A0A087XAI2_POEFO Loading...

adenylate cyclase

AlphaFold DB , UniProt , Accession A0A087XAI2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 891 aa.

						>A0A087XAI2_POEFO|A0A087XAI2
MELSEVRCSSASEELYTINKTHITEQRFIHEQGGGGGGAKDDPFDPIQGARKQSAGRTSVGDRHNNGGTKVFPERASSDLGFLQIDCAPSNSDFFLNWGYTYRGVIFPTLRNAFKSRDLERLYQRYFLGQRRKSVVVMNILDVVTKLTLLVLHLTLASTPMDPIKGTLLGFFTGIEVVICALVVVRKDTTSHSYLQYSGVVTWVAMATQILAAGLGYGLLGDGVGYVLFTLFATYSMLPLPLTWAILAGLFTSGLHILVQLFISESARFFTNQVAAQAVLFMCMNTAGIFISYLSDRAQRQAFLETRRCIEARLRLETENQRQERLVLSVLPRFVVLEMINDMTNVEDEHLQHQFHRIYIHRYENVSILFADVKGFTNLSTTLSAQELVRMLNELFARFDRLAHEHHCLRIKILGDCYYCVSGLPEPRPDHAHCCVEMGLSMLKTIRYVRSRTKHDIDMRIGIHSGSVLCGVLGLRKWQFDVWSWDVDIANKLESGGIPGWRIHISKAALDCLNGDYEVEEGHGKDRNDFLRRHNIETYLIKQPEESLLTLPEDIMKEAASSADRRASSATFNEASWSPELPFDNIVGNQNTLAALTRNSINLLPNHLAQALHVHSGPEEINKRIESAIDLRSGDKLRREHIKPFSLMFKDSSLEEKYSQMRDEVFKSNLVCAFIVLIFITAIQSLLPSARMVTMVIQFSVLIVLHSCLVLVTTAEDYKCLPLVLRKACCWINETYAARNVIVFVSILINFLAAMINILWCDFDKSNTFRNQTYNESASIPDICFYPEYFVFTGVLAMVTCAVFLRLNSVLKLAVLLLMIAIYSLLTEAFYTSLFVRYDTVHHNTENFLGTKETSLLLMAMFLLAVFYHGQQVKPSLPKHKLCSFSVQFVL
					

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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	28.2	Very low	26.1	Very low	248 Å²	248	148.6 Å²	148.6	100%	1.222	82%	0.819	S	S	*	*				0	90.3	0	-153.8	169.2	-178.5	0	0	105.8
2	E	24.8	Very low	26.2	Very low	193 Å²	193	143.4 Å²	143.4	90%	0.902	80%	0.801	S	S	*	*			trans	-77.1	141.5	-167.1	-64.4	164.4	135.9	0	0	110.8
3	L	24.9	Very low	26.4	Very low	177 Å²	177	142.5 Å²	142.5	93%	0.927	79%	0.787	S	S	*	*			trans	-113.9	105.2	165.2	-102.9	152.8	0	0	0	107.2
4	S	24.3	Very low	26.4	Very low	101 Å²	101	144.5 Å²	144.5	71%	0.706	79%	0.787	S	S	*	*			trans	-74.4	116.4	-178.3	41.1	0	0	0	0	111.6	V6	S4-V6 PolarHBondContact O-N 3.07Å
5	E	26.7	Very low	26.4	Very low	200 Å²	200	144.8 Å²	144.8	94%	0.935	79%	0.787	S	S	*	*			trans	-71	111	158.9	-76.4	-175.6	146.6	0	0	109
6	V	27.1	Very low	26.4	Very low	108 Å²	108	147.8 Å²	147.8	66%	0.655	79%	0.785	S	S	*	*			trans	-99.6	98	172.2	179.9	0	0	0	0	109.1	S4	S4-V6 PolarHBondContact O-N 3.07Å
7	R	26.6	Very low	26.4	Very low	218 Å²	218	144.5 Å²	144.5	82%	0.823	77%	0.772	S	S	*	*			trans	-56.8	135.4	159.2	-91.5	178.6	-171.7	177.2	4.7	109.7	S9	R7-S9 VanDerWaalsContact C-N 3.29Å; R7-S9 PolarHBondContact O-N 3.45Å; R7-S9 VanDerWaalsContact O-N 3.09Å
8	C	24.9	Very low	26.4	Very low	100 Å²	100	142.8 Å²	142.8	68%	0.676	76%	0.761	S	S	*	*			trans	-75	88.7	156.4	-88.6	0	0	0	0	107.8
9	S	24.8	Very low	26.5	Very low	96 Å²	96	142.6 Å²	142.6	67%	0.671	76%	0.76	S	S	*	*			trans	-80.9	123.8	162.7	165.7	0	0	0	0	108.4	R7	R7-S9 VanDerWaalsContact C-N 3.29Å; R7-S9 PolarHBondContact O-N 3.45Å; R7-S9 VanDerWaalsContact O-N 3.09Å
10	S	25.6	Very low	26.5	Very low	85 Å²	85	143.9 Å²	143.9	59%	0.594	76%	0.759	S	S	*	*			trans	-117.2	130.6	155.9	63.1	0	0	0	0	107.7	S12	S10-S12 VanDerWaalsContact C-N 3.28Å; S10-S12 PolarHBondContact O-N 3.29Å; S10-S12 PolarHBondContact O-OG 3.32Å
11	A	29	Very low	26.5	Very low	109 Å²	109	141.3 Å²	141.3	90%	0.901	75%	0.749	S	S	*	*	S	Bend	trans	-59	74.9	-173	0	0	0	0	0	114.6
12	S	27.7	Very low	26.4	Very low	86 Å²	86	136.5 Å²	136.5	60%	0.601	72%	0.723	S	S	*	*			trans	-141.8	6.4	165.1	28.6	0	0	0	0	112.4	S10	S10-S12 VanDerWaalsContact C-N 3.28Å; S10-S12 PolarHBondContact O-N 3.29Å; S10-S12 PolarHBondContact O-OG 3.32Å
13	E	28.1	Very low	26.6	Very low	132 Å²	132	134.7 Å²	134.7	62%	0.617	72%	0.718	S	S	*	*	S	Bend	trans	-87.4	-9.5	175.1	-83.2	-171.2	147.6	0	0	114.4	L15 Y16 T17	E13-L15 VanDerWaalsContact C-N 3.34Å; E13-L15 PolarHBondContact O-N 3.18Å; E13-Y16 PolarHBondContact O-N 3.42Å; E13-T17 PolarHBondContact O-OG1 2.77Å
14	E	26.7	Very low	26.8	Very low	170 Å²	170	131.5 Å²	131.5	79%	0.794	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-9.1	177.7	-79.2	-173.2	163.5	0	0	114.6
15	L	26.5	Very low	26.9	Very low	149 Å²	149	135.3 Å²	135.3	78%	0.78	71%	0.713	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	-9.5	170.7	-129.8	83.1	0	0	0	113.4	E13	E13-L15 VanDerWaalsContact C-N 3.34Å; E13-L15 PolarHBondContact O-N 3.18Å
16	Y	26.4	Very low	27	Very low	193 Å²	193	135.1 Å²	135.1	76%	0.757	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-7.5	-178.2	-111.6	-87	0	0	0	113.9	E13	E13-Y16 PolarHBondContact O-N 3.42Å
17	T	26.7	Very low	27.2	Very low	92 Å²	92	141 Å²	141	56%	0.564	72%	0.722	S	S	*	*	S	Bend	trans	-94.2	-10.6	174.8	33.1	0	0	0	0	114.1	E13	E13-T17 PolarHBondContact O-OG1 2.77Å
18	I	26.1	Very low	27.1	Very low	113 Å²	113	140.4 Å²	140.4	58%	0.579	73%	0.726	S	S	*	*	S	Bend	trans	-83.1	-23.7	176.8	-63.2	174.8	0	0	0	112.2	T21	I18-T21 PolarHBondContact O-OG1 3.1Å
19	N	28.8	Very low	27.3	Very low	139 Å²	139	143.4 Å²	143.4	74%	0.743	73%	0.734	S	S	*	*	S	Bend	trans	-96.3	7.5	179.1	-81.5	5.5	0	0	0	115.1
20	K	25.6	Very low	27.3	Very low	169 Å²	169	147.6 Å²	147.6	74%	0.735	74%	0.742	S	S	*	*	S	Bend	trans	-108.8	-4.8	177.1	-116.7	-177.9	-178.4	179.1	0	114.5
21	T	26.3	Very low	27.4	Very low	89 Å²	89	152.4 Å²	152.4	55%	0.546	76%	0.756	S	S	.	*	G	3₁₀ helix	trans	-82.2	-12.8	174.9	38.1	0	0	0	0	113.6	I18	I18-T21 PolarHBondContact O-OG1 3.1Å
22	H	26.7	Very low	27.1	Very low	148 Å²	148	157 Å²	157	69%	0.685	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-85.7	0.6	178.8	-102	-83.4	0	0	0	116.1
23	I	29.6	Very low	26.9	Very low	155 Å²	155	156.7 Å²	156.7	80%	0.795	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-120.4	7.3	-176.4	-60.6	178.3	0	0	0	113.2
24	T	27.8	Very low	26.7	Very low	110 Å²	110	154.4 Å²	154.4	68%	0.675	78%	0.78	S	S	*	*	S	Bend	trans	-124.8	10.6	179.8	39.8	0	0	0	0	116.5
25	E	27.8	Very low	26.5	Very low	180 Å²	180	150.5 Å²	150.5	84%	0.841	79%	0.786	S	S	*	*	S	Bend	trans	-106.2	39.8	177.1	-79.6	-163.8	155	0	0	115.1
26	Q	27.8	Very low	26.3	Very low	196 Å²	196	147.3 Å²	147.3	92%	0.916	79%	0.789	S	S	*	*	S	Bend	trans	-130.1	18.7	165.4	-86.7	-166.7	-8.2	0	0	114.8
27	R	30.5	Very low	26.2	Very low	232 Å²	232	142.3 Å²	142.3	88%	0.875	80%	0.796	S	S	*	*	S	Bend	trans	-127.6	32.4	-178.9	-100.4	-171.9	-172	178.1	3.4	116.1
28	F	26.3	Very low	26.1	Very low	206 Å²	206	141.7 Å²	141.7	90%	0.904	81%	0.808	S	S	*	*			trans	-138.7	64.7	169.4	-93.6	-78.7	0	0	0	112.2
29	I	28.2	Very low	26	Very low	162 Å²	162	140.9 Å²	140.9	83%	0.831	82%	0.818	S	S	*	*			trans	-143	77.8	155.4	-51.7	-179	0	0	0	108.8
30	H	25.4	Very low	25.7	Very low	184 Å²	184	143.1 Å²	143.1	85%	0.852	82%	0.821	S	S	*	*	S	Bend	trans	-173.9	146	137.9	-113.7	-69.4	0	0	0	109.3
31	E	26.3	Very low	25.7	Very low	187 Å²	187	141.5 Å²	141.5	87%	0.874	82%	0.821	S	S	*	*			trans	85.4	64.6	-178.3	-56.1	-169.8	162.2	0	0	116.3
32	Q	23.2	Very low	25.6	Very low	205 Å²	205	144.8 Å²	144.8	96%	0.958	84%	0.835	S	S	*	*			trans	-110	116.8	135.5	-87.6	-170.8	-8.8	0	0	108.4
33	G	23.6	Very low	26.1	Very low	79 Å²	79	142.4 Å²	142.4	81%	0.814	83%	0.833	S	S	*	*			trans	-172	105	171.5	0	0	0	0	0	111.3
34	G	23.8	Very low	25.7	Very low	84 Å²	84	145.5 Å²	145.5	87%	0.866	84%	0.841	S	S	*	*			trans	94.5	107.3	157.5	0	0	0	0	0	116
35	G	23	Very low	25.5	Very low	88 Å²	88	147.2 Å²	147.2	91%	0.907	85%	0.846	S	S	*	*			trans	-96	179.9	175.6	0	0	0	0	0	114.4
36	G	23.4	Very low	25.7	Very low	83 Å²	83	143.4 Å²	143.4	86%	0.856	84%	0.837	S	S	*	*			trans	119.8	98.6	148.8	0	0	0	0	0	117.1
37	G	23.7	Very low	25.5	Very low	87 Å²	87	142.2 Å²	142.2	90%	0.897	84%	0.835	S	S	*	*				92	127.2	123.7	0	0	0	0	0	120.3
38	G	23.9	Very low	25.1	Very low	79 Å²	79	140.4 Å²	140.4	81%	0.814	84%	0.836	S	S	*	*				111.1	88.2	129.2	0	0	0	0	0	119.6
39	A	23.7	Very low	25	Very low	97 Å²	97	134.4 Å²	134.4	80%	0.802	83%	0.833	S	S	*	*				30.9	136.7	129.4	0	0	0	0	0	123.7
40	K	24.2	Very low	24.7	Very low	185 Å²	185	131.5 Å²	131.5	80%	0.804	83%	0.832	S	S	*	*			trans	103.4	138.9	130.4	-91.5	-175.1	-178.5	-171.2	0	122.6
41	D	25.6	Very low	24.6	Very low	135 Å²	135	134.4 Å²	134.4	72%	0.722	84%	0.836	S	S	*	*			trans	81.2	97.8	148.7	-54.6	-19.1	0	0	0	121.8
42	D	22.6	Very low	24.4	Very low	158 Å²	158	134 Å²	134	85%	0.845	83%	0.832	S	S	*	*				46.3	165.3	108.9	-109.5	19.1	0	0	0	122
43	P	36.8	Very low	24.4	Very low	98 Å²	98	132.6 Å²	132.6	64%	0.636	83%	0.825	S	S	*	*				-123	168.3	-102.1	35.1	-16.9	0	0	0	114.5
44	F	22.8	Very low	24.3	Very low	221 Å²	221	134.7 Å²	134.7	97%	0.969	83%	0.827	S	S	*	*			trans	-157.3	150.6	157.2	-110	-79.6	0	0	0	114
45	D	23.6	Very low	24.3	Very low	145 Å²	145	135.5 Å²	135.5	78%	0.775	83%	0.826	S	S	*	*			trans	-106.1	-160.4	-151.4	-151.2	12.3	0	0	0	111.1
46	P	31.7	Very low	24.2	Very low	100 Å²	100	135.3 Å²	135.3	65%	0.649	82%	0.823	S	S	*	*				-118.3	170.8	-119.5	36.8	-17.8	0	0	0	114
47	I	23.7	Very low	24.1	Very low	172 Å²	172	142.9 Å²	142.9	88%	0.882	83%	0.826	S	S	*	*			trans	-132.8	121.1	162.8	-62.6	-176.4	0	0	0	111.9
48	Q	22.3	Very low	24.1	Very low	194 Å²	194	145.3 Å²	145.3	91%	0.907	82%	0.824	S	S	*	*			trans	-61.5	156.2	171.4	-73.1	168.7	-26.3	0	0	113.8
49	G	24.5	Very low	24	Very low	80 Å²	80	147 Å²	147	83%	0.825	82%	0.823	S	S	*	*			trans	-178.9	73.7	162.3	0	0	0	0	0	114
50	A	22	Very low	23.9	Very low	100 Å²	100	148.5 Å²	148.5	83%	0.826	82%	0.822	S	S	*	*			trans	-71	138.1	175	0	0	0	0	0	112.9
51	R	22.8	Very low	23.8	Very low	246 Å²	246	143.1 Å²	143.1	93%	0.928	82%	0.819	S	S	*	*			trans	-156.6	104.7	144.5	-123.6	175.6	-177.8	176.8	0.3	114.5
52	K	22.1	Very low	23.7	Very low	179 Å²	179	144 Å²	144	78%	0.778	82%	0.823	S	S	*	*			trans	6.4	137.5	144.9	-76.9	178.3	177.7	177.5	0	122.2
53	Q	21.8	Very low	23.8	Very low	175 Å²	175	148.2 Å²	148.2	82%	0.818	83%	0.828	S	S	*	*				80.8	112.7	129.9	-74	173	-7.3	0	0	120.1
54	S	22.9	Very low	23.2	Very low	123 Å²	123	152.2 Å²	152.2	86%	0.86	84%	0.837	S	S	*	*				-162.8	136.6	104.4	128	0	0	0	0	110.6
55	A	22.3	Very low	23.2	Very low	101 Å²	101	149.4 Å²	149.4	84%	0.835	83%	0.833	S	S	*	*			trans	-95.2	139.8	-175	0	0	0	0	0	111.3
56	G	23	Very low	23.3	Very low	83 Å²	83	149.3 Å²	149.3	86%	0.856	83%	0.832	S	S	*	*			trans	-140.9	90.4	161.2	0	0	0	0	0	108.5
57	R	20.8	Very low	23	Very low	243 Å²	243	148.6 Å²	148.6	92%	0.917	84%	0.843	S	S	*	*			trans	-85.5	126.9	172.6	-97	178.3	166.1	173.1	-4.2	108.9
58	T	22.2	Very low	23	Very low	138 Å²	138	143.4 Å²	143.4	85%	0.847	83%	0.832	S	S	*	*			trans	-140.8	107.6	144.5	38.4	0	0	0	0	110.3
59	S	22.3	Very low	23.2	Very low	115 Å²	115	141 Å²	141	80%	0.804	83%	0.831	S	S	*	*			trans	34	112.9	153.1	65.3	0	0	0	0	121.5
60	V	22.6	Very low	23.2	Very low	127 Å²	127	144.8 Å²	144.8	77%	0.77	83%	0.825	S	S	*	*			trans	-47.1	137.2	149.3	174.6	0	0	0	0	112.3
61	G	22.3	Very low	23.4	Very low	73 Å²	73	145.7 Å²	145.7	75%	0.753	82%	0.82	S	S	*	*			trans	-136.2	108.6	155.2	0	0	0	0	0	107.7	R63	G61-R63 PolarHBondContact O-N 2.86Å
62	D	22.8	Very low	23.4	Very low	152 Å²	152	142.8 Å²	142.8	81%	0.813	81%	0.814	S	S	*	*			trans	-49.5	129	-175	-72.4	-52.4	0	0	0	113.5
63	R	24.2	Very low	23.6	Very low	247 Å²	247	140.1 Å²	140.1	93%	0.932	82%	0.815	S	S	*	*			trans	-122.2	111.4	158.2	-90.1	-173.3	175.9	179.2	0.5	110	G61 N65	G61-R63 PolarHBondContact O-N 2.86Å; R63-N65 PolarHBondContact O-N 2.84Å
64	H	23.6	Very low	23.6	Very low	182 Å²	182	139.5 Å²	139.5	84%	0.843	81%	0.812	S	S	*	*			trans	-48.4	131.8	173.1	-84.4	-48.2	0	0	0	113	N66	H64-N66 PolarHBondContact O-N 3.09Å
65	N	24	Very low	23.7	Very low	162 Å²	162	145.2 Å²	145.2	87%	0.866	82%	0.815	S	S	*	*			trans	-45.7	117.1	166.2	-128.2	-4.5	0	0	0	111.4	R63	R63-N65 PolarHBondContact O-N 2.84Å
66	N	24.8	Very low	23.8	Very low	144 Å²	144	145 Å²	145	77%	0.77	81%	0.812	S	S	*	*			trans	-117.1	105	164.7	-96.2	-11	0	0	0	108.8	H64 G68	H64-N66 PolarHBondContact O-N 3.09Å; N66-G68 PolarHBondContact O-N 3.48Å
67	G	26.3	Very low	23.8	Very low	85 Å²	85	146.9 Å²	146.9	88%	0.876	81%	0.813	S	S	*	*			trans	-65.7	107.7	176.1	0	0	0	0	0	111.4
68	G	24.6	Very low	23.9	Very low	63 Å²	63	140.6 Å²	140.6	65%	0.649	81%	0.806	S	S	*	*			trans	-90.8	130.4	153.7	0	0	0	0	0	108.8	N66 K70	N66-G68 PolarHBondContact O-N 3.48Å; G68-K70 PolarHBondContact O-N 3.27Å
69	T	25.5	Very low	24.2	Very low	144 Å²	144	141.9 Å²	141.9	88%	0.883	81%	0.808	S	S	*	*			trans	-57.1	98.7	172.4	14.5	0	0	0	0	110.2	V71	T69-V71 PolarHBondContact O-N 2.83Å; T69-V71 VanDerWaalsContact O-N 3.15Å
70	K	24.4	Very low	24.4	Very low	159 Å²	159	144.4 Å²	144.4	69%	0.691	81%	0.811	S	S	*	*			trans	-66.5	101.6	163.2	-76.1	-178.1	174.8	179.5	0	107.9	G68 F72 E74	G68-K70 PolarHBondContact O-N 3.27Å; K70-F72 PolarHBondContact O-N 3.29Å; K70-E74 IonicContact NZ-OE1 2.65Å; K70-E74 PolarHBondContact NZ-OE1 3.16Å; K70-E74 IonicContact NZ-OE2 3.79Å
71	V	27	Very low	24.7	Very low	119 Å²	119	142.7 Å²	142.7	72%	0.721	82%	0.819	S	S	*	*			trans	-83.8	88	163.8	178	0	0	0	0	105.8	T69	T69-V71 PolarHBondContact O-N 2.83Å; T69-V71 VanDerWaalsContact O-N 3.15Å
72	F	22.9	Very low	24.7	Very low	184 Å²	184	148.6 Å²	148.6	81%	0.807	82%	0.824	S	S	*	*	S	Bend	trans	168.6	135.3	154.6	-79.9	-58.1	0	0	0	107.2	K70 E74	K70-F72 PolarHBondContact O-N 3.29Å; F72-E74 PolarHBondContact O-N 2.86Å
73	P	25.6	Very low	24.9	Very low	123 Å²	123	148.9 Å²	148.9	80%	0.799	83%	0.825	S	S	*	*			trans	-73	128.4	178.5	19.4	-12.8	0	0	0	110.5	R75	P73-R75 PolarHBondContact O-N 3.41Å
74	E	22.4	Very low	24.8	Very low	163 Å²	163	145.7 Å²	145.7	76%	0.762	82%	0.821	S	S	*	*			trans	-62.2	108.9	165	-95.3	165	-178.2	0	0	108.6	K70 F72	K70-E74 IonicContact NZ-OE1 2.65Å; K70-E74 PolarHBondContact NZ-OE1 3.16Å; K70-E74 IonicContact NZ-OE2 3.79Å; F72-E74 PolarHBondContact O-N 2.86Å
75	R	23.5	Very low	25	Very low	243 Å²	243	144.2 Å²	144.2	92%	0.917	82%	0.817	S	S	*	*			trans	-79.2	126.5	160.1	-90.3	-178.7	176	163.6	-1.3	107.9	P73 S77	P73-R75 PolarHBondContact O-N 3.41Å; R75-S77 PolarHBondContact O-N 3.33Å
76	A	24.2	Very low	25.3	Very low	95 Å²	95	143.5 Å²	143.5	79%	0.785	81%	0.814	S	S	*	*			trans	-54.6	130	171.8	0	0	0	0	0	110.3	S78	A76-S78 PolarHBondContact O-N 2.68Å
77	S	23.5	Very low	25.8	Very low	123 Å²	123	142.2 Å²	142.2	86%	0.86	82%	0.815	S	S	*	*			trans	-58.9	114.7	173.3	49	0	0	0	0	110.4	R75	R75-S77 PolarHBondContact O-N 3.33Å
78	S	23.9	Very low	26.6	Very low	111 Å²	111	142.5 Å²	142.5	78%	0.776	81%	0.809	S	S	*	*			trans	-110.4	127	154.4	41.1	0	0	0	0	107	A76 L80	A76-S78 PolarHBondContact O-N 2.68Å; S78-L80 PolarHBondContact O-N 3.24Å; S78-L80 VanDerWaalsContact O-N 3.09Å
79	D	28.7	Very low	27.9	Very low	165 Å²	165	142.9 Å²	142.9	88%	0.882	80%	0.8	S	S	*	*			trans	-58.3	106.4	179.4	-74.7	-43.7	0	0	0	110.6
80	L	25.8	Very low	29.3	Very low	169 Å²	169	138.4 Å²	138.4	89%	0.885	78%	0.775	S	S	*	*			trans	-150.2	116.5	154.9	-131.3	87.7	0	0	0	107.9	S78 F82	S78-L80 PolarHBondContact O-N 3.24Å; S78-L80 VanDerWaalsContact O-N 3.09Å; L80-F82 PolarHBondContact O-N 2.86Å
81	G	28.1	Very low	30.8	Very low	90 Å²	90	133.1 Å²	133.1	93%	0.928	75%	0.754	S	S	*	*			trans	-65.8	90.2	-172.7	0	0	0	0	0	113.6
82	F	24.2	Very low	32.2	Very low	197 Å²	197	130.4 Å²	130.4	86%	0.864	74%	0.74	S	S	*	*			trans	-123	135.6	166.3	-134	-91.5	0	0	0	110.5	L80 Q84	L80-F82 PolarHBondContact O-N 2.86Å; F82-Q84 PolarHBondContact O-N 3.12Å
83	L	26.1	Very low	33.9	Very low	158 Å²	158	126.1 Å²	126.1	83%	0.827	73%	0.726	S	S	*	*			trans	-37.2	125.9	-176	-80.3	149.3	0	0	0	114.3	I85	L83-I85 PolarHBondContact O-N 2.95Å
84	Q	22.8	Very low	35.5	Very low	180 Å²	180	122 Å²	122	84%	0.841	70%	0.695	S	S	*	*			trans	-64.1	102.1	170.6	-165.4	169.7	0.9	0	0	108.6	F82 D86	F82-Q84 PolarHBondContact O-N 3.12Å; Q84-D86 PolarHBondContact O-N 2.71Å; Q84-D86 VanDerWaalsContact O-N 3.13Å
85	I	26.8	Very low	37.5	Very low	151 Å²	151	115.1 Å²	115.1	77%	0.774	66%	0.663	S	S	*	*			trans	-64.2	111.8	167.4	-64.6	169.6	0	0	0	106	L83 C87	L83-I85 PolarHBondContact O-N 2.95Å; I85-C87 PolarHBondContact O-N 2.95Å
86	D	30.5	Very low	39.2	Very low	147 Å²	147	108.5 Å²	108.5	79%	0.786	65%	0.645	S	S	*	*			trans	-53.6	105.5	175.6	-82.2	-31.4	0	0	0	109.5	Q84 A88	Q84-D86 PolarHBondContact O-N 2.71Å; Q84-D86 VanDerWaalsContact O-N 3.13Å; D86-A88 PolarHBondContact O-N 3.12Å
87	C	34.8	Very low	40.9	Very low	117 Å²	117	108.6 Å²	108.6	79%	0.791	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-57.8	131.7	166.8	-73.4	0	0	0	0	108.1	I85	I85-C87 PolarHBondContact O-N 2.95Å
88	A	43.1	Very low	42.4	Very low	91 Å²	91	106.5 Å²	106.5	75%	0.752	61%	0.606	S	S	*	*	P	Polyproline II helix	trans	-51.2	127.5	176	0	0	0	0	0	109.6	D86 S90	D86-A88 PolarHBondContact O-N 3.12Å; A88-S90 PolarHBondContact O-N 2.72Å
89	P	51.8	Low	44.2	Very low	71 Å²	71	102 Å²	102	46%	0.461	58%	0.576	S	S	.	*	P	Polyproline II helix	trans	-59.8	130.5	-173.3	20.8	-31.9	0	0	0	110.3	D93 F94	P89-D93 HydrophobicContact CB-CB 4.41Å; P89-F94 HydrophobicContact CB-CE2 3.78Å; P89-F94 HydrophobicContact CB-CZ 3.89Å; P89-F94 HydrophobicContact CG-CE2 3.87Å; P89-F94 HydrophobicContact CG-CZ 3.65Å
90	S	55.5	Low	46.2	Very low	51 Å²	51	100.2 Å²	100.2	36%	0.357	56%	0.559	S	S	.	*	P	Polyproline II helix	trans	-64.9	156.9	179.1	73	0	0	0	0	110.2	A88 S92 D93 F94	A88-S90 PolarHBondContact O-N 2.72Å; S90-S92 PolarHBondContact O-N 3.37Å; S90-S92 PolarHBondContact OG-OG 3.09Å; S90-D93 WeakPolarHBondContact CB-OD2 3.16Å; S90-D93 PolarHBondContact N-OD2 2.84Å; S90-D93 WeakPolarHBondContact O-CB 3.22Å; S90-D93 PolarHBondContact O-N 2.84Å; S90-D93 VanDerWaalsContact O-N 3.07Å; S90-D93 PolarHBondContact OG-OD1 3.36Å; S90-D93 PolarHBondContact OG-OD2 3.16Å; S90-F94 WeakPolarHBondContact O-CD2 2.87Å
91	N	55	Low	48.4	Very low	47 Å²	47	95.3 Å²	95.3	25%	0.251	54%	0.536	S	S	.	.	G	3₁₀ helix	trans	-58.8	-31.9	178.4	-70.7	-18.3	0	0	0	112.1	D93 F94 F95 W98 R308	N91-D93 PolarHBondContact O-N 2.8Å; N91-F94 PolarHBondContact O-N 3.09Å; N91-F95 WeakPolarHBondContact O-CD2 3.29Å; N91-W98 VanDerWaalsContact C-CZ3 3.44Å; N91-W98 HydrophobicContact CB-CH2 3.32Å; N91-W98 HydrophobicContact CB-CZ2 4.34Å; N91-W98 HydrophobicContact CB-CZ3 3.53Å; N91-W98 WeakPolarHBondContact O-CZ3 3.5Å; N91-R308 VanDerWaalsContact OD1-CZ 3.22Å; N91-R308 PolarHBondContact OD1-NH1 3.26Å; N91-R308 PolarHBondContact OD1-NH2 3.01Å
92	S	56.7	Low	50.6	Low	63 Å²	63	96 Å²	96	44%	0.441	51%	0.511	S	S	.	.	G	3₁₀ helix	trans	-62.1	-26.1	176.7	30.3	0	0	0	0	114.3	S90 F94 F95	S90-S92 PolarHBondContact O-N 3.37Å; S90-S92 PolarHBondContact OG-OG 3.09Å; S92-F94 PolarHBondContact O-N 2.88Å; S92-F95 PolarHBondContact O-N 3.19Å
93	D	59.1	Low	52.8	Low	94 Å²	94	91.5 Å²	91.5	50%	0.503	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-71.8	-17.1	-175.8	-59.5	-35.7	0	0	0	112.8	P89 S90 N91	P89-D93 HydrophobicContact CB-CB 4.41Å; S90-D93 WeakPolarHBondContact CB-OD2 3.16Å; S90-D93 PolarHBondContact N-OD2 2.84Å; S90-D93 WeakPolarHBondContact O-CB 3.22Å; S90-D93 PolarHBondContact O-N 2.84Å; S90-D93 VanDerWaalsContact O-N 3.07Å; S90-D93 PolarHBondContact OG-OD1 3.36Å; S90-D93 PolarHBondContact OG-OD2 3.16Å; N91-D93 PolarHBondContact O-N 2.8Å
94	F	59.9	Low	54.8	Low	35 Å²	35	85.6 Å²	85.6	15%	0.154	47%	0.466	C	S	.	.	G	3₁₀ helix	trans	-92.2	-17.9	-177.5	-67	-76.8	0	0	0	114.4	P89 S90 N91 S92 F114 K115 L119 L304 R308	P89-F94 HydrophobicContact CB-CE2 3.78Å; P89-F94 HydrophobicContact CB-CZ 3.89Å; P89-F94 HydrophobicContact CG-CE2 3.87Å; P89-F94 HydrophobicContact CG-CZ 3.65Å; S90-F94 WeakPolarHBondContact O-CD2 2.87Å; N91-F94 PolarHBondContact O-N 3.09Å; S92-F94 PolarHBondContact O-N 2.88Å; F94-F114 HydrophobicContact CB-CD1 4.37Å; F94-F114 WeakPolarHBondContact O-CA 3.35Å; F94-K115 PolarHBondContact O-N 2.93Å; F94-L119 HydrophobicContact CD1-CD2 4.2Å; F94-L304 HydrophobicContact CB-CD1 4.18Å; F94-L304 HydrophobicContact CB-CD2 4.45Å; F94-L304 HydrophobicContact CG-CD1 4.47Å; F94-L304 HydrophobicContact CG-CD2 4.34Å; F94-R308 VanDerWaalsContact CE2-NH2 3.35Å
95	F	64.3	Low	57.4	Low	20 Å²	20	77.7 Å²	77.7	9%	0.088	43%	0.43	C	S	.	.	B	Isolated β-bridge	trans	-105.4	142.4	-173.1	-65.4	-95.6	0	0	0	111.9	N91 S92 N97 W98 F114 R300 L304	N91-F95 WeakPolarHBondContact O-CD2 3.29Å; S92-F95 PolarHBondContact O-N 3.19Å; F95-N97 VanDerWaalsContact C-N 3.32Å; F95-W98 HydrophobicContact CB-CE3 4.3Å; F95-W98 AromaticContact CD2-CE3 3.51Å; F95-W98 HydrophobicContact CD2-CE3 3.51Å; F95-W98 AromaticContact CD2-CZ3 3.41Å; F95-W98 HydrophobicContact CD2-CZ3 3.41Å; F95-W98 VanDerWaalsContact CD2-CZ3 3.41Å; F95-W98 HydrophobicContact CE2-CE3 4.03Å; F95-W98 HydrophobicContact CE2-CH2 4.47Å; F95-W98 AromaticContact CE2-CZ3 3.45Å; F95-W98 HydrophobicContact CE2-CZ3 3.45Å; F95-W98 VanDerWaalsContact CE2-CZ3 3.45Å; F95-W98 HydrophobicContact CG-CE3 4.03Å; F95-W98 HydrophobicContact CG-CZ3 4.31Å; F95-W98 HydrophobicContact CZ-CZ3 4.37Å; F95-F114 HydrophobicContact CD1-CD1 4.14Å; F95-F114 HydrophobicContact CD1-CE1 4.1Å; F95-F114 HydrophobicContact CE1-CD1 4Å; F95-F114 AromaticContact CE1-CE1 3.49Å; F95-F114 HydrophobicContact CE1-CE1 3.49Å; F95-F114 VanDerWaalsContact CE1-CE1 3.49Å; F95-F114 HydrophobicContact CE1-CZ 4.13Å; F95-F114 HydrophobicContact CE2-CE1 4.05Å; F95-F114 HydrophobicContact CZ-CD1 4.25Å; F95-F114 AromaticContact CZ-CE1 3.48Å; F95-F114 HydrophobicContact CZ-CE1 3.48Å; F95-F114 VanDerWaalsContact CZ-CE1 3.48Å; F95-F114 HydrophobicContact CZ-CZ 4.2Å; F95-R300 HydrophobicContact CE1-CB 4.19Å; F95-R300 HydrophobicContact CZ-CB 4.33Å; F95-L304 HydrophobicContact CE2-CD1 3.5Å; F95-L304 VanDerWaalsContact CE2-CD1 3.5Å; F95-L304 HydrophobicContact CZ-CD1 3.72Å
96	L	58	Low	60.1	Low	103 Å²	103	70.9 Å²	70.9	54%	0.539	40%	0.395	S	S	.	.	S	Bend	trans	-67	-34.5	172.8	-90.9	147.3	0	0	0	112.4	A113 F114 K115	L96-A113 HydrophobicContact CD1-CB 4.11Å; L96-A113 PolarHBondContact N-O 3.4Å; L96-F114 VanDerWaalsContact CD1-O 3.23Å; L96-F114 WeakPolarHBondContact CD1-O 3.49Å; L96-K115 HydrophobicContact CG-CB 4.36Å
97	N	60.8	Low	62.5	Low	97 Å²	97	67.4 Å²	67.4	52%	0.519	37%	0.373	S	S	.	.			trans	-149.5	115.8	177.7	-139.7	1.3	0	0	0	107	F95 G99	F95-N97 VanDerWaalsContact C-N 3.32Å; N97-G99 PolarHBondContact O-N 3.03Å; N97-G99 VanDerWaalsContact O-N 3.07Å
98	W	55.2	Low	64.7	Low	79 Å²	79	63.8 Å²	63.8	30%	0.299	35%	0.348	S	S	.	.			trans	-70.9	-1.1	-176.7	-174.5	-102.7	0	0	0	113.3	N91 F95 R297	N91-W98 VanDerWaalsContact C-CZ3 3.44Å; N91-W98 HydrophobicContact CB-CH2 3.32Å; N91-W98 HydrophobicContact CB-CZ2 4.34Å; N91-W98 HydrophobicContact CB-CZ3 3.53Å; N91-W98 WeakPolarHBondContact O-CZ3 3.5Å; F95-W98 HydrophobicContact CB-CE3 4.3Å; F95-W98 AromaticContact CD2-CE3 3.51Å; F95-W98 HydrophobicContact CD2-CE3 3.51Å; F95-W98 AromaticContact CD2-CZ3 3.41Å; F95-W98 HydrophobicContact CD2-CZ3 3.41Å; F95-W98 VanDerWaalsContact CD2-CZ3 3.41Å; F95-W98 HydrophobicContact CE2-CE3 4.03Å; F95-W98 HydrophobicContact CE2-CH2 4.47Å; F95-W98 AromaticContact CE2-CZ3 3.45Å; F95-W98 HydrophobicContact CE2-CZ3 3.45Å; F95-W98 VanDerWaalsContact CE2-CZ3 3.45Å; F95-W98 HydrophobicContact CG-CE3 4.03Å; F95-W98 HydrophobicContact CG-CZ3 4.31Å; F95-W98 HydrophobicContact CZ-CZ3 4.37Å; W98-R297 PolarHBondContact O-NH1 3.18Å
99	G	61.7	Low	66.4	Low	16 Å²	16	60.9 Å²	60.9	17%	0.165	32%	0.321	C	S	.	.			trans	84.7	161.5	-174.4	0	0	0	0	0	111.9	N97 T101	N97-G99 PolarHBondContact O-N 3.03Å; N97-G99 VanDerWaalsContact O-N 3.07Å; G99-T101 PolarHBondContact O-N 3.29Å
100	Y	69.8	Low	67.4	Low	129 Å²	129	63.7 Å²	63.7	51%	0.506	33%	0.331	S	S	.	.			trans	-80.8	110.5	174.2	-174.1	-102.2	0	0	0	109.2	F107	Y100-F107 HydrophobicContact CD1-CB 4.46Å; Y100-F107 AromaticContact CD1-CD2 3.99Å; Y100-F107 HydrophobicContact CD1-CD2 3.99Å; Y100-F107 HydrophobicContact CE1-CD2 4.42Å; Y100-F107 PolarHBondContact O-N 3.35Å
101	T	72.8	Confident	67.9	Low	66 Å²	66	70.4 Å²	70.4	41%	0.405	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	118.2	173.5	56.5	0	0	0	0	109.2	G99 V105 I106	G99-T101 PolarHBondContact O-N 3.29Å; T101-V105 CarbonylContact C-O 3.33Å; T101-V105 WeakPolarHBondContact CA-O 3.18Å; T101-I106 HydrophobicContact CG2-CG1 4.19Å; T101-I106 HydrophobicContact CG2-CG2 4.4Å
102	Y	74	Confident	68.6	Low	103 Å²	103	69.1 Å²	69.1	40%	0.404	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	115.4	174	-179	-99.2	0	0	0	108.8	G104 V105	Y102-G104 VanDerWaalsContact C-N 3.3Å; Y102-G104 PolarHBondContact O-N 3.1Å; Y102-V105 PolarHBondContact N-O 3.4Å; Y102-V105 WeakPolarHBondContact O-CB 3.21Å; Y102-V105 PolarHBondContact O-N 3.02Å
103	R	70.3	Confident	69.6	Low	103 Å²	103	67.1 Å²	67.1	39%	0.389	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	50.6	176.7	-62.7	-170	-174.6	-166.2	1.1	112.8	V105 D717	R103-V105 PolarHBondContact O-N 3.1Å; R103-V105 VanDerWaalsContact O-N 3.14Å; R103-D717 HydrophobicContact CB-CB 3.75Å; R103-D717 HydrophobicContact CG-CB 4.34Å
104	G	68.1	Low	70.7	Confident	35 Å²	35	62.9 Å²	62.9	36%	0.361	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.4	-4.9	180	0	0	0	0	0	116.1	Y102	Y102-G104 VanDerWaalsContact C-N 3.3Å; Y102-G104 PolarHBondContact O-N 3.1Å
105	V	78.1	Confident	71.6	Confident	14 Å²	14	68.8 Å²	68.8	9%	0.085	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	129.4	172.9	-177.8	0	0	0	0	109.7	T101 Y102 R103 F107 K667 V671 T714	T101-V105 CarbonylContact C-O 3.33Å; T101-V105 WeakPolarHBondContact CA-O 3.18Å; Y102-V105 PolarHBondContact N-O 3.4Å; Y102-V105 WeakPolarHBondContact O-CB 3.21Å; Y102-V105 PolarHBondContact O-N 3.02Å; R103-V105 PolarHBondContact O-N 3.1Å; R103-V105 VanDerWaalsContact O-N 3.14Å; V105-F107 HydrophobicContact CB-CE2 4.16Å; V105-F107 HydrophobicContact CG1-CD2 4.33Å; V105-F107 HydrophobicContact CG1-CE2 3.78Å; V105-F107 HydrophobicContact CG1-CZ 3.92Å; V105-K667 HydrophobicContact CG2-CB 4.28Å; V105-V671 HydrophobicContact CG1-CG2 4.11Å; V105-V671 HydrophobicContact CG2-CG2 4.26Å; V105-T714 HydrophobicContact CG2-CG2 4.34Å
106	I	82.2	Confident	72.4	Confident	8 Å²	8	70.4 Å²	70.4	4%	0.041	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	117.5	-177.2	-46.8	174.8	0	0	0	108.1	T101 Y293 V665 S668	T101-I106 HydrophobicContact CG2-CG1 4.19Å; T101-I106 HydrophobicContact CG2-CG2 4.4Å; I106-Y293 HydrophobicContact CG2-CE1 3.79Å; I106-V665 HydrophobicContact CD1-CG1 4.43Å; I106-S668 WeakPolarHBondContact CB-OG 3.27Å; I106-S668 PolarHBondContact N-OG 2.93Å
107	F	81.3	Confident	73.4	Confident	73 Å²	73	74 Å²	74	32%	0.32	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-92.3	145.3	176.6	-72.6	-84.6	0	0	0	111.7	Y100 V105 T109 Y293	Y100-F107 HydrophobicContact CD1-CB 4.46Å; Y100-F107 AromaticContact CD1-CD2 3.99Å; Y100-F107 HydrophobicContact CD1-CD2 3.99Å; Y100-F107 HydrophobicContact CE1-CD2 4.42Å; Y100-F107 PolarHBondContact O-N 3.35Å; V105-F107 HydrophobicContact CB-CE2 4.16Å; V105-F107 HydrophobicContact CG1-CD2 4.33Å; V105-F107 HydrophobicContact CG1-CE2 3.78Å; V105-F107 HydrophobicContact CG1-CZ 3.92Å; F107-T109 PolarHBondContact O-N 3.35Å; F107-Y293 WeakPolarHBondContact O-CE1 3.33Å; F107-Y293 PolarHBondContact O-OH 2.81Å
108	P	80.8	Confident	74.2	Confident	41 Å²	41	71.8 Å²	71.8	27%	0.266	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-57.7	133.9	175.4	-22.2	32.8	0	0	0	111.4	I289 F290 Y293	P108-I289 HydrophobicContact CB-CG2 3.9Å; P108-I289 HydrophobicContact CG-CG2 4.18Å; P108-F290 HydrophobicContact CG-CD1 3.89Å; P108-F290 HydrophobicContact CG-CD2 4.39Å; P108-F290 HydrophobicContact CG-CE1 3.73Å; P108-F290 HydrophobicContact CG-CE2 4.23Å; P108-F290 HydrophobicContact CG-CG 4.23Å; P108-F290 HydrophobicContact CG-CZ 3.9Å; P108-Y293 HydrophobicContact CB-CD1 4.17Å; P108-Y293 HydrophobicContact CB-CD2 4.46Å; P108-Y293 HydrophobicContact CB-CG 4.08Å; P108-Y293 HydrophobicContact CG-CD1 4.34Å
109	T	80.2	Confident	75.4	Confident	30 Å²	30	68.2 Å²	68.2	18%	0.184	33%	0.327	C	S	.	.			trans	-126.5	143.6	173.3	57.1	0	0	0	0	109.7	F107 R111 Y293	F107-T109 PolarHBondContact O-N 3.35Å; T109-R111 PolarHBondContact O-N 3.13Å; T109-Y293 PolarHBondContact OG1-OH 3.27Å
110	L	70.9	Confident	76.5	Confident	131 Å²	131	68.9 Å²	68.9	69%	0.686	33%	0.326	S	S	*	.	S	Bend	trans	-69.7	-15.9	-174.8	-71.5	167.7	0	0	0	113.8	I246	L110-I246 HydrophobicContact CD2-CD1 3.84Å
111	R	66	Low	77.1	Confident	192 Å²	192	68.7 Å²	68.7	73%	0.725	32%	0.324	S	S	*	.			trans	-133	83.9	-171.9	-156.5	175.1	-173.6	-172.6	1.7	111.5	T109	T109-R111 PolarHBondContact O-N 3.13Å
112	N	70.8	Confident	77.4	Confident	19 Å²	19	66.3 Å²	66.3	10%	0.102	31%	0.309	C	S	.	.			trans	-104.6	104.3	171.3	-163.4	24.1	0	0	0	108.9	D296 R300	N112-D296 PolarHBondContact ND2-OD2 2.85Å; N112-D296 VanDerWaalsContact ND2-OD2 3.11Å; N112-R300 PolarHBondContact O-NH2 2.97Å
113	A	77.3	Confident	77.8	Confident	22 Å²	22	61.4 Å²	61.4	18%	0.182	29%	0.29	C	S	.	.			trans	-148	151.1	-177.3	0	0	0	0	0	111.4	L96	L96-A113 HydrophobicContact CD1-CB 4.11Å; L96-A113 PolarHBondContact N-O 3.4Å
114	F	81.6	Confident	78.5	Confident	5 Å²	5	58.7 Å²	58.7	2%	0.022	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-71.9	146.4	173.5	-66.8	-63.7	0	0	0	111.7	F94 F95 L96 S116 L119 E120 Y123 R300 F303 L304	F94-F114 HydrophobicContact CB-CD1 4.37Å; F94-F114 WeakPolarHBondContact O-CA 3.35Å; F95-F114 HydrophobicContact CD1-CD1 4.14Å; F95-F114 HydrophobicContact CD1-CE1 4.1Å; F95-F114 HydrophobicContact CE1-CD1 4Å; F95-F114 AromaticContact CE1-CE1 3.49Å; F95-F114 HydrophobicContact CE1-CE1 3.49Å; F95-F114 VanDerWaalsContact CE1-CE1 3.49Å; F95-F114 HydrophobicContact CE1-CZ 4.13Å; F95-F114 HydrophobicContact CE2-CE1 4.05Å; F95-F114 HydrophobicContact CZ-CD1 4.25Å; F95-F114 AromaticContact CZ-CE1 3.48Å; F95-F114 HydrophobicContact CZ-CE1 3.48Å; F95-F114 VanDerWaalsContact CZ-CE1 3.48Å; F95-F114 HydrophobicContact CZ-CZ 4.2Å; L96-F114 VanDerWaalsContact CD1-O 3.23Å; L96-F114 WeakPolarHBondContact CD1-O 3.49Å; F114-S116 VanDerWaalsContact C-N 3.28Å; F114-S116 PolarHBondContact O-N 2.69Å; F114-L119 HydrophobicContact CB-CB 4.29Å; F114-L119 HydrophobicContact CB-CD2 4.13Å; F114-L119 HydrophobicContact CB-CG 4.26Å; F114-L119 HydrophobicContact CD1-CD2 3.87Å; F114-L119 HydrophobicContact CD1-CG 4.39Å; F114-L119 HydrophobicContact CD2-CD2 4.4Å; F114-L119 HydrophobicContact CD2-CG 4.05Å; F114-L119 HydrophobicContact CE1-CD2 4.39Å; F114-L119 HydrophobicContact CG-CD2 3.88Å; F114-L119 HydrophobicContact CG-CG 3.98Å; F114-E120 HydrophobicContact CB-CB 4.39Å; F114-E120 VanDerWaalsContact CD2-OE2 3.22Å; F114-E120 WeakPolarHBondContact CD2-OE2 3.41Å; F114-E120 PolarHBondContact N-OE2 2.97Å; F114-Y123 HydrophobicContact CD2-CG 4.43Å; F114-Y123 HydrophobicContact CE2-CD1 4.21Å; F114-Y123 HydrophobicContact CE2-CD2 4.06Å; F114-Y123 AromaticContact CE2-CG 3.67Å; F114-Y123 HydrophobicContact CE2-CG 3.67Å; F114-R300 HydrophobicContact CE2-CG 4.19Å; F114-R300 VanDerWaalsContact CE2-NH1 3.34Å; F114-R300 HydrophobicContact CZ-CB 3.88Å; F114-R300 HydrophobicContact CZ-CG 4.03Å; F114-F303 HydrophobicContact CE2-CD1 4.26Å; F114-F303 HydrophobicContact CE2-CE1 4.41Å; F114-F303 HydrophobicContact CZ-CD1 4.21Å; F114-L304 HydrophobicContact CE1-CD1 3.8Å; F114-L304 HydrophobicContact CE1-CD2 3.81Å; F114-L304 HydrophobicContact CE1-CG 3.79Å; F114-L304 HydrophobicContact CZ-CD1 4.45Å; F114-L304 HydrophobicContact CZ-CD2 4.2Å; F114-L304 HydrophobicContact CZ-CG 4.04Å
115	K	79.1	Confident	79	Confident	159 Å²	159	62.3 Å²	62.3	69%	0.691	28%	0.284	S	S	*	.	S	Bend	trans	-64.6	-33.2	176.1	-169.7	179.5	179.2	-177.2	0	112.6	F94 L96	F94-K115 PolarHBondContact O-N 2.93Å; L96-K115 HydrophobicContact CG-CB 4.36Å
116	S	80.6	Confident	79	Confident	53 Å²	53	64 Å²	64	37%	0.371	29%	0.29	S	S	.	.	S	Bend	trans	-86.7	126.4	173.5	169.4	0	0	0	0	110.9	F114 D118 L119 E120	F114-S116 VanDerWaalsContact C-N 3.28Å; F114-S116 PolarHBondContact O-N 2.69Å; S116-D118 VanDerWaalsContact C-N 3.33Å; S116-D118 PolarHBondContact O-N 3.3Å; S116-D118 PolarHBondContact OG-N 2.99Å; S116-L119 PolarHBondContact O-N 3.23Å; S116-L119 PolarHBondContact OG-N 3.31Å; S116-E120 PolarHBondContact O-N 3.47Å
117	R	79.9	Confident	79	Confident	179 Å²	179	64 Å²	64	68%	0.675	29%	0.289	S	S	*	.	H	α-helix	trans	-65.7	-35.4	178	-171.9	175.1	-178.5	174.5	-1.1	112.3	E120 R121	R117-E120 PolarHBondContact O-N 3.45Å; R117-R121 WeakPolarHBondContact O-CG 3.16Å; R117-R121 PolarHBondContact O-N 2.67Å
118	D	77.6	Confident	79	Confident	51 Å²	51	60.9 Å²	60.9	27%	0.273	28%	0.276	S	S	.	.	H	α-helix	trans	-74.5	-34.9	179.9	-54.7	-46.6	0	0	0	111.4	S116 E120 R121 L122	S116-D118 VanDerWaalsContact C-N 3.33Å; S116-D118 PolarHBondContact O-N 3.3Å; S116-D118 PolarHBondContact OG-N 2.99Å; D118-E120 VanDerWaalsContact C-N 3.34Å; D118-R121 PolarHBondContact O-N 2.83Å; D118-R121 IonicContact OD1-CZ 3.83Å; D118-R121 IonicContact OD1-NH1 3.09Å; D118-R121 PolarHBondContact OD1-NH1 3.45Å; D118-L122 WeakPolarHBondContact O-CB 3.5Å; D118-L122 PolarHBondContact O-N 3.29Å
119	L	80.3	Confident	78.9	Confident	3 Å²	3	60.5 Å²	60.5	2%	0.016	28%	0.279	C	S	.	.	H	α-helix	trans	-64.6	-40.4	171.5	-170	58.5	0	0	0	112	F94 F114 S116 L122 Y123 F303 L304	F94-L119 HydrophobicContact CD1-CD2 4.2Å; F114-L119 HydrophobicContact CB-CB 4.29Å; F114-L119 HydrophobicContact CB-CD2 4.13Å; F114-L119 HydrophobicContact CB-CG 4.26Å; F114-L119 HydrophobicContact CD1-CD2 3.87Å; F114-L119 HydrophobicContact CD1-CG 4.39Å; F114-L119 HydrophobicContact CD2-CD2 4.4Å; F114-L119 HydrophobicContact CD2-CG 4.05Å; F114-L119 HydrophobicContact CE1-CD2 4.39Å; F114-L119 HydrophobicContact CG-CD2 3.88Å; F114-L119 HydrophobicContact CG-CG 3.98Å; S116-L119 PolarHBondContact O-N 3.23Å; S116-L119 PolarHBondContact OG-N 3.31Å; L119-L122 PolarHBondContact O-N 3.48Å; L119-Y123 WeakPolarHBondContact O-CB 3.31Å; L119-Y123 PolarHBondContact O-N 3.3Å; L119-F303 HydrophobicContact CD1-CE1 3.57Å; L119-F303 HydrophobicContact CD1-CZ 4.01Å; L119-F303 HydrophobicContact CG-CE1 4.27Å; L119-L304 HydrophobicContact CD2-CD2 3.97Å
120	E	84.8	Confident	78.6	Confident	31 Å²	31	61.5 Å²	61.5	15%	0.145	28%	0.282	C	S	.	.	H	α-helix	trans	-63.1	-44.6	173.6	-171.2	63.5	-148.9	0	0	111.1	F114 S116 R117 D118 L122 Y123 Q124 R300	F114-E120 HydrophobicContact CB-CB 4.39Å; F114-E120 VanDerWaalsContact CD2-OE2 3.22Å; F114-E120 WeakPolarHBondContact CD2-OE2 3.41Å; F114-E120 PolarHBondContact N-OE2 2.97Å; S116-E120 PolarHBondContact O-N 3.47Å; R117-E120 PolarHBondContact O-N 3.45Å; D118-E120 VanDerWaalsContact C-N 3.34Å; E120-L122 VanDerWaalsContact C-N 3.34Å; E120-L122 PolarHBondContact O-N 3.35Å; E120-Y123 PolarHBondContact O-N 3.36Å; E120-Q124 HydrophobicContact CG-CG 4.38Å; E120-Q124 WeakPolarHBondContact O-CB 3.06Å; E120-Q124 WeakPolarHBondContact O-CG 3.48Å; E120-Q124 PolarHBondContact O-N 3.41Å; E120-Q124 PolarHBondContact OE1-NE2 3.42Å; E120-R300 IonicContact OE1-CZ 3.37Å; E120-R300 IonicContact OE1-NH1 3.33Å; E120-R300 PolarHBondContact OE1-NH1 3.48Å; E120-R300 IonicContact OE1-NH2 2.94Å; E120-R300 PolarHBondContact OE1-NH2 3.34Å; E120-R300 IonicContact OE2-CZ 3.94Å; E120-R300 IonicContact OE2-NH1 3.56Å; E120-R300 PolarHBondContact OE2-NH1 3.07Å; E120-R300 IonicContact OE2-NH2 3.19Å
121	R	82.1	Confident	79.2	Confident	124 Å²	124	55.4 Å²	55.4	47%	0.468	25%	0.25	S	C	.	.	H	α-helix	trans	-59.1	-44.2	175.7	-74.3	170.6	177.4	156	-10.1	112.2	R117 D118 Q124 R125	R117-R121 WeakPolarHBondContact O-CG 3.16Å; R117-R121 PolarHBondContact O-N 2.67Å; D118-R121 PolarHBondContact O-N 2.83Å; D118-R121 IonicContact OD1-CZ 3.83Å; D118-R121 IonicContact OD1-NH1 3.09Å; D118-R121 PolarHBondContact OD1-NH1 3.45Å; R121-Q124 PolarHBondContact O-N 3.28Å; R121-R125 PolarHBondContact O-N 3.17Å; R121-R125 VanDerWaalsContact O-N 3.09Å
122	L	79.3	Confident	80	Confident	17 Å²	17	48.1 Å²	48.1	9%	0.089	22%	0.222	C	C	.	.	H	α-helix	trans	-64.8	-43	178.7	-171	64.1	0	0	0	111.3	D118 L119 E120 R125 Y126 F303	D118-L122 WeakPolarHBondContact O-CB 3.5Å; D118-L122 PolarHBondContact O-N 3.29Å; L119-L122 PolarHBondContact O-N 3.48Å; E120-L122 VanDerWaalsContact C-N 3.34Å; E120-L122 PolarHBondContact O-N 3.35Å; L122-R125 PolarHBondContact O-N 2.93Å; L122-Y126 PolarHBondContact O-N 3.1Å; L122-F303 HydrophobicContact CB-CZ 4.13Å; L122-F303 HydrophobicContact CD2-CE2 4.33Å; L122-F303 HydrophobicContact CD2-CZ 3.83Å; L122-F303 HydrophobicContact CG-CE2 4.13Å; L122-F303 HydrophobicContact CG-CZ 3.8Å
123	Y	83.3	Confident	80.7	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.8	-43.9	173.6	172.7	-101.2	0	0	0	112.3	F114 L119 E120 R125 Y126 F127 D296 Q299 R300 F303	F114-Y123 HydrophobicContact CD2-CG 4.43Å; F114-Y123 HydrophobicContact CE2-CD1 4.21Å; F114-Y123 HydrophobicContact CE2-CD2 4.06Å; F114-Y123 AromaticContact CE2-CG 3.67Å; F114-Y123 HydrophobicContact CE2-CG 3.67Å; L119-Y123 WeakPolarHBondContact O-CB 3.31Å; L119-Y123 PolarHBondContact O-N 3.3Å; E120-Y123 PolarHBondContact O-N 3.36Å; Y123-R125 VanDerWaalsContact C-N 3.29Å; Y123-R125 PolarHBondContact O-N 3.31Å; Y123-Y126 WeakPolarHBondContact O-CB 3.39Å; Y123-Y126 PolarHBondContact O-N 2.97Å; Y123-Y126 VanDerWaalsContact O-N 3.15Å; Y123-F127 HydrophobicContact CE1-CB 4.13Å; Y123-F127 HydrophobicContact CE1-CG 4.47Å; Y123-F127 VanDerWaalsContact O-CB 3.32Å; Y123-F127 WeakPolarHBondContact O-CB 3.46Å; Y123-F127 PolarHBondContact O-N 2.84Å; Y123-F127 WeakPolarHBondContact OH-CD2 3.45Å; Y123-D296 PolarHBondContact OH-OD1 3.25Å; Y123-Q299 HydrophobicContact CE2-CB 4.45Å; Y123-R300 HydrophobicContact CD1-CG 4.27Å; Y123-R300 HydrophobicContact CD2-CG 4Å; Y123-R300 HydrophobicContact CE1-CG 3.73Å; Y123-R300 HydrophobicContact CE2-CB 4.16Å; Y123-R300 HydrophobicContact CE2-CG 3.41Å; Y123-R300 VanDerWaalsContact CE2-CG 3.41Å; Y123-R300 HydrophobicContact CG-CG 4.4Å; Y123-F303 HydrophobicContact CD2-CB 4.05Å; Y123-F303 AromaticContact CD2-CD1 3.91Å; Y123-F303 HydrophobicContact CD2-CD1 3.91Å; Y123-F303 AromaticContact CD2-CG 3.94Å; Y123-F303 HydrophobicContact CD2-CG 3.94Å; Y123-F303 HydrophobicContact CE2-CB 4.45Å; Y123-F303 HydrophobicContact CG-CD1 4.49Å
124	Q	83.4	Confident	81.1	Confident	45 Å²	45	51.8 Å²	51.8	21%	0.21	23%	0.233	C	C	.	.	H	α-helix	trans	-60.8	-39	178.5	-70.5	-66.8	-29.7	0	0	111.4	E120 R121 L128	E120-Q124 HydrophobicContact CG-CG 4.38Å; E120-Q124 WeakPolarHBondContact O-CB 3.06Å; E120-Q124 WeakPolarHBondContact O-CG 3.48Å; E120-Q124 PolarHBondContact O-N 3.41Å; E120-Q124 PolarHBondContact OE1-NE2 3.42Å; R121-Q124 PolarHBondContact O-N 3.28Å; Q124-L128 WeakPolarHBondContact O-CB 3.31Å; Q124-L128 WeakPolarHBondContact O-CG 3.24Å; Q124-L128 PolarHBondContact O-N 3.05Å
125	R	80	Confident	81.5	Confident	111 Å²	111	51.6 Å²	51.6	42%	0.419	23%	0.233	S	C	.	.	H	α-helix	trans	-61.9	-48.6	172.3	-69.9	-176.4	-175.7	164.3	3.2	111.8	R121 L122 Y123 F127 L128 G129 E626	R121-R125 PolarHBondContact O-N 3.17Å; R121-R125 VanDerWaalsContact O-N 3.09Å; L122-R125 PolarHBondContact O-N 2.93Å; Y123-R125 VanDerWaalsContact C-N 3.29Å; Y123-R125 PolarHBondContact O-N 3.31Å; R125-F127 PolarHBondContact O-N 3.37Å; R125-L128 PolarHBondContact O-N 3.04Å; R125-G129 PolarHBondContact O-N 2.9Å; R125-E626 IonicContact CZ-OE1 3.8Å; R125-E626 IonicContact NH1-OE1 2.88Å; R125-E626 PolarHBondContact NH1-OE1 2.97Å; R125-E626 IonicContact NH1-OE2 2.71Å
126	Y	78.1	Confident	82	Confident	50 Å²	50	45.1 Å²	45.1	20%	0.196	21%	0.206	C	C	.	.	H	α-helix	trans	-58.1	-47.7	176.9	175.2	-97.7	0	0	0	112.2	L122 Y123 G129 Q130 F303	L122-Y126 PolarHBondContact O-N 3.1Å; Y123-Y126 WeakPolarHBondContact O-CB 3.39Å; Y123-Y126 PolarHBondContact O-N 2.97Å; Y123-Y126 VanDerWaalsContact O-N 3.15Å; Y126-G129 PolarHBondContact O-N 2.92Å; Y126-Q130 PolarHBondContact O-N 3.41Å; Y126-F303 HydrophobicContact CD1-CB 4.28Å; Y126-F303 HydrophobicContact CD1-CD2 4.08Å; Y126-F303 HydrophobicContact CD2-CD2 4.42Å; Y126-F303 HydrophobicContact CE1-CB 4.3Å; Y126-F303 AromaticContact CG-CD2 3.96Å; Y126-F303 HydrophobicContact CG-CD2 3.96Å
127	F	81.7	Confident	82.4	Confident	9 Å²	9	45 Å²	45	4%	0.039	20%	0.203	C	C	.	.	H	α-helix	trans	-60.8	-48.9	178.6	175.3	-97.2	0	0	0	112.3	Y123 R125 Q130 R131 Q299	Y123-F127 HydrophobicContact CE1-CB 4.13Å; Y123-F127 HydrophobicContact CE1-CG 4.47Å; Y123-F127 VanDerWaalsContact O-CB 3.32Å; Y123-F127 WeakPolarHBondContact O-CB 3.46Å; Y123-F127 PolarHBondContact O-N 2.84Å; Y123-F127 WeakPolarHBondContact OH-CD2 3.45Å; R125-F127 PolarHBondContact O-N 3.37Å; F127-Q130 PolarHBondContact O-N 2.88Å; F127-R131 HydrophobicContact CE1-CG 4.45Å; F127-R131 HydrophobicContact CE2-CG 4.45Å; F127-R131 VanDerWaalsContact CE2-NE 3.28Å; F127-R131 VanDerWaalsContact CZ-CD 3.47Å; F127-R131 HydrophobicContact CZ-CG 4.3Å; F127-R131 PolarHBondContact O-N 3.45Å; F127-Q299 VanDerWaalsContact CD2-OE1 3.24Å; F127-Q299 VanDerWaalsContact CE2-OE1 3.28Å
128	L	81.4	Confident	82.9	Confident	6 Å²	6	36.9 Å²	36.9	3%	0.031	17%	0.173	C	C	.	.	H	α-helix	trans	-64.8	-41	178.5	-68.8	170.5	0	0	0	111.2	Q124 R125 Q130 R131 R132 H192 L195 Q196 P239	Q124-L128 WeakPolarHBondContact O-CB 3.31Å; Q124-L128 WeakPolarHBondContact O-CG 3.24Å; Q124-L128 PolarHBondContact O-N 3.05Å; R125-L128 PolarHBondContact O-N 3.04Å; L128-Q130 VanDerWaalsContact C-N 3.32Å; L128-Q130 PolarHBondContact O-N 2.94Å; L128-R131 PolarHBondContact O-N 3.38Å; L128-R132 PolarHBondContact O-N 2.92Å; L128-H192 HydrophobicContact CB-CB 4.27Å; L128-H192 HydrophobicContact CD1-CB 3.81Å; L128-L195 HydrophobicContact CB-CD2 4.48Å; L128-L195 HydrophobicContact CD2-CB 4.34Å; L128-L195 WeakPolarHBondContact O-CD2 3.38Å; L128-Q196 HydrophobicContact CD1-CG 4.04Å; L128-Q196 HydrophobicContact CD2-CG 3.59Å; L128-Q196 HydrophobicContact CG-CG 4.48Å; L128-P239 HydrophobicContact CD2-CB 3.94Å
129	G	77.6	Confident	83.5	Confident	33 Å²	33	34.4 Å²	34.4	34%	0.34	16%	0.16	S	C	.	.	H	α-helix	trans	-56.1	-44.5	173.3	0	0	0	0	0	112.6	R125 Y126 R132	R125-G129 PolarHBondContact O-N 2.9Å; Y126-G129 PolarHBondContact O-N 2.92Å; G129-R132 WeakPolarHBondContact O-CB 3.33Å; G129-R132 PolarHBondContact O-N 3.06Å
130	Q	75.8	Confident	84.1	Confident	51 Å²	51	38.4 Å²	38.4	24%	0.238	18%	0.18	C	C	.	.	H	α-helix	trans	-68.6	-37.3	178.6	-171.1	69.7	-0.2	0	0	112.9	Y126 F127 L128 R132 Q872	Y126-Q130 PolarHBondContact O-N 3.41Å; F127-Q130 PolarHBondContact O-N 2.88Å; L128-Q130 VanDerWaalsContact C-N 3.32Å; L128-Q130 PolarHBondContact O-N 2.94Å; Q130-R132 VanDerWaalsContact C-N 3.33Å; Q130-Q872 PolarHBondContact NE2-O 3.02Å
131	R	81.8	Confident	84.3	Confident	4 Å²	4	37.9 Å²	37.9	2%	0.015	18%	0.178	C	C	.	.	H	α-helix	trans	-79.8	-8.4	178.3	-67.7	-158.5	174.5	-146.2	1.4	114.1	F127 L128 K133 S134 V135 S236 L238 P239	F127-R131 HydrophobicContact CE1-CG 4.45Å; F127-R131 HydrophobicContact CE2-CG 4.45Å; F127-R131 VanDerWaalsContact CE2-NE 3.28Å; F127-R131 VanDerWaalsContact CZ-CD 3.47Å; F127-R131 HydrophobicContact CZ-CG 4.3Å; F127-R131 PolarHBondContact O-N 3.45Å; L128-R131 PolarHBondContact O-N 3.38Å; R131-K133 PolarHBondContact O-N 3.34Å; R131-S134 WeakPolarHBondContact O-CA 3.48Å; R131-S134 VanDerWaalsContact O-CB 3.31Å; R131-S134 WeakPolarHBondContact O-CB 3.46Å; R131-S134 PolarHBondContact O-N 3.31Å; R131-V135 PolarHBondContact O-N 3.06Å; R131-V135 VanDerWaalsContact O-N 3.12Å; R131-S236 PolarHBondContact NH1-O 2.8Å; R131-L238 PolarHBondContact NH1-O 2.97Å; R131-P239 HydrophobicContact CB-CB 3.95Å
132	R	84.5	Confident	84.6	Confident	38 Å²	38	32 Å²	32	14%	0.143	16%	0.156	C	C	.	.	H	α-helix	trans	-53.5	-52.6	176.2	-172	-178.8	-76	173.1	-7.2	112.9	L128 G129 Q130 S134 V135 V183 K187 Y194 L195	L128-R132 PolarHBondContact O-N 2.92Å; G129-R132 WeakPolarHBondContact O-CB 3.33Å; G129-R132 PolarHBondContact O-N 3.06Å; Q130-R132 VanDerWaalsContact C-N 3.33Å; R132-S134 PolarHBondContact O-N 3.27Å; R132-V135 PolarHBondContact O-N 3.19Å; R132-V183 HydrophobicContact CG-CG1 3.68Å; R132-K187 VanDerWaalsContact NH1-CA 3.27Å; R132-K187 VanDerWaalsContact NH1-CG 3.33Å; R132-K187 PolarHBondContact NH1-O 3.42Å; R132-K187 PolarHBondContact NH2-O 3.21Å; R132-Y194 PolarHBondContact NE-OH 2.82Å; R132-Y194 PolarHBondContact NH2-OH 2.98Å; R132-L195 HydrophobicContact CB-CD2 3.6Å; R132-L195 HydrophobicContact CG-CD2 3.9Å
133	K	84	Confident	85.1	Confident	119 Å²	119	32.7 Å²	32.7	52%	0.517	16%	0.161	S	C	.	.	H	α-helix	trans	-62.4	-31.6	179.7	-66.7	178.1	-176.3	166.6	0	110.8	R131 V136 V137 D635 Y868	R131-K133 PolarHBondContact O-N 3.34Å; K133-V136 PolarHBondContact O-N 3.47Å; K133-V137 WeakPolarHBondContact O-CG2 3.29Å; K133-V137 PolarHBondContact O-N 3.38Å; K133-V137 VanDerWaalsContact O-N 3.07Å; K133-D635 IonicContact NZ-OD1 2.75Å; K133-D635 IonicContact NZ-OD2 3.78Å; K133-D635 PolarHBondContact NZ-OD2 3.5Å; K133-Y868 WeakPolarHBondContact CB-OH 3.36Å; K133-Y868 PolarHBondContact O-OH 3.02Å
134	S	86.5	Confident	85.4	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-70.3	-41.3	-178.1	-165.5	0	0	0	0	113.6	R131 R132 V136 V137 M138 M237 Y868 Q872	R131-S134 WeakPolarHBondContact O-CA 3.48Å; R131-S134 VanDerWaalsContact O-CB 3.31Å; R131-S134 WeakPolarHBondContact O-CB 3.46Å; R131-S134 PolarHBondContact O-N 3.31Å; R132-S134 PolarHBondContact O-N 3.27Å; S134-V136 VanDerWaalsContact C-N 3.33Å; S134-V136 PolarHBondContact O-N 3Å; S134-V137 PolarHBondContact O-N 3.18Å; S134-M138 WeakPolarHBondContact O-CB 3.46Å; S134-M138 PolarHBondContact O-N 3.03Å; S134-M237 WeakPolarHBondContact OG-CA 3.41Å; S134-M237 PolarHBondContact OG-O 2.69Å; S134-M237 PolarHBondContact OG-SD 3.22Å; S134-Y868 PolarHBondContact N-OH 2.81Å; S134-Q872 PolarHBondContact OG-OE1 3.45Å
135	V	88.8	Confident	85.5	Confident	1 Å²	1	34.4 Å²	34.4	1%	0.006	18%	0.175	C	C	.	.	H	α-helix	trans	-57.8	-47.2	173.1	177.2	0	0	0	0	111.6	R131 R132 M138 N139 P239	R131-V135 PolarHBondContact O-N 3.06Å; R131-V135 VanDerWaalsContact O-N 3.12Å; R132-V135 PolarHBondContact O-N 3.19Å; V135-M138 PolarHBondContact O-N 3.05Å; V135-N139 PolarHBondContact O-N 3.29Å; V135-P239 HydrophobicContact CG2-CB 4.38Å; V135-P239 HydrophobicContact CG2-CG 3.54Å
136	V	89.9	Confident	85.7	Confident	23 Å²	23	29.3 Å²	29.3	14%	0.139	16%	0.155	C	C	.	.	H	α-helix	trans	-64.1	-45.5	-177.9	177.4	0	0	0	0	110.3	K133 S134 M138 N139 I140 V183 V184	K133-V136 PolarHBondContact O-N 3.47Å; S134-V136 VanDerWaalsContact C-N 3.33Å; S134-V136 PolarHBondContact O-N 3Å; V136-M138 PolarHBondContact O-N 3.14Å; V136-N139 PolarHBondContact O-N 2.77Å; V136-I140 HydrophobicContact CG1-CD1 3.75Å; V136-I140 HydrophobicContact CG1-CG1 4.43Å; V136-I140 WeakPolarHBondContact O-CB 3.29Å; V136-I140 VanDerWaalsContact O-CG1 3.24Å; V136-I140 WeakPolarHBondContact O-CG1 3.36Å; V136-I140 PolarHBondContact O-N 2.77Å; V136-V183 HydrophobicContact CG2-CB 4.01Å; V136-V183 HydrophobicContact CG2-CG1 3.57Å; V136-V184 HydrophobicContact CG1-CG2 4.29Å; V136-V184 HydrophobicContact CG2-CG2 4.22Å
137	V	89.8	Confident	86.1	Confident	51 Å²	51	31.7 Å²	31.7	31%	0.309	17%	0.171	S	C	.	.	H	α-helix	trans	-66	-38.5	179.4	172.1	0	0	0	0	112.1	K133 S134 I140 L141 Y868	K133-V137 WeakPolarHBondContact O-CG2 3.29Å; K133-V137 PolarHBondContact O-N 3.38Å; K133-V137 VanDerWaalsContact O-N 3.07Å; S134-V137 PolarHBondContact O-N 3.18Å; V137-I140 PolarHBondContact O-N 3.38Å; V137-L141 WeakPolarHBondContact O-CB 3.36Å; V137-L141 PolarHBondContact O-N 3Å; V137-Y868 HydrophobicContact CB-CD1 4.4Å; V137-Y868 HydrophobicContact CB-CD2 4.34Å; V137-Y868 HydrophobicContact CB-CE1 4.03Å; V137-Y868 HydrophobicContact CB-CE2 3.92Å; V137-Y868 HydrophobicContact CG1-CD1 4.04Å; V137-Y868 HydrophobicContact CG1-CD2 3.7Å; V137-Y868 HydrophobicContact CG1-CE1 4.16Å; V137-Y868 HydrophobicContact CG1-CE2 3.79Å; V137-Y868 HydrophobicContact CG1-CG 3.8Å; V137-Y868 HydrophobicContact CG2-CD2 4.33Å; V137-Y868 HydrophobicContact CG2-CE1 4.41Å; V137-Y868 HydrophobicContact CG2-CE2 3.58Å
138	M	90.1	Very high	86.2	Confident	7 Å²	7	34.2 Å²	34.2	3%	0.034	19%	0.187	C	C	.	.	H	α-helix	trans	-59.5	-50	174.9	174.7	60.5	-165.4	0	0	111.7	S134 V135 V136 I140 L141 D142 M206 F229 A233 M237	S134-M138 WeakPolarHBondContact O-CB 3.46Å; S134-M138 PolarHBondContact O-N 3.03Å; V135-M138 PolarHBondContact O-N 3.05Å; V136-M138 PolarHBondContact O-N 3.14Å; M138-I140 VanDerWaalsContact C-N 3.34Å; M138-I140 PolarHBondContact O-N 3.03Å; M138-L141 WeakPolarHBondContact O-CB 3.5Å; M138-L141 PolarHBondContact O-N 3.4Å; M138-D142 PolarHBondContact O-N 2.74Å; M138-M206 HydrophobicContact CE-CE 4.02Å; M138-M206 HydrophobicContact CE-SD 4.36Å; M138-F229 HydrophobicContact CE-CD1 4Å; M138-F229 HydrophobicContact CE-CE1 3.18Å; M138-F229 HydrophobicContact CE-CE2 4.14Å; M138-F229 HydrophobicContact CE-CZ 3.27Å; M138-F229 HydrophobicContact SD-CE1 4.1Å; M138-F229 HydrophobicContact SD-CE2 4.14Å; M138-F229 HydrophobicContact SD-CZ 3.52Å; M138-F229 VanDerWaalsContact SD-CZ 3.52Å; M138-A233 HydrophobicContact CE-CB 3.13Å; M138-A233 HydrophobicContact CG-CB 4.32Å; M138-A233 HydrophobicContact SD-CB 3.47Å; M138-A233 WeakPolarHBondContact SD-CB 3.31Å; M138-M237 HydrophobicContact CB-CB 4.13Å; M138-M237 HydrophobicContact CG-CB 4.37Å
139	N	91.1	Very high	86.1	Confident	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.1	-37.3	178.6	-74.4	-13.4	0	0	0	112.1	V135 V136 D142 V143 C180 T202	V135-N139 PolarHBondContact O-N 3.29Å; V136-N139 PolarHBondContact O-N 2.77Å; N139-D142 PolarHBondContact O-N 3.3Å; N139-V143 WeakPolarHBondContact O-CB 3.47Å; N139-V143 WeakPolarHBondContact O-CG2 3.35Å; N139-V143 PolarHBondContact O-N 3.12Å; N139-C180 WeakPolarHBondContact CB-SG 3.36Å; N139-T202 PolarHBondContact ND2-OG1 3.43Å; N139-T202 WeakPolarHBondContact OD1-CG2 3.47Å
140	I	91.7	Very high	86.2	Confident	86 Å²	86	35.3 Å²	35.3	44%	0.441	19%	0.185	S	C	.	.	H	α-helix	trans	-62.4	-45.3	172.9	-70.3	167.9	0	0	0	110.6	V136 V137 M138 D142 V143 V144	V136-I140 HydrophobicContact CG1-CD1 3.75Å; V136-I140 HydrophobicContact CG1-CG1 4.43Å; V136-I140 WeakPolarHBondContact O-CB 3.29Å; V136-I140 VanDerWaalsContact O-CG1 3.24Å; V136-I140 WeakPolarHBondContact O-CG1 3.36Å; V136-I140 PolarHBondContact O-N 2.77Å; V137-I140 PolarHBondContact O-N 3.38Å; M138-I140 VanDerWaalsContact C-N 3.34Å; M138-I140 PolarHBondContact O-N 3.03Å; I140-D142 VanDerWaalsContact C-N 3.3Å; I140-D142 PolarHBondContact O-N 3.39Å; I140-V143 PolarHBondContact O-N 3.43Å; I140-V144 HydrophobicContact CG2-CG2 4.14Å; I140-V144 WeakPolarHBondContact O-CB 3.42Å; I140-V144 WeakPolarHBondContact O-CG2 3.46Å; I140-V144 PolarHBondContact O-N 3.16Å
141	L	89.6	Confident	86.5	Confident	20 Å²	20	36.3 Å²	36.3	11%	0.105	20%	0.195	C	C	.	.	H	α-helix	trans	-60.3	-42	179.2	-178.4	64.8	0	0	0	111.3	V137 M138 T145 F229 M861 L864 A865	V137-L141 WeakPolarHBondContact O-CB 3.36Å; V137-L141 PolarHBondContact O-N 3Å; M138-L141 WeakPolarHBondContact O-CB 3.5Å; M138-L141 PolarHBondContact O-N 3.4Å; L141-T145 WeakPolarHBondContact O-CB 3.3Å; L141-T145 PolarHBondContact O-N 3.14Å; L141-T145 PolarHBondContact O-OG1 3.21Å; L141-F229 HydrophobicContact CD2-CE2 3.8Å; L141-F229 HydrophobicContact CD2-CZ 3.84Å; L141-F229 HydrophobicContact CG-CZ 4.23Å; L141-M861 HydrophobicContact CD2-CG 4.21Å; L141-M861 HydrophobicContact CG-CG 4.23Å; L141-L864 HydrophobicContact CD1-CB 3.81Å; L141-L864 HydrophobicContact CD1-CD1 3.64Å; L141-L864 HydrophobicContact CD1-CG 4.39Å; L141-L864 HydrophobicContact CD2-CB 4.41Å; L141-A865 HydrophobicContact CD2-CB 3.91Å
142	D	88.4	Confident	86.3	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.005	21%	0.205	C	C	.	.	H	α-helix	trans	-69.1	-44.9	178.4	-163.8	45.1	0	0	0	112.3	M138 N139 I140 V144 T145 K146 M206 Y226 F229	M138-D142 PolarHBondContact O-N 2.74Å; N139-D142 PolarHBondContact O-N 3.3Å; I140-D142 VanDerWaalsContact C-N 3.3Å; I140-D142 PolarHBondContact O-N 3.39Å; D142-V144 PolarHBondContact O-N 3.15Å; D142-T145 PolarHBondContact O-N 3.22Å; D142-T145 VanDerWaalsContact O-N 3.16Å; D142-K146 VanDerWaalsContact CG-CE 3.46Å; D142-K146 WeakPolarHBondContact O-CG 3.43Å; D142-K146 PolarHBondContact O-N 3.33Å; D142-K146 WeakPolarHBondContact OD2-CE 3.36Å; D142-K146 IonicContact OD2-NZ 3.78Å; D142-K146 PolarHBondContact OD2-NZ 3.25Å; D142-M206 HydrophobicContact CB-CE 3.67Å; D142-M206 WeakPolarHBondContact OD2-CE 3.22Å; D142-Y226 WeakPolarHBondContact OD1-CE2 3.43Å; D142-Y226 PolarHBondContact OD2-OH 3.36Å; D142-F229 HydrophobicContact CB-CE1 4.33Å
143	V	90.3	Very high	85.7	Confident	31 Å²	31	38 Å²	38	19%	0.188	21%	0.205	C	C	.	.	H	α-helix	trans	-60.2	-44.4	174.7	169.4	0	0	0	0	111.5	N139 I140 T145 K146 L147 E176 V177	N139-V143 WeakPolarHBondContact O-CB 3.47Å; N139-V143 WeakPolarHBondContact O-CG2 3.35Å; N139-V143 PolarHBondContact O-N 3.12Å; I140-V143 PolarHBondContact O-N 3.43Å; V143-T145 VanDerWaalsContact C-N 3.29Å; V143-T145 PolarHBondContact O-N 3.17Å; V143-K146 PolarHBondContact O-N 3.16Å; V143-L147 WeakPolarHBondContact O-CB 3.48Å; V143-L147 PolarHBondContact O-N 3.38Å; V143-E176 HydrophobicContact CG2-CB 3.7Å; V143-V177 HydrophobicContact CG1-CG2 4.31Å; V143-V177 HydrophobicContact CG2-CG2 4.18Å
144	V	89.9	Confident	85.4	Confident	72 Å²	72	38.4 Å²	38.4	44%	0.436	21%	0.213	S	C	.	.	H	α-helix	trans	-61.4	-41.9	176.9	167.5	0	0	0	0	110.1	I140 D142 L147 T148	I140-V144 HydrophobicContact CG2-CG2 4.14Å; I140-V144 WeakPolarHBondContact O-CB 3.42Å; I140-V144 WeakPolarHBondContact O-CG2 3.46Å; I140-V144 PolarHBondContact O-N 3.16Å; D142-V144 PolarHBondContact O-N 3.15Å; V144-L147 PolarHBondContact O-N 3.19Å; V144-T148 HydrophobicContact CG1-CG2 4.33Å; V144-T148 WeakPolarHBondContact O-CG2 3.25Å; V144-T148 PolarHBondContact O-N 3.18Å; V144-T148 PolarHBondContact O-OG1 3.44Å
145	T	84.2	Confident	84.9	Confident	10 Å²	10	42.9 Å²	42.9	6%	0.061	24%	0.24	C	C	.	.	H	α-helix	trans	-66.3	-41.9	178.9	-52.6	0	0	0	0	111.6	L141 D142 V143 L147 T148 L149 L857 M861	L141-T145 WeakPolarHBondContact O-CB 3.3Å; L141-T145 PolarHBondContact O-N 3.14Å; L141-T145 PolarHBondContact O-OG1 3.21Å; D142-T145 PolarHBondContact O-N 3.22Å; D142-T145 VanDerWaalsContact O-N 3.16Å; V143-T145 VanDerWaalsContact C-N 3.29Å; V143-T145 PolarHBondContact O-N 3.17Å; T145-L147 VanDerWaalsContact C-N 3.31Å; T145-L147 PolarHBondContact O-N 3.06Å; T145-T148 WeakPolarHBondContact CA-OG1 3.35Å; T145-T148 PolarHBondContact O-N 3.08Å; T145-T148 PolarHBondContact O-OG1 3.29Å; T145-L149 HydrophobicContact CG2-CD1 4.1Å; T145-L149 WeakPolarHBondContact O-CB 3.43Å; T145-L149 WeakPolarHBondContact O-CD1 3.44Å; T145-L149 VanDerWaalsContact O-CG 3.25Å; T145-L149 WeakPolarHBondContact O-CG 3.45Å; T145-L149 PolarHBondContact O-N 2.73Å; T145-L857 HydrophobicContact CG2-CD2 3.53Å; T145-L857 HydrophobicContact CG2-CG 4.32Å; T145-M861 HydrophobicContact CG2-CE 3.13Å
146	K	84.8	Confident	83.9	Confident	3 Å²	3	47.7 Å²	47.7	1%	0.013	27%	0.265	C	S	.	.	H	α-helix	trans	-63.4	-39.3	174.8	-70.2	172.3	-164	174.1	0	111.8	D142 V143 L149 L150 L169 T173 E176	D142-K146 VanDerWaalsContact CG-CE 3.46Å; D142-K146 WeakPolarHBondContact O-CG 3.43Å; D142-K146 PolarHBondContact O-N 3.33Å; D142-K146 WeakPolarHBondContact OD2-CE 3.36Å; D142-K146 IonicContact OD2-NZ 3.78Å; D142-K146 PolarHBondContact OD2-NZ 3.25Å; V143-K146 PolarHBondContact O-N 3.16Å; K146-L149 PolarHBondContact O-N 3.49Å; K146-L150 WeakPolarHBondContact O-CB 3.45Å; K146-L150 PolarHBondContact O-N 2.68Å; K146-L169 HydrophobicContact CB-CD1 4.05Å; K146-L169 HydrophobicContact CD-CD1 4.11Å; K146-L169 HydrophobicContact CG-CD1 3.99Å; K146-T173 HydrophobicContact CB-CG2 3.77Å; K146-T173 HydrophobicContact CD-CG2 3.49Å; K146-T173 VanDerWaalsContact CD-CG2 3.49Å; K146-T173 HydrophobicContact CG-CG2 4.26Å; K146-E176 IonicContact NZ-OE1 2.77Å; K146-E176 PolarHBondContact NZ-OE1 3.18Å; K146-E176 IonicContact NZ-OE2 3.88Å; K146-E176 PolarHBondContact NZ-OE2 3.05Å
147	L	86.5	Confident	82.7	Confident	100 Å²	100	48.3 Å²	48.3	52%	0.524	27%	0.273	S	S	.	.	H	α-helix	trans	-67.8	-42.1	177	-174.2	66.9	0	0	0	111.8	V143 V144 T145 L149 L150 V151	V143-L147 WeakPolarHBondContact O-CB 3.48Å; V143-L147 PolarHBondContact O-N 3.38Å; V144-L147 PolarHBondContact O-N 3.19Å; T145-L147 VanDerWaalsContact C-N 3.31Å; T145-L147 PolarHBondContact O-N 3.06Å; L147-L149 VanDerWaalsContact C-N 3.33Å; L147-L150 HydrophobicContact CD1-CD2 4.47Å; L147-L150 PolarHBondContact O-N 3.33Å; L147-V151 WeakPolarHBondContact O-CG2 3.37Å; L147-V151 PolarHBondContact O-N 3.23Å
148	T	83.6	Confident	81.2	Confident	62 Å²	62	50.7 Å²	50.7	38%	0.38	29%	0.292	S	S	.	.	H	α-helix	trans	-64.9	-39.5	176.6	53.8	0	0	0	0	111.3	V144 T145 V151 L152	V144-T148 HydrophobicContact CG1-CG2 4.33Å; V144-T148 WeakPolarHBondContact O-CG2 3.25Å; V144-T148 PolarHBondContact O-N 3.18Å; V144-T148 PolarHBondContact O-OG1 3.44Å; T145-T148 WeakPolarHBondContact CA-OG1 3.35Å; T145-T148 PolarHBondContact O-N 3.08Å; T145-T148 PolarHBondContact O-OG1 3.29Å; T148-V151 PolarHBondContact O-N 2.94Å; T148-L152 VanDerWaalsContact O-CB 3.23Å; T148-L152 WeakPolarHBondContact O-CB 3.2Å; T148-L152 PolarHBondContact O-N 3.33Å
149	L	78.9	Confident	79.9	Confident	6 Å²	6	53.4 Å²	53.4	3%	0.031	31%	0.308	C	S	.	.	H	α-helix	trans	-64.3	-41.1	173.4	-71.3	163.6	0	0	0	112	T145 K146 L147 L152 H153 L219 L220 L849 L857	T145-L149 HydrophobicContact CG2-CD1 4.1Å; T145-L149 WeakPolarHBondContact O-CB 3.43Å; T145-L149 WeakPolarHBondContact O-CD1 3.44Å; T145-L149 VanDerWaalsContact O-CG 3.25Å; T145-L149 WeakPolarHBondContact O-CG 3.45Å; T145-L149 PolarHBondContact O-N 2.73Å; K146-L149 PolarHBondContact O-N 3.49Å; L147-L149 VanDerWaalsContact C-N 3.33Å; L149-L152 PolarHBondContact O-N 3.49Å; L149-H153 WeakPolarHBondContact O-CB 3.27Å; L149-H153 PolarHBondContact O-N 3.4Å; L149-L219 HydrophobicContact CB-CD2 3.46Å; L149-L219 VanDerWaalsContact CB-CD2 3.46Å; L149-L219 HydrophobicContact CB-CG 4.29Å; L149-L219 HydrophobicContact CD1-CD2 4.28Å; L149-L219 HydrophobicContact CG-CD2 4.48Å; L149-L220 HydrophobicContact CD1-CD1 3.37Å; L149-L220 HydrophobicContact CD1-CD2 4.23Å; L149-L220 HydrophobicContact CD1-CG 3.53Å; L149-L220 HydrophobicContact CD2-CG 4.47Å; L149-L849 HydrophobicContact CD2-CD2 4.19Å; L149-L857 HydrophobicContact CD1-CD2 4.43Å; L149-L857 HydrophobicContact CD2-CD1 4.03Å; L149-L857 HydrophobicContact CD2-CD2 4.17Å; L149-L857 HydrophobicContact CG-CD1 4.17Å; L149-L857 HydrophobicContact CG-CD2 4.32Å
150	L	79.6	Confident	78.8	Confident	56 Å²	56	59.3 Å²	59.3	29%	0.293	35%	0.347	S	S	.	.	H	α-helix	trans	-62.4	-45.6	174.9	-179.8	66.7	0	0	0	111.6	K146 L147 H153 L154 M161 L169	K146-L150 WeakPolarHBondContact O-CB 3.45Å; K146-L150 PolarHBondContact O-N 2.68Å; L147-L150 HydrophobicContact CD1-CD2 4.47Å; L147-L150 PolarHBondContact O-N 3.33Å; L150-H153 PolarHBondContact O-N 2.79Å; L150-L154 HydrophobicContact CG-CD1 4.26Å; L150-L154 WeakPolarHBondContact O-CG 3.49Å; L150-L154 PolarHBondContact O-N 3.32Å; L150-M161 HydrophobicContact CD1-SD 4.25Å; L150-L169 HydrophobicContact CB-CD2 4.4Å; L150-L169 HydrophobicContact CD1-CD2 4.27Å
151	V	82.7	Confident	77.7	Confident	73 Å²	73	57.4 Å²	57.4	44%	0.442	34%	0.337	S	S	.	.	H	α-helix	trans	-62.3	-45.4	177.6	169.5	0	0	0	0	110.6	L147 T148 H153 L154 T155	L147-V151 WeakPolarHBondContact O-CG2 3.37Å; L147-V151 PolarHBondContact O-N 3.23Å; T148-V151 PolarHBondContact O-N 2.94Å; V151-H153 VanDerWaalsContact C-N 3.28Å; V151-H153 PolarHBondContact O-N 2.96Å; V151-L154 PolarHBondContact O-N 2.9Å; V151-L154 VanDerWaalsContact O-N 3.12Å; V151-T155 HydrophobicContact CG1-CG2 4.25Å; V151-T155 WeakPolarHBondContact O-CG2 3.29Å; V151-T155 PolarHBondContact O-N 3.11Å; V151-T155 PolarHBondContact O-OG1 2.95Å; V151-T155 VanDerWaalsContact O-OG1 3.05Å
152	L	77.2	Confident	77	Confident	45 Å²	45	60.4 Å²	60.4	24%	0.236	35%	0.353	C	S	.	.	H	α-helix	trans	-64.6	-35.1	179.9	-168	62.3	0	0	0	111.9	T148 L149 T155 L156 L849	T148-L152 VanDerWaalsContact O-CB 3.23Å; T148-L152 WeakPolarHBondContact O-CB 3.2Å; T148-L152 PolarHBondContact O-N 3.33Å; L149-L152 PolarHBondContact O-N 3.49Å; L152-T155 PolarHBondContact O-OG1 3.13Å; L152-L156 HydrophobicContact CD1-CD1 3.99Å; L152-L156 HydrophobicContact CD1-CD2 4.12Å; L152-L156 PolarHBondContact O-N 3.35Å; L152-L156 VanDerWaalsContact O-N 3.14Å; L152-L849 HydrophobicContact CD1-CD1 4.35Å; L152-L849 HydrophobicContact CD2-CD1 3.39Å; L152-L849 HydrophobicContact CD2-CD2 3.46Å; L152-L849 VanDerWaalsContact CD2-CD2 3.46Å; L152-L849 HydrophobicContact CD2-CG 4.03Å; L152-L849 HydrophobicContact CG-CD1 3.48Å; L152-L849 VanDerWaalsContact CG-CD1 3.48Å; L152-L849 HydrophobicContact CG-CD2 4.32Å
153	H	72.8	Confident	76.6	Confident	32 Å²	32	65.2 Å²	65.2	15%	0.148	38%	0.384	C	S	.	.	H	α-helix	trans	-65.8	-43.4	170.8	-167.7	72.6	0	0	0	111.6	L149 L150 V151 T155 A157 M161 F848	L149-H153 WeakPolarHBondContact O-CB 3.27Å; L149-H153 PolarHBondContact O-N 3.4Å; L150-H153 PolarHBondContact O-N 2.79Å; V151-H153 VanDerWaalsContact C-N 3.28Å; V151-H153 PolarHBondContact O-N 2.96Å; H153-T155 PolarHBondContact O-N 3.2Å; H153-A157 WeakPolarHBondContact O-CA 3.41Å; H153-A157 WeakPolarHBondContact O-CB 3.46Å; H153-A157 PolarHBondContact O-N 2.88Å; H153-M161 VanDerWaalsContact CD2-SD 3.53Å; H153-M161 VanDerWaalsContact NE2-CB 3.28Å; H153-M161 WeakPolarHBondContact NE2-CB 3.48Å; H153-M161 WeakPolarHBondContact NE2-CG 3.42Å; H153-F848 HydrophobicContact CB-CD1 4.41Å; H153-F848 AromaticContact CE1-CD1 3.84Å; H153-F848 AromaticContact CE1-CG 3.78Å; H153-F848 AromaticContact ND1-CD1 3.17Å; H153-F848 WeakPolarHBondContact ND1-CD1 3.4Å; H153-F848 AromaticContact ND1-CG 3.57Å
154	L	76.6	Confident	76.2	Confident	128 Å²	128	68.6 Å²	68.6	67%	0.67	40%	0.4	S	S	*	.	H	α-helix	trans	-68.6	-30.6	178.7	-70	170.3	0	0	0	113.8	L150 V151	L150-L154 HydrophobicContact CG-CD1 4.26Å; L150-L154 WeakPolarHBondContact O-CG 3.49Å; L150-L154 PolarHBondContact O-N 3.32Å; V151-L154 PolarHBondContact O-N 2.9Å; V151-L154 VanDerWaalsContact O-N 3.12Å
155	T	76.4	Confident	75.5	Confident	94 Å²	94	67.7 Å²	67.7	58%	0.577	39%	0.39	S	S	*	.	H	α-helix	trans	-89.7	-37.4	-174.1	53.2	0	0	0	0	114	V151 L152 H153	V151-T155 HydrophobicContact CG1-CG2 4.25Å; V151-T155 WeakPolarHBondContact O-CG2 3.29Å; V151-T155 PolarHBondContact O-N 3.11Å; V151-T155 PolarHBondContact O-OG1 2.95Å; V151-T155 VanDerWaalsContact O-OG1 3.05Å; L152-T155 PolarHBondContact O-OG1 3.13Å; H153-T155 PolarHBondContact O-N 3.2Å
156	L	68.3	Low	75.2	Confident	102 Å²	102	68.5 Å²	68.5	53%	0.534	40%	0.401	S	S	.	.	H	α-helix	trans	-92.8	-22	178.4	-80.9	59.4	0	0	0	110.7	L152 S158 F848	L152-L156 HydrophobicContact CD1-CD1 3.99Å; L152-L156 HydrophobicContact CD1-CD2 4.12Å; L152-L156 PolarHBondContact O-N 3.35Å; L152-L156 VanDerWaalsContact O-N 3.14Å; L156-S158 PolarHBondContact O-N 3.15Å; L156-F848 HydrophobicContact CB-CE1 3.68Å; L156-F848 HydrophobicContact CB-CZ 3.48Å; L156-F848 VanDerWaalsContact CB-CZ 3.48Å; L156-F848 WeakPolarHBondContact O-CE2 3.45Å; L156-F848 WeakPolarHBondContact O-CZ 3.28Å
157	A	63.3	Low	75.1	Confident	36 Å²	36	73.3 Å²	73.3	30%	0.298	43%	0.431	S	S	.	.			trans	-20.9	96	171.5	0	0	0	0	0	118.5	H153 T159 F848	H153-A157 WeakPolarHBondContact O-CA 3.41Å; H153-A157 WeakPolarHBondContact O-CB 3.46Å; H153-A157 PolarHBondContact O-N 2.88Å; A157-T159 WeakPolarHBondContact CB-O 3.23Å; A157-F848 HydrophobicContact CB-CD1 3.53Å; A157-F848 HydrophobicContact CB-CD2 3.22Å; A157-F848 HydrophobicContact CB-CE1 3.36Å; A157-F848 HydrophobicContact CB-CE2 3.08Å; A157-F848 HydrophobicContact CB-CG 3.55Å; A157-F848 HydrophobicContact CB-CZ 3.26Å
158	S	58.6	Low	75	Confident	101 Å²	101	71.1 Å²	71.1	71%	0.706	42%	0.419	S	S	*	.	S	Bend	trans	-85.7	-24.3	163.4	58.9	0	0	0	0	112.8	L156	L156-S158 PolarHBondContact O-N 3.15Å
159	T	63.6	Low	74.9	Confident	63 Å²	63	68.9 Å²	68.9	39%	0.387	41%	0.405	S	S	.	.	S	Bend	trans	-117.2	143	178	53.6	0	0	0	0	111.7	A157	A157-T159 WeakPolarHBondContact CB-O 3.23Å
160	P	67.3	Low	75.2	Confident	124 Å²	124	70.5 Å²	70.5	81%	0.805	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-69.5	138.7	177	28.1	-32.8	0	0	0	111.2
161	M	68.8	Low	75.6	Confident	47 Å²	47	74 Å²	74	23%	0.232	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-61.6	136.8	179.9	-164.8	163.1	171.4	0	0	112.3	L150 H153 K165 L169 L219	L150-M161 HydrophobicContact CD1-SD 4.25Å; H153-M161 VanDerWaalsContact CD2-SD 3.53Å; H153-M161 VanDerWaalsContact NE2-CB 3.28Å; H153-M161 WeakPolarHBondContact NE2-CB 3.48Å; H153-M161 WeakPolarHBondContact NE2-CG 3.42Å; M161-K165 HydrophobicContact CE-CB 3.88Å; M161-L169 HydrophobicContact CE-CD2 4.38Å; M161-L219 HydrophobicContact CE-CD1 3.3Å; M161-L219 HydrophobicContact SD-CD1 4.31Å
162	D	76.3	Confident	75.8	Confident	82 Å²	82	71.4 Å²	71.4	44%	0.439	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-55.7	128.5	172.5	-65.8	-41.4	0	0	0	110.4	I164 K165 G166	D162-I164 PolarHBondContact O-N 2.87Å; D162-I164 VanDerWaalsContact O-N 3.14Å; D162-K165 HydrophobicContact CB-CB 4.23Å; D162-K165 HydrophobicContact CB-CD 4.01Å; D162-K165 HydrophobicContact CB-CG 4.03Å; D162-K165 PolarHBondContact O-N 3.02Å; D162-K165 VanDerWaalsContact O-N 3.09Å; D162-K165 WeakPolarHBondContact OD2-CD 3.46Å; D162-K165 VanDerWaalsContact OD2-CE 3.27Å; D162-K165 WeakPolarHBondContact OD2-CE 3.46Å; D162-K165 IonicContact OD2-NZ 3.1Å; D162-K165 PolarHBondContact OD2-NZ 3.29Å; D162-G166 PolarHBondContact O-N 2.97Å; D162-G166 VanDerWaalsContact O-N 3.11Å
