A0A087X8Q7_POEFO Loading...

Cohesin subunit SA

Component of cohesin complex, a complex required for the cohesion of sister chromatids after DNA replication. The cohesin complex apparently forms a large proteinaceous ring within which sister chromatids can be trapped. At anaphase, the complex is cleaved and dissociates from chromatin, allowing sister chromatids to segregate.

AlphaFold DB , UniProt , Accession A0A087X8Q7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,221 aa.

						>A0A087X8Q7_POEFO|A0A087X8Q7
METGSSESLEELDLSSESGSIYESQTKARKRSKQSLPAPQPPKRPRRNAALRVTSSTSSSPIPDPPDPSQQQPSPSQGTSRKLSSGRVTSEESQGISAKDIYDAVCSGKSAMVTVVEEWLCSYKQSREEGLLVLINFIVQSCGCKGVVSREMYDSMENAEIISTLTKEFNEDSVNYPLITPGPQFKRFKAGLCEFVRILVHSCRNSLVYDEFLFPSLLALLTGLSDSQVRAFRHTSTLLAMKLMTGLVDVAVAVSVQLQTTQRQCDIENSKSPRDQGSDRLEELKTAVRELQENREELSFMMNATFRGVFVHRYRDRLADIRAACIEELGLWLKTDPDNFLNDRCLKYLGWTLHDKQSPVRLQCVRALQGLYQEKEFIGRLELFTSRFKERILSMVLDKDPDVAVEVVNLLLMIQHSTEDDLMEEESGHIYPLVYASHRGLASAAGAFLCHKLKRVVTTQSQDDDDKSNNAAFFQILISFYIQSEFHEHGAYLVDSLWTVAGSELRDWDTMTTLLLQDSGLMYEEEGALLEIMICAIRQAAEATPPAGRSQGKKVLSMKLKKIQEQDRTRITTHFIPVLPQLLSKYSADAEKMSLLLRAPLYFDLDMYSSTQWLEKHLDLLLSQICTIVKKHTDAAVLQACALLVSTLCSESHTFSSRAHLVFSQLMDELTECFNSYLSDLLQGAADEDGVYNAASALKRIAALCSAKDPTRWELLDSCMELLKNRIESLDFDTELLVAALKCAAFHLMWAKLNAVNLNPAEVDLTHLRKKVRLFCRVCQTCLSLDQTEIRDQAFELLCDLLLLYGAVSVRGEPVLRALVHLPSDSLRAELASFLLDYVFNDSENIDLDDEDLEKKVALLQKKRNQLGGYCKLVLYGVLDLSAATNVFKHYSKYFKDFGDIIKETVSKSKLINPIQSAKIVCLSLQQLFSEMLTEGHDQQDFTEIRELARKLAMSFGVDLRRSRKQLVALHLDGIRFAFRVPQEGEECPNVAFLEILSEFSFKLLPQDCAQLAQFLKSECPSAALSWPSVKLYRRSLESRTSKYKDPDEESKADSSLHTPVTKRKRITAQGSASSTARGSLLESSSIQSHLHTPALTSTVLKHRPKRATAKKPTATVSDSGSVLTELESEDEFSCGSNMRKVKPAKRGKASSVQTSTQQEDLDSHLNLLSLIEDDISKRAGSDISGEEEPEIEDYESDKGSEFTLPSTRHTSASILDQLFD
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.9	Very low	36.1	Very low	236 Å²	236	141.2 Å²	141.2	100%	1.163	79%	0.788	S	S	*	*				0	113.7	0	-74	171	178	0	0	106.2
2	E	29.5	Very low	36.1	Very low	188 Å²	188	140.2 Å²	140.2	88%	0.879	78%	0.779	S	S	*	*			cis	-138.7	177.5	-1.3	-69.6	-170.9	120.9	0	0	110.9
3	T	37.2	Very low	36.1	Very low	146 Å²	146	138.9 Å²	138.9	90%	0.896	77%	0.77	S	S	*	*			trans	-127.2	148.9	-174.6	49.6	0	0	0	0	110.5
4	G	37.6	Very low	35.7	Very low	65 Å²	65	139 Å²	139	67%	0.67	77%	0.767	S	S	*	*			trans	149.9	148.8	144.2	0	0	0	0	0	119.4
5	S	37.2	Very low	35.5	Very low	124 Å²	124	136.1 Å²	136.1	87%	0.867	76%	0.761	S	S	*	*			trans	65.5	144.4	150.4	55.6	0	0	0	0	121.1
6	S	38.3	Very low	35	Very low	89 Å²	89	135.6 Å²	135.6	62%	0.622	77%	0.769	S	S	*	*			cis	-172.4	164.5	-25.2	-147.9	0	0	0	0	111.6
7	E	35.8	Very low	34.9	Very low	170 Å²	170	138.5 Å²	138.5	79%	0.794	78%	0.775	S	S	*	*			trans	62.2	150	150.4	-77.8	143.6	-111.5	0	0	121.7
8	S	40.3	Very low	34.5	Very low	88 Å²	88	137.4 Å²	137.4	62%	0.615	78%	0.778	S	S	*	*			cis	-174.5	173.2	-19.6	51.8	0	0	0	0	112.5
9	L	37	Very low	34	Very low	139 Å²	139	133.8 Å²	133.8	73%	0.728	77%	0.774	S	S	*	*			trans	71.6	148.6	164.6	-52.8	176.8	0	0	0	116.6
10	E	37.8	Very low	33.6	Very low	159 Å²	159	132.7 Å²	132.7	74%	0.743	77%	0.774	S	S	*	*			cis	-165.9	168.9	-4.8	-103	161.8	164.9	0	0	106.6
11	E	36.5	Very low	33.3	Very low	149 Å²	149	133.6 Å²	133.6	70%	0.696	78%	0.775	S	S	*	*			cis	-157.6	155.6	2.1	-121.4	-154.5	150.1	0	0	110.2
12	L	36	Very low	33.2	Very low	129 Å²	129	133.1 Å²	133.1	68%	0.675	76%	0.761	S	S	*	*			trans	44.9	148.8	142.8	-60.2	-173.7	0	0	0	125.8
13	D	36.1	Very low	32.9	Very low	124 Å²	124	131.4 Å²	131.4	66%	0.663	75%	0.753	S	S	*	*			cis	-171.4	170.8	-23.7	-156	6.3	0	0	0	114
14	L	30.8	Very low	32.2	Very low	140 Å²	140	127.7 Å²	127.7	73%	0.733	73%	0.733	S	S	*	*			trans	68.7	143.6	159.6	-55.5	-177.2	0	0	0	120.8
15	S	31.9	Very low	31.5	Very low	96 Å²	96	132.1 Å²	132.1	67%	0.671	74%	0.737	S	S	*	*			cis	174	136.8	-46.5	51.9	0	0	0	0	109.7
16	S	28.3	Very low	30.8	Very low	128 Å²	128	131.2 Å²	131.2	90%	0.895	73%	0.726	S	S	*	*			trans	171.3	138.2	140.1	-98	0	0	0	0	111.8
17	E	32.4	Very low	30.1	Very low	184 Å²	184	136.1 Å²	136.1	86%	0.86	74%	0.736	S	S	*	*			trans	-98.8	160.6	-179.2	-52.5	166	107.3	0	0	112.5
18	S	28	Very low	29.7	Very low	120 Å²	120	132.6 Å²	132.6	84%	0.839	74%	0.736	S	S	*	*				165.6	120.8	123.5	-76.4	0	0	0	0	115.3
19	G	24.6	Very low	29.1	Very low	68 Å²	68	138.7 Å²	138.7	70%	0.701	75%	0.746	S	S	*	*				75.4	132.2	106.4	0	0	0	0	0	122.6
20	S	26.7	Very low	28.9	Very low	111 Å²	111	140 Å²	140	78%	0.776	75%	0.745	S	S	*	*			trans	68.2	135.8	157.7	73.1	0	0	0	0	117.4
21	I	28.2	Very low	28.4	Very low	152 Å²	152	143 Å²	143	78%	0.779	75%	0.75	S	S	*	*			cis	65.8	100.5	43.8	-52.3	167.1	0	0	0	112.7
22	Y	25.9	Very low	27.9	Very low	226 Å²	226	140.3 Å²	140.3	89%	0.886	75%	0.747	S	S	*	*				-158.2	172.1	129.3	-132.8	-97.5	0	0	0	113.2
23	E	24.4	Very low	27.5	Very low	152 Å²	152	142.8 Å²	142.8	71%	0.71	75%	0.753	S	S	*	*			trans	-113	-180	-163.4	-163.1	-156.8	-116.2	0	0	111.9
24	S	22.9	Very low	27	Very low	68 Å²	68	144.6 Å²	144.6	48%	0.476	76%	0.757	S	S	.	*			trans	85	122.2	143.8	-97	0	0	0	0	121.8
25	Q	22.2	Very low	26.6	Very low	159 Å²	159	142.5 Å²	142.5	74%	0.743	75%	0.754	S	S	*	*				87.2	100	125.2	-72.5	178.7	49.7	0	0	124.1
26	T	22.8	Very low	26.6	Very low	104 Å²	104	146 Å²	146	64%	0.638	77%	0.765	S	S	*	*				57.1	141.4	117.6	67.7	0	0	0	0	124.6
27	K	23.1	Very low	27.1	Very low	193 Å²	193	145.8 Å²	145.8	84%	0.839	76%	0.76	S	S	*	*			trans	70.3	87.8	138.7	-72.7	163.7	-174.5	169.2	0	119.8
28	A	26.8	Very low	26.9	Very low	96 Å²	96	141.6 Å²	141.6	79%	0.793	76%	0.757	S	S	*	*			trans	-1.8	140.1	136.9	0	0	0	0	0	120.7
29	R	29.6	Very low	27.2	Very low	216 Å²	216	141.9 Å²	141.9	82%	0.815	76%	0.756	S	S	*	*				-175.2	151.1	113.1	-116.4	175.1	162.2	176.2	-2	115.5
30	K	31.2	Very low	27.4	Very low	165 Å²	165	146.7 Å²	146.7	72%	0.717	76%	0.76	S	S	*	*			trans	70.8	156.5	157.2	-66.3	165.9	-178.5	171.9	0	114.9
31	R	28.3	Very low	27.6	Very low	224 Å²	224	147 Å²	147	85%	0.845	76%	0.76	S	S	*	*			cis	-156.2	153.4	6.6	-138.1	172.2	179.8	173.3	-3.1	112.5
32	S	25.1	Very low	27.9	Very low	91 Å²	91	145.7 Å²	145.7	64%	0.636	76%	0.761	S	S	*	*			trans	70.7	105.4	138.7	-170.9	0	0	0	0	122.6
33	K	28.4	Very low	28.1	Very low	181 Å²	181	142.5 Å²	142.5	79%	0.787	75%	0.752	S	S	*	*			trans	75.7	149.7	131.8	-71.3	-175.2	174.6	-174.2	0	122.3
34	Q	24.3	Very low	28.5	Very low	162 Å²	162	142.8 Å²	142.8	76%	0.757	75%	0.746	S	S	*	*			trans	77.6	81.1	149.3	-79.1	165.2	-70.3	0	0	120.7
35	S	24.2	Very low	28.9	Very low	97 Å²	97	145.8 Å²	145.8	68%	0.678	77%	0.765	S	S	*	*				57.2	87	113.3	64.6	0	0	0	0	120.6
36	L	30.1	Very low	29.4	Very low	169 Å²	169	146.7 Å²	146.7	89%	0.885	76%	0.761	S	S	*	*			trans	63.7	167	145.4	-65.1	172.1	0	0	0	118.3
37	P	40.7	Very low	29.8	Very low	123 Å²	123	152.4 Å²	152.4	80%	0.799	77%	0.771	S	S	*	*			cis	-114.6	154.9	-18	35	-22	0	0	0	112.9
38	A	28.4	Very low	30.5	Very low	96 Å²	96	150.8 Å²	150.8	79%	0.793	77%	0.772	S	S	*	*			trans	-136.6	153.3	175.4	0	0	0	0	0	111.7
39	P	32.8	Very low	30.4	Very low	127 Å²	127	151 Å²	151	83%	0.825	77%	0.773	S	S	*	*			trans	-93.5	161.4	-155.1	35.7	-36.8	0	0	0	116
40	Q	29.3	Very low	30.3	Very low	168 Å²	168	145.8 Å²	145.8	79%	0.785	78%	0.776	S	S	*	*			trans	-126.3	131.3	171.9	-70.3	-172	1.7	0	0	112.2
41	P	30.5	Very low	30.2	Very low	118 Å²	118	145.3 Å²	145.3	77%	0.766	78%	0.781	S	S	*	*			trans	-105	169.6	159.1	39.6	-31.8	0	0	0	111.5
42	P	35.8	Very low	30.2	Very low	125 Å²	125	145.8 Å²	145.8	81%	0.812	78%	0.783	S	S	*	*				-98.3	161.8	-77.2	37.3	-30	0	0	0	112.1
43	K	28.8	Very low	30.2	Very low	159 Å²	159	147.9 Å²	147.9	69%	0.691	79%	0.791	S	S	*	*			trans	-147	158.6	175.3	-77.1	-176.8	176	163.1	0	112.1
44	R	32.1	Very low	30.1	Very low	157 Å²	157	145.3 Å²	145.3	59%	0.592	79%	0.791	S	S	*	*			trans	82.6	158.2	159.6	-75	157	-174.8	164.2	7.1	115.8	R46	R44-R46 HydrophobicContact CG-CB 4.09Å; R44-R46 HydrophobicContact CG-CG 4.2Å
45	P	32.3	Very low	30.2	Very low	132 Å²	132	142.9 Å²	142.9	86%	0.857	79%	0.792	S	S	*	*				-74.9	155	50.6	23.8	-35.1	0	0	0	118.8
46	R	33	Very low	30.3	Very low	178 Å²	178	144 Å²	144	67%	0.672	80%	0.8	S	S	*	*			trans	-110	177.7	163.8	-127.5	-173.8	179.8	172.1	-2.8	105.3	R44	R44-R46 HydrophobicContact CG-CB 4.09Å; R44-R46 HydrophobicContact CG-CG 4.2Å
47	R	30.1	Very low	30.2	Very low	223 Å²	223	142 Å²	142	84%	0.842	80%	0.795	S	S	*	*				-172.1	124.5	51.2	-162.7	174.3	-168.5	163	0.5	110.5
48	N	38.3	Very low	29.5	Very low	160 Å²	160	141.3 Å²	141.3	86%	0.856	79%	0.793	S	S	*	*			trans	-85	153.9	155.6	-68.8	5.7	0	0	0	109.1
49	A	25	Very low	29.5	Very low	100 Å²	100	142 Å²	142	83%	0.826	79%	0.792	S	S	*	*			trans	-139.5	159.5	169.6	0	0	0	0	0	109.6
50	A	28.4	Very low	29.4	Very low	107 Å²	107	141.5 Å²	141.5	88%	0.884	79%	0.791	S	S	*	*			trans	-122	-175.7	-170.9	0	0	0	0	0	112.9
51	L	29.1	Very low	30.3	Very low	155 Å²	155	138.7 Å²	138.7	81%	0.812	79%	0.788	S	S	*	*			trans	-76.7	158.9	-166	-75.2	158.9	0	0	0	116.7
52	R	27.1	Very low	30.4	Very low	233 Å²	233	140.6 Å²	140.6	88%	0.879	79%	0.79	S	S	*	*			trans	64.3	137.7	158.6	-68.9	172	173.2	-178.7	-2.8	116.1
53	V	25.6	Very low	30.6	Very low	135 Å²	135	140.1 Å²	140.1	82%	0.818	79%	0.787	S	S	*	*				-162	168.7	71.5	154.8	0	0	0	0	110.4
54	T	26	Very low	30.4	Very low	128 Å²	128	139.6 Å²	139.6	79%	0.785	79%	0.792	S	S	*	*			trans	-69.1	175.9	174.5	53.5	0	0	0	0	112
55	S	25.7	Very low	31.6	Very low	110 Å²	110	137.7 Å²	137.7	77%	0.769	80%	0.8	S	S	*	*			cis	-164.4	166.8	24.3	52.5	0	0	0	0	111.3
56	S	26.2	Very low	32.3	Very low	122 Å²	122	137.1 Å²	137.1	85%	0.853	80%	0.796	S	S	*	*			trans	-161.1	169.6	156.8	60.9	0	0	0	0	111.2
57	T	27.9	Very low	32.2	Very low	127 Å²	127	135 Å²	135	78%	0.779	80%	0.798	S	S	*	*			trans	-130.8	138	-154.9	49.3	0	0	0	0	115.9
58	S	28	Very low	32.7	Very low	107 Å²	107	129.6 Å²	129.6	75%	0.748	79%	0.791	S	S	*	*			trans	38.5	120.5	145.8	62.4	0	0	0	0	121.4
59	S	27.4	Very low	32.2	Very low	111 Å²	111	125.9 Å²	125.9	78%	0.776	78%	0.778	S	S	*	*				172.4	116	104.4	43	0	0	0	0	116
60	S	30.9	Very low	32.5	Very low	116 Å²	116	129.5 Å²	129.5	81%	0.811	78%	0.778	S	S	*	*			trans	65.4	174	147	-44.7	0	0	0	0	118.8
61	P	48.8	Very low	32.4	Very low	109 Å²	109	133.4 Å²	133.4	71%	0.708	78%	0.778	S	S	*	*				-137	164	-86.5	41.2	-23.7	0	0	0	117.6
62	I	32.4	Very low	32.4	Very low	158 Å²	158	134.5 Å²	134.5	81%	0.81	78%	0.779	S	S	*	*			trans	40.6	134.7	137.6	-68.7	168.6	0	0	0	119.4
63	P	40.3	Very low	32.6	Very low	116 Å²	116	129.7 Å²	129.7	75%	0.753	78%	0.777	S	S	*	*			cis	-144.6	179	38.5	33.6	-9.9	0	0	0	119.3
64	D	24.3	Very low	32.6	Very low	148 Å²	148	128.2 Å²	128.2	79%	0.791	77%	0.773	S	S	*	*			trans	-76.7	-172.6	163.2	-40.5	-88.7	0	0	0	112.7
65	P	55.9	Low	33.5	Very low	117 Å²	117	127.4 Å²	127.4	76%	0.76	77%	0.77	S	S	*	*			cis	-128.9	-144.5	-6.4	41.3	-20	0	0	0	110.5
66	P	47.2	Very low	33.5	Very low	120 Å²	120	126.9 Å²	126.9	78%	0.779	77%	0.767	S	S	*	*			cis	-135.1	-165.8	-13.9	43.4	-24.1	0	0	0	115.9
67	D	30.7	Very low	33.8	Very low	134 Å²	134	130.7 Å²	130.7	72%	0.717	77%	0.771	S	S	*	*			trans	-106.5	162.5	163.6	177.2	44.6	0	0	0	110.1	S69	D67-S69 PolarHBondContact OD1-N 3.41Å; D67-S69 PolarHBondContact OD2-N 3.34Å
68	P	41.8	Very low	33.7	Very low	108 Å²	108	127.9 Å²	127.9	70%	0.701	77%	0.768	S	S	*	*				-155.7	124.2	105	37	-16.1	0	0	0	118.7
69	S	27.5	Very low	33.7	Very low	82 Å²	82	130 Å²	130	57%	0.573	78%	0.776	S	S	*	*				45.3	138.3	124.7	74.2	0	0	0	0	126	D67	D67-S69 PolarHBondContact OD1-N 3.41Å; D67-S69 PolarHBondContact OD2-N 3.34Å
70	Q	31.4	Very low	33.7	Very low	176 Å²	176	129.5 Å²	129.5	82%	0.822	77%	0.773	S	S	*	*			trans	62.3	128.6	140.1	-68.1	178.1	20.4	0	0	123.8
71	Q	26	Very low	33.7	Very low	190 Å²	190	134.8 Å²	134.8	89%	0.888	78%	0.775	S	S	*	*				-176.7	154	107.7	-97.9	173.2	26.4	0	0	113.8
72	Q	29.5	Very low	32.7	Very low	178 Å²	178	138.7 Å²	138.7	83%	0.832	78%	0.781	S	S	*	*			trans	-113.7	156.8	164.1	-72.7	-172	-21.1	0	0	109.4
73	P	31.9	Very low	32.6	Very low	131 Å²	131	139.8 Å²	139.8	85%	0.851	79%	0.787	S	S	*	*				-145	176	102.1	35.6	-18.5	0	0	0	115.9
74	S	25	Very low	31.9	Very low	104 Å²	104	140.1 Å²	140.1	73%	0.727	79%	0.792	S	S	*	*			trans	-110.8	-165.6	179.3	61.1	0	0	0	0	110.1
75	P	45.3	Very low	32.4	Very low	112 Å²	112	139 Å²	139	73%	0.727	80%	0.796	S	S	*	*			cis	-145.7	-154.6	7.1	45.1	-23.4	0	0	0	116.5
76	S	25.8	Very low	30.9	Very low	99 Å²	99	136.9 Å²	136.9	69%	0.692	80%	0.795	S	S	*	*			trans	89.2	108.3	164.8	75.3	0	0	0	0	117
77	Q	31.6	Very low	30	Very low	201 Å²	201	141.3 Å²	141.3	94%	0.939	80%	0.797	S	S	*	*				87.8	132.6	75.3	-80.5	179.4	10.6	0	0	112.6
78	G	25	Very low	30.3	Very low	69 Å²	69	142 Å²	142	71%	0.711	81%	0.806	S	S	*	*			cis	-143.5	-162.6	-5.5	0	0	0	0	0	110.1
79	T	29.1	Very low	29.6	Very low	152 Å²	152	141.1 Å²	141.1	93%	0.933	80%	0.798	S	S	*	*			cis	-150.6	152.4	9.9	-65	0	0	0	0	109.1
80	S	28.1	Very low	30.2	Very low	100 Å²	100	143.3 Å²	143.3	70%	0.699	81%	0.813	S	S	*	*			trans	-115.3	151.1	-167.3	172.9	0	0	0	0	114.4
81	R	30.8	Very low	30.1	Very low	227 Å²	227	142 Å²	142	86%	0.857	81%	0.807	S	S	*	*			trans	169.3	143.3	135.5	-90.8	152.4	-173.1	-164.3	3.4	110.2
82	K	27.8	Very low	30.4	Very low	191 Å²	191	141.5 Å²	141.5	83%	0.83	81%	0.805	S	S	*	*			cis	-156.6	125.2	-1.9	-141.2	172.6	-174.9	-170.5	0	109.7
83	L	29.5	Very low	30.8	Very low	180 Å²	180	138.1 Å²	138.1	94%	0.942	80%	0.801	S	S	*	*			trans	-109.7	131.4	162.2	-95.3	159	0	0	0	107.7	S85	L83-S85 PolarHBondContact O-N 3.38Å
84	S	26.5	Very low	31.7	Very low	124 Å²	124	139 Å²	139	87%	0.867	79%	0.794	S	S	*	*			trans	-93.3	88	-179.8	51.1	0	0	0	0	111
85	S	33.6	Very low	33.5	Very low	123 Å²	123	136.2 Å²	136.2	86%	0.86	78%	0.782	S	S	*	*			trans	-71.8	138.3	158.7	177.6	0	0	0	0	109.5	L83	L83-S85 PolarHBondContact O-N 3.38Å
86	G	25.5	Very low	35.5	Very low	73 Å²	73	132.2 Å²	132.2	75%	0.753	75%	0.754	S	S	*	*			trans	-128	76.3	-176.9	0	0	0	0	0	112.1
87	R	26.9	Very low	38.6	Very low	214 Å²	214	129.6 Å²	129.6	81%	0.808	74%	0.735	S	S	*	*			trans	48	113.2	165.9	-76.6	179.2	167.4	168.3	-4.7	118	T89	R87-T89 HydrophobicContact CB-CG2 4.42Å; R87-T89 PolarHBondContact O-N 3.11Å
88	V	38.1	Very low	41.3	Very low	149 Å²	149	120.5 Å²	120.5	90%	0.903	69%	0.694	S	S	*	*			trans	-65.4	117.6	133.8	176.8	0	0	0	0	107.2
89	T	27.3	Very low	44.3	Very low	89 Å²	89	122.8 Å²	122.8	55%	0.546	69%	0.685	S	S	.	*			trans	-117.1	150.6	156.5	29	0	0	0	0	107.2	R87 E91	R87-T89 HydrophobicContact CB-CG2 4.42Å; R87-T89 PolarHBondContact O-N 3.11Å; T89-E91 PolarHBondContact O-N 3.41Å; T89-E91 VanDerWaalsContact O-N 3.11Å
90	S	38.4	Very low	47.2	Very low	128 Å²	128	119.4 Å²	119.4	90%	0.895	66%	0.661	S	S	*	*			trans	-59.3	116.7	-179.5	-47.8	0	0	0	0	110.4
91	E	30.4	Very low	50.2	Low	147 Å²	147	114.6 Å²	114.6	69%	0.687	63%	0.628	S	S	*	*			trans	-114.6	140.7	163.8	-69.2	-171.8	125.5	0	0	108.2	T89 Q94	T89-E91 PolarHBondContact O-N 3.41Å; T89-E91 VanDerWaalsContact O-N 3.11Å; E91-Q94 PolarHBondContact OE1-NE2 3.33Å
92	E	32.8	Very low	53.1	Low	181 Å²	181	106 Å²	106	85%	0.846	60%	0.596	S	S	*	*			trans	-71.5	175.2	175.7	-66.5	156.4	139.1	0	0	109.8	Q94	E92-Q94 VanDerWaalsContact C-N 3.29Å; E92-Q94 PolarHBondContact O-N 2.76Å
93	S	36.6	Very low	56	Low	107 Å²	107	100.2 Å²	100.2	75%	0.748	57%	0.574	S	S	*	*			trans	-67.9	81.9	-178.3	52.6	0	0	0	0	112.3	G95	S93-G95 PolarHBondContact O-N 3.23Å
94	Q	51	Low	58.8	Low	149 Å²	149	92.1 Å²	92.1	70%	0.696	53%	0.532	S	S	*	.			trans	-65.3	113.5	167.9	-66.7	-179.8	18.4	0	0	108.5	E91 E92	E91-Q94 PolarHBondContact OE1-NE2 3.33Å; E92-Q94 VanDerWaalsContact C-N 3.29Å; E92-Q94 PolarHBondContact O-N 2.76Å
95	G	64.1	Low	61.8	Low	46 Å²	46	86.3 Å²	86.3	47%	0.474	49%	0.492	S	S	.	.	P	Polyproline II helix	trans	-68	159.1	173.1	0	0	0	0	0	111.7	S93 S97	S93-G95 PolarHBondContact O-N 3.23Å; G95-S97 PolarHBondContact O-N 3Å
96	I	86.1	Confident	64.3	Low	27 Å²	27	81 Å²	81	14%	0.138	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-58	127.8	177.7	-171.4	174	0	0	0	110.8	D100 I101 V115 E118 W119	I96-D100 HydrophobicContact CG1-CB 3.84Å; I96-I101 HydrophobicContact CD1-CG1 3.85Å; I96-I101 HydrophobicContact CG1-CG1 4.07Å; I96-V115 HydrophobicContact CD1-CG1 3.97Å; I96-E118 HydrophobicContact CD1-CB 4.39Å; I96-W119 HydrophobicContact CG2-CB 3.85Å
97	S	90.6	Very high	67.1	Low	44 Å²	44	79.9 Å²	79.9	31%	0.308	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-88	161.2	-177.8	82.5	0	0	0	0	112.3	G95 K99 D100 I101	G95-S97 PolarHBondContact O-N 3Å; S97-K99 PolarHBondContact O-N 2.7Å; S97-K99 VanDerWaalsContact O-N 3.12Å; S97-K99 PolarHBondContact OG-N 2.86Å; S97-D100 WeakPolarHBondContact CA-OD2 3.43Å; S97-D100 WeakPolarHBondContact CB-OD2 3.43Å; S97-D100 PolarHBondContact N-OD2 3.35Å; S97-D100 PolarHBondContact O-N 3.41Å; S97-D100 VanDerWaalsContact OG-CG 3.27Å; S97-D100 PolarHBondContact OG-N 3.4Å; S97-D100 PolarHBondContact OG-OD2 2.98Å; S97-I101 PolarHBondContact O-N 3.15Å
98	A	88.8	Confident	69.4	Low	10 Å²	10	72.4 Å²	72.4	8%	0.083	42%	0.424	C	S	.	.	H	α-helix	trans	-52.7	-34.8	173.9	0	0	0	0	0	112.7	Y102 V133 N136 F137	A98-Y102 PolarHBondContact O-N 3.04Å; A98-Y102 VanDerWaalsContact O-N 3.09Å; A98-V133 WeakPolarHBondContact CB-O 3.41Å; A98-N136 HydrophobicContact CB-CB 3.7Å; A98-F137 HydrophobicContact CB-CB 4.22Å
99	K	88.4	Confident	71.2	Confident	118 Å²	118	74.2 Å²	74.2	51%	0.513	42%	0.42	S	S	.	.	H	α-helix	trans	-72.6	-37.8	179.2	-170.1	-166.5	170	-145.5	0	111.9	S97 I101 Y102 D103	S97-K99 PolarHBondContact O-N 2.7Å; S97-K99 VanDerWaalsContact O-N 3.12Å; S97-K99 PolarHBondContact OG-N 2.86Å; K99-I101 VanDerWaalsContact C-N 3.32Å; K99-I101 PolarHBondContact O-N 2.72Å; K99-Y102 PolarHBondContact O-N 3.23Å; K99-D103 WeakPolarHBondContact CE-OD2 3.43Å; K99-D103 IonicContact NZ-OD2 3.4Å; K99-D103 WeakPolarHBondContact O-CB 3.46Å; K99-D103 PolarHBondContact O-N 2.98Å
100	D	90.3	Very high	73.7	Confident	80 Å²	80	73 Å²	73	43%	0.428	42%	0.416	S	S	.	.	H	α-helix	trans	-66.8	-38	179.4	-55.5	-55.6	0	0	0	111	I96 S97 A104	I96-D100 HydrophobicContact CG1-CB 3.84Å; S97-D100 WeakPolarHBondContact CA-OD2 3.43Å; S97-D100 WeakPolarHBondContact CB-OD2 3.43Å; S97-D100 PolarHBondContact N-OD2 3.35Å; S97-D100 PolarHBondContact O-N 3.41Å; S97-D100 VanDerWaalsContact OG-CG 3.27Å; S97-D100 PolarHBondContact OG-N 3.4Å; S97-D100 PolarHBondContact OG-OD2 2.98Å; D100-A104 WeakPolarHBondContact O-CB 3.39Å; D100-A104 PolarHBondContact O-N 3.42Å
101	I	91.1	Very high	75.9	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-62.2	-46.9	170.8	-55.1	172.3	0	0	0	109.9	I96 S97 K99 A104 V105 V115 W119 V133 F137 F195	I96-I101 HydrophobicContact CD1-CG1 3.85Å; I96-I101 HydrophobicContact CG1-CG1 4.07Å; S97-I101 PolarHBondContact O-N 3.15Å; K99-I101 VanDerWaalsContact C-N 3.32Å; K99-I101 PolarHBondContact O-N 2.72Å; I101-A104 PolarHBondContact O-N 3.32Å; I101-V105 HydrophobicContact CG2-CG2 4.47Å; I101-V105 VanDerWaalsContact O-CG2 3.25Å; I101-V105 WeakPolarHBondContact O-CG2 3.36Å; I101-V105 PolarHBondContact O-N 3.13Å; I101-V115 HydrophobicContact CB-CG1 4.45Å; I101-V115 HydrophobicContact CG1-CG1 4.18Å; I101-V115 HydrophobicContact CG2-CG1 4.2Å; I101-W119 HydrophobicContact CD1-CB 4.43Å; I101-W119 HydrophobicContact CD1-CG 4.24Å; I101-V133 HydrophobicContact CD1-CG1 3.85Å; I101-F137 HydrophobicContact CB-CD2 3.86Å; I101-F137 HydrophobicContact CB-CE2 4.3Å; I101-F137 HydrophobicContact CB-CG 4.25Å; I101-F137 HydrophobicContact CG2-CD1 4.18Å; I101-F137 HydrophobicContact CG2-CD2 3.54Å; I101-F137 HydrophobicContact CG2-CE1 4.2Å; I101-F137 HydrophobicContact CG2-CE2 3.58Å; I101-F137 HydrophobicContact CG2-CG 3.85Å; I101-F137 HydrophobicContact CG2-CZ 3.91Å; I101-F195 HydrophobicContact CG2-CD2 4.2Å; I101-F195 HydrophobicContact CG2-CE2 3.68Å; I101-F195 HydrophobicContact CG2-CZ 3.99Å
102	Y	90.6	Very high	78.7	Confident	46 Å²	46	64.1 Å²	64.1	18%	0.18	37%	0.371	C	S	.	.	H	α-helix	trans	-61.3	-46.8	177.8	-175.9	-90	0	0	0	113	A98 K99 A104 V105 C106 Q140 F188	A98-Y102 PolarHBondContact O-N 3.04Å; A98-Y102 VanDerWaalsContact O-N 3.09Å; K99-Y102 PolarHBondContact O-N 3.23Å; Y102-A104 VanDerWaalsContact C-N 3.34Å; Y102-A104 PolarHBondContact O-N 3.1Å; Y102-V105 PolarHBondContact O-N 3.04Å; Y102-C106 WeakPolarHBondContact CE1-SG 3.32Å; Y102-C106 VanDerWaalsContact CZ-SG 3.57Å; Y102-C106 VanDerWaalsContact O-CB 3.29Å; Y102-C106 WeakPolarHBondContact O-CB 3.47Å; Y102-C106 PolarHBondContact O-N 3.25Å; Y102-Q140 HydrophobicContact CD2-CB 4.13Å; Y102-F188 AromaticContact CD2-CE2 3.89Å; Y102-F188 HydrophobicContact CD2-CE2 3.89Å; Y102-F188 HydrophobicContact CD2-CZ 4.26Å; Y102-F188 AromaticContact CE2-CE2 3.6Å; Y102-F188 HydrophobicContact CE2-CE2 3.6Å; Y102-F188 AromaticContact CE2-CZ 3.78Å; Y102-F188 HydrophobicContact CE2-CZ 3.78Å
103	D	89.4	Confident	81.5	Confident	70 Å²	70	58.8 Å²	58.8	37%	0.374	35%	0.35	S	S	.	.	H	α-helix	trans	-68.5	-31.7	178.7	-79.1	-20.7	0	0	0	111.5	K99 S107	K99-D103 WeakPolarHBondContact CE-OD2 3.43Å; K99-D103 IonicContact NZ-OD2 3.4Å; K99-D103 WeakPolarHBondContact O-CB 3.46Å; K99-D103 PolarHBondContact O-N 2.98Å; D103-S107 WeakPolarHBondContact O-CB 3.38Å; D103-S107 PolarHBondContact O-N 3.48Å; D103-S107 PolarHBondContact O-OG 3.46Å
104	A	89.1	Confident	84	Confident	9 Å²	9	56.6 Å²	56.6	7%	0.074	33%	0.333	C	S	.	.	H	α-helix	trans	-65.4	-49.4	170.4	0	0	0	0	0	112	D100 I101 Y102 C106 S107 G108 V115	D100-A104 WeakPolarHBondContact O-CB 3.39Å; D100-A104 PolarHBondContact O-N 3.42Å; I101-A104 PolarHBondContact O-N 3.32Å; Y102-A104 VanDerWaalsContact C-N 3.34Å; Y102-A104 PolarHBondContact O-N 3.1Å; A104-C106 PolarHBondContact O-N 3.03Å; A104-S107 PolarHBondContact O-N 3.28Å; A104-S107 PolarHBondContact O-OG 3.17Å; A104-G108 PolarHBondContact O-N 2.93Å; A104-V115 HydrophobicContact CB-CG1 4.46Å; A104-V115 HydrophobicContact CB-CG2 3.91Å
105	V	88.9	Confident	86	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.018	30%	0.301	C	S	.	.	H	α-helix	trans	-64.6	-38	178.1	176.3	0	0	0	0	111.6	I101 Y102 M112 F137 F188 L192	I101-V105 HydrophobicContact CG2-CG2 4.47Å; I101-V105 VanDerWaalsContact O-CG2 3.25Å; I101-V105 WeakPolarHBondContact O-CG2 3.36Å; I101-V105 PolarHBondContact O-N 3.13Å; Y102-V105 PolarHBondContact O-N 3.04Å; V105-M112 HydrophobicContact CB-CE 4.47Å; V105-M112 HydrophobicContact CG2-CE 3.83Å; V105-M112 HydrophobicContact CG2-SD 3.97Å; V105-F137 HydrophobicContact CG2-CE2 4.1Å; V105-F137 HydrophobicContact CG2-CZ 4.06Å; V105-F188 HydrophobicContact CB-CD2 4.38Å; V105-F188 HydrophobicContact CB-CE2 4.37Å; V105-F188 HydrophobicContact CG1-CD2 3.64Å; V105-F188 HydrophobicContact CG1-CE2 3.77Å; V105-L192 HydrophobicContact CG1-CB 4.37Å
106	C	85.9	Confident	87.3	Confident	10 Å²	10	47.6 Å²	47.6	7%	0.068	28%	0.279	C	S	.	.	H	α-helix	trans	-69.9	-37	175	-84.9	0	0	0	0	113.8	Y102 A104 F188	Y102-C106 WeakPolarHBondContact CE1-SG 3.32Å; Y102-C106 VanDerWaalsContact CZ-SG 3.57Å; Y102-C106 VanDerWaalsContact O-CB 3.29Å; Y102-C106 WeakPolarHBondContact O-CB 3.47Å; Y102-C106 PolarHBondContact O-N 3.25Å; A104-C106 PolarHBondContact O-N 3.03Å; C106-F188 HydrophobicContact CB-CD2 4.46Å; C106-F188 WeakPolarHBondContact SG-CD2 3.49Å
107	S	83.4	Confident	87.6	Confident	51 Å²	51	51.2 Å²	51.2	36%	0.357	30%	0.295	S	S	.	.	H	α-helix	trans	-86.6	-31.4	-174.4	66.7	0	0	0	0	113.6	D103 A104 K109	D103-S107 WeakPolarHBondContact O-CB 3.38Å; D103-S107 PolarHBondContact O-N 3.48Å; D103-S107 PolarHBondContact O-OG 3.46Å; A104-S107 PolarHBondContact O-N 3.28Å; A104-S107 PolarHBondContact O-OG 3.17Å; S107-K109 PolarHBondContact O-N 3.04Å
108	G	75.6	Confident	87.7	Confident	56 Å²	56	54.1 Å²	54.1	58%	0.577	30%	0.304	S	S	*	.			trans	63.2	21.4	-176.5	0	0	0	0	0	114.1	A104	A104-G108 PolarHBondContact O-N 2.93Å
109	K	77.3	Confident	87.9	Confident	187 Å²	187	53.6 Å²	53.6	81%	0.813	30%	0.3	S	S	*	.			trans	-94.9	-28.8	-178.5	-66.7	179.8	-177.8	175.8	0	113.5	S107	S107-K109 PolarHBondContact O-N 3.04Å
110	S	79.1	Confident	88.1	Confident	64 Å²	64	48.4 Å²	48.4	45%	0.448	28%	0.277	S	S	.	.	S	Bend	trans	-85.3	147.1	177.7	-53.2	0	0	0	0	110.7	M112	S110-M112 PolarHBondContact O-N 3.37Å
111	A	85.4	Confident	88	Confident	62 Å²	62	48 Å²	48	51%	0.512	28%	0.28	S	S	.	.			trans	-70.4	118.8	170.2	0	0	0	0	0	109.3	V113 T114 V115	A111-V113 PolarHBondContact O-N 3.21Å; A111-T114 WeakPolarHBondContact O-CB 3.38Å; A111-T114 PolarHBondContact O-N 2.62Å; A111-V115 PolarHBondContact O-N 2.94Å
112	M	89.3	Confident	87.9	Confident	27 Å²	27	49 Å²	49	13%	0.133	29%	0.287	C	S	.	.	H	α-helix	trans	-61	-29.8	-173.7	-163.1	68.3	75	0	0	113.1	V105 S110 V115 V116 G191 E194 F195 I198	V105-M112 HydrophobicContact CB-CE 4.47Å; V105-M112 HydrophobicContact CG2-CE 3.83Å; V105-M112 HydrophobicContact CG2-SD 3.97Å; S110-M112 PolarHBondContact O-N 3.37Å; M112-V115 PolarHBondContact O-N 3.35Å; M112-V116 WeakPolarHBondContact O-CG2 3.5Å; M112-V116 PolarHBondContact O-N 3.22Å; M112-V116 VanDerWaalsContact O-N 3.08Å; M112-G191 WeakPolarHBondContact CE-O 3.48Å; M112-E194 HydrophobicContact CG-CG 4.49Å; M112-F195 HydrophobicContact CG-CB 4.21Å; M112-F195 HydrophobicContact CG-CD2 4.47Å; M112-F195 HydrophobicContact SD-CB 3.9Å; M112-F195 HydrophobicContact SD-CD2 3.89Å; M112-F195 HydrophobicContact SD-CG 4.4Å; M112-I198 HydrophobicContact CB-CD1 3.67Å; M112-I198 HydrophobicContact CG-CD1 3.84Å
113	V	90.4	Very high	87.9	Confident	68 Å²	68	47 Å²	47	41%	0.412	28%	0.279	S	S	.	.	H	α-helix	trans	-57.9	-48.3	171.9	-179.1	0	0	0	0	111.1	A111 V115 V116 E117 I198	A111-V113 PolarHBondContact O-N 3.21Å; V113-V115 PolarHBondContact O-N 3.47Å; V113-V116 PolarHBondContact O-N 2.95Å; V113-E117 HydrophobicContact CG1-CG 4.31Å; V113-E117 WeakPolarHBondContact O-CB 3.36Å; V113-E117 WeakPolarHBondContact O-CG 3.46Å; V113-E117 PolarHBondContact O-N 3.25Å; V113-I198 HydrophobicContact CG2-CD1 3.99Å; V113-I198 HydrophobicContact CG2-CG2 4.26Å
114	T	90.5	Very high	87.8	Confident	62 Å²	62	50.2 Å²	50.2	38%	0.38	29%	0.29	S	S	.	.	H	α-helix	trans	-64	-40.8	179.9	-50.3	0	0	0	0	111.9	A111 V116 E117 E118	A111-T114 WeakPolarHBondContact O-CB 3.38Å; A111-T114 PolarHBondContact O-N 2.62Å; T114-V116 VanDerWaalsContact C-N 3.31Å; T114-V116 PolarHBondContact O-N 3.44Å; T114-E117 PolarHBondContact O-N 3.49Å; T114-E118 HydrophobicContact CG2-CG 4.38Å; T114-E118 WeakPolarHBondContact O-CB 3.19Å; T114-E118 VanDerWaalsContact O-CG 3.32Å; T114-E118 WeakPolarHBondContact O-CG 3.34Å; T114-E118 PolarHBondContact O-N 2.99Å
115	V	91.8	Very high	87.9	Confident	6 Å²	6	56.6 Å²	56.6	4%	0.036	32%	0.318	C	S	.	.	H	α-helix	trans	-60.6	-41.7	175.8	-179.6	0	0	0	0	111.3	I96 I101 A104 A111 M112 V113 W119 F195	I96-V115 HydrophobicContact CD1-CG1 3.97Å; I101-V115 HydrophobicContact CB-CG1 4.45Å; I101-V115 HydrophobicContact CG1-CG1 4.18Å; I101-V115 HydrophobicContact CG2-CG1 4.2Å; A104-V115 HydrophobicContact CB-CG1 4.46Å; A104-V115 HydrophobicContact CB-CG2 3.91Å; A111-V115 PolarHBondContact O-N 2.94Å; M112-V115 PolarHBondContact O-N 3.35Å; V113-V115 PolarHBondContact O-N 3.47Å; V115-W119 WeakPolarHBondContact O-CB 3.24Å; V115-W119 PolarHBondContact O-N 3.44Å; V115-W119 VanDerWaalsContact O-N 3.1Å; V115-F195 HydrophobicContact CG1-CE2 4.43Å
116	V	92.6	Very high	87.9	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-69.7	-40.3	175.3	169.9	0	0	0	0	111.5	M112 V113 T114 W119 L120 F195 I198 L199	M112-V116 WeakPolarHBondContact O-CG2 3.5Å; M112-V116 PolarHBondContact O-N 3.22Å; M112-V116 VanDerWaalsContact O-N 3.08Å; V113-V116 PolarHBondContact O-N 2.95Å; T114-V116 VanDerWaalsContact C-N 3.31Å; T114-V116 PolarHBondContact O-N 3.44Å; V116-W119 PolarHBondContact O-N 3.45Å; V116-L120 HydrophobicContact CG1-CD1 3.75Å; V116-L120 HydrophobicContact CG1-CG 4.22Å; V116-L120 VanDerWaalsContact O-CB 3.28Å; V116-L120 WeakPolarHBondContact O-CB 3.41Å; V116-L120 WeakPolarHBondContact O-CG 3.22Å; V116-L120 PolarHBondContact O-N 3.32Å; V116-F195 HydrophobicContact CG2-CD2 3.69Å; V116-F195 HydrophobicContact CG2-CE2 3.64Å; V116-F195 HydrophobicContact CG2-CZ 4.44Å; V116-I198 HydrophobicContact CB-CG2 3.91Å; V116-I198 HydrophobicContact CG1-CG2 4.08Å; V116-I198 HydrophobicContact CG2-CB 4.33Å; V116-I198 HydrophobicContact CG2-CG2 3.81Å; V116-L199 HydrophobicContact CG1-CD1 4.41Å
