4.45Å; G237-V523 PolarHBondContact N-O 3.14Å; L278-V523 HydrophobicContact CD1-CG2 3.97Å; V430-V523 HydrophobicContact CG1-CG1 4.08Å; V430-V523 HydrophobicContact CG2-CG1 4.04Å; M521-V523 HydrophobicContact CB-CG2 3.98Å; M521-V523 PolarHBondContact O-N 3.25Å; V523-S525 PolarHBondContact O-N 3.34Å; V523-S525 PolarHBondContact O-OG 2.99Å
524	P	94.1	Very high	93	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.006	7%	0.066	C	C	.	.	B	Isolated β-bridge	trans	-62.6	129	173.7	-16.9	32.8	0	0	0	109.2	V228 K264 T267 L268 P283	V228-P524 HydrophobicContact CG2-CG 4.28Å; K264-P524 HydrophobicContact CG-CB 4.28Å; K264-P524 HydrophobicContact CG-CG 4.37Å; T267-P524 VanDerWaalsContact OG1-CG 3.24Å; T267-P524 WeakPolarHBondContact OG1-CG 3.32Å; L268-P524 HydrophobicContact CB-CB 4.38Å; L268-P524 HydrophobicContact CD1-CB 3.92Å; P283-P524 HydrophobicContact CG-CB 4.49Å
525	S	91.1	Very high	93.1	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.063	C	C	.	.			trans	-149.8	108.2	-166.4	35.2	0	0	0	0	111.8	G237 S238 V523	G237-S525 CarbonylContact C-O 3.56Å; G237-S525 VanDerWaalsContact CA-OG 3.31Å; G237-S525 WeakPolarHBondContact CA-OG 3.5Å; G237-S525 PolarHBondContact O-N 3.26Å; S238-S525 WeakPolarHBondContact CA-O 3.41Å; S238-S525 VanDerWaalsContact CB-O 3.3Å; S238-S525 WeakPolarHBondContact CB-O 3.39Å; S238-S525 PolarHBondContact N-O 2.99Å; V523-S525 PolarHBondContact O-N 3.34Å; V523-S525 PolarHBondContact O-OG 2.99Å
526	G	92.6	Very high	93.2	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.01	6%	0.064	C	C	.	.	B	Isolated β-bridge	trans	-91.8	147.3	168	0	0	0	0	0	111.8	G279 P283	G279-G526 PolarHBondContact N-O 2.83Å; G279-G526 WeakPolarHBondContact O-CA 3.27Å; G279-G526 PolarHBondContact O-N 3.19Å; P283-G526 VanDerWaalsContact CD-CA 3.42Å
527	L	93.3	Very high	93.2	Very high	2 Å²	2	10.2 Å²	10.2	1%	0.01	6%	0.057	C	C	.	.	S	Bend	trans	-103.6	-19.6	-174.6	-177.1	57.6	0	0	0	113.7	F406 T515 F519 P530 S531 V587 I630	F406-L527 HydrophobicContact CE1-CD1 4.02Å; F406-L527 HydrophobicContact CE1-CD2 3.71Å; F406-L527 HydrophobicContact CE1-CG 4.48Å; F406-L527 HydrophobicContact CE2-CD1 4.28Å; F406-L527 HydrophobicContact CZ-CD1 3.57Å; F406-L527 HydrophobicContact CZ-CD2 4.04Å; F406-L527 HydrophobicContact CZ-CG 4.46Å; T515-L527 HydrophobicContact CG2-CD1 3.93Å; F519-L527 HydrophobicContact CD1-CD2 4.19Å; F519-L527 HydrophobicContact CD2-CB 4.18Å; F519-L527 HydrophobicContact CD2-CD1 4.37Å; F519-L527 HydrophobicContact CE1-CD2 3.98Å; F519-L527 HydrophobicContact CE2-CB 3.94Å; F519-L527 HydrophobicContact CE2-CD2 4.34Å; F519-L527 HydrophobicContact CG-CD1 4.32Å; F519-L527 HydrophobicContact CG-CD2 4.47Å; F519-L527 HydrophobicContact CZ-CB 4.37Å; F519-L527 HydrophobicContact CZ-CD2 4.07Å; L527-P530 WeakPolarHBondContact O-CD 3.46Å; L527-S531 PolarHBondContact O-N 3.04Å; L527-S531 PolarHBondContact O-OG 2.79Å; L527-S531 VanDerWaalsContact O-OG 3.12Å; L527-V587 HydrophobicContact CD2-CG1 3.6Å; L527-V587 HydrophobicContact CG-CG1 4.17Å; L527-I630 HydrophobicContact CD2-CB 4.33Å; L527-I630 HydrophobicContact CD2-CG1 3.77Å; L527-I630 HydrophobicContact CD2-CG2 3.89Å
528	F	93.9	Very high	93.4	Very high	3 Å²	3	8.3 Å²	8.3	1%	0.013	5%	0.049	C	C	.	.	H	α-helix	trans	-57.5	-56.4	-174.2	-58.8	-29.8	0	0	0	113.3	I240 E281 F325 F334 S531 M532 L584 T588 Y631	I240-F528 HydrophobicContact CD1-CE2 4.25Å; I240-F528 HydrophobicContact CD1-CZ 3.82Å; E281-F528 HydrophobicContact CB-CD2 3.84Å; F325-F528 AromaticContact CE2-CD2 3.59Å; F325-F528 HydrophobicContact CE2-CD2 3.59Å; F325-F528 AromaticContact CE2-CE2 3.92Å; F325-F528 HydrophobicContact CE2-CE2 3.92Å; F325-F528 HydrophobicContact CE2-CG 4.47Å; F325-F528 HydrophobicContact CZ-CB 3.87Å; F325-F528 AromaticContact CZ-CD2 3.41Å; F325-F528 HydrophobicContact CZ-CD2 3.41Å; F325-F528 VanDerWaalsContact CZ-CD2 3.41Å; F325-F528 HydrophobicContact CZ-CE2 4.16Å; F325-F528 AromaticContact CZ-CG 3.88Å; F325-F528 HydrophobicContact CZ-CG 3.88Å; F334-F528 HydrophobicContact CE2-CE1 4.31Å; F334-F528 HydrophobicContact CE2-CE2 4.12Å; F334-F528 AromaticContact CE2-CZ 3.49Å; F334-F528 HydrophobicContact CE2-CZ 3.49Å; F334-F528 VanDerWaalsContact CE2-CZ 3.49Å; F334-F528 HydrophobicContact CZ-CE2 4.38Å; F334-F528 AromaticContact CZ-CZ 3.72Å; F334-F528 HydrophobicContact CZ-CZ 3.72Å; F528-S531 PolarHBondContact O-N 2.92Å; F528-M532 WeakPolarHBondContact O-CB 3.38Å; F528-M532 VanDerWaalsContact O-CG 3.32Å; F528-M532 WeakPolarHBondContact O-CG 3.48Å; F528-M532 PolarHBondContact O-N 3.44Å; F528-L584 HydrophobicContact CB-CD1 4.46Å; F528-L584 HydrophobicContact CD1-CD1 3.69Å; F528-L584 HydrophobicContact CE1-CD1 4.43Å; F528-L584 HydrophobicContact CG-CD1 4.46Å; F528-T588 HydrophobicContact CD1-CG2 4.25Å; F528-T588 HydrophobicContact CE1-CG2 3.95Å; F528-Y631 HydrophobicContact CE1-CE2 4.19Å; F528-Y631 WeakPolarHBondContact CE1-OH 3.25Å; F528-Y631 WeakPolarHBondContact CZ-OH 3.46Å
529	I	93.3	Very high	93.6	Very high	8 Å²	8	8.2 Å²	8.2	4%	0.041	5%	0.049	C	C	.	.	H	α-helix	trans	-59.3	-49.1	-178.7	-63.8	-78.2	0	0	0	111.9	E281 F376 I455 S531 M532 A533	E281-I529 HydrophobicContact CG-CD1 4.27Å; E281-I529 HydrophobicContact CG-CG1 3.91Å; F376-I529 HydrophobicContact CE1-CD1 3.97Å; F376-I529 HydrophobicContact CZ-CD1 4.29Å; I455-I529 HydrophobicContact CD1-CD1 4.15Å; I455-I529 HydrophobicContact CD1-CG2 4.11Å; I529-S531 PolarHBondContact O-N 3.25Å; I529-M532 HydrophobicContact CD1-CE 3.62Å; I529-M532 HydrophobicContact CG1-CE 4.26Å; I529-M532 PolarHBondContact O-N 3.5Å; I529-A533 WeakPolarHBondContact O-CB 3.36Å; I529-A533 PolarHBondContact O-N 3.38Å
530	P	94.6	Very high	93.6	Very high	7 Å²	7	8 Å²	8	5%	0.045	5%	0.048	C	C	.	.	H	α-helix	trans	-56	-44	173.5	-29.1	35.5	0	0	0	114.9	T515 L527 A533 V534	T515-P530 HydrophobicContact CG2-CB 3.54Å; L527-P530 WeakPolarHBondContact O-CD 3.46Å; P530-A533 PolarHBondContact O-N 2.88Å; P530-V534 PolarHBondContact O-N 3.28Å; P530-V534 VanDerWaalsContact O-N 3.14Å
531	S	94.8	Very high	93.9	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-68.5	-40.4	179.3	-60.6	0	0	0	0	112.6	L527 F528 I529 G535 C583	L527-S531 PolarHBondContact O-N 3.04Å; L527-S531 PolarHBondContact O-OG 2.79Å; L527-S531 VanDerWaalsContact O-OG 3.12Å; F528-S531 PolarHBondContact O-N 2.92Å; I529-S531 PolarHBondContact O-N 3.25Å; S531-G535 PolarHBondContact O-N 3.35Å; S531-C583 WeakPolarHBondContact O-CB 3.46Å
532	M	94.9	Very high	94.1	Very high	2 Å²	2	10.6 Å²	10.6	1%	0.01	5%	0.054	C	C	.	.	H	α-helix	trans	-64.4	-41	173.4	-70.8	-172.4	-50.1	0	0	111.4	F325 F376 I455 F528 I529 G535 A536 A580 L584 M598	F325-M532 HydrophobicContact CE1-CE 3.86Å; F325-M532 HydrophobicContact CE1-SD 4.21Å; F376-M532 HydrophobicContact CZ-CE 4.41Å; I455-M532 HydrophobicContact CD1-CB 3.8Å; I455-M532 HydrophobicContact CD1-CE 4.12Å; F528-M532 WeakPolarHBondContact O-CB 3.38Å; F528-M532 VanDerWaalsContact O-CG 3.32Å; F528-M532 WeakPolarHBondContact O-CG 3.48Å; F528-M532 PolarHBondContact O-N 3.44Å; I529-M532 HydrophobicContact CD1-CE 3.62Å; I529-M532 HydrophobicContact CG1-CE 4.26Å; I529-M532 PolarHBondContact O-N 3.5Å; M532-G535 CarbonylContact O-C 3.02Å; M532-G535 PolarHBondContact O-N 3.14Å; M532-A536 WeakPolarHBondContact O-CB 3.31Å; M532-A536 PolarHBondContact O-N 2.92Å; M532-A580 HydrophobicContact CB-CB 4.11Å; M532-A580 HydrophobicContact CG-CB 4.47Å; M532-A580 WeakPolarHBondContact O-CB 3.21Å; M532-L584 HydrophobicContact CG-CB 3.97Å; M532-L584 HydrophobicContact CG-CD2 3.6Å; M532-L584 HydrophobicContact CG-CG 4.32Å; M532-L584 HydrophobicContact SD-CD2 3.71Å; M532-M598 HydrophobicContact CG-CE 4.28Å; M532-M598 HydrophobicContact SD-CE 3.56Å; M532-M598 VanDerWaalsContact SD-CE 3.56Å
533	A	95	Very high	94.2	Very high	3 Å²	3	6.3 Å²	6.3	3%	0.025	4%	0.035	C	C	.	.	H	α-helix	trans	-63.4	-42.2	178.8	0	0	0	0	0	112.6	I455 I529 P530 G535 A536 I537	I455-A533 HydrophobicContact CD1-CB 4.28Å; I455-A533 HydrophobicContact CG1-CB 4.19Å; I529-A533 WeakPolarHBondContact O-CB 3.36Å; I529-A533 PolarHBondContact O-N 3.38Å; P530-A533 PolarHBondContact O-N 2.88Å; A533-G535 VanDerWaalsContact C-N 3.3Å; A533-G535 PolarHBondContact O-N 3.31Å; A533-A536 PolarHBondContact O-N 3.15Å; A533-I537 WeakPolarHBondContact O-CD1 3.33Å; A533-I537 VanDerWaalsContact O-CG1 3.22Å; A533-I537 WeakPolarHBondContact O-CG1 3.5Å; A533-I537 PolarHBondContact O-N 3.41Å
534	V	96.1	Very high	94	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	4%	0.035	C	C	.	.	H	α-helix	trans	-59.5	-43	173.5	169.5	0	0	0	0	110.9	W402 L508 K511 I512 P530 A538	W402-V534 HydrophobicContact CD2-CG1 4.33Å; W402-V534 HydrophobicContact CG-CG1 4.37Å; W402-V534 HydrophobicContact CZ2-CG1 4.4Å; W402-V534 HydrophobicContact CZ2-CG2 4.41Å; L508-V534 HydrophobicContact CD1-CG1 3.86Å; L508-V534 WeakPolarHBondContact CD1-O 3.28Å; K511-V534 HydrophobicContact CB-CG2 3.95Å; I512-V534 HydrophobicContact CD1-CG1 4.22Å; I512-V534 HydrophobicContact CG1-CG1 3.77Å; I512-V534 HydrophobicContact CG1-CG2 4.25Å; P530-V534 PolarHBondContact O-N 3.28Å; P530-V534 VanDerWaalsContact O-N 3.14Å; V534-A538 PolarHBondContact O-N 3.34Å
535	G	96.2	Very high	93.8	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-68.7	-40.2	176.6	0	0	0	0	0	114.3	S531 M532 A533 A538 G539 G579 C583	S531-G535 PolarHBondContact O-N 3.35Å; M532-G535 CarbonylContact O-C 3.02Å; M532-G535 PolarHBondContact O-N 3.14Å; A533-G535 VanDerWaalsContact C-N 3.3Å; A533-G535 PolarHBondContact O-N 3.31Å; G535-A538 PolarHBondContact O-N 3.21Å; G535-G539 PolarHBondContact O-N 2.79Å; G535-G579 VanDerWaalsContact CA-C 3.48Å; G535-G579 VanDerWaalsContact CA-O 3.22Å; G535-G579 WeakPolarHBondContact CA-O 3.26Å; G535-G579 CarbonylContact O-C 3.54Å; G535-G579 WeakPolarHBondContact O-CA 3.36Å; G535-C583 WeakPolarHBondContact CA-SG 3.29Å
536	A	95.4	Very high	93.6	Very high	1 Å²	1	9.8 Å²	9.8	1%	0.008	6%	0.063	C	C	.	.	H	α-helix	trans	-61.5	-45.9	177	0	0	0	0	0	110.8	L458 F459 M532 A533 G539 R540 A576 A580	L458-A536 HydrophobicContact CB-CB 4.35Å; L458-A536 VanDerWaalsContact CD2-C 3.46Å; L458-A536 HydrophobicContact CD2-CB 3.95Å; F459-A536 HydrophobicContact CE1-CB 4.01Å; M532-A536 WeakPolarHBondContact O-CB 3.31Å; M532-A536 PolarHBondContact O-N 2.92Å; A533-A536 PolarHBondContact O-N 3.15Å; A536-G539 PolarHBondContact O-N 2.93Å; A536-R540 WeakPolarHBondContact O-CB 3.3Å; A536-R540 PolarHBondContact O-N 2.92Å; A536-A576 WeakPolarHBondContact CA-O 3.42Å; A536-A580 HydrophobicContact CB-CB 4.22Å
537	I	95.4	Very high	93.3	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-62.6	-48.3	178	-62.6	160.8	0	0	0	110.6	L454 L458 L504 A507 L508 K511 A533 G539 R540 L541	L454-I537 HydrophobicContact CD2-CD1 4.35Å; L458-I537 VanDerWaalsContact CD2-CA 3.47Å; L458-I537 HydrophobicContact CD2-CB 4.14Å; L458-I537 HydrophobicContact CD2-CG1 3.65Å; L504-I537 HydrophobicContact CB-CG2 4.14Å; L504-I537 HydrophobicContact CD2-CG1 4.44Å; L504-I537 HydrophobicContact CD2-CG2 4.36Å; L504-I537 WeakPolarHBondContact O-CG2 3.35Å; A507-I537 HydrophobicContact CB-CD1 4.39Å; L508-I537 HydrophobicContact CB-CG2 3.8Å; L508-I537 HydrophobicContact CD1-CB 4.22Å; L508-I537 HydrophobicContact CD1-CG2 4.24Å; L508-I537 HydrophobicContact CG-CG2 4.46Å; K511-I537 HydrophobicContact CG-CD1 4.4Å; A533-I537 WeakPolarHBondContact O-CD1 3.33Å; A533-I537 VanDerWaalsContact O-CG1 3.22Å; A533-I537 WeakPolarHBondContact O-CG1 3.5Å; A533-I537 PolarHBondContact O-N 3.41Å; I537-G539 VanDerWaalsContact C-N 3.31Å; I537-G539 PolarHBondContact O-N 2.64Å; I537-R540 PolarHBondContact O-N 3.16Å; I537-L541 HydrophobicContact CG2-CD1 3.99Å; I537-L541 HydrophobicContact CG2-CG 4.4Å; I537-L541 WeakPolarHBondContact O-CB 3.21Å; I537-L541 WeakPolarHBondContact O-CG 3.39Å; I537-L541 PolarHBondContact O-N 2.97Å
538	A	96.4	Very high	93	Very high	11 Å²	11	11 Å²	11	9%	0.091	7%	0.068	C	C	.	.	H	α-helix	trans	-61.6	-39.8	177	0	0	0	0	0	112.4	F398 L508 V534 G535 L542	F398-A538 HydrophobicContact CD1-CB 3.89Å; F398-A538 HydrophobicContact CE1-CB 3.39Å; F398-A538 HydrophobicContact CZ-CB 3.95Å; L508-A538 HydrophobicContact CD1-CB 4.38Å; L508-A538 HydrophobicContact CD2-CB 4.41Å; V534-A538 PolarHBondContact O-N 3.34Å; G535-A538 PolarHBondContact O-N 3.21Å; A538-L542 PolarHBondContact O-N 2.96Å
539	G	95.6	Very high	92.6	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-63.1	-50.7	175.2	0	0	0	0	0	112.9	G535 A536 I537 L541 L542 G543 Y575	G535-G539 PolarHBondContact O-N 2.79Å; A536-G539 PolarHBondContact O-N 2.93Å; I537-G539 VanDerWaalsContact C-N 3.31Å; I537-G539 PolarHBondContact O-N 2.64Å; G539-L541 VanDerWaalsContact C-N 3.35Å; G539-L541 PolarHBondContact O-N 3.18Å; G539-L542 PolarHBondContact O-N 3.43Å; G539-L542 VanDerWaalsContact O-N 3.17Å; G539-G543 PolarHBondContact O-N 3.42Å; G539-Y575 VanDerWaalsContact CA-O 3.22Å; G539-Y575 WeakPolarHBondContact CA-O 3.33Å; G539-Y575 VanDerWaalsContact O-CB 3.31Å; G539-Y575 WeakPolarHBondContact O-CB 3.17Å
540	R	93.3	Very high	92.1	Very high	4 Å²	4	13.6 Å²	13.6	2%	0.015	8%	0.082	C	C	.	.	H	α-helix	trans	-63.5	-39.4	178.8	-167.5	64.5	175.5	-138.8	6.4	111.9	L458 N460 L470 A536 I537 G543 V544 P572 A576	L458-R540 HydrophobicContact CD2-CB 4.07Å; L458-R540 HydrophobicContact CG-CB 4.23Å; L458-R540 HydrophobicContact CG-CG 4.34Å; L458-R540 PolarHBondContact O-NH1 3.15Å; N460-R540 PolarHBondContact O-NH1 3.07Å; N460-R540 PolarHBondContact O-NH2 3.41Å; L470-R540 HydrophobicContact CD2-CG 4.23Å; A536-R540 WeakPolarHBondContact O-CB 3.3Å; A536-R540 PolarHBondContact O-N 2.92Å; I537-R540 PolarHBondContact O-N 3.16Å; R540-G543 PolarHBondContact O-N 2.99Å; R540-V544 WeakPolarHBondContact O-CG2 3.47Å; R540-V544 PolarHBondContact O-N 2.99Å; R540-P572 WeakPolarHBondContact CD-O 3.23Å; R540-A576 HydrophobicContact CB-CB 4.03Å
541	L	93.7	Very high	91.4	Very high	43 Å²	43	17.4 Å²	17.4	23%	0.225	10%	0.096	C	C	.	.	H	α-helix	trans	-60.4	-42.5	173.5	-72.9	172.9	0	0	0	111.8	L501 L504 A505 L508 I537 G539 G545	L501-L541 HydrophobicContact CB-CD2 4.27Å; L501-L541 HydrophobicContact CD2-CD2 3.71Å; L504-L541 HydrophobicContact CB-CD2 4Å; L504-L541 HydrophobicContact CB-CG 4.45Å; A505-L541 HydrophobicContact CB-CD1 4.46Å; L508-L541 HydrophobicContact CD2-CD1 4.19Å; I537-L541 HydrophobicContact CG2-CD1 3.99Å; I537-L541 HydrophobicContact CG2-CG 4.4Å; I537-L541 WeakPolarHBondContact O-CB 3.21Å; I537-L541 WeakPolarHBondContact O-CG 3.39Å; I537-L541 PolarHBondContact O-N 2.97Å; G539-L541 VanDerWaalsContact C-N 3.35Å; G539-L541 PolarHBondContact O-N 3.18Å; L541-G545 PolarHBondContact O-N 3.2Å; L541-G545 VanDerWaalsContact O-N 3.15Å
542	L	94	Very high	90.8	Very high	44 Å²	44	23.7 Å²	23.7	23%	0.23	12%	0.121	C	C	.	.	H	α-helix	trans	-71	-41.4	175.8	-173.6	66.1	0	0	0	112.1	P391 L394 L395 A538 G539 G545 M546 Y575	P391-L542 HydrophobicContact CB-CD2 3.87Å; L394-L542 HydrophobicContact CD2-CD2 4.04Å; L395-L542 HydrophobicContact CD1-CD2 4.06Å; L395-L542 HydrophobicContact CD2-CB 4.17Å; L395-L542 HydrophobicContact CD2-CD2 3.66Å; L395-L542 HydrophobicContact CG-CD2 3.56Å; A538-L542 PolarHBondContact O-N 2.96Å; G539-L542 PolarHBondContact O-N 3.43Å; G539-L542 VanDerWaalsContact O-N 3.17Å; L542-G545 CarbonylContact O-C 3.58Å; L542-G545 WeakPolarHBondContact O-CA 3.34Å; L542-G545 PolarHBondContact O-N 3.14Å; L542-G545 VanDerWaalsContact O-N 3.15Å; L542-M546 HydrophobicContact CD1-CG 4.48Å; L542-M546 HydrophobicContact CG-CG 4.37Å; L542-M546 WeakPolarHBondContact O-CG 3.45Å; L542-M546 PolarHBondContact O-N 3.41Å; L542-Y575 HydrophobicContact CD2-CD1 4.42Å; L542-Y575 HydrophobicContact CG-CD1 4.4Å
543	G	91	Very high	90.3	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-60	-51.9	180	0	0	0	0	0	112.2	G539 R540 G545 M546 E547	G539-G543 PolarHBondContact O-N 3.42Å; R540-G543 PolarHBondContact O-N 2.99Å; G543-G545 VanDerWaalsContact C-N 3.26Å; G543-G545 PolarHBondContact O-N 3.36Å; G543-M546 PolarHBondContact O-N 2.86Å; G543-M546 VanDerWaalsContact O-N 3.14Å; G543-E547 WeakPolarHBondContact O-CB 3.32Å; G543-E547 PolarHBondContact O-N 3.37Å
544	V	89.2	Confident	89.3	Confident	2 Å²	2	30 Å²	30	1%	0.012	15%	0.152	C	C	.	.	H	α-helix	trans	-63.2	-34.4	173.8	178.3	0	0	0	0	111	L497 L501 R540 Q548 P572	L497-V544 HydrophobicContact CD1-CG1 4.35Å; L497-V544 HydrophobicContact CD2-CG1 3.95Å; L497-V544 HydrophobicContact CG-CG1 4.37Å; L501-V544 HydrophobicContact CD1-CG1 4.01Å; L501-V544 HydrophobicContact CD2-CB 4.09Å; L501-V544 HydrophobicContact CD2-CG1 4.05Å; L501-V544 HydrophobicContact CD2-CG2 4.42Å; R540-V544 WeakPolarHBondContact O-CG2 3.47Å; R540-V544 PolarHBondContact O-N 2.99Å; V544-Q548 HydrophobicContact CG1-CG 4.29Å; V544-Q548 WeakPolarHBondContact O-CB 3.42Å; V544-Q548 VanDerWaalsContact O-CG 3.25Å; V544-Q548 WeakPolarHBondContact O-CG 3.22Å; V544-Q548 PolarHBondContact O-N 3.44Å; V544-P572 HydrophobicContact CG2-CB 3.87Å; V544-P572 HydrophobicContact CG2-CG 4.15Å
545	G	89.5	Confident	88.1	Confident	41 Å²	41	35.8 Å²	35.8	42%	0.423	18%	0.183	S	C	.	.	H	α-helix	trans	-61.5	-41.8	172.8	0	0	0	0	0	113.4	L541 L542 G543 L549	L541-G545 PolarHBondContact O-N 3.2Å; L541-G545 VanDerWaalsContact O-N 3.15Å; L542-G545 CarbonylContact O-C 3.58Å; L542-G545 WeakPolarHBondContact O-CA 3.34Å; L542-G545 PolarHBondContact O-N 3.14Å; L542-G545 VanDerWaalsContact O-N 3.15Å; G543-G545 VanDerWaalsContact C-N 3.26Å; G543-G545 PolarHBondContact O-N 3.36Å; G545-L549 VanDerWaalsContact O-CB 3.28Å; G545-L549 WeakPolarHBondContact O-CB 3.49Å; G545-L549 PolarHBondContact O-N 2.91Å
546	M	88.1	Confident	87.3	Confident	34 Å²	34	42.1 Å²	42.1	17%	0.167	21%	0.207	C	C	.	.	H	α-helix	trans	-72	-42.8	177.7	-73.5	-62.9	-57.1	0	0	112.1	P391 L542 G543 L549 A550 F559 I570 Y575	P391-M546 HydrophobicContact CB-CG 4.38Å; P391-M546 HydrophobicContact CB-SD 4.38Å; P391-M546 HydrophobicContact CG-CE 4.16Å; P391-M546 HydrophobicContact CG-SD 4.4Å; L542-M546 HydrophobicContact CD1-CG 4.48Å; L542-M546 HydrophobicContact CG-CG 4.37Å; L542-M546 WeakPolarHBondContact O-CG 3.45Å; L542-M546 PolarHBondContact O-N 3.41Å; G543-M546 PolarHBondContact O-N 2.86Å; G543-M546 VanDerWaalsContact O-N 3.14Å; M546-L549 WeakPolarHBondContact O-CB 3.36Å; M546-L549 PolarHBondContact O-N 3.07Å; M546-L549 HydrophobicContact SD-CD2 4.3Å; M546-A550 WeakPolarHBondContact O-CB 3.28Å; M546-A550 PolarHBondContact O-N 2.85Å; M546-F559 HydrophobicContact CE-CE1 4.32Å; M546-F559 HydrophobicContact CE-CZ 4.15Å; M546-I570 HydrophobicContact CB-CD1 4.11Å; M546-I570 HydrophobicContact CB-CG2 4.38Å; M546-Y575 HydrophobicContact CB-CE1 4.42Å; M546-Y575 HydrophobicContact CG-CE1 4.04Å
547	E	85.6	Confident	86.1	Confident	7 Å²	7	49.3 Å²	49.3	3%	0.033	24%	0.244	C	C	.	.	H	α-helix	trans	-54	-53.4	173.1	-173	-145.9	141.6	0	0	110.8	Y473 G543 L549 A550 Y551 I570 P572	Y473-E547 WeakPolarHBondContact CE1-OE1 3.16Å; Y473-E547 PolarHBondContact OH-OE1 2.88Å; Y473-E547 PolarHBondContact OH-OE2 3.4Å; G543-E547 WeakPolarHBondContact O-CB 3.32Å; G543-E547 PolarHBondContact O-N 3.37Å; E547-L549 VanDerWaalsContact C-N 3.34Å; E547-L549 PolarHBondContact O-N 2.85Å; E547-A550 PolarHBondContact O-N 3.38Å; E547-Y551 PolarHBondContact O-N 3.4Å; E547-I570 HydrophobicContact CB-CB 4.46Å; E547-I570 HydrophobicContact CB-CG2 4.34Å; E547-P572 HydrophobicContact CB-CG 4.45Å; E547-P572 WeakPolarHBondContact OE2-CG 3.27Å
548	Q	86.3	Confident	85.2	Confident	20 Å²	20	52.3 Å²	52.3	9%	0.093	26%	0.26	C	S	.	.	H	α-helix	trans	-66.5	-34.2	178.2	-62.9	-60.2	-65.6	0	0	112.4	R491 A493 V544 Y552	R491-Q548 PolarHBondContact O-NE2 2.87Å; A493-Q548 HydrophobicContact CB-CG 4.37Å; V544-Q548 HydrophobicContact CG1-CG 4.29Å; V544-Q548 WeakPolarHBondContact O-CB 3.42Å; V544-Q548 VanDerWaalsContact O-CG 3.25Å; V544-Q548 WeakPolarHBondContact O-CG 3.22Å; V544-Q548 PolarHBondContact O-N 3.44Å; Q548-Y552 WeakPolarHBondContact O-CD2 3.02Å; Q548-Y552 PolarHBondContact O-N 3.25Å; Q548-Y552 VanDerWaalsContact O-N 3.16Å
549	L	86.4	Confident	84.1	Confident	67 Å²	67	52 Å²	52	35%	0.351	26%	0.257	S	S	.	.	H	α-helix	trans	-64.2	-42.8	175.2	-178.5	67.2	0	0	0	111.7	G545 M546 E547 N553 F559	G545-L549 VanDerWaalsContact O-CB 3.28Å; G545-L549 WeakPolarHBondContact O-CB 3.49Å; G545-L549 PolarHBondContact O-N 2.91Å; M546-L549 WeakPolarHBondContact O-CB 3.36Å; M546-L549 PolarHBondContact O-N 3.07Å; M546-L549 HydrophobicContact SD-CD2 4.3Å; E547-L549 VanDerWaalsContact C-N 3.34Å; E547-L549 PolarHBondContact O-N 2.85Å; L549-N553 WeakPolarHBondContact O-CB 3.43Å; L549-N553 PolarHBondContact O-N 2.93Å; L549-N553 PolarHBondContact O-ND2 3.21Å; L549-F559 HydrophobicContact CD2-CE2 4.46Å; L549-F559 HydrophobicContact CD2-CZ 4.3Å; L549-F559 HydrophobicContact CG-CE2 4.23Å; L549-F559 HydrophobicContact CG-CZ 4.35Å
550	A	82.5	Confident	82.9	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.3	-46.8	176.3	0	0	0	0	0	111.2	M546 E547 Y552 N553 H554 F559 I570	M546-A550 WeakPolarHBondContact O-CB 3.28Å; M546-A550 PolarHBondContact O-N 2.85Å; E547-A550 PolarHBondContact O-N 3.38Å; A550-Y552 PolarHBondContact O-N 3.16Å; A550-N553 CarbonylContact O-C 3.44Å; A550-N553 PolarHBondContact O-N 3.03Å; A550-N553 VanDerWaalsContact O-N 3.13Å; A550-H554 PolarHBondContact O-N 3.16Å; A550-H554 VanDerWaalsContact O-N 3.09Å; A550-F559 HydrophobicContact CB-CD1 3.82Å; A550-F559 HydrophobicContact CB-CE1 3.79Å; A550-F559 HydrophobicContact CB-CE2 4.49Å; A550-F559 HydrophobicContact CB-CG 4.2Å; A550-F559 HydrophobicContact CB-CZ 4.14Å; A550-I570 HydrophobicContact CB-CD1 3.72Å
551	Y	80.6	Confident	81.7	Confident	87 Å²	87	64.5 Å²	64.5	34%	0.341	33%	0.329	S	S	.	.	H	α-helix	trans	-54	-48.2	177.6	-177.2	-92	0	0	0	112.6	D490 P492 E547	D490-Y551 HydrophobicContact CB-CD2 4.13Å; D490-Y551 WeakPolarHBondContact O-CD2 3.49Å; D490-Y551 VanDerWaalsContact O-CE2 3.29Å; D490-Y551 WeakPolarHBondContact O-CE2 3.21Å; P492-Y551 HydrophobicContact CB-CD1 4.37Å; P492-Y551 HydrophobicContact CB-CE1 3.78Å; P492-Y551 HydrophobicContact CG-CE1 4.17Å; E547-Y551 PolarHBondContact O-N 3.4Å
552	Y	82.6	Confident	80.8	Confident	132 Å²	132	65.4 Å²	65.4	52%	0.518	33%	0.329	S	S	.	.	H	α-helix	trans	-77.8	-16.4	-179.7	-75.1	-65	0	0	0	114.6	Q548 A550	Q548-Y552 WeakPolarHBondContact O-CD2 3.02Å; Q548-Y552 PolarHBondContact O-N 3.25Å; Q548-Y552 VanDerWaalsContact O-N 3.16Å; A550-Y552 PolarHBondContact O-N 3.16Å
553	N	82.5	Confident	79.7	Confident	69 Å²	69	63.9 Å²	63.9	37%	0.369	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-132.3	38.3	-171.7	-56.7	-89.3	0	0	0	113.2	L549 A550 D555 W556	L549-N553 WeakPolarHBondContact O-CB 3.43Å; L549-N553 PolarHBondContact O-N 2.93Å; L549-N553 PolarHBondContact O-ND2 3.21Å; A550-N553 CarbonylContact O-C 3.44Å; A550-N553 PolarHBondContact O-N 3.03Å; A550-N553 VanDerWaalsContact O-N 3.13Å; N553-D555 PolarHBondContact O-N 3.4Å; N553-D555 VanDerWaalsContact O-N 3.09Å; N553-W556 HydrophobicContact CB-CB 4.22Å; N553-W556 VanDerWaalsContact O-CB 3.29Å; N553-W556 WeakPolarHBondContact O-CB 3.25Å; N553-W556 PolarHBondContact O-N 2.82Å
554	H	73.9	Confident	78.4	Confident	69 Å²	69	67 Å²	67	32%	0.319	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-31	180	60.8	70.1	0	0	0	114.1	A550 W556 P565	A550-H554 PolarHBondContact O-N 3.16Å; A550-H554 VanDerWaalsContact O-N 3.09Å; H554-W556 VanDerWaalsContact C-N 3.3Å; H554-W556 PolarHBondContact O-N 3.14Å; H554-P565 HydrophobicContact CB-CG 4.29Å