163	P	79.8	Confident	76.3	Confident	102 Å²	102	70.7 Å²	70.7	66%	0.662	42%	0.416	S	S	*	.	H	α-helix	trans	-61.5	-30.5	-174.8	22.9	-33	0	0	0	112.3	T167	P163-T167 WeakPolarHBondContact O-CB 3.45Å; P163-T167 PolarHBondContact O-N 2.8Å; P163-T167 PolarHBondContact O-OG1 2.84Å
164	I	80.4	Confident	77.1	Confident	102 Å²	102	70.8 Å²	70.8	52%	0.523	43%	0.426	S	S	.	.	H	α-helix	trans	-68.1	-45.3	177.9	-60.3	172.9	0	0	0	110.8	D162 G166 T167 L168 Y217	D162-I164 PolarHBondContact O-N 2.87Å; D162-I164 VanDerWaalsContact O-N 3.14Å; I164-G166 VanDerWaalsContact C-N 3.35Å; I164-G166 PolarHBondContact O-N 2.88Å; I164-T167 PolarHBondContact O-N 3.42Å; I164-L168 VanDerWaalsContact O-CB 3.31Å; I164-L168 WeakPolarHBondContact O-CB 3.38Å; I164-L168 PolarHBondContact O-N 2.8Å; I164-Y217 HydrophobicContact CG2-CD1 3.91Å; I164-Y217 HydrophobicContact CG2-CE1 3.99Å
165	K	76.3	Confident	77.8	Confident	53 Å²	53	67 Å²	67	23%	0.23	41%	0.405	C	S	.	.	H	α-helix	trans	-62.5	-43.3	177.7	-68.8	178.5	-179.1	152	0	110.9	M161 D162 L169 G216 Y217	M161-K165 HydrophobicContact CE-CB 3.88Å; D162-K165 HydrophobicContact CB-CB 4.23Å; D162-K165 HydrophobicContact CB-CD 4.01Å; D162-K165 HydrophobicContact CB-CG 4.03Å; D162-K165 PolarHBondContact O-N 3.02Å; D162-K165 VanDerWaalsContact O-N 3.09Å; D162-K165 WeakPolarHBondContact OD2-CD 3.46Å; D162-K165 VanDerWaalsContact OD2-CE 3.27Å; D162-K165 WeakPolarHBondContact OD2-CE 3.46Å; D162-K165 IonicContact OD2-NZ 3.1Å; D162-K165 PolarHBondContact OD2-NZ 3.29Å; K165-L169 WeakPolarHBondContact O-CB 3.41Å; K165-L169 PolarHBondContact O-N 3.24Å; K165-G216 WeakPolarHBondContact CE-O 3.12Å; K165-Y217 HydrophobicContact CG-CD1 4.3Å
166	G	78.3	Confident	78.4	Confident	28 Å²	28	62.5 Å²	62.5	29%	0.289	38%	0.378	S	S	.	.	H	α-helix	trans	-65.3	-43.6	178.8	0	0	0	0	0	112.8	D162 I164 L169 G170	D162-G166 PolarHBondContact O-N 2.97Å; D162-G166 VanDerWaalsContact O-N 3.11Å; I164-G166 VanDerWaalsContact C-N 3.35Å; I164-G166 PolarHBondContact O-N 2.88Å; G166-L169 PolarHBondContact O-N 3.43Å; G166-G170 PolarHBondContact O-N 2.86Å
167	T	83	Confident	79.5	Confident	104 Å²	104	61.3 Å²	61.3	64%	0.638	38%	0.375	S	S	*	.	H	α-helix	trans	-64.7	-43.3	178.7	-53.9	0	0	0	0	111.5	P163 I164 G170 F171	P163-T167 WeakPolarHBondContact O-CB 3.45Å; P163-T167 PolarHBondContact O-N 2.8Å; P163-T167 PolarHBondContact O-OG1 2.84Å; I164-T167 PolarHBondContact O-N 3.42Å; T167-G170 PolarHBondContact O-N 2.87Å; T167-F171 WeakPolarHBondContact O-CB 3.48Å; T167-F171 PolarHBondContact O-N 3.04Å
168	L	82.9	Confident	80.9	Confident	54 Å²	54	63.7 Å²	63.7	28%	0.283	39%	0.386	S	S	.	.	H	α-helix	trans	-66.3	-41.4	179.8	-168.9	124.6	0	0	0	111.8	I164 F171 F172 A212	I164-L168 VanDerWaalsContact O-CB 3.31Å; I164-L168 WeakPolarHBondContact O-CB 3.38Å; I164-L168 PolarHBondContact O-N 2.8Å; L168-F171 PolarHBondContact O-N 3.2Å; L168-F172 HydrophobicContact CD1-CE2 4.21Å; L168-F172 HydrophobicContact CD2-CD2 3.88Å; L168-F172 HydrophobicContact CD2-CE2 3.62Å; L168-F172 HydrophobicContact CG-CD2 3.98Å; L168-F172 HydrophobicContact CG-CE2 3.62Å; L168-F172 WeakPolarHBondContact O-CD2 3.33Å; L168-F172 PolarHBondContact O-N 3Å; L168-F172 VanDerWaalsContact O-N 3.14Å; L168-A212 HydrophobicContact CD1-CB 4.41Å; L168-A212 HydrophobicContact CD2-CB 3.65Å
169	L	82.2	Confident	82.4	Confident	15 Å²	15	59.5 Å²	59.5	8%	0.079	36%	0.355	C	S	.	.	H	α-helix	trans	-61.7	-46.2	173.6	-175.6	71.6	0	0	0	112.1	K146 L150 M161 K165 G166 F171 F172 T173 L219	K146-L169 HydrophobicContact CB-CD1 4.05Å; K146-L169 HydrophobicContact CD-CD1 4.11Å; K146-L169 HydrophobicContact CG-CD1 3.99Å; L150-L169 HydrophobicContact CB-CD2 4.4Å; L150-L169 HydrophobicContact CD1-CD2 4.27Å; M161-L169 HydrophobicContact CE-CD2 4.38Å; K165-L169 WeakPolarHBondContact O-CB 3.41Å; K165-L169 PolarHBondContact O-N 3.24Å; G166-L169 PolarHBondContact O-N 3.43Å; L169-F171 VanDerWaalsContact C-N 3.31Å; L169-F171 PolarHBondContact O-N 3.13Å; L169-F172 PolarHBondContact O-N 2.72Å; L169-T173 WeakPolarHBondContact O-CB 3.33Å; L169-T173 WeakPolarHBondContact O-CG2 3.29Å; L169-T173 PolarHBondContact O-N 2.93Å; L169-T173 PolarHBondContact O-OG1 3.25Å; L169-L219 HydrophobicContact CD1-CD2 3.97Å; L169-L219 HydrophobicContact CD2-CD1 4.32Å; L169-L219 HydrophobicContact CD2-CD2 3.59Å; L169-L219 HydrophobicContact CG-CD2 4.43Å
170	G	84.8	Confident	83.6	Confident	40 Å²	40	57.3 Å²	57.3	41%	0.412	34%	0.342	S	S	.	.	H	α-helix	trans	-60.9	-37.7	176.4	0	0	0	0	0	113.1	G166 T167 T173 G174	G166-G170 PolarHBondContact O-N 2.86Å; T167-G170 PolarHBondContact O-N 2.87Å; G170-T173 VanDerWaalsContact CA-OG1 3.31Å; G170-T173 WeakPolarHBondContact CA-OG1 3.47Å; G170-T173 PolarHBondContact O-OG1 3.46Å; G170-G174 PolarHBondContact O-N 2.99Å
171	F	88.6	Confident	84.6	Confident	129 Å²	129	54 Å²	54	57%	0.566	33%	0.325	S	S	*	.	H	α-helix	trans	-66.6	-49.6	177.5	179.1	-103.5	0	0	0	112.5	T167 L168 L169 G174 I175	T167-F171 WeakPolarHBondContact O-CB 3.48Å; T167-F171 PolarHBondContact O-N 3.04Å; L168-F171 PolarHBondContact O-N 3.2Å; L169-F171 VanDerWaalsContact C-N 3.31Å; L169-F171 PolarHBondContact O-N 3.13Å; F171-G174 PolarHBondContact O-N 3.39Å; F171-I175 HydrophobicContact CD1-CD1 3.89Å; F171-I175 HydrophobicContact CE1-CD1 3.34Å; F171-I175 HydrophobicContact CE1-CG1 4.43Å; F171-I175 HydrophobicContact CE2-CD1 4.29Å; F171-I175 HydrophobicContact CZ-CD1 3.58Å; F171-I175 HydrophobicContact CZ-CG1 4.41Å; F171-I175 PolarHBondContact O-N 2.89Å
172	F	87.2	Confident	85.5	Confident	19 Å²	19	55.8 Å²	55.8	8%	0.083	34%	0.335	C	S	.	.	H	α-helix	trans	-67.4	-40	-179.6	-73.8	-60.3	0	0	0	112.8	L168 L169 G174 I175 E176 A205 T208 Q209	L168-F172 HydrophobicContact CD1-CE2 4.21Å; L168-F172 HydrophobicContact CD2-CD2 3.88Å; L168-F172 HydrophobicContact CD2-CE2 3.62Å; L168-F172 HydrophobicContact CG-CD2 3.98Å; L168-F172 HydrophobicContact CG-CE2 3.62Å; L168-F172 WeakPolarHBondContact O-CD2 3.33Å; L168-F172 PolarHBondContact O-N 3Å; L168-F172 VanDerWaalsContact O-N 3.14Å; L169-F172 PolarHBondContact O-N 2.72Å; F172-G174 VanDerWaalsContact C-N 3.31Å; F172-G174 PolarHBondContact O-N 2.67Å; F172-I175 HydrophobicContact CD1-CD1 4.42Å; F172-I175 PolarHBondContact O-N 3.03Å; F172-E176 PolarHBondContact O-N 3.36Å; F172-E176 VanDerWaalsContact O-N 3.1Å; F172-A205 HydrophobicContact CD1-CB 4.36Å; F172-T208 WeakPolarHBondContact CE1-OG1 3.34Å; F172-T208 WeakPolarHBondContact CZ-OG1 3.5Å; F172-Q209 HydrophobicContact CD2-CB 4.47Å
173	T	87.6	Confident	86	Confident	30 Å²	30	52 Å²	52	18%	0.184	32%	0.315	C	S	.	.	H	α-helix	trans	-61	-40.4	171.9	49	0	0	0	0	111.8	K146 L169 G170 I175 E176 V177	K146-T173 HydrophobicContact CB-CG2 3.77Å; K146-T173 HydrophobicContact CD-CG2 3.49Å; K146-T173 VanDerWaalsContact CD-CG2 3.49Å; K146-T173 HydrophobicContact CG-CG2 4.26Å; L169-T173 WeakPolarHBondContact O-CB 3.33Å; L169-T173 WeakPolarHBondContact O-CG2 3.29Å; L169-T173 PolarHBondContact O-N 2.93Å; L169-T173 PolarHBondContact O-OG1 3.25Å; G170-T173 VanDerWaalsContact CA-OG1 3.31Å; G170-T173 WeakPolarHBondContact CA-OG1 3.47Å; G170-T173 PolarHBondContact O-OG1 3.46Å; T173-I175 PolarHBondContact O-N 3Å; T173-E176 PolarHBondContact O-N 3.23Å; T173-V177 WeakPolarHBondContact O-CG2 3.21Å; T173-V177 PolarHBondContact O-N 2.87Å
174	G	89.8	Confident	86.3	Confident	33 Å²	33	51.5 Å²	51.5	34%	0.34	31%	0.31	S	S	.	.	H	α-helix	trans	-59.7	-44.8	174.4	0	0	0	0	0	112.9	G170 F171 F172 E176 V177 V178	G170-G174 PolarHBondContact O-N 2.99Å; F171-G174 PolarHBondContact O-N 3.39Å; F172-G174 VanDerWaalsContact C-N 3.31Å; F172-G174 PolarHBondContact O-N 2.67Å; G174-E176 PolarHBondContact O-N 3.41Å; G174-V177 PolarHBondContact O-N 2.94Å; G174-V178 VanDerWaalsContact O-CG2 3.31Å; G174-V178 WeakPolarHBondContact O-CG2 3.17Å; G174-V178 PolarHBondContact O-N 3.25Å
175	I	90.4	Very high	86.4	Confident	48 Å²	48	52.2 Å²	52.2	25%	0.246	32%	0.319	C	S	.	.	H	α-helix	trans	-58.6	-47.1	175.7	-71.4	172.1	0	0	0	111	F171 F172 T173 V177 V178 I179 A205	F171-I175 HydrophobicContact CD1-CD1 3.89Å; F171-I175 HydrophobicContact CE1-CD1 3.34Å; F171-I175 HydrophobicContact CE1-CG1 4.43Å; F171-I175 HydrophobicContact CE2-CD1 4.29Å; F171-I175 HydrophobicContact CZ-CD1 3.58Å; F171-I175 HydrophobicContact CZ-CG1 4.41Å; F171-I175 PolarHBondContact O-N 2.89Å; F172-I175 HydrophobicContact CD1-CD1 4.42Å; F172-I175 PolarHBondContact O-N 3.03Å; T173-I175 PolarHBondContact O-N 3Å; I175-V177 PolarHBondContact O-N 3.32Å; I175-V178 PolarHBondContact O-N 3.25Å; I175-I179 HydrophobicContact CG2-CD1 3.74Å; I175-I179 HydrophobicContact CG2-CG1 4.43Å; I175-I179 VanDerWaalsContact O-CG1 3.28Å; I175-I179 WeakPolarHBondContact O-CG1 3.36Å; I175-I179 PolarHBondContact O-N 3.48Å; I175-A205 HydrophobicContact CG2-CB 4.42Å
176	E	89.3	Confident	86.6	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62.8	-41.3	-179.5	-76.5	159.4	-173.2	0	0	112.7	V143 K146 F172 T173 G174 I179 C180	V143-E176 HydrophobicContact CG2-CB 3.7Å; K146-E176 IonicContact NZ-OE1 2.77Å; K146-E176 PolarHBondContact NZ-OE1 3.18Å; K146-E176 IonicContact NZ-OE2 3.88Å; K146-E176 PolarHBondContact NZ-OE2 3.05Å; F172-E176 PolarHBondContact O-N 3.36Å; F172-E176 VanDerWaalsContact O-N 3.1Å; T173-E176 PolarHBondContact O-N 3.23Å; G174-E176 PolarHBondContact O-N 3.41Å; E176-I179 PolarHBondContact O-N 2.92Å; E176-C180 PolarHBondContact O-N 2.8Å; E176-C180 PolarHBondContact O-SG 3.47Å
177	V	91.8	Very high	86.3	Confident	78 Å²	78	60.8 Å²	60.8	47%	0.473	35%	0.345	S	S	.	.	H	α-helix	trans	-64.1	-42.3	175.7	172.5	0	0	0	0	111.1	V143 T173 G174 I175 I179 C180 A181	V143-V177 HydrophobicContact CG1-CG2 4.31Å; V143-V177 HydrophobicContact CG2-CG2 4.18Å; T173-V177 WeakPolarHBondContact O-CG2 3.21Å; T173-V177 PolarHBondContact O-N 2.87Å; G174-V177 PolarHBondContact O-N 2.94Å; I175-V177 PolarHBondContact O-N 3.32Å; V177-I179 VanDerWaalsContact C-N 3.35Å; V177-I179 PolarHBondContact O-N 3Å; V177-C180 WeakPolarHBondContact O-CB 3.5Å; V177-C180 PolarHBondContact O-N 3.24Å; V177-A181 PolarHBondContact O-N 2.93Å
178	V	91.9	Very high	85.4	Confident	86 Å²	86	62.7 Å²	62.7	52%	0.521	35%	0.351	S	S	.	.	H	α-helix	trans	-62.4	-42.7	175.8	170.6	0	0	0	0	110.9	G174 I175 C180 A181 L182	G174-V178 VanDerWaalsContact O-CG2 3.31Å; G174-V178 WeakPolarHBondContact O-CG2 3.17Å; G174-V178 PolarHBondContact O-N 3.25Å; I175-V178 PolarHBondContact O-N 3.25Å; V178-C180 PolarHBondContact O-N 3.18Å; V178-A181 PolarHBondContact O-N 2.66Å; V178-L182 HydrophobicContact CG1-CD1 3.9Å; V178-L182 HydrophobicContact CG1-CG 4.31Å; V178-L182 WeakPolarHBondContact O-CB 3.3Å; V178-L182 VanDerWaalsContact O-CG 3.29Å; V178-L182 WeakPolarHBondContact O-CG 3.43Å; V178-L182 PolarHBondContact O-N 3.41Å
179	I	89.6	Confident	84.5	Confident	13 Å²	13	62.8 Å²	62.8	7%	0.067	35%	0.353	C	S	.	.	H	α-helix	trans	-61.4	-45.2	176	-66.1	164.6	0	0	0	110.5	I175 E176 V177 A181 L182 V183 V201	I175-I179 HydrophobicContact CG2-CD1 3.74Å; I175-I179 HydrophobicContact CG2-CG1 4.43Å; I175-I179 VanDerWaalsContact O-CG1 3.28Å; I175-I179 WeakPolarHBondContact O-CG1 3.36Å; I175-I179 PolarHBondContact O-N 3.48Å; E176-I179 PolarHBondContact O-N 2.92Å; V177-I179 VanDerWaalsContact C-N 3.35Å; V177-I179 PolarHBondContact O-N 3Å; I179-A181 PolarHBondContact O-N 2.82Å; I179-L182 PolarHBondContact O-N 2.9Å; I179-V183 HydrophobicContact CG2-CG2 4.31Å; I179-V183 VanDerWaalsContact O-CG2 3.3Å; I179-V183 WeakPolarHBondContact O-CG2 3.33Å; I179-V183 PolarHBondContact O-N 3.33Å; I179-V201 HydrophobicContact CD1-CB 4.41Å; I179-V201 HydrophobicContact CD1-CG1 3.76Å; I179-V201 HydrophobicContact CG1-CG1 4.47Å
180	C	89.4	Confident	83.4	Confident	17 Å²	17	68.3 Å²	68.3	12%	0.115	39%	0.388	C	S	.	.	H	α-helix	trans	-55.9	-49.3	174.7	-79	0	0	0	0	112	N139 E176 V177 V178 L182 V183 V184	N139-C180 WeakPolarHBondContact CB-SG 3.36Å; E176-C180 PolarHBondContact O-N 2.8Å; E176-C180 PolarHBondContact O-SG 3.47Å; V177-C180 WeakPolarHBondContact O-CB 3.5Å; V177-C180 PolarHBondContact O-N 3.24Å; V178-C180 PolarHBondContact O-N 3.18Å; C180-L182 PolarHBondContact O-N 3.14Å; C180-V183 PolarHBondContact O-N 3.37Å; C180-V184 VanDerWaalsContact O-CG2 3.32Å; C180-V184 WeakPolarHBondContact O-CG2 3.25Å; C180-V184 PolarHBondContact O-N 3.14Å
181	A	88.5	Confident	82.6	Confident	53 Å²	53	69.5 Å²	69.5	44%	0.438	39%	0.39	S	S	.	.	H	α-helix	trans	-60.7	-45.5	179	0	0	0	0	0	111.6	V177 V178 I179 V183 V184 V185	V177-A181 PolarHBondContact O-N 2.93Å; V178-A181 PolarHBondContact O-N 2.66Å; I179-A181 PolarHBondContact O-N 2.82Å; A181-V183 PolarHBondContact O-N 2.95Å; A181-V184 PolarHBondContact O-N 3.31Å; A181-V185 WeakPolarHBondContact O-CB 3.46Å; A181-V185 VanDerWaalsContact O-CG2 3.22Å; A181-V185 WeakPolarHBondContact O-CG2 3.49Å; A181-V185 PolarHBondContact O-N 3.18Å
182	L	88.1	Confident	81.8	Confident	85 Å²	85	65.6 Å²	65.6	45%	0.445	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-41.7	179	-72.8	172.9	0	0	0	112.7	V178 I179 C180 R186	V178-L182 HydrophobicContact CG1-CD1 3.9Å; V178-L182 HydrophobicContact CG1-CG 4.31Å; V178-L182 WeakPolarHBondContact O-CB 3.3Å; V178-L182 VanDerWaalsContact O-CG 3.29Å; V178-L182 WeakPolarHBondContact O-CG 3.43Å; V178-L182 PolarHBondContact O-N 3.41Å; I179-L182 PolarHBondContact O-N 2.9Å; C180-L182 PolarHBondContact O-N 3.14Å; L182-R186 WeakPolarHBondContact O-CB 3.33Å; L182-R186 PolarHBondContact O-N 2.93Å; L182-R186 VanDerWaalsContact O-N 3.11Å
183	V	86.1	Confident	81.3	Confident	3 Å²	3	67.6 Å²	67.6	2%	0.018	39%	0.39	C	S	.	.	H	α-helix	trans	-69.1	-34.7	179.5	174	0	0	0	0	111.7	R132 V136 I179 C180 A181	R132-V183 HydrophobicContact CG-CG1 3.68Å; V136-V183 HydrophobicContact CG2-CB 4.01Å; V136-V183 HydrophobicContact CG2-CG1 3.57Å; I179-V183 HydrophobicContact CG2-CG2 4.31Å; I179-V183 VanDerWaalsContact O-CG2 3.3Å; I179-V183 WeakPolarHBondContact O-CG2 3.33Å; I179-V183 PolarHBondContact O-N 3.33Å; C180-V183 PolarHBondContact O-N 3.37Å; A181-V183 PolarHBondContact O-N 2.95Å
184	V	85.4	Confident	81.1	Confident	91 Å²	91	68.2 Å²	68.2	55%	0.552	39%	0.389	S	S	*	.	H	α-helix	trans	-74.4	-44.4	177.1	173	0	0	0	0	111.6	V136 C180 A181 R186 K187	V136-V184 HydrophobicContact CG1-CG2 4.29Å; V136-V184 HydrophobicContact CG2-CG2 4.22Å; C180-V184 VanDerWaalsContact O-CG2 3.32Å; C180-V184 WeakPolarHBondContact O-CG2 3.25Å; C180-V184 PolarHBondContact O-N 3.14Å; A181-V184 PolarHBondContact O-N 3.31Å; V184-R186 PolarHBondContact O-N 2.76Å; V184-K187 PolarHBondContact O-N 2.93Å
185	V	84.4	Confident	80.8	Confident	118 Å²	118	66.6 Å²	66.6	72%	0.715	37%	0.373	S	S	*	.	H	α-helix	trans	-67.4	-36.3	-178.2	171.3	0	0	0	0	111.6	A181 K187	A181-V185 WeakPolarHBondContact O-CB 3.46Å; A181-V185 VanDerWaalsContact O-CG2 3.22Å; A181-V185 WeakPolarHBondContact O-CG2 3.49Å; A181-V185 PolarHBondContact O-N 3.18Å; V185-K187 PolarHBondContact O-N 3.4Å; V185-K187 VanDerWaalsContact O-N 3.14Å
186	R	79.6	Confident	80.7	Confident	127 Å²	127	67.2 Å²	67.2	48%	0.479	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	32.9	179.2	-67.7	-150.9	167.7	106.2	0.6	114.1	L182 V184 D188 T189 Y194	L182-R186 WeakPolarHBondContact O-CB 3.33Å; L182-R186 PolarHBondContact O-N 2.93Å; L182-R186 VanDerWaalsContact O-N 3.11Å; V184-R186 PolarHBondContact O-N 2.76Å; R186-D188 VanDerWaalsContact C-N 3.28Å; R186-D188 PolarHBondContact O-N 3.47Å; R186-T189 HydrophobicContact CB-CG2 4.12Å; R186-T189 HydrophobicContact CG-CG2 4.26Å; R186-T189 PolarHBondContact O-OG1 2.87Å; R186-T189 VanDerWaalsContact O-OG1 3.09Å; R186-Y194 HydrophobicContact CB-CE1 4.27Å; R186-Y194 HydrophobicContact CB-CE2 4.25Å; R186-Y194 PolarHBondContact O-OH 3.15Å
187	K	71.1	Confident	80.6	Confident	134 Å²	134	75 Å²	75	58%	0.583	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-39	-178.5	-170.8	-174.5	173	-169.7	0	112.3	R132 V184 V185	R132-K187 VanDerWaalsContact NH1-CA 3.27Å; R132-K187 VanDerWaalsContact NH1-CG 3.33Å; R132-K187 PolarHBondContact NH1-O 3.42Å; R132-K187 PolarHBondContact NH2-O 3.21Å; V184-K187 PolarHBondContact O-N 2.93Å; V185-K187 PolarHBondContact O-N 3.4Å; V185-K187 VanDerWaalsContact O-N 3.14Å
188	D	64.8	Low	80.5	Confident	144 Å²	144	72 Å²	72	77%	0.77	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	4.1	-168.7	-53.4	-36.7	0	0	0	113.7	R186	R186-D188 VanDerWaalsContact C-N 3.28Å; R186-D188 PolarHBondContact O-N 3.47Å
189	T	64.8	Low	80.4	Confident	55 Å²	55	67.9 Å²	67.9	34%	0.337	36%	0.363	S	S	.	.			trans	-78.5	133	177.2	61.3	0	0	0	0	111.2	R186 S191 Y194	R186-T189 HydrophobicContact CB-CG2 4.12Å; R186-T189 HydrophobicContact CG-CG2 4.26Å; R186-T189 PolarHBondContact O-OG1 2.87Å; R186-T189 VanDerWaalsContact O-OG1 3.09Å; T189-S191 VanDerWaalsContact C-N 3.32Å; T189-S191 PolarHBondContact O-N 3.12Å; T189-Y194 VanDerWaalsContact OG1-CE1 3.26Å; T189-Y194 WeakPolarHBondContact OG1-CE1 3.23Å
190	T	57.9	Low	80.6	Confident	131 Å²	131	69.7 Å²	69.7	80%	0.804	37%	0.374	S	S	*	.	S	Bend	trans	-72.6	-15.6	-175.7	53.4	0	0	0	0	115	H192	T190-H192 PolarHBondContact O-N 3.09Å
191	S	68.4	Low	80.7	Confident	66 Å²	66	72.4 Å²	72.4	46%	0.462	39%	0.39	S	S	.	.			trans	-83.4	115	175.8	-178.5	0	0	0	0	110.4	T189 Y194	T189-S191 VanDerWaalsContact C-N 3.32Å; T189-S191 PolarHBondContact O-N 3.12Å; S191-Y194 WeakPolarHBondContact O-CD1 3.39Å; S191-Y194 WeakPolarHBondContact O-CE1 3.38Å
192	H	70.9	Confident	80.8	Confident	46 Å²	46	69.9 Å²	69.9	21%	0.213	37%	0.369	C	S	.	.			trans	-87	-8.2	177	-71.4	-91.7	0	0	0	113.6	L128 T190 Y194 L195	L128-H192 HydrophobicContact CB-CB 4.27Å; L128-H192 HydrophobicContact CD1-CB 3.81Å; T190-H192 PolarHBondContact O-N 3.09Å; H192-Y194 VanDerWaalsContact C-N 3.25Å; H192-Y194 PolarHBondContact O-N 3.17Å; H192-L195 PolarHBondContact O-N 2.65Å
193	S	76.9	Confident	81.1	Confident	61 Å²	61	67.9 Å²	67.9	43%	0.427	36%	0.356	S	S	.	.	H	α-helix	trans	-62.8	-29.1	-177.7	-59.8	0	0	0	0	113.1	L195 Q196 Y197	S193-L195 PolarHBondContact O-N 3.48Å; S193-Q196 PolarHBondContact O-N 2.83Å; S193-Y197 WeakPolarHBondContact O-CD2 3.3Å; S193-Y197 PolarHBondContact O-N 2.76Å
194	Y	83.4	Confident	81.4	Confident	43 Å²	43	70.9 Å²	70.9	17%	0.169	37%	0.374	C	S	.	.	H	α-helix	trans	-63.2	-27.3	177.9	79.9	-98.3	0	0	0	113.1	R132 R186 T189 S191 H192 Q196 Y197 S198	R132-Y194 PolarHBondContact NE-OH 2.82Å; R132-Y194 PolarHBondContact NH2-OH 2.98Å; R186-Y194 HydrophobicContact CB-CE1 4.27Å; R186-Y194 HydrophobicContact CB-CE2 4.25Å; R186-Y194 PolarHBondContact O-OH 3.15Å; T189-Y194 VanDerWaalsContact OG1-CE1 3.26Å; T189-Y194 WeakPolarHBondContact OG1-CE1 3.23Å; S191-Y194 WeakPolarHBondContact O-CD1 3.39Å; S191-Y194 WeakPolarHBondContact O-CE1 3.38Å; H192-Y194 VanDerWaalsContact C-N 3.25Å; H192-Y194 PolarHBondContact O-N 3.17Å; Y194-Q196 VanDerWaalsContact C-N 3.34Å; Y194-Y197 PolarHBondContact O-N 3.08Å; Y194-S198 PolarHBondContact O-N 3.32Å; Y194-S198 PolarHBondContact O-OG 3.32Å
195	L	85.1	Confident	81.7	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-68.4	-36	178.8	-78.1	90.2	0	0	0	111.8	L128 R132 H192 S193 S198 G199 P239	L128-L195 HydrophobicContact CB-CD2 4.48Å; L128-L195 HydrophobicContact CD2-CB 4.34Å; L128-L195 WeakPolarHBondContact O-CD2 3.38Å; R132-L195 HydrophobicContact CB-CD2 3.6Å; R132-L195 HydrophobicContact CG-CD2 3.9Å; H192-L195 PolarHBondContact O-N 2.65Å; S193-L195 PolarHBondContact O-N 3.48Å; L195-S198 WeakPolarHBondContact CA-OG 3.41Å; L195-S198 PolarHBondContact O-N 3.04Å; L195-S198 PolarHBondContact O-OG 3.46Å; L195-G199 PolarHBondContact O-N 3.38Å; L195-P239 WeakPolarHBondContact O-CG 3.27Å
196	Q	87	Confident	81.9	Confident	60 Å²	60	61.3 Å²	61.3	28%	0.28	32%	0.317	S	S	.	.	H	α-helix	trans	-65.1	-46.7	175.8	-67.7	179.1	-25.7	0	0	109.9	L128 S193 Y194 S198 G199 V200	L128-Q196 HydrophobicContact CD1-CG 4.04Å; L128-Q196 HydrophobicContact CD2-CG 3.59Å; L128-Q196 HydrophobicContact CG-CG 4.48Å; S193-Q196 PolarHBondContact O-N 2.83Å; Y194-Q196 VanDerWaalsContact C-N 3.34Å; Q196-S198 PolarHBondContact O-N 3.25Å; Q196-G199 PolarHBondContact O-N 3.5Å; Q196-G199 VanDerWaalsContact O-N 3.15Å; Q196-V200 WeakPolarHBondContact O-CG2 3.45Å; Q196-V200 PolarHBondContact O-N 3.45Å
197	Y	88.4	Confident	82.3	Confident	164 Å²	164	55.7 Å²	55.7	64%	0.643	30%	0.297	S	S	*	.	H	α-helix	trans	-62.1	-40.8	175.4	-64.2	-63.3	0	0	0	112.4	S193 Y194 G199 V200 V201	S193-Y197 WeakPolarHBondContact O-CD2 3.3Å; S193-Y197 PolarHBondContact O-N 2.76Å; Y194-Y197 PolarHBondContact O-N 3.08Å; Y197-G199 VanDerWaalsContact C-N 3.26Å; Y197-G199 PolarHBondContact O-N 3.21Å; Y197-V200 PolarHBondContact O-N 3.44Å; Y197-V201 VanDerWaalsContact O-CG2 3.29Å; Y197-V201 WeakPolarHBondContact O-CG2 3.41Å; Y197-V201 PolarHBondContact O-N 3.2Å
198	S	89	Confident	83.1	Confident	15 Å²	15	51.9 Å²	51.9	11%	0.105	29%	0.285	C	S	.	.	H	α-helix	trans	-62	-35.9	175.3	65	0	0	0	0	112.2	Y194 L195 Q196 T202	Y194-S198 PolarHBondContact O-N 3.32Å; Y194-S198 PolarHBondContact O-OG 3.32Å; L195-S198 WeakPolarHBondContact CA-OG 3.41Å; L195-S198 PolarHBondContact O-N 3.04Å; L195-S198 PolarHBondContact O-OG 3.46Å; Q196-S198 PolarHBondContact O-N 3.25Å; S198-T202 WeakPolarHBondContact O-CB 3.49Å; S198-T202 PolarHBondContact O-N 3.24Å; S198-T202 PolarHBondContact O-OG1 3.31Å
199	G	90.1	Very high	84.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-64.9	-44	173.7	0	0	0	0	0	112.6	L195 Q196 Y197 T202 W203	L195-G199 PolarHBondContact O-N 3.38Å; Q196-G199 PolarHBondContact O-N 3.5Å; Q196-G199 VanDerWaalsContact O-N 3.15Å; Y197-G199 VanDerWaalsContact C-N 3.26Å; Y197-G199 PolarHBondContact O-N 3.21Å; G199-T202 PolarHBondContact O-N 3.19Å; G199-W203 PolarHBondContact O-N 3.16Å
200	V	92.4	Very high	85	Confident	51 Å²	51	43.4 Å²	43.4	31%	0.309	24%	0.237	S	C	.	.	H	α-helix	trans	-64	-46.4	176.4	175.1	0	0	0	0	111.2	Q196 Y197 T202 W203 V204 L240	Q196-V200 WeakPolarHBondContact O-CG2 3.45Å; Q196-V200 PolarHBondContact O-N 3.45Å; Y197-V200 PolarHBondContact O-N 3.44Å; V200-T202 VanDerWaalsContact C-N 3.32Å; V200-T202 PolarHBondContact O-N 3.42Å; V200-W203 WeakPolarHBondContact O-CB 3.45Å; V200-W203 PolarHBondContact O-N 3.17Å; V200-V204 HydrophobicContact CG1-CG2 4.38Å; V200-V204 WeakPolarHBondContact O-CG2 3.37Å; V200-V204 PolarHBondContact O-N 3.48Å; V200-L240 HydrophobicContact CG2-CD2 3.64Å
201	V	91.9	Very high	86.3	Confident	73 Å²	73	40.2 Å²	40.2	44%	0.442	22%	0.215	S	C	.	.	H	α-helix	trans	-62.5	-41.4	179.1	176.5	0	0	0	0	111	I179 Y197 W203 V204 A205	I179-V201 HydrophobicContact CD1-CB 4.41Å; I179-V201 HydrophobicContact CD1-CG1 3.76Å; I179-V201 HydrophobicContact CG1-CG1 4.47Å; Y197-V201 VanDerWaalsContact O-CG2 3.29Å; Y197-V201 WeakPolarHBondContact O-CG2 3.41Å; Y197-V201 PolarHBondContact O-N 3.2Å; V201-W203 VanDerWaalsContact C-N 3.35Å; V201-W203 PolarHBondContact O-N 2.82Å; V201-V204 PolarHBondContact O-N 2.78Å; V201-A205 PolarHBondContact O-N 2.76Å
202	T	91.6	Very high	86.8	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.006	20%	0.198	C	C	.	.	H	α-helix	trans	-59.3	-46.1	173.9	-58.4	0	0	0	0	111.1	N139 S198 G199 V200 A205 M206 L238	N139-T202 PolarHBondContact ND2-OG1 3.43Å; N139-T202 WeakPolarHBondContact OD1-CG2 3.47Å; S198-T202 WeakPolarHBondContact O-CB 3.49Å; S198-T202 PolarHBondContact O-N 3.24Å; S198-T202 PolarHBondContact O-OG1 3.31Å; G199-T202 PolarHBondContact O-N 3.19Å; V200-T202 VanDerWaalsContact C-N 3.32Å; V200-T202 PolarHBondContact O-N 3.42Å; T202-A205 PolarHBondContact O-N 3.16Å; T202-M206 HydrophobicContact CG2-CE 4.15Å; T202-M206 WeakPolarHBondContact O-CG 3.48Å; T202-M206 PolarHBondContact O-N 3.05Å; T202-M206 VanDerWaalsContact O-N 3.1Å; T202-L238 HydrophobicContact CG2-CD2 3.93Å
203	W	93.9	Very high	86.9	Confident	42 Å²	42	36.5 Å²	36.5	16%	0.159	20%	0.196	C	C	.	.	H	α-helix	trans	-62.1	-43.4	176.5	167.5	72.2	0	0	0	112.6	G199 V200 V201 A205 M206 A207 T234 L238 A248 F251 T252	G199-W203 PolarHBondContact O-N 3.16Å; V200-W203 WeakPolarHBondContact O-CB 3.45Å; V200-W203 PolarHBondContact O-N 3.17Å; V201-W203 VanDerWaalsContact C-N 3.35Å; V201-W203 PolarHBondContact O-N 2.82Å; W203-A205 VanDerWaalsContact C-N 3.32Å; W203-A205 PolarHBondContact O-N 2.8Å; W203-M206 PolarHBondContact O-N 3.36Å; W203-A207 WeakPolarHBondContact O-CB 3.43Å; W203-A207 PolarHBondContact O-N 3.39Å; W203-T234 VanDerWaalsContact CD1-CG2 3.4Å; W203-T234 HydrophobicContact CG-CG2 4.31Å; W203-L238 HydrophobicContact CB-CD1 3.94Å; W203-A248 HydrophobicContact CD2-CB 4.06Å; W203-A248 HydrophobicContact CG-CB 4.3Å; W203-A248 HydrophobicContact CZ2-CB 3.95Å; W203-F251 AromaticContact CH2-CD1 3.88Å; W203-F251 HydrophobicContact CH2-CD1 3.88Å; W203-F251 HydrophobicContact CH2-CE1 4.36Å; W203-F251 HydrophobicContact CH2-CG 4.41Å; W203-F251 HydrophobicContact CZ2-CB 4.22Å; W203-F251 AromaticContact CZ2-CD1 3.67Å; W203-F251 HydrophobicContact CZ2-CD1 3.67Å; W203-F251 HydrophobicContact CZ2-CE1 4.46Å; W203-F251 HydrophobicContact CZ2-CG 4.25Å; W203-T252 HydrophobicContact CZ2-CG2 4.29Å; W203-T252 VanDerWaalsContact NE1-CG2 3.28Å
204	V	93.1	Very high	86.7	Confident	66 Å²	66	34.8 Å²	34.8	40%	0.4	19%	0.188	S	C	.	.	H	α-helix	trans	-59.3	-45.3	176.9	172.3	0	0	0	0	110.2	V200 V201 M206 A207 T208	V200-V204 HydrophobicContact CG1-CG2 4.38Å; V200-V204 WeakPolarHBondContact O-CG2 3.37Å; V200-V204 PolarHBondContact O-N 3.48Å; V201-V204 PolarHBondContact O-N 2.78Å; V204-M206 PolarHBondContact O-N 2.77Å; V204-A207 PolarHBondContact O-N 3.19Å; V204-T208 HydrophobicContact CG1-CG2 4.26Å; V204-T208 WeakPolarHBondContact O-CG2 3.48Å; V204-T208 PolarHBondContact O-N 2.87Å; V204-T208 PolarHBondContact O-OG1 3.16Å
205	A	90.3	Very high	86.2	Confident	5 Å²	5	37.7 Å²	37.7	4%	0.041	21%	0.206	C	C	.	.	H	α-helix	trans	-57.9	-46.5	177.8	0	0	0	0	0	112	F172 I175 V201 T202 W203 T208 Q209	F172-A205 HydrophobicContact CD1-CB 4.36Å; I175-A205 HydrophobicContact CG2-CB 4.42Å; V201-A205 PolarHBondContact O-N 2.76Å; T202-A205 PolarHBondContact O-N 3.16Å; W203-A205 VanDerWaalsContact C-N 3.32Å; W203-A205 PolarHBondContact O-N 2.8Å; A205-T208 WeakPolarHBondContact CA-OG1 3.34Å; A205-T208 PolarHBondContact O-N 2.96Å; A205-T208 PolarHBondContact O-OG1 3.49Å; A205-Q209 PolarHBondContact O-N 2.89Å
206	M	88.5	Confident	85.3	Confident	4 Å²	4	40 Å²	40	2%	0.02	23%	0.23	C	C	.	.	H	α-helix	trans	-63.9	-43.9	177.2	-59.1	-93.2	171.8	0	0	111.6	M138 D142 T202 W203 V204 Q209 I210 Y226 T230	M138-M206 HydrophobicContact CE-CE 4.02Å; M138-M206 HydrophobicContact CE-SD 4.36Å; D142-M206 HydrophobicContact CB-CE 3.67Å; D142-M206 WeakPolarHBondContact OD2-CE 3.22Å; T202-M206 HydrophobicContact CG2-CE 4.15Å; T202-M206 WeakPolarHBondContact O-CG 3.48Å; T202-M206 PolarHBondContact O-N 3.05Å; T202-M206 VanDerWaalsContact O-N 3.1Å; W203-M206 PolarHBondContact O-N 3.36Å; V204-M206 PolarHBondContact O-N 2.77Å; M206-Q209 WeakPolarHBondContact O-CB 3.26Å; M206-Q209 PolarHBondContact O-N 3.38Å; M206-I210 WeakPolarHBondContact O-CG1 3.5Å; M206-I210 PolarHBondContact O-N 3.13Å; M206-Y226 PolarHBondContact SD-OH 2.76Å; M206-T230 HydrophobicContact CB-CG2 3.82Å
207	A	89.3	Confident	84.3	Confident	8 Å²	8	42.4 Å²	42.4	7%	0.066	24%	0.237	C	C	.	.	H	α-helix	trans	-65.2	-39.5	178.5	0	0	0	0	0	112.4	W203 V204 Q209 I210 L211 T252	W203-A207 WeakPolarHBondContact O-CB 3.43Å; W203-A207 PolarHBondContact O-N 3.39Å; V204-A207 PolarHBondContact O-N 3.19Å; A207-Q209 VanDerWaalsContact C-N 3.29Å; A207-Q209 PolarHBondContact O-N 3.04Å; A207-I210 WeakPolarHBondContact O-CB 3.29Å; A207-I210 PolarHBondContact O-N 3.36Å; A207-L211 PolarHBondContact O-N 3.42Å; A207-L211 VanDerWaalsContact O-N 3.07Å; A207-T252 HydrophobicContact CB-CG2 4.09Å
208	T	87.7	Confident	83	Confident	54 Å²	54	35.9 Å²	35.9	33%	0.331	22%	0.219	S	C	.	.	H	α-helix	trans	-66.2	-33.2	174.4	47.4	0	0	0	0	112.1	F172 V204 A205 L211 A212	F172-T208 WeakPolarHBondContact CE1-OG1 3.34Å; F172-T208 WeakPolarHBondContact CZ-OG1 3.5Å; V204-T208 HydrophobicContact CG1-CG2 4.26Å; V204-T208 WeakPolarHBondContact O-CG2 3.48Å; V204-T208 PolarHBondContact O-N 2.87Å; V204-T208 PolarHBondContact O-OG1 3.16Å; A205-T208 WeakPolarHBondContact CA-OG1 3.34Å; A205-T208 PolarHBondContact O-N 2.96Å; A205-T208 PolarHBondContact O-OG1 3.49Å; T208-L211 PolarHBondContact O-N 3.15Å; T208-A212 PolarHBondContact O-N 3.19Å
209	Q	84.6	Confident	81.2	Confident	17 Å²	17	37.3 Å²	37.3	8%	0.079	23%	0.226	C	C	.	.	H	α-helix	trans	-70.7	-37	174.7	-175.1	171.3	-19.7	0	0	112.1	F172 A205 M206 A207 L211 A212 A213 Y226	F172-Q209 HydrophobicContact CD2-CB 4.47Å; A205-Q209 PolarHBondContact O-N 2.89Å; M206-Q209 WeakPolarHBondContact O-CB 3.26Å; M206-Q209 PolarHBondContact O-N 3.38Å; A207-Q209 VanDerWaalsContact C-N 3.29Å; A207-Q209 PolarHBondContact O-N 3.04Å; Q209-L211 VanDerWaalsContact C-N 3.31Å; Q209-L211 PolarHBondContact O-N 3.48Å; Q209-A212 PolarHBondContact O-N 3.36Å; Q209-A213 WeakPolarHBondContact O-CB 3.26Å; Q209-A213 PolarHBondContact O-N 2.84Å; Q209-Y226 HydrophobicContact CB-CE1 4.13Å; Q209-Y226 HydrophobicContact CG-CE1 3.96Å; Q209-Y226 PolarHBondContact OE1-OH 3.23Å
210	I	85.2	Confident	79.6	Confident	5 Å²	5	38.6 Å²	38.6	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-59.5	-43.9	171.2	-68.9	164.4	0	0	0	110.6	M206 A207 A213 G214 Y226 V227 T230 H256	M206-I210 WeakPolarHBondContact O-CG1 3.5Å; M206-I210 PolarHBondContact O-N 3.13Å; A207-I210 WeakPolarHBondContact O-CB 3.29Å; A207-I210 PolarHBondContact O-N 3.36Å; I210-A213 PolarHBondContact O-N 3.31Å; I210-G214 PolarHBondContact O-N 2.88Å; I210-Y226 HydrophobicContact CG1-CD1 3.76Å; I210-Y226 HydrophobicContact CG1-CE1 4.04Å; I210-V227 HydrophobicContact CD1-CG2 4.06Å; I210-V227 HydrophobicContact CG1-CG2 4.06Å; I210-V227 HydrophobicContact CG2-CG2 3.72Å; I210-T230 HydrophobicContact CD1-CG2 3.94Å; I210-H256 HydrophobicContact CG2-CB 4.33Å
211	L	84.1	Confident	78	Confident	64 Å²	64	38.6 Å²	38.6	34%	0.335	24%	0.243	S	C	.	.	H	α-helix	trans	-62.5	-44.1	176.8	-179.4	61.5	0	0	0	111.9	A207 T208 Q209 A213 G214 L215 L255 V259	A207-L211 PolarHBondContact O-N 3.42Å; A207-L211 VanDerWaalsContact O-N 3.07Å; T208-L211 PolarHBondContact O-N 3.15Å; Q209-L211 VanDerWaalsContact C-N 3.31Å; Q209-L211 PolarHBondContact O-N 3.48Å; L211-A213 VanDerWaalsContact C-N 3.3Å; L211-A213 PolarHBondContact O-N 2.83Å; L211-G214 PolarHBondContact O-N 2.67Å; L211-L215 HydrophobicContact CG-CD1 4.48Å; L211-L215 WeakPolarHBondContact O-CG 3.45Å; L211-L215 PolarHBondContact O-N 3.14Å; L211-L255 HydrophobicContact CB-CD2 4.29Å; L211-L255 HydrophobicContact CD1-CD1 4.28Å; L211-V259 HydrophobicContact CD1-CG2 3.57Å
212	A	79.1	Confident	76.6	Confident	12 Å²	12	38.8 Å²	38.8	10%	0.099	24%	0.242	C	C	.	.	H	α-helix	trans	-63	-37.2	176.2	0	0	0	0	0	112.1	L168 T208 Q209 L215 Y217	L168-A212 HydrophobicContact CD1-CB 4.41Å; L168-A212 HydrophobicContact CD2-CB 3.65Å; T208-A212 PolarHBondContact O-N 3.19Å; Q209-A212 PolarHBondContact O-N 3.36Å; A212-L215 PolarHBondContact O-N 3.3Å; A212-Y217 CarbonylContact O-C 3.58Å; A212-Y217 WeakPolarHBondContact O-CA 3.47Å; A212-Y217 WeakPolarHBondContact O-CB 3.32Å; A212-Y217 PolarHBondContact O-N 3.36Å
213	A	74.3	Confident	75.8	Confident	21 Å²	21	39.1 Å²	39.1	17%	0.174	25%	0.246	C	C	.	.	I	π-helix	trans	-64.5	-45.1	174.4	0	0	0	0	0	112.2	Q209 I210 L211 L215 G216	Q209-A213 WeakPolarHBondContact O-CB 3.26Å; Q209-A213 PolarHBondContact O-N 2.84Å; I210-A213 PolarHBondContact O-N 3.31Å; L211-A213 VanDerWaalsContact C-N 3.3Å; L211-A213 PolarHBondContact O-N 2.83Å; A213-L215 PolarHBondContact O-N 2.92Å; A213-G216 PolarHBondContact O-N 3.01Å
214	G	71.1	Confident	75.4	Confident	26 Å²	26	37.2 Å²	37.2	27%	0.268	24%	0.239	S	C	.	.	I	π-helix	trans	-60.6	-29.3	176.5	0	0	0	0	0	113.5	I210 L211 G216 I263	I210-G214 PolarHBondContact O-N 2.88Å; L211-G214 PolarHBondContact O-N 2.67Å; G214-G216 VanDerWaalsContact C-N 3.28Å; G214-G216 PolarHBondContact O-N 3.46Å; G214-I263 WeakPolarHBondContact O-CD1 3.36Å
215	L	72.8	Confident	75	Confident	103 Å²	103	34.5 Å²	34.5	54%	0.539	22%	0.224	S	C	.	.	I	π-helix	trans	-83.3	6	175.5	-67.3	170	0	0	0	114.2	L211 A212 A213 Y217	L211-L215 HydrophobicContact CG-CD1 4.48Å; L211-L215 WeakPolarHBondContact O-CG 3.45Å; L211-L215 PolarHBondContact O-N 3.14Å; A212-L215 PolarHBondContact O-N 3.3Å; A213-L215 PolarHBondContact O-N 2.92Å; L215-Y217 HydrophobicContact CB-CD2 4.01Å; L215-Y217 HydrophobicContact CB-CE2 4.41Å
216	G	66.3	Low	74.8	Confident	49 Å²	49	34.7 Å²	34.7	51%	0.505	22%	0.224	S	C	.	.	I	π-helix	trans	87.2	6.3	179.5	0	0	0	0	0	115.4	K165 A213 G214	K165-G216 WeakPolarHBondContact CE-O 3.12Å; A213-G216 PolarHBondContact O-N 3.01Å; G214-G216 VanDerWaalsContact C-N 3.28Å; G214-G216 PolarHBondContact O-N 3.46Å
217	Y	66.4	Low	74.9	Confident	111 Å²	111	34.5 Å²	34.5	44%	0.435	22%	0.223	S	C	.	.	I	π-helix	trans	-100.9	17.4	178.4	-60.7	-78.8	0	0	0	113.4	I164 K165 A212 L215	I164-Y217 HydrophobicContact CG2-CD1 3.91Å; I164-Y217 HydrophobicContact CG2-CE1 3.99Å; K165-Y217 HydrophobicContact CG-CD1 4.3Å; A212-Y217 CarbonylContact O-C 3.58Å; A212-Y217 WeakPolarHBondContact O-CA 3.47Å; A212-Y217 WeakPolarHBondContact O-CB 3.32Å; A212-Y217 PolarHBondContact O-N 3.36Å; L215-Y217 HydrophobicContact CB-CD2 4.01Å; L215-Y217 HydrophobicContact CB-CE2 4.41Å
218	G	60.8	Low	75	Confident	26 Å²	26	34.1 Å²	34.1	27%	0.268	22%	0.219	S	C	.	.			trans	-88.9	152.8	179.9	0	0	0	0	0	113.9
219	L	52.8	Low	75.2	Confident	45 Å²	45	31.5 Å²	31.5	24%	0.236	20%	0.204	C	C	.	.	S	Bend	trans	-90.8	-21.7	178.1	-159	76	0	0	0	113.6	L149 M161 L169	L149-L219 HydrophobicContact CB-CD2 3.46Å; L149-L219 VanDerWaalsContact CB-CD2 3.46Å; L149-L219 HydrophobicContact CB-CG 4.29Å; L149-L219 HydrophobicContact CD1-CD2 4.28Å; L149-L219 HydrophobicContact CG-CD2 4.48Å; M161-L219 HydrophobicContact CE-CD1 3.3Å; M161-L219 HydrophobicContact SD-CD1 4.31Å; L169-L219 HydrophobicContact CD1-CD2 3.97Å; L169-L219 HydrophobicContact CD2-CD1 4.32Å; L169-L219 HydrophobicContact CD2-CD2 3.59Å; L169-L219 HydrophobicContact CG-CD2 4.43Å
220	L	55.8	Low	75.5	Confident	27 Å²	27	30.8 Å²	30.8	14%	0.141	20%	0.2	C	C	.	.	S	Bend	trans	-106.7	83.1	-176.6	-96.6	137.1	0	0	0	109.9	L149 G223 Y226	L149-L220 HydrophobicContact CD1-CD1 3.37Å; L149-L220 HydrophobicContact CD1-CD2 4.23Å; L149-L220 HydrophobicContact CD1-CG 3.53Å; L149-L220 HydrophobicContact CD2-CG 4.47Å; L220-G223 WeakPolarHBondContact O-CA 3.44Å; L220-G223 PolarHBondContact O-N 3.48Å; L220-Y226 HydrophobicContact CD1-CD2 4.06Å; L220-Y226 HydrophobicContact CD1-CG 4.5Å
221	G	58.7	Low	75.9	Confident	52 Å²	52	30.6 Å²	30.6	54%	0.536	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	33.9	-134.2	168.4	0	0	0	0	0	116.1	G223	G221-G223 PolarHBondContact O-N 2.8Å
222	D	62	Low	76.3	Confident	76 Å²	76	27.7 Å²	27.7	41%	0.406	18%	0.184	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	4.7	179.1	-86.1	15.4	0	0	0	115	V224	D222-V224 PolarHBondContact O-N 2.88Å
223	G	75.9	Confident	76.9	Confident	9 Å²	9	27.2 Å²	27.2	9%	0.093	18%	0.18	C	C	.	.	S	Bend	trans	70.7	-20.7	173.6	0	0	0	0	0	116.3	L220 G221 G225 Y226 V227	L220-G223 WeakPolarHBondContact O-CA 3.44Å; L220-G223 PolarHBondContact O-N 3.48Å; G221-G223 PolarHBondContact O-N 2.8Å; G223-G225 PolarHBondContact O-N 3.09Å; G223-Y226 WeakPolarHBondContact O-CB 3.07Å; G223-Y226 PolarHBondContact O-N 3.3Å; G223-Y226 VanDerWaalsContact O-N 3.12Å; G223-V227 PolarHBondContact O-N 3.13Å; G223-V227 VanDerWaalsContact O-N 3.16Å
224	V	84.4	Confident	77.8	Confident	2 Å²	2	26.3 Å²	26.3	1%	0.012	17%	0.173	C	C	.	.	H	α-helix	trans	-56.7	-46.8	-175.2	-178.5	0	0	0	0	112.1	D222 Y226 V227 L228 Q277 F281 F792	D222-V224 PolarHBondContact O-N 2.88Å; V224-Y226 VanDerWaalsContact C-N 3.29Å; V224-Y226 PolarHBondContact O-N 3.05Å; V224-V227 WeakPolarHBondContact O-CB 3.47Å; V224-V227 PolarHBondContact O-N 3.06Å; V224-V227 VanDerWaalsContact O-N 3.13Å; V224-L228 WeakPolarHBondContact O-CG 3.38Å; V224-L228 PolarHBondContact O-N 3.47Å; V224-L228 VanDerWaalsContact O-N 3.12Å; V224-Q277 HydrophobicContact CG2-CG 4.49Å; V224-F281 HydrophobicContact CG1-CE1 4.14Å; V224-F281 HydrophobicContact CG1-CZ 4.3Å; V224-F792 HydrophobicContact CB-CE1 4.45Å; V224-F792 HydrophobicContact CB-CE2 4Å; V224-F792 HydrophobicContact CB-CZ 3.82Å; V224-F792 HydrophobicContact CG1-CD2 4.08Å; V224-F792 HydrophobicContact CG1-CE1 4.41Å; V224-F792 HydrophobicContact CG1-CE2 3.77Å; V224-F792 HydrophobicContact CG1-CZ 3.95Å
225	G	84.4	Confident	78.8	Confident	9 Å²	9	25.2 Å²	25.2	9%	0.093	16%	0.16	C	C	.	.	H	α-helix	trans	-59.4	-38	179.3	0	0	0	0	0	113.3	G223 L228 F229 L858	G223-G225 PolarHBondContact O-N 3.09Å; G225-L228 WeakPolarHBondContact O-CB 3.43Å; G225-L228 PolarHBondContact O-N 3.34Å; G225-F229 PolarHBondContact O-N 3.48Å; G225-F229 VanDerWaalsContact O-N 3.14Å; G225-L858 WeakPolarHBondContact O-CD1 3.11Å
226	Y	86.3	Confident	79.6	Confident	8 Å²	8	20.4 Å²	20.4	3%	0.031	14%	0.135	C	C	.	.	H	α-helix	trans	-70.2	-34.4	177.3	-171.1	-112.2	0	0	0	112.4	D142 M206 Q209 I210 L220 G223 V224 L228 F229 T230	D142-Y226 WeakPolarHBondContact OD1-CE2 3.43Å; D142-Y226 PolarHBondContact OD2-OH 3.36Å; M206-Y226 PolarHBondContact SD-OH 2.76Å; Q209-Y226 HydrophobicContact CB-CE1 4.13Å; Q209-Y226 HydrophobicContact CG-CE1 3.96Å; Q209-Y226 PolarHBondContact OE1-OH 3.23Å; I210-Y226 HydrophobicContact CG1-CD1 3.76Å; I210-Y226 HydrophobicContact CG1-CE1 4.04Å; L220-Y226 HydrophobicContact CD1-CD2 4.06Å; L220-Y226 HydrophobicContact CD1-CG 4.5Å; G223-Y226 WeakPolarHBondContact O-CB 3.07Å; G223-Y226 PolarHBondContact O-N 3.3Å; G223-Y226 VanDerWaalsContact O-N 3.12Å; V224-Y226 VanDerWaalsContact C-N 3.29Å; V224-Y226 PolarHBondContact O-N 3.05Å; Y226-L228 VanDerWaalsContact C-N 3.33Å; Y226-L228 PolarHBondContact O-N 2.99Å; Y226-F229 HydrophobicContact CD2-CD1 4.49Å; Y226-F229 HydrophobicContact CE2-CD1 4.36Å; Y226-F229 PolarHBondContact O-N 2.89Å; Y226-T230 WeakPolarHBondContact O-CB 3.5Å; Y226-T230 PolarHBondContact O-N 3.42Å; Y226-T230 PolarHBondContact O-OG1 3.32Å
227	V	90.8	Very high	80.6	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.3	-42.4	171.2	179.8	0	0	0	0	110.8	I210 G223 V224 F229 T230 L231 H256 F281	I210-V227 HydrophobicContact CD1-CG2 4.06Å; I210-V227 HydrophobicContact CG1-CG2 4.06Å; I210-V227 HydrophobicContact CG2-CG2 3.72Å; G223-V227 PolarHBondContact O-N 3.13Å; G223-V227 VanDerWaalsContact O-N 3.16Å; V224-V227 WeakPolarHBondContact O-CB 3.47Å; V224-V227 PolarHBondContact O-N 3.06Å; V224-V227 VanDerWaalsContact O-N 3.13Å; V227-F229 VanDerWaalsContact C-N 3.35Å; V227-F229 PolarHBondContact O-N 3.38Å; V227-T230 PolarHBondContact O-N 3.25Å; V227-L231 HydrophobicContact CG1-CD1 4.06Å; V227-L231 HydrophobicContact CG1-CG 4.27Å; V227-L231 WeakPolarHBondContact O-CB 3.45Å; V227-L231 VanDerWaalsContact O-CG 3.31Å; V227-L231 WeakPolarHBondContact O-CG 3.49Å; V227-L231 PolarHBondContact O-N 3.02Å; V227-H256 HydrophobicContact CG2-CB 4.32Å; V227-H256 VanDerWaalsContact CG2-CD2 3.43Å; V227-H256 WeakPolarHBondContact CG2-CD2 3.43Å; V227-F281 HydrophobicContact CB-CE1 3.89Å; V227-F281 HydrophobicContact CB-CZ 4.03Å; V227-F281 HydrophobicContact CG1-CD1 4.01Å; V227-F281 HydrophobicContact CG1-CE1 3.52Å; V227-F281 HydrophobicContact CG1-CE2 4.31Å; V227-F281 HydrophobicContact CG1-CZ 3.69Å; V227-F281 HydrophobicContact CG2-CZ 4.39Å
228	L	91.4	Very high	81.7	Confident	0 Å²	0	13.1 Å²	13.1	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-62.4	-43.4	177.7	-57.4	177.1	0	0	0	112.4	V224 G225 Y226 L231 F232 L280 F281 M284 F792 F862	V224-L228 WeakPolarHBondContact O-CG 3.38Å; V224-L228 PolarHBondContact O-N 3.47Å; V224-L228 VanDerWaalsContact O-N 3.12Å; G225-L228 WeakPolarHBondContact O-CB 3.43Å; G225-L228 PolarHBondContact O-N 3.34Å; Y226-L228 VanDerWaalsContact C-N 3.33Å; Y226-L228 PolarHBondContact O-N 2.99Å; L228-L231 PolarHBondContact O-N 2.69Å; L228-F232 WeakPolarHBondContact O-CB 3.13Å; L228-F232 PolarHBondContact O-N 3.16Å; L228-L280 HydrophobicContact CD1-CD2 3.62Å; L228-L280 HydrophobicContact CD2-CD2 3.01Å; L228-L280 HydrophobicContact CD2-CG 4.49Å; L228-L280 HydrophobicContact CG-CD2 3.85Å; L228-F281 HydrophobicContact CD2-CD1 3.79Å; L228-F281 HydrophobicContact CD2-CE1 3.9Å; L228-M284 HydrophobicContact CD2-CB 4.49Å; L228-M284 HydrophobicContact CD2-CG 3.63Å; L228-F792 HydrophobicContact CD1-CB 4.04Å; L228-F792 HydrophobicContact CD1-CD1 3.91Å; L228-F792 HydrophobicContact CD1-CG 4.15Å; L228-F862 HydrophobicContact CB-CE2 4.33Å; L228-F862 HydrophobicContact CB-CZ 3.96Å
229	F	91.1	Very high	83	Confident	0 Å²	0	11.9 Å²	11.9	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.2	-45.7	176.2	175.5	-114.8	0	0	0	111.3	M138 L141 D142 G225 Y226 V227 L231 F232 A233 M861 F862 A865	M138-F229 HydrophobicContact CE-CD1 4Å; M138-F229 HydrophobicContact CE-CE1 3.18Å; M138-F229 HydrophobicContact CE-CE2 4.14Å; M138-F229 HydrophobicContact CE-CZ 3.27Å; M138-F229 HydrophobicContact SD-CE1 4.1Å; M138-F229 HydrophobicContact SD-CE2 4.14Å; M138-F229 HydrophobicContact SD-CZ 3.52Å; M138-F229 VanDerWaalsContact SD-CZ 3.52Å; L141-F229 HydrophobicContact CD2-CE2 3.8Å; L141-F229 HydrophobicContact CD2-CZ 3.84Å; L141-F229 HydrophobicContact CG-CZ 4.23Å; D142-F229 HydrophobicContact CB-CE1 4.33Å; G225-F229 PolarHBondContact O-N 3.48Å; G225-F229 VanDerWaalsContact O-N 3.14Å; Y226-F229 HydrophobicContact CD2-CD1 4.49Å; Y226-F229 HydrophobicContact CE2-CD1 4.36Å; Y226-F229 PolarHBondContact O-N 2.89Å; V227-F229 VanDerWaalsContact C-N 3.35Å; V227-F229 PolarHBondContact O-N 3.38Å; F229-L231 PolarHBondContact O-N 2.71Å; F229-F232 PolarHBondContact O-N 3.13Å; F229-A233 VanDerWaalsContact O-CB 3.31Å; F229-A233 WeakPolarHBondContact O-CB 3.36Å; F229-A233 PolarHBondContact O-N 3.13Å; F229-M861 HydrophobicContact CB-SD 3.77Å; F229-M861 HydrophobicContact CD1-CE 4.46Å; F229-M861 HydrophobicContact CD1-SD 3.54Å; F229-M861 VanDerWaalsContact CD1-SD 3.54Å; F229-M861 HydrophobicContact CD2-CG 3.87Å; F229-M861 HydrophobicContact CD2-SD 3.23Å; F229-M861 WeakPolarHBondContact CD2-SD 3.44Å; F229-M861 HydrophobicContact CE1-SD 3.79Å; F229-M861 HydrophobicContact CE2-CG 3.64Å; F229-M861 HydrophobicContact CE2-SD 3.53Å; F229-M861 VanDerWaalsContact CE2-SD 3.53Å; F229-M861 HydrophobicContact CG-CG 4.41Å; F229-M861 HydrophobicContact CG-SD 3.22Å; F229-M861 WeakPolarHBondContact CG-SD 3.35Å; F229-M861 HydrophobicContact CZ-CG 4Å; F229-M861 HydrophobicContact CZ-SD 3.79Å; F229-F862 HydrophobicContact CB-CE2 3.9Å; F229-F862 HydrophobicContact CB-CZ 4.18Å; F229-F862 HydrophobicContact CD2-CE2 4.47Å; F229-A865 HydrophobicContact CE2-CB 4.19Å
230	T	91.3	Very high	84.7	Confident	2 Å²	2	10.2 Å²	10.2	1%	0.012	7%	0.071	C	C	.	.	H	α-helix	trans	-60	-46.2	177.5	-57.9	0	0	0	0	111.2	M206 I210 Y226 V227 F232 A233 T234	M206-T230 HydrophobicContact CB-CG2 3.82Å; I210-T230 HydrophobicContact CD1-CG2 3.94Å; Y226-T230 WeakPolarHBondContact O-CB 3.5Å; Y226-T230 PolarHBondContact O-N 3.42Å; Y226-T230 PolarHBondContact O-OG1 3.32Å; V227-T230 PolarHBondContact O-N 3.25Å; T230-F232 PolarHBondContact O-N 2.85Å; T230-A233 PolarHBondContact O-N 3.5Å; T230-T234 HydrophobicContact CG2-CG2 4.45Å; T230-T234 WeakPolarHBondContact O-CG2 3.43Å; T230-T234 PolarHBondContact O-N 3.49Å; T230-T234 PolarHBondContact O-OG1 2.8Å
231	L	93.8	Very high	86.2	Confident	0 Å²	0	10.7 Å²	10.7	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-60.2	-46.4	175.8	-73.2	175.6	0	0	0	111.8	V227 L228 F229 A233 T234 Y235 G249 T252 F281 M284	V227-L231 HydrophobicContact CG1-CD1 4.06Å; V227-L231 HydrophobicContact CG1-CG 4.27Å; V227-L231 WeakPolarHBondContact O-CB 3.45Å; V227-L231 VanDerWaalsContact O-CG 3.31Å; V227-L231 WeakPolarHBondContact O-CG 3.49Å; V227-L231 PolarHBondContact O-N 3.02Å; L228-L231 PolarHBondContact O-N 2.69Å; F229-L231 PolarHBondContact O-N 2.71Å; L231-A233 VanDerWaalsContact C-N 3.33Å; L231-A233 PolarHBondContact O-N 3.05Å; L231-T234 WeakPolarHBondContact CA-OG1 3.48Å; L231-T234 PolarHBondContact O-N 3.02Å; L231-T234 PolarHBondContact O-OG1 2.83Å; L231-Y235 WeakPolarHBondContact O-CD2 2.86Å; L231-Y235 PolarHBondContact O-N 2.94Å; L231-G249 WeakPolarHBondContact CD2-O 3.38Å; L231-T252 VanDerWaalsContact CD2-OG1 3.22Å; L231-T252 WeakPolarHBondContact CD2-OG1 3.23Å; L231-F281 HydrophobicContact CD1-CB 4.23Å; L231-F281 HydrophobicContact CD1-CD1 4Å; L231-F281 HydrophobicContact CD1-CG 4.33Å; L231-M284 HydrophobicContact CB-CB 4.32Å; L231-M284 HydrophobicContact CD1-CB 3.99Å
232	F	93.3	Very high	87.6	Confident	3 Å²	3	9.7 Å²	9.7	1%	0.013	6%	0.058	C	C	.	.	H	α-helix	trans	-59.7	-45.6	176.5	180	-105.1	0	0	0	111.5	L228 F229 T230 Y235 S236 M237 M284 I291 V799 A802 F862 A865 V866	L228-F232 WeakPolarHBondContact O-CB 3.13Å; L228-F232 PolarHBondContact O-N 3.16Å; F229-F232 PolarHBondContact O-N 3.13Å; T230-F232 PolarHBondContact O-N 2.85Å; F232-Y235 PolarHBondContact O-N 2.78Å; F232-S236 WeakPolarHBondContact CE1-OG 3.34Å; F232-S236 WeakPolarHBondContact O-CB 3.42Å; F232-S236 PolarHBondContact O-N 2.99Å; F232-S236 PolarHBondContact O-OG 2.9Å; F232-M237 HydrophobicContact CE1-CE 4.45Å; F232-M284 HydrophobicContact CB-CE 3.66Å; F232-M284 HydrophobicContact CD2-CE 4.33Å; F232-M284 HydrophobicContact CG-CE 4.45Å; F232-I291 HydrophobicContact CE2-CD1 4.18Å; F232-V799 HydrophobicContact CD2-CG1 4.32Å; F232-V799 HydrophobicContact CD2-CG2 4.05Å; F232-V799 HydrophobicContact CE2-CG1 4.38Å; F232-V799 HydrophobicContact CE2-CG2 4.37Å; F232-A802 HydrophobicContact CE2-CB 3.91Å; F232-A802 HydrophobicContact CZ-CB 4.12Å; F232-F862 HydrophobicContact CB-CE1 3.78Å; F232-F862 HydrophobicContact CB-CZ 4.25Å; F232-F862 HydrophobicContact CD1-CE1 4.27Å; F232-F862 HydrophobicContact CD2-CE1 4.49Å; F232-F862 AromaticContact CG-CE1 3.92Å; F232-F862 HydrophobicContact CG-CE1 3.92Å; F232-A865 HydrophobicContact CD1-CB 4.15Å; F232-A865 HydrophobicContact CE1-CB 3.78Å; F232-V866 HydrophobicContact CE1-CG2 4.26Å; F232-V866 HydrophobicContact CE2-CG2 4.34Å; F232-V866 HydrophobicContact CZ-CG2 3.8Å
233	A	91.6	Very high	88.9	Confident	3 Å²	3	9 Å²	9	3%	0.025	6%	0.056	C	C	.	.	H	α-helix	trans	-66.2	-38	-178.3	0	0	0	0	0	113.1	M138 F229 T230 L231 Y235 M237 L238	M138-A233 HydrophobicContact CE-CB 3.13Å; M138-A233 HydrophobicContact CG-CB 4.32Å; M138-A233 HydrophobicContact SD-CB 3.47Å; M138-A233 WeakPolarHBondContact SD-CB 3.31Å; F229-A233 VanDerWaalsContact O-CB 3.31Å; F229-A233 WeakPolarHBondContact O-CB 3.36Å; F229-A233 PolarHBondContact O-N 3.13Å; T230-A233 PolarHBondContact O-N 3.5Å; L231-A233 VanDerWaalsContact C-N 3.33Å; L231-A233 PolarHBondContact O-N 3.05Å; A233-Y235 VanDerWaalsContact C-N 3.3Å; A233-Y235 PolarHBondContact O-N 3.09Å; A233-M237 PolarHBondContact O-N 2.84Å; A233-L238 PolarHBondContact O-N 3.42Å
234	T	92.8	Very high	89.6	Confident	2 Å²	2	16.1 Å²	16.1	1%	0.012	8%	0.08	C	C	.	.	H	α-helix	trans	-61.1	-38.1	178.6	47.3	0	0	0	0	112.8	W203 T230 L231 L238	W203-T234 VanDerWaalsContact CD1-CG2 3.4Å; W203-T234 HydrophobicContact CG-CG2 4.31Å; T230-T234 HydrophobicContact CG2-CG2 4.45Å; T230-T234 WeakPolarHBondContact O-CG2 3.43Å; T230-T234 PolarHBondContact O-N 3.49Å; T230-T234 PolarHBondContact O-OG1 2.8Å; L231-T234 WeakPolarHBondContact CA-OG1 3.48Å; L231-T234 PolarHBondContact O-N 3.02Å; L231-T234 PolarHBondContact O-OG1 2.83Å; T234-L238 HydrophobicContact CG2-CD1 3.94Å
235	Y	92.3	Very high	90	Very high	2 Å²	2	16 Å²	16	1%	0.008	8%	0.08	C	C	.	.	H	α-helix	trans	-85.5	-38	179.6	-69.8	-70.5	0	0	0	112.9	L231 F232 A233 A245 I246 N285 G288 I289	L231-Y235 WeakPolarHBondContact O-CD2 2.86Å; L231-Y235 PolarHBondContact O-N 2.94Å; F232-Y235 PolarHBondContact O-N 2.78Å; A233-Y235 VanDerWaalsContact C-N 3.3Å; A233-Y235 PolarHBondContact O-N 3.09Å; Y235-A245 HydrophobicContact CD1-CB 3.78Å; Y235-A245 HydrophobicContact CE1-CB 3.95Å; Y235-I246 HydrophobicContact CE1-CG1 4.13Å; Y235-N285 HydrophobicContact CE2-CB 4.47Å; Y235-N285 WeakPolarHBondContact CE2-OD1 3.06Å; Y235-N285 PolarHBondContact OH-OD1 3.33Å; Y235-G288 WeakPolarHBondContact CB-O 3.23Å; Y235-I289 HydrophobicContact CE1-CG1 3.84Å
236	S	89.4	Confident	90.4	Very high	2 Å²	2	16.9 Å²	16.9	1%	0.014	8%	0.082	C	C	.	.	H	α-helix	trans	-93.7	-41.8	-170.2	64.9	0	0	0	0	114.6	R131 F232	R131-S236 PolarHBondContact NH1-O 2.8Å; F232-S236 WeakPolarHBondContact CE1-OG 3.34Å; F232-S236 WeakPolarHBondContact O-CB 3.42Å; F232-S236 PolarHBondContact O-N 2.99Å; F232-S236 PolarHBondContact O-OG 2.9Å
237	M	88.2	Confident	90.8	Very high	4 Å²	4	22.2 Å²	22.2	2%	0.02	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.2	-37.8	-168	-60.6	-56.7	-175.5	0	0	113.8	S134 M138 F232 A233 A865 Y868 H869	S134-M237 WeakPolarHBondContact OG-CA 3.41Å; S134-M237 PolarHBondContact OG-O 2.69Å; S134-M237 PolarHBondContact OG-SD 3.22Å; M138-M237 HydrophobicContact CB-CB 4.13Å; M138-M237 HydrophobicContact CG-CB 4.37Å; F232-M237 HydrophobicContact CE1-CE 4.45Å; A233-M237 PolarHBondContact O-N 2.84Å; M237-A865 HydrophobicContact CE-CB 4.46Å; M237-A865 WeakPolarHBondContact CE-O 3.22Å; M237-Y868 HydrophobicContact CE-CD1 3.9Å; M237-Y868 HydrophobicContact SD-CD1 3.84Å; M237-Y868 HydrophobicContact SD-CE1 4.36Å; M237-H869 HydrophobicContact CE-CB 3.58Å; M237-H869 HydrophobicContact SD-CB 4.4Å
238	L	89.4	Confident	90.9	Very high	4 Å²	4	22.5 Å²	22.5	2%	0.021	11%	0.113	C	C	.	.	S	Bend	trans	-70.4	146.2	-176	-67.6	-177.2	0	0	0	112.2	R131 T202 W203 A233 T234 L240	R131-L238 PolarHBondContact NH1-O 2.97Å; T202-L238 HydrophobicContact CG2-CD2 3.93Å; W203-L238 HydrophobicContact CB-CD1 3.94Å; A233-L238 PolarHBondContact O-N 3.42Å; T234-L238 HydrophobicContact CG2-CD1 3.94Å; L238-L240 HydrophobicContact CB-CD1 4.16Å; L238-L240 HydrophobicContact CB-CG 4.08Å; L238-L240 HydrophobicContact CD1-CD1 4.15Å; L238-L240 PolarHBondContact O-N 3.44Å
239	P	88.1	Confident	91	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.113	C	C	.	.			trans	-83.3	46.5	-177	35.7	-39.7	0	0	0	111	L128 R131 V135 L195	L128-P239 HydrophobicContact CD2-CB 3.94Å; R131-P239 HydrophobicContact CB-CB 3.95Å; V135-P239 HydrophobicContact CG2-CB 4.38Å; V135-P239 HydrophobicContact CG2-CG 3.54Å; L195-P239 WeakPolarHBondContact O-CG 3.27Å
240	L	87.4	Confident	91.2	Very high	9 Å²	9	26.9 Å²	26.9	5%	0.047	14%	0.136	C	C	.	.			trans	-99.2	138.4	-179.3	-61.4	176.6	0	0	0	109.7	V200 L238 W244 A245	V200-L240 HydrophobicContact CG2-CD2 3.64Å; L238-L240 HydrophobicContact CB-CD1 4.16Å; L238-L240 HydrophobicContact CB-CG 4.08Å; L238-L240 HydrophobicContact CD1-CD1 4.15Å; L238-L240 PolarHBondContact O-N 3.44Å; L240-W244 HydrophobicContact CB-CB 4.4Å; L240-A245 HydrophobicContact CB-CB 4.42Å
241	P	87.9	Confident	91.3	Very high	37 Å²	37	32.2 Å²	32.2	24%	0.24	16%	0.159	C	C	.	.			trans	-62.7	154.2	168	-12.2	24.5	0	0	0	110.4	T243 W244 A245	P241-T243 VanDerWaalsContact C-N 3.26Å; P241-T243 PolarHBondContact O-N 3.45Å; P241-T243 VanDerWaalsContact O-N 3.12Å; P241-W244 HydrophobicContact CG-CG 4.37Å; P241-W244 PolarHBondContact O-N 3Å; P241-A245 PolarHBondContact O-N 3.25Å
242	L	87.7	Confident	91.3	Very high	31 Å²	31	32.2 Å²	32.2	16%	0.162	16%	0.159	C	C	.	.	H	α-helix	trans	-52.1	-40.8	-175.1	-178.5	64.9	0	0	0	113.4	A245 I246 Y293	L242-A245 PolarHBondContact O-N 3.07Å; L242-I246 HydrophobicContact CD1-CD1 4.27Å; L242-I246 HydrophobicContact CD1-CG1 4.45Å; L242-I246 HydrophobicContact CG-CD1 4Å; L242-I246 VanDerWaalsContact O-CG1 3.26Å; L242-I246 WeakPolarHBondContact O-CG1 3.18Å; L242-I246 PolarHBondContact O-N 2.95Å; L242-Y293 HydrophobicContact CD2-CD2 4.09Å
243	T	89.1	Confident	91.3	Very high	61 Å²	61	32.6 Å²	32.6	37%	0.374	16%	0.162	S	C	.	.	H	α-helix	trans	-64.5	-42.1	179.5	51.2	0	0	0	0	112.8	P241 I246 L247	P241-T243 VanDerWaalsContact C-N 3.26Å; P241-T243 PolarHBondContact O-N 3.45Å; P241-T243 VanDerWaalsContact O-N 3.12Å; T243-I246 PolarHBondContact O-N 3.37Å; T243-L247 WeakPolarHBondContact O-CG 3.44Å; T243-L247 PolarHBondContact O-N 3.13Å; T243-L247 VanDerWaalsContact O-N 3.14Å
244	W	90.9	Very high	91.3	Very high	159 Å²	159	34.2 Å²	34.2	60%	0.602	18%	0.179	S	C	*	.	H	α-helix	trans	-69.1	-38.4	176.9	-64.9	81.9	0	0	0	111.1	L240 P241 L247 A248	L240-W244 HydrophobicContact CB-CB 4.4Å; P241-W244 HydrophobicContact CG-CG 4.37Å; P241-W244 PolarHBondContact O-N 3Å; W244-L247 PolarHBondContact O-N 3.18Å; W244-A248 WeakPolarHBondContact O-CB 3.41Å; W244-A248 PolarHBondContact O-N 2.76Å
245	A	92.1	Very high	91.1	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.5	-40.6	175.5	0	0	0	0	0	112.2	Y235 L240 P241 L242 A248 G249	Y235-A245 HydrophobicContact CD1-CB 3.78Å; Y235-A245 HydrophobicContact CE1-CB 3.95Å; L240-A245 HydrophobicContact CB-CB 4.42Å; P241-A245 PolarHBondContact O-N 3.25Å; L242-A245 PolarHBondContact O-N 3.07Å; A245-A248 PolarHBondContact O-N 3.01Å; A245-G249 PolarHBondContact O-N 3.13Å
246	I	93.7	Very high	90.9	Very high	28 Å²	28	36.4 Å²	36.4	14%	0.144	19%	0.19	C	C	.	.	H	α-helix	trans	-62.2	-48.1	175	-68.3	164.8	0	0	0	111	L110 Y235 L242 T243 A248 G249 L250 I289	L110-I246 HydrophobicContact CD2-CD1 3.84Å; Y235-I246 HydrophobicContact CE1-CG1 4.13Å; L242-I246 HydrophobicContact CD1-CD1 4.27Å; L242-I246 HydrophobicContact CD1-CG1 4.45Å; L242-I246 HydrophobicContact CG-CD1 4Å; L242-I246 VanDerWaalsContact O-CG1 3.26Å; L242-I246 WeakPolarHBondContact O-CG1 3.18Å; L242-I246 PolarHBondContact O-N 2.95Å; T243-I246 PolarHBondContact O-N 3.37Å; I246-A248 VanDerWaalsContact C-N 3.34Å; I246-A248 PolarHBondContact O-N 3.18Å; I246-G249 PolarHBondContact O-N 3.14Å; I246-L250 HydrophobicContact CG2-CD1 3.88Å; I246-L250 HydrophobicContact CG2-CG 4.38Å; I246-L250 WeakPolarHBondContact O-CB 3.42Å; I246-L250 VanDerWaalsContact O-CG 3.31Å; I246-L250 WeakPolarHBondContact O-CG 3.37Å; I246-L250 PolarHBondContact O-N 2.96Å; I246-I289 HydrophobicContact CD1-CD1 4.45Å; I246-I289 HydrophobicContact CD1-CG1 4.33Å; I246-I289 HydrophobicContact CG1-CD1 4.1Å; I246-I289 HydrophobicContact CG1-CG1 3.87Å
247	L	94.1	Very high	90.8	Very high	119 Å²	119	38.2 Å²	38.2	62%	0.623	20%	0.199	S	C	*	.	H	α-helix	trans	-61.3	-44.4	178	-70	171	0	0	0	111.5	T243 W244 F251	T243-L247 WeakPolarHBondContact O-CG 3.44Å; T243-L247 PolarHBondContact O-N 3.13Å; T243-L247 VanDerWaalsContact O-N 3.14Å; W244-L247 PolarHBondContact O-N 3.18Å; L247-F251 VanDerWaalsContact O-CB 3.28Å; L247-F251 WeakPolarHBondContact O-CB 3.42Å; L247-F251 PolarHBondContact O-N 3.02Å
248	A	93.8	Very high	90.8	Very high	6 Å²	6	42.2 Å²	42.2	5%	0.05	22%	0.22	C	C	.	.	H	α-helix	trans	-60.9	-46.2	177.4	0	0	0	0	0	112.3	W203 W244 A245 I246 F251 T252	W203-A248 HydrophobicContact CD2-CB 4.06Å; W203-A248 HydrophobicContact CG-CB 4.3Å; W203-A248 HydrophobicContact CZ2-CB 3.95Å; W244-A248 WeakPolarHBondContact O-CB 3.41Å; W244-A248 PolarHBondContact O-N 2.76Å; A245-A248 PolarHBondContact O-N 3.01Å; I246-A248 VanDerWaalsContact C-N 3.34Å; I246-A248 PolarHBondContact O-N 3.18Å; A248-F251 PolarHBondContact O-N 2.98Å; A248-T252 WeakPolarHBondContact O-CG2 3.46Å; A248-T252 PolarHBondContact O-N 3.23Å; A248-T252 PolarHBondContact O-OG1 3.05Å
249	G	94	Very high	90.6	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-69.3	-39.5	-179.7	0	0	0	0	0	113.7	L231 A245 I246 F251 T252 S253 N285	L231-G249 WeakPolarHBondContact CD2-O 3.38Å; A245-G249 PolarHBondContact O-N 3.13Å; I246-G249 PolarHBondContact O-N 3.14Å; G249-F251 VanDerWaalsContact C-N 3.34Å; G249-T252 PolarHBondContact O-OG1 3.01Å; G249-S253 WeakPolarHBondContact O-CB 3.43Å; G249-S253 PolarHBondContact O-N 2.77Å; G249-S253 VanDerWaalsContact O-N 3.09Å; G249-S253 PolarHBondContact O-OG 3.44Å; G249-N285 WeakPolarHBondContact CA-OD1 3.38Å
250	L	94.6	Very high	90.2	Very high	93 Å²	93	44.3 Å²	44.3	49%	0.487	23%	0.231	S	C	.	.	H	α-helix	trans	-64.5	-40.7	173.3	-71	174.9	0	0	0	111.2	I246 S253 G254	I246-L250 HydrophobicContact CG2-CD1 3.88Å; I246-L250 HydrophobicContact CG2-CG 4.38Å; I246-L250 WeakPolarHBondContact O-CB 3.42Å; I246-L250 VanDerWaalsContact O-CG 3.31Å; I246-L250 WeakPolarHBondContact O-CG 3.37Å; I246-L250 PolarHBondContact O-N 2.96Å; L250-S253 PolarHBondContact O-N 3.37Å; L250-G254 PolarHBondContact O-N 3.36Å
251	F	94.1	Very high	90	Very high	113 Å²	113	48.4 Å²	48.4	50%	0.496	25%	0.252	S	S	.	.	H	α-helix	trans	-64	-47.4	177.5	-175.9	-92.9	0	0	0	112.1	W203 L247 A248 G249 S253 G254 L255	W203-F251 AromaticContact CH2-CD1 3.88Å; W203-F251 HydrophobicContact CH2-CD1 3.88Å; W203-F251 HydrophobicContact CH2-CE1 4.36Å; W203-F251 HydrophobicContact CH2-CG 4.41Å; W203-F251 HydrophobicContact CZ2-CB 4.22Å; W203-F251 AromaticContact CZ2-CD1 3.67Å; W203-F251 HydrophobicContact CZ2-CD1 3.67Å; W203-F251 HydrophobicContact CZ2-CE1 4.46Å; W203-F251 HydrophobicContact CZ2-CG 4.25Å; L247-F251 VanDerWaalsContact O-CB 3.28Å; L247-F251 WeakPolarHBondContact O-CB 3.42Å; L247-F251 PolarHBondContact O-N 3.02Å; A248-F251 PolarHBondContact O-N 2.98Å; G249-F251 VanDerWaalsContact C-N 3.34Å; F251-S253 VanDerWaalsContact C-N 3.32Å; F251-S253 PolarHBondContact O-N 3.4Å; F251-G254 PolarHBondContact O-N 3.3Å; F251-L255 HydrophobicContact CE1-CD2 4.06Å; F251-L255 WeakPolarHBondContact O-CB 3.46Å; F251-L255 PolarHBondContact O-N 3.49Å
252	T	92.3	Very high	89.7	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-63.2	-39.6	178.8	50.5	0	0	0	0	112.2	W203 A207 L231 A248 G249 H256	W203-T252 HydrophobicContact CZ2-CG2 4.29Å; W203-T252 VanDerWaalsContact NE1-CG2 3.28Å; A207-T252 HydrophobicContact CB-CG2 4.09Å; L231-T252 VanDerWaalsContact CD2-OG1 3.22Å; L231-T252 WeakPolarHBondContact CD2-OG1 3.23Å; A248-T252 WeakPolarHBondContact O-CG2 3.46Å; A248-T252 PolarHBondContact O-N 3.23Å; A248-T252 PolarHBondContact O-OG1 3.05Å; G249-T252 PolarHBondContact O-OG1 3.01Å; T252-H256 PolarHBondContact O-N 2.66Å
253	S	93.1	Very high	89.1	Confident	10 Å²	10	57.9 Å²	57.9	7%	0.07	29%	0.292	C	S	.	.	H	α-helix	trans	-67.4	-46.5	178.5	-49.4	0	0	0	0	111.4	G249 L250 F251 I257 N285	G249-S253 WeakPolarHBondContact O-CB 3.43Å; G249-S253 PolarHBondContact O-N 2.77Å; G249-S253 VanDerWaalsContact O-N 3.09Å; G249-S253 PolarHBondContact O-OG 3.44Å; L250-S253 PolarHBondContact O-N 3.37Å; F251-S253 VanDerWaalsContact C-N 3.32Å; F251-S253 PolarHBondContact O-N 3.4Å; S253-I257 WeakPolarHBondContact O-CG1 3.28Å; S253-I257 PolarHBondContact O-N 3.39Å; S253-N285 PolarHBondContact OG-ND2 3.36Å
254	G	91.4	Very high	88	Confident	37 Å²	37	57.1 Å²	57.1	38%	0.381	29%	0.289	S	S	.	.	H	α-helix	trans	-65.6	-40.5	178.7	0	0	0	0	0	112.7	L250 F251 I257 L258	L250-G254 PolarHBondContact O-N 3.36Å; F251-G254 PolarHBondContact O-N 3.3Å; G254-I257 PolarHBondContact O-N 3.34Å; G254-L258 WeakPolarHBondContact O-CB 3.49Å; G254-L258 PolarHBondContact O-N 3.41Å
255	L	89.6	Confident	86.4	Confident	35 Å²	35	59.2 Å²	59.2	18%	0.183	31%	0.306	C	S	.	.	H	α-helix	trans	-60.7	-46.6	177.7	-176.5	65.4	0	0	0	111.5	L211 F251 L258 V259	L211-L255 HydrophobicContact CB-CD2 4.29Å; L211-L255 HydrophobicContact CD1-CD1 4.28Å; F251-L255 HydrophobicContact CE1-CD2 4.06Å; F251-L255 WeakPolarHBondContact O-CB 3.46Å; F251-L255 PolarHBondContact O-N 3.49Å; L255-L258 PolarHBondContact O-N 3.41Å; L255-V259 VanDerWaalsContact O-CG2 3.28Å; L255-V259 WeakPolarHBondContact O-CG2 3.35Å; L255-V259 PolarHBondContact O-N 3.24Å
256	H	87.6	Confident	84.6	Confident	16 Å²	16	63 Å²	63	7%	0.074	33%	0.333	C	S	.	.	H	α-helix	trans	-63	-47.9	178.8	-175.1	-80.7	0	0	0	112.1	I210 V227 T252 L258 V259 Q260 F281	I210-H256 HydrophobicContact CG2-CB 4.33Å; V227-H256 HydrophobicContact CG2-CB 4.32Å; V227-H256 VanDerWaalsContact CG2-CD2 3.43Å; V227-H256 WeakPolarHBondContact CG2-CD2 3.43Å; T252-H256 PolarHBondContact O-N 2.66Å; H256-L258 VanDerWaalsContact C-N 3.3Å; H256-L258 PolarHBondContact O-N 3.09Å; H256-V259 PolarHBondContact O-N 3.27Å; H256-Q260 WeakPolarHBondContact O-CB 3.21Å; H256-Q260 PolarHBondContact O-N 3.09Å; H256-F281 HydrophobicContact CB-CE2 4.21Å; H256-F281 AromaticContact ND1-CE2 3.71Å; H256-F281 AromaticContact ND1-CZ 3.85Å
257	I	88.7	Confident	82.8	Confident	39 Å²	39	65.6 Å²	65.6	20%	0.2	36%	0.358	C	S	.	.	H	α-helix	trans	-59.9	-43.7	178.1	-66.5	169.2	0	0	0	110.3	S253 G254 Q260 L261 V274 A278 F281	S253-I257 WeakPolarHBondContact O-CG1 3.28Å; S253-I257 PolarHBondContact O-N 3.39Å; G254-I257 PolarHBondContact O-N 3.34Å; I257-Q260 PolarHBondContact O-N 2.93Å; I257-L261 HydrophobicContact CG2-CD1 4Å; I257-L261 HydrophobicContact CG2-CG 4.26Å; I257-L261 VanDerWaalsContact O-CG 3.27Å; I257-L261 WeakPolarHBondContact O-CG 3.48Å; I257-L261 PolarHBondContact O-N 3.16Å; I257-V274 HydrophobicContact CG2-CG1 4.28Å; I257-A278 HydrophobicContact CD1-CB 3.97Å; I257-F281 HydrophobicContact CD1-CD2 4.17Å; I257-F281 HydrophobicContact CG1-CD2 4.18Å; I257-F281 HydrophobicContact CG1-CE2 4.22Å
258	L	87.4	Confident	80.7	Confident	88 Å²	88	70 Å²	70	46%	0.461	37%	0.366	S	S	.	.	H	α-helix	trans	-62.4	-46.2	-180	-179.4	134.6	0	0	0	112.1	G254 L255 H256 Q260 L261 F262	G254-L258 WeakPolarHBondContact O-CB 3.49Å; G254-L258 PolarHBondContact O-N 3.41Å; L255-L258 PolarHBondContact O-N 3.41Å; H256-L258 VanDerWaalsContact C-N 3.3Å; H256-L258 PolarHBondContact O-N 3.09Å; L258-Q260 VanDerWaalsContact C-N 3.3Å; L258-Q260 PolarHBondContact O-N 2.96Å; L258-L261 PolarHBondContact O-N 3.32Å; L258-F262 HydrophobicContact CD1-CE2 4.1Å; L258-F262 HydrophobicContact CD2-CD2 3.7Å; L258-F262 HydrophobicContact CD2-CE2 3.56Å; L258-F262 HydrophobicContact CG-CD2 3.83Å; L258-F262 HydrophobicContact CG-CE2 3.58Å; L258-F262 WeakPolarHBondContact O-CD2 3.48Å; L258-F262 PolarHBondContact O-N 3.45Å
259	V	84.2	Confident	78.9	Confident	14 Å²	14	75.7 Å²	75.7	9%	0.085	39%	0.39	C	S	.	.	H	α-helix	trans	-60	-43.3	176.4	172.8	0	0	0	0	110.9	L211 L255 H256 L261 F262 I263	L211-V259 HydrophobicContact CD1-CG2 3.57Å; L255-V259 VanDerWaalsContact O-CG2 3.28Å; L255-V259 WeakPolarHBondContact O-CG2 3.35Å; L255-V259 PolarHBondContact O-N 3.24Å; H256-V259 PolarHBondContact O-N 3.27Å; V259-L261 PolarHBondContact O-N 3.09Å; V259-F262 PolarHBondContact O-N 3.03Å; V259-I263 HydrophobicContact CG1-CD1 3.64Å; V259-I263 WeakPolarHBondContact O-CG1 3.47Å; V259-I263 PolarHBondContact O-N 2.98Å
260	Q	80.6	Confident	77.7	Confident	34 Å²	34	77.1 Å²	77.1	16%	0.159	40%	0.396	C	S	.	.	H	α-helix	trans	-66.3	-36.7	178.8	-168.2	178.2	-2.9	0	0	112.8	H256 I257 L258 F262 I263 S264 F270	H256-Q260 WeakPolarHBondContact O-CB 3.21Å; H256-Q260 PolarHBondContact O-N 3.09Å; I257-Q260 PolarHBondContact O-N 2.93Å; L258-Q260 VanDerWaalsContact C-N 3.3Å; L258-Q260 PolarHBondContact O-N 2.96Å; Q260-F262 VanDerWaalsContact C-N 3.32Å; Q260-I263 PolarHBondContact O-N 2.98Å; Q260-S264 PolarHBondContact O-N 2.95Å; Q260-F270 HydrophobicContact CG-CE2 4.05Å; Q260-F270 HydrophobicContact CG-CZ 4.38Å; Q260-F270 WeakPolarHBondContact O-CZ 3.48Å
261	L	82.8	Confident	76.7	Confident	96 Å²	96	76.4 Å²	76.4	50%	0.503	40%	0.396	S	S	.	.	H	α-helix	trans	-64.4	-34.1	172.6	-71.9	175.3	0	0	0	112.6	I257 L258 V259 F270 V274	I257-L261 HydrophobicContact CG2-CD1 4Å; I257-L261 HydrophobicContact CG2-CG 4.26Å; I257-L261 VanDerWaalsContact O-CG 3.27Å; I257-L261 WeakPolarHBondContact O-CG 3.48Å; I257-L261 PolarHBondContact O-N 3.16Å; L258-L261 PolarHBondContact O-N 3.32Å; V259-L261 PolarHBondContact O-N 3.09Å; L261-F270 HydrophobicContact CD2-CE1 3.67Å; L261-F270 HydrophobicContact CD2-CZ 3.98Å; L261-V274 HydrophobicContact CD2-CG1 4.34Å
262	F	81.3	Confident	76	Confident	167 Å²	167	74.3 Å²	74.3	73%	0.732	39%	0.39	S	S	*	.	H	α-helix	trans	-76.7	-26.3	179.6	-84.6	-65.2	0	0	0	114	L258 V259 Q260	L258-F262 HydrophobicContact CD1-CE2 4.1Å; L258-F262 HydrophobicContact CD2-CD2 3.7Å; L258-F262 HydrophobicContact CD2-CE2 3.56Å; L258-F262 HydrophobicContact CG-CD2 3.83Å; L258-F262 HydrophobicContact CG-CE2 3.58Å; L258-F262 WeakPolarHBondContact O-CD2 3.48Å; L258-F262 PolarHBondContact O-N 3.45Å; V259-F262 PolarHBondContact O-N 3.03Å; Q260-F262 VanDerWaalsContact C-N 3.32Å
263	I	75.3	Confident	75.3	Confident	100 Å²	100	76.2 Å²	76.2	51%	0.513	40%	0.399	S	S	.	.	H	α-helix	trans	-91.5	-22.9	-174.4	-66.7	170.9	0	0	0	112.5	G214 V259 Q260	G214-I263 WeakPolarHBondContact O-CD1 3.36Å; V259-I263 HydrophobicContact CG1-CD1 3.64Å; V259-I263 WeakPolarHBondContact O-CG1 3.47Å; V259-I263 PolarHBondContact O-N 2.98Å; Q260-I263 PolarHBondContact O-N 2.98Å