117	E	91.6	Very high	88.1	Confident	102 Å²	102	64.2 Å²	64.2	48%	0.477	35%	0.352	S	S	.	.	H	α-helix	trans	-65.8	-41.1	177.5	-74.4	175.5	150.9	0	0	112.6	V113 T114 L120 C121	V113-E117 HydrophobicContact CG1-CG 4.31Å; V113-E117 WeakPolarHBondContact O-CB 3.36Å; V113-E117 WeakPolarHBondContact O-CG 3.46Å; V113-E117 PolarHBondContact O-N 3.25Å; T114-E117 PolarHBondContact O-N 3.49Å; E117-L120 PolarHBondContact O-N 3.02Å; E117-C121 WeakPolarHBondContact O-CB 3.42Å; E117-C121 PolarHBondContact O-N 3.36Å; E117-C121 PolarHBondContact O-SG 3.12Å
118	E	91.5	Very high	88.4	Confident	105 Å²	105	66 Å²	66	49%	0.491	36%	0.355	S	S	.	.	H	α-helix	trans	-63.5	-45.6	174.1	-73.9	170.8	175.8	0	0	111.3	I96 T114 C121 S122	I96-E118 HydrophobicContact CD1-CB 4.39Å; T114-E118 HydrophobicContact CG2-CG 4.38Å; T114-E118 WeakPolarHBondContact O-CB 3.19Å; T114-E118 VanDerWaalsContact O-CG 3.32Å; T114-E118 WeakPolarHBondContact O-CG 3.34Å; T114-E118 PolarHBondContact O-N 2.99Å; E118-C121 WeakPolarHBondContact O-CB 3.49Å; E118-C121 PolarHBondContact O-N 2.82Å; E118-S122 PolarHBondContact O-N 3.23Å; E118-S122 VanDerWaalsContact O-N 3.1Å
119	W	94.1	Very high	89	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-64	-41.3	174.8	177	81.8	0	0	0	112.2	I96 I101 V115 V116 C121 S122 Y123 G130 L134 L199 L213	I96-W119 HydrophobicContact CG2-CB 3.85Å; I101-W119 HydrophobicContact CD1-CB 4.43Å; I101-W119 HydrophobicContact CD1-CG 4.24Å; V115-W119 WeakPolarHBondContact O-CB 3.24Å; V115-W119 PolarHBondContact O-N 3.44Å; V115-W119 VanDerWaalsContact O-N 3.1Å; V116-W119 PolarHBondContact O-N 3.45Å; W119-C121 VanDerWaalsContact C-N 3.29Å; W119-C121 PolarHBondContact O-N 3.4Å; W119-S122 WeakPolarHBondContact O-CA 3.42Å; W119-S122 WeakPolarHBondContact O-CB 3.41Å; W119-S122 PolarHBondContact O-N 2.82Å; W119-Y123 HydrophobicContact CH2-CD2 4.15Å; W119-Y123 HydrophobicContact CH2-CG 4.08Å; W119-Y123 HydrophobicContact CZ2-CD2 4.22Å; W119-Y123 HydrophobicContact CZ2-CG 4.38Å; W119-Y123 PolarHBondContact O-N 2.56Å; W119-G130 WeakPolarHBondContact CZ2-O 3.46Å; W119-G130 PolarHBondContact NE1-O 2.97Å; W119-L134 HydrophobicContact CH2-CD2 4.12Å; W119-L134 HydrophobicContact CZ2-CB 3.87Å; W119-L134 HydrophobicContact CZ2-CD2 3.9Å; W119-L134 HydrophobicContact CZ2-CG 4.4Å; W119-L199 HydrophobicContact CE3-CD1 3.95Å; W119-L199 HydrophobicContact CH2-CD1 4.29Å; W119-L199 HydrophobicContact CZ3-CD1 3.44Å; W119-L199 VanDerWaalsContact CZ3-CD1 3.44Å; W119-L213 HydrophobicContact CH2-CD1 3.74Å; W119-L213 HydrophobicContact CH2-CD2 3.95Å; W119-L213 HydrophobicContact CZ2-CD1 4.39Å; W119-L213 HydrophobicContact CZ3-CD2 4.31Å
120	L	91.8	Very high	89.6	Confident	9 Å²	9	58.4 Å²	58.4	5%	0.047	31%	0.307	C	S	.	.	H	α-helix	trans	-64.2	-32.4	175	-76.5	171.5	0	0	0	112.7	V116 E117 S122 K124 L199 L207	V116-L120 HydrophobicContact CG1-CD1 3.75Å; V116-L120 HydrophobicContact CG1-CG 4.22Å; V116-L120 VanDerWaalsContact O-CB 3.28Å; V116-L120 WeakPolarHBondContact O-CB 3.41Å; V116-L120 WeakPolarHBondContact O-CG 3.22Å; V116-L120 PolarHBondContact O-N 3.32Å; E117-L120 PolarHBondContact O-N 3.02Å; L120-S122 VanDerWaalsContact C-N 3.34Å; L120-K124 WeakPolarHBondContact O-CB 3.19Å; L120-K124 WeakPolarHBondContact O-CD 3.23Å; L120-K124 WeakPolarHBondContact O-CG 3.31Å; L120-K124 PolarHBondContact O-N 3.12Å; L120-L199 HydrophobicContact CD2-CD1 4.5Å; L120-L207 HydrophobicContact CD2-CD1 3.81Å
121	C	89.3	Confident	90.2	Very high	71 Å²	71	55.4 Å²	55.4	48%	0.48	29%	0.286	S	S	.	.	H	α-helix	trans	-67.9	-33.5	171.3	-75	0	0	0	0	112.2	E117 E118 W119 Q125	E117-C121 WeakPolarHBondContact O-CB 3.42Å; E117-C121 PolarHBondContact O-N 3.36Å; E117-C121 PolarHBondContact O-SG 3.12Å; E118-C121 WeakPolarHBondContact O-CB 3.49Å; E118-C121 PolarHBondContact O-N 2.82Å; W119-C121 VanDerWaalsContact C-N 3.29Å; W119-C121 PolarHBondContact O-N 3.4Å; C121-Q125 WeakPolarHBondContact O-CG 3.18Å; C121-Q125 PolarHBondContact O-N 2.59Å; C121-Q125 PolarHBondContact O-NE2 2.83Å
122	S	88.8	Confident	90.5	Very high	22 Å²	22	52.8 Å²	52.8	15%	0.154	26%	0.264	C	S	.	.	H	α-helix	trans	-70.8	-46.3	172.7	-157.4	0	0	0	0	111.7	E118 W119 L120 K124 Q125 S126	E118-S122 PolarHBondContact O-N 3.23Å; E118-S122 VanDerWaalsContact O-N 3.1Å; W119-S122 WeakPolarHBondContact O-CA 3.42Å; W119-S122 WeakPolarHBondContact O-CB 3.41Å; W119-S122 PolarHBondContact O-N 2.82Å; L120-S122 VanDerWaalsContact C-N 3.34Å; S122-K124 VanDerWaalsContact C-N 3.28Å; S122-K124 PolarHBondContact O-N 3.5Å; S122-Q125 WeakPolarHBondContact O-CB 3.4Å; S122-Q125 PolarHBondContact O-N 3.44Å; S122-S126 PolarHBondContact O-N 3.39Å
123	Y	90.1	Very high	90.8	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.008	26%	0.263	C	S	.	.	H	α-helix	trans	-59.6	-35.4	176.3	177.4	-99.5	0	0	0	112.8	W119 Q125 S126 R127 L207 D210 F212 L213	W119-Y123 HydrophobicContact CH2-CD2 4.15Å; W119-Y123 HydrophobicContact CH2-CG 4.08Å; W119-Y123 HydrophobicContact CZ2-CD2 4.22Å; W119-Y123 HydrophobicContact CZ2-CG 4.38Å; W119-Y123 PolarHBondContact O-N 2.56Å; Y123-Q125 VanDerWaalsContact C-N 3.28Å; Y123-Q125 PolarHBondContact O-N 3.4Å; Y123-S126 CarbonylContact O-C 3.53Å; Y123-R127 HydrophobicContact CD2-CB 4.33Å; Y123-R127 VanDerWaalsContact CD2-O 3.24Å; Y123-R127 WeakPolarHBondContact CD2-O 3.35Å; Y123-R127 HydrophobicContact CE1-CG 4.35Å; Y123-R127 VanDerWaalsContact CE2-CA 3.49Å; Y123-R127 HydrophobicContact CE2-CB 3.68Å; Y123-R127 HydrophobicContact CE2-CG 4.11Å; Y123-R127 VanDerWaalsContact CE2-O 3.23Å; Y123-R127 WeakPolarHBondContact CE2-O 3.5Å; Y123-R127 WeakPolarHBondContact O-CA 3.28Å; Y123-R127 PolarHBondContact O-N 3.46Å; Y123-L207 HydrophobicContact CD1-CD1 4Å; Y123-L207 HydrophobicContact CE1-CD1 4.09Å; Y123-L207 HydrophobicContact CE1-CD2 4.17Å; Y123-D210 PolarHBondContact OH-OD2 2.92Å; Y123-F212 HydrophobicContact CE2-CD1 4.32Å; Y123-F212 WeakPolarHBondContact OH-CD1 3.4Å; Y123-L213 HydrophobicContact CE1-CB 4.47Å; Y123-L213 HydrophobicContact CE1-CD2 4.26Å; Y123-L213 HydrophobicContact CE2-CB 4.37Å; Y123-L213 HydrophobicContact CE2-CD1 4.19Å
124	K	88.3	Confident	90.9	Very high	138 Å²	138	49.4 Å²	49.4	60%	0.6	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71	-18	174	-74	167.4	-173.5	172.7	0	114.2	L120 S122	L120-K124 WeakPolarHBondContact O-CB 3.19Å; L120-K124 WeakPolarHBondContact O-CD 3.23Å; L120-K124 WeakPolarHBondContact O-CG 3.31Å; L120-K124 PolarHBondContact O-N 3.12Å; S122-K124 VanDerWaalsContact C-N 3.28Å; S122-K124 PolarHBondContact O-N 3.5Å
125	Q	89.8	Confident	91.1	Very high	143 Å²	143	46.9 Å²	46.9	67%	0.668	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-41	173	-69.4	167.7	56.1	0	0	111.4	C121 S122 Y123	C121-Q125 WeakPolarHBondContact O-CG 3.18Å; C121-Q125 PolarHBondContact O-N 2.59Å; C121-Q125 PolarHBondContact O-NE2 2.83Å; S122-Q125 WeakPolarHBondContact O-CB 3.4Å; S122-Q125 PolarHBondContact O-N 3.44Å; Y123-Q125 VanDerWaalsContact C-N 3.28Å; Y123-Q125 PolarHBondContact O-N 3.4Å
126	S	89.7	Confident	91.1	Very high	46 Å²	46	47.3 Å²	47.3	32%	0.322	23%	0.23	S	C	.	.			trans	-146.6	115.5	171.2	177.5	0	0	0	0	110.2	S122 Y123 E129 G130	S122-S126 PolarHBondContact O-N 3.39Å; Y123-S126 CarbonylContact O-C 3.53Å; S126-E129 WeakPolarHBondContact OG-CB 3.07Å; S126-E129 PolarHBondContact OG-N 3.27Å; S126-G130 PolarHBondContact O-N 2.85Å
127	R	89.8	Confident	91.2	Very high	128 Å²	128	47.3 Å²	47.3	48%	0.483	23%	0.231	S	C	.	.	H	α-helix	trans	-62.6	-49.5	-176.9	-65	-172.3	-175.6	-161.8	1.1	111.6	Y123 G130 L131 D210 F212	Y123-R127 HydrophobicContact CD2-CB 4.33Å; Y123-R127 VanDerWaalsContact CD2-O 3.24Å; Y123-R127 WeakPolarHBondContact CD2-O 3.35Å; Y123-R127 HydrophobicContact CE1-CG 4.35Å; Y123-R127 VanDerWaalsContact CE2-CA 3.49Å; Y123-R127 HydrophobicContact CE2-CB 3.68Å; Y123-R127 HydrophobicContact CE2-CG 4.11Å; Y123-R127 VanDerWaalsContact CE2-O 3.23Å; Y123-R127 WeakPolarHBondContact CE2-O 3.5Å; Y123-R127 WeakPolarHBondContact O-CA 3.28Å; Y123-R127 PolarHBondContact O-N 3.46Å; R127-G130 PolarHBondContact O-N 3.41Å; R127-L131 VanDerWaalsContact O-CB 3.31Å; R127-L131 WeakPolarHBondContact O-CB 3.4Å; R127-L131 PolarHBondContact O-N 3.21Å; R127-D210 PolarHBondContact NH1-O 3.1Å; R127-F212 HydrophobicContact CB-CD1 4.12Å; R127-F212 HydrophobicContact CB-CE1 3.88Å
128	E	89.8	Confident	91.3	Very high	88 Å²	88	42.7 Å²	42.7	41%	0.411	21%	0.209	S	C	.	.	H	α-helix	trans	-65.6	-41.6	-176.8	-60.9	164.1	173.7	0	0	111.2	L131 L132 R150 Y153 F212	E128-L131 PolarHBondContact O-N 3.4Å; E128-L132 WeakPolarHBondContact O-CB 3.47Å; E128-L132 PolarHBondContact O-N 3.38Å; E128-R150 VanDerWaalsContact CB-NH1 3.35Å; E128-R150 IonicContact OE2-CZ 3.5Å; E128-R150 IonicContact OE2-NH1 3.41Å; E128-R150 PolarHBondContact OE2-NH1 2.95Å; E128-R150 IonicContact OE2-NH2 2.7Å; E128-R150 PolarHBondContact OE2-NH2 2.9Å; E128-Y153 HydrophobicContact CB-CE1 4.1Å; E128-Y153 HydrophobicContact CG-CE1 4.41Å; E128-F212 HydrophobicContact CG-CZ 4.04Å
129	E	88.5	Confident	91.4	Very high	83 Å²	83	37.8 Å²	37.8	39%	0.388	19%	0.186	S	C	.	.	H	α-helix	trans	-71.9	-41	179.6	-161.1	61.1	-152.7	0	0	111.7	S126 L131 L132 V133 R150	S126-E129 WeakPolarHBondContact OG-CB 3.07Å; S126-E129 PolarHBondContact OG-N 3.27Å; E129-L131 VanDerWaalsContact C-N 3.31Å; E129-L131 PolarHBondContact O-N 3.46Å; E129-L132 PolarHBondContact O-N 3.41Å; E129-V133 WeakPolarHBondContact O-CG2 3.27Å; E129-V133 PolarHBondContact O-N 2.86Å; E129-R150 IonicContact OE2-NH1 2.72Å; E129-R150 PolarHBondContact OE2-NH1 3.35Å
130	G	90.1	Very high	91.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-60.3	-41	172.1	0	0	0	0	0	112.1	W119 S126 R127 V133 L134	W119-G130 WeakPolarHBondContact CZ2-O 3.46Å; W119-G130 PolarHBondContact NE1-O 2.97Å; S126-G130 PolarHBondContact O-N 2.85Å; R127-G130 PolarHBondContact O-N 3.41Å; G130-V133 PolarHBondContact O-N 3.12Å; G130-L134 PolarHBondContact O-N 2.84Å; G130-L134 VanDerWaalsContact O-N 3.12Å
131	L	91.3	Very high	91.2	Very high	1 Å²	1	39.7 Å²	39.7	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-66.8	-42.3	174.2	-179.4	54.6	0	0	0	111.6	R127 E128 E129 V133 L134 I135 Y153 F212 L213	R127-L131 VanDerWaalsContact O-CB 3.31Å; R127-L131 WeakPolarHBondContact O-CB 3.4Å; R127-L131 PolarHBondContact O-N 3.21Å; E128-L131 PolarHBondContact O-N 3.4Å; E129-L131 VanDerWaalsContact C-N 3.31Å; E129-L131 PolarHBondContact O-N 3.46Å; L131-V133 VanDerWaalsContact C-N 3.29Å; L131-V133 PolarHBondContact O-N 3.36Å; L131-L134 HydrophobicContact CD1-CD2 4.4Å; L131-L134 CarbonylContact O-C 3.17Å; L131-L134 WeakPolarHBondContact O-CA 3.41Å; L131-L134 WeakPolarHBondContact O-CB 3.3Å; L131-L134 PolarHBondContact O-N 2.84Å; L131-I135 HydrophobicContact CD1-CD1 4.36Å; L131-I135 HydrophobicContact CD1-CG1 4.18Å; L131-I135 HydrophobicContact CG-CD1 4.09Å; L131-I135 HydrophobicContact CG-CG1 4.37Å; L131-I135 VanDerWaalsContact O-CG1 3.29Å; L131-I135 WeakPolarHBondContact O-CG1 3.39Å; L131-I135 PolarHBondContact O-N 3.36Å; L131-Y153 HydrophobicContact CD2-CE2 4.45Å; L131-Y153 WeakPolarHBondContact CD2-OH 3.43Å; L131-F212 HydrophobicContact CD2-CD1 4.4Å; L131-F212 HydrophobicContact CD2-CE1 3.72Å; L131-F212 HydrophobicContact CD2-CZ 4.17Å; L131-L213 HydrophobicContact CD1-CD1 4.27Å
132	L	92.5	Very high	91.3	Very high	8 Å²	8	36.3 Å²	36.3	4%	0.042	17%	0.172	C	C	.	.	H	α-helix	trans	-61.7	-35.8	176.6	-174.1	58.7	0	0	0	112.7	E128 E129 N136 V148 R150 Y153	E128-L132 WeakPolarHBondContact O-CB 3.47Å; E128-L132 PolarHBondContact O-N 3.38Å; E129-L132 PolarHBondContact O-N 3.41Å; L132-N136 WeakPolarHBondContact O-CB 3.29Å; L132-N136 PolarHBondContact O-N 3.22Å; L132-N136 PolarHBondContact O-ND2 3.41Å; L132-V148 HydrophobicContact CD1-CB 4.09Å; L132-V148 HydrophobicContact CD1-CG1 3.85Å; L132-R150 HydrophobicContact CD2-CB 4.23Å; L132-Y153 HydrophobicContact CD1-CD2 4.4Å; L132-Y153 HydrophobicContact CD1-CG 4.28Å
133	V	93.8	Very high	91.3	Very high	21 Å²	21	36.1 Å²	36.1	13%	0.127	17%	0.173	C	C	.	.	H	α-helix	trans	-61.3	-45.9	169.2	163.2	0	0	0	0	111.4	A98 I101 E129 G130 L131 N136 F137	A98-V133 WeakPolarHBondContact CB-O 3.41Å; I101-V133 HydrophobicContact CD1-CG1 3.85Å; E129-V133 WeakPolarHBondContact O-CG2 3.27Å; E129-V133 PolarHBondContact O-N 2.86Å; G130-V133 PolarHBondContact O-N 3.12Å; L131-V133 VanDerWaalsContact C-N 3.29Å; L131-V133 PolarHBondContact O-N 3.36Å; V133-N136 PolarHBondContact O-N 3.48Å; V133-F137 PolarHBondContact O-N 2.98Å
134	L	93.6	Very high	91.2	Very high	3 Å²	3	36.2 Å²	36.2	2%	0.016	18%	0.175	C	C	.	.	H	α-helix	trans	-65.6	-41.2	178.9	-177.4	64.1	0	0	0	112	W119 G130 L131 F137 I138 F195 L199 L213 L217	W119-L134 HydrophobicContact CH2-CD2 4.12Å; W119-L134 HydrophobicContact CZ2-CB 3.87Å; W119-L134 HydrophobicContact CZ2-CD2 3.9Å; W119-L134 HydrophobicContact CZ2-CG 4.4Å; G130-L134 PolarHBondContact O-N 2.84Å; G130-L134 VanDerWaalsContact O-N 3.12Å; L131-L134 HydrophobicContact CD1-CD2 4.4Å; L131-L134 CarbonylContact O-C 3.17Å; L131-L134 WeakPolarHBondContact O-CA 3.41Å; L131-L134 WeakPolarHBondContact O-CB 3.3Å; L131-L134 PolarHBondContact O-N 2.84Å; L134-F137 HydrophobicContact CD1-CD1 4.16Å; L134-F137 PolarHBondContact O-N 2.94Å; L134-I138 HydrophobicContact CG-CD1 4.31Å; L134-I138 WeakPolarHBondContact O-CG1 3.46Å; L134-I138 PolarHBondContact O-N 2.93Å; L134-F195 HydrophobicContact CD1-CE1 3.78Å; L134-F195 HydrophobicContact CD1-CZ 4.03Å; L134-L199 HydrophobicContact CD2-CD2 4.28Å; L134-L213 HydrophobicContact CD2-CD1 4.26Å; L134-L217 HydrophobicContact CD2-CD1 4.16Å; L134-L217 HydrophobicContact CD2-CD2 4.16Å
135	I	93.6	Very high	90.9	Very high	9 Å²	9	36.9 Å²	36.9	5%	0.046	18%	0.177	C	C	.	.	H	α-helix	trans	-57.6	-50.8	174	-69.6	178.1	0	0	0	110.2	L131 F137 I138 V139 V148 Y153 L220	L131-I135 HydrophobicContact CD1-CD1 4.36Å; L131-I135 HydrophobicContact CD1-CG1 4.18Å; L131-I135 HydrophobicContact CG-CD1 4.09Å; L131-I135 HydrophobicContact CG-CG1 4.37Å; L131-I135 VanDerWaalsContact O-CG1 3.29Å; L131-I135 WeakPolarHBondContact O-CG1 3.39Å; L131-I135 PolarHBondContact O-N 3.36Å; I135-F137 VanDerWaalsContact C-N 3.33Å; I135-F137 PolarHBondContact O-N 3.38Å; I135-I138 WeakPolarHBondContact O-CB 3.47Å; I135-I138 PolarHBondContact O-N 3.03Å; I135-I138 VanDerWaalsContact O-N 3.14Å; I135-V139 WeakPolarHBondContact O-CG2 3.43Å; I135-V139 PolarHBondContact O-N 3.01Å; I135-V148 HydrophobicContact CG2-CB 4.18Å; I135-V148 HydrophobicContact CG2-CG1 4.48Å; I135-V148 HydrophobicContact CG2-CG2 3.83Å; I135-Y153 HydrophobicContact CD1-CD2 3.87Å; I135-Y153 HydrophobicContact CD1-CE2 3.73Å; I135-L220 HydrophobicContact CB-CD2 4.09Å; I135-L220 HydrophobicContact CD1-CD2 4.12Å; I135-L220 HydrophobicContact CG1-CD2 3.6Å; I135-L220 HydrophobicContact CG2-CD2 3.77Å
136	N	92.9	Very high	90.6	Very high	14 Å²	14	30.3 Å²	30.3	8%	0.075	15%	0.148	C	C	.	.	H	α-helix	trans	-65.7	-33.8	-180	-82	-67.8	0	0	0	112.8	A98 L132 V133 I138 V139 Q140 V147 V148	A98-N136 HydrophobicContact CB-CB 3.7Å; L132-N136 WeakPolarHBondContact O-CB 3.29Å; L132-N136 PolarHBondContact O-N 3.22Å; L132-N136 PolarHBondContact O-ND2 3.41Å; V133-N136 PolarHBondContact O-N 3.48Å; N136-I138 VanDerWaalsContact C-N 3.35Å; N136-V139 PolarHBondContact O-N 3.02Å; N136-Q140 WeakPolarHBondContact O-CB 3.41Å; N136-Q140 VanDerWaalsContact O-CG 3.3Å; N136-Q140 WeakPolarHBondContact O-CG 3.34Å; N136-Q140 PolarHBondContact O-N 2.85Å; N136-V147 WeakPolarHBondContact OD1-CA 3.34Å; N136-V147 WeakPolarHBondContact OD1-CG1 3.46Å; N136-V148 PolarHBondContact ND2-O 2.76Å; N136-V148 PolarHBondContact OD1-N 3.31Å
137	F	94.7	Very high	90.6	Very high	1 Å²	1	32.3 Å²	32.3	0%	0.004	16%	0.158	C	C	.	.	H	α-helix	trans	-62.8	-39.7	171.7	161.5	-105.6	0	0	0	112.2	A98 I101 V105 V133 L134 I135 S141 L192 F195	A98-F137 HydrophobicContact CB-CB 4.22Å; I101-F137 HydrophobicContact CB-CD2 3.86Å; I101-F137 HydrophobicContact CB-CE2 4.3Å; I101-F137 HydrophobicContact CB-CG 4.25Å; I101-F137 HydrophobicContact CG2-CD1 4.18Å; I101-F137 HydrophobicContact CG2-CD2 3.54Å; I101-F137 HydrophobicContact CG2-CE1 4.2Å; I101-F137 HydrophobicContact CG2-CE2 3.58Å; I101-F137 HydrophobicContact CG2-CG 3.85Å; I101-F137 HydrophobicContact CG2-CZ 3.91Å; V105-F137 HydrophobicContact CG2-CE2 4.1Å; V105-F137 HydrophobicContact CG2-CZ 4.06Å; V133-F137 PolarHBondContact O-N 2.98Å; L134-F137 HydrophobicContact CD1-CD1 4.16Å; L134-F137 PolarHBondContact O-N 2.94Å; I135-F137 VanDerWaalsContact C-N 3.33Å; I135-F137 PolarHBondContact O-N 3.38Å; F137-S141 VanDerWaalsContact O-CB 3.32Å; F137-S141 WeakPolarHBondContact O-CB 3.12Å; F137-S141 PolarHBondContact O-N 3.49Å; F137-S141 PolarHBondContact O-OG 3.09Å; F137-L192 HydrophobicContact CE1-CD1 3.92Å; F137-L192 HydrophobicContact CZ-CD1 3.53Å; F137-F195 HydrophobicContact CD1-CE1 4.23Å; F137-F195 AromaticContact CE1-CD1 3.83Å; F137-F195 HydrophobicContact CE1-CD1 3.83Å; F137-F195 AromaticContact CE1-CE1 3.74Å; F137-F195 HydrophobicContact CE1-CE1 3.74Å; F137-F195 HydrophobicContact CE1-CZ 4.35Å; F137-F195 HydrophobicContact CZ-CD1 4.32Å
138	I	94.1	Very high	90.6	Very high	5 Å²	5	26.3 Å²	26.3	3%	0.026	14%	0.136	C	C	.	.	H	α-helix	trans	-66.9	-43.1	176.1	-67.3	166	0	0	0	110.7	L134 I135 N136 Q140 S141 C142 L217 L221 L224 L239	L134-I138 HydrophobicContact CG-CD1 4.31Å; L134-I138 WeakPolarHBondContact O-CG1 3.46Å; L134-I138 PolarHBondContact O-N 2.93Å; I135-I138 WeakPolarHBondContact O-CB 3.47Å; I135-I138 PolarHBondContact O-N 3.03Å; I135-I138 VanDerWaalsContact O-N 3.14Å; N136-I138 VanDerWaalsContact C-N 3.35Å; I138-Q140 PolarHBondContact O-N 2.79Å; I138-S141 WeakPolarHBondContact O-CB 3.12Å; I138-S141 PolarHBondContact O-N 3.18Å; I138-S141 VanDerWaalsContact O-N 3.17Å; I138-C142 PolarHBondContact O-N 3.39Å; I138-C142 PolarHBondContact O-SG 2.82Å; I138-L217 HydrophobicContact CD1-CD1 3.49Å; I138-L217 VanDerWaalsContact CD1-CD1 3.49Å; I138-L221 HydrophobicContact CD1-CD2 4.34Å; I138-L221 HydrophobicContact CG2-CD2 4.34Å; I138-L224 HydrophobicContact CG2-CD1 4Å; I138-L239 HydrophobicContact CB-CD1 4.34Å; I138-L239 HydrophobicContact CD1-CD1 4.41Å; I138-L239 HydrophobicContact CG1-CD1 3.9Å; I138-L239 HydrophobicContact CG2-CD1 3.72Å
139	V	91.9	Very high	90.6	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.006	13%	0.131	C	C	.	.	H	α-helix	trans	-61.4	-44.2	176.9	172.5	0	0	0	0	111.5	I135 N136 C142 C144 G146 V148 L165	I135-V139 WeakPolarHBondContact O-CG2 3.43Å; I135-V139 PolarHBondContact O-N 3.01Å; N136-V139 PolarHBondContact O-N 3.02Å; V139-C142 WeakPolarHBondContact O-CB 3.45Å; V139-C142 PolarHBondContact O-N 2.7Å; V139-C144 HydrophobicContact CG1-CB 3.66Å; V139-C144 WeakPolarHBondContact O-CB 3.22Å; V139-C144 PolarHBondContact O-N 2.84Å; V139-G146 WeakPolarHBondContact CG1-O 3.34Å; V139-V148 HydrophobicContact CG2-CG2 4.33Å; V139-L165 HydrophobicContact CG1-CD1 4.17Å; V139-L165 HydrophobicContact CG1-CD2 3.93Å; V139-L165 HydrophobicContact CG2-CD1 3.63Å
140	Q	90.9	Very high	90.6	Very high	49 Å²	49	23.5 Å²	23.5	23%	0.229	13%	0.125	C	C	.	.	H	α-helix	trans	-64.9	-37.4	173	-70.8	173.7	20.2	0	0	112.3	Y102 N136 I138 C142 G143	Y102-Q140 HydrophobicContact CD2-CB 4.13Å; N136-Q140 WeakPolarHBondContact O-CB 3.41Å; N136-Q140 VanDerWaalsContact O-CG 3.3Å; N136-Q140 WeakPolarHBondContact O-CG 3.34Å; N136-Q140 PolarHBondContact O-N 2.85Å; I138-Q140 PolarHBondContact O-N 2.79Å; Q140-C142 PolarHBondContact O-N 2.83Å; Q140-G143 WeakPolarHBondContact O-CA 3.29Å; Q140-G143 PolarHBondContact O-N 3.34Å
141	S	92.6	Very high	90.4	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-63	-26.7	174.9	-63.4	0	0	0	0	113.3	F137 I138 G143	F137-S141 VanDerWaalsContact O-CB 3.32Å; F137-S141 WeakPolarHBondContact O-CB 3.12Å; F137-S141 PolarHBondContact O-N 3.49Å; F137-S141 PolarHBondContact O-OG 3.09Å; I138-S141 WeakPolarHBondContact O-CB 3.12Å; I138-S141 PolarHBondContact O-N 3.18Å; I138-S141 VanDerWaalsContact O-N 3.17Å; S141-G143 PolarHBondContact O-N 3.48Å
142	C	91.1	Very high	90.2	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76	-3.8	170.7	-56.8	0	0	0	0	113.4	I138 V139 Q140 C144 A231 F232 T235	I138-C142 PolarHBondContact O-N 3.39Å; I138-C142 PolarHBondContact O-SG 2.82Å; V139-C142 WeakPolarHBondContact O-CB 3.45Å; V139-C142 PolarHBondContact O-N 2.7Å; Q140-C142 PolarHBondContact O-N 2.83Å; C142-C144 VanDerWaalsContact C-N 3.29Å; C142-A231 VanDerWaalsContact O-CB 3.32Å; C142-A231 WeakPolarHBondContact O-CB 3.18Å; C142-F232 HydrophobicContact CB-CD1 3.58Å; C142-F232 HydrophobicContact CB-CE1 3.97Å; C142-T235 VanDerWaalsContact SG-CB 3.53Å
143	G	87.9	Confident	90	Very high	18 Å²	18	34.2 Å²	34.2	19%	0.186	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.3	3.7	-172.2	0	0	0	0	0	114.5	Q140 S141	Q140-G143 WeakPolarHBondContact O-CA 3.29Å; Q140-G143 PolarHBondContact O-N 3.34Å; S141-G143 PolarHBondContact O-N 3.48Å
144	C	87.7	Confident	89.6	Confident	5 Å²	5	37.7 Å²	37.7	3%	0.034	19%	0.191	C	C	.	.			trans	-73.2	140.7	178.5	-168.7	0	0	0	0	110.9	V139 C142 G146 F169 F232	V139-C144 HydrophobicContact CG1-CB 3.66Å; V139-C144 WeakPolarHBondContact O-CB 3.22Å; V139-C144 PolarHBondContact O-N 2.84Å; C142-C144 VanDerWaalsContact C-N 3.29Å; C144-G146 PolarHBondContact SG-N 3.01Å; C144-G146 VanDerWaalsContact SG-N 3.41Å; C144-F169 HydrophobicContact CB-CD2 3.67Å; C144-F169 HydrophobicContact CB-CE2 4Å; C144-F232 HydrophobicContact CB-CE1 3.78Å; C144-F232 HydrophobicContact CB-CZ 4.11Å
145	K	83.2	Confident	89.2	Confident	151 Å²	151	42 Å²	42	66%	0.657	22%	0.221	S	C	*	.			trans	-97.8	-9.9	175.9	-69.6	161.6	179.8	159.3	0	113.4	E171	K145-E171 WeakPolarHBondContact CE-OE1 3.25Å; K145-E171 IonicContact NZ-OE1 2.68Å; K145-E171 PolarHBondContact NZ-OE1 3.12Å
146	G	84	Confident	89	Confident	6 Å²	6	44 Å²	44	6%	0.062	23%	0.231	C	C	.	.			trans	-65.9	152.6	170.1	0	0	0	0	0	111.5	V139 C144 E168	V139-G146 WeakPolarHBondContact CG1-O 3.34Å; C144-G146 PolarHBondContact SG-N 3.01Å; C144-G146 VanDerWaalsContact SG-N 3.41Å; G146-E168 WeakPolarHBondContact CA-OE2 3.41Å
147	V	87.7	Confident	88.8	Confident	87 Å²	87	50.4 Å²	50.4	53%	0.527	26%	0.261	S	S	.	.			trans	-128.9	125.1	-176	177.8	0	0	0	0	108.1	N136 S149	N136-V147 WeakPolarHBondContact OD1-CA 3.34Å; N136-V147 WeakPolarHBondContact OD1-CG1 3.46Å; V147-S149 PolarHBondContact O-N 2.94Å
148	V	90.7	Very high	88.6	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.018	27%	0.274	C	S	.	.			trans	-72	113.3	172.9	-174.6	0	0	0	0	107.3	L132 I135 N136 V139 M152 I161 L165	L132-V148 HydrophobicContact CD1-CB 4.09Å; L132-V148 HydrophobicContact CD1-CG1 3.85Å; I135-V148 HydrophobicContact CG2-CB 4.18Å; I135-V148 HydrophobicContact CG2-CG1 4.48Å; I135-V148 HydrophobicContact CG2-CG2 3.83Å; N136-V148 PolarHBondContact ND2-O 2.76Å; N136-V148 PolarHBondContact OD1-N 3.31Å; V139-V148 HydrophobicContact CG2-CG2 4.33Å; V148-M152 HydrophobicContact CG1-CB 4.19Å; V148-I161 HydrophobicContact CG1-CD1 4.45Å; V148-I161 HydrophobicContact CG1-CG2 4.06Å; V148-I161 HydrophobicContact CG2-CG2 3.76Å; V148-L165 HydrophobicContact CG2-CD1 3.87Å; V148-L165 HydrophobicContact CG2-CD2 4.18Å; V148-L165 HydrophobicContact CG2-CG 4.38Å
149	S	90.1	Very high	88.3	Confident	42 Å²	42	55.9 Å²	55.9	29%	0.294	30%	0.299	S	S	.	.			trans	-78.5	163	176.3	80.2	0	0	0	0	111.3	V147 E151 M152 Y153	V147-S149 PolarHBondContact O-N 2.94Å; S149-E151 VanDerWaalsContact C-N 3.3Å; S149-E151 PolarHBondContact O-N 3.29Å; S149-E151 PolarHBondContact OG-N 3.3Å; S149-M152 PolarHBondContact O-N 2.98Å; S149-M152 WeakPolarHBondContact OG-CG 3.43Å; S149-M152 PolarHBondContact OG-N 2.94Å; S149-M152 VanDerWaalsContact OG-N 3.13Å; S149-Y153 PolarHBondContact O-N 3.11Å
150	R	88.3	Confident	88.1	Confident	70 Å²	70	60.8 Å²	60.8	26%	0.264	32%	0.322	S	S	.	.	H	α-helix	trans	-56.2	-45.6	172.6	-171.4	68.2	-136.8	-145.7	-2.9	111.7	E128 E129 L132 M152 Y153 D154	E128-R150 VanDerWaalsContact CB-NH1 3.35Å; E128-R150 IonicContact OE2-CZ 3.5Å; E128-R150 IonicContact OE2-NH1 3.41Å; E128-R150 PolarHBondContact OE2-NH1 2.95Å; E128-R150 IonicContact OE2-NH2 2.7Å; E128-R150 PolarHBondContact OE2-NH2 2.9Å; E129-R150 IonicContact OE2-NH1 2.72Å; E129-R150 PolarHBondContact OE2-NH1 3.35Å; L132-R150 HydrophobicContact CD2-CB 4.23Å; R150-M152 VanDerWaalsContact C-N 3.33Å; R150-M152 PolarHBondContact O-N 3.18Å; R150-Y153 PolarHBondContact O-N 3.18Å; R150-D154 WeakPolarHBondContact CG-OD2 3.44Å; R150-D154 IonicContact CZ-OD1 3.33Å; R150-D154 IonicContact CZ-OD2 3.61Å; R150-D154 IonicContact NE-OD1 3.15Å; R150-D154 PolarHBondContact NE-OD1 3.49Å; R150-D154 VanDerWaalsContact NE-OD1 3.15Å; R150-D154 IonicContact NE-OD2 2.86Å; R150-D154 PolarHBondContact NE-OD2 3.33Å; R150-D154 IonicContact NH2-OD1 3.51Å; R150-D154 PolarHBondContact NH2-OD1 3.47Å; R150-D154 IonicContact NH2-OD2 3.85Å; R150-D154 WeakPolarHBondContact O-CB 3.5Å; R150-D154 VanDerWaalsContact O-CG 3.28Å; R150-D154 PolarHBondContact O-N 2.95Å
151	E	86.2	Confident	88.1	Confident	156 Å²	156	58.7 Å²	58.7	73%	0.729	31%	0.313	S	S	*	.	H	α-helix	trans	-59.4	-40.1	176.9	-60.1	175.8	165.5	0	0	112.5	S149 S155	S149-E151 VanDerWaalsContact C-N 3.3Å; S149-E151 PolarHBondContact O-N 3.29Å; S149-E151 PolarHBondContact OG-N 3.3Å; E151-S155 WeakPolarHBondContact O-CB 3.2Å; E151-S155 PolarHBondContact O-N 3.31Å; E151-S155 PolarHBondContact O-OG 3.08Å
152	M	86.8	Confident	87.9	Confident	26 Å²	26	59.3 Å²	59.3	13%	0.128	32%	0.316	C	S	.	.	H	α-helix	trans	-66.1	-44	175.5	-68.8	173.5	68.1	0	0	111.5	V148 S149 R150 D154 S155 M156 I161 T164	V148-M152 HydrophobicContact CG1-CB 4.19Å; S149-M152 PolarHBondContact O-N 2.98Å; S149-M152 WeakPolarHBondContact OG-CG 3.43Å; S149-M152 PolarHBondContact OG-N 2.94Å; S149-M152 VanDerWaalsContact OG-N 3.13Å; R150-M152 VanDerWaalsContact C-N 3.33Å; R150-M152 PolarHBondContact O-N 3.18Å; M152-D154 VanDerWaalsContact C-N 3.34Å; M152-D154 PolarHBondContact O-N 3.23Å; M152-S155 PolarHBondContact O-N 3.36Å; M152-M156 HydrophobicContact CB-SD 4Å; M152-M156 HydrophobicContact CE-SD 4.35Å; M152-M156 HydrophobicContact CG-SD 3.8Å; M152-M156 VanDerWaalsContact O-CB 3.27Å; M152-M156 WeakPolarHBondContact O-CB 3.34Å; M152-M156 PolarHBondContact O-N 3.29Å; M152-I161 HydrophobicContact CE-CG2 4.29Å; M152-T164 HydrophobicContact CE-CG2 3.77Å
153	Y	88.1	Confident	87.8	Confident	51 Å²	51	62 Å²	62	20%	0.2	34%	0.335	C	S	.	.	H	α-helix	trans	-63.9	-37.5	179	-180	-97.5	0	0	0	112.6	E128 L131 L132 I135 S149 R150	E128-Y153 HydrophobicContact CB-CE1 4.1Å; E128-Y153 HydrophobicContact CG-CE1 4.41Å; L131-Y153 HydrophobicContact CD2-CE2 4.45Å; L131-Y153 WeakPolarHBondContact CD2-OH 3.43Å; L132-Y153 HydrophobicContact CD1-CD2 4.4Å; L132-Y153 HydrophobicContact CD1-CG 4.28Å; I135-Y153 HydrophobicContact CD1-CD2 3.87Å; I135-Y153 HydrophobicContact CD1-CE2 3.73Å; S149-Y153 PolarHBondContact O-N 3.11Å; R150-Y153 PolarHBondContact O-N 3.18Å
154	D	85.8	Confident	87.7	Confident	94 Å²	94	62.7 Å²	62.7	50%	0.503	34%	0.335	S	S	.	.	H	α-helix	trans	-82.8	-13.8	-177.5	-65.4	-30.3	0	0	0	114.4	R150 M152	R150-D154 WeakPolarHBondContact CG-OD2 3.44Å; R150-D154 IonicContact CZ-OD1 3.33Å; R150-D154 IonicContact CZ-OD2 3.61Å; R150-D154 IonicContact NE-OD1 3.15Å; R150-D154 PolarHBondContact NE-OD1 3.49Å; R150-D154 VanDerWaalsContact NE-OD1 3.15Å; R150-D154 IonicContact NE-OD2 2.86Å; R150-D154 PolarHBondContact NE-OD2 3.33Å; R150-D154 IonicContact NH2-OD1 3.51Å; R150-D154 PolarHBondContact NH2-OD1 3.47Å; R150-D154 IonicContact NH2-OD2 3.85Å; R150-D154 WeakPolarHBondContact O-CB 3.5Å; R150-D154 VanDerWaalsContact O-CG 3.28Å; R150-D154 PolarHBondContact O-N 2.95Å; M152-D154 VanDerWaalsContact C-N 3.34Å; M152-D154 PolarHBondContact O-N 3.23Å
155	S	84.8	Confident	87.7	Confident	94 Å²	94	62.5 Å²	62.5	66%	0.657	33%	0.334	S	S	*	.	H	α-helix	trans	-132.6	-7.6	-170.8	71	0	0	0	0	116.8	E151 M152	E151-S155 WeakPolarHBondContact O-CB 3.2Å; E151-S155 PolarHBondContact O-N 3.31Å; E151-S155 PolarHBondContact O-OG 3.08Å; M152-S155 PolarHBondContact O-N 3.36Å
156	M	89.3	Confident	87.8	Confident	52 Å²	52	58 Å²	58	26%	0.256	32%	0.319	S	S	.	.	S	Bend	trans	-124.7	143.1	-175.2	-55.1	-178.8	65.1	0	0	111.8	M152 E160 I161	M152-M156 HydrophobicContact CB-SD 4Å; M152-M156 HydrophobicContact CE-SD 4.35Å; M152-M156 HydrophobicContact CG-SD 3.8Å; M152-M156 VanDerWaalsContact O-CB 3.27Å; M152-M156 WeakPolarHBondContact O-CB 3.34Å; M152-M156 PolarHBondContact O-N 3.29Å; M156-E160 HydrophobicContact CB-CB 4.23Å; M156-E160 HydrophobicContact CE-CB 3.58Å; M156-I161 HydrophobicContact CB-CD1 4.44Å; M156-I161 HydrophobicContact CB-CG1 3.83Å