555	D	71.4	Confident	77.1	Confident	121 Å²	121	71.7 Å²	71.7	65%	0.647	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-11.4	179.4	-72.4	-24	0	0	0	114	N553	N553-D555 PolarHBondContact O-N 3.4Å; N553-D555 VanDerWaalsContact O-N 3.09Å
556	W	79.9	Confident	75.5	Confident	132 Å²	132	72 Å²	72	50%	0.5	38%	0.377	S	S	.	.	S	Bend	trans	-68.4	142	-179.4	-166.4	20.1	0	0	0	110.4	N553 H554 I558 F559 R560	N553-W556 HydrophobicContact CB-CB 4.22Å; N553-W556 VanDerWaalsContact O-CB 3.29Å; N553-W556 WeakPolarHBondContact O-CB 3.25Å; N553-W556 PolarHBondContact O-N 2.82Å; H554-W556 VanDerWaalsContact C-N 3.3Å; H554-W556 PolarHBondContact O-N 3.14Å; W556-I558 HydrophobicContact CD2-CD1 4.02Å; W556-I558 HydrophobicContact CD2-CG1 4.25Å; W556-I558 HydrophobicContact CE3-CD1 4.04Å; W556-I558 HydrophobicContact CH2-CD1 3.76Å; W556-I558 HydrophobicContact CZ2-CD1 3.72Å; W556-I558 HydrophobicContact CZ3-CD1 3.92Å; W556-I558 PolarHBondContact O-N 3.15Å; W556-F559 HydrophobicContact CB-CD2 4.47Å; W556-F559 HydrophobicContact CE3-CD2 4.43Å; W556-F559 HydrophobicContact CE3-CE2 4.06Å; W556-F559 PolarHBondContact O-N 3.15Å; W556-R560 WeakPolarHBondContact O-CB 3.47Å; W556-R560 PolarHBondContact O-N 3.37Å
557	L	70.7	Confident	74.2	Confident	152 Å²	152	72 Å²	72	80%	0.796	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	-17.9	-173.3	-148.2	144.3	0	0	0	114
558	I	75.3	Confident	73.3	Confident	64 Å²	64	74.9 Å²	74.9	33%	0.328	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-44.6	174.9	-56.1	178.5	0	0	0	111.6	L387 W556 W562	L387-I558 HydrophobicContact CD1-CG2 4.17Å; L387-I558 WeakPolarHBondContact CD1-O 3.42Å; W556-I558 HydrophobicContact CD2-CD1 4.02Å; W556-I558 HydrophobicContact CD2-CG1 4.25Å; W556-I558 HydrophobicContact CE3-CD1 4.04Å; W556-I558 HydrophobicContact CH2-CD1 3.76Å; W556-I558 HydrophobicContact CZ2-CD1 3.72Å; W556-I558 HydrophobicContact CZ3-CD1 3.92Å; W556-I558 PolarHBondContact O-N 3.15Å; I558-W562 WeakPolarHBondContact O-CZ2 3.31Å; I558-W562 PolarHBondContact O-NE1 2.79Å
559	F	75.1	Confident	72.8	Confident	5 Å²	5	74.5 Å²	74.5	2%	0.022	40%	0.398	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-21.2	-174.1	-58.8	-66.6	0	0	0	113.3	M546 L549 A550 W556 G561 W562 C563 I570	M546-F559 HydrophobicContact CE-CE1 4.32Å; M546-F559 HydrophobicContact CE-CZ 4.15Å; L549-F559 HydrophobicContact CD2-CE2 4.46Å; L549-F559 HydrophobicContact CD2-CZ 4.3Å; L549-F559 HydrophobicContact CG-CE2 4.23Å; L549-F559 HydrophobicContact CG-CZ 4.35Å; A550-F559 HydrophobicContact CB-CD1 3.82Å; A550-F559 HydrophobicContact CB-CE1 3.79Å; A550-F559 HydrophobicContact CB-CE2 4.49Å; A550-F559 HydrophobicContact CB-CG 4.2Å; A550-F559 HydrophobicContact CB-CZ 4.14Å; W556-F559 HydrophobicContact CB-CD2 4.47Å; W556-F559 HydrophobicContact CE3-CD2 4.43Å; W556-F559 HydrophobicContact CE3-CE2 4.06Å; W556-F559 PolarHBondContact O-N 3.15Å; F559-G561 PolarHBondContact O-N 3.02Å; F559-G561 VanDerWaalsContact O-N 3.15Å; F559-W562 HydrophobicContact CD1-CH2 4.44Å; F559-W562 HydrophobicContact CD1-CZ2 4.18Å; F559-W562 PolarHBondContact O-N 3Å; F559-C563 HydrophobicContact CB-CB 4.36Å; F559-C563 PolarHBondContact O-N 3.38Å; F559-C563 VanDerWaalsContact O-N 3.15Å; F559-I570 HydrophobicContact CE1-CD1 4.37Å
560	R	69	Low	72.6	Confident	184 Å²	184	71.7 Å²	71.7	69%	0.694	38%	0.383	S	S	*	.	B	Isolated β-bridge	trans	-58.7	113.8	-177.3	-175.3	176.1	-178	177.7	1.6	112.4	W556	W556-R560 WeakPolarHBondContact O-CB 3.47Å; W556-R560 PolarHBondContact O-N 3.37Å
561	G	67.9	Low	72.8	Confident	81 Å²	81	72.6 Å²	72.6	84%	0.835	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	108.7	-9.2	169.2	0	0	0	0	0	115.7	F559	F559-G561 PolarHBondContact O-N 3.02Å; F559-G561 VanDerWaalsContact O-N 3.15Å
562	W	74.6	Confident	73.1	Confident	63 Å²	63	69 Å²	69	24%	0.239	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	-29.6	173.8	55.4	-73.7	0	0	0	112.6	H385 L387 E388 I558 F559	H385-W562 HydrophobicContact CB-CD2 4.2Å; H385-W562 HydrophobicContact CB-CE3 3.56Å; H385-W562 HydrophobicContact CB-CH2 3.9Å; H385-W562 HydrophobicContact CB-CZ3 3.39Å; H385-W562 AromaticContact CD2-CE3 3.29Å; H385-W562 AromaticContact CD2-CZ3 3.55Å; H385-W562 AromaticContact CE1-CE3 3.96Å; H385-W562 AromaticContact CG-CD2 3.98Å; H385-W562 AromaticContact CG-CE3 3.22Å; H385-W562 AromaticContact CG-CZ3 3.52Å; H385-W562 AromaticContact ND1-CE3 3.67Å; H385-W562 AromaticContact NE2-CE3 3.76Å; L387-W562 HydrophobicContact CB-CH2 4.3Å; L387-W562 HydrophobicContact CB-CZ2 3.84Å; L387-W562 HydrophobicContact CD1-CZ2 3.77Å; L387-W562 HydrophobicContact CG-CZ2 4.4Å; E388-W562 HydrophobicContact CG-CH2 4.06Å; E388-W562 HydrophobicContact CG-CZ3 4.33Å; I558-W562 WeakPolarHBondContact O-CZ2 3.31Å; I558-W562 PolarHBondContact O-NE1 2.79Å; F559-W562 HydrophobicContact CD1-CH2 4.44Å; F559-W562 HydrophobicContact CD1-CZ2 4.18Å; F559-W562 PolarHBondContact O-N 3Å
563	C	71.5	Confident	73.3	Confident	12 Å²	12	62.7 Å²	62.7	8%	0.081	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-98.1	122.1	164.1	-173.7	0	0	0	0	110.8	F559 C569	F559-C563 HydrophobicContact CB-CB 4.36Å; F559-C563 PolarHBondContact O-N 3.38Å; F559-C563 VanDerWaalsContact O-N 3.15Å; C563-C569 WeakPolarHBondContact CA-SG 3.4Å; C563-C569 HydrophobicContact CB-CB 3.72Å; C563-C569 WeakPolarHBondContact CB-SG 3.25Å; C563-C569 WeakPolarHBondContact SG-CB 3.32Å; C563-C569 CovalentContact SG-SG 2.04Å; C563-C569 PolarHBondContact SG-SG 3.43Å
564	S	64.8	Low	73.7	Confident	65 Å²	65	59.5 Å²	59.5	46%	0.455	33%	0.334	S	S	.	.			trans	-115	143.1	173.1	56.4	0	0	0	0	110.3	G566 A567	S564-G566 PolarHBondContact O-N 3.17Å; S564-A567 PolarHBondContact O-N 3.44Å; S564-A567 WeakPolarHBondContact OG-CB 3.35Å
565	P	60.6	Low	74.6	Confident	101 Å²	101	56.2 Å²	56.2	66%	0.656	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.4	112.7	178.3	-25.7	34.7	0	0	0	111.9	H554	H554-P565 HydrophobicContact CB-CG 4.29Å
566	G	56.7	Low	75.7	Confident	46 Å²	46	50.4 Å²	50.4	47%	0.474	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.6	14.2	-179.9	0	0	0	0	0	116.4	A489 S564	A489-G566 WeakPolarHBondContact CB-O 3.43Å; S564-G566 PolarHBondContact O-N 3.17Å
567	A	61.4	Low	76.3	Confident	36 Å²	36	44.3 Å²	44.3	30%	0.298	27%	0.265	S	S	.	.	S	Bend	trans	-103.2	155.9	162.2	0	0	0	0	0	110.3	S564 C569	S564-A567 PolarHBondContact O-N 3.44Å; S564-A567 WeakPolarHBondContact OG-CB 3.35Å; A567-C569 PolarHBondContact O-N 3.28Å; A567-C569 PolarHBondContact O-SG 3.06Å
568	D	65.9	Low	77.5	Confident	67 Å²	67	37.1 Å²	37.1	36%	0.358	23%	0.227	S	C	.	.			trans	-76.6	91.3	177.1	-60	5.3	0	0	0	108.4	L488 A489	L488-D568 PolarHBondContact N-OD1 2.79Å; L488-D568 PolarHBondContact N-OD2 2.82Å; A489-D568 WeakPolarHBondContact CA-OD1 3.37Å; A489-D568 PolarHBondContact N-OD1 3.31Å
569	C	74.9	Confident	78.5	Confident	11 Å²	11	34.1 Å²	34.1	7%	0.074	21%	0.213	C	C	.	.			trans	-87.9	-35.1	-170.1	-61.6	0	0	0	0	113.9	D490 C563 A567	D490-C569 PolarHBondContact OD1-N 2.74Å; D490-C569 WeakPolarHBondContact OD2-CB 3.38Å; C563-C569 WeakPolarHBondContact CA-SG 3.4Å; C563-C569 HydrophobicContact CB-CB 3.72Å; C563-C569 WeakPolarHBondContact CB-SG 3.25Å; C563-C569 WeakPolarHBondContact SG-CB 3.32Å; C563-C569 CovalentContact SG-SG 2.04Å; C563-C569 PolarHBondContact SG-SG 3.43Å; A567-C569 PolarHBondContact O-N 3.28Å; A567-C569 PolarHBondContact O-SG 3.06Å
570	I	83	Confident	79.4	Confident	8 Å²	8	33.9 Å²	33.9	4%	0.041	21%	0.212	C	C	.	.			trans	-142	122.2	-169.9	-63.4	-178.6	0	0	0	107.8	M546 E547 A550 F559 P572 Y575	M546-I570 HydrophobicContact CB-CD1 4.11Å; M546-I570 HydrophobicContact CB-CG2 4.38Å; E547-I570 HydrophobicContact CB-CB 4.46Å; E547-I570 HydrophobicContact CB-CG2 4.34Å; A550-I570 HydrophobicContact CB-CD1 3.72Å; F559-I570 HydrophobicContact CE1-CD1 4.37Å; I570-P572 WeakPolarHBondContact O-CD 3.24Å; I570-Y575 HydrophobicContact CG2-CD2 4.35Å; I570-Y575 HydrophobicContact CG2-CE2 3.72Å
571	T	85.6	Confident	80.7	Confident	20 Å²	20	25.2 Å²	25.2	12%	0.123	18%	0.179	C	C	.	.			trans	-96.4	107.3	178.2	46	0	0	0	0	111	A382 G573 L574 Y575	A382-T571 HydrophobicContact CB-CG2 3.94Å; T571-G573 PolarHBondContact O-N 3.26Å; T571-L574 WeakPolarHBondContact O-CB 3.44Å; T571-L574 PolarHBondContact O-N 2.99Å; T571-L574 VanDerWaalsContact O-N 3.1Å; T571-L574 WeakPolarHBondContact OG1-CB 3.46Å; T571-Y575 WeakPolarHBondContact O-CD2 3.49Å
572	P	87.8	Confident	82.1	Confident	11 Å²	11	21.3 Å²	21.3	7%	0.071	14%	0.139	C	C	.	.	H	α-helix	trans	-64.4	-23.5	-176.8	-23.6	36.5	0	0	0	113.7	R540 V544 E547 I570 Y575 A576	R540-P572 WeakPolarHBondContact CD-O 3.23Å; V544-P572 HydrophobicContact CG2-CB 3.87Å; V544-P572 HydrophobicContact CG2-CG 4.15Å; E547-P572 HydrophobicContact CB-CG 4.45Å; E547-P572 WeakPolarHBondContact OE2-CG 3.27Å; I570-P572 WeakPolarHBondContact O-CD 3.24Å; P572-Y575 PolarHBondContact O-N 3.35Å; P572-A576 PolarHBondContact O-N 3.12Å; P572-A576 VanDerWaalsContact O-N 3.17Å
573	G	87.8	Confident	83.2	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-62.7	-40.4	172.3	0	0	0	0	0	113.1	F459 D461 T571 Y575 A576 M577	F459-G573 WeakPolarHBondContact O-CA 3.27Å; D461-G573 PolarHBondContact OD1-N 3.09Å; T571-G573 PolarHBondContact O-N 3.26Å; G573-Y575 VanDerWaalsContact C-N 3.34Å; G573-Y575 PolarHBondContact O-N 2.95Å; G573-A576 WeakPolarHBondContact O-CB 3.3Å; G573-A576 PolarHBondContact O-N 2.87Å; G573-A576 VanDerWaalsContact O-N 3.14Å; G573-M577 WeakPolarHBondContact O-CG 3.49Å; G573-M577 PolarHBondContact O-N 3.17Å
574	L	89.9	Confident	84.3	Confident	1 Å²	1	18 Å²	18	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-61.4	-41.8	176.5	178.7	60	0	0	0	111.8	W384 F392 T571 A576 M577 V578 Y607	W384-L574 HydrophobicContact CB-CD2 4.01Å; F392-L574 HydrophobicContact CZ-CD2 3.98Å; F392-L574 HydrophobicContact CZ-CG 4.17Å; T571-L574 WeakPolarHBondContact O-CB 3.44Å; T571-L574 PolarHBondContact O-N 2.99Å; T571-L574 VanDerWaalsContact O-N 3.1Å; T571-L574 WeakPolarHBondContact OG1-CB 3.46Å; L574-A576 VanDerWaalsContact C-N 3.33Å; L574-A576 PolarHBondContact O-N 3.13Å; L574-M577 HydrophobicContact CD1-CE 3.8Å; L574-M577 PolarHBondContact O-N 3.18Å; L574-V578 HydrophobicContact CD1-CG2 4.28Å; L574-V578 WeakPolarHBondContact O-CG2 3.36Å; L574-V578 PolarHBondContact O-N 3.1Å; L574-Y607 HydrophobicContact CD1-CD1 3.62Å; L574-Y607 HydrophobicContact CD1-CE1 4.32Å; L574-Y607 HydrophobicContact CD1-CG 3.9Å; L574-Y607 HydrophobicContact CD2-CD1 3.79Å; L574-Y607 HydrophobicContact CD2-CE1 3.98Å; L574-Y607 HydrophobicContact CG-CD1 4.38Å
575	Y	93.4	Very high	85.7	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-64.7	-37.7	176.1	-74.7	-112.2	0	0	0	111.7	E388 P391 F392 L395 G539 L542 M546 I570 T571 P572 G573 V578 G579	E388-Y575 WeakPolarHBondContact CB-OH 3.1Å; E388-Y575 WeakPolarHBondContact CG-OH 3.38Å; E388-Y575 WeakPolarHBondContact OE2-CE2 3.47Å; E388-Y575 PolarHBondContact OE2-OH 2.88Å; P391-Y575 HydrophobicContact CB-CE1 3.94Å; P391-Y575 HydrophobicContact CG-CE1 3.85Å; F392-Y575 HydrophobicContact CD1-CD1 4.21Å; F392-Y575 HydrophobicContact CD1-CE1 4.17Å; F392-Y575 AromaticContact CE1-CD1 3.84Å; F392-Y575 HydrophobicContact CE1-CD1 3.84Å; F392-Y575 AromaticContact CE1-CD2 3.77Å; F392-Y575 HydrophobicContact CE1-CD2 3.77Å; F392-Y575 AromaticContact CE1-CE1 3.78Å; F392-Y575 HydrophobicContact CE1-CE1 3.78Å; F392-Y575 AromaticContact CE1-CE2 3.67Å; F392-Y575 HydrophobicContact CE1-CE2 3.67Å; F392-Y575 AromaticContact CE1-CG 3.83Å; F392-Y575 HydrophobicContact CE1-CG 3.83Å; F392-Y575 AromaticContact CE1-CZ 3.67Å; F392-Y575 HydrophobicContact CZ-CD2 4.29Å; F392-Y575 AromaticContact CZ-CE2 3.86Å; F392-Y575 HydrophobicContact CZ-CE2 3.86Å; F392-Y575 AromaticContact CZ-CZ 3.97Å; L395-Y575 HydrophobicContact CD1-CD1 4.3Å; L395-Y575 WeakPolarHBondContact CD1-O 3.39Å; G539-Y575 VanDerWaalsContact CA-O 3.22Å; G539-Y575 WeakPolarHBondContact CA-O 3.33Å; G539-Y575 VanDerWaalsContact O-CB 3.31Å; G539-Y575 WeakPolarHBondContact O-CB 3.17Å; L542-Y575 HydrophobicContact CD2-CD1 4.42Å; L542-Y575 HydrophobicContact CG-CD1 4.4Å; M546-Y575 HydrophobicContact CB-CE1 4.42Å; M546-Y575 HydrophobicContact CG-CE1 4.04Å; I570-Y575 HydrophobicContact CG2-CD2 4.35Å; I570-Y575 HydrophobicContact CG2-CE2 3.72Å; T571-Y575 WeakPolarHBondContact O-CD2 3.49Å; P572-Y575 PolarHBondContact O-N 3.35Å; G573-Y575 VanDerWaalsContact C-N 3.34Å; G573-Y575 PolarHBondContact O-N 2.95Å; Y575-V578 PolarHBondContact O-N 3.28Å; Y575-G579 PolarHBondContact O-N 3.18Å
576	A	94	Very high	87.4	Confident	0 Å²	0	10 Å²	10	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-60.9	-44.5	173.2	0	0	0	0	0	111.6	L458 F459 A536 R540 P572 G573 L574 G579 A580	L458-A576 HydrophobicContact CB-CB 4.42Å; L458-A576 VanDerWaalsContact O-CB 3.25Å; L458-A576 WeakPolarHBondContact O-CB 3.45Å; F459-A576 HydrophobicContact CD1-CB 3.88Å; F459-A576 HydrophobicContact CE1-CB 4.2Å; A536-A576 WeakPolarHBondContact CA-O 3.42Å; R540-A576 HydrophobicContact CB-CB 4.03Å; P572-A576 PolarHBondContact O-N 3.12Å; P572-A576 VanDerWaalsContact O-N 3.17Å; G573-A576 WeakPolarHBondContact O-CB 3.3Å; G573-A576 PolarHBondContact O-N 2.87Å; G573-A576 VanDerWaalsContact O-N 3.14Å; L574-A576 VanDerWaalsContact C-N 3.33Å; L574-A576 PolarHBondContact O-N 3.13Å; A576-G579 PolarHBondContact O-N 3.01Å; A576-A580 WeakPolarHBondContact O-CB 3.47Å; A576-A580 PolarHBondContact O-N 3.34Å
577	M	92.6	Very high	89.2	Confident	4 Å²	4	7.9 Å²	7.9	2%	0.02	5%	0.05	C	C	.	.	H	α-helix	trans	-64.6	-46.2	176.4	-64.2	-162.8	-56.2	0	0	113.1	F380 F459 G573 L574 G579 A580 A581 T602	F380-M577 HydrophobicContact CD2-CE 3.6Å; F380-M577 HydrophobicContact CD2-SD 4.39Å; F380-M577 HydrophobicContact CE2-CE 3.1Å; F380-M577 HydrophobicContact CE2-SD 3.44Å; F380-M577 WeakPolarHBondContact CE2-SD 3.16Å; F380-M577 HydrophobicContact CZ-CE 3.71Å; F380-M577 HydrophobicContact CZ-CG 4.49Å; F380-M577 HydrophobicContact CZ-SD 3.97Å; F459-M577 HydrophobicContact CB-CG 4.39Å; F459-M577 HydrophobicContact CD1-CG 3.65Å; F459-M577 HydrophobicContact CD2-CG 3.8Å; F459-M577 HydrophobicContact CD2-SD 4.23Å; F459-M577 HydrophobicContact CE1-CB 4.26Å; F459-M577 HydrophobicContact CE1-CG 3.73Å; F459-M577 HydrophobicContact CE2-CG 3.87Å; F459-M577 HydrophobicContact CE2-SD 4.46Å; F459-M577 HydrophobicContact CG-CG 3.69Å; F459-M577 HydrophobicContact CG-SD 4.47Å; F459-M577 HydrophobicContact CZ-CB 4.33Å; F459-M577 HydrophobicContact CZ-CG 3.83Å; G573-M577 WeakPolarHBondContact O-CG 3.49Å; G573-M577 PolarHBondContact O-N 3.17Å; L574-M577 HydrophobicContact CD1-CE 3.8Å; L574-M577 PolarHBondContact O-N 3.18Å; M577-G579 VanDerWaalsContact C-N 3.3Å; M577-G579 PolarHBondContact O-N 3.14Å; M577-A580 WeakPolarHBondContact O-CB 3.31Å; M577-A580 PolarHBondContact O-N 3.42Å; M577-A581 WeakPolarHBondContact O-CB 3.4Å; M577-A581 PolarHBondContact O-N 2.91Å; M577-T602 HydrophobicContact CE-CG2 3.51Å; M577-T602 HydrophobicContact SD-CG2 3.21Å; M577-T602 WeakPolarHBondContact SD-CG2 3.34Å
578	V	95	Very high	90.7	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-61.7	-40.6	177.3	174.4	0	0	0	0	110.7	F392 L395 L574 Y575 A582 L611 A614	F392-V578 HydrophobicContact CB-CG1 3.99Å; F392-V578 HydrophobicContact CD1-CB 4.01Å; F392-V578 HydrophobicContact CD1-CG1 3.74Å; F392-V578 HydrophobicContact CD1-CG2 4.01Å; F392-V578 HydrophobicContact CE1-CB 4.37Å; F392-V578 HydrophobicContact CE1-CG2 4.08Å; F392-V578 HydrophobicContact CG-CG1 4.07Å; L395-V578 HydrophobicContact CD1-CB 4.48Å; L395-V578 HydrophobicContact CD1-CG1 4.32Å; L574-V578 HydrophobicContact CD1-CG2 4.28Å; L574-V578 WeakPolarHBondContact O-CG2 3.36Å; L574-V578 PolarHBondContact O-N 3.1Å; Y575-V578 PolarHBondContact O-N 3.28Å; V578-A582 VanDerWaalsContact O-CB 3.26Å; V578-A582 WeakPolarHBondContact O-CB 3Å; V578-A582 PolarHBondContact O-N 3.2Å; V578-L611 HydrophobicContact CG2-CD2 4.01Å; V578-L611 HydrophobicContact CG2-CG 4.39Å; V578-A614 HydrophobicContact CG1-CB 3.44Å; V578-A614 VanDerWaalsContact CG1-CB 3.44Å
579	G	96.3	Very high	92	Very high	2 Å²	2	3.6 Å²	3.6	2%	0.021	2%	0.021	C	C	.	.	H	α-helix	trans	-63.2	-43.9	173.2	0	0	0	0	0	113.1	G535 Y575 A576 M577 A582 C583	G535-G579 VanDerWaalsContact CA-C 3.48Å; G535-G579 VanDerWaalsContact CA-O 3.22Å; G535-G579 WeakPolarHBondContact CA-O 3.26Å; G535-G579 CarbonylContact O-C 3.54Å; G535-G579 WeakPolarHBondContact O-CA 3.36Å; Y575-G579 PolarHBondContact O-N 3.18Å; A576-G579 PolarHBondContact O-N 3.01Å; M577-G579 VanDerWaalsContact C-N 3.3Å; M577-G579 PolarHBondContact O-N 3.14Å; G579-A582 PolarHBondContact O-N 2.04Å; G579-C583 PolarHBondContact O-N 3.4Å
580	A	95.6	Very high	92.7	Very high	0 Å²	0	3.4 Å²	3.4	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-60.7	-46.2	176.7	0	0	0	0	0	111.8	F459 M532 A536 A576 M577 L584	F459-A580 HydrophobicContact CE1-CB 4.04Å; F459-A580 HydrophobicContact CZ-CB 3.87Å; M532-A580 HydrophobicContact CB-CB 4.11Å; M532-A580 HydrophobicContact CG-CB 4.47Å; M532-A580 WeakPolarHBondContact O-CB 3.21Å; A536-A580 HydrophobicContact CB-CB 4.22Å; A576-A580 WeakPolarHBondContact O-CB 3.47Å; A576-A580 PolarHBondContact O-N 3.34Å; M577-A580 WeakPolarHBondContact O-CB 3.31Å; M577-A580 PolarHBondContact O-N 3.42Å; A580-L584 VanDerWaalsContact O-CB 3.3Å; A580-L584 WeakPolarHBondContact O-CB 3.43Å; A580-L584 PolarHBondContact O-N 3.07Å
581	A	95.6	Very high	93.1	Very high	1 Å²	1	4 Å²	4	1%	0.008	2%	0.023	C	C	.	.	H	α-helix	trans	-63.4	-45.9	174.7	0	0	0	0	0	111.7	M577 C583 L584 G585 L594 M598 L611 T615	M577-A581 WeakPolarHBondContact O-CB 3.4Å; M577-A581 PolarHBondContact O-N 2.91Å; A581-C583 PolarHBondContact O-N 3.07Å; A581-L584 PolarHBondContact O-N 2.88Å; A581-G585 PolarHBondContact O-N 3.21Å; A581-L594 WeakPolarHBondContact O-CD2 3.29Å; A581-M598 HydrophobicContact CB-CE 4.25Å; A581-M598 HydrophobicContact CB-CG 4.09Å; A581-L611 HydrophobicContact CB-CD2 3.74Å; A581-T615 HydrophobicContact CB-CG2 3.82Å
582	A	97.2	Very high	93.5	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-59.7	-48.1	178.2	0	0	0	0	0	112.5	L395 V578 G579 G586 A614 S618	L395-A582 WeakPolarHBondContact O-CB 3.42Å; V578-A582 VanDerWaalsContact O-CB 3.26Å; V578-A582 WeakPolarHBondContact O-CB 3Å; V578-A582 PolarHBondContact O-N 3.2Å; G579-A582 PolarHBondContact O-N 2.04Å; A582-G586 PolarHBondContact O-N 3.42Å; A582-A614 HydrophobicContact CB-CB 4.37Å; A582-S618 WeakPolarHBondContact O-CB 3.29Å; A582-S618 PolarHBondContact O-OG 3.13Å
583	C	96.5	Very high	93.8	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	4%	0.037	C	C	.	.	H	α-helix	trans	-67.6	-39.4	178.9	-74.7	0	0	0	0	112.7	S531 G535 G579 A581 G586 V587	S531-C583 WeakPolarHBondContact O-CB 3.46Å; G535-C583 WeakPolarHBondContact CA-SG 3.29Å; G579-C583 PolarHBondContact O-N 3.4Å; A581-C583 PolarHBondContact O-N 3.07Å; C583-G586 PolarHBondContact O-N 2.9Å; C583-V587 WeakPolarHBondContact O-CG2 3.31Å; C583-V587 PolarHBondContact O-N 3Å
584	L	95.2	Very high	94.1	Very high	4 Å²	4	6.5 Å²	6.5	2%	0.021	4%	0.038	C	C	.	.	H	α-helix	trans	-64.3	-49	175.7	177.9	52.8	0	0	0	110.9	F528 M532 A580 A581 G586 V587 T588 L594	F528-L584 HydrophobicContact CB-CD1 4.46Å; F528-L584 HydrophobicContact CD1-CD1 3.69Å; F528-L584 HydrophobicContact CE1-CD1 4.43Å; F528-L584 HydrophobicContact CG-CD1 4.46Å; M532-L584 HydrophobicContact CG-CB 3.97Å; M532-L584 HydrophobicContact CG-CD2 3.6Å; M532-L584 HydrophobicContact CG-CG 4.32Å; M532-L584 HydrophobicContact SD-CD2 3.71Å; A580-L584 VanDerWaalsContact O-CB 3.3Å; A580-L584 WeakPolarHBondContact O-CB 3.43Å; A580-L584 PolarHBondContact O-N 3.07Å; A581-L584 PolarHBondContact O-N 2.88Å; L584-G586 VanDerWaalsContact C-N 3.3Å; L584-G586 PolarHBondContact O-N 2.89Å; L584-V587 PolarHBondContact O-N 3.48Å; L584-V587 VanDerWaalsContact O-N 3.09Å; L584-T588 HydrophobicContact CD1-CG2 3.63Å; L584-T588 PolarHBondContact O-N 3.45Å; L584-T588 PolarHBondContact O-OG1 2.92Å; L584-L594 HydrophobicContact CB-CD2 4.14Å; L584-L594 HydrophobicContact CD2-CD1 3.55Å; L584-L594 HydrophobicContact CD2-CD2 4.44Å; L584-L594 HydrophobicContact CG-CD1 4.07Å; L584-L594 HydrophobicContact CG-CD2 4.04Å
585	G	94.9	Very high	94.3	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-59.6	-35.6	177.2	0	0	0	0	0	113.5	A581 V587 R589	A581-G585 PolarHBondContact O-N 3.21Å; G585-V587 PolarHBondContact O-N 3.26Å; G585-R589 WeakPolarHBondContact O-CA 3.35Å; G585-R589 PolarHBondContact O-N 3.02Å
586	G	95.3	Very high	94.3	Very high	0 Å²	0	8.5 Å²	8.5	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-68.9	-30.8	175.3	0	0	0	0	0	113.8	A582 C583 L584 R589 S618	A582-G586 PolarHBondContact O-N 3.42Å; C583-G586 PolarHBondContact O-N 2.9Å; L584-G586 VanDerWaalsContact C-N 3.3Å; L584-G586 PolarHBondContact O-N 2.89Å; G586-R589 WeakPolarHBondContact O-CD 3.44Å; G586-R589 PolarHBondContact O-NE 2.99Å; G586-S618 WeakPolarHBondContact CA-OG 3.43Å; G586-S618 PolarHBondContact N-OG 3.34Å
587	V	95.2	Very high	94.2	Very high	0 Å²	0	8.7 Å²	8.7	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-83.3	-41.8	178.7	170.7	0	0	0	0	112	F406 L527 C583 L584 G585 I630	F406-V587 HydrophobicContact CD1-CG1 3.9Å; F406-V587 HydrophobicContact CD1-CG2 4.13Å; F406-V587 HydrophobicContact CE1-CG1 4.01Å; F406-V587 HydrophobicContact CG-CG2 4.44Å; L527-V587 HydrophobicContact CD2-CG1 3.6Å; L527-V587 HydrophobicContact CG-CG1 4.17Å; C583-V587 WeakPolarHBondContact O-CG2 3.31Å; C583-V587 PolarHBondContact O-N 3Å; L584-V587 PolarHBondContact O-N 3.48Å; L584-V587 VanDerWaalsContact O-N 3.09Å; G585-V587 PolarHBondContact O-N 3.26Å; V587-I630 HydrophobicContact CG1-CB 4.28Å; V587-I630 HydrophobicContact CG1-CG2 4.02Å; V587-I630 WeakPolarHBondContact O-CB 3.27Å; V587-I630 WeakPolarHBondContact O-CG2 3.02Å; V587-I630 PolarHBondContact O-N 3.5Å
588	T	93	Very high	94.1	Very high	2 Å²	2	8.7 Å²	8.7	1%	0.012	5%	0.051	C	C	.	.	H	α-helix	trans	-99.1	-16.2	-174	60.6	0	0	0	0	114.4	F528 L584 M590 I630 Y631	F528-T588 HydrophobicContact CD1-CG2 4.25Å; F528-T588 HydrophobicContact CE1-CG2 3.95Å; L584-T588 HydrophobicContact CD1-CG2 3.63Å; L584-T588 PolarHBondContact O-N 3.45Å; L584-T588 PolarHBondContact O-OG1 2.92Å; T588-M590 PolarHBondContact O-N 3.03Å; T588-M590 VanDerWaalsContact OG1-CG 3.26Å; T588-M590 WeakPolarHBondContact OG1-CG 3.18Å; T588-I630 HydrophobicContact CG2-CG2 4.43Å; T588-Y631 HydrophobicContact CG2-CE2 4.05Å
589	R	92.4	Very high	93.8	Very high	12 Å²	12	11.1 Å²	11.1	5%	0.045	6%	0.061	C	C	.	.			trans	66.3	18.3	-176.4	-47.2	-46.9	-173.3	85.2	11.1	115.5	G585 G586 K619 A622 D623 G626 E628	G585-R589 WeakPolarHBondContact O-CA 3.35Å; G585-R589 PolarHBondContact O-N 3.02Å; G586-R589 WeakPolarHBondContact O-CD 3.44Å; G586-R589 PolarHBondContact O-NE 2.99Å; R589-K619 PolarHBondContact O-NZ 3.11Å; R589-A622 PolarHBondContact NH1-O 2.75Å; R589-A622 PolarHBondContact NH2-O 2.8Å; R589-D623 IonicContact CZ-OD1 3.3Å; R589-D623 VanDerWaalsContact NH1-CA 3.34Å; R589-D623 IonicContact NH1-OD1 2.8Å; R589-D623 PolarHBondContact NH1-OD1 3.18Å; R589-G626 PolarHBondContact NH1-O 2.93Å; R589-G626 VanDerWaalsContact NH1-O 3.16Å; R589-G626 PolarHBondContact NH2-O 3.09Å; R589-E628 PolarHBondContact NH2-O 2.98Å