264	S	67.1	Low	75	Confident	44 Å²	44	76.5 Å²	76.5	31%	0.308	40%	0.4	S	S	.	.			trans	-92.6	120.2	-174	-174.2	0	0	0	0	113.5	Q260 F270	Q260-S264 PolarHBondContact O-N 2.95Å; S264-F270 WeakPolarHBondContact OG-CD2 3.27Å; S264-F270 WeakPolarHBondContact OG-CE2 3.26Å; S264-F270 WeakPolarHBondContact OG-CG 3.34Å
265	E	57.6	Low	74.8	Confident	204 Å²	204	76.4 Å²	76.4	95%	0.953	40%	0.396	S	S	*	.			trans	-91.6	-2.3	177.8	-72.3	-163.5	149.6	0	0	114.9
266	S	53.7	Low	74.7	Confident	80 Å²	80	74.8 Å²	74.8	56%	0.559	39%	0.387	S	S	*	.			trans	-112.5	133.8	-172	-175.9	0	0	0	0	114.3	F270	S266-F270 WeakPolarHBondContact O-CB 3.39Å
267	A	55.6	Low	74.7	Confident	81 Å²	81	74.2 Å²	74.2	67%	0.669	38%	0.384	S	S	*	.			trans	-96.9	-19.8	-154.1	0	0	0	0	0	119.3
268	R	50.7	Low	74.9	Confident	213 Å²	213	73.9 Å²	73.9	80%	0.804	39%	0.387	S	S	*	.	S	Bend	trans	-112.2	-39.4	-170.8	-69.9	-175.2	-169.6	162.8	4	116.6	T271	R268-T271 PolarHBondContact O-OG1 2.87Å
269	F	55.9	Low	75.2	Confident	124 Å²	124	71.3 Å²	71.3	54%	0.544	38%	0.375	S	S	.	.	H	α-helix	trans	-80.5	-27.8	176.3	-68.3	-72.5	0	0	0	111.9	T271 P781	F269-T271 PolarHBondContact O-N 3.41Å; F269-P781 HydrophobicContact CD1-CG 3.75Å; F269-P781 HydrophobicContact CE1-CG 3.41Å; F269-P781 VanDerWaalsContact CE1-CG 3.41Å; F269-P781 HydrophobicContact CZ-CG 4.35Å
270	F	67.8	Low	75.7	Confident	31 Å²	31	70.6 Å²	70.6	14%	0.136	37%	0.371	C	S	.	.	H	α-helix	trans	-61	-37.7	175.4	-177.6	-115.8	0	0	0	113.7	Q260 L261 S264 S266 N272 Q273 V274	Q260-F270 HydrophobicContact CG-CE2 4.05Å; Q260-F270 HydrophobicContact CG-CZ 4.38Å; Q260-F270 WeakPolarHBondContact O-CZ 3.48Å; L261-F270 HydrophobicContact CD2-CE1 3.67Å; L261-F270 HydrophobicContact CD2-CZ 3.98Å; S264-F270 WeakPolarHBondContact OG-CD2 3.27Å; S264-F270 WeakPolarHBondContact OG-CE2 3.26Å; S264-F270 WeakPolarHBondContact OG-CG 3.34Å; S266-F270 WeakPolarHBondContact O-CB 3.39Å; F270-N272 PolarHBondContact O-N 3.47Å; F270-Q273 PolarHBondContact O-N 2.94Å; F270-V274 HydrophobicContact CD1-CG2 4.27Å; F270-V274 HydrophobicContact CD2-CG2 3.85Å; F270-V274 HydrophobicContact CE1-CG2 3.93Å; F270-V274 HydrophobicContact CE2-CG2 3.45Å; F270-V274 VanDerWaalsContact CE2-CG2 3.45Å; F270-V274 HydrophobicContact CG-CG2 4.23Å; F270-V274 HydrophobicContact CZ-CG2 3.49Å; F270-V274 VanDerWaalsContact CZ-CG2 3.49Å; F270-V274 WeakPolarHBondContact O-CB 2.9Å; F270-V274 VanDerWaalsContact O-CG2 3.28Å; F270-V274 WeakPolarHBondContact O-CG2 3.44Å; F270-V274 PolarHBondContact O-N 3.46Å
271	T	75.2	Confident	76.3	Confident	77 Å²	77	69.1 Å²	69.1	47%	0.472	36%	0.364	S	S	.	.	H	α-helix	trans	-66.2	-39.2	-175.9	41.6	0	0	0	0	113.4	R268 F269 A275	R268-T271 PolarHBondContact O-OG1 2.87Å; F269-T271 PolarHBondContact O-N 3.41Å; T271-A275 WeakPolarHBondContact O-CB 3.44Å; T271-A275 PolarHBondContact O-N 3.44Å
272	N	77.5	Confident	76.9	Confident	70 Å²	70	69.4 Å²	69.4	37%	0.374	36%	0.364	S	S	.	.	H	α-helix	trans	-72.6	-37.3	179	-68.3	-6.4	0	0	0	111.6	F270 A275 A276	F270-N272 PolarHBondContact O-N 3.47Å; N272-A275 PolarHBondContact O-N 3.47Å; N272-A276 WeakPolarHBondContact O-CB 3.28Å; N272-A276 PolarHBondContact O-N 3.26Å
273	Q	79.1	Confident	77.6	Confident	41 Å²	41	61.4 Å²	61.4	19%	0.192	33%	0.329	C	S	.	.	H	α-helix	trans	-67.1	-45.5	178.3	-167.2	179.5	-7.6	0	0	112	F270 A276 Q277 Y789	F270-Q273 PolarHBondContact O-N 2.94Å; Q273-A276 PolarHBondContact O-N 3.49Å; Q273-Q277 WeakPolarHBondContact O-CG 3.47Å; Q273-Q277 PolarHBondContact O-N 3.03Å; Q273-Y789 HydrophobicContact CG-CE2 4.43Å; Q273-Y789 WeakPolarHBondContact CG-OH 3.32Å; Q273-Y789 PolarHBondContact O-OH 3.32Å
274	V	85.2	Confident	78.5	Confident	16 Å²	16	56.8 Å²	56.8	10%	0.097	31%	0.305	C	S	.	.	H	α-helix	trans	-65.5	-39.7	174.4	173.6	0	0	0	0	111.1	I257 L261 F270 Q277 A278	I257-V274 HydrophobicContact CG2-CG1 4.28Å; L261-V274 HydrophobicContact CD2-CG1 4.34Å; F270-V274 HydrophobicContact CD1-CG2 4.27Å; F270-V274 HydrophobicContact CD2-CG2 3.85Å; F270-V274 HydrophobicContact CE1-CG2 3.93Å; F270-V274 HydrophobicContact CE2-CG2 3.45Å; F270-V274 VanDerWaalsContact CE2-CG2 3.45Å; F270-V274 HydrophobicContact CG-CG2 4.23Å; F270-V274 HydrophobicContact CZ-CG2 3.49Å; F270-V274 VanDerWaalsContact CZ-CG2 3.49Å; F270-V274 WeakPolarHBondContact O-CB 2.9Å; F270-V274 VanDerWaalsContact O-CG2 3.28Å; F270-V274 WeakPolarHBondContact O-CG2 3.44Å; F270-V274 PolarHBondContact O-N 3.46Å; V274-Q277 PolarHBondContact O-N 2.89Å; V274-A278 WeakPolarHBondContact O-CB 3.43Å; V274-A278 PolarHBondContact O-N 2.94Å
275	A	87.6	Confident	79.8	Confident	35 Å²	35	55 Å²	55	29%	0.289	29%	0.292	S	S	.	.	H	α-helix	trans	-61.7	-44.4	174.4	0	0	0	0	0	111.7	T271 N272 Q277 A278 V279	T271-A275 WeakPolarHBondContact O-CB 3.44Å; T271-A275 PolarHBondContact O-N 3.44Å; N272-A275 PolarHBondContact O-N 3.47Å; A275-Q277 PolarHBondContact O-N 3.14Å; A275-A278 PolarHBondContact O-N 3.33Å; A275-V279 WeakPolarHBondContact O-CG2 3.4Å; A275-V279 PolarHBondContact O-N 3.39Å
276	A	87.6	Confident	81.6	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-60.9	-43.6	176.2	0	0	0	0	0	111.8	N272 Q273 V279 L280 L687 Y789	N272-A276 WeakPolarHBondContact O-CB 3.28Å; N272-A276 PolarHBondContact O-N 3.26Å; Q273-A276 PolarHBondContact O-N 3.49Å; A276-V279 PolarHBondContact O-N 3.1Å; A276-L280 VanDerWaalsContact O-CB 3.25Å; A276-L280 WeakPolarHBondContact O-CB 3.4Å; A276-L280 PolarHBondContact O-N 2.75Å; A276-L687 HydrophobicContact CB-CD2 4.39Å; A276-Y789 HydrophobicContact CB-CD1 4.46Å; A276-Y789 HydrophobicContact CB-CE1 3.79Å
277	Q	89.1	Confident	83.4	Confident	4 Å²	4	43.2 Å²	43.2	2%	0.019	23%	0.231	C	C	.	.	H	α-helix	trans	-64.8	-39.6	175.2	-74.6	162.9	-25.3	0	0	112.7	V224 Q273 V274 A275 L280 F281 Y789	V224-Q277 HydrophobicContact CG2-CG 4.49Å; Q273-Q277 WeakPolarHBondContact O-CG 3.47Å; Q273-Q277 PolarHBondContact O-N 3.03Å; V274-Q277 PolarHBondContact O-N 2.89Å; A275-Q277 PolarHBondContact O-N 3.14Å; Q277-L280 WeakPolarHBondContact O-CB 3.22Å; Q277-L280 PolarHBondContact O-N 3.42Å; Q277-F281 WeakPolarHBondContact O-CG 3.45Å; Q277-F281 PolarHBondContact O-N 2.94Å; Q277-Y789 HydrophobicContact CG-CE1 4.3Å; Q277-Y789 WeakPolarHBondContact CG-OH 3.2Å
278	A	92.4	Very high	85.2	Confident	32 Å²	32	39.5 Å²	39.5	26%	0.264	20%	0.201	S	C	.	.	H	α-helix	trans	-61.9	-45.8	175.5	0	0	0	0	0	111.4	I257 V274 A275 L280 F281 M282	I257-A278 HydrophobicContact CD1-CB 3.97Å; V274-A278 WeakPolarHBondContact O-CB 3.43Å; V274-A278 PolarHBondContact O-N 2.94Å; A275-A278 PolarHBondContact O-N 3.33Å; A278-L280 VanDerWaalsContact C-N 3.26Å; A278-L280 PolarHBondContact O-N 3.09Å; A278-F281 PolarHBondContact O-N 3.36Å; A278-M282 WeakPolarHBondContact O-CB 3.34Å; A278-M282 WeakPolarHBondContact O-CG 3.26Å; A278-M282 PolarHBondContact O-N 3.4Å
279	V	94.2	Very high	87.2	Confident	34 Å²	34	31.2 Å²	31.2	21%	0.206	17%	0.172	C	C	.	.	H	α-helix	trans	-62.3	-37.3	174.8	177.1	0	0	0	0	111.1	A275 A276 M282 C283 F679 A682 I683 L686	A275-V279 WeakPolarHBondContact O-CG2 3.4Å; A275-V279 PolarHBondContact O-N 3.39Å; A276-V279 PolarHBondContact O-N 3.1Å; V279-M282 WeakPolarHBondContact O-CB 3.37Å; V279-M282 PolarHBondContact O-N 2.88Å; V279-C283 WeakPolarHBondContact O-CB 3.35Å; V279-C283 PolarHBondContact O-N 3.41Å; V279-F679 HydrophobicContact CG1-CD1 3.8Å; V279-F679 HydrophobicContact CG1-CE1 4.46Å; V279-A682 HydrophobicContact CG1-CB 4.16Å; V279-I683 HydrophobicContact CB-CG1 4.13Å; V279-I683 HydrophobicContact CG1-CD1 4.46Å; V279-I683 HydrophobicContact CG1-CG1 3.67Å; V279-L686 HydrophobicContact CB-CD1 4.37Å; V279-L686 HydrophobicContact CG2-CD1 3.71Å
280	L	92.9	Very high	88.9	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.9	-45.6	179.1	-160.4	152.3	0	0	0	112.2	L228 A276 Q277 A278 C283 M284 I683 Y789 F792 L796	L228-L280 HydrophobicContact CD1-CD2 3.62Å; L228-L280 HydrophobicContact CD2-CD2 3.01Å; L228-L280 HydrophobicContact CD2-CG 4.49Å; L228-L280 HydrophobicContact CG-CD2 3.85Å; A276-L280 VanDerWaalsContact O-CB 3.25Å; A276-L280 WeakPolarHBondContact O-CB 3.4Å; A276-L280 PolarHBondContact O-N 2.75Å; Q277-L280 WeakPolarHBondContact O-CB 3.22Å; Q277-L280 PolarHBondContact O-N 3.42Å; A278-L280 VanDerWaalsContact C-N 3.26Å; A278-L280 PolarHBondContact O-N 3.09Å; L280-C283 WeakPolarHBondContact O-CB 3.4Å; L280-C283 PolarHBondContact O-N 2.94Å; L280-M284 PolarHBondContact O-N 3.37Å; L280-I683 HydrophobicContact CB-CD1 3.9Å; L280-I683 HydrophobicContact CB-CG1 4.36Å; L280-I683 HydrophobicContact CD1-CD1 4.21Å; L280-I683 HydrophobicContact CD1-CG2 4.43Å; L280-I683 HydrophobicContact CG-CD1 3.91Å; L280-Y789 HydrophobicContact CD1-CD1 4.44Å; L280-F792 HydrophobicContact CD1-CB 3.51Å; L280-F792 HydrophobicContact CD1-CD2 4.24Å; L280-F792 HydrophobicContact CD1-CG 4.26Å; L280-L796 HydrophobicContact CG-CD1 4.35Å
281	F	94.9	Very high	90	Very high	2 Å²	2	24.9 Å²	24.9	1%	0.009	14%	0.144	C	C	.	.	H	α-helix	trans	-67	-36.2	173.3	-60.5	-26.1	0	0	0	112.1	V224 V227 L228 L231 H256 I257 Q277 A278 C283 M284 N285	V224-F281 HydrophobicContact CG1-CE1 4.14Å; V224-F281 HydrophobicContact CG1-CZ 4.3Å; V227-F281 HydrophobicContact CB-CE1 3.89Å; V227-F281 HydrophobicContact CB-CZ 4.03Å; V227-F281 HydrophobicContact CG1-CD1 4.01Å; V227-F281 HydrophobicContact CG1-CE1 3.52Å; V227-F281 HydrophobicContact CG1-CE2 4.31Å; V227-F281 HydrophobicContact CG1-CZ 3.69Å; V227-F281 HydrophobicContact CG2-CZ 4.39Å; L228-F281 HydrophobicContact CD2-CD1 3.79Å; L228-F281 HydrophobicContact CD2-CE1 3.9Å; L231-F281 HydrophobicContact CD1-CB 4.23Å; L231-F281 HydrophobicContact CD1-CD1 4Å; L231-F281 HydrophobicContact CD1-CG 4.33Å; H256-F281 HydrophobicContact CB-CE2 4.21Å; H256-F281 AromaticContact ND1-CE2 3.71Å; H256-F281 AromaticContact ND1-CZ 3.85Å; I257-F281 HydrophobicContact CD1-CD2 4.17Å; I257-F281 HydrophobicContact CG1-CD2 4.18Å; I257-F281 HydrophobicContact CG1-CE2 4.22Å; Q277-F281 WeakPolarHBondContact O-CG 3.45Å; Q277-F281 PolarHBondContact O-N 2.94Å; A278-F281 PolarHBondContact O-N 3.36Å; F281-C283 VanDerWaalsContact C-N 3.33Å; F281-C283 PolarHBondContact O-N 2.93Å; F281-M284 PolarHBondContact O-N 3.46Å; F281-N285 WeakPolarHBondContact O-CB 3.39Å; F281-N285 PolarHBondContact O-N 2.91Å; F281-N285 PolarHBondContact O-ND2 3.14Å
282	M	95.2	Very high	90.7	Very high	102 Å²	102	21.4 Å²	21.4	50%	0.502	12%	0.123	S	C	.	.	H	α-helix	trans	-61.5	-40.6	172.4	-74.2	-65.2	-69.4	0	0	111.8	A278 V279 N285 T286 F679	A278-M282 WeakPolarHBondContact O-CB 3.34Å; A278-M282 WeakPolarHBondContact O-CG 3.26Å; A278-M282 PolarHBondContact O-N 3.4Å; V279-M282 WeakPolarHBondContact O-CB 3.37Å; V279-M282 PolarHBondContact O-N 2.88Å; M282-N285 PolarHBondContact O-N 3.48Å; M282-T286 WeakPolarHBondContact O-CB 3.48Å; M282-T286 VanDerWaalsContact O-CG2 3.3Å; M282-T286 WeakPolarHBondContact O-CG2 3.42Å; M282-T286 PolarHBondContact O-N 3.21Å; M282-T286 PolarHBondContact O-OG1 2.72Å; M282-F679 HydrophobicContact CB-CE1 4.42Å
283	C	95.3	Very high	91.3	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-61.7	-46.9	174.2	-174.3	0	0	0	0	111.7	V279 L280 F281 T286 A287 F679 L796	V279-C283 WeakPolarHBondContact O-CB 3.35Å; V279-C283 PolarHBondContact O-N 3.41Å; L280-C283 WeakPolarHBondContact O-CB 3.4Å; L280-C283 PolarHBondContact O-N 2.94Å; F281-C283 VanDerWaalsContact C-N 3.33Å; F281-C283 PolarHBondContact O-N 2.93Å; C283-T286 WeakPolarHBondContact CA-OG1 3.48Å; C283-T286 PolarHBondContact O-N 2.71Å; C283-T286 PolarHBondContact O-OG1 3.47Å; C283-A287 WeakPolarHBondContact O-CB 3.32Å; C283-A287 PolarHBondContact O-N 2.76Å; C283-F679 HydrophobicContact CB-CB 3.57Å; C283-F679 HydrophobicContact CB-CD1 4.17Å; C283-F679 HydrophobicContact CB-CD2 3.86Å; C283-F679 HydrophobicContact CB-CG 3.62Å; C283-F679 WeakPolarHBondContact SG-CB 3.29Å; C283-L796 HydrophobicContact CB-CD1 4.2Å; C283-L796 HydrophobicContact CB-CD2 4.29Å
284	M	94.5	Very high	91.7	Very high	2 Å²	2	16.2 Å²	16.2	1%	0.01	10%	0.097	C	C	.	.	H	α-helix	trans	-65.4	-40.3	178.9	-78.8	-56.2	-72.2	0	0	113	L228 L231 F232 L280 F281 G288 L796 V799 F862	L228-M284 HydrophobicContact CD2-CB 4.49Å; L228-M284 HydrophobicContact CD2-CG 3.63Å; L231-M284 HydrophobicContact CB-CB 4.32Å; L231-M284 HydrophobicContact CD1-CB 3.99Å; F232-M284 HydrophobicContact CB-CE 3.66Å; F232-M284 HydrophobicContact CD2-CE 4.33Å; F232-M284 HydrophobicContact CG-CE 4.45Å; L280-M284 PolarHBondContact O-N 3.37Å; F281-M284 PolarHBondContact O-N 3.46Å; M284-G288 PolarHBondContact O-N 3.32Å; M284-L796 HydrophobicContact CG-CD2 3.59Å; M284-L796 HydrophobicContact SD-CD2 3.3Å; M284-L796 WeakPolarHBondContact SD-CD2 3.44Å; M284-V799 HydrophobicContact CE-CG2 3.95Å; M284-V799 HydrophobicContact SD-CG1 4.5Å; M284-V799 HydrophobicContact SD-CG2 4.03Å; M284-F862 HydrophobicContact CE-CE1 4.31Å
285	N	94.9	Very high	91.6	Very high	6 Å²	6	15.5 Å²	15.5	3%	0.032	9%	0.092	C	C	.	.	H	α-helix	trans	-65.2	-43.7	176.1	-81.1	-80.1	0	0	0	111.5	Y235 G249 S253 F281 M282 G288 I289	Y235-N285 HydrophobicContact CE2-CB 4.47Å; Y235-N285 WeakPolarHBondContact CE2-OD1 3.06Å; Y235-N285 PolarHBondContact OH-OD1 3.33Å; G249-N285 WeakPolarHBondContact CA-OD1 3.38Å; S253-N285 PolarHBondContact OG-ND2 3.36Å; F281-N285 WeakPolarHBondContact O-CB 3.39Å; F281-N285 PolarHBondContact O-N 2.91Å; F281-N285 PolarHBondContact O-ND2 3.14Å; M282-N285 PolarHBondContact O-N 3.48Å; N285-G288 PolarHBondContact O-N 3.11Å; N285-I289 WeakPolarHBondContact O-CB 3.15Å; N285-I289 WeakPolarHBondContact O-CD1 3.48Å; N285-I289 WeakPolarHBondContact O-CG1 3.34Å; N285-I289 PolarHBondContact O-N 3.49Å
286	T	93.5	Very high	91.5	Very high	36 Å²	36	15 Å²	15	22%	0.221	9%	0.085	C	C	.	.	H	α-helix	trans	-64.4	-49	177.6	51.5	0	0	0	0	111.6	M282 C283 G288 I289 F290 F679	M282-T286 WeakPolarHBondContact O-CB 3.48Å; M282-T286 VanDerWaalsContact O-CG2 3.3Å; M282-T286 WeakPolarHBondContact O-CG2 3.42Å; M282-T286 PolarHBondContact O-N 3.21Å; M282-T286 PolarHBondContact O-OG1 2.72Å; C283-T286 WeakPolarHBondContact CA-OG1 3.48Å; C283-T286 PolarHBondContact O-N 2.71Å; C283-T286 PolarHBondContact O-OG1 3.47Å; T286-G288 VanDerWaalsContact C-N 3.32Å; T286-G288 PolarHBondContact O-N 3.46Å; T286-I289 PolarHBondContact O-N 3.34Å; T286-F290 WeakPolarHBondContact O-CD2 3.3Å; T286-F290 PolarHBondContact O-N 3.19Å; T286-F290 VanDerWaalsContact O-N 3.11Å; T286-F679 HydrophobicContact CG2-CE2 4.18Å; T286-F679 HydrophobicContact CG2-CZ 4.27Å; T286-F679 VanDerWaalsContact OG1-CE2 3.29Å; T286-F679 WeakPolarHBondContact OG1-CE2 3.39Å
287	A	93.3	Very high	91.3	Very high	2 Å²	2	15.6 Å²	15.6	2%	0.017	9%	0.087	C	C	.	.	H	α-helix	trans	-59.3	-42	175.1	0	0	0	0	0	112.2	C283 F290 I291 V676 V799	C283-A287 WeakPolarHBondContact O-CB 3.32Å; C283-A287 PolarHBondContact O-N 2.76Å; A287-F290 PolarHBondContact O-N 2.76Å; A287-I291 VanDerWaalsContact O-CG1 3.27Å; A287-I291 WeakPolarHBondContact O-CG1 3.35Å; A287-I291 PolarHBondContact O-N 3.03Å; A287-V676 HydrophobicContact CB-CG2 4.04Å; A287-V799 HydrophobicContact CB-CG1 4.15Å
288	G	93.3	Very high	90.9	Very high	3 Å²	3	15.8 Å²	15.8	3%	0.031	9%	0.089	C	C	.	.	H	α-helix	trans	-61.7	-43.5	176.1	0	0	0	0	0	113.4	Y235 M284 N285 T286 F290 I291 S292	Y235-G288 WeakPolarHBondContact CB-O 3.23Å; M284-G288 PolarHBondContact O-N 3.32Å; N285-G288 PolarHBondContact O-N 3.11Å; T286-G288 VanDerWaalsContact C-N 3.32Å; T286-G288 PolarHBondContact O-N 3.46Å; G288-F290 VanDerWaalsContact C-N 3.35Å; G288-F290 PolarHBondContact O-N 3.36Å; G288-I291 PolarHBondContact O-N 2.79Å; G288-S292 WeakPolarHBondContact O-CB 3.39Å; G288-S292 PolarHBondContact O-N 3.49Å
289	I	93	Very high	90.3	Very high	39 Å²	39	14.4 Å²	14.4	20%	0.2	8%	0.077	C	C	.	.	H	α-helix	trans	-59.3	-46.4	174.6	-70.9	164	0	0	0	110.5	P108 Y235 I246 N285 T286 S292 Y293	P108-I289 HydrophobicContact CB-CG2 3.9Å; P108-I289 HydrophobicContact CG-CG2 4.18Å; Y235-I289 HydrophobicContact CE1-CG1 3.84Å; I246-I289 HydrophobicContact CD1-CD1 4.45Å; I246-I289 HydrophobicContact CD1-CG1 4.33Å; I246-I289 HydrophobicContact CG1-CD1 4.1Å; I246-I289 HydrophobicContact CG1-CG1 3.87Å; N285-I289 WeakPolarHBondContact O-CB 3.15Å; N285-I289 WeakPolarHBondContact O-CD1 3.48Å; N285-I289 WeakPolarHBondContact O-CG1 3.34Å; N285-I289 PolarHBondContact O-N 3.49Å; T286-I289 PolarHBondContact O-N 3.34Å; I289-S292 PolarHBondContact O-N 3.33Å; I289-Y293 WeakPolarHBondContact O-CB 3.22Å; I289-Y293 PolarHBondContact O-N 3.4Å
290	F	91.6	Very high	89.8	Confident	19 Å²	19	13.1 Å²	13.1	8%	0.083	7%	0.069	C	C	.	.	H	α-helix	trans	-61.8	-46.9	176.8	-88	-80.8	0	0	0	111.9	P108 T286 A287 G288 S292 Y293 L294 C672 I675	P108-F290 HydrophobicContact CG-CD1 3.89Å; P108-F290 HydrophobicContact CG-CD2 4.39Å; P108-F290 HydrophobicContact CG-CE1 3.73Å; P108-F290 HydrophobicContact CG-CE2 4.23Å; P108-F290 HydrophobicContact CG-CG 4.23Å; P108-F290 HydrophobicContact CG-CZ 3.9Å; T286-F290 WeakPolarHBondContact O-CD2 3.3Å; T286-F290 PolarHBondContact O-N 3.19Å; T286-F290 VanDerWaalsContact O-N 3.11Å; A287-F290 PolarHBondContact O-N 2.76Å; G288-F290 VanDerWaalsContact C-N 3.35Å; G288-F290 PolarHBondContact O-N 3.36Å; F290-S292 PolarHBondContact O-N 2.91Å; F290-Y293 PolarHBondContact O-N 3.3Å; F290-L294 HydrophobicContact CD1-CD1 4.34Å; F290-L294 VanDerWaalsContact O-CB 3.29Å; F290-L294 WeakPolarHBondContact O-CB 3.47Å; F290-L294 VanDerWaalsContact O-CG 3.23Å; F290-L294 WeakPolarHBondContact O-CG 3.45Å; F290-L294 PolarHBondContact O-N 3.18Å; F290-C672 HydrophobicContact CB-CB 4.14Å; F290-C672 WeakPolarHBondContact CB-SG 3.3Å; F290-C672 HydrophobicContact CD1-CB 3.98Å; F290-C672 HydrophobicContact CD2-CB 4.31Å; F290-C672 HydrophobicContact CE1-CB 4.46Å; F290-C672 HydrophobicContact CG-CB 3.9Å; F290-I675 HydrophobicContact CE2-CD1 3.86Å; F290-I675 HydrophobicContact CZ-CD1 3.96Å
291	I	90.8	Very high	89.1	Confident	2 Å²	2	14.7 Å²	14.7	1%	0.01	8%	0.076	C	C	.	.	H	α-helix	trans	-59	-50.1	177.9	-69.9	164.6	0	0	0	110.6	F232 A287 G288 S295 V799 A802 V803	F232-I291 HydrophobicContact CE2-CD1 4.18Å; A287-I291 VanDerWaalsContact O-CG1 3.27Å; A287-I291 WeakPolarHBondContact O-CG1 3.35Å; A287-I291 PolarHBondContact O-N 3.03Å; G288-I291 PolarHBondContact O-N 2.79Å; I291-S295 WeakPolarHBondContact O-CB 3.47Å; I291-S295 PolarHBondContact O-N 3.03Å; I291-V799 HydrophobicContact CD1-CG1 3.92Å; I291-A802 HydrophobicContact CD1-CB 3.96Å; I291-V803 HydrophobicContact CD1-CG2 4.12Å; I291-V803 HydrophobicContact CG1-CG2 3.9Å
292	S	89.8	Confident	88.2	Confident	4 Å²	4	14.8 Å²	14.8	3%	0.028	8%	0.077	C	C	.	.	H	α-helix	trans	-65.5	-42.1	-178.4	-175.7	0	0	0	0	112	G288 I289 F290 D296	G288-S292 WeakPolarHBondContact O-CB 3.39Å; G288-S292 PolarHBondContact O-N 3.49Å; I289-S292 PolarHBondContact O-N 3.33Å; F290-S292 PolarHBondContact O-N 2.91Å; S292-D296 VanDerWaalsContact O-CB 3.28Å; S292-D296 WeakPolarHBondContact O-CB 3.35Å; S292-D296 PolarHBondContact O-N 3.11Å
293	Y	89	Confident	87.4	Confident	1 Å²	1	10.1 Å²	10.1	0%	0.004	5%	0.054	C	C	.	.	H	α-helix	trans	-68.7	-46.8	-179.3	176.9	-101.8	0	0	0	112.3	I106 F107 P108 T109 L242 I289 F290 S295 D296 R297	I106-Y293 HydrophobicContact CG2-CE1 3.79Å; F107-Y293 WeakPolarHBondContact O-CE1 3.33Å; F107-Y293 PolarHBondContact O-OH 2.81Å; P108-Y293 HydrophobicContact CB-CD1 4.17Å; P108-Y293 HydrophobicContact CB-CD2 4.46Å; P108-Y293 HydrophobicContact CB-CG 4.08Å; P108-Y293 HydrophobicContact CG-CD1 4.34Å; T109-Y293 PolarHBondContact OG1-OH 3.27Å; L242-Y293 HydrophobicContact CD2-CD2 4.09Å; I289-Y293 WeakPolarHBondContact O-CB 3.22Å; I289-Y293 PolarHBondContact O-N 3.4Å; F290-Y293 PolarHBondContact O-N 3.3Å; Y293-S295 VanDerWaalsContact C-N 3.35Å; Y293-D296 PolarHBondContact O-N 2.83Å; Y293-R297 WeakPolarHBondContact O-CB 3.16Å; Y293-R297 PolarHBondContact O-N 3.05Å
294	L	86.8	Confident	86.6	Confident	1 Å²	1	10.2 Å²	10.2	1%	0.005	6%	0.055	C	C	.	.	H	α-helix	trans	-69.1	-35.5	-179.9	-64.4	175.8	0	0	0	111.4	F290 A298 V665 N669 L805	F290-L294 HydrophobicContact CD1-CD1 4.34Å; F290-L294 VanDerWaalsContact O-CB 3.29Å; F290-L294 WeakPolarHBondContact O-CB 3.47Å; F290-L294 VanDerWaalsContact O-CG 3.23Å; F290-L294 WeakPolarHBondContact O-CG 3.45Å; F290-L294 PolarHBondContact O-N 3.18Å; L294-A298 WeakPolarHBondContact O-CB 3.32Å; L294-A298 PolarHBondContact O-N 2.99Å; L294-V665 HydrophobicContact CD2-CG1 4.31Å; L294-N669 WeakPolarHBondContact CD1-OD1 3.26Å; L294-L805 HydrophobicContact CB-CD1 3.81Å
295	S	84.8	Confident	85.6	Confident	1 Å²	1	11.1 Å²	11.1	1%	0.007	6%	0.059	C	C	.	.	H	α-helix	trans	-66.1	-47.7	173.8	-173.4	0	0	0	0	112	I291 Y293 R297 A298 Q299	I291-S295 WeakPolarHBondContact O-CB 3.47Å; I291-S295 PolarHBondContact O-N 3.03Å; Y293-S295 VanDerWaalsContact C-N 3.35Å; S295-R297 PolarHBondContact O-N 3.22Å; S295-A298 PolarHBondContact O-N 2.87Å; S295-Q299 WeakPolarHBondContact O-CB 3.49Å; S295-Q299 VanDerWaalsContact O-CG 3.26Å; S295-Q299 WeakPolarHBondContact O-CG 3.33Å; S295-Q299 PolarHBondContact O-N 3.23Å
296	D	84.9	Confident	84.6	Confident	24 Å²	24	11.9 Å²	11.9	13%	0.128	6%	0.064	C	C	.	.	H	α-helix	trans	-57.4	-46.4	175.7	175.8	76.1	0	0	0	111.5	N112 Y123 S292 Y293 Q299 R300	N112-D296 PolarHBondContact ND2-OD2 2.85Å; N112-D296 VanDerWaalsContact ND2-OD2 3.11Å; Y123-D296 PolarHBondContact OH-OD1 3.25Å; S292-D296 VanDerWaalsContact O-CB 3.28Å; S292-D296 WeakPolarHBondContact O-CB 3.35Å; S292-D296 PolarHBondContact O-N 3.11Å; Y293-D296 PolarHBondContact O-N 2.83Å; D296-Q299 PolarHBondContact O-N 3.42Å; D296-R300 WeakPolarHBondContact O-CG 3.31Å; D296-R300 PolarHBondContact O-N 2.69Å; D296-R300 IonicContact OD1-CZ 4Å; D296-R300 IonicContact OD1-NE 3.39Å; D296-R300 PolarHBondContact OD1-NE 3.34Å; D296-R300 IonicContact OD1-NH2 2.94Å; D296-R300 WeakPolarHBondContact OD2-CD 3.12Å; D296-R300 IonicContact OD2-CZ 3.72Å; D296-R300 IonicContact OD2-NE 2.98Å; D296-R300 PolarHBondContact OD2-NE 3.05Å
297	R	83.2	Confident	83.7	Confident	13 Å²	13	11.7 Å²	11.7	5%	0.049	6%	0.059	C	C	.	.	H	α-helix	trans	-61.5	-47.5	177.6	-174	-179.4	179.4	97.9	-1.9	112.3	W98 Y293 S295 Q299 R300 Q301	W98-R297 PolarHBondContact O-NH1 3.18Å; Y293-R297 WeakPolarHBondContact O-CB 3.16Å; Y293-R297 PolarHBondContact O-N 3.05Å; S295-R297 PolarHBondContact O-N 3.22Å; R297-Q299 VanDerWaalsContact C-N 3.26Å; R297-Q299 PolarHBondContact O-N 3.43Å; R297-R300 PolarHBondContact O-N 3.44Å; R297-Q301 PolarHBondContact O-N 3.35Å
298	A	80.4	Confident	82.7	Confident	8 Å²	8	15.2 Å²	15.2	7%	0.066	7%	0.072	C	C	.	.	H	α-helix	trans	-59.2	-40.3	177.7	0	0	0	0	0	111.5	L294 S295 A302 L877	L294-A298 WeakPolarHBondContact O-CB 3.32Å; L294-A298 PolarHBondContact O-N 2.99Å; S295-A298 PolarHBondContact O-N 2.87Å; A298-A302 WeakPolarHBondContact O-CB 3.39Å; A298-A302 PolarHBondContact O-N 3.47Å; A298-L877 HydrophobicContact CB-CD2 4.14Å; A298-L877 HydrophobicContact CB-CG 4.4Å
299	Q	80.6	Confident	81.6	Confident	3 Å²	3	16 Å²	16	1%	0.014	8%	0.077	C	C	.	.	H	α-helix	trans	-68	-42.5	177.2	-72.3	173.8	-13	0	0	112.7	Y123 F127 S295 D296 R297 Q301 A302 F303	Y123-Q299 HydrophobicContact CE2-CB 4.45Å; F127-Q299 VanDerWaalsContact CD2-OE1 3.24Å; F127-Q299 VanDerWaalsContact CE2-OE1 3.28Å; S295-Q299 WeakPolarHBondContact O-CB 3.49Å; S295-Q299 VanDerWaalsContact O-CG 3.26Å; S295-Q299 WeakPolarHBondContact O-CG 3.33Å; S295-Q299 PolarHBondContact O-N 3.23Å; D296-Q299 PolarHBondContact O-N 3.42Å; R297-Q299 VanDerWaalsContact C-N 3.26Å; R297-Q299 PolarHBondContact O-N 3.43Å; Q299-Q301 VanDerWaalsContact C-N 3.34Å; Q299-Q301 PolarHBondContact O-N 2.93Å; Q299-A302 PolarHBondContact O-N 3.24Å; Q299-F303 WeakPolarHBondContact O-CB 3.43Å; Q299-F303 PolarHBondContact O-N 2.94Å
300	R	83.2	Confident	80.5	Confident	7 Å²	7	15.2 Å²	15.2	3%	0.026	7%	0.073	C	C	.	.	H	α-helix	trans	-61.6	-42.4	176.2	-74.7	175.7	-179.6	-87.7	-0.4	111.9	F95 N112 F114 E120 Y123 D296 R297 F303 L304	F95-R300 HydrophobicContact CE1-CB 4.19Å; F95-R300 HydrophobicContact CZ-CB 4.33Å; N112-R300 PolarHBondContact O-NH2 2.97Å; F114-R300 HydrophobicContact CE2-CG 4.19Å; F114-R300 VanDerWaalsContact CE2-NH1 3.34Å; F114-R300 HydrophobicContact CZ-CB 3.88Å; F114-R300 HydrophobicContact CZ-CG 4.03Å; E120-R300 IonicContact OE1-CZ 3.37Å; E120-R300 IonicContact OE1-NH1 3.33Å; E120-R300 PolarHBondContact OE1-NH1 3.48Å; E120-R300 IonicContact OE1-NH2 2.94Å; E120-R300 PolarHBondContact OE1-NH2 3.34Å; E120-R300 IonicContact OE2-CZ 3.94Å; E120-R300 IonicContact OE2-NH1 3.56Å; E120-R300 PolarHBondContact OE2-NH1 3.07Å; E120-R300 IonicContact OE2-NH2 3.19Å; Y123-R300 HydrophobicContact CD1-CG 4.27Å; Y123-R300 HydrophobicContact CD2-CG 4Å; Y123-R300 HydrophobicContact CE1-CG 3.73Å; Y123-R300 HydrophobicContact CE2-CB 4.16Å; Y123-R300 HydrophobicContact CE2-CG 3.41Å; Y123-R300 VanDerWaalsContact CE2-CG 3.41Å; Y123-R300 HydrophobicContact CG-CG 4.4Å; D296-R300 WeakPolarHBondContact O-CG 3.31Å; D296-R300 PolarHBondContact O-N 2.69Å; D296-R300 IonicContact OD1-CZ 4Å; D296-R300 IonicContact OD1-NE 3.39Å; D296-R300 PolarHBondContact OD1-NE 3.34Å; D296-R300 IonicContact OD1-NH2 2.94Å; D296-R300 WeakPolarHBondContact OD2-CD 3.12Å; D296-R300 IonicContact OD2-CZ 3.72Å; D296-R300 IonicContact OD2-NE 2.98Å; D296-R300 PolarHBondContact OD2-NE 3.05Å; R297-R300 PolarHBondContact O-N 3.44Å; R300-F303 PolarHBondContact O-N 3.29Å; R300-L304 PolarHBondContact O-N 3.03Å
301	Q	78.5	Confident	79.6	Confident	34 Å²	34	16.3 Å²	16.3	16%	0.159	8%	0.078	C	C	.	.	H	α-helix	trans	-63.5	-47.5	176.5	-179	169.8	-6.7	0	0	111.4	R297 Q299 F303 L304 E305	R297-Q301 PolarHBondContact O-N 3.35Å; Q299-Q301 VanDerWaalsContact C-N 3.34Å; Q299-Q301 PolarHBondContact O-N 2.93Å; Q301-F303 VanDerWaalsContact C-N 3.29Å; Q301-F303 PolarHBondContact O-N 3.17Å; Q301-L304 PolarHBondContact O-N 2.82Å; Q301-E305 PolarHBondContact NE2-OE1 3.42Å; Q301-E305 VanDerWaalsContact O-CG 3.28Å; Q301-E305 WeakPolarHBondContact O-CG 2.95Å; Q301-E305 PolarHBondContact O-N 3.36Å
302	A	76.1	Confident	78.7	Confident	4 Å²	4	18.2 Å²	18.2	3%	0.033	10%	0.095	C	C	.	.	H	α-helix	trans	-62.3	-37	177.5	0	0	0	0	0	113	A298 Q299 E305 T306 S876	A298-A302 WeakPolarHBondContact O-CB 3.39Å; A298-A302 PolarHBondContact O-N 3.47Å; Q299-A302 PolarHBondContact O-N 3.24Å; A302-E305 PolarHBondContact O-N 2.99Å; A302-T306 WeakPolarHBondContact O-CB 3.3Å; A302-T306 PolarHBondContact O-N 3.09Å; A302-T306 PolarHBondContact O-OG1 3.31Å; A302-S876 WeakPolarHBondContact CB-O 3.23Å
303	F	79.1	Confident	77.7	Confident	4 Å²	4	22.1 Å²	22.1	2%	0.018	11%	0.108	C	C	.	.	H	α-helix	trans	-62.2	-48	174	169.5	-102.9	0	0	0	112	F114 L119 L122 Y123 Y126 Q299 R300 Q301 E305 T306 R307	F114-F303 HydrophobicContact CE2-CD1 4.26Å; F114-F303 HydrophobicContact CE2-CE1 4.41Å; F114-F303 HydrophobicContact CZ-CD1 4.21Å; L119-F303 HydrophobicContact CD1-CE1 3.57Å; L119-F303 HydrophobicContact CD1-CZ 4.01Å; L119-F303 HydrophobicContact CG-CE1 4.27Å; L122-F303 HydrophobicContact CB-CZ 4.13Å; L122-F303 HydrophobicContact CD2-CE2 4.33Å; L122-F303 HydrophobicContact CD2-CZ 3.83Å; L122-F303 HydrophobicContact CG-CE2 4.13Å; L122-F303 HydrophobicContact CG-CZ 3.8Å; Y123-F303 HydrophobicContact CD2-CB 4.05Å; Y123-F303 AromaticContact CD2-CD1 3.91Å; Y123-F303 HydrophobicContact CD2-CD1 3.91Å; Y123-F303 AromaticContact CD2-CG 3.94Å; Y123-F303 HydrophobicContact CD2-CG 3.94Å; Y123-F303 HydrophobicContact CE2-CB 4.45Å; Y123-F303 HydrophobicContact CG-CD1 4.49Å; Y126-F303 HydrophobicContact CD1-CB 4.28Å; Y126-F303 HydrophobicContact CD1-CD2 4.08Å; Y126-F303 HydrophobicContact CD2-CD2 4.42Å; Y126-F303 HydrophobicContact CE1-CB 4.3Å; Y126-F303 AromaticContact CG-CD2 3.96Å; Y126-F303 HydrophobicContact CG-CD2 3.96Å; Q299-F303 WeakPolarHBondContact O-CB 3.43Å; Q299-F303 PolarHBondContact O-N 2.94Å; R300-F303 PolarHBondContact O-N 3.29Å; Q301-F303 VanDerWaalsContact C-N 3.29Å; Q301-F303 PolarHBondContact O-N 3.17Å; F303-E305 VanDerWaalsContact C-N 3.32Å; F303-E305 PolarHBondContact O-N 3.41Å; F303-T306 PolarHBondContact O-N 3.36Å; F303-R307 WeakPolarHBondContact O-CB 3.14Å; F303-R307 PolarHBondContact O-N 3.27Å
304	L	77.9	Confident	76.8	Confident	2 Å²	2	24.3 Å²	24.3	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-60.1	-42.4	176.8	-76.4	-178.5	0	0	0	112.4	F94 F95 F114 L119 R300 Q301 R307 R308	F94-L304 HydrophobicContact CB-CD1 4.18Å; F94-L304 HydrophobicContact CB-CD2 4.45Å; F94-L304 HydrophobicContact CG-CD1 4.47Å; F94-L304 HydrophobicContact CG-CD2 4.34Å; F95-L304 HydrophobicContact CE2-CD1 3.5Å; F95-L304 VanDerWaalsContact CE2-CD1 3.5Å; F95-L304 HydrophobicContact CZ-CD1 3.72Å; F114-L304 HydrophobicContact CE1-CD1 3.8Å; F114-L304 HydrophobicContact CE1-CD2 3.81Å; F114-L304 HydrophobicContact CE1-CG 3.79Å; F114-L304 HydrophobicContact CZ-CD1 4.45Å; F114-L304 HydrophobicContact CZ-CD2 4.2Å; F114-L304 HydrophobicContact CZ-CG 4.04Å; L119-L304 HydrophobicContact CD2-CD2 3.97Å; R300-L304 PolarHBondContact O-N 3.03Å; Q301-L304 PolarHBondContact O-N 2.82Å; L304-R307 PolarHBondContact O-N 2.9Å; L304-R308 WeakPolarHBondContact O-CG 3.33Å; L304-R308 PolarHBondContact O-N 2.81Å
305	E	73.2	Confident	76.1	Confident	20 Å²	20	31.6 Å²	31.6	9%	0.093	15%	0.148	C	C	.	.	H	α-helix	trans	-65.1	-42.9	178.9	-69.5	173	172	0	0	111.6	Q301 A302 F303 R307 R308 C309 K881	Q301-E305 PolarHBondContact NE2-OE1 3.42Å; Q301-E305 VanDerWaalsContact O-CG 3.28Å; Q301-E305 WeakPolarHBondContact O-CG 2.95Å; Q301-E305 PolarHBondContact O-N 3.36Å; A302-E305 PolarHBondContact O-N 2.99Å; F303-E305 VanDerWaalsContact C-N 3.32Å; F303-E305 PolarHBondContact O-N 3.41Å; E305-R307 VanDerWaalsContact C-N 3.34Å; E305-R307 PolarHBondContact O-N 3.43Å; E305-R308 PolarHBondContact O-N 2.82Å; E305-C309 PolarHBondContact O-N 2.93Å; E305-K881 HydrophobicContact CB-CG 4.21Å; E305-K881 WeakPolarHBondContact OE1-CE 3.31Å; E305-K881 IonicContact OE1-NZ 2.69Å; E305-K881 PolarHBondContact OE1-NZ 3.37Å; E305-K881 WeakPolarHBondContact OE2-CD 3.28Å; E305-K881 WeakPolarHBondContact OE2-CE 3.46Å; E305-K881 IonicContact OE2-NZ 2.72Å; E305-K881 PolarHBondContact OE2-NZ 3.26Å
306	T	72.9	Confident	75.4	Confident	23 Å²	23	36.2 Å²	36.2	14%	0.141	17%	0.171	C	C	.	.	H	α-helix	trans	-61.3	-44.6	175	-56.2	0	0	0	0	110.7	A302 F303 R308 C309 I310	A302-T306 WeakPolarHBondContact O-CB 3.3Å; A302-T306 PolarHBondContact O-N 3.09Å; A302-T306 PolarHBondContact O-OG1 3.31Å; F303-T306 PolarHBondContact O-N 3.36Å; T306-R308 PolarHBondContact O-N 2.82Å; T306-C309 PolarHBondContact O-N 3.49Å; T306-I310 HydrophobicContact CG2-CD1 3.97Å; T306-I310 WeakPolarHBondContact O-CG1 3.37Å; T306-I310 PolarHBondContact O-N 2.65Å
307	R	75.3	Confident	74.6	Confident	32 Å²	32	38.8 Å²	38.8	12%	0.121	18%	0.183	C	C	.	.	H	α-helix	trans	-58.6	-49.2	176.9	-165	-167.2	72.6	176.1	-2	111.9	F303 L304 E305 C309 I310 E311 I625	F303-R307 WeakPolarHBondContact O-CB 3.14Å; F303-R307 PolarHBondContact O-N 3.27Å; L304-R307 PolarHBondContact O-N 2.9Å; E305-R307 VanDerWaalsContact C-N 3.34Å; E305-R307 PolarHBondContact O-N 3.43Å; R307-C309 VanDerWaalsContact C-N 3.26Å; R307-C309 PolarHBondContact O-N 3.31Å; R307-I310 PolarHBondContact O-N 3.43Å; R307-E311 VanDerWaalsContact O-CB 3.32Å; R307-E311 WeakPolarHBondContact O-CB 3.17Å; R307-E311 PolarHBondContact O-N 2.77Å; R307-I625 HydrophobicContact CG-CD1 3.74Å
308	R	72.4	Confident	74.1	Confident	75 Å²	75	41.1 Å²	41.1	28%	0.283	20%	0.198	S	C	.	.	H	α-helix	trans	-60.1	-37.5	178.3	-73.6	179.3	-170.3	151.9	4.8	112	N91 F94 L304 E305 T306 A312	N91-R308 VanDerWaalsContact OD1-CZ 3.22Å; N91-R308 PolarHBondContact OD1-NH1 3.26Å; N91-R308 PolarHBondContact OD1-NH2 3.01Å; F94-R308 VanDerWaalsContact CE2-NH2 3.35Å; L304-R308 WeakPolarHBondContact O-CG 3.33Å; L304-R308 PolarHBondContact O-N 2.81Å; E305-R308 PolarHBondContact O-N 2.82Å; T306-R308 PolarHBondContact O-N 2.82Å; R308-A312 VanDerWaalsContact O-CB 3.31Å; R308-A312 WeakPolarHBondContact O-CB 3.24Å; R308-A312 PolarHBondContact O-N 3.46Å
309	C	70.1	Confident	73.7	Confident	19 Å²	19	45.6 Å²	45.6	13%	0.128	22%	0.218	C	C	.	.	H	α-helix	trans	-68.6	-44.9	177.9	-167.2	0	0	0	0	112.1	E305 T306 R307 E311 A312 R313 S884	E305-C309 PolarHBondContact O-N 2.93Å; T306-C309 PolarHBondContact O-N 3.49Å; R307-C309 VanDerWaalsContact C-N 3.26Å; R307-C309 PolarHBondContact O-N 3.31Å; C309-E311 VanDerWaalsContact C-N 3.33Å; C309-E311 PolarHBondContact O-N 3.46Å; C309-A312 PolarHBondContact O-N 2.98Å; C309-R313 WeakPolarHBondContact O-CB 3.38Å; C309-R313 PolarHBondContact O-N 3.32Å; C309-S884 WeakPolarHBondContact SG-CB 3.47Å; C309-S884 PolarHBondContact SG-OG 2.94Å
310	I	70.4	Confident	73.3	Confident	24 Å²	24	50.1 Å²	50.1	12%	0.123	24%	0.242	C	C	.	.	H	α-helix	trans	-62.2	-43.1	175.2	-64.7	169.3	0	0	0	110.6	T306 R307 R313 L314 I625 A628 I629	T306-I310 HydrophobicContact CG2-CD1 3.97Å; T306-I310 WeakPolarHBondContact O-CG1 3.37Å; T306-I310 PolarHBondContact O-N 2.65Å; R307-I310 PolarHBondContact O-N 3.43Å; I310-R313 PolarHBondContact O-N 3.49Å; I310-L314 HydrophobicContact CG2-CD1 4.09Å; I310-L314 HydrophobicContact CG2-CG 4.43Å; I310-L314 WeakPolarHBondContact O-CG 3.43Å; I310-L314 PolarHBondContact O-N 3.3Å; I310-I625 HydrophobicContact CD1-CG2 4.45Å; I310-I625 HydrophobicContact CG2-CG1 3.91Å; I310-A628 HydrophobicContact CG2-CB 4.16Å; I310-I629 HydrophobicContact CD1-CD1 4.31Å; I310-I629 HydrophobicContact CD1-CG1 3.71Å
311	E	72	Confident	72.7	Confident	41 Å²	41	54.8 Å²	54.8	19%	0.192	26%	0.264	C	S	.	.	H	α-helix	trans	-61.1	-46.3	176.8	-177.3	177.8	-175.5	0	0	111.9	R307 C309 R313 L314 R315	R307-E311 VanDerWaalsContact O-CB 3.32Å; R307-E311 WeakPolarHBondContact O-CB 3.17Å; R307-E311 PolarHBondContact O-N 2.77Å; C309-E311 VanDerWaalsContact C-N 3.33Å; C309-E311 PolarHBondContact O-N 3.46Å; E311-R313 VanDerWaalsContact C-N 3.34Å; E311-R313 PolarHBondContact O-N 2.95Å; E311-L314 PolarHBondContact O-N 3.47Å; E311-R315 VanDerWaalsContact O-CG 3.32Å; E311-R315 WeakPolarHBondContact O-CG 3.44Å; E311-R315 PolarHBondContact O-N 3.38Å; E311-R315 IonicContact OE1-CZ 3.94Å; E311-R315 IonicContact OE1-NE 2.69Å; E311-R315 IonicContact OE1-NH2 3.53Å; E311-R315 PolarHBondContact OE1-NH2 3.38Å
312	A	71.4	Confident	72.4	Confident	43 Å²	43	57.5 Å²	57.5	36%	0.355	27%	0.273	S	S	.	.	H	α-helix	trans	-61.2	-42.4	176.1	0	0	0	0	0	111.7	R308 C309 R315 L316	R308-A312 VanDerWaalsContact O-CB 3.31Å; R308-A312 WeakPolarHBondContact O-CB 3.24Å; R308-A312 PolarHBondContact O-N 3.46Å; C309-A312 PolarHBondContact O-N 2.98Å; A312-R315 PolarHBondContact O-N 3.45Å; A312-L316 WeakPolarHBondContact O-CG 3.33Å; A312-L316 PolarHBondContact O-N 3.41Å
313	R	69.5	Low	72.2	Confident	85 Å²	85	63 Å²	63	32%	0.321	30%	0.298	S	S	.	.	H	α-helix	trans	-61.5	-47.5	176.1	178.4	-176.7	168.8	142	11.6	112.3	C309 I310 E311 R315 L316 E317	C309-R313 WeakPolarHBondContact O-CB 3.38Å; C309-R313 PolarHBondContact O-N 3.32Å; I310-R313 PolarHBondContact O-N 3.49Å; E311-R313 VanDerWaalsContact C-N 3.34Å; E311-R313 PolarHBondContact O-N 2.95Å; R313-R315 VanDerWaalsContact C-N 3.28Å; R313-R315 PolarHBondContact O-N 2.96Å; R313-L316 PolarHBondContact O-N 3.05Å; R313-E317 IonicContact CZ-OE1 2.86Å; R313-E317 IonicContact NE-OE1 3.46Å; R313-E317 PolarHBondContact NE-OE1 2.83Å; R313-E317 IonicContact NH2-OE1 3.19Å; R313-E317 PolarHBondContact NH2-OE1 2.74Å; R313-E317 PolarHBondContact O-N 3.37Å
314	L	69.2	Low	71.9	Confident	47 Å²	47	68 Å²	68	25%	0.246	32%	0.322	C	S	.	.	H	α-helix	trans	-62	-38.2	177.9	-72.8	173.1	0	0	0	111.6	I310 E311 T318 R624	I310-L314 HydrophobicContact CG2-CD1 4.09Å; I310-L314 HydrophobicContact CG2-CG 4.43Å; I310-L314 WeakPolarHBondContact O-CG 3.43Å; I310-L314 PolarHBondContact O-N 3.3Å; E311-L314 PolarHBondContact O-N 3.47Å; L314-T318 WeakPolarHBondContact O-CB 3.4Å; L314-T318 PolarHBondContact O-N 3.49Å; L314-T318 PolarHBondContact O-OG1 2.94Å; L314-R624 HydrophobicContact CD1-CB 4.31Å
315	R	72.9	Confident	71.6	Confident	155 Å²	155	73.7 Å²	73.7	59%	0.585	34%	0.343	S	S	*	.	H	α-helix	trans	-62.4	-47.1	172.9	-71.8	176.3	-172.3	-166.3	1	111.1	E311 A312 R313 T318 E319	E311-R315 VanDerWaalsContact O-CG 3.32Å; E311-R315 WeakPolarHBondContact O-CG 3.44Å; E311-R315 PolarHBondContact O-N 3.38Å; E311-R315 IonicContact OE1-CZ 3.94Å; E311-R315 IonicContact OE1-NE 2.69Å; E311-R315 IonicContact OE1-NH2 3.53Å; E311-R315 PolarHBondContact OE1-NH2 3.38Å; A312-R315 PolarHBondContact O-N 3.45Å; R313-R315 VanDerWaalsContact C-N 3.28Å; R313-R315 PolarHBondContact O-N 2.96Å; R315-T318 PolarHBondContact O-N 2.99Å; R315-E319 WeakPolarHBondContact O-CG 3.36Å; R315-E319 PolarHBondContact O-N 3.28Å
316	L	69.9	Low	71.9	Confident	97 Å²	97	77.5 Å²	77.5	51%	0.508	36%	0.363	S	S	.	.	H	α-helix	trans	-60.9	-45.5	177.3	-72.7	172	0	0	0	112.5	A312 R313 T318 E319 N320	A312-L316 WeakPolarHBondContact O-CG 3.33Å; A312-L316 PolarHBondContact O-N 3.41Å; R313-L316 PolarHBondContact O-N 3.05Å; L316-T318 VanDerWaalsContact C-N 3.29Å; L316-T318 PolarHBondContact O-N 3.32Å; L316-E319 PolarHBondContact O-N 3.04Å; L316-N320 VanDerWaalsContact O-CB 3.3Å; L316-N320 WeakPolarHBondContact O-CB 3.46Å; L316-N320 PolarHBondContact O-N 3.07Å
317	E	69.3	Low	72.1	Confident	79 Å²	79	79.1 Å²	79.1	37%	0.369	37%	0.373	S	S	.	.	H	α-helix	trans	-61.2	-39.2	176.6	-73.9	173.8	-174.1	0	0	111.4	R313 Q321	R313-E317 IonicContact CZ-OE1 2.86Å; R313-E317 IonicContact NE-OE1 3.46Å; R313-E317 PolarHBondContact NE-OE1 2.83Å; R313-E317 IonicContact NH2-OE1 3.19Å; R313-E317 PolarHBondContact NH2-OE1 2.74Å; R313-E317 PolarHBondContact O-N 3.37Å; E317-Q321 WeakPolarHBondContact O-CG 3.21Å; E317-Q321 PolarHBondContact O-N 3.4Å
318	T	71.6	Confident	72.2	Confident	61 Å²	61	79.7 Å²	79.7	37%	0.374	38%	0.378	S	S	.	.	H	α-helix	trans	-67.7	-43.8	177.2	-54	0	0	0	0	112	L314 R315 L316 Q321 R322	L314-T318 WeakPolarHBondContact O-CB 3.4Å; L314-T318 PolarHBondContact O-N 3.49Å; L314-T318 PolarHBondContact O-OG1 2.94Å; R315-T318 PolarHBondContact O-N 2.99Å; L316-T318 VanDerWaalsContact C-N 3.29Å; L316-T318 PolarHBondContact O-N 3.32Å; T318-Q321 PolarHBondContact O-N 3.4Å; T318-R322 WeakPolarHBondContact O-CB 3.32Å; T318-R322 PolarHBondContact O-N 3.03Å
319	E	71.6	Confident	72.3	Confident	102 Å²	102	79.6 Å²	79.6	48%	0.477	39%	0.39	S	S	.	.	H	α-helix	trans	-67.7	-37.1	176.9	-69.7	-54.4	141.2	0	0	111.8	R315 L316 R322 Q323	R315-E319 WeakPolarHBondContact O-CG 3.36Å; R315-E319 PolarHBondContact O-N 3.28Å; L316-E319 PolarHBondContact O-N 3.04Å; E319-R322 WeakPolarHBondContact O-CB 3.29Å; E319-R322 PolarHBondContact O-N 3.24Å; E319-Q323 WeakPolarHBondContact O-CG 3.44Å; E319-Q323 PolarHBondContact O-N 3.17Å
320	N	73.1	Confident	72.8	Confident	99 Å²	99	82.6 Å²	82.6	53%	0.529	41%	0.407	S	S	.	.	H	α-helix	trans	-63.2	-46.8	175.1	-167.7	12.1	0	0	0	111.2	L316 R322 Q323 E324	L316-N320 VanDerWaalsContact O-CB 3.3Å; L316-N320 WeakPolarHBondContact O-CB 3.46Å; L316-N320 PolarHBondContact O-N 3.07Å; N320-R322 PolarHBondContact O-N 2.88Å; N320-Q323 WeakPolarHBondContact O-CB 3.09Å; N320-Q323 PolarHBondContact O-N 2.94Å; N320-Q323 VanDerWaalsContact O-N 3.11Å; N320-E324 PolarHBondContact O-N 2.92Å
321	Q	70	Confident	73.4	Confident	104 Å²	104	81.6 Å²	81.6	49%	0.486	40%	0.402	S	S	.	.	H	α-helix	trans	-59	-36.2	173.2	-74.3	177.6	-0.5	0	0	112.5	E317 T318 R325	E317-Q321 WeakPolarHBondContact O-CG 3.21Å; E317-Q321 PolarHBondContact O-N 3.4Å; T318-Q321 PolarHBondContact O-N 3.4Å; Q321-R325 VanDerWaalsContact O-CG 3.28Å; Q321-R325 WeakPolarHBondContact O-CG 3.34Å; Q321-R325 PolarHBondContact O-N 2.9Å; Q321-R325 VanDerWaalsContact O-N 3.09Å
322	R	73	Confident	74	Confident	92 Å²	92	80.7 Å²	80.7	35%	0.347	40%	0.4	S	S	.	.	H	α-helix	trans	-67.2	-43.7	175.2	-178.6	-175.6	169.7	125	-5.7	111.2	T318 E319 N320 R325 L326 N599	T318-R322 WeakPolarHBondContact O-CB 3.32Å; T318-R322 PolarHBondContact O-N 3.03Å; E319-R322 WeakPolarHBondContact O-CB 3.29Å; E319-R322 PolarHBondContact O-N 3.24Å; N320-R322 PolarHBondContact O-N 2.88Å; R322-R325 PolarHBondContact O-N 3.04Å; R322-L326 HydrophobicContact CG-CD1 4.23Å; R322-L326 WeakPolarHBondContact O-CG 3.12Å; R322-L326 PolarHBondContact O-N 3.17Å; R322-N599 VanDerWaalsContact CZ-OD1 3.28Å; R322-N599 PolarHBondContact NH1-ND2 2.96Å; R322-N599 PolarHBondContact NH1-OD1 3.28Å; R322-N599 VanDerWaalsContact NH2-CG 3.26Å; R322-N599 PolarHBondContact NH2-ND2 3.47Å; R322-N599 PolarHBondContact NH2-OD1 2.86Å
323	Q	71.4	Confident	74.5	Confident	120 Å²	120	87.3 Å²	87.3	56%	0.561	42%	0.415	S	S	*	.	H	α-helix	trans	-60.9	-47.2	175.7	-74.8	178.8	-33.3	0	0	111.2	E319 N320 R325 L326 V327	E319-Q323 WeakPolarHBondContact O-CG 3.44Å; E319-Q323 PolarHBondContact O-N 3.17Å; N320-Q323 WeakPolarHBondContact O-CB 3.09Å; N320-Q323 PolarHBondContact O-N 2.94Å; N320-Q323 VanDerWaalsContact O-N 3.11Å; Q323-R325 VanDerWaalsContact C-N 3.34Å; Q323-R325 PolarHBondContact O-N 2.93Å; Q323-L326 PolarHBondContact O-N 3.5Å; Q323-L326 VanDerWaalsContact O-N 3.16Å; Q323-V327 WeakPolarHBondContact O-CG2 3.35Å; Q323-V327 PolarHBondContact O-N 2.82Å
324	E	73.1	Confident	75.1	Confident	109 Å²	109	85.4 Å²	85.4	51%	0.509	41%	0.409	S	S	.	.	H	α-helix	trans	-56.9	-46.1	176.9	-171.3	-177.5	178.9	0	0	111.7	N320 L326 V327 L328	N320-E324 PolarHBondContact O-N 2.92Å; E324-L326 PolarHBondContact O-N 2.9Å; E324-V327 PolarHBondContact O-N 2.84Å; E324-L328 HydrophobicContact CG-CD1 4.11Å; E324-L328 WeakPolarHBondContact O-CB 3.37Å; E324-L328 WeakPolarHBondContact O-CG 3.46Å; E324-L328 PolarHBondContact O-N 3.33Å
325	R	71.9	Confident	75.8	Confident	120 Å²	120	83.1 Å²	83.1	45%	0.453	40%	0.398	S	S	.	.	H	α-helix	trans	-61.5	-41.6	176.1	-73.8	175.5	-170.9	177.6	5.4	113	Q321 R322 Q323 S329	Q321-R325 VanDerWaalsContact O-CG 3.28Å; Q321-R325 WeakPolarHBondContact O-CG 3.34Å; Q321-R325 PolarHBondContact O-N 2.9Å; Q321-R325 VanDerWaalsContact O-N 3.09Å; R322-R325 PolarHBondContact O-N 3.04Å; Q323-R325 VanDerWaalsContact C-N 3.34Å; Q323-R325 PolarHBondContact O-N 2.93Å; R325-S329 PolarHBondContact O-N 3.07Å; R325-S329 VanDerWaalsContact O-N 3.09Å
326	L	78.7	Confident	76.3	Confident	100 Å²	100	76.1 Å²	76.1	52%	0.524	37%	0.372	S	S	.	.	H	α-helix	trans	-66.5	-41.3	178.6	-72.1	170.9	0	0	0	111.1	R322 Q323 E324 S329	R322-L326 HydrophobicContact CG-CD1 4.23Å; R322-L326 WeakPolarHBondContact O-CG 3.12Å; R322-L326 PolarHBondContact O-N 3.17Å; Q323-L326 PolarHBondContact O-N 3.5Å; Q323-L326 VanDerWaalsContact O-N 3.16Å; E324-L326 PolarHBondContact O-N 2.9Å; L326-S329 PolarHBondContact O-N 3.3Å; L326-S329 PolarHBondContact O-OG 2.98Å
327	V	77.4	Confident	76.8	Confident	58 Å²	58	76.2 Å²	76.2	35%	0.352	37%	0.372	S	S	.	.	H	α-helix	trans	-63.7	-46.5	176.9	172.7	0	0	0	0	110.9	Q323 E324 S329 V330 L331 V336	Q323-V327 WeakPolarHBondContact O-CG2 3.35Å; Q323-V327 PolarHBondContact O-N 2.82Å; E324-V327 PolarHBondContact O-N 2.84Å; V327-S329 PolarHBondContact O-N 3.03Å; V327-V330 PolarHBondContact O-N 3.08Å; V327-V330 VanDerWaalsContact O-N 3.09Å; V327-L331 PolarHBondContact O-N 3.36Å; V327-V336 HydrophobicContact CG1-CB 4.32Å; V327-V336 HydrophobicContact CG1-CG1 3.68Å; V327-V336 HydrophobicContact CG1-CG2 3.63Å
328	L	76.7	Confident	77.4	Confident	43 Å²	43	75.7 Å²	75.7	23%	0.225	37%	0.37	C	S	.	.	H	α-helix	trans	-66.4	-19.2	177.5	-70	172.8	0	0	0	113.9	E324 V330 R333 V336	E324-L328 HydrophobicContact CG-CD1 4.11Å; E324-L328 WeakPolarHBondContact O-CB 3.37Å; E324-L328 WeakPolarHBondContact O-CG 3.46Å; E324-L328 PolarHBondContact O-N 3.33Å; L328-V330 VanDerWaalsContact C-N 3.33Å; L328-R333 HydrophobicContact CD2-CB 3.89Å; L328-R333 HydrophobicContact CD2-CG 4.02Å; L328-V336 HydrophobicContact CD2-CB 4.22Å; L328-V336 HydrophobicContact CD2-CG1 4.26Å; L328-V336 HydrophobicContact CD2-CG2 4.15Å
329	S	76	Confident	77.7	Confident	74 Å²	74	73.5 Å²	73.5	52%	0.517	36%	0.356	S	S	.	.	H	α-helix	trans	-76.3	-21.7	173.9	77	0	0	0	0	113.5	R325 L326 V327	R325-S329 PolarHBondContact O-N 3.07Å; R325-S329 VanDerWaalsContact O-N 3.09Å; L326-S329 PolarHBondContact O-N 3.3Å; L326-S329 PolarHBondContact O-OG 2.98Å; V327-S329 PolarHBondContact O-N 3.03Å
330	V	78.7	Confident	78	Confident	81 Å²	81	73 Å²	73	49%	0.491	36%	0.355	S	S	.	.	H	α-helix	trans	-101.3	-37.4	-178.7	178.9	0	0	0	0	111.3	V327 L328 W478	V327-V330 PolarHBondContact O-N 3.08Å; V327-V330 VanDerWaalsContact O-N 3.09Å; L328-V330 VanDerWaalsContact C-N 3.33Å; V330-W478 WeakPolarHBondContact CG1-O 3.14Å
331	L	84.2	Confident	78.2	Confident	3 Å²	3	72.5 Å²	72.5	2%	0.016	35%	0.353	C	S	.	.	S	Bend	trans	-122.9	140.6	-172.5	-63.6	-177.5	0	0	0	111.5	V327 V336 M339 V472 W478 F480	V327-L331 PolarHBondContact O-N 3.36Å; L331-V336 HydrophobicContact CB-CG2 3.5Å; L331-V336 HydrophobicContact CD1-CG2 4.33Å; L331-M339 HydrophobicContact CD1-CE 4.27Å; L331-M339 HydrophobicContact CD1-SD 3.6Å; L331-V472 HydrophobicContact CD2-CB 4.4Å; L331-V472 HydrophobicContact CD2-CG1 3.85Å; L331-V472 HydrophobicContact CD2-CG2 3.56Å; L331-W478 HydrophobicContact CD1-CE3 3.7Å; L331-W478 HydrophobicContact CD1-CZ3 4.26Å; L331-W478 HydrophobicContact CD2-CB 4.3Å; L331-F480 HydrophobicContact CD2-CB 4.18Å
332	P	83.9	Confident	78.3	Confident	23 Å²	23	68.6 Å²	68.6	15%	0.149	34%	0.335	C	S	.	.			trans	-59.5	144.3	171.4	-24	34	0	0	0	112.6	F334 V335 V336 L409 F480	P332-F334 VanDerWaalsContact C-N 3.28Å; P332-F334 HydrophobicContact CB-CD1 3.56Å; P332-F334 HydrophobicContact CB-CE1 3.3Å; P332-F334 HydrophobicContact CB-CZ 4.3Å; P332-F334 HydrophobicContact CG-CE1 3.95Å; P332-F334 PolarHBondContact O-N 2.8Å; P332-F334 VanDerWaalsContact O-N 3.14Å; P332-V335 PolarHBondContact O-N 2.95Å; P332-V335 VanDerWaalsContact O-N 3.13Å; P332-V336 WeakPolarHBondContact O-CG2 3.29Å; P332-V336 PolarHBondContact O-N 2.96Å; P332-L409 HydrophobicContact CG-CD2 4.49Å; P332-F480 HydrophobicContact CG-CB 4.25Å; P332-F480 HydrophobicContact CG-CD1 3.53Å; P332-F480 HydrophobicContact CG-CD2 3.89Å; P332-F480 HydrophobicContact CG-CE1 3.71Å; P332-F480 HydrophobicContact CG-CE2 4.08Å; P332-F480 HydrophobicContact CG-CG 3.61Å; P332-F480 HydrophobicContact CG-CZ 3.99Å
333	R	82.8	Confident	78	Confident	181 Å²	181	70.7 Å²	70.7	68%	0.683	35%	0.35	S	S	*	.	H	α-helix	trans	-53.1	-39.4	-174.6	-172.9	178.3	179.2	-171	-0.6	114.2	L328 V335 V336 L337	L328-R333 HydrophobicContact CD2-CB 3.89Å; L328-R333 HydrophobicContact CD2-CG 4.02Å; R333-V335 PolarHBondContact O-N 3.44Å; R333-V336 PolarHBondContact O-N 3.23Å; R333-L337 HydrophobicContact CG-CD1 4.1Å; R333-L337 HydrophobicContact CG-CG 4.35Å; R333-L337 WeakPolarHBondContact O-CG 3.35Å; R333-L337 PolarHBondContact O-N 3.39Å
334	F	82.4	Confident	77.8	Confident	45 Å²	45	69.1 Å²	69.1	20%	0.197	35%	0.349	C	S	.	.	H	α-helix	trans	-64.2	-41.2	-177.4	71.9	-85	0	0	0	112.3	P332 E338 P425 F480	P332-F334 VanDerWaalsContact C-N 3.28Å; P332-F334 HydrophobicContact CB-CD1 3.56Å; P332-F334 HydrophobicContact CB-CE1 3.3Å; P332-F334 HydrophobicContact CB-CZ 4.3Å; P332-F334 HydrophobicContact CG-CE1 3.95Å; P332-F334 PolarHBondContact O-N 2.8Å; P332-F334 VanDerWaalsContact O-N 3.14Å; F334-E338 PolarHBondContact O-N 2.83Å; F334-P425 HydrophobicContact CD1-CB 3.44Å; F334-P425 VanDerWaalsContact CD1-CB 3.44Å; F334-P425 HydrophobicContact CD1-CG 3.69Å; F334-P425 HydrophobicContact CD2-CB 4.36Å; F334-P425 HydrophobicContact CE1-CB 3.57Å; F334-P425 HydrophobicContact CE1-CG 4.07Å; F334-P425 HydrophobicContact CE2-CB 4.46Å; F334-P425 HydrophobicContact CG-CB 3.86Å; F334-P425 HydrophobicContact CG-CG 4.35Å; F334-P425 HydrophobicContact CZ-CB 4.09Å; F334-F480 HydrophobicContact CE1-CE2 4.43Å; F334-F480 HydrophobicContact CE1-CZ 4.32Å; F334-F480 AromaticContact CZ-CE2 3.78Å; F334-F480 HydrophobicContact CZ-CE2 3.78Å; F334-F480 AromaticContact CZ-CZ 3.91Å; F334-F480 HydrophobicContact CZ-CZ 3.91Å
335	V	83	Confident	77.3	Confident	0 Å²	0	69 Å²	69	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-69.6	-40.5	176.1	-171	0	0	0	0	110.4	P332 R333 L337 E338 M339 Y359 V472 F480	P332-V335 PolarHBondContact O-N 2.95Å; P332-V335 VanDerWaalsContact O-N 3.13Å; R333-V335 PolarHBondContact O-N 3.44Å; V335-L337 VanDerWaalsContact C-N 3.32Å; V335-L337 PolarHBondContact O-N 3.31Å; V335-E338 PolarHBondContact O-N 2.84Å; V335-M339 HydrophobicContact CG1-CG 4.12Å; V335-M339 HydrophobicContact CG1-SD 3.95Å; V335-M339 WeakPolarHBondContact O-CB 3.14Å; V335-M339 WeakPolarHBondContact O-CG 3.35Å; V335-M339 PolarHBondContact O-N 3.43Å; V335-Y359 HydrophobicContact CG1-CG 4.13Å; V335-V472 HydrophobicContact CB-CG2 4.42Å; V335-V472 HydrophobicContact CG1-CG2 3.67Å; V335-V472 HydrophobicContact CG2-CG2 4.5Å; V335-F480 HydrophobicContact CG2-CD2 4.24Å; V335-F480 HydrophobicContact CG2-CE2 4.16Å
336	V	82.8	Confident	76.9	Confident	7 Å²	7	66.9 Å²	66.9	4%	0.042	35%	0.353	C	S	.	.	H	α-helix	trans	-59.5	-43.4	178.1	174.4	0	0	0	0	111.5	V327 L328 L331 P332 R333 M339 I340	V327-V336 HydrophobicContact CG1-CB 4.32Å; V327-V336 HydrophobicContact CG1-CG1 3.68Å; V327-V336 HydrophobicContact CG1-CG2 3.63Å; L328-V336 HydrophobicContact CD2-CB 4.22Å; L328-V336 HydrophobicContact CD2-CG1 4.26Å; L328-V336 HydrophobicContact CD2-CG2 4.15Å; L331-V336 HydrophobicContact CB-CG2 3.5Å; L331-V336 HydrophobicContact CD1-CG2 4.33Å; P332-V336 WeakPolarHBondContact O-CG2 3.29Å; P332-V336 PolarHBondContact O-N 2.96Å; R333-V336 PolarHBondContact O-N 3.23Å; V336-M339 PolarHBondContact O-N 3.25Å; V336-I340 HydrophobicContact CG1-CD1 3.67Å; V336-I340 HydrophobicContact CG1-CG1 4.37Å; V336-I340 WeakPolarHBondContact O-CB 3.18Å; V336-I340 VanDerWaalsContact O-CG1 3.22Å; V336-I340 WeakPolarHBondContact O-CG1 3.34Å; V336-I340 PolarHBondContact O-N 2.94Å
337	L	82.2	Confident	75.7	Confident	99 Å²	99	70.8 Å²	70.8	52%	0.518	37%	0.368	S	S	.	.	H	α-helix	trans	-65.2	-40.8	178.2	-70.5	173	0	0	0	112.3	R333 V335 N341	R333-L337 HydrophobicContact CG-CD1 4.1Å; R333-L337 HydrophobicContact CG-CG 4.35Å; R333-L337 WeakPolarHBondContact O-CG 3.35Å; R333-L337 PolarHBondContact O-N 3.39Å; V335-L337 VanDerWaalsContact C-N 3.32Å; V335-L337 PolarHBondContact O-N 3.31Å; L337-N341 WeakPolarHBondContact O-CB 3.45Å; L337-N341 PolarHBondContact O-N 2.8Å
338	E	81.4	Confident	74.4	Confident	68 Å²	68	73.3 Å²	73.3	32%	0.318	38%	0.379	S	S	.	.	H	α-helix	trans	-63.1	-46.8	174.9	-172	179.2	-171.4	0	0	111.4	F334 V335 I340 N341 D342 Y359 H361	F334-E338 PolarHBondContact O-N 2.83Å; V335-E338 PolarHBondContact O-N 2.84Å; E338-I340 PolarHBondContact O-N 3.01Å; E338-N341 PolarHBondContact O-N 2.99Å; E338-D342 WeakPolarHBondContact O-CB 3.19Å; E338-D342 PolarHBondContact O-N 3.35Å; E338-Y359 HydrophobicContact CG-CD1 4.13Å; E338-Y359 HydrophobicContact CG-CE1 4.25Å; E338-H361 IonicContact OE1-CE1 3.64Å; E338-H361 IonicContact OE1-NE2 2.87Å; E338-H361 IonicContact OE2-CD2 2.82Å; E338-H361 IonicContact OE2-CE1 3.12Å; E338-H361 PolarHBondContact OE2-CE1 3.38Å; E338-H361 IonicContact OE2-NE2 3.45Å; E338-H361 PolarHBondContact OE2-NE2 3.27Å
339	M	76.6	Confident	73.3	Confident	15 Å²	15	77.8 Å²	77.8	7%	0.074	40%	0.399	C	S	.	.	H	α-helix	trans	-58.5	-46.9	176.5	-72.3	178.2	75.7	0	0	112.3	L331 V335 V336 D342 M343 Y359 W478	L331-M339 HydrophobicContact CD1-CE 4.27Å; L331-M339 HydrophobicContact CD1-SD 3.6Å; V335-M339 HydrophobicContact CG1-CG 4.12Å; V335-M339 HydrophobicContact CG1-SD 3.95Å; V335-M339 WeakPolarHBondContact O-CB 3.14Å; V335-M339 WeakPolarHBondContact O-CG 3.35Å; V335-M339 PolarHBondContact O-N 3.43Å; V336-M339 PolarHBondContact O-N 3.25Å; M339-D342 PolarHBondContact O-N 3.02Å; M339-M343 WeakPolarHBondContact O-CB 3.32Å; M339-M343 VanDerWaalsContact O-CG 3.26Å; M339-M343 WeakPolarHBondContact O-CG 3.32Å; M339-M343 PolarHBondContact O-N 3.4Å; M339-Y359 HydrophobicContact CB-CE1 4.5Å; M339-Y359 HydrophobicContact CE-CE2 4.07Å; M339-Y359 HydrophobicContact CG-CD1 4.15Å; M339-Y359 HydrophobicContact CG-CD2 3.84Å; M339-Y359 HydrophobicContact CG-CE1 3.77Å; M339-Y359 HydrophobicContact CG-CE2 3.46Å; M339-Y359 VanDerWaalsContact CG-CE2 3.46Å; M339-Y359 HydrophobicContact CG-CG 4.18Å; M339-Y359 VanDerWaalsContact CG-CZ 3.42Å; M339-Y359 HydrophobicContact SD-CD2 4.26Å; M339-Y359 HydrophobicContact SD-CE2 4.15Å; M339-W478 HydrophobicContact CE-CD2 4.37Å; M339-W478 HydrophobicContact CE-CE3 3.89Å; M339-W478 HydrophobicContact CE-CH2 3.37Å; M339-W478 HydrophobicContact CE-CZ2 3.91Å; M339-W478 HydrophobicContact CE-CZ3 3.36Å
340	I	78.1	Confident	72	Confident	91 Å²	91	82.8 Å²	82.8	47%	0.467	41%	0.414	S	S	.	.	H	α-helix	trans	-62.9	-46.5	179.4	-69.9	167.4	0	0	0	110.1	V336 E338 D342 M343 T344	V336-I340 HydrophobicContact CG1-CD1 3.67Å; V336-I340 HydrophobicContact CG1-CG1 4.37Å; V336-I340 WeakPolarHBondContact O-CB 3.18Å; V336-I340 VanDerWaalsContact O-CG1 3.22Å; V336-I340 WeakPolarHBondContact O-CG1 3.34Å; V336-I340 PolarHBondContact O-N 2.94Å; E338-I340 PolarHBondContact O-N 3.01Å; I340-D342 VanDerWaalsContact C-N 3.35Å; I340-D342 PolarHBondContact O-N 3.15Å; I340-M343 PolarHBondContact O-N 3.4Å; I340-T344 WeakPolarHBondContact O-CG2 3.31Å; I340-T344 PolarHBondContact O-N 2.81Å; I340-T344 PolarHBondContact O-OG1 2.96Å
341	N	77.2	Confident	70.6	Confident	90 Å²	90	83.1 Å²	83.1	48%	0.481	41%	0.413	S	S	.	.	H	α-helix	trans	-63.7	-40.1	179.8	-175.4	58.6	0	0	0	112.1	L337 E338 T344 N345	L337-N341 WeakPolarHBondContact O-CB 3.45Å; L337-N341 PolarHBondContact O-N 2.8Å; E338-N341 PolarHBondContact O-N 2.99Å; N341-T344 WeakPolarHBondContact CA-OG1 3.35Å; N341-T344 PolarHBondContact O-N 3.46Å; N341-T344 PolarHBondContact O-OG1 3.35Å; N341-N345 PolarHBondContact O-N 2.71Å; N341-N345 PolarHBondContact O-ND2 2.87Å; N341-N345 PolarHBondContact OD1-ND2 3.18Å
342	D	72.1	Confident	68.9	Low	21 Å²	21	90.1 Å²	90.1	11%	0.112	45%	0.445	C	S	.	.	H	α-helix	trans	-65.5	-40.5	174.7	-86.8	-24.6	0	0	0	111.7	E338 M339 I340 T344 N345 V346 R357	E338-D342 WeakPolarHBondContact O-CB 3.19Å; E338-D342 PolarHBondContact O-N 3.35Å; M339-D342 PolarHBondContact O-N 3.02Å; I340-D342 VanDerWaalsContact C-N 3.35Å; I340-D342 PolarHBondContact O-N 3.15Å; D342-T344 VanDerWaalsContact C-N 3.35Å; D342-T344 PolarHBondContact O-N 3.17Å; D342-N345 PolarHBondContact O-N 3.09Å; D342-V346 WeakPolarHBondContact O-CG2 3.33Å; D342-V346 PolarHBondContact O-N 3.06Å; D342-R357 VanDerWaalsContact CG-NH2 3.27Å; D342-R357 IonicContact OD1-CZ 2.69Å; D342-R357 VanDerWaalsContact OD1-CZ 3.3Å; D342-R357 IonicContact OD1-NH1 2.96Å; D342-R357 PolarHBondContact OD1-NH1 3.43Å; D342-R357 VanDerWaalsContact OD1-NH1 3.1Å; D342-R357 IonicContact OD1-NH2 3.79Å; D342-R357 PolarHBondContact OD1-NH2 3.01Å; D342-R357 IonicContact OD2-CZ 3.27Å; D342-R357 IonicContact OD2-NE 2.75Å; D342-R357 PolarHBondContact OD2-NE 2.86Å; D342-R357 IonicContact OD2-NH1 2.95Å; D342-R357 PolarHBondContact OD2-NH1 3.46Å; D342-R357 IonicContact OD2-NH2 3.64Å; D342-R357 PolarHBondContact OD2-NH2 2.96Å
343	M	67.7	Low	67.2	Low	136 Å²	136	97.6 Å²	97.6	67%	0.67	48%	0.478	S	S	*	.	H	α-helix	trans	-65.4	-35.3	176.4	-73	-179	74.6	0	0	112.9	M339 I340 N345	M339-M343 WeakPolarHBondContact O-CB 3.32Å; M339-M343 VanDerWaalsContact O-CG 3.26Å; M339-M343 WeakPolarHBondContact O-CG 3.32Å; M339-M343 PolarHBondContact O-N 3.4Å; I340-M343 PolarHBondContact O-N 3.4Å; M343-N345 VanDerWaalsContact C-N 3.33Å
344	T	66.3	Low	65.3	Low	87 Å²	87	95.2 Å²	95.2	53%	0.534	47%	0.474	S	S	.	.	H	α-helix	trans	-73.1	-25.1	177.9	49.9	0	0	0	0	113.4	I340 N341 D342	I340-T344 WeakPolarHBondContact O-CG2 3.31Å; I340-T344 PolarHBondContact O-N 2.81Å; I340-T344 PolarHBondContact O-OG1 2.96Å; N341-T344 WeakPolarHBondContact CA-OG1 3.35Å; N341-T344 PolarHBondContact O-N 3.46Å; N341-T344 PolarHBondContact O-OG1 3.35Å; D342-T344 VanDerWaalsContact C-N 3.35Å; D342-T344 PolarHBondContact O-N 3.17Å
345	N	64.3	Low	63.5	Low	107 Å²	107	101.2 Å²	101.2	57%	0.572	50%	0.501	S	S	*	.	H	α-helix	trans	-89.1	-9.4	-177.4	-68	-29.4	0	0	0	113.5	N341 D342 M343 E347	N341-N345 PolarHBondContact O-N 2.71Å; N341-N345 PolarHBondContact O-ND2 2.87Å; N341-N345 PolarHBondContact OD1-ND2 3.18Å; D342-N345 PolarHBondContact O-N 3.09Å; M343-N345 VanDerWaalsContact C-N 3.33Å; N345-E347 PolarHBondContact O-N 3.37Å
346	V	61.9	Low	62.4	Low	76 Å²	76	107.7 Å²	107.7	46%	0.461	53%	0.531	S	S	.	.			trans	-91.4	78.5	176.2	-178.3	0	0	0	0	108.8	D342 D348	D342-V346 WeakPolarHBondContact O-CG2 3.33Å; D342-V346 PolarHBondContact O-N 3.06Å; V346-D348 VanDerWaalsContact C-N 3.29Å
347	E	53.4	Low	61.4	Low	181 Å²	181	114.3 Å²	114.3	85%	0.846	56%	0.555	S	S	*	*			trans	-78.3	-11.9	171.7	-69.3	-172.2	159.8	0	0	112.8	N345	N345-E347 PolarHBondContact O-N 3.37Å
348	D	50.2	Low	61	Low	111 Å²	111	114.7 Å²	114.7	59%	0.594	56%	0.556	S	S	*	*			trans	-93.9	105.6	-177.3	-75.5	-38.8	0	0	0	112.5	V346 H350 L351	V346-D348 VanDerWaalsContact C-N 3.29Å; D348-H350 PolarHBondContact O-N 3.42Å; D348-L351 HydrophobicContact CB-CD1 4.45Å; D348-L351 PolarHBondContact O-N 3.42Å; D348-L351 VanDerWaalsContact O-N 3.12Å
349	E	53.5	Low	61	Low	137 Å²	137	112.7 Å²	112.7	64%	0.64	55%	0.546	S	S	*	.	G	3₁₀ helix	trans	-52.2	-23.4	173	-78.3	-175.1	151.4	0	0	113.4	L351	E349-L351 VanDerWaalsContact C-N 3.28Å; E349-L351 PolarHBondContact O-N 3.34Å
350	H	50	Low	61.5	Low	179 Å²	179	116.2 Å²	116.2	83%	0.829	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-73.8	-10.8	-179.3	-78	-89.1	0	0	0	114.8	D348	D348-H350 PolarHBondContact O-N 3.42Å
351	L	49	Very low	62	Low	89 Å²	89	114.5 Å²	114.5	47%	0.466	55%	0.554	S	S	.	*	G	3₁₀ helix	trans	-99.8	-4.4	178.2	-97.7	126.3	0	0	0	114.7	D348 E349 H353 Q354	D348-L351 HydrophobicContact CB-CD1 4.45Å; D348-L351 PolarHBondContact O-N 3.42Å; D348-L351 VanDerWaalsContact O-N 3.12Å; E349-L351 VanDerWaalsContact C-N 3.28Å; E349-L351 PolarHBondContact O-N 3.34Å; L351-H353 PolarHBondContact O-N 2.66Å; L351-Q354 HydrophobicContact CD2-CB 4.25Å; L351-Q354 PolarHBondContact O-N 2.98Å
352	Q	49	Very low	62.7	Low	149 Å²	149	117.4 Å²	117.4	70%	0.696	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.6	-17	179.3	-79	-177.4	-8.7	0	0	114
353	H	47.7	Very low	63.7	Low	181 Å²	181	118.4 Å²	118.4	84%	0.838	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	-5.8	176.8	-72.9	-67	0	0	0	115.3	L351	L351-H353 PolarHBondContact O-N 2.66Å
354	Q	43	Very low	64.9	Low	130 Å²	130	117.2 Å²	117.2	61%	0.607	55%	0.554	S	S	*	*	S	Bend	trans	-101.6	91.3	178.3	-78.4	-175.5	3.8	0	0	110.7	L351	L351-Q354 HydrophobicContact CD2-CB 4.25Å; L351-Q354 PolarHBondContact O-N 2.98Å
355	F	44.7	Very low	66.1	Low	172 Å²	172	118.5 Å²	118.5	75%	0.754	56%	0.558	S	S	*	*			trans	72.8	100.2	164	-53.5	-81.3	0	0	0	116.4	R357	F355-R357 PolarHBondContact O-N 2.68Å
356	H	58.6	Low	67.6	Low	136 Å²	136	113.4 Å²	113.4	63%	0.63	53%	0.53	S	S	*	.				0.8	67.9	116.8	-59.2	73.6	0	0	0	114.7	I358 L475	H356-I358 WeakPolarHBondContact O-CG1 3.46Å; H356-I358 PolarHBondContact O-N 3.37Å; H356-I358 VanDerWaalsContact O-N 3.14Å; H356-L475 WeakPolarHBondContact CD2-CD1 3.17Å; H356-L475 WeakPolarHBondContact CD2-CD2 3.17Å; H356-L475 WeakPolarHBondContact NE2-CD1 3.44Å
357	R	63.5	Low	69.3	Low	146 Å²	146	109.8 Å²	109.8	55%	0.551	51%	0.508	S	S	*	.			trans	-70.6	114	-172.7	-162.1	165.9	176.7	-172.3	-16.1	108.1	D342 F355 Y359	D342-R357 VanDerWaalsContact CG-NH2 3.27Å; D342-R357 IonicContact OD1-CZ 2.69Å; D342-R357 VanDerWaalsContact OD1-CZ 3.3Å; D342-R357 IonicContact OD1-NH1 2.96Å; D342-R357 PolarHBondContact OD1-NH1 3.43Å; D342-R357 VanDerWaalsContact OD1-NH1 3.1Å; D342-R357 IonicContact OD1-NH2 3.79Å; D342-R357 PolarHBondContact OD1-NH2 3.01Å; D342-R357 IonicContact OD2-CZ 3.27Å; D342-R357 IonicContact OD2-NE 2.75Å; D342-R357 PolarHBondContact OD2-NE 2.86Å; D342-R357 IonicContact OD2-NH1 2.95Å; D342-R357 PolarHBondContact OD2-NH1 3.46Å; D342-R357 IonicContact OD2-NH2 3.64Å; D342-R357 PolarHBondContact OD2-NH2 2.96Å; F355-R357 PolarHBondContact O-N 2.68Å; R357-Y359 WeakPolarHBondContact O-CE2 3.22Å
358	I	73.3	Confident	71.4	Confident	106 Å²	106	101.2 Å²	101.2	54%	0.544	47%	0.468	S	S	.	.			trans	-91.6	122.3	-178.2	-43.2	179.6	0	0	0	107.4	H356 I360	H356-I358 WeakPolarHBondContact O-CG1 3.46Å; H356-I358 PolarHBondContact O-N 3.37Å; H356-I358 VanDerWaalsContact O-N 3.14Å; I358-I360 HydrophobicContact CB-CD1 4.41Å; I358-I360 HydrophobicContact CB-CG1 4.35Å; I358-I360 HydrophobicContact CG2-CD1 3.77Å; I358-I360 HydrophobicContact CG2-CG1 3.62Å; I358-I360 PolarHBondContact O-N 3.44Å
359	Y	81.9	Confident	73.6	Confident	26 Å²	26	95.9 Å²	95.9	10%	0.102	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	102.1	177.8	-56.8	-88	0	0	0	107.9	V335 E338 M339 R357 G471 V472	V335-Y359 HydrophobicContact CG1-CG 4.13Å; E338-Y359 HydrophobicContact CG-CD1 4.13Å; E338-Y359 HydrophobicContact CG-CE1 4.25Å; M339-Y359 HydrophobicContact CB-CE1 4.5Å; M339-Y359 HydrophobicContact CE-CE2 4.07Å; M339-Y359 HydrophobicContact CG-CD1 4.15Å; M339-Y359 HydrophobicContact CG-CD2 3.84Å; M339-Y359 HydrophobicContact CG-CE1 3.77Å; M339-Y359 HydrophobicContact CG-CE2 3.46Å; M339-Y359 VanDerWaalsContact CG-CE2 3.46Å; M339-Y359 HydrophobicContact CG-CG 4.18Å; M339-Y359 VanDerWaalsContact CG-CZ 3.42Å; M339-Y359 HydrophobicContact SD-CD2 4.26Å; M339-Y359 HydrophobicContact SD-CE2 4.15Å; R357-Y359 WeakPolarHBondContact O-CE2 3.22Å; Y359-G471 CarbonylContact O-C 3.52Å; Y359-G471 WeakPolarHBondContact O-CA 3.28Å; Y359-V472 PolarHBondContact O-N 3.49Å
360	I	86.8	Confident	75.7	Confident	90 Å²	90	89.7 Å²	89.7	46%	0.462	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	132	-179.9	-54.4	178.7	0	0	0	109.2	I358 L469 C470	I358-I360 HydrophobicContact CB-CD1 4.41Å; I358-I360 HydrophobicContact CB-CG1 4.35Å; I358-I360 HydrophobicContact CG2-CD1 3.77Å; I358-I360 HydrophobicContact CG2-CG1 3.62Å; I358-I360 PolarHBondContact O-N 3.44Å; I360-L469 HydrophobicContact CG2-CB 4.46Å; I360-L469 HydrophobicContact CG2-CD2 3.89Å; I360-C470 CarbonylContact C-O 3.51Å; I360-C470 WeakPolarHBondContact CA-O 2.84Å
361	H	88.8	Confident	77.8	Confident	54 Å²	54	81.2 Å²	81.2	25%	0.25	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	138.4	179.1	-65.4	-76.6	0	0	0	110	E338 Y363 L469 C470	E338-H361 IonicContact OE1-CE1 3.64Å; E338-H361 IonicContact OE1-NE2 2.87Å; E338-H361 IonicContact OE2-CD2 2.82Å; E338-H361 IonicContact OE2-CE1 3.12Å; E338-H361 PolarHBondContact OE2-CE1 3.38Å; E338-H361 IonicContact OE2-NE2 3.45Å; E338-H361 PolarHBondContact OE2-NE2 3.27Å; H361-Y363 HydrophobicContact CB-CD2 4.19Å; H361-Y363 HydrophobicContact CB-CE2 3.53Å; H361-L469 CarbonylContact O-C 3.59Å; H361-L469 WeakPolarHBondContact O-CA 3.38Å; H361-C470 PolarHBondContact N-O 3.2Å; H361-C470 PolarHBondContact O-N 3.46Å
362	R	91.5	Very high	79.9	Confident	151 Å²	151	78.1 Å²	78.1	57%	0.57	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.4	130.7	175.5	-179.6	-177	167.3	102.7	0.7	109.5	E364 V468 L469	R362-E364 IonicContact CZ-OE1 2.77Å; R362-E364 IonicContact NE-OE1 3.98Å; R362-E364 PolarHBondContact NE-OE1 3.03Å; R362-E364 VanDerWaalsContact NE-OE1 3.12Å; R362-E364 IonicContact NH2-OE1 3.52Å; R362-E364 PolarHBondContact NH2-OE1 3.5Å; R362-V468 WeakPolarHBondContact CA-O 3.45Å; R362-L469 HydrophobicContact CB-CD2 3.87Å; R362-L469 HydrophobicContact CG-CD2 4.35Å
363	Y	92.6	Very high	81.8	Confident	42 Å²	42	71.1 Å²	71.1	17%	0.165	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	141.9	175.4	-69.6	-95.2	0	0	0	110.4	H361 L424 P425 P427 S467 V468 C470	H361-Y363 HydrophobicContact CB-CD2 4.19Å; H361-Y363 HydrophobicContact CB-CE2 3.53Å; Y363-L424 HydrophobicContact CD1-CD2 3.62Å; Y363-L424 HydrophobicContact CD2-CD2 3.16Å; Y363-L424 HydrophobicContact CE1-CD2 4.07Å; Y363-L424 HydrophobicContact CE2-CD2 3.63Å; Y363-L424 HydrophobicContact CG-CD2 3.14Å; Y363-P425 WeakPolarHBondContact CE1-O 3.28Å; Y363-P425 PolarHBondContact OH-O 2.78Å; Y363-P427 HydrophobicContact CD1-CG 4.41Å; Y363-P427 HydrophobicContact CE1-CG 4.47Å; Y363-S467 CarbonylContact O-C 3.57Å; Y363-S467 WeakPolarHBondContact O-CA 3.37Å; Y363-V468 PolarHBondContact N-O 3.06Å; Y363-V468 PolarHBondContact O-N 2.84Å; Y363-C470 VanDerWaalsContact CE2-SG 3.51Å
364	E	92.1	Very high	83.6	Confident	112 Å²	112	66.9 Å²	66.9	52%	0.523	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	155.5	178.2	-58	-171.6	162.9	0	0	108.9	R362	R362-E364 IonicContact CZ-OE1 2.77Å; R362-E364 IonicContact NE-OE1 3.98Å; R362-E364 PolarHBondContact NE-OE1 3.03Å; R362-E364 VanDerWaalsContact NE-OE1 3.12Å; R362-E364 IonicContact NH2-OE1 3.52Å; R362-E364 PolarHBondContact NH2-OE1 3.5Å
365	N	92.3	Very high	85.3	Confident	114 Å²	114	62.6 Å²	62.6	61%	0.61	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	57	56.6	-177.1	-51	-43.5	0	0	0	112.3	H431 G466	N365-H431 PolarHBondContact O-CD2 3.27Å; N365-H431 VanDerWaalsContact O-CG 3.29Å; N365-H431 PolarHBondContact O-NE2 3.05Å; N365-G466 PolarHBondContact N-O 3.42Å; N365-G466 VanDerWaalsContact N-O 3.15Å