157	E	89.3	Confident	87.7	Confident	148 Å²	148	64.1 Å²	64.1	69%	0.692	34%	0.344	S	S	*	.			trans	-71.7	155.4	172	-68.6	-171.1	-179.2	0	0	111.8	A159 E160 I161	E157-A159 PolarHBondContact O-N 3.09Å; E157-E160 HydrophobicContact CB-CG 4.5Å; E157-E160 WeakPolarHBondContact O-CA 3.35Å; E157-E160 WeakPolarHBondContact O-CB 3.46Å; E157-E160 PolarHBondContact O-N 3.06Å; E157-I161 PolarHBondContact O-N 2.95Å
158	N	89.3	Confident	87.3	Confident	52 Å²	52	64.5 Å²	64.5	28%	0.278	34%	0.34	S	S	.	.	H	α-helix	trans	-49	-38.6	177.2	-82.2	-39.5	0	0	0	113	E160 I161 I162	N158-E160 PolarHBondContact O-N 2.86Å; N158-I161 PolarHBondContact O-N 2.93Å; N158-I162 WeakPolarHBondContact O-CB 3.27Å; N158-I162 WeakPolarHBondContact O-CD1 3.41Å; N158-I162 WeakPolarHBondContact O-CG1 3.37Å; N158-I162 PolarHBondContact O-N 3.34Å
159	A	88	Confident	86.7	Confident	69 Å²	69	65.8 Å²	65.8	57%	0.57	35%	0.345	S	S	*	.	H	α-helix	trans	-63.5	-37.9	177.1	0	0	0	0	0	112.9	E157 S163	E157-A159 PolarHBondContact O-N 3.09Å; A159-S163 VanDerWaalsContact O-CB 3.24Å; A159-S163 WeakPolarHBondContact O-CB 3.46Å; A159-S163 PolarHBondContact O-N 3.04Å
160	E	89.5	Confident	85.3	Confident	103 Å²	103	70.6 Å²	70.6	48%	0.481	37%	0.368	S	S	.	.	H	α-helix	trans	-76.8	-37.2	178.7	-55.9	-167.1	132.6	0	0	112.1	M156 E157 N158 S163 T164	M156-E160 HydrophobicContact CB-CB 4.23Å; M156-E160 HydrophobicContact CE-CB 3.58Å; E157-E160 HydrophobicContact CB-CG 4.5Å; E157-E160 WeakPolarHBondContact O-CA 3.35Å; E157-E160 WeakPolarHBondContact O-CB 3.46Å; E157-E160 PolarHBondContact O-N 3.06Å; N158-E160 PolarHBondContact O-N 2.86Å; E160-S163 WeakPolarHBondContact O-CB 3.4Å; E160-S163 PolarHBondContact O-N 2.9Å; E160-T164 WeakPolarHBondContact O-CB 3.24Å; E160-T164 PolarHBondContact O-N 2.88Å; E160-T164 PolarHBondContact O-OG1 3.49Å
161	I	89.3	Confident	84	Confident	6 Å²	6	70.5 Å²	70.5	3%	0.031	37%	0.37	C	S	.	.	H	α-helix	trans	-59.3	-50.5	171.3	-64.1	174.1	0	0	0	109.4	V148 M152 M156 E157 N158 S163 T164 L165	V148-I161 HydrophobicContact CG1-CD1 4.45Å; V148-I161 HydrophobicContact CG1-CG2 4.06Å; V148-I161 HydrophobicContact CG2-CG2 3.76Å; M152-I161 HydrophobicContact CE-CG2 4.29Å; M156-I161 HydrophobicContact CB-CD1 4.44Å; M156-I161 HydrophobicContact CB-CG1 3.83Å; E157-I161 PolarHBondContact O-N 2.95Å; N158-I161 PolarHBondContact O-N 2.93Å; I161-S163 PolarHBondContact O-N 3.11Å; I161-T164 WeakPolarHBondContact O-CB 3.29Å; I161-T164 PolarHBondContact O-N 3.19Å; I161-T164 VanDerWaalsContact O-N 3.08Å; I161-L165 HydrophobicContact CG2-CD1 4.03Å; I161-L165 HydrophobicContact CG2-CG 4.43Å; I161-L165 WeakPolarHBondContact O-CG 3.07Å; I161-L165 PolarHBondContact O-N 3.44Å
162	I	89.6	Confident	82.5	Confident	13 Å²	13	71.4 Å²	71.4	7%	0.067	38%	0.38	C	S	.	.	H	α-helix	trans	-64.1	-39.5	178.1	-65.6	164	0	0	0	111.4	N158 T164 L165 T166 L220 L224	N158-I162 WeakPolarHBondContact O-CB 3.27Å; N158-I162 WeakPolarHBondContact O-CD1 3.41Å; N158-I162 WeakPolarHBondContact O-CG1 3.37Å; N158-I162 PolarHBondContact O-N 3.34Å; I162-T164 PolarHBondContact O-N 3.46Å; I162-L165 PolarHBondContact O-N 3.01Å; I162-T166 VanDerWaalsContact O-CB 3.25Å; I162-T166 WeakPolarHBondContact O-CB 3.39Å; I162-T166 PolarHBondContact O-N 2.97Å; I162-T166 PolarHBondContact O-OG1 3Å; I162-L220 HydrophobicContact CD1-CD1 4.24Å; I162-L220 HydrophobicContact CG1-CD1 4.35Å; I162-L224 HydrophobicContact CD1-CD2 4.07Å; I162-L224 HydrophobicContact CD1-CG 3.96Å; I162-L224 HydrophobicContact CG1-CD2 3.78Å; I162-L224 HydrophobicContact CG1-CG 4.18Å; I162-L224 HydrophobicContact CG2-CD2 4.38Å
163	S	87.4	Confident	81.3	Confident	56 Å²	56	72.7 Å²	72.7	39%	0.392	39%	0.392	S	S	.	.	H	α-helix	trans	-59.9	-34.5	172.9	177.7	0	0	0	0	112.1	A159 E160 I161 K167	A159-S163 VanDerWaalsContact O-CB 3.24Å; A159-S163 WeakPolarHBondContact O-CB 3.46Å; A159-S163 PolarHBondContact O-N 3.04Å; E160-S163 WeakPolarHBondContact O-CB 3.4Å; E160-S163 PolarHBondContact O-N 2.9Å; I161-S163 PolarHBondContact O-N 3.11Å; S163-K167 WeakPolarHBondContact O-CD 3.48Å; S163-K167 WeakPolarHBondContact O-CE 3.48Å; S163-K167 WeakPolarHBondContact O-CG 3.45Å; S163-K167 PolarHBondContact O-NZ 3.05Å; S163-K167 PolarHBondContact OG-NZ 2.68Å; S163-K167 VanDerWaalsContact OG-NZ 3.12Å
164	T	87.3	Confident	80.3	Confident	33 Å²	33	75.1 Å²	75.1	20%	0.202	41%	0.412	C	S	.	.	H	α-helix	trans	-76.6	-50.1	177.5	-58.4	0	0	0	0	111.7	M152 E160 I161 I162 T166 K167 E168	M152-T164 HydrophobicContact CE-CG2 3.77Å; E160-T164 WeakPolarHBondContact O-CB 3.24Å; E160-T164 PolarHBondContact O-N 2.88Å; E160-T164 PolarHBondContact O-OG1 3.49Å; I161-T164 WeakPolarHBondContact O-CB 3.29Å; I161-T164 PolarHBondContact O-N 3.19Å; I161-T164 VanDerWaalsContact O-N 3.08Å; I162-T164 PolarHBondContact O-N 3.46Å; T164-T166 PolarHBondContact O-N 3.12Å; T164-K167 WeakPolarHBondContact O-CB 3.49Å; T164-K167 PolarHBondContact O-N 2.94Å; T164-E168 PolarHBondContact O-N 3.46Å; T164-E168 VanDerWaalsContact O-N 3.16Å
165	L	87.3	Confident	80	Confident	1 Å²	1	74.6 Å²	74.6	1%	0.005	41%	0.409	C	S	.	.	H	α-helix	trans	-56.7	-33.2	173.5	-67.5	173.4	0	0	0	112.7	V139 V148 I161 I162 K167 E168 F169 F232	V139-L165 HydrophobicContact CG1-CD1 4.17Å; V139-L165 HydrophobicContact CG1-CD2 3.93Å; V139-L165 HydrophobicContact CG2-CD1 3.63Å; V148-L165 HydrophobicContact CG2-CD1 3.87Å; V148-L165 HydrophobicContact CG2-CD2 4.18Å; V148-L165 HydrophobicContact CG2-CG 4.38Å; I161-L165 HydrophobicContact CG2-CD1 4.03Å; I161-L165 HydrophobicContact CG2-CG 4.43Å; I161-L165 WeakPolarHBondContact O-CG 3.07Å; I161-L165 PolarHBondContact O-N 3.44Å; I162-L165 PolarHBondContact O-N 3.01Å; L165-K167 VanDerWaalsContact C-N 3.31Å; L165-K167 PolarHBondContact O-N 2.92Å; L165-E168 PolarHBondContact O-N 2.7Å; L165-F169 WeakPolarHBondContact O-CB 3.39Å; L165-F169 PolarHBondContact O-N 3.11Å; L165-F232 HydrophobicContact CB-CE2 4.38Å; L165-F232 HydrophobicContact CB-CZ 3.88Å
166	T	85.4	Confident	80.2	Confident	57 Å²	57	70.7 Å²	70.7	35%	0.35	38%	0.38	S	S	.	.	H	α-helix	trans	-65.1	-31.5	175	-62.9	0	0	0	0	112.7	I162 T164 V229	I162-T166 VanDerWaalsContact O-CB 3.25Å; I162-T166 WeakPolarHBondContact O-CB 3.39Å; I162-T166 PolarHBondContact O-N 2.97Å; I162-T166 PolarHBondContact O-OG1 3Å; T164-T166 PolarHBondContact O-N 3.12Å; T166-V229 HydrophobicContact CG2-CG2 3.65Å
167	K	82.8	Confident	80.2	Confident	134 Å²	134	68.6 Å²	68.6	58%	0.583	37%	0.37	S	S	*	.	H	α-helix	trans	-76.5	-35	174.7	-60.5	156	-160.1	141.7	0	111.3	S163 T164 L165	S163-K167 WeakPolarHBondContact O-CD 3.48Å; S163-K167 WeakPolarHBondContact O-CE 3.48Å; S163-K167 WeakPolarHBondContact O-CG 3.45Å; S163-K167 PolarHBondContact O-NZ 3.05Å; S163-K167 PolarHBondContact OG-NZ 2.68Å; S163-K167 VanDerWaalsContact OG-NZ 3.12Å; T164-K167 WeakPolarHBondContact O-CB 3.49Å; T164-K167 PolarHBondContact O-N 2.94Å; L165-K167 VanDerWaalsContact C-N 3.31Å; L165-K167 PolarHBondContact O-N 2.92Å
168	E	79.1	Confident	80.2	Confident	94 Å²	94	62.5 Å²	62.5	44%	0.439	34%	0.342	S	S	.	.	H	α-helix	trans	-80.2	-22.2	179.8	-63.8	-169	155.7	0	0	113.8	G146 T164 L165 N170	G146-E168 WeakPolarHBondContact CA-OE2 3.41Å; T164-E168 PolarHBondContact O-N 3.46Å; T164-E168 VanDerWaalsContact O-N 3.16Å; L165-E168 PolarHBondContact O-N 2.7Å; E168-N170 VanDerWaalsContact C-N 3.33Å; E168-N170 PolarHBondContact O-N 3.09Å
169	F	76.8	Confident	80.1	Confident	30 Å²	30	62.7 Å²	62.7	13%	0.132	34%	0.343	C	S	.	.	H	α-helix	trans	-53.3	-50.1	-178.3	-167.1	-86.7	0	0	0	111.9	C144 L165 E171 V229 A231 F232	C144-F169 HydrophobicContact CB-CD2 3.67Å; C144-F169 HydrophobicContact CB-CE2 4Å; L165-F169 WeakPolarHBondContact O-CB 3.39Å; L165-F169 PolarHBondContact O-N 3.11Å; F169-E171 HydrophobicContact CE1-CB 4.44Å; F169-E171 PolarHBondContact O-N 2.92Å; F169-V229 HydrophobicContact CD2-CG1 4.49Å; F169-A231 HydrophobicContact CE2-CB 3.91Å; F169-A231 HydrophobicContact CZ-CB 3.62Å; F169-F232 HydrophobicContact CD2-CE1 4.07Å; F169-F232 HydrophobicContact CD2-CE2 4.33Å; F169-F232 AromaticContact CD2-CZ 3.75Å; F169-F232 HydrophobicContact CD2-CZ 3.75Å; F169-F232 HydrophobicContact CE2-CE1 4.42Å; F169-F232 HydrophobicContact CE2-CZ 4.49Å
170	N	60.2	Low	80	Confident	144 Å²	144	61.1 Å²	61.1	77%	0.77	33%	0.326	S	S	*	.			trans	28.3	45.8	165.3	-155	66.3	0	0	0	117.7	E168	E168-N170 VanDerWaalsContact C-N 3.33Å; E168-N170 PolarHBondContact O-N 3.09Å
171	E	61.4	Low	79.7	Confident	67 Å²	67	61.7 Å²	61.7	31%	0.313	34%	0.339	S	S	.	.			trans	-103.3	129.8	168.5	-68.3	-151.1	137.5	0	0	110.9	K145 F169 S173	K145-E171 WeakPolarHBondContact CE-OE1 3.25Å; K145-E171 IonicContact NZ-OE1 2.68Å; K145-E171 PolarHBondContact NZ-OE1 3.12Å; F169-E171 HydrophobicContact CE1-CB 4.44Å; F169-E171 PolarHBondContact O-N 2.92Å; E171-S173 PolarHBondContact O-N 2.89Å; E171-S173 VanDerWaalsContact O-N 3.16Å
172	D	55.5	Low	79.5	Confident	175 Å²	175	62.6 Å²	62.6	94%	0.936	35%	0.349	S	S	*	.			trans	-70.1	0.8	165.5	-56.4	-62.8	0	0	0	112.7
173	S	61.2	Low	79.3	Confident	54 Å²	54	66.5 Å²	66.5	38%	0.378	38%	0.376	S	S	.	.			trans	-78.9	127.4	178.4	178.1	0	0	0	0	111.3	E171 N175	E171-S173 PolarHBondContact O-N 2.89Å; E171-S173 VanDerWaalsContact O-N 3.16Å; S173-N175 PolarHBondContact O-N 3.22Å; S173-N175 PolarHBondContact OG-N 2.55Å; S173-N175 PolarHBondContact OG-O 2.7Å
174	V	66.8	Low	79.3	Confident	102 Å²	102	68.5 Å²	68.5	62%	0.618	38%	0.379	S	S	*	.	S	Bend	trans	-72.9	-17.4	168.6	-177.2	0	0	0	0	111.6	I179	V174-I179 WeakPolarHBondContact O-CD1 3.48Å
175	N	80.3	Confident	79.2	Confident	82 Å²	82	69.4 Å²	69.4	44%	0.439	38%	0.38	S	S	.	.			trans	-95.5	137.3	-172.6	-60.4	-39.6	0	0	0	112.5	S173	S173-N175 PolarHBondContact O-N 3.22Å; S173-N175 PolarHBondContact OG-N 2.55Å; S173-N175 PolarHBondContact OG-O 2.7Å
176	Y	88.6	Confident	79.2	Confident	12 Å²	12	77.3 Å²	77.3	5%	0.047	42%	0.415	C	S	.	.			trans	-141.4	164	174.2	59.4	-82.4	0	0	0	109.1	L178 I179 T180 R230 A231 H234	Y176-L178 VanDerWaalsContact C-N 3.25Å; Y176-L178 HydrophobicContact CD2-CB 4.36Å; Y176-L178 HydrophobicContact CE2-CB 4.03Å; Y176-L178 PolarHBondContact O-N 3.29Å; Y176-I179 HydrophobicContact CD1-CD1 3.67Å; Y176-I179 HydrophobicContact CD1-CG1 3.7Å; Y176-I179 HydrophobicContact CE1-CB 4.48Å; Y176-I179 HydrophobicContact CE1-CD1 3.25Å; Y176-I179 HydrophobicContact CE1-CG1 3.49Å; Y176-I179 VanDerWaalsContact CE1-CG1 3.49Å; Y176-I179 HydrophobicContact CE1-CG2 4.22Å; Y176-I179 HydrophobicContact CE2-CG1 4.36Å; Y176-I179 HydrophobicContact CE2-CG2 4.27Å; Y176-I179 HydrophobicContact CG-CG1 4.18Å; Y176-I179 WeakPolarHBondContact O-CG1 3.39Å; Y176-I179 PolarHBondContact O-N 3.16Å; Y176-I179 WeakPolarHBondContact OH-CG2 3.33Å; Y176-T180 PolarHBondContact O-N 3.12Å; Y176-T180 VanDerWaalsContact O-N 3.12Å; Y176-T180 PolarHBondContact O-OG1 2.89Å; Y176-T180 VanDerWaalsContact O-OG1 3.12Å; Y176-R230 HydrophobicContact CE1-CG 3.61Å; Y176-A231 HydrophobicContact CD1-CB 3.81Å; Y176-A231 HydrophobicContact CD2-CB 3.74Å; Y176-A231 HydrophobicContact CE1-CB 4.38Å; Y176-A231 HydrophobicContact CE2-CB 4.31Å; Y176-A231 HydrophobicContact CG-CB 3.48Å; Y176-A231 VanDerWaalsContact CG-CB 3.48Å; Y176-H234 HydrophobicContact CE2-CB 4.07Å; Y176-H234 AromaticContact CE2-ND1 3.74Å; Y176-H234 AromaticContact CZ-ND1 3.73Å; Y176-H234 PolarHBondContact OH-ND1 3.19Å
177	P	89	Confident	79.3	Confident	8 Å²	8	81.7 Å²	81.7	5%	0.052	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	-26.3	-160.8	-31.9	37.6	0	0	0	117.9	F185 F188	P177-F185 HydrophobicContact CB-CD1 4.21Å; P177-F185 HydrophobicContact CB-CE1 4.29Å; P177-F185 WeakPolarHBondContact O-CD1 3.39Å; P177-F188 HydrophobicContact CB-CD1 3.83Å; P177-F188 HydrophobicContact CB-CE1 3.55Å; P177-F188 HydrophobicContact CB-CZ 4.26Å
178	L	89.1	Confident	79.7	Confident	21 Å²	21	75.3 Å²	75.3	11%	0.11	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-17.9	178.2	-66.6	-177.9	0	0	0	115	Y176 F188 K189 L192 T235 L238	Y176-L178 VanDerWaalsContact C-N 3.25Å; Y176-L178 HydrophobicContact CD2-CB 4.36Å; Y176-L178 HydrophobicContact CE2-CB 4.03Å; Y176-L178 PolarHBondContact O-N 3.29Å; L178-F188 HydrophobicContact CD2-CD1 4.37Å; L178-F188 HydrophobicContact CD2-CE1 4.27Å; L178-K189 HydrophobicContact CD2-CB 3.96Å; L178-K189 HydrophobicContact CD2-CG 4Å; L178-L192 HydrophobicContact CD2-CD2 4.11Å; L178-T235 HydrophobicContact CD1-CG2 4.12Å; L178-L238 HydrophobicContact CD1-CD2 3.82Å; L178-L238 HydrophobicContact CD2-CD2 3.91Å
179	I	87.2	Confident	80.3	Confident	55 Å²	55	74.3 Å²	74.3	28%	0.282	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.3	-12.3	-179.3	64.3	162	0	0	0	114	V174 Y176 P181	V174-I179 WeakPolarHBondContact O-CD1 3.48Å; Y176-I179 HydrophobicContact CD1-CD1 3.67Å; Y176-I179 HydrophobicContact CD1-CG1 3.7Å; Y176-I179 HydrophobicContact CE1-CB 4.48Å; Y176-I179 HydrophobicContact CE1-CD1 3.25Å; Y176-I179 HydrophobicContact CE1-CG1 3.49Å; Y176-I179 VanDerWaalsContact CE1-CG1 3.49Å; Y176-I179 HydrophobicContact CE1-CG2 4.22Å; Y176-I179 HydrophobicContact CE2-CG1 4.36Å; Y176-I179 HydrophobicContact CE2-CG2 4.27Å; Y176-I179 HydrophobicContact CG-CG1 4.18Å; Y176-I179 WeakPolarHBondContact O-CG1 3.39Å; Y176-I179 PolarHBondContact O-N 3.16Å; Y176-I179 WeakPolarHBondContact OH-CG2 3.33Å; I179-P181 WeakPolarHBondContact O-CD 3.14Å
180	T	86.4	Confident	81	Confident	37 Å²	37	75.8 Å²	75.8	23%	0.227	41%	0.409	C	S	.	.	S	Bend	trans	-59.7	121.2	176.6	-58.5	0	0	0	0	110.1	Y176 G182 F185	Y176-T180 PolarHBondContact O-N 3.12Å; Y176-T180 VanDerWaalsContact O-N 3.12Å; Y176-T180 PolarHBondContact O-OG1 2.89Å; Y176-T180 VanDerWaalsContact O-OG1 3.12Å; T180-G182 PolarHBondContact O-N 3.19Å; T180-F185 HydrophobicContact CG2-CD2 3.53Å; T180-F185 HydrophobicContact CG2-CE2 3.51Å; T180-F185 HydrophobicContact CG2-CG 4.18Å; T180-F185 HydrophobicContact CG2-CZ 4.15Å; T180-F185 WeakPolarHBondContact O-CB 3.43Å
181	P	83.4	Confident	82.5	Confident	114 Å²	114	69.5 Å²	69.5	74%	0.74	38%	0.378	S	S	*	.			trans	-70.4	129.2	-176.9	27.4	-34	0	0	0	111.3	I179	I179-P181 WeakPolarHBondContact O-CD 3.14Å
182	G	85.1	Confident	84	Confident	25 Å²	25	66.4 Å²	66.4	26%	0.258	36%	0.364	S	S	.	.	S	Bend	trans	161.1	158.8	171.2	0	0	0	0	0	113.5	T180 Q184 F185 K186	T180-G182 PolarHBondContact O-N 3.19Å; G182-Q184 VanDerWaalsContact C-N 3.26Å; G182-Q184 PolarHBondContact O-N 3.36Å; G182-F185 PolarHBondContact O-N 3.35Å; G182-K186 PolarHBondContact O-N 2.93Å
183	P	86.3	Confident	85.9	Confident	96 Å²	96	59.1 Å²	59.1	62%	0.623	33%	0.326	S	S	*	.	H	α-helix	trans	-66.2	-27.3	179.2	27	-34.4	0	0	0	112.7	R187	P183-R187 WeakPolarHBondContact O-CG 3.46Å; P183-R187 PolarHBondContact O-N 2.87Å
184	Q	86.2	Confident	87.4	Confident	98 Å²	98	60 Å²	60	46%	0.458	32%	0.324	S	S	.	.	H	α-helix	trans	-66.5	-51	173.8	-177.2	177	-1.6	0	0	111.4	G182 K186 R187 F188	G182-Q184 VanDerWaalsContact C-N 3.26Å; G182-Q184 PolarHBondContact O-N 3.36Å; Q184-K186 VanDerWaalsContact C-N 3.34Å; Q184-K186 PolarHBondContact O-N 3.08Å; Q184-R187 CarbonylContact O-C 3.53Å; Q184-R187 WeakPolarHBondContact O-CA 3.33Å; Q184-R187 WeakPolarHBondContact O-CB 3.37Å; Q184-R187 PolarHBondContact O-N 3.49Å; Q184-F188 PolarHBondContact O-N 2.92Å
185	F	85.4	Confident	88.7	Confident	52 Å²	52	55.2 Å²	55.2	23%	0.228	30%	0.295	C	S	.	.	H	α-helix	trans	-69.4	-30.1	-178.8	-67.5	-71.4	0	0	0	113.1	P177 T180 G182 R187 F188 K189	P177-F185 HydrophobicContact CB-CD1 4.21Å; P177-F185 HydrophobicContact CB-CE1 4.29Å; P177-F185 WeakPolarHBondContact O-CD1 3.39Å; T180-F185 HydrophobicContact CG2-CD2 3.53Å; T180-F185 HydrophobicContact CG2-CE2 3.51Å; T180-F185 HydrophobicContact CG2-CG 4.18Å; T180-F185 HydrophobicContact CG2-CZ 4.15Å; T180-F185 WeakPolarHBondContact O-CB 3.43Å; G182-F185 PolarHBondContact O-N 3.35Å; F185-R187 VanDerWaalsContact C-N 3.34Å; F185-R187 PolarHBondContact O-N 3.45Å; F185-F188 WeakPolarHBondContact O-CB 3.37Å; F185-F188 PolarHBondContact O-N 2.88Å; F185-K189 PolarHBondContact O-N 3.41Å
186	K	86.7	Confident	89.4	Confident	167 Å²	167	51.7 Å²	51.7	73%	0.726	28%	0.277	S	S	*	.	H	α-helix	trans	-61	-39.7	166.7	-74.1	-173.5	176	-173.5	0	112.6	G182 Q184 A190	G182-K186 PolarHBondContact O-N 2.93Å; Q184-K186 VanDerWaalsContact C-N 3.34Å; Q184-K186 PolarHBondContact O-N 3.08Å; K186-A190 PolarHBondContact O-N 3.47Å
187	R	88.1	Confident	89.6	Confident	148 Å²	148	55.8 Å²	55.8	56%	0.558	29%	0.292	S	S	*	.	H	α-helix	trans	-69.3	-39	171.9	-67.9	-177.3	-150.5	112.7	1.7	112	P183 Q184 F185 A190 G191	P183-R187 WeakPolarHBondContact O-CG 3.46Å; P183-R187 PolarHBondContact O-N 2.87Å; Q184-R187 CarbonylContact O-C 3.53Å; Q184-R187 WeakPolarHBondContact O-CA 3.33Å; Q184-R187 WeakPolarHBondContact O-CB 3.37Å; Q184-R187 PolarHBondContact O-N 3.49Å; F185-R187 VanDerWaalsContact C-N 3.34Å; F185-R187 PolarHBondContact O-N 3.45Å; R187-A190 PolarHBondContact O-N 2.87Å; R187-G191 PolarHBondContact O-N 2.93Å
188	F	91.6	Very high	89.7	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-57.4	-49.1	176.1	176.6	-99.3	0	0	0	111.8	Y102 V105 C106 P177 L178 Q184 F185 A190 G191 L192	Y102-F188 AromaticContact CD2-CE2 3.89Å; Y102-F188 HydrophobicContact CD2-CE2 3.89Å; Y102-F188 HydrophobicContact CD2-CZ 4.26Å; Y102-F188 AromaticContact CE2-CE2 3.6Å; Y102-F188 HydrophobicContact CE2-CE2 3.6Å; Y102-F188 AromaticContact CE2-CZ 3.78Å; Y102-F188 HydrophobicContact CE2-CZ 3.78Å; V105-F188 HydrophobicContact CB-CD2 4.38Å; V105-F188 HydrophobicContact CB-CE2 4.37Å; V105-F188 HydrophobicContact CG1-CD2 3.64Å; V105-F188 HydrophobicContact CG1-CE2 3.77Å; C106-F188 HydrophobicContact CB-CD2 4.46Å; C106-F188 WeakPolarHBondContact SG-CD2 3.49Å; P177-F188 HydrophobicContact CB-CD1 3.83Å; P177-F188 HydrophobicContact CB-CE1 3.55Å; P177-F188 HydrophobicContact CB-CZ 4.26Å; L178-F188 HydrophobicContact CD2-CD1 4.37Å; L178-F188 HydrophobicContact CD2-CE1 4.27Å; Q184-F188 PolarHBondContact O-N 2.92Å; F185-F188 WeakPolarHBondContact O-CB 3.37Å; F185-F188 PolarHBondContact O-N 2.88Å; F188-A190 VanDerWaalsContact C-N 3.32Å; F188-A190 PolarHBondContact O-N 3.06Å; F188-G191 PolarHBondContact O-N 3.47Å; F188-L192 HydrophobicContact CE1-CD2 4.28Å; F188-L192 HydrophobicContact CZ-CD2 4.48Å; F188-L192 WeakPolarHBondContact O-CB 3.49Å; F188-L192 PolarHBondContact O-N 2.98Å
189	K	91.5	Very high	90	Very high	73 Å²	73	55.1 Å²	55.1	32%	0.317	29%	0.288	S	S	.	.	H	α-helix	trans	-56.4	-45.5	175.1	-178.4	175.6	177.8	-178.1	0	111.6	L178 F185 L192 C193 L238	L178-K189 HydrophobicContact CD2-CB 3.96Å; L178-K189 HydrophobicContact CD2-CG 4Å; F185-K189 PolarHBondContact O-N 3.41Å; K189-L192 PolarHBondContact O-N 3.22Å; K189-C193 PolarHBondContact O-N 2.86Å; K189-C193 PolarHBondContact O-SG 3.37Å; K189-L238 HydrophobicContact CD-CD2 4.38Å; K189-L238 HydrophobicContact CG-CD2 4.04Å
190	A	90.8	Very high	90.3	Very high	62 Å²	62	52.5 Å²	52.5	51%	0.512	28%	0.275	S	S	.	.	H	α-helix	trans	-65.2	-43.3	178.9	0	0	0	0	0	112.6	K186 R187 F188 C193 E194	K186-A190 PolarHBondContact O-N 3.47Å; R187-A190 PolarHBondContact O-N 2.87Å; F188-A190 VanDerWaalsContact C-N 3.32Å; F188-A190 PolarHBondContact O-N 3.06Å; A190-C193 PolarHBondContact O-N 3.28Å; A190-E194 WeakPolarHBondContact O-CB 3.39Å; A190-E194 PolarHBondContact O-N 3.17Å
191	G	92.5	Very high	90.4	Very high	12 Å²	12	54.8 Å²	54.8	12%	0.124	28%	0.283	C	S	.	.	H	α-helix	trans	-65.6	-35.6	177.1	0	0	0	0	0	113	M112 R187 F188 E194 F195	M112-G191 WeakPolarHBondContact CE-O 3.48Å; R187-G191 PolarHBondContact O-N 2.93Å; F188-G191 PolarHBondContact O-N 3.47Å; G191-E194 PolarHBondContact O-N 2.58Å; G191-F195 WeakPolarHBondContact O-CB 3.32Å; G191-F195 PolarHBondContact O-N 3.12Å
192	L	93.3	Very high	90.8	Very high	1 Å²	1	51.6 Å²	51.6	1%	0.005	26%	0.263	C	S	.	.	H	α-helix	trans	-64.9	-44.4	176	-170.8	67.8	0	0	0	111.3	V105 F137 L178 F188 K189 V196 T235 L239	V105-L192 HydrophobicContact CG1-CB 4.37Å; F137-L192 HydrophobicContact CE1-CD1 3.92Å; F137-L192 HydrophobicContact CZ-CD1 3.53Å; L178-L192 HydrophobicContact CD2-CD2 4.11Å; F188-L192 HydrophobicContact CE1-CD2 4.28Å; F188-L192 HydrophobicContact CZ-CD2 4.48Å; F188-L192 WeakPolarHBondContact O-CB 3.49Å; F188-L192 PolarHBondContact O-N 2.98Å; K189-L192 PolarHBondContact O-N 3.22Å; L192-V196 PolarHBondContact O-N 3.05Å; L192-T235 HydrophobicContact CD2-CG2 4.15Å; L192-L239 HydrophobicContact CD1-CD2 3.85Å; L192-L239 HydrophobicContact CD2-CD2 4.17Å; L192-L239 HydrophobicContact CD2-CG 4.46Å; L192-L239 HydrophobicContact CG-CD2 3.77Å
193	C	93.9	Very high	91.1	Very high	22 Å²	22	50.4 Å²	50.4	15%	0.149	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-43.7	172.8	-65.2	0	0	0	0	112.1	K189 A190 V196 R197 K242	K189-C193 PolarHBondContact O-N 2.86Å; K189-C193 PolarHBondContact O-SG 3.37Å; A190-C193 PolarHBondContact O-N 3.28Å; C193-V196 PolarHBondContact O-N 3.05Å; C193-R197 PolarHBondContact O-N 3.13Å; C193-R197 VanDerWaalsContact O-N 3.13Å; C193-K242 HydrophobicContact CB-CD 3.95Å; C193-K242 HydrophobicContact CB-CG 4.1Å
194	E	92.6	Very high	91.1	Very high	72 Å²	72	50.4 Å²	50.4	34%	0.336	24%	0.239	S	C	.	.	H	α-helix	trans	-69.3	-36.7	-179	-178.8	63.8	176.4	0	0	112.6	M112 A190 G191 R197 I198	M112-E194 HydrophobicContact CG-CG 4.49Å; A190-E194 WeakPolarHBondContact O-CB 3.39Å; A190-E194 PolarHBondContact O-N 3.17Å; G191-E194 PolarHBondContact O-N 2.58Å; E194-R197 VanDerWaalsContact CD-NH2 3.29Å; E194-R197 PolarHBondContact O-N 2.88Å; E194-R197 IonicContact OE1-CZ 3.26Å; E194-R197 IonicContact OE1-NE 3.05Å; E194-R197 IonicContact OE1-NH2 2.77Å; E194-R197 PolarHBondContact OE1-NH2 3.5Å; E194-R197 IonicContact OE2-CZ 3.04Å; E194-R197 IonicContact OE2-NE 3.09Å; E194-R197 PolarHBondContact OE2-NE 3.22Å; E194-R197 IonicContact OE2-NH2 3.93Å; E194-R197 PolarHBondContact OE2-NH2 2.98Å; E194-R197 VanDerWaalsContact OE2-NH2 3.16Å; E194-I198 HydrophobicContact CG-CD1 3.83Å; E194-I198 HydrophobicContact CG-CG1 4.48Å; E194-I198 WeakPolarHBondContact O-CB 3.21Å; E194-I198 WeakPolarHBondContact O-CG1 3.41Å; E194-I198 PolarHBondContact O-N 3.42Å; E194-I198 WeakPolarHBondContact OE1-CD1 3.28Å
195	F	94.9	Very high	91	Very high	2 Å²	2	52 Å²	52	1%	0.009	25%	0.25	C	C	.	.	H	α-helix	trans	-58	-49.3	173.7	175.5	-93.8	0	0	0	111.5	I101 M112 V115 V116 L134 F137 G191 I198 L199	I101-F195 HydrophobicContact CG2-CD2 4.2Å; I101-F195 HydrophobicContact CG2-CE2 3.68Å; I101-F195 HydrophobicContact CG2-CZ 3.99Å; M112-F195 HydrophobicContact CG-CB 4.21Å; M112-F195 HydrophobicContact CG-CD2 4.47Å; M112-F195 HydrophobicContact SD-CB 3.9Å; M112-F195 HydrophobicContact SD-CD2 3.89Å; M112-F195 HydrophobicContact SD-CG 4.4Å; V115-F195 HydrophobicContact CG1-CE2 4.43Å; V116-F195 HydrophobicContact CG2-CD2 3.69Å; V116-F195 HydrophobicContact CG2-CE2 3.64Å; V116-F195 HydrophobicContact CG2-CZ 4.44Å; L134-F195 HydrophobicContact CD1-CE1 3.78Å; L134-F195 HydrophobicContact CD1-CZ 4.03Å; F137-F195 HydrophobicContact CD1-CE1 4.23Å; F137-F195 AromaticContact CE1-CD1 3.83Å; F137-F195 HydrophobicContact CE1-CD1 3.83Å; F137-F195 AromaticContact CE1-CE1 3.74Å; F137-F195 HydrophobicContact CE1-CE1 3.74Å; F137-F195 HydrophobicContact CE1-CZ 4.35Å; F137-F195 HydrophobicContact CZ-CD1 4.32Å; G191-F195 WeakPolarHBondContact O-CB 3.32Å; G191-F195 PolarHBondContact O-N 3.12Å; F195-I198 PolarHBondContact O-N 3.4Å; F195-L199 HydrophobicContact CE1-CD2 4.26Å; F195-L199 VanDerWaalsContact O-CB 3.3Å; F195-L199 WeakPolarHBondContact O-CB 3.34Å; F195-L199 PolarHBondContact O-N 3.4Å
196	V	94.1	Very high	91.1	Very high	9 Å²	9	52.7 Å²	52.7	6%	0.055	26%	0.261	C	S	.	.	H	α-helix	trans	-63.1	-43.8	178	176.4	0	0	0	0	111.5	L192 C193 I198 L199 V200 L239 K242 L243	L192-V196 PolarHBondContact O-N 3.05Å; C193-V196 PolarHBondContact O-N 3.05Å; V196-I198 VanDerWaalsContact C-N 3.34Å; V196-I198 PolarHBondContact O-N 2.76Å; V196-L199 WeakPolarHBondContact O-CB 3.41Å; V196-L199 PolarHBondContact O-N 3.02Å; V196-V200 PolarHBondContact O-N 3.14Å; V196-V200 VanDerWaalsContact O-N 3.11Å; V196-L239 HydrophobicContact CG2-CD2 3.4Å; V196-L239 VanDerWaalsContact CG2-CD2 3.4Å; V196-K242 HydrophobicContact CB-CB 4.36Å; V196-K242 HydrophobicContact CG1-CB 4.15Å; V196-L243 HydrophobicContact CG1-CB 3.88Å; V196-L243 HydrophobicContact CG1-CD1 3.95Å
197	R	92.6	Very high	91.1	Very high	98 Å²	98	45.9 Å²	45.9	37%	0.37	23%	0.233	S	C	.	.	H	α-helix	trans	-60.6	-42.8	178.8	-166.1	-166.9	65.7	71.8	3.5	111.8	C193 E194 H201	C193-R197 PolarHBondContact O-N 3.13Å; C193-R197 VanDerWaalsContact O-N 3.13Å; E194-R197 VanDerWaalsContact CD-NH2 3.29Å; E194-R197 PolarHBondContact O-N 2.88Å; E194-R197 IonicContact OE1-CZ 3.26Å; E194-R197 IonicContact OE1-NE 3.05Å; E194-R197 IonicContact OE1-NH2 2.77Å; E194-R197 PolarHBondContact OE1-NH2 3.5Å; E194-R197 IonicContact OE2-CZ 3.04Å; E194-R197 IonicContact OE2-NE 3.09Å; E194-R197 PolarHBondContact OE2-NE 3.22Å; E194-R197 IonicContact OE2-NH2 3.93Å; E194-R197 PolarHBondContact OE2-NH2 2.98Å; E194-R197 VanDerWaalsContact OE2-NH2 3.16Å; R197-H201 WeakPolarHBondContact O-CB 3.25Å; R197-H201 PolarHBondContact O-N 3.34Å
198	I	93.1	Very high	91.1	Very high	11 Å²	11	39 Å²	39	6%	0.056	21%	0.207	C	C	.	.	H	α-helix	trans	-70.2	-40.4	176.3	-69.1	171.4	0	0	0	111.1	M112 V113 V116 E194 F195 V196 V200 H201 S202	M112-I198 HydrophobicContact CB-CD1 3.67Å; M112-I198 HydrophobicContact CG-CD1 3.84Å; V113-I198 HydrophobicContact CG2-CD1 3.99Å; V113-I198 HydrophobicContact CG2-CG2 4.26Å; V116-I198 HydrophobicContact CB-CG2 3.91Å; V116-I198 HydrophobicContact CG1-CG2 4.08Å; V116-I198 HydrophobicContact CG2-CB 4.33Å; V116-I198 HydrophobicContact CG2-CG2 3.81Å; E194-I198 HydrophobicContact CG-CD1 3.83Å; E194-I198 HydrophobicContact CG-CG1 4.48Å; E194-I198 WeakPolarHBondContact O-CB 3.21Å; E194-I198 WeakPolarHBondContact O-CG1 3.41Å; E194-I198 PolarHBondContact O-N 3.42Å; E194-I198 WeakPolarHBondContact OE1-CD1 3.28Å; F195-I198 PolarHBondContact O-N 3.4Å; V196-I198 VanDerWaalsContact C-N 3.34Å; V196-I198 PolarHBondContact O-N 2.76Å; I198-V200 PolarHBondContact O-N 3.49Å; I198-H201 PolarHBondContact O-N 3.25Å; I198-S202 WeakPolarHBondContact O-CB 3.29Å; I198-S202 PolarHBondContact O-N 3.37Å; I198-S202 PolarHBondContact O-OG 2.84Å
199	L	94.1	Very high	91	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.016	22%	0.216	C	C	.	.	H	α-helix	trans	-54.8	-51.4	177.4	173.3	59	0	0	0	111.8	V116 W119 L120 L134 F195 V196 S202 C203 F214	V116-L199 HydrophobicContact CG1-CD1 4.41Å; W119-L199 HydrophobicContact CE3-CD1 3.95Å; W119-L199 HydrophobicContact CH2-CD1 4.29Å; W119-L199 HydrophobicContact CZ3-CD1 3.44Å; W119-L199 VanDerWaalsContact CZ3-CD1 3.44Å; L120-L199 HydrophobicContact CD2-CD1 4.5Å; L134-L199 HydrophobicContact CD2-CD2 4.28Å; F195-L199 HydrophobicContact CE1-CD2 4.26Å; F195-L199 VanDerWaalsContact O-CB 3.3Å; F195-L199 WeakPolarHBondContact O-CB 3.34Å; F195-L199 PolarHBondContact O-N 3.4Å; V196-L199 WeakPolarHBondContact O-CB 3.41Å; V196-L199 PolarHBondContact O-N 3.02Å; L199-S202 PolarHBondContact O-N 3.48Å; L199-C203 PolarHBondContact O-N 3.38Å; L199-C203 PolarHBondContact O-SG 3.2Å; L199-F214 HydrophobicContact CG-CE1 4.42Å; L199-F214 HydrophobicContact CG-CZ 4.38Å
200	V	93.3	Very high	90.8	Very high	1 Å²	1	39 Å²	39	1%	0.006	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-44.2	176.6	-175	0	0	0	0	111.1	V196 I198 S202 C203 R204 V208 F214 L243 G246 L247 V250	V196-V200 PolarHBondContact O-N 3.14Å; V196-V200 VanDerWaalsContact O-N 3.11Å; I198-V200 PolarHBondContact O-N 3.49Å; V200-S202 VanDerWaalsContact C-N 3.3Å; V200-S202 PolarHBondContact O-N 3.34Å; V200-C203 PolarHBondContact O-N 2.94Å; V200-C203 VanDerWaalsContact O-N 3.11Å; V200-R204 PolarHBondContact O-N 2.83Å; V200-V208 HydrophobicContact CG1-CG2 4.41Å; V200-F214 HydrophobicContact CG2-CE1 3.96Å; V200-F214 HydrophobicContact CG2-CZ 4.46Å; V200-L243 HydrophobicContact CG2-CD1 3.45Å; V200-L243 VanDerWaalsContact CG2-CD1 3.45Å; V200-G246 WeakPolarHBondContact CG1-O 3.49Å; V200-L247 HydrophobicContact CG1-CD2 4.36Å; V200-V250 HydrophobicContact CG1-CG2 3.94Å