590	M	90.7	Very high	93.5	Very high	6 Å²	6	13 Å²	13	3%	0.03	7%	0.07	C	C	.	.			trans	-82.1	141	176.5	-56	-174	78.2	0	0	111.2	F334 E337 E338 T588 S593 L594	F334-M590 HydrophobicContact CB-CE 4.26Å; F334-M590 HydrophobicContact CD2-CE 3.06Å; F334-M590 HydrophobicContact CD2-SD 3.85Å; F334-M590 HydrophobicContact CE2-CE 3.32Å; F334-M590 HydrophobicContact CE2-SD 3.51Å; F334-M590 VanDerWaalsContact CE2-SD 3.51Å; F334-M590 HydrophobicContact CG-CE 3.75Å; F334-M590 HydrophobicContact CZ-CE 4.22Å; F334-M590 HydrophobicContact CZ-SD 4.43Å; E337-M590 WeakPolarHBondContact OE1-CA 3.35Å; E338-M590 HydrophobicContact CB-CE 3.95Å; E338-M590 HydrophobicContact CG-CE 3.44Å; E338-M590 VanDerWaalsContact CG-CE 3.44Å; E338-M590 HydrophobicContact CG-CG 3.52Å; E338-M590 HydrophobicContact CG-SD 3.82Å; T588-M590 PolarHBondContact O-N 3.03Å; T588-M590 VanDerWaalsContact OG1-CG 3.26Å; T588-M590 WeakPolarHBondContact OG1-CG 3.18Å; M590-S593 WeakPolarHBondContact CE-OG 3.48Å; M590-L594 HydrophobicContact CB-CB 4.25Å
591	T	91.9	Very high	93	Very high	21 Å²	21	13.4 Å²	13.4	13%	0.129	7%	0.072	C	C	.	.			trans	-125.1	-74.9	-179.7	49	0	0	0	0	111.9	E337 L594 V595 K619	E337-T591 PolarHBondContact OE1-N 3.43Å; E337-T591 PolarHBondContact OE1-OG1 2.9Å; T591-L594 PolarHBondContact O-N 2.92Å; T591-V595 WeakPolarHBondContact O-CG2 3.26Å; T591-V595 PolarHBondContact O-N 3.47Å; T591-V595 VanDerWaalsContact O-N 3.1Å; T591-K619 HydrophobicContact CG2-CB 4.29Å; T591-K619 HydrophobicContact CG2-CD 3.47Å; T591-K619 VanDerWaalsContact CG2-CD 3.47Å
592	V	93.1	Very high	92.4	Very high	79 Å²	79	13.6 Å²	13.6	48%	0.479	7%	0.073	S	C	.	.	H	α-helix	trans	-68.6	-47.7	-166.7	-178.4	0	0	0	0	110.5	E337 L594 V595 V596	E337-V592 PolarHBondContact OE2-N 3.3Å; V592-L594 VanDerWaalsContact C-N 3.26Å; V592-L594 PolarHBondContact O-N 2.89Å; V592-V595 PolarHBondContact O-N 3.47Å; V592-V596 WeakPolarHBondContact O-CG2 3.07Å; V592-V596 PolarHBondContact O-N 3.46Å; V592-V596 VanDerWaalsContact O-N 3.1Å
593	S	93.6	Very high	91.5	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-61.3	-35.7	177.8	68.8	0	0	0	0	112.4	L333 E337 M590 V596 I597	L333-S593 VanDerWaalsContact C-CB 3.5Å; E337-S593 PolarHBondContact OE2-N 2.71Å; E337-S593 PolarHBondContact OE2-OG 3.18Å; M590-S593 WeakPolarHBondContact CE-OG 3.48Å; S593-V596 PolarHBondContact O-N 3.08Å; S593-I597 WeakPolarHBondContact O-CG1 3.43Å; S593-I597 PolarHBondContact O-N 3.14Å
594	L	93.8	Very high	90.7	Very high	5 Å²	5	16.7 Å²	16.7	3%	0.026	11%	0.105	C	C	.	.	H	α-helix	trans	-70.4	-42.9	-178.4	176.8	56.9	0	0	0	111.6	A581 L584 M590 T591 V592 V596 I597 M598 T615	A581-L594 WeakPolarHBondContact O-CD2 3.29Å; L584-L594 HydrophobicContact CB-CD2 4.14Å; L584-L594 HydrophobicContact CD2-CD1 3.55Å; L584-L594 HydrophobicContact CD2-CD2 4.44Å; L584-L594 HydrophobicContact CG-CD1 4.07Å; L584-L594 HydrophobicContact CG-CD2 4.04Å; M590-L594 HydrophobicContact CB-CB 4.25Å; T591-L594 PolarHBondContact O-N 2.92Å; V592-L594 VanDerWaalsContact C-N 3.26Å; V592-L594 PolarHBondContact O-N 2.89Å; L594-V596 VanDerWaalsContact C-N 3.3Å; L594-V596 PolarHBondContact O-N 3.33Å; L594-I597 PolarHBondContact O-N 3.04Å; L594-M598 HydrophobicContact CD1-CE 3.94Å; L594-M598 HydrophobicContact CD1-CG 4.24Å; L594-M598 WeakPolarHBondContact O-CG 3.36Å; L594-M598 PolarHBondContact O-N 3.28Å; L594-T615 HydrophobicContact CD2-CG2 4.15Å
595	V	94.3	Very high	90	Very high	12 Å²	12	22.2 Å²	22.2	7%	0.073	13%	0.134	C	C	.	.	H	α-helix	trans	-61.6	-40.8	174.3	176	0	0	0	0	110.6	T591 V592 M598 F599 I608 L611 M612 T615	T591-V595 WeakPolarHBondContact O-CG2 3.26Å; T591-V595 PolarHBondContact O-N 3.47Å; T591-V595 VanDerWaalsContact O-N 3.1Å; V592-V595 PolarHBondContact O-N 3.47Å; V595-M598 PolarHBondContact O-N 3.44Å; V595-F599 WeakPolarHBondContact O-CB 3.42Å; V595-F599 PolarHBondContact O-N 2.95Å; V595-I608 HydrophobicContact CG1-CG2 3.99Å; V595-L611 HydrophobicContact CG1-CB 4.25Å; V595-L611 HydrophobicContact CG2-CB 4.44Å; V595-M612 HydrophobicContact CG2-CB 4.34Å; V595-T615 HydrophobicContact CG2-CG2 4.37Å; V595-T615 WeakPolarHBondContact CG2-OG1 3.16Å
596	V	94.1	Very high	89.5	Confident	30 Å²	30	27.8 Å²	27.8	18%	0.182	16%	0.16	C	C	.	.	H	α-helix	trans	-68.7	-38.8	177.3	177.1	0	0	0	0	112.5	I329 L333 V592 S593 L594 M598 F599 E600	I329-V596 HydrophobicContact CB-CG1 4.1Å; I329-V596 HydrophobicContact CG2-CG1 3.88Å; L333-V596 HydrophobicContact CD1-CB 3.93Å; L333-V596 HydrophobicContact CD1-CG1 4Å; L333-V596 HydrophobicContact CD1-CG2 3.68Å; V592-V596 WeakPolarHBondContact O-CG2 3.07Å; V592-V596 PolarHBondContact O-N 3.46Å; V592-V596 VanDerWaalsContact O-N 3.1Å; S593-V596 PolarHBondContact O-N 3.08Å; L594-V596 VanDerWaalsContact C-N 3.3Å; L594-V596 PolarHBondContact O-N 3.33Å; V596-M598 PolarHBondContact O-N 3.48Å; V596-F599 PolarHBondContact O-N 3.47Å; V596-E600 HydrophobicContact CG1-CG 4.48Å; V596-E600 PolarHBondContact O-N 3.07Å
597	I	92.8	Very high	89.1	Confident	5 Å²	5	28 Å²	28	3%	0.026	16%	0.161	C	C	.	.	H	α-helix	trans	-59.2	-47.1	172.7	-70.7	164.9	0	0	0	110.5	V321 F325 A327 S593 L594 F599 E600 L601	V321-I597 HydrophobicContact CG1-CD1 4.03Å; F325-I597 HydrophobicContact CB-CG2 3.87Å; F325-I597 HydrophobicContact CD1-CG2 4Å; F325-I597 HydrophobicContact CD2-CG2 4.48Å; F325-I597 HydrophobicContact CG-CG2 3.89Å; A327-I597 HydrophobicContact CB-CB 4.4Å; A327-I597 HydrophobicContact CB-CG1 4.16Å; A327-I597 HydrophobicContact CB-CG2 4.22Å; S593-I597 WeakPolarHBondContact O-CG1 3.43Å; S593-I597 PolarHBondContact O-N 3.14Å; L594-I597 PolarHBondContact O-N 3.04Å; I597-F599 VanDerWaalsContact C-N 3.32Å; I597-F599 PolarHBondContact O-N 3.38Å; I597-E600 PolarHBondContact O-N 3.44Å; I597-L601 HydrophobicContact CG2-CD1 3.83Å; I597-L601 WeakPolarHBondContact O-CB 3.27Å; I597-L601 WeakPolarHBondContact O-CD1 3.28Å; I597-L601 VanDerWaalsContact O-CG 3.28Å; I597-L601 WeakPolarHBondContact O-CG 3.15Å; I597-L601 PolarHBondContact O-N 3.4Å
598	M	90.6	Very high	88.9	Confident	4 Å²	4	30.5 Å²	30.5	2%	0.02	17%	0.173	C	C	.	.	H	α-helix	trans	-66.4	-33.1	178.7	-66.8	-68	178	0	0	112.5	M532 A581 L594 V595 V596 L601 T602 L611	M532-M598 HydrophobicContact CG-CE 4.28Å; M532-M598 HydrophobicContact SD-CE 3.56Å; M532-M598 VanDerWaalsContact SD-CE 3.56Å; A581-M598 HydrophobicContact CB-CE 4.25Å; A581-M598 HydrophobicContact CB-CG 4.09Å; L594-M598 HydrophobicContact CD1-CE 3.94Å; L594-M598 HydrophobicContact CD1-CG 4.24Å; L594-M598 WeakPolarHBondContact O-CG 3.36Å; L594-M598 PolarHBondContact O-N 3.28Å; V595-M598 PolarHBondContact O-N 3.44Å; V596-M598 PolarHBondContact O-N 3.48Å; M598-L601 HydrophobicContact SD-CD1 4.31Å; M598-T602 VanDerWaalsContact O-CG2 3.28Å; M598-T602 WeakPolarHBondContact O-CG2 3.31Å; M598-T602 PolarHBondContact O-N 3.45Å; M598-T602 PolarHBondContact O-OG1 3.03Å; M598-L611 HydrophobicContact CB-CD1 3.93Å; M598-L611 HydrophobicContact CB-CD2 4.36Å
599	F	88.5	Confident	88.8	Confident	50 Å²	50	34.3 Å²	34.3	22%	0.219	20%	0.197	C	C	.	.	H	α-helix	trans	-66.7	-47.7	172.1	164.1	-112.5	0	0	0	112.4	V595 V596 I597 L601 T602 G603 L605 I608	V595-F599 WeakPolarHBondContact O-CB 3.42Å; V595-F599 PolarHBondContact O-N 2.95Å; V596-F599 PolarHBondContact O-N 3.47Å; I597-F599 VanDerWaalsContact C-N 3.32Å; I597-F599 PolarHBondContact O-N 3.38Å; F599-L601 PolarHBondContact O-N 3.5Å; F599-T602 WeakPolarHBondContact CA-OG1 3.18Å; F599-T602 PolarHBondContact O-N 3.12Å; F599-T602 PolarHBondContact O-OG1 3.48Å; F599-T602 VanDerWaalsContact O-OG1 3.11Å; F599-G603 PolarHBondContact O-N 2.91Å; F599-L605 HydrophobicContact CD2-CD2 4.26Å; F599-L605 HydrophobicContact CE1-CD2 4.2Å; F599-L605 HydrophobicContact CE2-CB 4.32Å; F599-L605 HydrophobicContact CE2-CD2 3.45Å; F599-L605 VanDerWaalsContact CE2-CD2 3.45Å; F599-L605 HydrophobicContact CE2-CG 3.67Å; F599-L605 HydrophobicContact CZ-CD2 3.41Å; F599-L605 VanDerWaalsContact CZ-CD2 3.41Å; F599-L605 HydrophobicContact CZ-CG 3.92Å; F599-I608 HydrophobicContact CB-CD1 4.39Å; F599-I608 HydrophobicContact CB-CG1 4.19Å; F599-I608 HydrophobicContact CD1-CD1 4.49Å; F599-I608 HydrophobicContact CD2-CD1 3.93Å; F599-I608 HydrophobicContact CD2-CG1 4.16Å; F599-I608 HydrophobicContact CE2-CD1 4.43Å; F599-I608 HydrophobicContact CG-CD1 3.98Å; F599-I608 HydrophobicContact CG-CG1 4.24Å
600	E	89.8	Confident	88.8	Confident	42 Å²	42	33.8 Å²	33.8	20%	0.196	20%	0.195	C	C	.	.	H	α-helix	trans	-62.7	-29.1	177.1	-73.6	-173.8	123.2	0	0	112.5	A327 P328 I329 G330 V596 I597	A327-E600 WeakPolarHBondContact CA-OE2 3.41Å; A327-E600 HydrophobicContact CB-CB 4.02Å; A327-E600 VanDerWaalsContact CB-OE2 3.24Å; A327-E600 WeakPolarHBondContact CB-OE2 3.28Å; P328-E600 VanDerWaalsContact CD-OE1 3.3Å; P328-E600 WeakPolarHBondContact CD-OE1 3.44Å; I329-E600 VanDerWaalsContact CB-OE1 3.3Å; I329-E600 WeakPolarHBondContact CB-OE1 3.2Å; I329-E600 VanDerWaalsContact CG1-OE1 3.26Å; I329-E600 WeakPolarHBondContact CG1-OE1 3.19Å; I329-E600 PolarHBondContact N-OE1 3.29Å; I329-E600 PolarHBondContact N-OE2 3Å; I329-E600 VanDerWaalsContact N-OE2 3.13Å; G330-E600 PolarHBondContact N-OE2 3.3Å; V596-E600 HydrophobicContact CG1-CG 4.48Å; V596-E600 PolarHBondContact O-N 3.07Å; I597-E600 PolarHBondContact O-N 3.44Å
601	L	85.3	Confident	88.9	Confident	8 Å²	8	33.6 Å²	33.6	4%	0.042	19%	0.194	C	C	.	.	H	α-helix	trans	-75.5	-18.6	174.3	-74.7	164.6	0	0	0	114.8	F325 V374 F376 Y377 I597 M598 F599	F325-L601 WeakPolarHBondContact O-CD2 3.45Å; V374-L601 HydrophobicContact CB-CD2 4.13Å; V374-L601 HydrophobicContact CG1-CD2 4.19Å; V374-L601 HydrophobicContact CG2-CD2 4.25Å; F376-L601 HydrophobicContact CD2-CD1 4.4Å; F376-L601 HydrophobicContact CD2-CD2 4.16Å; F376-L601 HydrophobicContact CE2-CD1 3.75Å; F376-L601 HydrophobicContact CE2-CD2 3.82Å; F376-L601 HydrophobicContact CE2-CG 4.43Å; Y377-L601 WeakPolarHBondContact CD2-O 3.47Å; Y377-L601 WeakPolarHBondContact CE2-O 3.44Å; I597-L601 HydrophobicContact CG2-CD1 3.83Å; I597-L601 WeakPolarHBondContact O-CB 3.27Å; I597-L601 WeakPolarHBondContact O-CD1 3.28Å; I597-L601 VanDerWaalsContact O-CG 3.28Å; I597-L601 WeakPolarHBondContact O-CG 3.15Å; I597-L601 PolarHBondContact O-N 3.4Å; M598-L601 HydrophobicContact SD-CD1 4.31Å; F599-L601 PolarHBondContact O-N 3.5Å
602	T	82.9	Confident	89	Confident	5 Å²	5	36.6 Å²	36.6	3%	0.031	21%	0.207	C	C	.	.	H	α-helix	trans	-113.2	-23.9	-174.1	49.4	0	0	0	0	114.1	V378 M577 M598 F599 G604	V378-T602 WeakPolarHBondContact O-CA 3.45Å; M577-T602 HydrophobicContact CE-CG2 3.51Å; M577-T602 HydrophobicContact SD-CG2 3.21Å; M577-T602 WeakPolarHBondContact SD-CG2 3.34Å; M598-T602 VanDerWaalsContact O-CG2 3.28Å; M598-T602 WeakPolarHBondContact O-CG2 3.31Å; M598-T602 PolarHBondContact O-N 3.45Å; M598-T602 PolarHBondContact O-OG1 3.03Å; F599-T602 WeakPolarHBondContact CA-OG1 3.18Å; F599-T602 PolarHBondContact O-N 3.12Å; F599-T602 PolarHBondContact O-OG1 3.48Å; F599-T602 VanDerWaalsContact O-OG1 3.11Å; T602-G604 PolarHBondContact O-N 3.22Å
603	G	78.5	Confident	89.1	Confident	48 Å²	48	34.1 Å²	34.1	50%	0.495	20%	0.195	S	C	.	.			trans	69.7	-10.9	-175.6	0	0	0	0	0	115.3	F599	F599-G603 PolarHBondContact O-N 2.91Å
604	G	78.4	Confident	89.2	Confident	17 Å²	17	34.1 Å²	34.1	18%	0.175	20%	0.195	C	C	.	.			trans	-94	109.6	-176	0	0	0	0	0	113.3	T602 E606	T602-G604 PolarHBondContact O-N 3.22Å; G604-E606 PolarHBondContact O-N 3.3Å
605	L	80.9	Confident	89.3	Confident	121 Å²	121	33.9 Å²	33.9	63%	0.634	19%	0.194	S	C	*	.	G	3₁₀ helix	trans	-62.2	-28.7	176	-76.9	168.1	0	0	0	113	F599 Y607 I608	F599-L605 HydrophobicContact CD2-CD2 4.26Å; F599-L605 HydrophobicContact CE1-CD2 4.2Å; F599-L605 HydrophobicContact CE2-CB 4.32Å; F599-L605 HydrophobicContact CE2-CD2 3.45Å; F599-L605 VanDerWaalsContact CE2-CD2 3.45Å; F599-L605 HydrophobicContact CE2-CG 3.67Å; F599-L605 HydrophobicContact CZ-CD2 3.41Å; F599-L605 VanDerWaalsContact CZ-CD2 3.41Å; F599-L605 HydrophobicContact CZ-CG 3.92Å; L605-Y607 VanDerWaalsContact C-N 3.27Å; L605-Y607 PolarHBondContact O-N 3.42Å; L605-I608 HydrophobicContact CD2-CD1 3.8Å; L605-I608 WeakPolarHBondContact O-CB 3.26Å; L605-I608 WeakPolarHBondContact O-CG1 3.46Å; L605-I608 PolarHBondContact O-N 3.17Å
606	E	84	Confident	89.4	Confident	116 Å²	116	36.2 Å²	36.2	54%	0.542	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-63.8	-32.6	-173.9	-59	-171.7	175.4	0	0	112.5	W384 G604 I608	W384-E606 PolarHBondContact NE1-O 2.92Å; G604-E606 PolarHBondContact O-N 3.3Å; E606-I608 VanDerWaalsContact C-N 3.29Å; E606-I608 PolarHBondContact O-N 2.87Å
607	Y	86.7	Confident	89.5	Confident	5 Å²	5	35.7 Å²	35.7	2%	0.02	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-80.9	-2.5	-175.2	-47.3	-61.5	0	0	0	114.3	F380 A382 W384 L574 L605 V609 P610 L611	F380-Y607 HydrophobicContact CB-CE2 3.75Å; F380-Y607 VanDerWaalsContact CB-OH 3.26Å; F380-Y607 WeakPolarHBondContact CB-OH 3.21Å; F380-Y607 PolarHBondContact O-OH 2.82Å; A382-Y607 PolarHBondContact O-OH 2.93Å; W384-Y607 AromaticContact CD1-CD1 3.96Å; L574-Y607 HydrophobicContact CD1-CD1 3.62Å; L574-Y607 HydrophobicContact CD1-CE1 4.32Å; L574-Y607 HydrophobicContact CD1-CG 3.9Å; L574-Y607 HydrophobicContact CD2-CD1 3.79Å; L574-Y607 HydrophobicContact CD2-CE1 3.98Å; L574-Y607 HydrophobicContact CG-CD1 4.38Å; L605-Y607 VanDerWaalsContact C-N 3.27Å; L605-Y607 PolarHBondContact O-N 3.42Å; Y607-V609 VanDerWaalsContact C-N 3.33Å; Y607-V609 PolarHBondContact O-N 3.47Å; Y607-P610 VanDerWaalsContact O-CD 3.28Å; Y607-P610 WeakPolarHBondContact O-CD 3.49Å; Y607-P610 WeakPolarHBondContact O-CG 3.3Å; Y607-L611 WeakPolarHBondContact O-CB 3.45Å; Y607-L611 WeakPolarHBondContact O-CD1 3.38Å; Y607-L611 VanDerWaalsContact O-CG 3.28Å; Y607-L611 WeakPolarHBondContact O-CG 3.47Å; Y607-L611 PolarHBondContact O-N 3.48Å
608	I	90.8	Very high	89.7	Confident	52 Å²	52	35.5 Å²	35.5	27%	0.267	20%	0.201	S	C	.	.	H	α-helix	trans	-60.8	-40.8	179.7	-70.3	175.2	0	0	0	111.7	V595 F599 L605 E606 L611 M612	V595-I608 HydrophobicContact CG1-CG2 3.99Å; F599-I608 HydrophobicContact CB-CD1 4.39Å; F599-I608 HydrophobicContact CB-CG1 4.19Å; F599-I608 HydrophobicContact CD1-CD1 4.49Å; F599-I608 HydrophobicContact CD2-CD1 3.93Å; F599-I608 HydrophobicContact CD2-CG1 4.16Å; F599-I608 HydrophobicContact CE2-CD1 4.43Å; F599-I608 HydrophobicContact CG-CD1 3.98Å; F599-I608 HydrophobicContact CG-CG1 4.24Å; L605-I608 HydrophobicContact CD2-CD1 3.8Å; L605-I608 WeakPolarHBondContact O-CB 3.26Å; L605-I608 WeakPolarHBondContact O-CG1 3.46Å; L605-I608 PolarHBondContact O-N 3.17Å; E606-I608 VanDerWaalsContact C-N 3.29Å; E606-I608 PolarHBondContact O-N 2.87Å; I608-L611 PolarHBondContact O-N 3.04Å; I608-M612 VanDerWaalsContact O-CB 3.25Å; I608-M612 WeakPolarHBondContact O-CB 3.43Å; I608-M612 PolarHBondContact O-N 2.82Å
609	V	91.6	Very high	90	Very high	83 Å²	83	37.4 Å²	37.4	50%	0.503	21%	0.209	S	C	.	.	H	α-helix	trans	-63.1	-53.8	-177.6	177.1	0	0	0	0	112.7	W384 Y607 L611 M612 A613	W384-V609 HydrophobicContact CH2-CB 4.28Å; W384-V609 HydrophobicContact CH2-CG1 3.88Å; W384-V609 HydrophobicContact CZ2-CB 3.77Å; W384-V609 HydrophobicContact CZ2-CG1 3.88Å; Y607-V609 VanDerWaalsContact C-N 3.33Å; Y607-V609 PolarHBondContact O-N 3.47Å; V609-L611 VanDerWaalsContact C-N 3.34Å; V609-L611 PolarHBondContact O-N 2.81Å; V609-M612 PolarHBondContact O-N 2.94Å; V609-A613 WeakPolarHBondContact O-CB 3.45Å; V609-A613 PolarHBondContact O-N 2.63Å
610	P	91.9	Very high	90.3	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-36.1	177.8	23.6	-33.7	0	0	0	112.8	W384 F392 Y607 A613 A614	W384-P610 HydrophobicContact CD2-CG 4.06Å; W384-P610 HydrophobicContact CG-CG 4.28Å; F392-P610 HydrophobicContact CD2-CB 3.29Å; F392-P610 HydrophobicContact CD2-CG 4.41Å; F392-P610 HydrophobicContact CE2-CB 3.57Å; F392-P610 HydrophobicContact CE2-CG 4.24Å; F392-P610 HydrophobicContact CG-CB 4.02Å; F392-P610 HydrophobicContact CZ-CB 4.47Å; Y607-P610 VanDerWaalsContact O-CD 3.28Å; Y607-P610 WeakPolarHBondContact O-CD 3.49Å; Y607-P610 WeakPolarHBondContact O-CG 3.3Å; P610-A613 PolarHBondContact O-N 3.46Å; P610-A614 WeakPolarHBondContact O-CB 3.34Å; P610-A614 PolarHBondContact O-N 3.46Å
611	L	93.3	Very high	90.6	Very high	2 Å²	2	42.9 Å²	42.9	1%	0.01	23%	0.23	C	C	.	.	H	α-helix	trans	-60.7	-45.5	173	-74.3	168.9	0	0	0	111.8	V578 A581 V595 M598 Y607 I608 V609 T615	V578-L611 HydrophobicContact CG2-CD2 4.01Å; V578-L611 HydrophobicContact CG2-CG 4.39Å; A581-L611 HydrophobicContact CB-CD2 3.74Å; V595-L611 HydrophobicContact CG1-CB 4.25Å; V595-L611 HydrophobicContact CG2-CB 4.44Å; M598-L611 HydrophobicContact CB-CD1 3.93Å; M598-L611 HydrophobicContact CB-CD2 4.36Å; Y607-L611 WeakPolarHBondContact O-CB 3.45Å; Y607-L611 WeakPolarHBondContact O-CD1 3.38Å; Y607-L611 VanDerWaalsContact O-CG 3.28Å; Y607-L611 WeakPolarHBondContact O-CG 3.47Å; Y607-L611 PolarHBondContact O-N 3.48Å; I608-L611 PolarHBondContact O-N 3.04Å; V609-L611 VanDerWaalsContact C-N 3.34Å; V609-L611 PolarHBondContact O-N 2.81Å; L611-T615 WeakPolarHBondContact O-CB 3.16Å; L611-T615 VanDerWaalsContact O-CG2 3.27Å; L611-T615 WeakPolarHBondContact O-CG2 3.31Å; L611-T615 PolarHBondContact O-N 3.41Å; L611-T615 PolarHBondContact O-OG1 2.87Å
612	M	94.6	Very high	91.1	Very high	84 Å²	84	42.5 Å²	42.5	41%	0.414	23%	0.228	S	C	.	.	H	α-helix	trans	-65.7	-43.4	178.5	-170.4	173.9	-173.1	0	0	111.9	V595 I608 V609 T615 M616	V595-M612 HydrophobicContact CG2-CB 4.34Å; I608-M612 VanDerWaalsContact O-CB 3.25Å; I608-M612 WeakPolarHBondContact O-CB 3.43Å; I608-M612 PolarHBondContact O-N 2.82Å; V609-M612 PolarHBondContact O-N 2.94Å; M612-T615 WeakPolarHBondContact CA-OG1 3.24Å; M612-T615 PolarHBondContact O-OG1 3.44Å; M612-M616 HydrophobicContact CE-CE 3.42Å; M612-M616 VanDerWaalsContact CE-CE 3.42Å; M612-M616 HydrophobicContact CE-SD 4.26Å; M612-M616 HydrophobicContact CG-CE 4.25Å; M612-M616 HydrophobicContact CG-SD 4.23Å; M612-M616 VanDerWaalsContact O-CB 3.31Å; M612-M616 WeakPolarHBondContact O-CB 3.47Å; M612-M616 WeakPolarHBondContact O-CG 3.3Å; M612-M616 PolarHBondContact O-N 3.18Å
613	A	95.3	Very high	91.5	Very high	27 Å²	27	44.5 Å²	44.5	22%	0.223	24%	0.239	C	C	.	.	H	α-helix	trans	-63.1	-45.9	177.9	0	0	0	0	0	112.4	L389 V609 P610 T617	L389-A613 HydrophobicContact CD1-CB 3.63Å; V609-A613 WeakPolarHBondContact O-CB 3.45Å; V609-A613 PolarHBondContact O-N 2.63Å; P610-A613 PolarHBondContact O-N 3.46Å; A613-T617 VanDerWaalsContact O-CB 3.31Å; A613-T617 WeakPolarHBondContact O-CB 3.31Å; A613-T617 PolarHBondContact O-N 3.02Å; A613-T617 PolarHBondContact O-OG1 2.9Å
614	A	96.3	Very high	92.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-68.4	-42.4	179.4	0	0	0	0	0	112.4	F392 G396 V578 A582 P610 T617 S618	F392-A614 WeakPolarHBondContact O-CB 3.43Å; G396-A614 VanDerWaalsContact CA-O 3.27Å; G396-A614 WeakPolarHBondContact CA-O 3.37Å; V578-A614 HydrophobicContact CG1-CB 3.44Å; V578-A614 VanDerWaalsContact CG1-CB 3.44Å; A582-A614 HydrophobicContact CB-CB 4.37Å; P610-A614 WeakPolarHBondContact O-CB 3.34Å; P610-A614 PolarHBondContact O-N 3.46Å; A614-T617 PolarHBondContact O-N 3.45Å; A614-S618 VanDerWaalsContact O-CB 3.3Å; A614-S618 WeakPolarHBondContact O-CB 3.36Å; A614-S618 PolarHBondContact O-N 3.32Å
615	T	95.8	Very high	92.9	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.006	26%	0.263	C	S	.	.	H	α-helix	trans	-68	-41.1	178.2	52.3	0	0	0	0	112.7	A581 L594 V595 L611 M612 S618 K619	A581-T615 HydrophobicContact CB-CG2 3.82Å; L594-T615 HydrophobicContact CD2-CG2 4.15Å; V595-T615 HydrophobicContact CG2-CG2 4.37Å; V595-T615 WeakPolarHBondContact CG2-OG1 3.16Å; L611-T615 WeakPolarHBondContact O-CB 3.16Å; L611-T615 VanDerWaalsContact O-CG2 3.27Å; L611-T615 WeakPolarHBondContact O-CG2 3.31Å; L611-T615 PolarHBondContact O-N 3.41Å; L611-T615 PolarHBondContact O-OG1 2.87Å; M612-T615 WeakPolarHBondContact CA-OG1 3.24Å; M612-T615 PolarHBondContact O-OG1 3.44Å; T615-S618 PolarHBondContact O-N 2.89Å; T615-K619 PolarHBondContact O-N 3.32Å
616	M	95.8	Very high	93.1	Very high	60 Å²	60	46.2 Å²	46.2	30%	0.296	25%	0.248	S	C	.	.	H	α-helix	trans	-64.5	-44.4	173.5	-74.9	-171.1	166.4	0	0	112.2	M612 S618 K619 W620	M612-M616 HydrophobicContact CE-CE 3.42Å; M612-M616 VanDerWaalsContact CE-CE 3.42Å; M612-M616 HydrophobicContact CE-SD 4.26Å; M612-M616 HydrophobicContact CG-CE 4.25Å; M612-M616 HydrophobicContact CG-SD 4.23Å; M612-M616 VanDerWaalsContact O-CB 3.31Å; M612-M616 WeakPolarHBondContact O-CB 3.47Å; M612-M616 WeakPolarHBondContact O-CG 3.3Å; M612-M616 PolarHBondContact O-N 3.18Å; M616-S618 VanDerWaalsContact C-N 3.34Å; M616-S618 PolarHBondContact O-N 3.42Å; M616-K619 PolarHBondContact O-N 3.42Å; M616-W620 PolarHBondContact O-N 3.02Å
617	T	96.7	Very high	92.9	Very high	20 Å²	20	49.1 Å²	49.1	12%	0.123	25%	0.254	C	S	.	.	H	α-helix	trans	-58.9	-46.4	175.5	-59.2	0	0	0	0	110.9	I393 I397 A613 A614 K619 W620 V621	I393-T617 HydrophobicContact CG2-CG2 4.09Å; I397-T617 HydrophobicContact CG1-CG2 3.75Å; A613-T617 VanDerWaalsContact O-CB 3.31Å; A613-T617 WeakPolarHBondContact O-CB 3.31Å; A613-T617 PolarHBondContact O-N 3.02Å; A613-T617 PolarHBondContact O-OG1 2.9Å; A614-T617 PolarHBondContact O-N 3.45Å; T617-K619 PolarHBondContact O-N 3.46Å; T617-W620 PolarHBondContact O-N 3.29Å; T617-V621 HydrophobicContact CG2-CG2 4.38Å; T617-V621 WeakPolarHBondContact O-CB 3.48Å; T617-V621 VanDerWaalsContact O-CG2 3.32Å; T617-V621 WeakPolarHBondContact O-CG2 3.06Å; T617-V621 PolarHBondContact O-N 2.81Å
618	S	97	Very high	92.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-58	-45.8	176.7	178.9	0	0	0	0	112.2	G396 G399 G400 A582 G586 A614 T615 M616 A622	G396-S618 WeakPolarHBondContact O-CA 3.33Å; G396-S618 VanDerWaalsContact O-CB 3.25Å; G396-S618 WeakPolarHBondContact O-CB 3.45Å; G399-S618 VanDerWaalsContact C-OG 3.24Å; G400-S618 WeakPolarHBondContact CA-O 3.41Å; G400-S618 WeakPolarHBondContact CA-OG 3.2Å; G400-S618 PolarHBondContact N-OG 3.06Å; A582-S618 WeakPolarHBondContact O-CB 3.29Å; A582-S618 PolarHBondContact O-OG 3.13Å; G586-S618 WeakPolarHBondContact CA-OG 3.43Å; G586-S618 PolarHBondContact N-OG 3.34Å; A614-S618 VanDerWaalsContact O-CB 3.3Å; A614-S618 WeakPolarHBondContact O-CB 3.36Å; A614-S618 PolarHBondContact O-N 3.32Å; T615-S618 PolarHBondContact O-N 2.89Å; M616-S618 VanDerWaalsContact C-N 3.34Å; M616-S618 PolarHBondContact O-N 3.42Å; S618-A622 VanDerWaalsContact O-CB 3.3Å; S618-A622 WeakPolarHBondContact O-CB 3.45Å; S618-A622 PolarHBondContact O-N 3.4Å
619	K	95.3	Very high	92.8	Very high	44 Å²	44	48.4 Å²	48.4	19%	0.191	25%	0.25	C	C	.	.	H	α-helix	trans	-60.1	-51.8	175.4	176.6	164	-175.8	159.2	0	112.2	R589 T591 T615 M616 T617 V621 A622 D623	R589-K619 PolarHBondContact O-NZ 3.11Å; T591-K619 HydrophobicContact CG2-CB 4.29Å; T591-K619 HydrophobicContact CG2-CD 3.47Å; T591-K619 VanDerWaalsContact CG2-CD 3.47Å; T615-K619 PolarHBondContact O-N 3.32Å; M616-K619 PolarHBondContact O-N 3.42Å; T617-K619 PolarHBondContact O-N 3.46Å; K619-V621 PolarHBondContact O-N 2.67Å; K619-A622 PolarHBondContact O-N 3.2Å; K619-D623 WeakPolarHBondContact CG-OD2 3.46Å; K619-D623 WeakPolarHBondContact O-CB 3.46Å; K619-D623 VanDerWaalsContact O-CG 3.3Å; K619-D623 PolarHBondContact O-N 2.97Å
620	W	95.6	Very high	92.9	Very high	174 Å²	174	44.5 Å²	44.5	66%	0.659	23%	0.226	S	C	*	.	H	α-helix	trans	-60.1	-43.8	-179.4	-65.5	-21.8	0	0	0	112.7	M616 T617 A622 D623 A624	M616-W620 PolarHBondContact O-N 3.02Å; T617-W620 PolarHBondContact O-N 3.29Å; W620-A622 VanDerWaalsContact C-N 3.35Å; W620-D623 PolarHBondContact O-N 3.08Å; W620-A624 PolarHBondContact O-N 2.99Å; W620-A624 VanDerWaalsContact O-N 3.1Å