366	V	96.5	Very high	87	Confident	0 Å²	0	56 Å²	56	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	153.6	172	-59.8	0	0	0	0	109.9	I368 V421 S422 L424 S465 G466 V468	V366-I368 HydrophobicContact CG2-CG1 4.39Å; V366-V421 HydrophobicContact CB-CG1 3.98Å; V366-V421 HydrophobicContact CG2-CG1 4.3Å; V366-S422 WeakPolarHBondContact CA-O 3.43Å; V366-S422 WeakPolarHBondContact CB-O 3.41Å; V366-L424 HydrophobicContact CG1-CD2 4.31Å; V366-L424 HydrophobicContact CG1-CG 4.16Å; V366-S465 CarbonylContact O-C 3.59Å; V366-S465 VanDerWaalsContact O-CA 3.27Å; V366-S465 WeakPolarHBondContact O-CA 3.47Å; V366-G466 WeakPolarHBondContact CG2-O 3.3Å; V366-G466 PolarHBondContact N-O 3.45Å; V366-G466 PolarHBondContact O-N 2.92Å; V366-V468 HydrophobicContact CB-CG2 4.42Å; V366-V468 HydrophobicContact CG1-CG2 4.18Å; V366-V468 HydrophobicContact CG2-CB 4.1Å; V366-V468 HydrophobicContact CG2-CG1 3.57Å; V366-V468 HydrophobicContact CG2-CG2 3.58Å
367	S	96.9	Very high	88.1	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	136.3	171.1	-69.3	0	0	0	0	111.2	V421 S422 H431 A432 C435 H464 S465	S367-V421 CarbonylContact O-C 3.57Å; S367-V421 VanDerWaalsContact O-CA 3.27Å; S367-V421 WeakPolarHBondContact O-CA 3.31Å; S367-V421 WeakPolarHBondContact O-CG1 3.49Å; S367-S422 PolarHBondContact N-O 2.84Å; S367-S422 PolarHBondContact O-N 2.87Å; S367-H431 PolarHBondContact N-ND1 3.1Å; S367-H431 PolarHBondContact OG-CE1 3.48Å; S367-H431 PolarHBondContact OG-ND1 3.14Å; S367-A432 WeakPolarHBondContact OG-CA 3.45Å; S367-A432 PolarHBondContact OG-N 3.1Å; S367-C435 WeakPolarHBondContact CB-SG 3.46Å; S367-C435 PolarHBondContact O-SG 3.41Å; S367-C435 VanDerWaalsContact O-SG 3.41Å; S367-H464 CarbonylContact C-O 3.57Å; S367-H464 WeakPolarHBondContact CA-O 3.35Å; S367-S465 PolarHBondContact OG-OG 3.25Å
368	I	97.4	Very high	89	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	121.1	-168.3	-61.8	170	0	0	0	106.3	V366 F370 Y419 V421 I463 H464 V468 D486 V487 A490	V366-I368 HydrophobicContact CG2-CG1 4.39Å; I368-F370 HydrophobicContact CG2-CD2 4.1Å; I368-F370 HydrophobicContact CG2-CE2 3.85Å; I368-Y419 HydrophobicContact CB-CE2 4.39Å; I368-Y419 HydrophobicContact CG2-CD2 4.35Å; I368-Y419 HydrophobicContact CG2-CE2 3.32Å; I368-V421 HydrophobicContact CG1-CG2 4.41Å; I368-I463 VanDerWaalsContact O-CA 3.3Å; I368-I463 WeakPolarHBondContact O-CA 3.48Å; I368-H464 PolarHBondContact N-O 3.43Å; I368-H464 PolarHBondContact O-N 3.32Å; I368-V468 HydrophobicContact CD1-CG1 3.64Å; I368-V468 HydrophobicContact CG1-CG1 4.24Å; I368-D486 HydrophobicContact CD1-CB 4Å; I368-V487 HydrophobicContact CD1-CG2 3.87Å; I368-A490 HydrophobicContact CB-CB 3.96Å; I368-A490 HydrophobicContact CG2-CB 3.31Å
369	L	96.8	Very high	89.3	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	118.8	-178.7	-179	156.9	0	0	0	110.5	A371 Y419 C420 C435 M438 M442 I461 G462 I463	L369-A371 HydrophobicContact CD2-CB 3.89Å; L369-Y419 WeakPolarHBondContact O-CA 3.41Å; L369-Y419 VanDerWaalsContact O-CD2 3.26Å; L369-Y419 WeakPolarHBondContact O-CD2 2.92Å; L369-C420 PolarHBondContact N-O 3.47Å; L369-C420 PolarHBondContact O-N 3Å; L369-C435 HydrophobicContact CD1-CB 4.5Å; L369-C435 WeakPolarHBondContact CD1-O 3.38Å; L369-M438 HydrophobicContact CD1-CB 4.41Å; L369-M438 HydrophobicContact CD1-CG 4.3Å; L369-M442 HydrophobicContact CD2-CE 3.74Å; L369-M442 HydrophobicContact CD2-SD 3.95Å; L369-I461 HydrophobicContact CD1-CG2 4.04Å; L369-I461 HydrophobicContact CD2-CG2 4.16Å; L369-I461 HydrophobicContact CG-CG2 3.89Å; L369-G462 WeakPolarHBondContact CA-O 3.27Å; L369-I463 HydrophobicContact CB-CG1 4.26Å; L369-I463 HydrophobicContact CD1-CD1 3.88Å; L369-I463 HydrophobicContact CD1-CG1 4.05Å; L369-I463 HydrophobicContact CG-CD1 4.42Å; L369-I463 HydrophobicContact CG-CG1 4.03Å
370	F	96.6	Very high	89.4	Confident	7 Å²	7	50.1 Å²	50.1	3%	0.031	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	131.4	168	-81.2	-94	0	0	0	109.7	I368 L414 Y419 I461 G462 V487 A490 N491 E494	I368-F370 HydrophobicContact CG2-CD2 4.1Å; I368-F370 HydrophobicContact CG2-CE2 3.85Å; F370-L414 HydrophobicContact CE1-CD1 4.37Å; F370-Y419 AromaticContact CD1-CD2 3.97Å; F370-Y419 HydrophobicContact CD1-CD2 3.97Å; F370-Y419 HydrophobicContact CD1-CG 4.07Å; F370-Y419 AromaticContact CD2-CD2 3.52Å; F370-Y419 HydrophobicContact CD2-CD2 3.52Å; F370-Y419 AromaticContact CD2-CE2 3.87Å; F370-Y419 HydrophobicContact CD2-CE2 3.87Å; F370-Y419 HydrophobicContact CD2-CG 4.36Å; F370-Y419 HydrophobicContact CE1-CD1 4.22Å; F370-Y419 AromaticContact CE1-CD2 3.76Å; F370-Y419 HydrophobicContact CE1-CD2 3.76Å; F370-Y419 AromaticContact CE1-CG 3.61Å; F370-Y419 HydrophobicContact CE1-CG 3.61Å; F370-Y419 AromaticContact CE2-CD2 3.29Å; F370-Y419 HydrophobicContact CE2-CD2 3.29Å; F370-Y419 AromaticContact CE2-CE2 3.39Å; F370-Y419 HydrophobicContact CE2-CE2 3.39Å; F370-Y419 AromaticContact CE2-CG 3.95Å; F370-Y419 HydrophobicContact CE2-CG 3.95Å; F370-Y419 AromaticContact CE2-CZ 3.98Å; F370-Y419 AromaticContact CG-CD2 3.86Å; F370-Y419 HydrophobicContact CG-CD2 3.86Å; F370-Y419 HydrophobicContact CG-CG 4.42Å; F370-Y419 AromaticContact CZ-CD1 3.92Å; F370-Y419 HydrophobicContact CZ-CD1 3.92Å; F370-Y419 AromaticContact CZ-CD2 3.41Å; F370-Y419 HydrophobicContact CZ-CD2 3.41Å; F370-Y419 VanDerWaalsContact CZ-CD2 3.41Å; F370-Y419 HydrophobicContact CZ-CE1 4.14Å; F370-Y419 AromaticContact CZ-CE2 3.77Å; F370-Y419 HydrophobicContact CZ-CE2 3.77Å; F370-Y419 AromaticContact CZ-CG 3.55Å; F370-Y419 HydrophobicContact CZ-CG 3.55Å; F370-I461 CarbonylContact O-C 3.51Å; F370-I461 WeakPolarHBondContact O-CA 3.35Å; F370-G462 PolarHBondContact N-O 3.05Å; F370-G462 PolarHBondContact O-N 3.06Å; F370-V487 HydrophobicContact CE2-CG1 3.84Å; F370-V487 HydrophobicContact CZ-CG1 3.84Å; F370-A490 HydrophobicContact CD2-CB 3.66Å; F370-A490 HydrophobicContact CE2-CB 4.01Å; F370-N491 HydrophobicContact CD2-CB 4.32Å; F370-N491 HydrophobicContact CE1-CB 4.38Å; F370-N491 HydrophobicContact CE2-CB 4.13Å; F370-N491 HydrophobicContact CZ-CB 4.17Å; F370-E494 HydrophobicContact CB-CB 3.7Å; F370-E494 HydrophobicContact CB-CG 4.04Å
371	A	94.2	Very high	89.3	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	117.4	177.9	0	0	0	0	0	110.2	L369 C417 Y418 M442 M459 R460 I461	L369-A371 HydrophobicContact CD2-CB 3.89Å; A371-C417 CarbonylContact O-C 3.52Å; A371-C417 WeakPolarHBondContact O-CA 3.31Å; A371-Y418 PolarHBondContact N-O 3.49Å; A371-Y418 PolarHBondContact O-N 2.87Å; A371-M442 HydrophobicContact CB-CE 4.41Å; A371-M442 HydrophobicContact CB-SD 3.7Å; A371-M459 HydrophobicContact CB-CG 4.27Å; A371-M459 HydrophobicContact CB-SD 3.84Å; A371-R460 CarbonylContact C-O 3.58Å; A371-R460 VanDerWaalsContact CA-O 3.25Å; A371-R460 WeakPolarHBondContact CA-O 3.33Å; A371-I461 HydrophobicContact CB-CG1 4.09Å
372	D	93.6	Very high	89.1	Confident	25 Å²	25	53.1 Å²	53.1	13%	0.134	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	144.1	-176.8	-170.9	38.3	0	0	0	112.8	K374 C417 M459 R460 E494	D372-K374 PolarHBondContact O-N 3.4Å; D372-C417 HydrophobicContact CB-CB 4.3Å; D372-C417 PolarHBondContact OD1-N 3.28Å; D372-M459 CarbonylContact O-C 3.39Å; D372-M459 WeakPolarHBondContact O-CA 3.45Å; D372-M459 WeakPolarHBondContact O-CG 3.5Å; D372-R460 PolarHBondContact N-O 3.36Å; D372-R460 PolarHBondContact O-N 3.14Å; D372-E494 VanDerWaalsContact CB-CD 3.42Å; D372-E494 HydrophobicContact CB-CG 3.94Å; D372-E494 WeakPolarHBondContact CB-OE1 3.34Å
373	V	89.4	Confident	88.7	Confident	1 Å²	1	47.2 Å²	47.2	1%	0.006	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	118.3	-178.1	179.8	0	0	0	0	110.2	G375 L395 D416 I457 M459	V373-G375 PolarHBondContact O-N 3.38Å; V373-L395 HydrophobicContact CG2-CD2 4.15Å; V373-D416 HydrophobicContact CB-CB 4.17Å; V373-D416 HydrophobicContact CG2-CB 4.42Å; V373-I457 HydrophobicContact CG1-CG2 3.32Å; V373-M459 HydrophobicContact CG2-CE 3.76Å
374	K	86.1	Confident	88.4	Confident	93 Å²	93	47.9 Å²	47.9	40%	0.404	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	128.7	176.1	-170.7	-157	-172.8	171.9	0	110.6	D372 F376 D458 P499	D372-K374 PolarHBondContact O-N 3.4Å; K374-F376 VanDerWaalsContact C-N 3.34Å; K374-D458 HydrophobicContact CB-CB 4.24Å; K374-D458 WeakPolarHBondContact CB-O 3.43Å; K374-D458 HydrophobicContact CD-CB 4.23Å; K374-D458 PolarHBondContact N-O 3.41Å; K374-P499 HydrophobicContact CB-CB 4.32Å; K374-P499 HydrophobicContact CD-CB 3.61Å; K374-P499 HydrophobicContact CD-CG 3.67Å; K374-P499 HydrophobicContact CG-CB 4.19Å; K374-P499 HydrophobicContact CG-CG 4.36Å
375	G	78.1	Confident	88.2	Confident	39 Å²	39	46.3 Å²	46.3	40%	0.402	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.3	15.4	170.6	0	0	0	0	0	114.2	V373 T377 N378 L379	V373-G375 PolarHBondContact O-N 3.38Å; G375-T377 PolarHBondContact O-N 2.91Å; G375-N378 PolarHBondContact O-N 3.36Å; G375-L379 PolarHBondContact O-N 2.87Å; G375-L379 VanDerWaalsContact O-N 3.13Å
376	F	80.7	Confident	87.9	Confident	35 Å²	35	47.2 Å²	47.2	15%	0.154	28%	0.282	C	S	.	.	H	α-helix	trans	-52.4	-38.3	176.8	-177.3	-105.6	0	0	0	113.5	K374 N378 L379 S380 L388 L392 D416	K374-F376 VanDerWaalsContact C-N 3.34Å; F376-N378 VanDerWaalsContact C-N 3.29Å; F376-N378 PolarHBondContact O-N 3.28Å; F376-L379 CarbonylContact O-C 3.45Å; F376-L379 WeakPolarHBondContact O-CB 3.35Å; F376-L379 PolarHBondContact O-N 3.48Å; F376-L379 VanDerWaalsContact O-N 3.09Å; F376-S380 WeakPolarHBondContact O-CB 3.2Å; F376-S380 PolarHBondContact O-N 3.37Å; F376-S380 PolarHBondContact O-OG 3.44Å; F376-L388 HydrophobicContact CD2-CD1 4.34Å; F376-L388 HydrophobicContact CE2-CD1 3.66Å; F376-L388 HydrophobicContact CE2-CD2 4.08Å; F376-L388 HydrophobicContact CE2-CG 4.04Å; F376-L388 HydrophobicContact CZ-CD1 4.28Å; F376-L388 HydrophobicContact CZ-CD2 3.82Å; F376-L388 HydrophobicContact CZ-CG 4.25Å; F376-L392 HydrophobicContact CD2-CD2 4.46Å; F376-L392 HydrophobicContact CE2-CD1 3.69Å; F376-L392 HydrophobicContact CE2-CD2 3.97Å; F376-L392 HydrophobicContact CE2-CG 4.11Å; F376-L392 HydrophobicContact CZ-CD1 3.92Å; F376-D416 HydrophobicContact CB-CB 3.95Å; F376-D416 WeakPolarHBondContact CB-OD2 3.34Å; F376-D416 HydrophobicContact CD1-CB 3.79Å; F376-D416 WeakPolarHBondContact CD1-OD2 3.5Å; F376-D416 HydrophobicContact CD2-CB 3.64Å; F376-D416 HydrophobicContact CE1-CB 4.18Å; F376-D416 HydrophobicContact CE2-CB 4.04Å; F376-D416 HydrophobicContact CG-CB 3.51Å; F376-D416 VanDerWaalsContact CG-OD2 3.23Å; F376-D416 WeakPolarHBondContact CG-OD2 3.24Å; F376-D416 HydrophobicContact CZ-CB 4.29Å
377	T	81.9	Confident	87.3	Confident	109 Å²	109	52 Å²	52	67%	0.669	30%	0.304	S	S	*	.	H	α-helix	trans	-58	-41.3	178.1	-36	0	0	0	0	111.9	G375 S380 T381	G375-T377 PolarHBondContact O-N 2.91Å; T377-S380 PolarHBondContact O-N 3.48Å; T377-S380 PolarHBondContact O-OG 3.03Å; T377-T381 PolarHBondContact O-N 3.48Å
378	N	82	Confident	86.7	Confident	115 Å²	115	53 Å²	53	62%	0.615	31%	0.309	S	S	*	.	H	α-helix	trans	-75.5	-30.3	177.3	-168.1	32.4	0	0	0	112.5	G375 F376 T381 T382	G375-N378 PolarHBondContact O-N 3.36Å; F376-N378 VanDerWaalsContact C-N 3.29Å; F376-N378 PolarHBondContact O-N 3.28Å; N378-T381 PolarHBondContact O-OG1 2.98Å; N378-T382 WeakPolarHBondContact O-CG2 3.03Å; N378-T382 PolarHBondContact O-N 3Å; N378-T382 PolarHBondContact O-OG1 2.79Å
379	L	79.9	Confident	86.2	Confident	18 Å²	18	57.5 Å²	57.5	9%	0.094	34%	0.336	C	S	.	.	H	α-helix	trans	-68.4	-38.3	172.6	-72	162.8	0	0	0	111.2	G375 F376 T381 T382 L383 H455 I457	G375-L379 PolarHBondContact O-N 2.87Å; G375-L379 VanDerWaalsContact O-N 3.13Å; F376-L379 CarbonylContact O-C 3.45Å; F376-L379 WeakPolarHBondContact O-CB 3.35Å; F376-L379 PolarHBondContact O-N 3.48Å; F376-L379 VanDerWaalsContact O-N 3.09Å; L379-T381 VanDerWaalsContact C-N 3.27Å; L379-T381 PolarHBondContact O-N 3.47Å; L379-T382 WeakPolarHBondContact CA-OG1 3.4Å; L379-T382 PolarHBondContact O-N 2.94Å; L379-T382 PolarHBondContact O-OG1 3.03Å; L379-T382 VanDerWaalsContact O-OG1 3.14Å; L379-L383 HydrophobicContact CD2-CD1 4.45Å; L379-L383 WeakPolarHBondContact O-CB 3.48Å; L379-L383 PolarHBondContact O-N 3.46Å; L379-H455 HydrophobicContact CD2-CB 4.39Å; L379-I457 HydrophobicContact CD1-CD1 4.36Å; L379-I457 HydrophobicContact CD1-CG1 3.93Å
380	S	84	Confident	85.6	Confident	48 Å²	48	64.2 Å²	64.2	34%	0.336	36%	0.362	S	S	.	.	H	α-helix	trans	-69.2	-23.5	-179.1	74.9	0	0	0	0	113.8	F376 T377	F376-S380 WeakPolarHBondContact O-CB 3.2Å; F376-S380 PolarHBondContact O-N 3.37Å; F376-S380 PolarHBondContact O-OG 3.44Å; T377-S380 PolarHBondContact O-N 3.48Å; T377-S380 PolarHBondContact O-OG 3.03Å
381	T	84.9	Confident	85	Confident	106 Å²	106	64.5 Å²	64.5	65%	0.65	36%	0.363	S	S	*	.	H	α-helix	trans	-85	-23.7	175.1	53.2	0	0	0	0	113	T377 N378 L379	T377-T381 PolarHBondContact O-N 3.48Å; N378-T381 PolarHBondContact O-OG1 2.98Å; L379-T381 VanDerWaalsContact C-N 3.27Å; L379-T381 PolarHBondContact O-N 3.47Å
382	T	83.4	Confident	84.6	Confident	100 Å²	100	65.5 Å²	65.5	61%	0.613	37%	0.369	S	S	*	.	H	α-helix	trans	-97.9	-29.3	-175.2	49.5	0	0	0	0	113.1	N378 L379	N378-T382 WeakPolarHBondContact O-CG2 3.03Å; N378-T382 PolarHBondContact O-N 3Å; N378-T382 PolarHBondContact O-OG1 2.79Å; L379-T382 WeakPolarHBondContact CA-OG1 3.4Å; L379-T382 PolarHBondContact O-N 2.94Å; L379-T382 PolarHBondContact O-OG1 3.03Å; L379-T382 VanDerWaalsContact O-OG1 3.14Å
383	L	82.9	Confident	84.3	Confident	28 Å²	28	68.7 Å²	68.7	15%	0.147	39%	0.386	C	S	.	.	S	Bend	trans	-93.8	151.2	179.6	-73.7	172	0	0	0	112.8	L379 E387 L388 H455	L379-L383 HydrophobicContact CD2-CD1 4.45Å; L379-L383 WeakPolarHBondContact O-CB 3.48Å; L379-L383 PolarHBondContact O-N 3.46Å; L383-E387 HydrophobicContact CD2-CB 4.33Å; L383-L388 HydrophobicContact CB-CB 4.38Å; L383-L388 HydrophobicContact CD1-CD1 4.09Å; L383-H455 WeakPolarHBondContact CD2-NE2 3.47Å
384	S	87.5	Confident	84.1	Confident	55 Å²	55	70.5 Å²	70.5	39%	0.385	39%	0.394	S	S	.	.			trans	-67.5	150.5	166.3	71.5	0	0	0	0	110.8	Q386 E387 L388	S384-Q386 PolarHBondContact O-N 2.92Å; S384-E387 WeakPolarHBondContact CB-OE2 3.46Å; S384-E387 PolarHBondContact N-OE2 3.49Å; S384-E387 PolarHBondContact O-N 3.43Å; S384-E387 VanDerWaalsContact O-N 3.13Å; S384-E387 WeakPolarHBondContact OG-CB 3.32Å; S384-E387 VanDerWaalsContact OG-CG 3.23Å; S384-E387 WeakPolarHBondContact OG-CG 3.3Å; S384-E387 PolarHBondContact OG-N 3.42Å; S384-E387 PolarHBondContact OG-OE2 3.4Å; S384-L388 PolarHBondContact O-N 3.05Å
385	A	87.4	Confident	84.2	Confident	79 Å²	79	66 Å²	66	65%	0.653	38%	0.375	S	S	*	.	H	α-helix	trans	-56.1	-36.4	179.9	0	0	0	0	0	112.8	V389	A385-V389 WeakPolarHBondContact O-CB 3.37Å; A385-V389 VanDerWaalsContact O-CG2 3.26Å; A385-V389 WeakPolarHBondContact O-CG2 3.34Å; A385-V389 PolarHBondContact O-N 3.05Å; A385-V389 VanDerWaalsContact O-N 3.07Å
386	Q	85.2	Confident	84.8	Confident	133 Å²	133	64.8 Å²	64.8	62%	0.621	36%	0.358	S	S	*	.	H	α-helix	trans	-69.3	-41.3	178.7	-172.4	-179.6	-1.1	0	0	112.3	S384 R390	S384-Q386 PolarHBondContact O-N 2.92Å; Q386-R390 VanDerWaalsContact O-CB 3.28Å; Q386-R390 WeakPolarHBondContact O-CB 3.13Å; Q386-R390 PolarHBondContact O-N 3.45Å
387	E	83.6	Confident	85.1	Confident	101 Å²	101	64.8 Å²	64.8	47%	0.472	36%	0.364	S	S	.	.	H	α-helix	trans	-69.4	-39.8	178.1	-71.3	165.1	150.2	0	0	111.6	L383 S384 R390 M391	L383-E387 HydrophobicContact CD2-CB 4.33Å; S384-E387 WeakPolarHBondContact CB-OE2 3.46Å; S384-E387 PolarHBondContact N-OE2 3.49Å; S384-E387 PolarHBondContact O-N 3.43Å; S384-E387 VanDerWaalsContact O-N 3.13Å; S384-E387 WeakPolarHBondContact OG-CB 3.32Å; S384-E387 VanDerWaalsContact OG-CG 3.23Å; S384-E387 WeakPolarHBondContact OG-CG 3.3Å; S384-E387 PolarHBondContact OG-N 3.42Å; S384-E387 PolarHBondContact OG-OE2 3.4Å; E387-R390 PolarHBondContact O-N 3.41Å; E387-M391 WeakPolarHBondContact O-CB 3.38Å; E387-M391 PolarHBondContact O-N 3.23Å
388	L	85.4	Confident	85.5	Confident	20 Å²	20	62.3 Å²	62.3	11%	0.105	34%	0.343	C	S	.	.	H	α-helix	trans	-60.7	-50.5	175.9	-173.1	69.8	0	0	0	111.4	F376 L383 S384 R390 M391 L392	F376-L388 HydrophobicContact CD2-CD1 4.34Å; F376-L388 HydrophobicContact CE2-CD1 3.66Å; F376-L388 HydrophobicContact CE2-CD2 4.08Å; F376-L388 HydrophobicContact CE2-CG 4.04Å; F376-L388 HydrophobicContact CZ-CD1 4.28Å; F376-L388 HydrophobicContact CZ-CD2 3.82Å; F376-L388 HydrophobicContact CZ-CG 4.25Å; L383-L388 HydrophobicContact CB-CB 4.38Å; L383-L388 HydrophobicContact CD1-CD1 4.09Å; S384-L388 PolarHBondContact O-N 3.05Å; L388-R390 VanDerWaalsContact C-N 3.33Å; L388-R390 PolarHBondContact O-N 3.45Å; L388-M391 HydrophobicContact CD1-CE 4.09Å; L388-M391 PolarHBondContact O-N 2.98Å; L388-L392 WeakPolarHBondContact O-CG 3.2Å; L388-L392 PolarHBondContact O-N 3.3Å
389	V	86.8	Confident	86.1	Confident	95 Å²	95	56.9 Å²	56.9	58%	0.576	31%	0.314	S	S	*	.	H	α-helix	trans	-64.1	-39	178.7	172.2	0	0	0	0	111.1	A385 N393	A385-V389 WeakPolarHBondContact O-CB 3.37Å; A385-V389 VanDerWaalsContact O-CG2 3.26Å; A385-V389 WeakPolarHBondContact O-CG2 3.34Å; A385-V389 PolarHBondContact O-N 3.05Å; A385-V389 VanDerWaalsContact O-N 3.07Å; V389-N393 WeakPolarHBondContact O-CB 3.37Å; V389-N393 PolarHBondContact O-N 2.93Å
390	R	84.2	Confident	86.7	Confident	141 Å²	141	58.5 Å²	58.5	53%	0.532	32%	0.323	S	S	.	.	H	α-helix	trans	-63	-44.3	176.3	-174.3	-177.9	-72.2	118.4	-6.4	111.6	Q386 E387 L388 N393 E394	Q386-R390 VanDerWaalsContact O-CB 3.28Å; Q386-R390 WeakPolarHBondContact O-CB 3.13Å; Q386-R390 PolarHBondContact O-N 3.45Å; E387-R390 PolarHBondContact O-N 3.41Å; L388-R390 VanDerWaalsContact C-N 3.33Å; L388-R390 PolarHBondContact O-N 3.45Å; R390-N393 PolarHBondContact O-N 3.42Å; R390-E394 PolarHBondContact O-N 3.12Å
391	M	83.2	Confident	87	Confident	13 Å²	13	62.2 Å²	62.2	6%	0.064	33%	0.329	C	S	.	.	H	α-helix	trans	-63.8	-47.3	177.9	-179.3	-81.1	-67.1	0	0	111.6	E387 L388 N393 E394 L395 T453 I457	E387-M391 WeakPolarHBondContact O-CB 3.38Å; E387-M391 PolarHBondContact O-N 3.23Å; L388-M391 HydrophobicContact CD1-CE 4.09Å; L388-M391 PolarHBondContact O-N 2.98Å; M391-N393 PolarHBondContact O-N 3.35Å; M391-E394 PolarHBondContact O-N 2.88Å; M391-L395 PolarHBondContact O-N 2.84Å; M391-T453 HydrophobicContact CG-CG2 4.39Å; M391-I457 HydrophobicContact CE-CD1 3.85Å; M391-I457 HydrophobicContact CG-CD1 4.23Å; M391-I457 HydrophobicContact SD-CD1 3.65Å
392	L	86.4	Confident	87.4	Confident	21 Å²	21	58.1 Å²	58.1	11%	0.11	30%	0.303	C	S	.	.	H	α-helix	trans	-61.2	-44	176.2	-75.3	178.1	0	0	0	112	F376 L388 E394 L395 F396	F376-L392 HydrophobicContact CD2-CD2 4.46Å; F376-L392 HydrophobicContact CE2-CD1 3.69Å; F376-L392 HydrophobicContact CE2-CD2 3.97Å; F376-L392 HydrophobicContact CE2-CG 4.11Å; F376-L392 HydrophobicContact CZ-CD1 3.92Å; L388-L392 WeakPolarHBondContact O-CG 3.2Å; L388-L392 PolarHBondContact O-N 3.3Å; L392-E394 VanDerWaalsContact C-N 3.35Å; L392-E394 PolarHBondContact O-N 3.32Å; L392-L395 PolarHBondContact O-N 3.44Å; L392-F396 HydrophobicContact CB-CD2 4.27Å; L392-F396 HydrophobicContact CB-CE2 4.1Å; L392-F396 HydrophobicContact CD2-CE2 3.94Å; L392-F396 HydrophobicContact CD2-CZ 4Å; L392-F396 HydrophobicContact CG-CE2 4.45Å; L392-F396 WeakPolarHBondContact O-CB 3.48Å; L392-F396 VanDerWaalsContact O-CD2 3.31Å; L392-F396 WeakPolarHBondContact O-CD2 3.05Å; L392-F396 WeakPolarHBondContact O-CG 3.37Å; L392-F396 PolarHBondContact O-N 3.31Å
393	N	87.6	Confident	87.9	Confident	92 Å²	92	53.5 Å²	53.5	49%	0.492	28%	0.275	S	S	.	.	H	α-helix	trans	-64.9	-38.2	179.7	-171.7	74.8	0	0	0	111.9	V389 R390 M391 A397	V389-N393 WeakPolarHBondContact O-CB 3.37Å; V389-N393 PolarHBondContact O-N 2.93Å; R390-N393 PolarHBondContact O-N 3.42Å; M391-N393 PolarHBondContact O-N 3.35Å; N393-A397 WeakPolarHBondContact O-CB 3.39Å; N393-A397 PolarHBondContact O-N 2.9Å
394	E	84.8	Confident	88.2	Confident	39 Å²	39	59.3 Å²	59.3	18%	0.182	30%	0.302	C	S	.	.	H	α-helix	trans	-65.6	-41.1	173.9	-176.4	175.1	-179.8	0	0	111.8	R390 M391 L392 R398 W577	R390-E394 PolarHBondContact O-N 3.12Å; M391-E394 PolarHBondContact O-N 2.88Å; L392-E394 VanDerWaalsContact C-N 3.35Å; L392-E394 PolarHBondContact O-N 3.32Å; E394-R398 WeakPolarHBondContact O-CG 3.47Å; E394-R398 PolarHBondContact O-N 3.44Å; E394-R398 IonicContact OE1-CZ 3.46Å; E394-R398 IonicContact OE1-NE 3.99Å; E394-R398 IonicContact OE1-NH2 3.99Å; E394-R398 PolarHBondContact OE1-NH2 3.49Å; E394-W577 HydrophobicContact CG-CZ2 4.08Å
395	L	87.9	Confident	88.4	Confident	0 Å²	0	62 Å²	62	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-65.7	-52.3	178.5	-176.8	65.6	0	0	0	111.4	V373 M391 L392 A397 R398 F399 I446 V449 M459	V373-L395 HydrophobicContact CG2-CD2 4.15Å; M391-L395 PolarHBondContact O-N 2.84Å; L392-L395 PolarHBondContact O-N 3.44Å; L395-A397 PolarHBondContact O-N 3.4Å; L395-R398 WeakPolarHBondContact O-CB 3.49Å; L395-R398 PolarHBondContact O-N 3.42Å; L395-F399 HydrophobicContact CD1-CE1 3.8Å; L395-F399 HydrophobicContact CD1-CE2 4.17Å; L395-F399 HydrophobicContact CD1-CZ 3.57Å; L395-F399 HydrophobicContact CD2-CE2 4.19Å; L395-F399 HydrophobicContact CD2-CZ 4.27Å; L395-F399 HydrophobicContact CG-CD2 4.43Å; L395-F399 HydrophobicContact CG-CE1 4.32Å; L395-F399 HydrophobicContact CG-CE2 3.86Å; L395-F399 HydrophobicContact CG-CZ 3.81Å; L395-F399 PolarHBondContact O-N 2.94Å; L395-F399 VanDerWaalsContact O-N 3.08Å; L395-I446 HydrophobicContact CD1-CD1 3.64Å; L395-I446 HydrophobicContact CD2-CD1 3.81Å; L395-I446 HydrophobicContact CG-CD1 4.4Å; L395-V449 HydrophobicContact CD1-CB 4.39Å; L395-V449 HydrophobicContact CD1-CG2 3.99Å; L395-M459 HydrophobicContact CD2-CE 4.25Å
396	F	91.3	Very high	88.7	Confident	13 Å²	13	60 Å²	60	6%	0.057	29%	0.285	C	S	.	.	H	α-helix	trans	-69	-31.7	-177.7	-63.6	-34.7	0	0	0	113	L392 R398 F399 D400 I413 Y418	L392-F396 HydrophobicContact CB-CD2 4.27Å; L392-F396 HydrophobicContact CB-CE2 4.1Å; L392-F396 HydrophobicContact CD2-CE2 3.94Å; L392-F396 HydrophobicContact CD2-CZ 4Å; L392-F396 HydrophobicContact CG-CE2 4.45Å; L392-F396 WeakPolarHBondContact O-CB 3.48Å; L392-F396 VanDerWaalsContact O-CD2 3.31Å; L392-F396 WeakPolarHBondContact O-CD2 3.05Å; L392-F396 WeakPolarHBondContact O-CG 3.37Å; L392-F396 PolarHBondContact O-N 3.31Å; F396-R398 VanDerWaalsContact C-N 3.3Å; F396-R398 PolarHBondContact O-N 3.37Å; F396-F399 AromaticContact CD1-CD2 3.9Å; F396-F399 HydrophobicContact CD1-CD2 3.9Å; F396-F399 HydrophobicContact CD1-CE2 4.35Å; F396-F399 HydrophobicContact CE1-CD2 4.44Å; F396-F399 CarbonylContact O-C 3.6Å; F396-F399 PolarHBondContact O-N 3.07Å; F396-D400 VanDerWaalsContact O-CG 3.26Å; F396-D400 PolarHBondContact O-N 3.17Å; F396-I413 HydrophobicContact CB-CD1 4.02Å; F396-I413 HydrophobicContact CD2-CD1 3.85Å; F396-I413 HydrophobicContact CD2-CG2 3.88Å; F396-I413 HydrophobicContact CE2-CG2 3.44Å; F396-I413 VanDerWaalsContact CE2-CG2 3.44Å; F396-I413 HydrophobicContact CG-CD1 4.01Å; F396-I413 HydrophobicContact CZ-CG2 3.88Å; F396-Y418 HydrophobicContact CB-CD2 4.44Å; F396-Y418 AromaticContact CD1-CD2 3.65Å; F396-Y418 HydrophobicContact CD1-CD2 3.65Å; F396-Y418 HydrophobicContact CD1-CG 4.38Å; F396-Y418 HydrophobicContact CE1-CD2 4.19Å; F396-Y418 HydrophobicContact CG-CD2 4.23Å
397	A	88	Confident	89	Confident	34 Å²	34	59.3 Å²	59.3	28%	0.281	28%	0.282	S	S	.	.	H	α-helix	trans	-62.4	-37.6	172.7	0	0	0	0	0	112.2	N393 L395 D400 R401 W577	N393-A397 WeakPolarHBondContact O-CB 3.39Å; N393-A397 PolarHBondContact O-N 2.9Å; L395-A397 PolarHBondContact O-N 3.4Å; A397-D400 PolarHBondContact O-N 2.87Å; A397-R401 PolarHBondContact O-N 3.07Å; A397-W577 HydrophobicContact CB-CH2 4.3Å
398	R	89.9	Confident	89.5	Confident	58 Å²	58	54.9 Å²	54.9	22%	0.219	26%	0.262	C	S	.	.	H	α-helix	trans	-68.6	-39.9	173.7	-66.3	166.8	-175	-103.5	-2.3	111.2	E394 L395 F396 D400 R401 L402 T445 Y448	E394-R398 WeakPolarHBondContact O-CG 3.47Å; E394-R398 PolarHBondContact O-N 3.44Å; E394-R398 IonicContact OE1-CZ 3.46Å; E394-R398 IonicContact OE1-NE 3.99Å; E394-R398 IonicContact OE1-NH2 3.99Å; E394-R398 PolarHBondContact OE1-NH2 3.49Å; L395-R398 WeakPolarHBondContact O-CB 3.49Å; L395-R398 PolarHBondContact O-N 3.42Å; F396-R398 VanDerWaalsContact C-N 3.3Å; F396-R398 PolarHBondContact O-N 3.37Å; R398-D400 VanDerWaalsContact C-N 3.33Å; R398-D400 PolarHBondContact O-N 2.98Å; R398-R401 PolarHBondContact O-N 3.13Å; R398-L402 WeakPolarHBondContact O-CG 3.32Å; R398-L402 PolarHBondContact O-N 2.99Å; R398-T445 HydrophobicContact CB-CG2 3.88Å; R398-T445 HydrophobicContact CG-CG2 4.47Å; R398-Y448 VanDerWaalsContact CZ-CE1 3.48Å
399	F	94	Very high	89.8	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-64.3	-36.6	174.9	-66.6	-9.1	0	0	0	112.3	L395 F396 R401 L402 A403 Y418 M438 M442 T445 M459	L395-F399 HydrophobicContact CD1-CE1 3.8Å; L395-F399 HydrophobicContact CD1-CE2 4.17Å; L395-F399 HydrophobicContact CD1-CZ 3.57Å; L395-F399 HydrophobicContact CD2-CE2 4.19Å; L395-F399 HydrophobicContact CD2-CZ 4.27Å; L395-F399 HydrophobicContact CG-CD2 4.43Å; L395-F399 HydrophobicContact CG-CE1 4.32Å; L395-F399 HydrophobicContact CG-CE2 3.86Å; L395-F399 HydrophobicContact CG-CZ 3.81Å; L395-F399 PolarHBondContact O-N 2.94Å; L395-F399 VanDerWaalsContact O-N 3.08Å; F396-F399 AromaticContact CD1-CD2 3.9Å; F396-F399 HydrophobicContact CD1-CD2 3.9Å; F396-F399 HydrophobicContact CD1-CE2 4.35Å; F396-F399 HydrophobicContact CE1-CD2 4.44Å; F396-F399 CarbonylContact O-C 3.6Å; F396-F399 PolarHBondContact O-N 3.07Å; F399-R401 VanDerWaalsContact C-N 3.28Å; F399-R401 PolarHBondContact O-N 3.41Å; F399-L402 HydrophobicContact CD1-CD1 4.2Å; F399-L402 PolarHBondContact O-N 3.34Å; F399-A403 VanDerWaalsContact O-CB 3.29Å; F399-A403 WeakPolarHBondContact O-CB 3.39Å; F399-A403 PolarHBondContact O-N 3.34Å; F399-Y418 HydrophobicContact CB-CD2 4.15Å; F399-Y418 HydrophobicContact CB-CE1 4.23Å; F399-Y418 HydrophobicContact CB-CE2 3.79Å; F399-Y418 HydrophobicContact CD2-CD1 4.49Å; F399-Y418 HydrophobicContact CD2-CD2 4.07Å; F399-Y418 HydrophobicContact CD2-CG 4.02Å; F399-M438 HydrophobicContact CB-CE 4.47Å; F399-M438 WeakPolarHBondContact O-CE 3.35Å; F399-M442 HydrophobicContact CD1-CB 4.43Å; F399-M442 HydrophobicContact CD1-CG 3.92Å; F399-M442 HydrophobicContact CD2-CE 4.41Å; F399-M442 HydrophobicContact CD2-SD 4.49Å; F399-M442 HydrophobicContact CE1-CB 3.88Å; F399-M442 HydrophobicContact CE1-CG 3.85Å; F399-M442 HydrophobicContact CE2-CG 4.48Å; F399-M442 HydrophobicContact CE2-SD 4.43Å; F399-M442 HydrophobicContact CG-CE 4.47Å; F399-M442 HydrophobicContact CG-CG 4.27Å; F399-M442 HydrophobicContact CZ-CB 4.07Å; F399-M442 HydrophobicContact CZ-CG 4.14Å; F399-T445 HydrophobicContact CD1-CG2 4.4Å; F399-T445 HydrophobicContact CE1-CG2 4.09Å; F399-M459 HydrophobicContact CE2-CE 3.57Å; F399-M459 HydrophobicContact CE2-SD 3.92Å; F399-M459 HydrophobicContact CZ-CE 3.68Å; F399-M459 HydrophobicContact CZ-SD 3.76Å
400	D	91.7	Very high	90.1	Very high	53 Å²	53	56.1 Å²	56.1	28%	0.283	26%	0.258	S	S	.	.	H	α-helix	trans	-60.3	-39.3	174.2	-71.1	-13.5	0	0	0	111.8	F396 A397 R398 A403 H404 R410 Y418	F396-D400 VanDerWaalsContact O-CG 3.26Å; F396-D400 PolarHBondContact O-N 3.17Å; A397-D400 PolarHBondContact O-N 2.87Å; R398-D400 VanDerWaalsContact C-N 3.33Å; R398-D400 PolarHBondContact O-N 2.98Å; D400-A403 PolarHBondContact O-N 2.89Å; D400-H404 PolarHBondContact O-N 2.93Å; D400-R410 WeakPolarHBondContact OD1-CD 3.2Å; D400-R410 IonicContact OD1-CZ 2.66Å; D400-R410 IonicContact OD1-NE 3.26Å; D400-R410 IonicContact OD1-NH1 3.47Å; D400-R410 PolarHBondContact OD1-NH1 3.26Å; D400-R410 VanDerWaalsContact OD1-NH1 3.09Å; D400-R410 IonicContact OD2-CZ 2.84Å; D400-R410 IonicContact OD2-NH1 3.88Å; D400-R410 PolarHBondContact OD2-NH1 2.96Å; D400-Y418 WeakPolarHBondContact OD1-CE2 3.45Å; D400-Y418 PolarHBondContact OD1-OH 3.18Å
401	R	91.6	Very high	90.5	Very high	125 Å²	125	50.2 Å²	50.2	47%	0.472	24%	0.236	S	C	.	.	H	α-helix	trans	-65.2	-48.7	174.1	-174	-176.7	-80.3	174.9	-6.6	111.4	A397 R398 F399 A403 H404 E405 E580	A397-R401 PolarHBondContact O-N 3.07Å; R398-R401 PolarHBondContact O-N 3.13Å; F399-R401 VanDerWaalsContact C-N 3.28Å; F399-R401 PolarHBondContact O-N 3.41Å; R401-A403 VanDerWaalsContact C-N 3.27Å; R401-A403 PolarHBondContact O-N 3.35Å; R401-H404 WeakPolarHBondContact O-CB 3.17Å; R401-H404 PolarHBondContact O-N 3.32Å; R401-H404 VanDerWaalsContact O-N 3.16Å; R401-E405 WeakPolarHBondContact CG-OE1 2.96Å; R401-E405 WeakPolarHBondContact O-CG 3.16Å; R401-E405 PolarHBondContact O-N 3Å; R401-E580 IonicContact CZ-OE2 3.2Å; R401-E580 IonicContact NH2-OE1 3.81Å; R401-E580 IonicContact NH2-OE2 3.83Å; R401-E580 PolarHBondContact NH2-OE2 3.39Å
402	L	93.3	Very high	90.9	Very high	20 Å²	20	52.4 Å²	52.4	11%	0.105	25%	0.245	C	C	.	.	H	α-helix	trans	-60.4	-37.9	177	-67.4	177.7	0	0	0	112.2	R398 F399 H404 E405 H406 M438 T445	R398-L402 WeakPolarHBondContact O-CG 3.32Å; R398-L402 PolarHBondContact O-N 2.99Å; F399-L402 HydrophobicContact CD1-CD1 4.2Å; F399-L402 PolarHBondContact O-N 3.34Å; L402-H404 VanDerWaalsContact C-N 3.28Å; L402-H404 PolarHBondContact O-N 2.91Å; L402-E405 PolarHBondContact O-N 3.12Å; L402-H406 WeakPolarHBondContact O-CB 3.45Å; L402-H406 PolarHBondContact O-CD2 3.04Å; L402-H406 VanDerWaalsContact O-CD2 3.29Å; L402-H406 PolarHBondContact O-N 3.41Å; L402-M438 HydrophobicContact CB-CE 3.61Å; L402-M438 HydrophobicContact CB-SD 3.51Å; L402-M438 VanDerWaalsContact CB-SD 3.51Å; L402-T445 WeakPolarHBondContact CD1-OG1 3.23Å
403	A	93	Very high	91.1	Very high	3 Å²	3	54.3 Å²	54.3	3%	0.025	26%	0.255	C	S	.	.	H	α-helix	trans	-63.1	-41	178.8	0	0	0	0	0	109.8	F399 D400 R401 H407 C408 M438	F399-A403 VanDerWaalsContact O-CB 3.29Å; F399-A403 WeakPolarHBondContact O-CB 3.39Å; F399-A403 PolarHBondContact O-N 3.34Å; D400-A403 PolarHBondContact O-N 2.89Å; R401-A403 VanDerWaalsContact C-N 3.27Å; R401-A403 PolarHBondContact O-N 3.35Å; A403-H407 CarbonylContact O-C 3.56Å; A403-H407 PolarHBondContact O-N 3.41Å; A403-H407 VanDerWaalsContact O-N 3.13Å; A403-C408 CarbonylContact C-O 3.58Å; A403-C408 HydrophobicContact CB-CB 4.3Å; A403-C408 WeakPolarHBondContact CB-O 3.31Å; A403-C408 WeakPolarHBondContact O-CA 3.46Å; A403-C408 PolarHBondContact O-N 2.74Å; A403-M438 HydrophobicContact CB-CE 3.82Å
404	H	89.7	Confident	91.1	Very high	151 Å²	151	53.9 Å²	53.9	70%	0.699	25%	0.252	S	S	*	.	H	α-helix	trans	-63.9	-45.4	173.4	-171	64.2	0	0	0	112.8	D400 R401 L402 H407	D400-H404 PolarHBondContact O-N 2.93Å; R401-H404 WeakPolarHBondContact O-CB 3.17Å; R401-H404 PolarHBondContact O-N 3.32Å; R401-H404 VanDerWaalsContact O-N 3.16Å; L402-H404 VanDerWaalsContact C-N 3.28Å; L402-H404 PolarHBondContact O-N 2.91Å; H404-H407 PolarHBondContact O-N 3.33Å
405	E	92.3	Very high	91.2	Very high	110 Å²	110	54.6 Å²	54.6	51%	0.514	27%	0.27	S	S	.	.	H	α-helix	trans	-62.9	-41.8	179.8	-71.4	171.8	-170.8	0	0	112.7	R401 L402 H407	R401-E405 WeakPolarHBondContact CG-OE1 2.96Å; R401-E405 WeakPolarHBondContact O-CG 3.16Å; R401-E405 PolarHBondContact O-N 3Å; L402-E405 PolarHBondContact O-N 3.12Å; E405-H407 PolarHBondContact O-N 2.96Å
406	H	92.9	Very high	91.3	Very high	39 Å²	39	56.1 Å²	56.1	18%	0.181	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.7	16.9	177.6	-65.9	-67.1	0	0	0	112.9	L402 C408 C434 M438 S441	L402-H406 WeakPolarHBondContact O-CB 3.45Å; L402-H406 PolarHBondContact O-CD2 3.04Å; L402-H406 VanDerWaalsContact O-CD2 3.29Å; L402-H406 PolarHBondContact O-N 3.41Å; H406-C408 PolarHBondContact O-N 2.96Å; H406-C408 PolarHBondContact O-SG 2.97Å; H406-C408 VanDerWaalsContact O-SG 3.39Å; H406-C434 WeakPolarHBondContact O-CB 3.48Å; H406-M438 HydrophobicContact CB-CB 3.94Å; H406-M438 HydrophobicContact CB-SD 4.3Å; H406-S441 PolarHBondContact NE2-OG 3.45Å
407	H	92.4	Very high	91.3	Very high	118 Å²	118	56.1 Å²	56.1	55%	0.546	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.4	22.9	178.8	-55.7	-64.2	0	0	0	115.6	A403 H404 E405 R428	A403-H407 CarbonylContact O-C 3.56Å; A403-H407 PolarHBondContact O-N 3.41Å; A403-H407 VanDerWaalsContact O-N 3.13Å; H404-H407 PolarHBondContact O-N 3.33Å; E405-H407 PolarHBondContact O-N 2.96Å; H407-R428 VanDerWaalsContact CB-NH1 3.32Å; H407-R428 VanDerWaalsContact CB-NH2 3.34Å; H407-R428 PolarHBondContact O-NH1 3.49Å; H407-R428 PolarHBondContact O-NH2 3.5Å
408	C	93.7	Very high	91.7	Very high	8 Å²	8	54.5 Å²	54.5	5%	0.054	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-84.5	132.3	175.9	-64.6	0	0	0	0	110.6	A403 H406 C420	A403-C408 CarbonylContact C-O 3.58Å; A403-C408 HydrophobicContact CB-CB 4.3Å; A403-C408 WeakPolarHBondContact CB-O 3.31Å; A403-C408 WeakPolarHBondContact O-CA 3.46Å; A403-C408 PolarHBondContact O-N 2.74Å; H406-C408 PolarHBondContact O-N 2.96Å; H406-C408 PolarHBondContact O-SG 2.97Å; H406-C408 VanDerWaalsContact O-SG 3.39Å; C408-C420 HydrophobicContact CB-CB 4.29Å
409	L	92.4	Very high	91.9	Very high	41 Å²	41	51.9 Å²	51.9	22%	0.215	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	117.2	173.6	-177.4	66.1	0	0	0	109.6	P332 I411 C420 V421 L424 F480	P332-L409 HydrophobicContact CG-CD2 4.49Å; L409-I411 HydrophobicContact CD2-CD1 4.15Å; L409-I411 HydrophobicContact CG-CD1 4.21Å; L409-I411 PolarHBondContact O-N 3.33Å; L409-C420 CarbonylContact O-C 3.54Å; L409-C420 VanDerWaalsContact O-CA 3.26Å; L409-C420 WeakPolarHBondContact O-CA 3.34Å; L409-C420 WeakPolarHBondContact O-CB 3.47Å; L409-V421 PolarHBondContact N-O 3.44Å; L409-V421 PolarHBondContact O-N 2.93Å; L409-L424 HydrophobicContact CD2-CB 4.27Å; L409-F480 HydrophobicContact CD2-CE1 3.92Å; L409-F480 HydrophobicContact CD2-CZ 4.41Å
410	R	92.7	Very high	92	Very high	100 Å²	100	51.9 Å²	51.9	38%	0.377	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	126.2	169.4	-176.3	-167	72.4	-172	-1.2	110.1	D400 Y418	D400-R410 WeakPolarHBondContact OD1-CD 3.2Å; D400-R410 IonicContact OD1-CZ 2.66Å; D400-R410 IonicContact OD1-NE 3.26Å; D400-R410 IonicContact OD1-NH1 3.47Å; D400-R410 PolarHBondContact OD1-NH1 3.26Å; D400-R410 VanDerWaalsContact OD1-NH1 3.09Å; D400-R410 IonicContact OD2-CZ 2.84Å; D400-R410 IonicContact OD2-NH1 3.88Å; D400-R410 PolarHBondContact OD2-NH1 2.96Å; R410-Y418 HydrophobicContact CG-CE1 4.3Å; R410-Y418 HydrophobicContact CG-CE2 4.05Å
411	I	92.2	Very high	92.2	Very high	16 Å²	16	49.4 Å²	49.4	8%	0.082	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	-59.3	176.2	-53	-54	0	0	0	110.1	L409 Y419 V421 F480 D481 V482	L409-I411 HydrophobicContact CD2-CD1 4.15Å; L409-I411 HydrophobicContact CG-CD1 4.21Å; L409-I411 PolarHBondContact O-N 3.33Å; I411-Y419 HydrophobicContact CB-CD1 3.69Å; I411-Y419 HydrophobicContact CB-CE1 3.73Å; I411-Y419 HydrophobicContact CG1-CD1 4.12Å; I411-Y419 HydrophobicContact CG1-CE1 3.76Å; I411-Y419 HydrophobicContact CG2-CD1 4.09Å; I411-Y419 HydrophobicContact CG2-CE1 3.91Å; I411-Y419 PolarHBondContact N-O 3.44Å; I411-V421 HydrophobicContact CD1-CB 4.42Å; I411-V421 HydrophobicContact CD1-CG2 4.19Å; I411-V421 HydrophobicContact CG1-CB 4.39Å; I411-V421 HydrophobicContact CG1-CG2 3.75Å; I411-F480 HydrophobicContact CD1-CD1 4.41Å; I411-F480 HydrophobicContact CD1-CE1 3.81Å; I411-D481 WeakPolarHBondContact CG2-OD1 3.36Å; I411-V482 HydrophobicContact CD1-CG2 3.58Å; I411-V482 HydrophobicContact CG1-CG2 3.87Å; I411-V482 HydrophobicContact CG2-CG2 4.03Å
412	K	90.6	Very high	92.4	Very high	59 Å²	59	43.4 Å²	43.4	26%	0.257	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.2	154.3	-173.5	-166.5	173.1	179.4	169.5	0	111.8	L414 Y419 Q479	K412-L414 HydrophobicContact CD-CD2 3.65Å; K412-L414 HydrophobicContact CD-CG 4.32Å; K412-L414 HydrophobicContact CG-CD2 4.12Å; K412-L414 HydrophobicContact CG-CG 4.36Å; K412-Y419 PolarHBondContact N-O 3.46Å; K412-Y419 PolarHBondContact O-N 2.99Å; K412-Q479 VanDerWaalsContact CD-NE2 3.25Å
413	I	90.9	Very high	92.3	Very high	61 Å²	61	42.5 Å²	42.5	31%	0.313	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	123.4	165.7	-59.9	169.5	0	0	0	107.2	F396 G415 C417 Y418	F396-I413 HydrophobicContact CB-CD1 4.02Å; F396-I413 HydrophobicContact CD2-CD1 3.85Å; F396-I413 HydrophobicContact CD2-CG2 3.88Å; F396-I413 HydrophobicContact CE2-CG2 3.44Å; F396-I413 VanDerWaalsContact CE2-CG2 3.44Å; F396-I413 HydrophobicContact CG-CD1 4.01Å; F396-I413 HydrophobicContact CZ-CG2 3.88Å; I413-G415 WeakPolarHBondContact CG2-O 3.4Å; I413-C417 CarbonylContact C-O 3.47Å; I413-C417 WeakPolarHBondContact CA-O 2.91Å; I413-Y418 HydrophobicContact CD1-CD2 4.49Å; I413-Y418 HydrophobicContact CG1-CD2 4.08Å; I413-Y418 HydrophobicContact CG1-CE2 4.43Å
414	L	88.8	Confident	92	Very high	83 Å²	83	42.6 Å²	42.6	44%	0.435	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	82.8	-177.6	-67.9	173	0	0	0	108.9	F370 K412 D416 C417	F370-L414 HydrophobicContact CE1-CD1 4.37Å; K412-L414 HydrophobicContact CD-CD2 3.65Å; K412-L414 HydrophobicContact CD-CG 4.32Å; K412-L414 HydrophobicContact CG-CD2 4.12Å; K412-L414 HydrophobicContact CG-CG 4.36Å; L414-D416 PolarHBondContact O-N 3.43Å; L414-D416 VanDerWaalsContact O-N 3.16Å; L414-C417 HydrophobicContact CB-CB 4.22Å; L414-C417 PolarHBondContact N-O 3.3Å; L414-C417 WeakPolarHBondContact O-CB 3.35Å; L414-C417 PolarHBondContact O-N 2.85Å
415	G	86.9	Confident	91.6	Very high	54 Å²	54	37.5 Å²	37.5	56%	0.557	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.8	-111.8	-173.3	0	0	0	0	0	110.9	I413	I413-G415 WeakPolarHBondContact CG2-O 3.4Å
416	D	88.8	Confident	91.4	Very high	33 Å²	33	38.9 Å²	38.9	18%	0.176	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-6.9	175.4	52.5	-35.8	0	0	0	114.1	V373 F376 L414	V373-D416 HydrophobicContact CB-CB 4.17Å; V373-D416 HydrophobicContact CG2-CB 4.42Å; F376-D416 HydrophobicContact CB-CB 3.95Å; F376-D416 WeakPolarHBondContact CB-OD2 3.34Å; F376-D416 HydrophobicContact CD1-CB 3.79Å; F376-D416 WeakPolarHBondContact CD1-OD2 3.5Å; F376-D416 HydrophobicContact CD2-CB 3.64Å; F376-D416 HydrophobicContact CE1-CB 4.18Å; F376-D416 HydrophobicContact CE2-CB 4.04Å; F376-D416 HydrophobicContact CG-CB 3.51Å; F376-D416 VanDerWaalsContact CG-OD2 3.23Å; F376-D416 WeakPolarHBondContact CG-OD2 3.24Å; F376-D416 HydrophobicContact CZ-CB 4.29Å; L414-D416 PolarHBondContact O-N 3.43Å; L414-D416 VanDerWaalsContact O-N 3.16Å
417	C	92.6	Very high	91.2	Very high	12 Å²	12	41.9 Å²	41.9	8%	0.081	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	130	178.7	-173.1	0	0	0	0	112.2	A371 D372 I413 L414	A371-C417 CarbonylContact O-C 3.52Å; A371-C417 WeakPolarHBondContact O-CA 3.31Å; D372-C417 HydrophobicContact CB-CB 4.3Å; D372-C417 PolarHBondContact OD1-N 3.28Å; I413-C417 CarbonylContact C-O 3.47Å; I413-C417 WeakPolarHBondContact CA-O 2.91Å; L414-C417 HydrophobicContact CB-CB 4.22Å; L414-C417 PolarHBondContact N-O 3.3Å; L414-C417 WeakPolarHBondContact O-CB 3.35Å; L414-C417 PolarHBondContact O-N 2.85Å
418	Y	95.1	Very high	91.2	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	124.8	172.9	-168.6	-85.1	0	0	0	110.1	A371 F396 F399 D400 R410 I413 C420 M438 M442	A371-Y418 PolarHBondContact N-O 3.49Å; A371-Y418 PolarHBondContact O-N 2.87Å; F396-Y418 HydrophobicContact CB-CD2 4.44Å; F396-Y418 AromaticContact CD1-CD2 3.65Å; F396-Y418 HydrophobicContact CD1-CD2 3.65Å; F396-Y418 HydrophobicContact CD1-CG 4.38Å; F396-Y418 HydrophobicContact CE1-CD2 4.19Å; F396-Y418 HydrophobicContact CG-CD2 4.23Å; F399-Y418 HydrophobicContact CB-CD2 4.15Å; F399-Y418 HydrophobicContact CB-CE1 4.23Å; F399-Y418 HydrophobicContact CB-CE2 3.79Å; F399-Y418 HydrophobicContact CD2-CD1 4.49Å; F399-Y418 HydrophobicContact CD2-CD2 4.07Å; F399-Y418 HydrophobicContact CD2-CG 4.02Å; D400-Y418 WeakPolarHBondContact OD1-CE2 3.45Å; D400-Y418 PolarHBondContact OD1-OH 3.18Å; R410-Y418 HydrophobicContact CG-CE1 4.3Å; R410-Y418 HydrophobicContact CG-CE2 4.05Å; I413-Y418 HydrophobicContact CD1-CD2 4.49Å; I413-Y418 HydrophobicContact CG1-CD2 4.08Å; I413-Y418 HydrophobicContact CG1-CE2 4.43Å; Y418-C420 HydrophobicContact CE1-CB 4.08Å; Y418-M438 HydrophobicContact CE1-CE 4.49Å; Y418-M442 HydrophobicContact CD1-CE 3.46Å; Y418-M442 VanDerWaalsContact CD1-CE 3.46Å; Y418-M442 HydrophobicContact CE1-CE 3.73Å; Y418-M442 HydrophobicContact CG-CE 4.39Å
419	Y	94.4	Very high	91	Very high	4 Å²	4	44 Å²	44	2%	0.016	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	123.8	-177.1	170.7	-125.3	0	0	0	112	I368 L369 F370 I411 K412 V421 V487	I368-Y419 HydrophobicContact CB-CE2 4.39Å; I368-Y419 HydrophobicContact CG2-CD2 4.35Å; I368-Y419 HydrophobicContact CG2-CE2 3.32Å; L369-Y419 WeakPolarHBondContact O-CA 3.41Å; L369-Y419 VanDerWaalsContact O-CD2 3.26Å; L369-Y419 WeakPolarHBondContact O-CD2 2.92Å; F370-Y419 AromaticContact CD1-CD2 3.97Å; F370-Y419 HydrophobicContact CD1-CD2 3.97Å; F370-Y419 HydrophobicContact CD1-CG 4.07Å; F370-Y419 AromaticContact CD2-CD2 3.52Å; F370-Y419 HydrophobicContact CD2-CD2 3.52Å; F370-Y419 AromaticContact CD2-CE2 3.87Å; F370-Y419 HydrophobicContact CD2-CE2 3.87Å; F370-Y419 HydrophobicContact CD2-CG 4.36Å; F370-Y419 HydrophobicContact CE1-CD1 4.22Å; F370-Y419 AromaticContact CE1-CD2 3.76Å; F370-Y419 HydrophobicContact CE1-CD2 3.76Å; F370-Y419 AromaticContact CE1-CG 3.61Å; F370-Y419 HydrophobicContact CE1-CG 3.61Å; F370-Y419 AromaticContact CE2-CD2 3.29Å; F370-Y419 HydrophobicContact CE2-CD2 3.29Å; F370-Y419 AromaticContact CE2-CE2 3.39Å; F370-Y419 HydrophobicContact CE2-CE2 3.39Å; F370-Y419 AromaticContact CE2-CG 3.95Å; F370-Y419 HydrophobicContact CE2-CG 3.95Å; F370-Y419 AromaticContact CE2-CZ 3.98Å; F370-Y419 AromaticContact CG-CD2 3.86Å; F370-Y419 HydrophobicContact CG-CD2 3.86Å; F370-Y419 HydrophobicContact CG-CG 4.42Å; F370-Y419 AromaticContact CZ-CD1 3.92Å; F370-Y419 HydrophobicContact CZ-CD1 3.92Å; F370-Y419 AromaticContact CZ-CD2 3.41Å; F370-Y419 HydrophobicContact CZ-CD2 3.41Å; F370-Y419 VanDerWaalsContact CZ-CD2 3.41Å; F370-Y419 HydrophobicContact CZ-CE1 4.14Å; F370-Y419 AromaticContact CZ-CE2 3.77Å; F370-Y419 HydrophobicContact CZ-CE2 3.77Å; F370-Y419 AromaticContact CZ-CG 3.55Å; F370-Y419 HydrophobicContact CZ-CG 3.55Å; I411-Y419 HydrophobicContact CB-CD1 3.69Å; I411-Y419 HydrophobicContact CB-CE1 3.73Å; I411-Y419 HydrophobicContact CG1-CD1 4.12Å; I411-Y419 HydrophobicContact CG1-CE1 3.76Å; I411-Y419 HydrophobicContact CG2-CD1 4.09Å; I411-Y419 HydrophobicContact CG2-CE1 3.91Å; I411-Y419 PolarHBondContact N-O 3.44Å; K412-Y419 PolarHBondContact N-O 3.46Å; K412-Y419 PolarHBondContact O-N 2.99Å; Y419-V421 HydrophobicContact CE1-CG2 4.39Å; Y419-V421 HydrophobicContact CE2-CG2 3.83Å; Y419-V421 WeakPolarHBondContact OH-CG2 3.34Å; Y419-V487 HydrophobicContact CE1-CG1 4.45Å
420	C	95.4	Very high	91	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	159.2	178.1	65.5	0	0	0	0	112.9	L369 C408 L409 Y418	L369-C420 PolarHBondContact N-O 3.47Å; L369-C420 PolarHBondContact O-N 3Å; C408-C420 HydrophobicContact CB-CB 4.29Å; L409-C420 CarbonylContact O-C 3.54Å; L409-C420 VanDerWaalsContact O-CA 3.26Å; L409-C420 WeakPolarHBondContact O-CA 3.34Å; L409-C420 WeakPolarHBondContact O-CB 3.47Å; Y418-C420 HydrophobicContact CE1-CB 4.08Å
421	V	96.1	Very high	91.1	Very high	0 Å²	0	41 Å²	41	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	137.2	-177.9	-178	0	0	0	0	110.4	V366 S367 I368 L409 I411 Y419 L424	V366-V421 HydrophobicContact CB-CG1 3.98Å; V366-V421 HydrophobicContact CG2-CG1 4.3Å; S367-V421 CarbonylContact O-C 3.57Å; S367-V421 VanDerWaalsContact O-CA 3.27Å; S367-V421 WeakPolarHBondContact O-CA 3.31Å; S367-V421 WeakPolarHBondContact O-CG1 3.49Å; I368-V421 HydrophobicContact CG1-CG2 4.41Å; L409-V421 PolarHBondContact N-O 3.44Å; L409-V421 PolarHBondContact O-N 2.93Å; I411-V421 HydrophobicContact CD1-CB 4.42Å; I411-V421 HydrophobicContact CD1-CG2 4.19Å; I411-V421 HydrophobicContact CG1-CB 4.39Å; I411-V421 HydrophobicContact CG1-CG2 3.75Å; Y419-V421 HydrophobicContact CE1-CG2 4.39Å; Y419-V421 HydrophobicContact CE2-CG2 3.83Å; Y419-V421 WeakPolarHBondContact OH-CG2 3.34Å; V421-L424 HydrophobicContact CB-CD1 4.09Å; V421-L424 HydrophobicContact CG1-CB 4.46Å; V421-L424 HydrophobicContact CG1-CD1 3.62Å; V421-L424 HydrophobicContact CG1-CG 3.93Å
422	S	95.9	Very high	91.3	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	146.9	171.1	-176.9	0	0	0	0	110.3	V366 S367 R428 H431 C434 C435	V366-S422 WeakPolarHBondContact CA-O 3.43Å; V366-S422 WeakPolarHBondContact CB-O 3.41Å; S367-S422 PolarHBondContact N-O 2.84Å; S367-S422 PolarHBondContact O-N 2.87Å; S422-R428 PolarHBondContact OG-NH2 2.91Å; S422-H431 VanDerWaalsContact CB-O 3.25Å; S422-H431 WeakPolarHBondContact CB-O 3.25Å; S422-H431 WeakPolarHBondContact OG-CA 3.39Å; S422-H431 PolarHBondContact OG-O 3.43Å; S422-C434 WeakPolarHBondContact OG-CB 3.38Å; S422-C435 WeakPolarHBondContact CB-SG 2.99Å
423	G	90.7	Very high	91.4	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.01	23%	0.228	C	C	.	.	S	Bend	trans	88.5	12.9	-170.8	0	0	0	0	0	114.2	E426	G423-E426 CarbonylContact C-O 3.51Å
424	L	88.4	Confident	91.6	Very high	4 Å²	4	36.9 Å²	36.9	2%	0.021	22%	0.217	C	C	.	.			trans	-128.5	142.2	172.8	-71.5	-179.3	0	0	0	111	Y363 V366 L409 V421 E426 V468 C470 V482	Y363-L424 HydrophobicContact CD1-CD2 3.62Å; Y363-L424 HydrophobicContact CD2-CD2 3.16Å; Y363-L424 HydrophobicContact CE1-CD2 4.07Å; Y363-L424 HydrophobicContact CE2-CD2 3.63Å; Y363-L424 HydrophobicContact CG-CD2 3.14Å; V366-L424 HydrophobicContact CG1-CD2 4.31Å; V366-L424 HydrophobicContact CG1-CG 4.16Å; L409-L424 HydrophobicContact CD2-CB 4.27Å; V421-L424 HydrophobicContact CB-CD1 4.09Å; V421-L424 HydrophobicContact CG1-CB 4.46Å; V421-L424 HydrophobicContact CG1-CD1 3.62Å; V421-L424 HydrophobicContact CG1-CG 3.93Å; L424-E426 VanDerWaalsContact C-N 3.31Å; L424-V468 HydrophobicContact CD1-CG2 3.99Å; L424-V468 HydrophobicContact CD2-CG2 4.42Å; L424-C470 HydrophobicContact CD1-CB 4.35Å; L424-V482 HydrophobicContact CD1-CG2 4.24Å
425	P	80.4	Confident	91.9	Very high	45 Å²	45	32.9 Å²	32.9	29%	0.292	20%	0.196	S	C	.	.	S	Bend	cis	-75.8	-15.6	-13.3	32	-34.7	0	0	0	113.2	F334 Y363 P427	F334-P425 HydrophobicContact CD1-CB 3.44Å; F334-P425 VanDerWaalsContact CD1-CB 3.44Å; F334-P425 HydrophobicContact CD1-CG 3.69Å; F334-P425 HydrophobicContact CD2-CB 4.36Å; F334-P425 HydrophobicContact CE1-CB 3.57Å; F334-P425 HydrophobicContact CE1-CG 4.07Å; F334-P425 HydrophobicContact CE2-CB 4.46Å; F334-P425 HydrophobicContact CG-CB 3.86Å; F334-P425 HydrophobicContact CG-CG 4.35Å; F334-P425 HydrophobicContact CZ-CB 4.09Å; Y363-P425 WeakPolarHBondContact CE1-O 3.28Å; Y363-P425 PolarHBondContact OH-O 2.78Å; P425-P427 WeakPolarHBondContact O-CD 3.47Å
426	E	87.3	Confident	92.2	Very high	139 Å²	139	30.4 Å²	30.4	65%	0.65	17%	0.17	S	C	*	.	S	Bend	trans	-89.6	118.4	179.2	-69.2	177.3	-173.2	0	0	109.2	G423 L424 R428	G423-E426 CarbonylContact C-O 3.51Å; L424-E426 VanDerWaalsContact C-N 3.31Å; E426-R428 PolarHBondContact O-N 3.15Å
427	P	89.9	Confident	92.5	Very high	102 Å²	102	32.1 Å²	32.1	66%	0.662	18%	0.177	S	C	*	.			trans	-60.4	132.9	175.8	-19.9	31.5	0	0	0	109.7	Y363 P425	Y363-P427 HydrophobicContact CD1-CG 4.41Å; Y363-P427 HydrophobicContact CE1-CG 4.47Å; P425-P427 WeakPolarHBondContact O-CD 3.47Å
428	R	91	Very high	92.5	Very high	45 Å²	45	31.5 Å²	31.5	17%	0.17	17%	0.173	C	C	.	.			trans	-131.2	137.7	-178.9	-77.7	-157.7	-58.5	-86.2	-7.3	111	H407 S422 E426 D430 H431	H407-R428 VanDerWaalsContact CB-NH1 3.32Å; H407-R428 VanDerWaalsContact CB-NH2 3.34Å; H407-R428 PolarHBondContact O-NH1 3.49Å; H407-R428 PolarHBondContact O-NH2 3.5Å; S422-R428 PolarHBondContact OG-NH2 2.91Å; E426-R428 PolarHBondContact O-N 3.15Å; R428-D430 VanDerWaalsContact C-N 3.34Å; R428-D430 WeakPolarHBondContact CB-OD1 3.48Å; R428-D430 IonicContact NE-OD1 2.82Å; R428-H431 WeakPolarHBondContact O-CB 3.41Å; R428-H431 PolarHBondContact O-CD2 3.29Å
429	P	90.4	Very high	92.4	Very high	125 Å²	125	31.5 Å²	31.5	81%	0.812	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73	-27.2	178.8	30.1	-34.4	0	0	0	112.8	H431	P429-H431 VanDerWaalsContact C-N 3.29Å; P429-H431 PolarHBondContact O-N 3.49Å
430	D	93.1	Very high	92.3	Very high	70 Å²	70	32 Å²	32	37%	0.374	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.4	19.7	179.3	62.6	-26.9	0	0	0	112.7	R428 A432 H433 C434	R428-D430 VanDerWaalsContact C-N 3.34Å; R428-D430 WeakPolarHBondContact CB-OD1 3.48Å; R428-D430 IonicContact NE-OD1 2.82Å; D430-A432 PolarHBondContact O-N 3.14Å; D430-A432 VanDerWaalsContact O-N 3.14Å; D430-H433 HydrophobicContact CB-CB 4.46Å; D430-H433 WeakPolarHBondContact O-CB 3.42Å; D430-H433 PolarHBondContact O-N 3.09Å; D430-C434 PolarHBondContact O-N 3.04Å
431	H	94.9	Very high	92.1	Very high	9 Å²	9	32.7 Å²	32.7	4%	0.042	18%	0.181	C	C	.	.	H	α-helix	trans	-53.8	-39.1	-174.6	64.4	89.5	0	0	0	113.2	N365 S367 S422 R428 P429 C435	N365-H431 PolarHBondContact O-CD2 3.27Å; N365-H431 VanDerWaalsContact O-CG 3.29Å; N365-H431 PolarHBondContact O-NE2 3.05Å; S367-H431 PolarHBondContact N-ND1 3.1Å; S367-H431 PolarHBondContact OG-CE1 3.48Å; S367-H431 PolarHBondContact OG-ND1 3.14Å; S422-H431 VanDerWaalsContact CB-O 3.25Å; S422-H431 WeakPolarHBondContact CB-O 3.25Å; S422-H431 WeakPolarHBondContact OG-CA 3.39Å; S422-H431 PolarHBondContact OG-O 3.43Å; R428-H431 WeakPolarHBondContact O-CB 3.41Å; R428-H431 PolarHBondContact O-CD2 3.29Å; P429-H431 VanDerWaalsContact C-N 3.29Å; P429-H431 PolarHBondContact O-N 3.49Å; H431-C435 PolarHBondContact O-N 3.25Å
432	A	94.8	Very high	91.9	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-69.5	-39.8	177.6	0	0	0	0	0	112.8	S367 D430 C435 V436 C512 L513	S367-A432 WeakPolarHBondContact OG-CA 3.45Å; S367-A432 PolarHBondContact OG-N 3.1Å; D430-A432 PolarHBondContact O-N 3.14Å; D430-A432 VanDerWaalsContact O-N 3.14Å; A432-C435 PolarHBondContact O-N 3.31Å; A432-V436 WeakPolarHBondContact O-CG2 3.32Å; A432-V436 PolarHBondContact O-N 2.91Å; A432-C512 HydrophobicContact CB-CB 3.49Å; A432-C512 VanDerWaalsContact CB-CB 3.49Å; A432-L513 HydrophobicContact CB-CD2 3.82Å; A432-L513 HydrophobicContact CB-CG 4.22Å
433	H	94.4	Very high	91.6	Very high	35 Å²	35	33 Å²	33	16%	0.162	18%	0.182	C	C	.	.	H	α-helix	trans	-63	-46.3	176.7	-67.9	-94.8	0	0	0	110.7	D430 C435 V436 E437 L513 D516 Y517	D430-H433 HydrophobicContact CB-CB 4.46Å; D430-H433 WeakPolarHBondContact O-CB 3.42Å; D430-H433 PolarHBondContact O-N 3.09Å; H433-C435 VanDerWaalsContact C-N 3.32Å; H433-C435 PolarHBondContact O-N 3.02Å; H433-V436 PolarHBondContact O-N 3.27Å; H433-E437 WeakPolarHBondContact O-CB 3.3Å; H433-E437 PolarHBondContact O-N 2.98Å; H433-L513 PolarHBondContact CE1-O 3.4Å; H433-D516 IonicContact CE1-OD2 3.63Å; H433-D516 PolarHBondContact CE1-OD2 3.44Å; H433-D516 IonicContact ND1-OD2 3.62Å; H433-Y517 AromaticContact ND1-CE2 3.63Å
434	C	94.8	Very high	91.4	Very high	12 Å²	12	37.2 Å²	37.2	8%	0.081	20%	0.2	C	C	.	.	H	α-helix	trans	-53.9	-45.8	174.4	-70.4	0	0	0	0	112.7	H406 S422 D430 M438	H406-C434 WeakPolarHBondContact O-CB 3.48Å; S422-C434 WeakPolarHBondContact OG-CB 3.38Å; D430-C434 PolarHBondContact O-N 3.04Å; C434-M438 WeakPolarHBondContact O-CB 3.15Å; C434-M438 PolarHBondContact O-N 3.49Å
435	C	94.9	Very high	91.4	Very high	0 Å²	0	38 Å²	38	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-67.3	-40	178.8	-83.1	0	0	0	0	112.4	S367 L369 S422 H431 A432 H433 M438 G439 I463	S367-C435 WeakPolarHBondContact CB-SG 3.46Å; S367-C435 PolarHBondContact O-SG 3.41Å; S367-C435 VanDerWaalsContact O-SG 3.41Å; L369-C435 HydrophobicContact CD1-CB 4.5Å; L369-C435 WeakPolarHBondContact CD1-O 3.38Å; S422-C435 WeakPolarHBondContact CB-SG 2.99Å; H431-C435 PolarHBondContact O-N 3.25Å; A432-C435 PolarHBondContact O-N 3.31Å; H433-C435 VanDerWaalsContact C-N 3.32Å; H433-C435 PolarHBondContact O-N 3.02Å; C435-M438 WeakPolarHBondContact O-CB 2.94Å; C435-G439 PolarHBondContact O-N 3.49Å; C435-I463 HydrophobicContact CB-CD1 4.24Å; C435-I463 HydrophobicContact CB-CG2 4.01Å; C435-I463 WeakPolarHBondContact O-CD1 3.34Å
436	V	93.8	Very high	91.7	Very high	1 Å²	1	36 Å²	36	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-64.7	-49	176.9	171.5	0	0	0	0	110.5	A432 H433 M438 G439 L440 I463 L513 Y517 I541	A432-V436 WeakPolarHBondContact O-CG2 3.32Å; A432-V436 PolarHBondContact O-N 2.91Å; H433-V436 PolarHBondContact O-N 3.27Å; V436-M438 VanDerWaalsContact C-N 3.3Å; V436-M438 PolarHBondContact O-N 3.37Å; V436-G439 WeakPolarHBondContact O-CA 3.39Å; V436-G439 PolarHBondContact O-N 3.11Å; V436-L440 HydrophobicContact CG1-CD1 4.03Å; V436-L440 HydrophobicContact CG1-CG 4.31Å; V436-L440 WeakPolarHBondContact O-CG 2.99Å; V436-L440 PolarHBondContact O-N 2.82Å; V436-I463 HydrophobicContact CG2-CD1 4.02Å; V436-L513 HydrophobicContact CB-CD2 4.4Å; V436-L513 HydrophobicContact CG2-CD1 3.86Å; V436-L513 HydrophobicContact CG2-CD2 3.74Å; V436-L513 HydrophobicContact CG2-CG 4.45Å; V436-Y517 HydrophobicContact CG1-CD1 3.96Å; V436-Y517 HydrophobicContact CG1-CE1 3.51Å; V436-Y517 HydrophobicContact CG1-CE2 4.2Å; V436-Y517 HydrophobicContact CG1-CG 4.46Å; V436-I541 HydrophobicContact CB-CD1 4.27Å; V436-I541 HydrophobicContact CG1-CD1 3.53Å; V436-I541 HydrophobicContact CG2-CD1 3.65Å
437	E	93.5	Very high	91.5	Very high	69 Å²	69	33.6 Å²	33.6	32%	0.322	18%	0.177	S	C	.	.	H	α-helix	trans	-61.6	-37.8	177.8	-74.4	-58.6	145.4	0	0	112.8	H433 L440 S441 Y517	H433-E437 WeakPolarHBondContact O-CB 3.3Å; H433-E437 PolarHBondContact O-N 2.98Å; E437-L440 PolarHBondContact O-N 2.64Å; E437-S441 WeakPolarHBondContact O-CB 3.45Å; E437-S441 PolarHBondContact O-N 3.24Å; E437-S441 PolarHBondContact O-OG 2.99Å; E437-Y517 PolarHBondContact OE1-OH 3.37Å; E437-Y517 VanDerWaalsContact OE1-OH 3.12Å
438	M	94.3	Very high	91.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.1	-50.3	169.7	178.4	61.2	-176.5	0	0	111.2	L369 F399 L402 A403 H406 Y418 C434 C435 V436 L440 S441 M442	L369-M438 HydrophobicContact CD1-CB 4.41Å; L369-M438 HydrophobicContact CD1-CG 4.3Å; F399-M438 HydrophobicContact CB-CE 4.47Å; F399-M438 WeakPolarHBondContact O-CE 3.35Å; L402-M438 HydrophobicContact CB-CE 3.61Å; L402-M438 HydrophobicContact CB-SD 3.51Å; L402-M438 VanDerWaalsContact CB-SD 3.51Å; A403-M438 HydrophobicContact CB-CE 3.82Å; H406-M438 HydrophobicContact CB-CB 3.94Å; H406-M438 HydrophobicContact CB-SD 4.3Å; Y418-M438 HydrophobicContact CE1-CE 4.49Å; C434-M438 WeakPolarHBondContact O-CB 3.15Å; C434-M438 PolarHBondContact O-N 3.49Å; C435-M438 WeakPolarHBondContact O-CB 2.94Å; V436-M438 VanDerWaalsContact C-N 3.3Å; V436-M438 PolarHBondContact O-N 3.37Å; M438-L440 PolarHBondContact O-N 2.67Å; M438-S441 PolarHBondContact O-N 3.4Å; M438-M442 HydrophobicContact CE-CE 3.16Å; M438-M442 HydrophobicContact CE-CG 3.93Å; M438-M442 HydrophobicContact CE-SD 4.31Å; M438-M442 HydrophobicContact CG-CE 4.01Å; M438-M442 WeakPolarHBondContact O-CG 3.32Å; M438-M442 PolarHBondContact O-N 3.27Å; M438-M442 HydrophobicContact SD-CE 4.35Å
439	G	92.8	Very high	90.7	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.2	-42.7	178.2	0	0	0	0	0	112.7	C435 V436 S441 M442 L443 I461	C435-G439 PolarHBondContact O-N 3.49Å; V436-G439 WeakPolarHBondContact O-CA 3.39Å; V436-G439 PolarHBondContact O-N 3.11Å; G439-S441 VanDerWaalsContact C-N 3.3Å; G439-S441 PolarHBondContact O-N 3.2Å; G439-M442 PolarHBondContact O-N 3.04Å; G439-L443 WeakPolarHBondContact O-CG 3.23Å; G439-L443 PolarHBondContact O-N 2.91Å; G439-I461 WeakPolarHBondContact O-CD1 3.34Å
440	L	90.8	Very high	90.3	Very high	13 Å²	13	26.4 Å²	26.4	7%	0.068	12%	0.12	C	C	.	.	H	α-helix	trans	-64.2	-37.6	176.5	-61.6	171.3	0	0	0	111.1	V436 E437 M438 L443 K444 I503 Y517 Q543	V436-L440 HydrophobicContact CG1-CD1 4.03Å; V436-L440 HydrophobicContact CG1-CG 4.31Å; V436-L440 WeakPolarHBondContact O-CG 2.99Å; V436-L440 PolarHBondContact O-N 2.82Å; E437-L440 PolarHBondContact O-N 2.64Å; M438-L440 PolarHBondContact O-N 2.67Å; L440-L443 PolarHBondContact O-N 3.36Å; L440-K444 WeakPolarHBondContact O-CG 3.41Å; L440-K444 PolarHBondContact O-N 2.89Å; L440-K444 VanDerWaalsContact O-N 3.1Å; L440-I503 HydrophobicContact CD2-CD1 3.46Å; L440-I503 VanDerWaalsContact CD2-CD1 3.46Å; L440-I503 HydrophobicContact CD2-CG1 4.29Å; L440-I503 HydrophobicContact CG-CD1 3.69Å; L440-Y517 HydrophobicContact CD1-CE1 4.21Å; L440-Q543 HydrophobicContact CD2-CG 3.9Å
441	S	91.9	Very high	89.6	Confident	16 Å²	16	26.9 Å²	26.9	11%	0.112	13%	0.13	C	C	.	.	H	α-helix	trans	-70.7	-36.4	176.7	-60.6	0	0	0	0	112.8	H406 E437 M438 G439 K444 T445	H406-S441 PolarHBondContact NE2-OG 3.45Å; E437-S441 WeakPolarHBondContact O-CB 3.45Å; E437-S441 PolarHBondContact O-N 3.24Å; E437-S441 PolarHBondContact O-OG 2.99Å; M438-S441 PolarHBondContact O-N 3.4Å; G439-S441 VanDerWaalsContact C-N 3.3Å; G439-S441 PolarHBondContact O-N 3.2Å; S441-K444 PolarHBondContact O-N 3.19Å; S441-T445 WeakPolarHBondContact O-CB 3.49Å; S441-T445 PolarHBondContact O-N 2.95Å; S441-T445 PolarHBondContact O-OG1 3.04Å
442	M	92.3	Very high	88.9	Confident	0 Å²	0	32.5 Å²	32.5	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-60.6	-43.8	171.1	-72.4	-176.3	177.9	0	0	111.1	L369 A371 F399 Y418 M438 G439 K444 T445 I446 I461	L369-M442 HydrophobicContact CD2-CE 3.74Å; L369-M442 HydrophobicContact CD2-SD 3.95Å; A371-M442 HydrophobicContact CB-CE 4.41Å; A371-M442 HydrophobicContact CB-SD 3.7Å; F399-M442 HydrophobicContact CD1-CB 4.43Å; F399-M442 HydrophobicContact CD1-CG 3.92Å; F399-M442 HydrophobicContact CD2-CE 4.41Å; F399-M442 HydrophobicContact CD2-SD 4.49Å; F399-M442 HydrophobicContact CE1-CB 3.88Å; F399-M442 HydrophobicContact CE1-CG 3.85Å; F399-M442 HydrophobicContact CE2-CG 4.48Å; F399-M442 HydrophobicContact CE2-SD 4.43Å; F399-M442 HydrophobicContact CG-CE 4.47Å; F399-M442 HydrophobicContact CG-CG 4.27Å; F399-M442 HydrophobicContact CZ-CB 4.07Å; F399-M442 HydrophobicContact CZ-CG 4.14Å; Y418-M442 HydrophobicContact CD1-CE 3.46Å; Y418-M442 VanDerWaalsContact CD1-CE 3.46Å; Y418-M442 HydrophobicContact CE1-CE 3.73Å; Y418-M442 HydrophobicContact CG-CE 4.39Å; M438-M442 HydrophobicContact CE-CE 3.16Å; M438-M442 HydrophobicContact CE-CG 3.93Å; M438-M442 HydrophobicContact CE-SD 4.31Å; M438-M442 HydrophobicContact CG-CE 4.01Å; M438-M442 WeakPolarHBondContact O-CG 3.32Å; M438-M442 PolarHBondContact O-N 3.27Å; M438-M442 HydrophobicContact SD-CE 4.35Å; G439-M442 PolarHBondContact O-N 3.04Å; M442-K444 PolarHBondContact O-N 2.77Å; M442-T445 PolarHBondContact O-N 3.46Å; M442-T445 VanDerWaalsContact O-N 3.15Å; M442-I446 PolarHBondContact O-N 3.02Å; M442-I461 HydrophobicContact CB-CD1 4.12Å; M442-I461 HydrophobicContact SD-CD1 4.43Å
443	L	88.5	Confident	87.8	Confident	6 Å²	6	34 Å²	34	3%	0.031	16%	0.159	C	C	.	.	H	α-helix	trans	-63.2	-39	176.4	-69	175.1	0	0	0	112.7	G439 L440 T445 I446 R447 I461 G500 I503	G439-L443 WeakPolarHBondContact O-CG 3.23Å; G439-L443 PolarHBondContact O-N 2.91Å; L440-L443 PolarHBondContact O-N 3.36Å; L443-T445 VanDerWaalsContact C-N 3.34Å; L443-I446 VanDerWaalsContact O-CG2 3.24Å; L443-I446 WeakPolarHBondContact O-CG2 3.21Å; L443-R447 WeakPolarHBondContact O-CG 3.22Å; L443-I461 HydrophobicContact CD1-CD1 4.42Å; L443-I461 HydrophobicContact CD2-CD1 3.95Å; L443-I461 HydrophobicContact CG-CD1 3.79Å; L443-G500 VanDerWaalsContact CD2-O 3.29Å; L443-G500 WeakPolarHBondContact CD2-O 3.35Å; L443-I503 HydrophobicContact CD1-CD1 4.49Å; L443-I503 HydrophobicContact CD1-CG1 4.01Å
444	K	87.4	Confident	86.8	Confident	90 Å²	90	41.4 Å²	41.4	39%	0.391	19%	0.191	S	C	.	.	H	α-helix	trans	-64.2	-40.7	172.4	-69.9	171.6	-175.1	170.6	0	111.4	L440 S441 M442 R447 Y448	L440-K444 WeakPolarHBondContact O-CG 3.41Å; L440-K444 PolarHBondContact O-N 2.89Å; L440-K444 VanDerWaalsContact O-N 3.1Å; S441-K444 PolarHBondContact O-N 3.19Å; M442-K444 PolarHBondContact O-N 2.77Å; K444-R447 PolarHBondContact O-N 3.38Å; K444-Y448 PolarHBondContact O-N 3.45Å
445	T	88.4	Confident	85.8	Confident	19 Å²	19	44 Å²	44	12%	0.117	20%	0.202	C	C	.	.	H	α-helix	trans	-70.8	-40.6	-176.9	-61.5	0	0	0	0	112.7	R398 F399 L402 S441 M442 L443 R447 Y448 V449	R398-T445 HydrophobicContact CB-CG2 3.88Å; R398-T445 HydrophobicContact CG-CG2 4.47Å; F399-T445 HydrophobicContact CD1-CG2 4.4Å; F399-T445 HydrophobicContact CE1-CG2 4.09Å; L402-T445 WeakPolarHBondContact CD1-OG1 3.23Å; S441-T445 WeakPolarHBondContact O-CB 3.49Å; S441-T445 PolarHBondContact O-N 2.95Å; S441-T445 PolarHBondContact O-OG1 3.04Å; M442-T445 PolarHBondContact O-N 3.46Å; M442-T445 VanDerWaalsContact O-N 3.15Å; L443-T445 VanDerWaalsContact C-N 3.34Å; T445-R447 VanDerWaalsContact C-N 3.25Å; T445-R447 PolarHBondContact O-N 3.27Å; T445-Y448 WeakPolarHBondContact O-CB 3.37Å; T445-Y448 PolarHBondContact O-N 3.3Å; T445-Y448 VanDerWaalsContact O-N 3.13Å; T445-V449 HydrophobicContact CG2-CG2 4.47Å; T445-V449 WeakPolarHBondContact O-CG2 3.49Å; T445-V449 PolarHBondContact O-N 2.9Å
446	I	87.3	Confident	85	Confident	4 Å²	4	49.6 Å²	49.6	2%	0.021	23%	0.232	C	C	.	.	H	α-helix	trans	-62.6	-34	177.6	-167.5	67.6	0	0	0	111.4	L395 M442 L443 V449 R450 I457	L395-I446 HydrophobicContact CD1-CD1 3.64Å; L395-I446 HydrophobicContact CD2-CD1 3.81Å; L395-I446 HydrophobicContact CG-CD1 4.4Å; M442-I446 PolarHBondContact O-N 3.02Å; L443-I446 VanDerWaalsContact O-CG2 3.24Å; L443-I446 WeakPolarHBondContact O-CG2 3.21Å; I446-V449 PolarHBondContact O-N 3Å; I446-R450 VanDerWaalsContact O-CB 3.23Å; I446-R450 WeakPolarHBondContact O-CB 3.35Å; I446-R450 PolarHBondContact O-N 3.39Å; I446-I457 HydrophobicContact CD1-CB 4.32Å; I446-I457 HydrophobicContact CD1-CG2 3.85Å; I446-I457 HydrophobicContact CG1-CG2 4.4Å
447	R	82.8	Confident	84.4	Confident	89 Å²	89	49.6 Å²	49.6	34%	0.336	23%	0.232	S	C	.	.	H	α-helix	trans	-62.9	-44.4	173.2	-68	178	75.8	-160.5	13.3	112.3	L443 K444 T445 V449 R450 S451 W501 L548	L443-R447 WeakPolarHBondContact O-CG 3.22Å; K444-R447 PolarHBondContact O-N 3.38Å; T445-R447 VanDerWaalsContact C-N 3.25Å; T445-R447 PolarHBondContact O-N 3.27Å; R447-V449 VanDerWaalsContact C-N 3.34Å; R447-R450 PolarHBondContact O-N 2.92Å; R447-S451 PolarHBondContact O-N 2.87Å; R447-W501 VanDerWaalsContact CD-CZ2 3.48Å; R447-W501 HydrophobicContact CG-CH2 4.44Å; R447-W501 VanDerWaalsContact NE-CH2 3.33Å; R447-W501 VanDerWaalsContact NH1-CH2 3.29Å; R447-L548 PolarHBondContact NH1-O 3.46Å; R447-L548 VanDerWaalsContact NH1-O 3.12Å; R447-L548 PolarHBondContact NH2-O 3.12Å
448	Y	81.9	Confident	84.1	Confident	13 Å²	13	48 Å²	48	5%	0.051	23%	0.226	C	C	.	.	H	α-helix	trans	-60.1	-47.7	176.2	176.2	-88.7	0	0	0	110.6	R398 K444 T445 R450 S451 R452 I555	R398-Y448 VanDerWaalsContact CZ-CE1 3.48Å; K444-Y448 PolarHBondContact O-N 3.45Å; T445-Y448 WeakPolarHBondContact O-CB 3.37Å; T445-Y448 PolarHBondContact O-N 3.3Å; T445-Y448 VanDerWaalsContact O-N 3.13Å; Y448-R450 PolarHBondContact O-N 3.5Å; Y448-S451 PolarHBondContact O-N 3.42Å; Y448-S451 PolarHBondContact O-OG 3.23Å; Y448-R452 HydrophobicContact CE1-CG 4.35Å; Y448-R452 PolarHBondContact O-N 2.92Å; Y448-R452 VanDerWaalsContact OH-CZ 3.23Å; Y448-R452 PolarHBondContact OH-NE 3.22Å; Y448-R452 PolarHBondContact OH-NH1 2.98Å; Y448-R452 VanDerWaalsContact OH-NH1 3.09Å; Y448-I555 HydrophobicContact CD2-CG2 3.18Å; Y448-I555 HydrophobicContact CE2-CG2 3.26Å; Y448-I555 HydrophobicContact CG-CG2 4.1Å
449	V	81.5	Confident	83.8	Confident	1 Å²	1	48 Å²	48	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-62.3	-45.6	178.1	175.4	0	0	0	0	110.9	L395 T445 I446 R447 S451 R452 T453	L395-V449 HydrophobicContact CD1-CB 4.39Å; L395-V449 HydrophobicContact CD1-CG2 3.99Å; T445-V449 HydrophobicContact CG2-CG2 4.47Å; T445-V449 WeakPolarHBondContact O-CG2 3.49Å; T445-V449 PolarHBondContact O-N 2.9Å; I446-V449 PolarHBondContact O-N 3Å; R447-V449 VanDerWaalsContact C-N 3.34Å; V449-S451 VanDerWaalsContact C-N 3.3Å; V449-S451 PolarHBondContact O-N 3.48Å; V449-R452 PolarHBondContact O-N 3.13Å; V449-T453 HydrophobicContact CG1-CG2 3.82Å; V449-T453 WeakPolarHBondContact O-CG2 3.48Å; V449-T453 PolarHBondContact O-N 3.06Å; V449-T453 PolarHBondContact O-OG1 2.87Å
450	R	82	Confident	83.8	Confident	106 Å²	106	51.2 Å²	51.2	40%	0.4	24%	0.238	S	C	.	.	H	α-helix	trans	-54.6	-42.7	174.4	171.6	168.6	179.9	-176.3	1	112.5	I446 R447 Y448 R452 K454 H455 D456 I457	I446-R450 VanDerWaalsContact O-CB 3.23Å; I446-R450 WeakPolarHBondContact O-CB 3.35Å; I446-R450 PolarHBondContact O-N 3.39Å; R447-R450 PolarHBondContact O-N 2.92Å; Y448-R450 PolarHBondContact O-N 3.5Å; R450-R452 VanDerWaalsContact C-N 3.31Å; R450-R452 PolarHBondContact O-N 3.34Å; R450-K454 PolarHBondContact O-N 3.16Å; R450-K454 VanDerWaalsContact O-N 3.11Å; R450-H455 WeakPolarHBondContact CG-O 3.2Å; R450-D456 IonicContact CZ-OD1 2.71Å; R450-D456 IonicContact NE-OD1 2.64Å; R450-D456 PolarHBondContact NE-OD1 3.44Å; R450-D456 IonicContact NH1-OD1 2.67Å; R450-D456 PolarHBondContact NH1-OD1 3.01Å; R450-D456 IonicContact NH2-OD1 3.92Å; R450-D456 PolarHBondContact NH2-OD1 2.74Å; R450-D456 IonicContact NH2-OD2 2.78Å; R450-I457 WeakPolarHBondContact CD-O 3.45Å