201	H	90	Very high	90.6	Very high	85 Å²	85	43.9 Å²	43.9	39%	0.394	22%	0.219	S	C	.	.	H	α-helix	trans	-63.6	-32.6	-178.4	-169.1	91.2	0	0	0	113.7	R197 I198 R204	R197-H201 WeakPolarHBondContact O-CB 3.25Å; R197-H201 PolarHBondContact O-N 3.34Å; I198-H201 PolarHBondContact O-N 3.25Å; H201-R204 VanDerWaalsContact CE1-CZ 3.43Å; H201-R204 VanDerWaalsContact NE2-CZ 3.31Å; H201-R204 PolarHBondContact NE2-NE 3.43Å; H201-R204 PolarHBondContact NE2-NH2 3.19Å; H201-R204 WeakPolarHBondContact O-CD 3.3Å; H201-R204 WeakPolarHBondContact O-CG 3.49Å; H201-R204 PolarHBondContact O-NE 2.86Å
202	S	90.7	Very high	90.5	Very high	46 Å²	46	45.7 Å²	45.7	32%	0.322	22%	0.224	S	C	.	.	H	α-helix	trans	-76.6	-28.1	175	-67.8	0	0	0	0	112.6	I198 L199 V200	I198-S202 WeakPolarHBondContact O-CB 3.29Å; I198-S202 PolarHBondContact O-N 3.37Å; I198-S202 PolarHBondContact O-OG 2.84Å; L199-S202 PolarHBondContact O-N 3.48Å; V200-S202 VanDerWaalsContact C-N 3.3Å; V200-S202 PolarHBondContact O-N 3.34Å
203	C	90.8	Very high	90.4	Very high	1 Å²	1	45.7 Å²	45.7	1%	0.007	22%	0.224	C	C	.	.	H	α-helix	trans	-85	-20.4	178.6	-69.4	0	0	0	0	114.6	L199 V200 N205 S206 L207 V208 F214	L199-C203 PolarHBondContact O-N 3.38Å; L199-C203 PolarHBondContact O-SG 3.2Å; V200-C203 PolarHBondContact O-N 2.94Å; V200-C203 VanDerWaalsContact O-N 3.11Å; C203-N205 PolarHBondContact O-N 3.11Å; C203-S206 CarbonylContact O-C 3.58Å; C203-S206 PolarHBondContact O-N 3.37Å; C203-L207 HydrophobicContact CB-CB 3.94Å; C203-L207 PolarHBondContact O-N 3.32Å; C203-V208 HydrophobicContact CB-CG2 3.67Å; C203-V208 PolarHBondContact O-N 3.02Å; C203-F214 HydrophobicContact CB-CE2 3.68Å; C203-F214 HydrophobicContact CB-CZ 3.81Å
204	R	87.1	Confident	90.4	Very high	96 Å²	96	44.6 Å²	44.6	36%	0.362	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-20.2	-167	72.3	-172.1	161.1	129.4	-3.2	118.8	V200 H201 Y209 V250	V200-R204 PolarHBondContact O-N 2.83Å; H201-R204 VanDerWaalsContact CE1-CZ 3.43Å; H201-R204 VanDerWaalsContact NE2-CZ 3.31Å; H201-R204 PolarHBondContact NE2-NE 3.43Å; H201-R204 PolarHBondContact NE2-NH2 3.19Å; H201-R204 WeakPolarHBondContact O-CD 3.3Å; H201-R204 WeakPolarHBondContact O-CG 3.49Å; H201-R204 PolarHBondContact O-NE 2.86Å; R204-Y209 WeakPolarHBondContact O-CE2 3.39Å; R204-Y209 PolarHBondContact O-OH 3.2Å; R204-V250 HydrophobicContact CB-CB 4.48Å; R204-V250 HydrophobicContact CB-CG1 4Å; R204-V250 HydrophobicContact CB-CG2 3.56Å
205	N	84	Confident	90.3	Very high	130 Å²	130	43.1 Å²	43.1	70%	0.695	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-100.9	0.6	-179.6	-68.1	-9.1	0	0	0	113.5	C203	C203-N205 PolarHBondContact O-N 3.11Å
206	S	86.8	Confident	90.2	Very high	67 Å²	67	44.8 Å²	44.8	47%	0.469	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-162.3	-70.8	-178.8	45.5	0	0	0	0	112.8	C203 V208 Y209	C203-S206 CarbonylContact O-C 3.58Å; C203-S206 PolarHBondContact O-N 3.37Å; S206-V208 PolarHBondContact O-N 3.45Å; S206-V208 VanDerWaalsContact O-N 3.09Å; S206-Y209 WeakPolarHBondContact O-CD2 3.34Å; S206-Y209 PolarHBondContact O-N 3.46Å
207	L	87.2	Confident	90.2	Very high	25 Å²	25	44.7 Å²	44.7	13%	0.131	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-72.8	-2.6	-168.2	-60.3	178.2	0	0	0	115.2	L120 Y123 C203 Y209 D210 F214	L120-L207 HydrophobicContact CD2-CD1 3.81Å; Y123-L207 HydrophobicContact CD1-CD1 4Å; Y123-L207 HydrophobicContact CE1-CD1 4.09Å; Y123-L207 HydrophobicContact CE1-CD2 4.17Å; C203-L207 HydrophobicContact CB-CB 3.94Å; C203-L207 PolarHBondContact O-N 3.32Å; L207-Y209 VanDerWaalsContact C-N 3.25Å; L207-D210 HydrophobicContact CD2-CB 4.28Å; L207-F214 WeakPolarHBondContact O-CD2 3.44Å; L207-F214 WeakPolarHBondContact O-CE2 3.32Å
208	V	88.7	Confident	90.3	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.012	21%	0.21	C	C	.	.	G	3₁₀ helix	trans	-72.2	-24	165.4	175.9	0	0	0	0	111.5	V200 C203 S206 F214 L247 L298 M301	V200-V208 HydrophobicContact CG1-CG2 4.41Å; C203-V208 HydrophobicContact CB-CG2 3.67Å; C203-V208 PolarHBondContact O-N 3.02Å; S206-V208 PolarHBondContact O-N 3.45Å; S206-V208 VanDerWaalsContact O-N 3.09Å; V208-F214 HydrophobicContact CB-CD2 4.47Å; V208-F214 HydrophobicContact CB-CE2 4.39Å; V208-F214 HydrophobicContact CG2-CD2 4.28Å; V208-F214 HydrophobicContact CG2-CE2 3.8Å; V208-F214 HydrophobicContact CG2-CZ 4.31Å; V208-L247 HydrophobicContact CG1-CD2 4.13Å; V208-L298 HydrophobicContact CG1-CD2 3.64Å; V208-M301 HydrophobicContact CG1-CE 3.91Å; V208-M301 WeakPolarHBondContact O-CE 3.42Å
209	Y	88.9	Confident	90.3	Very high	50 Å²	50	42.4 Å²	42.4	20%	0.196	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-111.7	24.2	-175.9	-37.2	-75.6	0	0	0	112.2	R204 S206 L207 E211 V254 N294 L298	R204-Y209 WeakPolarHBondContact O-CE2 3.39Å; R204-Y209 PolarHBondContact O-OH 3.2Å; S206-Y209 WeakPolarHBondContact O-CD2 3.34Å; S206-Y209 PolarHBondContact O-N 3.46Å; L207-Y209 VanDerWaalsContact C-N 3.25Å; Y209-E211 VanDerWaalsContact C-N 3.28Å; Y209-E211 PolarHBondContact O-N 2.84Å; Y209-V254 WeakPolarHBondContact OH-CG2 3.47Å; Y209-N294 HydrophobicContact CD1-CB 4.01Å; Y209-N294 WeakPolarHBondContact CD1-OD1 3.42Å; Y209-N294 HydrophobicContact CE1-CB 3.61Å; Y209-L298 HydrophobicContact CE1-CD1 3.96Å; Y209-L298 HydrophobicContact CE1-CG 3.97Å
210	D	86.9	Confident	90.3	Very high	24 Å²	24	42.5 Å²	42.5	13%	0.128	23%	0.227	C	C	.	.	S	Bend	trans	-87.8	7.9	-177.7	84.8	-10	0	0	0	114.7	Y123 R127 L207 F212 L213	Y123-D210 PolarHBondContact OH-OD2 2.92Å; R127-D210 PolarHBondContact NH1-O 3.1Å; L207-D210 HydrophobicContact CD2-CB 4.28Å; D210-F212 PolarHBondContact O-N 2.96Å; D210-F212 PolarHBondContact OD1-N 3.47Å; D210-L213 PolarHBondContact OD1-N 3.12Å
211	E	86.8	Confident	90.4	Very high	164 Å²	164	42.6 Å²	42.6	77%	0.766	23%	0.227	S	C	*	.	S	Bend	trans	53.5	4.5	-175.4	-65.2	-178.9	-175.6	0	0	115.5	Y209	Y209-E211 VanDerWaalsContact C-N 3.28Å; Y209-E211 PolarHBondContact O-N 2.84Å
212	F	90.2	Very high	90.7	Very high	51 Å²	51	40.4 Å²	40.4	22%	0.224	22%	0.22	C	C	.	.	S	Bend	trans	-121.9	-55.7	-168.9	-173	-95.3	0	0	0	113	Y123 R127 E128 L131 D210 S216	Y123-F212 HydrophobicContact CE2-CD1 4.32Å; Y123-F212 WeakPolarHBondContact OH-CD1 3.4Å; R127-F212 HydrophobicContact CB-CD1 4.12Å; R127-F212 HydrophobicContact CB-CE1 3.88Å; E128-F212 HydrophobicContact CG-CZ 4.04Å; L131-F212 HydrophobicContact CD2-CD1 4.4Å; L131-F212 HydrophobicContact CD2-CE1 3.72Å; L131-F212 HydrophobicContact CD2-CZ 4.17Å; D210-F212 PolarHBondContact O-N 2.96Å; D210-F212 PolarHBondContact OD1-N 3.47Å; F212-S216 WeakPolarHBondContact O-CB 3.44Å; F212-S216 PolarHBondContact O-N 3.04Å; F212-S216 VanDerWaalsContact O-N 3.12Å; F212-S216 PolarHBondContact O-OG 2.73Å
213	L	91.7	Very high	90.9	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-64.3	-60.1	-169	174.2	53.7	0	0	0	112.1	W119 Y123 L131 L134 D210 L217	W119-L213 HydrophobicContact CH2-CD1 3.74Å; W119-L213 HydrophobicContact CH2-CD2 3.95Å; W119-L213 HydrophobicContact CZ2-CD1 4.39Å; W119-L213 HydrophobicContact CZ3-CD2 4.31Å; Y123-L213 HydrophobicContact CE1-CB 4.47Å; Y123-L213 HydrophobicContact CE1-CD2 4.26Å; Y123-L213 HydrophobicContact CE2-CB 4.37Å; Y123-L213 HydrophobicContact CE2-CD1 4.19Å; L131-L213 HydrophobicContact CD1-CD1 4.27Å; L134-L213 HydrophobicContact CD2-CD1 4.26Å; D210-L213 PolarHBondContact OD1-N 3.12Å; L213-L217 WeakPolarHBondContact O-CB 3.46Å; L213-L217 PolarHBondContact O-N 3.03Å
214	F	93.1	Very high	91.1	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-75.2	-39.3	-174.2	-66.6	-79.2	0	0	0	113.2	L199 V200 C203 L207 V208 S216 L217 L218 L243 M301	L199-F214 HydrophobicContact CG-CE1 4.42Å; L199-F214 HydrophobicContact CG-CZ 4.38Å; V200-F214 HydrophobicContact CG2-CE1 3.96Å; V200-F214 HydrophobicContact CG2-CZ 4.46Å; C203-F214 HydrophobicContact CB-CE2 3.68Å; C203-F214 HydrophobicContact CB-CZ 3.81Å; L207-F214 WeakPolarHBondContact O-CD2 3.44Å; L207-F214 WeakPolarHBondContact O-CE2 3.32Å; V208-F214 HydrophobicContact CB-CD2 4.47Å; V208-F214 HydrophobicContact CB-CE2 4.39Å; V208-F214 HydrophobicContact CG2-CD2 4.28Å; V208-F214 HydrophobicContact CG2-CE2 3.8Å; V208-F214 HydrophobicContact CG2-CZ 4.31Å; F214-S216 PolarHBondContact O-N 3.26Å; F214-L217 HydrophobicContact CD1-CD2 4.37Å; F214-L217 PolarHBondContact O-N 3.3Å; F214-L218 VanDerWaalsContact O-CB 3.28Å; F214-L218 WeakPolarHBondContact O-CB 3.4Å; F214-L218 VanDerWaalsContact O-CG 3.29Å; F214-L218 WeakPolarHBondContact O-CG 3.17Å; F214-L218 PolarHBondContact O-N 2.83Å; F214-L243 HydrophobicContact CD1-CD1 3.8Å; F214-L243 HydrophobicContact CE1-CD1 3.77Å; F214-M301 HydrophobicContact CB-SD 3.53Å; F214-M301 VanDerWaalsContact CB-SD 3.53Å
215	P	92.4	Very high	91.5	Very high	40 Å²	40	35.1 Å²	35.1	26%	0.26	20%	0.202	S	C	.	.	H	α-helix	trans	-58.4	-45.5	171.2	-28.7	38.2	0	0	0	113.3	L218 A219	P215-L218 PolarHBondContact O-N 3.45Å; P215-A219 WeakPolarHBondContact O-CB 3.2Å; P215-A219 PolarHBondContact O-N 2.98Å
216	S	92.5	Very high	92.1	Very high	38 Å²	38	33.6 Å²	33.6	27%	0.266	19%	0.194	S	C	.	.	H	α-helix	trans	-67.1	-41.2	178.5	-56.5	0	0	0	0	112.5	F212 F214 A219 L220	F212-S216 WeakPolarHBondContact O-CB 3.44Å; F212-S216 PolarHBondContact O-N 3.04Å; F212-S216 VanDerWaalsContact O-N 3.12Å; F212-S216 PolarHBondContact O-OG 2.73Å; F214-S216 PolarHBondContact O-N 3.26Å; S216-A219 PolarHBondContact O-N 2.92Å; S216-L220 PolarHBondContact O-N 3.34Å; S216-L220 VanDerWaalsContact O-N 3.13Å
217	L	93.4	Very high	92.3	Very high	7 Å²	7	31.1 Å²	31.1	4%	0.037	18%	0.177	C	C	.	.	H	α-helix	trans	-62	-43.7	174.6	177.3	61.7	0	0	0	111.4	L134 I138 L213 F214 L220 L221 L243	L134-L217 HydrophobicContact CD2-CD1 4.16Å; L134-L217 HydrophobicContact CD2-CD2 4.16Å; I138-L217 HydrophobicContact CD1-CD1 3.49Å; I138-L217 VanDerWaalsContact CD1-CD1 3.49Å; L213-L217 WeakPolarHBondContact O-CB 3.46Å; L213-L217 PolarHBondContact O-N 3.03Å; F214-L217 HydrophobicContact CD1-CD2 4.37Å; F214-L217 PolarHBondContact O-N 3.3Å; L217-L220 PolarHBondContact O-N 3.34Å; L217-L221 HydrophobicContact CD1-CD1 3.97Å; L217-L221 HydrophobicContact CD1-CG 4.09Å; L217-L221 HydrophobicContact CG-CD1 3.89Å; L217-L221 HydrophobicContact CG-CG 4.4Å; L217-L221 WeakPolarHBondContact O-CB 3.38Å; L217-L221 VanDerWaalsContact O-CG 3.25Å; L217-L221 WeakPolarHBondContact O-CG 3.17Å; L217-L221 PolarHBondContact O-N 3.03Å; L217-L243 HydrophobicContact CD2-CD1 4.32Å; L217-L243 HydrophobicContact CD2-CD2 4.04Å; L217-L243 HydrophobicContact CG-CD2 4.35Å
218	L	93.9	Very high	92.4	Very high	11 Å²	11	37.2 Å²	37.2	6%	0.058	21%	0.205	C	C	.	.	H	α-helix	trans	-64.5	-40.6	176.8	-79.6	172.2	0	0	0	112.4	F214 P215 L221 T222 L243 M301 T305	F214-L218 VanDerWaalsContact O-CB 3.28Å; F214-L218 WeakPolarHBondContact O-CB 3.4Å; F214-L218 VanDerWaalsContact O-CG 3.29Å; F214-L218 WeakPolarHBondContact O-CG 3.17Å; F214-L218 PolarHBondContact O-N 2.83Å; P215-L218 PolarHBondContact O-N 3.45Å; L218-L221 PolarHBondContact O-N 3.2Å; L218-T222 VanDerWaalsContact O-CB 3.25Å; L218-T222 WeakPolarHBondContact O-CB 3.47Å; L218-T222 PolarHBondContact O-N 3.35Å; L218-T222 PolarHBondContact O-OG1 2.99Å; L218-L243 HydrophobicContact CD2-CD2 3.62Å; L218-L243 HydrophobicContact CG-CD2 3.93Å; L218-M301 HydrophobicContact CD1-CB 3.93Å; L218-M301 HydrophobicContact CD1-CG 3.97Å; L218-M301 HydrophobicContact CD1-SD 4.27Å; L218-T305 HydrophobicContact CD2-CG2 4.05Å; L218-T305 WeakPolarHBondContact CD2-OG1 3.17Å
219	A	93.9	Very high	92.5	Very high	50 Å²	50	38.5 Å²	38.5	41%	0.413	21%	0.213	S	C	.	.	H	α-helix	trans	-60.3	-46.1	175.7	0	0	0	0	0	111.8	P215 S216 G223	P215-A219 WeakPolarHBondContact O-CB 3.2Å; P215-A219 PolarHBondContact O-N 2.98Å; S216-A219 PolarHBondContact O-N 2.92Å; A219-G223 PolarHBondContact O-N 3.08Å; A219-G223 VanDerWaalsContact O-N 3.09Å
220	L	94.1	Very high	92.6	Very high	5 Å²	5	41.4 Å²	41.4	3%	0.026	22%	0.223	C	C	.	.	H	α-helix	trans	-66	-47.1	175.8	176.5	65.7	0	0	0	112.1	I135 I162 S216 L217 T222 G223 L224	I135-L220 HydrophobicContact CB-CD2 4.09Å; I135-L220 HydrophobicContact CD1-CD2 4.12Å; I135-L220 HydrophobicContact CG1-CD2 3.6Å; I135-L220 HydrophobicContact CG2-CD2 3.77Å; I162-L220 HydrophobicContact CD1-CD1 4.24Å; I162-L220 HydrophobicContact CG1-CD1 4.35Å; S216-L220 PolarHBondContact O-N 3.34Å; S216-L220 VanDerWaalsContact O-N 3.13Å; L217-L220 PolarHBondContact O-N 3.34Å; L220-T222 VanDerWaalsContact C-N 3.28Å; L220-T222 PolarHBondContact O-N 2.94Å; L220-G223 PolarHBondContact O-N 3.19Å; L220-L224 HydrophobicContact CD1-CD1 4.02Å; L220-L224 HydrophobicContact CD1-CG 4.09Å; L220-L224 HydrophobicContact CD2-CD1 4.34Å; L220-L224 HydrophobicContact CG-CD1 3.84Å; L220-L224 HydrophobicContact CG-CG 4.34Å; L220-L224 WeakPolarHBondContact O-CB 3.28Å; L220-L224 WeakPolarHBondContact O-CG 3.33Å; L220-L224 PolarHBondContact O-N 3.01Å
221	L	95.9	Very high	92.8	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-61.3	-39	-179.6	-74.2	175.4	0	0	0	111.6	I138 L217 L218 L224 S225 S236 L239 A240 L243	I138-L221 HydrophobicContact CD1-CD2 4.34Å; I138-L221 HydrophobicContact CG2-CD2 4.34Å; L217-L221 HydrophobicContact CD1-CD1 3.97Å; L217-L221 HydrophobicContact CD1-CG 4.09Å; L217-L221 HydrophobicContact CG-CD1 3.89Å; L217-L221 HydrophobicContact CG-CG 4.4Å; L217-L221 WeakPolarHBondContact O-CB 3.38Å; L217-L221 VanDerWaalsContact O-CG 3.25Å; L217-L221 WeakPolarHBondContact O-CG 3.17Å; L217-L221 PolarHBondContact O-N 3.03Å; L218-L221 PolarHBondContact O-N 3.2Å; L221-L224 PolarHBondContact O-N 3.2Å; L221-S225 VanDerWaalsContact O-CB 3.31Å; L221-S225 WeakPolarHBondContact O-CB 3.37Å; L221-S225 PolarHBondContact O-N 3.02Å; L221-S236 WeakPolarHBondContact O-CB 3.43Å; L221-S236 PolarHBondContact O-OG 3.41Å; L221-L239 HydrophobicContact CD1-CB 4.24Å; L221-L239 HydrophobicContact CD2-CB 3.78Å; L221-L239 HydrophobicContact CD2-CD1 3.92Å; L221-A240 HydrophobicContact CB-CB 4.32Å; L221-A240 HydrophobicContact CD1-CB 4.35Å; L221-L243 HydrophobicContact CD1-CD2 4.08Å
222	T	96.2	Very high	93.1	Very high	40 Å²	40	32.6 Å²	32.6	25%	0.245	18%	0.181	C	C	.	.	H	α-helix	trans	-62.1	-51.3	174.8	-56.8	0	0	0	0	110.6	L218 L220 L224 S225 D226 V309	L218-T222 VanDerWaalsContact O-CB 3.25Å; L218-T222 WeakPolarHBondContact O-CB 3.47Å; L218-T222 PolarHBondContact O-N 3.35Å; L218-T222 PolarHBondContact O-OG1 2.99Å; L220-T222 VanDerWaalsContact C-N 3.28Å; L220-T222 PolarHBondContact O-N 2.94Å; T222-L224 PolarHBondContact O-N 2.97Å; T222-S225 WeakPolarHBondContact O-CA 3.32Å; T222-S225 WeakPolarHBondContact O-CB 3.42Å; T222-S225 PolarHBondContact O-N 3.07Å; T222-S225 PolarHBondContact O-OG 3.23Å; T222-D226 PolarHBondContact O-N 3.45Å; T222-V309 HydrophobicContact CG2-CG2 4.3Å
223	G	94.8	Very high	93.3	Very high	29 Å²	29	31.2 Å²	31.2	30%	0.299	18%	0.175	S	C	.	.	H	α-helix	trans	-59	-43.3	176.4	0	0	0	0	0	113.4	A219 L220 S225 D226 S227	A219-G223 PolarHBondContact O-N 3.08Å; A219-G223 VanDerWaalsContact O-N 3.09Å; L220-G223 PolarHBondContact O-N 3.19Å; G223-S225 PolarHBondContact O-N 2.86Å; G223-D226 PolarHBondContact O-N 2.84Å; G223-S227 PolarHBondContact O-N 2.7Å
224	L	94.6	Very high	93.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-32.1	174.5	-74.4	169	0	0	0	111.7	I138 I162 L220 L221 T222 D226 S227 F232 R233 S236	I138-L224 HydrophobicContact CG2-CD1 4Å; I162-L224 HydrophobicContact CD1-CD2 4.07Å; I162-L224 HydrophobicContact CD1-CG 3.96Å; I162-L224 HydrophobicContact CG1-CD2 3.78Å; I162-L224 HydrophobicContact CG1-CG 4.18Å; I162-L224 HydrophobicContact CG2-CD2 4.38Å; L220-L224 HydrophobicContact CD1-CD1 4.02Å; L220-L224 HydrophobicContact CD1-CG 4.09Å; L220-L224 HydrophobicContact CD2-CD1 4.34Å; L220-L224 HydrophobicContact CG-CD1 3.84Å; L220-L224 HydrophobicContact CG-CG 4.34Å; L220-L224 WeakPolarHBondContact O-CB 3.28Å; L220-L224 WeakPolarHBondContact O-CG 3.33Å; L220-L224 PolarHBondContact O-N 3.01Å; L221-L224 PolarHBondContact O-N 3.2Å; T222-L224 PolarHBondContact O-N 2.97Å; L224-D226 VanDerWaalsContact C-N 3.29Å; L224-D226 PolarHBondContact O-N 3.41Å; L224-S227 VanDerWaalsContact O-CB 3.29Å; L224-S227 WeakPolarHBondContact O-CB 3.31Å; L224-S227 PolarHBondContact O-N 2.8Å; L224-F232 HydrophobicContact CD2-CB 3.9Å; L224-F232 HydrophobicContact CD2-CD1 3.92Å; L224-F232 HydrophobicContact CD2-CD2 4.39Å; L224-F232 HydrophobicContact CD2-CG 3.84Å; L224-R233 WeakPolarHBondContact O-CA 3.47Å; L224-S236 WeakPolarHBondContact CB-OG 3.39Å; L224-S236 PolarHBondContact O-OG 3.44Å
225	S	96.6	Very high	93.6	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.014	18%	0.176	C	C	.	.	H	α-helix	trans	-73.9	-16.3	179.1	83.8	0	0	0	0	113.6	L221 T222 G223 R233 S236 R313	L221-S225 VanDerWaalsContact O-CB 3.31Å; L221-S225 WeakPolarHBondContact O-CB 3.37Å; L221-S225 PolarHBondContact O-N 3.02Å; T222-S225 WeakPolarHBondContact O-CA 3.32Å; T222-S225 WeakPolarHBondContact O-CB 3.42Å; T222-S225 PolarHBondContact O-N 3.07Å; T222-S225 PolarHBondContact O-OG 3.23Å; G223-S225 PolarHBondContact O-N 2.86Å; S225-R233 WeakPolarHBondContact O-CD 3.31Å; S225-R233 WeakPolarHBondContact O-CG 3.22Å; S225-S236 VanDerWaalsContact CA-OG 3.23Å; S225-S236 WeakPolarHBondContact CA-OG 3.48Å; S225-S236 PolarHBondContact N-OG 3.04Å; S225-R313 WeakPolarHBondContact O-CD 3.49Å; S225-R313 PolarHBondContact O-NE 3.48Å
226	D	94.7	Very high	93.8	Very high	99 Å²	99	29.5 Å²	29.5	53%	0.529	16%	0.163	S	C	.	.	H	α-helix	trans	-97.1	-4.7	171.2	-152	52.6	0	0	0	113.5	T222 G223 L224 Q228 R313	T222-D226 PolarHBondContact O-N 3.45Å; G223-D226 PolarHBondContact O-N 2.84Å; L224-D226 VanDerWaalsContact C-N 3.29Å; L224-D226 PolarHBondContact O-N 3.41Å; D226-Q228 PolarHBondContact O-N 2.92Å; D226-R313 IonicContact OD1-NH2 3.16Å; D226-R313 PolarHBondContact OD1-NH2 3Å
227	S	92.6	Very high	94	Very high	14 Å²	14	27.7 Å²	27.7	10%	0.098	15%	0.151	C	C	.	.			trans	-58.5	135.8	175.9	-172.3	0	0	0	0	112.1	G223 L224 V229 R233	G223-S227 PolarHBondContact O-N 2.7Å; L224-S227 VanDerWaalsContact O-CB 3.29Å; L224-S227 WeakPolarHBondContact O-CB 3.31Å; L224-S227 PolarHBondContact O-N 2.8Å; S227-V229 PolarHBondContact O-N 2.87Å; S227-V229 PolarHBondContact OG-N 3.26Å; S227-R233 WeakPolarHBondContact O-CD 3.45Å; S227-R233 PolarHBondContact O-NH1 2.88Å
228	Q	89.1	Confident	94.2	Very high	153 Å²	153	27.6 Å²	27.6	72%	0.715	15%	0.15	S	C	*	.	S	Bend	trans	-63.7	-25.9	172.7	-62	-58.6	-37.4	0	0	111.9	D226 R230 R233	D226-Q228 PolarHBondContact O-N 2.92Å; Q228-R230 PolarHBondContact O-N 3.41Å; Q228-R230 VanDerWaalsContact O-N 3.16Å; Q228-R233 PolarHBondContact O-NH1 3.47Å
229	V	89.8	Confident	94.3	Very high	30 Å²	30	27.4 Å²	27.4	18%	0.182	15%	0.149	C	C	.	.			trans	-64	113.7	176.7	-176.8	0	0	0	0	110	T166 F169 S227 A231 F232 R233	T166-V229 HydrophobicContact CG2-CG2 3.65Å; F169-V229 HydrophobicContact CD2-CG1 4.49Å; S227-V229 PolarHBondContact O-N 2.87Å; S227-V229 PolarHBondContact OG-N 3.26Å; V229-A231 HydrophobicContact CG1-CB 4.34Å; V229-A231 PolarHBondContact O-N 3.4Å; V229-F232 HydrophobicContact CB-CB 4.36Å; V229-F232 HydrophobicContact CB-CD2 3.56Å; V229-F232 HydrophobicContact CB-CE2 4.19Å; V229-F232 HydrophobicContact CB-CG 4.23Å; V229-F232 HydrophobicContact CG1-CD2 3.76Å; V229-F232 HydrophobicContact CG1-CE2 4.15Å; V229-F232 HydrophobicContact CG1-CG 4.2Å; V229-F232 HydrophobicContact CG2-CD2 3.87Å; V229-F232 HydrophobicContact CG2-CE2 4.1Å; V229-F232 PolarHBondContact O-N 2.69Å; V229-R233 PolarHBondContact O-N 3.09Å
230	R	91.2	Very high	94.5	Very high	111 Å²	111	25 Å²	25	42%	0.419	13%	0.13	S	C	.	.	H	α-helix	trans	-48.7	-43.7	179.4	170.7	178.2	-62.3	176.8	1.8	113.2	Y176 Q228 H234 L318	Y176-R230 HydrophobicContact CE1-CG 3.61Å; Q228-R230 PolarHBondContact O-N 3.41Å; Q228-R230 VanDerWaalsContact O-N 3.16Å; R230-H234 WeakPolarHBondContact O-CB 3.48Å; R230-H234 PolarHBondContact O-N 3.38Å; R230-L318 HydrophobicContact CB-CD1 4.3Å; R230-L318 HydrophobicContact CG-CD1 3.67Å
231	A	91.8	Very high	94.6	Very high	2 Å²	2	24.8 Å²	24.8	2%	0.017	13%	0.128	C	C	.	.	H	α-helix	trans	-71	-44.6	-172.5	0	0	0	0	0	112.7	C142 F169 Y176 V229 T235	C142-A231 VanDerWaalsContact O-CB 3.32Å; C142-A231 WeakPolarHBondContact O-CB 3.18Å; F169-A231 HydrophobicContact CE2-CB 3.91Å; F169-A231 HydrophobicContact CZ-CB 3.62Å; Y176-A231 HydrophobicContact CD1-CB 3.81Å; Y176-A231 HydrophobicContact CD2-CB 3.74Å; Y176-A231 HydrophobicContact CE1-CB 4.38Å; Y176-A231 HydrophobicContact CE2-CB 4.31Å; Y176-A231 HydrophobicContact CG-CB 3.48Å; Y176-A231 VanDerWaalsContact CG-CB 3.48Å; V229-A231 HydrophobicContact CG1-CB 4.34Å; V229-A231 PolarHBondContact O-N 3.4Å; A231-T235 WeakPolarHBondContact O-CB 3.31Å; A231-T235 PolarHBondContact O-N 3.42Å; A231-T235 PolarHBondContact O-OG1 3.37Å
232	F	93.4	Very high	94.6	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-58.1	-54.5	169.8	-65.4	-37.6	0	0	0	110.3	C142 C144 L165 F169 L224 V229 H234 T235 S236	C142-F232 HydrophobicContact CB-CD1 3.58Å; C142-F232 HydrophobicContact CB-CE1 3.97Å; C144-F232 HydrophobicContact CB-CE1 3.78Å; C144-F232 HydrophobicContact CB-CZ 4.11Å; L165-F232 HydrophobicContact CB-CE2 4.38Å; L165-F232 HydrophobicContact CB-CZ 3.88Å; F169-F232 HydrophobicContact CD2-CE1 4.07Å; F169-F232 HydrophobicContact CD2-CE2 4.33Å; F169-F232 AromaticContact CD2-CZ 3.75Å; F169-F232 HydrophobicContact CD2-CZ 3.75Å; F169-F232 HydrophobicContact CE2-CE1 4.42Å; F169-F232 HydrophobicContact CE2-CZ 4.49Å; L224-F232 HydrophobicContact CD2-CB 3.9Å; L224-F232 HydrophobicContact CD2-CD1 3.92Å; L224-F232 HydrophobicContact CD2-CD2 4.39Å; L224-F232 HydrophobicContact CD2-CG 3.84Å; V229-F232 HydrophobicContact CB-CB 4.36Å; V229-F232 HydrophobicContact CB-CD2 3.56Å; V229-F232 HydrophobicContact CB-CE2 4.19Å; V229-F232 HydrophobicContact CB-CG 4.23Å; V229-F232 HydrophobicContact CG1-CD2 3.76Å; V229-F232 HydrophobicContact CG1-CE2 4.15Å; V229-F232 HydrophobicContact CG1-CG 4.2Å; V229-F232 HydrophobicContact CG2-CD2 3.87Å; V229-F232 HydrophobicContact CG2-CE2 4.1Å; V229-F232 PolarHBondContact O-N 2.69Å; F232-H234 PolarHBondContact O-N 2.9Å; F232-T235 PolarHBondContact O-N 2.94Å; F232-S236 WeakPolarHBondContact O-CB 3.45Å; F232-S236 PolarHBondContact O-N 3.35Å; F232-S236 PolarHBondContact O-OG 3.24Å; F232-S236 VanDerWaalsContact O-OG 3.11Å
233	R	94.7	Very high	94.6	Very high	22 Å²	22	24.6 Å²	24.6	8%	0.083	12%	0.124	C	C	.	.	H	α-helix	trans	-62.2	-42.6	-172.6	-175	160.9	83	-97.4	-2.3	114.4	L224 S225 S227 Q228 V229 T237 D316 I321	L224-R233 WeakPolarHBondContact O-CA 3.47Å; S225-R233 WeakPolarHBondContact O-CD 3.31Å; S225-R233 WeakPolarHBondContact O-CG 3.22Å; S227-R233 WeakPolarHBondContact O-CD 3.45Å; S227-R233 PolarHBondContact O-NH1 2.88Å; Q228-R233 PolarHBondContact O-NH1 3.47Å; V229-R233 PolarHBondContact O-N 3.09Å; R233-T237 VanDerWaalsContact O-CB 3.26Å; R233-T237 WeakPolarHBondContact O-CB 3.35Å; R233-T237 PolarHBondContact O-N 3.38Å; R233-T237 VanDerWaalsContact O-N 3.13Å; R233-T237 PolarHBondContact O-OG1 3.44Å; R233-D316 WeakPolarHBondContact CD-OD2 3.42Å; R233-D316 IonicContact CZ-OD1 2.7Å; R233-D316 IonicContact CZ-OD2 2.7Å; R233-D316 IonicContact NE-OD1 2.73Å; R233-D316 IonicContact NE-OD2 3.86Å; R233-D316 PolarHBondContact NE-OD2 2.87Å; R233-D316 IonicContact NH2-OD1 2.58Å; R233-D316 PolarHBondContact NH2-OD1 2.89Å; R233-D316 IonicContact NH2-OD2 3.71Å; R233-I321 HydrophobicContact CG-CD1 4.11Å
234	H	94.8	Very high	94.6	Very high	4 Å²	4	23.2 Å²	23.2	2%	0.019	11%	0.11	C	C	.	.	H	α-helix	trans	-66.7	-46.4	176.8	-174.9	-175.1	0	0	0	111	Y176 R230 F232 T237 L238 I321	Y176-H234 HydrophobicContact CE2-CB 4.07Å; Y176-H234 AromaticContact CE2-ND1 3.74Å; Y176-H234 AromaticContact CZ-ND1 3.73Å; Y176-H234 PolarHBondContact OH-ND1 3.19Å; R230-H234 WeakPolarHBondContact O-CB 3.48Å; R230-H234 PolarHBondContact O-N 3.38Å; F232-H234 PolarHBondContact O-N 2.9Å; H234-T237 PolarHBondContact O-N 2.98Å; H234-L238 WeakPolarHBondContact O-CB 3.24Å; H234-L238 PolarHBondContact O-N 2.86Å; H234-I321 HydrophobicContact CB-CD1 3.86Å; H234-I321 HydrophobicContact CB-CG1 3.97Å
235	T	95.5	Very high	94.7	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68.5	-45.7	-175.2	-47	0	0	0	0	111.8	C142 L178 L192 A231 F232 L238 L239	C142-T235 VanDerWaalsContact SG-CB 3.53Å; L178-T235 HydrophobicContact CD1-CG2 4.12Å; L192-T235 HydrophobicContact CD2-CG2 4.15Å; A231-T235 WeakPolarHBondContact O-CB 3.31Å; A231-T235 PolarHBondContact O-N 3.42Å; A231-T235 PolarHBondContact O-OG1 3.37Å; F232-T235 PolarHBondContact O-N 2.94Å; T235-L238 PolarHBondContact O-N 2.7Å; T235-L239 HydrophobicContact CG2-CD1 4.14Å; T235-L239 WeakPolarHBondContact O-CB 3.48Å; T235-L239 VanDerWaalsContact O-CG 3.24Å; T235-L239 WeakPolarHBondContact O-CG 3.25Å; T235-L239 PolarHBondContact O-N 3Å
236	S	96.1	Very high	94.7	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-68.1	-35.3	177.8	68.8	0	0	0	0	112.8	L221 L224 S225 F232 L239 A240	L221-S236 WeakPolarHBondContact O-CB 3.43Å; L221-S236 PolarHBondContact O-OG 3.41Å; L224-S236 WeakPolarHBondContact CB-OG 3.39Å; L224-S236 PolarHBondContact O-OG 3.44Å; S225-S236 VanDerWaalsContact CA-OG 3.23Å; S225-S236 WeakPolarHBondContact CA-OG 3.48Å; S225-S236 PolarHBondContact N-OG 3.04Å; F232-S236 WeakPolarHBondContact O-CB 3.45Å; F232-S236 PolarHBondContact O-N 3.35Å; F232-S236 PolarHBondContact O-OG 3.24Å; F232-S236 VanDerWaalsContact O-OG 3.11Å; S236-L239 PolarHBondContact O-N 3.36Å; S236-A240 VanDerWaalsContact O-CB 3.24Å; S236-A240 WeakPolarHBondContact O-CB 3.16Å; S236-A240 PolarHBondContact O-N 3.49Å
237	T	97.6	Very high	94.7	Very high	1 Å²	1	19.5 Å²	19.5	1%	0.006	9%	0.091	C	C	.	.	H	α-helix	trans	-63.5	-49.2	173.3	-55	0	0	0	0	110.4	R233 H234 L239 A240 M241 V309 R313 I321	R233-T237 VanDerWaalsContact O-CB 3.26Å; R233-T237 WeakPolarHBondContact O-CB 3.35Å; R233-T237 PolarHBondContact O-N 3.38Å; R233-T237 VanDerWaalsContact O-N 3.13Å; R233-T237 PolarHBondContact O-OG1 3.44Å; H234-T237 PolarHBondContact O-N 2.98Å; T237-L239 VanDerWaalsContact C-N 3.29Å; T237-L239 PolarHBondContact O-N 3.2Å; T237-A240 PolarHBondContact O-N 3.24Å; T237-A240 VanDerWaalsContact O-N 3.17Å; T237-M241 HydrophobicContact CG2-CG 3.92Å; T237-M241 VanDerWaalsContact O-CG 3.22Å; T237-M241 WeakPolarHBondContact O-CG 3.36Å; T237-M241 PolarHBondContact O-N 3.37Å; T237-V309 HydrophobicContact CG2-CG1 4.09Å; T237-R313 HydrophobicContact CG2-CB 3.74Å; T237-R313 HydrophobicContact CG2-CG 4Å; T237-I321 HydrophobicContact CG2-CG2 3.83Å
238	L	96.5	Very high	94.8	Very high	4 Å²	4	18.9 Å²	18.9	2%	0.021	9%	0.087	C	C	.	.	H	α-helix	trans	-57.2	-43.8	178.4	179.5	63.4	0	0	0	111.8	L178 K189 H234 T235 K242 A324	L178-L238 HydrophobicContact CD1-CD2 3.82Å; L178-L238 HydrophobicContact CD2-CD2 3.91Å; K189-L238 HydrophobicContact CD-CD2 4.38Å; K189-L238 HydrophobicContact CG-CD2 4.04Å; H234-L238 WeakPolarHBondContact O-CB 3.24Å; H234-L238 PolarHBondContact O-N 2.86Å; T235-L238 PolarHBondContact O-N 2.7Å; L238-K242 HydrophobicContact CD1-CG 4.47Å; L238-K242 WeakPolarHBondContact O-CB 3.43Å; L238-K242 WeakPolarHBondContact O-CG 3.33Å; L238-K242 PolarHBondContact O-N 2.8Å; L238-A324 HydrophobicContact CD1-CB 4.37Å
239	L	96.8	Very high	95.1	Very high	7 Å²	7	15 Å²	15	4%	0.037	7%	0.071	C	C	.	.	H	α-helix	trans	-62.6	-47.2	175.3	-71.3	168.4	0	0	0	112	I138 L192 V196 L221 T235 S236 T237 K242 L243	I138-L239 HydrophobicContact CB-CD1 4.34Å; I138-L239 HydrophobicContact CD1-CD1 4.41Å; I138-L239 HydrophobicContact CG1-CD1 3.9Å; I138-L239 HydrophobicContact CG2-CD1 3.72Å; L192-L239 HydrophobicContact CD1-CD2 3.85Å; L192-L239 HydrophobicContact CD2-CD2 4.17Å; L192-L239 HydrophobicContact CD2-CG 4.46Å; L192-L239 HydrophobicContact CG-CD2 3.77Å; V196-L239 HydrophobicContact CG2-CD2 3.4Å; V196-L239 VanDerWaalsContact CG2-CD2 3.4Å; L221-L239 HydrophobicContact CD1-CB 4.24Å; L221-L239 HydrophobicContact CD2-CB 3.78Å; L221-L239 HydrophobicContact CD2-CD1 3.92Å; T235-L239 HydrophobicContact CG2-CD1 4.14Å; T235-L239 WeakPolarHBondContact O-CB 3.48Å; T235-L239 VanDerWaalsContact O-CG 3.24Å; T235-L239 WeakPolarHBondContact O-CG 3.25Å; T235-L239 PolarHBondContact O-N 3Å; S236-L239 PolarHBondContact O-N 3.36Å; T237-L239 VanDerWaalsContact C-N 3.29Å; T237-L239 PolarHBondContact O-N 3.2Å; L239-K242 PolarHBondContact O-N 3.38Å; L239-L243 VanDerWaalsContact O-CB 3.22Å; L239-L243 WeakPolarHBondContact O-CB 3.45Å; L239-L243 PolarHBondContact O-N 3.46Å