621	V	96.7	Very high	92.9	Very high	33 Å²	33	44.6 Å²	44.6	20%	0.2	23%	0.226	C	C	.	.	H	α-helix	trans	-62.2	-44.2	176.3	170	0	0	0	0	110.4	I397 L401 T617 K619 A624 F625	I397-V621 HydrophobicContact CG1-CG2 4.19Å; L401-V621 HydrophobicContact CD2-CG1 4.21Å; L401-V621 HydrophobicContact CG-CG1 3.96Å; T617-V621 HydrophobicContact CG2-CG2 4.38Å; T617-V621 WeakPolarHBondContact O-CB 3.48Å; T617-V621 VanDerWaalsContact O-CG2 3.32Å; T617-V621 WeakPolarHBondContact O-CG2 3.06Å; T617-V621 PolarHBondContact O-N 2.81Å; K619-V621 PolarHBondContact O-N 2.67Å; V621-A624 PolarHBondContact O-N 3.25Å; V621-F625 HydrophobicContact CG1-CE2 4.37Å; V621-F625 WeakPolarHBondContact O-CD2 3.45Å
622	A	95.1	Very high	92.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-68.9	-36.9	178.2	0	0	0	0	0	112.7	G400 R589 S618 K619 W620 A624 F625 G626	G400-A622 WeakPolarHBondContact O-CB 3.35Å; R589-A622 PolarHBondContact NH1-O 2.75Å; R589-A622 PolarHBondContact NH2-O 2.8Å; S618-A622 VanDerWaalsContact O-CB 3.3Å; S618-A622 WeakPolarHBondContact O-CB 3.45Å; S618-A622 PolarHBondContact O-N 3.4Å; K619-A622 PolarHBondContact O-N 3.2Å; W620-A622 VanDerWaalsContact C-N 3.35Å; A622-A624 VanDerWaalsContact C-N 3.31Å; A622-A624 PolarHBondContact O-N 3.26Å; A622-F625 PolarHBondContact O-N 3.28Å; A622-F625 VanDerWaalsContact O-N 3.11Å; A622-G626 PolarHBondContact O-N 2.76Å; A622-G626 VanDerWaalsContact O-N 3.12Å; A622-G626 VanDerWaalsContact O-O 3.08Å
623	D	91.9	Very high	92.5	Very high	48 Å²	48	41.3 Å²	41.3	26%	0.257	21%	0.211	S	C	.	.	H	α-helix	trans	-62.7	-37.4	177.8	-78.5	-28.8	0	0	0	111.2	R589 K619 W620 F625 G626	R589-D623 IonicContact CZ-OD1 3.3Å; R589-D623 VanDerWaalsContact NH1-CA 3.34Å; R589-D623 IonicContact NH1-OD1 2.8Å; R589-D623 PolarHBondContact NH1-OD1 3.18Å; K619-D623 WeakPolarHBondContact CG-OD2 3.46Å; K619-D623 WeakPolarHBondContact O-CB 3.46Å; K619-D623 VanDerWaalsContact O-CG 3.3Å; K619-D623 PolarHBondContact O-N 2.97Å; W620-D623 PolarHBondContact O-N 3.08Å; D623-F625 PolarHBondContact O-N 3.43Å; D623-G626 CarbonylContact O-C 3.55Å; D623-G626 PolarHBondContact O-N 2.99Å; D623-G626 VanDerWaalsContact O-N 3.07Å
624	A	93.1	Very high	92.2	Very high	88 Å²	88	41 Å²	41	73%	0.727	20%	0.204	S	C	*	.	H	α-helix	trans	-61.2	-28.2	174.4	0	0	0	0	0	113.5	W620 V621 A622	W620-A624 PolarHBondContact O-N 2.99Å; W620-A624 VanDerWaalsContact O-N 3.1Å; V621-A624 PolarHBondContact O-N 3.25Å; A622-A624 VanDerWaalsContact C-N 3.31Å; A622-A624 PolarHBondContact O-N 3.26Å
625	F	92.5	Very high	91.9	Very high	103 Å²	103	41.1 Å²	41.1	45%	0.452	21%	0.205	S	C	.	.	H	α-helix	trans	-92.3	-12.9	174.5	-69.9	-75	0	0	0	113.8	L401 A404 K408 V621 A622 D623	L401-F625 HydrophobicContact CD2-CD2 4.35Å; L401-F625 HydrophobicContact CD2-CE2 3.46Å; L401-F625 VanDerWaalsContact CD2-CE2 3.46Å; L401-F625 HydrophobicContact CD2-CZ 3.84Å; A404-F625 HydrophobicContact CB-CB 3.59Å; A404-F625 HydrophobicContact CB-CD2 4.11Å; A404-F625 HydrophobicContact CB-CG 4.09Å; K408-F625 WeakPolarHBondContact CE-O 3.12Å; K408-F625 PolarHBondContact NZ-O 2.98Å; V621-F625 HydrophobicContact CG1-CE2 4.37Å; V621-F625 WeakPolarHBondContact O-CD2 3.45Å; A622-F625 PolarHBondContact O-N 3.28Å; A622-F625 VanDerWaalsContact O-N 3.11Å; D623-F625 PolarHBondContact O-N 3.43Å
626	G	85.5	Confident	91.4	Very high	30 Å²	30	44.8 Å²	44.8	31%	0.309	22%	0.219	S	C	.	.			trans	164.9	131.7	176.6	0	0	0	0	0	111.7	R589 A622 D623 E628	R589-G626 PolarHBondContact NH1-O 2.93Å; R589-G626 VanDerWaalsContact NH1-O 3.16Å; R589-G626 PolarHBondContact NH2-O 3.09Å; A622-G626 PolarHBondContact O-N 2.76Å; A622-G626 VanDerWaalsContact O-N 3.12Å; A622-G626 VanDerWaalsContact O-O 3.08Å; D623-G626 CarbonylContact O-C 3.55Å; D623-G626 PolarHBondContact O-N 2.99Å; D623-G626 VanDerWaalsContact O-N 3.07Å; G626-E628 VanDerWaalsContact C-N 3.28Å; G626-E628 PolarHBondContact O-N 3.33Å
627	R	79.9	Confident	90.9	Very high	178 Å²	178	43.5 Å²	43.5	67%	0.672	21%	0.213	S	C	*	.	S	Bend	trans	-70.5	-16.8	-176.8	-63.7	-179.5	176.4	176.6	-3.1	114.4	E650	R627-E650 IonicContact CZ-OE1 3.46Å; R627-E650 IonicContact NH1-OE1 3.92Å; R627-E650 PolarHBondContact NH1-OE1 2.96Å; R627-E650 IonicContact NH2-OE1 2.68Å
628	E	85.1	Confident	90.3	Very high	41 Å²	41	44.9 Å²	44.9	19%	0.192	22%	0.22	C	C	.	.			trans	-85.9	133.3	-172.1	-63.2	165.6	-131.4	0	0	112.3	R589 G626 R636 R811	R589-E628 PolarHBondContact NH2-O 2.98Å; G626-E628 VanDerWaalsContact C-N 3.28Å; G626-E628 PolarHBondContact O-N 3.33Å; E628-R636 IonicContact OE1-CZ 3.99Å; E628-R636 IonicContact OE1-NH1 4Å; E628-R636 PolarHBondContact OE1-NH1 3.46Å; E628-R636 WeakPolarHBondContact OE2-CD 3.28Å; E628-R636 IonicContact OE2-CZ 2.71Å; E628-R636 IonicContact OE2-NE 3.67Å; E628-R636 PolarHBondContact OE2-NE 2.94Å; E628-R636 IonicContact OE2-NH1 3.89Å; E628-R636 PolarHBondContact OE2-NH1 3.45Å; E628-R811 IonicContact OE1-CZ 3.21Å; E628-R811 IonicContact OE1-NH1 2.66Å; E628-R811 IonicContact OE1-NH2 2.62Å; E628-R811 PolarHBondContact OE1-NH2 3.17Å
629	G	90.6	Very high	89.4	Confident	1 Å²	1	45.6 Å²	45.6	1%	0.01	23%	0.227	C	C	.	.			trans	-79	165.7	167.8	0	0	0	0	0	112.9	Y631 E632 A633	G629-Y631 VanDerWaalsContact C-N 3.25Å; G629-Y631 PolarHBondContact O-N 3.04Å; G629-E632 PolarHBondContact N-OE2 3.11Å; G629-E632 PolarHBondContact O-N 3.46Å; G629-A633 WeakPolarHBondContact O-CB 3.48Å; G629-A633 PolarHBondContact O-N 3.37Å
630	I	92.9	Very high	88.9	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-57.2	-36	-179	-172.3	61.1	0	0	0	113.4	F406 I407 F519 L527 V587 T588 H634	F406-I630 HydrophobicContact CD1-CD1 4.41Å; F406-I630 HydrophobicContact CE1-CD1 3.81Å; F406-I630 HydrophobicContact CE1-CG1 4.07Å; I407-I630 HydrophobicContact CG1-CB 4.15Å; I407-I630 HydrophobicContact CG1-CD1 4.22Å; F519-I630 HydrophobicContact CD1-CD1 4.32Å; F519-I630 HydrophobicContact CD1-CG1 4.3Å; F519-I630 HydrophobicContact CE1-CD1 4.01Å; F519-I630 HydrophobicContact CE1-CG1 3.64Å; F519-I630 HydrophobicContact CZ-CG1 4.46Å; L527-I630 HydrophobicContact CD2-CB 4.33Å; L527-I630 HydrophobicContact CD2-CG1 3.77Å; L527-I630 HydrophobicContact CD2-CG2 3.89Å; V587-I630 HydrophobicContact CG1-CB 4.28Å; V587-I630 HydrophobicContact CG1-CG2 4.02Å; V587-I630 WeakPolarHBondContact O-CB 3.27Å; V587-I630 WeakPolarHBondContact O-CG2 3.02Å; V587-I630 PolarHBondContact O-N 3.5Å; T588-I630 HydrophobicContact CG2-CG2 4.43Å; I630-H634 PolarHBondContact O-CD2 3.42Å; I630-H634 VanDerWaalsContact O-CD2 3.31Å; I630-H634 PolarHBondContact O-N 3.26Å; I630-H634 VanDerWaalsContact O-N 3.14Å
631	Y	91.7	Very high	88	Confident	2 Å²	2	37.6 Å²	37.6	1%	0.008	20%	0.197	C	C	.	.	H	α-helix	trans	-73.4	-41.5	-178.5	-61.4	-55	0	0	0	112.3	I240 P241 F528 T588 G629 H634 I635	I240-Y631 HydrophobicContact CB-CD1 4.13Å; I240-Y631 HydrophobicContact CB-CE1 3.96Å; I240-Y631 HydrophobicContact CD1-CE1 4.16Å; I240-Y631 HydrophobicContact CD1-CE2 4.37Å; I240-Y631 WeakPolarHBondContact CD1-OH 3.44Å; I240-Y631 HydrophobicContact CG2-CD1 4.04Å; I240-Y631 HydrophobicContact CG2-CD2 3.99Å; I240-Y631 HydrophobicContact CG2-CE1 4.14Å; I240-Y631 HydrophobicContact CG2-CE2 4.1Å; I240-Y631 HydrophobicContact CG2-CG 3.97Å; P241-Y631 HydrophobicContact CG-CD1 3.86Å; F528-Y631 HydrophobicContact CE1-CE2 4.19Å; F528-Y631 WeakPolarHBondContact CE1-OH 3.25Å; F528-Y631 WeakPolarHBondContact CZ-OH 3.46Å; T588-Y631 HydrophobicContact CG2-CE2 4.05Å; G629-Y631 VanDerWaalsContact C-N 3.25Å; G629-Y631 PolarHBondContact O-N 3.04Å; Y631-H634 PolarHBondContact O-N 2.97Å; Y631-I635 WeakPolarHBondContact O-CG1 3.2Å; Y631-I635 PolarHBondContact O-N 3.5Å
632	E	89.1	Confident	87.3	Confident	14 Å²	14	36.8 Å²	36.8	7%	0.065	19%	0.191	C	C	.	.	H	α-helix	trans	-63	-42.4	173.7	-73.6	133.5	-172.7	0	0	111.3	K244 G629 H634 I635 R636 F642 E644	K244-E632 IonicContact NZ-OE1 2.68Å; K244-E632 PolarHBondContact NZ-OE1 2.71Å; G629-E632 PolarHBondContact N-OE2 3.11Å; G629-E632 PolarHBondContact O-N 3.46Å; E632-H634 VanDerWaalsContact C-N 3.3Å; E632-H634 PolarHBondContact O-N 3.26Å; E632-I635 WeakPolarHBondContact O-CB 3.5Å; E632-I635 PolarHBondContact O-N 2.94Å; E632-R636 WeakPolarHBondContact O-CB 3.46Å; E632-R636 PolarHBondContact O-N 3.3Å; E632-F642 HydrophobicContact CG-CE1 4.31Å; E632-E644 HydrophobicContact CG-CG 4.24Å
633	A	90.3	Very high	86.5	Confident	4 Å²	4	37 Å²	37	3%	0.033	19%	0.192	C	C	.	.	H	α-helix	trans	-59.2	-37.2	174.3	0	0	0	0	0	113.4	I407 I411 G629 L637	I407-A633 HydrophobicContact CG2-CB 4.4Å; I411-A633 HydrophobicContact CD1-CB 3.52Å; I411-A633 HydrophobicContact CG1-CB 3.93Å; G629-A633 WeakPolarHBondContact O-CB 3.48Å; G629-A633 PolarHBondContact O-N 3.37Å; A633-L637 VanDerWaalsContact O-CB 3.27Å; A633-L637 WeakPolarHBondContact O-CB 3.04Å; A633-L637 PolarHBondContact O-N 3.1Å
634	H	89.7	Confident	85.6	Confident	20 Å²	20	35.3 Å²	35.3	9%	0.093	18%	0.182	C	C	.	.	H	α-helix	trans	-73.4	-39.4	174.7	-90.6	-98	0	0	0	112.9	P241 N410 F519 I630 Y631 E632 R636 L637 N638	P241-H634 HydrophobicContact CB-CB 4.46Å; P241-H634 HydrophobicContact CG-CB 4.11Å; N410-H634 PolarHBondContact ND2-NE2 2.95Å; F519-H634 AromaticContact CD1-NE2 3.65Å; F519-H634 AromaticContact CE1-CD2 3.73Å; F519-H634 AromaticContact CE1-CE1 3.89Å; F519-H634 AromaticContact CE1-NE2 3.27Å; F519-H634 VanDerWaalsContact CE1-NE2 3.27Å; F519-H634 WeakPolarHBondContact CE1-NE2 3.45Å; I630-H634 PolarHBondContact O-CD2 3.42Å; I630-H634 VanDerWaalsContact O-CD2 3.31Å; I630-H634 PolarHBondContact O-N 3.26Å; I630-H634 VanDerWaalsContact O-N 3.14Å; Y631-H634 PolarHBondContact O-N 2.97Å; E632-H634 VanDerWaalsContact C-N 3.3Å; E632-H634 PolarHBondContact O-N 3.26Å; H634-R636 VanDerWaalsContact C-N 3.27Å; H634-R636 PolarHBondContact O-N 3.44Å; H634-L637 PolarHBondContact O-N 2.76Å; H634-N638 WeakPolarHBondContact O-CB 3.5Å; H634-N638 PolarHBondContact O-N 2.9Å
635	I	89.4	Confident	84.3	Confident	3 Å²	3	33.9 Å²	33.9	2%	0.015	17%	0.166	C	C	.	.	H	α-helix	trans	-53.2	-49.1	170.9	-75.1	171.5	0	0	0	110	P241 K244 T245 Y631 E632 N638 G639 Y640 F642	P241-I635 HydrophobicContact CB-CG1 3.82Å; K244-I635 HydrophobicContact CB-CD1 4.12Å; K244-I635 HydrophobicContact CD-CD1 4.08Å; K244-I635 HydrophobicContact CG-CD1 4.13Å; T245-I635 HydrophobicContact CG2-CD1 4.01Å; T245-I635 HydrophobicContact CG2-CG1 3.86Å; T245-I635 HydrophobicContact CG2-CG2 4.02Å; Y631-I635 WeakPolarHBondContact O-CG1 3.2Å; Y631-I635 PolarHBondContact O-N 3.5Å; E632-I635 WeakPolarHBondContact O-CB 3.5Å; E632-I635 PolarHBondContact O-N 2.94Å; I635-N638 CarbonylContact O-C 3.33Å; I635-N638 PolarHBondContact O-N 3.42Å; I635-G639 PolarHBondContact O-N 3.12Å; I635-G639 VanDerWaalsContact O-N 3.11Å; I635-Y640 PolarHBondContact O-N 3.12Å; I635-F642 HydrophobicContact CD1-CD1 4.09Å; I635-F642 HydrophobicContact CD1-CE1 4.31Å; I635-F642 HydrophobicContact CD1-CG 4.28Å; I635-F642 HydrophobicContact CG2-CB 3.44Å; I635-F642 VanDerWaalsContact CG2-CB 3.44Å; I635-F642 HydrophobicContact CG2-CD1 4.08Å; I635-F642 HydrophobicContact CG2-CG 3.99Å
636	R	84.9	Confident	82.9	Confident	77 Å²	77	34.4 Å²	34.4	29%	0.291	17%	0.168	S	C	.	.	H	α-helix	trans	-68.2	-40.6	-179.9	-158.5	171	-68.5	-166	-6.5	112.4	E628 E632 H634 N638 G639 E644 E647	E628-R636 IonicContact OE1-CZ 3.99Å; E628-R636 IonicContact OE1-NH1 4Å; E628-R636 PolarHBondContact OE1-NH1 3.46Å; E628-R636 WeakPolarHBondContact OE2-CD 3.28Å; E628-R636 IonicContact OE2-CZ 2.71Å; E628-R636 IonicContact OE2-NE 3.67Å; E628-R636 PolarHBondContact OE2-NE 2.94Å; E628-R636 IonicContact OE2-NH1 3.89Å; E628-R636 PolarHBondContact OE2-NH1 3.45Å; E632-R636 WeakPolarHBondContact O-CB 3.46Å; E632-R636 PolarHBondContact O-N 3.3Å; H634-R636 VanDerWaalsContact C-N 3.27Å; H634-R636 PolarHBondContact O-N 3.44Å; R636-N638 PolarHBondContact O-N 3.4Å; R636-G639 PolarHBondContact O-N 3.23Å; R636-E644 IonicContact CZ-OE1 3.97Å; R636-E644 IonicContact NE-OE1 3.75Å; R636-E644 VanDerWaalsContact NH2-CD 3.34Å; R636-E644 IonicContact NH2-OE1 3.27Å; R636-E644 PolarHBondContact NH2-OE1 2.93Å; R636-E644 IonicContact NH2-OE2 3.61Å; R636-E644 PolarHBondContact NH2-OE2 3.19Å; R636-E647 IonicContact NH2-OE1 3.97Å; R636-E647 PolarHBondContact NH2-OE1 3.03Å
637	L	85.6	Confident	82	Confident	33 Å²	33	35.3 Å²	35.3	17%	0.173	16%	0.164	C	C	.	.	H	α-helix	trans	-64.8	-26	173.6	-177.1	63.6	0	0	0	113	C414 R415 K418 A633 H634	C414-L637 HydrophobicContact CB-CD2 3.45Å; C414-L637 VanDerWaalsContact CB-CD2 3.45Å; R415-L637 HydrophobicContact CB-CD1 4.31Å; K418-L637 PolarHBondContact NZ-O 2.7Å; A633-L637 VanDerWaalsContact O-CB 3.27Å; A633-L637 WeakPolarHBondContact O-CB 3.04Å; A633-L637 PolarHBondContact O-N 3.1Å; H634-L637 PolarHBondContact O-N 2.76Å
638	N	83.4	Confident	81.2	Confident	50 Å²	50	34.7 Å²	34.7	27%	0.267	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-2.8	173.9	-70.6	-18.4	0	0	0	113.5	K418 H634 I635 R636 Y640	K418-N638 PolarHBondContact NZ-OD1 3.37Å; H634-N638 WeakPolarHBondContact O-CB 3.5Å; H634-N638 PolarHBondContact O-N 2.9Å; I635-N638 CarbonylContact O-C 3.33Å; I635-N638 PolarHBondContact O-N 3.42Å; R636-N638 PolarHBondContact O-N 3.4Å; N638-Y640 VanDerWaalsContact C-N 3.27Å; N638-Y640 HydrophobicContact CB-CD2 3.65Å; N638-Y640 HydrophobicContact CB-CE2 3.5Å; N638-Y640 VanDerWaalsContact CB-CE2 3.5Å; N638-Y640 HydrophobicContact CB-CG 4.45Å; N638-Y640 PolarHBondContact O-N 2.99Å
639	G	79.6	Confident	80.3	Confident	15 Å²	15	34 Å²	34	16%	0.155	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	76	1	176.8	0	0	0	0	0	115.6	I635 R636 F818	I635-G639 PolarHBondContact O-N 3.12Å; I635-G639 VanDerWaalsContact O-N 3.11Å; R636-G639 PolarHBondContact O-N 3.23Å; G639-F818 WeakPolarHBondContact O-CE2 3.29Å
640	Y	83.3	Confident	79.1	Confident	41 Å²	41	40.2 Å²	40.2	16%	0.161	19%	0.194	C	C	.	.			trans	-57	141.8	-172.7	-66.7	-57.5	0	0	0	112.8	E242 T245 F250 I252 I635 N638 F642 F818	E242-Y640 HydrophobicContact CG-CE2 4.32Å; T245-Y640 HydrophobicContact CG2-CD2 4Å; T245-Y640 HydrophobicContact CG2-CG 3.98Å; F250-Y640 HydrophobicContact CD1-CD1 4.36Å; F250-Y640 AromaticContact CE1-CD1 3.87Å; F250-Y640 HydrophobicContact CE1-CD1 3.87Å; F250-Y640 HydrophobicContact CE1-CE1 4.3Å; I252-Y640 HydrophobicContact CD1-CE1 4.01Å; I635-Y640 PolarHBondContact O-N 3.12Å; N638-Y640 VanDerWaalsContact C-N 3.27Å; N638-Y640 HydrophobicContact CB-CD2 3.65Å; N638-Y640 HydrophobicContact CB-CE2 3.5Å; N638-Y640 VanDerWaalsContact CB-CE2 3.5Å; N638-Y640 HydrophobicContact CB-CG 4.45Å; N638-Y640 PolarHBondContact O-N 2.99Å; Y640-F642 PolarHBondContact O-N 3.34Å; Y640-F818 HydrophobicContact CD1-CE1 4.28Å; Y640-F818 HydrophobicContact CD1-CE2 4.37Å; Y640-F818 AromaticContact CD1-CZ 3.5Å; Y640-F818 HydrophobicContact CD1-CZ 3.5Å; Y640-F818 HydrophobicContact CE1-CE1 4.36Å; Y640-F818 HydrophobicContact CE1-CZ 4Å; Y640-F818 HydrophobicContact CG-CZ 4.3Å
641	P	78	Confident	78.1	Confident	8 Å²	8	44.4 Å²	44.4	5%	0.052	21%	0.213	C	C	.	.			trans	-81.2	70.6	-174.3	35.3	-34.5	0	0	0	111	F250 K798 L802	F250-P641 HydrophobicContact CD2-CG 3.58Å; F250-P641 HydrophobicContact CE2-CG 3.44Å; F250-P641 VanDerWaalsContact CE2-CG 3.44Å; F250-P641 HydrophobicContact CG-CG 4.27Å; F250-P641 HydrophobicContact CZ-CG 4.03Å; P641-K798 WeakPolarHBondContact O-CE 3.13Å; P641-K798 PolarHBondContact O-NZ 2.94Å; P641-L802 HydrophobicContact CB-CD1 3.96Å
642	F	82	Confident	77.4	Confident	16 Å²	16	50.1 Å²	50.1	7%	0.07	25%	0.253	C	S	.	.			trans	-99	130.6	178.4	-172.1	-116.6	0	0	0	109.8	K244 T245 E632 I635 Y640 E644 L802	K244-F642 HydrophobicContact CD-CE1 4.5Å; K244-F642 HydrophobicContact CD-CZ 4.09Å; K244-F642 HydrophobicContact CG-CE1 4.46Å; K244-F642 HydrophobicContact CG-CE2 3.87Å; K244-F642 HydrophobicContact CG-CZ 3.7Å; T245-F642 HydrophobicContact CG2-CB 4.44Å; E632-F642 HydrophobicContact CG-CE1 4.31Å; I635-F642 HydrophobicContact CD1-CD1 4.09Å; I635-F642 HydrophobicContact CD1-CE1 4.31Å; I635-F642 HydrophobicContact CD1-CG 4.28Å; I635-F642 HydrophobicContact CG2-CB 3.44Å; I635-F642 VanDerWaalsContact CG2-CB 3.44Å; I635-F642 HydrophobicContact CG2-CD1 4.08Å; I635-F642 HydrophobicContact CG2-CG 3.99Å; Y640-F642 PolarHBondContact O-N 3.34Å; F642-E644 HydrophobicContact CD1-CG 3.67Å; F642-E644 HydrophobicContact CE1-CB 4.45Å; F642-E644 HydrophobicContact CE1-CG 3.44Å; F642-E644 VanDerWaalsContact CE1-CG 3.44Å; F642-L802 VanDerWaalsContact O-CD2 3.25Å; F642-L802 WeakPolarHBondContact O-CD2 3.01Å
643	L	78.6	Confident	77.2	Confident	5 Å²	5	50.3 Å²	50.3	3%	0.026	26%	0.256	C	S	.	.			trans	-110.6	111.2	176	-177.9	63.4	0	0	0	106.4	V773 F776 R777 I801 L802 M805	L643-V773 HydrophobicContact CD1-CG1 4.45Å; L643-V773 HydrophobicContact CD2-CG1 4.48Å; L643-F776 HydrophobicContact CD2-CB 4.12Å; L643-R777 HydrophobicContact CD2-CG 3.68Å; L643-R777 HydrophobicContact CG-CG 3.95Å; L643-I801 HydrophobicContact CD1-CG2 4.22Å; L643-L802 HydrophobicContact CB-CD2 4.44Å; L643-L802 HydrophobicContact CD1-CD2 3.97Å; L643-M805 HydrophobicContact CD1-CE 4.49Å; L643-M805 HydrophobicContact CD1-SD 3.78Å
644	E	72.6	Confident	77.2	Confident	12 Å²	12	52.7 Å²	52.7	6%	0.056	27%	0.268	C	S	.	.			trans	-69.5	132.6	-172.8	-81.8	163.9	-134.7	0	0	110.8	E632 R636 F642 K646 E647 R777	E632-E644 HydrophobicContact CG-CG 4.24Å; R636-E644 IonicContact CZ-OE1 3.97Å; R636-E644 IonicContact NE-OE1 3.75Å; R636-E644 VanDerWaalsContact NH2-CD 3.34Å; R636-E644 IonicContact NH2-OE1 3.27Å; R636-E644 PolarHBondContact NH2-OE1 2.93Å; R636-E644 IonicContact NH2-OE2 3.61Å; R636-E644 PolarHBondContact NH2-OE2 3.19Å; F642-E644 HydrophobicContact CD1-CG 3.67Å; F642-E644 HydrophobicContact CE1-CB 4.45Å; F642-E644 HydrophobicContact CE1-CG 3.44Å; F642-E644 VanDerWaalsContact CE1-CG 3.44Å; E644-K646 VanDerWaalsContact C-N 3.29Å; E644-E647 HydrophobicContact CB-CG 4.06Å; E644-R777 PolarHBondContact O-NE 3.27Å; E644-R777 PolarHBondContact O-NH2 3.09Å
645	P	65.8	Low	77.2	Confident	58 Å²	58	51.7 Å²	51.7	38%	0.377	26%	0.264	S	S	.	.	S	Bend	trans	-69.4	-26.3	174.9	20	-26.1	0	0	0	113.3	Y341	Y341-P645 HydrophobicContact CD2-CB 3.89Å; Y341-P645 HydrophobicContact CD2-CG 4.07Å; Y341-P645 HydrophobicContact CE2-CB 3.68Å; Y341-P645 HydrophobicContact CE2-CG 4.36Å
646	K	63.3	Low	77.2	Confident	114 Å²	114	54.2 Å²	54.2	50%	0.496	28%	0.279	S	S	.	.	S	Bend	trans	-90.2	-8.5	-168.1	-60.6	175.4	-174.8	177.6	0	113.9	E337 E338 E644	E337-K646 PolarHBondContact O-NZ 2.82Å; E338-K646 IonicContact OE1-NZ 3.39Å; E338-K646 PolarHBondContact OE1-NZ 3.47Å; E644-K646 VanDerWaalsContact C-N 3.29Å
647	E	65.6	Low	77.4	Confident	50 Å²	50	54.4 Å²	54.4	23%	0.234	29%	0.286	C	S	.	.			trans	-89.9	111.1	179.9	-71.2	-177.7	151.3	0	0	111.2	R636 E644 R777 M805	R636-E647 IonicContact NH2-OE1 3.97Å; R636-E647 PolarHBondContact NH2-OE1 3.03Å; E644-E647 HydrophobicContact CB-CG 4.06Å; E647-R777 PolarHBondContact O-NH1 3.49Å; E647-R777 PolarHBondContact O-NH2 2.86Å; E647-M805 WeakPolarHBondContact OE2-CE 3.29Å
648	E	63.7	Low	77.5	Confident	164 Å²	164	52.9 Å²	52.9	77%	0.766	28%	0.278	S	S	*	.			trans	-68.4	140.2	169.8	-68.9	-179.4	177.2	0	0	110.9	E650	E648-E650 PolarHBondContact O-N 3.39Å
649	F	65.9	Low	77.8	Confident	26 Å²	26	51.5 Å²	51.5	11%	0.114	27%	0.27	C	S	.	.			trans	-94.5	90.8	-179.8	-169.8	-96.9	0	0	0	109.9	H651 M769 D770 V773 M805 I808	F649-H651 HydrophobicContact CD1-CB 4.31Å; F649-H651 WeakPolarHBondContact CD1-O 3.38Å; F649-H651 HydrophobicContact CE1-CB 3.73Å; F649-H651 WeakPolarHBondContact CE1-O 3.35Å; F649-H651 HydrophobicContact CZ-CB 3.9Å; F649-H651 PolarHBondContact O-N 2.66Å; F649-H651 VanDerWaalsContact O-N 3.1Å; F649-M769 HydrophobicContact CD1-CB 4.24Å; F649-M769 HydrophobicContact CE1-CB 3.55Å; F649-M769 HydrophobicContact CZ-CB 4.09Å; F649-D770 HydrophobicContact CB-CB 4.31Å; F649-D770 HydrophobicContact CD1-CB 4.16Å; F649-V773 HydrophobicContact CD2-CG2 4.4Å; F649-M805 HydrophobicContact CD2-CG 4.32Å; F649-M805 HydrophobicContact CE2-CG 3.97Å; F649-I808 HydrophobicContact CE2-CD1 4.31Å; F649-I808 HydrophobicContact CZ-CD1 4.04Å
650	E	66	Low	78.3	Confident	132 Å²	132	54.8 Å²	54.8	62%	0.617	28%	0.278	S	S	*	.			trans	-73.9	6.7	-172.7	-59	173.2	-149.7	0	0	114.4	R627 E648	R627-E650 IonicContact CZ-OE1 3.46Å; R627-E650 IonicContact NH1-OE1 3.92Å; R627-E650 PolarHBondContact NH1-OE1 2.96Å; R627-E650 IonicContact NH2-OE1 2.68Å; E648-E650 PolarHBondContact O-N 3.39Å
651	H	71.8	Confident	78.5	Confident	89 Å²	89	54.3 Å²	54.3	41%	0.412	28%	0.279	S	S	.	.			trans	-111.4	140	-168.3	-56.6	-61.2	0	0	0	114.6	F649 S653 I808	F649-H651 HydrophobicContact CD1-CB 4.31Å; F649-H651 WeakPolarHBondContact CD1-O 3.38Å; F649-H651 HydrophobicContact CE1-CB 3.73Å; F649-H651 WeakPolarHBondContact CE1-O 3.35Å; F649-H651 HydrophobicContact CZ-CB 3.9Å; F649-H651 PolarHBondContact O-N 2.66Å; F649-H651 VanDerWaalsContact O-N 3.1Å; H651-S653 VanDerWaalsContact C-N 3.34Å; H651-S653 PolarHBondContact O-N 2.88Å; H651-I808 HydrophobicContact CB-CD1 4.43Å; H651-I808 VanDerWaalsContact NE2-CG2 3.29Å; H651-I808 WeakPolarHBondContact NE2-CG2 3.45Å
652	S	76.4	Confident	78.7	Confident	121 Å²	121	57.9 Å²	57.9	85%	0.846	29%	0.292	S	S	*	.			trans	-86.6	20.1	-173.7	55.2	0	0	0	0	116.1
653	S	85.8	Confident	78.4	Confident	19 Å²	19	69.7 Å²	69.7	13%	0.133	34%	0.336	C	S	.	.			trans	-67.7	152.1	176.5	53.8	0	0	0	0	112.2	H651 M769 H804	H651-S653 VanDerWaalsContact C-N 3.34Å; H651-S653 PolarHBondContact O-N 2.88Å; S653-M769 WeakPolarHBondContact O-CB 3.49Å; S653-M769 VanDerWaalsContact O-CG 3.28Å; S653-M769 WeakPolarHBondContact O-CG 3.24Å; S653-M769 PolarHBondContact O-N 3.06Å; S653-M769 WeakPolarHBondContact OG-CG 3.17Å; S653-H804 PolarHBondContact OG-NE2 3.31Å
654	L	90.8	Very high	78	Confident	53 Å²	53	73.3 Å²	73.3	28%	0.277	38%	0.375	S	S	.	.	B	Isolated β-bridge	trans	-103.1	161.3	-179.8	-61.3	178.5	0	0	0	112	V656 D657	L654-V656 HydrophobicContact CB-CG1 3.98Å; L654-V656 PolarHBondContact O-N 2.73Å; L654-D657 PolarHBondContact N-OD2 3.27Å; L654-D657 WeakPolarHBondContact O-CB 3.4Å; L654-D657 PolarHBondContact O-N 3.4Å
655	A	89.6	Confident	78.4	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	39%	0.388	C	S	.	.	H	α-helix	trans	-52.5	-38.1	176.3	0	0	0	0	0	112.8	D657 V658 M659 V763 T767 V786 I796	A655-D657 VanDerWaalsContact C-N 3.25Å; A655-D657 PolarHBondContact O-N 3.5Å; A655-V658 PolarHBondContact O-N 3.38Å; A655-M659 WeakPolarHBondContact O-CB 3.42Å; A655-M659 PolarHBondContact O-N 2.85Å; A655-V763 HydrophobicContact CB-CG2 4.26Å; A655-T767 WeakPolarHBondContact CB-O 3.32Å; A655-T767 PolarHBondContact N-O 2.84Å; A655-V786 HydrophobicContact CB-CG2 4.49Å; A655-I796 HydrophobicContact CB-CD1 3.94Å
656	V	89.6	Confident	79.1	Confident	56 Å²	56	77.8 Å²	77.8	34%	0.339	40%	0.401	S	S	.	.	H	α-helix	trans	-61.7	-25.4	177	72.4	0	0	0	0	114.3	L654 M659 D765	L654-V656 HydrophobicContact CB-CG1 3.98Å; L654-V656 PolarHBondContact O-N 2.73Å; V656-M659 HydrophobicContact CG2-CE 3.75Å; V656-M659 HydrophobicContact CG2-SD 4.46Å; V656-D765 HydrophobicContact CB-CB 4.21Å; V656-D765 HydrophobicContact CG2-CB 4.48Å; V656-D765 PolarHBondContact N-O 3.48Å
657	D	87.9	Confident	80	Confident	81 Å²	81	76.9 Å²	76.9	43%	0.433	42%	0.415	S	S	.	.	H	α-helix	trans	-80.5	-26.4	-179.6	-56.6	-43.3	0	0	0	112.2	L654 A655	L654-D657 PolarHBondContact N-OD2 3.27Å; L654-D657 WeakPolarHBondContact O-CB 3.4Å; L654-D657 PolarHBondContact O-N 3.4Å; A655-D657 VanDerWaalsContact C-N 3.25Å; A655-D657 PolarHBondContact O-N 3.5Å