451	S	78.9	Confident	84	Confident	81 Å²	81	50.7 Å²	50.7	57%	0.566	24%	0.235	S	C	*	.	H	α-helix	trans	-65.5	-33.5	177.6	78.2	0	0	0	0	113.1	R447 Y448 V449	R447-S451 PolarHBondContact O-N 2.87Å; Y448-S451 PolarHBondContact O-N 3.42Å; Y448-S451 PolarHBondContact O-OG 3.23Å; V449-S451 VanDerWaalsContact C-N 3.3Å; V449-S451 PolarHBondContact O-N 3.48Å
452	R	79.8	Confident	84.1	Confident	126 Å²	126	49.9 Å²	49.9	48%	0.475	23%	0.23	S	C	.	.	H	α-helix	trans	-83.1	-46.6	-179.5	-95.4	-165.2	148.6	169.7	2.4	113.5	Y448 V449 R450 K454	Y448-R452 HydrophobicContact CE1-CG 4.35Å; Y448-R452 PolarHBondContact O-N 2.92Å; Y448-R452 VanDerWaalsContact OH-CZ 3.23Å; Y448-R452 PolarHBondContact OH-NE 3.22Å; Y448-R452 PolarHBondContact OH-NH1 2.98Å; Y448-R452 VanDerWaalsContact OH-NH1 3.09Å; V449-R452 PolarHBondContact O-N 3.13Å; R450-R452 VanDerWaalsContact C-N 3.31Å; R450-R452 PolarHBondContact O-N 3.34Å; R452-K454 VanDerWaalsContact C-N 3.3Å
453	T	71.3	Confident	84.4	Confident	33 Å²	33	50 Å²	50	20%	0.202	23%	0.23	C	C	.	.	H	α-helix	trans	-80.8	-14.6	-174.8	62.8	0	0	0	0	112	M391 V449 H455	M391-T453 HydrophobicContact CG-CG2 4.39Å; V449-T453 HydrophobicContact CG1-CG2 3.82Å; V449-T453 WeakPolarHBondContact O-CG2 3.48Å; V449-T453 PolarHBondContact O-N 3.06Å; V449-T453 PolarHBondContact O-OG1 2.87Å; T453-H455 PolarHBondContact O-CE1 3.19Å; T453-H455 PolarHBondContact O-N 3.12Å; T453-H455 VanDerWaalsContact O-N 3.17Å; T453-H455 PolarHBondContact O-ND1 2.94Å
454	K	73.4	Confident	84.8	Confident	191 Å²	191	50.2 Å²	50.2	83%	0.83	23%	0.231	S	C	*	.			trans	59	16.4	-175.4	-57.2	-176.1	179.2	-179	0	114.3	R450 R452	R450-K454 PolarHBondContact O-N 3.16Å; R450-K454 VanDerWaalsContact O-N 3.11Å; R452-K454 VanDerWaalsContact C-N 3.3Å
455	H	74.9	Confident	85.2	Confident	65 Å²	65	46.3 Å²	46.3	30%	0.301	22%	0.215	S	C	.	.			trans	-96.4	135.6	173.7	-67	82.3	0	0	0	109.2	L379 L383 R450 T453 I457	L379-H455 HydrophobicContact CD2-CB 4.39Å; L383-H455 WeakPolarHBondContact CD2-NE2 3.47Å; R450-H455 WeakPolarHBondContact CG-O 3.2Å; T453-H455 PolarHBondContact O-CE1 3.19Å; T453-H455 PolarHBondContact O-N 3.12Å; T453-H455 VanDerWaalsContact O-N 3.17Å; T453-H455 PolarHBondContact O-ND1 2.94Å; H455-I457 VanDerWaalsContact C-N 3.32Å; H455-I457 HydrophobicContact CB-CD1 3.84Å; H455-I457 HydrophobicContact CB-CG1 3.75Å; H455-I457 PolarHBondContact O-N 2.99Å
456	D	78.4	Confident	85.5	Confident	118 Å²	118	46.2 Å²	46.2	63%	0.631	22%	0.218	S	C	*	.			trans	-76.3	84	176.7	-172.6	16.7	0	0	0	110.4	R450	R450-D456 IonicContact CZ-OD1 2.71Å; R450-D456 IonicContact NE-OD1 2.64Å; R450-D456 PolarHBondContact NE-OD1 3.44Å; R450-D456 IonicContact NH1-OD1 2.67Å; R450-D456 PolarHBondContact NH1-OD1 3.01Å; R450-D456 IonicContact NH2-OD1 3.92Å; R450-D456 PolarHBondContact NH2-OD1 2.74Å; R450-D456 IonicContact NH2-OD2 2.78Å
457	I	80.9	Confident	85.9	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.01	23%	0.227	C	C	.	.			trans	-110.8	136	-177.7	-48.9	178.2	0	0	0	109.2	V373 L379 M391 I446 R450 H455	V373-I457 HydrophobicContact CG1-CG2 3.32Å; L379-I457 HydrophobicContact CD1-CD1 4.36Å; L379-I457 HydrophobicContact CD1-CG1 3.93Å; M391-I457 HydrophobicContact CE-CD1 3.85Å; M391-I457 HydrophobicContact CG-CD1 4.23Å; M391-I457 HydrophobicContact SD-CD1 3.65Å; I446-I457 HydrophobicContact CD1-CB 4.32Å; I446-I457 HydrophobicContact CD1-CG2 3.85Å; I446-I457 HydrophobicContact CG1-CG2 4.4Å; R450-I457 WeakPolarHBondContact CD-O 3.45Å; H455-I457 VanDerWaalsContact C-N 3.32Å; H455-I457 HydrophobicContact CB-CD1 3.84Å; H455-I457 HydrophobicContact CB-CG1 3.75Å; H455-I457 PolarHBondContact O-N 2.99Å
458	D	86.1	Confident	86.5	Confident	36 Å²	36	43.4 Å²	43.4	19%	0.193	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	169.2	176.4	-158.1	-2.3	0	0	0	109.8	K374 G500	K374-D458 HydrophobicContact CB-CB 4.24Å; K374-D458 WeakPolarHBondContact CB-O 3.43Å; K374-D458 HydrophobicContact CD-CB 4.23Å; K374-D458 PolarHBondContact N-O 3.41Å; D458-G500 WeakPolarHBondContact OD1-CA 3.14Å; D458-G500 PolarHBondContact OD1-N 3.34Å; D458-G500 WeakPolarHBondContact OD2-CA 3.49Å; D458-G500 PolarHBondContact OD2-N 2.92Å
459	M	88.6	Confident	87.1	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	147.1	-172.6	-170.8	158.4	-81.3	0	0	112	A371 D372 V373 L395 F399 I461 P499 G500	A371-M459 HydrophobicContact CB-CG 4.27Å; A371-M459 HydrophobicContact CB-SD 3.84Å; D372-M459 CarbonylContact O-C 3.39Å; D372-M459 WeakPolarHBondContact O-CA 3.45Å; D372-M459 WeakPolarHBondContact O-CG 3.5Å; V373-M459 HydrophobicContact CG2-CE 3.76Å; L395-M459 HydrophobicContact CD2-CE 4.25Å; F399-M459 HydrophobicContact CE2-CE 3.57Å; F399-M459 HydrophobicContact CE2-SD 3.92Å; F399-M459 HydrophobicContact CZ-CE 3.68Å; F399-M459 HydrophobicContact CZ-SD 3.76Å; M459-I461 HydrophobicContact CG-CD1 4.46Å; M459-I461 HydrophobicContact CG-CG1 3.95Å; M459-I461 HydrophobicContact SD-CG1 4.46Å; M459-P499 WeakPolarHBondContact O-CA 3.5Å; M459-G500 PolarHBondContact O-N 3.37Å
460	R	92.6	Very high	87.6	Confident	66 Å²	66	46.1 Å²	46.1	25%	0.249	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	133.5	167.2	-76.3	-179.6	-89.5	-140.8	-0.8	108.6	A371 D372 E494 G497 P499	A371-R460 CarbonylContact C-O 3.58Å; A371-R460 VanDerWaalsContact CA-O 3.25Å; A371-R460 WeakPolarHBondContact CA-O 3.33Å; D372-R460 PolarHBondContact N-O 3.36Å; D372-R460 PolarHBondContact O-N 3.14Å; R460-E494 HydrophobicContact CB-CG 4.36Å; R460-E494 WeakPolarHBondContact CB-OE1 3.39Å; R460-E494 IonicContact NE-OE1 3.28Å; R460-G497 VanDerWaalsContact CD-O 3.29Å; R460-G497 WeakPolarHBondContact CD-O 3.35Å; R460-P499 HydrophobicContact CG-CB 3.95Å
461	I	94.8	Very high	87.9	Confident	2 Å²	2	41.1 Å²	41.1	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	124.3	-179.8	-53.8	-177.5	0	0	0	109.1	L369 F370 A371 G439 M442 L443 M459 I463 I503 H504	L369-I461 HydrophobicContact CD1-CG2 4.04Å; L369-I461 HydrophobicContact CD2-CG2 4.16Å; L369-I461 HydrophobicContact CG-CG2 3.89Å; F370-I461 CarbonylContact O-C 3.51Å; F370-I461 WeakPolarHBondContact O-CA 3.35Å; A371-I461 HydrophobicContact CB-CG1 4.09Å; G439-I461 WeakPolarHBondContact O-CD1 3.34Å; M442-I461 HydrophobicContact CB-CD1 4.12Å; M442-I461 HydrophobicContact SD-CD1 4.43Å; L443-I461 HydrophobicContact CD1-CD1 4.42Å; L443-I461 HydrophobicContact CD2-CD1 3.95Å; L443-I461 HydrophobicContact CG-CD1 3.79Å; M459-I461 HydrophobicContact CG-CD1 4.46Å; M459-I461 HydrophobicContact CG-CG1 3.95Å; M459-I461 HydrophobicContact SD-CG1 4.46Å; I461-I463 HydrophobicContact CG2-CG1 4.22Å; I461-I503 HydrophobicContact CB-CG2 4.47Å; I461-I503 HydrophobicContact CG2-CG2 4.09Å; I461-H504 PolarHBondContact O-N 3.35Å
462	G	95.4	Very high	88.4	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	129.4	175.3	0	0	0	0	0	111.4	L369 F370 H504	L369-G462 WeakPolarHBondContact CA-O 3.27Å; F370-G462 PolarHBondContact N-O 3.05Å; F370-G462 PolarHBondContact O-N 3.06Å; G462-H504 CarbonylContact C-O 3.57Å; G462-H504 VanDerWaalsContact CA-O 3.3Å; G462-H504 WeakPolarHBondContact CA-O 3.43Å
463	I	96.8	Very high	88.5	Confident	1 Å²	1	35.7 Å²	35.7	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	132	179.2	-51.3	178.9	0	0	0	110.9	I368 L369 C435 V436 I461 L493 I503 H504 I505 S506	I368-I463 VanDerWaalsContact O-CA 3.3Å; I368-I463 WeakPolarHBondContact O-CA 3.48Å; L369-I463 HydrophobicContact CB-CG1 4.26Å; L369-I463 HydrophobicContact CD1-CD1 3.88Å; L369-I463 HydrophobicContact CD1-CG1 4.05Å; L369-I463 HydrophobicContact CG-CD1 4.42Å; L369-I463 HydrophobicContact CG-CG1 4.03Å; C435-I463 HydrophobicContact CB-CD1 4.24Å; C435-I463 HydrophobicContact CB-CG2 4.01Å; C435-I463 WeakPolarHBondContact O-CD1 3.34Å; V436-I463 HydrophobicContact CG2-CD1 4.02Å; I461-I463 HydrophobicContact CG2-CG1 4.22Å; I463-L493 WeakPolarHBondContact O-CD1 3.22Å; I463-I503 HydrophobicContact CD1-CG2 3.45Å; I463-I503 VanDerWaalsContact CD1-CG2 3.45Å; I463-I503 HydrophobicContact CG1-CG2 3.81Å; I463-H504 PolarHBondContact N-O 2.97Å; I463-I505 HydrophobicContact CB-CG2 4.11Å; I463-I505 WeakPolarHBondContact O-CA 3.39Å; I463-S506 PolarHBondContact O-N 2.94Å
464	H	96.8	Very high	88.7	Confident	11 Å²	11	36.3 Å²	36.3	5%	0.051	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	148.7	173.9	-175.3	55.8	0	0	0	110.5	S367 I368 D486 I489 A490 L493 S506	S367-H464 CarbonylContact C-O 3.57Å; S367-H464 WeakPolarHBondContact CA-O 3.35Å; I368-H464 PolarHBondContact N-O 3.43Å; I368-H464 PolarHBondContact O-N 3.32Å; H464-D486 PolarHBondContact CD2-O 2.9Å; H464-D486 IonicContact NE2-OD1 3.74Å; H464-D486 PolarHBondContact NE2-OD1 3.44Å; H464-I489 HydrophobicContact CB-CG2 4.38Å; H464-A490 HydrophobicContact CB-CB 3.77Å; H464-L493 HydrophobicContact CB-CD1 3.96Å; H464-S506 VanDerWaalsContact ND1-CB 3.29Å; H464-S506 WeakPolarHBondContact ND1-CB 3.48Å; H464-S506 PolarHBondContact ND1-OG 2.92Å
465	S	96.6	Very high	88.4	Confident	8 Å²	8	33 Å²	33	6%	0.056	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	134.8	173.4	-65.1	0	0	0	0	110.1	V366 S367 A508 A509	V366-S465 CarbonylContact O-C 3.59Å; V366-S465 VanDerWaalsContact O-CA 3.27Å; V366-S465 WeakPolarHBondContact O-CA 3.47Å; S367-S465 PolarHBondContact OG-OG 3.25Å; S465-A508 WeakPolarHBondContact O-CB 3.31Å; S465-A509 WeakPolarHBondContact OG-CA 3.28Å
466	G	94.9	Very high	88.1	Confident	18 Å²	18	41.6 Å²	41.6	19%	0.186	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-174.3	-148.4	-176.4	0	0	0	0	0	113.1	N365 V366	N365-G466 PolarHBondContact N-O 3.42Å; N365-G466 VanDerWaalsContact N-O 3.15Å; V366-G466 WeakPolarHBondContact CG2-O 3.3Å; V366-G466 PolarHBondContact N-O 3.45Å; V366-G466 PolarHBondContact O-N 2.92Å
467	S	95.1	Very high	88	Confident	30 Å²	30	45 Å²	45	21%	0.21	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	148.6	179.9	65.5	0	0	0	0	111.1	Y363 S484 D486	Y363-S467 CarbonylContact O-C 3.57Å; Y363-S467 WeakPolarHBondContact O-CA 3.37Å; S467-S484 WeakPolarHBondContact O-CB 3.26Å; S467-S484 PolarHBondContact O-OG 3.22Å; S467-D486 PolarHBondContact N-OD2 2.88Å; S467-D486 PolarHBondContact OG-OD2 3.45Å
468	V	95.6	Very high	88	Confident	3 Å²	3	50.2 Å²	50.2	2%	0.018	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	148.8	-179.3	-62	0	0	0	0	113.8	R362 Y363 V366 I368 L424 V482 V487	R362-V468 WeakPolarHBondContact CA-O 3.45Å; Y363-V468 PolarHBondContact N-O 3.06Å; Y363-V468 PolarHBondContact O-N 2.84Å; V366-V468 HydrophobicContact CB-CG2 4.42Å; V366-V468 HydrophobicContact CG1-CG2 4.18Å; V366-V468 HydrophobicContact CG2-CB 4.1Å; V366-V468 HydrophobicContact CG2-CG1 3.57Å; V366-V468 HydrophobicContact CG2-CG2 3.58Å; I368-V468 HydrophobicContact CD1-CG1 3.64Å; I368-V468 HydrophobicContact CG1-CG1 4.24Å; L424-V468 HydrophobicContact CD1-CG2 3.99Å; L424-V468 HydrophobicContact CD2-CG2 4.42Å; V468-V482 HydrophobicContact CB-CG1 3.37Å; V468-V482 HydrophobicContact CG1-CG1 3.62Å; V468-V482 HydrophobicContact CG2-CG1 3.76Å; V468-V487 HydrophobicContact CG1-CG2 4.05Å
469	L	94.1	Very high	87.9	Confident	72 Å²	72	52.3 Å²	52.3	38%	0.377	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	120.2	164	-73.4	149.5	0	0	0	107.6	I360 H361 R362 V482 W483	I360-L469 HydrophobicContact CG2-CB 4.46Å; I360-L469 HydrophobicContact CG2-CD2 3.89Å; H361-L469 CarbonylContact O-C 3.59Å; H361-L469 WeakPolarHBondContact O-CA 3.38Å; R362-L469 HydrophobicContact CB-CD2 3.87Å; R362-L469 HydrophobicContact CG-CD2 4.35Å; L469-V482 CarbonylContact O-C 3.58Å; L469-V482 WeakPolarHBondContact O-CA 3.48Å; L469-W483 PolarHBondContact N-O 2.81Å; L469-W483 PolarHBondContact O-N 2.91Å
470	C	92	Very high	87.9	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	149.9	174.1	72.5	0	0	0	0	110.6	I360 H361 Y363 L424 F480 D481 V482	I360-C470 CarbonylContact C-O 3.51Å; I360-C470 WeakPolarHBondContact CA-O 2.84Å; H361-C470 PolarHBondContact N-O 3.2Å; H361-C470 PolarHBondContact O-N 3.46Å; Y363-C470 VanDerWaalsContact CE2-SG 3.51Å; L424-C470 HydrophobicContact CD1-CB 4.35Å; C470-F480 HydrophobicContact CB-CE2 3.95Å; C470-F480 HydrophobicContact CB-CZ 3.69Å; C470-D481 WeakPolarHBondContact CA-O 3.47Å; C470-V482 HydrophobicContact CB-CG2 3.91Å
471	G	89.9	Confident	87.9	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.9	178.7	-178.4	0	0	0	0	0	113.7	Y359 F480 D481	Y359-G471 CarbonylContact O-C 3.52Å; Y359-G471 WeakPolarHBondContact O-CA 3.28Å; G471-F480 WeakPolarHBondContact O-CA 3.46Å; G471-F480 WeakPolarHBondContact O-CD2 2.89Å; G471-D481 PolarHBondContact N-O 3.23Å; G471-D481 PolarHBondContact O-N 2.83Å
472	V	87.6	Confident	87.8	Confident	10 Å²	10	51.5 Å²	51.5	6%	0.061	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	126.1	178.9	179.8	0	0	0	0	110.1	L331 V335 Y359 W478 Q479 F480	L331-V472 HydrophobicContact CD2-CB 4.4Å; L331-V472 HydrophobicContact CD2-CG1 3.85Å; L331-V472 HydrophobicContact CD2-CG2 3.56Å; V335-V472 HydrophobicContact CB-CG2 4.42Å; V335-V472 HydrophobicContact CG1-CG2 3.67Å; V335-V472 HydrophobicContact CG2-CG2 4.5Å; Y359-V472 PolarHBondContact O-N 3.49Å; V472-W478 HydrophobicContact CG1-CB 3.95Å; V472-W478 HydrophobicContact CG1-CG 4.25Å; V472-Q479 WeakPolarHBondContact CA-O 3.23Å; V472-F480 HydrophobicContact CG2-CB 4.31Å; V472-F480 HydrophobicContact CG2-CD2 4.09Å
473	L	83.2	Confident	87.7	Confident	83 Å²	83	56.1 Å²	56.1	44%	0.435	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	157.3	171.3	-82.8	94.6	0	0	0	112.6	W478 Q479 W483	L473-W478 WeakPolarHBondContact O-CA 2.92Å; L473-Q479 PolarHBondContact N-O 3.14Å; L473-Q479 PolarHBondContact O-N 3.35Å; L473-W483 HydrophobicContact CD1-CH2 2.94Å; L473-W483 HydrophobicContact CD1-CZ2 3.22Å; L473-W483 HydrophobicContact CD1-CZ3 3.67Å; L473-W483 HydrophobicContact CG-CH2 4.39Å; L473-W483 HydrophobicContact CG-CZ2 4.48Å
474	G	74.4	Confident	87.6	Confident	46 Å²	46	57.6 Å²	57.6	47%	0.474	28%	0.281	S	S	.	.			trans	102.7	156.1	175.1	0	0	0	0	0	112.9	W478	G474-W478 PolarHBondContact O-NE1 3.05Å
475	L	68	Low	87.4	Confident	121 Å²	121	63.1 Å²	63.1	63%	0.634	30%	0.302	S	S	*	.	S	Bend	trans	-107.9	-26.2	176.1	-69	164.9	0	0	0	113.4	H356	H356-L475 WeakPolarHBondContact CD2-CD1 3.17Å; H356-L475 WeakPolarHBondContact CD2-CD2 3.17Å; H356-L475 WeakPolarHBondContact NE2-CD1 3.44Å
476	R	68.3	Low	87.4	Confident	246 Å²	246	64.1 Å²	64.1	93%	0.928	31%	0.306	S	S	*	.	S	Bend	trans	-115.6	-35.2	-177	-66.6	-176.8	174.4	-177	-1.9	112.5
477	K	76.8	Confident	87.4	Confident	189 Å²	189	63.9 Å²	63.9	82%	0.822	30%	0.301	S	S	*	.	S	Bend	trans	-121.9	92.9	173.5	-68.5	-171.7	178	-174.9	0	107.2	Q479	K477-Q479 PolarHBondContact O-N 3.44Å
478	W	80.6	Confident	87.4	Confident	113 Å²	113	66 Å²	66	43%	0.428	31%	0.31	S	S	.	.			trans	-66.8	130.6	175.3	-66.1	-15.1	0	0	0	109.4	V330 L331 M339 V472 L473 G474	V330-W478 WeakPolarHBondContact CG1-O 3.14Å; L331-W478 HydrophobicContact CD1-CE3 3.7Å; L331-W478 HydrophobicContact CD1-CZ3 4.26Å; L331-W478 HydrophobicContact CD2-CB 4.3Å; M339-W478 HydrophobicContact CE-CD2 4.37Å; M339-W478 HydrophobicContact CE-CE3 3.89Å; M339-W478 HydrophobicContact CE-CH2 3.37Å; M339-W478 HydrophobicContact CE-CZ2 3.91Å; M339-W478 HydrophobicContact CE-CZ3 3.36Å; V472-W478 HydrophobicContact CG1-CB 3.95Å; V472-W478 HydrophobicContact CG1-CG 4.25Å; L473-W478 WeakPolarHBondContact O-CA 2.92Å; G474-W478 PolarHBondContact O-NE1 3.05Å
479	Q	83.9	Confident	87.3	Confident	79 Å²	79	66.3 Å²	66.3	37%	0.369	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	116.6	177.9	173.5	145.8	45.1	0	0	108	K412 V472 L473 K477 D481	K412-Q479 VanDerWaalsContact CD-NE2 3.25Å; V472-Q479 WeakPolarHBondContact CA-O 3.23Å; L473-Q479 PolarHBondContact N-O 3.14Å; L473-Q479 PolarHBondContact O-N 3.35Å; K477-Q479 PolarHBondContact O-N 3.44Å; Q479-D481 HydrophobicContact CG-CB 4.23Å
480	F	89.3	Confident	87.4	Confident	13 Å²	13	62.9 Å²	62.9	6%	0.057	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	128.7	163.5	-179.7	-102	0	0	0	108.6	L331 P332 F334 V335 L409 I411 C470 G471 V472	L331-F480 HydrophobicContact CD2-CB 4.18Å; P332-F480 HydrophobicContact CG-CB 4.25Å; P332-F480 HydrophobicContact CG-CD1 3.53Å; P332-F480 HydrophobicContact CG-CD2 3.89Å; P332-F480 HydrophobicContact CG-CE1 3.71Å; P332-F480 HydrophobicContact CG-CE2 4.08Å; P332-F480 HydrophobicContact CG-CG 3.61Å; P332-F480 HydrophobicContact CG-CZ 3.99Å; F334-F480 HydrophobicContact CE1-CE2 4.43Å; F334-F480 HydrophobicContact CE1-CZ 4.32Å; F334-F480 AromaticContact CZ-CE2 3.78Å; F334-F480 HydrophobicContact CZ-CE2 3.78Å; F334-F480 AromaticContact CZ-CZ 3.91Å; F334-F480 HydrophobicContact CZ-CZ 3.91Å; V335-F480 HydrophobicContact CG2-CD2 4.24Å; V335-F480 HydrophobicContact CG2-CE2 4.16Å; L409-F480 HydrophobicContact CD2-CE1 3.92Å; L409-F480 HydrophobicContact CD2-CZ 4.41Å; I411-F480 HydrophobicContact CD1-CD1 4.41Å; I411-F480 HydrophobicContact CD1-CE1 3.81Å; C470-F480 HydrophobicContact CB-CE2 3.95Å; C470-F480 HydrophobicContact CB-CZ 3.69Å; G471-F480 WeakPolarHBondContact O-CA 3.46Å; G471-F480 WeakPolarHBondContact O-CD2 2.89Å; V472-F480 HydrophobicContact CG2-CB 4.31Å; V472-F480 HydrophobicContact CG2-CD2 4.09Å
481	D	91.7	Very high	87.5	Confident	33 Å²	33	65.4 Å²	65.4	18%	0.176	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	172.7	-180	-158.6	1.5	0	0	0	110.4	I411 C470 G471 Q479 W483	I411-D481 WeakPolarHBondContact CG2-OD1 3.36Å; C470-D481 WeakPolarHBondContact CA-O 3.47Å; G471-D481 PolarHBondContact N-O 3.23Å; G471-D481 PolarHBondContact O-N 2.83Å; Q479-D481 HydrophobicContact CG-CB 4.23Å; D481-W483 HydrophobicContact CB-CH2 3.78Å; D481-W483 HydrophobicContact CB-CZ2 3.5Å; D481-W483 VanDerWaalsContact CB-CZ2 3.5Å; D481-W483 WeakPolarHBondContact O-CH2 3.48Å; D481-W483 VanDerWaalsContact O-CZ3 3.27Å; D481-W483 WeakPolarHBondContact O-CZ3 3.47Å
482	V	93.2	Very high	87.7	Confident	5 Å²	5	68.7 Å²	68.7	3%	0.03	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	130.4	-172.2	-174.4	0	0	0	0	109.7	I411 L424 V468 L469 C470 V487	I411-V482 HydrophobicContact CD1-CG2 3.58Å; I411-V482 HydrophobicContact CG1-CG2 3.87Å; I411-V482 HydrophobicContact CG2-CG2 4.03Å; L424-V482 HydrophobicContact CD1-CG2 4.24Å; V468-V482 HydrophobicContact CB-CG1 3.37Å; V468-V482 HydrophobicContact CG1-CG1 3.62Å; V468-V482 HydrophobicContact CG2-CG1 3.76Å; L469-V482 CarbonylContact O-C 3.58Å; L469-V482 WeakPolarHBondContact O-CA 3.48Å; C470-V482 HydrophobicContact CB-CG2 3.91Å; V482-V487 HydrophobicContact CG1-CG2 4.11Å
483	W	93.3	Very high	88	Confident	98 Å²	98	68.2 Å²	68.2	37%	0.371	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	131	179.7	-53.3	-81.2	0	0	0	111	L469 L473 D481	L469-W483 PolarHBondContact N-O 2.81Å; L469-W483 PolarHBondContact O-N 2.91Å; L473-W483 HydrophobicContact CD1-CH2 2.94Å; L473-W483 HydrophobicContact CD1-CZ2 3.22Å; L473-W483 HydrophobicContact CD1-CZ3 3.67Å; L473-W483 HydrophobicContact CG-CH2 4.39Å; L473-W483 HydrophobicContact CG-CZ2 4.48Å; D481-W483 HydrophobicContact CB-CH2 3.78Å; D481-W483 HydrophobicContact CB-CZ2 3.5Å; D481-W483 VanDerWaalsContact CB-CZ2 3.5Å; D481-W483 WeakPolarHBondContact O-CH2 3.48Å; D481-W483 VanDerWaalsContact O-CZ3 3.27Å; D481-W483 WeakPolarHBondContact O-CZ3 3.47Å
484	S	94.6	Very high	88.5	Confident	32 Å²	32	64.7 Å²	64.7	22%	0.224	30%	0.3	C	S	.	.			trans	-169.6	160.5	166.8	-170.4	0	0	0	0	109.6	S467 D486 V487	S467-S484 WeakPolarHBondContact O-CB 3.26Å; S467-S484 PolarHBondContact O-OG 3.22Å; S484-D486 PolarHBondContact O-N 3.02Å; S484-D486 PolarHBondContact OG-N 2.77Å; S484-D486 PolarHBondContact OG-OD2 3.31Å; S484-V487 WeakPolarHBondContact O-CB 3.48Å; S484-V487 PolarHBondContact O-N 2.99Å
485	W	93.4	Very high	89.2	Confident	126 Å²	126	65.1 Å²	65.1	48%	0.477	30%	0.296	S	S	.	.	H	α-helix	trans	-57.3	-33.7	162.4	-177.9	-108.5	0	0	0	112	V487 D488 I489 F530 H534	W485-V487 VanDerWaalsContact C-N 3.29Å; W485-V487 PolarHBondContact O-N 3.38Å; W485-D488 WeakPolarHBondContact O-CB 3.49Å; W485-D488 PolarHBondContact O-N 3.07Å; W485-D488 VanDerWaalsContact O-N 3.16Å; W485-I489 PolarHBondContact O-N 3.31Å; W485-I489 VanDerWaalsContact O-N 3.13Å; W485-F530 HydrophobicContact CH2-CE1 4.48Å; W485-F530 AromaticContact CH2-CE2 3.4Å; W485-F530 HydrophobicContact CH2-CE2 3.4Å; W485-F530 VanDerWaalsContact CH2-CE2 3.4Å; W485-F530 AromaticContact CH2-CZ 3.27Å; W485-F530 HydrophobicContact CH2-CZ 3.27Å; W485-F530 HydrophobicContact CZ2-CE1 4.23Å; W485-F530 AromaticContact CZ2-CE2 3.94Å; W485-F530 HydrophobicContact CZ2-CE2 3.94Å; W485-F530 AromaticContact CZ2-CZ 3.35Å; W485-F530 HydrophobicContact CZ2-CZ 3.35Å; W485-F530 HydrophobicContact CZ3-CE2 4.02Å; W485-F530 AromaticContact CZ3-CZ 3.9Å; W485-F530 HydrophobicContact CZ3-CZ 3.9Å; W485-H534 AromaticContact CH2-CE1 3.81Å; W485-H534 AromaticContact CH2-NE2 3.51Å; W485-H534 AromaticContact CZ2-CD2 3.56Å; W485-H534 AromaticContact CZ2-CE1 3.93Å; W485-H534 AromaticContact CZ2-NE2 3.51Å
486	D	95.8	Very high	90.2	Very high	29 Å²	29	59.5 Å²	59.5	16%	0.155	27%	0.267	C	S	.	.	H	α-helix	trans	-67.1	-30.1	179.8	-60	-33.9	0	0	0	112	I368 H464 S467 S484 I489 A490	I368-D486 HydrophobicContact CD1-CB 4Å; H464-D486 PolarHBondContact CD2-O 2.9Å; H464-D486 IonicContact NE2-OD1 3.74Å; H464-D486 PolarHBondContact NE2-OD1 3.44Å; S467-D486 PolarHBondContact N-OD2 2.88Å; S467-D486 PolarHBondContact OG-OD2 3.45Å; S484-D486 PolarHBondContact O-N 3.02Å; S484-D486 PolarHBondContact OG-N 2.77Å; S484-D486 PolarHBondContact OG-OD2 3.31Å; D486-I489 PolarHBondContact O-N 2.88Å; D486-A490 PolarHBondContact O-N 3.47Å; D486-A490 VanDerWaalsContact O-N 3.14Å
487	V	95.3	Very high	91.1	Very high	14 Å²	14	48 Å²	48	9%	0.085	23%	0.226	C	C	.	.	H	α-helix	trans	-66.3	-41.2	173.6	-179.9	0	0	0	0	110.3	I368 F370 Y419 V468 V482 S484 W485 I489 A490 N491	I368-V487 HydrophobicContact CD1-CG2 3.87Å; F370-V487 HydrophobicContact CE2-CG1 3.84Å; F370-V487 HydrophobicContact CZ-CG1 3.84Å; Y419-V487 HydrophobicContact CE1-CG1 4.45Å; V468-V487 HydrophobicContact CG1-CG2 4.05Å; V482-V487 HydrophobicContact CG1-CG2 4.11Å; S484-V487 WeakPolarHBondContact O-CB 3.48Å; S484-V487 PolarHBondContact O-N 2.99Å; W485-V487 VanDerWaalsContact C-N 3.29Å; W485-V487 PolarHBondContact O-N 3.38Å; V487-I489 VanDerWaalsContact C-N 3.34Å; V487-I489 PolarHBondContact O-N 3.42Å; V487-A490 PolarHBondContact O-N 2.86Å; V487-N491 PolarHBondContact O-N 2.84Å
488	D	93.8	Very high	91.6	Very high	73 Å²	73	41.4 Å²	41.4	39%	0.39	20%	0.199	S	C	.	.	H	α-helix	trans	-64.9	-39.2	177.3	-69.6	-38.5	0	0	0	111.5	W485 N491 K492	W485-D488 WeakPolarHBondContact O-CB 3.49Å; W485-D488 PolarHBondContact O-N 3.07Å; W485-D488 VanDerWaalsContact O-N 3.16Å; D488-N491 PolarHBondContact O-N 3.31Å; D488-K492 WeakPolarHBondContact O-CG 2.98Å; D488-K492 PolarHBondContact O-N 2.95Å
489	I	94.6	Very high	91.6	Very high	11 Å²	11	37.6 Å²	37.6	6%	0.056	19%	0.188	C	C	.	.	H	α-helix	trans	-59.6	-48.4	174.7	-64.2	172	0	0	0	110.4	H464 W485 D486 V487 N491 K492 L493 F530 I536	H464-I489 HydrophobicContact CB-CG2 4.38Å; W485-I489 PolarHBondContact O-N 3.31Å; W485-I489 VanDerWaalsContact O-N 3.13Å; D486-I489 PolarHBondContact O-N 2.88Å; V487-I489 VanDerWaalsContact C-N 3.34Å; V487-I489 PolarHBondContact O-N 3.42Å; I489-N491 VanDerWaalsContact C-N 3.33Å; I489-N491 PolarHBondContact O-N 3.26Å; I489-K492 PolarHBondContact O-N 3.27Å; I489-K492 VanDerWaalsContact O-N 3.15Å; I489-L493 HydrophobicContact CG2-CD1 3.98Å; I489-L493 HydrophobicContact CG2-CG 4.33Å; I489-L493 WeakPolarHBondContact O-CG 3.39Å; I489-L493 PolarHBondContact O-N 3.34Å; I489-F530 HydrophobicContact CG1-CE1 4.2Å; I489-I536 HydrophobicContact CB-CD1 4.37Å; I489-I536 HydrophobicContact CD1-CD1 3.9Å; I489-I536 HydrophobicContact CG1-CD1 3.72Å; I489-I536 HydrophobicContact CG2-CD1 3.84Å; I489-I536 HydrophobicContact CG2-CG2 4.43Å
490	A	95.4	Very high	91	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-59.6	-42.9	178.8	0	0	0	0	0	112.5	I368 F370 H464 D486 V487 K492 L493 E494	I368-A490 HydrophobicContact CB-CB 3.96Å; I368-A490 HydrophobicContact CG2-CB 3.31Å; F370-A490 HydrophobicContact CD2-CB 3.66Å; F370-A490 HydrophobicContact CE2-CB 4.01Å; H464-A490 HydrophobicContact CB-CB 3.77Å; D486-A490 PolarHBondContact O-N 3.47Å; D486-A490 VanDerWaalsContact O-N 3.14Å; V487-A490 PolarHBondContact O-N 2.86Å; A490-K492 PolarHBondContact O-N 3.29Å; A490-L493 WeakPolarHBondContact O-CB 3.36Å; A490-L493 PolarHBondContact O-N 2.99Å; A490-E494 PolarHBondContact O-N 3.03Å
491	N	94.8	Very high	90.1	Very high	52 Å²	52	37.9 Å²	37.9	28%	0.278	19%	0.189	S	C	.	.	H	α-helix	trans	-60.2	-43.8	174.8	-176.4	11.2	0	0	0	111.3	F370 V487 D488 I489 L493 E494 S495	F370-N491 HydrophobicContact CD2-CB 4.32Å; F370-N491 HydrophobicContact CE1-CB 4.38Å; F370-N491 HydrophobicContact CE2-CB 4.13Å; F370-N491 HydrophobicContact CZ-CB 4.17Å; V487-N491 PolarHBondContact O-N 2.84Å; D488-N491 PolarHBondContact O-N 3.31Å; I489-N491 VanDerWaalsContact C-N 3.33Å; I489-N491 PolarHBondContact O-N 3.26Å; N491-L493 VanDerWaalsContact C-N 3.35Å; N491-L493 PolarHBondContact O-N 3.13Å; N491-E494 PolarHBondContact O-N 2.96Å; N491-S495 PolarHBondContact O-N 3.27Å; N491-S495 PolarHBondContact O-OG 2.89Å
492	K	93.9	Very high	89.8	Confident	70 Å²	70	41.1 Å²	41.1	30%	0.304	20%	0.199	S	C	.	.	H	α-helix	trans	-70.8	-27.5	176.8	-61.6	-54.1	173.7	-162.1	0	113.8	D488 I489 A490 G496 N528 F530 L531	D488-K492 WeakPolarHBondContact O-CG 2.98Å; D488-K492 PolarHBondContact O-N 2.95Å; I489-K492 PolarHBondContact O-N 3.27Å; I489-K492 VanDerWaalsContact O-N 3.15Å; A490-K492 PolarHBondContact O-N 3.29Å; K492-G496 PolarHBondContact O-N 2.98Å; K492-N528 PolarHBondContact O-ND2 2.9Å; K492-F530 HydrophobicContact CB-CD1 3.98Å; K492-F530 HydrophobicContact CD-CB 4.35Å; K492-F530 HydrophobicContact CG-CB 4.01Å; K492-F530 HydrophobicContact CG-CD1 3.63Å; K492-F530 HydrophobicContact CG-CE1 4.16Å; K492-F530 HydrophobicContact CG-CG 3.84Å; K492-L531 HydrophobicContact CB-CD2 4.06Å; K492-L531 HydrophobicContact CB-CG 4.37Å
493	L	93.6	Very high	89.8	Confident	0 Å²	0	41 Å²	41	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-67.3	-43.1	170.8	-71	167.5	0	0	0	111.3	I463 H464 I489 A490 N491 G496 G497 H504 L531 T538	I463-L493 WeakPolarHBondContact O-CD1 3.22Å; H464-L493 HydrophobicContact CB-CD1 3.96Å; I489-L493 HydrophobicContact CG2-CD1 3.98Å; I489-L493 HydrophobicContact CG2-CG 4.33Å; I489-L493 WeakPolarHBondContact O-CG 3.39Å; I489-L493 PolarHBondContact O-N 3.34Å; A490-L493 WeakPolarHBondContact O-CB 3.36Å; A490-L493 PolarHBondContact O-N 2.99Å; N491-L493 VanDerWaalsContact C-N 3.35Å; N491-L493 PolarHBondContact O-N 3.13Å; L493-G496 CarbonylContact O-C 3.52Å; L493-G496 PolarHBondContact O-N 3.22Å; L493-G497 WeakPolarHBondContact O-CA 3.48Å; L493-G497 PolarHBondContact O-N 3.45Å; L493-H504 PolarHBondContact O-ND1 2.88Å; L493-L531 HydrophobicContact CD2-CD1 4.03Å; L493-L531 HydrophobicContact CD2-CD2 4.18Å; L493-L531 HydrophobicContact CG-CD2 4.39Å; L493-T538 HydrophobicContact CD2-CG2 3.46Å; L493-T538 VanDerWaalsContact CD2-CG2 3.46Å
494	E	93.9	Very high	89.9	Confident	8 Å²	8	36.3 Å²	36.3	4%	0.037	18%	0.18	C	C	.	.	H	α-helix	trans	-58.5	-52	172.7	176.7	-68.8	123.1	0	0	110.1	F370 D372 R460 A490 N491 G496 G497	F370-E494 HydrophobicContact CB-CB 3.7Å; F370-E494 HydrophobicContact CB-CG 4.04Å; D372-E494 VanDerWaalsContact CB-CD 3.42Å; D372-E494 HydrophobicContact CB-CG 3.94Å; D372-E494 WeakPolarHBondContact CB-OE1 3.34Å; R460-E494 HydrophobicContact CB-CG 4.36Å; R460-E494 WeakPolarHBondContact CB-OE1 3.39Å; R460-E494 IonicContact NE-OE1 3.28Å; A490-E494 PolarHBondContact O-N 3.03Å; N491-E494 PolarHBondContact O-N 2.96Å; E494-G496 VanDerWaalsContact C-N 3.26Å; E494-G496 PolarHBondContact O-N 2.9Å; E494-G497 VanDerWaalsContact O-CA 3.29Å; E494-G497 WeakPolarHBondContact O-CA 3.4Å; E494-G497 PolarHBondContact O-N 2.91Å
495	S	89.9	Confident	89.9	Confident	56 Å²	56	34.8 Å²	34.8	39%	0.392	17%	0.17	S	C	.	.	H	α-helix	trans	-65.4	-31.8	-174.8	-57.6	0	0	0	0	112.8	N491 G497	N491-S495 PolarHBondContact O-N 3.27Å; N491-S495 PolarHBondContact O-OG 2.89Å; S495-G497 VanDerWaalsContact C-N 3.28Å
496	G	88.3	Confident	90	Very high	2 Å²	2	28.9 Å²	28.9	2%	0.021	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	1.3	171.7	0	0	0	0	0	114	K492 L493 E494 R527	K492-G496 PolarHBondContact O-N 2.98Å; L493-G496 CarbonylContact O-C 3.52Å; L493-G496 PolarHBondContact O-N 3.22Å; E494-G496 VanDerWaalsContact C-N 3.26Å; E494-G496 PolarHBondContact O-N 2.9Å; G496-R527 PolarHBondContact O-NE 3.05Å; G496-R527 PolarHBondContact O-NH2 3.35Å
497	G	87.5	Confident	89.9	Confident	6 Å²	6	31.1 Å²	31.1	6%	0.062	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-71.3	149.7	-176.2	0	0	0	0	0	112.5	R460 L493 E494 S495 H504	R460-G497 VanDerWaalsContact CD-O 3.29Å; R460-G497 WeakPolarHBondContact CD-O 3.35Å; L493-G497 WeakPolarHBondContact O-CA 3.48Å; L493-G497 PolarHBondContact O-N 3.45Å; E494-G497 VanDerWaalsContact O-CA 3.29Å; E494-G497 WeakPolarHBondContact O-CA 3.4Å; E494-G497 PolarHBondContact O-N 2.91Å; S495-G497 VanDerWaalsContact C-N 3.28Å; G497-H504 WeakPolarHBondContact CA-ND1 3.49Å
498	I	86.5	Confident	89.8	Confident	50 Å²	50	32.2 Å²	32.2	26%	0.256	17%	0.166	S	C	.	.	P	Polyproline II helix	trans	-92.7	122.4	174.7	-55.8	-178.9	0	0	0	107.1	L540	I498-L540 HydrophobicContact CD1-CD1 3.67Å; I498-L540 HydrophobicContact CG1-CD1 4.38Å
499	P	81.3	Confident	89.9	Confident	32 Å²	32	28.9 Å²	28.9	21%	0.208	15%	0.149	C	C	.	.	S	Bend	trans	-65.6	149.6	178	26.1	-32.5	0	0	0	111.4	K374 M459 R460	K374-P499 HydrophobicContact CB-CB 4.32Å; K374-P499 HydrophobicContact CD-CB 3.61Å; K374-P499 HydrophobicContact CD-CG 3.67Å; K374-P499 HydrophobicContact CG-CB 4.19Å; K374-P499 HydrophobicContact CG-CG 4.36Å; M459-P499 WeakPolarHBondContact O-CA 3.5Å; R460-P499 HydrophobicContact CG-CB 3.95Å
500	G	71.8	Confident	89.8	Confident	11 Å²	11	29.6 Å²	29.6	11%	0.113	15%	0.153	C	C	.	.	S	Bend	trans	110.7	-144.3	179.1	0	0	0	0	0	112.5	L443 D458 M459 R502	L443-G500 VanDerWaalsContact CD2-O 3.29Å; L443-G500 WeakPolarHBondContact CD2-O 3.35Å; D458-G500 WeakPolarHBondContact OD1-CA 3.14Å; D458-G500 PolarHBondContact OD1-N 3.34Å; D458-G500 WeakPolarHBondContact OD2-CA 3.49Å; D458-G500 PolarHBondContact OD2-N 2.92Å; M459-G500 PolarHBondContact O-N 3.37Å; G500-R502 PolarHBondContact O-N 2.96Å
501	W	69.9	Low	89.7	Confident	88 Å²	88	34 Å²	34	33%	0.333	18%	0.176	S	C	.	.	S	Bend	trans	-76	21.1	-168.9	-59.2	103.3	0	0	0	116.1	R447 L548	R447-W501 VanDerWaalsContact CD-CZ2 3.48Å; R447-W501 HydrophobicContact CG-CH2 4.44Å; R447-W501 VanDerWaalsContact NE-CH2 3.33Å; R447-W501 VanDerWaalsContact NH1-CH2 3.29Å; W501-L548 HydrophobicContact CD2-CD2 3.46Å; W501-L548 VanDerWaalsContact CD2-CD2 3.46Å; W501-L548 HydrophobicContact CE3-CD2 3.5Å; W501-L548 HydrophobicContact CG-CD2 4.03Å; W501-L548 HydrophobicContact CH2-CB 4.47Å; W501-L548 HydrophobicContact CH2-CD2 3.39Å; W501-L548 HydrophobicContact CZ2-CD2 3.53Å; W501-L548 HydrophobicContact CZ3-CD2 3.48Å; W501-L548 VanDerWaalsContact CZ3-CD2 3.48Å
502	R	85.9	Confident	89.6	Confident	101 Å²	101	33.3 Å²	33.3	38%	0.381	18%	0.175	S	C	.	.			trans	-124.9	130.2	-173.1	-62.7	-175.9	175.1	101.7	-3.5	109.7	G500 E520 L540	G500-R502 PolarHBondContact O-N 2.96Å; R502-E520 VanDerWaalsContact CD-OE1 3.27Å; R502-E520 WeakPolarHBondContact CD-OE1 3.22Å; R502-E520 IonicContact CZ-OE1 3.16Å; R502-E520 IonicContact NE-OE1 2.68Å; R502-E520 PolarHBondContact NE-OE1 2.73Å; R502-E520 IonicContact NH2-OE1 3.78Å; R502-L540 HydrophobicContact CB-CB 4.37Å; R502-L540 HydrophobicContact CB-CD2 3.95Å
503	I	92.4	Very high	89.4	Confident	1 Å²	1	30 Å²	30	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	123.9	172.1	-59	179.3	0	0	0	107.6	L440 L443 I461 I463 I505 L540 I541	L440-I503 HydrophobicContact CD2-CD1 3.46Å; L440-I503 VanDerWaalsContact CD2-CD1 3.46Å; L440-I503 HydrophobicContact CD2-CG1 4.29Å; L440-I503 HydrophobicContact CG-CD1 3.69Å; L443-I503 HydrophobicContact CD1-CD1 4.49Å; L443-I503 HydrophobicContact CD1-CG1 4.01Å; I461-I503 HydrophobicContact CB-CG2 4.47Å; I461-I503 HydrophobicContact CG2-CG2 4.09Å; I463-I503 HydrophobicContact CD1-CG2 3.45Å; I463-I503 VanDerWaalsContact CD1-CG2 3.45Å; I463-I503 HydrophobicContact CG1-CG2 3.81Å; I503-I505 HydrophobicContact CG2-CG2 3.95Å; I503-L540 WeakPolarHBondContact O-CA 3.13Å; I503-I541 HydrophobicContact CB-CB 4.33Å; I503-I541 HydrophobicContact CB-CD1 4.39Å; I503-I541 PolarHBondContact O-N 3.33Å
504	H	94.5	Very high	89.1	Confident	1 Å²	1	36.3 Å²	36.3	1%	0.005	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	116.7	-179.9	-164.3	173.9	0	0	0	109.5	I461 G462 I463 L493 G497 T538 Y539 L540	I461-H504 PolarHBondContact O-N 3.35Å; G462-H504 CarbonylContact C-O 3.57Å; G462-H504 VanDerWaalsContact CA-O 3.3Å; G462-H504 WeakPolarHBondContact CA-O 3.43Å; I463-H504 PolarHBondContact N-O 2.97Å; L493-H504 PolarHBondContact O-ND1 2.88Å; G497-H504 WeakPolarHBondContact CA-ND1 3.49Å; H504-T538 WeakPolarHBondContact NE2-CB 3.44Å; H504-T538 PolarHBondContact NE2-OG1 2.86Å; H504-T538 VanDerWaalsContact NE2-OG1 3.16Å; H504-Y539 PolarHBondContact CD2-O 3.32Å; H504-L540 HydrophobicContact CB-CD2 3.82Å
505	I	95.5	Very high	88.7	Confident	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	152.4	-178.2	68.7	172	0	0	0	111.5	I463 I503 A509 L510 L513 V519 T538 Y539 I541	I463-I505 HydrophobicContact CB-CG2 4.11Å; I463-I505 WeakPolarHBondContact O-CA 3.39Å; I503-I505 HydrophobicContact CG2-CG2 3.95Å; I505-A509 HydrophobicContact CB-CB 4.21Å; I505-L510 HydrophobicContact CD1-CB 4Å; I505-L510 HydrophobicContact CD1-CD1 4.11Å; I505-L513 HydrophobicContact CD1-CD1 3.91Å; I505-V519 HydrophobicContact CD1-CG1 4.13Å; I505-T538 CarbonylContact O-C 3.59Å; I505-T538 WeakPolarHBondContact O-CA 3.47Å; I505-Y539 PolarHBondContact N-O 2.94Å; I505-Y539 PolarHBondContact O-N 2.85Å; I505-I541 HydrophobicContact CD1-CD1 4.12Å; I505-I541 HydrophobicContact CD1-CG1 3.85Å; I505-I541 HydrophobicContact CG1-CG1 4.38Å; I505-I541 HydrophobicContact CG2-CD1 3.76Å; I505-I541 HydrophobicContact CG2-CG1 4.06Å
506	S	95.3	Very high	88.5	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.014	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	165.7	169	69.5	0	0	0	0	112.2	I463 H464 A508 A509 L510	I463-S506 PolarHBondContact O-N 2.94Å; H464-S506 VanDerWaalsContact ND1-CB 3.29Å; H464-S506 WeakPolarHBondContact ND1-CB 3.48Å; H464-S506 PolarHBondContact ND1-OG 2.92Å; S506-A508 VanDerWaalsContact C-N 3.28Å; S506-A508 PolarHBondContact O-N 3.29Å; S506-A508 PolarHBondContact OG-N 3.49Å; S506-A509 PolarHBondContact O-N 3.37Å; S506-A509 VanDerWaalsContact O-N 3.13Å; S506-A509 PolarHBondContact OG-N 3.42Å; S506-A509 VanDerWaalsContact OG-N 3.12Å; S506-L510 PolarHBondContact O-N 3.13Å
507	K	93.8	Very high	88.5	Confident	76 Å²	76	43.6 Å²	43.6	33%	0.33	24%	0.241	S	C	.	.	H	α-helix	trans	-52.9	-44.7	167.1	-176.6	52.2	174.3	156.1	0	112.8	A509 L510 D511 E537 Y539	K507-A509 VanDerWaalsContact C-N 3.3Å; K507-A509 PolarHBondContact O-N 2.76Å; K507-L510 HydrophobicContact CD-CD2 4.45Å; K507-L510 WeakPolarHBondContact O-CB 3.28Å; K507-L510 PolarHBondContact O-N 2.67Å; K507-L510 VanDerWaalsContact O-N 3.1Å; K507-D511 WeakPolarHBondContact CE-OD1 3.38Å; K507-D511 IonicContact NZ-OD1 2.66Å; K507-D511 PolarHBondContact NZ-OD1 3.07Å; K507-D511 VanDerWaalsContact O-CG 3.26Å; K507-D511 PolarHBondContact O-N 2.95Å; K507-E537 HydrophobicContact CB-CB 3.89Å; K507-E537 PolarHBondContact N-O 3.26Å; K507-Y539 HydrophobicContact CB-CE2 3.96Å; K507-Y539 HydrophobicContact CD-CE2 3.74Å; K507-Y539 HydrophobicContact CG-CE2 4.4Å
508	A	94.1	Very high	88.6	Confident	37 Å²	37	49.9 Å²	49.9	31%	0.306	27%	0.268	S	S	.	.	H	α-helix	trans	-58.6	-37.8	177.2	0	0	0	0	0	113.8	S465 S506 C512	S465-A508 WeakPolarHBondContact O-CB 3.31Å; S506-A508 VanDerWaalsContact C-N 3.28Å; S506-A508 PolarHBondContact O-N 3.29Å; S506-A508 PolarHBondContact OG-N 3.49Å; A508-C512 PolarHBondContact O-SG 3.02Å
509	A	94.3	Very high	88.8	Confident	2 Å²	2	50 Å²	50	2%	0.017	27%	0.271	C	S	.	.	H	α-helix	trans	-71.9	-40.6	175.4	0	0	0	0	0	111.2	S465 I505 S506 K507 D511 C512 L513	S465-A509 WeakPolarHBondContact OG-CA 3.28Å; I505-A509 HydrophobicContact CB-CB 4.21Å; S506-A509 PolarHBondContact O-N 3.37Å; S506-A509 VanDerWaalsContact O-N 3.13Å; S506-A509 PolarHBondContact OG-N 3.42Å; S506-A509 VanDerWaalsContact OG-N 3.12Å; K507-A509 VanDerWaalsContact C-N 3.3Å; K507-A509 PolarHBondContact O-N 2.76Å; A509-D511 VanDerWaalsContact C-N 3.31Å; A509-D511 PolarHBondContact O-N 2.78Å; A509-C512 WeakPolarHBondContact O-CB 3.41Å; A509-C512 PolarHBondContact O-N 2.75Å; A509-C512 VanDerWaalsContact O-N 3.1Å; A509-L513 VanDerWaalsContact O-CG 3.31Å; A509-L513 WeakPolarHBondContact O-CG 3.49Å; A509-L513 PolarHBondContact O-N 3.3Å
510	L	94.2	Very high	89.3	Confident	27 Å²	27	50.5 Å²	50.5	14%	0.141	27%	0.271	C	S	.	.	H	α-helix	trans	-58.6	-41.7	176	-179.3	61.3	0	0	0	112.5	I505 S506 K507 C512 L513 V519 Y539	I505-L510 HydrophobicContact CD1-CB 4Å; I505-L510 HydrophobicContact CD1-CD1 4.11Å; S506-L510 PolarHBondContact O-N 3.13Å; K507-L510 HydrophobicContact CD-CD2 4.45Å; K507-L510 WeakPolarHBondContact O-CB 3.28Å; K507-L510 PolarHBondContact O-N 2.67Å; K507-L510 VanDerWaalsContact O-N 3.1Å; L510-C512 PolarHBondContact O-N 3Å; L510-L513 PolarHBondContact O-N 2.96Å; L510-V519 HydrophobicContact CD1-CG1 3.88Å; L510-V519 HydrophobicContact CD1-CG2 4.04Å; L510-V519 HydrophobicContact CD2-CG2 4.26Å; L510-Y539 HydrophobicContact CB-CD2 4.42Å; L510-Y539 HydrophobicContact CD2-CD1 3.96Å; L510-Y539 HydrophobicContact CD2-CD2 3.69Å; L510-Y539 HydrophobicContact CD2-CE1 4.01Å; L510-Y539 HydrophobicContact CD2-CE2 3.79Å; L510-Y539 HydrophobicContact CD2-CG 3.81Å
511	D	93.3	Very high	90.1	Very high	93 Å²	93	56.4 Å²	56.4	50%	0.497	30%	0.295	S	S	.	.	H	α-helix	trans	-64.7	-26.3	179	-64.1	-23.5	0	0	0	112	K507 A509	K507-D511 WeakPolarHBondContact CE-OD1 3.38Å; K507-D511 IonicContact NZ-OD1 2.66Å; K507-D511 PolarHBondContact NZ-OD1 3.07Å; K507-D511 VanDerWaalsContact O-CG 3.26Å; K507-D511 PolarHBondContact O-N 2.95Å; A509-D511 VanDerWaalsContact C-N 3.31Å; A509-D511 PolarHBondContact O-N 2.78Å
512	C	92.3	Very high	90.8	Very high	37 Å²	37	52.2 Å²	52.2	25%	0.25	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-7.9	173.9	-61.2	0	0	0	0	114.3	A432 A508 A509 L510	A432-C512 HydrophobicContact CB-CB 3.49Å; A432-C512 VanDerWaalsContact CB-CB 3.49Å; A508-C512 PolarHBondContact O-SG 3.02Å; A509-C512 WeakPolarHBondContact O-CB 3.41Å; A509-C512 PolarHBondContact O-N 2.75Å; A509-C512 VanDerWaalsContact O-N 3.1Å; L510-C512 PolarHBondContact O-N 3Å
513	L	90.3	Very high	90.8	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.005	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	1.4	-175.9	-68.8	169.7	0	0	0	113.7	A432 H433 V436 I505 A509 L510 G515 D516 Y517 I541	A432-L513 HydrophobicContact CB-CD2 3.82Å; A432-L513 HydrophobicContact CB-CG 4.22Å; H433-L513 PolarHBondContact CE1-O 3.4Å; V436-L513 HydrophobicContact CB-CD2 4.4Å; V436-L513 HydrophobicContact CG2-CD1 3.86Å; V436-L513 HydrophobicContact CG2-CD2 3.74Å; V436-L513 HydrophobicContact CG2-CG 4.45Å; I505-L513 HydrophobicContact CD1-CD1 3.91Å; A509-L513 VanDerWaalsContact O-CG 3.31Å; A509-L513 WeakPolarHBondContact O-CG 3.49Å; A509-L513 PolarHBondContact O-N 3.3Å; L510-L513 PolarHBondContact O-N 2.96Å; L513-G515 PolarHBondContact O-N 2.69Å; L513-D516 PolarHBondContact O-N 3.34Å; L513-D516 VanDerWaalsContact O-N 3.09Å; L513-Y517 HydrophobicContact CB-CD2 4.15Å; L513-Y517 HydrophobicContact CD1-CD2 4.23Å; L513-Y517 HydrophobicContact CD2-CD2 3.99Å; L513-Y517 HydrophobicContact CD2-CE2 3.71Å; L513-Y517 HydrophobicContact CG-CD2 4.34Å; L513-I541 HydrophobicContact CD1-CD1 4.31Å
514	N	86.9	Confident	90.4	Very high	131 Å²	131	52.2 Å²	52.2	70%	0.701	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.4	16.3	174.4	-60.4	-44.1	0	0	0	116.7
515	G	84.6	Confident	90	Very high	62 Å²	62	55 Å²	55	64%	0.639	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.7	11.1	-180	0	0	0	0	0	115.4	L513 Y517	L513-G515 PolarHBondContact O-N 2.69Å; G515-Y517 PolarHBondContact O-N 2.84Å
516	D	86.3	Confident	89.6	Confident	117 Å²	117	61 Å²	61	63%	0.626	33%	0.327	S	S	*	.			trans	-73.9	-11.1	-176.6	-69.6	-18.9	0	0	0	114.2	H433 L513	H433-D516 IonicContact CE1-OD2 3.63Å; H433-D516 PolarHBondContact CE1-OD2 3.44Å; H433-D516 IonicContact ND1-OD2 3.62Å; L513-D516 PolarHBondContact O-N 3.34Å; L513-D516 VanDerWaalsContact O-N 3.09Å
517	Y	88.4	Confident	89.3	Confident	41 Å²	41	65.6 Å²	65.6	16%	0.161	35%	0.345	C	S	.	.	S	Bend	trans	-121	137.9	-177.6	-60.9	-90.1	0	0	0	111.3	H433 V436 E437 L440 L513 G515 V519 I541	H433-Y517 AromaticContact ND1-CE2 3.63Å; V436-Y517 HydrophobicContact CG1-CD1 3.96Å; V436-Y517 HydrophobicContact CG1-CE1 3.51Å; V436-Y517 HydrophobicContact CG1-CE2 4.2Å; V436-Y517 HydrophobicContact CG1-CG 4.46Å; E437-Y517 PolarHBondContact OE1-OH 3.37Å; E437-Y517 VanDerWaalsContact OE1-OH 3.12Å; L440-Y517 HydrophobicContact CD1-CE1 4.21Å; L513-Y517 HydrophobicContact CB-CD2 4.15Å; L513-Y517 HydrophobicContact CD1-CD2 4.23Å; L513-Y517 HydrophobicContact CD2-CD2 3.99Å; L513-Y517 HydrophobicContact CD2-CE2 3.71Å; L513-Y517 HydrophobicContact CG-CD2 4.34Å; G515-Y517 PolarHBondContact O-N 2.84Å; Y517-V519 PolarHBondContact O-N 2.94Å; Y517-I541 HydrophobicContact CD1-CG2 4.26Å
518	E	88.5	Confident	89.1	Confident	138 Å²	138	63.1 Å²	63.1	65%	0.645	34%	0.335	S	S	*	.			trans	-71.9	127.1	171.3	-67.4	-173	179.1	0	0	110.4	K542	E518-K542 HydrophobicContact CB-CB 4.33Å; E518-K542 PolarHBondContact O-N 3.42Å
519	V	91.1	Very high	88.9	Confident	51 Å²	51	65.5 Å²	65.5	31%	0.309	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	148.4	-177	-62.4	0	0	0	0	112.6	I505 L510 Y517 Y539 L540 I541	I505-V519 HydrophobicContact CD1-CG1 4.13Å; L510-V519 HydrophobicContact CD1-CG1 3.88Å; L510-V519 HydrophobicContact CD1-CG2 4.04Å; L510-V519 HydrophobicContact CD2-CG2 4.26Å; Y517-V519 PolarHBondContact O-N 2.94Å; V519-Y539 HydrophobicContact CG2-CD1 4.33Å; V519-L540 CarbonylContact C-O 3.53Å; V519-L540 VanDerWaalsContact CA-O 3.29Å; V519-L540 WeakPolarHBondContact CA-O 3.43Å; V519-I541 HydrophobicContact CG1-CG1 4.1Å
520	E	91.4	Very high	88.7	Confident	44 Å²	44	67.3 Å²	67.3	21%	0.206	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	161.1	169	64.4	-175.6	175.8	0	0	111.4	R502 G522 Y539 L540 K542	R502-E520 VanDerWaalsContact CD-OE1 3.27Å; R502-E520 WeakPolarHBondContact CD-OE1 3.22Å; R502-E520 IonicContact CZ-OE1 3.16Å; R502-E520 IonicContact NE-OE1 2.68Å; R502-E520 PolarHBondContact NE-OE1 2.73Å; R502-E520 IonicContact NH2-OE1 3.78Å; E520-G522 PolarHBondContact O-N 3.34Å; E520-Y539 CarbonylContact O-C 3.47Å; E520-Y539 WeakPolarHBondContact O-CA 3.28Å; E520-Y539 WeakPolarHBondContact O-CB 3.21Å; E520-L540 HydrophobicContact CG-CB 3.67Å; E520-L540 HydrophobicContact CG-CD1 4.4Å; E520-L540 PolarHBondContact N-O 3.11Å; E520-L540 PolarHBondContact O-N 3.18Å; E520-K542 HydrophobicContact CB-CD 4.38Å; E520-K542 HydrophobicContact CG-CG 4.29Å; E520-K542 WeakPolarHBondContact OE2-CE 3.47Å; E520-K542 IonicContact OE2-NZ 3.45Å; E520-K542 PolarHBondContact OE2-NZ 3.43Å
521	E	89.8	Confident	88.6	Confident	134 Å²	134	66 Å²	66	63%	0.626	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.5	125.8	174.4	-72.1	-167.3	172.1	0	0	110.6	H523	E521-H523 IonicContact OE2-CE1 3.29Å; E521-H523 PolarHBondContact OE2-CE1 3Å; E521-H523 VanDerWaalsContact OE2-CE1 3.29Å; E521-H523 IonicContact OE2-NE2 3.87Å
522	G	84.1	Confident	88.4	Confident	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.345	C	S	.	.			trans	-79.7	-20.1	-173.8	0	0	0	0	0	113.8	E520 G524 R527 T538	E520-G522 PolarHBondContact O-N 3.34Å; G522-G524 PolarHBondContact O-N 3.01Å; G522-G524 VanDerWaalsContact O-N 3.09Å; G522-R527 PolarHBondContact O-NH1 3.41Å; G522-R527 PolarHBondContact O-NH2 3.16Å; G522-T538 WeakPolarHBondContact CA-O 3.48Å; G522-T538 PolarHBondContact N-O 2.72Å
523	H	86.7	Confident	88.3	Confident	103 Å²	103	76.1 Å²	76.1	48%	0.477	37%	0.369	S	S	.	.			trans	45.8	36	-172.8	-58.2	-67.7	0	0	0	113.9	E521 K525 D526 R527	E521-H523 IonicContact OE2-CE1 3.29Å; E521-H523 PolarHBondContact OE2-CE1 3Å; E521-H523 VanDerWaalsContact OE2-CE1 3.29Å; E521-H523 IonicContact OE2-NE2 3.87Å; H523-K525 PolarHBondContact O-N 3.49Å; H523-D526 PolarHBondContact O-N 3.45Å; H523-R527 PolarHBondContact O-NH1 3.19Å
524	G	83.3	Confident	88.2	Confident	0 Å²	0	80.3 Å²	80.3	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-62.3	-26.3	-175.8	0	0	0	0	0	113.9	G522 D526 R527 N528 T538	G522-G524 PolarHBondContact O-N 3.01Å; G522-G524 VanDerWaalsContact O-N 3.09Å; G524-D526 PolarHBondContact O-N 3.31Å; G524-R527 PolarHBondContact O-N 2.6Å; G524-N528 PolarHBondContact O-N 3.35Å; G524-T538 PolarHBondContact N-OG1 3.19Å; G524-T538 VanDerWaalsContact N-OG1 3.09Å
525	K	85.6	Confident	88.4	Confident	58 Å²	58	79.3 Å²	79.3	25%	0.252	38%	0.383	S	S	.	.	H	α-helix	trans	-63.1	-26.2	177.8	-61.3	-178.8	-174.5	174.3	0	113	H523 R532 N535 I536	H523-K525 PolarHBondContact O-N 3.49Å; K525-R532 HydrophobicContact CB-CB 4.16Å; K525-R532 HydrophobicContact CB-CG 4.41Å; K525-R532 WeakPolarHBondContact O-CB 3.43Å; K525-N535 PolarHBondContact NZ-OD1 2.69Å; K525-I536 WeakPolarHBondContact CE-O 3.22Å
526	D	87.6	Confident	88.6	Confident	126 Å²	126	77.5 Å²	77.5	67%	0.674	36%	0.359	S	S	*	.	H	α-helix	trans	-82.2	-25.1	-179.1	-58.4	-26.6	0	0	0	111.8	H523 G524	H523-D526 PolarHBondContact O-N 3.45Å; G524-D526 PolarHBondContact O-N 3.31Å
527	R	88.1	Confident	88.9	Confident	100 Å²	100	76.4 Å²	76.4	38%	0.377	35%	0.35	S	S	.	.	H	α-helix	trans	-101.3	-18.4	-174.6	-60.2	-170.1	-60.6	-83.9	-0.4	113.7	G496 G522 H523 G524	G496-R527 PolarHBondContact O-NE 3.05Å; G496-R527 PolarHBondContact O-NH2 3.35Å; G522-R527 PolarHBondContact O-NH1 3.41Å; G522-R527 PolarHBondContact O-NH2 3.16Å; H523-R527 PolarHBondContact O-NH1 3.19Å; G524-R527 PolarHBondContact O-N 2.6Å
528	N	90.7	Very high	89.2	Confident	24 Å²	24	75 Å²	75	13%	0.128	35%	0.346	C	S	.	.			trans	-138.8	119.3	-178.7	-166.7	-57	0	0	0	112.1	K492 G524 F530 L531 R532	K492-N528 PolarHBondContact O-ND2 2.9Å; G524-N528 PolarHBondContact O-N 3.35Å; N528-F530 VanDerWaalsContact C-N 3.25Å; N528-F530 PolarHBondContact O-N 2.96Å; N528-F530 VanDerWaalsContact OD1-CB 3.23Å; N528-F530 WeakPolarHBondContact OD1-CB 3.49Å; N528-F530 PolarHBondContact OD1-N 3.46Å; N528-L531 HydrophobicContact CB-CB 4.29Å; N528-L531 HydrophobicContact CB-CD1 3.84Å; N528-L531 HydrophobicContact CB-CG 3.89Å; N528-L531 PolarHBondContact O-N 3.31Å; N528-R532 PolarHBondContact O-N 3.11Å
529	D	89.9	Confident	89.4	Confident	87 Å²	87	70.6 Å²	70.6	47%	0.465	32%	0.323	S	S	.	.	H	α-helix	trans	-58.7	-34.3	-179.8	-80.2	-28.9	0	0	0	113.7	R532 R533	D529-R532 PolarHBondContact O-N 2.98Å; D529-R532 IonicContact OD1-CZ 3.94Å; D529-R532 IonicContact OD1-NE 2.67Å; D529-R532 IonicContact OD1-NH2 3.71Å; D529-R532 PolarHBondContact OD1-NH2 2.98Å; D529-R533 WeakPolarHBondContact O-CB 3.26Å; D529-R533 VanDerWaalsContact O-CG 3.3Å; D529-R533 WeakPolarHBondContact O-CG 3.35Å; D529-R533 PolarHBondContact O-N 3.34Å
530	F	90.5	Very high	89.5	Confident	39 Å²	39	68.3 Å²	68.3	17%	0.171	31%	0.309	C	S	.	.	H	α-helix	trans	-68.1	-44.7	-179.5	-179.9	-87.1	0	0	0	111.2	W485 I489 K492 N528 R532 R533 H534 I536	W485-F530 HydrophobicContact CH2-CE1 4.48Å; W485-F530 AromaticContact CH2-CE2 3.4Å; W485-F530 HydrophobicContact CH2-CE2 3.4Å; W485-F530 VanDerWaalsContact CH2-CE2 3.4Å; W485-F530 AromaticContact CH2-CZ 3.27Å; W485-F530 HydrophobicContact CH2-CZ 3.27Å; W485-F530 HydrophobicContact CZ2-CE1 4.23Å; W485-F530 AromaticContact CZ2-CE2 3.94Å; W485-F530 HydrophobicContact CZ2-CE2 3.94Å; W485-F530 AromaticContact CZ2-CZ 3.35Å; W485-F530 HydrophobicContact CZ2-CZ 3.35Å; W485-F530 HydrophobicContact CZ3-CE2 4.02Å; W485-F530 AromaticContact CZ3-CZ 3.9Å; W485-F530 HydrophobicContact CZ3-CZ 3.9Å; I489-F530 HydrophobicContact CG1-CE1 4.2Å; K492-F530 HydrophobicContact CB-CD1 3.98Å; K492-F530 HydrophobicContact CD-CB 4.35Å; K492-F530 HydrophobicContact CG-CB 4.01Å; K492-F530 HydrophobicContact CG-CD1 3.63Å; K492-F530 HydrophobicContact CG-CE1 4.16Å; K492-F530 HydrophobicContact CG-CG 3.84Å; N528-F530 VanDerWaalsContact C-N 3.25Å; N528-F530 PolarHBondContact O-N 2.96Å; N528-F530 VanDerWaalsContact OD1-CB 3.23Å; N528-F530 WeakPolarHBondContact OD1-CB 3.49Å; N528-F530 PolarHBondContact OD1-N 3.46Å; F530-R532 VanDerWaalsContact C-N 3.26Å; F530-R532 PolarHBondContact O-N 3.48Å; F530-R533 PolarHBondContact O-N 3.28Å; F530-H534 AromaticContact CD1-ND1 3.93Å; F530-H534 AromaticContact CD2-CE1 3.59Å; F530-H534 AromaticContact CD2-ND1 3.71Å; F530-H534 AromaticContact CE1-ND1 3.95Å; F530-H534 AromaticContact CE2-CE1 3.43Å; F530-H534 VanDerWaalsContact CE2-CE1 3.43Å; F530-H534 WeakPolarHBondContact CE2-CE1 3.19Å; F530-H534 AromaticContact CE2-ND1 3.73Å; F530-H534 AromaticContact CG-ND1 3.83Å; F530-H534 AromaticContact CZ-CE1 3.9Å; F530-H534 AromaticContact CZ-ND1 3.87Å; F530-H534 PolarHBondContact O-N 2.95Å; F530-H534 VanDerWaalsContact O-N 3.14Å; F530-H534 PolarHBondContact O-ND1 2.9Å; F530-I536 HydrophobicContact CE1-CD1 4.29Å
531	L	90.6	Very high	89.5	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-62.7	-36.5	177.2	-59.5	-179.5	0	0	0	111	K492 L493 N528 N535 I536 T538	K492-L531 HydrophobicContact CB-CD2 4.06Å; K492-L531 HydrophobicContact CB-CG 4.37Å; L493-L531 HydrophobicContact CD2-CD1 4.03Å; L493-L531 HydrophobicContact CD2-CD2 4.18Å; L493-L531 HydrophobicContact CG-CD2 4.39Å; N528-L531 HydrophobicContact CB-CB 4.29Å; N528-L531 HydrophobicContact CB-CD1 3.84Å; N528-L531 HydrophobicContact CB-CG 3.89Å; N528-L531 PolarHBondContact O-N 3.31Å; L531-N535 PolarHBondContact O-N 3.4Å; L531-I536 HydrophobicContact CD2-CB 4.25Å; L531-I536 HydrophobicContact CD2-CD1 3.97Å; L531-I536 HydrophobicContact CD2-CG2 4.39Å; L531-I536 PolarHBondContact O-N 2.99Å; L531-T538 HydrophobicContact CD1-CG2 4.28Å
532	R	89.6	Confident	89.1	Confident	142 Å²	142	64.7 Å²	64.7	54%	0.536	29%	0.291	S	S	.	.	H	α-helix	trans	-66.1	-50.7	175.2	-171.7	168.8	60.5	176.7	-0.5	112.7	K525 N528 D529 F530 H534 N535	K525-R532 HydrophobicContact CB-CB 4.16Å; K525-R532 HydrophobicContact CB-CG 4.41Å; K525-R532 WeakPolarHBondContact O-CB 3.43Å; N528-R532 PolarHBondContact O-N 3.11Å; D529-R532 PolarHBondContact O-N 2.98Å; D529-R532 IonicContact OD1-CZ 3.94Å; D529-R532 IonicContact OD1-NE 2.67Å; D529-R532 IonicContact OD1-NH2 3.71Å; D529-R532 PolarHBondContact OD1-NH2 2.98Å; F530-R532 VanDerWaalsContact C-N 3.26Å; F530-R532 PolarHBondContact O-N 3.48Å; R532-H534 VanDerWaalsContact C-N 3.28Å; R532-H534 PolarHBondContact O-N 3.44Å; R532-N535 PolarHBondContact O-N 3.32Å; R532-N535 VanDerWaalsContact O-N 3.17Å
533	R	89.4	Confident	88.3	Confident	200 Å²	200	66.4 Å²	66.4	76%	0.755	30%	0.299	S	S	*	.	H	α-helix	trans	-61.9	-35.3	-177.9	-74.6	176.5	-170.7	-178.9	5.2	112.9	D529 F530	D529-R533 WeakPolarHBondContact O-CB 3.26Å; D529-R533 VanDerWaalsContact O-CG 3.3Å; D529-R533 WeakPolarHBondContact O-CG 3.35Å; D529-R533 PolarHBondContact O-N 3.34Å; F530-R533 PolarHBondContact O-N 3.28Å
534	H	88.9	Confident	86.9	Confident	89 Å²	89	65.5 Å²	65.5	41%	0.412	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	9.1	-179.7	-59.8	93	0	0	0	113.3	W485 F530 R532 I536	W485-H534 AromaticContact CH2-CE1 3.81Å; W485-H534 AromaticContact CH2-NE2 3.51Å; W485-H534 AromaticContact CZ2-CD2 3.56Å; W485-H534 AromaticContact CZ2-CE1 3.93Å; W485-H534 AromaticContact CZ2-NE2 3.51Å; F530-H534 AromaticContact CD1-ND1 3.93Å; F530-H534 AromaticContact CD2-CE1 3.59Å; F530-H534 AromaticContact CD2-ND1 3.71Å; F530-H534 AromaticContact CE1-ND1 3.95Å; F530-H534 AromaticContact CE2-CE1 3.43Å; F530-H534 VanDerWaalsContact CE2-CE1 3.43Å; F530-H534 WeakPolarHBondContact CE2-CE1 3.19Å; F530-H534 AromaticContact CE2-ND1 3.73Å; F530-H534 AromaticContact CG-ND1 3.83Å; F530-H534 AromaticContact CZ-CE1 3.9Å; F530-H534 AromaticContact CZ-ND1 3.87Å; F530-H534 PolarHBondContact O-N 2.95Å; F530-H534 VanDerWaalsContact O-N 3.14Å; F530-H534 PolarHBondContact O-ND1 2.9Å; R532-H534 VanDerWaalsContact C-N 3.28Å; R532-H534 PolarHBondContact O-N 3.44Å; H534-I536 HydrophobicContact CB-CD1 4.1Å; H534-I536 HydrophobicContact CB-CG1 3.94Å; H534-I536 PolarHBondContact O-N 2.74Å; H534-I536 VanDerWaalsContact O-N 3.15Å
535	N	90.2	Very high	85.3	Confident	111 Å²	111	73.3 Å²	73.3	59%	0.594	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	34.4	177.6	-162.5	38.2	0	0	0	114.5	K525 L531 R532 E537	K525-N535 PolarHBondContact NZ-OD1 2.69Å; L531-N535 PolarHBondContact O-N 3.4Å; R532-N535 PolarHBondContact O-N 3.32Å; R532-N535 VanDerWaalsContact O-N 3.17Å; N535-E537 PolarHBondContact O-N 2.93Å
536	I	90.3	Very high	83.4	Confident	23 Å²	23	78.8 Å²	78.8	12%	0.118	37%	0.365	C	S	.	.			trans	-74.9	123	-176	-57.6	179.3	0	0	0	109.7	I489 K525 F530 L531 H534 T538	I489-I536 HydrophobicContact CB-CD1 4.37Å; I489-I536 HydrophobicContact CD1-CD1 3.9Å; I489-I536 HydrophobicContact CG1-CD1 3.72Å; I489-I536 HydrophobicContact CG2-CD1 3.84Å; I489-I536 HydrophobicContact CG2-CG2 4.43Å; K525-I536 WeakPolarHBondContact CE-O 3.22Å; F530-I536 HydrophobicContact CE1-CD1 4.29Å; L531-I536 HydrophobicContact CD2-CB 4.25Å; L531-I536 HydrophobicContact CD2-CD1 3.97Å; L531-I536 HydrophobicContact CD2-CG2 4.39Å; L531-I536 PolarHBondContact O-N 2.99Å; H534-I536 HydrophobicContact CB-CD1 4.1Å; H534-I536 HydrophobicContact CB-CG1 3.94Å; H534-I536 PolarHBondContact O-N 2.74Å; H534-I536 VanDerWaalsContact O-N 3.15Å; I536-T538 HydrophobicContact CG2-CG2 4.19Å
537	E	92.1	Very high	81.6	Confident	94 Å²	94	75.2 Å²	75.2	44%	0.439	35%	0.35	S	S	.	.			trans	-79.9	137	172.9	-72.7	179.1	-162.9	0	0	111.1	K507 N535 Y539	K507-E537 HydrophobicContact CB-CB 3.89Å; K507-E537 PolarHBondContact N-O 3.26Å; N535-E537 PolarHBondContact O-N 2.93Å; E537-Y539 HydrophobicContact CB-CE2 4.33Å; E537-Y539 PolarHBondContact OE2-OH 3.31Å
538	T	94.1	Very high	79.8	Confident	12 Å²	12	72.1 Å²	72.1	7%	0.074	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	147.2	-171.2	73.3	0	0	0	0	112	L493 H504 I505 G522 G524 L531 I536	L493-T538 HydrophobicContact CD2-CG2 3.46Å; L493-T538 VanDerWaalsContact CD2-CG2 3.46Å; H504-T538 WeakPolarHBondContact NE2-CB 3.44Å; H504-T538 PolarHBondContact NE2-OG1 2.86Å; H504-T538 VanDerWaalsContact NE2-OG1 3.16Å; I505-T538 CarbonylContact O-C 3.59Å; I505-T538 WeakPolarHBondContact O-CA 3.47Å; G522-T538 WeakPolarHBondContact CA-O 3.48Å; G522-T538 PolarHBondContact N-O 2.72Å; G524-T538 PolarHBondContact N-OG1 3.19Å; G524-T538 VanDerWaalsContact N-OG1 3.09Å; L531-T538 HydrophobicContact CD1-CG2 4.28Å; I536-T538 HydrophobicContact CG2-CG2 4.19Å
539	Y	94.4	Very high	77.7	Confident	45 Å²	45	78.6 Å²	78.6	18%	0.176	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	159.3	-176.3	-56	-94.7	0	0	0	110.1	H504 I505 K507 L510 V519 E520 E537	H504-Y539 PolarHBondContact CD2-O 3.32Å; I505-Y539 PolarHBondContact N-O 2.94Å; I505-Y539 PolarHBondContact O-N 2.85Å; K507-Y539 HydrophobicContact CB-CE2 3.96Å; K507-Y539 HydrophobicContact CD-CE2 3.74Å; K507-Y539 HydrophobicContact CG-CE2 4.4Å; L510-Y539 HydrophobicContact CB-CD2 4.42Å; L510-Y539 HydrophobicContact CD2-CD1 3.96Å; L510-Y539 HydrophobicContact CD2-CD2 3.69Å; L510-Y539 HydrophobicContact CD2-CE1 4.01Å; L510-Y539 HydrophobicContact CD2-CE2 3.79Å; L510-Y539 HydrophobicContact CD2-CG 3.81Å; V519-Y539 HydrophobicContact CG2-CD1 4.33Å; E520-Y539 CarbonylContact O-C 3.47Å; E520-Y539 WeakPolarHBondContact O-CA 3.28Å; E520-Y539 WeakPolarHBondContact O-CB 3.21Å; E537-Y539 HydrophobicContact CB-CE2 4.33Å; E537-Y539 PolarHBondContact OE2-OH 3.31Å
540	L	93.1	Very high	75.6	Confident	3 Å²	3	79.1 Å²	79.1	2%	0.016	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	129.7	172.7	-67.3	157.2	0	0	0	108.6	I498 R502 I503 H504 V519 E520	I498-L540 HydrophobicContact CD1-CD1 3.67Å; I498-L540 HydrophobicContact CG1-CD1 4.38Å; R502-L540 HydrophobicContact CB-CB 4.37Å; R502-L540 HydrophobicContact CB-CD2 3.95Å; I503-L540 WeakPolarHBondContact O-CA 3.13Å; H504-L540 HydrophobicContact CB-CD2 3.82Å; V519-L540 CarbonylContact C-O 3.53Å; V519-L540 VanDerWaalsContact CA-O 3.29Å; V519-L540 WeakPolarHBondContact CA-O 3.43Å; E520-L540 HydrophobicContact CG-CB 3.67Å; E520-L540 HydrophobicContact CG-CD1 4.4Å; E520-L540 PolarHBondContact N-O 3.11Å; E520-L540 PolarHBondContact O-N 3.18Å
541	I	91	Very high	73.7	Confident	3 Å²	3	81.5 Å²	81.5	2%	0.015	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	127.2	174.5	-61.3	177.1	0	0	0	108.8	V436 I503 I505 L513 Y517 V519	V436-I541 HydrophobicContact CB-CD1 4.27Å; V436-I541 HydrophobicContact CG1-CD1 3.53Å; V436-I541 HydrophobicContact CG2-CD1 3.65Å; I503-I541 HydrophobicContact CB-CB 4.33Å; I503-I541 HydrophobicContact CB-CD1 4.39Å; I503-I541 PolarHBondContact O-N 3.33Å; I505-I541 HydrophobicContact CD1-CD1 4.12Å; I505-I541 HydrophobicContact CD1-CG1 3.85Å; I505-I541 HydrophobicContact CG1-CG1 4.38Å; I505-I541 HydrophobicContact CG2-CD1 3.76Å; I505-I541 HydrophobicContact CG2-CG1 4.06Å; L513-I541 HydrophobicContact CD1-CD1 4.31Å; Y517-I541 HydrophobicContact CD1-CG2 4.26Å; V519-I541 HydrophobicContact CG1-CG1 4.1Å
542	K	80.1	Confident	71.7	Confident	99 Å²	99	84 Å²	84	43%	0.43	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-87.6	138.8	173.5	-76.2	179.8	168.3	161.8	0	110.3	E518 E520	E518-K542 HydrophobicContact CB-CB 4.33Å; E518-K542 PolarHBondContact O-N 3.42Å; E520-K542 HydrophobicContact CB-CD 4.38Å; E520-K542 HydrophobicContact CG-CG 4.29Å; E520-K542 WeakPolarHBondContact OE2-CE 3.47Å; E520-K542 IonicContact OE2-NZ 3.45Å; E520-K542 PolarHBondContact OE2-NZ 3.43Å
543	Q	68.5	Low	69.5	Low	37 Å²	37	84.4 Å²	84.4	17%	0.173	42%	0.419	C	S	.	.	P	Polyproline II helix	trans	-102.6	142.8	162.8	-80.2	-165.5	-30	0	0	110.3	L440	L440-Q543 HydrophobicContact CD2-CG 3.9Å
544	P	57.1	Low	67.6	Low	83 Å²	83	80.8 Å²	80.8	54%	0.539	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-64.5	133.3	172.5	-13.5	25.6	0	0	0	110.9	E546 S547	P544-E546 PolarHBondContact O-N 3.21Å; P544-E546 VanDerWaalsContact O-N 3.07Å; P544-S547 PolarHBondContact O-N 3Å; P544-S547 VanDerWaalsContact O-N 3.1Å; P544-S547 PolarHBondContact O-OG 3.4Å
545	E	48.8	Very low	65.7	Low	164 Å²	164	78.6 Å²	78.6	77%	0.766	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-58.3	-23.8	-176.6	-76.6	-176	149.6	0	0	114	S547 L548	E545-S547 VanDerWaalsContact C-N 3.33Å; E545-S547 PolarHBondContact O-N 2.99Å; E545-L548 VanDerWaalsContact CA-CD1 3.47Å; E545-L548 HydrophobicContact CB-CD1 3.9Å; E545-L548 HydrophobicContact CG-CD1 3.82Å; E545-L548 WeakPolarHBondContact O-CB 3.31Å; E545-L548 WeakPolarHBondContact O-CD1 3.4Å; E545-L548 VanDerWaalsContact O-CG 3.22Å; E545-L548 WeakPolarHBondContact O-CG 3.46Å; E545-L548 PolarHBondContact O-N 3.14Å
546	E	45.5	Very low	63.6	Low	174 Å²	174	78.9 Å²	78.9	81%	0.813	41%	0.405	S	S	*	.	G	3₁₀ helix	trans	-68.5	-27.5	178.1	-73.8	-176.8	155.3	0	0	113.7	P544 L548	P544-E546 PolarHBondContact O-N 3.21Å; P544-E546 VanDerWaalsContact O-N 3.07Å; E546-L548 PolarHBondContact O-N 3.39Å
547	S	51	Low	61.4	Low	50 Å²	50	84.5 Å²	84.5	35%	0.35	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-74.8	-7.2	174.6	68.2	0	0	0	0	113.6	P544 E545	P544-S547 PolarHBondContact O-N 3Å; P544-S547 VanDerWaalsContact O-N 3.1Å; P544-S547 PolarHBondContact O-OG 3.4Å; E545-S547 VanDerWaalsContact C-N 3.33Å; E545-S547 PolarHBondContact O-N 2.99Å
548	L	49.4	Very low	59.1	Low	36 Å²	36	85.2 Å²	85.2	19%	0.188	43%	0.432	C	S	.	.	G	3₁₀ helix	trans	-80.8	-23	-177.6	-55.9	174.8	0	0	0	113.2	R447 W501 E545 E546	R447-L548 PolarHBondContact NH1-O 3.46Å; R447-L548 VanDerWaalsContact NH1-O 3.12Å; R447-L548 PolarHBondContact NH2-O 3.12Å; W501-L548 HydrophobicContact CD2-CD2 3.46Å; W501-L548 VanDerWaalsContact CD2-CD2 3.46Å; W501-L548 HydrophobicContact CE3-CD2 3.5Å; W501-L548 HydrophobicContact CG-CD2 4.03Å; W501-L548 HydrophobicContact CH2-CB 4.47Å; W501-L548 HydrophobicContact CH2-CD2 3.39Å; W501-L548 HydrophobicContact CZ2-CD2 3.53Å; W501-L548 HydrophobicContact CZ3-CD2 3.48Å; W501-L548 VanDerWaalsContact CZ3-CD2 3.48Å; E545-L548 VanDerWaalsContact CA-CD1 3.47Å; E545-L548 HydrophobicContact CB-CD1 3.9Å; E545-L548 HydrophobicContact CG-CD1 3.82Å; E545-L548 WeakPolarHBondContact O-CB 3.31Å; E545-L548 WeakPolarHBondContact O-CD1 3.4Å; E545-L548 VanDerWaalsContact O-CG 3.22Å; E545-L548 WeakPolarHBondContact O-CG 3.46Å; E545-L548 PolarHBondContact O-N 3.14Å; E546-L548 PolarHBondContact O-N 3.39Å
549	L	46.3	Very low	56.6	Low	159 Å²	159	86.5 Å²	86.5	83%	0.832	44%	0.444	S	S	*	.	S	Bend	trans	-96.2	-17.2	-172.1	-72.6	166.8	0	0	0	114.1
550	T	45.9	Very low	54	Low	99 Å²	99	87.2 Å²	87.2	61%	0.607	46%	0.459	S	S	*	.			trans	-98.6	106.2	176.8	46.4	0	0	0	0	110.1
551	L	51.4	Low	51.4	Low	89 Å²	89	91.2 Å²	91.2	47%	0.466	49%	0.487	S	S	.	.			trans	-60.5	130.9	155.2	-80.9	154.8	0	0	0	106.7	E553	L551-E553 PolarHBondContact O-N 2.95Å
552	P	47.7	Very low	48.9	Very low	51 Å²	51	94 Å²	94	33%	0.331	51%	0.507	S	S	.	.			trans	-53.1	128.7	176.9	-24.2	31.7	0	0	0	110.6	D554 I555 M556	P552-D554 PolarHBondContact O-N 3.31Å; P552-D554 VanDerWaalsContact O-N 3.07Å; P552-I555 HydrophobicContact CB-CD1 4.23Å; P552-I555 HydrophobicContact CB-CG1 4.25Å; P552-I555 HydrophobicContact CG-CD1 3.95Å; P552-I555 PolarHBondContact O-N 2.9Å; P552-M556 PolarHBondContact O-N 3.37Å
553	E	45.3	Very low	46.9	Very low	151 Å²	151	92.4 Å²	92.4	71%	0.706	51%	0.512	S	S	*	.	H	α-helix	trans	-54.1	-28.8	179.4	-78.7	-172	148.8	0	0	112.6	L551 I555 M556 K557	L551-E553 PolarHBondContact O-N 2.95Å; E553-I555 VanDerWaalsContact C-N 3.33Å; E553-I555 PolarHBondContact O-N 3.17Å; E553-M556 PolarHBondContact O-N 3.3Å; E553-K557 PolarHBondContact O-N 3Å
554	D	47.9	Very low	45.2	Very low	124 Å²	124	98.2 Å²	98.2	66%	0.663	54%	0.544	S	S	*	.	H	α-helix	trans	-66.2	-32.6	177.8	-65.9	-33	0	0	0	113	P552	P552-D554 PolarHBondContact O-N 3.31Å; P552-D554 VanDerWaalsContact O-N 3.07Å
555	I	49.6	Very low	44.2	Very low	44 Å²	44	104.9 Å²	104.9	23%	0.226	56%	0.558	C	S	.	*	H	α-helix	trans	-79.5	-30.2	175.5	-60.2	178.3	0	0	0	110.7	Y448 P552 E553 E558 A559	Y448-I555 HydrophobicContact CD2-CG2 3.18Å; Y448-I555 HydrophobicContact CE2-CG2 3.26Å; Y448-I555 HydrophobicContact CG-CG2 4.1Å; P552-I555 HydrophobicContact CB-CD1 4.23Å; P552-I555 HydrophobicContact CB-CG1 4.25Å; P552-I555 HydrophobicContact CG-CD1 3.95Å; P552-I555 PolarHBondContact O-N 2.9Å; E553-I555 VanDerWaalsContact C-N 3.33Å; E553-I555 PolarHBondContact O-N 3.17Å; I555-E558 PolarHBondContact O-N 3.24Å; I555-A559 PolarHBondContact O-N 2.86Å
556	M	45.7	Very low	43.5	Very low	117 Å²	117	107.6 Å²	107.6	58%	0.576	56%	0.562	S	S	*	*	H	α-helix	trans	-73.5	-29.7	177	-141.7	165.2	81	0	0	112.1	P552 E553 A559 A560	P552-M556 PolarHBondContact O-N 3.37Å; E553-M556 PolarHBondContact O-N 3.3Å; M556-A559 PolarHBondContact O-N 3.45Å; M556-A560 VanDerWaalsContact O-CB 3.31Å; M556-A560 WeakPolarHBondContact O-CB 3.47Å; M556-A560 PolarHBondContact O-N 3.48Å
557	K	45	Very low	42.9	Very low	141 Å²	141	104.1 Å²	104.1	61%	0.613	56%	0.563	S	S	*	*	H	α-helix	trans	-65.1	-37.1	170.7	-83.2	175.8	-179.8	163.1	0	113.3	E553 S561	E553-K557 PolarHBondContact O-N 3Å; K557-S561 WeakPolarHBondContact O-CB 3.16Å; K557-S561 PolarHBondContact O-N 3.4Å; K557-S561 PolarHBondContact O-OG 2.89Å
558	E	43.4	Very low	41.9	Very low	109 Å²	109	106.8 Å²	106.8	51%	0.509	58%	0.582	S	S	.	*	H	α-helix	trans	-68.5	-36.5	171	-89.3	-170.4	158.2	0	0	112.4	I555 S561 S562	I555-E558 PolarHBondContact O-N 3.24Å; E558-S561 PolarHBondContact O-OG 3.48Å; E558-S562 PolarHBondContact O-N 3.43Å
559	A	40.5	Very low	41.4	Very low	39 Å²	39	111 Å²	111	32%	0.322	61%	0.614	S	S	.	*	H	α-helix	trans	-69.2	-41.1	175.4	0	0	0	0	0	112.2	I555 M556 S562 A563	I555-A559 PolarHBondContact O-N 2.86Å; M556-A559 PolarHBondContact O-N 3.45Å; A559-S562 PolarHBondContact O-N 3.4Å; A559-S562 PolarHBondContact O-OG 3.42Å; A559-A563 PolarHBondContact O-N 2.88Å