240	A	97.4	Very high	95.3	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-65.4	-40.3	-179.8	0	0	0	0	0	112.8	L221 S236 T237 L243 M244 T305 V309	L221-A240 HydrophobicContact CB-CB 4.32Å; L221-A240 HydrophobicContact CD1-CB 4.35Å; S236-A240 VanDerWaalsContact O-CB 3.24Å; S236-A240 WeakPolarHBondContact O-CB 3.16Å; S236-A240 PolarHBondContact O-N 3.49Å; T237-A240 PolarHBondContact O-N 3.24Å; T237-A240 VanDerWaalsContact O-N 3.17Å; A240-L243 PolarHBondContact O-N 3.28Å; A240-M244 WeakPolarHBondContact O-CB 3.47Å; A240-M244 PolarHBondContact O-N 2.83Å; A240-T305 HydrophobicContact CB-CG2 4.35Å; A240-V309 HydrophobicContact CB-CB 4.48Å; A240-V309 HydrophobicContact CB-CG1 4.13Å; A240-V309 HydrophobicContact CB-CG2 4.18Å
241	M	97.1	Very high	95.4	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-69.3	-38.5	176.7	-54.4	-67.8	82.1	0	0	111.1	T237 M244 T245 T305 V309 F310 C325 E328 W332	T237-M241 HydrophobicContact CG2-CG 3.92Å; T237-M241 VanDerWaalsContact O-CG 3.22Å; T237-M241 WeakPolarHBondContact O-CG 3.36Å; T237-M241 PolarHBondContact O-N 3.37Å; M241-M244 WeakPolarHBondContact O-CB 3.31Å; M241-M244 PolarHBondContact O-N 3.38Å; M241-T245 PolarHBondContact O-N 3.26Å; M241-T245 PolarHBondContact O-OG1 2.85Å; M241-T305 HydrophobicContact CE-CG2 4.07Å; M241-V309 HydrophobicContact CE-CB 3.9Å; M241-V309 HydrophobicContact CE-CG1 3.74Å; M241-F310 HydrophobicContact CE-CB 4.07Å; M241-F310 HydrophobicContact SD-CB 4.01Å; M241-F310 HydrophobicContact SD-CD2 4Å; M241-C325 HydrophobicContact SD-CB 4.31Å; M241-E328 HydrophobicContact CB-CB 4.04Å; M241-E328 HydrophobicContact CB-CG 3.58Å; M241-W332 HydrophobicContact CB-CZ2 4.38Å; M241-W332 HydrophobicContact CE-CH2 4.29Å; M241-W332 HydrophobicContact SD-CH2 3.77Å; M241-W332 HydrophobicContact SD-CZ2 4.28Å
242	K	95.8	Very high	95.5	Very high	36 Å²	36	10.8 Å²	10.8	16%	0.157	6%	0.058	C	C	.	.	H	α-helix	trans	-68.7	-32.9	172.6	-73.3	-72.4	166.7	-155.6	0	113.2	C193 V196 L238 L239 T245 G246 E328	C193-K242 HydrophobicContact CB-CD 3.95Å; C193-K242 HydrophobicContact CB-CG 4.1Å; V196-K242 HydrophobicContact CB-CB 4.36Å; V196-K242 HydrophobicContact CG1-CB 4.15Å; L238-K242 HydrophobicContact CD1-CG 4.47Å; L238-K242 WeakPolarHBondContact O-CB 3.43Å; L238-K242 WeakPolarHBondContact O-CG 3.33Å; L238-K242 PolarHBondContact O-N 2.8Å; L239-K242 PolarHBondContact O-N 3.38Å; K242-T245 PolarHBondContact O-N 3.2Å; K242-G246 PolarHBondContact O-N 2.94Å; K242-G246 VanDerWaalsContact O-N 3.14Å; K242-E328 WeakPolarHBondContact CD-OE2 3.33Å; K242-E328 VanDerWaalsContact CE-CD 3.47Å; K242-E328 WeakPolarHBondContact CE-OE1 3.47Å; K242-E328 VanDerWaalsContact CE-OE2 3.31Å; K242-E328 WeakPolarHBondContact CE-OE2 3.49Å; K242-E328 IonicContact NZ-OE1 3.46Å; K242-E328 PolarHBondContact NZ-OE1 3.41Å; K242-E328 IonicContact NZ-OE2 3.9Å; K242-E328 PolarHBondContact NZ-OE2 3.4Å
243	L	95.8	Very high	95.5	Very high	2 Å²	2	12.4 Å²	12.4	1%	0.01	7%	0.071	C	C	.	.	H	α-helix	trans	-66.2	-45.6	174.4	-173.2	70.3	0	0	0	110.6	V196 V200 F214 L217 L218 L221 L239 A240 T245 G246 L247	V196-L243 HydrophobicContact CG1-CB 3.88Å; V196-L243 HydrophobicContact CG1-CD1 3.95Å; V200-L243 HydrophobicContact CG2-CD1 3.45Å; V200-L243 VanDerWaalsContact CG2-CD1 3.45Å; F214-L243 HydrophobicContact CD1-CD1 3.8Å; F214-L243 HydrophobicContact CE1-CD1 3.77Å; L217-L243 HydrophobicContact CD2-CD1 4.32Å; L217-L243 HydrophobicContact CD2-CD2 4.04Å; L217-L243 HydrophobicContact CG-CD2 4.35Å; L218-L243 HydrophobicContact CD2-CD2 3.62Å; L218-L243 HydrophobicContact CG-CD2 3.93Å; L221-L243 HydrophobicContact CD1-CD2 4.08Å; L239-L243 VanDerWaalsContact O-CB 3.22Å; L239-L243 WeakPolarHBondContact O-CB 3.45Å; L239-L243 PolarHBondContact O-N 3.46Å; A240-L243 PolarHBondContact O-N 3.28Å; L243-T245 PolarHBondContact O-N 3.46Å; L243-G246 PolarHBondContact O-N 3.15Å; L243-G246 VanDerWaalsContact O-N 3.15Å; L243-L247 WeakPolarHBondContact O-CG 3.44Å; L243-L247 PolarHBondContact O-N 2.93Å
244	M	96.1	Very high	95.4	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.005	7%	0.069	C	C	.	.	H	α-helix	trans	-54.2	-48.7	172.1	-176.8	71.3	-178.9	0	0	111.8	A240 M241 G246 L247 V248 M302 T305 F306 W332 F340	A240-M244 WeakPolarHBondContact O-CB 3.47Å; A240-M244 PolarHBondContact O-N 2.83Å; M241-M244 WeakPolarHBondContact O-CB 3.31Å; M241-M244 PolarHBondContact O-N 3.38Å; M244-G246 VanDerWaalsContact C-N 3.3Å; M244-G246 PolarHBondContact O-N 3.48Å; M244-L247 PolarHBondContact O-N 3.21Å; M244-V248 HydrophobicContact CE-CG2 4.37Å; M244-V248 WeakPolarHBondContact O-CG2 3.36Å; M244-V248 PolarHBondContact O-N 3Å; M244-M302 HydrophobicContact CE-CB 3.72Å; M244-M302 HydrophobicContact CE-CG 3.93Å; M244-M302 HydrophobicContact CE-SD 4.43Å; M244-M302 HydrophobicContact SD-CB 3.9Å; M244-M302 HydrophobicContact SD-CG 3.86Å; M244-T305 HydrophobicContact CB-CG2 4.02Å; M244-T305 HydrophobicContact SD-CG2 4.25Å; M244-F306 HydrophobicContact CE-CB 4.45Å; M244-W332 HydrophobicContact CB-CH2 4.38Å; M244-W332 HydrophobicContact CB-CZ2 3.67Å; M244-W332 HydrophobicContact CE-CE3 4.42Å; M244-W332 HydrophobicContact CG-CD2 4.03Å; M244-W332 VanDerWaalsContact CG-CE2 3.43Å; M244-W332 HydrophobicContact CG-CE3 4.4Å; M244-W332 HydrophobicContact CG-CH2 3.82Å; M244-W332 HydrophobicContact CG-CZ2 3.34Å; M244-W332 HydrophobicContact CG-CZ3 4.32Å; M244-F340 HydrophobicContact CE-CE1 3.85Å; M244-F340 HydrophobicContact CE-CZ 3.55Å
245	T	96.4	Very high	95.3	Very high	19 Å²	19	12.9 Å²	12.9	12%	0.117	8%	0.078	C	C	.	.	H	α-helix	trans	-57.4	-42.2	176.5	-52.8	0	0	0	0	111.9	M241 K242 L243 V248 D249 E328 L331 W332	M241-T245 PolarHBondContact O-N 3.26Å; M241-T245 PolarHBondContact O-OG1 2.85Å; K242-T245 PolarHBondContact O-N 3.2Å; L243-T245 PolarHBondContact O-N 3.46Å; T245-V248 PolarHBondContact O-N 3.38Å; T245-D249 PolarHBondContact O-N 3.49Å; T245-D249 VanDerWaalsContact O-N 3.09Å; T245-E328 PolarHBondContact OG1-OE2 3.18Å; T245-L331 HydrophobicContact CG2-CB 4.47Å; T245-L331 HydrophobicContact CG2-CD1 4.29Å; T245-W332 PolarHBondContact OG1-NE1 3Å
246	G	95	Very high	95.2	Very high	3 Å²	3	16.9 Å²	16.9	3%	0.031	10%	0.102	C	C	.	.	H	α-helix	trans	-66	-34	174.3	0	0	0	0	0	114.2	V200 K242 L243 M244 V250	V200-G246 WeakPolarHBondContact CG1-O 3.49Å; K242-G246 PolarHBondContact O-N 2.94Å; K242-G246 VanDerWaalsContact O-N 3.14Å; L243-G246 PolarHBondContact O-N 3.15Å; L243-G246 VanDerWaalsContact O-N 3.15Å; M244-G246 VanDerWaalsContact C-N 3.3Å; M244-G246 PolarHBondContact O-N 3.48Å; G246-V250 WeakPolarHBondContact O-CG2 3.37Å; G246-V250 PolarHBondContact O-N 3.42Å
247	L	94.6	Very high	95	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-69.7	-37.9	174.8	-68.6	172.1	0	0	0	111.6	V200 V208 L243 M244 V250 A251 L298 M301 M302	V200-L247 HydrophobicContact CG1-CD2 4.36Å; V208-L247 HydrophobicContact CG1-CD2 4.13Å; L243-L247 WeakPolarHBondContact O-CG 3.44Å; L243-L247 PolarHBondContact O-N 2.93Å; M244-L247 PolarHBondContact O-N 3.21Å; L247-V250 PolarHBondContact O-N 2.85Å; L247-A251 WeakPolarHBondContact O-CB 3.25Å; L247-A251 PolarHBondContact O-N 3.18Å; L247-L298 HydrophobicContact CD2-CD2 3.88Å; L247-M301 HydrophobicContact CD1-CB 3.96Å; L247-M301 HydrophobicContact CD2-CE 4.35Å; L247-M301 HydrophobicContact CD2-SD 4.48Å; L247-M302 HydrophobicContact CB-CG 3.98Å
248	V	95.8	Very high	94.8	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.006	13%	0.129	C	C	.	.	H	α-helix	trans	-61.8	-46.8	173.7	174.5	0	0	0	0	110.9	M244 T245 V250 A251 V252 M302 W332 T335 D336 F340	M244-V248 HydrophobicContact CE-CG2 4.37Å; M244-V248 WeakPolarHBondContact O-CG2 3.36Å; M244-V248 PolarHBondContact O-N 3Å; T245-V248 PolarHBondContact O-N 3.38Å; V248-V250 PolarHBondContact O-N 3.34Å; V248-A251 PolarHBondContact O-N 3.05Å; V248-A251 VanDerWaalsContact O-N 3.15Å; V248-V252 WeakPolarHBondContact O-CG2 3.13Å; V248-V252 PolarHBondContact O-N 3.13Å; V248-M302 HydrophobicContact CB-SD 4.37Å; V248-M302 HydrophobicContact CG2-SD 3.59Å; V248-M302 VanDerWaalsContact CG2-SD 3.59Å; V248-W332 HydrophobicContact CG2-CB 4.46Å; V248-W332 HydrophobicContact CG2-CG 4.2Å; V248-T335 HydrophobicContact CG1-CG2 4Å; V248-D336 HydrophobicContact CG1-CB 3.68Å; V248-F340 HydrophobicContact CG2-CE2 3.94Å; V248-F340 HydrophobicContact CG2-CZ 4.11Å
249	D	94.7	Very high	94.6	Very high	71 Å²	71	27.1 Å²	27.1	38%	0.38	15%	0.151	S	C	.	.	H	α-helix	trans	-53.2	-41.2	174.3	-79.3	-15.7	0	0	0	112.1	T245 A253	T245-D249 PolarHBondContact O-N 3.49Å; T245-D249 VanDerWaalsContact O-N 3.09Å; D249-A253 WeakPolarHBondContact O-CB 3.22Å; D249-A253 PolarHBondContact O-N 3.14Å
250	V	94.4	Very high	94.5	Very high	8 Å²	8	29.9 Å²	29.9	5%	0.048	17%	0.168	C	C	.	.	H	α-helix	trans	-75.3	-39.9	178.8	178.4	0	0	0	0	111.6	V200 R204 G246 L247 V248 V252 A253 V254 L298	V200-V250 HydrophobicContact CG1-CG2 3.94Å; R204-V250 HydrophobicContact CB-CB 4.48Å; R204-V250 HydrophobicContact CB-CG1 4Å; R204-V250 HydrophobicContact CB-CG2 3.56Å; G246-V250 WeakPolarHBondContact O-CG2 3.37Å; G246-V250 PolarHBondContact O-N 3.42Å; L247-V250 PolarHBondContact O-N 2.85Å; V248-V250 PolarHBondContact O-N 3.34Å; V250-V252 VanDerWaalsContact C-N 3.35Å; V250-V252 PolarHBondContact O-N 3.47Å; V250-A253 PolarHBondContact O-N 3.25Å; V250-A253 VanDerWaalsContact O-N 3.17Å; V250-V254 HydrophobicContact CG1-CG2 4.21Å; V250-V254 WeakPolarHBondContact O-CG2 3.42Å; V250-V254 PolarHBondContact O-N 2.84Å; V250-L298 HydrophobicContact CB-CD2 4.39Å; V250-L298 HydrophobicContact CG1-CD1 3.9Å; V250-L298 HydrophobicContact CG1-CD2 4.13Å
251	A	93.7	Very high	94.2	Very high	3 Å²	3	31 Å²	31	3%	0.025	18%	0.175	C	C	.	.	H	α-helix	trans	-62.1	-39.2	178	0	0	0	0	0	112.6	L247 V248 S255 L298 M302	L247-A251 WeakPolarHBondContact O-CB 3.25Å; L247-A251 PolarHBondContact O-N 3.18Å; V248-A251 PolarHBondContact O-N 3.05Å; V248-A251 VanDerWaalsContact O-N 3.15Å; A251-S255 VanDerWaalsContact O-CB 3.28Å; A251-S255 WeakPolarHBondContact O-CB 3.24Å; A251-S255 PolarHBondContact O-N 3.28Å; A251-S255 PolarHBondContact O-OG 2.99Å; A251-L298 HydrophobicContact CB-CB 4.34Å; A251-L298 HydrophobicContact CB-CD1 4.32Å; A251-M302 HydrophobicContact CB-CE 3.63Å; A251-M302 HydrophobicContact CB-SD 4.14Å
252	V	93.8	Very high	94	Very high	44 Å²	44	34 Å²	34	27%	0.267	19%	0.189	S	C	.	.	H	α-helix	trans	-65.7	-45.4	172.2	175	0	0	0	0	110.7	V248 V250 V254 S255 V256 T335 D336	V248-V252 WeakPolarHBondContact O-CG2 3.13Å; V248-V252 PolarHBondContact O-N 3.13Å; V250-V252 VanDerWaalsContact C-N 3.35Å; V250-V252 PolarHBondContact O-N 3.47Å; V252-V254 PolarHBondContact O-N 3.23Å; V252-S255 PolarHBondContact O-N 2.97Å; V252-V256 WeakPolarHBondContact O-CG2 3.46Å; V252-V256 PolarHBondContact O-N 3.4Å; V252-T335 HydrophobicContact CG2-CG2 4.38Å; V252-D336 HydrophobicContact CG2-CB 3.72Å
253	A	93.3	Very high	93.8	Very high	35 Å²	35	39.4 Å²	39.4	29%	0.289	21%	0.208	S	C	.	.	H	α-helix	trans	-62.3	-39.9	178.3	0	0	0	0	0	113.2	D249 V250 Q257	D249-A253 WeakPolarHBondContact O-CB 3.22Å; D249-A253 PolarHBondContact O-N 3.14Å; V250-A253 PolarHBondContact O-N 3.25Å; V250-A253 VanDerWaalsContact O-N 3.17Å; A253-Q257 VanDerWaalsContact O-CG 3.32Å; A253-Q257 WeakPolarHBondContact O-CG 3.34Å; A253-Q257 PolarHBondContact O-N 3.16Å; A253-Q257 VanDerWaalsContact O-N 3.16Å; A253-Q257 PolarHBondContact O-NE2 3.24Å
254	V	92.9	Very high	93.5	Very high	7 Å²	7	43.3 Å²	43.3	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-67.1	-41.9	173.5	170.2	0	0	0	0	110.7	Y209 V250 V252 V256 Q257 L258 L291 N294 R295 L298	Y209-V254 WeakPolarHBondContact OH-CG2 3.47Å; V250-V254 HydrophobicContact CG1-CG2 4.21Å; V250-V254 WeakPolarHBondContact O-CG2 3.42Å; V250-V254 PolarHBondContact O-N 2.84Å; V252-V254 PolarHBondContact O-N 3.23Å; V254-V256 PolarHBondContact O-N 3.07Å; V254-Q257 WeakPolarHBondContact O-CB 3.43Å; V254-Q257 PolarHBondContact O-N 2.75Å; V254-L258 WeakPolarHBondContact O-CB 3.44Å; V254-L258 PolarHBondContact O-N 3.24Å; V254-L291 HydrophobicContact CG1-CD2 4.18Å; V254-N294 HydrophobicContact CG1-CB 4.5Å; V254-R295 HydrophobicContact CG1-CB 4.06Å; V254-L298 HydrophobicContact CB-CD1 4.3Å; V254-L298 HydrophobicContact CG2-CD1 3.91Å
255	S	92.6	Very high	93.2	Very high	29 Å²	29	43.6 Å²	43.6	20%	0.203	23%	0.228	C	C	.	.	H	α-helix	trans	-64.3	-39	179.1	-62.1	0	0	0	0	112.6	A251 V252 L258 Q259	A251-S255 VanDerWaalsContact O-CB 3.28Å; A251-S255 WeakPolarHBondContact O-CB 3.24Å; A251-S255 PolarHBondContact O-N 3.28Å; A251-S255 PolarHBondContact O-OG 2.99Å; V252-S255 PolarHBondContact O-N 2.97Å; S255-L258 PolarHBondContact O-N 2.92Å; S255-Q259 WeakPolarHBondContact O-CG 3.46Å; S255-Q259 PolarHBondContact O-N 2.83Å
256	V	93.1	Very high	92.8	Very high	84 Å²	84	46.2 Å²	46.2	51%	0.509	24%	0.242	S	C	.	.	H	α-helix	trans	-66.4	-39.1	173.4	172.2	0	0	0	0	111.6	V252 V254 T260	V252-V256 WeakPolarHBondContact O-CG2 3.46Å; V252-V256 PolarHBondContact O-N 3.4Å; V254-V256 PolarHBondContact O-N 3.07Å; V256-T260 WeakPolarHBondContact O-CB 3.43Å; V256-T260 PolarHBondContact O-N 3.16Å; V256-T260 VanDerWaalsContact O-N 3.09Å; V256-T260 PolarHBondContact O-OG1 3.45Å
257	Q	92.4	Very high	92.5	Very high	97 Å²	97	51.2 Å²	51.2	45%	0.453	27%	0.266	S	S	.	.	H	α-helix	trans	-64.1	-47.7	173.5	-73.6	173.4	53.3	0	0	111.2	A253 V254 Q259 T260 T261 L291	A253-Q257 VanDerWaalsContact O-CG 3.32Å; A253-Q257 WeakPolarHBondContact O-CG 3.34Å; A253-Q257 PolarHBondContact O-N 3.16Å; A253-Q257 VanDerWaalsContact O-N 3.16Å; A253-Q257 PolarHBondContact O-NE2 3.24Å; V254-Q257 WeakPolarHBondContact O-CB 3.43Å; V254-Q257 PolarHBondContact O-N 2.75Å; Q257-Q259 PolarHBondContact O-N 3.17Å; Q257-T260 CarbonylContact O-C 3.57Å; Q257-T260 WeakPolarHBondContact O-CA 3.37Å; Q257-T260 WeakPolarHBondContact O-CB 3.39Å; Q257-T260 PolarHBondContact O-N 3.2Å; Q257-T261 PolarHBondContact O-N 3.2Å; Q257-T261 PolarHBondContact O-OG1 3.46Å; Q257-T261 VanDerWaalsContact O-OG1 3.08Å; Q257-L291 HydrophobicContact CB-CD1 4.24Å; Q257-L291 HydrophobicContact CB-CD2 4.24Å
258	L	92.6	Very high	92.1	Very high	21 Å²	21	51.6 Å²	51.6	11%	0.11	27%	0.268	C	S	.	.	H	α-helix	trans	-56.9	-49.6	177.5	176.9	56.4	0	0	0	111.6	V254 S255 T260 T261 Q262 V288 L291 Q292	V254-L258 WeakPolarHBondContact O-CB 3.44Å; V254-L258 PolarHBondContact O-N 3.24Å; S255-L258 PolarHBondContact O-N 2.92Å; L258-T260 PolarHBondContact O-N 2.75Å; L258-T261 PolarHBondContact O-N 3.15Å; L258-Q262 WeakPolarHBondContact O-CB 3.22Å; L258-Q262 PolarHBondContact O-N 3.44Å; L258-V288 HydrophobicContact CD1-CG1 4.11Å; L258-L291 HydrophobicContact CB-CB 4.13Å; L258-L291 HydrophobicContact CD1-CB 3.96Å; L258-Q292 HydrophobicContact CD1-CG 3.81Å; L258-Q292 HydrophobicContact CD2-CG 3.79Å; L258-Q292 HydrophobicContact CG-CG 4.47Å
259	Q	92.8	Very high	91.5	Very high	102 Å²	102	55.6 Å²	55.6	48%	0.477	29%	0.29	S	S	.	.	H	α-helix	trans	-58.7	-36.5	174.8	-72.4	-174.2	27.4	0	0	112.5	S255 Q257 R263	S255-Q259 WeakPolarHBondContact O-CG 3.46Å; S255-Q259 PolarHBondContact O-N 2.83Å; Q257-Q259 PolarHBondContact O-N 3.17Å; Q259-R263 WeakPolarHBondContact O-CB 3.33Å; Q259-R263 WeakPolarHBondContact O-CD 3.49Å; Q259-R263 WeakPolarHBondContact O-CG 3.25Å; Q259-R263 PolarHBondContact O-N 2.8Å; Q259-R263 VanDerWaalsContact O-N 3.12Å
260	T	93.8	Very high	91.1	Very high	65 Å²	65	56.7 Å²	56.7	40%	0.399	30%	0.303	S	S	.	.	H	α-helix	trans	-72.7	-42.9	-179.3	-59.7	0	0	0	0	111.9	V256 Q257 L258 Q264	V256-T260 WeakPolarHBondContact O-CB 3.43Å; V256-T260 PolarHBondContact O-N 3.16Å; V256-T260 VanDerWaalsContact O-N 3.09Å; V256-T260 PolarHBondContact O-OG1 3.45Å; Q257-T260 CarbonylContact O-C 3.57Å; Q257-T260 WeakPolarHBondContact O-CA 3.37Å; Q257-T260 WeakPolarHBondContact O-CB 3.39Å; Q257-T260 PolarHBondContact O-N 3.2Å; L258-T260 PolarHBondContact O-N 2.75Å; T260-Q264 WeakPolarHBondContact O-CG 3.41Å; T260-Q264 PolarHBondContact O-N 2.94Å
261	T	92.6	Very high	90.7	Very high	24 Å²	24	59.9 Å²	59.9	15%	0.147	32%	0.316	C	S	.	.	H	α-helix	trans	-71.6	-38.5	177.4	-50.5	0	0	0	0	111.2	Q257 L258 Q264 C265 L284 A287 V288	Q257-T261 PolarHBondContact O-N 3.2Å; Q257-T261 PolarHBondContact O-OG1 3.46Å; Q257-T261 VanDerWaalsContact O-OG1 3.08Å; L258-T261 PolarHBondContact O-N 3.15Å; T261-Q264 WeakPolarHBondContact O-CB 3.36Å; T261-Q264 PolarHBondContact O-N 3.43Å; T261-C265 PolarHBondContact O-N 2.96Å; T261-L284 HydrophobicContact CG2-CD2 3.83Å; T261-A287 HydrophobicContact CG2-CB 4.07Å; T261-V288 HydrophobicContact CG2-CG2 3.89Å
262	Q	92.6	Very high	89.8	Confident	61 Å²	61	62.3 Å²	62.3	29%	0.285	33%	0.333	S	S	.	.	H	α-helix	trans	-58.4	-51.4	173.2	-176.3	63.4	57.1	0	0	111	L258 Q264 C265 D266 V288	L258-Q262 WeakPolarHBondContact O-CB 3.22Å; L258-Q262 PolarHBondContact O-N 3.44Å; Q262-Q264 PolarHBondContact O-N 3.44Å; Q262-C265 CarbonylContact O-C 3.6Å; Q262-C265 WeakPolarHBondContact O-CA 3.46Å; Q262-C265 VanDerWaalsContact O-CB 3.31Å; Q262-C265 WeakPolarHBondContact O-CB 3.28Å; Q262-C265 PolarHBondContact O-N 3.29Å; Q262-D266 PolarHBondContact NE2-OD1 3.19Å; Q262-D266 PolarHBondContact O-N 3.03Å; Q262-V288 HydrophobicContact CB-CG2 4.45Å
263	R	92.3	Very high	88.6	Confident	151 Å²	151	65.8 Å²	65.8	57%	0.57	36%	0.357	S	S	*	.	H	α-helix	trans	-58.3	-35.7	176.4	-72	169.6	-170.7	170.9	8.8	112.4	Q259 I267	Q259-R263 WeakPolarHBondContact O-CB 3.33Å; Q259-R263 WeakPolarHBondContact O-CD 3.49Å; Q259-R263 WeakPolarHBondContact O-CG 3.25Å; Q259-R263 PolarHBondContact O-N 2.8Å; Q259-R263 VanDerWaalsContact O-N 3.12Å; R263-I267 WeakPolarHBondContact O-CB 3.27Å; R263-I267 WeakPolarHBondContact O-CD1 3.42Å; R263-I267 WeakPolarHBondContact O-CG1 3.39Å; R263-I267 PolarHBondContact O-N 2.83Å
264	Q	88.9	Confident	87	Confident	83 Å²	83	75.3 Å²	75.3	39%	0.388	39%	0.385	S	S	.	.	H	α-helix	trans	-68.3	-41.2	173.6	-73.1	178.1	59.6	0	0	112.4	T260 T261 Q262 I267 E268 L284	T260-Q264 WeakPolarHBondContact O-CG 3.41Å; T260-Q264 PolarHBondContact O-N 2.94Å; T261-Q264 WeakPolarHBondContact O-CB 3.36Å; T261-Q264 PolarHBondContact O-N 3.43Å; Q262-Q264 PolarHBondContact O-N 3.44Å; Q264-I267 PolarHBondContact O-N 3.36Å; Q264-E268 WeakPolarHBondContact O-CB 3.4Å; Q264-E268 PolarHBondContact O-N 2.83Å; Q264-L284 HydrophobicContact CB-CD1 4.35Å; Q264-L284 HydrophobicContact CB-CD2 4.09Å
265	C	88.8	Confident	85.7	Confident	7 Å²	7	80.3 Å²	80.3	5%	0.047	41%	0.411	C	S	.	.	H	α-helix	trans	-59.5	-47.3	172.5	-178.9	0	0	0	0	111.1	T261 Q262 I267 E268 N269 L284 V288	T261-C265 PolarHBondContact O-N 2.96Å; Q262-C265 CarbonylContact O-C 3.6Å; Q262-C265 WeakPolarHBondContact O-CA 3.46Å; Q262-C265 VanDerWaalsContact O-CB 3.31Å; Q262-C265 WeakPolarHBondContact O-CB 3.28Å; Q262-C265 PolarHBondContact O-N 3.29Å; C265-I267 VanDerWaalsContact C-N 3.34Å; C265-I267 PolarHBondContact O-N 2.84Å; C265-E268 PolarHBondContact O-N 3.23Å; C265-N269 WeakPolarHBondContact O-CB 3.38Å; C265-N269 PolarHBondContact O-N 2.76Å; C265-L284 HydrophobicContact CB-CB 4.16Å; C265-V288 HydrophobicContact CB-CG2 4.46Å
266	D	89.3	Confident	84.6	Confident	75 Å²	75	82 Å²	82	40%	0.401	42%	0.416	S	S	.	.	H	α-helix	trans	-63	-38.9	-180	-58	-30.2	0	0	0	112.1	Q262 N269 S270	Q262-D266 PolarHBondContact NE2-OD1 3.19Å; Q262-D266 PolarHBondContact O-N 3.03Å; D266-N269 PolarHBondContact O-N 3.16Å; D266-S270 WeakPolarHBondContact O-CB 3.42Å; D266-S270 PolarHBondContact O-N 3.09Å; D266-S270 VanDerWaalsContact O-N 3.08Å; D266-S270 PolarHBondContact O-OG 3.12Å
267	I	88.1	Confident	83.9	Confident	107 Å²	107	79.4 Å²	79.4	55%	0.549	41%	0.406	S	S	.	.	H	α-helix	trans	-67.2	-40.8	174.8	-71	166.4	0	0	0	111.3	R263 Q264 C265 S270 K271	R263-I267 WeakPolarHBondContact O-CB 3.27Å; R263-I267 WeakPolarHBondContact O-CD1 3.42Å; R263-I267 WeakPolarHBondContact O-CG1 3.39Å; R263-I267 PolarHBondContact O-N 2.83Å; Q264-I267 PolarHBondContact O-N 3.36Å; C265-I267 VanDerWaalsContact C-N 3.34Å; C265-I267 PolarHBondContact O-N 2.84Å; I267-S270 PolarHBondContact O-OG 2.8Å; I267-K271 WeakPolarHBondContact O-CG 3.39Å
268	E	85.4	Confident	83.2	Confident	8 Å²	8	78.7 Å²	78.7	4%	0.037	41%	0.412	C	S	.	.	H	α-helix	trans	-72.4	-32.2	177	-163	68.2	-130.3	0	0	111.8	Q264 C265 S270 K271 Q276 G277 R280 L281 L284	Q264-E268 WeakPolarHBondContact O-CB 3.4Å; Q264-E268 PolarHBondContact O-N 2.83Å; C265-E268 PolarHBondContact O-N 3.23Å; E268-S270 VanDerWaalsContact C-N 3.35Å; E268-K271 WeakPolarHBondContact OE1-CE 3.19Å; E268-K271 IonicContact OE1-NZ 3.43Å; E268-K271 PolarHBondContact OE1-NZ 3.06Å; E268-K271 WeakPolarHBondContact OE2-CE 3.43Å; E268-K271 IonicContact OE2-NZ 2.63Å; E268-K271 PolarHBondContact OE2-NZ 3.08Å; E268-Q276 PolarHBondContact O-NE2 3.44Å; E268-Q276 VanDerWaalsContact O-NE2 3.07Å; E268-G277 PolarHBondContact OE1-N 2.71Å; E268-G277 VanDerWaalsContact OE1-N 3.09Å; E268-R280 IonicContact OE2-CZ 3.59Å; E268-R280 IonicContact OE2-NE 3.71Å; E268-R280 IonicContact OE2-NH1 2.79Å; E268-R280 PolarHBondContact OE2-NH1 3.14Å; E268-L281 HydrophobicContact CB-CD1 4.15Å; E268-L281 HydrophobicContact CG-CB 4.25Å; E268-L281 HydrophobicContact CG-CD1 4.34Å; E268-L284 HydrophobicContact CB-CD1 4.19Å; E268-L284 HydrophobicContact CG-CD1 4.47Å
269	N	84.4	Confident	82.7	Confident	85 Å²	85	83.5 Å²	83.5	46%	0.455	44%	0.438	S	S	.	.	H	α-helix	trans	-75.5	-19.3	177.8	-161.3	63.3	0	0	0	113.3	C265 D266 L281	C265-N269 WeakPolarHBondContact O-CB 3.38Å; C265-N269 PolarHBondContact O-N 2.76Å; D266-N269 PolarHBondContact O-N 3.16Å; N269-L281 HydrophobicContact CB-CD1 3.99Å
270	S	84.6	Confident	82.2	Confident	95 Å²	95	84.5 Å²	84.5	66%	0.664	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	3.2	179.5	52	0	0	0	0	114.8	D266 I267 E268	D266-S270 WeakPolarHBondContact O-CB 3.42Å; D266-S270 PolarHBondContact O-N 3.09Å; D266-S270 VanDerWaalsContact O-N 3.08Å; D266-S270 PolarHBondContact O-OG 3.12Å; I267-S270 PolarHBondContact O-OG 2.8Å; E268-S270 VanDerWaalsContact C-N 3.35Å
271	K	86.9	Confident	81.8	Confident	75 Å²	75	82 Å²	82	33%	0.326	42%	0.421	S	S	.	.	S	Bend	trans	-71.6	165.6	171.7	-69.1	-176.1	-166.7	169	0	112.6	I267 E268 D275 Q276	I267-K271 WeakPolarHBondContact O-CG 3.39Å; E268-K271 WeakPolarHBondContact OE1-CE 3.19Å; E268-K271 IonicContact OE1-NZ 3.43Å; E268-K271 PolarHBondContact OE1-NZ 3.06Å; E268-K271 WeakPolarHBondContact OE2-CE 3.43Å; E268-K271 IonicContact OE2-NZ 2.63Å; E268-K271 PolarHBondContact OE2-NZ 3.08Å; K271-D275 HydrophobicContact CB-CB 4.46Å; K271-D275 HydrophobicContact CD-CB 4.37Å; K271-D275 VanDerWaalsContact CD-O 3.24Å; K271-D275 WeakPolarHBondContact CD-O 3.37Å; K271-Q276 HydrophobicContact CB-CB 4.24Å
272	S	74.4	Confident	81.6	Confident	53 Å²	53	87.1 Å²	87.1	37%	0.371	44%	0.444	S	S	.	.			trans	-64.8	148.3	167.2	108.3	0	0	0	0	110.5	R274 D275 Q276	S272-R274 PolarHBondContact O-N 3.29Å; S272-R274 PolarHBondContact OG-N 3.27Å; S272-D275 VanDerWaalsContact CB-OD2 3.29Å; S272-D275 WeakPolarHBondContact CB-OD2 3.48Å; S272-D275 PolarHBondContact O-N 3.41Å; S272-D275 PolarHBondContact OG-OD2 2.99Å; S272-Q276 WeakPolarHBondContact O-CB 3.41Å; S272-Q276 PolarHBondContact O-N 3.04Å; S272-Q276 VanDerWaalsContact O-N 3.11Å
273	P	68.3	Low	81.5	Confident	118 Å²	118	90.5 Å²	90.5	77%	0.766	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	11.5	178.5	29.9	-36.5	0	0	0	114.4
274	R	60.3	Low	81.4	Confident	235 Å²	235	84.2 Å²	84.2	89%	0.887	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.6	-18.2	166.6	-66.2	-175.8	175.7	-171.5	-1.2	113.5	S272	S272-R274 PolarHBondContact O-N 3.29Å; S272-R274 PolarHBondContact OG-N 3.27Å
275	D	65.7	Low	81.4	Confident	111 Å²	111	84.7 Å²	84.7	59%	0.594	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.9	-3.9	-177.5	-47.8	-71.2	0	0	0	112.3	K271 S272	K271-D275 HydrophobicContact CB-CB 4.46Å; K271-D275 HydrophobicContact CD-CB 4.37Å; K271-D275 VanDerWaalsContact CD-O 3.24Å; K271-D275 WeakPolarHBondContact CD-O 3.37Å; S272-D275 VanDerWaalsContact CB-OD2 3.29Å; S272-D275 WeakPolarHBondContact CB-OD2 3.48Å; S272-D275 PolarHBondContact O-N 3.41Å; S272-D275 PolarHBondContact OG-OD2 2.99Å
276	Q	70.5	Confident	81.6	Confident	65 Å²	65	86.3 Å²	86.3	30%	0.304	45%	0.447	S	S	.	.			trans	-86.8	117.6	-179	176.2	168.8	66.8	0	0	110.7	E268 K271 S272 S278 L281	E268-Q276 PolarHBondContact O-NE2 3.44Å; E268-Q276 VanDerWaalsContact O-NE2 3.07Å; K271-Q276 HydrophobicContact CB-CB 4.24Å; S272-Q276 WeakPolarHBondContact O-CB 3.41Å; S272-Q276 PolarHBondContact O-N 3.04Å; S272-Q276 VanDerWaalsContact O-N 3.11Å; Q276-S278 PolarHBondContact O-N 3.36Å; Q276-L281 HydrophobicContact CG-CD2 4.31Å
277	G	77.6	Confident	81.7	Confident	29 Å²	29	84.2 Å²	84.2	30%	0.299	44%	0.44	S	S	.	.			trans	-80.5	107	173.5	0	0	0	0	0	110.9	E268 R280 L281	E268-G277 PolarHBondContact OE1-N 2.71Å; E268-G277 VanDerWaalsContact OE1-N 3.09Å; G277-R280 PolarHBondContact O-N 3.49Å; G277-L281 WeakPolarHBondContact O-CB 3.46Å; G277-L281 PolarHBondContact O-N 3.46Å
278	S	77.3	Confident	82	Confident	82 Å²	82	79.6 Å²	79.6	57%	0.573	42%	0.417	S	S	*	.	H	α-helix	trans	-55.3	-55.5	-179.2	-169.8	0	0	0	0	111.8	Q276 R280 L281 E282	Q276-S278 PolarHBondContact O-N 3.36Å; S278-R280 VanDerWaalsContact C-N 3.34Å; S278-R280 PolarHBondContact O-N 3.27Å; S278-L281 WeakPolarHBondContact O-CB 3.21Å; S278-L281 PolarHBondContact O-N 3.42Å; S278-E282 PolarHBondContact O-N 3.25Å
279	D	81.4	Confident	82.3	Confident	123 Å²	123	84.5 Å²	84.5	66%	0.658	44%	0.435	S	S	*	.	H	α-helix	trans	-59.2	-45.9	-177.3	-40.3	-9.3	0	0	0	110.5	L281 E282 E283	D279-L281 VanDerWaalsContact C-N 3.31Å; D279-L281 PolarHBondContact O-N 3.17Å; D279-E282 PolarHBondContact O-N 3.06Å; D279-E282 VanDerWaalsContact O-N 3.12Å; D279-E283 WeakPolarHBondContact O-CG 3.47Å; D279-E283 PolarHBondContact O-N 2.83Å
280	R	83.8	Confident	82.7	Confident	122 Å²	122	85 Å²	85	46%	0.46	44%	0.435	S	S	.	.	H	α-helix	trans	-62.5	-35	176.1	-175.4	-179	179.6	-171.9	-0.3	113	E268 G277 S278 E282 L284	E268-R280 IonicContact OE2-CZ 3.59Å; E268-R280 IonicContact OE2-NE 3.71Å; E268-R280 IonicContact OE2-NH1 2.79Å; E268-R280 PolarHBondContact OE2-NH1 3.14Å; G277-R280 PolarHBondContact O-N 3.49Å; S278-R280 VanDerWaalsContact C-N 3.34Å; S278-R280 PolarHBondContact O-N 3.27Å; R280-E282 VanDerWaalsContact C-N 3.34Å; R280-L284 HydrophobicContact CG-CD1 4.21Å; R280-L284 WeakPolarHBondContact O-CB 3.36Å; R280-L284 VanDerWaalsContact O-CG 3.27Å; R280-L284 WeakPolarHBondContact O-CG 3.18Å; R280-L284 PolarHBondContact O-N 3.36Å
281	L	85.7	Confident	83	Confident	13 Å²	13	81.6 Å²	81.6	7%	0.068	41%	0.409	C	S	.	.	H	α-helix	trans	-71.8	-32.2	176.6	-178.6	63	0	0	0	111.2	E268 N269 Q276 G277 S278 D279 K285	E268-L281 HydrophobicContact CB-CD1 4.15Å; E268-L281 HydrophobicContact CG-CB 4.25Å; E268-L281 HydrophobicContact CG-CD1 4.34Å; N269-L281 HydrophobicContact CB-CD1 3.99Å; Q276-L281 HydrophobicContact CG-CD2 4.31Å; G277-L281 WeakPolarHBondContact O-CB 3.46Å; G277-L281 PolarHBondContact O-N 3.46Å; S278-L281 WeakPolarHBondContact O-CB 3.21Å; S278-L281 PolarHBondContact O-N 3.42Å; D279-L281 VanDerWaalsContact C-N 3.31Å; D279-L281 PolarHBondContact O-N 3.17Å; L281-K285 HydrophobicContact CD1-CD 4.47Å; L281-K285 HydrophobicContact CG-CD 4.23Å; L281-K285 WeakPolarHBondContact O-CB 3.42Å; L281-K285 WeakPolarHBondContact O-CD 3.44Å; L281-K285 WeakPolarHBondContact O-CG 3.36Å; L281-K285 PolarHBondContact O-N 3.12Å
282	E	88	Confident	83.3	Confident	131 Å²	131	81.7 Å²	81.7	61%	0.612	41%	0.411	S	S	*	.	H	α-helix	trans	-74.2	-40.1	174	-171.2	163.9	-163.4	0	0	112.3	S278 D279 R280 K285 T286	S278-E282 PolarHBondContact O-N 3.25Å; D279-E282 PolarHBondContact O-N 3.06Å; D279-E282 VanDerWaalsContact O-N 3.12Å; R280-E282 VanDerWaalsContact C-N 3.34Å; E282-K285 PolarHBondContact O-N 3.12Å; E282-T286 WeakPolarHBondContact O-CB 3.32Å; E282-T286 PolarHBondContact O-N 2.94Å; E282-T286 PolarHBondContact O-OG1 3.39Å; E282-T286 VanDerWaalsContact O-OG1 3.12Å
283	E	89.7	Confident	84.1	Confident	133 Å²	133	84.3 Å²	84.3	62%	0.621	42%	0.417	S	S	*	.	H	α-helix	trans	-55.4	-52.4	167.5	-72.4	173.8	166.6	0	0	111.1	D279 K285 T286 A287	D279-E283 WeakPolarHBondContact O-CG 3.47Å; D279-E283 PolarHBondContact O-N 2.83Å; E283-K285 PolarHBondContact O-N 3.22Å; E283-T286 PolarHBondContact O-N 2.74Å; E283-A287 PolarHBondContact O-N 2.65Å