658	V	87.9	Confident	81	Confident	1 Å²	1	76.7 Å²	76.7	1%	0.006	42%	0.416	C	S	.	.	H	α-helix	trans	-98.9	-31.8	-173.7	-176	0	0	0	0	112.2	A655 M769 D800 H804	A655-V658 PolarHBondContact O-N 3.38Å; V658-M769 HydrophobicContact CB-CE 4.21Å; V658-M769 HydrophobicContact CB-SD 3.87Å; V658-M769 HydrophobicContact CG1-CE 4.17Å; V658-M769 HydrophobicContact CG1-SD 4.46Å; V658-M769 HydrophobicContact CG2-CE 3.93Å; V658-M769 HydrophobicContact CG2-CG 3.73Å; V658-M769 HydrophobicContact CG2-SD 3.56Å; V658-M769 VanDerWaalsContact CG2-SD 3.56Å; V658-D800 HydrophobicContact CG1-CB 4.27Å; V658-H804 HydrophobicContact CG1-CB 4.11Å; V658-H804 HydrophobicContact CG2-CB 4.25Å; V658-H804 WeakPolarHBondContact CG2-CD2 3.34Å; V658-H804 WeakPolarHBondContact CG2-NE2 3.49Å
659	M	90.3	Very high	82.2	Confident	20 Å²	20	69.7 Å²	69.7	10%	0.099	39%	0.386	C	S	.	.	S	Bend	trans	-59.1	155.7	-175.9	75.3	178.8	-169.5	0	0	114.1	A655 V656 V786 L793 I796	A655-M659 WeakPolarHBondContact O-CB 3.42Å; A655-M659 PolarHBondContact O-N 2.85Å; V656-M659 HydrophobicContact CG2-CE 3.75Å; V656-M659 HydrophobicContact CG2-SD 4.46Å; M659-V786 HydrophobicContact CB-CG2 3.85Å; M659-V786 HydrophobicContact SD-CB 3.73Å; M659-V786 HydrophobicContact SD-CG1 3.68Å; M659-V786 HydrophobicContact SD-CG2 4.07Å; M659-L793 HydrophobicContact CE-CB 3.96Å; M659-L793 HydrophobicContact SD-CB 4.1Å; M659-I796 HydrophobicContact CB-CD1 4.36Å; M659-I796 HydrophobicContact CB-CG1 3.75Å
660	R	88.9	Confident	83.4	Confident	85 Å²	85	69.1 Å²	69.1	32%	0.321	39%	0.385	S	S	.	.	B	Isolated β-bridge	trans	-110.3	140.3	169.2	-68.8	-67.5	-173.3	161.5	2.2	110.1	D665 G794 I795 D800	R660-D665 WeakPolarHBondContact CD-OD2 3.36Å; R660-D665 IonicContact CZ-OD2 2.88Å; R660-D665 IonicContact NE-OD2 2.69Å; R660-D665 VanDerWaalsContact NH1-CG 3.34Å; R660-D665 IonicContact NH1-OD1 2.69Å; R660-D665 PolarHBondContact NH1-OD1 2.73Å; R660-D665 IonicContact NH1-OD2 2.66Å; R660-D665 PolarHBondContact NH1-OD2 3.07Å; R660-G794 CarbonylContact O-C 3.59Å; R660-G794 WeakPolarHBondContact O-CA 3.31Å; R660-I795 PolarHBondContact N-O 3.08Å; R660-I795 PolarHBondContact O-N 2.84Å; R660-D800 IonicContact NE-OD1 2.83Å
661	P	87.8	Confident	84.7	Confident	30 Å²	30	62.9 Å²	62.9	20%	0.195	36%	0.356	C	S	.	.	S	Bend	cis	-75.2	146	-0.7	30.5	-35.3	0	0	0	113.3	D665 P666 L668	P661-D665 HydrophobicContact CB-CB 3.61Å; P661-P666 VanDerWaalsContact CB-O 3.25Å; P661-P666 WeakPolarHBondContact CB-O 3.38Å; P661-L668 HydrophobicContact CG-CB 4.4Å
662	R	82.6	Confident	85.6	Confident	84 Å²	84	58.7 Å²	58.7	32%	0.317	34%	0.336	S	S	.	.			trans	-78.9	166.2	167.6	-69.8	-175.9	172.9	-174.7	-2.4	110.5	G664 D665	R662-G664 PolarHBondContact O-N 3.08Å; R662-D665 WeakPolarHBondContact CB-OD2 3.31Å; R662-D665 PolarHBondContact N-OD2 3.43Å; R662-D665 WeakPolarHBondContact O-CB 3.37Å; R662-D665 PolarHBondContact O-N 3.08Å
663	R	74.9	Confident	86.1	Confident	263 Å²	263	54.8 Å²	54.8	99%	0.992	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	104.3	173.4	-66.5	-177.5	-178.9	178.9	1.6	110.3
664	G	70.1	Confident	86	Confident	82 Å²	82	56.1 Å²	56.1	85%	0.845	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	111.7	-10.8	-177.6	0	0	0	0	0	115.1	R662	R662-G664 PolarHBondContact O-N 3.08Å
665	D	81.2	Confident	85.7	Confident	61 Å²	61	56.9 Å²	56.9	33%	0.326	32%	0.32	S	S	.	.	S	Bend	trans	-72.3	157.9	166.3	-74.5	-22.8	0	0	0	110.4	R660 P661 R662	R660-D665 WeakPolarHBondContact CD-OD2 3.36Å; R660-D665 IonicContact CZ-OD2 2.88Å; R660-D665 IonicContact NE-OD2 2.69Å; R660-D665 VanDerWaalsContact NH1-CG 3.34Å; R660-D665 IonicContact NH1-OD1 2.69Å; R660-D665 PolarHBondContact NH1-OD1 2.73Å; R660-D665 IonicContact NH1-OD2 2.66Å; R660-D665 PolarHBondContact NH1-OD2 3.07Å; P661-D665 HydrophobicContact CB-CB 3.61Å; R662-D665 WeakPolarHBondContact CB-OD2 3.31Å; R662-D665 PolarHBondContact N-OD2 3.43Å; R662-D665 WeakPolarHBondContact O-CB 3.37Å; R662-D665 PolarHBondContact O-N 3.08Å
666	P	80.9	Confident	85.7	Confident	102 Å²	102	58 Å²	58	66%	0.662	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-60	152.5	169.5	27	-35.7	0	0	0	111.9	P661	P661-P666 VanDerWaalsContact CB-O 3.25Å; P661-P666 WeakPolarHBondContact CB-O 3.38Å
667	A	82.5	Confident	85.7	Confident	95 Å²	95	57.1 Å²	57.1	79%	0.785	32%	0.32	S	S	*	.	P	Polyproline II helix	trans	-57.5	149.7	178.8	0	0	0	0	0	112.3	A669	A667-A669 PolarHBondContact O-N 2.92Å
668	L	86.2	Confident	85.7	Confident	46 Å²	46	53.3 Å²	53.3	24%	0.241	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-61.8	130.8	-179.7	-170.5	64.3	0	0	0	110.6	P661 V670 P694 L792 I795	P661-L668 HydrophobicContact CG-CB 4.4Å; L668-V670 HydrophobicContact CB-CG1 4.45Å; L668-V670 HydrophobicContact CD2-CG1 4.41Å; L668-V670 HydrophobicContact CG-CG1 4.36Å; L668-V670 PolarHBondContact O-N 3.45Å; L668-V670 VanDerWaalsContact O-N 3.17Å; L668-P694 HydrophobicContact CD2-CG 4.01Å; L668-L792 HydrophobicContact CD2-CD2 3.77Å; L668-L792 HydrophobicContact CD2-CG 4.11Å; L668-I795 HydrophobicContact CD1-CG2 3.92Å
669	A	89.3	Confident	85.7	Confident	17 Å²	17	54.2 Å²	54.2	14%	0.14	31%	0.309	C	S	.	.			trans	-67.9	110.7	171.7	0	0	0	0	0	109.8	A667 L684 T688 Y690 F693	A667-A669 PolarHBondContact O-N 2.92Å; A669-L684 HydrophobicContact CB-CD1 4.14Å; A669-T688 HydrophobicContact CB-CG2 4.42Å; A669-Y690 HydrophobicContact CB-CD2 4.05Å; A669-Y690 HydrophobicContact CB-CE2 4.11Å; A669-F693 HydrophobicContact CB-CD1 3.99Å; A669-F693 HydrophobicContact CB-CE1 4.08Å
670	V	91.6	Very high	85.7	Confident	15 Å²	15	57.8 Å²	57.8	9%	0.091	33%	0.326	C	S	.	.			trans	-117.8	149.6	-178.9	-61.7	0	0	0	0	110.7	L668 P694 V696 L792	L668-V670 HydrophobicContact CB-CG1 4.45Å; L668-V670 HydrophobicContact CD2-CG1 4.41Å; L668-V670 HydrophobicContact CG-CG1 4.36Å; L668-V670 PolarHBondContact O-N 3.45Å; L668-V670 VanDerWaalsContact O-N 3.17Å; V670-P694 HydrophobicContact CG1-CG 4.17Å; V670-V696 HydrophobicContact CB-CG1 4.39Å; V670-V696 HydrophobicContact CB-CG2 4.03Å; V670-V696 HydrophobicContact CG1-CG1 4.27Å; V670-V696 HydrophobicContact CG2-CG2 3.97Å; V670-L792 HydrophobicContact CG1-CD2 4.09Å
671	L	92.1	Very high	85.8	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	141.4	167.5	-68.9	173.5	0	0	0	109.6	M676 V681 L684 F693 P694 V695 V696 L713 F735	L671-M676 HydrophobicContact CD2-SD 3.87Å; L671-V681 HydrophobicContact CD2-CG1 4.32Å; L671-V681 HydrophobicContact CD2-CG2 3.97Å; L671-L684 HydrophobicContact CD2-CD2 3.79Å; L671-F693 HydrophobicContact CD1-CB 3.87Å; L671-F693 HydrophobicContact CD1-CD2 4.38Å; L671-F693 HydrophobicContact CD1-CG 4.38Å; L671-F693 HydrophobicContact CG-CB 3.88Å; L671-F693 HydrophobicContact CG-CG 4.38Å; L671-P694 PolarHBondContact N-O 3.2Å; L671-V695 HydrophobicContact CB-CG2 4.28Å; L671-V695 CarbonylContact O-C 3.54Å; L671-V695 VanDerWaalsContact O-CA 3.29Å; L671-V695 WeakPolarHBondContact O-CA 3.32Å; L671-V696 PolarHBondContact O-N 3.49Å; L671-L713 HydrophobicContact CD1-CD2 3.97Å; L671-F735 HydrophobicContact CD1-CZ 4.34Å
672	T	90.8	Very high	86	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.006	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	148.5	173.2	58.6	0	0	0	0	111.4	D674 S675 M676 V696 Q699	T672-D674 VanDerWaalsContact C-N 3.31Å; T672-D674 PolarHBondContact O-N 2.96Å; T672-S675 WeakPolarHBondContact CB-OG 3.49Å; T672-S675 WeakPolarHBondContact CG2-OG 3.44Å; T672-S675 PolarHBondContact OG1-N 3.43Å; T672-S675 PolarHBondContact OG1-OG 3.02Å; T672-M676 HydrophobicContact CG2-SD 4.44Å; T672-M676 VanDerWaalsContact OG1-CG 3.29Å; T672-M676 WeakPolarHBondContact OG1-CG 3.47Å; T672-M676 PolarHBondContact OG1-N 3.4Å; T672-V696 CarbonylContact C-O 3.5Å; T672-V696 WeakPolarHBondContact CA-O 3.49Å; T672-Q699 HydrophobicContact CG2-CG 3.79Å
673	Q	86.6	Confident	86.4	Confident	38 Å²	38	54.2 Å²	54.2	18%	0.178	32%	0.32	C	S	.	.	S	Bend	trans	-60.8	-33.8	-177.7	76.1	-175.9	7.6	0	0	114.4	V695 V696 F735 T736	Q673-V695 HydrophobicContact CB-CG1 4.42Å; Q673-V696 PolarHBondContact N-O 2.9Å; Q673-F735 PolarHBondContact O-N 3.17Å; Q673-T736 HydrophobicContact CB-CG2 4.49Å; Q673-T736 HydrophobicContact CG-CG2 4.43Å
674	D	85.1	Confident	87.2	Confident	48 Å²	48	43.2 Å²	43.2	26%	0.257	28%	0.28	S	S	.	.	S	Bend	trans	-153.3	0.1	-167.9	61.1	-8.3	0	0	0	115.6	T672 L732	T672-D674 VanDerWaalsContact C-N 3.31Å; T672-D674 PolarHBondContact O-N 2.96Å; D674-L732 WeakPolarHBondContact O-CD1 3.44Å; D674-L732 VanDerWaalsContact O-CD2 3.31Å; D674-L732 WeakPolarHBondContact O-CD2 3.31Å; D674-L732 WeakPolarHBondContact O-CG 3.37Å
675	S	84.4	Confident	88.1	Confident	68 Å²	68	39.5 Å²	39.5	48%	0.476	24%	0.241	S	C	.	.	S	Bend	trans	-104.2	-8.1	-175.8	57.9	0	0	0	0	116.4	T672	T672-S675 WeakPolarHBondContact CB-OG 3.49Å; T672-S675 WeakPolarHBondContact CG2-OG 3.44Å; T672-S675 PolarHBondContact OG1-N 3.43Å; T672-S675 PolarHBondContact OG1-OG 3.02Å
676	M	88.3	Confident	88.6	Confident	23 Å²	23	43.9 Å²	43.9	11%	0.113	26%	0.26	C	S	.	.			trans	-95.3	141.4	-175.3	-89.9	171	153.8	0	0	112.5	L671 T672 V681 L684 V733	L671-M676 HydrophobicContact CD2-SD 3.87Å; T672-M676 HydrophobicContact CG2-SD 4.44Å; T672-M676 VanDerWaalsContact OG1-CG 3.29Å; T672-M676 WeakPolarHBondContact OG1-CG 3.47Å; T672-M676 PolarHBondContact OG1-N 3.4Å; M676-V681 HydrophobicContact CB-CG2 4.14Å; M676-L684 HydrophobicContact CE-CD2 4.39Å; M676-V733 PolarHBondContact O-N 2.95Å
677	T	90.2	Very high	89	Confident	39 Å²	39	43.3 Å²	43.3	24%	0.239	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-86.6	158.3	171.4	61.5	0	0	0	0	111.9	G679 E680 V681 S731	T677-G679 PolarHBondContact O-N 3.49Å; T677-E680 PolarHBondContact N-OE2 3.24Å; T677-E680 PolarHBondContact O-N 3.35Å; T677-E680 VanDerWaalsContact OG1-CD 3.22Å; T677-E680 VanDerWaalsContact OG1-CG 3.3Å; T677-E680 WeakPolarHBondContact OG1-CG 3.4Å; T677-E680 PolarHBondContact OG1-N 3.14Å; T677-E680 PolarHBondContact OG1-OE2 3.08Å; T677-V681 WeakPolarHBondContact O-CG2 3.04Å; T677-V681 PolarHBondContact O-N 3.44Å; T677-S731 CarbonylContact C-O 3.6Å; T677-S731 WeakPolarHBondContact CA-O 3.5Å
678	I	88.5	Confident	89.3	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-56.7	-38.6	176.7	-69.7	177.5	0	0	0	111.4	V681 E682 I717 I727 S729 S731 V733 L750	I678-V681 PolarHBondContact O-N 3.41Å; I678-E682 HydrophobicContact CG2-CG 4.09Å; I678-E682 WeakPolarHBondContact O-CB 3.46Å; I678-E682 WeakPolarHBondContact O-CG 3.48Å; I678-E682 PolarHBondContact O-N 3.09Å; I678-I717 HydrophobicContact CG2-CG2 3.98Å; I678-I727 HydrophobicContact CD1-CG2 3.43Å; I678-I727 VanDerWaalsContact CD1-CG2 3.43Å; I678-S729 PolarHBondContact N-O 3.05Å; I678-S731 PolarHBondContact N-O 3.42Å; I678-V733 HydrophobicContact CB-CG2 4.45Å; I678-V733 HydrophobicContact CG1-CG2 3.56Å; I678-L750 HydrophobicContact CD1-CB 4.01Å; I678-L750 HydrophobicContact CD1-CD2 3.62Å; I678-L750 HydrophobicContact CD1-CG 4.47Å; I678-L750 HydrophobicContact CG1-CD2 4.21Å
679	G	88.1	Confident	89.2	Confident	20 Å²	20	46.3 Å²	46.3	21%	0.206	26%	0.256	C	S	.	.	H	α-helix	trans	-67.1	-35.3	178.9	0	0	0	0	0	113.8	T677 T683 S729	T677-G679 PolarHBondContact O-N 3.49Å; G679-T683 WeakPolarHBondContact O-CB 3.39Å; G679-T683 WeakPolarHBondContact O-CG2 3.48Å; G679-T683 PolarHBondContact O-N 3.46Å; G679-T683 PolarHBondContact O-OG1 2.66Å; G679-S729 PolarHBondContact N-O 2.92Å
680	E	90.8	Very high	89.1	Confident	95 Å²	95	51.8 Å²	51.8	44%	0.444	27%	0.273	S	S	.	.	H	α-helix	trans	-68.5	-36.1	172	-70.8	162.9	151.8	0	0	111.5	T677 T683 L684	T677-E680 PolarHBondContact N-OE2 3.24Å; T677-E680 PolarHBondContact O-N 3.35Å; T677-E680 VanDerWaalsContact OG1-CD 3.22Å; T677-E680 VanDerWaalsContact OG1-CG 3.3Å; T677-E680 WeakPolarHBondContact OG1-CG 3.4Å; T677-E680 PolarHBondContact OG1-N 3.14Å; T677-E680 PolarHBondContact OG1-OE2 3.08Å; E680-T683 WeakPolarHBondContact CA-OG1 3.39Å; E680-T683 PolarHBondContact O-OG1 3.02Å; E680-T683 VanDerWaalsContact O-OG1 3.14Å; E680-L684 VanDerWaalsContact O-CB 3.26Å; E680-L684 WeakPolarHBondContact O-CB 3.23Å; E680-L684 PolarHBondContact O-N 3.16Å
681	V	90.4	Very high	88.6	Confident	1 Å²	1	53.5 Å²	53.5	1%	0.006	29%	0.286	C	S	.	.	H	α-helix	trans	-70.6	-44	174.7	177.1	0	0	0	0	111.4	L671 M676 T677 I678 L684 V685 L713 I717 V733	L671-V681 HydrophobicContact CD2-CG1 4.32Å; L671-V681 HydrophobicContact CD2-CG2 3.97Å; M676-V681 HydrophobicContact CB-CG2 4.14Å; T677-V681 WeakPolarHBondContact O-CG2 3.04Å; T677-V681 PolarHBondContact O-N 3.44Å; I678-V681 PolarHBondContact O-N 3.41Å; V681-L684 PolarHBondContact O-N 3.3Å; V681-V685 HydrophobicContact CG1-CG2 4.43Å; V681-V685 WeakPolarHBondContact O-CB 3.3Å; V681-V685 WeakPolarHBondContact O-CG2 3.42Å; V681-V685 PolarHBondContact O-N 3.31Å; V681-L713 HydrophobicContact CG1-CD1 4.25Å; V681-L713 HydrophobicContact CG1-CD2 3.72Å; V681-L713 HydrophobicContact CG1-CG 4.18Å; V681-I717 HydrophobicContact CG1-CD1 4.04Å; V681-V733 HydrophobicContact CG2-CG2 4.19Å
682	E	90.8	Very high	88.5	Confident	42 Å²	42	54 Å²	54	20%	0.196	29%	0.291	C	S	.	.	H	α-helix	trans	-57.4	-49.4	174.3	-75.4	175.5	139.9	0	0	109.9	I678 V685 E686 R721 S729	I678-E682 HydrophobicContact CG2-CG 4.09Å; I678-E682 WeakPolarHBondContact O-CB 3.46Å; I678-E682 WeakPolarHBondContact O-CG 3.48Å; I678-E682 PolarHBondContact O-N 3.09Å; E682-V685 PolarHBondContact O-N 2.93Å; E682-E686 WeakPolarHBondContact O-CG 3.21Å; E682-E686 PolarHBondContact O-N 3.4Å; E682-R721 IonicContact OE1-CZ 3.88Å; E682-R721 VanDerWaalsContact OE1-CZ 3.29Å; E682-R721 IonicContact OE1-NH1 2.79Å; E682-R721 PolarHBondContact OE1-NH1 2.83Å; E682-R721 IonicContact OE1-NH2 2.64Å; E682-R721 PolarHBondContact OE1-NH2 2.87Å; E682-R721 IonicContact OE2-NH2 3.31Å; E682-R721 PolarHBondContact OE2-NH2 3.05Å; E682-S729 PolarHBondContact OE2-OG 3.26Å
683	T	92	Very high	88.6	Confident	82 Å²	82	54 Å²	54	50%	0.503	29%	0.291	S	S	.	.	H	α-helix	trans	-67.9	-35.2	178.5	48.8	0	0	0	0	114	G679 E680 V685 E686 S687	G679-T683 WeakPolarHBondContact O-CB 3.39Å; G679-T683 WeakPolarHBondContact O-CG2 3.48Å; G679-T683 PolarHBondContact O-N 3.46Å; G679-T683 PolarHBondContact O-OG1 2.66Å; E680-T683 WeakPolarHBondContact CA-OG1 3.39Å; E680-T683 PolarHBondContact O-OG1 3.02Å; E680-T683 VanDerWaalsContact O-OG1 3.14Å; T683-V685 VanDerWaalsContact C-N 3.34Å; T683-E686 PolarHBondContact O-N 3.01Å; T683-S687 VanDerWaalsContact O-CB 3.29Å; T683-S687 WeakPolarHBondContact O-CB 3.38Å; T683-S687 PolarHBondContact O-N 3.04Å; T683-S687 PolarHBondContact O-OG 3.05Å
684	L	90.9	Very high	88.9	Confident	31 Å²	31	52.3 Å²	52.3	16%	0.162	28%	0.284	C	S	.	.	H	α-helix	trans	-64.5	-39.4	171.9	-177.5	65.9	0	0	0	111.7	A669 L671 M676 E680 V681 S687 T688 F693	A669-L684 HydrophobicContact CB-CD1 4.14Å; L671-L684 HydrophobicContact CD2-CD2 3.79Å; M676-L684 HydrophobicContact CE-CD2 4.39Å; E680-L684 VanDerWaalsContact O-CB 3.26Å; E680-L684 WeakPolarHBondContact O-CB 3.23Å; E680-L684 PolarHBondContact O-N 3.16Å; V681-L684 PolarHBondContact O-N 3.3Å; L684-S687 PolarHBondContact O-OG 3.25Å; L684-T688 HydrophobicContact CD1-CG2 4.3Å; L684-T688 WeakPolarHBondContact O-CB 3.27Å; L684-T688 WeakPolarHBondContact O-CG2 3.38Å; L684-T688 PolarHBondContact O-N 3.4Å; L684-T688 PolarHBondContact O-OG1 2.81Å; L684-F693 HydrophobicContact CD2-CD1 4.38Å; L684-F693 HydrophobicContact CD2-CE1 4.39Å; L684-F693 HydrophobicContact CG-CE1 4.27Å
685	V	90.4	Very high	89.3	Confident	4 Å²	4	50 Å²	50	2%	0.024	27%	0.271	C	S	.	.	H	α-helix	trans	-70.5	-41	177.6	172.8	0	0	0	0	110.9	V681 E682 T683 F693 R710 L713 L714	V681-V685 HydrophobicContact CG1-CG2 4.43Å; V681-V685 WeakPolarHBondContact O-CB 3.3Å; V681-V685 WeakPolarHBondContact O-CG2 3.42Å; V681-V685 PolarHBondContact O-N 3.31Å; E682-V685 PolarHBondContact O-N 2.93Å; T683-V685 VanDerWaalsContact C-N 3.34Å; V685-F693 HydrophobicContact CG2-CE2 3.89Å; V685-F693 HydrophobicContact CG2-CZ 4.18Å; V685-R710 HydrophobicContact CG1-CG 3.89Å; V685-R710 VanDerWaalsContact O-CZ 3.25Å; V685-R710 PolarHBondContact O-NH1 3.34Å; V685-R710 VanDerWaalsContact O-NH1 3.16Å; V685-R710 PolarHBondContact O-NH2 3.38Å; V685-L713 HydrophobicContact CG2-CD2 4.07Å; V685-L714 HydrophobicContact CG1-CD1 3.91Å; V685-L714 HydrophobicContact CG1-CD2 3.95Å; V685-L714 HydrophobicContact CG1-CG 4.07Å
686	E	90	Very high	89.7	Confident	154 Å²	154	46.8 Å²	46.8	72%	0.72	25%	0.249	S	C	*	.	H	α-helix	trans	-67.7	-40.5	177.2	-74.1	-179.9	173.1	0	0	113.2	E682 T683 T688	E682-E686 WeakPolarHBondContact O-CG 3.21Å; E682-E686 PolarHBondContact O-N 3.4Å; T683-E686 PolarHBondContact O-N 3.01Å; E686-T688 VanDerWaalsContact C-N 3.3Å; E686-T688 PolarHBondContact O-N 3.16Å
687	S	90.1	Very high	89.8	Confident	90 Å²	90	48 Å²	48	63%	0.629	26%	0.258	S	S	*	.	H	α-helix	trans	-74.5	-15.7	-179.3	57.4	0	0	0	0	114.5	T683 L684	T683-S687 VanDerWaalsContact O-CB 3.29Å; T683-S687 WeakPolarHBondContact O-CB 3.38Å; T683-S687 PolarHBondContact O-N 3.04Å; T683-S687 PolarHBondContact O-OG 3.05Å; L684-S687 PolarHBondContact O-OG 3.25Å
688	T	88.3	Confident	89.7	Confident	19 Å²	19	48.1 Å²	48.1	12%	0.117	26%	0.26	C	S	.	.			trans	-117.9	149	-177.8	63.8	0	0	0	0	112.1	A669 L684 E686 Y690 F693 R710	A669-T688 HydrophobicContact CB-CG2 4.42Å; L684-T688 HydrophobicContact CD1-CG2 4.3Å; L684-T688 WeakPolarHBondContact O-CB 3.27Å; L684-T688 WeakPolarHBondContact O-CG2 3.38Å; L684-T688 PolarHBondContact O-N 3.4Å; L684-T688 PolarHBondContact O-OG1 2.81Å; E686-T688 VanDerWaalsContact C-N 3.3Å; E686-T688 PolarHBondContact O-N 3.16Å; T688-Y690 HydrophobicContact CG2-CD2 3.82Å; T688-Y690 HydrophobicContact CG2-CE2 3.91Å; T688-F693 WeakPolarHBondContact OG1-CZ 3.37Å; T688-R710 PolarHBondContact O-NH1 2.86Å; T688-R710 PolarHBondContact O-NH2 3.19Å
689	H	84.9	Confident	89.6	Confident	185 Å²	185	53.9 Å²	53.9	86%	0.856	29%	0.287	S	S	*	.			trans	-98.7	15.3	170.6	-65.5	-66	0	0	0	113
690	Y	86.6	Confident	89.6	Confident	131 Å²	131	61.6 Å²	61.6	51%	0.514	32%	0.317	S	S	.	.			trans	-72.4	146.4	-179.2	-56.1	-49	0	0	0	112	A669 T688 F693 R710	A669-Y690 HydrophobicContact CB-CD2 4.05Å; A669-Y690 HydrophobicContact CB-CE2 4.11Å; T688-Y690 HydrophobicContact CG2-CD2 3.82Å; T688-Y690 HydrophobicContact CG2-CE2 3.91Å; Y690-F693 HydrophobicContact CD2-CE1 4.29Å; Y690-R710 WeakPolarHBondContact O-CD 3.31Å; Y690-R710 PolarHBondContact O-NH1 2.72Å; Y690-R710 VanDerWaalsContact O-NH1 3.08Å
691	S	82.5	Confident	89.5	Confident	51 Å²	51	58.6 Å²	58.6	36%	0.357	31%	0.307	S	S	.	.	S	Bend	trans	-91	-5.5	-173.2	66.8	0	0	0	0	114.2	R710 R782	S691-R710 WeakPolarHBondContact O-CB 3.27Å; S691-R710 PolarHBondContact O-N 2.91Å; S691-R782 PolarHBondContact OG-NH2 2.99Å
692	G	88.8	Confident	89.5	Confident	11 Å²	11	61.2 Å²	61.2	11%	0.113	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.2	167.5	174.1	0	0	0	0	0	110.6	F707 V708	G692-F707 VanDerWaalsContact C-CZ 3.43Å; G692-V708 CarbonylContact C-O 3.52Å; G692-V708 WeakPolarHBondContact CA-O 3.41Å
693	F	92.3	Very high	89.6	Confident	1 Å²	1	66.6 Å²	66.6	0%	0.004	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	135.4	-172.9	-53.4	-87	0	0	0	109.9	A669 L671 L684 V685 T688 Y690 V708 R710 L713	A669-F693 HydrophobicContact CB-CD1 3.99Å; A669-F693 HydrophobicContact CB-CE1 4.08Å; L671-F693 HydrophobicContact CD1-CB 3.87Å; L671-F693 HydrophobicContact CD1-CD2 4.38Å; L671-F693 HydrophobicContact CD1-CG 4.38Å; L671-F693 HydrophobicContact CG-CB 3.88Å; L671-F693 HydrophobicContact CG-CG 4.38Å; L684-F693 HydrophobicContact CD2-CD1 4.38Å; L684-F693 HydrophobicContact CD2-CE1 4.39Å; L684-F693 HydrophobicContact CG-CE1 4.27Å; V685-F693 HydrophobicContact CG2-CE2 3.89Å; V685-F693 HydrophobicContact CG2-CZ 4.18Å; T688-F693 WeakPolarHBondContact OG1-CZ 3.37Å; Y690-F693 HydrophobicContact CD2-CE1 4.29Å; F693-V708 PolarHBondContact N-O 3.1Å; F693-V708 PolarHBondContact O-N 3.49Å; F693-R710 HydrophobicContact CE2-CB 4.11Å; F693-R710 HydrophobicContact CE2-CG 4.21Å; F693-L713 HydrophobicContact CD2-CD2 4.47Å
694	P	93.8	Very high	89.6	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.019	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	144.6	167.6	29.8	-32.2	0	0	0	110.5	L668 V670 L671 L704 F707 L785 L792	L668-P694 HydrophobicContact CD2-CG 4.01Å; V670-P694 HydrophobicContact CG1-CG 4.17Å; L671-P694 PolarHBondContact N-O 3.2Å; P694-L704 HydrophobicContact CB-CD1 4.19Å; P694-F707 HydrophobicContact CB-CD2 4.19Å; P694-L785 HydrophobicContact CB-CD1 4.36Å; P694-L785 HydrophobicContact CB-CD2 4.25Å; P694-L792 HydrophobicContact CB-CD2 3.63Å; P694-L792 HydrophobicContact CG-CD2 3.54Å
695	V	92.8	Very high	89.6	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	128.9	176.2	-175.7	0	0	0	0	108.7	L671 Q673 V705 G706 V708 F735 I756	L671-V695 HydrophobicContact CB-CG2 4.28Å; L671-V695 CarbonylContact O-C 3.54Å; L671-V695 VanDerWaalsContact O-CA 3.29Å; L671-V695 WeakPolarHBondContact O-CA 3.32Å; Q673-V695 HydrophobicContact CB-CG1 4.42Å; V695-V705 HydrophobicContact CG1-CB 4.3Å; V695-V705 PolarHBondContact O-N 2.9Å; V695-G706 PolarHBondContact N-O 3.15Å; V695-G706 PolarHBondContact O-N 3.42Å; V695-V708 HydrophobicContact CG2-CB 4.4Å; V695-V708 HydrophobicContact CG2-CG2 3.59Å; V695-F735 HydrophobicContact CG1-CD2 4.06Å; V695-F735 HydrophobicContact CG1-CG 4.33Å; V695-I756 HydrophobicContact CB-CD1 3.83Å; V695-I756 HydrophobicContact CG1-CD1 4.04Å; V695-I756 HydrophobicContact CG2-CD1 3.78Å; V695-I756 HydrophobicContact CG2-CG1 4.22Å
696	V	93.1	Very high	89.7	Confident	0 Å²	0	65 Å²	65	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	155.7	179.4	-61.1	0	0	0	0	111.9	V670 L671 T672 Q673 S698 R703 L792	V670-V696 HydrophobicContact CB-CG1 4.39Å; V670-V696 HydrophobicContact CB-CG2 4.03Å; V670-V696 HydrophobicContact CG1-CG1 4.27Å; V670-V696 HydrophobicContact CG2-CG2 3.97Å; L671-V696 PolarHBondContact O-N 3.49Å; T672-V696 CarbonylContact C-O 3.5Å; T672-V696 WeakPolarHBondContact CA-O 3.49Å; Q673-V696 PolarHBondContact N-O 2.9Å; V696-S698 PolarHBondContact O-N 3.25Å; V696-R703 CarbonylContact C-O 3.58Å; V696-R703 WeakPolarHBondContact CA-O 3.45Å; V696-R703 WeakPolarHBondContact CB-O 3.22Å; V696-L792 HydrophobicContact CG1-CB 4.46Å; V696-L792 HydrophobicContact CG1-CD2 3.95Å
697	V	91	Very high	89.7	Confident	50 Å²	50	58 Å²	58	30%	0.303	30%	0.295	S	S	.	.	S	Bend	trans	-60.2	-45.2	179.2	175.9	0	0	0	0	111.4	R703 V705	V697-R703 HydrophobicContact CB-CB 4.26Å; V697-R703 HydrophobicContact CG2-CB 3.85Å; V697-R703 PolarHBondContact N-O 3.46Å; V697-V705 HydrophobicContact CB-CG2 4.38Å; V697-V705 HydrophobicContact CG2-CG2 3.47Å; V697-V705 VanDerWaalsContact CG2-CG2 3.47Å
698	S	88.7	Confident	89.7	Confident	40 Å²	40	53.8 Å²	53.8	28%	0.28	27%	0.265	S	S	.	.			trans	-159.6	156.2	176.9	162.7	0	0	0	0	109.6	V696 E700 S701 Q702	V696-S698 PolarHBondContact O-N 3.25Å; S698-E700 PolarHBondContact O-N 3.37Å; S698-E700 PolarHBondContact OG-N 3.36Å; S698-S701 PolarHBondContact N-OG 3.15Å; S698-S701 PolarHBondContact O-N 3.28Å; S698-S701 PolarHBondContact O-OG 3.27Å; S698-Q702 PolarHBondContact O-N 3.26Å
699	Q	85.8	Confident	89.7	Confident	121 Å²	121	54.1 Å²	54.1	57%	0.565	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-27.8	175.9	-62.3	-169.7	11.1	0	0	113.1	T672 Q702	T672-Q699 HydrophobicContact CG2-CG 3.79Å; Q699-Q702 WeakPolarHBondContact O-CG 3.22Å; Q699-Q702 PolarHBondContact O-NE2 3.3Å
700	E	87.4	Confident	89.9	Confident	182 Å²	182	48 Å²	48	85%	0.85	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-40.2	177.8	-62.2	-177.7	172	0	0	112.5	S698	S698-E700 PolarHBondContact O-N 3.37Å; S698-E700 PolarHBondContact OG-N 3.36Å
701	S	89.3	Confident	89.8	Confident	32 Å²	32	45.5 Å²	45.5	22%	0.224	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-29.4	-173.9	72.2	0	0	0	0	112.7	S698 R703	S698-S701 PolarHBondContact N-OG 3.15Å; S698-S701 PolarHBondContact O-N 3.28Å; S698-S701 PolarHBondContact O-OG 3.27Å; S701-R703 PolarHBondContact O-N 3.47Å