560	A	40.4	Very low	40.5	Very low	59 Å²	59	107.7 Å²	107.7	49%	0.488	61%	0.61	S	S	.	*	H	α-helix	trans	-70.2	-39.1	179.8	0	0	0	0	0	112.8	M556 S562 A563	M556-A560 VanDerWaalsContact O-CB 3.31Å; M556-A560 WeakPolarHBondContact O-CB 3.47Å; M556-A560 PolarHBondContact O-N 3.48Å; A560-S562 PolarHBondContact O-N 3.22Å; A560-A563 PolarHBondContact O-N 2.99Å; A560-A563 VanDerWaalsContact O-N 3.08Å
561	S	39.8	Very low	39.7	Very low	87 Å²	87	109.4 Å²	109.4	61%	0.608	62%	0.62	S	S	*	*	H	α-helix	trans	-65.7	-20.3	175.1	67.8	0	0	0	0	113.3	K557 E558	K557-S561 WeakPolarHBondContact O-CB 3.16Å; K557-S561 PolarHBondContact O-N 3.4Å; K557-S561 PolarHBondContact O-OG 2.89Å; E558-S561 PolarHBondContact O-OG 3.48Å
562	S	38.1	Very low	38.4	Very low	63 Å²	63	114.4 Å²	114.4	44%	0.441	64%	0.638	S	S	.	*	H	α-helix	trans	-87.6	-17.6	173.5	78.5	0	0	0	0	114.5	E558 A559 A560	E558-S562 PolarHBondContact O-N 3.43Å; A559-S562 PolarHBondContact O-N 3.4Å; A559-S562 PolarHBondContact O-OG 3.42Å; A560-S562 PolarHBondContact O-N 3.22Å
563	A	37.5	Very low	37.3	Very low	64 Å²	64	118.9 Å²	118.9	53%	0.529	66%	0.659	S	S	.	*	H	α-helix	trans	-84.1	-29.9	-176.6	0	0	0	0	0	113.2	A559 A560 R565	A559-A563 PolarHBondContact O-N 2.88Å; A560-A563 PolarHBondContact O-N 2.99Å; A560-A563 VanDerWaalsContact O-N 3.08Å; A563-R565 PolarHBondContact O-N 2.97Å; A563-R565 VanDerWaalsContact O-N 3.14Å
564	D	33.1	Very low	36.6	Very low	159 Å²	159	121.2 Å²	121.2	85%	0.85	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	4.9	-177.6	-97.4	-9.3	0	0	0	115.3
565	R	35.9	Very low	35.7	Very low	223 Å²	223	119.7 Å²	119.7	84%	0.842	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	14.5	177.4	-77.5	-168.8	171.8	-175.6	-0	115.2	A563	A563-R565 PolarHBondContact O-N 2.97Å; A563-R565 VanDerWaalsContact O-N 3.14Å
566	R	33.8	Very low	34.5	Very low	222 Å²	222	123.2 Å²	123.2	84%	0.838	70%	0.704	S	S	*	*			trans	-111.1	69.8	178.3	-73.7	-173.6	-179	167.6	1.6	112.9
567	A	33.1	Very low	33.9	Very low	101 Å²	101	124.9 Å²	124.9	84%	0.835	70%	0.704	S	S	*	*	S	Bend	trans	-153.4	57.9	157.8	0	0	0	0	0	111.6
568	S	30.6	Very low	33	Very low	106 Å²	106	122.6 Å²	122.6	74%	0.741	71%	0.705	S	S	*	*	S	Bend	trans	-168.3	126.3	158.9	46.2	0	0	0	0	109.7	A570	S568-A570 PolarHBondContact O-N 2.96Å
569	S	38.9	Very low	32.4	Very low	125 Å²	125	121.5 Å²	121.5	87%	0.874	71%	0.708	S	S	*	*			trans	-45.5	120.9	177.8	57.4	0	0	0	0	112.8
570	A	26.6	Very low	32	Very low	89 Å²	89	125.6 Å²	125.6	74%	0.736	72%	0.72	S	S	*	*			trans	-158.9	132.3	166.9	0	0	0	0	0	111.7	S568	S568-A570 PolarHBondContact O-N 2.96Å
571	T	29	Very low	31.7	Very low	134 Å²	134	127.3 Å²	127.3	82%	0.822	72%	0.721	S	S	*	*			trans	-39.9	129	162.4	-26.6	0	0	0	0	110.9	N573	T571-N573 PolarHBondContact O-N 3.36Å
572	F	24.7	Very low	31.5	Very low	195 Å²	195	128.4 Å²	128.4	86%	0.855	73%	0.726	S	S	*	*			trans	-67.3	97.8	-175.3	-142	-95.3	0	0	0	109.8
573	N	25.4	Very low	31.6	Very low	145 Å²	145	129.6 Å²	129.6	78%	0.775	72%	0.723	S	S	*	*			trans	-81	124.4	172.7	-95	-5.9	0	0	0	110.3	T571 A575	T571-N573 PolarHBondContact O-N 3.36Å; N573-A575 PolarHBondContact O-N 3.11Å
574	E	30	Very low	31.5	Very low	200 Å²	200	130.1 Å²	130.1	94%	0.935	72%	0.717	S	S	*	*	S	Bend	trans	-73	49.8	-175.3	-154.7	172.8	-157.2	0	0	113.1
575	A	27.7	Very low	31.7	Very low	92 Å²	92	130.7 Å²	130.7	76%	0.76	72%	0.72	S	S	*	*			trans	-133.3	25.1	-164.6	0	0	0	0	0	116.6	N573	N573-A575 PolarHBondContact O-N 3.11Å
576	S	26.1	Very low	31.9	Very low	118 Å²	118	126.8 Å²	126.8	83%	0.825	71%	0.714	S	S	*	*	S	Bend	trans	-123.7	10.4	-176.1	-167	0	0	0	0	116.2
577	W	33	Very low	32	Very low	152 Å²	152	118.3 Å²	118.3	58%	0.576	69%	0.687	S	S	*	*			trans	-130.2	103	176.2	-134	85.5	0	0	0	109.8	E394 A397	E394-W577 HydrophobicContact CG-CZ2 4.08Å; A397-W577 HydrophobicContact CB-CH2 4.3Å
578	S	25.8	Very low	32.1	Very low	93 Å²	93	116.4 Å²	116.4	65%	0.65	68%	0.677	S	S	*	*			trans	-107.3	129.5	163.5	50.1	0	0	0	0	107.5	E580	S578-E580 PolarHBondContact O-N 3.24Å
579	P	30.7	Very low	32.1	Very low	86 Å²	86	118.3 Å²	118.3	56%	0.558	68%	0.679	S	S	*	*			trans	-60.3	114.3	166.6	-8.6	22.2	0	0	0	106.9	L581	P579-L581 PolarHBondContact O-N 3.47Å
580	E	32	Very low	32.1	Very low	124 Å²	124	121.1 Å²	121.1	58%	0.579	68%	0.679	S	S	*	*			trans	-60.3	111.4	167.1	-76.8	-178.6	-170.7	0	0	106.8	R401 S578	R401-E580 IonicContact CZ-OE2 3.2Å; R401-E580 IonicContact NH2-OE1 3.81Å; R401-E580 IonicContact NH2-OE2 3.83Å; R401-E580 PolarHBondContact NH2-OE2 3.39Å; S578-E580 PolarHBondContact O-N 3.24Å
581	L	34.6	Very low	32.6	Very low	96 Å²	96	121.1 Å²	121.1	50%	0.503	67%	0.666	S	S	.	*			trans	-65.2	144.4	171.4	-75.8	150.1	0	0	0	107.2	P579 F583 L596	P579-L581 PolarHBondContact O-N 3.47Å; L581-F583 PolarHBondContact O-N 3.41Å; L581-L596 HydrophobicContact CD1-CD1 4.32Å; L581-L596 HydrophobicContact CD1-CD2 4.14Å
582	P	35.7	Very low	33.1	Very low	110 Å²	110	117.1 Å²	117.1	71%	0.714	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	15.4	-174.8	-19.2	30.6	0	0	0	116.3
583	F	39.6	Very low	33.5	Very low	88 Å²	88	114.8 Å²	114.8	39%	0.386	64%	0.637	S	S	.	*	T	Hydrogen-bonded Turn	trans	-131.1	14.7	-166.5	-53.6	-67.7	0	0	0	114.2	L581 N585 I586	L581-F583 PolarHBondContact O-N 3.41Å; F583-N585 PolarHBondContact O-N 3.31Å; F583-N585 VanDerWaalsContact O-N 3.13Å; F583-I586 PolarHBondContact O-N 2.69Å; F583-I586 VanDerWaalsContact O-N 3.13Å
584	D	34.7	Very low	34.1	Very low	74 Å²	74	110.1 Å²	110.1	40%	0.396	62%	0.619	S	S	.	*	G	3₁₀ helix	trans	-59.3	-24.8	179.4	-93.5	-14.4	0	0	0	113.3	I586	D584-I586 VanDerWaalsContact C-N 3.29Å; D584-I586 PolarHBondContact O-N 3.18Å
585	N	38	Very low	34.4	Very low	172 Å²	172	102.6 Å²	102.6	92%	0.92	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-77.4	-5.7	179.2	-72.3	-19.8	0	0	0	114.9	F583	F583-N585 PolarHBondContact O-N 3.31Å; F583-N585 VanDerWaalsContact O-N 3.13Å
586	I	39.1	Very low	34.7	Very low	141 Å²	141	103.5 Å²	103.5	72%	0.723	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-104	-14.9	-177.7	-60.3	176.3	0	0	0	112.2	F583 D584	F583-I586 PolarHBondContact O-N 2.69Å; F583-I586 VanDerWaalsContact O-N 3.13Å; D584-I586 VanDerWaalsContact C-N 3.29Å; D584-I586 PolarHBondContact O-N 3.18Å
587	V	36.9	Very low	35.1	Very low	44 Å²	44	100 Å²	100	27%	0.267	56%	0.556	S	S	.	*	S	Bend	trans	-136.5	109.3	-174.4	-175.1	0	0	0	0	110.8	N591	V587-N591 HydrophobicContact CG1-CB 4.46Å
588	G	34.3	Very low	35.5	Very low	61 Å²	61	98.8 Å²	98.8	63%	0.629	55%	0.551	S	S	*	*			trans	-47.7	142.5	178.8	0	0	0	0	0	114.5	Q590	G588-Q590 PolarHBondContact O-N 2.81Å
589	N	31.5	Very low	36.1	Very low	146 Å²	146	99.4 Å²	99.4	78%	0.781	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52	5.6	-165.2	-115	-9.5	0	0	0	119.5
590	Q	38	Very low	36.3	Very low	184 Å²	184	97.8 Å²	97.8	86%	0.86	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.4	-10	-173.6	-71.2	-175.2	-17.4	0	0	114.9	G588	G588-Q590 PolarHBondContact O-N 2.81Å
591	N	38.9	Very low	36.6	Very low	88 Å²	88	95.4 Å²	95.4	47%	0.471	53%	0.529	S	S	.	.	S	Bend	trans	-108.3	-5.9	-174	-71.5	-31.4	0	0	0	115	V587	V587-N591 HydrophobicContact CG1-CB 4.46Å
592	T	38.3	Very low	36.8	Very low	50 Å²	50	98.6 Å²	98.6	31%	0.307	55%	0.546	S	S	.	.	H	α-helix	trans	-75.8	-38.5	-173.3	39.2	0	0	0	0	113.4	A594 A595 L596	T592-A594 VanDerWaalsContact C-N 3.32Å; T592-A594 PolarHBondContact O-N 3.29Å; T592-A595 PolarHBondContact O-N 3.07Å; T592-L596 PolarHBondContact O-N 2.79Å
593	L	34.1	Very low	37	Very low	146 Å²	146	101.1 Å²	101.1	76%	0.764	55%	0.553	S	S	*	*	H	α-helix	trans	-66.9	-32	-178.3	-152.6	84.6	0	0	0	113.2	T597	L593-T597 PolarHBondContact O-OG1 3.43Å
594	A	37.5	Very low	36.6	Very low	48 Å²	48	99.6 Å²	99.6	40%	0.397	55%	0.548	S	S	.	.	H	α-helix	trans	-83	-19	-179	0	0	0	0	0	113.7	T592	T592-A594 VanDerWaalsContact C-N 3.32Å; T592-A594 PolarHBondContact O-N 3.29Å
595	A	35.7	Very low	36.5	Very low	41 Å²	41	100.7 Å²	100.7	34%	0.339	56%	0.56	S	S	.	*	H	α-helix	trans	-86.8	-34.7	-179.3	0	0	0	0	0	112.5	T592	T592-A595 PolarHBondContact O-N 3.07Å
596	L	34.2	Very low	36.4	Very low	111 Å²	111	99.1 Å²	99.1	58%	0.581	55%	0.551	S	S	*	*	H	α-helix	trans	-81.1	-26.7	-177.8	-75.6	164.6	0	0	0	113.7	L581 T592 R598	L581-L596 HydrophobicContact CD1-CD1 4.32Å; L581-L596 HydrophobicContact CD1-CD2 4.14Å; T592-L596 PolarHBondContact O-N 2.79Å; L596-R598 VanDerWaalsContact C-N 3.32Å; L596-R598 PolarHBondContact O-N 2.99Å
597	T	34.1	Very low	36.3	Very low	44 Å²	44	100.8 Å²	100.8	27%	0.27	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.5	-9.8	178.4	30.4	0	0	0	0	114.5	L593 I601 L612	L593-T597 PolarHBondContact O-OG1 3.43Å; T597-I601 VanDerWaalsContact O-CG1 3.31Å; T597-I601 WeakPolarHBondContact O-CG1 3.45Å; T597-L612 HydrophobicContact CG2-CD1 4.09Å; T597-L612 HydrophobicContact CG2-CD2 3.78Å
598	R	41.1	Very low	36	Very low	127 Å²	127	103.7 Å²	103.7	48%	0.479	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.8	-23.4	-180	-80.6	-174.3	-178.9	126.5	2.8	114.5	L596 S616	L596-R598 VanDerWaalsContact C-N 3.32Å; L596-R598 PolarHBondContact O-N 2.99Å; R598-S616 PolarHBondContact NH2-OG 3.48Å
599	N	38.6	Very low	35.9	Very low	106 Å²	106	101.9 Å²	101.9	57%	0.567	55%	0.548	S	S	*	.	S	Bend	trans	-94.8	-13.5	-176.6	-75.7	-8.7	0	0	0	114.4	R322	R322-N599 VanDerWaalsContact CZ-OD1 3.28Å; R322-N599 PolarHBondContact NH1-ND2 2.96Å; R322-N599 PolarHBondContact NH1-OD1 3.28Å; R322-N599 VanDerWaalsContact NH2-CG 3.26Å; R322-N599 PolarHBondContact NH2-ND2 3.47Å; R322-N599 PolarHBondContact NH2-OD1 2.86Å
600	S	35.8	Very low	35.9	Very low	53 Å²	53	102.6 Å²	102.6	37%	0.371	55%	0.547	S	S	.	.			trans	-107.2	19.2	-176.1	60.8	0	0	0	0	113.7	N602 L603	S600-N602 PolarHBondContact O-N 3.21Å; S600-L603 PolarHBondContact O-N 2.8Å
601	I	37.5	Very low	35.6	Very low	74 Å²	74	96.8 Å²	96.8	38%	0.379	53%	0.53	S	S	.	.	G	3₁₀ helix	trans	-68.9	-19.1	-176.4	-63.3	177.8	0	0	0	112.2	T597 L603	T597-I601 VanDerWaalsContact O-CG1 3.31Å; T597-I601 WeakPolarHBondContact O-CG1 3.45Å; I601-L603 VanDerWaalsContact C-N 3.29Å; I601-L603 PolarHBondContact O-N 3.45Å
602	N	38.6	Very low	35.1	Very low	162 Å²	162	96.6 Å²	96.6	87%	0.866	53%	0.529	S	S	*	.	G	3₁₀ helix	trans	-82.5	-1.3	-178.6	-64.5	-14	0	0	0	114.3	S600	S600-N602 PolarHBondContact O-N 3.21Å
603	L	39.6	Very low	34.9	Very low	163 Å²	163	100.7 Å²	100.7	85%	0.853	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-121.6	4.6	-175.4	-95.8	144.2	0	0	0	114.1	S600 I601	S600-L603 PolarHBondContact O-N 2.8Å; I601-L603 VanDerWaalsContact C-N 3.29Å; I601-L603 PolarHBondContact O-N 3.45Å
604	L	31.6	Very low	34.9	Very low	57 Å²	57	97.8 Å²	97.8	30%	0.298	53%	0.532	S	S	.	.	S	Bend	trans	-102.6	139.4	-175.6	-118.7	115	0	0	0	112.4	N606 L608	L604-N606 PolarHBondContact O-N 3.43Å; L604-L608 HydrophobicContact CD2-CB 3.34Å; L604-L608 HydrophobicContact CD2-CD2 3.81Å; L604-L608 HydrophobicContact CD2-CG 4.2Å
605	P	34.1	Very low	34.7	Very low	97 Å²	97	103.5 Å²	103.5	63%	0.63	55%	0.55	S	S	*	*			trans	-57.6	135.6	174	-20.6	30.7	0	0	0	111.4	H607 L608	P605-H607 PolarHBondContact O-N 3.28Å; P605-L608 PolarHBondContact O-N 3.5Å
606	N	36	Very low	35	Very low	138 Å²	138	104.2 Å²	104.2	74%	0.738	55%	0.553	S	S	*	*	H	α-helix	trans	-48.3	-23.9	-171.8	-70.1	-15.1	0	0	0	115.7	L604	L604-N606 PolarHBondContact O-N 3.43Å
607	H	35	Very low	35.4	Very low	177 Å²	177	99.8 Å²	99.8	82%	0.819	53%	0.534	S	S	*	.	H	α-helix	trans	-78.8	-25.1	-180	-74	-79.8	0	0	0	115	P605	P605-H607 PolarHBondContact O-N 3.28Å
608	L	30.7	Very low	36.4	Very low	104 Å²	104	101.9 Å²	101.9	55%	0.545	55%	0.548	S	S	.	.	H	α-helix	trans	-92.2	-28.9	176.9	-115.5	96.8	0	0	0	112.8	L604 P605 Q610 A611 L612	L604-L608 HydrophobicContact CD2-CB 3.34Å; L604-L608 HydrophobicContact CD2-CD2 3.81Å; L604-L608 HydrophobicContact CD2-CG 4.2Å; P605-L608 PolarHBondContact O-N 3.5Å; L608-Q610 PolarHBondContact O-N 3.48Å; L608-A611 WeakPolarHBondContact O-CB 3.4Å; L608-A611 PolarHBondContact O-N 3.45Å; L608-L612 PolarHBondContact O-N 2.86Å
609	A	34	Very low	37	Very low	24 Å²	24	102.2 Å²	102.2	20%	0.198	56%	0.555	C	S	.	*	H	α-helix	trans	-60.3	-35	172.7	0	0	0	0	0	111.4	A611 L612 H613	A609-A611 PolarHBondContact O-N 3.44Å; A609-L612 PolarHBondContact O-N 3.48Å; A609-H613 PolarHBondContact O-CD2 3.47Å; A609-H613 PolarHBondContact O-N 3.5Å; A609-H613 VanDerWaalsContact O-N 3.17Å
610	Q	30.6	Very low	37.9	Very low	161 Å²	161	100.6 Å²	100.6	75%	0.752	54%	0.544	S	S	*	.	H	α-helix	trans	-64	-26	172.7	-155.9	96.8	24.2	0	0	113.1	L608 V614	L608-Q610 PolarHBondContact O-N 3.48Å; Q610-V614 VanDerWaalsContact O-CG2 3.32Å; Q610-V614 WeakPolarHBondContact O-CG2 3.48Å
611	A	31.2	Very low	39.1	Very low	62 Å²	62	100.9 Å²	100.9	51%	0.512	54%	0.541	S	S	.	.	H	α-helix	trans	-91.3	-28.5	-179.7	0	0	0	0	0	113.2	L608 A609 V614	L608-A611 WeakPolarHBondContact O-CB 3.4Å; L608-A611 PolarHBondContact O-N 3.45Å; A609-A611 PolarHBondContact O-N 3.44Å; A611-V614 WeakPolarHBondContact O-CB 3.28Å
612	L	29.7	Very low	40.4	Very low	84 Å²	84	98.4 Å²	98.4	44%	0.44	53%	0.528	S	S	.	.	H	α-helix	trans	-87.2	-22	179.6	-108.4	151.9	0	0	0	113.9	T597 L608 A609 V614	T597-L612 HydrophobicContact CG2-CD1 4.09Å; T597-L612 HydrophobicContact CG2-CD2 3.78Å; L608-L612 PolarHBondContact O-N 2.86Å; A609-L612 PolarHBondContact O-N 3.48Å; L612-V614 PolarHBondContact O-N 3.31Å; L612-V614 VanDerWaalsContact O-N 3.09Å
613	H	32.4	Very low	41.7	Very low	136 Å²	136	97 Å²	97	63%	0.63	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-6	166.3	-99.1	-76.1	0	0	0	113.9	A609	A609-H613 PolarHBondContact O-CD2 3.47Å; A609-H613 PolarHBondContact O-N 3.5Å; A609-H613 VanDerWaalsContact O-N 3.17Å
614	V	35.9	Very low	42.7	Very low	84 Å²	84	94.2 Å²	94.2	51%	0.509	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-12.8	-168.8	-179.7	0	0	0	0	114.1	Q610 A611 L612	Q610-V614 VanDerWaalsContact O-CG2 3.32Å; Q610-V614 WeakPolarHBondContact O-CG2 3.48Å; A611-V614 WeakPolarHBondContact O-CB 3.28Å; L612-V614 PolarHBondContact O-N 3.31Å; L612-V614 VanDerWaalsContact O-N 3.09Å
615	H	33	Very low	44.2	Very low	169 Å²	169	91.5 Å²	91.5	78%	0.782	48%	0.479	S	S	*	.	S	Bend	trans	-114.2	10.5	-171.2	-82	-62.1	0	0	0	118.7
616	S	41.4	Very low	45.6	Very low	56 Å²	56	89.9 Å²	89.9	39%	0.392	46%	0.463	S	S	.	.	S	Bend	trans	-109.6	59.2	144.2	65.3	0	0	0	0	108.5	R598	R598-S616 PolarHBondContact NH2-OG 3.48Å
617	G	43.4	Very low	46.8	Very low	17 Å²	17	85.8 Å²	85.8	18%	0.175	45%	0.445	C	S	.	.			trans	-57.5	159.4	179.6	0	0	0	0	0	111.4	E619 E620 I621	G617-E619 PolarHBondContact O-N 3.44Å; G617-E620 PolarHBondContact O-N 3.42Å; G617-I621 PolarHBondContact O-N 2.98Å
618	P	53.3	Low	48	Very low	89 Å²	89	78.9 Å²	78.9	58%	0.578	42%	0.419	S	S	*	.	H	α-helix	trans	-50.2	-25.2	171.2	21.7	-32.8	0	0	0	111.9	N622	P618-N622 WeakPolarHBondContact O-CB 3.49Å; P618-N622 PolarHBondContact O-N 2.92Å; P618-N622 PolarHBondContact O-ND2 3.32Å; P618-N622 PolarHBondContact O-OD1 3.02Å
619	E	54.7	Low	49.2	Very low	134 Å²	134	76.5 Å²	76.5	63%	0.626	41%	0.406	S	S	*	.	H	α-helix	trans	-65.6	-42.6	176.1	-62.7	-174.8	165.7	0	0	114.7	G617 N622 K623	G617-E619 PolarHBondContact O-N 3.44Å; E619-N622 PolarHBondContact O-N 2.89Å; E619-K623 WeakPolarHBondContact O-CB 3.49Å; E619-K623 PolarHBondContact O-N 3.37Å
620	E	58.3	Low	50.2	Low	71 Å²	71	80.9 Å²	80.9	33%	0.332	43%	0.426	S	S	.	.	H	α-helix	trans	-73	-37.6	178.3	177.9	58.7	-160.4	0	0	110.8	G617 K623 R624	G617-E620 PolarHBondContact O-N 3.42Å; E620-K623 PolarHBondContact O-N 3.34Å; E620-R624 WeakPolarHBondContact O-CG 3.06Å; E620-R624 PolarHBondContact O-N 3.28Å; E620-R624 IonicContact OE1-CZ 2.65Å; E620-R624 IonicContact OE1-NE 3.83Å; E620-R624 PolarHBondContact OE1-NE 3.13Å; E620-R624 IonicContact OE1-NH2 3.74Å; E620-R624 PolarHBondContact OE1-NH2 2.93Å
621	I	59.7	Low	50.9	Low	59 Å²	59	80.4 Å²	80.4	30%	0.303	43%	0.428	S	S	.	.	H	α-helix	trans	-62.2	-45.5	170.9	-66	172.5	0	0	0	109.7	G617 K623 R624 I625	G617-I621 PolarHBondContact O-N 2.98Å; I621-K623 VanDerWaalsContact C-N 3.32Å; I621-K623 PolarHBondContact O-N 3.16Å; I621-R624 PolarHBondContact O-N 3.12Å; I621-I625 HydrophobicContact CG2-CD1 3.51Å; I621-I625 HydrophobicContact CG2-CG1 4.26Å; I621-I625 WeakPolarHBondContact O-CB 3.5Å; I621-I625 WeakPolarHBondContact O-CD1 3.45Å; I621-I625 WeakPolarHBondContact O-CG1 3.44Å; I621-I625 PolarHBondContact O-N 2.99Å
622	N	65.6	Low	51.7	Low	22 Å²	22	83.7 Å²	83.7	12%	0.118	43%	0.427	C	S	.	.	H	α-helix	trans	-62.5	-38.1	176.5	-72.9	-23.2	0	0	0	111.8	P618 E619 I625 E626	P618-N622 WeakPolarHBondContact O-CB 3.49Å; P618-N622 PolarHBondContact O-N 2.92Å; P618-N622 PolarHBondContact O-ND2 3.32Å; P618-N622 PolarHBondContact O-OD1 3.02Å; E619-N622 PolarHBondContact O-N 2.89Å; N622-I625 PolarHBondContact O-N 3Å; N622-E626 VanDerWaalsContact O-CB 3.23Å; N622-E626 WeakPolarHBondContact O-CB 3.41Å; N622-E626 PolarHBondContact O-N 3.12Å
623	K	66.1	Low	52.8	Low	132 Å²	132	82 Å²	82	57%	0.574	42%	0.422	S	S	*	.	H	α-helix	trans	-68.1	-40.1	176.7	-170.6	-178.5	179.8	-173.9	0	112	E619 E620 I621 E626 S627	E619-K623 WeakPolarHBondContact O-CB 3.49Å; E619-K623 PolarHBondContact O-N 3.37Å; E620-K623 PolarHBondContact O-N 3.34Å; I621-K623 VanDerWaalsContact C-N 3.32Å; I621-K623 PolarHBondContact O-N 3.16Å; K623-E626 PolarHBondContact O-N 3.37Å; K623-S627 PolarHBondContact O-N 3.14Å; K623-S627 PolarHBondContact O-OG 3.49Å
624	R	60	Low	53.9	Low	105 Å²	105	76.7 Å²	76.7	40%	0.396	40%	0.404	S	S	.	.	H	α-helix	trans	-68.2	-40.4	173.1	-71.4	-175.6	-169.1	-168.4	-1.3	111.8	L314 E620 I621 E626 S627 A628	L314-R624 HydrophobicContact CD1-CB 4.31Å; E620-R624 WeakPolarHBondContact O-CG 3.06Å; E620-R624 PolarHBondContact O-N 3.28Å; E620-R624 IonicContact OE1-CZ 2.65Å; E620-R624 IonicContact OE1-NE 3.83Å; E620-R624 PolarHBondContact OE1-NE 3.13Å; E620-R624 IonicContact OE1-NH2 3.74Å; E620-R624 PolarHBondContact OE1-NH2 2.93Å; I621-R624 PolarHBondContact O-N 3.12Å; R624-E626 VanDerWaalsContact C-N 3.34Å; R624-S627 WeakPolarHBondContact CA-OG 3.35Å; R624-S627 PolarHBondContact O-N 3.03Å; R624-S627 PolarHBondContact O-OG 3.4Å; R624-A628 VanDerWaalsContact O-CB 3.24Å; R624-A628 WeakPolarHBondContact O-CB 3.35Å; R624-A628 PolarHBondContact O-N 2.91Å
625	I	63.5	Low	54.8	Low	1 Å²	1	76 Å²	76	1%	0.005	40%	0.397	C	S	.	.	H	α-helix	trans	-62.1	-43.3	172.7	-70.4	166	0	0	0	110.4	R307 I310 I621 N622 A628 I629	R307-I625 HydrophobicContact CG-CD1 3.74Å; I310-I625 HydrophobicContact CD1-CG2 4.45Å; I310-I625 HydrophobicContact CG2-CG1 3.91Å; I621-I625 HydrophobicContact CG2-CD1 3.51Å; I621-I625 HydrophobicContact CG2-CG1 4.26Å; I621-I625 WeakPolarHBondContact O-CB 3.5Å; I621-I625 WeakPolarHBondContact O-CD1 3.45Å; I621-I625 WeakPolarHBondContact O-CG1 3.44Å; I621-I625 PolarHBondContact O-N 2.99Å; N622-I625 PolarHBondContact O-N 3Å; I625-A628 PolarHBondContact O-N 3.3Å; I625-I629 HydrophobicContact CG2-CD1 3.53Å; I625-I629 HydrophobicContact CG2-CG1 4.18Å; I625-I629 WeakPolarHBondContact O-CB 3.37Å; I625-I629 WeakPolarHBondContact O-CG1 3.39Å; I625-I629 PolarHBondContact O-N 2.86Å
626	E	64	Low	56.1	Low	63 Å²	63	73.9 Å²	73.9	29%	0.294	39%	0.386	S	S	.	.	H	α-helix	trans	-59	-49.9	175.1	-176.8	166.7	-145.3	0	0	110.4	R125 N622 K623 R624 A628 I629 D630	R125-E626 IonicContact CZ-OE1 3.8Å; R125-E626 IonicContact NH1-OE1 2.88Å; R125-E626 PolarHBondContact NH1-OE1 2.97Å; R125-E626 IonicContact NH1-OE2 2.71Å; N622-E626 VanDerWaalsContact O-CB 3.23Å; N622-E626 WeakPolarHBondContact O-CB 3.41Å; N622-E626 PolarHBondContact O-N 3.12Å; K623-E626 PolarHBondContact O-N 3.37Å; R624-E626 VanDerWaalsContact C-N 3.34Å; E626-A628 VanDerWaalsContact C-N 3.31Å; E626-A628 PolarHBondContact O-N 2.88Å; E626-I629 PolarHBondContact O-N 3.25Å; E626-D630 PolarHBondContact O-N 2.92Å
627	S	60.6	Low	57	Low	51 Å²	51	72.9 Å²	72.9	36%	0.357	38%	0.376	S	S	.	.	H	α-helix	trans	-62.4	-35.3	174.7	73.2	0	0	0	0	113	K623 R624 D630 L631	K623-S627 PolarHBondContact O-N 3.14Å; K623-S627 PolarHBondContact O-OG 3.49Å; R624-S627 WeakPolarHBondContact CA-OG 3.35Å; R624-S627 PolarHBondContact O-N 3.03Å; R624-S627 PolarHBondContact O-OG 3.4Å; S627-D630 PolarHBondContact O-N 2.6Å; S627-L631 WeakPolarHBondContact O-CA 3.44Å; S627-L631 WeakPolarHBondContact O-CB 3.25Å; S627-L631 VanDerWaalsContact O-CD1 3.3Å; S627-L631 WeakPolarHBondContact O-CD1 3.45Å; S627-L631 WeakPolarHBondContact O-CG 3.22Å; S627-L631 PolarHBondContact O-N 3.21Å
628	A	59.3	Low	57.9	Low	33 Å²	33	75.5 Å²	75.5	27%	0.273	38%	0.38	S	S	.	.	H	α-helix	trans	-75.3	-35.5	-179	0	0	0	0	0	112.4	I310 R624 I625 E626 D630 R632	I310-A628 HydrophobicContact CG2-CB 4.16Å; R624-A628 VanDerWaalsContact O-CB 3.24Å; R624-A628 WeakPolarHBondContact O-CB 3.35Å; R624-A628 PolarHBondContact O-N 2.91Å; I625-A628 PolarHBondContact O-N 3.3Å; E626-A628 VanDerWaalsContact C-N 3.31Å; E626-A628 PolarHBondContact O-N 2.88Å; A628-D630 VanDerWaalsContact C-N 3.34Å; A628-R632 PolarHBondContact O-N 3.44Å
629	I	57.3	Low	58.5	Low	53 Å²	53	79.8 Å²	79.8	27%	0.272	39%	0.385	S	S	.	.	H	α-helix	trans	-65.3	-40	173.1	-70.1	169	0	0	0	110	I310 I625 E626	I310-I629 HydrophobicContact CD1-CD1 4.31Å; I310-I629 HydrophobicContact CD1-CG1 3.71Å; I625-I629 HydrophobicContact CG2-CD1 3.53Å; I625-I629 HydrophobicContact CG2-CG1 4.18Å; I625-I629 WeakPolarHBondContact O-CB 3.37Å; I625-I629 WeakPolarHBondContact O-CG1 3.39Å; I625-I629 PolarHBondContact O-N 2.86Å; E626-I629 PolarHBondContact O-N 3.25Å
630	D	53.8	Low	59.2	Low	117 Å²	117	77.9 Å²	77.9	63%	0.626	38%	0.376	S	S	*	.	H	α-helix	trans	-81.2	-45.1	-179	-74.9	-16.5	0	0	0	113.5	E626 S627 A628 R632	E626-D630 PolarHBondContact O-N 2.92Å; S627-D630 PolarHBondContact O-N 2.6Å; A628-D630 VanDerWaalsContact C-N 3.34Å; D630-R632 VanDerWaalsContact C-N 3.32Å; D630-R632 PolarHBondContact O-N 3.44Å
631	L	44.7	Very low	59.7	Low	150 Å²	150	77 Å²	77	79%	0.785	37%	0.372	S	S	*	.	H	α-helix	trans	-68.8	-27.3	-177.7	-75.7	160.8	0	0	0	112.9	S627	S627-L631 WeakPolarHBondContact O-CA 3.44Å; S627-L631 WeakPolarHBondContact O-CB 3.25Å; S627-L631 VanDerWaalsContact O-CD1 3.3Å; S627-L631 WeakPolarHBondContact O-CD1 3.45Å; S627-L631 WeakPolarHBondContact O-CG 3.22Å; S627-L631 PolarHBondContact O-N 3.21Å
632	R	49.8	Very low	60.4	Low	132 Å²	132	74.7 Å²	74.7	50%	0.498	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.3	61.4	176.8	-136.2	177.1	-163	-162.9	1.6	110	A628 D630 G634	A628-R632 PolarHBondContact O-N 3.44Å; D630-R632 VanDerWaalsContact C-N 3.32Å; D630-R632 PolarHBondContact O-N 3.44Å; R632-G634 PolarHBondContact O-N 3.15Å
633	S	52.4	Low	61	Low	49 Å²	49	78.5 Å²	78.5	34%	0.343	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-34.7	120.1	-176	65.5	0	0	0	0	112.2	D635 K636 L637	S633-D635 PolarHBondContact O-N 3.11Å; S633-K636 PolarHBondContact O-N 3.01Å; S633-K636 PolarHBondContact OG-N 3.15Å; S633-L637 PolarHBondContact O-N 3.3Å
634	G	55.3	Low	61.2	Low	23 Å²	23	77.8 Å²	77.8	24%	0.237	38%	0.384	C	S	.	.	H	α-helix	trans	-50.3	-25.1	172.9	0	0	0	0	0	112.3	R632 R638	R632-G634 PolarHBondContact O-N 3.15Å; G634-R638 WeakPolarHBondContact O-CB 3.35Å; G634-R638 PolarHBondContact O-N 3.46Å
635	D	55.5	Low	61.8	Low	70 Å²	70	78.4 Å²	78.4	37%	0.374	39%	0.39	S	S	.	.	H	α-helix	trans	-66.6	-27.6	173.5	-83.8	-5	0	0	0	114.8	K133 S633 R639	K133-D635 IonicContact NZ-OD1 2.75Å; K133-D635 IonicContact NZ-OD2 3.78Å; K133-D635 PolarHBondContact NZ-OD2 3.5Å; S633-D635 PolarHBondContact O-N 3.11Å; D635-R639 WeakPolarHBondContact O-CG 3.37Å; D635-R639 PolarHBondContact O-N 3.4Å; D635-R639 PolarHBondContact O-NE 3.36Å; D635-R639 VanDerWaalsContact O-NE 3.08Å
636	K	60.2	Low	62.3	Low	124 Å²	124	79.5 Å²	79.5	54%	0.539	40%	0.398	S	S	.	.	H	α-helix	trans	-78.4	-51.2	173	-174	174.8	178.9	-179.3	0	110.8	S633 R638 R639 E640	S633-K636 PolarHBondContact O-N 3.01Å; S633-K636 PolarHBondContact OG-N 3.15Å; K636-R638 VanDerWaalsContact C-N 3.27Å; K636-R638 PolarHBondContact O-N 3.1Å; K636-R639 PolarHBondContact O-N 2.91Å; K636-E640 WeakPolarHBondContact CE-OE1 3.49Å; K636-E640 WeakPolarHBondContact CG-OE1 3.04Å; K636-E640 PolarHBondContact O-N 3.48Å
637	L	59.4	Low	62.6	Low	36 Å²	36	76.6 Å²	76.6	19%	0.188	38%	0.384	C	S	.	.	H	α-helix	trans	-57.8	-39.5	176.2	-78.9	163	0	0	0	112.1	S633 E640 H641 V887	S633-L637 PolarHBondContact O-N 3.3Å; L637-E640 PolarHBondContact O-N 3.35Å; L637-H641 PolarHBondContact O-N 3.19Å; L637-H641 VanDerWaalsContact O-N 3.13Å; L637-H641 PolarHBondContact O-ND1 2.93Å; L637-V887 HydrophobicContact CD2-CG2 4.22Å
638	R	62.6	Low	63.4	Low	71 Å²	71	77.4 Å²	77.4	27%	0.268	38%	0.383	S	S	.	.	H	α-helix	trans	-64.2	-41.1	174.9	178.6	173.6	174.7	-167.7	-4.3	112.5	G634 K636 E640 I642	G634-R638 WeakPolarHBondContact O-CB 3.35Å; G634-R638 PolarHBondContact O-N 3.46Å; K636-R638 VanDerWaalsContact C-N 3.27Å; K636-R638 PolarHBondContact O-N 3.1Å; R638-E640 VanDerWaalsContact C-N 3.33Å; R638-I642 HydrophobicContact CG-CB 4.35Å; R638-I642 HydrophobicContact CG-CD1 4.18Å; R638-I642 WeakPolarHBondContact O-CA 3.39Å; R638-I642 VanDerWaalsContact O-CB 3.3Å; R638-I642 WeakPolarHBondContact O-CB 3.44Å; R638-I642 PolarHBondContact O-N 3.49Å
639	R	65.1	Low	64.2	Low	180 Å²	180	76.2 Å²	76.2	68%	0.679	37%	0.372	S	S	*	.	H	α-helix	trans	-68.3	-33.8	177.2	-83.1	-175.4	-80.2	173.5	-5.8	112.6	D635 K636 K650	D635-R639 WeakPolarHBondContact O-CG 3.37Å; D635-R639 PolarHBondContact O-N 3.4Å; D635-R639 PolarHBondContact O-NE 3.36Å; D635-R639 VanDerWaalsContact O-NE 3.08Å; K636-R639 PolarHBondContact O-N 2.91Å; R639-K650 PolarHBondContact O-NZ 3.01Å
640	E	70.1	Confident	65.2	Low	93 Å²	93	79.1 Å²	79.1	44%	0.435	38%	0.383	S	S	.	.	H	α-helix	trans	-70	-44.5	179.1	-74	169.6	-173	0	0	111.4	K636 L637 R638 K650	K636-E640 WeakPolarHBondContact CE-OE1 3.49Å; K636-E640 WeakPolarHBondContact CG-OE1 3.04Å; K636-E640 PolarHBondContact O-N 3.48Å; L637-E640 PolarHBondContact O-N 3.35Å; R638-E640 VanDerWaalsContact C-N 3.33Å; E640-K650 WeakPolarHBondContact O-CD 3.48Å; E640-K650 WeakPolarHBondContact O-CE 3.39Å; E640-K650 PolarHBondContact O-NZ 3.02Å
641	H	69.2	Low	66.4	Low	53 Å²	53	77.2 Å²	77.2	25%	0.245	37%	0.372	C	S	.	.	H	α-helix	trans	-107.5	-13.6	-168.7	-60.6	82.2	0	0	0	115.6	L637 K650 C883	L637-H641 PolarHBondContact O-N 3.19Å; L637-H641 VanDerWaalsContact O-N 3.13Å; L637-H641 PolarHBondContact O-ND1 2.93Å; H641-K650 PolarHBondContact O-N 3.36Å; H641-C883 VanDerWaalsContact CB-SG 3.53Å
642	I	73.5	Confident	68	Low	10 Å²	10	74.7 Å²	74.7	5%	0.051	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-121.9	135.5	-174.6	-59.4	171.8	0	0	0	110.6	R638 L647 F649 K879	R638-I642 HydrophobicContact CG-CB 4.35Å; R638-I642 HydrophobicContact CG-CD1 4.18Å; R638-I642 WeakPolarHBondContact O-CA 3.39Å; R638-I642 VanDerWaalsContact O-CB 3.3Å; R638-I642 WeakPolarHBondContact O-CB 3.44Å; R638-I642 PolarHBondContact O-N 3.49Å; I642-L647 HydrophobicContact CG2-CD2 4.48Å; I642-F649 HydrophobicContact CD1-CE1 4.34Å; I642-F649 HydrophobicContact CG1-CD1 4.06Å; I642-F649 HydrophobicContact CG1-CE1 4.07Å; I642-K879 HydrophobicContact CD1-CB 3.98Å; I642-K879 HydrophobicContact CD1-CD 4.44Å
643	K	78.7	Confident	69.4	Low	103 Å²	103	71 Å²	71	45%	0.448	36%	0.361	S	S	.	.			trans	-68.7	131.4	173.8	-66.7	-178	-178.5	178	0	110	F645 S646 L647 M648 K650	K643-F645 PolarHBondContact O-N 3.31Å; K643-S646 WeakPolarHBondContact CB-OG 3.41Å; K643-L647 VanDerWaalsContact O-CA 3.32Å; K643-L647 WeakPolarHBondContact O-CA 3.22Å; K643-L647 PolarHBondContact O-N 3.48Å; K643-M648 PolarHBondContact N-O 2.88Å; K643-K650 HydrophobicContact CG-CG 3.95Å
644	P	70.9	Confident	70.4	Confident	117 Å²	117	69.6 Å²	69.6	76%	0.76	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-36.5	-170.5	23.4	-33.3	0	0	0	113.7
645	F	71.8	Confident	71.5	Confident	118 Å²	118	69.6 Å²	69.6	52%	0.518	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-49.1	-175.2	-173.9	-103	0	0	0	113.7	K643 L647 V810 L813 F867	K643-F645 PolarHBondContact O-N 3.31Å; F645-L647 VanDerWaalsContact C-N 3.31Å; F645-L647 PolarHBondContact O-N 3.4Å; F645-V810 HydrophobicContact CD1-CG2 4.18Å; F645-V810 HydrophobicContact CE1-CG2 4Å; F645-L813 HydrophobicContact CZ-CD2 4.31Å; F645-F867 HydrophobicContact CE2-CZ 4.07Å; F645-F867 HydrophobicContact CZ-CZ 4.48Å
646	S	73.1	Confident	72.6	Confident	23 Å²	23	71.7 Å²	71.7	16%	0.161	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-16.9	-178.9	66.6	0	0	0	0	113.5	K643 M648 N808 K874	K643-S646 WeakPolarHBondContact CB-OG 3.41Å; S646-M648 PolarHBondContact O-N 3.35Å; S646-M648 VanDerWaalsContact O-N 3.14Å; S646-M648 PolarHBondContact OG-N 3.43Å; S646-N808 PolarHBondContact O-OD1 3.17Å; S646-K874 PolarHBondContact O-NZ 2.72Å
647	L	71.6	Confident	73.3	Confident	2 Å²	2	71.9 Å²	71.9	1%	0.01	35%	0.352	C	S	.	.			trans	52.1	31.6	-173	-58.2	173.7	0	0	0	112.1	I642 K643 F645 Q871 K874 P875 K879	I642-L647 HydrophobicContact CG2-CD2 4.48Å; K643-L647 VanDerWaalsContact O-CA 3.32Å; K643-L647 WeakPolarHBondContact O-CA 3.22Å; K643-L647 PolarHBondContact O-N 3.48Å; F645-L647 VanDerWaalsContact C-N 3.31Å; F645-L647 PolarHBondContact O-N 3.4Å; L647-Q871 HydrophobicContact CD1-CB 4.37Å; L647-Q871 HydrophobicContact CD1-CG 4.41Å; L647-K874 HydrophobicContact CB-CD 4.05Å; L647-K874 HydrophobicContact CD1-CB 4.07Å; L647-K874 HydrophobicContact CD1-CD 4.11Å; L647-K874 HydrophobicContact CD1-CG 4.41Å; L647-P875 HydrophobicContact CD1-CG 4.02Å; L647-P875 HydrophobicContact CD2-CG 4.08Å; L647-K879 PolarHBondContact O-NZ 2.9Å
648	M	76.3	Confident	74	Confident	69 Å²	69	71 Å²	71	34%	0.34	35%	0.346	S	S	.	.			trans	-96.1	153.5	171.8	-65.5	178	72.6	0	0	109.7	K643 S646 E655	K643-M648 PolarHBondContact N-O 2.88Å; S646-M648 PolarHBondContact O-N 3.35Å; S646-M648 VanDerWaalsContact O-N 3.14Å; S646-M648 PolarHBondContact OG-N 3.43Å; M648-E655 WeakPolarHBondContact CA-OE2 3.46Å; M648-E655 HydrophobicContact CE-CG 3.76Å
649	F	76.6	Confident	74.5	Confident	7 Å²	7	68.9 Å²	68.9	3%	0.031	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-59.4	145.4	168.8	-72.4	-70.2	0	0	0	110.2	I642 D651 L654 E655 Y658 K879 L882	I642-F649 HydrophobicContact CD1-CE1 4.34Å; I642-F649 HydrophobicContact CG1-CD1 4.06Å; I642-F649 HydrophobicContact CG1-CE1 4.07Å; F649-D651 VanDerWaalsContact C-N 3.28Å; F649-D651 WeakPolarHBondContact CB-O 3.32Å; F649-L654 HydrophobicContact CB-CB 4.29Å; F649-L654 HydrophobicContact CD2-CB 4.17Å; F649-L654 HydrophobicContact CG-CB 4.09Å; F649-E655 HydrophobicContact CB-CB 4.26Å; F649-E655 HydrophobicContact CD2-CB 4.42Å; F649-E655 WeakPolarHBondContact CD2-OE2 3.41Å; F649-E655 PolarHBondContact N-OE2 3.29Å; F649-Y658 HydrophobicContact CE2-CD2 4.33Å; F649-Y658 HydrophobicContact CE2-CG 4.31Å; F649-K879 VanDerWaalsContact CD2-CE 3.48Å; F649-K879 HydrophobicContact CE1-CB 4.27Å; F649-K879 HydrophobicContact CE2-CB 4.15Å; F649-K879 HydrophobicContact CE2-CD 4.08Å; F649-K879 HydrophobicContact CE2-CG 3.84Å; F649-K879 HydrophobicContact CZ-CB 3.56Å; F649-K879 HydrophobicContact CZ-CD 4.24Å; F649-K879 HydrophobicContact CZ-CG 3.8Å; F649-L882 HydrophobicContact CE1-CB 4.14Å; F649-L882 HydrophobicContact CE2-CB 4.1Å; F649-L882 HydrophobicContact CE2-CD1 3.88Å; F649-L882 HydrophobicContact CZ-CB 3.55Å; F649-L882 HydrophobicContact CZ-CD1 4.09Å; F649-L882 HydrophobicContact CZ-CG 4.42Å
650	K	79.1	Confident	74.9	Confident	115 Å²	115	66 Å²	66	50%	0.5	34%	0.337	S	S	.	.	S	Bend	trans	-68.5	-34.9	170.5	-69.5	-175.9	-170.4	163.8	0	110.7	R639 E640 H641 K643	R639-K650 PolarHBondContact O-NZ 3.01Å; E640-K650 WeakPolarHBondContact O-CD 3.48Å; E640-K650 WeakPolarHBondContact O-CE 3.39Å; E640-K650 PolarHBondContact O-NZ 3.02Å; H641-K650 PolarHBondContact O-N 3.36Å; K643-K650 HydrophobicContact CG-CG 3.95Å
651	D	78.3	Confident	75	Confident	77 Å²	77	64.3 Å²	64.3	41%	0.412	33%	0.33	S	S	.	.	S	Bend	trans	-81.6	126.1	173.4	-174.3	-14.3	0	0	0	110.9	F649 S653 L654 E655	F649-D651 VanDerWaalsContact C-N 3.28Å; F649-D651 WeakPolarHBondContact CB-O 3.32Å; D651-S653 VanDerWaalsContact CG-OG 3.3Å; D651-S653 WeakPolarHBondContact OD1-CB 3.29Å; D651-S653 PolarHBondContact OD1-N 3.46Å; D651-S653 PolarHBondContact OD1-OG 2.89Å; D651-S653 PolarHBondContact OD2-OG 3.49Å; D651-L654 HydrophobicContact CB-CB 4.39Å; D651-L654 HydrophobicContact CB-CD1 3.88Å; D651-L654 HydrophobicContact CB-CG 4.14Å; D651-E655 PolarHBondContact O-N 3.44Å
652	S	79.6	Confident	75.2	Confident	96 Å²	96	66.8 Å²	66.8	67%	0.671	34%	0.337	S	S	*	.	H	α-helix	trans	-69.6	-34	-178.9	-166.8	0	0	0	0	112.7	E655 E656	S652-E655 PolarHBondContact O-N 3.33Å; S652-E656 PolarHBondContact O-N 2.93Å
653	S	78.5	Confident	75.3	Confident	54 Å²	54	67.2 Å²	67.2	38%	0.378	34%	0.339	S	S	.	.	H	α-helix	trans	-68.8	-37.7	-176.8	70.6	0	0	0	0	112	D651 E656 K657	D651-S653 VanDerWaalsContact CG-OG 3.3Å; D651-S653 WeakPolarHBondContact OD1-CB 3.29Å; D651-S653 PolarHBondContact OD1-N 3.46Å; D651-S653 PolarHBondContact OD1-OG 2.89Å; D651-S653 PolarHBondContact OD2-OG 3.49Å; S653-E656 PolarHBondContact O-N 3.31Å; S653-K657 PolarHBondContact O-N 2.87Å; S653-K657 VanDerWaalsContact O-N 3.11Å
654	L	72.3	Confident	75.1	Confident	20 Å²	20	67 Å²	67	11%	0.105	34%	0.34	C	S	.	.	H	α-helix	trans	-69.8	-36.4	175.5	-64.4	175.3	0	0	0	111.8	F649 D651 Y658 L882 S886	F649-L654 HydrophobicContact CB-CB 4.29Å; F649-L654 HydrophobicContact CD2-CB 4.17Å; F649-L654 HydrophobicContact CG-CB 4.09Å; D651-L654 HydrophobicContact CB-CB 4.39Å; D651-L654 HydrophobicContact CB-CD1 3.88Å; D651-L654 HydrophobicContact CB-CG 4.14Å; L654-Y658 VanDerWaalsContact O-CB 3.28Å; L654-Y658 WeakPolarHBondContact O-CB 3.48Å; L654-Y658 PolarHBondContact O-N 3Å; L654-L882 HydrophobicContact CB-CD2 4.11Å; L654-L882 HydrophobicContact CD2-CD2 3.58Å; L654-L882 HydrophobicContact CG-CD2 4.42Å; L654-S886 WeakPolarHBondContact CD1-OG 3.27Å
655	E	79.8	Confident	75.7	Confident	24 Å²	24	61.9 Å²	61.9	11%	0.112	31%	0.307	C	S	.	.	H	α-helix	trans	-69.2	-35.6	175.2	-166.7	72.6	-163.3	0	0	111.4	M648 F649 D651 S652 Y658 S659 K879	M648-E655 WeakPolarHBondContact CA-OE2 3.46Å; M648-E655 HydrophobicContact CE-CG 3.76Å; F649-E655 HydrophobicContact CB-CB 4.26Å; F649-E655 HydrophobicContact CD2-CB 4.42Å; F649-E655 WeakPolarHBondContact CD2-OE2 3.41Å; F649-E655 PolarHBondContact N-OE2 3.29Å; D651-E655 PolarHBondContact O-N 3.44Å; S652-E655 PolarHBondContact O-N 3.33Å; E655-Y658 WeakPolarHBondContact O-CB 3.05Å; E655-Y658 PolarHBondContact O-N 3.35Å; E655-S659 WeakPolarHBondContact O-CB 3.31Å; E655-S659 PolarHBondContact O-N 3.49Å; E655-K879 IonicContact OE1-NZ 3.61Å; E655-K879 PolarHBondContact OE1-NZ 3.4Å; E655-K879 WeakPolarHBondContact OE2-CE 3.42Å; E655-K879 IonicContact OE2-NZ 3.3Å; E655-K879 PolarHBondContact OE2-NZ 3Å
656	E	78.6	Confident	76.4	Confident	113 Å²	113	56.4 Å²	56.4	53%	0.528	28%	0.283	S	S	.	.	H	α-helix	trans	-63.1	-50.6	174.4	-173.4	174.7	-174.6	0	0	111.4	S652 S653 Y658 S659 Q660	S652-E656 PolarHBondContact O-N 2.93Å; S653-E656 PolarHBondContact O-N 3.31Å; E656-Y658 VanDerWaalsContact C-N 3.26Å; E656-Y658 PolarHBondContact O-N 3.38Å; E656-S659 WeakPolarHBondContact O-CB 3.46Å; E656-S659 PolarHBondContact O-N 3.5Å; E656-S659 PolarHBondContact O-OG 3.2Å; E656-Q660 PolarHBondContact O-N 2.67Å
657	K	75.3	Confident	77.1	Confident	129 Å²	129	56.5 Å²	56.5	56%	0.561	28%	0.28	S	S	*	.	H	α-helix	trans	-58.2	-39.1	173.7	-71	177.8	-176.4	174.4	0	112	S653 S659 Q660 L882	S653-K657 PolarHBondContact O-N 2.87Å; S653-K657 VanDerWaalsContact O-N 3.11Å; K657-S659 VanDerWaalsContact C-N 3.35Å; K657-Q660 PolarHBondContact O-N 3.03Å; K657-L882 HydrophobicContact CB-CD2 4.47Å
658	Y	74	Confident	78	Confident	16 Å²	16	56.4 Å²	56.4	6%	0.063	28%	0.28	C	S	.	.	H	α-helix	trans	-64.1	-39.2	175	179.7	-94.8	0	0	0	112.3	F649 L654 E655 E656 Q660 M661 P878 K879 L882	F649-Y658 HydrophobicContact CE2-CD2 4.33Å; F649-Y658 HydrophobicContact CE2-CG 4.31Å; L654-Y658 VanDerWaalsContact O-CB 3.28Å; L654-Y658 WeakPolarHBondContact O-CB 3.48Å; L654-Y658 PolarHBondContact O-N 3Å; E655-Y658 WeakPolarHBondContact O-CB 3.05Å; E655-Y658 PolarHBondContact O-N 3.35Å; E656-Y658 VanDerWaalsContact C-N 3.26Å; E656-Y658 PolarHBondContact O-N 3.38Å; Y658-Q660 VanDerWaalsContact C-N 3.3Å; Y658-Q660 PolarHBondContact O-N 3.03Å; Y658-M661 HydrophobicContact CD2-CE 3.5Å; Y658-M661 VanDerWaalsContact CD2-CE 3.5Å; Y658-M661 HydrophobicContact CE2-CE 4.16Å; Y658-M661 HydrophobicContact CG-CE 4.23Å; Y658-M661 PolarHBondContact O-N 3.28Å; Y658-P878 HydrophobicContact CE2-CG 3.95Å; Y658-K879 HydrophobicContact CD2-CG 4.18Å; Y658-K879 HydrophobicContact CE2-CG 3.77Å; Y658-L882 HydrophobicContact CD2-CD1 3.87Å; Y658-L882 HydrophobicContact CG-CD1 4.39Å
659	S	73.2	Confident	78.7	Confident	27 Å²	27	53.2 Å²	53.2	19%	0.189	26%	0.264	C	S	.	.	H	α-helix	trans	-66	-32.7	-178.6	79	0	0	0	0	112.8	E655 E656 K657 M661	E655-S659 WeakPolarHBondContact O-CB 3.31Å; E655-S659 PolarHBondContact O-N 3.49Å; E656-S659 WeakPolarHBondContact O-CB 3.46Å; E656-S659 PolarHBondContact O-N 3.5Å; E656-S659 PolarHBondContact O-OG 3.2Å; K657-S659 VanDerWaalsContact C-N 3.35Å; S659-M661 VanDerWaalsContact C-N 3.31Å; S659-M661 PolarHBondContact O-N 3.45Å
660	Q	72.5	Confident	79.4	Confident	120 Å²	120	53 Å²	53	56%	0.561	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-13.4	178.8	-67	173.8	-1.6	0	0	113.5	E656 K657 Y658 R662	E656-Q660 PolarHBondContact O-N 2.67Å; K657-Q660 PolarHBondContact O-N 3.03Å; Y658-Q660 VanDerWaalsContact C-N 3.3Å; Y658-Q660 PolarHBondContact O-N 3.03Å; Q660-R662 PolarHBondContact O-N 2.96Å
661	M	72.3	Confident	80	Confident	58 Å²	58	48.6 Å²	48.6	29%	0.286	25%	0.246	S	C	.	.	S	Bend	trans	-69.2	128.7	176	-75.8	-165.5	-85.2	0	0	111.7	Y658 S659 P878 L882	Y658-M661 HydrophobicContact CD2-CE 3.5Å; Y658-M661 VanDerWaalsContact CD2-CE 3.5Å; Y658-M661 HydrophobicContact CE2-CE 4.16Å; Y658-M661 HydrophobicContact CG-CE 4.23Å; Y658-M661 PolarHBondContact O-N 3.28Å; S659-M661 VanDerWaalsContact C-N 3.31Å; S659-M661 PolarHBondContact O-N 3.45Å; M661-P878 HydrophobicContact CE-CB 4.43Å; M661-P878 HydrophobicContact CE-CG 4.36Å; M661-L882 HydrophobicContact CE-CD1 3.78Å
662	R	73.1	Confident	80.7	Confident	105 Å²	105	45 Å²	45	40%	0.396	23%	0.227	S	C	.	.			trans	-60.4	143	172.2	-76	-176.6	-179	-161.3	0.1	110.9	Q660 E716 C730 E734	Q660-R662 PolarHBondContact O-N 2.96Å; R662-E716 IonicContact NH1-OE1 3.84Å; R662-E716 PolarHBondContact NH1-OE1 2.92Å; R662-E716 IonicContact NH1-OE2 3.04Å; R662-C730 PolarHBondContact NH2-SG 3.07Å; R662-E734 HydrophobicContact CG-CG 4.38Å; R662-E734 IonicContact CZ-OE1 3.61Å; R662-E734 IonicContact NE-OE1 3.94Å; R662-E734 IonicContact NH2-OE1 3.88Å; R662-E734 PolarHBondContact NH2-OE1 3.01Å
663	D	75.4	Confident	81.4	Confident	19 Å²	19	40.4 Å²	40.4	10%	0.102	20%	0.195	C	C	.	.			trans	-101.8	106.4	175.3	-174.7	13.8	0	0	0	110.7	V665 F666 R806	D663-V665 VanDerWaalsContact C-N 3.27Å; D663-V665 PolarHBondContact O-N 3.26Å; D663-V665 WeakPolarHBondContact OD1-CG2 3.48Å; D663-V665 PolarHBondContact OD1-N 3.42Å; D663-F666 HydrophobicContact CB-CB 3.97Å; D663-F666 VanDerWaalsContact O-CB 3.31Å; D663-F666 WeakPolarHBondContact O-CB 3.36Å; D663-F666 PolarHBondContact O-N 3.46Å; D663-R806 VanDerWaalsContact CG-NE 3.3Å; D663-R806 WeakPolarHBondContact OD1-CD 3.29Å; D663-R806 IonicContact OD1-CZ 3.41Å; D663-R806 IonicContact OD1-NE 3.39Å; D663-R806 PolarHBondContact OD1-NE 3.48Å; D663-R806 IonicContact OD1-NH2 2.94Å; D663-R806 WeakPolarHBondContact OD2-CD 3.45Å; D663-R806 WeakPolarHBondContact OD2-CG 3.19Å; D663-R806 IonicContact OD2-NE 3.05Å
664	E	75.4	Confident	82.2	Confident	99 Å²	99	40 Å²	40	46%	0.463	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-26.3	-178.2	-64.6	178.1	-162	0	0	113.2
665	V	83.5	Confident	83.3	Confident	9 Å²	9	41.2 Å²	41.2	6%	0.055	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-7.7	179.8	-64.7	0	0	0	0	113.2	I106 L294 D663 K667 S668 N669	I106-V665 HydrophobicContact CD1-CG1 4.43Å; L294-V665 HydrophobicContact CD2-CG1 4.31Å; D663-V665 VanDerWaalsContact C-N 3.27Å; D663-V665 PolarHBondContact O-N 3.26Å; D663-V665 WeakPolarHBondContact OD1-CG2 3.48Å; D663-V665 PolarHBondContact OD1-N 3.42Å; V665-K667 PolarHBondContact O-N 2.91Å; V665-S668 PolarHBondContact O-N 3.31Å; V665-N669 VanDerWaalsContact O-CG 3.27Å; V665-N669 PolarHBondContact O-N 3.37Å; V665-N669 PolarHBondContact O-ND2 3.4Å
666	F	86.5	Confident	84	Confident	3 Å²	3	40.1 Å²	40.1	1%	0.013	19%	0.187	C	C	.	.	H	α-helix	trans	-57.2	-47.8	-175	171.7	-112.9	0	0	0	113.2	D663 S668 N669 L670 T713 R739 I742 V743	D663-F666 HydrophobicContact CB-CB 3.97Å; D663-F666 VanDerWaalsContact O-CB 3.31Å; D663-F666 WeakPolarHBondContact O-CB 3.36Å; D663-F666 PolarHBondContact O-N 3.46Å; F666-S668 VanDerWaalsContact C-N 3.31Å; F666-S668 PolarHBondContact O-N 3.04Å; F666-N669 WeakPolarHBondContact O-CB 3.2Å; F666-N669 PolarHBondContact O-N 3Å; F666-L670 PolarHBondContact O-N 3.38Å; F666-L670 VanDerWaalsContact O-N 3.17Å; F666-T713 HydrophobicContact CE1-CG2 3.99Å; F666-T713 HydrophobicContact CZ-CG2 4.19Å; F666-R739 HydrophobicContact CD1-CG 4.27Å; F666-R739 HydrophobicContact CD2-CG 3.65Å; F666-R739 HydrophobicContact CE1-CG 4.14Å; F666-R739 HydrophobicContact CE2-CG 3.52Å; F666-R739 HydrophobicContact CG-CG 4.05Å; F666-R739 HydrophobicContact CZ-CG 3.78Å; F666-I742 HydrophobicContact CZ-CB 4.46Å; F666-I742 HydrophobicContact CZ-CG2 4.18Å; F666-V743 HydrophobicContact CD2-CG2 4.26Å; F666-V743 HydrophobicContact CE2-CG2 3.67Å
667	K	88	Confident	84.8	Confident	25 Å²	25	34.7 Å²	34.7	11%	0.109	16%	0.162	C	C	.	.	H	α-helix	trans	-59.4	-42.5	179.2	-64	178.2	178.5	179.1	0	111.5	V105 V665 L670 V671 E716 D717	V105-K667 HydrophobicContact CG2-CB 4.28Å; V665-K667 PolarHBondContact O-N 2.91Å; K667-L670 PolarHBondContact O-N 3.25Å; K667-V671 WeakPolarHBondContact O-CG2 3.14Å; K667-V671 PolarHBondContact O-N 3.09Å; K667-E716 IonicContact NZ-OE2 2.84Å; K667-D717 IonicContact NZ-OD1 3.58Å; K667-D717 IonicContact NZ-OD2 3.9Å; K667-D717 PolarHBondContact NZ-OD2 2.95Å
668	S	90.2	Very high	85.8	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-68.6	-37.3	179.5	-48.4	0	0	0	0	112.4	I106 V665 F666 L670 V671 C672	I106-S668 WeakPolarHBondContact CB-OG 3.27Å; I106-S668 PolarHBondContact N-OG 2.93Å; V665-S668 PolarHBondContact O-N 3.31Å; F666-S668 VanDerWaalsContact C-N 3.31Å; F666-S668 PolarHBondContact O-N 3.04Å; S668-L670 VanDerWaalsContact C-N 3.31Å; S668-L670 PolarHBondContact O-N 3.48Å; S668-V671 PolarHBondContact O-N 3.2Å; S668-C672 PolarHBondContact O-N 2.91Å
669	N	91.1	Very high	86.8	Confident	2 Å²	2	33.5 Å²	33.5	1%	0.011	16%	0.16	C	C	.	.	H	α-helix	trans	-61.9	-39.9	175.3	-67.6	-23.1	0	0	0	111.7	L294 V665 F666 C672 A673 V803 F804	L294-N669 WeakPolarHBondContact CD1-OD1 3.26Å; V665-N669 VanDerWaalsContact O-CG 3.27Å; V665-N669 PolarHBondContact O-N 3.37Å; V665-N669 PolarHBondContact O-ND2 3.4Å; F666-N669 WeakPolarHBondContact O-CB 3.2Å; F666-N669 PolarHBondContact O-N 3Å; N669-C672 PolarHBondContact O-N 3.49Å; N669-A673 PolarHBondContact O-N 2.97Å; N669-V803 HydrophobicContact CB-CG1 3.92Å; N669-V803 VanDerWaalsContact CG-O 3.22Å; N669-V803 PolarHBondContact ND2-O 3.46Å; N669-V803 PolarHBondContact OD1-O 3.39Å; N669-F804 HydrophobicContact CB-CD1 3.67Å; N669-F804 HydrophobicContact CB-CE1 3.75Å
670	L	91.6	Very high	87.7	Confident	1 Å²	1	32.2 Å²	32.2	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-68.8	-38.6	179.6	-166.9	71.2	0	0	0	112.4	F666 K667 S668 A673 F674 H706 V710 T713 I742 F804	F666-L670 PolarHBondContact O-N 3.38Å; F666-L670 VanDerWaalsContact O-N 3.17Å; K667-L670 PolarHBondContact O-N 3.25Å; S668-L670 VanDerWaalsContact C-N 3.31Å; S668-L670 PolarHBondContact O-N 3.48Å; L670-A673 PolarHBondContact O-N 3.44Å; L670-F674 PolarHBondContact O-N 3.02Å; L670-H706 PolarHBondContact O-NE2 3.39Å; L670-V710 HydrophobicContact CD2-CB 4.38Å; L670-V710 HydrophobicContact CD2-CG2 3.93Å; L670-V710 HydrophobicContact CG-CG2 3.89Å; L670-T713 HydrophobicContact CD2-CG2 3.94Å; L670-T713 WeakPolarHBondContact CD2-OG1 3.3Å; L670-I742 HydrophobicContact CD1-CG2 4.42Å; L670-F804 HydrophobicContact CD1-CZ 4.44Å
671	V	92.1	Very high	88.5	Confident	24 Å²	24	27.3 Å²	27.3	15%	0.145	13%	0.129	C	C	.	.	H	α-helix	trans	-64.9	-42	173.5	174	0	0	0	0	111.1	V105 K667 S668 A673 F674 I675 V710	V105-V671 HydrophobicContact CG1-CG2 4.11Å; V105-V671 HydrophobicContact CG2-CG2 4.26Å; K667-V671 WeakPolarHBondContact O-CG2 3.14Å; K667-V671 PolarHBondContact O-N 3.09Å; S668-V671 PolarHBondContact O-N 3.2Å; V671-A673 VanDerWaalsContact C-N 3.33Å; V671-A673 PolarHBondContact O-N 3.19Å; V671-F674 WeakPolarHBondContact O-CB 3.31Å; V671-F674 PolarHBondContact O-N 3.21Å; V671-F674 VanDerWaalsContact O-N 3.14Å; V671-I675 HydrophobicContact CG1-CD1 4.21Å; V671-I675 WeakPolarHBondContact O-CG1 3.35Å; V671-I675 PolarHBondContact O-N 2.84Å; V671-V710 HydrophobicContact CG2-CG1 4.18Å
672	C	93.1	Very high	89.4	Confident	1 Å²	1	26 Å²	26	1%	0.007	13%	0.127	C	C	.	.	H	α-helix	trans	-61.4	-41.5	174.2	180	0	0	0	0	111.8	F290 S668 N669 F674 I675 V676 V803	F290-C672 HydrophobicContact CB-CB 4.14Å; F290-C672 WeakPolarHBondContact CB-SG 3.3Å; F290-C672 HydrophobicContact CD1-CB 3.98Å; F290-C672 HydrophobicContact CD2-CB 4.31Å; F290-C672 HydrophobicContact CE1-CB 4.46Å; F290-C672 HydrophobicContact CG-CB 3.9Å; S668-C672 PolarHBondContact O-N 2.91Å; N669-C672 PolarHBondContact O-N 3.49Å; C672-F674 VanDerWaalsContact C-N 3.26Å; C672-F674 PolarHBondContact O-N 3.09Å; C672-I675 PolarHBondContact O-N 2.74Å; C672-V676 WeakPolarHBondContact O-CG2 3.41Å; C672-V676 PolarHBondContact O-N 2.68Å; C672-V803 HydrophobicContact CB-CG1 3.75Å
673	A	94.3	Very high	90.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.5	-32	175	0	0	0	0	0	112.6	N669 L670 V671 L677 N750 F804	N669-A673 PolarHBondContact O-N 2.97Å; L670-A673 PolarHBondContact O-N 3.44Å; V671-A673 VanDerWaalsContact C-N 3.33Å; V671-A673 PolarHBondContact O-N 3.19Å; A673-L677 PolarHBondContact O-N 2.9Å; A673-L677 VanDerWaalsContact O-N 3.13Å; A673-N750 PolarHBondContact O-ND2 3.34Å; A673-N750 PolarHBondContact O-OD1 2.84Å; A673-F804 HydrophobicContact CB-CE2 4.28Å; A673-F804 HydrophobicContact CB-CZ 4.11Å
674	F	95.1	Very high	90.7	Very high	44 Å²	44	20.2 Å²	20.2	19%	0.193	10%	0.104	C	C	.	.	H	α-helix	trans	-69	-40.6	173.4	-177.3	-122.1	0	0	0	112.5	L670 V671 C672 V676 L677 I678 I703 H706 S707 V710	L670-F674 PolarHBondContact O-N 3.02Å; V671-F674 WeakPolarHBondContact O-CB 3.31Å; V671-F674 PolarHBondContact O-N 3.21Å; V671-F674 VanDerWaalsContact O-N 3.14Å; C672-F674 VanDerWaalsContact C-N 3.26Å; C672-F674 PolarHBondContact O-N 3.09Å; F674-V676 VanDerWaalsContact C-N 3.32Å; F674-V676 PolarHBondContact O-N 3.4Å; F674-L677 HydrophobicContact CD2-CD2 4.43Å; F674-L677 WeakPolarHBondContact O-CB 3.44Å; F674-L677 PolarHBondContact O-N 3.07Å; F674-I678 HydrophobicContact CD1-CD1 4.06Å; F674-I678 HydrophobicContact CE1-CD1 3.68Å; F674-I678 HydrophobicContact CZ-CD1 3.95Å; F674-I678 HydrophobicContact CZ-CG1 4.38Å; F674-I678 WeakPolarHBondContact O-CG1 2.89Å; F674-I678 PolarHBondContact O-N 2.91Å; F674-I678 VanDerWaalsContact O-N 3.09Å; F674-I703 HydrophobicContact CE2-CG2 4.13Å; F674-I703 HydrophobicContact CZ-CG2 4.28Å; F674-H706 WeakPolarHBondContact CA-NE2 3.16Å; F674-H706 VanDerWaalsContact CB-CD2 3.41Å; F674-H706 WeakPolarHBondContact CB-CD2 3.11Å; F674-H706 HydrophobicContact CD2-CB 4Å; F674-H706 AromaticContact CD2-CD2 3.37Å; F674-H706 WeakPolarHBondContact CD2-CD2 3.28Å; F674-H706 AromaticContact CD2-CG 3.95Å; F674-H706 HydrophobicContact CE2-CB 4.41Å; F674-H706 AromaticContact CG-CD2 3.78Å; F674-H706 PolarHBondContact N-NE2 3.37Å; F674-S707 VanDerWaalsContact CE2-OG 3.3Å; F674-S707 WeakPolarHBondContact CE2-OG 3.35Å; F674-S707 VanDerWaalsContact CZ-OG 3.28Å; F674-S707 WeakPolarHBondContact CZ-OG 3.43Å; F674-V710 HydrophobicContact CB-CG2 4.3Å
675	I	94.9	Very high	91.1	Very high	46 Å²	46	18.4 Å²	18.4	24%	0.236	10%	0.103	C	C	.	.	H	α-helix	trans	-62.4	-42.3	176.1	-67.7	166.8	0	0	0	110.4	F290 V671 C672 L677 I678 F679	F290-I675 HydrophobicContact CE2-CD1 3.86Å; F290-I675 HydrophobicContact CZ-CD1 3.96Å; V671-I675 HydrophobicContact CG1-CD1 4.21Å; V671-I675 WeakPolarHBondContact O-CG1 3.35Å; V671-I675 PolarHBondContact O-N 2.84Å; C672-I675 PolarHBondContact O-N 2.74Å; I675-L677 VanDerWaalsContact C-N 3.32Å; I675-L677 PolarHBondContact O-N 2.8Å; I675-I678 PolarHBondContact O-N 2.84Å; I675-F679 HydrophobicContact CG2-CD2 3.8Å; I675-F679 HydrophobicContact CG2-CE2 3.51Å; I675-F679 VanDerWaalsContact O-CD2 3.24Å; I675-F679 WeakPolarHBondContact O-CD2 3.42Å; I675-F679 PolarHBondContact O-N 3.4Å; I675-F679 VanDerWaalsContact O-N 3.09Å
676	V	94.8	Very high	91	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.006	12%	0.115	C	C	.	.	H	α-helix	trans	-61.4	-41.2	175.3	174.7	0	0	0	0	111.2	A287 C672 F674 I678 F679 I680 L796 T800	A287-V676 HydrophobicContact CB-CG2 4.04Å; C672-V676 WeakPolarHBondContact O-CG2 3.41Å; C672-V676 PolarHBondContact O-N 2.68Å; F674-V676 VanDerWaalsContact C-N 3.32Å; F674-V676 PolarHBondContact O-N 3.4Å; V676-I678 VanDerWaalsContact C-N 3.35Å; V676-I678 PolarHBondContact O-N 3.11Å; V676-F679 PolarHBondContact O-N 2.83Å; V676-I680 HydrophobicContact CG1-CD1 3.84Å; V676-I680 HydrophobicContact CG1-CG1 4.28Å; V676-I680 WeakPolarHBondContact O-CG1 3.46Å; V676-I680 PolarHBondContact O-N 3.39Å; V676-L796 HydrophobicContact CG1-CB 4.41Å; V676-T800 HydrophobicContact CB-CG2 3.99Å; V676-T800 HydrophobicContact CG1-CG2 3.59Å; V676-T800 HydrophobicContact CG2-CG2 4.41Å
677	L	95.1	Very high	90.6	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-56.4	-48.6	174.7	-179	62.9	0	0	0	111.4	A673 F674 I675 F679 I680 T681 I703 H706 I749 N750 A753	A673-L677 PolarHBondContact O-N 2.9Å; A673-L677 VanDerWaalsContact O-N 3.13Å; F674-L677 HydrophobicContact CD2-CD2 4.43Å; F674-L677 WeakPolarHBondContact O-CB 3.44Å; F674-L677 PolarHBondContact O-N 3.07Å; I675-L677 VanDerWaalsContact C-N 3.32Å; I675-L677 PolarHBondContact O-N 2.8Å; L677-F679 VanDerWaalsContact C-N 3.29Å; L677-F679 PolarHBondContact O-N 2.91Å; L677-I680 PolarHBondContact O-N 3.09Å; L677-T681 HydrophobicContact CD1-CG2 4.42Å; L677-T681 HydrophobicContact CG-CG2 4.49Å; L677-T681 WeakPolarHBondContact O-CG2 3.43Å; L677-T681 PolarHBondContact O-N 3.48Å; L677-I703 HydrophobicContact CD2-CG1 4.43Å; L677-H706 HydrophobicContact CD2-CB 3.61Å; L677-I749 HydrophobicContact CD1-CG2 4.34Å; L677-I749 HydrophobicContact CD2-CG2 3.99Å; L677-N750 WeakPolarHBondContact CA-OD1 3.48Å; L677-N750 WeakPolarHBondContact CB-OD1 3.33Å; L677-N750 PolarHBondContact N-OD1 3.29Å; L677-A753 HydrophobicContact CD1-CB 3.34Å
678	I	94.9	Very high	89.5	Confident	75 Å²	75	21.8 Å²	21.8	39%	0.385	12%	0.124	S	C	.	.	H	α-helix	trans	-57.5	-44.6	178.2	-65.7	168.6	0	0	0	110.5	F674 I675 V676 T681 A682	F674-I678 HydrophobicContact CD1-CD1 4.06Å; F674-I678 HydrophobicContact CE1-CD1 3.68Å; F674-I678 HydrophobicContact CZ-CD1 3.95Å; F674-I678 HydrophobicContact CZ-CG1 4.38Å; F674-I678 WeakPolarHBondContact O-CG1 2.89Å; F674-I678 PolarHBondContact O-N 2.91Å; F674-I678 VanDerWaalsContact O-N 3.09Å; I675-I678 PolarHBondContact O-N 2.84Å; V676-I678 VanDerWaalsContact C-N 3.35Å; V676-I678 PolarHBondContact O-N 3.11Å; I678-T681 PolarHBondContact O-N 3.31Å; I678-T681 PolarHBondContact O-OG1 3.29Å; I678-A682 WeakPolarHBondContact O-CB 3.19Å; I678-A682 PolarHBondContact O-N 3.28Å
679	F	95.1	Very high	88.4	Confident	44 Å²	44	23 Å²	23	19%	0.193	13%	0.132	C	C	.	.	H	α-helix	trans	-64.6	-42	176.7	-77.9	-61.3	0	0	0	113.2	V279 M282 C283 T286 I675 V676 L677 T681 A682 I683	V279-F679 HydrophobicContact CG1-CD1 3.8Å; V279-F679 HydrophobicContact CG1-CE1 4.46Å; M282-F679 HydrophobicContact CB-CE1 4.42Å; C283-F679 HydrophobicContact CB-CB 3.57Å; C283-F679 HydrophobicContact CB-CD1 4.17Å; C283-F679 HydrophobicContact CB-CD2 3.86Å; C283-F679 HydrophobicContact CB-CG 3.62Å; C283-F679 WeakPolarHBondContact SG-CB 3.29Å; T286-F679 HydrophobicContact CG2-CE2 4.18Å; T286-F679 HydrophobicContact CG2-CZ 4.27Å; T286-F679 VanDerWaalsContact OG1-CE2 3.29Å; T286-F679 WeakPolarHBondContact OG1-CE2 3.39Å; I675-F679 HydrophobicContact CG2-CD2 3.8Å; I675-F679 HydrophobicContact CG2-CE2 3.51Å; I675-F679 VanDerWaalsContact O-CD2 3.24Å; I675-F679 WeakPolarHBondContact O-CD2 3.42Å; I675-F679 PolarHBondContact O-N 3.4Å; I675-F679 VanDerWaalsContact O-N 3.09Å; V676-F679 PolarHBondContact O-N 2.83Å; L677-F679 VanDerWaalsContact C-N 3.29Å; L677-F679 PolarHBondContact O-N 2.91Å; F679-T681 VanDerWaalsContact C-N 3.28Å; F679-T681 PolarHBondContact O-N 3.29Å; F679-A682 PolarHBondContact O-N 3.35Å; F679-A682 VanDerWaalsContact O-N 3.14Å; F679-I683 WeakPolarHBondContact O-CD1 3.5Å; F679-I683 VanDerWaalsContact O-CG1 3.26Å; F679-I683 WeakPolarHBondContact O-CG1 3.38Å; F679-I683 PolarHBondContact O-N 3.38Å
680	I	92.1	Very high	87.1	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-57.3	-45.6	174.7	-68.8	167.8	0	0	0	109.8	V676 L677 A682 I683 Q684 A753 A754 T793 L796	V676-I680 HydrophobicContact CG1-CD1 3.84Å; V676-I680 HydrophobicContact CG1-CG1 4.28Å; V676-I680 WeakPolarHBondContact O-CG1 3.46Å; V676-I680 PolarHBondContact O-N 3.39Å; L677-I680 PolarHBondContact O-N 3.09Å; I680-A682 VanDerWaalsContact C-N 3.33Å; I680-A682 PolarHBondContact O-N 3.19Å; I680-I683 PolarHBondContact O-N 3.34Å; I680-Q684 WeakPolarHBondContact O-CG 3.16Å; I680-Q684 PolarHBondContact O-N 2.94Å; I680-Q684 VanDerWaalsContact O-N 3.16Å; I680-A753 HydrophobicContact CG2-CB 4.16Å; I680-A754 HydrophobicContact CG2-CB 4.49Å; I680-T793 HydrophobicContact CG2-CG2 4.42Å; I680-L796 HydrophobicContact CD1-CB 4.22Å; I680-L796 HydrophobicContact CG1-CB 4.13Å; I680-L796 HydrophobicContact CG1-CD1 4.12Å
681	T	90.6	Very high	86.3	Confident	18 Å²	18	31.9 Å²	31.9	11%	0.11	18%	0.183	C	C	.	.	H	α-helix	trans	-64.1	-36.4	177.5	71	0	0	0	0	112.7	L677 I678 F679 S685 F699 I703	L677-T681 HydrophobicContact CD1-CG2 4.42Å; L677-T681 HydrophobicContact CG-CG2 4.49Å; L677-T681 WeakPolarHBondContact O-CG2 3.43Å; L677-T681 PolarHBondContact O-N 3.48Å; I678-T681 PolarHBondContact O-N 3.31Å; I678-T681 PolarHBondContact O-OG1 3.29Å; F679-T681 VanDerWaalsContact C-N 3.28Å; F679-T681 PolarHBondContact O-N 3.29Å; T681-S685 VanDerWaalsContact O-CB 3.31Å; T681-S685 WeakPolarHBondContact O-CB 3.33Å; T681-S685 PolarHBondContact O-N 2.89Å; T681-S685 PolarHBondContact O-OG 3.2Å; T681-S685 VanDerWaalsContact O-OG 3.14Å; T681-F699 HydrophobicContact CG2-CB 4.02Å; T681-F699 HydrophobicContact CG2-CD1 3.22Å; T681-F699 HydrophobicContact CG2-CE1 3.96Å; T681-F699 HydrophobicContact CG2-CG 3.76Å; T681-I703 HydrophobicContact CG2-CD1 4.09Å; T681-I703 HydrophobicContact CG2-CG1 4.29Å
682	A	91	Very high	85.5	Confident	29 Å²	29	34.7 Å²	34.7	24%	0.24	20%	0.195	C	C	.	.	H	α-helix	trans	-70.8	-40.7	178.7	0	0	0	0	0	112.4	V279 I678 F679 I680 Q684 S685 L686	V279-A682 HydrophobicContact CG1-CB 4.16Å; I678-A682 WeakPolarHBondContact O-CB 3.19Å; I678-A682 PolarHBondContact O-N 3.28Å; F679-A682 PolarHBondContact O-N 3.35Å; F679-A682 VanDerWaalsContact O-N 3.14Å; I680-A682 VanDerWaalsContact C-N 3.33Å; I680-A682 PolarHBondContact O-N 3.19Å; A682-Q684 VanDerWaalsContact C-N 3.33Å; A682-Q684 PolarHBondContact O-N 3.32Å; A682-S685 WeakPolarHBondContact CA-OG 3.44Å; A682-S685 PolarHBondContact O-N 3.22Å; A682-S685 PolarHBondContact O-OG 3.45Å; A682-S685 VanDerWaalsContact O-OG 3.08Å; A682-L686 VanDerWaalsContact O-CG 3.28Å; A682-L686 WeakPolarHBondContact O-CG 3.3Å; A682-L686 PolarHBondContact O-N 3Å; A682-L686 VanDerWaalsContact O-N 3.14Å
683	I	89	Confident	85	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-46.5	176.7	-67	160.5	0	0	0	109.8	V279 L280 F679 I680 S685 Y789 T793 L796	V279-I683 HydrophobicContact CB-CG1 4.13Å; V279-I683 HydrophobicContact CG1-CD1 4.46Å; V279-I683 HydrophobicContact CG1-CG1 3.67Å; L280-I683 HydrophobicContact CB-CD1 3.9Å; L280-I683 HydrophobicContact CB-CG1 4.36Å; L280-I683 HydrophobicContact CD1-CD1 4.21Å; L280-I683 HydrophobicContact CD1-CG2 4.43Å; L280-I683 HydrophobicContact CG-CD1 3.91Å; F679-I683 WeakPolarHBondContact O-CD1 3.5Å; F679-I683 VanDerWaalsContact O-CG1 3.26Å; F679-I683 WeakPolarHBondContact O-CG1 3.38Å; F679-I683 PolarHBondContact O-N 3.38Å; I680-I683 PolarHBondContact O-N 3.34Å; I683-S685 VanDerWaalsContact C-N 3.33Å; I683-S685 PolarHBondContact O-N 3.38Å; I683-Y789 HydrophobicContact CG2-CD1 4.22Å; I683-T793 HydrophobicContact CB-CG2 4.38Å; I683-T793 HydrophobicContact CD1-CG2 4.49Å; I683-T793 HydrophobicContact CG2-CG2 3.97Å; I683-L796 HydrophobicContact CD1-CD1 3.51Å
684	Q	86.1	Confident	84.3	Confident	3 Å²	3	42.1 Å²	42.1	1%	0.014	24%	0.24	C	C	.	.	H	α-helix	trans	-72.6	-26.8	-177.7	-65.5	-179.7	-4.7	0	0	112.3	I680 A682 M695 F699 A753 A754 N757 I783 T793	I680-Q684 WeakPolarHBondContact O-CG 3.16Å; I680-Q684 PolarHBondContact O-N 2.94Å; I680-Q684 VanDerWaalsContact O-N 3.16Å; A682-Q684 VanDerWaalsContact C-N 3.33Å; A682-Q684 PolarHBondContact O-N 3.32Å; Q684-M695 HydrophobicContact CB-CE 3.9Å; Q684-M695 VanDerWaalsContact O-CE 3.28Å; Q684-M695 WeakPolarHBondContact O-CE 3.47Å; Q684-F699 HydrophobicContact CB-CZ 4.48Å; Q684-A753 PolarHBondContact NE2-O 3.4Å; Q684-A753 PolarHBondContact OE1-O 3.06Å; Q684-A753 VanDerWaalsContact OE1-O 3.13Å; Q684-A754 PolarHBondContact NE2-O 3.49Å; Q684-N757 PolarHBondContact OE1-ND2 2.78Å; Q684-I783 HydrophobicContact CB-CD1 4.26Å; Q684-T793 HydrophobicContact CG-CG2 4.16Å; Q684-T793 PolarHBondContact NE2-OG1 3.09Å
685	S	83.4	Confident	83.7	Confident	62 Å²	62	40.2 Å²	40.2	43%	0.434	23%	0.232	S	C	.	.	H	α-helix	trans	-81	-20.8	177.8	68.4	0	0	0	0	114.8	T681 A682 I683	T681-S685 VanDerWaalsContact O-CB 3.31Å; T681-S685 WeakPolarHBondContact O-CB 3.33Å; T681-S685 PolarHBondContact O-N 2.89Å; T681-S685 PolarHBondContact O-OG 3.2Å; T681-S685 VanDerWaalsContact O-OG 3.14Å; A682-S685 WeakPolarHBondContact CA-OG 3.44Å; A682-S685 PolarHBondContact O-N 3.22Å; A682-S685 PolarHBondContact O-OG 3.45Å; A682-S685 VanDerWaalsContact O-OG 3.08Å; I683-S685 VanDerWaalsContact C-N 3.33Å; I683-S685 PolarHBondContact O-N 3.38Å
686	L	82.6	Confident	83.4	Confident	60 Å²	60	42 Å²	42	31%	0.314	25%	0.245	S	C	.	.	H	α-helix	trans	-73.2	-18.8	171.4	-74.1	167.6	0	0	0	112.8	V279 A682	V279-L686 HydrophobicContact CB-CD1 4.37Å; V279-L686 HydrophobicContact CG2-CD1 3.71Å; A682-L686 VanDerWaalsContact O-CG 3.28Å; A682-L686 WeakPolarHBondContact O-CG 3.3Å; A682-L686 PolarHBondContact O-N 3Å; A682-L686 VanDerWaalsContact O-N 3.14Å
687	L	77.2	Confident	83.1	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.021	27%	0.269	C	S	.	.	S	Bend	trans	-93	120.5	175.8	-61.9	173.9	0	0	0	109.1	A276 S689 I783 Y789	A276-L687 HydrophobicContact CB-CD2 4.39Å; L687-S689 PolarHBondContact O-N 3.5Å; L687-I783 HydrophobicContact CB-CB 4.3Å; L687-I783 HydrophobicContact CB-CD1 3.94Å; L687-I783 HydrophobicContact CB-CG1 3.82Å; L687-I783 HydrophobicContact CD1-CD1 4.21Å; L687-I783 HydrophobicContact CD1-CG1 3.98Å; L687-Y789 HydrophobicContact CD1-CD1 4.15Å; L687-Y789 HydrophobicContact CD1-CD2 4.28Å; L687-Y789 HydrophobicContact CD1-CG 3.87Å
688	P	66.2	Low	82.7	Confident	44 Å²	44	48.2 Å²	48.2	29%	0.286	28%	0.276	S	S	.	.			trans	-61.4	127.5	-176.2	-16.5	27.2	0	0	0	111	I780 D782 I783	P688-I780 HydrophobicContact CB-CG2 3.84Å; P688-I780 HydrophobicContact CG-CG2 4.35Å; P688-D782 CarbonylContact O-C 3.31Å; P688-D782 VanDerWaalsContact O-C 3.31Å; P688-D782 VanDerWaalsContact O-CA 3.3Å; P688-D782 WeakPolarHBondContact O-CA 3.44Å; P688-I783 PolarHBondContact O-N 3.45Å
689	S	66.4	Low	82.5	Confident	24 Å²	24	45.2 Å²	45.2	17%	0.168	26%	0.26	C	S	.	.			trans	-110.3	142.5	173.4	179.2	0	0	0	0	112.1	L687 R691 M692 D782	L687-S689 PolarHBondContact O-N 3.5Å; S689-R691 PolarHBondContact O-N 3.35Å; S689-R691 PolarHBondContact OG-N 3.29Å; S689-M692 PolarHBondContact N-SD 2.61Å; S689-M692 VanDerWaalsContact O-CG 3.28Å; S689-M692 WeakPolarHBondContact O-CG 3.27Å; S689-D782 WeakPolarHBondContact CA-OD1 3.35Å
690	A	63.3	Low	82.4	Confident	81 Å²	81	46 Å²	46	67%	0.669	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.5	173.5	0	0	0	0	0	113.4	D782	A690-D782 WeakPolarHBondContact CB-OD2 3.39Å; A690-D782 PolarHBondContact N-OD1 3.4Å
691	R	75.3	Confident	82.5	Confident	110 Å²	110	50.2 Å²	50.2	42%	0.415	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	50.1	-178.7	-59.1	-173.1	179.8	174.2	5.6	113.2	S689 V693 T694 M695 D762	S689-R691 PolarHBondContact O-N 3.35Å; S689-R691 PolarHBondContact OG-N 3.29Å; R691-V693 PolarHBondContact O-N 3.24Å; R691-V693 VanDerWaalsContact O-N 3.07Å; R691-T694 HydrophobicContact CB-CG2 4.48Å; R691-T694 VanDerWaalsContact CB-OG1 3.27Å; R691-T694 WeakPolarHBondContact CB-OG1 3.46Å; R691-T694 PolarHBondContact O-N 2.64Å; R691-T694 PolarHBondContact O-OG1 2.92Å; R691-M695 PolarHBondContact O-N 3.08Å; R691-D762 IonicContact NH2-OD2 3.43Å
692	M	75.4	Confident	82.6	Confident	82 Å²	82	50.1 Å²	50.1	40%	0.404	30%	0.295	S	S	.	.	H	α-helix	trans	-46.6	-40.3	-179.7	-66.8	-58.4	-73.9	0	0	114.7	S689 T694 M695 V696	S689-M692 PolarHBondContact N-SD 2.61Å; S689-M692 VanDerWaalsContact O-CG 3.28Å; S689-M692 WeakPolarHBondContact O-CG 3.27Å; M692-T694 PolarHBondContact O-N 3.39Å; M692-M695 WeakPolarHBondContact O-CB 3.15Å; M692-M695 PolarHBondContact O-N 3.5Å; M692-M695 HydrophobicContact SD-SD 4.45Å; M692-V696 VanDerWaalsContact O-CG2 3.29Å; M692-V696 WeakPolarHBondContact O-CG2 3.23Å; M692-V696 PolarHBondContact O-N 3.25Å
693	V	81.6	Confident	82.8	Confident	109 Å²	109	51.1 Å²	51.1	66%	0.661	30%	0.296	S	S	*	.	H	α-helix	trans	-63.7	-44.4	-178.7	178.3	0	0	0	0	111.7	R691 M695 V696 I697	R691-V693 PolarHBondContact O-N 3.24Å; R691-V693 VanDerWaalsContact O-N 3.07Å; V693-M695 VanDerWaalsContact C-N 3.32Å; V693-M695 PolarHBondContact O-N 3.26Å; V693-V696 PolarHBondContact O-N 2.99Å; V693-I697 HydrophobicContact CG1-CD1 3.97Å; V693-I697 VanDerWaalsContact O-CG1 3.31Å; V693-I697 WeakPolarHBondContact O-CG1 3.28Å; V693-I697 PolarHBondContact O-N 2.95Å; V693-I697 VanDerWaalsContact O-N 3.12Å
694	T	81.1	Confident	83.1	Confident	49 Å²	49	56 Å²	56	30%	0.301	33%	0.326	S	S	.	.	H	α-helix	trans	-65.4	-39.8	179.1	60.6	0	0	0	0	111.6	R691 M692 I697 Q698	R691-T694 HydrophobicContact CB-CG2 4.48Å; R691-T694 VanDerWaalsContact CB-OG1 3.27Å; R691-T694 WeakPolarHBondContact CB-OG1 3.46Å; R691-T694 PolarHBondContact O-N 2.64Å; R691-T694 PolarHBondContact O-OG1 2.92Å; M692-T694 PolarHBondContact O-N 3.39Å; T694-I697 PolarHBondContact O-N 2.83Å; T694-Q698 WeakPolarHBondContact O-CB 3.37Å; T694-Q698 WeakPolarHBondContact O-CG 3.29Å; T694-Q698 PolarHBondContact O-N 3.33Å
695	M	82.8	Confident	83.5	Confident	4 Å²	4	59.8 Å²	59.8	2%	0.02	35%	0.346	C	S	.	.	H	α-helix	trans	-62.6	-48	177.4	-172.7	-162.5	160.1	0	0	111.7	Q684 R691 M692 V693 I697 Q698 F699	Q684-M695 HydrophobicContact CB-CE 3.9Å; Q684-M695 VanDerWaalsContact O-CE 3.28Å; Q684-M695 WeakPolarHBondContact O-CE 3.47Å; R691-M695 PolarHBondContact O-N 3.08Å; M692-M695 WeakPolarHBondContact O-CB 3.15Å; M692-M695 PolarHBondContact O-N 3.5Å; M692-M695 HydrophobicContact SD-SD 4.45Å; V693-M695 VanDerWaalsContact C-N 3.32Å; V693-M695 PolarHBondContact O-N 3.26Å; M695-I697 PolarHBondContact O-N 3.42Å; M695-Q698 PolarHBondContact O-N 2.91Å; M695-F699 HydrophobicContact CE-CD2 3.76Å; M695-F699 HydrophobicContact CE-CE2 3.34Å; M695-F699 HydrophobicContact CE-CZ 4.39Å; M695-F699 HydrophobicContact CG-CD2 3.75Å; M695-F699 HydrophobicContact CG-CE2 3.4Å; M695-F699 VanDerWaalsContact CG-CE2 3.4Å; M695-F699 WeakPolarHBondContact O-CD2 3.26Å; M695-F699 PolarHBondContact O-N 3.25Å; M695-F699 HydrophobicContact SD-CE2 4.29Å
696	V	86.8	Confident	84	Confident	83 Å²	83	56.9 Å²	56.9	50%	0.503	33%	0.325	S	S	.	.	H	α-helix	trans	-61.5	-43	178.3	170.3	0	0	0	0	111.4	M692 V693 S700	M692-V696 VanDerWaalsContact O-CG2 3.29Å; M692-V696 WeakPolarHBondContact O-CG2 3.23Å; M692-V696 PolarHBondContact O-N 3.25Å; V693-V696 PolarHBondContact O-N 2.99Å; V696-S700 VanDerWaalsContact O-CB 3.3Å; V696-S700 WeakPolarHBondContact O-CB 3.42Å; V696-S700 PolarHBondContact O-N 3.38Å; V696-S700 PolarHBondContact O-OG 3.17Å
697	I	89.3	Confident	84.4	Confident	102 Å²	102	56 Å²	56	52%	0.523	33%	0.325	S	S	.	.	H	α-helix	trans	-62.2	-45.9	177.4	-67.5	167.6	0	0	0	110.4	V693 T694 M695 S700 V701	V693-I697 HydrophobicContact CG1-CD1 3.97Å; V693-I697 VanDerWaalsContact O-CG1 3.31Å; V693-I697 WeakPolarHBondContact O-CG1 3.28Å; V693-I697 PolarHBondContact O-N 2.95Å; V693-I697 VanDerWaalsContact O-N 3.12Å; T694-I697 PolarHBondContact O-N 2.83Å; M695-I697 PolarHBondContact O-N 3.42Å; I697-S700 PolarHBondContact O-N 3.35Å; I697-V701 WeakPolarHBondContact O-CG2 3.42Å; I697-V701 PolarHBondContact O-N 2.75Å