284	L	89.9	Confident	85.3	Confident	18 Å²	18	80.7 Å²	80.7	9%	0.094	39%	0.392	C	S	.	.	H	α-helix	trans	-63.3	-40.2	-179.9	-76.7	168.9	0	0	0	112.5	T261 Q264 C265 E268 R280 T286 V288	T261-L284 HydrophobicContact CG2-CD2 3.83Å; Q264-L284 HydrophobicContact CB-CD1 4.35Å; Q264-L284 HydrophobicContact CB-CD2 4.09Å; C265-L284 HydrophobicContact CB-CB 4.16Å; E268-L284 HydrophobicContact CB-CD1 4.19Å; E268-L284 HydrophobicContact CG-CD1 4.47Å; R280-L284 HydrophobicContact CG-CD1 4.21Å; R280-L284 WeakPolarHBondContact O-CB 3.36Å; R280-L284 VanDerWaalsContact O-CG 3.27Å; R280-L284 WeakPolarHBondContact O-CG 3.18Å; R280-L284 PolarHBondContact O-N 3.36Å; L284-T286 VanDerWaalsContact C-N 3.31Å; L284-T286 PolarHBondContact O-N 2.92Å; L284-V288 WeakPolarHBondContact O-CB 3.29Å; L284-V288 VanDerWaalsContact O-CG2 3.31Å; L284-V288 WeakPolarHBondContact O-CG2 3.37Å; L284-V288 PolarHBondContact O-N 3.11Å
285	K	90.3	Very high	86.8	Confident	94 Å²	94	74 Å²	74	41%	0.409	37%	0.366	S	S	.	.	H	α-helix	trans	-65.9	-33.4	175	-77.1	168.6	-178.6	170	0	112.6	L281 E282 E283 R289	L281-K285 HydrophobicContact CD1-CD 4.47Å; L281-K285 HydrophobicContact CG-CD 4.23Å; L281-K285 WeakPolarHBondContact O-CB 3.42Å; L281-K285 WeakPolarHBondContact O-CD 3.44Å; L281-K285 WeakPolarHBondContact O-CG 3.36Å; L281-K285 PolarHBondContact O-N 3.12Å; E282-K285 PolarHBondContact O-N 3.12Å; E283-K285 PolarHBondContact O-N 3.22Å; K285-R289 PolarHBondContact O-N 2.98Å
286	T	92.1	Very high	88	Confident	40 Å²	40	74.3 Å²	74.3	25%	0.245	36%	0.364	C	S	.	.	H	α-helix	trans	-72.4	-46.8	175.6	-71.3	0	0	0	0	111.4	E282 E283 L284 V288 R289 E290	E282-T286 WeakPolarHBondContact O-CB 3.32Å; E282-T286 PolarHBondContact O-N 2.94Å; E282-T286 PolarHBondContact O-OG1 3.39Å; E282-T286 VanDerWaalsContact O-OG1 3.12Å; E283-T286 PolarHBondContact O-N 2.74Å; L284-T286 VanDerWaalsContact C-N 3.31Å; L284-T286 PolarHBondContact O-N 2.92Å; T286-V288 VanDerWaalsContact C-N 3.3Å; T286-V288 PolarHBondContact O-N 3.25Å; T286-R289 VanDerWaalsContact CG2-NH2 3.32Å; T286-R289 WeakPolarHBondContact O-CB 3.46Å; T286-R289 PolarHBondContact O-N 3.24Å; T286-R289 VanDerWaalsContact O-N 3.11Å; T286-R289 PolarHBondContact OG1-NH2 2.86Å; T286-E290 WeakPolarHBondContact CG2-OE1 3.44Å; T286-E290 WeakPolarHBondContact O-CG 3.44Å; T286-E290 PolarHBondContact O-N 2.97Å
287	A	91.8	Very high	89	Confident	31 Å²	31	73.7 Å²	73.7	26%	0.256	36%	0.361	S	S	.	.	H	α-helix	trans	-62.1	-33.7	174.3	0	0	0	0	0	113.2	T261 E283 L291	T261-A287 HydrophobicContact CG2-CB 4.07Å; E283-A287 PolarHBondContact O-N 2.65Å; A287-L291 VanDerWaalsContact O-CB 3.31Å; A287-L291 WeakPolarHBondContact O-CB 3.4Å; A287-L291 WeakPolarHBondContact O-CD1 3.26Å; A287-L291 WeakPolarHBondContact O-CG 3.23Å; A287-L291 PolarHBondContact O-N 2.7Å
288	V	93	Very high	89.7	Confident	10 Å²	10	72.3 Å²	72.3	6%	0.061	35%	0.347	C	S	.	.	H	α-helix	trans	-62.3	-46.9	171.2	161.1	0	0	0	0	111.4	L258 T261 Q262 C265 L284 T286 L291 Q292	L258-V288 HydrophobicContact CD1-CG1 4.11Å; T261-V288 HydrophobicContact CG2-CG2 3.89Å; Q262-V288 HydrophobicContact CB-CG2 4.45Å; C265-V288 HydrophobicContact CB-CG2 4.46Å; L284-V288 WeakPolarHBondContact O-CB 3.29Å; L284-V288 VanDerWaalsContact O-CG2 3.31Å; L284-V288 WeakPolarHBondContact O-CG2 3.37Å; L284-V288 PolarHBondContact O-N 3.11Å; T286-V288 VanDerWaalsContact C-N 3.3Å; T286-V288 PolarHBondContact O-N 3.25Å; V288-L291 PolarHBondContact O-N 3Å; V288-Q292 WeakPolarHBondContact O-CG 3.45Å; V288-Q292 PolarHBondContact O-N 3.33Å
289	R	93.4	Very high	90.4	Very high	111 Å²	111	70.7 Å²	70.7	42%	0.419	34%	0.336	S	S	.	.	H	α-helix	trans	-63.1	-48	178.9	176	179.2	63.7	-100	-3.7	111.6	K285 T286 L291 Q292 E293	K285-R289 PolarHBondContact O-N 2.98Å; T286-R289 VanDerWaalsContact CG2-NH2 3.32Å; T286-R289 WeakPolarHBondContact O-CB 3.46Å; T286-R289 PolarHBondContact O-N 3.24Å; T286-R289 VanDerWaalsContact O-N 3.11Å; T286-R289 PolarHBondContact OG1-NH2 2.86Å; R289-L291 VanDerWaalsContact C-N 3.29Å; R289-L291 PolarHBondContact O-N 3.41Å; R289-Q292 WeakPolarHBondContact O-CA 3.07Å; R289-Q292 WeakPolarHBondContact O-CB 3.16Å; R289-Q292 PolarHBondContact O-N 3.46Å; R289-E293 WeakPolarHBondContact CD-OE1 3.46Å; R289-E293 HydrophobicContact CG-CG 4.46Å; R289-E293 WeakPolarHBondContact CG-OE1 3.44Å; R289-E293 WeakPolarHBondContact O-CG 3.45Å; R289-E293 PolarHBondContact O-N 2.98Å
290	E	91.6	Very high	91	Very high	97 Å²	97	71.2 Å²	71.2	45%	0.453	33%	0.332	S	S	.	.	H	α-helix	trans	-58.2	-41.1	176	-69.9	167.7	-170.3	0	0	111.4	T286 Q292 N294	T286-E290 WeakPolarHBondContact CG2-OE1 3.44Å; T286-E290 WeakPolarHBondContact O-CG 3.44Å; T286-E290 PolarHBondContact O-N 2.97Å; E290-Q292 VanDerWaalsContact C-N 3.3Å; E290-Q292 PolarHBondContact O-N 3.13Å; E290-N294 VanDerWaalsContact O-CB 3.28Å; E290-N294 WeakPolarHBondContact O-CB 3.22Å; E290-N294 PolarHBondContact O-N 2.84Å; E290-N294 PolarHBondContact O-ND2 3.43Å
291	L	91.9	Very high	91.5	Very high	22 Å²	22	65.5 Å²	65.5	12%	0.115	31%	0.311	C	S	.	.	H	α-helix	trans	-71.5	-20.6	175.7	-73	168.5	0	0	0	113.6	V254 Q257 L258 A287 V288 R289 R295	V254-L291 HydrophobicContact CG1-CD2 4.18Å; Q257-L291 HydrophobicContact CB-CD1 4.24Å; Q257-L291 HydrophobicContact CB-CD2 4.24Å; L258-L291 HydrophobicContact CB-CB 4.13Å; L258-L291 HydrophobicContact CD1-CB 3.96Å; A287-L291 VanDerWaalsContact O-CB 3.31Å; A287-L291 WeakPolarHBondContact O-CB 3.4Å; A287-L291 WeakPolarHBondContact O-CD1 3.26Å; A287-L291 WeakPolarHBondContact O-CG 3.23Å; A287-L291 PolarHBondContact O-N 2.7Å; V288-L291 PolarHBondContact O-N 3Å; R289-L291 VanDerWaalsContact C-N 3.29Å; R289-L291 PolarHBondContact O-N 3.41Å; L291-R295 WeakPolarHBondContact O-CB 3.24Å; L291-R295 PolarHBondContact O-N 2.74Å
292	Q	92.6	Very high	91.9	Very high	77 Å²	77	65.4 Å²	65.4	36%	0.36	31%	0.31	S	S	.	.	H	α-helix	trans	-77.7	-48.9	171.2	-74.8	166.1	-29.7	0	0	111	L258 V288 R289 E290 N294 R295 E296	L258-Q292 HydrophobicContact CD1-CG 3.81Å; L258-Q292 HydrophobicContact CD2-CG 3.79Å; L258-Q292 HydrophobicContact CG-CG 4.47Å; V288-Q292 WeakPolarHBondContact O-CG 3.45Å; V288-Q292 PolarHBondContact O-N 3.33Å; R289-Q292 WeakPolarHBondContact O-CA 3.07Å; R289-Q292 WeakPolarHBondContact O-CB 3.16Å; R289-Q292 PolarHBondContact O-N 3.46Å; E290-Q292 VanDerWaalsContact C-N 3.3Å; E290-Q292 PolarHBondContact O-N 3.13Å; Q292-N294 PolarHBondContact O-N 2.92Å; Q292-R295 WeakPolarHBondContact O-CB 3.43Å; Q292-R295 PolarHBondContact O-N 3.24Å; Q292-R295 VanDerWaalsContact O-N 3.07Å; Q292-E296 PolarHBondContact O-N 3.38Å
293	E	92	Very high	92.2	Very high	108 Å²	108	62.9 Å²	62.9	51%	0.505	30%	0.301	S	S	.	.	H	α-helix	trans	-56.9	-49	176	-69.2	162.5	180	0	0	110.8	R289 R295 E296 E297	R289-E293 WeakPolarHBondContact CD-OE1 3.46Å; R289-E293 HydrophobicContact CG-CG 4.46Å; R289-E293 WeakPolarHBondContact CG-OE1 3.44Å; R289-E293 WeakPolarHBondContact O-CG 3.45Å; R289-E293 PolarHBondContact O-N 2.98Å; E293-R295 VanDerWaalsContact C-N 3.27Å; E293-R295 PolarHBondContact O-N 2.87Å; E293-E296 PolarHBondContact O-N 3.17Å; E293-E296 VanDerWaalsContact O-N 3.12Å; E293-E297 PolarHBondContact O-N 3.47Å
294	N	92.1	Very high	92.4	Very high	43 Å²	43	58.7 Å²	58.7	23%	0.23	29%	0.289	C	S	.	.	H	α-helix	trans	-58.9	-34	174.8	-74.7	-41.7	0	0	0	113.5	Y209 V254 E290 Q292 L298	Y209-N294 HydrophobicContact CD1-CB 4.01Å; Y209-N294 WeakPolarHBondContact CD1-OD1 3.42Å; Y209-N294 HydrophobicContact CE1-CB 3.61Å; V254-N294 HydrophobicContact CG1-CB 4.5Å; E290-N294 VanDerWaalsContact O-CB 3.28Å; E290-N294 WeakPolarHBondContact O-CB 3.22Å; E290-N294 PolarHBondContact O-N 2.84Å; E290-N294 PolarHBondContact O-ND2 3.43Å; Q292-N294 PolarHBondContact O-N 2.92Å; N294-L298 WeakPolarHBondContact O-CD1 3.44Å; N294-L298 VanDerWaalsContact O-CG 3.27Å; N294-L298 WeakPolarHBondContact O-CG 3.39Å; N294-L298 PolarHBondContact O-N 2.92Å
295	R	91.8	Very high	92.7	Very high	95 Å²	95	57.8 Å²	57.8	36%	0.358	28%	0.284	S	S	.	.	H	α-helix	trans	-74.9	-33.6	177.7	-170.9	-166.4	68	114.2	6.6	111.7	V254 L291 Q292 E293 S299	V254-R295 HydrophobicContact CG1-CB 4.06Å; L291-R295 WeakPolarHBondContact O-CB 3.24Å; L291-R295 PolarHBondContact O-N 2.74Å; Q292-R295 WeakPolarHBondContact O-CB 3.43Å; Q292-R295 PolarHBondContact O-N 3.24Å; Q292-R295 VanDerWaalsContact O-N 3.07Å; E293-R295 VanDerWaalsContact C-N 3.27Å; E293-R295 PolarHBondContact O-N 2.87Å; R295-S299 WeakPolarHBondContact O-CB 3.42Å; R295-S299 PolarHBondContact O-N 3.44Å
296	E	91.2	Very high	92.9	Very high	117 Å²	117	54.7 Å²	54.7	55%	0.547	27%	0.271	S	S	.	.	H	α-helix	trans	-72.8	-39.3	178.5	-74.5	173.6	-163.7	0	0	111.5	Q292 E293 S299 F300	Q292-E296 PolarHBondContact O-N 3.38Å; E293-E296 PolarHBondContact O-N 3.17Å; E293-E296 VanDerWaalsContact O-N 3.12Å; E296-S299 CarbonylContact O-C 3.56Å; E296-S299 WeakPolarHBondContact O-CB 3.49Å; E296-S299 PolarHBondContact O-N 2.98Å; E296-F300 PolarHBondContact O-N 3.03Å
297	E	91.4	Very high	93.1	Very high	52 Å²	52	61.5 Å²	61.5	24%	0.243	29%	0.292	C	S	.	.	H	α-helix	trans	-66.4	-40.5	173.3	-179.1	48.6	-144.9	0	0	112.5	E293 S299 F300 M301	E293-E297 PolarHBondContact O-N 3.47Å; E297-S299 VanDerWaalsContact C-N 3.31Å; E297-S299 PolarHBondContact O-N 3.47Å; E297-F300 WeakPolarHBondContact O-CB 3.4Å; E297-F300 PolarHBondContact O-N 2.86Å; E297-M301 HydrophobicContact CG-CE 4.1Å; E297-M301 PolarHBondContact O-N 3.07Å
298	L	92.7	Very high	93.2	Very high	0 Å²	0	61.4 Å²	61.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-58.5	-43.5	169.5	-76	165.4	0	0	0	111.8	V208 Y209 L247 V250 A251 V254 N294 F300 M301 M302	V208-L298 HydrophobicContact CG1-CD2 3.64Å; Y209-L298 HydrophobicContact CE1-CD1 3.96Å; Y209-L298 HydrophobicContact CE1-CG 3.97Å; L247-L298 HydrophobicContact CD2-CD2 3.88Å; V250-L298 HydrophobicContact CB-CD2 4.39Å; V250-L298 HydrophobicContact CG1-CD1 3.9Å; V250-L298 HydrophobicContact CG1-CD2 4.13Å; A251-L298 HydrophobicContact CB-CB 4.34Å; A251-L298 HydrophobicContact CB-CD1 4.32Å; V254-L298 HydrophobicContact CB-CD1 4.3Å; V254-L298 HydrophobicContact CG2-CD1 3.91Å; N294-L298 WeakPolarHBondContact O-CD1 3.44Å; N294-L298 VanDerWaalsContact O-CG 3.27Å; N294-L298 WeakPolarHBondContact O-CG 3.39Å; N294-L298 PolarHBondContact O-N 2.92Å; L298-F300 VanDerWaalsContact C-N 3.33Å; L298-F300 PolarHBondContact O-N 3.07Å; L298-M301 PolarHBondContact O-N 3.21Å; L298-M302 WeakPolarHBondContact O-CB 3.47Å; L298-M302 VanDerWaalsContact O-CG 3.25Å; L298-M302 WeakPolarHBondContact O-CG 3.39Å; L298-M302 PolarHBondContact O-N 3.05Å
299	S	92.6	Very high	93.4	Very high	48 Å²	48	60.9 Å²	60.9	34%	0.336	29%	0.291	S	S	.	.	H	α-helix	trans	-63.3	-37.7	176.3	-171.8	0	0	0	0	112.3	R295 E296 E297 N303	R295-S299 WeakPolarHBondContact O-CB 3.42Å; R295-S299 PolarHBondContact O-N 3.44Å; E296-S299 CarbonylContact O-C 3.56Å; E296-S299 WeakPolarHBondContact O-CB 3.49Å; E296-S299 PolarHBondContact O-N 2.98Å; E297-S299 VanDerWaalsContact C-N 3.31Å; E297-S299 PolarHBondContact O-N 3.47Å; S299-N303 WeakPolarHBondContact O-CB 3.36Å; S299-N303 PolarHBondContact O-N 3.35Å; S299-N303 PolarHBondContact O-ND2 2.9Å; S299-N303 PolarHBondContact OG-ND2 2.77Å
300	F	93.5	Very high	93.6	Very high	133 Å²	133	55.6 Å²	55.6	58%	0.583	27%	0.271	S	S	*	.	H	α-helix	trans	-63.2	-53.5	175.3	176.5	-108.4	0	0	0	111.5	E296 E297 L298 M302 N303 A304	E296-F300 PolarHBondContact O-N 3.03Å; E297-F300 WeakPolarHBondContact O-CB 3.4Å; E297-F300 PolarHBondContact O-N 2.86Å; L298-F300 VanDerWaalsContact C-N 3.33Å; L298-F300 PolarHBondContact O-N 3.07Å; F300-M302 VanDerWaalsContact C-N 3.31Å; F300-M302 PolarHBondContact O-N 2.91Å; F300-N303 PolarHBondContact O-N 2.84Å; F300-A304 WeakPolarHBondContact O-CB 3.38Å; F300-A304 PolarHBondContact O-N 2.68Å
301	M	93.9	Very high	93.9	Very high	2 Å²	2	52.4 Å²	52.4	1%	0.01	26%	0.258	C	S	.	.	H	α-helix	trans	-59.4	-39.4	176.2	-76	-170.7	-83.6	0	0	112.9	V208 F214 L218 L247 E297 L298 A304 T305	V208-M301 HydrophobicContact CG1-CE 3.91Å; V208-M301 WeakPolarHBondContact O-CE 3.42Å; F214-M301 HydrophobicContact CB-SD 3.53Å; F214-M301 VanDerWaalsContact CB-SD 3.53Å; L218-M301 HydrophobicContact CD1-CB 3.93Å; L218-M301 HydrophobicContact CD1-CG 3.97Å; L218-M301 HydrophobicContact CD1-SD 4.27Å; L247-M301 HydrophobicContact CD1-CB 3.96Å; L247-M301 HydrophobicContact CD2-CE 4.35Å; L247-M301 HydrophobicContact CD2-SD 4.48Å; E297-M301 HydrophobicContact CG-CE 4.1Å; E297-M301 PolarHBondContact O-N 3.07Å; L298-M301 PolarHBondContact O-N 3.21Å; M301-A304 PolarHBondContact O-N 2.59Å; M301-T305 WeakPolarHBondContact O-CB 3.2Å; M301-T305 PolarHBondContact O-N 2.89Å; M301-T305 PolarHBondContact O-OG1 2.93Å
302	M	95.1	Very high	94.1	Very high	12 Å²	12	55.5 Å²	55.5	6%	0.059	27%	0.271	C	S	.	.	H	α-helix	trans	-63.5	-46.4	175.4	-76.9	-169.4	-60.7	0	0	111.9	M244 L247 V248 A251 L298 F300 T305 F306 F340	M244-M302 HydrophobicContact CE-CB 3.72Å; M244-M302 HydrophobicContact CE-CG 3.93Å; M244-M302 HydrophobicContact CE-SD 4.43Å; M244-M302 HydrophobicContact SD-CB 3.9Å; M244-M302 HydrophobicContact SD-CG 3.86Å; L247-M302 HydrophobicContact CB-CG 3.98Å; V248-M302 HydrophobicContact CB-SD 4.37Å; V248-M302 HydrophobicContact CG2-SD 3.59Å; V248-M302 VanDerWaalsContact CG2-SD 3.59Å; A251-M302 HydrophobicContact CB-CE 3.63Å; A251-M302 HydrophobicContact CB-SD 4.14Å; L298-M302 WeakPolarHBondContact O-CB 3.47Å; L298-M302 VanDerWaalsContact O-CG 3.25Å; L298-M302 WeakPolarHBondContact O-CG 3.39Å; L298-M302 PolarHBondContact O-N 3.05Å; F300-M302 VanDerWaalsContact C-N 3.31Å; F300-M302 PolarHBondContact O-N 2.91Å; M302-T305 PolarHBondContact O-N 3.09Å; M302-F306 WeakPolarHBondContact O-CB 3.39Å; M302-F306 PolarHBondContact O-N 2.99Å; M302-F340 HydrophobicContact SD-CZ 4.5Å
303	N	94	Very high	94.3	Very high	78 Å²	78	53.1 Å²	53.1	42%	0.417	26%	0.259	S	S	.	.	H	α-helix	trans	-64.9	-39.4	176.7	-86.2	-84.1	0	0	0	112.6	S299 F300 F306 R307	S299-N303 WeakPolarHBondContact O-CB 3.36Å; S299-N303 PolarHBondContact O-N 3.35Å; S299-N303 PolarHBondContact O-ND2 2.9Å; S299-N303 PolarHBondContact OG-ND2 2.77Å; F300-N303 PolarHBondContact O-N 2.84Å; N303-F306 PolarHBondContact O-N 3.16Å; N303-R307 WeakPolarHBondContact O-CB 3.32Å; N303-R307 WeakPolarHBondContact O-CG 3.31Å; N303-R307 PolarHBondContact O-N 3.49Å
304	A	93.7	Very high	94.5	Very high	44 Å²	44	49.5 Å²	49.5	36%	0.364	24%	0.241	S	C	.	.	H	α-helix	trans	-61.4	-46.1	175.6	0	0	0	0	0	111.3	F300 M301 G308	F300-A304 WeakPolarHBondContact O-CB 3.38Å; F300-A304 PolarHBondContact O-N 2.68Å; M301-A304 PolarHBondContact O-N 2.59Å; A304-G308 WeakPolarHBondContact O-CA 3.47Å; A304-G308 PolarHBondContact O-N 3.04Å
305	T	95.5	Very high	94.7	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-66.1	-41.1	177.6	-47.2	0	0	0	0	112	L218 A240 M241 M244 M301 M302 V309 F310	L218-T305 HydrophobicContact CD2-CG2 4.05Å; L218-T305 WeakPolarHBondContact CD2-OG1 3.17Å; A240-T305 HydrophobicContact CB-CG2 4.35Å; M241-T305 HydrophobicContact CE-CG2 4.07Å; M244-T305 HydrophobicContact CB-CG2 4.02Å; M244-T305 HydrophobicContact SD-CG2 4.25Å; M301-T305 WeakPolarHBondContact O-CB 3.2Å; M301-T305 PolarHBondContact O-N 2.89Å; M301-T305 PolarHBondContact O-OG1 2.93Å; M302-T305 PolarHBondContact O-N 3.09Å; T305-V309 WeakPolarHBondContact O-CB 3.4Å; T305-V309 PolarHBondContact O-N 3.03Å; T305-F310 PolarHBondContact O-N 3.36Å
306	F	95.9	Very high	95	Very high	28 Å²	28	50 Å²	50	12%	0.123	24%	0.24	C	C	.	.	I	π-helix	trans	-66.3	-48.1	179.9	-169.2	-91.6	0	0	0	112.1	M244 M302 N303 F310 V311 L329 W332 Y348	M244-F306 HydrophobicContact CE-CB 4.45Å; M302-F306 WeakPolarHBondContact O-CB 3.39Å; M302-F306 PolarHBondContact O-N 2.99Å; N303-F306 PolarHBondContact O-N 3.16Å; F306-F310 HydrophobicContact CD2-CB 4.22Å; F306-F310 AromaticContact CD2-CD1 3.92Å; F306-F310 HydrophobicContact CD2-CD1 3.92Å; F306-F310 HydrophobicContact CD2-CG 4.16Å; F306-F310 HydrophobicContact CE1-CD1 4.19Å; F306-F310 AromaticContact CE2-CD1 3.49Å; F306-F310 HydrophobicContact CE2-CD1 3.49Å; F306-F310 VanDerWaalsContact CE2-CD1 3.49Å; F306-F310 AromaticContact CE2-CE1 3.88Å; F306-F310 HydrophobicContact CE2-CE1 3.88Å; F306-F310 HydrophobicContact CE2-CG 4.07Å; F306-F310 HydrophobicContact CG-CD1 4.44Å; F306-F310 AromaticContact CZ-CD1 3.65Å; F306-F310 HydrophobicContact CZ-CD1 3.65Å; F306-F310 AromaticContact CZ-CE1 3.84Å; F306-F310 HydrophobicContact CZ-CE1 3.84Å; F306-F310 WeakPolarHBondContact O-CB 3.44Å; F306-F310 PolarHBondContact O-N 2.86Å; F306-V311 HydrophobicContact CD1-CG2 3.99Å; F306-V311 HydrophobicContact CE1-CG2 3.84Å; F306-V311 WeakPolarHBondContact O-CG2 3.41Å; F306-V311 PolarHBondContact O-N 2.81Å; F306-L329 HydrophobicContact CE2-CD1 4.43Å; F306-W332 HydrophobicContact CD2-CE3 4.41Å; F306-W332 AromaticContact CD2-CZ3 3.93Å; F306-W332 HydrophobicContact CD2-CZ3 3.93Å; F306-W332 HydrophobicContact CE2-CE3 4.49Å; F306-W332 HydrophobicContact CE2-CZ3 4.13Å; F306-Y348 HydrophobicContact CE1-CE2 4.2Å; F306-Y348 HydrophobicContact CZ-CD2 4.3Å; F306-Y348 AromaticContact CZ-CE2 3.74Å; F306-Y348 HydrophobicContact CZ-CE2 3.74Å
307	R	95	Very high	95.1	Very high	184 Å²	184	55.2 Å²	55.2	69%	0.694	26%	0.255	S	S	*	.	I	π-helix	trans	-71.8	-48.5	178.6	-70	-178.6	176.7	-116.6	3.6	112	N303 H312	N303-R307 WeakPolarHBondContact O-CB 3.32Å; N303-R307 WeakPolarHBondContact O-CG 3.31Å; N303-R307 PolarHBondContact O-N 3.49Å; R307-H312 PolarHBondContact O-CD2 3.1Å; R307-H312 VanDerWaalsContact O-CD2 3.26Å
308	G	93.9	Very high	95.2	Very high	28 Å²	28	54.1 Å²	54.1	29%	0.289	25%	0.251	S	S	.	.	I	π-helix	trans	-72.1	-35	-174.5	0	0	0	0	0	114.5	A304	A304-G308 WeakPolarHBondContact O-CA 3.47Å; A304-G308 PolarHBondContact O-N 3.04Å
309	V	97.4	Very high	95.4	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.258	C	S	.	.	I	π-helix	trans	-113.4	-61.3	-176.8	-171.8	0	0	0	0	112	T222 T237 A240 M241 T305 V311 H312 R313	T222-V309 HydrophobicContact CG2-CG2 4.3Å; T237-V309 HydrophobicContact CG2-CG1 4.09Å; A240-V309 HydrophobicContact CB-CB 4.48Å; A240-V309 HydrophobicContact CB-CG1 4.13Å; A240-V309 HydrophobicContact CB-CG2 4.18Å; M241-V309 HydrophobicContact CE-CB 3.9Å; M241-V309 HydrophobicContact CE-CG1 3.74Å; T305-V309 WeakPolarHBondContact O-CB 3.4Å; T305-V309 PolarHBondContact O-N 3.03Å; V309-V311 PolarHBondContact O-N 2.73Å; V309-H312 PolarHBondContact O-N 2.95Å; V309-H312 VanDerWaalsContact O-N 3.16Å; V309-R313 HydrophobicContact CG1-CB 4.47Å; V309-R313 HydrophobicContact CG1-CG 3.91Å; V309-R313 WeakPolarHBondContact O-CB 3.38Å; V309-R313 WeakPolarHBondContact O-CG 3.41Å; V309-R313 PolarHBondContact O-N 3.16Å
310	F	97.9	Very high	95.4	Very high	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.264	C	S	.	.	I	π-helix	trans	-58.4	-50.8	-169.6	172.5	-89.8	0	0	0	112.3	M241 T305 F306 H312 R313 Y314 C325 L329 W332 Y348	M241-F310 HydrophobicContact CE-CB 4.07Å; M241-F310 HydrophobicContact SD-CB 4.01Å; M241-F310 HydrophobicContact SD-CD2 4Å; T305-F310 PolarHBondContact O-N 3.36Å; F306-F310 HydrophobicContact CD2-CB 4.22Å; F306-F310 AromaticContact CD2-CD1 3.92Å; F306-F310 HydrophobicContact CD2-CD1 3.92Å; F306-F310 HydrophobicContact CD2-CG 4.16Å; F306-F310 HydrophobicContact CE1-CD1 4.19Å; F306-F310 AromaticContact CE2-CD1 3.49Å; F306-F310 HydrophobicContact CE2-CD1 3.49Å; F306-F310 VanDerWaalsContact CE2-CD1 3.49Å; F306-F310 AromaticContact CE2-CE1 3.88Å; F306-F310 HydrophobicContact CE2-CE1 3.88Å; F306-F310 HydrophobicContact CE2-CG 4.07Å; F306-F310 HydrophobicContact CG-CD1 4.44Å; F306-F310 AromaticContact CZ-CD1 3.65Å; F306-F310 HydrophobicContact CZ-CD1 3.65Å; F306-F310 AromaticContact CZ-CE1 3.84Å; F306-F310 HydrophobicContact CZ-CE1 3.84Å; F306-F310 WeakPolarHBondContact O-CB 3.44Å; F306-F310 PolarHBondContact O-N 2.86Å; F310-H312 PolarHBondContact O-N 2.91Å; F310-R313 PolarHBondContact O-N 3.38Å; F310-R313 VanDerWaalsContact O-N 3.1Å; F310-Y314 HydrophobicContact CE1-CD1 4.28Å; F310-Y314 HydrophobicContact CE1-CG 4.38Å; F310-Y314 HydrophobicContact CZ-CG 4.21Å; F310-Y314 WeakPolarHBondContact O-CD1 3.4Å; F310-Y314 PolarHBondContact O-N 2.83Å; F310-C325 HydrophobicContact CD2-CB 3.9Å; F310-C325 HydrophobicContact CE2-CB 3.88Å; F310-C325 WeakPolarHBondContact CE2-O 3.18Å; F310-L329 HydrophobicContact CE2-CB 4.05Å; F310-L329 HydrophobicContact CE2-CD2 4.28Å; F310-L329 HydrophobicContact CZ-CB 4.44Å; F310-L329 HydrophobicContact CZ-CD1 4.49Å; F310-L329 HydrophobicContact CZ-CD2 3.83Å; F310-L329 HydrophobicContact CZ-CG 4.47Å; F310-W332 HydrophobicContact CB-CH2 4.48Å; F310-W332 HydrophobicContact CD2-CH2 4.01Å; F310-W332 AromaticContact CD2-CZ3 3.93Å; F310-W332 HydrophobicContact CD2-CZ3 3.93Å; F310-W332 HydrophobicContact CE2-CZ3 4.47Å; F310-W332 HydrophobicContact CG-CH2 4.44Å; F310-W332 HydrophobicContact CG-CZ3 4.21Å; F310-Y348 HydrophobicContact CE1-CD1 4.09Å; F310-Y348 AromaticContact CE1-CD2 3.75Å; F310-Y348 HydrophobicContact CE1-CD2 3.75Å; F310-Y348 HydrophobicContact CE1-CE1 4.33Å; F310-Y348 HydrophobicContact CE1-CE2 4.02Å; F310-Y348 AromaticContact CE1-CG 3.82Å; F310-Y348 HydrophobicContact CE1-CG 3.82Å; F310-Y348 HydrophobicContact CZ-CD2 4.23Å; F310-Y348 HydrophobicContact CZ-CG 4.04Å
311	V	96.7	Very high	95.6	Very high	29 Å²	29	50.5 Å²	50.5	18%	0.176	24%	0.236	C	C	.	.	H	α-helix	trans	-60.9	-19.5	-177.6	168.5	0	0	0	0	113.7	F306 V309 Y314 R315	F306-V311 HydrophobicContact CD1-CG2 3.99Å; F306-V311 HydrophobicContact CE1-CG2 3.84Å; F306-V311 WeakPolarHBondContact O-CG2 3.41Å; F306-V311 PolarHBondContact O-N 2.81Å; V309-V311 PolarHBondContact O-N 2.73Å; V311-Y314 WeakPolarHBondContact O-CD1 3.34Å; V311-Y314 WeakPolarHBondContact O-CE1 3.39Å; V311-R315 PolarHBondContact O-NE 3.28Å; V311-R315 PolarHBondContact O-NH2 3.03Å
312	H	96	Very high	95.8	Very high	87 Å²	87	51.7 Å²	51.7	40%	0.403	24%	0.24	S	C	.	.	H	α-helix	trans	-98.2	-33.8	174.8	-64.1	-89.3	0	0	0	112.7	R307 V309 F310	R307-H312 PolarHBondContact O-CD2 3.1Å; R307-H312 VanDerWaalsContact O-CD2 3.26Å; V309-H312 PolarHBondContact O-N 2.95Å; V309-H312 VanDerWaalsContact O-N 3.16Å; F310-H312 PolarHBondContact O-N 2.91Å
313	R	97.5	Very high	95.9	Very high	27 Å²	27	51.8 Å²	51.8	10%	0.102	24%	0.243	C	C	.	.	H	α-helix	trans	-94.2	-21.9	-171.7	-61.2	-64.6	127.8	-114.2	-7.8	115.2	S225 D226 T237 V309 F310 R315 D316 I321	S225-R313 WeakPolarHBondContact O-CD 3.49Å; S225-R313 PolarHBondContact O-NE 3.48Å; D226-R313 IonicContact OD1-NH2 3.16Å; D226-R313 PolarHBondContact OD1-NH2 3Å; T237-R313 HydrophobicContact CG2-CB 3.74Å; T237-R313 HydrophobicContact CG2-CG 4Å; V309-R313 HydrophobicContact CG1-CB 4.47Å; V309-R313 HydrophobicContact CG1-CG 3.91Å; V309-R313 WeakPolarHBondContact O-CB 3.38Å; V309-R313 WeakPolarHBondContact O-CG 3.41Å; V309-R313 PolarHBondContact O-N 3.16Å; F310-R313 PolarHBondContact O-N 3.38Å; F310-R313 VanDerWaalsContact O-N 3.1Å; R313-R315 PolarHBondContact O-N 3.26Å; R313-D316 IonicContact CZ-OD2 3.37Å; R313-D316 IonicContact NE-OD2 2.89Å; R313-D316 IonicContact NH1-OD2 3.78Å; R313-D316 PolarHBondContact NH1-OD2 3.24Å; R313-D316 WeakPolarHBondContact O-CB 3.4Å; R313-D316 PolarHBondContact O-N 3.44Å; R313-I321 HydrophobicContact CB-CG2 4Å
314	Y	97.1	Very high	96	Very high	32 Å²	32	48.2 Å²	48.2	13%	0.125	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-20.7	171.3	91.1	-89.2	0	0	0	112.7	F310 V311 R322 Y348 W351	F310-Y314 HydrophobicContact CE1-CD1 4.28Å; F310-Y314 HydrophobicContact CE1-CG 4.38Å; F310-Y314 HydrophobicContact CZ-CG 4.21Å; F310-Y314 WeakPolarHBondContact O-CD1 3.4Å; F310-Y314 PolarHBondContact O-N 2.83Å; V311-Y314 WeakPolarHBondContact O-CD1 3.34Å; V311-Y314 WeakPolarHBondContact O-CE1 3.39Å; Y314-R322 WeakPolarHBondContact O-CB 3.48Å; Y314-R322 WeakPolarHBondContact O-CD 3.32Å; Y314-R322 WeakPolarHBondContact O-CG 3.48Å; Y314-Y348 HydrophobicContact CD1-CD1 4.19Å; Y314-Y348 HydrophobicContact CD1-CE1 4.31Å; Y314-Y348 HydrophobicContact CD2-CD1 4.17Å; Y314-Y348 AromaticContact CE1-CD1 3.84Å; Y314-Y348 HydrophobicContact CE1-CD1 3.84Å; Y314-Y348 AromaticContact CE1-CE1 3.73Å; Y314-Y348 HydrophobicContact CE1-CE1 3.73Å; Y314-Y348 AromaticContact CE2-CD1 3.84Å; Y314-Y348 HydrophobicContact CE2-CD1 3.84Å; Y314-Y348 HydrophobicContact CE2-CE1 4.47Å; Y314-Y348 HydrophobicContact CG-CD1 4.35Å; Y314-Y348 AromaticContact CZ-CD1 3.66Å; Y314-Y348 AromaticContact CZ-CE1 3.83Å; Y314-W351 HydrophobicContact CE2-CE3 4.39Å
315	R	96.6	Very high	96.2	Very high	144 Å²	144	46.1 Å²	46.1	54%	0.543	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	27.3	178.1	55.2	-178.3	160	162.8	-1.8	113.3	V311 R313	V311-R315 PolarHBondContact O-NE 3.28Å; V311-R315 PolarHBondContact O-NH2 3.03Å; R313-R315 PolarHBondContact O-N 3.26Å
316	D	97.6	Very high	96.3	Very high	6 Å²	6	46.1 Å²	46.1	3%	0.032	21%	0.207	C	C	.	.			trans	-60.4	156.7	174.6	-154.9	-81.9	0	0	0	112.4	R233 R313 L318 I321 R322	R233-D316 WeakPolarHBondContact CD-OD2 3.42Å; R233-D316 IonicContact CZ-OD1 2.7Å; R233-D316 IonicContact CZ-OD2 2.7Å; R233-D316 IonicContact NE-OD1 2.73Å; R233-D316 IonicContact NE-OD2 3.86Å; R233-D316 PolarHBondContact NE-OD2 2.87Å; R233-D316 IonicContact NH2-OD1 2.58Å; R233-D316 PolarHBondContact NH2-OD1 2.89Å; R233-D316 IonicContact NH2-OD2 3.71Å; R313-D316 IonicContact CZ-OD2 3.37Å; R313-D316 IonicContact NE-OD2 2.89Å; R313-D316 IonicContact NH1-OD2 3.78Å; R313-D316 PolarHBondContact NH1-OD2 3.24Å; R313-D316 WeakPolarHBondContact O-CB 3.4Å; R313-D316 PolarHBondContact O-N 3.44Å; D316-L318 PolarHBondContact O-N 3Å; D316-L318 PolarHBondContact OD1-N 3.28Å; D316-I321 HydrophobicContact CB-CB 4.01Å; D316-I321 HydrophobicContact CB-CD1 4.49Å; D316-I321 HydrophobicContact CB-CG2 3.91Å; D316-R322 HydrophobicContact CB-CG 4.25Å; D316-R322 WeakPolarHBondContact O-CD 3.42Å; D316-R322 WeakPolarHBondContact O-CG 3.47Å; D316-R322 PolarHBondContact O-NH1 2.99Å
317	R	93.6	Very high	96.4	Very high	226 Å²	226	48.2 Å²	48.2	85%	0.853	22%	0.218	S	C	*	.	S	Bend	trans	-62	-26.3	170.5	-68.9	176.3	172.8	145.9	-1.8	112	R322	R317-R322 PolarHBondContact O-NH1 3.44Å
318	L	93.2	Very high	96.5	Very high	29 Å²	29	39.5 Å²	39.5	15%	0.152	19%	0.185	C	C	.	.	S	Bend	trans	-93.2	125.3	-175.9	-59.6	170.4	0	0	0	112.6	R230 D316 D320 I321 R322	R230-L318 HydrophobicContact CB-CD1 4.3Å; R230-L318 HydrophobicContact CG-CD1 3.67Å; D316-L318 PolarHBondContact O-N 3Å; D316-L318 PolarHBondContact OD1-N 3.28Å; L318-D320 PolarHBondContact O-N 3.5Å; L318-I321 HydrophobicContact CB-CB 4.47Å; L318-I321 HydrophobicContact CB-CD1 4.04Å; L318-I321 HydrophobicContact CB-CG1 4.03Å; L318-I321 HydrophobicContact CD1-CD1 3.76Å; L318-I321 HydrophobicContact CD1-CG1 4.47Å; L318-I321 HydrophobicContact CG-CD1 4.48Å; L318-I321 PolarHBondContact O-N 3.45Å; L318-R322 PolarHBondContact O-N 3.23Å
319	A	95.9	Very high	96.6	Very high	19 Å²	19	38.2 Å²	38.2	16%	0.157	17%	0.171	C	C	.	.	H	α-helix	trans	-61.3	-41.2	-176.7	0	0	0	0	0	113.1	I321 R322 A323 Q357 V360	A319-I321 PolarHBondContact O-N 2.93Å; A319-R322 PolarHBondContact O-N 3.35Å; A319-A323 WeakPolarHBondContact O-CB 3.5Å; A319-A323 PolarHBondContact O-N 3.38Å; A319-Q357 HydrophobicContact CB-CB 4.03Å; A319-Q357 HydrophobicContact CB-CG 4.07Å; A319-V360 HydrophobicContact CB-CG2 3.99Å
320	D	93.9	Very high	96.6	Very high	85 Å²	85	38.6 Å²	38.6	46%	0.455	18%	0.175	S	C	.	.	H	α-helix	trans	-60.7	-35.1	-178.5	-48.5	-62.2	0	0	0	112.4	L318 A324	L318-D320 PolarHBondContact O-N 3.5Å; D320-A324 WeakPolarHBondContact O-CB 3.3Å; D320-A324 PolarHBondContact O-N 3.35Å
321	I	96.7	Very high	96.5	Very high	1 Å²	1	42 Å²	42	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-71.1	-47.5	177.8	-58	-173.5	0	0	0	110	R233 H234 T237 R313 D316 L318 A319 A323 A324 C325	R233-I321 HydrophobicContact CG-CD1 4.11Å; H234-I321 HydrophobicContact CB-CD1 3.86Å; H234-I321 HydrophobicContact CB-CG1 3.97Å; T237-I321 HydrophobicContact CG2-CG2 3.83Å; R313-I321 HydrophobicContact CB-CG2 4Å; D316-I321 HydrophobicContact CB-CB 4.01Å; D316-I321 HydrophobicContact CB-CD1 4.49Å; D316-I321 HydrophobicContact CB-CG2 3.91Å; L318-I321 HydrophobicContact CB-CB 4.47Å; L318-I321 HydrophobicContact CB-CD1 4.04Å; L318-I321 HydrophobicContact CB-CG1 4.03Å; L318-I321 HydrophobicContact CD1-CD1 3.76Å; L318-I321 HydrophobicContact CD1-CG1 4.47Å; L318-I321 HydrophobicContact CG-CD1 4.48Å; L318-I321 PolarHBondContact O-N 3.45Å; A319-I321 PolarHBondContact O-N 2.93Å; I321-A323 VanDerWaalsContact C-N 3.33Å; I321-A323 PolarHBondContact O-N 3.29Å; I321-A324 PolarHBondContact O-N 3Å; I321-C325 PolarHBondContact O-N 3.38Å; I321-C325 PolarHBondContact O-SG 3.32Å