702	Q	89.8	Confident	89.9	Confident	56 Å²	56	43.1 Å²	43.1	26%	0.262	21%	0.208	S	C	.	.			trans	48.9	23.9	-175.8	-65.1	-67.6	-23.5	0	0	113.5	S698 Q699 L704 R791 L792	S698-Q702 PolarHBondContact O-N 3.26Å; Q699-Q702 WeakPolarHBondContact O-CG 3.22Å; Q699-Q702 PolarHBondContact O-NE2 3.3Å; Q702-L704 PolarHBondContact O-N 3.19Å; Q702-R791 CarbonylContact O-C 3.35Å; Q702-R791 WeakPolarHBondContact O-CA 3.43Å; Q702-L792 WeakPolarHBondContact O-CB 3.42Å; Q702-L792 PolarHBondContact O-N 2.95Å
703	R	93.3	Very high	89.9	Confident	156 Å²	156	42.6 Å²	42.6	59%	0.589	20%	0.203	S	C	*	.	B	Isolated β-bridge	trans	-73.9	126.7	177.6	-77.4	-175.6	174.4	167.7	-1	109.8	V696 V697 S701 G790	V696-R703 CarbonylContact C-O 3.58Å; V696-R703 WeakPolarHBondContact CA-O 3.45Å; V696-R703 WeakPolarHBondContact CB-O 3.22Å; V697-R703 HydrophobicContact CB-CB 4.26Å; V697-R703 HydrophobicContact CG2-CB 3.85Å; V697-R703 PolarHBondContact N-O 3.46Å; S701-R703 PolarHBondContact O-N 3.47Å; R703-G790 WeakPolarHBondContact CA-O 3.33Å
704	L	92.8	Very high	89.7	Confident	40 Å²	40	46 Å²	46	21%	0.209	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	133.8	-178.7	-179.1	63.6	0	0	0	111.2	P694 Q702 G706 P760 T762 L785 T787 G790	P694-L704 HydrophobicContact CB-CD1 4.19Å; Q702-L704 PolarHBondContact O-N 3.19Å; L704-G706 WeakPolarHBondContact CD1-O 3.37Å; L704-P760 HydrophobicContact CD2-CG 4.23Å; L704-T762 HydrophobicContact CD2-CG2 3.52Å; L704-L785 HydrophobicContact CD1-CD1 3.66Å; L704-L785 HydrophobicContact CD2-CB 4.28Å; L704-L785 HydrophobicContact CD2-CD1 3.67Å; L704-L785 HydrophobicContact CG-CD1 4.32Å; L704-T787 HydrophobicContact CD2-CG2 4.01Å; L704-G790 PolarHBondContact N-O 3.34Å
705	V	90.9	Very high	89.4	Confident	42 Å²	42	47.4 Å²	47.4	26%	0.255	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	-37	174	-179.2	0	0	0	0	111.1	V695 V697 I756	V695-V705 HydrophobicContact CG1-CB 4.3Å; V695-V705 PolarHBondContact O-N 2.9Å; V697-V705 HydrophobicContact CB-CG2 4.38Å; V697-V705 HydrophobicContact CG2-CG2 3.47Å; V697-V705 VanDerWaalsContact CG2-CG2 3.47Å; V705-I756 HydrophobicContact CG1-CD1 4.24Å
706	G	90.8	Very high	89	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.8	-164.3	-176.9	0	0	0	0	0	113.1	V695 L704 D757	V695-G706 PolarHBondContact N-O 3.15Å; V695-G706 PolarHBondContact O-N 3.42Å; L704-G706 WeakPolarHBondContact CD1-O 3.37Å; G706-D757 CarbonylContact C-O 3.53Å; G706-D757 WeakPolarHBondContact CA-O 3.24Å
707	F	90.7	Very high	88.8	Confident	9 Å²	9	47.9 Å²	47.9	4%	0.039	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	143.5	178	-170.4	-84.9	0	0	0	111.8	G692 P694 L709 D757 P760 Q783 L785 I795	G692-F707 VanDerWaalsContact C-CZ 3.43Å; P694-F707 HydrophobicContact CB-CD2 4.19Å; F707-L709 HydrophobicContact CE1-CD2 4.03Å; F707-L709 HydrophobicContact CE1-CG 4.47Å; F707-D757 PolarHBondContact N-O 2.98Å; F707-D757 PolarHBondContact O-N 3.06Å; F707-P760 HydrophobicContact CB-CB 3.93Å; F707-P760 HydrophobicContact CB-CG 4.34Å; F707-Q783 VanDerWaalsContact CZ-NE2 3.25Å; F707-L785 HydrophobicContact CD2-CD1 4.38Å; F707-L785 HydrophobicContact CD2-CD2 4.37Å; F707-I795 HydrophobicContact CE2-CD1 4.1Å
708	V	90.3	Very high	88.6	Confident	1 Å²	1	49 Å²	49	1%	0.006	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	134.5	179.6	177.8	0	0	0	0	110.4	G692 F693 V695 L713 F735 I755 I756	G692-V708 CarbonylContact C-O 3.52Å; G692-V708 WeakPolarHBondContact CA-O 3.41Å; F693-V708 PolarHBondContact N-O 3.1Å; F693-V708 PolarHBondContact O-N 3.49Å; V695-V708 HydrophobicContact CG2-CB 4.4Å; V695-V708 HydrophobicContact CG2-CG2 3.59Å; V708-L713 HydrophobicContact CG1-CB 3.92Å; V708-L713 HydrophobicContact CG1-CD1 4.32Å; V708-F735 HydrophobicContact CG2-CD1 4.38Å; V708-F735 HydrophobicContact CG2-CE1 3.81Å; V708-F735 HydrophobicContact CG2-CZ 4.36Å; V708-I755 HydrophobicContact CG1-CD1 3.84Å; V708-I755 HydrophobicContact CG1-CG1 4.39Å; V708-I756 HydrophobicContact CG2-CB 4.11Å; V708-I756 HydrophobicContact CG2-CG1 3.9Å
709	L	87.9	Confident	88.4	Confident	26 Å²	26	48.7 Å²	48.7	14%	0.136	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	138.9	173.5	-71.8	171.4	0	0	0	111.6	R94 F707 R711 D712 L713	R94-L709 VanDerWaalsContact NH1-CD1 3.31Å; F707-L709 HydrophobicContact CE1-CD2 4.03Å; F707-L709 HydrophobicContact CE1-CG 4.47Å; L709-R711 PolarHBondContact O-N 3.4Å; L709-D712 HydrophobicContact CB-CB 4.24Å; L709-D712 PolarHBondContact O-N 3.48Å; L709-L713 WeakPolarHBondContact O-CB 3.49Å; L709-L713 PolarHBondContact O-N 3.1Å
710	R	88.8	Confident	88.3	Confident	57 Å²	57	43.3 Å²	43.3	22%	0.215	21%	0.206	C	C	.	.	H	α-helix	trans	-52.7	-41.9	178.1	-176.4	-146	-174.3	82.5	-0.1	112.1	V685 T688 Y690 S691 F693 L714	V685-R710 HydrophobicContact CG1-CG 3.89Å; V685-R710 VanDerWaalsContact O-CZ 3.25Å; V685-R710 PolarHBondContact O-NH1 3.34Å; V685-R710 VanDerWaalsContact O-NH1 3.16Å; V685-R710 PolarHBondContact O-NH2 3.38Å; T688-R710 PolarHBondContact O-NH1 2.86Å; T688-R710 PolarHBondContact O-NH2 3.19Å; Y690-R710 WeakPolarHBondContact O-CD 3.31Å; Y690-R710 PolarHBondContact O-NH1 2.72Å; Y690-R710 VanDerWaalsContact O-NH1 3.08Å; S691-R710 WeakPolarHBondContact O-CB 3.27Å; S691-R710 PolarHBondContact O-N 2.91Å; F693-R710 HydrophobicContact CE2-CB 4.11Å; F693-R710 HydrophobicContact CE2-CG 4.21Å; R710-L714 HydrophobicContact CG-CD1 4.25Å; R710-L714 WeakPolarHBondContact O-CB 3.08Å; R710-L714 WeakPolarHBondContact O-CG 3.48Å; R710-L714 PolarHBondContact O-N 3.49Å
711	R	84.1	Confident	88.2	Confident	77 Å²	77	39.8 Å²	39.8	29%	0.291	19%	0.185	S	C	.	.	H	α-helix	trans	-69.2	-45.6	-179	-180	176	174.9	73.7	13.4	112.5	T83 E85 L709 L713 L714 I715	T83-R711 WeakPolarHBondContact O-CD 3.31Å; T83-R711 PolarHBondContact O-NE 3.49Å; T83-R711 VanDerWaalsContact O-NE 3.09Å; T83-R711 PolarHBondContact OG1-NE 3.21Å; T83-R711 VanDerWaalsContact OG1-NE 3.16Å; T83-R711 PolarHBondContact OG1-NH2 2.84Å; T83-R711 VanDerWaalsContact OG1-NH2 3.12Å; E85-R711 WeakPolarHBondContact OE1-CD 3.42Å; E85-R711 IonicContact OE1-CZ 2.71Å; E85-R711 IonicContact OE1-NE 3.69Å; E85-R711 IonicContact OE1-NH1 2.67Å; E85-R711 PolarHBondContact OE1-NH1 3.49Å; L709-R711 PolarHBondContact O-N 3.4Å; R711-L713 VanDerWaalsContact C-N 3.31Å; R711-L713 PolarHBondContact O-N 2.55Å; R711-L714 PolarHBondContact O-N 3.07Å; R711-I715 HydrophobicContact CG-CD1 3.77Å; R711-I715 WeakPolarHBondContact O-CB 3.46Å; R711-I715 VanDerWaalsContact O-CG1 3.24Å; R711-I715 WeakPolarHBondContact O-CG1 3.18Å; R711-I715 PolarHBondContact O-N 3.05Å
712	D	85.4	Confident	87.9	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.011	21%	0.205	C	C	.	.	H	α-helix	trans	-65.8	-38.8	179.2	-67.7	-7.9	0	0	0	110	V81 G82 R94 L709 S716	V81-D712 WeakPolarHBondContact CA-OD1 3.15Å; V81-D712 HydrophobicContact CG1-CB 4.11Å; G82-D712 PolarHBondContact N-OD1 2.04Å; R94-D712 IonicContact CZ-OD2 2.7Å; R94-D712 VanDerWaalsContact CZ-OD2 3.3Å; R94-D712 IonicContact NH1-OD2 3.92Å; R94-D712 PolarHBondContact NH1-OD2 3.37Å; R94-D712 IonicContact NH2-OD2 3.67Å; R94-D712 PolarHBondContact NH2-OD2 2.9Å; L709-D712 HydrophobicContact CB-CB 4.24Å; L709-D712 PolarHBondContact O-N 3.48Å; D712-S716 WeakPolarHBondContact O-CB 3.3Å; D712-S716 PolarHBondContact O-N 3.4Å; D712-S716 PolarHBondContact O-OG 3.11Å
713	L	88.1	Confident	87.4	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-58.6	-54.3	172.3	-175.5	63	0	0	0	112.9	L671 V681 V685 F693 V708 L709 R711 I715 S716 I717 F735 L752 I755	L671-L713 HydrophobicContact CD1-CD2 3.97Å; V681-L713 HydrophobicContact CG1-CD1 4.25Å; V681-L713 HydrophobicContact CG1-CD2 3.72Å; V681-L713 HydrophobicContact CG1-CG 4.18Å; V685-L713 HydrophobicContact CG2-CD2 4.07Å; F693-L713 HydrophobicContact CD2-CD2 4.47Å; V708-L713 HydrophobicContact CG1-CB 3.92Å; V708-L713 HydrophobicContact CG1-CD1 4.32Å; L709-L713 WeakPolarHBondContact O-CB 3.49Å; L709-L713 PolarHBondContact O-N 3.1Å; R711-L713 VanDerWaalsContact C-N 3.31Å; R711-L713 PolarHBondContact O-N 2.55Å; L713-I715 PolarHBondContact O-N 2.81Å; L713-S716 PolarHBondContact O-N 2.9Å; L713-I717 HydrophobicContact CD1-CD1 4.02Å; L713-I717 HydrophobicContact CG-CD1 4.01Å; L713-I717 WeakPolarHBondContact O-CG1 3.12Å; L713-I717 PolarHBondContact O-N 3.38Å; L713-F735 HydrophobicContact CD1-CZ 4.47Å; L713-L752 HydrophobicContact CD1-CD1 3.64Å; L713-I755 HydrophobicContact CB-CD1 4.36Å; L713-I755 HydrophobicContact CD1-CD1 4.2Å
714	L	89	Confident	86.7	Confident	73 Å²	73	45.3 Å²	45.3	38%	0.382	21%	0.206	S	C	.	.	H	α-helix	trans	-62	-42.9	180	-77.2	172	0	0	0	112.6	V685 R710 R711 S716 I717 D718	V685-L714 HydrophobicContact CG1-CD1 3.91Å; V685-L714 HydrophobicContact CG1-CD2 3.95Å; V685-L714 HydrophobicContact CG1-CG 4.07Å; R710-L714 HydrophobicContact CG-CD1 4.25Å; R710-L714 WeakPolarHBondContact O-CB 3.08Å; R710-L714 WeakPolarHBondContact O-CG 3.48Å; R710-L714 PolarHBondContact O-N 3.49Å; R711-L714 PolarHBondContact O-N 3.07Å; L714-S716 VanDerWaalsContact C-N 3.33Å; L714-S716 PolarHBondContact O-N 3.07Å; L714-I717 PolarHBondContact O-N 3.25Å; L714-D718 WeakPolarHBondContact O-CB 3.44Å; L714-D718 PolarHBondContact O-N 3.4Å
715	I	86.4	Confident	85.6	Confident	31 Å²	31	51.4 Å²	51.4	16%	0.159	24%	0.239	C	C	.	.	H	α-helix	trans	-64.5	-39.5	178.2	-68.5	170.1	0	0	0	110.5	V81 R711 L713 N719	V81-I715 HydrophobicContact CG2-CB 4.18Å; V81-I715 HydrophobicContact CG2-CG2 3.66Å; R711-I715 HydrophobicContact CG-CD1 3.77Å; R711-I715 WeakPolarHBondContact O-CB 3.46Å; R711-I715 VanDerWaalsContact O-CG1 3.24Å; R711-I715 WeakPolarHBondContact O-CG1 3.18Å; R711-I715 PolarHBondContact O-N 3.05Å; L713-I715 PolarHBondContact O-N 2.81Å; I715-N719 VanDerWaalsContact CG2-ND2 3.31Å; I715-N719 WeakPolarHBondContact CG2-ND2 3.04Å; I715-N719 VanDerWaalsContact O-CB 3.32Å; I715-N719 WeakPolarHBondContact O-CB 2.98Å; I715-N719 PolarHBondContact O-N 3.47Å; I715-N719 PolarHBondContact O-ND2 3.19Å
716	S	86.3	Confident	85	Confident	5 Å²	5	51.6 Å²	51.6	4%	0.035	25%	0.249	C	C	.	.	H	α-helix	trans	-69	-40.2	176.6	-72.4	0	0	0	0	113	D712 L713 L714 A720 I755	D712-S716 WeakPolarHBondContact O-CB 3.3Å; D712-S716 PolarHBondContact O-N 3.4Å; D712-S716 PolarHBondContact O-OG 3.11Å; L713-S716 PolarHBondContact O-N 2.9Å; L714-S716 VanDerWaalsContact C-N 3.33Å; L714-S716 PolarHBondContact O-N 3.07Å; S716-A720 WeakPolarHBondContact O-CB 3.44Å; S716-A720 PolarHBondContact O-N 3.1Å; S716-I755 WeakPolarHBondContact OG-CG2 3.31Å
717	I	87.7	Confident	84.5	Confident	6 Å²	6	52.3 Å²	52.3	3%	0.031	25%	0.253	C	S	.	.	H	α-helix	trans	-64.2	-46.8	176.7	-67.1	165.9	0	0	0	111.1	I678 V681 L713 L714 A720 R721 L750 L752	I678-I717 HydrophobicContact CG2-CG2 3.98Å; V681-I717 HydrophobicContact CG1-CD1 4.04Å; L713-I717 HydrophobicContact CD1-CD1 4.02Å; L713-I717 HydrophobicContact CG-CD1 4.01Å; L713-I717 WeakPolarHBondContact O-CG1 3.12Å; L713-I717 PolarHBondContact O-N 3.38Å; L714-I717 PolarHBondContact O-N 3.25Å; I717-A720 PolarHBondContact O-N 2.88Å; I717-R721 PolarHBondContact O-N 2.99Å; I717-L750 HydrophobicContact CG1-CD2 3.97Å; I717-L752 HydrophobicContact CG1-CD1 4.41Å
718	D	87.3	Confident	84.2	Confident	73 Å²	73	55.2 Å²	55.2	39%	0.39	27%	0.271	S	S	.	.	H	α-helix	trans	-64.6	-42.4	178.5	174.9	61.9	0	0	0	112.4	L714 K722	L714-D718 WeakPolarHBondContact O-CB 3.44Å; L714-D718 PolarHBondContact O-N 3.4Å; D718-K722 WeakPolarHBondContact O-CD 3.32Å; D718-K722 VanDerWaalsContact O-CG 3.31Å; D718-K722 WeakPolarHBondContact O-CG 3.43Å; D718-K722 PolarHBondContact O-N 2.89Å; D718-K722 WeakPolarHBondContact OD1-CE 3.4Å; D718-K722 IonicContact OD1-NZ 3.16Å; D718-K722 PolarHBondContact OD1-NZ 2.96Å; D718-K722 IonicContact OD2-NZ 2.78Å; D718-K722 PolarHBondContact OD2-NZ 3.43Å
719	N	85.2	Confident	83.8	Confident	33 Å²	33	57.6 Å²	57.6	18%	0.176	29%	0.288	C	S	.	.	H	α-helix	trans	-65.9	-37.7	174.1	-81	-62.4	0	0	0	112.4	L78 I715 K722 R723	L78-N719 HydrophobicContact CD1-CB 4.28Å; L78-N719 HydrophobicContact CD2-CB 4.12Å; I715-N719 VanDerWaalsContact CG2-ND2 3.31Å; I715-N719 WeakPolarHBondContact CG2-ND2 3.04Å; I715-N719 VanDerWaalsContact O-CB 3.32Å; I715-N719 WeakPolarHBondContact O-CB 2.98Å; I715-N719 PolarHBondContact O-N 3.47Å; I715-N719 PolarHBondContact O-ND2 3.19Å; N719-K722 PolarHBondContact O-N 3.26Å; N719-R723 WeakPolarHBondContact O-CB 3.49Å; N719-R723 WeakPolarHBondContact O-CG 3.07Å; N719-R723 PolarHBondContact O-N 3.35Å
720	A	83.8	Confident	83.7	Confident	9 Å²	9	59.5 Å²	59.5	7%	0.074	31%	0.307	C	S	.	.	H	α-helix	trans	-65.2	-47.9	177.8	0	0	0	0	0	111.1	S716 I717 K722 R723 Q724 I727 L750	S716-A720 WeakPolarHBondContact O-CB 3.44Å; S716-A720 PolarHBondContact O-N 3.1Å; I717-A720 PolarHBondContact O-N 2.88Å; A720-K722 PolarHBondContact O-N 3.26Å; A720-K722 VanDerWaalsContact O-N 3.12Å; A720-R723 PolarHBondContact O-N 3.45Å; A720-R723 VanDerWaalsContact O-N 3.1Å; A720-Q724 PolarHBondContact O-N 2.97Å; A720-I727 HydrophobicContact CB-CD1 3.56Å; A720-L750 HydrophobicContact CB-CD1 3.47Å; A720-L750 VanDerWaalsContact CB-CD1 3.47Å; A720-L750 HydrophobicContact CB-CD2 4.08Å; A720-L750 HydrophobicContact CB-CG 4.43Å
721	R	83.7	Confident	83.5	Confident	107 Å²	107	56.8 Å²	56.8	40%	0.404	30%	0.297	S	S	.	.	H	α-helix	trans	-59.5	-22.6	174.8	-170.8	-179.5	-84.3	147.9	-3.2	113.1	E682 I717 S729	E682-R721 IonicContact OE1-CZ 3.88Å; E682-R721 VanDerWaalsContact OE1-CZ 3.29Å; E682-R721 IonicContact OE1-NH1 2.79Å; E682-R721 PolarHBondContact OE1-NH1 2.83Å; E682-R721 IonicContact OE1-NH2 2.64Å; E682-R721 PolarHBondContact OE1-NH2 2.87Å; E682-R721 IonicContact OE2-NH2 3.31Å; E682-R721 PolarHBondContact OE2-NH2 3.05Å; I717-R721 PolarHBondContact O-N 2.99Å; R721-S729 PolarHBondContact NH2-OG 3.4Å
722	K	83.9	Confident	83.6	Confident	145 Å²	145	54.5 Å²	54.5	63%	0.63	29%	0.291	S	S	*	.	H	α-helix	trans	-91.8	-23.5	175.7	-72.8	168.8	-177.7	164.8	0	115.1	D718 N719 A720	D718-K722 WeakPolarHBondContact O-CD 3.32Å; D718-K722 VanDerWaalsContact O-CG 3.31Å; D718-K722 WeakPolarHBondContact O-CG 3.43Å; D718-K722 PolarHBondContact O-N 2.89Å; D718-K722 WeakPolarHBondContact OD1-CE 3.4Å; D718-K722 IonicContact OD1-NZ 3.16Å; D718-K722 PolarHBondContact OD1-NZ 2.96Å; D718-K722 IonicContact OD2-NZ 2.78Å; D718-K722 PolarHBondContact OD2-NZ 3.43Å; N719-K722 PolarHBondContact O-N 3.26Å; A720-K722 PolarHBondContact O-N 3.26Å; A720-K722 VanDerWaalsContact O-N 3.12Å
723	R	79.8	Confident	83.6	Confident	145 Å²	145	54.5 Å²	54.5	55%	0.547	29%	0.29	S	S	.	.	H	α-helix	trans	-109.8	-20.2	-173.7	-74.3	-173.2	169.4	-157	-4.3	114.3	N719 A720	N719-R723 WeakPolarHBondContact O-CB 3.49Å; N719-R723 WeakPolarHBondContact O-CG 3.07Å; N719-R723 PolarHBondContact O-N 3.35Å; A720-R723 PolarHBondContact O-N 3.45Å; A720-R723 VanDerWaalsContact O-N 3.1Å
724	Q	78	Confident	83.5	Confident	70 Å²	70	54.5 Å²	54.5	33%	0.327	29%	0.291	S	S	.	.	S	Bend	trans	-121.6	114.1	-176.7	-63	-173.5	7.3	0	0	110.1	A720 I727	A720-Q724 PolarHBondContact O-N 2.97Å; Q724-I727 HydrophobicContact CB-CD1 3.73Å; Q724-I727 HydrophobicContact CB-CG1 4Å; Q724-I727 HydrophobicContact CG-CD1 4.39Å
725	D	70.6	Confident	83.3	Confident	169 Å²	169	51.3 Å²	51.3	90%	0.904	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	133.9	174.1	-65.5	-43	0	0	0	110.4
726	G	76.4	Confident	83.1	Confident	46 Å²	46	51.8 Å²	51.8	47%	0.474	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.6	-3.3	177.1	0	0	0	0	0	116.2	V728 P748	G726-V728 PolarHBondContact O-N 3.43Å; G726-P748 WeakPolarHBondContact O-CD 3.31Å
727	I	81.5	Confident	82.4	Confident	14 Å²	14	57 Å²	57	7%	0.072	30%	0.302	C	S	.	.			trans	-70.1	119	170.1	-63.6	-173.5	0	0	0	110.2	I678 A720 Q724 L750	I678-I727 HydrophobicContact CD1-CG2 3.43Å; I678-I727 VanDerWaalsContact CD1-CG2 3.43Å; A720-I727 HydrophobicContact CB-CD1 3.56Å; Q724-I727 HydrophobicContact CB-CD1 3.73Å; Q724-I727 HydrophobicContact CB-CG1 4Å; Q724-I727 HydrophobicContact CG-CD1 4.39Å; I727-L750 HydrophobicContact CD1-CD1 4.1Å
728	V	83.8	Confident	81.7	Confident	70 Å²	70	63.9 Å²	63.9	42%	0.424	33%	0.333	S	S	.	.			trans	-124.5	166.6	177.8	-68.1	0	0	0	0	110.1	G726 A730 S731 P747	G726-V728 PolarHBondContact O-N 3.43Å; V728-A730 HydrophobicContact CG2-CB 4.17Å; V728-A730 PolarHBondContact O-N 3.32Å; V728-S731 PolarHBondContact N-OG 3.36Å; V728-S731 WeakPolarHBondContact O-CB 3.49Å; V728-S731 PolarHBondContact O-N 3.25Å; V728-S731 PolarHBondContact O-OG 2.91Å; V728-P747 HydrophobicContact CG2-CB 3.47Å; V728-P747 VanDerWaalsContact CG2-CB 3.47Å; V728-P747 HydrophobicContact CG2-CG 3.81Å
729	S	82.9	Confident	80.7	Confident	51 Å²	51	62.7 Å²	62.7	36%	0.357	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-15.3	178.8	-60.5	0	0	0	0	113.7	I678 G679 E682 R721	I678-S729 PolarHBondContact N-O 3.05Å; G679-S729 PolarHBondContact N-O 2.92Å; E682-S729 PolarHBondContact OE2-OG 3.26Å; R721-S729 PolarHBondContact NH2-OG 3.4Å
730	A	84.2	Confident	79.9	Confident	67 Å²	67	63.5 Å²	63.5	55%	0.554	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-5.3	170.6	0	0	0	0	0	114.5	V728 P747	V728-A730 HydrophobicContact CG2-CB 4.17Å; V728-A730 PolarHBondContact O-N 3.32Å; A730-P747 HydrophobicContact CB-CG 4.2Å
731	S	85.7	Confident	79	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	38%	0.377	C	S	.	.	S	Bend	trans	-62.3	137.9	172.4	-74.2	0	0	0	0	110.7	T677 I678 V728 P748	T677-S731 CarbonylContact C-O 3.6Å; T677-S731 WeakPolarHBondContact CA-O 3.5Å; I678-S731 PolarHBondContact N-O 3.42Å; V728-S731 PolarHBondContact N-OG 3.36Å; V728-S731 WeakPolarHBondContact O-CB 3.49Å; V728-S731 PolarHBondContact O-N 3.25Å; V728-S731 PolarHBondContact O-OG 2.91Å; S731-P748 WeakPolarHBondContact CB-O 3.43Å; S731-P748 PolarHBondContact OG-O 3.08Å
732	L	86.1	Confident	78.2	Confident	29 Å²	29	66.1 Å²	66.1	15%	0.152	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	-74.5	137.8	176.5	-164.7	74.1	0	0	0	110.6	D674 V734 P740 Q742 P749 L750	D674-L732 WeakPolarHBondContact O-CD1 3.44Å; D674-L732 VanDerWaalsContact O-CD2 3.31Å; D674-L732 WeakPolarHBondContact O-CD2 3.31Å; D674-L732 WeakPolarHBondContact O-CG 3.37Å; L732-V734 HydrophobicContact CD2-CG2 3.86Å; L732-V734 HydrophobicContact CG-CG2 4.12Å; L732-P740 HydrophobicContact CD2-CG 4.01Å; L732-Q742 VanDerWaalsContact CB-NE2 3.35Å; L732-Q742 VanDerWaalsContact CD2-NE2 3.31Å; L732-P749 HydrophobicContact CB-CB 4.3Å; L732-P749 CarbonylContact O-C 3.55Å; L732-P749 WeakPolarHBondContact O-CA 3.31Å; L732-L750 PolarHBondContact O-N 2.64Å
733	V	86	Confident	77.7	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.006	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	126.4	172.1	-178.9	0	0	0	0	109.2	M676 I678 V681 F735 L752	M676-V733 PolarHBondContact O-N 2.95Å; I678-V733 HydrophobicContact CB-CG2 4.45Å; I678-V733 HydrophobicContact CG1-CG2 3.56Å; V681-V733 HydrophobicContact CG2-CG2 4.19Å; V733-F735 HydrophobicContact CG1-CD2 4.36Å; V733-F735 HydrophobicContact CG1-CE2 3.67Å; V733-F735 HydrophobicContact CG1-CZ 3.78Å; V733-L752 HydrophobicContact CG1-CD1 3.66Å; V733-L752 HydrophobicContact CG1-CG 4.17Å
734	V	86.1	Confident	77	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.006	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	122.5	-173.7	-177.2	0	0	0	0	110.7	L732 T736 P749 L750 R751 L752	L732-V734 HydrophobicContact CD2-CG2 3.86Å; L732-V734 HydrophobicContact CG-CG2 4.12Å; V734-T736 WeakPolarHBondContact CG1-OG1 3.34Å; V734-P749 HydrophobicContact CG2-CB 4.07Å; V734-L750 PolarHBondContact N-O 3.15Å; V734-R751 WeakPolarHBondContact O-CA 3.17Å; V734-L752 PolarHBondContact O-N 3.14Å
735	F	84.3	Confident	76.5	Confident	6 Å²	6	69.1 Å²	69.1	3%	0.026	41%	0.414	C	S	.	.			trans	-100.9	-5.4	177.6	-63.8	-79.6	0	0	0	113.5	L671 Q673 V695 V708 L713 V733 L752 R753 I756	L671-F735 HydrophobicContact CD1-CZ 4.34Å; Q673-F735 PolarHBondContact O-N 3.17Å; V695-F735 HydrophobicContact CG1-CD2 4.06Å; V695-F735 HydrophobicContact CG1-CG 4.33Å; V708-F735 HydrophobicContact CG2-CD1 4.38Å; V708-F735 HydrophobicContact CG2-CE1 3.81Å; V708-F735 HydrophobicContact CG2-CZ 4.36Å; L713-F735 HydrophobicContact CD1-CZ 4.47Å; V733-F735 HydrophobicContact CG1-CD2 4.36Å; V733-F735 HydrophobicContact CG1-CE2 3.67Å; V733-F735 HydrophobicContact CG1-CZ 3.78Å; F735-L752 HydrophobicContact CD1-CB 3.87Å; F735-L752 HydrophobicContact CE1-CB 3.55Å; F735-L752 HydrophobicContact CE1-CD1 4.38Å; F735-L752 HydrophobicContact CZ-CB 4.29Å; F735-L752 HydrophobicContact CZ-CD1 4.43Å; F735-R753 WeakPolarHBondContact O-CB 3.43Å; F735-R753 WeakPolarHBondContact O-CG 3.44Å; F735-I756 HydrophobicContact CB-CD1 4.28Å; F735-I756 HydrophobicContact CD1-CB 4.43Å; F735-I756 HydrophobicContact CD1-CD1 4.44Å
736	T	81.4	Confident	76.7	Confident	40 Å²	40	62.9 Å²	62.9	25%	0.245	39%	0.386	C	S	.	.	S	Bend	trans	-85.4	158.8	177.5	52.5	0	0	0	0	112.6	Q673 V734 H738	Q673-T736 HydrophobicContact CB-CG2 4.49Å; Q673-T736 HydrophobicContact CG-CG2 4.43Å; V734-T736 WeakPolarHBondContact CG1-OG1 3.34Å; T736-H738 VanDerWaalsContact C-N 3.32Å; T736-H738 PolarHBondContact OG1-O 3.41Å
737	E	71.4	Confident	76.9	Confident	114 Å²	114	62.5 Å²	62.5	53%	0.533	38%	0.375	S	S	.	.	S	Bend	trans	-71.6	-27.8	173.9	-118.8	154.3	-117.8	0	0	112.6	R753	E737-R753 IonicContact OE1-CZ 3.13Å; E737-R753 IonicContact OE1-NE 3.91Å; E737-R753 PolarHBondContact OE1-NE 2.71Å; E737-R753 IonicContact OE1-NH2 2.71Å; E737-R753 PolarHBondContact OE1-NH2 2.95Å
738	H	73.6	Confident	76.9	Confident	151 Å²	151	64.6 Å²	64.6	70%	0.699	39%	0.389	S	S	*	.	S	Bend	trans	-109	128	179.7	-59.1	-5.9	0	0	0	108.6	T736	T736-H738 VanDerWaalsContact C-N 3.32Å; T736-H738 PolarHBondContact OG1-O 3.41Å
739	C	65.6	Low	76.9	Confident	48 Å²	48	62.7 Å²	62.7	32%	0.324	38%	0.378	S	S	.	.			trans	-79.5	132.8	175.3	-172.2	0	0	0	0	109.4	P749	C739-P749 VanDerWaalsContact SG-CG 3.53Å
740	P	70.1	Confident	76.9	Confident	50 Å²	50	60.5 Å²	60.5	33%	0.325	36%	0.363	S	S	.	.			trans	-58.3	147.3	167.6	25.6	-33.7	0	0	0	110.3	L732 Q742	L732-P740 HydrophobicContact CD2-CG 4.01Å; P740-Q742 PolarHBondContact O-N 3.13Å; P740-Q742 VanDerWaalsContact O-N 3.14Å
741	A	64.4	Low	76.9	Confident	109 Å²	109	63.8 Å²	63.8	90%	0.901	36%	0.361	S	S	*	.			trans	-67.6	111.4	178.8	0	0	0	0	0	110.1
742	Q	66.9	Low	76.8	Confident	63 Å²	63	64 Å²	64	29%	0.294	36%	0.362	S	S	.	.			trans	-92.2	151.4	179.3	-71.9	-177.4	-23.3	0	0	111.6	L732 P740 A746	L732-Q742 VanDerWaalsContact CB-NE2 3.35Å; L732-Q742 VanDerWaalsContact CD2-NE2 3.31Å; P740-Q742 PolarHBondContact O-N 3.13Å; P740-Q742 VanDerWaalsContact O-N 3.14Å; Q742-A746 HydrophobicContact CB-CB 4.11Å
743	P	73.4	Confident	76.7	Confident	91 Å²	91	66.5 Å²	66.5	59%	0.591	37%	0.369	S	S	*	.			trans	-65.3	150.8	172	28.1	-33.1	0	0	0	110.7	E745 A746	P743-E745 PolarHBondContact O-N 2.71Å; P743-A746 HydrophobicContact CG-CB 4.11Å; P743-A746 WeakPolarHBondContact O-CB 3.31Å; P743-A746 PolarHBondContact O-N 3.33Å
744	P	64.2	Low	76.3	Confident	141 Å²	141	69.5 Å²	69.5	92%	0.916	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-10.3	-170.3	26.1	-35.6	0	0	0	115.5
745	E	68.8	Low	76.1	Confident	191 Å²	191	70.1 Å²	70.1	89%	0.893	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.5	-2.2	175	-64.8	-178.3	138.9	0	0	113.4	P743	P743-E745 PolarHBondContact O-N 2.71Å