698	Q	87.3	Confident	85.1	Confident	29 Å²	29	59 Å²	59	14%	0.136	35%	0.345	C	S	.	.	H	α-helix	trans	-61.8	-48.6	-179.4	-73.2	165.4	15.9	0	0	112.4	T694 M695 S700 V701 L702 I756	T694-Q698 WeakPolarHBondContact O-CB 3.37Å; T694-Q698 WeakPolarHBondContact O-CG 3.29Å; T694-Q698 PolarHBondContact O-N 3.33Å; M695-Q698 PolarHBondContact O-N 2.91Å; Q698-S700 VanDerWaalsContact C-N 3.33Å; Q698-S700 PolarHBondContact O-N 3.48Å; Q698-V701 PolarHBondContact O-N 2.8Å; Q698-L702 WeakPolarHBondContact O-CG 3.39Å; Q698-L702 PolarHBondContact O-N 3.27Å; Q698-I756 HydrophobicContact CG-CD1 4.5Å
699	F	90.3	Very high	86.3	Confident	12 Å²	12	58.3 Å²	58.3	5%	0.053	34%	0.339	C	S	.	.	H	α-helix	trans	-65.8	-36.2	177.2	-71.7	-57.7	0	0	0	112.9	T681 Q684 M695 V701 L702 I703 A753 I756 N757	T681-F699 HydrophobicContact CG2-CB 4.02Å; T681-F699 HydrophobicContact CG2-CD1 3.22Å; T681-F699 HydrophobicContact CG2-CE1 3.96Å; T681-F699 HydrophobicContact CG2-CG 3.76Å; Q684-F699 HydrophobicContact CB-CZ 4.48Å; M695-F699 HydrophobicContact CE-CD2 3.76Å; M695-F699 HydrophobicContact CE-CE2 3.34Å; M695-F699 HydrophobicContact CE-CZ 4.39Å; M695-F699 HydrophobicContact CG-CD2 3.75Å; M695-F699 HydrophobicContact CG-CE2 3.4Å; M695-F699 VanDerWaalsContact CG-CE2 3.4Å; M695-F699 WeakPolarHBondContact O-CD2 3.26Å; M695-F699 PolarHBondContact O-N 3.25Å; M695-F699 HydrophobicContact SD-CE2 4.29Å; F699-V701 VanDerWaalsContact C-N 3.3Å; F699-V701 PolarHBondContact O-N 3.45Å; F699-L702 HydrophobicContact CD1-CD1 4.41Å; F699-L702 PolarHBondContact O-N 3.28Å; F699-I703 WeakPolarHBondContact O-CB 3.43Å; F699-I703 VanDerWaalsContact O-CG1 3.22Å; F699-I703 WeakPolarHBondContact O-CG1 3.44Å; F699-I703 PolarHBondContact O-N 3.07Å; F699-A753 HydrophobicContact CE1-CB 4.2Å; F699-I756 HydrophobicContact CZ-CG2 4.3Å; F699-N757 WeakPolarHBondContact CE2-ND2 3.14Å; F699-N757 WeakPolarHBondContact CZ-ND2 3.38Å
700	S	92.2	Very high	87.5	Confident	60 Å²	60	58.3 Å²	58.3	42%	0.42	34%	0.338	S	S	.	.	H	α-helix	trans	-59.5	-43.4	174.9	-59.5	0	0	0	0	111.1	V696 I697 Q698 V704	V696-S700 VanDerWaalsContact O-CB 3.3Å; V696-S700 WeakPolarHBondContact O-CB 3.42Å; V696-S700 PolarHBondContact O-N 3.38Å; V696-S700 PolarHBondContact O-OG 3.17Å; I697-S700 PolarHBondContact O-N 3.35Å; Q698-S700 VanDerWaalsContact C-N 3.33Å; Q698-S700 PolarHBondContact O-N 3.48Å; S700-V704 WeakPolarHBondContact O-CB 3.22Å; S700-V704 WeakPolarHBondContact O-CG2 3.49Å; S700-V704 PolarHBondContact O-N 3.4Å
701	V	94.1	Very high	88.7	Confident	90 Å²	90	58.1 Å²	58.1	55%	0.545	33%	0.325	S	S	.	.	H	α-helix	trans	-63.5	-46.4	176.2	172.5	0	0	0	0	111.5	I697 Q698 F699 V704 L705	I697-V701 WeakPolarHBondContact O-CG2 3.42Å; I697-V701 PolarHBondContact O-N 2.75Å; Q698-V701 PolarHBondContact O-N 2.8Å; F699-V701 VanDerWaalsContact C-N 3.3Å; F699-V701 PolarHBondContact O-N 3.45Å; V701-V704 PolarHBondContact O-N 2.79Å; V701-L705 VanDerWaalsContact O-CB 3.31Å; V701-L705 WeakPolarHBondContact O-CB 3.1Å; V701-L705 PolarHBondContact O-N 3.35Å
702	L	93.6	Very high	89.3	Confident	15 Å²	15	54.6 Å²	54.6	8%	0.079	32%	0.315	C	S	.	.	H	α-helix	trans	-65.3	-40.6	-179.8	-66.1	174.3	0	0	0	112.4	Q698 F699 L705 H706 I749 A753	Q698-L702 WeakPolarHBondContact O-CG 3.39Å; Q698-L702 PolarHBondContact O-N 3.27Å; F699-L702 HydrophobicContact CD1-CD1 4.41Å; F699-L702 PolarHBondContact O-N 3.28Å; L702-L705 PolarHBondContact O-N 3.46Å; L702-H706 WeakPolarHBondContact O-CB 3.34Å; L702-H706 PolarHBondContact O-N 2.92Å; L702-I749 HydrophobicContact CB-CG2 4.38Å; L702-I749 HydrophobicContact CD2-CG2 4.29Å; L702-A753 HydrophobicContact CD1-CB 3.81Å
703	I	94.2	Very high	89.7	Confident	51 Å²	51	50.7 Å²	50.7	26%	0.262	30%	0.296	S	S	.	.	H	α-helix	trans	-64.4	-44.9	176.4	-70.3	168	0	0	0	110.6	F674 L677 T681 F699 H706 S707	F674-I703 HydrophobicContact CE2-CG2 4.13Å; F674-I703 HydrophobicContact CZ-CG2 4.28Å; L677-I703 HydrophobicContact CD2-CG1 4.43Å; T681-I703 HydrophobicContact CG2-CD1 4.09Å; T681-I703 HydrophobicContact CG2-CG1 4.29Å; F699-I703 WeakPolarHBondContact O-CB 3.43Å; F699-I703 VanDerWaalsContact O-CG1 3.22Å; F699-I703 WeakPolarHBondContact O-CG1 3.44Å; F699-I703 PolarHBondContact O-N 3.07Å; I703-H706 PolarHBondContact O-N 2.87Å; I703-S707 VanDerWaalsContact O-CB 3.26Å; I703-S707 WeakPolarHBondContact O-CB 3.48Å; I703-S707 PolarHBondContact O-N 3.39Å; I703-S707 PolarHBondContact O-OG 2.7Å
704	V	95.2	Very high	89.8	Confident	103 Å²	103	46 Å²	46	62%	0.624	27%	0.268	S	S	*	.	H	α-helix	trans	-63.6	-43.5	177.2	169.8	0	0	0	0	110.9	S700 V701 H706 S707 C708	S700-V704 WeakPolarHBondContact O-CB 3.22Å; S700-V704 WeakPolarHBondContact O-CG2 3.49Å; S700-V704 PolarHBondContact O-N 3.4Å; V701-V704 PolarHBondContact O-N 2.79Å; V704-H706 PolarHBondContact O-N 3.31Å; V704-S707 PolarHBondContact O-N 3.5Å; V704-C708 WeakPolarHBondContact O-CB 3.28Å; V704-C708 PolarHBondContact O-N 3.36Å
705	L	94.6	Very high	89.9	Confident	82 Å²	82	43.6 Å²	43.6	43%	0.429	25%	0.253	S	S	.	.	H	α-helix	trans	-60.4	-47.3	178.2	-177.3	63.9	0	0	0	111.5	V701 L702 C708 L709 I749	V701-L705 VanDerWaalsContact O-CB 3.31Å; V701-L705 WeakPolarHBondContact O-CB 3.1Å; V701-L705 PolarHBondContact O-N 3.35Å; L702-L705 PolarHBondContact O-N 3.46Å; L705-C708 WeakPolarHBondContact O-CB 3.31Å; L705-C708 PolarHBondContact O-N 2.69Å; L705-L709 PolarHBondContact O-N 3.18Å; L705-L709 VanDerWaalsContact O-N 3.15Å; L705-I749 HydrophobicContact CB-CD1 4.46Å; L705-I749 HydrophobicContact CD2-CD1 3.64Å; L705-I749 HydrophobicContact CD2-CG1 3.83Å; L705-I749 HydrophobicContact CG-CD1 3.7Å; L705-I749 HydrophobicContact CG-CG1 4.42Å
706	H	93.9	Very high	89.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-69.4	-37.3	178.8	-156.9	96.8	0	0	0	112.6	L670 F674 L677 L702 I703 V704 C708 L709 V710 S746 I749	L670-H706 PolarHBondContact O-NE2 3.39Å; F674-H706 WeakPolarHBondContact CA-NE2 3.16Å; F674-H706 VanDerWaalsContact CB-CD2 3.41Å; F674-H706 WeakPolarHBondContact CB-CD2 3.11Å; F674-H706 HydrophobicContact CD2-CB 4Å; F674-H706 AromaticContact CD2-CD2 3.37Å; F674-H706 WeakPolarHBondContact CD2-CD2 3.28Å; F674-H706 AromaticContact CD2-CG 3.95Å; F674-H706 HydrophobicContact CE2-CB 4.41Å; F674-H706 AromaticContact CG-CD2 3.78Å; F674-H706 PolarHBondContact N-NE2 3.37Å; L677-H706 HydrophobicContact CD2-CB 3.61Å; L702-H706 WeakPolarHBondContact O-CB 3.34Å; L702-H706 PolarHBondContact O-N 2.92Å; I703-H706 PolarHBondContact O-N 2.87Å; V704-H706 PolarHBondContact O-N 3.31Å; H706-C708 VanDerWaalsContact C-N 3.27Å; H706-C708 PolarHBondContact O-N 2.85Å; H706-L709 WeakPolarHBondContact O-CB 3.13Å; H706-L709 PolarHBondContact O-N 3.19Å; H706-L709 VanDerWaalsContact O-N 3.16Å; H706-V710 WeakPolarHBondContact O-CG2 3.47Å; H706-V710 PolarHBondContact O-N 3.25Å; H706-S746 PolarHBondContact CE1-OG 3.44Å; H706-I749 HydrophobicContact CB-CG2 4.25Å
707	S	92.8	Very high	89.2	Confident	43 Å²	43	45.2 Å²	45.2	30%	0.301	26%	0.257	S	S	.	.	H	α-helix	trans	-60.8	-39.1	173.7	-59.9	0	0	0	0	111.3	F674 I703 V704 V710 L711	F674-S707 VanDerWaalsContact CE2-OG 3.3Å; F674-S707 WeakPolarHBondContact CE2-OG 3.35Å; F674-S707 VanDerWaalsContact CZ-OG 3.28Å; F674-S707 WeakPolarHBondContact CZ-OG 3.43Å; I703-S707 VanDerWaalsContact O-CB 3.26Å; I703-S707 WeakPolarHBondContact O-CB 3.48Å; I703-S707 PolarHBondContact O-N 3.39Å; I703-S707 PolarHBondContact O-OG 2.7Å; V704-S707 PolarHBondContact O-N 3.5Å; S707-V710 PolarHBondContact O-N 2.9Å; S707-L711 WeakPolarHBondContact O-CB 3.38Å; S707-L711 PolarHBondContact O-N 3.06Å
708	C	91.7	Very high	88.7	Confident	66 Å²	66	44 Å²	44	45%	0.446	25%	0.246	S	C	.	.	H	α-helix	trans	-61.6	-44.1	173.6	-172.2	0	0	0	0	111.5	V704 L705 H706 V710 L711 V712	V704-C708 WeakPolarHBondContact O-CB 3.28Å; V704-C708 PolarHBondContact O-N 3.36Å; L705-C708 WeakPolarHBondContact O-CB 3.31Å; L705-C708 PolarHBondContact O-N 2.69Å; H706-C708 VanDerWaalsContact C-N 3.27Å; H706-C708 PolarHBondContact O-N 2.85Å; C708-V710 PolarHBondContact O-N 3.2Å; C708-L711 PolarHBondContact O-N 3.4Å; C708-V712 VanDerWaalsContact O-CG2 3.22Å; C708-V712 WeakPolarHBondContact O-CG2 3.41Å; C708-V712 PolarHBondContact O-N 2.87Å
709	L	91.3	Very high	88	Confident	30 Å²	30	51.5 Å²	51.5	16%	0.157	28%	0.279	C	S	.	.	H	α-helix	trans	-60.7	-43	175.6	-65.9	173.7	0	0	0	112.5	L705 H706 L711 V712 T713 V745 I749	L705-L709 PolarHBondContact O-N 3.18Å; L705-L709 VanDerWaalsContact O-N 3.15Å; H706-L709 WeakPolarHBondContact O-CB 3.13Å; H706-L709 PolarHBondContact O-N 3.19Å; H706-L709 VanDerWaalsContact O-N 3.16Å; L709-L711 VanDerWaalsContact C-N 3.34Å; L709-V712 PolarHBondContact O-N 3.46Å; L709-T713 WeakPolarHBondContact O-CG2 3.25Å; L709-T713 PolarHBondContact O-N 2.9Å; L709-T713 VanDerWaalsContact O-N 3.14Å; L709-T713 PolarHBondContact O-OG1 3.48Å; L709-V745 HydrophobicContact CD1-CB 4.41Å; L709-V745 HydrophobicContact CD1-CG1 3.74Å; L709-V745 HydrophobicContact CD2-CG1 4.43Å; L709-I749 HydrophobicContact CD1-CD1 3.47Å; L709-I749 VanDerWaalsContact CD1-CD1 3.47Å
710	V	90.4	Very high	87.3	Confident	24 Å²	24	57.2 Å²	57.2	15%	0.145	32%	0.319	C	S	.	.	H	α-helix	trans	-63	-42.3	175.8	175.6	0	0	0	0	110.8	L670 V671 F674 H706 S707 C708 T713 T714	L670-V710 HydrophobicContact CD2-CB 4.38Å; L670-V710 HydrophobicContact CD2-CG2 3.93Å; L670-V710 HydrophobicContact CG-CG2 3.89Å; V671-V710 HydrophobicContact CG2-CG1 4.18Å; F674-V710 HydrophobicContact CB-CG2 4.3Å; H706-V710 WeakPolarHBondContact O-CG2 3.47Å; H706-V710 PolarHBondContact O-N 3.25Å; S707-V710 PolarHBondContact O-N 2.9Å; C708-V710 PolarHBondContact O-N 3.2Å; V710-T713 PolarHBondContact O-N 2.94Å; V710-T713 PolarHBondContact O-OG1 2.86Å; V710-T713 VanDerWaalsContact O-OG1 3.06Å; V710-T714 HydrophobicContact CG1-CG2 4.48Å; V710-T714 WeakPolarHBondContact O-CB 3.42Å; V710-T714 WeakPolarHBondContact O-CG2 3.29Å; V710-T714 PolarHBondContact O-N 3.28Å; V710-T714 VanDerWaalsContact O-N 3.08Å; V710-T714 PolarHBondContact O-OG1 3.31Å
711	L	88.2	Confident	86.7	Confident	76 Å²	76	56.1 Å²	56.1	40%	0.398	31%	0.308	S	S	.	.	H	α-helix	trans	-64.6	-45.8	178.1	-175.8	65.5	0	0	0	112	S707 C708 L709 T713 T714 A715 L721	S707-L711 WeakPolarHBondContact O-CB 3.38Å; S707-L711 PolarHBondContact O-N 3.06Å; C708-L711 PolarHBondContact O-N 3.4Å; L709-L711 VanDerWaalsContact C-N 3.34Å; L711-T713 VanDerWaalsContact C-N 3.3Å; L711-T713 PolarHBondContact O-N 3.28Å; L711-T714 PolarHBondContact O-N 3.33Å; L711-T714 PolarHBondContact O-OG1 3.42Å; L711-A715 WeakPolarHBondContact O-CB 3.3Å; L711-A715 PolarHBondContact O-N 2.93Å; L711-L721 HydrophobicContact CD1-CD1 4.11Å
712	V	87.9	Confident	86.3	Confident	36 Å²	36	55.8 Å²	55.8	22%	0.218	31%	0.307	C	S	.	.	H	α-helix	trans	-60.4	-40.1	179.8	170.9	0	0	0	0	111.4	C708 L709 L725 C729 I732	C708-V712 VanDerWaalsContact O-CG2 3.22Å; C708-V712 WeakPolarHBondContact O-CG2 3.41Å; C708-V712 PolarHBondContact O-N 2.87Å; L709-V712 PolarHBondContact O-N 3.46Å; V712-L725 HydrophobicContact CG1-CD1 4.42Å; V712-L725 HydrophobicContact CG2-CD1 4.09Å; V712-C729 WeakPolarHBondContact O-CB 3.25Å; V712-C729 PolarHBondContact O-SG 2.94Å; V712-I732 HydrophobicContact CG1-CD1 3.77Å
713	T	84.9	Confident	85.6	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.006	34%	0.337	C	S	.	.	H	α-helix	trans	-82.7	-18.4	-177.2	53.8	0	0	0	0	114.5	F666 L670 L709 V710 L711 C729 I732 I742	F666-T713 HydrophobicContact CE1-CG2 3.99Å; F666-T713 HydrophobicContact CZ-CG2 4.19Å; L670-T713 HydrophobicContact CD2-CG2 3.94Å; L670-T713 WeakPolarHBondContact CD2-OG1 3.3Å; L709-T713 WeakPolarHBondContact O-CG2 3.25Å; L709-T713 PolarHBondContact O-N 2.9Å; L709-T713 VanDerWaalsContact O-N 3.14Å; L709-T713 PolarHBondContact O-OG1 3.48Å; V710-T713 PolarHBondContact O-N 2.94Å; V710-T713 PolarHBondContact O-OG1 2.86Å; V710-T713 VanDerWaalsContact O-OG1 3.06Å; L711-T713 VanDerWaalsContact C-N 3.3Å; L711-T713 PolarHBondContact O-N 3.28Å; T713-C729 VanDerWaalsContact C-SG 3.55Å; T713-C729 PolarHBondContact O-SG 3.32Å; T713-I732 HydrophobicContact CG2-CG2 4.4Å; T713-I742 HydrophobicContact CG2-CD1 3.8Å; T713-I742 HydrophobicContact CG2-CG2 4.01Å
714	T	83.7	Confident	85.1	Confident	9 Å²	9	64.7 Å²	64.7	6%	0.055	36%	0.359	C	S	.	.	H	α-helix	trans	-101.6	0.1	174.9	57.7	0	0	0	0	112.7	V105 V710 L711 E716 D717 Y718	V105-T714 HydrophobicContact CG2-CG2 4.34Å; V710-T714 HydrophobicContact CG1-CG2 4.48Å; V710-T714 WeakPolarHBondContact O-CB 3.42Å; V710-T714 WeakPolarHBondContact O-CG2 3.29Å; V710-T714 PolarHBondContact O-N 3.28Å; V710-T714 VanDerWaalsContact O-N 3.08Å; V710-T714 PolarHBondContact O-OG1 3.31Å; L711-T714 PolarHBondContact O-N 3.33Å; L711-T714 PolarHBondContact O-OG1 3.42Å; T714-E716 PolarHBondContact O-N 2.93Å; T714-E716 VanDerWaalsContact O-N 3.14Å; T714-D717 PolarHBondContact O-N 2.9Å; T714-Y718 WeakPolarHBondContact O-CD2 3.5Å
715	A	82.4	Confident	84.4	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-61.6	-27.5	-171.8	0	0	0	0	0	114.6	L711 D717 Y718 L721 L725 C729	L711-A715 WeakPolarHBondContact O-CB 3.3Å; L711-A715 PolarHBondContact O-N 2.93Å; A715-D717 PolarHBondContact O-N 2.89Å; A715-Y718 PolarHBondContact O-N 3.41Å; A715-Y718 VanDerWaalsContact O-N 3.15Å; A715-L721 HydrophobicContact CB-CD1 3.61Å; A715-L725 HydrophobicContact CB-CD2 3.83Å; A715-L725 HydrophobicContact CB-CG 3.68Å; A715-C729 HydrophobicContact CB-CB 4.12Å
716	E	78	Confident	83.8	Confident	67 Å²	67	61.3 Å²	61.3	31%	0.313	33%	0.332	S	S	.	.	G	3₁₀ helix	trans	-54.2	-34.1	174.5	-175.8	179.6	-171.8	0	0	112.2	R662 K667 T714 C729 N733	R662-E716 IonicContact NH1-OE1 3.84Å; R662-E716 PolarHBondContact NH1-OE1 2.92Å; R662-E716 IonicContact NH1-OE2 3.04Å; K667-E716 IonicContact NZ-OE2 2.84Å; T714-E716 PolarHBondContact O-N 2.93Å; T714-E716 VanDerWaalsContact O-N 3.14Å; E716-C729 HydrophobicContact CB-CB 4.35Å; E716-C729 PolarHBondContact N-SG 3.21Å; E716-N733 PolarHBondContact OE2-ND2 2.99Å
717	D	77.1	Confident	83.4	Confident	53 Å²	53	66.4 Å²	66.4	28%	0.283	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-86.7	-8	-175.8	-58.5	-63.3	0	0	0	113.4	R103 K667 T714 A715	R103-D717 HydrophobicContact CB-CB 3.75Å; R103-D717 HydrophobicContact CG-CB 4.34Å; K667-D717 IonicContact NZ-OD1 3.58Å; K667-D717 IonicContact NZ-OD2 3.9Å; K667-D717 PolarHBondContact NZ-OD2 2.95Å; T714-D717 PolarHBondContact O-N 2.9Å; A715-D717 PolarHBondContact O-N 2.89Å
718	Y	78.9	Confident	82.9	Confident	76 Å²	76	66.2 Å²	66.2	30%	0.298	36%	0.355	S	S	.	.			trans	-102.3	102.8	-179.3	-72.4	-103.9	0	0	0	111.3	T714 A715 C720 L721 R726	T714-Y718 WeakPolarHBondContact O-CD2 3.5Å; A715-Y718 PolarHBondContact O-N 3.41Å; A715-Y718 VanDerWaalsContact O-N 3.15Å; Y718-C720 PolarHBondContact O-N 3.15Å; Y718-L721 HydrophobicContact CD2-CD1 4.4Å; Y718-L721 HydrophobicContact CG-CD1 4.06Å; Y718-L721 PolarHBondContact O-N 3.3Å; Y718-R726 PolarHBondContact O-NE 2.99Å; Y718-R726 PolarHBondContact O-NH2 2.88Å
719	K	72.4	Confident	82.6	Confident	188 Å²	188	63 Å²	63	82%	0.817	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-8.5	177.1	-67.4	-173.6	-178.8	-178.2	0	115.2	R726	K719-R726 VanDerWaalsContact CA-NH2 3.29Å; K719-R726 PolarHBondContact O-NH2 2.92Å
720	C	76	Confident	82.2	Confident	132 Å²	132	63.3 Å²	63.3	89%	0.892	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-10.1	178.8	-55	0	0	0	0	113.8	Y718	Y718-C720 PolarHBondContact O-N 3.15Å
721	L	80.2	Confident	81.9	Confident	37 Å²	37	69.5 Å²	69.5	19%	0.194	36%	0.359	C	S	.	.	S	Bend	trans	-84.7	151.7	-176.7	-73.1	173	0	0	0	112.6	L711 A715 Y718 L725 R726	L711-L721 HydrophobicContact CD1-CD1 4.11Å; A715-L721 HydrophobicContact CB-CD1 3.61Å; Y718-L721 HydrophobicContact CD2-CD1 4.4Å; Y718-L721 HydrophobicContact CG-CD1 4.06Å; Y718-L721 PolarHBondContact O-N 3.3Å; L721-L725 HydrophobicContact CB-CD2 4.24Å; L721-L725 HydrophobicContact CD1-CD2 3.9Å; L721-L725 HydrophobicContact CD2-CD2 4Å; L721-L725 HydrophobicContact CG-CD2 4.27Å; L721-R726 PolarHBondContact O-NE 3.38Å; L721-R726 PolarHBondContact O-NH2 3.05Å
722	P	84.8	Confident	81.8	Confident	83 Å²	83	66.6 Å²	66.6	54%	0.539	34%	0.343	S	S	.	.			trans	-60.7	146.8	-177.5	22.9	-32.4	0	0	0	112.5	V724 L725 R726	P722-V724 PolarHBondContact O-N 3.23Å; P722-L725 HydrophobicContact CG-CB 4.06Å; P722-L725 WeakPolarHBondContact O-CB 3.22Å; P722-L725 PolarHBondContact O-N 3.38Å; P722-R726 PolarHBondContact O-N 3.39Å
723	L	80.1	Confident	81.5	Confident	133 Å²	133	65.6 Å²	65.6	70%	0.696	34%	0.336	S	S	*	.	H	α-helix	trans	-55	-35.6	-177.8	-86.8	153.6	0	0	0	113.3	L725 R726 K727	L723-L725 VanDerWaalsContact C-N 3.33Å; L723-L725 PolarHBondContact O-N 3.05Å; L723-R726 PolarHBondContact O-N 3.24Å; L723-K727 PolarHBondContact O-N 3.45Å; L723-K727 VanDerWaalsContact O-N 3.07Å
724	V	81.9	Confident	81.4	Confident	119 Å²	119	69.7 Å²	69.7	72%	0.721	36%	0.356	S	S	*	.	H	α-helix	trans	-61.2	-42.5	177.2	-177.8	0	0	0	0	111.1	P722 K727 A728	P722-V724 PolarHBondContact O-N 3.23Å; V724-K727 PolarHBondContact O-N 3.38Å; V724-A728 WeakPolarHBondContact O-CB 3.29Å; V724-A728 PolarHBondContact O-N 3.2Å
725	L	80.9	Confident	81.4	Confident	42 Å²	42	71.3 Å²	71.3	22%	0.22	37%	0.365	C	S	.	.	H	α-helix	trans	-70.5	-35	-178.5	-168.3	66.7	0	0	0	111.9	V712 A715 L721 P722 L723 A728 C729	V712-L725 HydrophobicContact CG1-CD1 4.42Å; V712-L725 HydrophobicContact CG2-CD1 4.09Å; A715-L725 HydrophobicContact CB-CD2 3.83Å; A715-L725 HydrophobicContact CB-CG 3.68Å; L721-L725 HydrophobicContact CB-CD2 4.24Å; L721-L725 HydrophobicContact CD1-CD2 3.9Å; L721-L725 HydrophobicContact CD2-CD2 4Å; L721-L725 HydrophobicContact CG-CD2 4.27Å; P722-L725 HydrophobicContact CG-CB 4.06Å; P722-L725 WeakPolarHBondContact O-CB 3.22Å; P722-L725 PolarHBondContact O-N 3.38Å; L723-L725 VanDerWaalsContact C-N 3.33Å; L723-L725 PolarHBondContact O-N 3.05Å; L725-A728 PolarHBondContact O-N 3Å; L725-C729 WeakPolarHBondContact O-CB 3.31Å; L725-C729 PolarHBondContact O-N 3.23Å
726	R	83.4	Confident	81.4	Confident	72 Å²	72	74.7 Å²	74.7	27%	0.272	38%	0.379	S	S	.	.	H	α-helix	trans	-67.9	-41.9	174.3	-62.9	-163.9	-163.6	148.9	29.5	112.7	Y718 K719 L721 P722 L723 C729 C730	Y718-R726 PolarHBondContact O-NE 2.99Å; Y718-R726 PolarHBondContact O-NH2 2.88Å; K719-R726 VanDerWaalsContact CA-NH2 3.29Å; K719-R726 PolarHBondContact O-NH2 2.92Å; L721-R726 PolarHBondContact O-NE 3.38Å; L721-R726 PolarHBondContact O-NH2 3.05Å; P722-R726 PolarHBondContact O-N 3.39Å; L723-R726 PolarHBondContact O-N 3.24Å; R726-C729 PolarHBondContact O-N 3.36Å; R726-C730 PolarHBondContact O-N 3.08Å
727	K	83.9	Confident	81.7	Confident	108 Å²	108	74.4 Å²	74.4	47%	0.47	39%	0.388	S	S	.	.	H	α-helix	trans	-62.1	-43.8	174.7	-74.6	-174.4	178.4	-175.2	0	111.3	L723 V724 C729 C730 W731	L723-K727 PolarHBondContact O-N 3.45Å; L723-K727 VanDerWaalsContact O-N 3.07Å; V724-K727 PolarHBondContact O-N 3.38Å; K727-C729 PolarHBondContact O-N 3.14Å; K727-C730 PolarHBondContact O-N 3.38Å; K727-W731 WeakPolarHBondContact O-CB 3.31Å; K727-W731 PolarHBondContact O-N 3.43Å
728	A	83.8	Confident	82.2	Confident	38 Å²	38	72.5 Å²	72.5	31%	0.314	38%	0.379	S	S	.	.	H	α-helix	trans	-60.5	-44.3	174.6	0	0	0	0	0	112.1	V724 L725 C730 W731 I732	V724-A728 WeakPolarHBondContact O-CB 3.29Å; V724-A728 PolarHBondContact O-N 3.2Å; L725-A728 PolarHBondContact O-N 3Å; A728-C730 PolarHBondContact O-N 3.03Å; A728-W731 PolarHBondContact O-N 3.49Å; A728-I732 WeakPolarHBondContact O-CB 3.3Å; A728-I732 WeakPolarHBondContact O-CD1 3.35Å; A728-I732 WeakPolarHBondContact O-CG1 3.29Å; A728-I732 PolarHBondContact O-N 3.41Å
729	C	84.9	Confident	82.7	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-60.5	-42.7	176.1	-176.8	0	0	0	0	112.7	V712 T713 A715 E716 L725 R726 K727 I732 N733	V712-C729 WeakPolarHBondContact O-CB 3.25Å; V712-C729 PolarHBondContact O-SG 2.94Å; T713-C729 VanDerWaalsContact C-SG 3.55Å; T713-C729 PolarHBondContact O-SG 3.32Å; A715-C729 HydrophobicContact CB-CB 4.12Å; E716-C729 HydrophobicContact CB-CB 4.35Å; E716-C729 PolarHBondContact N-SG 3.21Å; L725-C729 WeakPolarHBondContact O-CB 3.31Å; L725-C729 PolarHBondContact O-N 3.23Å; R726-C729 PolarHBondContact O-N 3.36Å; K727-C729 PolarHBondContact O-N 3.14Å; C729-I732 PolarHBondContact O-N 2.95Å; C729-N733 WeakPolarHBondContact O-CB 3.18Å; C729-N733 PolarHBondContact O-N 3.05Å; C729-N733 PolarHBondContact O-ND2 3.21Å
730	C	82.1	Confident	83.4	Confident	35 Å²	35	61.2 Å²	61.2	24%	0.236	33%	0.332	C	S	.	.	H	α-helix	trans	-61.8	-48.9	176.2	-169.2	0	0	0	0	111	R662 R726 K727 A728 I732 N733 E734	R662-C730 PolarHBondContact NH2-SG 3.07Å; R726-C730 PolarHBondContact O-N 3.08Å; K727-C730 PolarHBondContact O-N 3.38Å; A728-C730 PolarHBondContact O-N 3.03Å; C730-I732 VanDerWaalsContact C-N 3.32Å; C730-I732 PolarHBondContact O-N 2.9Å; C730-N733 PolarHBondContact O-N 3.43Å; C730-E734 PolarHBondContact O-N 3.34Å
731	W	85.4	Confident	84.2	Confident	155 Å²	155	59.1 Å²	59.1	59%	0.587	32%	0.315	S	S	*	.	H	α-helix	trans	-59.6	-41.8	177.7	-179.2	80	0	0	0	112.3	K727 A728 T735 A738	K727-W731 WeakPolarHBondContact O-CB 3.31Å; K727-W731 PolarHBondContact O-N 3.43Å; A728-W731 PolarHBondContact O-N 3.49Å; W731-T735 HydrophobicContact CZ2-CG2 4.31Å; W731-T735 PolarHBondContact NE1-OG1 3.33Å; W731-T735 WeakPolarHBondContact O-CB 3.27Å; W731-T735 PolarHBondContact O-N 3.29Å; W731-T735 PolarHBondContact O-OG1 3.49Å; W731-A738 HydrophobicContact CE3-CB 4.05Å; W731-A738 HydrophobicContact CH2-CB 3.79Å; W731-A738 HydrophobicContact CZ3-CB 3.49Å; W731-A738 VanDerWaalsContact CZ3-CB 3.49Å
732	I	85.6	Confident	84.7	Confident	15 Å²	15	58.2 Å²	58.2	8%	0.077	31%	0.311	C	S	.	.	H	α-helix	trans	-62	-45.4	175.8	-75.5	163.8	0	0	0	111.6	V712 T713 A728 C729 C730 A738 I742	V712-I732 HydrophobicContact CG1-CD1 3.77Å; T713-I732 HydrophobicContact CG2-CG2 4.4Å; A728-I732 WeakPolarHBondContact O-CB 3.3Å; A728-I732 WeakPolarHBondContact O-CD1 3.35Å; A728-I732 WeakPolarHBondContact O-CG1 3.29Å; A728-I732 PolarHBondContact O-N 3.41Å; C729-I732 PolarHBondContact O-N 2.95Å; C730-I732 VanDerWaalsContact C-N 3.32Å; C730-I732 PolarHBondContact O-N 2.9Å; I732-A738 HydrophobicContact CG1-CB 4.46Å; I732-I742 HydrophobicContact CB-CD1 4.27Å; I732-I742 HydrophobicContact CD1-CD1 3.81Å; I732-I742 HydrophobicContact CG1-CD1 4Å; I732-I742 HydrophobicContact CG2-CD1 3.26Å
733	N	81.3	Confident	85	Confident	14 Å²	14	54.6 Å²	54.6	8%	0.075	29%	0.287	C	S	.	.	H	α-helix	trans	-71.1	-31.4	-175.4	-76.7	-21.7	0	0	0	112.4	E716 C729 C730 R739	E716-N733 PolarHBondContact OE2-ND2 2.99Å; C729-N733 WeakPolarHBondContact O-CB 3.18Å; C729-N733 PolarHBondContact O-N 3.05Å; C729-N733 PolarHBondContact O-ND2 3.21Å; C730-N733 PolarHBondContact O-N 3.43Å; N733-R739 PolarHBondContact O-NH1 3Å
734	E	82.1	Confident	85.6	Confident	87 Å²	87	51.4 Å²	51.4	41%	0.407	27%	0.267	S	S	.	.	H	α-helix	trans	-82.4	-38	177	-73.1	175.6	174.5	0	0	113	R662 C730 Y736	R662-E734 HydrophobicContact CG-CG 4.38Å; R662-E734 IonicContact CZ-OE1 3.61Å; R662-E734 IonicContact NE-OE1 3.94Å; R662-E734 IonicContact NH2-OE1 3.88Å; R662-E734 PolarHBondContact NH2-OE1 3.01Å; C730-E734 PolarHBondContact O-N 3.34Å; E734-Y736 PolarHBondContact O-N 2.99Å
735	T	83.9	Confident	86.2	Confident	43 Å²	43	48.3 Å²	48.3	26%	0.264	25%	0.249	S	C	.	.			trans	-83.3	112.7	-174.6	-52.5	0	0	0	0	111.3	W731 A737 A738 R739	W731-T735 HydrophobicContact CZ2-CG2 4.31Å; W731-T735 PolarHBondContact NE1-OG1 3.33Å; W731-T735 WeakPolarHBondContact O-CB 3.27Å; W731-T735 PolarHBondContact O-N 3.29Å; W731-T735 PolarHBondContact O-OG1 3.49Å; T735-A737 VanDerWaalsContact C-N 3.32Å; T735-A737 HydrophobicContact CG2-CB 4.36Å; T735-A737 PolarHBondContact O-N 3.33Å; T735-A738 HydrophobicContact CG2-CB 4.11Å; T735-A738 PolarHBondContact O-N 3.12Å; T735-R739 PolarHBondContact O-N 3.23Å
736	Y	83.2	Confident	86.8	Confident	71 Å²	71	46.3 Å²	46.3	28%	0.278	24%	0.238	S	C	.	.	H	α-helix	trans	-52.5	-45.2	177.9	176.8	-103.2	0	0	0	113.5	E734 N740	E734-Y736 PolarHBondContact O-N 2.99Å; Y736-N740 WeakPolarHBondContact CE1-ND2 3.21Å; Y736-N740 PolarHBondContact O-N 3.17Å; Y736-N740 VanDerWaalsContact O-N 3.07Å; Y736-N740 PolarHBondContact O-ND2 3.16Å; Y736-N740 PolarHBondContact OH-ND2 3.19Å
737	A	84.3	Confident	87.3	Confident	62 Å²	62	43 Å²	43	51%	0.512	23%	0.226	S	C	.	.	H	α-helix	trans	-64.1	-47.4	-179.4	0	0	0	0	0	111.9	T735 R739 N740 V741	T735-A737 VanDerWaalsContact C-N 3.32Å; T735-A737 HydrophobicContact CG2-CB 4.36Å; T735-A737 PolarHBondContact O-N 3.33Å; A737-R739 PolarHBondContact O-N 2.9Å; A737-N740 PolarHBondContact O-N 3Å; A737-V741 WeakPolarHBondContact O-CG2 3.5Å; A737-V741 PolarHBondContact O-N 3.09Å
738	A	88	Confident	87.7	Confident	12 Å²	12	42 Å²	42	10%	0.099	23%	0.225	C	C	.	.	H	α-helix	trans	-61.2	-44.5	178.9	0	0	0	0	0	111.8	W731 I732 T735 N740 V741 I742	W731-A738 HydrophobicContact CE3-CB 4.05Å; W731-A738 HydrophobicContact CH2-CB 3.79Å; W731-A738 HydrophobicContact CZ3-CB 3.49Å; W731-A738 VanDerWaalsContact CZ3-CB 3.49Å; I732-A738 HydrophobicContact CG1-CB 4.46Å; T735-A738 HydrophobicContact CG2-CB 4.11Å; T735-A738 PolarHBondContact O-N 3.12Å; A738-N740 PolarHBondContact O-N 3.37Å; A738-V741 PolarHBondContact O-N 3.35Å; A738-I742 PolarHBondContact O-N 3.09Å; A738-I742 VanDerWaalsContact O-N 3.11Å
739	R	88.1	Confident	88.2	Confident	13 Å²	13	40.4 Å²	40.4	5%	0.049	21%	0.211	C	C	.	.	H	α-helix	trans	-57.8	-46.9	175.3	-172.9	173.1	61.9	-129.2	4.2	111.7	F666 N733 T735 A737 V741 I742 V743	F666-R739 HydrophobicContact CD1-CG 4.27Å; F666-R739 HydrophobicContact CD2-CG 3.65Å; F666-R739 HydrophobicContact CE1-CG 4.14Å; F666-R739 HydrophobicContact CE2-CG 3.52Å; F666-R739 HydrophobicContact CG-CG 4.05Å; F666-R739 HydrophobicContact CZ-CG 3.78Å; N733-R739 PolarHBondContact O-NH1 3Å; T735-R739 PolarHBondContact O-N 3.23Å; A737-R739 PolarHBondContact O-N 2.9Å; R739-V741 PolarHBondContact O-N 3.12Å; R739-I742 PolarHBondContact O-N 2.86Å; R739-V743 WeakPolarHBondContact O-CG2 3.42Å; R739-V743 PolarHBondContact O-N 3.48Å
740	N	88.6	Confident	88.7	Confident	15 Å²	15	40.4 Å²	40.4	8%	0.08	21%	0.211	C	C	.	.	H	α-helix	trans	-63	-41.6	178.2	-73.2	-21	0	0	0	112.3	Y736 A737 A738 I742 V743 F744	Y736-N740 WeakPolarHBondContact CE1-ND2 3.21Å; Y736-N740 PolarHBondContact O-N 3.17Å; Y736-N740 VanDerWaalsContact O-N 3.07Å; Y736-N740 PolarHBondContact O-ND2 3.16Å; Y736-N740 PolarHBondContact OH-ND2 3.19Å; A737-N740 PolarHBondContact O-N 3Å; A738-N740 PolarHBondContact O-N 3.37Å; N740-I742 VanDerWaalsContact C-N 3.3Å; N740-I742 PolarHBondContact O-N 2.95Å; N740-V743 WeakPolarHBondContact O-CB 3.41Å; N740-V743 PolarHBondContact O-N 3.49Å; N740-V743 VanDerWaalsContact O-N 3.14Å; N740-F744 HydrophobicContact CB-CE2 4.34Å; N740-F744 WeakPolarHBondContact O-CD2 3.45Å; N740-F744 PolarHBondContact O-N 3.2Å
741	V	91.2	Very high	89.1	Confident	87 Å²	87	39.3 Å²	39.3	53%	0.527	20%	0.202	S	C	.	.	H	α-helix	trans	-56.2	-45.7	175.9	171	0	0	0	0	110.7	A737 A738 R739 V743 F744 V745	A737-V741 WeakPolarHBondContact O-CG2 3.5Å; A737-V741 PolarHBondContact O-N 3.09Å; A738-V741 PolarHBondContact O-N 3.35Å; R739-V741 PolarHBondContact O-N 3.12Å; V741-V743 PolarHBondContact O-N 3.24Å; V741-F744 WeakPolarHBondContact O-CB 3.5Å; V741-F744 PolarHBondContact O-N 3.37Å; V741-V745 HydrophobicContact CG1-CG2 4.46Å; V741-V745 WeakPolarHBondContact O-CG2 3.34Å; V741-V745 PolarHBondContact O-N 2.94Å
742	I	91.9	Very high	89.4	Confident	19 Å²	19	35.5 Å²	35.5	10%	0.097	19%	0.193	C	C	.	.	H	α-helix	trans	-64.6	-40.1	177.7	-65.1	175.5	0	0	0	111.8	F666 L670 T713 I732 A738 R739 N740 F744 V745 S746	F666-I742 HydrophobicContact CZ-CB 4.46Å; F666-I742 HydrophobicContact CZ-CG2 4.18Å; L670-I742 HydrophobicContact CD1-CG2 4.42Å; T713-I742 HydrophobicContact CG2-CD1 3.8Å; T713-I742 HydrophobicContact CG2-CG2 4.01Å; I732-I742 HydrophobicContact CB-CD1 4.27Å; I732-I742 HydrophobicContact CD1-CD1 3.81Å; I732-I742 HydrophobicContact CG1-CD1 4Å; I732-I742 HydrophobicContact CG2-CD1 3.26Å; A738-I742 PolarHBondContact O-N 3.09Å; A738-I742 VanDerWaalsContact O-N 3.11Å; R739-I742 PolarHBondContact O-N 2.86Å; N740-I742 VanDerWaalsContact C-N 3.3Å; N740-I742 PolarHBondContact O-N 2.95Å; I742-F744 VanDerWaalsContact C-N 3.3Å; I742-F744 PolarHBondContact O-N 2.6Å; I742-V745 PolarHBondContact O-N 2.95Å; I742-S746 WeakPolarHBondContact O-CB 3.42Å; I742-S746 PolarHBondContact O-N 3.29Å
743	V	91.4	Very high	89.7	Confident	6 Å²	6	34.8 Å²	34.8	4%	0.036	19%	0.19	C	C	.	.	H	α-helix	trans	-58.1	-45.3	174.1	173.4	0	0	0	0	110.7	F666 R739 N740 V741 S746 I747 F804 L807	F666-V743 HydrophobicContact CD2-CG2 4.26Å; F666-V743 HydrophobicContact CE2-CG2 3.67Å; R739-V743 WeakPolarHBondContact O-CG2 3.42Å; R739-V743 PolarHBondContact O-N 3.48Å; N740-V743 WeakPolarHBondContact O-CB 3.41Å; N740-V743 PolarHBondContact O-N 3.49Å; N740-V743 VanDerWaalsContact O-N 3.14Å; V741-V743 PolarHBondContact O-N 3.24Å; V743-S746 WeakPolarHBondContact O-CB 3.49Å; V743-S746 PolarHBondContact O-N 2.98Å; V743-I747 HydrophobicContact CG1-CD1 3.74Å; V743-I747 HydrophobicContact CG1-CG1 4.47Å; V743-I747 VanDerWaalsContact O-CG1 3.31Å; V743-I747 WeakPolarHBondContact O-CG1 3.3Å; V743-I747 PolarHBondContact O-N 3Å; V743-F804 HydrophobicContact CB-CD1 4.34Å; V743-F804 HydrophobicContact CB-CE1 4.4Å; V743-F804 HydrophobicContact CG1-CB 4.08Å; V743-F804 HydrophobicContact CG1-CD1 3.75Å; V743-F804 HydrophobicContact CG1-CD2 3.67Å; V743-F804 HydrophobicContact CG1-CE1 4.09Å; V743-F804 HydrophobicContact CG1-CE2 4.01Å; V743-F804 HydrophobicContact CG1-CG 3.54Å; V743-F804 HydrophobicContact CG1-CZ 4.21Å; V743-F804 HydrophobicContact CG2-CD1 3.7Å; V743-F804 HydrophobicContact CG2-CE1 3.85Å; V743-F804 HydrophobicContact CG2-CG 4.33Å; V743-L807 HydrophobicContact CB-CD1 4.49Å; V743-L807 HydrophobicContact CG1-CD1 4.02Å; V743-L807 HydrophobicContact CG1-CD2 3.91Å; V743-L807 HydrophobicContact CG1-CG 4.45Å
744	F	92.2	Very high	90.1	Very high	67 Å²	67	34.1 Å²	34.1	29%	0.294	19%	0.186	S	C	.	.	H	α-helix	trans	-63.5	-44.8	177.6	-73.7	-68.9	0	0	0	113.2	N740 V741 I742 S746 I747 L748 L811 V815	N740-F744 HydrophobicContact CB-CE2 4.34Å; N740-F744 WeakPolarHBondContact O-CD2 3.45Å; N740-F744 PolarHBondContact O-N 3.2Å; V741-F744 WeakPolarHBondContact O-CB 3.5Å; V741-F744 PolarHBondContact O-N 3.37Å; I742-F744 VanDerWaalsContact C-N 3.3Å; I742-F744 PolarHBondContact O-N 2.6Å; F744-S746 VanDerWaalsContact C-N 3.29Å; F744-S746 PolarHBondContact O-N 3.34Å; F744-I747 PolarHBondContact O-N 3.19Å; F744-L748 WeakPolarHBondContact O-CB 3.29Å; F744-L748 PolarHBondContact O-N 3.03Å; F744-L811 HydrophobicContact CE1-CD1 4.23Å; F744-L811 HydrophobicContact CE1-CD2 3.99Å; F744-L811 HydrophobicContact CE1-CG 3.71Å; F744-L811 HydrophobicContact CE2-CD1 4.41Å; F744-L811 HydrophobicContact CE2-CD2 3.52Å; F744-L811 HydrophobicContact CE2-CG 4.08Å; F744-L811 HydrophobicContact CZ-CD1 3.48Å; F744-L811 VanDerWaalsContact CZ-CD1 3.48Å; F744-L811 HydrophobicContact CZ-CD2 3.13Å; F744-L811 HydrophobicContact CZ-CG 3.16Å; F744-V815 HydrophobicContact CD1-CG2 3.71Å; F744-V815 HydrophobicContact CE1-CG2 3.34Å
745	V	93.8	Very high	90.2	Very high	54 Å²	54	30.5 Å²	30.5	33%	0.327	17%	0.169	S	C	.	.	H	α-helix	trans	-60.8	-42.6	177.7	177	0	0	0	0	110.1	L709 V741 I742 I747 L748 I749	L709-V745 HydrophobicContact CD1-CB 4.41Å; L709-V745 HydrophobicContact CD1-CG1 3.74Å; L709-V745 HydrophobicContact CD2-CG1 4.43Å; V741-V745 HydrophobicContact CG1-CG2 4.46Å; V741-V745 WeakPolarHBondContact O-CG2 3.34Å; V741-V745 PolarHBondContact O-N 2.94Å; I742-V745 PolarHBondContact O-N 2.95Å; V745-I747 PolarHBondContact O-N 3.06Å; V745-L748 PolarHBondContact O-N 3.08Å; V745-I749 HydrophobicContact CG1-CD1 3.96Å; V745-I749 HydrophobicContact CG1-CG1 4.48Å; V745-I749 VanDerWaalsContact O-CG1 3.26Å; V745-I749 WeakPolarHBondContact O-CG1 3.47Å; V745-I749 PolarHBondContact O-N 3.32Å
746	S	94.1	Very high	90.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.5	-43	175.3	168	0	0	0	0	113.1	H706 I742 V743 F744 N750	H706-S746 PolarHBondContact CE1-OG 3.44Å; I742-S746 WeakPolarHBondContact O-CB 3.42Å; I742-S746 PolarHBondContact O-N 3.29Å; V743-S746 WeakPolarHBondContact O-CB 3.49Å; V743-S746 PolarHBondContact O-N 2.98Å; F744-S746 VanDerWaalsContact C-N 3.29Å; F744-S746 PolarHBondContact O-N 3.34Å; S746-N750 PolarHBondContact O-N 3.13Å; S746-N750 PolarHBondContact O-ND2 2.78Å
747	I	93.3	Very high	90	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.015	16%	0.155	C	C	.	.	H	α-helix	trans	-67.4	-42.1	176	-66.7	163.4	0	0	0	110.6	V743 F744 V745 I749 N750 F751 C801 F804 L807 V815 M819	V743-I747 HydrophobicContact CG1-CD1 3.74Å; V743-I747 HydrophobicContact CG1-CG1 4.47Å; V743-I747 VanDerWaalsContact O-CG1 3.31Å; V743-I747 WeakPolarHBondContact O-CG1 3.3Å; V743-I747 PolarHBondContact O-N 3Å; F744-I747 PolarHBondContact O-N 3.19Å; V745-I747 PolarHBondContact O-N 3.06Å; I747-I749 PolarHBondContact O-N 3.39Å; I747-N750 PolarHBondContact O-N 2.72Å; I747-F751 PolarHBondContact O-N 3.24Å; I747-C801 VanDerWaalsContact CG2-SG 3.59Å; I747-F804 HydrophobicContact CD1-CD2 4.09Å; I747-F804 HydrophobicContact CD1-CE2 4.35Å; I747-F804 HydrophobicContact CG1-CD2 4.14Å; I747-F804 HydrophobicContact CG1-CE2 3.93Å; I747-L807 HydrophobicContact CD1-CD2 4.15Å; I747-V815 HydrophobicContact CG2-CG1 3.85Å; I747-M819 HydrophobicContact CG2-CE 4.18Å
748	L	93.3	Very high	89.9	Confident	87 Å²	87	24.3 Å²	24.3	46%	0.455	13%	0.13	S	C	.	.	H	α-helix	trans	-62.5	-41.7	178.7	-178.3	63.7	0	0	0	111.5	F744 V745 N750 F751 L752 M819	F744-L748 WeakPolarHBondContact O-CB 3.29Å; F744-L748 PolarHBondContact O-N 3.03Å; V745-L748 PolarHBondContact O-N 3.08Å; L748-N750 PolarHBondContact O-N 3.3Å; L748-F751 PolarHBondContact O-N 2.96Å; L748-L752 HydrophobicContact CD1-CD1 4.31Å; L748-L752 HydrophobicContact CD1-CG 4.22Å; L748-L752 HydrophobicContact CG-CD1 3.95Å; L748-L752 HydrophobicContact CG-CG 4.31Å; L748-L752 WeakPolarHBondContact O-CB 3.4Å; L748-L752 VanDerWaalsContact O-CG 3.24Å; L748-L752 WeakPolarHBondContact O-CG 3.4Å; L748-L752 PolarHBondContact O-N 3.2Å; L748-M819 HydrophobicContact CD1-CE 4.48Å
749	I	94.6	Very high	89.4	Confident	4 Å²	4	28.2 Å²	28.2	2%	0.021	15%	0.149	C	C	.	.	H	α-helix	trans	-59.8	-45.8	175.9	-70.8	165.4	0	0	0	111.2	L677 L702 L705 H706 L709 V745 I747 L752 A753	L677-I749 HydrophobicContact CD1-CG2 4.34Å; L677-I749 HydrophobicContact CD2-CG2 3.99Å; L702-I749 HydrophobicContact CB-CG2 4.38Å; L702-I749 HydrophobicContact CD2-CG2 4.29Å; L705-I749 HydrophobicContact CB-CD1 4.46Å; L705-I749 HydrophobicContact CD2-CD1 3.64Å; L705-I749 HydrophobicContact CD2-CG1 3.83Å; L705-I749 HydrophobicContact CG-CD1 3.7Å; L705-I749 HydrophobicContact CG-CG1 4.42Å; H706-I749 HydrophobicContact CB-CG2 4.25Å; L709-I749 HydrophobicContact CD1-CD1 3.47Å; L709-I749 VanDerWaalsContact CD1-CD1 3.47Å; V745-I749 HydrophobicContact CG1-CD1 3.96Å; V745-I749 HydrophobicContact CG1-CG1 4.48Å; V745-I749 VanDerWaalsContact O-CG1 3.26Å; V745-I749 WeakPolarHBondContact O-CG1 3.47Å; V745-I749 PolarHBondContact O-N 3.32Å; I747-I749 PolarHBondContact O-N 3.39Å; I749-L752 PolarHBondContact O-N 3.22Å; I749-A753 WeakPolarHBondContact O-CB 3.49Å; I749-A753 PolarHBondContact O-N 2.93Å
750	N	93.8	Very high	88.7	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-64.2	-40.5	177.6	-82.1	-68.2	0	0	0	112.4	A673 L677 S746 I747 L748 A753 A754 A797 T800	A673-N750 PolarHBondContact O-ND2 3.34Å; A673-N750 PolarHBondContact O-OD1 2.84Å; L677-N750 WeakPolarHBondContact CA-OD1 3.48Å; L677-N750 WeakPolarHBondContact CB-OD1 3.33Å; L677-N750 PolarHBondContact N-OD1 3.29Å; S746-N750 PolarHBondContact O-N 3.13Å; S746-N750 PolarHBondContact O-ND2 2.78Å; I747-N750 PolarHBondContact O-N 2.72Å; L748-N750 PolarHBondContact O-N 3.3Å; N750-A753 PolarHBondContact O-N 3.45Å; N750-A754 PolarHBondContact O-N 3.39Å; N750-A797 HydrophobicContact CB-CB 4.48Å; N750-T800 HydrophobicContact CB-CG2 4.05Å
751	F	92.3	Very high	88	Confident	11 Å²	11	32.5 Å²	32.5	5%	0.048	17%	0.165	C	C	.	.	H	α-helix	trans	-66.8	-43.6	176.3	178.6	-106	0	0	0	112.4	I747 L748 A753 A754 M755 A797 M819 I822	I747-F751 PolarHBondContact O-N 3.24Å; L748-F751 PolarHBondContact O-N 2.96Å; F751-A753 VanDerWaalsContact C-N 3.32Å; F751-A753 PolarHBondContact O-N 3.14Å; F751-A754 PolarHBondContact O-N 3.3Å; F751-M755 HydrophobicContact CD2-CG 4.25Å; F751-M755 HydrophobicContact CE1-CG 4.26Å; F751-M755 HydrophobicContact CE2-CG 3.8Å; F751-M755 HydrophobicContact CZ-CG 3.82Å; F751-M755 WeakPolarHBondContact O-CG 3.22Å; F751-M755 PolarHBondContact O-N 3.26Å; F751-M755 VanDerWaalsContact O-N 3.08Å; F751-A797 HydrophobicContact CB-CB 4.49Å; F751-M819 HydrophobicContact CB-CE 3.54Å; F751-M819 HydrophobicContact CB-SD 3.86Å; F751-M819 HydrophobicContact CD1-CE 3.77Å; F751-M819 HydrophobicContact CD1-SD 3.24Å; F751-M819 WeakPolarHBondContact CD1-SD 3.42Å; F751-M819 HydrophobicContact CD2-CB 3.95Å; F751-M819 HydrophobicContact CD2-CE 4.25Å; F751-M819 HydrophobicContact CD2-CG 3.73Å; F751-M819 HydrophobicContact CD2-SD 3.41Å; F751-M819 WeakPolarHBondContact CD2-SD 3.06Å; F751-M819 HydrophobicContact CE1-SD 3.47Å; F751-M819 WeakPolarHBondContact CE1-SD 3.25Å; F751-M819 HydrophobicContact CE2-CB 3.68Å; F751-M819 HydrophobicContact CE2-CG 3.94Å; F751-M819 HydrophobicContact CE2-SD 3.63Å; F751-M819 HydrophobicContact CG-CE 3.59Å; F751-M819 HydrophobicContact CG-CG 4.07Å; F751-M819 HydrophobicContact CG-SD 3.19Å; F751-M819 WeakPolarHBondContact CG-SD 3.36Å; F751-M819 HydrophobicContact CZ-CB 4.23Å; F751-M819 HydrophobicContact CZ-CG 4.45Å; F751-M819 HydrophobicContact CZ-SD 3.65Å; F751-I822 HydrophobicContact CE1-CB 4.28Å; F751-I822 HydrophobicContact CE1-CD1 4.1Å; F751-I822 HydrophobicContact CE1-CG2 3.91Å; F751-I822 HydrophobicContact CZ-CB 4Å; F751-I822 HydrophobicContact CZ-CG2 3.83Å
752	L	91.3	Very high	86.6	Confident	76 Å²	76	33 Å²	33	40%	0.398	17%	0.165	S	C	.	.	H	α-helix	trans	-59.6	-44.9	174	-72.6	170.8	0	0	0	110.3	L748 I749 A754 M755 I756	L748-L752 HydrophobicContact CD1-CD1 4.31Å; L748-L752 HydrophobicContact CD1-CG 4.22Å; L748-L752 HydrophobicContact CG-CD1 3.95Å; L748-L752 HydrophobicContact CG-CG 4.31Å; L748-L752 WeakPolarHBondContact O-CB 3.4Å; L748-L752 VanDerWaalsContact O-CG 3.24Å; L748-L752 WeakPolarHBondContact O-CG 3.4Å; L748-L752 PolarHBondContact O-N 3.2Å; I749-L752 PolarHBondContact O-N 3.22Å; L752-A754 VanDerWaalsContact C-N 3.3Å; L752-A754 PolarHBondContact O-N 3.11Å; L752-M755 PolarHBondContact O-N 2.98Å; L752-M755 VanDerWaalsContact O-N 3.15Å; L752-I756 VanDerWaalsContact O-CB 3.25Å; L752-I756 WeakPolarHBondContact O-CB 3.45Å; L752-I756 PolarHBondContact O-N 3.46Å
753	A	91.1	Very high	84.9	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-58.1	-40.8	176	0	0	0	0	0	112.7	L677 I680 Q684 F699 L702 I749 N750 F751 M755	L677-A753 HydrophobicContact CD1-CB 3.34Å; I680-A753 HydrophobicContact CG2-CB 4.16Å; Q684-A753 PolarHBondContact NE2-O 3.4Å; Q684-A753 PolarHBondContact OE1-O 3.06Å; Q684-A753 VanDerWaalsContact OE1-O 3.13Å; F699-A753 HydrophobicContact CE1-CB 4.2Å; L702-A753 HydrophobicContact CD1-CB 3.81Å; I749-A753 WeakPolarHBondContact O-CB 3.49Å; I749-A753 PolarHBondContact O-N 2.93Å; N750-A753 PolarHBondContact O-N 3.45Å; F751-A753 VanDerWaalsContact C-N 3.32Å; F751-A753 PolarHBondContact O-N 3.14Å; A753-M755 VanDerWaalsContact C-N 3.34Å; A753-M755 PolarHBondContact O-N 3.44Å
754	A	89.7	Confident	82.7	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.7	-35.9	177.5	0	0	0	0	0	112.7	I680 Q684 N750 F751 L752 T793 A797	I680-A754 HydrophobicContact CG2-CB 4.49Å; Q684-A754 PolarHBondContact NE2-O 3.49Å; N750-A754 PolarHBondContact O-N 3.39Å; F751-A754 PolarHBondContact O-N 3.3Å; L752-A754 VanDerWaalsContact C-N 3.3Å; L752-A754 PolarHBondContact O-N 3.11Å; A754-T793 WeakPolarHBondContact CB-O 3.41Å; A754-T793 PolarHBondContact O-OG1 3.46Å; A754-A797 HydrophobicContact CB-CB 4.1Å
755	M	85.3	Confident	80.7	Confident	10 Å²	10	48.4 Å²	48.4	5%	0.049	24%	0.238	C	C	.	.	H	α-helix	trans	-100.8	-24.6	-170.5	-63.9	-56	-66.5	0	0	114.9	F751 L752 A753 N757 I758 Y823 L826	F751-M755 HydrophobicContact CD2-CG 4.25Å; F751-M755 HydrophobicContact CE1-CG 4.26Å; F751-M755 HydrophobicContact CE2-CG 3.8Å; F751-M755 HydrophobicContact CZ-CG 3.82Å; F751-M755 WeakPolarHBondContact O-CG 3.22Å; F751-M755 PolarHBondContact O-N 3.26Å; F751-M755 VanDerWaalsContact O-N 3.08Å; L752-M755 PolarHBondContact O-N 2.98Å; L752-M755 VanDerWaalsContact O-N 3.15Å; A753-M755 VanDerWaalsContact C-N 3.34Å; A753-M755 PolarHBondContact O-N 3.44Å; M755-N757 PolarHBondContact O-N 3.24Å; M755-I758 HydrophobicContact CE-CD1 4.43Å; M755-I758 HydrophobicContact CE-CG2 4.31Å; M755-I758 WeakPolarHBondContact O-CB 3.31Å; M755-I758 WeakPolarHBondContact O-CG2 3.38Å; M755-I758 PolarHBondContact O-N 3.03Å; M755-Y823 HydrophobicContact CE-CD2 3.52Å; M755-Y823 HydrophobicContact CE-CE2 4.09Å; M755-Y823 HydrophobicContact CE-CG 4.49Å; M755-Y823 HydrophobicContact SD-CD2 3.77Å; M755-Y823 HydrophobicContact SD-CE2 4.32Å; M755-L826 HydrophobicContact CE-CB 4.49Å; M755-L826 HydrophobicContact CE-CD1 3.52Å
756	I	82.8	Confident	78.3	Confident	38 Å²	38	49.7 Å²	49.7	20%	0.195	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-59.9	-31	-165.9	-153.3	162.1	0	0	0	113.6	Q698 F699 L752 I758 L759 W760	Q698-I756 HydrophobicContact CG-CD1 4.5Å; F699-I756 HydrophobicContact CZ-CG2 4.3Å; L752-I756 VanDerWaalsContact O-CB 3.25Å; L752-I756 WeakPolarHBondContact O-CB 3.45Å; L752-I756 PolarHBondContact O-N 3.46Å; I756-I758 VanDerWaalsContact C-N 3.31Å; I756-I758 PolarHBondContact O-N 3.47Å; I756-L759 WeakPolarHBondContact O-CB 3.42Å; I756-L759 PolarHBondContact O-N 2.74Å; I756-W760 PolarHBondContact O-NE1 3.25Å
757	N	79.8	Confident	75.5	Confident	8 Å²	8	57.2 Å²	57.2	4%	0.043	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-69.5	-25.8	179.4	-77.9	-18	0	0	0	113.5	Q684 F699 M755 L759 W760 F790	Q684-N757 PolarHBondContact OE1-ND2 2.78Å; F699-N757 WeakPolarHBondContact CE2-ND2 3.14Å; F699-N757 WeakPolarHBondContact CZ-ND2 3.38Å; M755-N757 PolarHBondContact O-N 3.24Å; N757-L759 PolarHBondContact O-N 3.24Å; N757-W760 PolarHBondContact O-N 3.25Å; N757-F790 HydrophobicContact CB-CE1 3.9Å
758	I	80.9	Confident	72.8	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	-62.8	-31.2	176.6	-152.1	174.7	0	0	0	111.1	M755 I756 W760 C761 F790 Y831	M755-I758 HydrophobicContact CE-CD1 4.43Å; M755-I758 HydrophobicContact CE-CG2 4.31Å; M755-I758 WeakPolarHBondContact O-CB 3.31Å; M755-I758 WeakPolarHBondContact O-CG2 3.38Å; M755-I758 PolarHBondContact O-N 3.03Å; I756-I758 VanDerWaalsContact C-N 3.31Å; I756-I758 PolarHBondContact O-N 3.47Å; I758-W760 PolarHBondContact O-N 2.91Å; I758-C761 PolarHBondContact O-N 2.91Å; I758-F790 HydrophobicContact CB-CD1 4.5Å; I758-F790 HydrophobicContact CD1-CD2 4.49Å; I758-F790 HydrophobicContact CG1-CD2 4.35Å; I758-F790 HydrophobicContact CG1-CE2 4.43Å; I758-Y831 HydrophobicContact CD1-CD2 4.07Å; I758-Y831 HydrophobicContact CD1-CG 4.28Å; I758-Y831 HydrophobicContact CG1-CD1 4.43Å; I758-Y831 HydrophobicContact CG1-CD2 4.13Å; I758-Y831 HydrophobicContact CG1-CE2 4.36Å; I758-Y831 HydrophobicContact CG1-CG 4.22Å; I758-Y831 HydrophobicContact CG2-CE2 4.2Å; I758-Y831 WeakPolarHBondContact O-CE1 3.37Å; I758-Y831 VanDerWaalsContact O-CZ 3.27Å; I758-Y831 PolarHBondContact O-OH 3.48Å
759	L	77.4	Confident	70.3	Confident	94 Å²	94	66.4 Å²	66.4	49%	0.492	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-68.2	-20.6	-176.5	-62.7	174.2	0	0	0	113.3	I756 N757 L826 Y831	I756-L759 WeakPolarHBondContact O-CB 3.42Å; I756-L759 PolarHBondContact O-N 2.74Å; N757-L759 PolarHBondContact O-N 3.24Å; L759-L826 HydrophobicContact CD2-CD2 4.15Å; L759-Y831 WeakPolarHBondContact CA-OH 3.45Å
760	W	74.7	Confident	67.5	Low	111 Å²	111	77.6 Å²	77.6	42%	0.42	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-99.2	1.4	-176	-57.6	104.4	0	0	0	113.6	I756 N757 I758 D762	I756-W760 PolarHBondContact O-NE1 3.25Å; N757-W760 PolarHBondContact O-N 3.25Å; I758-W760 PolarHBondContact O-N 2.91Å; W760-D762 PolarHBondContact O-N 3Å
761	C	72.7	Confident	64.8	Low	8 Å²	8	85.1 Å²	85.1	5%	0.054	42%	0.418	C	S	.	.			trans	-69.4	116.6	171.2	-69.3	0	0	0	0	110.1	I758 C784 Y831 L834	I758-C761 PolarHBondContact O-N 2.91Å; C761-C784 WeakPolarHBondContact CA-SG 3.48Å; C761-C784 HydrophobicContact CB-CB 3.95Å; C761-C784 WeakPolarHBondContact CB-SG 3.24Å; C761-C784 WeakPolarHBondContact SG-CB 3.35Å; C761-C784 CovalentContact SG-SG 2.04Å; C761-C784 PolarHBondContact SG-SG 3.35Å; C761-Y831 HydrophobicContact CB-CE1 4.37Å; C761-L834 HydrophobicContact CB-CD1 4.02Å
762	D	62.6	Low	62.2	Low	96 Å²	96	93 Å²	93	51%	0.513	45%	0.454	S	S	.	.			trans	-87.3	129	-174.6	-157.9	-8.1	0	0	0	111.6	R691 W760	R691-D762 IonicContact NH2-OD2 3.43Å; W760-D762 PolarHBondContact O-N 3Å
763	F	55.8	Low	59.6	Low	92 Å²	92	96 Å²	96	40%	0.404	48%	0.476	S	S	.	.	S	Bend	trans	-84.5	-25.6	-175.7	-80	-101.4	0	0	0	113.7	F830 Y831 S833	F763-F830 WeakPolarHBondContact CZ-O 3.34Å; F763-Y831 AromaticContact CE2-CD1 3.55Å; F763-Y831 HydrophobicContact CE2-CD1 3.55Å; F763-Y831 AromaticContact CE2-CE1 3.41Å; F763-Y831 HydrophobicContact CE2-CE1 3.41Å; F763-Y831 VanDerWaalsContact CE2-CE1 3.41Å; F763-Y831 AromaticContact CZ-CD1 3.44Å; F763-Y831 HydrophobicContact CZ-CD1 3.44Å; F763-Y831 VanDerWaalsContact CZ-CD1 3.44Å; F763-Y831 AromaticContact CZ-CE1 3.84Å; F763-Y831 HydrophobicContact CZ-CE1 3.84Å; F763-Y831 HydrophobicContact CZ-CG 4.21Å; F763-S833 WeakPolarHBondContact CE1-OG 3.22Å
764	D	46.5	Very low	57.4	Low	150 Å²	150	106.6 Å²	106.6	80%	0.802	52%	0.518	S	S	*	.	G	3₁₀ helix	trans	-89.9	-4.5	-159.4	-92.1	-15.7	0	0	0	115.7	S766	D764-S766 VanDerWaalsContact C-N 3.31Å; D764-S766 PolarHBondContact O-N 2.89Å
765	K	49.8	Very low	54.7	Low	174 Å²	174	114.1 Å²	114.1	76%	0.757	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-87.3	17.1	-179.4	-84.3	-173.4	178.5	178.1	0	115.3
766	S	43.1	Very low	52.6	Low	81 Å²	81	123.1 Å²	123.1	57%	0.566	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-94.7	-8.4	-171.4	63.9	0	0	0	0	116.5	D764	D764-S766 VanDerWaalsContact C-N 3.31Å; D764-S766 PolarHBondContact O-N 2.89Å
767	N	35.7	Very low	50.2	Low	158 Å²	158	126.4 Å²	126.4	85%	0.845	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91	0.8	-178	-90	-14.1	0	0	0	116.2
768	T	36.8	Very low	48.3	Very low	109 Å²	109	130.6 Å²	130.6	67%	0.669	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107	12.8	-176.6	6.9	0	0	0	0	115.3
769	F	39.4	Very low	46.5	Very low	175 Å²	175	134.8 Å²	134.8	77%	0.768	69%	0.691	S	S	*	*	S	Bend	trans	-90.7	0.7	-179.6	-121	-85.2	0	0	0	115.5
770	R	35.7	Very low	45.2	Very low	239 Å²	239	136.7 Å²	136.7	90%	0.902	70%	0.7	S	S	*	*	S	Bend	trans	-98.8	-6.4	179.9	-103.3	-173.3	177.2	-172.4	0.3	116.7
771	N	38.3	Very low	44.3	Very low	158 Å²	158	132.7 Å²	132.7	85%	0.845	69%	0.689	S	S	*	*	S	Bend	trans	-138.2	43.8	-174.1	-79.9	-15.7	0	0	0	114.6
772	Q	36.8	Very low	44	Very low	176 Å²	176	134 Å²	134	82%	0.822	70%	0.695	S	S	*	*			trans	-132.1	102.8	163.2	-74.5	-172.3	-11.6	0	0	110.9
773	T	37.9	Very low	44.2	Very low	138 Å²	138	129.6 Å²	129.6	85%	0.847	67%	0.672	S	S	*	*			trans	-47.6	129.1	160.5	15.8	0	0	0	0	111.1	N775	T773-N775 PolarHBondContact O-N 3.37Å
774	Y	43.8	Very low	44.9	Very low	224 Å²	224	125.8 Å²	125.8	88%	0.878	66%	0.656	S	S	*	*			trans	18.9	94.7	155.4	-89.7	-94.7	0	0	0	116.4
775	N	33.7	Very low	46	Very low	157 Å²	157	123.1 Å²	123.1	84%	0.84	64%	0.638	S	S	*	*			trans	-147.9	117.2	141.4	-100.5	-21.3	0	0	0	108.4	T773 S777	T773-N775 PolarHBondContact O-N 3.37Å; N775-S777 PolarHBondContact O-N 2.91Å
776	E	39.9	Very low	47.2	Very low	200 Å²	200	116.6 Å²	116.6	94%	0.935	61%	0.609	S	S	*	*			trans	-60.5	94	173.7	-71.2	-172	152.7	0	0	110.4
777	S	34.3	Very low	48.8	Very low	106 Å²	106	112.7 Å²	112.7	74%	0.741	58%	0.582	S	S	*	*			trans	-126.3	97.9	149.5	50.5	0	0	0	0	105.5	N775 S779	N775-S777 PolarHBondContact O-N 2.91Å; S777-S779 PolarHBondContact O-N 3.36Å
778	A	39.6	Very low	50.8	Low	97 Å²	97	106.1 Å²	106.1	80%	0.802	55%	0.546	S	S	*	.			trans	-53.1	108	-179.6	0	0	0	0	0	109.7	I780	A778-I780 PolarHBondContact O-N 2.96Å; A778-I780 VanDerWaalsContact O-N 3.1Å
779	S	43	Very low	53	Low	88 Å²	88	101.3 Å²	101.3	62%	0.615	52%	0.515	S	S	*	.			trans	-63.4	111.1	169.2	53.5	0	0	0	0	108	S777	S777-S779 PolarHBondContact O-N 3.36Å
780	I	49.3	Very low	55.3	Low	133 Å²	133	93.1 Å²	93.1	68%	0.682	48%	0.479	S	S	*	.	P	Polyproline II helix	trans	-59.2	125.7	177.6	-60.2	169.7	0	0	0	108	P688 A778 D782	P688-I780 HydrophobicContact CB-CG2 3.84Å; P688-I780 HydrophobicContact CG-CG2 4.35Å; A778-I780 PolarHBondContact O-N 2.96Å; A778-I780 VanDerWaalsContact O-N 3.1Å; I780-D782 PolarHBondContact O-N 3.17Å
781	P	56.5	Low	57.7	Low	27 Å²	27	81.7 Å²	81.7	18%	0.175	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-63	125.1	176.4	23.8	-30.5	0	0	0	110.1	F269	F269-P781 HydrophobicContact CD1-CG 3.75Å; F269-P781 HydrophobicContact CE1-CG 3.41Å; F269-P781 VanDerWaalsContact CE1-CG 3.41Å; F269-P781 HydrophobicContact CZ-CG 4.35Å
782	D	65.1	Low	60.2	Low	35 Å²	35	74.9 Å²	74.9	19%	0.187	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-79.7	159	177.9	-158.3	-11.6	0	0	0	110.9	P688 S689 A690 I780 C784 F785	P688-D782 CarbonylContact O-C 3.31Å; P688-D782 VanDerWaalsContact O-C 3.31Å; P688-D782 VanDerWaalsContact O-CA 3.3Å; P688-D782 WeakPolarHBondContact O-CA 3.44Å; S689-D782 WeakPolarHBondContact CA-OD1 3.35Å; A690-D782 WeakPolarHBondContact CB-OD2 3.39Å; A690-D782 PolarHBondContact N-OD1 3.4Å; I780-D782 PolarHBondContact O-N 3.17Å; D782-C784 PolarHBondContact O-N 3.46Å; D782-F785 HydrophobicContact CB-CD2 4.03Å; D782-F785 HydrophobicContact CB-CE2 4.27Å; D782-F785 WeakPolarHBondContact O-CB 3.49Å; D782-F785 WeakPolarHBondContact O-CD2 3.43Å; D782-F785 PolarHBondContact O-N 2.98Å
783	I	66.9	Low	62.7	Low	5 Å²	5	66.5 Å²	66.5	3%	0.026	36%	0.36	C	S	.	.	G	3₁₀ helix	trans	-55.7	-27.1	177.8	-166.4	166.4	0	0	0	112.4	Q684 L687 P688 F785 Y786 F790	Q684-I783 HydrophobicContact CB-CD1 4.26Å; L687-I783 HydrophobicContact CB-CB 4.3Å; L687-I783 HydrophobicContact CB-CD1 3.94Å; L687-I783 HydrophobicContact CB-CG1 3.82Å; L687-I783 HydrophobicContact CD1-CD1 4.21Å; L687-I783 HydrophobicContact CD1-CG1 3.98Å; P688-I783 PolarHBondContact O-N 3.45Å; I783-F785 PolarHBondContact O-N 2.97Å; I783-F785 VanDerWaalsContact O-N 3.17Å; I783-Y786 PolarHBondContact O-N 3.29Å; I783-Y786 VanDerWaalsContact O-N 3.1Å; I783-F790 HydrophobicContact CD1-CE1 4.37Å; I783-F790 HydrophobicContact CG1-CE1 4.41Å; I783-F790 HydrophobicContact CG1-CZ 4.07Å; I783-F790 HydrophobicContact CG2-CZ 4.33Å
784	C	71.4	Confident	65.2	Low	12 Å²	12	60 Å²	60	8%	0.081	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-67.2	-6.8	175.6	-53	0	0	0	0	114.2	C761 D782 L834	C761-C784 WeakPolarHBondContact CA-SG 3.48Å; C761-C784 HydrophobicContact CB-CB 3.95Å; C761-C784 WeakPolarHBondContact CB-SG 3.24Å; C761-C784 WeakPolarHBondContact SG-CB 3.35Å; C761-C784 CovalentContact SG-SG 2.04Å; C761-C784 PolarHBondContact SG-SG 3.35Å; D782-C784 PolarHBondContact O-N 3.46Å; C784-L834 HydrophobicContact CB-CD1 3.96Å
785	F	69.9	Low	67.5	Low	94 Å²	94	49.3 Å²	49.3	41%	0.412	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-86.6	-10.8	171.1	-76.6	-93.9	0	0	0	113.3	D782 I783 P787 Y838	D782-F785 HydrophobicContact CB-CD2 4.03Å; D782-F785 HydrophobicContact CB-CE2 4.27Å; D782-F785 WeakPolarHBondContact O-CB 3.49Å; D782-F785 WeakPolarHBondContact O-CD2 3.43Å; D782-F785 PolarHBondContact O-N 2.98Å; I783-F785 PolarHBondContact O-N 2.97Å; I783-F785 VanDerWaalsContact O-N 3.17Å; F785-P787 VanDerWaalsContact C-CD 3.45Å; F785-P787 WeakPolarHBondContact O-CD 2.94Å; F785-Y838 WeakPolarHBondContact O-CD2 3.26Å; F785-Y838 WeakPolarHBondContact O-CE2 3.42Å
786	Y	73.8	Confident	70.3	Confident	36 Å²	36	42 Å²	42	14%	0.141	24%	0.239	C	C	.	.			trans	-124.8	69	179.1	-57.7	-78.1	0	0	0	111.7	I783 E788 Y789 Y838	I783-Y786 PolarHBondContact O-N 3.29Å; I783-Y786 VanDerWaalsContact O-N 3.1Å; Y786-E788 PolarHBondContact O-N 3.02Å; Y786-E788 VanDerWaalsContact O-N 3.15Å; Y786-Y789 PolarHBondContact O-N 3.48Å; Y786-Y838 HydrophobicContact CD1-CE2 4.4Å
787	P	76.3	Confident	72.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-27.9	-176	16.3	-27.4	0	0	0	115.2	F785 Y789 F790 L834 F835 Y838	F785-P787 VanDerWaalsContact C-CD 3.45Å; F785-P787 WeakPolarHBondContact O-CD 2.94Å; P787-Y789 PolarHBondContact O-N 3.24Å; P787-F790 WeakPolarHBondContact O-CB 3.46Å; P787-F790 WeakPolarHBondContact O-CD2 3.46Å; P787-F790 PolarHBondContact O-N 3.34Å; P787-F790 VanDerWaalsContact O-N 3.12Å; P787-L834 HydrophobicContact CB-CD2 3.52Å; P787-L834 HydrophobicContact CG-CD2 3.84Å; P787-F835 HydrophobicContact CB-CD1 3.94Å; P787-F835 HydrophobicContact CB-CD2 4.44Å; P787-F835 HydrophobicContact CB-CE1 3.63Å; P787-F835 HydrophobicContact CB-CE2 4.14Å; P787-F835 HydrophobicContact CB-CG 4.35Å; P787-F835 HydrophobicContact CB-CZ 3.73Å; P787-F835 HydrophobicContact CG-CD1 4.31Å; P787-F835 HydrophobicContact CG-CE1 4.42Å; P787-Y838 HydrophobicContact CG-CD1 4.16Å; P787-Y838 HydrophobicContact CG-CD2 3.97Å; P787-Y838 HydrophobicContact CG-CG 3.64Å
788	E	78.3	Confident	75.6	Confident	19 Å²	19	27.7 Å²	27.7	9%	0.089	16%	0.161	C	C	.	.	H	α-helix	trans	-59	-32	-177.8	-56.4	-168.5	161.5	0	0	113.1	Y786 F790 V791 F792 Y838 T851	Y786-E788 PolarHBondContact O-N 3.02Å; Y786-E788 VanDerWaalsContact O-N 3.15Å; E788-F790 VanDerWaalsContact C-N 3.31Å; E788-F790 PolarHBondContact O-N 2.9Å; E788-V791 VanDerWaalsContact O-CB 3.31Å; E788-V791 WeakPolarHBondContact O-CB 3.45Å; E788-V791 PolarHBondContact O-N 2.97Å; E788-V791 VanDerWaalsContact O-N 3.08Å; E788-F792 HydrophobicContact CB-CE2 3.85Å; E788-F792 HydrophobicContact CB-CZ 4.01Å; E788-F792 WeakPolarHBondContact O-CD2 3.38Å; E788-F792 WeakPolarHBondContact O-CG 3.31Å; E788-F792 PolarHBondContact O-N 3.41Å; E788-Y838 HydrophobicContact CG-CE1 4Å; E788-Y838 WeakPolarHBondContact OE1-CE1 3.38Å; E788-T851 HydrophobicContact CG-CG2 4.41Å; E788-T851 VanDerWaalsContact OE1-CG2 3.26Å; E788-T851 WeakPolarHBondContact OE1-CG2 3.46Å
789	Y	84.1	Confident	78.1	Confident	8 Å²	8	23.1 Å²	23.1	3%	0.031	12%	0.123	C	C	.	.	H	α-helix	trans	-69.1	-27.2	179.9	-75.2	-94.3	0	0	0	113	Q273 A276 Q277 L280 I683 L687 Y786 P787 V791 F792 T793	Q273-Y789 HydrophobicContact CG-CE2 4.43Å; Q273-Y789 WeakPolarHBondContact CG-OH 3.32Å; Q273-Y789 PolarHBondContact O-OH 3.32Å; A276-Y789 HydrophobicContact CB-CD1 4.46Å; A276-Y789 HydrophobicContact CB-CE1 3.79Å; Q277-Y789 HydrophobicContact CG-CE1 4.3Å; Q277-Y789 WeakPolarHBondContact CG-OH 3.2Å; L280-Y789 HydrophobicContact CD1-CD1 4.44Å; I683-Y789 HydrophobicContact CG2-CD1 4.22Å; L687-Y789 HydrophobicContact CD1-CD1 4.15Å; L687-Y789 HydrophobicContact CD1-CD2 4.28Å; L687-Y789 HydrophobicContact CD1-CG 3.87Å; Y786-Y789 PolarHBondContact O-N 3.48Å; P787-Y789 PolarHBondContact O-N 3.24Å; Y789-V791 PolarHBondContact O-N 2.93Å; Y789-F792 HydrophobicContact CD1-CD2 4.33Å; Y789-F792 HydrophobicContact CG-CD2 4.41Å; Y789-F792 PolarHBondContact O-N 3.09Å; Y789-T793 WeakPolarHBondContact O-CG2 3.42Å; Y789-T793 PolarHBondContact O-N 3.19Å; Y789-T793 PolarHBondContact O-OG1 2.9Å; Y789-T793 VanDerWaalsContact O-OG1 3.05Å
790	F	86.2	Confident	80.4	Confident	3 Å²	3	18.9 Å²	18.9	1%	0.013	9%	0.094	C	C	.	.	H	α-helix	trans	-62.5	-39.1	171.6	-62.5	-61.2	0	0	0	110.4	N757 I758 I783 P787 E788 T793 G794	N757-F790 HydrophobicContact CB-CE1 3.9Å; I758-F790 HydrophobicContact CB-CD1 4.5Å; I758-F790 HydrophobicContact CD1-CD2 4.49Å; I758-F790 HydrophobicContact CG1-CD2 4.35Å; I758-F790 HydrophobicContact CG1-CE2 4.43Å; I783-F790 HydrophobicContact CD1-CE1 4.37Å; I783-F790 HydrophobicContact CG1-CE1 4.41Å; I783-F790 HydrophobicContact CG1-CZ 4.07Å; I783-F790 HydrophobicContact CG2-CZ 4.33Å; P787-F790 WeakPolarHBondContact O-CB 3.46Å; P787-F790 WeakPolarHBondContact O-CD2 3.46Å; P787-F790 PolarHBondContact O-N 3.34Å; P787-F790 VanDerWaalsContact O-N 3.12Å; E788-F790 VanDerWaalsContact C-N 3.31Å; E788-F790 PolarHBondContact O-N 2.9Å; F790-T793 PolarHBondContact O-N 3.26Å; F790-T793 PolarHBondContact O-OG1 3.48Å; F790-G794 PolarHBondContact O-N 3.14Å
791	V	87.1	Confident	82.4	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-68.2	-46.7	178.4	-163.9	0	0	0	0	110.3	E788 Y789 T793 G794 V795 Y823 S855 M859	E788-V791 VanDerWaalsContact O-CB 3.31Å; E788-V791 WeakPolarHBondContact O-CB 3.45Å; E788-V791 PolarHBondContact O-N 2.97Å; E788-V791 VanDerWaalsContact O-N 3.08Å; Y789-V791 PolarHBondContact O-N 2.93Å; V791-T793 VanDerWaalsContact C-N 3.34Å; V791-T793 PolarHBondContact O-N 3.43Å; V791-G794 CarbonylContact O-C 3.58Å; V791-G794 WeakPolarHBondContact O-CA 3.46Å; V791-G794 PolarHBondContact O-N 3.4Å; V791-G794 VanDerWaalsContact O-N 3.09Å; V791-V795 WeakPolarHBondContact O-CG2 3.41Å; V791-V795 PolarHBondContact O-N 3.22Å; V791-Y823 HydrophobicContact CG2-CE2 4.26Å; V791-Y823 WeakPolarHBondContact CG2-OH 3.32Å; V791-S855 WeakPolarHBondContact CG2-OG 3.26Å; V791-M859 HydrophobicContact CG1-CG 4.18Å; V791-M859 HydrophobicContact CG1-SD 4.41Å
792	F	89.8	Confident	84	Confident	14 Å²	14	11.3 Å²	11.3	6%	0.061	5%	0.054	C	C	.	.	H	α-helix	trans	-62.9	-41.1	178.6	-54.5	-35.4	0	0	0	111.6	V224 L228 L280 E788 Y789 G794 V795 L796 L858	V224-F792 HydrophobicContact CB-CE1 4.45Å; V224-F792 HydrophobicContact CB-CE2 4Å; V224-F792 HydrophobicContact CB-CZ 3.82Å; V224-F792 HydrophobicContact CG1-CD2 4.08Å; V224-F792 HydrophobicContact CG1-CE1 4.41Å; V224-F792 HydrophobicContact CG1-CE2 3.77Å; V224-F792 HydrophobicContact CG1-CZ 3.95Å; L228-F792 HydrophobicContact CD1-CB 4.04Å; L228-F792 HydrophobicContact CD1-CD1 3.91Å; L228-F792 HydrophobicContact CD1-CG 4.15Å; L280-F792 HydrophobicContact CD1-CB 3.51Å; L280-F792 HydrophobicContact CD1-CD2 4.24Å; L280-F792 HydrophobicContact CD1-CG 4.26Å; E788-F792 HydrophobicContact CB-CE2 3.85Å; E788-F792 HydrophobicContact CB-CZ 4.01Å; E788-F792 WeakPolarHBondContact O-CD2 3.38Å; E788-F792 WeakPolarHBondContact O-CG 3.31Å; E788-F792 PolarHBondContact O-N 3.41Å; Y789-F792 HydrophobicContact CD1-CD2 4.33Å; Y789-F792 HydrophobicContact CG-CD2 4.41Å; Y789-F792 PolarHBondContact O-N 3.09Å; F792-G794 VanDerWaalsContact C-N 3.34Å; F792-V795 PolarHBondContact O-N 3.36Å; F792-L796 WeakPolarHBondContact O-CG 3.19Å; F792-L796 PolarHBondContact O-N 3.1Å; F792-L858 HydrophobicContact CD1-CD2 4.14Å; F792-L858 HydrophobicContact CE1-CD2 4.09Å
793	T	90.5	Very high	85.2	Confident	1 Å²	1	9.7 Å²	9.7	1%	0.006	5%	0.045	C	C	.	.	H	α-helix	trans	-68	-31.6	172.9	59.6	0	0	0	0	113	I680 I683 Q684 A754 Y789 F790 V791 L796 A797	I680-T793 HydrophobicContact CG2-CG2 4.42Å; I683-T793 HydrophobicContact CB-CG2 4.38Å; I683-T793 HydrophobicContact CD1-CG2 4.49Å; I683-T793 HydrophobicContact CG2-CG2 3.97Å; Q684-T793 HydrophobicContact CG-CG2 4.16Å; Q684-T793 PolarHBondContact NE2-OG1 3.09Å; A754-T793 WeakPolarHBondContact CB-O 3.41Å; A754-T793 PolarHBondContact O-OG1 3.46Å; Y789-T793 WeakPolarHBondContact O-CG2 3.42Å; Y789-T793 PolarHBondContact O-N 3.19Å; Y789-T793 PolarHBondContact O-OG1 2.9Å; Y789-T793 VanDerWaalsContact O-OG1 3.05Å; F790-T793 PolarHBondContact O-N 3.26Å; F790-T793 PolarHBondContact O-OG1 3.48Å; V791-T793 VanDerWaalsContact C-N 3.34Å; V791-T793 PolarHBondContact O-N 3.43Å; T793-L796 WeakPolarHBondContact O-CB 3.24Å; T793-L796 PolarHBondContact O-N 3.15Å; T793-A797 PolarHBondContact O-N 3.27Å
794	G	90.1	Very high	86.3	Confident	1 Å²	1	9.7 Å²	9.7	1%	0.01	5%	0.045	C	C	.	.	H	α-helix	trans	-65	-39.5	171	0	0	0	0	0	112.6	F790 V791 F792 A797 M798	F790-G794 PolarHBondContact O-N 3.14Å; V791-G794 CarbonylContact O-C 3.58Å; V791-G794 WeakPolarHBondContact O-CA 3.46Å; V791-G794 PolarHBondContact O-N 3.4Å; V791-G794 VanDerWaalsContact O-N 3.09Å; F792-G794 VanDerWaalsContact C-N 3.34Å; G794-A797 WeakPolarHBondContact O-CB 3.33Å; G794-A797 PolarHBondContact O-N 3.02Å; G794-M798 WeakPolarHBondContact O-CG 2.96Å; G794-M798 PolarHBondContact O-N 3Å
795	V	92.1	Very high	86.8	Confident	0 Å²	0	9.2 Å²	9.2	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-63.8	-42.4	172.3	169.5	0	0	0	0	110.9	V791 F792 A797 M798 V799 L858 M859 F862	V791-V795 WeakPolarHBondContact O-CG2 3.41Å; V791-V795 PolarHBondContact O-N 3.22Å; F792-V795 PolarHBondContact O-N 3.36Å; V795-A797 VanDerWaalsContact C-N 3.28Å; V795-A797 PolarHBondContact O-N 3.14Å; V795-M798 WeakPolarHBondContact O-CB 3.5Å; V795-M798 PolarHBondContact O-N 3.45Å; V795-M798 VanDerWaalsContact O-N 3.09Å; V795-V799 WeakPolarHBondContact O-CG2 3.47Å; V795-V799 PolarHBondContact O-N 2.69Å; V795-L858 HydrophobicContact CG2-CD2 4.22Å; V795-L858 HydrophobicContact CG2-CG 4.31Å; V795-M859 HydrophobicContact CG2-CG 4.34Å; V795-F862 HydrophobicContact CG1-CD1 3.71Å; V795-F862 HydrophobicContact CG1-CD2 3.66Å; V795-F862 HydrophobicContact CG1-CE1 3.55Å; V795-F862 HydrophobicContact CG1-CE2 3.52Å; V795-F862 HydrophobicContact CG1-CG 3.74Å; V795-F862 HydrophobicContact CG1-CZ 3.44Å; V795-F862 VanDerWaalsContact CG1-CZ 3.44Å; V795-F862 HydrophobicContact CG2-CD2 4.25Å
796	L	92.9	Very high	87.3	Confident	2 Å²	2	6.4 Å²	6.4	1%	0.01	3%	0.028	C	C	.	.	H	α-helix	trans	-57.9	-42.2	172.3	-66.1	-179	0	0	0	111.6	L280 C283 M284 V676 I680 I683 F792 T793 M798 V799 T800	L280-L796 HydrophobicContact CG-CD1 4.35Å; C283-L796 HydrophobicContact CB-CD1 4.2Å; C283-L796 HydrophobicContact CB-CD2 4.29Å; M284-L796 HydrophobicContact CG-CD2 3.59Å; M284-L796 HydrophobicContact SD-CD2 3.3Å; M284-L796 WeakPolarHBondContact SD-CD2 3.44Å; V676-L796 HydrophobicContact CG1-CB 4.41Å; I680-L796 HydrophobicContact CD1-CB 4.22Å; I680-L796 HydrophobicContact CG1-CB 4.13Å; I680-L796 HydrophobicContact CG1-CD1 4.12Å; I683-L796 HydrophobicContact CD1-CD1 3.51Å; F792-L796 WeakPolarHBondContact O-CG 3.19Å; F792-L796 PolarHBondContact O-N 3.1Å; T793-L796 WeakPolarHBondContact O-CB 3.24Å; T793-L796 PolarHBondContact O-N 3.15Å; L796-M798 PolarHBondContact O-N 3.47Å; L796-V799 WeakPolarHBondContact O-CB 3.47Å; L796-V799 PolarHBondContact O-N 2.89Å; L796-T800 PolarHBondContact O-N 2.94Å
797	A	92.3	Very high	87.7	Confident	4 Å²	4	5 Å²	5	3%	0.033	2%	0.023	C	C	.	.	H	α-helix	trans	-62.9	-39.5	174.4	0	0	0	0	0	112	N750 F751 A754 T793 G794 V795 V799 T800	N750-A797 HydrophobicContact CB-CB 4.48Å; F751-A797 HydrophobicContact CB-CB 4.49Å; A754-A797 HydrophobicContact CB-CB 4.1Å; T793-A797 PolarHBondContact O-N 3.27Å; G794-A797 WeakPolarHBondContact O-CB 3.33Å; G794-A797 PolarHBondContact O-N 3.02Å; V795-A797 VanDerWaalsContact C-N 3.28Å; V795-A797 PolarHBondContact O-N 3.14Å; A797-V799 VanDerWaalsContact C-N 3.33Å; A797-V799 PolarHBondContact O-N 3.32Å; A797-T800 WeakPolarHBondContact O-CB 3.35Å; A797-T800 PolarHBondContact O-N 3.13Å; A797-T800 PolarHBondContact O-OG1 3.16Å
798	M	92.7	Very high	88	Confident	2 Å²	2	6 Å²	6	1%	0.01	3%	0.028	C	C	.	.	H	α-helix	trans	-63.3	-36.6	173.3	-69.3	177.1	65.4	0	0	112.8	G794 V795 L796 T800 C801 L816 I820 M859 F862 L863	G794-M798 WeakPolarHBondContact O-CG 2.96Å; G794-M798 PolarHBondContact O-N 3Å; V795-M798 WeakPolarHBondContact O-CB 3.5Å; V795-M798 PolarHBondContact O-N 3.45Å; V795-M798 VanDerWaalsContact O-N 3.09Å; L796-M798 PolarHBondContact O-N 3.47Å; M798-T800 PolarHBondContact O-N 3.34Å; M798-C801 VanDerWaalsContact O-CB 3.25Å; M798-C801 WeakPolarHBondContact O-CB 3.33Å; M798-C801 PolarHBondContact O-N 3.17Å; M798-C801 VanDerWaalsContact O-N 3.08Å; M798-L816 HydrophobicContact CB-CD2 3.86Å; M798-L816 HydrophobicContact CE-CD2 3.85Å; M798-L816 HydrophobicContact CG-CD2 3.93Å; M798-I820 HydrophobicContact CE-CD1 4.13Å; M798-I820 HydrophobicContact CE-CG1 4.42Å; M798-I820 HydrophobicContact SD-CG1 4.44Å; M798-M859 WeakPolarHBondContact CE-O 3.38Å; M798-M859 HydrophobicContact SD-CB 4.34Å; M798-M859 HydrophobicContact SD-CE 3.76Å; M798-M859 HydrophobicContact SD-CG 4.41Å; M798-F862 HydrophobicContact CE-CB 4.01Å; M798-L863 HydrophobicContact CE-CB 3.93Å