322	R	98.2	Very high	96.5	Very high	26 Å²	26	40.7 Å²	40.7	10%	0.098	19%	0.185	C	C	.	.	H	α-helix	trans	-60.5	-44	177.2	-59.6	-160.7	-59.2	-76.9	1.8	111.5	Y314 D316 R317 L318 A319 C325 I326 D355 V360	Y314-R322 WeakPolarHBondContact O-CB 3.48Å; Y314-R322 WeakPolarHBondContact O-CD 3.32Å; Y314-R322 WeakPolarHBondContact O-CG 3.48Å; D316-R322 HydrophobicContact CB-CG 4.25Å; D316-R322 WeakPolarHBondContact O-CD 3.42Å; D316-R322 WeakPolarHBondContact O-CG 3.47Å; D316-R322 PolarHBondContact O-NH1 2.99Å; R317-R322 PolarHBondContact O-NH1 3.44Å; L318-R322 PolarHBondContact O-N 3.23Å; A319-R322 PolarHBondContact O-N 3.35Å; R322-C325 PolarHBondContact O-N 2.77Å; R322-I326 WeakPolarHBondContact O-CB 3.49Å; R322-I326 VanDerWaalsContact O-CG1 3.25Å; R322-I326 WeakPolarHBondContact O-CG1 3.32Å; R322-I326 PolarHBondContact O-N 3.23Å; R322-I326 VanDerWaalsContact O-N 3.09Å; R322-D355 IonicContact CZ-OD1 3.91Å; R322-D355 IonicContact CZ-OD2 2.81Å; R322-D355 IonicContact NE-OD2 2.73Å; R322-D355 PolarHBondContact NE-OD2 2.89Å; R322-D355 VanDerWaalsContact NH2-CG 3.29Å; R322-D355 IonicContact NH2-OD1 2.95Å; R322-D355 PolarHBondContact NH2-OD1 2.98Å; R322-D355 IonicContact NH2-OD2 3.76Å; R322-D355 PolarHBondContact NH2-OD2 3.28Å; R322-V360 HydrophobicContact CB-CG1 3.85Å; R322-V360 HydrophobicContact CB-CG2 4.17Å
323	A	97.2	Very high	96.5	Very high	15 Å²	15	36.5 Å²	36.5	12%	0.124	17%	0.166	C	C	.	.	H	α-helix	trans	-60.2	-45.4	175.6	0	0	0	0	0	111.9	A319 I321 C325 I326 E327 V360	A319-A323 WeakPolarHBondContact O-CB 3.5Å; A319-A323 PolarHBondContact O-N 3.38Å; I321-A323 VanDerWaalsContact C-N 3.33Å; I321-A323 PolarHBondContact O-N 3.29Å; A323-C325 PolarHBondContact O-N 3.15Å; A323-I326 PolarHBondContact O-N 3.44Å; A323-E327 WeakPolarHBondContact O-CB 3.34Å; A323-E327 PolarHBondContact O-N 3.01Å; A323-V360 HydrophobicContact CB-CG2 4.37Å
324	A	96.2	Very high	96.4	Very high	3 Å²	3	38.2 Å²	38.2	3%	0.025	17%	0.174	C	C	.	.	H	α-helix	trans	-64.3	-38.9	177.7	0	0	0	0	0	113.2	L238 D320 I321 I326 E328	L238-A324 HydrophobicContact CD1-CB 4.37Å; D320-A324 WeakPolarHBondContact O-CB 3.3Å; D320-A324 PolarHBondContact O-N 3.35Å; I321-A324 PolarHBondContact O-N 3Å; A324-I326 VanDerWaalsContact C-N 3.3Å; A324-I326 PolarHBondContact O-N 3.27Å; A324-E328 PolarHBondContact O-N 2.76Å
325	C	98.1	Very high	96.3	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-62.4	-38.2	173.5	-70.7	0	0	0	0	112.2	M241 F310 I321 R322 A323 L329	M241-C325 HydrophobicContact SD-CB 4.31Å; F310-C325 HydrophobicContact CD2-CB 3.9Å; F310-C325 HydrophobicContact CE2-CB 3.88Å; F310-C325 WeakPolarHBondContact CE2-O 3.18Å; I321-C325 PolarHBondContact O-N 3.38Å; I321-C325 PolarHBondContact O-SG 3.32Å; R322-C325 PolarHBondContact O-N 2.77Å; A323-C325 PolarHBondContact O-N 3.15Å; C325-L329 WeakPolarHBondContact O-CB 3.41Å; C325-L329 PolarHBondContact O-N 3.31Å
326	I	98.1	Very high	96.2	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-80.6	-29.3	-177.7	-65.4	-72.2	0	0	0	112	R322 A323 A324 L329 G330 L349 T352 C364	R322-I326 WeakPolarHBondContact O-CB 3.49Å; R322-I326 VanDerWaalsContact O-CG1 3.25Å; R322-I326 WeakPolarHBondContact O-CG1 3.32Å; R322-I326 PolarHBondContact O-N 3.23Å; R322-I326 VanDerWaalsContact O-N 3.09Å; A323-I326 PolarHBondContact O-N 3.44Å; A324-I326 VanDerWaalsContact C-N 3.3Å; A324-I326 PolarHBondContact O-N 3.27Å; I326-L329 HydrophobicContact CD1-CD2 4.3Å; I326-G330 PolarHBondContact O-N 3.24Å; I326-G330 VanDerWaalsContact O-N 3.16Å; I326-L349 HydrophobicContact CD1-CD2 4.28Å; I326-L349 HydrophobicContact CG2-CD2 3.91Å; I326-T352 HydrophobicContact CD1-CG2 4.12Å; I326-T352 VanDerWaalsContact CD1-OG1 3.27Å; I326-T352 WeakPolarHBondContact CD1-OG1 3.44Å; I326-T352 HydrophobicContact CG1-CG2 3.94Å; I326-T352 HydrophobicContact CG2-CG2 4.3Å; I326-C364 HydrophobicContact CG2-CB 4.03Å
327	E	96.7	Very high	96	Very high	72 Å²	72	33.9 Å²	33.9	34%	0.336	17%	0.167	S	C	.	.	H	α-helix	trans	-57.5	-54.9	167.9	-176.3	170.9	-163.9	0	0	110.9	A323 G330 L331 Q363	A323-E327 WeakPolarHBondContact O-CB 3.34Å; A323-E327 PolarHBondContact O-N 3.01Å; E327-G330 PolarHBondContact O-N 3.45Å; E327-L331 PolarHBondContact O-N 3.43Å; E327-Q363 HydrophobicContact CB-CG 3.8Å
328	E	96.9	Very high	95.8	Very high	1 Å²	1	28.7 Å²	28.7	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-71.1	-35.1	-178.9	-55.8	-49	109.6	0	0	112.9	M241 K242 T245 A324 G330 L331 W332	M241-E328 HydrophobicContact CB-CB 4.04Å; M241-E328 HydrophobicContact CB-CG 3.58Å; K242-E328 WeakPolarHBondContact CD-OE2 3.33Å; K242-E328 VanDerWaalsContact CE-CD 3.47Å; K242-E328 WeakPolarHBondContact CE-OE1 3.47Å; K242-E328 VanDerWaalsContact CE-OE2 3.31Å; K242-E328 WeakPolarHBondContact CE-OE2 3.49Å; K242-E328 IonicContact NZ-OE1 3.46Å; K242-E328 PolarHBondContact NZ-OE1 3.41Å; K242-E328 IonicContact NZ-OE2 3.9Å; K242-E328 PolarHBondContact NZ-OE2 3.4Å; T245-E328 PolarHBondContact OG1-OE2 3.18Å; A324-E328 PolarHBondContact O-N 2.76Å; E328-G330 VanDerWaalsContact C-N 3.27Å; E328-G330 PolarHBondContact O-N 3.15Å; E328-L331 WeakPolarHBondContact O-CA 3.45Å; E328-L331 WeakPolarHBondContact O-CB 3.46Å; E328-L331 PolarHBondContact O-N 3.46Å; E328-W332 HydrophobicContact CB-CH2 4.28Å; E328-W332 HydrophobicContact CB-CZ2 3.43Å; E328-W332 VanDerWaalsContact CB-CZ2 3.43Å; E328-W332 VanDerWaalsContact O-CD1 3.23Å; E328-W332 VanDerWaalsContact O-CG 3.23Å; E328-W332 PolarHBondContact O-N 2.95Å; E328-W332 PolarHBondContact O-NE1 2.96Å
329	L	97.6	Very high	95.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-56.9	-42.1	173.5	178.9	66.6	0	0	0	111.8	F306 F310 C325 I326 L331 W332 L333 C345 L349	F306-L329 HydrophobicContact CE2-CD1 4.43Å; F310-L329 HydrophobicContact CE2-CB 4.05Å; F310-L329 HydrophobicContact CE2-CD2 4.28Å; F310-L329 HydrophobicContact CZ-CB 4.44Å; F310-L329 HydrophobicContact CZ-CD1 4.49Å; F310-L329 HydrophobicContact CZ-CD2 3.83Å; F310-L329 HydrophobicContact CZ-CG 4.47Å; C325-L329 WeakPolarHBondContact O-CB 3.41Å; C325-L329 PolarHBondContact O-N 3.31Å; I326-L329 HydrophobicContact CD1-CD2 4.3Å; L329-L331 VanDerWaalsContact C-N 3.26Å; L329-L331 PolarHBondContact O-N 2.73Å; L329-W332 HydrophobicContact CB-CE3 4.36Å; L329-W332 HydrophobicContact CB-CZ3 4.42Å; L329-W332 HydrophobicContact CD1-CE3 3.89Å; L329-W332 HydrophobicContact CD1-CZ3 4.25Å; L329-W332 PolarHBondContact O-N 3.2Å; L329-L333 HydrophobicContact CD1-CD1 4.27Å; L329-L333 HydrophobicContact CD1-CG 4.3Å; L329-L333 HydrophobicContact CD2-CD1 4.41Å; L329-L333 HydrophobicContact CG-CD1 3.86Å; L329-L333 HydrophobicContact CG-CG 4.37Å; L329-L333 WeakPolarHBondContact O-CB 3.18Å; L329-L333 WeakPolarHBondContact O-CD1 3.5Å; L329-L333 VanDerWaalsContact O-CG 3.26Å; L329-L333 WeakPolarHBondContact O-CG 3.25Å; L329-L333 PolarHBondContact O-N 3.16Å; L329-C345 HydrophobicContact CD1-CB 4.44Å; L329-L349 HydrophobicContact CD2-CD2 3.99Å; L329-L349 HydrophobicContact CD2-CG 4.21Å
330	G	96.2	Very high	95.5	Very high	9 Å²	9	31.3 Å²	31.3	9%	0.093	17%	0.167	C	C	.	.	H	α-helix	trans	-60.7	-34.2	175	0	0	0	0	0	113.2	I326 E327 E328 K334	I326-G330 PolarHBondContact O-N 3.24Å; I326-G330 VanDerWaalsContact O-N 3.16Å; E327-G330 PolarHBondContact O-N 3.45Å; E328-G330 VanDerWaalsContact C-N 3.27Å; E328-G330 PolarHBondContact O-N 3.15Å; G330-K334 PolarHBondContact O-N 3.22Å
331	L	95.8	Very high	95.6	Very high	71 Å²	71	27.5 Å²	27.5	37%	0.372	15%	0.146	S	C	.	.	H	α-helix	trans	-72.4	-42.8	174.8	-62	175.7	0	0	0	112	T245 E327 E328 L329 K334 T335	T245-L331 HydrophobicContact CG2-CB 4.47Å; T245-L331 HydrophobicContact CG2-CD1 4.29Å; E327-L331 PolarHBondContact O-N 3.43Å; E328-L331 WeakPolarHBondContact O-CA 3.45Å; E328-L331 WeakPolarHBondContact O-CB 3.46Å; E328-L331 PolarHBondContact O-N 3.46Å; L329-L331 VanDerWaalsContact C-N 3.26Å; L329-L331 PolarHBondContact O-N 2.73Å; L331-K334 PolarHBondContact O-N 2.97Å; L331-T335 VanDerWaalsContact O-CB 3.3Å; L331-T335 WeakPolarHBondContact O-CB 3.4Å; L331-T335 PolarHBondContact O-N 3.12Å; L331-T335 PolarHBondContact O-OG1 3.36Å
332	W	96.8	Very high	95.4	Very high	1 Å²	1	29.9 Å²	29.9	0%	0.004	16%	0.159	C	C	.	.	H	α-helix	trans	-63.9	-43.4	178.5	-47.9	-26.3	0	0	0	111.3	M241 M244 T245 V248 F306 F310 E328 L329 K334 T335 D336 F340	M241-W332 HydrophobicContact CB-CZ2 4.38Å; M241-W332 HydrophobicContact CE-CH2 4.29Å; M241-W332 HydrophobicContact SD-CH2 3.77Å; M241-W332 HydrophobicContact SD-CZ2 4.28Å; M244-W332 HydrophobicContact CB-CH2 4.38Å; M244-W332 HydrophobicContact CB-CZ2 3.67Å; M244-W332 HydrophobicContact CE-CE3 4.42Å; M244-W332 HydrophobicContact CG-CD2 4.03Å; M244-W332 VanDerWaalsContact CG-CE2 3.43Å; M244-W332 HydrophobicContact CG-CE3 4.4Å; M244-W332 HydrophobicContact CG-CH2 3.82Å; M244-W332 HydrophobicContact CG-CZ2 3.34Å; M244-W332 HydrophobicContact CG-CZ3 4.32Å; T245-W332 PolarHBondContact OG1-NE1 3Å; V248-W332 HydrophobicContact CG2-CB 4.46Å; V248-W332 HydrophobicContact CG2-CG 4.2Å; F306-W332 HydrophobicContact CD2-CE3 4.41Å; F306-W332 AromaticContact CD2-CZ3 3.93Å; F306-W332 HydrophobicContact CD2-CZ3 3.93Å; F306-W332 HydrophobicContact CE2-CE3 4.49Å; F306-W332 HydrophobicContact CE2-CZ3 4.13Å; F310-W332 HydrophobicContact CB-CH2 4.48Å; F310-W332 HydrophobicContact CD2-CH2 4.01Å; F310-W332 AromaticContact CD2-CZ3 3.93Å; F310-W332 HydrophobicContact CD2-CZ3 3.93Å; F310-W332 HydrophobicContact CE2-CZ3 4.47Å; F310-W332 HydrophobicContact CG-CH2 4.44Å; F310-W332 HydrophobicContact CG-CZ3 4.21Å; E328-W332 HydrophobicContact CB-CH2 4.28Å; E328-W332 HydrophobicContact CB-CZ2 3.43Å; E328-W332 VanDerWaalsContact CB-CZ2 3.43Å; E328-W332 VanDerWaalsContact O-CD1 3.23Å; E328-W332 VanDerWaalsContact O-CG 3.23Å; E328-W332 PolarHBondContact O-N 2.95Å; E328-W332 PolarHBondContact O-NE1 2.96Å; L329-W332 HydrophobicContact CB-CE3 4.36Å; L329-W332 HydrophobicContact CB-CZ3 4.42Å; L329-W332 HydrophobicContact CD1-CE3 3.89Å; L329-W332 HydrophobicContact CD1-CZ3 4.25Å; L329-W332 PolarHBondContact O-N 3.2Å; W332-K334 PolarHBondContact O-N 3.23Å; W332-T335 PolarHBondContact O-N 2.94Å; W332-D336 PolarHBondContact O-N 3.37Å; W332-F340 HydrophobicContact CB-CD1 3.99Å; W332-F340 HydrophobicContact CB-CD2 4.21Å; W332-F340 HydrophobicContact CB-CE1 4.23Å; W332-F340 HydrophobicContact CB-CE2 4.44Å; W332-F340 HydrophobicContact CB-CG 3.99Å; W332-F340 HydrophobicContact CB-CZ 4.46Å; W332-F340 HydrophobicContact CE3-CD1 4.48Å; W332-F340 HydrophobicContact CE3-CE1 4.18Å
333	L	96.1	Very high	95.1	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-57.8	-32.9	175.1	-74.5	165.6	0	0	0	113.3	L329 F340 L341 C345 L346 L349 L371	L329-L333 HydrophobicContact CD1-CD1 4.27Å; L329-L333 HydrophobicContact CD1-CG 4.3Å; L329-L333 HydrophobicContact CD2-CD1 4.41Å; L329-L333 HydrophobicContact CG-CD1 3.86Å; L329-L333 HydrophobicContact CG-CG 4.37Å; L329-L333 WeakPolarHBondContact O-CB 3.18Å; L329-L333 WeakPolarHBondContact O-CD1 3.5Å; L329-L333 VanDerWaalsContact O-CG 3.26Å; L329-L333 WeakPolarHBondContact O-CG 3.25Å; L329-L333 PolarHBondContact O-N 3.16Å; L333-F340 HydrophobicContact CD2-CB 4.13Å; L333-F340 WeakPolarHBondContact CD2-O 3.49Å; L333-L341 HydrophobicContact CD2-CB 4.44Å; L333-L341 HydrophobicContact CD2-CD1 4.08Å; L333-C345 HydrophobicContact CD2-CB 4.07Å; L333-L346 HydrophobicContact CD1-CD2 4.26Å; L333-L346 HydrophobicContact CD2-CD2 4.16Å; L333-L346 HydrophobicContact CD2-CG 4.46Å; L333-L349 HydrophobicContact CD1-CD1 3.65Å; L333-L349 HydrophobicContact CD1-CG 4.24Å; L333-L371 HydrophobicContact CB-CD1 4.14Å; L333-L371 HydrophobicContact CB-CD2 3.83Å; L333-L371 HydrophobicContact CD1-CD1 4.16Å
334	K	95.4	Very high	94.8	Very high	63 Å²	63	42.1 Å²	42.1	27%	0.274	21%	0.209	S	C	.	.	H	α-helix	trans	-86.6	-33.4	178.7	-166.9	-175.2	177	96.1	0	113.1	G330 L331 W332 G370 L371 E374 F377	G330-K334 PolarHBondContact O-N 3.22Å; L331-K334 PolarHBondContact O-N 2.97Å; W332-K334 PolarHBondContact O-N 3.23Å; K334-G370 PolarHBondContact NZ-O 3.4Å; K334-L371 HydrophobicContact CB-CD2 4.03Å; K334-E374 VanDerWaalsContact CE-OE1 3.3Å; K334-E374 WeakPolarHBondContact CE-OE1 3.42Å; K334-E374 IonicContact NZ-OE1 3.68Å; K334-E374 PolarHBondContact NZ-OE1 2.96Å; K334-F377 HydrophobicContact CG-CE2 4.23Å
335	T	95.1	Very high	94.7	Very high	53 Å²	53	42.5 Å²	42.5	33%	0.325	21%	0.211	S	C	.	.	H	α-helix	trans	-86.3	-38.9	-172.4	-53.6	0	0	0	0	112.7	V248 V252 L331 W332	V248-T335 HydrophobicContact CG1-CG2 4Å; V252-T335 HydrophobicContact CG2-CG2 4.38Å; L331-T335 VanDerWaalsContact O-CB 3.3Å; L331-T335 WeakPolarHBondContact O-CB 3.4Å; L331-T335 PolarHBondContact O-N 3.12Å; L331-T335 PolarHBondContact O-OG1 3.36Å; W332-T335 PolarHBondContact O-N 2.94Å
336	D	94.1	Very high	94.6	Very high	13 Å²	13	42.6 Å²	42.6	7%	0.07	21%	0.212	C	C	.	.			trans	-129.8	72.1	178.9	-177.6	2.8	0	0	0	110.2	V248 V252 W332 D338 N339 F340	V248-D336 HydrophobicContact CG1-CB 3.68Å; V252-D336 HydrophobicContact CG2-CB 3.72Å; W332-D336 PolarHBondContact O-N 3.37Å; D336-D338 PolarHBondContact O-N 3.42Å; D336-N339 VanDerWaalsContact CG-ND2 3.34Å; D336-N339 PolarHBondContact O-N 3.32Å; D336-N339 PolarHBondContact OD1-N 3.32Å; D336-N339 PolarHBondContact OD1-ND2 3Å; D336-N339 VanDerWaalsContact OD1-ND2 3.15Å; D336-N339 WeakPolarHBondContact OD2-CB 3.41Å; D336-N339 PolarHBondContact OD2-ND2 3.25Å; D336-F340 HydrophobicContact CB-CD2 3.9Å; D336-F340 HydrophobicContact CB-CE2 4.29Å; D336-F340 WeakPolarHBondContact O-CB 3.27Å; D336-F340 WeakPolarHBondContact O-CD2 3.47Å; D336-F340 PolarHBondContact O-N 3.29Å
337	P	93.4	Very high	94.5	Very high	24 Å²	24	46.5 Å²	46.5	16%	0.156	23%	0.229	C	C	.	.	H	α-helix	trans	-65.8	-23.6	-175	27.3	-35.9	0	0	0	112.7	L341 F377 R380	P337-L341 HydrophobicContact CB-CB 3.71Å; P337-L341 HydrophobicContact CB-CD2 3.94Å; P337-L341 WeakPolarHBondContact O-CA 3.22Å; P337-L341 WeakPolarHBondContact O-CB 3.27Å; P337-L341 PolarHBondContact O-N 3.03Å; P337-F377 HydrophobicContact CB-CE1 3.81Å; P337-F377 HydrophobicContact CB-CZ 3.97Å; P337-F377 HydrophobicContact CG-CE1 3.84Å; P337-F377 HydrophobicContact CG-CZ 4.01Å; P337-R380 PolarHBondContact O-NH1 2.73Å
338	D	90.4	Very high	94.5	Very high	117 Å²	117	44.1 Å²	44.1	63%	0.626	22%	0.217	S	C	*	.	H	α-helix	trans	-77.1	-30.1	-176.4	-67.8	-15.9	0	0	0	112.6	D336 R380	D336-D338 PolarHBondContact O-N 3.42Å; D338-R380 IonicContact OD1-CZ 3.53Å; D338-R380 IonicContact OD1-NH1 3.68Å; D338-R380 PolarHBondContact OD1-NH1 3.05Å; D338-R380 IonicContact OD1-NH2 2.73Å; D338-R380 PolarHBondContact OD1-NH2 3.17Å
339	N	89.6	Confident	94.5	Very high	86 Å²	86	44 Å²	44	46%	0.46	22%	0.217	S	C	.	.	H	α-helix	trans	-89.6	-35.1	169.7	-65.4	-58.8	0	0	0	113.1	D336 N342	D336-N339 VanDerWaalsContact CG-ND2 3.34Å; D336-N339 PolarHBondContact O-N 3.32Å; D336-N339 PolarHBondContact OD1-N 3.32Å; D336-N339 PolarHBondContact OD1-ND2 3Å; D336-N339 VanDerWaalsContact OD1-ND2 3.15Å; D336-N339 WeakPolarHBondContact OD2-CB 3.41Å; D336-N339 PolarHBondContact OD2-ND2 3.25Å; N339-N342 PolarHBondContact O-ND2 3.03Å
340	F	93.9	Very high	94.5	Very high	17 Å²	17	44 Å²	44	8%	0.075	22%	0.217	C	C	.	.	H	α-helix	trans	-104.3	-35.1	-171.1	-67.1	-88.4	0	0	0	115.5	M244 V248 M302 W332 L333 D336 N342 C345	M244-F340 HydrophobicContact CE-CE1 3.85Å; M244-F340 HydrophobicContact CE-CZ 3.55Å; V248-F340 HydrophobicContact CG2-CE2 3.94Å; V248-F340 HydrophobicContact CG2-CZ 4.11Å; M302-F340 HydrophobicContact SD-CZ 4.5Å; W332-F340 HydrophobicContact CB-CD1 3.99Å; W332-F340 HydrophobicContact CB-CD2 4.21Å; W332-F340 HydrophobicContact CB-CE1 4.23Å; W332-F340 HydrophobicContact CB-CE2 4.44Å; W332-F340 HydrophobicContact CB-CG 3.99Å; W332-F340 HydrophobicContact CB-CZ 4.46Å; W332-F340 HydrophobicContact CE3-CD1 4.48Å; W332-F340 HydrophobicContact CE3-CE1 4.18Å; L333-F340 HydrophobicContact CD2-CB 4.13Å; L333-F340 WeakPolarHBondContact CD2-O 3.49Å; D336-F340 HydrophobicContact CB-CD2 3.9Å; D336-F340 HydrophobicContact CB-CE2 4.29Å; D336-F340 WeakPolarHBondContact O-CB 3.27Å; D336-F340 WeakPolarHBondContact O-CD2 3.47Å; D336-F340 PolarHBondContact O-N 3.29Å; F340-N342 VanDerWaalsContact C-N 3.27Å; F340-N342 PolarHBondContact O-N 2.74Å; F340-N342 PolarHBondContact O-ND2 2.94Å; F340-C345 WeakPolarHBondContact O-CB 3.42Å
341	L	95.2	Very high	94.5	Very high	5 Å²	5	49.7 Å²	49.7	3%	0.026	24%	0.235	C	C	.	.	S	Bend	trans	-79.9	75.5	-172.2	-171.5	62.3	0	0	0	111.6	L333 P337 L346 L371 F377 R380 L381	L333-L341 HydrophobicContact CD2-CB 4.44Å; L333-L341 HydrophobicContact CD2-CD1 4.08Å; P337-L341 HydrophobicContact CB-CB 3.71Å; P337-L341 HydrophobicContact CB-CD2 3.94Å; P337-L341 WeakPolarHBondContact O-CA 3.22Å; P337-L341 WeakPolarHBondContact O-CB 3.27Å; P337-L341 PolarHBondContact O-N 3.03Å; L341-L346 HydrophobicContact CD1-CD1 4.19Å; L341-L346 HydrophobicContact CD1-CD2 3.96Å; L341-L346 HydrophobicContact CD1-CG 4.32Å; L341-L371 HydrophobicContact CD1-CD1 4.19Å; L341-F377 HydrophobicContact CD2-CB 3.75Å; L341-F377 HydrophobicContact CD2-CD1 3.69Å; L341-F377 HydrophobicContact CD2-CD2 3.8Å; L341-F377 HydrophobicContact CD2-CE1 4.24Å; L341-F377 HydrophobicContact CD2-CE2 4.34Å; L341-F377 HydrophobicContact CD2-CG 3.46Å; L341-F377 VanDerWaalsContact CD2-CG 3.46Å; L341-R380 HydrophobicContact CD2-CB 4.24Å; L341-R380 HydrophobicContact CD2-CG 4.49Å; L341-R380 HydrophobicContact CG-CB 4.21Å; L341-L381 HydrophobicContact CD1-CD2 4.16Å
342	N	93.4	Very high	94.6	Very high	51 Å²	51	46.7 Å²	46.7	27%	0.273	22%	0.22	S	C	.	.	S	Bend	trans	-154.6	163.2	-179.9	56.2	71.2	0	0	0	111.3	N339 F340 R344 C345 L346	N339-N342 PolarHBondContact O-ND2 3.03Å; F340-N342 VanDerWaalsContact C-N 3.27Å; F340-N342 PolarHBondContact O-N 2.74Å; F340-N342 PolarHBondContact O-ND2 2.94Å; N342-R344 PolarHBondContact O-N 2.87Å; N342-R344 WeakPolarHBondContact OD1-CB 3.44Å; N342-R344 PolarHBondContact OD1-N 3.06Å; N342-C345 PolarHBondContact O-N 2.88Å; N342-L346 PolarHBondContact O-N 3.09Å
343	D	91.4	Very high	94.6	Very high	94 Å²	94	46.7 Å²	46.7	50%	0.503	22%	0.22	S	C	.	.	H	α-helix	trans	-52.1	-32.4	-176.9	-66.5	0.9	0	0	0	114.7	C345 K347	D343-C345 PolarHBondContact O-N 3.21Å; D343-K347 WeakPolarHBondContact O-CB 3.22Å; D343-K347 PolarHBondContact O-N 2.93Å
344	R	90.8	Very high	94.7	Very high	204 Å²	204	51 Å²	51	77%	0.77	24%	0.24	S	C	*	.	H	α-helix	trans	-62.9	-27.6	-179.4	-57.8	178.1	170.6	-176.7	-4.6	111.7	N342 K347 Y348	N342-R344 PolarHBondContact O-N 2.87Å; N342-R344 WeakPolarHBondContact OD1-CB 3.44Å; N342-R344 PolarHBondContact OD1-N 3.06Å; R344-K347 VanDerWaalsContact O-CE 3.29Å; R344-K347 WeakPolarHBondContact O-CE 3.46Å; R344-Y348 VanDerWaalsContact O-CE2 3.22Å; R344-Y348 WeakPolarHBondContact O-CE2 3.19Å
345	C	94.4	Very high	94.8	Very high	11 Å²	11	49.2 Å²	49.2	7%	0.074	23%	0.234	C	C	.	.	H	α-helix	trans	-103.3	-42.4	176.3	-57.3	0	0	0	0	112.4	L329 L333 F340 N342 D343 K347 Y348	L329-C345 HydrophobicContact CD1-CB 4.44Å; L333-C345 HydrophobicContact CD2-CB 4.07Å; F340-C345 WeakPolarHBondContact O-CB 3.42Å; N342-C345 PolarHBondContact O-N 2.88Å; D343-C345 PolarHBondContact O-N 3.21Å; C345-K347 PolarHBondContact O-N 2.82Å; C345-K347 VanDerWaalsContact O-N 3.17Å; C345-Y348 VanDerWaalsContact O-CD2 3.27Å; C345-Y348 WeakPolarHBondContact O-CD2 3.15Å; C345-Y348 PolarHBondContact O-N 3.21Å
346	L	95.6	Very high	94.9	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-58.4	-31.3	-178.5	-74.7	173.6	0	0	0	113	L333 L341 N342 Y348 L349 G350 L371 L381 F384	L333-L346 HydrophobicContact CD1-CD2 4.26Å; L333-L346 HydrophobicContact CD2-CD2 4.16Å; L333-L346 HydrophobicContact CD2-CG 4.46Å; L341-L346 HydrophobicContact CD1-CD1 4.19Å; L341-L346 HydrophobicContact CD1-CD2 3.96Å; L341-L346 HydrophobicContact CD1-CG 4.32Å; N342-L346 PolarHBondContact O-N 3.09Å; L346-Y348 PolarHBondContact O-N 3.06Å; L346-Y348 VanDerWaalsContact O-N 3.13Å; L346-L349 HydrophobicContact CD2-CD1 4.39Å; L346-L349 WeakPolarHBondContact O-CB 3.47Å; L346-L349 PolarHBondContact O-N 2.99Å; L346-G350 PolarHBondContact O-N 3.37Å; L346-L371 HydrophobicContact CD2-CD1 4.25Å; L346-L381 HydrophobicContact CD1-CD2 4.27Å; L346-L381 HydrophobicContact CD2-CD2 4.14Å; L346-F384 HydrophobicContact CB-CD2 3.98Å; L346-F384 HydrophobicContact CD1-CB 4.45Å; L346-F384 WeakPolarHBondContact O-CE2 3.26Å
347	K	95.3	Very high	95.1	Very high	83 Å²	83	59.3 Å²	59.3	36%	0.361	27%	0.274	S	S	.	.	H	α-helix	trans	-53.6	-32.3	174.7	71.9	-175.5	-171.8	178.8	0	113.9	D343 R344 C345 G350 W351	D343-K347 WeakPolarHBondContact O-CB 3.22Å; D343-K347 PolarHBondContact O-N 2.93Å; R344-K347 VanDerWaalsContact O-CE 3.29Å; R344-K347 WeakPolarHBondContact O-CE 3.46Å; C345-K347 PolarHBondContact O-N 2.82Å; C345-K347 VanDerWaalsContact O-N 3.17Å; K347-G350 PolarHBondContact O-N 3.48Å; K347-W351 HydrophobicContact CB-CZ2 4.47Å; K347-W351 HydrophobicContact CD-CH2 3.75Å; K347-W351 HydrophobicContact CD-CZ2 4.15Å; K347-W351 HydrophobicContact CD-CZ3 4.16Å; K347-W351 HydrophobicContact CG-CE3 4.46Å; K347-W351 HydrophobicContact CG-CH2 4.14Å; K347-W351 HydrophobicContact CG-CZ2 4.43Å; K347-W351 HydrophobicContact CG-CZ3 4.14Å; K347-W351 VanDerWaalsContact O-CG 3.29Å; K347-W351 PolarHBondContact O-N 2.99Å
348	Y	97.6	Very high	95.3	Very high	21 Å²	21	59.4 Å²	59.4	8%	0.082	28%	0.275	C	S	.	.	H	α-helix	trans	-69	-34.6	179.6	-61.8	-68.2	0	0	0	111.8	F306 F310 Y314 R344 C345 L346 W351 T352	F306-Y348 HydrophobicContact CE1-CE2 4.2Å; F306-Y348 HydrophobicContact CZ-CD2 4.3Å; F306-Y348 AromaticContact CZ-CE2 3.74Å; F306-Y348 HydrophobicContact CZ-CE2 3.74Å; F310-Y348 HydrophobicContact CE1-CD1 4.09Å; F310-Y348 AromaticContact CE1-CD2 3.75Å; F310-Y348 HydrophobicContact CE1-CD2 3.75Å; F310-Y348 HydrophobicContact CE1-CE1 4.33Å; F310-Y348 HydrophobicContact CE1-CE2 4.02Å; F310-Y348 AromaticContact CE1-CG 3.82Å; F310-Y348 HydrophobicContact CE1-CG 3.82Å; F310-Y348 HydrophobicContact CZ-CD2 4.23Å; F310-Y348 HydrophobicContact CZ-CG 4.04Å; Y314-Y348 HydrophobicContact CD1-CD1 4.19Å; Y314-Y348 HydrophobicContact CD1-CE1 4.31Å; Y314-Y348 HydrophobicContact CD2-CD1 4.17Å; Y314-Y348 AromaticContact CE1-CD1 3.84Å; Y314-Y348 HydrophobicContact CE1-CD1 3.84Å; Y314-Y348 AromaticContact CE1-CE1 3.73Å; Y314-Y348 HydrophobicContact CE1-CE1 3.73Å; Y314-Y348 AromaticContact CE2-CD1 3.84Å; Y314-Y348 HydrophobicContact CE2-CD1 3.84Å; Y314-Y348 HydrophobicContact CE2-CE1 4.47Å; Y314-Y348 HydrophobicContact CG-CD1 4.35Å; Y314-Y348 AromaticContact CZ-CD1 3.66Å; Y314-Y348 AromaticContact CZ-CE1 3.83Å; R344-Y348 VanDerWaalsContact O-CE2 3.22Å; R344-Y348 WeakPolarHBondContact O-CE2 3.19Å; C345-Y348 VanDerWaalsContact O-CD2 3.27Å; C345-Y348 WeakPolarHBondContact O-CD2 3.15Å; C345-Y348 PolarHBondContact O-N 3.21Å; L346-Y348 PolarHBondContact O-N 3.06Å; L346-Y348 VanDerWaalsContact O-N 3.13Å; Y348-W351 AromaticContact CD1-CE3 3.86Å; Y348-W351 HydrophobicContact CD1-CE3 3.86Å; Y348-W351 AromaticContact CD1-CZ3 3.81Å; Y348-W351 HydrophobicContact CD1-CZ3 3.81Å; Y348-W351 HydrophobicContact CE1-CE3 4.26Å; Y348-W351 AromaticContact CE1-CZ3 3.73Å; Y348-W351 HydrophobicContact CE1-CZ3 3.73Å; Y348-T352 VanDerWaalsContact O-CB 3.27Å; Y348-T352 WeakPolarHBondContact O-CB 3.28Å; Y348-T352 PolarHBondContact O-N 3.16Å; Y348-T352 VanDerWaalsContact O-N 3.1Å; Y348-T352 PolarHBondContact O-OG1 2.94Å
349	L	97.1	Very high	95.6	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.2	-48.8	170.5	-62	-175.7	0	0	0	110.4	I326 L329 L333 L346 W351 T352 L353 C364 A367 L368 L371 F384	I326-L349 HydrophobicContact CD1-CD2 4.28Å; I326-L349 HydrophobicContact CG2-CD2 3.91Å; L329-L349 HydrophobicContact CD2-CD2 3.99Å; L329-L349 HydrophobicContact CD2-CG 4.21Å; L333-L349 HydrophobicContact CD1-CD1 3.65Å; L333-L349 HydrophobicContact CD1-CG 4.24Å; L346-L349 HydrophobicContact CD2-CD1 4.39Å; L346-L349 WeakPolarHBondContact O-CB 3.47Å; L346-L349 PolarHBondContact O-N 2.99Å; L349-W351 VanDerWaalsContact C-N 3.34Å; L349-W351 PolarHBondContact O-N 3.3Å; L349-T352 WeakPolarHBondContact O-CA 3.3Å; L349-T352 WeakPolarHBondContact O-CB 3.36Å; L349-T352 PolarHBondContact O-N 2.88Å; L349-L353 PolarHBondContact O-N 3.34Å; L349-C364 PolarHBondContact O-SG 2.83Å; L349-A367 HydrophobicContact CD1-CB 4.42Å; L349-A367 HydrophobicContact CD2-CB 4.1Å; L349-L368 HydrophobicContact CB-CD2 4.45Å; L349-L368 HydrophobicContact CD1-CD2 3.71Å; L349-L368 HydrophobicContact CD1-CG 4.22Å; L349-L371 HydrophobicContact CD1-CD1 4.4Å; L349-F384 HydrophobicContact CB-CE2 4.36Å; L349-F384 HydrophobicContact CB-CZ 4.27Å
350	G	96.3	Very high	96	Very high	0 Å²	0	53 Å²	53	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-58.1	-41	-179.1	0	0	0	0	0	113.9	L346 K347 H354	L346-G350 PolarHBondContact O-N 3.37Å; K347-G350 PolarHBondContact O-N 3.48Å; G350-H354 PolarHBondContact O-CE1 2.83Å; G350-H354 PolarHBondContact O-ND1 2.91Å
351	W	97.2	Very high	96.2	Very high	127 Å²	127	53.1 Å²	53.1	48%	0.481	24%	0.244	S	C	.	.	H	α-helix	trans	-65.9	-40.1	170.7	-64	-27.4	0	0	0	112.2	Y314 K347 Y348 L349 L353 H354	Y314-W351 HydrophobicContact CE2-CE3 4.39Å; K347-W351 HydrophobicContact CB-CZ2 4.47Å; K347-W351 HydrophobicContact CD-CH2 3.75Å; K347-W351 HydrophobicContact CD-CZ2 4.15Å; K347-W351 HydrophobicContact CD-CZ3 4.16Å; K347-W351 HydrophobicContact CG-CE3 4.46Å; K347-W351 HydrophobicContact CG-CH2 4.14Å; K347-W351 HydrophobicContact CG-CZ2 4.43Å; K347-W351 HydrophobicContact CG-CZ3 4.14Å; K347-W351 VanDerWaalsContact O-CG 3.29Å; K347-W351 PolarHBondContact O-N 2.99Å; Y348-W351 AromaticContact CD1-CE3 3.86Å; Y348-W351 HydrophobicContact CD1-CE3 3.86Å; Y348-W351 AromaticContact CD1-CZ3 3.81Å; Y348-W351 HydrophobicContact CD1-CZ3 3.81Å; Y348-W351 HydrophobicContact CE1-CE3 4.26Å; Y348-W351 AromaticContact CE1-CZ3 3.73Å; Y348-W351 HydrophobicContact CE1-CZ3 3.73Å; L349-W351 VanDerWaalsContact C-N 3.34Å; L349-W351 PolarHBondContact O-N 3.3Å; W351-L353 VanDerWaalsContact C-N 3.3Å; W351-L353 PolarHBondContact O-N 3.25Å; W351-H354 WeakPolarHBondContact O-CB 3.39Å; W351-H354 PolarHBondContact O-N 3.36Å
352	T	97.5	Very high	96.3	Very high	8 Å²	8	54.3 Å²	54.3	5%	0.049	25%	0.25	C	S	.	.	H	α-helix	trans	-67.2	-25.5	-177.9	-60.2	0	0	0	0	113.7	I326 Y348 L349 H354 D355 V360 C364	I326-T352 HydrophobicContact CD1-CG2 4.12Å; I326-T352 VanDerWaalsContact CD1-OG1 3.27Å; I326-T352 WeakPolarHBondContact CD1-OG1 3.44Å; I326-T352 HydrophobicContact CG1-CG2 3.94Å; I326-T352 HydrophobicContact CG2-CG2 4.3Å; Y348-T352 VanDerWaalsContact O-CB 3.27Å; Y348-T352 WeakPolarHBondContact O-CB 3.28Å; Y348-T352 PolarHBondContact O-N 3.16Å; Y348-T352 VanDerWaalsContact O-N 3.1Å; Y348-T352 PolarHBondContact O-OG1 2.94Å; L349-T352 WeakPolarHBondContact O-CA 3.3Å; L349-T352 WeakPolarHBondContact O-CB 3.36Å; L349-T352 PolarHBondContact O-N 2.88Å; T352-H354 PolarHBondContact O-N 2.66Å; T352-D355 VanDerWaalsContact O-CB 3.32Å; T352-D355 WeakPolarHBondContact O-CB 3.44Å; T352-D355 PolarHBondContact O-N 2.78Å; T352-V360 HydrophobicContact CG2-CG1 3.58Å; T352-C364 HydrophobicContact CG2-CB 3.78Å
353	L	97.7	Very high	96.5	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-20	169	-64.8	175.1	0	0	0	113.2	L349 W351 R361 C364 V365 L368 F384 F388 R391 I392 M395	L349-L353 PolarHBondContact O-N 3.34Å; W351-L353 VanDerWaalsContact C-N 3.3Å; W351-L353 PolarHBondContact O-N 3.25Å; L353-R361 WeakPolarHBondContact O-CD 3.37Å; L353-C364 HydrophobicContact CD2-CB 4.43Å; L353-V365 HydrophobicContact CD2-CG2 4.16Å; L353-L368 HydrophobicContact CD1-CD1 4.46Å; L353-L368 HydrophobicContact CD2-CD1 4.12Å; L353-F384 HydrophobicContact CD1-CZ 4.46Å; L353-F388 HydrophobicContact CD1-CB 4.2Å; L353-R391 HydrophobicContact CB-CG 3.85Å; L353-R391 HydrophobicContact CD1-CG 4.38Å; L353-R391 PolarHBondContact O-NE 3.31Å; L353-R391 PolarHBondContact O-NH2 2.72Å; L353-I392 HydrophobicContact CD1-CG1 3.99Å; L353-M395 HydrophobicContact CB-SD 4.1Å; L353-M395 HydrophobicContact CD2-CE 4.25Å; L353-M395 HydrophobicContact CD2-SD 4.04Å
354	H	97.6	Very high	96.8	Very high	90 Å²	90	49.3 Å²	49.3	42%	0.417	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	3.1	-180	-56.4	82.3	0	0	0	113.9	G350 W351 T352 R391	G350-H354 PolarHBondContact O-CE1 2.83Å; G350-H354 PolarHBondContact O-ND1 2.91Å; W351-H354 WeakPolarHBondContact O-CB 3.39Å; W351-H354 PolarHBondContact O-N 3.36Å; T352-H354 PolarHBondContact O-N 2.66Å; H354-R391 WeakPolarHBondContact NE2-CD 3.36Å