746	A	74	Confident	76.2	Confident	37 Å²	37	70.7 Å²	70.7	31%	0.306	41%	0.407	S	S	.	.	S	Bend	trans	-73	143.4	179.5	0	0	0	0	0	112.1	Q742 P743	Q742-A746 HydrophobicContact CB-CB 4.11Å; P743-A746 HydrophobicContact CG-CB 4.11Å; P743-A746 WeakPolarHBondContact O-CB 3.31Å; P743-A746 PolarHBondContact O-N 3.33Å
747	P	80.7	Confident	76.3	Confident	39 Å²	39	71.5 Å²	71.5	25%	0.253	41%	0.409	S	S	.	.	P	Polyproline II helix	trans	-66.6	150.3	172.5	29.2	-35.3	0	0	0	111.4	V728 A730	V728-P747 HydrophobicContact CG2-CB 3.47Å; V728-P747 VanDerWaalsContact CG2-CB 3.47Å; V728-P747 HydrophobicContact CG2-CG 3.81Å; A730-P747 HydrophobicContact CB-CG 4.2Å
748	P	81.7	Confident	77	Confident	57 Å²	57	70.5 Å²	70.5	37%	0.37	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-57.9	138.4	-174.2	23.1	-34.4	0	0	0	112.2	G726 S731	G726-P748 WeakPolarHBondContact O-CD 3.31Å; S731-P748 WeakPolarHBondContact CB-O 3.43Å; S731-P748 PolarHBondContact OG-O 3.08Å
749	P	82.4	Confident	77.5	Confident	30 Å²	30	68 Å²	68	20%	0.195	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-79.1	137.3	-179.1	28.7	-29.7	0	0	0	111.7	L732 V734 C739	L732-P749 HydrophobicContact CB-CB 4.3Å; L732-P749 CarbonylContact O-C 3.55Å; L732-P749 WeakPolarHBondContact O-CA 3.31Å; V734-P749 HydrophobicContact CG2-CB 4.07Å; C739-P749 VanDerWaalsContact SG-CG 3.53Å
750	L	83.7	Confident	78.6	Confident	5 Å²	5	66.6 Å²	66.6	3%	0.026	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	110.8	177.5	176.3	53	0	0	0	110.4	I678 I717 A720 I727 L732 V734 L752	I678-L750 HydrophobicContact CD1-CB 4.01Å; I678-L750 HydrophobicContact CD1-CD2 3.62Å; I678-L750 HydrophobicContact CD1-CG 4.47Å; I678-L750 HydrophobicContact CG1-CD2 4.21Å; I717-L750 HydrophobicContact CG1-CD2 3.97Å; A720-L750 HydrophobicContact CB-CD1 3.47Å; A720-L750 VanDerWaalsContact CB-CD1 3.47Å; A720-L750 HydrophobicContact CB-CD2 4.08Å; A720-L750 HydrophobicContact CB-CG 4.43Å; I727-L750 HydrophobicContact CD1-CD1 4.1Å; L732-L750 PolarHBondContact O-N 2.64Å; V734-L750 PolarHBondContact N-O 3.15Å; L750-L752 HydrophobicContact CD1-CD2 3.93Å; L750-L752 HydrophobicContact CD1-CG 4.47Å; L750-L752 HydrophobicContact CD2-CD1 4.3Å; L750-L752 HydrophobicContact CD2-CD2 4.19Å; L750-L752 HydrophobicContact CD2-CG 4.36Å; L750-L752 HydrophobicContact CG-CD1 4.37Å; L750-L752 HydrophobicContact CG-CD2 3.86Å; L750-L752 HydrophobicContact CG-CG 3.93Å
751	R	84.6	Confident	79.5	Confident	136 Å²	136	67.9 Å²	67.9	51%	0.513	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	118.3	177.4	-62	-178.1	-175	176.3	0.3	111	V734	V734-R751 WeakPolarHBondContact O-CA 3.17Å
752	L	83.7	Confident	80.9	Confident	5 Å²	5	65.6 Å²	65.6	3%	0.026	37%	0.373	C	S	.	.			trans	-120.3	19.7	-178.5	-63.9	-173.6	0	0	0	113.6	L713 I717 V733 V734 F735 L750 G754 I755	L713-L752 HydrophobicContact CD1-CD1 3.64Å; I717-L752 HydrophobicContact CG1-CD1 4.41Å; V733-L752 HydrophobicContact CG1-CD1 3.66Å; V733-L752 HydrophobicContact CG1-CG 4.17Å; V734-L752 PolarHBondContact O-N 3.14Å; F735-L752 HydrophobicContact CD1-CB 3.87Å; F735-L752 HydrophobicContact CE1-CB 3.55Å; F735-L752 HydrophobicContact CE1-CD1 4.38Å; F735-L752 HydrophobicContact CZ-CB 4.29Å; F735-L752 HydrophobicContact CZ-CD1 4.43Å; L750-L752 HydrophobicContact CD1-CD2 3.93Å; L750-L752 HydrophobicContact CD1-CG 4.47Å; L750-L752 HydrophobicContact CD2-CD1 4.3Å; L750-L752 HydrophobicContact CD2-CD2 4.19Å; L750-L752 HydrophobicContact CD2-CG 4.36Å; L750-L752 HydrophobicContact CG-CD1 4.37Å; L750-L752 HydrophobicContact CG-CD2 3.86Å; L750-L752 HydrophobicContact CG-CG 3.93Å; L752-G754 PolarHBondContact O-N 3.03Å; L752-I755 HydrophobicContact CB-CD1 4.12Å; L752-I755 HydrophobicContact CB-CG1 3.98Å; L752-I755 HydrophobicContact CD1-CD1 4.2Å; L752-I755 HydrophobicContact CD2-CD1 4.4Å; L752-I755 HydrophobicContact CG-CD1 4.49Å; L752-I755 WeakPolarHBondContact O-CG1 3.18Å; L752-I755 PolarHBondContact O-N 3.39Å
753	R	83.3	Confident	82.2	Confident	82 Å²	82	63.1 Å²	63.1	31%	0.309	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-56.2	-35.1	176.3	-173.9	166.7	175.6	71.7	-6.6	113.1	F735 E737 I755 I756	F735-R753 WeakPolarHBondContact O-CB 3.43Å; F735-R753 WeakPolarHBondContact O-CG 3.44Å; E737-R753 IonicContact OE1-CZ 3.13Å; E737-R753 IonicContact OE1-NE 3.91Å; E737-R753 PolarHBondContact OE1-NE 2.71Å; E737-R753 IonicContact OE1-NH2 2.71Å; E737-R753 PolarHBondContact OE1-NH2 2.95Å; R753-I755 PolarHBondContact O-N 3.32Å; R753-I755 VanDerWaalsContact O-N 3.12Å; R753-I756 VanDerWaalsContact O-CG2 3.26Å; R753-I756 WeakPolarHBondContact O-CG2 3.49Å; R753-I756 PolarHBondContact O-N 3.39Å
754	G	77.4	Confident	83.1	Confident	63 Å²	63	62.4 Å²	62.4	65%	0.649	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	-65.5	-11.1	179.6	0	0	0	0	0	116.1	L752	L752-G754 PolarHBondContact O-N 3.03Å
755	I	83.4	Confident	84.4	Confident	15 Å²	15	56.6 Å²	56.6	8%	0.077	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-109.7	-1.1	178.1	62.4	162.6	0	0	0	114.4	V81 V708 L713 S716 L752 R753	V81-I755 HydrophobicContact CG1-CG2 4.5Å; V708-I755 HydrophobicContact CG1-CD1 3.84Å; V708-I755 HydrophobicContact CG1-CG1 4.39Å; L713-I755 HydrophobicContact CB-CD1 4.36Å; L713-I755 HydrophobicContact CD1-CD1 4.2Å; S716-I755 WeakPolarHBondContact OG-CG2 3.31Å; L752-I755 HydrophobicContact CB-CD1 4.12Å; L752-I755 HydrophobicContact CB-CG1 3.98Å; L752-I755 HydrophobicContact CD1-CD1 4.2Å; L752-I755 HydrophobicContact CD2-CD1 4.4Å; L752-I755 HydrophobicContact CG-CD1 4.49Å; L752-I755 WeakPolarHBondContact O-CG1 3.18Å; L752-I755 PolarHBondContact O-N 3.39Å; R753-I755 PolarHBondContact O-N 3.32Å; R753-I755 VanDerWaalsContact O-N 3.12Å
756	I	85.9	Confident	85.5	Confident	18 Å²	18	53.4 Å²	53.4	9%	0.092	30%	0.302	C	S	.	.			trans	-83.6	131.4	177.8	-160.3	173.7	0	0	0	110.4	V695 V705 V708 F735 R753 L758	V695-I756 HydrophobicContact CB-CD1 3.83Å; V695-I756 HydrophobicContact CG1-CD1 4.04Å; V695-I756 HydrophobicContact CG2-CD1 3.78Å; V695-I756 HydrophobicContact CG2-CG1 4.22Å; V705-I756 HydrophobicContact CG1-CD1 4.24Å; V708-I756 HydrophobicContact CG2-CB 4.11Å; V708-I756 HydrophobicContact CG2-CG1 3.9Å; F735-I756 HydrophobicContact CB-CD1 4.28Å; F735-I756 HydrophobicContact CD1-CB 4.43Å; F735-I756 HydrophobicContact CD1-CD1 4.44Å; R753-I756 VanDerWaalsContact O-CG2 3.26Å; R753-I756 WeakPolarHBondContact O-CG2 3.49Å; R753-I756 PolarHBondContact O-N 3.39Å; I756-L758 HydrophobicContact CD1-CD2 4.47Å; I756-L758 HydrophobicContact CG2-CD2 3.59Å; I756-L758 HydrophobicContact CG2-CG 3.86Å; I756-L758 PolarHBondContact O-N 3.3Å
757	D	84.1	Confident	86.4	Confident	56 Å²	56	52.6 Å²	52.6	30%	0.299	29%	0.293	S	S	.	.	B	Isolated β-bridge	trans	-78.1	111.5	159.1	179.2	8	0	0	0	107.7	G706 F707 S759	G706-D757 CarbonylContact C-O 3.53Å; G706-D757 WeakPolarHBondContact CA-O 3.24Å; F707-D757 PolarHBondContact N-O 2.98Å; F707-D757 PolarHBondContact O-N 3.06Å; D757-S759 VanDerWaalsContact C-N 3.26Å; D757-S759 WeakPolarHBondContact OD1-CA 3.14Å; D757-S759 PolarHBondContact OD1-N 3Å; D757-S759 PolarHBondContact OD1-OG 3.16Å; D757-S759 VanDerWaalsContact OD1-OG 3.13Å
758	L	84.7	Confident	86.9	Confident	94 Å²	94	53.2 Å²	53.2	49%	0.492	30%	0.297	S	S	.	.	S	Bend	trans	-78.8	-10	177.9	-66.5	172.2	0	0	0	112.8	I756	I756-L758 HydrophobicContact CD1-CD2 4.47Å; I756-L758 HydrophobicContact CG2-CD2 3.59Å; I756-L758 HydrophobicContact CG2-CG 3.86Å; I756-L758 PolarHBondContact O-N 3.3Å
759	S	85.4	Confident	87.3	Confident	98 Å²	98	50.5 Å²	50.5	69%	0.685	28%	0.28	S	S	*	.	S	Bend	trans	-129.2	47.8	-173.9	52.5	0	0	0	0	113.1	D757	D757-S759 VanDerWaalsContact C-N 3.26Å; D757-S759 WeakPolarHBondContact OD1-CA 3.14Å; D757-S759 PolarHBondContact OD1-N 3Å; D757-S759 PolarHBondContact OD1-OG 3.16Å; D757-S759 VanDerWaalsContact OD1-OG 3.13Å
760	P	87.9	Confident	87.5	Confident	19 Å²	19	52.5 Å²	52.5	12%	0.123	29%	0.289	C	S	.	.			trans	-65	140.5	177.9	31.6	-36.6	0	0	0	109.8	L704 F707 T762 L785	L704-P760 HydrophobicContact CD2-CG 4.23Å; F707-P760 HydrophobicContact CB-CB 3.93Å; F707-P760 HydrophobicContact CB-CG 4.34Å; P760-T762 PolarHBondContact O-N 3.29Å; P760-L785 HydrophobicContact CB-CD1 3.81Å; P760-L785 HydrophobicContact CG-CD1 3.81Å
761	F	89.9	Confident	87.8	Confident	76 Å²	76	56.2 Å²	56.2	33%	0.333	31%	0.307	S	S	.	.			trans	-66.8	123.8	-177.2	-163.1	-77.2	0	0	0	111.6	V763 I775 L779 L781 C784 L785	F761-V763 HydrophobicContact CE1-CG1 4.03Å; F761-I775 HydrophobicContact CD1-CG2 4.11Å; F761-I775 HydrophobicContact CE1-CD1 4.07Å; F761-I775 HydrophobicContact CE1-CG2 3.49Å; F761-I775 VanDerWaalsContact CE1-CG2 3.49Å; F761-I775 HydrophobicContact CE2-CG2 4.29Å; F761-I775 HydrophobicContact CZ-CD1 4.1Å; F761-I775 HydrophobicContact CZ-CG1 4.44Å; F761-I775 HydrophobicContact CZ-CG2 3.59Å; F761-L779 HydrophobicContact CD2-CD1 3.84Å; F761-L779 HydrophobicContact CE2-CD1 3.39Å; F761-L779 HydrophobicContact CZ-CD1 4.07Å; F761-L781 HydrophobicContact CB-CD1 3.76Å; F761-L781 HydrophobicContact CB-CD2 4.09Å; F761-L781 HydrophobicContact CD1-CD1 3.5Å; F761-L781 VanDerWaalsContact CD1-CD1 3.5Å; F761-L781 HydrophobicContact CD2-CD1 4.18Å; F761-L781 HydrophobicContact CD2-CD2 4.38Å; F761-L781 HydrophobicContact CE1-CD1 4.16Å; F761-L781 HydrophobicContact CG-CD1 3.52Å; F761-L781 HydrophobicContact CG-CD2 4.24Å; F761-C784 WeakPolarHBondContact O-CA 3.36Å; F761-C784 PolarHBondContact O-SG 3.2Å; F761-C784 VanDerWaalsContact O-SG 3.34Å; F761-L785 PolarHBondContact O-N 3.25Å
762	T	92.2	Very high	88	Confident	62 Å²	62	49.8 Å²	49.8	38%	0.38	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	149.3	-177.9	48.4	0	0	0	0	112.7	L704 P760 L785 T787	L704-T762 HydrophobicContact CD2-CG2 3.52Å; P760-T762 PolarHBondContact O-N 3.29Å; T762-L785 CarbonylContact C-O 3.52Å; T762-L785 WeakPolarHBondContact CA-O 3.37Å; T762-L785 HydrophobicContact CG2-CB 4.09Å; T762-T787 HydrophobicContact CG2-CG2 3.85Å
763	V	94.3	Very high	88.3	Confident	11 Å²	11	49.5 Å²	49.5	7%	0.067	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	161.7	165.9	-66.8	0	0	0	0	110.1	A655 F761 T767 I775 L785 V786 T787	A655-V763 HydrophobicContact CB-CG2 4.26Å; F761-V763 HydrophobicContact CE1-CG1 4.03Å; V763-T767 HydrophobicContact CB-CG2 4.44Å; V763-T767 HydrophobicContact CG1-CG2 4.46Å; V763-I775 HydrophobicContact CG1-CD1 4.35Å; V763-L785 PolarHBondContact N-O 3.12Å; V763-V786 HydrophobicContact CG2-CG2 3.98Å; V763-T787 PolarHBondContact O-N 3.19Å
764	T	93.8	Very high	88.4	Confident	75 Å²	75	48.3 Å²	48.3	46%	0.46	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	153.6	169.8	57.6	0	0	0	0	110.8	H766 T767 T787	T764-H766 PolarHBondContact O-N 3.35Å; T764-T767 PolarHBondContact N-OG1 3.3Å; T764-T767 VanDerWaalsContact O-CB 3.27Å; T764-T767 WeakPolarHBondContact O-CB 3.27Å; T764-T767 PolarHBondContact O-N 3.02Å; T764-T767 PolarHBondContact O-OG1 3.1Å; T764-T767 VanDerWaalsContact O-OG1 3.06Å; T764-T767 PolarHBondContact OG1-OG1 2.81Å; T764-T787 WeakPolarHBondContact CA-O 3.26Å
765	D	91.8	Very high	89	Confident	19 Å²	19	47 Å²	47	10%	0.102	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-33.5	174.8	55	-21.6	0	0	0	114	V656 T767 V786 T787 H788 L793	V656-D765 HydrophobicContact CB-CB 4.21Å; V656-D765 HydrophobicContact CG2-CB 4.48Å; V656-D765 PolarHBondContact N-O 3.48Å; D765-T767 VanDerWaalsContact C-N 3.32Å; D765-V786 HydrophobicContact CB-CG1 4.04Å; D765-T787 PolarHBondContact N-O 3.47Å; D765-H788 VanDerWaalsContact CG-ND1 3.29Å; D765-H788 IonicContact OD1-CG 3.95Å; D765-H788 IonicContact OD1-ND1 3.08Å; D765-H788 PolarHBondContact OD1-ND1 3.34Å; D765-H788 VanDerWaalsContact OD1-ND1 3.08Å; D765-H788 IonicContact OD2-CE1 3.73Å; D765-H788 IonicContact OD2-CG 3.62Å; D765-H788 IonicContact OD2-ND1 2.83Å; D765-H788 PolarHBondContact OD2-ND1 2.97Å; D765-L793 HydrophobicContact CB-CD1 3.93Å
766	H	91.8	Very high	89.1	Confident	124 Å²	124	46.7 Å²	46.7	57%	0.574	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	3.6	174.9	-62.7	-64.2	0	0	0	114.8	T764 P768	T764-H766 PolarHBondContact O-N 3.35Å; H766-P768 WeakPolarHBondContact O-CD 3.23Å
767	T	92.4	Very high	88.9	Confident	21 Å²	21	46.4 Å²	46.4	13%	0.129	26%	0.255	C	S	.	.			trans	-67.8	127.3	177.3	-60.4	0	0	0	0	110.1	A655 V763 T764 D765 I771	A655-T767 WeakPolarHBondContact CB-O 3.32Å; A655-T767 PolarHBondContact N-O 2.84Å; V763-T767 HydrophobicContact CB-CG2 4.44Å; V763-T767 HydrophobicContact CG1-CG2 4.46Å; T764-T767 PolarHBondContact N-OG1 3.3Å; T764-T767 VanDerWaalsContact O-CB 3.27Å; T764-T767 WeakPolarHBondContact O-CB 3.27Å; T764-T767 PolarHBondContact O-N 3.02Å; T764-T767 PolarHBondContact O-OG1 3.1Å; T764-T767 VanDerWaalsContact O-OG1 3.06Å; T764-T767 PolarHBondContact OG1-OG1 2.81Å; D765-T767 VanDerWaalsContact C-N 3.32Å; T767-I771 HydrophobicContact CG2-CB 4.3Å; T767-I771 HydrophobicContact CG2-CG2 4.23Å
768	P	91.9	Very high	88.8	Confident	51 Å²	51	49.8 Å²	49.8	33%	0.331	27%	0.267	S	S	.	.	B	Isolated β-bridge	trans	-56.4	146.1	172.1	-31	40	0	0	0	114	H766 D770 I771 T772	H766-P768 WeakPolarHBondContact O-CD 3.23Å; P768-D770 WeakPolarHBondContact CB-OD1 3.44Å; P768-I771 HydrophobicContact CB-CD1 4.42Å; P768-I771 HydrophobicContact CB-CG1 4.42Å; P768-I771 HydrophobicContact CG-CD1 4.34Å; P768-I771 PolarHBondContact O-N 3.36Å; P768-T772 PolarHBondContact O-N 2.84Å; P768-T772 VanDerWaalsContact O-N 3.1Å; P768-T772 PolarHBondContact O-OG1 2.91Å
769	M	89.2	Confident	88.7	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	26%	0.261	C	S	.	.	H	α-helix	trans	-73.4	-25.4	-177.6	-81.1	-57.1	-51.2	0	0	114.2	F649 S653 V658 T772 V773 I801	F649-M769 HydrophobicContact CD1-CB 4.24Å; F649-M769 HydrophobicContact CE1-CB 3.55Å; F649-M769 HydrophobicContact CZ-CB 4.09Å; S653-M769 WeakPolarHBondContact O-CB 3.49Å; S653-M769 VanDerWaalsContact O-CG 3.28Å; S653-M769 WeakPolarHBondContact O-CG 3.24Å; S653-M769 PolarHBondContact O-N 3.06Å; S653-M769 WeakPolarHBondContact OG-CG 3.17Å; V658-M769 HydrophobicContact CB-CE 4.21Å; V658-M769 HydrophobicContact CB-SD 3.87Å; V658-M769 HydrophobicContact CG1-CE 4.17Å; V658-M769 HydrophobicContact CG1-SD 4.46Å; V658-M769 HydrophobicContact CG2-CE 3.93Å; V658-M769 HydrophobicContact CG2-CG 3.73Å; V658-M769 HydrophobicContact CG2-SD 3.56Å; V658-M769 VanDerWaalsContact CG2-SD 3.56Å; M769-T772 HydrophobicContact CE-CG2 4.07Å; M769-T772 PolarHBondContact O-N 3.44Å; M769-T772 HydrophobicContact SD-CG2 4.17Å; M769-V773 HydrophobicContact CE-CG2 4.12Å; M769-V773 VanDerWaalsContact O-CB 3.3Å; M769-V773 WeakPolarHBondContact O-CB 3.35Å; M769-V773 WeakPolarHBondContact O-CG2 3.47Å; M769-V773 PolarHBondContact O-N 2.92Å; M769-I801 HydrophobicContact CE-CG1 4.09Å
770	D	87.3	Confident	88.4	Confident	72 Å²	72	44.7 Å²	44.7	39%	0.385	24%	0.236	S	C	.	.	H	α-helix	trans	-59	-51.8	170.6	63.2	-39.7	0	0	0	110.6	F649 P768 T772 V773 D774	F649-D770 HydrophobicContact CB-CB 4.31Å; F649-D770 HydrophobicContact CD1-CB 4.16Å; P768-D770 WeakPolarHBondContact CB-OD1 3.44Å; D770-T772 VanDerWaalsContact C-N 3.31Å; D770-T772 PolarHBondContact O-N 3.44Å; D770-V773 PolarHBondContact O-N 2.87Å; D770-D774 WeakPolarHBondContact O-CB 3.3Å; D770-D774 PolarHBondContact O-N 3.11Å
771	I	89.4	Confident	88.3	Confident	82 Å²	82	44.2 Å²	44.2	42%	0.421	23%	0.233	S	C	.	.	H	α-helix	trans	-59.4	-44	175.3	-59.5	-179.9	0	0	0	110.4	T767 P768 D774 I775	T767-I771 HydrophobicContact CG2-CB 4.3Å; T767-I771 HydrophobicContact CG2-CG2 4.23Å; P768-I771 HydrophobicContact CB-CD1 4.42Å; P768-I771 HydrophobicContact CB-CG1 4.42Å; P768-I771 HydrophobicContact CG-CD1 4.34Å; P768-I771 PolarHBondContact O-N 3.36Å; I771-D774 PolarHBondContact O-N 2.9Å; I771-I775 HydrophobicContact CG2-CD1 3.88Å; I771-I775 HydrophobicContact CG2-CG1 4.45Å; I771-I775 VanDerWaalsContact O-CG1 3.25Å; I771-I775 WeakPolarHBondContact O-CG1 3.42Å; I771-I775 PolarHBondContact O-N 3.28Å
772	T	89.6	Confident	87.9	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.006	22%	0.221	C	C	.	.	H	α-helix	trans	-62.4	-46.1	179.2	-55.5	0	0	0	0	111.5	P768 M769 D770 D774 I775 F776 I796	P768-T772 PolarHBondContact O-N 2.84Å; P768-T772 VanDerWaalsContact O-N 3.1Å; P768-T772 PolarHBondContact O-OG1 2.91Å; M769-T772 HydrophobicContact CE-CG2 4.07Å; M769-T772 PolarHBondContact O-N 3.44Å; M769-T772 HydrophobicContact SD-CG2 4.17Å; D770-T772 VanDerWaalsContact C-N 3.31Å; D770-T772 PolarHBondContact O-N 3.44Å; T772-D774 VanDerWaalsContact C-N 3.33Å; T772-D774 PolarHBondContact O-N 3.49Å; T772-I775 PolarHBondContact O-N 2.8Å; T772-F776 HydrophobicContact CG2-CD2 4.16Å; T772-F776 HydrophobicContact CG2-CE2 4.21Å; T772-F776 WeakPolarHBondContact O-CD2 3.31Å; T772-F776 PolarHBondContact O-N 2.97Å; T772-I796 HydrophobicContact CG2-CD1 4.13Å
773	V	88.1	Confident	87.7	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.4	-43.5	175	167.3	0	0	0	0	110.6	L643 F649 M769 D770 I775 F776 R777 I801	L643-V773 HydrophobicContact CD1-CG1 4.45Å; L643-V773 HydrophobicContact CD2-CG1 4.48Å; F649-V773 HydrophobicContact CD2-CG2 4.4Å; M769-V773 HydrophobicContact CE-CG2 4.12Å; M769-V773 VanDerWaalsContact O-CB 3.3Å; M769-V773 WeakPolarHBondContact O-CB 3.35Å; M769-V773 WeakPolarHBondContact O-CG2 3.47Å; M769-V773 PolarHBondContact O-N 2.92Å; D770-V773 PolarHBondContact O-N 2.87Å; V773-I775 VanDerWaalsContact C-N 3.35Å; V773-I775 PolarHBondContact O-N 3.38Å; V773-F776 PolarHBondContact O-N 2.85Å; V773-R777 HydrophobicContact CG1-CG 4.39Å; V773-R777 WeakPolarHBondContact O-CB 3.34Å; V773-R777 VanDerWaalsContact O-CG 3.26Å; V773-R777 WeakPolarHBondContact O-CG 3.47Å; V773-R777 PolarHBondContact O-N 2.99Å; V773-I801 HydrophobicContact CG2-CG2 3.74Å
774	D	86.7	Confident	87.6	Confident	57 Å²	57	39.6 Å²	39.6	31%	0.305	21%	0.206	S	C	.	.	H	α-helix	trans	-65.7	-35.3	179.4	-115	33.2	0	0	0	113.3	D770 I771 T772 R777 K778	D770-D774 WeakPolarHBondContact O-CB 3.3Å; D770-D774 PolarHBondContact O-N 3.11Å; I771-D774 PolarHBondContact O-N 2.9Å; T772-D774 VanDerWaalsContact C-N 3.33Å; T772-D774 PolarHBondContact O-N 3.49Å; D774-R777 IonicContact OD1-NH1 3.68Å; D774-K778 VanDerWaalsContact O-CB 3.29Å; D774-K778 WeakPolarHBondContact O-CB 3.49Å; D774-K778 WeakPolarHBondContact O-CG 3.43Å; D774-K778 PolarHBondContact O-N 3.03Å; D774-K778 VanDerWaalsContact OD2-CE 3.26Å; D774-K778 WeakPolarHBondContact OD2-CE 3.16Å; D774-K778 IonicContact OD2-NZ 2.77Å; D774-K778 PolarHBondContact OD2-NZ 2.99Å
775	I	88.6	Confident	87.6	Confident	36 Å²	36	36.1 Å²	36.1	19%	0.185	19%	0.185	C	C	.	.	H	α-helix	trans	-63.9	-49.8	170.6	-71.4	166.3	0	0	0	110.2	F761 V763 I771 T772 V773 R777 K778 L779 L781	F761-I775 HydrophobicContact CD1-CG2 4.11Å; F761-I775 HydrophobicContact CE1-CD1 4.07Å; F761-I775 HydrophobicContact CE1-CG2 3.49Å; F761-I775 VanDerWaalsContact CE1-CG2 3.49Å; F761-I775 HydrophobicContact CE2-CG2 4.29Å; F761-I775 HydrophobicContact CZ-CD1 4.1Å; F761-I775 HydrophobicContact CZ-CG1 4.44Å; F761-I775 HydrophobicContact CZ-CG2 3.59Å; V763-I775 HydrophobicContact CG1-CD1 4.35Å; I771-I775 HydrophobicContact CG2-CD1 3.88Å; I771-I775 HydrophobicContact CG2-CG1 4.45Å; I771-I775 VanDerWaalsContact O-CG1 3.25Å; I771-I775 WeakPolarHBondContact O-CG1 3.42Å; I771-I775 PolarHBondContact O-N 3.28Å; T772-I775 PolarHBondContact O-N 2.8Å; V773-I775 VanDerWaalsContact C-N 3.35Å; V773-I775 PolarHBondContact O-N 3.38Å; I775-R777 VanDerWaalsContact C-N 3.25Å; I775-R777 PolarHBondContact O-N 3.16Å; I775-K778 PolarHBondContact O-N 2.77Å; I775-L779 HydrophobicContact CG2-CD1 4.07Å; I775-L779 WeakPolarHBondContact O-CB 3.43Å; I775-L779 PolarHBondContact O-N 2.75Å; I775-L781 HydrophobicContact CG2-CD1 3.5Å; I775-L781 HydrophobicContact CG2-CG 4.24Å
776	F	86.7	Confident	87.7	Confident	7 Å²	7	35.2 Å²	35.2	3%	0.031	18%	0.18	C	C	.	.	H	α-helix	trans	-59.2	-37	177.7	-95.9	-93	0	0	0	112.7	L643 T772 V773 G780 L781 C784 I796 K798 I801	L643-F776 HydrophobicContact CD2-CB 4.12Å; T772-F776 HydrophobicContact CG2-CD2 4.16Å; T772-F776 HydrophobicContact CG2-CE2 4.21Å; T772-F776 WeakPolarHBondContact O-CD2 3.31Å; T772-F776 PolarHBondContact O-N 2.97Å; V773-F776 PolarHBondContact O-N 2.85Å; F776-G780 VanDerWaalsContact O-CA 3.25Å; F776-G780 WeakPolarHBondContact O-CA 3.23Å; F776-G780 PolarHBondContact O-N 3.49Å; F776-L781 HydrophobicContact CD1-CB 3.96Å; F776-L781 WeakPolarHBondContact CD1-O 3.42Å; F776-L781 HydrophobicContact CE1-CB 4.05Å; F776-L781 WeakPolarHBondContact CE1-O 3.36Å; F776-L781 HydrophobicContact CG-CB 4.28Å; F776-L781 HydrophobicContact CZ-CB 4.47Å; F776-L781 PolarHBondContact O-N 3.39Å; F776-C784 HydrophobicContact CE2-CB 3.49Å; F776-C784 VanDerWaalsContact CE2-CB 3.49Å; F776-C784 HydrophobicContact CZ-CB 3.7Å; F776-I796 HydrophobicContact CE2-CB 4.4Å; F776-I796 HydrophobicContact CE2-CG2 3.87Å; F776-I796 HydrophobicContact CZ-CB 4.41Å; F776-I796 HydrophobicContact CZ-CG2 3.95Å; F776-I796 WeakPolarHBondContact CZ-O 3.34Å; F776-K798 HydrophobicContact CD1-CB 4.44Å; F776-I801 HydrophobicContact CB-CD1 4.05Å; F776-I801 HydrophobicContact CD1-CD1 3.97Å; F776-I801 HydrophobicContact CD2-CD1 3.42Å; F776-I801 VanDerWaalsContact CD2-CD1 3.42Å; F776-I801 HydrophobicContact CE1-CD1 4.26Å; F776-I801 HydrophobicContact CE2-CD1 3.73Å; F776-I801 HydrophobicContact CG-CD1 3.53Å; F776-I801 HydrophobicContact CZ-CD1 4.14Å
777	R	82.1	Confident	87.8	Confident	13 Å²	13	30 Å²	30	5%	0.049	16%	0.157	C	C	.	.	H	α-helix	trans	-64.1	-71.6	170.5	-73.5	171.2	171.5	161	-1.5	110.1	Y341 L643 E644 E647 V773 D774 I775 L779 G780	Y341-R777 WeakPolarHBondContact CE1-O 3.48Å; Y341-R777 HydrophobicContact CE2-CB 3.95Å; Y341-R777 HydrophobicContact CE2-CG 4.39Å; Y341-R777 WeakPolarHBondContact OH-CB 3.41Å; Y341-R777 PolarHBondContact OH-O 2.95Å; L643-R777 HydrophobicContact CD2-CG 3.68Å; L643-R777 HydrophobicContact CG-CG 3.95Å; E644-R777 PolarHBondContact O-NE 3.27Å; E644-R777 PolarHBondContact O-NH2 3.09Å; E647-R777 PolarHBondContact O-NH1 3.49Å; E647-R777 PolarHBondContact O-NH2 2.86Å; V773-R777 HydrophobicContact CG1-CG 4.39Å; V773-R777 WeakPolarHBondContact O-CB 3.34Å; V773-R777 VanDerWaalsContact O-CG 3.26Å; V773-R777 WeakPolarHBondContact O-CG 3.47Å; V773-R777 PolarHBondContact O-N 2.99Å; D774-R777 IonicContact OD1-NH1 3.68Å; I775-R777 VanDerWaalsContact C-N 3.25Å; I775-R777 PolarHBondContact O-N 3.16Å; R777-L779 PolarHBondContact O-N 3.47Å; R777-G780 PolarHBondContact O-N 3.11Å; R777-G780 VanDerWaalsContact O-N 3.08Å
778	K	82.4	Confident	87.9	Confident	127 Å²	127	32.4 Å²	32.4	55%	0.552	17%	0.167	S	C	*	.	H	α-helix	trans	-63.6	-37.5	-165.5	-70.3	166.9	175.6	166	0	113.7	Y341 D774 I775	Y341-K778 VanDerWaalsContact OH-CA 3.3Å; Y341-K778 WeakPolarHBondContact OH-CA 3.46Å; Y341-K778 PolarHBondContact OH-N 2.74Å; Y341-K778 VanDerWaalsContact OH-N 3.13Å; D774-K778 VanDerWaalsContact O-CB 3.29Å; D774-K778 WeakPolarHBondContact O-CB 3.49Å; D774-K778 WeakPolarHBondContact O-CG 3.43Å; D774-K778 PolarHBondContact O-N 3.03Å; D774-K778 VanDerWaalsContact OD2-CE 3.26Å; D774-K778 WeakPolarHBondContact OD2-CE 3.16Å; D774-K778 IonicContact OD2-NZ 2.77Å; D774-K778 PolarHBondContact OD2-NZ 2.99Å; I775-K778 PolarHBondContact O-N 2.77Å
779	L	82.1	Confident	87.8	Confident	67 Å²	67	36.8 Å²	36.8	35%	0.351	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-13.9	177.4	-58.5	-175.8	0	0	0	113.2	W92 F761 I775 R777 L781	W92-L779 WeakPolarHBondContact CB-O 3.23Å; F761-L779 HydrophobicContact CD2-CD1 3.84Å; F761-L779 HydrophobicContact CE2-CD1 3.39Å; F761-L779 HydrophobicContact CZ-CD1 4.07Å; I775-L779 HydrophobicContact CG2-CD1 4.07Å; I775-L779 WeakPolarHBondContact O-CB 3.43Å; I775-L779 PolarHBondContact O-N 2.75Å; R777-L779 PolarHBondContact O-N 3.47Å; L779-L781 HydrophobicContact CB-CD2 3.86Å; L779-L781 HydrophobicContact CB-CG 4.03Å; L779-L781 HydrophobicContact CD1-CD2 4.35Å