799	V	92.6	Very high	88.2	Confident	1 Å²	1	5.2 Å²	5.2	1%	0.006	3%	0.025	C	C	.	.	H	α-helix	trans	-63.5	-28.3	176.3	171.9	0	0	0	0	111.4	F232 M284 A287 I291 V795 L796 A797 C801 A802 V803 F862	F232-V799 HydrophobicContact CD2-CG1 4.32Å; F232-V799 HydrophobicContact CD2-CG2 4.05Å; F232-V799 HydrophobicContact CE2-CG1 4.38Å; F232-V799 HydrophobicContact CE2-CG2 4.37Å; M284-V799 HydrophobicContact CE-CG2 3.95Å; M284-V799 HydrophobicContact SD-CG1 4.5Å; M284-V799 HydrophobicContact SD-CG2 4.03Å; A287-V799 HydrophobicContact CB-CG1 4.15Å; I291-V799 HydrophobicContact CD1-CG1 3.92Å; V795-V799 WeakPolarHBondContact O-CG2 3.47Å; V795-V799 PolarHBondContact O-N 2.69Å; L796-V799 WeakPolarHBondContact O-CB 3.47Å; L796-V799 PolarHBondContact O-N 2.89Å; A797-V799 VanDerWaalsContact C-N 3.33Å; A797-V799 PolarHBondContact O-N 3.32Å; V799-C801 PolarHBondContact O-N 3.34Å; V799-A802 WeakPolarHBondContact O-CA 3Å; V799-A802 VanDerWaalsContact O-CB 3.22Å; V799-A802 WeakPolarHBondContact O-CB 3.25Å; V799-A802 PolarHBondContact O-N 3.5Å; V799-V803 PolarHBondContact O-N 3.06Å; V799-F862 HydrophobicContact CG2-CD1 4.23Å; V799-F862 HydrophobicContact CG2-CE1 3.98Å
800	T	91.4	Very high	88.3	Confident	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-59	-30.5	173.2	73.6	0	0	0	0	112.6	V676 N750 L796 A797 M798 A802 V803 F804	V676-T800 HydrophobicContact CB-CG2 3.99Å; V676-T800 HydrophobicContact CG1-CG2 3.59Å; V676-T800 HydrophobicContact CG2-CG2 4.41Å; N750-T800 HydrophobicContact CB-CG2 4.05Å; L796-T800 PolarHBondContact O-N 2.94Å; A797-T800 WeakPolarHBondContact O-CB 3.35Å; A797-T800 PolarHBondContact O-N 3.13Å; A797-T800 PolarHBondContact O-OG1 3.16Å; M798-T800 PolarHBondContact O-N 3.34Å; T800-A802 VanDerWaalsContact C-N 3.28Å; T800-A802 PolarHBondContact O-N 3.02Å; T800-V803 WeakPolarHBondContact O-CB 3.33Å; T800-V803 PolarHBondContact O-N 2.86Å; T800-F804 VanDerWaalsContact O-CD2 3.22Å; T800-F804 WeakPolarHBondContact O-CD2 3.16Å
801	C	91.4	Very high	88.3	Confident	1 Å²	1	9.6 Å²	9.6	1%	0.007	5%	0.05	C	C	.	.	H	α-helix	trans	-66.3	-29.3	172.8	-62.3	0	0	0	0	112.8	I747 M798 V799 K812 L816 V866	I747-C801 VanDerWaalsContact CG2-SG 3.59Å; M798-C801 VanDerWaalsContact O-CB 3.25Å; M798-C801 WeakPolarHBondContact O-CB 3.33Å; M798-C801 PolarHBondContact O-N 3.17Å; M798-C801 VanDerWaalsContact O-N 3.08Å; V799-C801 PolarHBondContact O-N 3.34Å; C801-K812 WeakPolarHBondContact O-CE 3.34Å; C801-K812 PolarHBondContact O-NZ 3.3Å; C801-L816 HydrophobicContact CB-CD2 4.06Å; C801-L816 HydrophobicContact CB-CG 4.5Å; C801-V866 HydrophobicContact CB-CG1 4.28Å
802	A	89.4	Confident	88.4	Confident	0 Å²	0	9.7 Å²	9.7	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-71.5	-33.4	178.3	0	0	0	0	0	112	F232 I291 V799 T800 F804 V866	F232-A802 HydrophobicContact CE2-CB 3.91Å; F232-A802 HydrophobicContact CZ-CB 4.12Å; I291-A802 HydrophobicContact CD1-CB 3.96Å; V799-A802 WeakPolarHBondContact O-CA 3Å; V799-A802 VanDerWaalsContact O-CB 3.22Å; V799-A802 WeakPolarHBondContact O-CB 3.25Å; V799-A802 PolarHBondContact O-N 3.5Å; T800-A802 VanDerWaalsContact C-N 3.28Å; T800-A802 PolarHBondContact O-N 3.02Å; A802-F804 VanDerWaalsContact C-N 3.31Å; A802-F804 PolarHBondContact O-N 3.32Å; A802-V866 HydrophobicContact CB-CG1 3.92Å; A802-V866 HydrophobicContact CB-CG2 4.24Å
803	V	90.5	Very high	88.5	Confident	1 Å²	1	10.7 Å²	10.7	1%	0.006	6%	0.057	C	C	.	.	H	α-helix	trans	-60	-38.8	178	178.7	0	0	0	0	111.4	I291 N669 C672 V799 T800 L805	I291-V803 HydrophobicContact CD1-CG2 4.12Å; I291-V803 HydrophobicContact CG1-CG2 3.9Å; N669-V803 HydrophobicContact CB-CG1 3.92Å; N669-V803 VanDerWaalsContact CG-O 3.22Å; N669-V803 PolarHBondContact ND2-O 3.46Å; N669-V803 PolarHBondContact OD1-O 3.39Å; C672-V803 HydrophobicContact CB-CG1 3.75Å; V799-V803 PolarHBondContact O-N 3.06Å; T800-V803 WeakPolarHBondContact O-CB 3.33Å; T800-V803 PolarHBondContact O-N 2.86Å; V803-L805 PolarHBondContact O-N 3.17Å
804	F	90	Very high	88.5	Confident	5 Å²	5	13.3 Å²	13.3	2%	0.022	8%	0.078	C	C	.	.			trans	-76.1	84	179.9	-66	-74.3	0	0	0	112.4	N669 L670 A673 V743 I747 T800 A802 R806 L807 K812	N669-F804 HydrophobicContact CB-CD1 3.67Å; N669-F804 HydrophobicContact CB-CE1 3.75Å; L670-F804 HydrophobicContact CD1-CZ 4.44Å; A673-F804 HydrophobicContact CB-CE2 4.28Å; A673-F804 HydrophobicContact CB-CZ 4.11Å; V743-F804 HydrophobicContact CB-CD1 4.34Å; V743-F804 HydrophobicContact CB-CE1 4.4Å; V743-F804 HydrophobicContact CG1-CB 4.08Å; V743-F804 HydrophobicContact CG1-CD1 3.75Å; V743-F804 HydrophobicContact CG1-CD2 3.67Å; V743-F804 HydrophobicContact CG1-CE1 4.09Å; V743-F804 HydrophobicContact CG1-CE2 4.01Å; V743-F804 HydrophobicContact CG1-CG 3.54Å; V743-F804 HydrophobicContact CG1-CZ 4.21Å; V743-F804 HydrophobicContact CG2-CD1 3.7Å; V743-F804 HydrophobicContact CG2-CE1 3.85Å; V743-F804 HydrophobicContact CG2-CG 4.33Å; I747-F804 HydrophobicContact CD1-CD2 4.09Å; I747-F804 HydrophobicContact CD1-CE2 4.35Å; I747-F804 HydrophobicContact CG1-CD2 4.14Å; I747-F804 HydrophobicContact CG1-CE2 3.93Å; T800-F804 VanDerWaalsContact O-CD2 3.22Å; T800-F804 WeakPolarHBondContact O-CD2 3.16Å; A802-F804 VanDerWaalsContact C-N 3.31Å; A802-F804 PolarHBondContact O-N 3.32Å; F804-R806 PolarHBondContact O-N 3.5Å; F804-L807 HydrophobicContact CB-CB 4.11Å; F804-L807 PolarHBondContact O-N 3.36Å; F804-K812 WeakPolarHBondContact O-CE 3.39Å; F804-K812 PolarHBondContact O-NZ 3.48Å
805	L	82.4	Confident	88.6	Confident	1 Å²	1	14 Å²	14	1%	0.005	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-35.8	-171.3	-55.4	175.1	0	0	0	114.6	L294 V803 V873 L877	L294-L805 HydrophobicContact CB-CD1 3.81Å; V803-L805 PolarHBondContact O-N 3.17Å; L805-V873 HydrophobicContact CB-CG1 4.18Å; L805-V873 HydrophobicContact CD2-CG1 4.16Å; L805-L877 HydrophobicContact CB-CD1 4.41Å
806	R	79.3	Confident	88.6	Confident	35 Å²	35	14 Å²	14	13%	0.132	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-6.7	-177.5	-67.1	-155.5	-169.8	-164.3	-4.4	115.6	D663 F804 L877	D663-R806 VanDerWaalsContact CG-NE 3.3Å; D663-R806 WeakPolarHBondContact OD1-CD 3.29Å; D663-R806 IonicContact OD1-CZ 3.41Å; D663-R806 IonicContact OD1-NE 3.39Å; D663-R806 PolarHBondContact OD1-NE 3.48Å; D663-R806 IonicContact OD1-NH2 2.94Å; D663-R806 WeakPolarHBondContact OD2-CD 3.45Å; D663-R806 WeakPolarHBondContact OD2-CG 3.19Å; D663-R806 IonicContact OD2-NE 3.05Å; F804-R806 PolarHBondContact O-N 3.5Å; R806-L877 HydrophobicContact CG-CD1 4.18Å; R806-L877 HydrophobicContact CG-CD2 4.13Å
807	L	82.2	Confident	88.6	Confident	6 Å²	6	18.2 Å²	18.2	3%	0.031	10%	0.104	C	C	.	.	S	Bend	trans	-63.6	138.8	179.1	-173.2	71.1	0	0	0	110.1	V743 I747 F804 S809 L811 K812	V743-L807 HydrophobicContact CB-CD1 4.49Å; V743-L807 HydrophobicContact CG1-CD1 4.02Å; V743-L807 HydrophobicContact CG1-CD2 3.91Å; V743-L807 HydrophobicContact CG1-CG 4.45Å; I747-L807 HydrophobicContact CD1-CD2 4.15Å; F804-L807 HydrophobicContact CB-CB 4.11Å; F804-L807 PolarHBondContact O-N 3.36Å; L807-S809 PolarHBondContact O-N 3.08Å; L807-L811 HydrophobicContact CD1-CD2 3.75Å; L807-L811 HydrophobicContact CG-CD2 4.41Å; L807-K812 HydrophobicContact CB-CG 4.21Å; L807-K812 HydrophobicContact CD2-CG 3.68Å; L807-K812 HydrophobicContact CG-CG 4.01Å; L807-K812 WeakPolarHBondContact O-CE 3.28Å
808	N	82.8	Confident	88.6	Confident	23 Å²	23	22.7 Å²	22.7	12%	0.123	13%	0.127	C	C	.	.			trans	-58.3	133.3	-176.9	-176.5	6.6	0	0	0	111.4	S646 V810 L811 K812 K874	S646-N808 PolarHBondContact O-OD1 3.17Å; N808-V810 VanDerWaalsContact C-N 3.3Å; N808-V810 PolarHBondContact O-N 3.15Å; N808-V810 PolarHBondContact OD1-N 3.08Å; N808-L811 HydrophobicContact CB-CB 3.93Å; N808-L811 WeakPolarHBondContact O-CA 3.36Å; N808-L811 VanDerWaalsContact O-CB 3.31Å; N808-L811 WeakPolarHBondContact O-CB 3.03Å; N808-L811 PolarHBondContact O-N 3.35Å; N808-K812 PolarHBondContact O-N 3.13Å; N808-K874 PolarHBondContact OD1-NZ 2.99Å
809	S	82.5	Confident	88.5	Confident	1 Å²	1	23.2 Å²	23.2	1%	0.007	13%	0.13	C	C	.	.	H	α-helix	trans	-58	-38.3	-178.8	48.2	0	0	0	0	113.1	L807 L811 K812 L813	L807-S809 PolarHBondContact O-N 3.08Å; S809-L811 VanDerWaalsContact C-N 3.32Å; S809-K812 PolarHBondContact O-N 3.35Å; S809-L813 WeakPolarHBondContact O-CB 3.44Å; S809-L813 PolarHBondContact O-N 3.49Å
810	V	85.7	Confident	88.4	Confident	55 Å²	55	24.4 Å²	24.4	33%	0.333	14%	0.136	S	C	.	.	H	α-helix	trans	-65	-40.3	175.6	178.8	0	0	0	0	110.9	F645 N808 L813 A814	F645-V810 HydrophobicContact CD1-CG2 4.18Å; F645-V810 HydrophobicContact CE1-CG2 4Å; N808-V810 VanDerWaalsContact C-N 3.3Å; N808-V810 PolarHBondContact O-N 3.15Å; N808-V810 PolarHBondContact OD1-N 3.08Å; V810-L813 PolarHBondContact O-N 3.3Å; V810-A814 WeakPolarHBondContact O-CB 3.44Å; V810-A814 PolarHBondContact O-N 3.42Å
811	L	86.6	Confident	88.4	Confident	48 Å²	48	27 Å²	27	25%	0.251	16%	0.157	S	C	.	.	H	α-helix	trans	-69.5	-41.1	-179.8	-153	64.3	0	0	0	111.6	F744 L807 N808 S809 L813 A814 V815	F744-L811 HydrophobicContact CE1-CD1 4.23Å; F744-L811 HydrophobicContact CE1-CD2 3.99Å; F744-L811 HydrophobicContact CE1-CG 3.71Å; F744-L811 HydrophobicContact CE2-CD1 4.41Å; F744-L811 HydrophobicContact CE2-CD2 3.52Å; F744-L811 HydrophobicContact CE2-CG 4.08Å; F744-L811 HydrophobicContact CZ-CD1 3.48Å; F744-L811 VanDerWaalsContact CZ-CD1 3.48Å; F744-L811 HydrophobicContact CZ-CD2 3.13Å; F744-L811 HydrophobicContact CZ-CG 3.16Å; L807-L811 HydrophobicContact CD1-CD2 3.75Å; L807-L811 HydrophobicContact CG-CD2 4.41Å; N808-L811 HydrophobicContact CB-CB 3.93Å; N808-L811 WeakPolarHBondContact O-CA 3.36Å; N808-L811 VanDerWaalsContact O-CB 3.31Å; N808-L811 WeakPolarHBondContact O-CB 3.03Å; N808-L811 PolarHBondContact O-N 3.35Å; S809-L811 VanDerWaalsContact C-N 3.32Å; L811-L813 VanDerWaalsContact C-N 3.35Å; L811-A814 PolarHBondContact O-N 3.21Å; L811-V815 VanDerWaalsContact O-CG2 3.29Å; L811-V815 WeakPolarHBondContact O-CG2 3Å; L811-V815 PolarHBondContact O-N 3.06Å
812	K	89.7	Confident	88.3	Confident	3 Å²	3	29.9 Å²	29.9	1%	0.013	17%	0.172	C	C	.	.	H	α-helix	trans	-56.7	-48.9	170.1	-74.4	-177.6	-179.9	-165.6	0	111.2	C801 F804 L807 N808 S809 A814 V815 L816	C801-K812 WeakPolarHBondContact O-CE 3.34Å; C801-K812 PolarHBondContact O-NZ 3.3Å; F804-K812 WeakPolarHBondContact O-CE 3.39Å; F804-K812 PolarHBondContact O-NZ 3.48Å; L807-K812 HydrophobicContact CB-CG 4.21Å; L807-K812 HydrophobicContact CD2-CG 3.68Å; L807-K812 HydrophobicContact CG-CG 4.01Å; L807-K812 WeakPolarHBondContact O-CE 3.28Å; N808-K812 PolarHBondContact O-N 3.13Å; S809-K812 PolarHBondContact O-N 3.35Å; K812-A814 PolarHBondContact O-N 3.42Å; K812-V815 PolarHBondContact O-N 2.9Å; K812-L816 WeakPolarHBondContact O-CB 3.24Å; K812-L816 WeakPolarHBondContact O-CG 3.41Å; K812-L816 PolarHBondContact O-N 3.46Å
813	L	90.9	Very high	88.2	Confident	35 Å²	35	29.9 Å²	29.9	18%	0.183	17%	0.172	C	C	.	.	H	α-helix	trans	-60.5	-46.5	179.4	-177.2	63.5	0	0	0	111.3	F645 S809 V810 L811 V815 L816 L817 L863 F867	F645-L813 HydrophobicContact CZ-CD2 4.31Å; S809-L813 WeakPolarHBondContact O-CB 3.44Å; S809-L813 PolarHBondContact O-N 3.49Å; V810-L813 PolarHBondContact O-N 3.3Å; L811-L813 VanDerWaalsContact C-N 3.35Å; L813-V815 PolarHBondContact O-N 3.43Å; L813-L816 PolarHBondContact O-N 2.98Å; L813-L817 HydrophobicContact CD1-CD1 4.17Å; L813-L817 HydrophobicContact CD1-CG 4.22Å; L813-L817 HydrophobicContact CG-CD1 3.93Å; L813-L817 HydrophobicContact CG-CG 4.4Å; L813-L817 WeakPolarHBondContact O-CB 3.4Å; L813-L817 WeakPolarHBondContact O-CG 3.37Å; L813-L817 PolarHBondContact O-N 3.46Å; L813-L863 HydrophobicContact CD1-CD1 4.49Å; L813-L863 HydrophobicContact CD1-CD2 3.91Å; L813-L863 HydrophobicContact CD1-CG 4.37Å; L813-F867 HydrophobicContact CB-CD2 3.83Å; L813-F867 HydrophobicContact CB-CE2 3.89Å; L813-F867 HydrophobicContact CD1-CD2 4.01Å; L813-F867 HydrophobicContact CD1-CE2 4.38Å; L813-F867 HydrophobicContact CD1-CG 4.27Å; L813-F867 HydrophobicContact CD2-CD2 4.35Å; L813-F867 HydrophobicContact CD2-CE2 3.89Å; L813-F867 HydrophobicContact CD2-CZ 4.2Å; L813-F867 HydrophobicContact CG-CD2 4.28Å; L813-F867 HydrophobicContact CG-CE2 4.28Å
814	A	91.9	Very high	88	Confident	55 Å²	55	31.1 Å²	31.1	46%	0.455	18%	0.18	S	C	.	.	H	α-helix	trans	-59.6	-44.3	178.2	0	0	0	0	0	112.2	V810 L811 K812 L818	V810-A814 WeakPolarHBondContact O-CB 3.44Å; V810-A814 PolarHBondContact O-N 3.42Å; L811-A814 PolarHBondContact O-N 3.21Å; K812-A814 PolarHBondContact O-N 3.42Å; A814-L818 WeakPolarHBondContact O-CB 3.48Å; A814-L818 PolarHBondContact O-N 3.14Å
815	V	91.5	Very high	87.9	Confident	16 Å²	16	35.7 Å²	35.7	10%	0.097	21%	0.205	C	C	.	.	H	α-helix	trans	-64.4	-46.2	176.7	174.6	0	0	0	0	111.4	F744 I747 L811 K812 L813 L817 L818 M819	F744-V815 HydrophobicContact CD1-CG2 3.71Å; F744-V815 HydrophobicContact CE1-CG2 3.34Å; I747-V815 HydrophobicContact CG2-CG1 3.85Å; L811-V815 VanDerWaalsContact O-CG2 3.29Å; L811-V815 WeakPolarHBondContact O-CG2 3Å; L811-V815 PolarHBondContact O-N 3.06Å; K812-V815 PolarHBondContact O-N 2.9Å; L813-V815 PolarHBondContact O-N 3.43Å; V815-L817 PolarHBondContact O-N 3.32Å; V815-L818 WeakPolarHBondContact O-CB 3.26Å; V815-L818 PolarHBondContact O-N 3.48Å; V815-M819 HydrophobicContact CG1-CE 4.1Å; V815-M819 HydrophobicContact CG1-CG 4.39Å; V815-M819 VanDerWaalsContact O-CG 3.3Å; V815-M819 WeakPolarHBondContact O-CG 3.35Å; V815-M819 PolarHBondContact O-N 3.43Å
816	L	92.3	Very high	87.9	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-64	-41.4	-179.9	-68.1	167.9	0	0	0	111.8	M798 C801 K812 L813 M819 I820 L863 V866	M798-L816 HydrophobicContact CB-CD2 3.86Å; M798-L816 HydrophobicContact CE-CD2 3.85Å; M798-L816 HydrophobicContact CG-CD2 3.93Å; C801-L816 HydrophobicContact CB-CD2 4.06Å; C801-L816 HydrophobicContact CB-CG 4.5Å; K812-L816 WeakPolarHBondContact O-CB 3.24Å; K812-L816 WeakPolarHBondContact O-CG 3.41Å; K812-L816 PolarHBondContact O-N 3.46Å; L813-L816 PolarHBondContact O-N 2.98Å; L816-M819 PolarHBondContact O-N 2.97Å; L816-I820 WeakPolarHBondContact O-CG1 3.43Å; L816-I820 PolarHBondContact O-N 2.94Å; L816-L863 HydrophobicContact CB-CD1 3.99Å; L816-L863 HydrophobicContact CB-CG 4.2Å; L816-V866 HydrophobicContact CD1-CB 3.98Å; L816-V866 HydrophobicContact CD1-CG1 3.71Å
817	L	93.3	Very high	87.8	Confident	90 Å²	90	35.2 Å²	35.2	47%	0.471	21%	0.205	S	C	.	.	H	α-helix	trans	-63.2	-41.5	174.3	-73.6	172.3	0	0	0	111.7	L813 V815 I820 A821 L863	L813-L817 HydrophobicContact CD1-CD1 4.17Å; L813-L817 HydrophobicContact CD1-CG 4.22Å; L813-L817 HydrophobicContact CG-CD1 3.93Å; L813-L817 HydrophobicContact CG-CG 4.4Å; L813-L817 WeakPolarHBondContact O-CB 3.4Å; L813-L817 WeakPolarHBondContact O-CG 3.37Å; L813-L817 PolarHBondContact O-N 3.46Å; V815-L817 PolarHBondContact O-N 3.32Å; L817-I820 PolarHBondContact O-N 3.49Å; L817-A821 VanDerWaalsContact O-CB 3.3Å; L817-A821 WeakPolarHBondContact O-CB 3.37Å; L817-A821 PolarHBondContact O-N 3.07Å; L817-L863 HydrophobicContact CD2-CD1 3.53Å; L817-L863 HydrophobicContact CG-CD1 3.9Å
818	L	92.7	Very high	87.6	Confident	99 Å²	99	39.9 Å²	39.9	52%	0.518	23%	0.226	S	C	.	.	H	α-helix	trans	-61.8	-43.5	175.3	-178.3	66.3	0	0	0	111.4	A814 V815 A821 I822	A814-L818 WeakPolarHBondContact O-CB 3.48Å; A814-L818 PolarHBondContact O-N 3.14Å; V815-L818 WeakPolarHBondContact O-CB 3.26Å; V815-L818 PolarHBondContact O-N 3.48Å; L818-A821 PolarHBondContact O-N 2.81Å; L818-I822 HydrophobicContact CD1-CD1 4.1Å; L818-I822 HydrophobicContact CD1-CG1 4.36Å; L818-I822 HydrophobicContact CG-CD1 3.9Å; L818-I822 VanDerWaalsContact O-CG1 3.29Å; L818-I822 WeakPolarHBondContact O-CG1 3.48Å; L818-I822 PolarHBondContact O-N 2.82Å
819	M	90.5	Very high	87.3	Confident	12 Å²	12	41.8 Å²	41.8	6%	0.059	25%	0.245	C	C	.	.	H	α-helix	trans	-62.8	-43.2	177.1	-65.2	-37.5	-178.2	0	0	112	I747 L748 F751 V815 L816 Y823	I747-M819 HydrophobicContact CG2-CE 4.18Å; L748-M819 HydrophobicContact CD1-CE 4.48Å; F751-M819 HydrophobicContact CB-CE 3.54Å; F751-M819 HydrophobicContact CB-SD 3.86Å; F751-M819 HydrophobicContact CD1-CE 3.77Å; F751-M819 HydrophobicContact CD1-SD 3.24Å; F751-M819 WeakPolarHBondContact CD1-SD 3.42Å; F751-M819 HydrophobicContact CD2-CB 3.95Å; F751-M819 HydrophobicContact CD2-CE 4.25Å; F751-M819 HydrophobicContact CD2-CG 3.73Å; F751-M819 HydrophobicContact CD2-SD 3.41Å; F751-M819 WeakPolarHBondContact CD2-SD 3.06Å; F751-M819 HydrophobicContact CE1-SD 3.47Å; F751-M819 WeakPolarHBondContact CE1-SD 3.25Å; F751-M819 HydrophobicContact CE2-CB 3.68Å; F751-M819 HydrophobicContact CE2-CG 3.94Å; F751-M819 HydrophobicContact CE2-SD 3.63Å; F751-M819 HydrophobicContact CG-CE 3.59Å; F751-M819 HydrophobicContact CG-CG 4.07Å; F751-M819 HydrophobicContact CG-SD 3.19Å; F751-M819 WeakPolarHBondContact CG-SD 3.36Å; F751-M819 HydrophobicContact CZ-CB 4.23Å; F751-M819 HydrophobicContact CZ-CG 4.45Å; F751-M819 HydrophobicContact CZ-SD 3.65Å; V815-M819 HydrophobicContact CG1-CE 4.1Å; V815-M819 HydrophobicContact CG1-CG 4.39Å; V815-M819 VanDerWaalsContact O-CG 3.3Å; V815-M819 WeakPolarHBondContact O-CG 3.35Å; V815-M819 PolarHBondContact O-N 3.43Å; L816-M819 PolarHBondContact O-N 2.97Å; M819-Y823 VanDerWaalsContact O-CB 3.29Å; M819-Y823 WeakPolarHBondContact O-CB 3.34Å; M819-Y823 PolarHBondContact O-N 3.31Å
820	I	90.4	Very high	87	Confident	27 Å²	27	47.4 Å²	47.4	14%	0.138	27%	0.269	C	S	.	.	H	α-helix	trans	-65.5	-41.2	175.6	-68.3	-180	0	0	0	111.1	M798 L816 L817 Y823 S824 M859 L863	M798-I820 HydrophobicContact CE-CD1 4.13Å; M798-I820 HydrophobicContact CE-CG1 4.42Å; M798-I820 HydrophobicContact SD-CG1 4.44Å; L816-I820 WeakPolarHBondContact O-CG1 3.43Å; L816-I820 PolarHBondContact O-N 2.94Å; L817-I820 PolarHBondContact O-N 3.49Å; I820-Y823 PolarHBondContact O-N 3Å; I820-S824 VanDerWaalsContact O-CB 3.31Å; I820-S824 WeakPolarHBondContact O-CB 3.48Å; I820-S824 PolarHBondContact O-N 2.91Å; I820-S824 PolarHBondContact O-OG 3.48Å; I820-M859 HydrophobicContact CD1-CB 4.1Å; I820-M859 HydrophobicContact CG1-CB 4.15Å; I820-M859 HydrophobicContact CG1-CE 3.99Å; I820-L863 HydrophobicContact CD1-CB 3.8Å; I820-L863 HydrophobicContact CD1-CD1 3.55Å; I820-L863 HydrophobicContact CD1-CG 4.32Å
821	A	91.3	Very high	86.5	Confident	54 Å²	54	45.7 Å²	45.7	45%	0.446	26%	0.257	S	S	.	.	H	α-helix	trans	-63.9	-44.5	178.7	0	0	0	0	0	111.7	L817 L818 S824 L825	L817-A821 VanDerWaalsContact O-CB 3.3Å; L817-A821 WeakPolarHBondContact O-CB 3.37Å; L817-A821 PolarHBondContact O-N 3.07Å; L818-A821 PolarHBondContact O-N 2.81Å; A821-S824 PolarHBondContact O-N 2.89Å; A821-L825 VanDerWaalsContact O-CB 3.31Å; A821-L825 WeakPolarHBondContact O-CB 3.33Å; A821-L825 PolarHBondContact O-N 3.49Å
822	I	89.3	Confident	85.9	Confident	61 Å²	61	46.4 Å²	46.4	31%	0.313	26%	0.264	S	S	.	.	H	α-helix	trans	-63.1	-44.5	175.4	-67	166.5	0	0	0	110.4	F751 L818 L825 L826	F751-I822 HydrophobicContact CE1-CB 4.28Å; F751-I822 HydrophobicContact CE1-CD1 4.1Å; F751-I822 HydrophobicContact CE1-CG2 3.91Å; F751-I822 HydrophobicContact CZ-CB 4Å; F751-I822 HydrophobicContact CZ-CG2 3.83Å; L818-I822 HydrophobicContact CD1-CD1 4.1Å; L818-I822 HydrophobicContact CD1-CG1 4.36Å; L818-I822 HydrophobicContact CG-CD1 3.9Å; L818-I822 VanDerWaalsContact O-CG1 3.29Å; L818-I822 WeakPolarHBondContact O-CG1 3.48Å; L818-I822 PolarHBondContact O-N 2.82Å; I822-L825 PolarHBondContact O-N 2.97Å; I822-L826 HydrophobicContact CG2-CD1 3.83Å; I822-L826 HydrophobicContact CG2-CG 4.41Å; I822-L826 WeakPolarHBondContact O-CB 3.37Å; I822-L826 VanDerWaalsContact O-CG 3.29Å; I822-L826 WeakPolarHBondContact O-CG 3.39Å; I822-L826 PolarHBondContact O-N 3.14Å
823	Y	86.6	Confident	84.9	Confident	1 Å²	1	49.3 Å²	49.3	0%	0.004	28%	0.284	C	S	.	.	H	α-helix	trans	-62	-44.3	177.3	178.3	-89.3	0	0	0	112.1	M755 V791 M819 I820 L826 T827 L856 M859	M755-Y823 HydrophobicContact CE-CD2 3.52Å; M755-Y823 HydrophobicContact CE-CE2 4.09Å; M755-Y823 HydrophobicContact CE-CG 4.49Å; M755-Y823 HydrophobicContact SD-CD2 3.77Å; M755-Y823 HydrophobicContact SD-CE2 4.32Å; V791-Y823 HydrophobicContact CG2-CE2 4.26Å; V791-Y823 WeakPolarHBondContact CG2-OH 3.32Å; M819-Y823 VanDerWaalsContact O-CB 3.29Å; M819-Y823 WeakPolarHBondContact O-CB 3.34Å; M819-Y823 PolarHBondContact O-N 3.31Å; I820-Y823 PolarHBondContact O-N 3Å; Y823-L826 PolarHBondContact O-N 3.48Å; Y823-T827 WeakPolarHBondContact CE1-OG1 3.18Å; Y823-T827 WeakPolarHBondContact O-CB 3.05Å; Y823-T827 PolarHBondContact O-N 3.5Å; Y823-T827 PolarHBondContact O-OG1 3.08Å; Y823-L856 HydrophobicContact CD1-CD2 4.23Å; Y823-L856 HydrophobicContact CE1-CD2 4.32Å; Y823-M859 HydrophobicContact CD1-CE 4.24Å; Y823-M859 HydrophobicContact CD1-SD 3.28Å; Y823-M859 WeakPolarHBondContact CD1-SD 3.08Å; Y823-M859 HydrophobicContact CD2-CE 4.43Å; Y823-M859 HydrophobicContact CD2-SD 4.12Å; Y823-M859 HydrophobicContact CE1-SD 3.68Å; Y823-M859 HydrophobicContact CE2-SD 4.46Å; Y823-M859 HydrophobicContact CG-CE 3.94Å; Y823-M859 HydrophobicContact CG-SD 3.55Å; Y823-M859 VanDerWaalsContact CG-SD 3.55Å
824	S	85.8	Confident	84.1	Confident	26 Å²	26	48.3 Å²	48.3	18%	0.182	28%	0.279	C	S	.	.	H	α-helix	trans	-63.5	-45.1	177.5	-54.3	0	0	0	0	110.5	I820 A821 L826 T827 E828 L856	I820-S824 VanDerWaalsContact O-CB 3.31Å; I820-S824 WeakPolarHBondContact O-CB 3.48Å; I820-S824 PolarHBondContact O-N 2.91Å; I820-S824 PolarHBondContact O-OG 3.48Å; A821-S824 PolarHBondContact O-N 2.89Å; S824-L826 PolarHBondContact O-N 3.33Å; S824-T827 PolarHBondContact O-N 2.99Å; S824-E828 VanDerWaalsContact O-CB 3.25Å; S824-E828 WeakPolarHBondContact O-CB 3.43Å; S824-E828 VanDerWaalsContact O-CG 3.29Å; S824-E828 WeakPolarHBondContact O-CG 3.41Å; S824-E828 PolarHBondContact O-N 3.09Å; S824-L856 VanDerWaalsContact OG-CD2 3.3Å; S824-L856 WeakPolarHBondContact OG-CD2 3.3Å
825	L	87.5	Confident	83.2	Confident	102 Å²	102	45.9 Å²	45.9	53%	0.534	26%	0.258	S	S	.	.	H	α-helix	trans	-59.9	-45.8	176	-178.7	68.6	0	0	0	111.9	A821 I822 A829 F830	A821-L825 VanDerWaalsContact O-CB 3.31Å; A821-L825 WeakPolarHBondContact O-CB 3.33Å; A821-L825 PolarHBondContact O-N 3.49Å; I822-L825 PolarHBondContact O-N 2.97Å; L825-A829 HydrophobicContact CD1-CB 4Å; L825-A829 WeakPolarHBondContact O-CB 3.41Å; L825-A829 PolarHBondContact O-N 3.44Å; L825-F830 HydrophobicContact CG-CE2 4.4Å
826	L	82.9	Confident	82.3	Confident	25 Å²	25	49.3 Å²	49.3	13%	0.131	28%	0.279	C	S	.	.	I	π-helix	trans	-61.5	-45.7	177.2	-73.3	167.5	0	0	0	111	M755 L759 I822 Y823 S824 F830 Y831	M755-L826 HydrophobicContact CE-CB 4.49Å; M755-L826 HydrophobicContact CE-CD1 3.52Å; L759-L826 HydrophobicContact CD2-CD2 4.15Å; I822-L826 HydrophobicContact CG2-CD1 3.83Å; I822-L826 HydrophobicContact CG2-CG 4.41Å; I822-L826 WeakPolarHBondContact O-CB 3.37Å; I822-L826 VanDerWaalsContact O-CG 3.29Å; I822-L826 WeakPolarHBondContact O-CG 3.39Å; I822-L826 PolarHBondContact O-N 3.14Å; Y823-L826 PolarHBondContact O-N 3.48Å; S824-L826 PolarHBondContact O-N 3.33Å; L826-F830 HydrophobicContact CD2-CD2 4.37Å; L826-F830 PolarHBondContact O-N 3.14Å; L826-Y831 HydrophobicContact CD2-CE2 4.26Å; L826-Y831 WeakPolarHBondContact O-CD2 3.49Å; L826-Y831 PolarHBondContact O-N 3.36Å
827	T	77.4	Confident	81.2	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.006	30%	0.298	C	S	.	.	I	π-helix	trans	-71.1	-38	-177	-53.2	0	0	0	0	112.5	Y823 S824 Y831 T832 F835 K852	Y823-T827 WeakPolarHBondContact CE1-OG1 3.18Å; Y823-T827 WeakPolarHBondContact O-CB 3.05Å; Y823-T827 PolarHBondContact O-N 3.5Å; Y823-T827 PolarHBondContact O-OG1 3.08Å; S824-T827 PolarHBondContact O-N 2.99Å; T827-Y831 CarbonylContact O-C 3.59Å; T827-T832 VanDerWaalsContact O-CG2 3.25Å; T827-T832 WeakPolarHBondContact O-CG2 3.36Å; T827-T832 PolarHBondContact O-N 2.93Å; T827-F835 HydrophobicContact CG2-CD2 3.84Å; T827-F835 HydrophobicContact CG2-CE1 4.41Å; T827-F835 HydrophobicContact CG2-CE2 3.63Å; T827-F835 HydrophobicContact CG2-CG 4.35Å; T827-F835 HydrophobicContact CG2-CZ 3.93Å; T827-K852 HydrophobicContact CG2-CG 4.08Å
828	E	77.8	Confident	80.1	Confident	103 Å²	103	50.7 Å²	50.7	48%	0.481	28%	0.278	S	S	.	.	I	π-helix	trans	-89.4	-36.1	-175.9	-66.4	-159.2	140.9	0	0	114.9	S824 T832 K852	S824-E828 VanDerWaalsContact O-CB 3.25Å; S824-E828 WeakPolarHBondContact O-CB 3.43Å; S824-E828 VanDerWaalsContact O-CG 3.29Å; S824-E828 WeakPolarHBondContact O-CG 3.41Å; S824-E828 PolarHBondContact O-N 3.09Å; E828-T832 WeakPolarHBondContact O-CG2 3.37Å; E828-K852 WeakPolarHBondContact OE1-CE 3.3Å; E828-K852 IonicContact OE1-NZ 2.81Å; E828-K852 PolarHBondContact OE1-NZ 2.04Å
829	A	76.4	Confident	79	Confident	63 Å²	63	47.5 Å²	47.5	52%	0.521	26%	0.262	S	S	.	.	I	π-helix	trans	-94.6	-35.7	-175.2	0	0	0	0	0	112.3	L825	L825-A829 HydrophobicContact CD1-CB 4Å; L825-A829 WeakPolarHBondContact O-CB 3.41Å; L825-A829 PolarHBondContact O-N 3.44Å
830	F	76.4	Confident	77.8	Confident	119 Å²	119	51.7 Å²	51.7	52%	0.522	29%	0.288	S	S	.	.	I	π-helix	trans	-108.9	-41	-169.8	-63.9	-80.3	0	0	0	113.1	F763 L825 L826	F763-F830 WeakPolarHBondContact CZ-O 3.34Å; L825-F830 HydrophobicContact CG-CE2 4.4Å; L826-F830 HydrophobicContact CD2-CD2 4.37Å; L826-F830 PolarHBondContact O-N 3.14Å
831	Y	75.3	Confident	76.5	Confident	20 Å²	20	55.3 Å²	55.3	8%	0.078	31%	0.311	C	S	.	.	S	Bend	trans	-117.7	22.1	-167.6	-60.6	-81.4	0	0	0	116.2	I758 L759 C761 F763 L826 T827 S833 L834	I758-Y831 HydrophobicContact CD1-CD2 4.07Å; I758-Y831 HydrophobicContact CD1-CG 4.28Å; I758-Y831 HydrophobicContact CG1-CD1 4.43Å; I758-Y831 HydrophobicContact CG1-CD2 4.13Å; I758-Y831 HydrophobicContact CG1-CE2 4.36Å; I758-Y831 HydrophobicContact CG1-CG 4.22Å; I758-Y831 HydrophobicContact CG2-CE2 4.2Å; I758-Y831 WeakPolarHBondContact O-CE1 3.37Å; I758-Y831 VanDerWaalsContact O-CZ 3.27Å; I758-Y831 PolarHBondContact O-OH 3.48Å; L759-Y831 WeakPolarHBondContact CA-OH 3.45Å; C761-Y831 HydrophobicContact CB-CE1 4.37Å; F763-Y831 AromaticContact CE2-CD1 3.55Å; F763-Y831 HydrophobicContact CE2-CD1 3.55Å; F763-Y831 AromaticContact CE2-CE1 3.41Å; F763-Y831 HydrophobicContact CE2-CE1 3.41Å; F763-Y831 VanDerWaalsContact CE2-CE1 3.41Å; F763-Y831 AromaticContact CZ-CD1 3.44Å; F763-Y831 HydrophobicContact CZ-CD1 3.44Å; F763-Y831 VanDerWaalsContact CZ-CD1 3.44Å; F763-Y831 AromaticContact CZ-CE1 3.84Å; F763-Y831 HydrophobicContact CZ-CE1 3.84Å; F763-Y831 HydrophobicContact CZ-CG 4.21Å; L826-Y831 HydrophobicContact CD2-CE2 4.26Å; L826-Y831 WeakPolarHBondContact O-CD2 3.49Å; L826-Y831 PolarHBondContact O-N 3.36Å; T827-Y831 CarbonylContact O-C 3.59Å; Y831-S833 VanDerWaalsContact C-N 3.33Å; Y831-S833 PolarHBondContact O-N 3.43Å; Y831-L834 WeakPolarHBondContact O-CB 3.39Å; Y831-L834 PolarHBondContact O-N 3.42Å; Y831-L834 VanDerWaalsContact O-N 3.13Å
832	T	73.8	Confident	75	Confident	63 Å²	63	57.5 Å²	57.5	39%	0.387	31%	0.312	S	S	.	.	H	α-helix	trans	-56.8	-42	-179.1	44.9	0	0	0	0	113.8	T827 E828 L834 F835 V836	T827-T832 VanDerWaalsContact O-CG2 3.25Å; T827-T832 WeakPolarHBondContact O-CG2 3.36Å; T827-T832 PolarHBondContact O-N 2.93Å; E828-T832 WeakPolarHBondContact O-CG2 3.37Å; T832-L834 PolarHBondContact O-N 2.69Å; T832-F835 PolarHBondContact O-N 3.3Å; T832-V836 WeakPolarHBondContact O-CG2 3.09Å; T832-V836 PolarHBondContact O-N 3.22Å; T832-V836 VanDerWaalsContact O-N 3.08Å
833	S	69.4	Low	73.6	Confident	63 Å²	63	56 Å²	56	44%	0.441	30%	0.303	S	S	.	.	H	α-helix	trans	-64.6	-23.9	-178.7	66.2	0	0	0	0	113.3	F763 Y831 R837	F763-S833 WeakPolarHBondContact CE1-OG 3.22Å; Y831-S833 VanDerWaalsContact C-N 3.33Å; Y831-S833 PolarHBondContact O-N 3.43Å; S833-R837 VanDerWaalsContact O-CB 3.22Å; S833-R837 WeakPolarHBondContact O-CB 3.46Å; S833-R837 PolarHBondContact O-N 3.06Å
834	L	73.3	Confident	71.8	Confident	14 Å²	14	62.4 Å²	62.4	7%	0.073	34%	0.338	C	S	.	.	H	α-helix	trans	-74.7	-42	179.4	-169.6	145.9	0	0	0	111.5	C761 C784 P787 Y831 T832 Y838	C761-L834 HydrophobicContact CB-CD1 4.02Å; C784-L834 HydrophobicContact CB-CD1 3.96Å; P787-L834 HydrophobicContact CB-CD2 3.52Å; P787-L834 HydrophobicContact CG-CD2 3.84Å; Y831-L834 WeakPolarHBondContact O-CB 3.39Å; Y831-L834 PolarHBondContact O-N 3.42Å; Y831-L834 VanDerWaalsContact O-N 3.13Å; T832-L834 PolarHBondContact O-N 2.69Å; L834-Y838 PolarHBondContact O-N 2.9Å; L834-Y838 VanDerWaalsContact O-N 3.09Å
835	F	73.3	Confident	69.9	Low	4 Å²	4	68 Å²	68	2%	0.018	37%	0.371	C	S	.	.	H	α-helix	trans	-70	-42.9	175	-74.7	-96.2	0	0	0	111.6	P787 T827 T832 R837 Y838 D839	P787-F835 HydrophobicContact CB-CD1 3.94Å; P787-F835 HydrophobicContact CB-CD2 4.44Å; P787-F835 HydrophobicContact CB-CE1 3.63Å; P787-F835 HydrophobicContact CB-CE2 4.14Å; P787-F835 HydrophobicContact CB-CG 4.35Å; P787-F835 HydrophobicContact CB-CZ 3.73Å; P787-F835 HydrophobicContact CG-CD1 4.31Å; P787-F835 HydrophobicContact CG-CE1 4.42Å; T827-F835 HydrophobicContact CG2-CD2 3.84Å; T827-F835 HydrophobicContact CG2-CE1 4.41Å; T827-F835 HydrophobicContact CG2-CE2 3.63Å; T827-F835 HydrophobicContact CG2-CG 4.35Å; T827-F835 HydrophobicContact CG2-CZ 3.93Å; T832-F835 PolarHBondContact O-N 3.3Å; F835-R837 VanDerWaalsContact C-N 3.29Å; F835-R837 PolarHBondContact O-N 3.15Å; F835-Y838 WeakPolarHBondContact O-CB 3.37Å; F835-Y838 PolarHBondContact O-N 3.03Å; F835-Y838 VanDerWaalsContact O-N 3.16Å; F835-D839 PolarHBondContact O-N 3.29Å
836	V	72.4	Confident	67.9	Low	88 Å²	88	70.5 Å²	70.5	53%	0.533	38%	0.38	S	S	.	.	H	α-helix	trans	-61.8	-37.7	175.3	174.3	0	0	0	0	111.5	T832 T840	T832-V836 WeakPolarHBondContact O-CG2 3.09Å; T832-V836 PolarHBondContact O-N 3.22Å; T832-V836 VanDerWaalsContact O-N 3.08Å; V836-T840 VanDerWaalsContact O-CG2 3.32Å; V836-T840 WeakPolarHBondContact O-CG2 3.17Å; V836-T840 PolarHBondContact O-N 3.46Å; V836-T840 PolarHBondContact O-OG1 2.88Å
837	R	69.9	Low	66.3	Low	105 Å²	105	74.1 Å²	74.1	40%	0.396	40%	0.399	S	S	.	.	H	α-helix	trans	-67.3	-38.9	175.7	-170.9	177.3	73.4	163.1	4.2	112.2	S833 F835 T840 V841	S833-R837 VanDerWaalsContact O-CB 3.22Å; S833-R837 WeakPolarHBondContact O-CB 3.46Å; S833-R837 PolarHBondContact O-N 3.06Å; F835-R837 VanDerWaalsContact C-N 3.29Å; F835-R837 PolarHBondContact O-N 3.15Å; R837-T840 WeakPolarHBondContact CA-OG1 2.98Å; R837-T840 PolarHBondContact O-OG1 2.93Å; R837-V841 WeakPolarHBondContact O-CB 3.25Å; R837-V841 VanDerWaalsContact O-CG2 3.24Å; R837-V841 WeakPolarHBondContact O-CG2 3.24Å; R837-V841 PolarHBondContact O-N 3.36Å
838	Y	69.9	Low	65.1	Low	15 Å²	15	76.2 Å²	76.2	6%	0.059	41%	0.408	C	S	.	.	H	α-helix	trans	-63.5	-48.4	175.5	-178.5	-98.3	0	0	0	111.2	F785 Y786 P787 E788 L834 F835 T840 V841 H842 T851	F785-Y838 WeakPolarHBondContact O-CD2 3.26Å; F785-Y838 WeakPolarHBondContact O-CE2 3.42Å; Y786-Y838 HydrophobicContact CD1-CE2 4.4Å; P787-Y838 HydrophobicContact CG-CD1 4.16Å; P787-Y838 HydrophobicContact CG-CD2 3.97Å; P787-Y838 HydrophobicContact CG-CG 3.64Å; E788-Y838 HydrophobicContact CG-CE1 4Å; E788-Y838 WeakPolarHBondContact OE1-CE1 3.38Å; L834-Y838 PolarHBondContact O-N 2.9Å; L834-Y838 VanDerWaalsContact O-N 3.09Å; F835-Y838 WeakPolarHBondContact O-CB 3.37Å; F835-Y838 PolarHBondContact O-N 3.03Å; F835-Y838 VanDerWaalsContact O-N 3.16Å; Y838-T840 VanDerWaalsContact C-N 3.32Å; Y838-T840 PolarHBondContact O-N 2.69Å; Y838-V841 PolarHBondContact O-N 3.36Å; Y838-V841 VanDerWaalsContact O-N 3.12Å; Y838-H842 AromaticContact CD2-CD2 3.63Å; Y838-H842 HydrophobicContact CE1-CB 4.39Å; Y838-H842 HydrophobicContact CE2-CB 4.45Å; Y838-H842 AromaticContact CE2-CD2 3.22Å; Y838-H842 WeakPolarHBondContact CE2-CD2 3.18Å; Y838-H842 AromaticContact CE2-NE2 3.89Å; Y838-H842 AromaticContact CZ-CD2 3.78Å; Y838-H842 PolarHBondContact O-N 3.41Å; Y838-T851 HydrophobicContact CD1-CG2 3.76Å; Y838-T851 HydrophobicContact CE1-CG2 3.73Å
839	D	69.9	Low	64.3	Low	32 Å²	32	72.9 Å²	72.9	17%	0.171	39%	0.394	C	S	.	.	H	α-helix	trans	-58.7	-44	178.7	-68.6	-12.1	0	0	0	111	F835 V841 H843 G850 T851	F835-D839 PolarHBondContact O-N 3.29Å; D839-V841 VanDerWaalsContact C-N 3.3Å; D839-V841 PolarHBondContact O-N 3.16Å; D839-H843 CarbonylContact O-C 3.55Å; D839-H843 WeakPolarHBondContact O-CA 3.28Å; D839-H843 VanDerWaalsContact O-CB 3.28Å; D839-H843 WeakPolarHBondContact O-CB 3.45Å; D839-H843 PolarHBondContact O-N 3.01Å; D839-G850 WeakPolarHBondContact OD2-CA 3.36Å; D839-T851 VanDerWaalsContact OD1-CB 3.28Å; D839-T851 WeakPolarHBondContact OD1-CB 3.2Å; D839-T851 WeakPolarHBondContact OD1-CG2 3.5Å; D839-T851 PolarHBondContact OD1-N 2.88Å; D839-T851 PolarHBondContact OD1-OG1 3.3Å; D839-T851 PolarHBondContact OD2-N 3.03Å
840	T	65.3	Low	63.8	Low	99 Å²	99	70.7 Å²	70.7	61%	0.607	38%	0.378	S	S	*	.	H	α-helix	trans	-68.8	-21.7	178.9	49.4	0	0	0	0	115.1	V836 R837 Y838	V836-T840 VanDerWaalsContact O-CG2 3.32Å; V836-T840 WeakPolarHBondContact O-CG2 3.17Å; V836-T840 PolarHBondContact O-N 3.46Å; V836-T840 PolarHBondContact O-OG1 2.88Å; R837-T840 WeakPolarHBondContact CA-OG1 2.98Å; R837-T840 PolarHBondContact O-OG1 2.93Å; Y838-T840 VanDerWaalsContact C-N 3.32Å; Y838-T840 PolarHBondContact O-N 2.69Å
841	V	63.3	Low	63.5	Low	103 Å²	103	65.1 Å²	65.1	62%	0.624	35%	0.353	S	S	*	.	H	α-helix	trans	-95	-40.1	-178.3	171	0	0	0	0	112.2	R837 Y838 D839	R837-V841 WeakPolarHBondContact O-CB 3.25Å; R837-V841 VanDerWaalsContact O-CG2 3.24Å; R837-V841 WeakPolarHBondContact O-CG2 3.24Å; R837-V841 PolarHBondContact O-N 3.36Å; Y838-V841 PolarHBondContact O-N 3.36Å; Y838-V841 VanDerWaalsContact O-N 3.12Å; D839-V841 VanDerWaalsContact C-N 3.3Å; D839-V841 PolarHBondContact O-N 3.16Å
842	H	59.1	Low	63.4	Low	101 Å²	101	66.4 Å²	66.4	47%	0.468	36%	0.359	S	S	.	.	H	α-helix	trans	-98.7	-19.6	-175.7	-85.6	-69.1	0	0	0	114	Y838	Y838-H842 AromaticContact CD2-CD2 3.63Å; Y838-H842 HydrophobicContact CE1-CB 4.39Å; Y838-H842 HydrophobicContact CE2-CB 4.45Å; Y838-H842 AromaticContact CE2-CD2 3.22Å; Y838-H842 WeakPolarHBondContact CE2-CD2 3.18Å; Y838-H842 AromaticContact CE2-NE2 3.89Å; Y838-H842 AromaticContact CZ-CD2 3.78Å; Y838-H842 PolarHBondContact O-N 3.41Å
843	H	59.2	Low	63.5	Low	29 Å²	29	67 Å²	67	13%	0.134	36%	0.358	C	S	.	.	S	Bend	trans	-114.8	101.3	173.8	-68.6	-9.9	0	0	0	107.9	D839 T845 N847	D839-H843 CarbonylContact O-C 3.55Å; D839-H843 WeakPolarHBondContact O-CA 3.28Å; D839-H843 VanDerWaalsContact O-CB 3.28Å; D839-H843 WeakPolarHBondContact O-CB 3.45Å; D839-H843 PolarHBondContact O-N 3.01Å; H843-T845 PolarHBondContact O-N 2.7Å; H843-N847 HydrophobicContact CB-CB 3.86Å; H843-N847 PolarHBondContact ND1-ND2 3.49Å
844	N	48.9	Very low	63.9	Low	136 Å²	136	65.3 Å²	65.3	73%	0.727	35%	0.345	S	S	*	.			trans	-48.7	146.6	154.1	-80.4	-19.8	0	0	0	106.9	E846 N847	N844-E846 PolarHBondContact O-N 3.48Å; N844-N847 PolarHBondContact O-N 3.22Å
845	T	46.7	Very low	64.2	Low	142 Å²	142	65 Å²	65	87%	0.871	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48	6	-173	13.5	0	0	0	0	117.7	H843	H843-T845 PolarHBondContact O-N 2.7Å
846	E	46	Very low	64.7	Low	155 Å²	155	66.9 Å²	66.9	72%	0.724	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-14.5	-179.8	-58.9	-166.4	160.4	0	0	114.8	N844	N844-E846 PolarHBondContact O-N 3.48Å
847	N	49.3	Very low	65.3	Low	101 Å²	101	64.2 Å²	64.2	54%	0.54	34%	0.336	S	S	.	.			trans	-90.7	125.3	173	-86.9	-7.8	0	0	0	111.5	H843 N844	H843-N847 HydrophobicContact CB-CB 3.86Å; H843-N847 PolarHBondContact ND1-ND2 3.49Å; N844-N847 PolarHBondContact O-N 3.22Å
848	F	52.1	Low	66.1	Low	46 Å²	46	59.6 Å²	59.6	20%	0.202	32%	0.319	C	S	.	.			trans	-92.4	-13.9	-145.4	-170.4	-93	0	0	0	115.5	H153 L156 A157	H153-F848 HydrophobicContact CB-CD1 4.41Å; H153-F848 AromaticContact CE1-CD1 3.84Å; H153-F848 AromaticContact CE1-CG 3.78Å; H153-F848 AromaticContact ND1-CD1 3.17Å; H153-F848 WeakPolarHBondContact ND1-CD1 3.4Å; H153-F848 AromaticContact ND1-CG 3.57Å; L156-F848 HydrophobicContact CB-CE1 3.68Å; L156-F848 HydrophobicContact CB-CZ 3.48Å; L156-F848 VanDerWaalsContact CB-CZ 3.48Å; L156-F848 WeakPolarHBondContact O-CE2 3.45Å; L156-F848 WeakPolarHBondContact O-CZ 3.28Å; A157-F848 HydrophobicContact CB-CD1 3.53Å; A157-F848 HydrophobicContact CB-CD2 3.22Å; A157-F848 HydrophobicContact CB-CE1 3.36Å; A157-F848 HydrophobicContact CB-CE2 3.08Å; A157-F848 HydrophobicContact CB-CG 3.55Å; A157-F848 HydrophobicContact CB-CZ 3.26Å
849	L	61.3	Low	67	Low	32 Å²	32	58.9 Å²	58.9	17%	0.168	32%	0.317	C	S	.	.	S	Bend	trans	-131.1	128	-176.9	-155.4	71	0	0	0	111.6	L149 L152 E853 T854	L149-L849 HydrophobicContact CD2-CD2 4.19Å; L152-L849 HydrophobicContact CD1-CD1 4.35Å; L152-L849 HydrophobicContact CD2-CD1 3.39Å; L152-L849 HydrophobicContact CD2-CD2 3.46Å; L152-L849 VanDerWaalsContact CD2-CD2 3.46Å; L152-L849 HydrophobicContact CD2-CG 4.03Å; L152-L849 HydrophobicContact CG-CD1 3.48Å; L152-L849 VanDerWaalsContact CG-CD1 3.48Å; L152-L849 HydrophobicContact CG-CD2 4.32Å; L849-E853 HydrophobicContact CD1-CB 4.46Å; L849-E853 HydrophobicContact CD2-CB 4.36Å; L849-E853 HydrophobicContact CG-CB 4.12Å; L849-T854 HydrophobicContact CB-CG2 4.25Å; L849-T854 HydrophobicContact CD2-CG2 3.63Å; L849-T854 HydrophobicContact CG-CG2 4.16Å
850	G	65.7	Low	67.9	Low	18 Å²	18	59.6 Å²	59.6	19%	0.186	33%	0.327	C	S	.	.			trans	-61.3	147.2	180	0	0	0	0	0	112	D839 K852 E853 T854	D839-G850 WeakPolarHBondContact OD2-CA 3.36Å; G850-K852 PolarHBondContact O-N 3Å; G850-K852 VanDerWaalsContact O-N 3.15Å; G850-E853 VanDerWaalsContact C-OE2 3.26Å; G850-E853 WeakPolarHBondContact CA-OE2 3.37Å; G850-E853 PolarHBondContact N-OE2 3.45Å; G850-E853 PolarHBondContact O-N 3.14Å; G850-E853 VanDerWaalsContact O-N 3.15Å; G850-E853 VanDerWaalsContact O-OE2 3.11Å; G850-T854 PolarHBondContact O-N 2.89Å; G850-T854 PolarHBondContact O-OG1 3.5Å
851	T	70.2	Confident	69	Low	2 Å²	2	55.1 Å²	55.1	1%	0.012	30%	0.299	C	S	.	.	H	α-helix	trans	-62.7	-21.5	-179.9	48.6	0	0	0	0	112.7	E788 Y838 D839 T854 S855	E788-T851 HydrophobicContact CG-CG2 4.41Å; E788-T851 VanDerWaalsContact OE1-CG2 3.26Å; E788-T851 WeakPolarHBondContact OE1-CG2 3.46Å; Y838-T851 HydrophobicContact CD1-CG2 3.76Å; Y838-T851 HydrophobicContact CE1-CG2 3.73Å; D839-T851 VanDerWaalsContact OD1-CB 3.28Å; D839-T851 WeakPolarHBondContact OD1-CB 3.2Å; D839-T851 WeakPolarHBondContact OD1-CG2 3.5Å; D839-T851 PolarHBondContact OD1-N 2.88Å; D839-T851 PolarHBondContact OD1-OG1 3.3Å; D839-T851 PolarHBondContact OD2-N 3.03Å; T851-T854 WeakPolarHBondContact CA-OG1 3.28Å; T851-T854 PolarHBondContact O-OG1 3.42Å; T851-S855 WeakPolarHBondContact O-CB 3.44Å; T851-S855 PolarHBondContact O-N 3.15Å; T851-S855 PolarHBondContact O-OG 3.38Å
852	K	73.5	Confident	70.3	Confident	47 Å²	47	50.2 Å²	50.2	20%	0.204	27%	0.269	C	S	.	.	H	α-helix	trans	-65.1	-51.7	172.5	178.2	-170.2	168.5	-169.3	0	111.9	T827 E828 G850 S855 L856	T827-K852 HydrophobicContact CG2-CG 4.08Å; E828-K852 WeakPolarHBondContact OE1-CE 3.3Å; E828-K852 IonicContact OE1-NZ 2.81Å; E828-K852 PolarHBondContact OE1-NZ 2.04Å; G850-K852 PolarHBondContact O-N 3Å; G850-K852 VanDerWaalsContact O-N 3.15Å; K852-S855 PolarHBondContact O-N 3.31Å; K852-L856 HydrophobicContact CG-CD1 4.49Å; K852-L856 PolarHBondContact O-N 2.88Å; K852-L856 VanDerWaalsContact O-N 3.1Å
853	E	75.7	Confident	71.9	Confident	76 Å²	76	46.2 Å²	46.2	36%	0.355	25%	0.251	S	S	.	.	H	α-helix	trans	-67.8	-40.7	-175.3	-67.3	73.4	-161.6	0	0	111.3	L849 G850 S855 L856 L857	L849-E853 HydrophobicContact CD1-CB 4.46Å; L849-E853 HydrophobicContact CD2-CB 4.36Å; L849-E853 HydrophobicContact CG-CB 4.12Å; G850-E853 VanDerWaalsContact C-OE2 3.26Å; G850-E853 WeakPolarHBondContact CA-OE2 3.37Å; G850-E853 PolarHBondContact N-OE2 3.45Å; G850-E853 PolarHBondContact O-N 3.14Å; G850-E853 VanDerWaalsContact O-N 3.15Å; G850-E853 VanDerWaalsContact O-OE2 3.11Å; E853-S855 VanDerWaalsContact C-N 3.33Å; E853-S855 PolarHBondContact O-N 2.91Å; E853-L856 PolarHBondContact O-N 3.41Å; E853-L857 WeakPolarHBondContact O-CB 3.43Å; E853-L857 PolarHBondContact O-N 3.07Å; E853-L857 VanDerWaalsContact O-N 3.11Å
854	T	76.8	Confident	73.4	Confident	27 Å²	27	49.1 Å²	49.1	17%	0.166	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-39	175.5	55.2	0	0	0	0	111.8	L849 G850 T851 L857 L858	L849-T854 HydrophobicContact CB-CG2 4.25Å; L849-T854 HydrophobicContact CD2-CG2 3.63Å; L849-T854 HydrophobicContact CG-CG2 4.16Å; G850-T854 PolarHBondContact O-N 2.89Å; G850-T854 PolarHBondContact O-OG1 3.5Å; T851-T854 WeakPolarHBondContact CA-OG1 3.28Å; T851-T854 PolarHBondContact O-OG1 3.42Å; T854-L857 PolarHBondContact O-N 3.3Å; T854-L858 WeakPolarHBondContact O-CB 3.45Å; T854-L858 PolarHBondContact O-N 2.98Å
855	S	80.4	Confident	75.4	Confident	7 Å²	7	42.8 Å²	42.8	5%	0.049	23%	0.234	C	C	.	.	H	α-helix	trans	-66.8	-43.1	178.7	-68.8	0	0	0	0	113.1	V791 T851 K852 E853 L858 M859	V791-S855 WeakPolarHBondContact CG2-OG 3.26Å; T851-S855 WeakPolarHBondContact O-CB 3.44Å; T851-S855 PolarHBondContact O-N 3.15Å; T851-S855 PolarHBondContact O-OG 3.38Å; K852-S855 PolarHBondContact O-N 3.31Å; E853-S855 VanDerWaalsContact C-N 3.33Å; E853-S855 PolarHBondContact O-N 2.91Å; S855-L858 PolarHBondContact O-N 3.37Å; S855-M859 WeakPolarHBondContact O-CG 3.22Å; S855-M859 PolarHBondContact O-N 3.47Å
856	L	84.1	Confident	77.5	Confident	44 Å²	44	36 Å²	36	23%	0.23	19%	0.193	C	C	.	.	H	α-helix	trans	-65.2	-40.9	175.8	-72.2	173.4	0	0	0	111.8	Y823 S824 K852 E853 M859 A860	Y823-L856 HydrophobicContact CD1-CD2 4.23Å; Y823-L856 HydrophobicContact CE1-CD2 4.32Å; S824-L856 VanDerWaalsContact OG-CD2 3.3Å; S824-L856 WeakPolarHBondContact OG-CD2 3.3Å; K852-L856 HydrophobicContact CG-CD1 4.49Å; K852-L856 PolarHBondContact O-N 2.88Å; K852-L856 VanDerWaalsContact O-N 3.1Å; E853-L856 PolarHBondContact O-N 3.41Å; L856-M859 PolarHBondContact O-N 3.4Å; L856-A860 WeakPolarHBondContact O-CB 3.03Å; L856-A860 PolarHBondContact O-N 3.33Å
857	L	85	Confident	79.5	Confident	32 Å²	32	30.2 Å²	30.2	17%	0.168	17%	0.165	C	C	.	.	H	α-helix	trans	-64.6	-39.9	176.1	178.4	144.1	0	0	0	111.8	T145 L149 E853 T854 A860 M861	T145-L857 HydrophobicContact CG2-CD2 3.53Å; T145-L857 HydrophobicContact CG2-CG 4.32Å; L149-L857 HydrophobicContact CD1-CD2 4.43Å; L149-L857 HydrophobicContact CD2-CD1 4.03Å; L149-L857 HydrophobicContact CD2-CD2 4.17Å; L149-L857 HydrophobicContact CG-CD1 4.17Å; L149-L857 HydrophobicContact CG-CD2 4.32Å; E853-L857 WeakPolarHBondContact O-CB 3.43Å; E853-L857 PolarHBondContact O-N 3.07Å; E853-L857 VanDerWaalsContact O-N 3.11Å; T854-L857 PolarHBondContact O-N 3.3Å; L857-A860 PolarHBondContact O-N 3.35Å; L857-M861 WeakPolarHBondContact O-CB 3.38Å; L857-M861 PolarHBondContact O-N 3.29Å
858	L	85.8	Confident	81.3	Confident	7 Å²	7	27.5 Å²	27.5	4%	0.037	15%	0.147	C	C	.	.	H	α-helix	trans	-61.4	-47.1	173.3	-177.6	66.5	0	0	0	111.8	G225 F792 V795 T854 S855 A860 M861 F862	G225-L858 WeakPolarHBondContact O-CD1 3.11Å; F792-L858 HydrophobicContact CD1-CD2 4.14Å; F792-L858 HydrophobicContact CE1-CD2 4.09Å; V795-L858 HydrophobicContact CG2-CD2 4.22Å; V795-L858 HydrophobicContact CG2-CG 4.31Å; T854-L858 WeakPolarHBondContact O-CB 3.45Å; T854-L858 PolarHBondContact O-N 2.98Å; S855-L858 PolarHBondContact O-N 3.37Å; L858-A860 PolarHBondContact O-N 3.37Å; L858-M861 WeakPolarHBondContact O-CB 3.45Å; L858-M861 PolarHBondContact O-N 3.29Å; L858-F862 HydrophobicContact CD1-CD2 4.01Å; L858-F862 HydrophobicContact CD1-CE2 3.86Å; L858-F862 HydrophobicContact CG-CD2 4.25Å; L858-F862 HydrophobicContact CG-CE2 4.4Å; L858-F862 WeakPolarHBondContact O-CD2 3.31Å; L858-F862 PolarHBondContact O-N 3.49Å
859	M	88.5	Confident	82.9	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.005	14%	0.138	C	C	.	.	H	α-helix	trans	-64.7	-39.6	177.5	-69.1	-173.8	83.9	0	0	112.2	V791 V795 M798 I820 Y823 S855 L856 F862 L863	V791-M859 HydrophobicContact CG1-CG 4.18Å; V791-M859 HydrophobicContact CG1-SD 4.41Å; V795-M859 HydrophobicContact CG2-CG 4.34Å; M798-M859 WeakPolarHBondContact CE-O 3.38Å; M798-M859 HydrophobicContact SD-CB 4.34Å; M798-M859 HydrophobicContact SD-CE 3.76Å; M798-M859 HydrophobicContact SD-CG 4.41Å; I820-M859 HydrophobicContact CD1-CB 4.1Å; I820-M859 HydrophobicContact CG1-CB 4.15Å; I820-M859 HydrophobicContact CG1-CE 3.99Å; Y823-M859 HydrophobicContact CD1-CE 4.24Å; Y823-M859 HydrophobicContact CD1-SD 3.28Å; Y823-M859 WeakPolarHBondContact CD1-SD 3.08Å; Y823-M859 HydrophobicContact CD2-CE 4.43Å; Y823-M859 HydrophobicContact CD2-SD 4.12Å; Y823-M859 HydrophobicContact CE1-SD 3.68Å; Y823-M859 HydrophobicContact CE2-SD 4.46Å; Y823-M859 HydrophobicContact CG-CE 3.94Å; Y823-M859 HydrophobicContact CG-SD 3.55Å; Y823-M859 VanDerWaalsContact CG-SD 3.55Å; S855-M859 WeakPolarHBondContact O-CG 3.22Å; S855-M859 PolarHBondContact O-N 3.47Å; L856-M859 PolarHBondContact O-N 3.4Å; M859-F862 PolarHBondContact O-N 3.46Å; M859-L863 PolarHBondContact O-N 3Å
860	A	89.3	Confident	83.8	Confident	47 Å²	47	24 Å²	24	39%	0.388	13%	0.132	S	C	.	.	H	α-helix	trans	-62.4	-42.7	175.7	0	0	0	0	0	112	L856 L857 L858 L863 L864	L856-A860 WeakPolarHBondContact O-CB 3.03Å; L856-A860 PolarHBondContact O-N 3.33Å; L857-A860 PolarHBondContact O-N 3.35Å; L858-A860 PolarHBondContact O-N 3.37Å; A860-L863 WeakPolarHBondContact O-CB 3.43Å; A860-L863 PolarHBondContact O-N 3.24Å; A860-L864 WeakPolarHBondContact O-CG 3.37Å; A860-L864 PolarHBondContact O-N 3.03Å; A860-L864 VanDerWaalsContact O-N 3.11Å
861	M	89.4	Confident	84.4	Confident	5 Å²	5	25.5 Å²	25.5	3%	0.025	13%	0.134	C	C	.	.	H	α-helix	trans	-59.6	-46.9	174.4	-177.5	-153.6	-73.8	0	0	111.3	L141 T145 F229 L857 L858 L863 L864 A865	L141-M861 HydrophobicContact CD2-CG 4.21Å; L141-M861 HydrophobicContact CG-CG 4.23Å; T145-M861 HydrophobicContact CG2-CE 3.13Å; F229-M861 HydrophobicContact CB-SD 3.77Å; F229-M861 HydrophobicContact CD1-CE 4.46Å; F229-M861 HydrophobicContact CD1-SD 3.54Å; F229-M861 VanDerWaalsContact CD1-SD 3.54Å; F229-M861 HydrophobicContact CD2-CG 3.87Å; F229-M861 HydrophobicContact CD2-SD 3.23Å; F229-M861 WeakPolarHBondContact CD2-SD 3.44Å; F229-M861 HydrophobicContact CE1-SD 3.79Å; F229-M861 HydrophobicContact CE2-CG 3.64Å; F229-M861 HydrophobicContact CE2-SD 3.53Å; F229-M861 VanDerWaalsContact CE2-SD 3.53Å; F229-M861 HydrophobicContact CG-CG 4.41Å; F229-M861 HydrophobicContact CG-SD 3.22Å; F229-M861 WeakPolarHBondContact CG-SD 3.35Å; F229-M861 HydrophobicContact CZ-CG 4Å; F229-M861 HydrophobicContact CZ-SD 3.79Å; L857-M861 WeakPolarHBondContact O-CB 3.38Å; L857-M861 PolarHBondContact O-N 3.29Å; L858-M861 WeakPolarHBondContact O-CB 3.45Å; L858-M861 PolarHBondContact O-N 3.29Å; M861-L863 PolarHBondContact O-N 3.3Å; M861-L864 PolarHBondContact O-N 2.65Å; M861-A865 WeakPolarHBondContact O-CB 3.22Å; M861-A865 PolarHBondContact O-N 3.43Å
862	F	90.4	Very high	84.6	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-65.4	-34.8	176.4	-93.7	-87.8	0	0	0	113.2	L228 F229 F232 M284 V795 M798 V799 L858 M859 A865 V866	L228-F862 HydrophobicContact CB-CE2 4.33Å; L228-F862 HydrophobicContact CB-CZ 3.96Å; F229-F862 HydrophobicContact CB-CE2 3.9Å; F229-F862 HydrophobicContact CB-CZ 4.18Å; F229-F862 HydrophobicContact CD2-CE2 4.47Å; F232-F862 HydrophobicContact CB-CE1 3.78Å; F232-F862 HydrophobicContact CB-CZ 4.25Å; F232-F862 HydrophobicContact CD1-CE1 4.27Å; F232-F862 HydrophobicContact CD2-CE1 4.49Å; F232-F862 AromaticContact CG-CE1 3.92Å; F232-F862 HydrophobicContact CG-CE1 3.92Å; M284-F862 HydrophobicContact CE-CE1 4.31Å; V795-F862 HydrophobicContact CG1-CD1 3.71Å; V795-F862 HydrophobicContact CG1-CD2 3.66Å; V795-F862 HydrophobicContact CG1-CE1 3.55Å; V795-F862 HydrophobicContact CG1-CE2 3.52Å; V795-F862 HydrophobicContact CG1-CG 3.74Å; V795-F862 HydrophobicContact CG1-CZ 3.44Å; V795-F862 VanDerWaalsContact CG1-CZ 3.44Å; V795-F862 HydrophobicContact CG2-CD2 4.25Å; M798-F862 HydrophobicContact CE-CB 4.01Å; V799-F862 HydrophobicContact CG2-CD1 4.23Å; V799-F862 HydrophobicContact CG2-CE1 3.98Å; L858-F862 HydrophobicContact CD1-CD2 4.01Å; L858-F862 HydrophobicContact CD1-CE2 3.86Å; L858-F862 HydrophobicContact CG-CD2 4.25Å; L858-F862 HydrophobicContact CG-CE2 4.4Å; L858-F862 WeakPolarHBondContact O-CD2 3.31Å; L858-F862 PolarHBondContact O-N 3.49Å; M859-F862 PolarHBondContact O-N 3.46Å; F862-A865 PolarHBondContact O-N 3.1Å; F862-V866 WeakPolarHBondContact O-CB 3.5Å; F862-V866 VanDerWaalsContact O-CG2 3.25Å; F862-V866 WeakPolarHBondContact O-CG2 3.43Å; F862-V866 PolarHBondContact O-N 3.28Å
863	L	92.2	Very high	84.3	Confident	17 Å²	17	23.9 Å²	23.9	9%	0.089	13%	0.127	C	C	.	.	H	α-helix	trans	-59.9	-48.5	173.9	176.2	151	0	0	0	110.9	M798 L813 L816 L817 I820 M859 A860 M861 F867	M798-L863 HydrophobicContact CE-CB 3.93Å; L813-L863 HydrophobicContact CD1-CD1 4.49Å; L813-L863 HydrophobicContact CD1-CD2 3.91Å; L813-L863 HydrophobicContact CD1-CG 4.37Å; L816-L863 HydrophobicContact CB-CD1 3.99Å; L816-L863 HydrophobicContact CB-CG 4.2Å; L817-L863 HydrophobicContact CD2-CD1 3.53Å; L817-L863 HydrophobicContact CG-CD1 3.9Å; I820-L863 HydrophobicContact CD1-CB 3.8Å; I820-L863 HydrophobicContact CD1-CD1 3.55Å; I820-L863 HydrophobicContact CD1-CG 4.32Å; M859-L863 PolarHBondContact O-N 3Å; A860-L863 WeakPolarHBondContact O-CB 3.43Å; A860-L863 PolarHBondContact O-N 3.24Å; M861-L863 PolarHBondContact O-N 3.3Å; L863-F867 WeakPolarHBondContact O-CB 3.48Å; L863-F867 PolarHBondContact O-N 3.42Å
864	L	91	Very high	83.6	Confident	90 Å²	90	20.6 Å²	20.6	47%	0.471	11%	0.112	S	C	.	.	H	α-helix	trans	-63.7	-42.9	179.2	-68.3	174.3	0	0	0	111.1	L141 A860 M861 Y868	L141-L864 HydrophobicContact CD1-CB 3.81Å; L141-L864 HydrophobicContact CD1-CD1 3.64Å; L141-L864 HydrophobicContact CD1-CG 4.39Å; L141-L864 HydrophobicContact CD2-CB 4.41Å; A860-L864 WeakPolarHBondContact O-CG 3.37Å; A860-L864 PolarHBondContact O-N 3.03Å; A860-L864 VanDerWaalsContact O-N 3.11Å; M861-L864 PolarHBondContact O-N 2.65Å; L864-Y868 WeakPolarHBondContact O-CB 3.31Å; L864-Y868 PolarHBondContact O-N 2.86Å
865	A	90	Very high	82.4	Confident	3 Å²	3	19.8 Å²	19.8	3%	0.025	11%	0.106	C	C	.	.	H	α-helix	trans	-63.2	-50.8	177.7	0	0	0	0	0	112	L141 F229 F232 M237 M861 F862 F867 Y868 H869	L141-A865 HydrophobicContact CD2-CB 3.91Å; F229-A865 HydrophobicContact CE2-CB 4.19Å; F232-A865 HydrophobicContact CD1-CB 4.15Å; F232-A865 HydrophobicContact CE1-CB 3.78Å; M237-A865 HydrophobicContact CE-CB 4.46Å; M237-A865 WeakPolarHBondContact CE-O 3.22Å; M861-A865 WeakPolarHBondContact O-CB 3.22Å; M861-A865 PolarHBondContact O-N 3.43Å; F862-A865 PolarHBondContact O-N 3.1Å; A865-F867 VanDerWaalsContact C-N 3.34Å; A865-F867 PolarHBondContact O-N 2.95Å; A865-Y868 PolarHBondContact O-N 3.46Å; A865-H869 WeakPolarHBondContact O-CB 3.32Å; A865-H869 PolarHBondContact O-N 3.2Å
866	V	90.1	Very high	81	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-65.5	-38.4	179.9	175.2	0	0	0	0	111.4	F232 C801 A802 L816 F862 H869 G870	F232-V866 HydrophobicContact CE1-CG2 4.26Å; F232-V866 HydrophobicContact CE2-CG2 4.34Å; F232-V866 HydrophobicContact CZ-CG2 3.8Å; C801-V866 HydrophobicContact CB-CG1 4.28Å; A802-V866 HydrophobicContact CB-CG1 3.92Å; A802-V866 HydrophobicContact CB-CG2 4.24Å; L816-V866 HydrophobicContact CD1-CB 3.98Å; L816-V866 HydrophobicContact CD1-CG1 3.71Å; F862-V866 WeakPolarHBondContact O-CB 3.5Å; F862-V866 VanDerWaalsContact O-CG2 3.25Å; F862-V866 WeakPolarHBondContact O-CG2 3.43Å; F862-V866 PolarHBondContact O-N 3.28Å; V866-H869 PolarHBondContact O-N 3.04Å; V866-G870 PolarHBondContact O-N 2.97Å
867	F	88.8	Confident	79.6	Confident	32 Å²	32	17.8 Å²	17.8	14%	0.14	10%	0.096	C	C	.	.	H	α-helix	trans	-61.9	-47.8	175.6	177.3	-113.1	0	0	0	111.6	F645 L813 L863 A865 H869 G870 Q871	F645-F867 HydrophobicContact CE2-CZ 4.07Å; F645-F867 HydrophobicContact CZ-CZ 4.48Å; L813-F867 HydrophobicContact CB-CD2 3.83Å; L813-F867 HydrophobicContact CB-CE2 3.89Å; L813-F867 HydrophobicContact CD1-CD2 4.01Å; L813-F867 HydrophobicContact CD1-CE2 4.38Å; L813-F867 HydrophobicContact CD1-CG 4.27Å; L813-F867 HydrophobicContact CD2-CD2 4.35Å; L813-F867 HydrophobicContact CD2-CE2 3.89Å; L813-F867 HydrophobicContact CD2-CZ 4.2Å; L813-F867 HydrophobicContact CG-CD2 4.28Å; L813-F867 HydrophobicContact CG-CE2 4.28Å; L863-F867 WeakPolarHBondContact O-CB 3.48Å; L863-F867 PolarHBondContact O-N 3.42Å; A865-F867 VanDerWaalsContact C-N 3.34Å; A865-F867 PolarHBondContact O-N 2.95Å; F867-H869 PolarHBondContact O-N 2.83Å; F867-G870 WeakPolarHBondContact O-CA 3.36Å; F867-G870 PolarHBondContact O-N 3.3Å; F867-Q871 HydrophobicContact CE1-CG 4.34Å; F867-Q871 HydrophobicContact CE2-CG 4.5Å; F867-Q871 HydrophobicContact CZ-CG 4.27Å; F867-Q871 PolarHBondContact O-N 3.47Å
868	Y	86.8	Confident	77.9	Confident	44 Å²	44	16.8 Å²	16.8	17%	0.173	9%	0.091	C	C	.	.	H	α-helix	trans	-64.2	-40.8	178.5	-173.9	-93.9	0	0	0	112.1	K133 S134 V137 M237 L864 A865 G870 Q871 Q872	K133-Y868 WeakPolarHBondContact CB-OH 3.36Å; K133-Y868 PolarHBondContact O-OH 3.02Å; S134-Y868 PolarHBondContact N-OH 2.81Å; V137-Y868 HydrophobicContact CB-CD1 4.4Å; V137-Y868 HydrophobicContact CB-CD2 4.34Å; V137-Y868 HydrophobicContact CB-CE1 4.03Å; V137-Y868 HydrophobicContact CB-CE2 3.92Å; V137-Y868 HydrophobicContact CG1-CD1 4.04Å; V137-Y868 HydrophobicContact CG1-CD2 3.7Å; V137-Y868 HydrophobicContact CG1-CE1 4.16Å; V137-Y868 HydrophobicContact CG1-CE2 3.79Å; V137-Y868 HydrophobicContact CG1-CG 3.8Å; V137-Y868 HydrophobicContact CG2-CD2 4.33Å; V137-Y868 HydrophobicContact CG2-CE1 4.41Å; V137-Y868 HydrophobicContact CG2-CE2 3.58Å; M237-Y868 HydrophobicContact CE-CD1 3.9Å; M237-Y868 HydrophobicContact SD-CD1 3.84Å; M237-Y868 HydrophobicContact SD-CE1 4.36Å; L864-Y868 WeakPolarHBondContact O-CB 3.31Å; L864-Y868 PolarHBondContact O-N 2.86Å; A865-Y868 PolarHBondContact O-N 3.46Å; Y868-G870 VanDerWaalsContact C-N 3.26Å; Y868-G870 PolarHBondContact O-N 3.25Å; Y868-Q871 CarbonylContact O-C 3.58Å; Y868-Q871 WeakPolarHBondContact O-CA 3.28Å; Y868-Q871 WeakPolarHBondContact O-CB 3.17Å; Y868-Q871 PolarHBondContact O-N 3.46Å; Y868-Q872 PolarHBondContact O-N 3.02Å
869	H	86.1	Confident	76.2	Confident	2 Å²	2	16.5 Å²	16.5	1%	0.009	9%	0.09	C	C	.	.	H	α-helix	trans	-57.6	-43.8	174.2	173.9	-104	0	0	0	110.5	M237 A865 V866 F867 Q871 Q872 V873	M237-H869 HydrophobicContact CE-CB 3.58Å; M237-H869 HydrophobicContact SD-CB 4.4Å; A865-H869 WeakPolarHBondContact O-CB 3.32Å; A865-H869 PolarHBondContact O-N 3.2Å; V866-H869 PolarHBondContact O-N 3.04Å; F867-H869 PolarHBondContact O-N 2.83Å; H869-Q871 VanDerWaalsContact C-N 3.32Å; H869-Q871 PolarHBondContact O-N 3.18Å; H869-Q872 PolarHBondContact O-N 3.27Å; H869-V873 WeakPolarHBondContact O-CG2 3.12Å; H869-V873 PolarHBondContact O-N 3.27Å; H869-V873 VanDerWaalsContact O-N 3.16Å
870	G	80.3	Confident	74.2	Confident	3 Å²	3	19.1 Å²	19.1	3%	0.031	10%	0.102	C	C	.	.	H	α-helix	trans	-58.9	-39.7	173.2	0	0	0	0	0	113.4	V866 F867 Y868 K874	V866-G870 PolarHBondContact O-N 2.97Å; F867-G870 WeakPolarHBondContact O-CA 3.36Å; F867-G870 PolarHBondContact O-N 3.3Å; Y868-G870 VanDerWaalsContact C-N 3.26Å; Y868-G870 PolarHBondContact O-N 3.25Å; G870-K874 VanDerWaalsContact O-CB 3.22Å; G870-K874 WeakPolarHBondContact O-CB 3.17Å; G870-K874 PolarHBondContact O-N 3.44Å
871	Q	79.1	Confident	72.1	Confident	50 Å²	50	20.3 Å²	20.3	23%	0.234	10%	0.098	C	C	.	.	H	α-helix	trans	-72.2	-28	177	-71.1	-163.6	-9.4	0	0	114.1	L647 F867 Y868 H869 P875	L647-Q871 HydrophobicContact CD1-CB 4.37Å; L647-Q871 HydrophobicContact CD1-CG 4.41Å; F867-Q871 HydrophobicContact CE1-CG 4.34Å; F867-Q871 HydrophobicContact CE2-CG 4.5Å; F867-Q871 HydrophobicContact CZ-CG 4.27Å; F867-Q871 PolarHBondContact O-N 3.47Å; Y868-Q871 CarbonylContact O-C 3.58Å; Y868-Q871 WeakPolarHBondContact O-CA 3.28Å; Y868-Q871 WeakPolarHBondContact O-CB 3.17Å; Y868-Q871 PolarHBondContact O-N 3.46Å; H869-Q871 VanDerWaalsContact C-N 3.32Å; H869-Q871 PolarHBondContact O-N 3.18Å; Q871-P875 WeakPolarHBondContact O-CD 3.21Å; Q871-P875 WeakPolarHBondContact O-CG 3.48Å
872	Q	74.1	Confident	70.1	Confident	13 Å²	13	21.1 Å²	21.1	6%	0.061	10%	0.102	C	C	.	.	H	α-helix	trans	-77.2	-41.3	-179.6	-174.5	-175.8	1.2	0	0	112.3	Q130 S134 Y868 H869 P875 S876	Q130-Q872 PolarHBondContact NE2-O 3.02Å; S134-Q872 PolarHBondContact OG-OE1 3.45Å; Y868-Q872 PolarHBondContact O-N 3.02Å; H869-Q872 PolarHBondContact O-N 3.27Å; Q872-P875 WeakPolarHBondContact O-CD 3.37Å; Q872-S876 PolarHBondContact O-OG 2.98Å
873	V	66.7	Low	67.9	Low	2 Å²	2	21.5 Å²	21.5	1%	0.012	11%	0.105	C	C	.	.	H	α-helix	trans	-85.7	-40.1	-171.7	178.2	0	0	0	0	112.6	L805 H869 S876 L877	L805-V873 HydrophobicContact CB-CG1 4.18Å; L805-V873 HydrophobicContact CD2-CG1 4.16Å; H869-V873 WeakPolarHBondContact O-CG2 3.12Å; H869-V873 PolarHBondContact O-N 3.27Å; H869-V873 VanDerWaalsContact O-N 3.16Å; V873-S876 WeakPolarHBondContact CA-OG 3.22Å; V873-S876 PolarHBondContact O-N 3.44Å; V873-S876 VanDerWaalsContact O-N 3.13Å; V873-S876 PolarHBondContact O-OG 3.05Å; V873-L877 HydrophobicContact CG1-CD1 3.87Å; V873-L877 PolarHBondContact O-N 3.26Å
874	K	60.1	Low	65.5	Low	7 Å²	7	22.2 Å²	22.2	3%	0.03	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	-58.6	-36.9	-177.3	-169.7	-179.8	179.3	-153	0	115.2	S646 L647 N808 G870	S646-K874 PolarHBondContact O-NZ 2.72Å; L647-K874 HydrophobicContact CB-CD 4.05Å; L647-K874 HydrophobicContact CD1-CB 4.07Å; L647-K874 HydrophobicContact CD1-CD 4.11Å; L647-K874 HydrophobicContact CD1-CG 4.41Å; N808-K874 PolarHBondContact OD1-NZ 2.99Å; G870-K874 VanDerWaalsContact O-CB 3.22Å; G870-K874 WeakPolarHBondContact O-CB 3.17Å; G870-K874 PolarHBondContact O-N 3.44Å
875	P	53.2	Low	63.2	Low	9 Å²	9	23.7 Å²	23.7	6%	0.058	11%	0.114	C	C	.	.	G	3₁₀ helix	trans	-75.8	-23.7	176.3	-4.7	19.1	0	0	0	113.8	L647 Q871 Q872 L877	L647-P875 HydrophobicContact CD1-CG 4.02Å; L647-P875 HydrophobicContact CD2-CG 4.08Å; Q871-P875 WeakPolarHBondContact O-CD 3.21Å; Q871-P875 WeakPolarHBondContact O-CG 3.48Å; Q872-P875 WeakPolarHBondContact O-CD 3.37Å; P875-L877 VanDerWaalsContact C-N 3.31Å
876	S	51.2	Low	60.6	Low	4 Å²	4	24.9 Å²	24.9	3%	0.028	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-81.1	-8.9	175.4	49	0	0	0	0	113.5	A302 Q872 V873	A302-S876 WeakPolarHBondContact CB-O 3.23Å; Q872-S876 PolarHBondContact O-OG 2.98Å; V873-S876 WeakPolarHBondContact CA-OG 3.22Å; V873-S876 PolarHBondContact O-N 3.44Å; V873-S876 VanDerWaalsContact O-N 3.13Å; V873-S876 PolarHBondContact O-OG 3.05Å
877	L	54.2	Low	58.2	Low	6 Å²	6	26.4 Å²	26.4	3%	0.031	13%	0.132	C	C	.	.	S	Bend	trans	-80	173.6	170.3	-90.5	145.6	0	0	0	110	A298 L805 R806 V873 P875 K879	A298-L877 HydrophobicContact CB-CD2 4.14Å; A298-L877 HydrophobicContact CB-CG 4.4Å; L805-L877 HydrophobicContact CB-CD1 4.41Å; R806-L877 HydrophobicContact CG-CD1 4.18Å; R806-L877 HydrophobicContact CG-CD2 4.13Å; V873-L877 HydrophobicContact CG1-CD1 3.87Å; V873-L877 PolarHBondContact O-N 3.26Å; P875-L877 VanDerWaalsContact C-N 3.31Å; L877-K879 PolarHBondContact O-N 3.04Å
878	P	49.3	Very low	55.7	Low	11 Å²	11	28.9 Å²	28.9	7%	0.071	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	19.9	-153.7	20.6	-30.5	0	0	0	117.8	Y658 M661 H880 K881	Y658-P878 HydrophobicContact CE2-CG 3.95Å; M661-P878 HydrophobicContact CE-CB 4.43Å; M661-P878 HydrophobicContact CE-CG 4.36Å; P878-H880 PolarHBondContact O-N 3Å; P878-K881 HydrophobicContact CB-CD 3.91Å; P878-K881 HydrophobicContact CB-CG 4.4Å; P878-K881 VanDerWaalsContact O-CB 3.3Å; P878-K881 WeakPolarHBondContact O-CB 3.42Å; P878-K881 PolarHBondContact O-N 3.33Å
879	K	49.1	Very low	53	Low	1 Å²	1	35.8 Å²	35.8	0%	0.004	18%	0.175	C	C	.	.	H	α-helix	trans	-62.3	-24.2	166.5	-58.3	-162.2	120.3	144.7	0	113.1	I642 L647 F649 E655 Y658 L877 K881 L882 C883	I642-K879 HydrophobicContact CD1-CB 3.98Å; I642-K879 HydrophobicContact CD1-CD 4.44Å; L647-K879 PolarHBondContact O-NZ 2.9Å; F649-K879 VanDerWaalsContact CD2-CE 3.48Å; F649-K879 HydrophobicContact CE1-CB 4.27Å; F649-K879 HydrophobicContact CE2-CB 4.15Å; F649-K879 HydrophobicContact CE2-CD 4.08Å; F649-K879 HydrophobicContact CE2-CG 3.84Å; F649-K879 HydrophobicContact CZ-CB 3.56Å; F649-K879 HydrophobicContact CZ-CD 4.24Å; F649-K879 HydrophobicContact CZ-CG 3.8Å; E655-K879 IonicContact OE1-NZ 3.61Å; E655-K879 PolarHBondContact OE1-NZ 3.4Å; E655-K879 WeakPolarHBondContact OE2-CE 3.42Å; E655-K879 IonicContact OE2-NZ 3.3Å; E655-K879 PolarHBondContact OE2-NZ 3Å; Y658-K879 HydrophobicContact CD2-CG 4.18Å; Y658-K879 HydrophobicContact CE2-CG 3.77Å; L877-K879 PolarHBondContact O-N 3.04Å; K879-K881 VanDerWaalsContact C-N 3.34Å; K879-L882 PolarHBondContact O-N 3.45Å; K879-C883 PolarHBondContact O-N 3.33Å
880	H	47	Very low	50.1	Low	55 Å²	55	41.7 Å²	41.7	26%	0.255	21%	0.211	S	C	.	.	H	α-helix	trans	-66.8	-31.2	169.5	-118.1	-73	0	0	0	113.1	P878 S884	P878-H880 PolarHBondContact O-N 3Å; H880-S884 WeakPolarHBondContact O-CB 3.29Å; H880-S884 PolarHBondContact O-N 3.18Å
881	K	45.1	Very low	47.5	Very low	73 Å²	73	50.8 Å²	50.8	32%	0.317	26%	0.258	S	S	.	.	H	α-helix	trans	-60.6	-52.8	172.4	-80.9	173.9	151.8	157.6	0	110.5	E305 P878 K879 S884 F885	E305-K881 HydrophobicContact CB-CG 4.21Å; E305-K881 WeakPolarHBondContact OE1-CE 3.31Å; E305-K881 IonicContact OE1-NZ 2.69Å; E305-K881 PolarHBondContact OE1-NZ 3.37Å; E305-K881 WeakPolarHBondContact OE2-CD 3.28Å; E305-K881 WeakPolarHBondContact OE2-CE 3.46Å; E305-K881 IonicContact OE2-NZ 2.72Å; E305-K881 PolarHBondContact OE2-NZ 3.26Å; P878-K881 HydrophobicContact CB-CD 3.91Å; P878-K881 HydrophobicContact CB-CG 4.4Å; P878-K881 VanDerWaalsContact O-CB 3.3Å; P878-K881 WeakPolarHBondContact O-CB 3.42Å; P878-K881 PolarHBondContact O-N 3.33Å; K879-K881 VanDerWaalsContact C-N 3.34Å; K881-S884 PolarHBondContact O-N 2.88Å; K881-F885 WeakPolarHBondContact O-CD2 3.48Å; K881-F885 PolarHBondContact O-N 3.42Å
882	L	47.3	Very low	45.9	Very low	21 Å²	21	50.8 Å²	50.8	11%	0.11	26%	0.259	C	S	.	.	H	α-helix	trans	-70.8	-36.6	-175.2	-76.9	128.8	0	0	0	113	F649 L654 K657 Y658 M661 K879 S884 F885 S886	F649-L882 HydrophobicContact CE1-CB 4.14Å; F649-L882 HydrophobicContact CE2-CB 4.1Å; F649-L882 HydrophobicContact CE2-CD1 3.88Å; F649-L882 HydrophobicContact CZ-CB 3.55Å; F649-L882 HydrophobicContact CZ-CD1 4.09Å; F649-L882 HydrophobicContact CZ-CG 4.42Å; L654-L882 HydrophobicContact CB-CD2 4.11Å; L654-L882 HydrophobicContact CD2-CD2 3.58Å; L654-L882 HydrophobicContact CG-CD2 4.42Å; K657-L882 HydrophobicContact CB-CD2 4.47Å; Y658-L882 HydrophobicContact CD2-CD1 3.87Å; Y658-L882 HydrophobicContact CG-CD1 4.39Å; M661-L882 HydrophobicContact CE-CD1 3.78Å; K879-L882 PolarHBondContact O-N 3.45Å; L882-S884 PolarHBondContact O-N 3.37Å; L882-F885 PolarHBondContact O-N 2.68Å; L882-S886 PolarHBondContact O-N 2.75Å; L882-S886 PolarHBondContact O-OG 3.49Å
883	C	43.9	Very low	44.4	Very low	8 Å²	8	52.8 Å²	52.8	5%	0.054	27%	0.27	C	S	.	.	H	α-helix	trans	-61	-34.8	171.2	-84.7	0	0	0	0	112.7	H641 K879 V887	H641-C883 VanDerWaalsContact CB-SG 3.53Å; K879-C883 PolarHBondContact O-N 3.33Å; C883-V887 WeakPolarHBondContact O-CG2 3.31Å
884	S	42	Very low	43.2	Very low	33 Å²	33	55.6 Å²	55.6	23%	0.231	28%	0.284	C	S	.	.	H	α-helix	trans	-80.1	-29.5	-179.7	-151.8	0	0	0	0	112.5	C309 H880 K881 L882	C309-S884 WeakPolarHBondContact SG-CB 3.47Å; C309-S884 PolarHBondContact SG-OG 2.94Å; H880-S884 WeakPolarHBondContact O-CB 3.29Å; H880-S884 PolarHBondContact O-N 3.18Å; K881-S884 PolarHBondContact O-N 2.88Å; L882-S884 PolarHBondContact O-N 3.37Å
885	F	42.8	Very low	42.2	Very low	120 Å²	120	58.5 Å²	58.5	53%	0.526	30%	0.299	S	S	.	.	H	α-helix	trans	-74.4	-34.9	171.5	-91.4	-79.2	0	0	0	113.4	K881 L882 V887 Q888	K881-F885 WeakPolarHBondContact O-CD2 3.48Å; K881-F885 PolarHBondContact O-N 3.42Å; L882-F885 PolarHBondContact O-N 2.68Å; F885-V887 VanDerWaalsContact C-N 3.26Å; F885-V887 PolarHBondContact O-N 3.05Å; F885-Q888 WeakPolarHBondContact O-CB 3.3Å; F885-Q888 PolarHBondContact O-N 3.07Å
886	S	36.6	Very low	41.5	Very low	29 Å²	29	61.6 Å²	61.6	20%	0.203	31%	0.314	C	S	.	.	H	α-helix	trans	-65.3	-28.2	177.4	-70.4	0	0	0	0	113.4	L654 L882 Q888	L654-S886 WeakPolarHBondContact CD1-OG 3.27Å; L882-S886 PolarHBondContact O-N 2.75Å; L882-S886 PolarHBondContact O-OG 3.49Å; S886-Q888 PolarHBondContact O-N 3.12Å
887	V	38.3	Very low	40.8	Very low	32 Å²	32	65.4 Å²	65.4	19%	0.194	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-11.5	174.2	179.7	0	0	0	0	111.6	L637 C883 F885	L637-V887 HydrophobicContact CD2-CG2 4.22Å; C883-V887 WeakPolarHBondContact O-CG2 3.31Å; F885-V887 VanDerWaalsContact C-N 3.26Å; F885-V887 PolarHBondContact O-N 3.05Å
888	Q	37.4	Very low	39.9	Very low	83 Å²	83	69.6 Å²	69.6	39%	0.388	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-4.7	-176.3	-152.6	165.5	-2.9	0	0	113.6	F885 S886	F885-Q888 WeakPolarHBondContact O-CB 3.3Å; F885-Q888 PolarHBondContact O-N 3.07Å; S886-Q888 PolarHBondContact O-N 3.12Å
889	F	29	Very low	39.2	Very low	189 Å²	189	74.2 Å²	74.2	83%	0.829	38%	0.376	S	S	*	.	S	Bend	trans	-113.6	1.2	177.2	-98.4	-82.6	0	0	0	113.4
890	V	26.5	Very low	38.3	Very low	126 Å²	126	80.3 Å²	80.3	76%	0.764	41%	0.407	S	S	*	.			trans	-111.4	-1	-178.5	-177	0	0	0	0	111.8
891	L	24.3	Very low	37.6	Very low	194 Å²	194	82.5 Å²	82.5	100%	1.016	42%	0.421	S	S	*	.			trans	-132.8	0	170	-80.7	161.7	0	0	0	107.2

Retrieved 891 of 891 residues in 447.7 ms (Link to these results)

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