780	G	79.1	Confident	87.8	Confident	17 Å²	17	38.7 Å²	38.7	18%	0.175	21%	0.207	C	C	.	.			trans	67.1	32.9	-175.7	0	0	0	0	0	113.5	F776 R777 R782	F776-G780 VanDerWaalsContact O-CA 3.25Å; F776-G780 WeakPolarHBondContact O-CA 3.23Å; F776-G780 PolarHBondContact O-N 3.49Å; R777-G780 PolarHBondContact O-N 3.11Å; R777-G780 VanDerWaalsContact O-N 3.08Å; G780-R782 PolarHBondContact O-N 3.46Å
781	L	84.3	Confident	88	Confident	9 Å²	9	42.5 Å²	42.5	5%	0.047	22%	0.216	C	C	.	.			trans	-59.5	137.2	-174.7	-60.1	-173.5	0	0	0	112.3	V93 F761 I775 F776 L779 C784	V93-L781 HydrophobicContact CG2-CD2 3.82Å; F761-L781 HydrophobicContact CB-CD1 3.76Å; F761-L781 HydrophobicContact CB-CD2 4.09Å; F761-L781 HydrophobicContact CD1-CD1 3.5Å; F761-L781 VanDerWaalsContact CD1-CD1 3.5Å; F761-L781 HydrophobicContact CD2-CD1 4.18Å; F761-L781 HydrophobicContact CD2-CD2 4.38Å; F761-L781 HydrophobicContact CE1-CD1 4.16Å; F761-L781 HydrophobicContact CG-CD1 3.52Å; F761-L781 HydrophobicContact CG-CD2 4.24Å; I775-L781 HydrophobicContact CG2-CD1 3.5Å; I775-L781 HydrophobicContact CG2-CG 4.24Å; F776-L781 HydrophobicContact CD1-CB 3.96Å; F776-L781 WeakPolarHBondContact CD1-O 3.42Å; F776-L781 HydrophobicContact CE1-CB 4.05Å; F776-L781 WeakPolarHBondContact CE1-O 3.36Å; F776-L781 HydrophobicContact CG-CB 4.28Å; F776-L781 HydrophobicContact CZ-CB 4.47Å; F776-L781 PolarHBondContact O-N 3.39Å; L779-L781 HydrophobicContact CB-CD2 3.86Å; L779-L781 HydrophobicContact CB-CG 4.03Å; L779-L781 HydrophobicContact CD1-CD2 4.35Å; L781-C784 HydrophobicContact CD1-CB 4.29Å
782	R	82.4	Confident	88.2	Confident	23 Å²	23	39.1 Å²	39.1	9%	0.087	20%	0.199	C	C	.	.	S	Bend	trans	-71.7	-44.3	169	171.2	174.8	175.3	158.4	-0.2	111.3	S691 G780	S691-R782 PolarHBondContact OG-NH2 2.99Å; G780-R782 PolarHBondContact O-N 3.46Å
783	Q	88.9	Confident	88.3	Confident	28 Å²	28	42.3 Å²	42.3	13%	0.131	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	162	-177.9	68	-127.6	-4.5	0	0	109.7	F707 I795 I796 T797	F707-Q783 VanDerWaalsContact CZ-NE2 3.25Å; Q783-I795 HydrophobicContact CB-CD1 3.97Å; Q783-I795 HydrophobicContact CB-CG1 4.15Å; Q783-I795 HydrophobicContact CG-CD1 4.16Å; Q783-I796 CarbonylContact C-O 3.46Å; Q783-I796 VanDerWaalsContact CA-O 3.29Å; Q783-I796 WeakPolarHBondContact CA-O 3.36Å; Q783-T797 HydrophobicContact CB-CG2 4.43Å
784	C	91.6	Very high	88.5	Confident	1 Å²	1	42.3 Å²	42.3	1%	0.007	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	138.8	173.6	179.4	0	0	0	0	108.9	F761 F776 L781 I795 I796	F761-C784 WeakPolarHBondContact O-CA 3.36Å; F761-C784 PolarHBondContact O-SG 3.2Å; F761-C784 VanDerWaalsContact O-SG 3.34Å; F776-C784 HydrophobicContact CE2-CB 3.49Å; F776-C784 VanDerWaalsContact CE2-CB 3.49Å; F776-C784 HydrophobicContact CZ-CB 3.7Å; L781-C784 HydrophobicContact CD1-CB 4.29Å; C784-I795 WeakPolarHBondContact O-CA 3.46Å; C784-I796 PolarHBondContact N-O 2.88Å; C784-I796 PolarHBondContact O-N 2.83Å
785	L	93.2	Very high	88.8	Confident	2 Å²	2	40.7 Å²	40.7	1%	0.01	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	127.2	-179.7	-61.5	175.4	0	0	0	109.9	P694 L704 F707 P760 F761 T762 V763 L792 I795	P694-L785 HydrophobicContact CB-CD1 4.36Å; P694-L785 HydrophobicContact CB-CD2 4.25Å; L704-L785 HydrophobicContact CD1-CD1 3.66Å; L704-L785 HydrophobicContact CD2-CB 4.28Å; L704-L785 HydrophobicContact CD2-CD1 3.67Å; L704-L785 HydrophobicContact CG-CD1 4.32Å; F707-L785 HydrophobicContact CD2-CD1 4.38Å; F707-L785 HydrophobicContact CD2-CD2 4.37Å; P760-L785 HydrophobicContact CB-CD1 3.81Å; P760-L785 HydrophobicContact CG-CD1 3.81Å; F761-L785 PolarHBondContact O-N 3.25Å; T762-L785 CarbonylContact C-O 3.52Å; T762-L785 WeakPolarHBondContact CA-O 3.37Å; T762-L785 HydrophobicContact CG2-CB 4.09Å; V763-L785 PolarHBondContact N-O 3.12Å; L785-L792 HydrophobicContact CB-CD1 4.02Å; L785-L792 HydrophobicContact CD2-CD1 4.13Å; L785-L792 HydrophobicContact CG-CD1 4.48Å; L785-I795 HydrophobicContact CD2-CB 4.11Å; L785-I795 HydrophobicContact CD2-CD1 3.88Å; L785-I795 HydrophobicContact CD2-CG1 3.91Å
786	V	94.4	Very high	88.9	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	124.2	177.4	-173.6	0	0	0	0	108.6	A655 M659 V763 D765 L793 G794 I796	A655-V786 HydrophobicContact CB-CG2 4.49Å; M659-V786 HydrophobicContact CB-CG2 3.85Å; M659-V786 HydrophobicContact SD-CB 3.73Å; M659-V786 HydrophobicContact SD-CG1 3.68Å; M659-V786 HydrophobicContact SD-CG2 4.07Å; V763-V786 HydrophobicContact CG2-CG2 3.98Å; D765-V786 HydrophobicContact CB-CG1 4.04Å; V786-L793 PolarHBondContact O-N 3.35Å; V786-G794 PolarHBondContact N-O 3.11Å; V786-G794 PolarHBondContact O-N 3.46Å; V786-I796 HydrophobicContact CG2-CD1 3.58Å; V786-I796 HydrophobicContact CG2-CG1 3.78Å
787	T	94	Very high	89	Confident	16 Å²	16	40.4 Å²	40.4	10%	0.098	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	151.3	-176.6	66.1	0	0	0	0	111.9	L704 T762 V763 T764 D765 R791	L704-T787 HydrophobicContact CD2-CG2 4.01Å; T762-T787 HydrophobicContact CG2-CG2 3.85Å; V763-T787 PolarHBondContact O-N 3.19Å; T764-T787 WeakPolarHBondContact CA-O 3.26Å; D765-T787 PolarHBondContact N-O 3.47Å; T787-R791 CarbonylContact C-O 3.49Å; T787-R791 WeakPolarHBondContact CA-O 3.31Å; T787-R791 WeakPolarHBondContact CB-O 3.31Å
788	H	93.7	Very high	89.1	Confident	71 Å²	71	40.7 Å²	40.7	33%	0.329	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	116.6	172.2	-175.1	100	0	0	0	108.5	D765 G790 R791 L793	D765-H788 VanDerWaalsContact CG-ND1 3.29Å; D765-H788 IonicContact OD1-CG 3.95Å; D765-H788 IonicContact OD1-ND1 3.08Å; D765-H788 PolarHBondContact OD1-ND1 3.34Å; D765-H788 VanDerWaalsContact OD1-ND1 3.08Å; D765-H788 IonicContact OD2-CE1 3.73Å; D765-H788 IonicContact OD2-CG 3.62Å; D765-H788 IonicContact OD2-ND1 2.83Å; D765-H788 PolarHBondContact OD2-ND1 2.97Å; H788-G790 PolarHBondContact O-N 3.47Å; H788-R791 PolarHBondContact N-O 2.98Å; H788-R791 WeakPolarHBondContact O-CB 3.36Å; H788-R791 PolarHBondContact O-N 2.95Å; H788-L793 HydrophobicContact CB-CD1 3.57Å; H788-L793 HydrophobicContact CB-CG 4.11Å
789	N	90.8	Very high	89.1	Confident	143 Å²	143	40 Å²	40	77%	0.765	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	42	-174.5	-60.9	-36.1	0	0	0	113.5	R791	N789-R791 PolarHBondContact O-N 3.36Å
790	G	87.6	Confident	89.3	Confident	41 Å²	41	38 Å²	38	42%	0.423	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.8	-4.1	-179	0	0	0	0	0	115.8	R703 L704 H788	R703-G790 WeakPolarHBondContact CA-O 3.33Å; L704-G790 PolarHBondContact N-O 3.34Å; H788-G790 PolarHBondContact O-N 3.47Å
791	R	92.6	Very high	89.7	Confident	151 Å²	151	37.2 Å²	37.2	57%	0.57	19%	0.188	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-81.6	134.4	168.7	-66.1	-175.6	166.9	165.9	-2.1	110.1	Q702 T787 H788 N789	Q702-R791 CarbonylContact O-C 3.35Å; Q702-R791 WeakPolarHBondContact O-CA 3.43Å; T787-R791 CarbonylContact C-O 3.49Å; T787-R791 WeakPolarHBondContact CA-O 3.31Å; T787-R791 WeakPolarHBondContact CB-O 3.31Å; H788-R791 PolarHBondContact N-O 2.98Å; H788-R791 WeakPolarHBondContact O-CB 3.36Å; H788-R791 PolarHBondContact O-N 2.95Å; N789-R791 PolarHBondContact O-N 3.36Å
792	L	93.3	Very high	89.6	Confident	11 Å²	11	37.7 Å²	37.7	6%	0.058	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	125.7	172.9	-178.1	65.1	0	0	0	109.9	L668 V670 P694 V696 Q702 L785	L668-L792 HydrophobicContact CD2-CD2 3.77Å; L668-L792 HydrophobicContact CD2-CG 4.11Å; V670-L792 HydrophobicContact CG1-CD2 4.09Å; P694-L792 HydrophobicContact CB-CD2 3.63Å; P694-L792 HydrophobicContact CG-CD2 3.54Å; V696-L792 HydrophobicContact CG1-CB 4.46Å; V696-L792 HydrophobicContact CG1-CD2 3.95Å; Q702-L792 WeakPolarHBondContact O-CB 3.42Å; Q702-L792 PolarHBondContact O-N 2.95Å; L785-L792 HydrophobicContact CB-CD1 4.02Å; L785-L792 HydrophobicContact CD2-CD1 4.13Å; L785-L792 HydrophobicContact CG-CD1 4.48Å
793	L	91.8	Very high	89.6	Confident	68 Å²	68	38.6 Å²	38.6	36%	0.356	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	-36.4	175.5	-65.2	-178.1	0	0	0	112.3	M659 D765 V786 H788	M659-L793 HydrophobicContact CE-CB 3.96Å; M659-L793 HydrophobicContact SD-CB 4.1Å; D765-L793 HydrophobicContact CB-CD1 3.93Å; V786-L793 PolarHBondContact O-N 3.35Å; H788-L793 HydrophobicContact CB-CD1 3.57Å; H788-L793 HydrophobicContact CB-CG 4.11Å
794	G	92.1	Very high	89.3	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.1	-176.9	-175.1	0	0	0	0	0	113.6	R660 V786	R660-G794 CarbonylContact O-C 3.59Å; R660-G794 WeakPolarHBondContact O-CA 3.31Å; V786-G794 PolarHBondContact N-O 3.11Å; V786-G794 PolarHBondContact O-N 3.46Å
795	I	92.5	Very high	88.8	Confident	24 Å²	24	40 Å²	40	12%	0.123	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	139.5	175.7	-170.2	165.6	0	0	0	109.1	R660 L668 F707 Q783 C784 L785 T797	R660-I795 PolarHBondContact N-O 3.08Å; R660-I795 PolarHBondContact O-N 2.84Å; L668-I795 HydrophobicContact CD1-CG2 3.92Å; F707-I795 HydrophobicContact CE2-CD1 4.1Å; Q783-I795 HydrophobicContact CB-CD1 3.97Å; Q783-I795 HydrophobicContact CB-CG1 4.15Å; Q783-I795 HydrophobicContact CG-CD1 4.16Å; C784-I795 WeakPolarHBondContact O-CA 3.46Å; L785-I795 HydrophobicContact CD2-CB 4.11Å; L785-I795 HydrophobicContact CD2-CD1 3.88Å; L785-I795 HydrophobicContact CD2-CG1 3.91Å; I795-T797 HydrophobicContact CG1-CG2 4.45Å
796	I	92	Very high	88.1	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	132.7	167.7	-64.8	169.9	0	0	0	106.6	A655 M659 T772 F776 Q783 C784 V786 I801	A655-I796 HydrophobicContact CB-CD1 3.94Å; M659-I796 HydrophobicContact CB-CD1 4.36Å; M659-I796 HydrophobicContact CB-CG1 3.75Å; T772-I796 HydrophobicContact CG2-CD1 4.13Å; F776-I796 HydrophobicContact CE2-CB 4.4Å; F776-I796 HydrophobicContact CE2-CG2 3.87Å; F776-I796 HydrophobicContact CZ-CB 4.41Å; F776-I796 HydrophobicContact CZ-CG2 3.95Å; F776-I796 WeakPolarHBondContact CZ-O 3.34Å; Q783-I796 CarbonylContact C-O 3.46Å; Q783-I796 VanDerWaalsContact CA-O 3.29Å; Q783-I796 WeakPolarHBondContact CA-O 3.36Å; C784-I796 PolarHBondContact N-O 2.88Å; C784-I796 PolarHBondContact O-N 2.83Å; V786-I796 HydrophobicContact CG2-CD1 3.58Å; V786-I796 HydrophobicContact CG2-CG1 3.78Å; I796-I801 HydrophobicContact CG2-CD1 3.88Å; I796-I801 HydrophobicContact CG2-CG1 3.69Å
797	T	89.1	Confident	87.4	Confident	37 Å²	37	43.9 Å²	43.9	23%	0.227	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	162.9	169.7	76.8	0	0	0	0	110.9	Q783 I795 K799 D800 I801	Q783-T797 HydrophobicContact CB-CG2 4.43Å; I795-T797 HydrophobicContact CG1-CG2 4.45Å; T797-K799 PolarHBondContact O-N 3.3Å; T797-K799 VanDerWaalsContact O-N 3.09Å; T797-K799 PolarHBondContact OG1-N 3Å; T797-D800 WeakPolarHBondContact CB-OD2 3.43Å; T797-D800 PolarHBondContact N-OD2 3.44Å; T797-D800 PolarHBondContact O-N 2.99Å; T797-D800 PolarHBondContact OG1-N 2.93Å; T797-D800 PolarHBondContact OG1-OD2 3.07Å; T797-I801 PolarHBondContact O-N 2.02Å
798	K	83.9	Confident	86.6	Confident	19 Å²	19	45.9 Å²	45.9	8%	0.083	23%	0.23	C	C	.	.	H	α-helix	trans	-53.2	-31	172.6	-165.1	-176.6	-170.6	-171.8	0	112.3	S248 P641 F776 L802	S248-K798 PolarHBondContact OG-NZ 3.45Å; P641-K798 WeakPolarHBondContact O-CE 3.13Å; P641-K798 PolarHBondContact O-NZ 2.94Å; F776-K798 HydrophobicContact CD1-CB 4.44Å; K798-L802 HydrophobicContact CG-CD1 4.34Å; K798-L802 VanDerWaalsContact O-CG 3.25Å; K798-L802 WeakPolarHBondContact O-CG 3.46Å; K798-L802 PolarHBondContact O-N 2.03Å
799	K	82.8	Confident	85.6	Confident	111 Å²	111	45 Å²	45	48%	0.483	24%	0.235	S	C	.	.	H	α-helix	trans	-70.3	-38.5	177.4	-66.1	-173.4	178.3	-175.3	0	112.3	T797 L802 K803	T797-K799 PolarHBondContact O-N 3.3Å; T797-K799 VanDerWaalsContact O-N 3.09Å; T797-K799 PolarHBondContact OG1-N 3Å; K799-L802 PolarHBondContact O-N 3.02Å; K799-K803 WeakPolarHBondContact O-CB 3.42Å; K799-K803 WeakPolarHBondContact O-CG 2.83Å; K799-K803 PolarHBondContact O-N 2.96Å
800	D	86.3	Confident	84.6	Confident	26 Å²	26	45.8 Å²	45.8	14%	0.139	24%	0.239	C	C	.	.	H	α-helix	trans	-68.4	-40.6	-179.9	-56.8	-65.2	0	0	0	111.3	V658 R660 T797 K803 H804	V658-D800 HydrophobicContact CG1-CB 4.27Å; R660-D800 IonicContact NE-OD1 2.83Å; T797-D800 WeakPolarHBondContact CB-OD2 3.43Å; T797-D800 PolarHBondContact N-OD2 3.44Å; T797-D800 PolarHBondContact O-N 2.99Å; T797-D800 PolarHBondContact OG1-N 2.93Å; T797-D800 PolarHBondContact OG1-OD2 3.07Å; D800-K803 PolarHBondContact O-N 2.92Å; D800-H804 WeakPolarHBondContact O-CB 2.99Å; D800-H804 PolarHBondContact O-N 3.46Å
801	I	86.3	Confident	83.6	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	24%	0.24	C	C	.	.	H	α-helix	trans	-58	-51.3	172.6	-64.9	176.7	0	0	0	110.7	L643 M769 V773 F776 I796 T797 K803 H804 M805	L643-I801 HydrophobicContact CD1-CG2 4.22Å; M769-I801 HydrophobicContact CE-CG1 4.09Å; V773-I801 HydrophobicContact CG2-CG2 3.74Å; F776-I801 HydrophobicContact CB-CD1 4.05Å; F776-I801 HydrophobicContact CD1-CD1 3.97Å; F776-I801 HydrophobicContact CD2-CD1 3.42Å; F776-I801 VanDerWaalsContact CD2-CD1 3.42Å; F776-I801 HydrophobicContact CE1-CD1 4.26Å; F776-I801 HydrophobicContact CE2-CD1 3.73Å; F776-I801 HydrophobicContact CG-CD1 3.53Å; F776-I801 HydrophobicContact CZ-CD1 4.14Å; I796-I801 HydrophobicContact CG2-CD1 3.88Å; I796-I801 HydrophobicContact CG2-CG1 3.69Å; T797-I801 PolarHBondContact O-N 2.02Å; I801-K803 VanDerWaalsContact C-N 3.35Å; I801-K803 PolarHBondContact O-N 2.98Å; I801-H804 WeakPolarHBondContact O-CB 3.01Å; I801-H804 PolarHBondContact O-N 3.42Å; I801-M805 HydrophobicContact CG2-SD 4.03Å; I801-M805 WeakPolarHBondContact O-CG 3.24Å; I801-M805 PolarHBondContact O-N 3.46Å
802	L	82.9	Confident	82.1	Confident	18 Å²	18	47 Å²	47	9%	0.094	24%	0.239	C	C	.	.	H	α-helix	trans	-63.9	-38.8	-179.1	-69.1	171.7	0	0	0	112.3	P641 F642 L643 K798 K799 M805 A806 I816	P641-L802 HydrophobicContact CB-CD1 3.96Å; F642-L802 VanDerWaalsContact O-CD2 3.25Å; F642-L802 WeakPolarHBondContact O-CD2 3.01Å; L643-L802 HydrophobicContact CB-CD2 4.44Å; L643-L802 HydrophobicContact CD1-CD2 3.97Å; K798-L802 HydrophobicContact CG-CD1 4.34Å; K798-L802 VanDerWaalsContact O-CG 3.25Å; K798-L802 WeakPolarHBondContact O-CG 3.46Å; K798-L802 PolarHBondContact O-N 2.03Å; K799-L802 PolarHBondContact O-N 3.02Å; L802-M805 PolarHBondContact O-N 3.43Å; L802-A806 PolarHBondContact O-N 3.24Å; L802-I816 HydrophobicContact CB-CD1 4.24Å; L802-I816 HydrophobicContact CB-CG2 4.15Å; L802-I816 VanDerWaalsContact O-CD1 3.29Å; L802-I816 WeakPolarHBondContact O-CD1 3.26Å
803	K	82.5	Confident	80.5	Confident	42 Å²	42	48 Å²	48	18%	0.183	25%	0.246	C	C	.	.	H	α-helix	trans	-62.9	-42.8	172.5	-78	-170	170.8	-148.7	0	112.1	K799 D800 I801 A806 Q807 D814	K799-K803 WeakPolarHBondContact O-CB 3.42Å; K799-K803 WeakPolarHBondContact O-CG 2.83Å; K799-K803 PolarHBondContact O-N 2.96Å; D800-K803 PolarHBondContact O-N 2.92Å; I801-K803 VanDerWaalsContact C-N 3.35Å; I801-K803 PolarHBondContact O-N 2.98Å; K803-A806 PolarHBondContact O-N 3.25Å; K803-Q807 WeakPolarHBondContact O-CG 3.29Å; K803-Q807 PolarHBondContact O-N 3.4Å; K803-D814 IonicContact NZ-OD1 3.5Å; K803-D814 PolarHBondContact NZ-OD1 3.12Å
804	H	83	Confident	79	Confident	21 Å²	21	49 Å²	49	10%	0.097	25%	0.251	C	S	.	.	H	α-helix	trans	-62.9	-45.3	176.9	-172.6	64.3	0	0	0	111.8	S653 V658 D800 I801 A806 Q807 I808	S653-H804 PolarHBondContact OG-NE2 3.31Å; V658-H804 HydrophobicContact CG1-CB 4.11Å; V658-H804 HydrophobicContact CG2-CB 4.25Å; V658-H804 WeakPolarHBondContact CG2-CD2 3.34Å; V658-H804 WeakPolarHBondContact CG2-NE2 3.49Å; D800-H804 WeakPolarHBondContact O-CB 2.99Å; D800-H804 PolarHBondContact O-N 3.46Å; I801-H804 WeakPolarHBondContact O-CB 3.01Å; I801-H804 PolarHBondContact O-N 3.42Å; H804-A806 VanDerWaalsContact C-N 3.31Å; H804-A806 PolarHBondContact O-N 3.06Å; H804-Q807 PolarHBondContact O-N 2.8Å; H804-I808 WeakPolarHBondContact NE2-CD1 3.49Å; H804-I808 WeakPolarHBondContact O-CG1 3.32Å; H804-I808 PolarHBondContact O-N 3.2Å
805	M	80.4	Confident	77.3	Confident	37 Å²	37	52.6 Å²	52.6	18%	0.182	28%	0.277	C	S	.	.	H	α-helix	trans	-58.1	-41.4	173.4	-69.5	174.8	74	0	0	112.2	L643 E647 F649 I801 L802 A809	L643-M805 HydrophobicContact CD1-CE 4.49Å; L643-M805 HydrophobicContact CD1-SD 3.78Å; E647-M805 WeakPolarHBondContact OE2-CE 3.29Å; F649-M805 HydrophobicContact CD2-CG 4.32Å; F649-M805 HydrophobicContact CE2-CG 3.97Å; I801-M805 HydrophobicContact CG2-SD 4.03Å; I801-M805 WeakPolarHBondContact O-CG 3.24Å; I801-M805 PolarHBondContact O-N 3.46Å; L802-M805 PolarHBondContact O-N 3.43Å; M805-A809 VanDerWaalsContact O-CB 3.3Å; M805-A809 WeakPolarHBondContact O-CB 3.43Å; M805-A809 PolarHBondContact O-N 3.4Å
806	A	77.4	Confident	75.6	Confident	6 Å²	6	53.4 Å²	53.4	5%	0.05	28%	0.281	C	S	.	.	H	α-helix	trans	-66.9	-41.5	175.3	0	0	0	0	0	113.2	L802 K803 H804 I808 A809 N810 R811 I816	L802-A806 PolarHBondContact O-N 3.24Å; K803-A806 PolarHBondContact O-N 3.25Å; H804-A806 VanDerWaalsContact C-N 3.31Å; H804-A806 PolarHBondContact O-N 3.06Å; A806-I808 PolarHBondContact O-N 2.95Å; A806-A809 PolarHBondContact O-N 2.78Å; A806-N810 PolarHBondContact O-N 3.45Å; A806-R811 HydrophobicContact CB-CB 4.36Å; A806-R811 PolarHBondContact O-N 2.74Å; A806-I816 HydrophobicContact CB-CD1 3.57Å
807	Q	80.4	Confident	73.6	Confident	79 Å²	79	57.5 Å²	57.5	37%	0.369	30%	0.302	S	S	.	.	H	α-helix	trans	-58.5	-47.4	175.2	-73.1	176.8	-10.7	0	0	110.9	K803 H804 A809 N810 P813	K803-Q807 WeakPolarHBondContact O-CG 3.29Å; K803-Q807 PolarHBondContact O-N 3.4Å; H804-Q807 PolarHBondContact O-N 2.8Å; Q807-A809 VanDerWaalsContact C-N 3.33Å; Q807-A809 PolarHBondContact O-N 3.49Å; Q807-N810 PolarHBondContact O-N 3.04Å; Q807-P813 HydrophobicContact CG-CB 3.79Å; Q807-P813 HydrophobicContact CG-CG 4.09Å
808	I	77.2	Confident	71.6	Confident	57 Å²	57	58.8 Å²	58.8	29%	0.292	31%	0.305	S	S	.	.	H	α-helix	trans	-65.1	-37.5	178.1	-61.2	162.1	0	0	0	111.5	F649 H651 H804 A806 N810	F649-I808 HydrophobicContact CE2-CD1 4.31Å; F649-I808 HydrophobicContact CZ-CD1 4.04Å; H651-I808 HydrophobicContact CB-CD1 4.43Å; H651-I808 VanDerWaalsContact NE2-CG2 3.29Å; H651-I808 WeakPolarHBondContact NE2-CG2 3.45Å; H804-I808 WeakPolarHBondContact NE2-CD1 3.49Å; H804-I808 WeakPolarHBondContact O-CG1 3.32Å; H804-I808 PolarHBondContact O-N 3.2Å; A806-I808 PolarHBondContact O-N 2.95Å; I808-N810 PolarHBondContact O-N 3.13Å; I808-N810 VanDerWaalsContact O-N 3.08Å
809	A	71.8	Confident	69.2	Low	53 Å²	53	68.5 Å²	68.5	44%	0.438	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	6.9	176.6	0	0	0	0	0	114.6	M805 A806 Q807 R811	M805-A809 VanDerWaalsContact O-CB 3.3Å; M805-A809 WeakPolarHBondContact O-CB 3.43Å; M805-A809 PolarHBondContact O-N 3.4Å; A806-A809 PolarHBondContact O-N 2.78Å; Q807-A809 VanDerWaalsContact C-N 3.33Å; Q807-A809 PolarHBondContact O-N 3.49Å; A809-R811 HydrophobicContact CB-CG 4.11Å; A809-R811 PolarHBondContact O-N 2.69Å
810	N	70.8	Confident	68.5	Low	159 Å²	159	66.4 Å²	66.4	85%	0.85	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.6	35.2	-171.7	-71.6	-47.6	0	0	0	113.1	A806 Q807 I808	A806-N810 PolarHBondContact O-N 3.45Å; Q807-N810 PolarHBondContact O-N 3.04Å; I808-N810 PolarHBondContact O-N 3.13Å; I808-N810 VanDerWaalsContact O-N 3.08Å
811	R	66.2	Low	67.6	Low	117 Å²	117	68.5 Å²	68.5	44%	0.442	36%	0.363	S	S	.	.	S	Bend	trans	-105.5	152.1	175.9	-67.3	170.2	178.6	-177.3	-6.7	109.3	E628 A806 A809 P813	E628-R811 IonicContact OE1-CZ 3.21Å; E628-R811 IonicContact OE1-NH1 2.66Å; E628-R811 IonicContact OE1-NH2 2.62Å; E628-R811 PolarHBondContact OE1-NH2 3.17Å; A806-R811 HydrophobicContact CB-CB 4.36Å; A806-R811 PolarHBondContact O-N 2.74Å; A809-R811 HydrophobicContact CB-CG 4.11Å; A809-R811 PolarHBondContact O-N 2.69Å; R811-P813 VanDerWaalsContact O-CD 3.27Å; R811-P813 WeakPolarHBondContact O-CD 3.13Å; R811-P813 VanDerWaalsContact O-N 3.12Å
812	D	61.1	Low	66.5	Low	102 Å²	102	72.3 Å²	72.3	55%	0.545	38%	0.383	S	S	.	.			trans	-61.2	112.6	178.6	-172.3	-14.7	0	0	0	110.2	D814 S815	D812-D814 PolarHBondContact O-N 2.9Å; D812-D814 PolarHBondContact OD1-N 3.25Å; D812-S815 WeakPolarHBondContact O-CB 3.39Å; D812-S815 PolarHBondContact O-N 3.21Å; D812-S815 VanDerWaalsContact O-N 3.13Å; D812-S815 PolarHBondContact O-OG 3.02Å
813	P	59.9	Low	65.6	Low	31 Å²	31	75.5 Å²	75.5	20%	0.201	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-67	-19.4	-177.2	28.5	-35.5	0	0	0	112.9	Q807 R811 S815	Q807-P813 HydrophobicContact CG-CB 3.79Å; Q807-P813 HydrophobicContact CG-CG 4.09Å; R811-P813 VanDerWaalsContact O-CD 3.27Å; R811-P813 WeakPolarHBondContact O-CD 3.13Å; R811-P813 VanDerWaalsContact O-N 3.12Å; P813-S815 VanDerWaalsContact C-N 3.31Å
814	D	60.4	Low	64.5	Low	89 Å²	89	77.6 Å²	77.6	48%	0.476	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-85.3	-8.2	179.6	-68.8	-25	0	0	0	111.9	K803 D812 I816 L817	K803-D814 IonicContact NZ-OD1 3.5Å; K803-D814 PolarHBondContact NZ-OD1 3.12Å; D812-D814 PolarHBondContact O-N 2.9Å; D812-D814 PolarHBondContact OD1-N 3.25Å; D814-I816 PolarHBondContact O-N 2.96Å; D814-L817 HydrophobicContact CB-CD1 3.71Å; D814-L817 HydrophobicContact CB-CG 4.33Å; D814-L817 VanDerWaalsContact O-CB 3.29Å; D814-L817 WeakPolarHBondContact O-CB 3.27Å; D814-L817 PolarHBondContact O-N 3.06Å; D814-L817 WeakPolarHBondContact OD1-CD1 3.23Å
815	S	57.2	Low	63.3	Low	76 Å²	76	81.3 Å²	81.3	53%	0.531	43%	0.434	S	S	.	.	G	3₁₀ helix	trans	-66	-12.7	166	71.2	0	0	0	0	114.3	D812 P813	D812-S815 WeakPolarHBondContact O-CB 3.39Å; D812-S815 PolarHBondContact O-N 3.21Å; D812-S815 VanDerWaalsContact O-N 3.13Å; D812-S815 PolarHBondContact O-OG 3.02Å; P813-S815 VanDerWaalsContact C-N 3.31Å
816	I	56.6	Low	62	Low	41 Å²	41	84.5 Å²	84.5	21%	0.21	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-95.4	-0.3	175.5	-62.9	173.8	0	0	0	111.3	L802 A806 D814 F818	L802-I816 HydrophobicContact CB-CD1 4.24Å; L802-I816 HydrophobicContact CB-CG2 4.15Å; L802-I816 VanDerWaalsContact O-CD1 3.29Å; L802-I816 WeakPolarHBondContact O-CD1 3.26Å; A806-I816 HydrophobicContact CB-CD1 3.57Å; D814-I816 PolarHBondContact O-N 2.96Å; I816-F818 PolarHBondContact O-N 3.01Å
817	L	48.5	Very low	60.9	Low	86 Å²	86	90.5 Å²	90.5	45%	0.45	48%	0.483	S	S	.	.			trans	-75.2	114	175.6	-72.3	173.4	0	0	0	111.7	D814	D814-L817 HydrophobicContact CB-CD1 3.71Å; D814-L817 HydrophobicContact CB-CG 4.33Å; D814-L817 VanDerWaalsContact O-CB 3.29Å; D814-L817 WeakPolarHBondContact O-CB 3.27Å; D814-L817 PolarHBondContact O-N 3.06Å; D814-L817 WeakPolarHBondContact OD1-CD1 3.23Å
818	F	48.1	Very low	59.2	Low	63 Å²	63	91.5 Å²	91.5	28%	0.276	49%	0.493	S	S	.	.			trans	-69.7	121	143.4	-76.5	-89.3	0	0	0	108.9	F87 G639 Y640 I816	F87-F818 HydrophobicContact CD1-CD1 4.4Å; F87-F818 HydrophobicContact CD1-CE1 4.2Å; F87-F818 HydrophobicContact CE1-CE1 4.39Å; G639-F818 WeakPolarHBondContact O-CE2 3.29Å; Y640-F818 HydrophobicContact CD1-CE1 4.28Å; Y640-F818 HydrophobicContact CD1-CE2 4.37Å; Y640-F818 AromaticContact CD1-CZ 3.5Å; Y640-F818 HydrophobicContact CD1-CZ 3.5Å; Y640-F818 HydrophobicContact CE1-CE1 4.36Å; Y640-F818 HydrophobicContact CE1-CZ 4Å; Y640-F818 HydrophobicContact CG-CZ 4.3Å; I816-F818 PolarHBondContact O-N 3.01Å
819	N	33.1	Very low	57.6	Low	224 Å²	224	94.6 Å²	94.6	100%	1.198	51%	0.511	S	S	*	.			trans	-89.8	0	140.4	-77.1	-18.1	0	0	0	107.6

Retrieved 819 of 819 residues in 479.3 ms (Link to these results)

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