355	D	98.3	Very high	97.2	Very high	27 Å²	27	39.7 Å²	39.7	14%	0.144	19%	0.186	C	C	.	.			trans	-58.7	141.8	179.3	-164.5	-67.8	0	0	0	111.5	R322 T352 Q357 V360 R361	R322-D355 IonicContact CZ-OD1 3.91Å; R322-D355 IonicContact CZ-OD2 2.81Å; R322-D355 IonicContact NE-OD2 2.73Å; R322-D355 PolarHBondContact NE-OD2 2.89Å; R322-D355 VanDerWaalsContact NH2-CG 3.29Å; R322-D355 IonicContact NH2-OD1 2.95Å; R322-D355 PolarHBondContact NH2-OD1 2.98Å; R322-D355 IonicContact NH2-OD2 3.76Å; R322-D355 PolarHBondContact NH2-OD2 3.28Å; T352-D355 VanDerWaalsContact O-CB 3.32Å; T352-D355 WeakPolarHBondContact O-CB 3.44Å; T352-D355 PolarHBondContact O-N 2.78Å; D355-Q357 VanDerWaalsContact C-N 3.3Å; D355-Q357 PolarHBondContact O-N 3.39Å; D355-Q357 WeakPolarHBondContact OD1-CB 3.45Å; D355-Q357 PolarHBondContact OD1-N 3.02Å; D355-V360 HydrophobicContact CB-CB 4.08Å; D355-V360 HydrophobicContact CB-CG1 4.17Å; D355-R361 HydrophobicContact CB-CG 4.12Å; D355-R361 VanDerWaalsContact O-CD 3.25Å; D355-R361 WeakPolarHBondContact O-CD 3.33Å; D355-R361 WeakPolarHBondContact O-CG 3.19Å; D355-R361 PolarHBondContact O-NH1 3.41Å
356	K	96.5	Very high	97.3	Very high	179 Å²	179	43.9 Å²	43.9	78%	0.778	20%	0.201	S	C	*	.	S	Bend	trans	-74.9	-16.7	-178.4	-51.4	-51.9	-178.2	-169.5	0	113.3	R361	K356-R361 PolarHBondContact O-NH1 2.89Å
357	Q	97.6	Very high	97.4	Very high	99 Å²	99	44.2 Å²	44.2	46%	0.463	20%	0.203	S	C	.	.	S	Bend	trans	-105.3	128	-175.8	-56.4	-61.2	-62.5	0	0	111.6	A319 D355 V360 R361	A319-Q357 HydrophobicContact CB-CB 4.03Å; A319-Q357 HydrophobicContact CB-CG 4.07Å; D355-Q357 VanDerWaalsContact C-N 3.3Å; D355-Q357 PolarHBondContact O-N 3.39Å; D355-Q357 WeakPolarHBondContact OD1-CB 3.45Å; D355-Q357 PolarHBondContact OD1-N 3.02Å; Q357-V360 HydrophobicContact CB-CG2 4.16Å; Q357-V360 PolarHBondContact O-N 3.14Å; Q357-R361 VanDerWaalsContact C-NH1 3.34Å; Q357-R361 PolarHBondContact O-N 3.13Å
358	S	97.3	Very high	97.5	Very high	26 Å²	26	40.2 Å²	40.2	18%	0.182	19%	0.186	C	C	.	.	H	α-helix	trans	-62.9	-35.7	-174.6	48.1	0	0	0	0	115.7	V360 R361 L362 D400	S358-V360 PolarHBondContact O-N 2.94Å; S358-R361 PolarHBondContact O-N 2.86Å; S358-L362 VanDerWaalsContact O-CB 3.28Å; S358-L362 WeakPolarHBondContact O-CB 3.43Å; S358-L362 PolarHBondContact O-N 2.91Å; S358-D400 WeakPolarHBondContact CB-OD2 3.47Å; S358-D400 PolarHBondContact OG-OD2 2.89Å
359	P	96.9	Very high	97.4	Very high	66 Å²	66	40.3 Å²	40.3	43%	0.429	19%	0.187	S	C	.	.	H	α-helix	trans	-62	-29.4	178.2	-24.1	35.5	0	0	0	113.3	Q363	P359-Q363 WeakPolarHBondContact O-CB 3.47Å; P359-Q363 PolarHBondContact O-N 2.97Å
360	V	98.3	Very high	97.3	Very high	1 Å²	1	41 Å²	41	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-76.4	-43.7	179	-165	0	0	0	0	110.4	A319 R322 A323 T352 D355 Q357 S358 Q363 C364	A319-V360 HydrophobicContact CB-CG2 3.99Å; R322-V360 HydrophobicContact CB-CG1 3.85Å; R322-V360 HydrophobicContact CB-CG2 4.17Å; A323-V360 HydrophobicContact CB-CG2 4.37Å; T352-V360 HydrophobicContact CG2-CG1 3.58Å; D355-V360 HydrophobicContact CB-CB 4.08Å; D355-V360 HydrophobicContact CB-CG1 4.17Å; Q357-V360 HydrophobicContact CB-CG2 4.16Å; Q357-V360 PolarHBondContact O-N 3.14Å; S358-V360 PolarHBondContact O-N 2.94Å; V360-Q363 PolarHBondContact O-N 3.11Å; V360-C364 PolarHBondContact O-N 3.04Å
361	R	98.4	Very high	97.3	Very high	20 Å²	20	41 Å²	41	8%	0.075	19%	0.194	C	C	.	.	H	α-helix	trans	-62.1	-44.7	173.3	-65	-163.6	-59.1	-74.3	-1.6	111.7	L353 D355 K356 Q357 S358 Q363 C364 V365 M395 D398 V403	L353-R361 WeakPolarHBondContact O-CD 3.37Å; D355-R361 HydrophobicContact CB-CG 4.12Å; D355-R361 VanDerWaalsContact O-CD 3.25Å; D355-R361 WeakPolarHBondContact O-CD 3.33Å; D355-R361 WeakPolarHBondContact O-CG 3.19Å; D355-R361 PolarHBondContact O-NH1 3.41Å; K356-R361 PolarHBondContact O-NH1 2.89Å; Q357-R361 VanDerWaalsContact C-NH1 3.34Å; Q357-R361 PolarHBondContact O-N 3.13Å; S358-R361 PolarHBondContact O-N 2.86Å; R361-Q363 VanDerWaalsContact C-N 3.31Å; R361-Q363 PolarHBondContact O-N 3Å; R361-C364 WeakPolarHBondContact O-CB 3.17Å; R361-C364 PolarHBondContact O-N 2.97Å; R361-V365 WeakPolarHBondContact O-CG2 3.34Å; R361-V365 PolarHBondContact O-N 3.31Å; R361-M395 HydrophobicContact CB-CE 3.99Å; R361-M395 HydrophobicContact CG-CE 4.46Å; R361-D398 IonicContact CZ-OD1 3.39Å; R361-D398 IonicContact CZ-OD2 2.66Å; R361-D398 VanDerWaalsContact CZ-OD2 3.27Å; R361-D398 IonicContact NE-OD1 2.78Å; R361-D398 IonicContact NE-OD2 3.17Å; R361-D398 PolarHBondContact NE-OD2 3.36Å; R361-D398 VanDerWaalsContact NH2-CG 3.29Å; R361-D398 IonicContact NH2-OD1 3.02Å; R361-D398 PolarHBondContact NH2-OD1 3.46Å; R361-D398 IonicContact NH2-OD2 2.78Å; R361-D398 PolarHBondContact NH2-OD2 2.74Å; R361-V403 HydrophobicContact CB-CG1 4.16Å
362	L	97.8	Very high	97.1	Very high	30 Å²	30	35.1 Å²	35.1	16%	0.157	17%	0.172	C	C	.	.	H	α-helix	trans	-54.3	-46.8	176.1	-171.6	68.1	0	0	0	111.6	S358 V365 R366 D402 V403 E406	S358-L362 VanDerWaalsContact O-CB 3.28Å; S358-L362 WeakPolarHBondContact O-CB 3.43Å; S358-L362 PolarHBondContact O-N 2.91Å; L362-V365 PolarHBondContact O-N 2.78Å; L362-R366 WeakPolarHBondContact O-CG 3.45Å; L362-R366 PolarHBondContact O-N 3.06Å; L362-D402 WeakPolarHBondContact CD1-O 3.33Å; L362-V403 HydrophobicContact CB-CG2 4.04Å; L362-V403 HydrophobicContact CD1-CG2 4.25Å; L362-E406 HydrophobicContact CD1-CB 4.32Å; L362-E406 HydrophobicContact CD1-CG 3.68Å
363	Q	97.6	Very high	96.9	Very high	41 Å²	41	39.8 Å²	39.8	19%	0.192	19%	0.193	C	C	.	.	H	α-helix	trans	-69.8	-35.8	-179.6	-162.8	58.8	32.4	0	0	112.5	E327 P359 V360 R361 R366 A367	E327-Q363 HydrophobicContact CB-CG 3.8Å; P359-Q363 WeakPolarHBondContact O-CB 3.47Å; P359-Q363 PolarHBondContact O-N 2.97Å; V360-Q363 PolarHBondContact O-N 3.11Å; R361-Q363 VanDerWaalsContact C-N 3.31Å; R361-Q363 PolarHBondContact O-N 3Å; Q363-R366 PolarHBondContact O-N 3.05Å; Q363-A367 WeakPolarHBondContact O-CB 3.28Å; Q363-A367 PolarHBondContact O-N 3.3Å
364	C	98.1	Very high	96.6	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63	-42.7	173	-171.8	0	0	0	0	112.5	I326 L349 T352 L353 V360 R361 A367 L368	I326-C364 HydrophobicContact CG2-CB 4.03Å; L349-C364 PolarHBondContact O-SG 2.83Å; T352-C364 HydrophobicContact CG2-CB 3.78Å; L353-C364 HydrophobicContact CD2-CB 4.43Å; V360-C364 PolarHBondContact O-N 3.04Å; R361-C364 WeakPolarHBondContact O-CB 3.17Å; R361-C364 PolarHBondContact O-N 2.97Å; C364-A367 PolarHBondContact O-N 3.35Å; C364-L368 WeakPolarHBondContact O-CG 3.44Å; C364-L368 PolarHBondContact O-N 2.81Å
365	V	98.1	Very high	96.2	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	22%	0.224	C	C	.	.	H	α-helix	trans	-65.8	-41.5	177.7	173.7	0	0	0	0	110.8	L353 R361 L362 L368 Q369 M395 E406 V407 L410	L353-V365 HydrophobicContact CD2-CG2 4.16Å; R361-V365 WeakPolarHBondContact O-CG2 3.34Å; R361-V365 PolarHBondContact O-N 3.31Å; L362-V365 PolarHBondContact O-N 2.78Å; V365-L368 PolarHBondContact O-N 2.88Å; V365-Q369 WeakPolarHBondContact O-CG 3.27Å; V365-Q369 PolarHBondContact O-N 3.16Å; V365-M395 HydrophobicContact CG2-CE 3.76Å; V365-E406 HydrophobicContact CB-CB 4.47Å; V365-E406 VanDerWaalsContact CG1-C 3.44Å; V365-E406 HydrophobicContact CG1-CB 3.66Å; V365-E406 VanDerWaalsContact CG1-O 3.29Å; V365-E406 WeakPolarHBondContact CG1-O 3.29Å; V365-V407 HydrophobicContact CG1-CG2 4.05Å; V365-V407 HydrophobicContact CG2-CG2 3.71Å; V365-L410 HydrophobicContact CG1-CB 4.2Å; V365-L410 HydrophobicContact CG1-CD2 4.06Å
366	R	97.6	Very high	95.8	Very high	100 Å²	100	54.1 Å²	54.1	38%	0.377	26%	0.257	S	S	.	.	H	α-helix	trans	-65.2	-37.1	174.1	-74.2	179	175.8	147.1	6.6	113.6	L362 Q363 L368 Q369 G370 E406	L362-R366 WeakPolarHBondContact O-CG 3.45Å; L362-R366 PolarHBondContact O-N 3.06Å; Q363-R366 PolarHBondContact O-N 3.05Å; R366-L368 VanDerWaalsContact C-N 3.34Å; R366-Q369 PolarHBondContact O-N 3.12Å; R366-G370 PolarHBondContact O-N 2.81Å; R366-E406 IonicContact CZ-OE1 3.7Å; R366-E406 IonicContact NE-OE1 3Å; R366-E406 PolarHBondContact NE-OE1 3.37Å; R366-E406 IonicContact NH2-OE1 3.83Å; R366-E406 PolarHBondContact NH2-OE1 2.89Å
367	A	96.9	Very high	95.6	Very high	8 Å²	8	46.4 Å²	46.4	7%	0.066	22%	0.224	C	C	.	.	H	α-helix	trans	-59.7	-45.7	171.7	0	0	0	0	0	110.8	L349 Q363 C364 G370 L371	L349-A367 HydrophobicContact CD1-CB 4.42Å; L349-A367 HydrophobicContact CD2-CB 4.1Å; Q363-A367 WeakPolarHBondContact O-CB 3.28Å; Q363-A367 PolarHBondContact O-N 3.3Å; C364-A367 PolarHBondContact O-N 3.35Å; A367-G370 PolarHBondContact O-N 2.94Å; A367-L371 PolarHBondContact O-N 3.28Å
368	L	97.1	Very high	95.3	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.3	-47.6	176	-68.4	171.5	0	0	0	112.4	L349 L353 C364 V365 R366 G370 L371 Y372 F384 L410	L349-L368 HydrophobicContact CB-CD2 4.45Å; L349-L368 HydrophobicContact CD1-CD2 3.71Å; L349-L368 HydrophobicContact CD1-CG 4.22Å; L353-L368 HydrophobicContact CD1-CD1 4.46Å; L353-L368 HydrophobicContact CD2-CD1 4.12Å; C364-L368 WeakPolarHBondContact O-CG 3.44Å; C364-L368 PolarHBondContact O-N 2.81Å; V365-L368 PolarHBondContact O-N 2.88Å; R366-L368 VanDerWaalsContact C-N 3.34Å; L368-G370 PolarHBondContact O-N 2.67Å; L368-L371 WeakPolarHBondContact O-CA 3.42Å; L368-L371 PolarHBondContact O-N 2.77Å; L368-Y372 HydrophobicContact CB-CD2 4.46Å; L368-Y372 HydrophobicContact CB-CE2 4.3Å; L368-Y372 VanDerWaalsContact O-CD2 3.22Å; L368-Y372 WeakPolarHBondContact O-CD2 3.44Å; L368-Y372 PolarHBondContact O-N 3.2Å; L368-F384 HydrophobicContact CD1-CE1 3.92Å; L368-F384 HydrophobicContact CD1-CZ 4.13Å; L368-F384 HydrophobicContact CD2-CD1 4.23Å; L368-F384 HydrophobicContact CD2-CE1 3.47Å; L368-F384 VanDerWaalsContact CD2-CE1 3.47Å; L368-F384 HydrophobicContact CD2-CZ 3.78Å; L368-F384 HydrophobicContact CG-CE1 4.37Å; L368-L410 HydrophobicContact CB-CD1 4.04Å; L368-L410 HydrophobicContact CB-CD2 3.97Å; L368-L410 HydrophobicContact CD1-CD2 4.07Å
369	Q	96.4	Very high	95	Very high	23 Å²	23	44 Å²	44	11%	0.107	23%	0.225	C	C	.	.	H	α-helix	trans	-51.3	-42.5	174	-71.8	172.7	-11.4	0	0	111.5	V365 R366 L371 Y372 Q373 E406 L410 M413	V365-Q369 WeakPolarHBondContact O-CG 3.27Å; V365-Q369 PolarHBondContact O-N 3.16Å; R366-Q369 PolarHBondContact O-N 3.12Å; Q369-L371 PolarHBondContact O-N 2.84Å; Q369-Y372 PolarHBondContact O-N 2.97Å; Q369-Q373 VanDerWaalsContact O-CG 3.29Å; Q369-Q373 WeakPolarHBondContact O-CG 3.43Å; Q369-Q373 PolarHBondContact O-N 2.78Å; Q369-Q373 VanDerWaalsContact O-N 3.14Å; Q369-E406 PolarHBondContact NE2-O 3.35Å; Q369-E406 PolarHBondContact NE2-OE2 2.77Å; Q369-L410 HydrophobicContact CG-CB 4.08Å; Q369-L410 HydrophobicContact CG-CD1 4.19Å; Q369-M413 HydrophobicContact CB-SD 4.49Å
370	G	94.9	Very high	94.7	Very high	14 Å²	14	45.6 Å²	45.6	14%	0.144	22%	0.223	C	C	.	.	H	α-helix	trans	-63.6	-19.1	176.9	0	0	0	0	0	115	K334 R366 A367 L368	K334-G370 PolarHBondContact NZ-O 3.4Å; R366-G370 PolarHBondContact O-N 2.81Å; A367-G370 PolarHBondContact O-N 2.94Å; L368-G370 PolarHBondContact O-N 2.67Å
371	L	95.1	Very high	94.4	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-92.8	-43.7	175.2	-57.9	174.7	0	0	0	111.8	L333 K334 L341 L346 L349 A367 L368 Q369 Q373 E374 F377 L381	L333-L371 HydrophobicContact CB-CD1 4.14Å; L333-L371 HydrophobicContact CB-CD2 3.83Å; L333-L371 HydrophobicContact CD1-CD1 4.16Å; K334-L371 HydrophobicContact CB-CD2 4.03Å; L341-L371 HydrophobicContact CD1-CD1 4.19Å; L346-L371 HydrophobicContact CD2-CD1 4.25Å; L349-L371 HydrophobicContact CD1-CD1 4.4Å; A367-L371 PolarHBondContact O-N 3.28Å; L368-L371 WeakPolarHBondContact O-CA 3.42Å; L368-L371 PolarHBondContact O-N 2.77Å; Q369-L371 PolarHBondContact O-N 2.84Å; L371-Q373 PolarHBondContact O-N 3.15Å; L371-E374 PolarHBondContact O-N 3.23Å; L371-F377 HydrophobicContact CB-CD2 4.39Å; L371-F377 HydrophobicContact CD2-CD2 4.07Å; L371-F377 HydrophobicContact CD2-CE2 4.12Å; L371-L381 HydrophobicContact CB-CD1 3.99Å; L371-L381 HydrophobicContact CD1-CD2 4.32Å
372	Y	93.6	Very high	94	Very high	3 Å²	3	50 Å²	50	1%	0.012	24%	0.244	C	C	.	.	H	α-helix	trans	-66.6	-12.9	175.5	-69.5	-79.4	0	0	0	113.9	L368 Q369 E374 I378 L381 T385 L410 I414	L368-Y372 HydrophobicContact CB-CD2 4.46Å; L368-Y372 HydrophobicContact CB-CE2 4.3Å; L368-Y372 VanDerWaalsContact O-CD2 3.22Å; L368-Y372 WeakPolarHBondContact O-CD2 3.44Å; L368-Y372 PolarHBondContact O-N 3.2Å; Q369-Y372 PolarHBondContact O-N 2.97Å; Y372-E374 VanDerWaalsContact C-N 3.25Å; Y372-E374 PolarHBondContact O-N 3.19Å; Y372-I378 HydrophobicContact CD1-CD1 3.8Å; Y372-L381 HydrophobicContact CD1-CD1 3.94Å; Y372-L381 HydrophobicContact CD2-CD1 4.45Å; Y372-L381 HydrophobicContact CE1-CB 4.1Å; Y372-L381 HydrophobicContact CE1-CD1 3.85Å; Y372-L381 HydrophobicContact CE2-CD1 4.38Å; Y372-L381 HydrophobicContact CG-CD1 4.24Å; Y372-T385 PolarHBondContact OH-OG1 3.17Å; Y372-L410 HydrophobicContact CD2-CD1 3.45Å; Y372-L410 VanDerWaalsContact CD2-CD1 3.45Å; Y372-L410 HydrophobicContact CE2-CD1 3.84Å; Y372-L410 HydrophobicContact CG-CD1 4.33Å; Y372-I414 HydrophobicContact CD1-CG1 3.92Å; Y372-I414 HydrophobicContact CD2-CG1 4.35Å; Y372-I414 HydrophobicContact CE1-CG1 3.76Å; Y372-I414 HydrophobicContact CE2-CD1 4.37Å; Y372-I414 HydrophobicContact CE2-CG1 4.21Å; Y372-I414 HydrophobicContact CG-CG1 4.23Å
373	Q	92.8	Very high	93.7	Very high	106 Å²	106	54 Å²	54	50%	0.495	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-28.4	167.3	-80	165.6	12.2	0	0	113.5	Q369 L371 M413	Q369-Q373 VanDerWaalsContact O-CG 3.29Å; Q369-Q373 WeakPolarHBondContact O-CG 3.43Å; Q369-Q373 PolarHBondContact O-N 2.78Å; Q369-Q373 VanDerWaalsContact O-N 3.14Å; L371-Q373 PolarHBondContact O-N 3.15Å; Q373-M413 HydrophobicContact CB-CE 4.3Å; Q373-M413 HydrophobicContact CG-CE 3.57Å; Q373-M413 HydrophobicContact CG-SD 4.02Å
374	E	91.9	Very high	93.5	Very high	77 Å²	77	52.4 Å²	52.4	36%	0.36	26%	0.257	S	S	.	.			trans	-101.8	108.1	-173.4	-53.7	-55.5	157.4	0	0	110.5	K334 L371 Y372 E376 F377	K334-E374 VanDerWaalsContact CE-OE1 3.3Å; K334-E374 WeakPolarHBondContact CE-OE1 3.42Å; K334-E374 IonicContact NZ-OE1 3.68Å; K334-E374 PolarHBondContact NZ-OE1 2.96Å; L371-E374 PolarHBondContact O-N 3.23Å; Y372-E374 VanDerWaalsContact C-N 3.25Å; Y372-E374 PolarHBondContact O-N 3.19Å; E374-E376 PolarHBondContact O-N 3.06Å; E374-E376 VanDerWaalsContact O-N 3.08Å; E374-F377 HydrophobicContact CB-CB 4.48Å; E374-F377 HydrophobicContact CB-CD1 4.34Å; E374-F377 HydrophobicContact CB-CD2 3.62Å; E374-F377 HydrophobicContact CB-CE1 4.48Å; E374-F377 HydrophobicContact CB-CE2 3.8Å; E374-F377 HydrophobicContact CB-CG 3.9Å; E374-F377 HydrophobicContact CB-CZ 4.23Å; E374-F377 HydrophobicContact CG-CD2 4.04Å; E374-F377 HydrophobicContact CG-CE2 3.77Å; E374-F377 HydrophobicContact CG-CZ 4.28Å; E374-F377 WeakPolarHBondContact O-CB 3.44Å; E374-F377 PolarHBondContact O-N 3.38Å
375	K	88.6	Confident	93.3	Very high	164 Å²	164	53.3 Å²	53.3	71%	0.713	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-59.5	-25.1	-175.7	-66.2	-159.3	171	-143.9	0	114.2	F377	K375-F377 PolarHBondContact O-N 2.63Å
376	E	90.7	Very high	92.9	Very high	179 Å²	179	57.7 Å²	57.7	84%	0.836	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-71.5	-13.1	177.2	-59.6	-175.3	179.5	0	0	113.3	E374	E374-E376 PolarHBondContact O-N 3.06Å; E374-E376 VanDerWaalsContact O-N 3.08Å
377	F	93.2	Very high	92.7	Very high	17 Å²	17	62.3 Å²	62.3	8%	0.075	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-95.4	-17.2	-177.5	-64.7	-5	0	0	0	113.7	K334 P337 L341 L371 E374 K375 G379 R380 L381	K334-F377 HydrophobicContact CG-CE2 4.23Å; P337-F377 HydrophobicContact CB-CE1 3.81Å; P337-F377 HydrophobicContact CB-CZ 3.97Å; P337-F377 HydrophobicContact CG-CE1 3.84Å; P337-F377 HydrophobicContact CG-CZ 4.01Å; L341-F377 HydrophobicContact CD2-CB 3.75Å; L341-F377 HydrophobicContact CD2-CD1 3.69Å; L341-F377 HydrophobicContact CD2-CD2 3.8Å; L341-F377 HydrophobicContact CD2-CE1 4.24Å; L341-F377 HydrophobicContact CD2-CE2 4.34Å; L341-F377 HydrophobicContact CD2-CG 3.46Å; L341-F377 VanDerWaalsContact CD2-CG 3.46Å; L371-F377 HydrophobicContact CB-CD2 4.39Å; L371-F377 HydrophobicContact CD2-CD2 4.07Å; L371-F377 HydrophobicContact CD2-CE2 4.12Å; E374-F377 HydrophobicContact CB-CB 4.48Å; E374-F377 HydrophobicContact CB-CD1 4.34Å; E374-F377 HydrophobicContact CB-CD2 3.62Å; E374-F377 HydrophobicContact CB-CE1 4.48Å; E374-F377 HydrophobicContact CB-CE2 3.8Å; E374-F377 HydrophobicContact CB-CG 3.9Å; E374-F377 HydrophobicContact CB-CZ 4.23Å; E374-F377 HydrophobicContact CG-CD2 4.04Å; E374-F377 HydrophobicContact CG-CE2 3.77Å; E374-F377 HydrophobicContact CG-CZ 4.28Å; E374-F377 WeakPolarHBondContact O-CB 3.44Å; E374-F377 PolarHBondContact O-N 3.38Å; K375-F377 PolarHBondContact O-N 2.63Å; F377-G379 PolarHBondContact O-N 3.04Å; F377-R380 WeakPolarHBondContact O-CA 3.5Å; F377-R380 WeakPolarHBondContact O-CB 3.35Å; F377-R380 PolarHBondContact O-N 3.1Å; F377-L381 HydrophobicContact CB-CD1 4.2Å; F377-L381 WeakPolarHBondContact O-CG 3.36Å; F377-L381 PolarHBondContact O-N 3.19Å
378	I	90.6	Very high	92.6	Very high	15 Å²	15	63 Å²	63	8%	0.077	31%	0.313	C	S	.	.	H	α-helix	trans	-56.8	-47	-169.8	-54.7	-56.7	0	0	0	112.2	Y372 R380 L381 E382	Y372-I378 HydrophobicContact CD1-CD1 3.8Å; I378-R380 PolarHBondContact O-N 3.13Å; I378-R380 VanDerWaalsContact O-N 3.14Å; I378-L381 WeakPolarHBondContact O-CA 3.35Å; I378-L381 WeakPolarHBondContact O-CB 3.48Å; I378-L381 PolarHBondContact O-N 3.2Å; I378-E382 PolarHBondContact O-N 3.33Å
379	G	89.8	Confident	92.4	Very high	58 Å²	58	66 Å²	66	60%	0.598	33%	0.326	S	S	*	.	H	α-helix	trans	-65.9	-12	176.2	0	0	0	0	0	115.6	F377 E382	F377-G379 PolarHBondContact O-N 3.04Å; G379-E382 WeakPolarHBondContact CA-OE1 3.38Å
380	R	91.1	Very high	92.3	Very high	101 Å²	101	71.3 Å²	71.3	38%	0.381	35%	0.35	S	S	.	.	H	α-helix	trans	-92.9	-13.2	167.8	-50.1	-165.5	-156.2	-169.3	1.6	112.5	P337 D338 L341 F377 I378	P337-R380 PolarHBondContact O-NH1 2.73Å; D338-R380 IonicContact OD1-CZ 3.53Å; D338-R380 IonicContact OD1-NH1 3.68Å; D338-R380 PolarHBondContact OD1-NH1 3.05Å; D338-R380 IonicContact OD1-NH2 2.73Å; D338-R380 PolarHBondContact OD1-NH2 3.17Å; L341-R380 HydrophobicContact CD2-CB 4.24Å; L341-R380 HydrophobicContact CD2-CG 4.49Å; L341-R380 HydrophobicContact CG-CB 4.21Å; F377-R380 WeakPolarHBondContact O-CA 3.5Å; F377-R380 WeakPolarHBondContact O-CB 3.35Å; F377-R380 PolarHBondContact O-N 3.1Å; I378-R380 PolarHBondContact O-N 3.13Å; I378-R380 VanDerWaalsContact O-N 3.14Å
381	L	92.8	Very high	92.3	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-99.4	-27.2	-177.2	-67	170.4	0	0	0	113	L341 L346 L371 Y372 F377 I378 L383 F384 T385	L341-L381 HydrophobicContact CD1-CD2 4.16Å; L346-L381 HydrophobicContact CD1-CD2 4.27Å; L346-L381 HydrophobicContact CD2-CD2 4.14Å; L371-L381 HydrophobicContact CB-CD1 3.99Å; L371-L381 HydrophobicContact CD1-CD2 4.32Å; Y372-L381 HydrophobicContact CD1-CD1 3.94Å; Y372-L381 HydrophobicContact CD2-CD1 4.45Å; Y372-L381 HydrophobicContact CE1-CB 4.1Å; Y372-L381 HydrophobicContact CE1-CD1 3.85Å; Y372-L381 HydrophobicContact CE2-CD1 4.38Å; Y372-L381 HydrophobicContact CG-CD1 4.24Å; F377-L381 HydrophobicContact CB-CD1 4.2Å; F377-L381 WeakPolarHBondContact O-CG 3.36Å; F377-L381 PolarHBondContact O-N 3.19Å; I378-L381 WeakPolarHBondContact O-CA 3.35Å; I378-L381 WeakPolarHBondContact O-CB 3.48Å; I378-L381 PolarHBondContact O-N 3.2Å; L381-L383 VanDerWaalsContact C-N 3.3Å; L381-L383 PolarHBondContact O-N 3.23Å; L381-L383 VanDerWaalsContact O-N 3.1Å; L381-F384 CarbonylContact O-C 3.56Å; L381-F384 VanDerWaalsContact O-CA 3.31Å; L381-F384 WeakPolarHBondContact O-CA 3.42Å; L381-F384 VanDerWaalsContact O-CB 3.26Å; L381-F384 WeakPolarHBondContact O-CB 3.35Å; L381-F384 PolarHBondContact O-N 3.37Å; L381-T385 PolarHBondContact O-N 2.97Å; L381-T385 PolarHBondContact O-OG1 3.06Å
382	E	89.9	Confident	92.4	Very high	114 Å²	114	73.5 Å²	73.5	53%	0.533	35%	0.354	S	S	.	.	H	α-helix	trans	-42	-48.8	-177.9	-76.6	162.7	-154	0	0	114.8	I378 G379 F384 T385 S386	I378-E382 PolarHBondContact O-N 3.33Å; G379-E382 WeakPolarHBondContact CA-OE1 3.38Å; E382-F384 VanDerWaalsContact C-N 3.34Å; E382-F384 PolarHBondContact O-N 3.05Å; E382-T385 WeakPolarHBondContact O-CB 3.4Å; E382-T385 PolarHBondContact O-N 3.39Å; E382-S386 WeakPolarHBondContact O-CB 3.49Å; E382-S386 PolarHBondContact O-N 2.96Å
383	L	90.9	Very high	92.4	Very high	112 Å²	112	73.7 Å²	73.7	59%	0.586	36%	0.356	S	S	*	.	H	α-helix	trans	-65.2	-35.6	178.2	-178.6	61.4	0	0	0	112.7	L381 R387	L381-L383 VanDerWaalsContact C-N 3.3Å; L381-L383 PolarHBondContact O-N 3.23Å; L381-L383 VanDerWaalsContact O-N 3.1Å; L383-R387 VanDerWaalsContact O-CB 3.25Å; L383-R387 WeakPolarHBondContact O-CB 3.45Å; L383-R387 PolarHBondContact O-N 3.19Å; L383-R387 VanDerWaalsContact O-N 3.14Å
384	F	94.4	Very high	92.6	Very high	8 Å²	8	71.4 Å²	71.4	4%	0.035	35%	0.352	C	S	.	.	H	α-helix	trans	-69.6	-44.2	172.5	177.4	-83.9	0	0	0	111.1	L346 L349 L353 L368 L381 E382 R387 F388	L346-F384 HydrophobicContact CB-CD2 3.98Å; L346-F384 HydrophobicContact CD1-CB 4.45Å; L346-F384 WeakPolarHBondContact O-CE2 3.26Å; L349-F384 HydrophobicContact CB-CE2 4.36Å; L349-F384 HydrophobicContact CB-CZ 4.27Å; L353-F384 HydrophobicContact CD1-CZ 4.46Å; L368-F384 HydrophobicContact CD1-CE1 3.92Å; L368-F384 HydrophobicContact CD1-CZ 4.13Å; L368-F384 HydrophobicContact CD2-CD1 4.23Å; L368-F384 HydrophobicContact CD2-CE1 3.47Å; L368-F384 VanDerWaalsContact CD2-CE1 3.47Å; L368-F384 HydrophobicContact CD2-CZ 3.78Å; L368-F384 HydrophobicContact CG-CE1 4.37Å; L381-F384 CarbonylContact O-C 3.56Å; L381-F384 VanDerWaalsContact O-CA 3.31Å; L381-F384 WeakPolarHBondContact O-CA 3.42Å; L381-F384 VanDerWaalsContact O-CB 3.26Å; L381-F384 WeakPolarHBondContact O-CB 3.35Å; L381-F384 PolarHBondContact O-N 3.37Å; E382-F384 VanDerWaalsContact C-N 3.34Å; E382-F384 PolarHBondContact O-N 3.05Å; F384-R387 PolarHBondContact O-N 3.37Å; F384-F388 HydrophobicContact CD1-CD2 4.41Å; F384-F388 AromaticContact CD2-CD2 3.58Å; F384-F388 HydrophobicContact CD2-CD2 3.58Å; F384-F388 AromaticContact CD2-CE2 3.79Å; F384-F388 HydrophobicContact CD2-CE2 3.79Å; F384-F388 HydrophobicContact CE1-CB 4.46Å; F384-F388 HydrophobicContact CE1-CD2 4.3Å; F384-F388 AromaticContact CE2-CD2 3.46Å; F384-F388 HydrophobicContact CE2-CD2 3.46Å; F384-F388 VanDerWaalsContact CE2-CD2 3.46Å; F384-F388 AromaticContact CE2-CE2 3.69Å; F384-F388 HydrophobicContact CE2-CE2 3.69Å; F384-F388 HydrophobicContact CE2-CG 4.33Å; F384-F388 HydrophobicContact CG-CD2 4.06Å; F384-F388 HydrophobicContact CZ-CB 4.48Å; F384-F388 AromaticContact CZ-CD2 3.84Å; F384-F388 HydrophobicContact CZ-CD2 3.84Å; F384-F388 HydrophobicContact CZ-CE2 4.45Å; F384-F388 HydrophobicContact CZ-CG 4.32Å; F384-F388 WeakPolarHBondContact O-CD2 3.47Å; F384-F388 PolarHBondContact O-N 3.44Å
385	T	92.1	Very high	92.8	Very high	20 Å²	20	67.8 Å²	67.8	12%	0.123	34%	0.335	C	S	.	.	H	α-helix	trans	-56.3	-56.2	176.4	-36.7	0	0	0	0	109.9	Y372 L381 E382 R387 F388 K389 I414	Y372-T385 PolarHBondContact OH-OG1 3.17Å; L381-T385 PolarHBondContact O-N 2.97Å; L381-T385 PolarHBondContact O-OG1 3.06Å; E382-T385 WeakPolarHBondContact O-CB 3.4Å; E382-T385 PolarHBondContact O-N 3.39Å; T385-R387 VanDerWaalsContact C-N 3.33Å; T385-R387 PolarHBondContact O-N 2.92Å; T385-F388 PolarHBondContact O-N 3.06Å; T385-K389 WeakPolarHBondContact O-CA 3.45Å; T385-K389 WeakPolarHBondContact O-CB 3.22Å; T385-K389 PolarHBondContact O-N 2.73Å; T385-I414 HydrophobicContact CG2-CD1 4.25Å; T385-I414 HydrophobicContact CG2-CG2 4.21Å
386	S	90.3	Very high	93.2	Very high	92 Å²	92	60.1 Å²	60.1	64%	0.643	30%	0.301	S	S	*	.	H	α-helix	trans	-54.1	-47	179.4	178.3	0	0	0	0	111.9	E382 F388	E382-S386 WeakPolarHBondContact O-CB 3.49Å; E382-S386 PolarHBondContact O-N 2.96Å; S386-F388 PolarHBondContact O-N 2.92Å
387	R	94.1	Very high	93.5	Very high	197 Å²	197	56.8 Å²	56.8	74%	0.743	29%	0.289	S	S	*	.	H	α-helix	trans	-68.5	-30.3	-178.9	-175.9	171	-174.8	145.5	8.6	114.7	L383 F384 T385	L383-R387 VanDerWaalsContact O-CB 3.25Å; L383-R387 WeakPolarHBondContact O-CB 3.45Å; L383-R387 PolarHBondContact O-N 3.19Å; L383-R387 VanDerWaalsContact O-N 3.14Å; F384-R387 PolarHBondContact O-N 3.37Å; T385-R387 VanDerWaalsContact C-N 3.33Å; T385-R387 PolarHBondContact O-N 2.92Å
388	F	95.4	Very high	93.7	Very high	24 Å²	24	57 Å²	57	11%	0.105	29%	0.291	C	S	.	.	H	α-helix	trans	-115.5	3.6	-173.3	-67.4	-73.7	0	0	0	114.5	L353 F384 T385 S386 E390 R391 I392	L353-F388 HydrophobicContact CD1-CB 4.2Å; F384-F388 HydrophobicContact CD1-CD2 4.41Å; F384-F388 AromaticContact CD2-CD2 3.58Å; F384-F388 HydrophobicContact CD2-CD2 3.58Å; F384-F388 AromaticContact CD2-CE2 3.79Å; F384-F388 HydrophobicContact CD2-CE2 3.79Å; F384-F388 HydrophobicContact CE1-CB 4.46Å; F384-F388 HydrophobicContact CE1-CD2 4.3Å; F384-F388 AromaticContact CE2-CD2 3.46Å; F384-F388 HydrophobicContact CE2-CD2 3.46Å; F384-F388 VanDerWaalsContact CE2-CD2 3.46Å; F384-F388 AromaticContact CE2-CE2 3.69Å; F384-F388 HydrophobicContact CE2-CE2 3.69Å; F384-F388 HydrophobicContact CE2-CG 4.33Å; F384-F388 HydrophobicContact CG-CD2 4.06Å; F384-F388 HydrophobicContact CZ-CB 4.48Å; F384-F388 AromaticContact CZ-CD2 3.84Å; F384-F388 HydrophobicContact CZ-CD2 3.84Å; F384-F388 HydrophobicContact CZ-CE2 4.45Å; F384-F388 HydrophobicContact CZ-CG 4.32Å; F384-F388 WeakPolarHBondContact O-CD2 3.47Å; F384-F388 PolarHBondContact O-N 3.44Å; T385-F388 PolarHBondContact O-N 3.06Å; S386-F388 PolarHBondContact O-N 2.92Å; F388-E390 PolarHBondContact O-N 3.11Å; F388-R391 WeakPolarHBondContact O-CA 3.32Å; F388-R391 WeakPolarHBondContact O-CB 3.24Å; F388-R391 PolarHBondContact O-N 3.18Å; F388-I392 WeakPolarHBondContact O-CG1 3.44Å; F388-I392 PolarHBondContact O-N 3.04Å
389	K	91.9	Very high	93.9	Very high	63 Å²	63	65.7 Å²	65.7	27%	0.274	33%	0.328	S	S	.	.	H	α-helix	trans	-49.5	-55.3	-179.6	-175.7	169.6	61.2	168.9	0	112.5	T385 R391 I392 L393 E426	T385-K389 WeakPolarHBondContact O-CA 3.45Å; T385-K389 WeakPolarHBondContact O-CB 3.22Å; T385-K389 PolarHBondContact O-N 2.73Å; K389-R391 PolarHBondContact O-N 2.8Å; K389-I392 WeakPolarHBondContact O-CA 3.35Å; K389-I392 PolarHBondContact O-N 3.21Å; K389-L393 HydrophobicContact CG-CD1 3.88Å; K389-L393 HydrophobicContact CG-CG 4.3Å; K389-L393 WeakPolarHBondContact O-CG 3.29Å; K389-L393 PolarHBondContact O-N 3.46Å; K389-E426 WeakPolarHBondContact CD-OE1 3.44Å; K389-E426 WeakPolarHBondContact CE-OE1 3.4Å; K389-E426 IonicContact NZ-OE1 2.89Å; K389-E426 PolarHBondContact NZ-OE1 2.88Å; K389-E426 IonicContact NZ-OE2 3.56Å
390	E	93.4	Very high	94.2	Very high	133 Å²	133	65.1 Å²	65.1	62%	0.621	31%	0.311	S	S	*	.	H	α-helix	trans	-50.9	-42.6	175.8	-61.1	-48	111.9	0	0	113	F388 S394	F388-E390 PolarHBondContact O-N 3.11Å; E390-S394 WeakPolarHBondContact O-CB 3.29Å; E390-S394 PolarHBondContact O-N 2.89Å; E390-S394 PolarHBondContact O-OG 3.23Å
391	R	96.1	Very high	94.3	Very high	57 Å²	57	62.9 Å²	62.9	22%	0.215	31%	0.31	C	S	.	.	H	α-helix	trans	-69.3	-41.4	179	180	60.4	-167.2	133.3	4.2	111.1	L353 H354 F388 K389 S394 M395	L353-R391 HydrophobicContact CB-CG 3.85Å; L353-R391 HydrophobicContact CD1-CG 4.38Å; L353-R391 PolarHBondContact O-NE 3.31Å; L353-R391 PolarHBondContact O-NH2 2.72Å; H354-R391 WeakPolarHBondContact NE2-CD 3.36Å; F388-R391 WeakPolarHBondContact O-CA 3.32Å; F388-R391 WeakPolarHBondContact O-CB 3.24Å; F388-R391 PolarHBondContact O-N 3.18Å; K389-R391 PolarHBondContact O-N 2.8Å; R391-S394 PolarHBondContact NH1-OG 2.88Å; R391-S394 PolarHBondContact O-N 3.03Å; R391-S394 PolarHBondContact O-OG 2.89Å; R391-M395 HydrophobicContact CG-SD 4.33Å; R391-M395 VanDerWaalsContact CZ-SD 3.57Å; R391-M395 VanDerWaalsContact NH2-CG 3.29Å; R391-M395 PolarHBondContact NH2-SD 3.45Å; R391-M395 VanDerWaalsContact NH2-SD 3.41Å; R391-M395 WeakPolarHBondContact O-CG 3.15Å; R391-M395 PolarHBondContact O-N 3.4Å
392	I	96.2	Very high	94.5	Very high	3 Å²	3	67.3 Å²	67.3	2%	0.015	33%	0.333	C	S	.	.	H	α-helix	trans	-64.4	-47.7	177.8	-62.3	169.1	0	0	0	109.8	L353 F388 K389 S394 M395 V407 L410 L411	L353-I392 HydrophobicContact CD1-CG1 3.99Å; F388-I392 WeakPolarHBondContact O-CG1 3.44Å; F388-I392 PolarHBondContact O-N 3.04Å; K389-I392 WeakPolarHBondContact O-CA 3.35Å; K389-I392 PolarHBondContact O-N 3.21Å; I392-S394 PolarHBondContact O-N 3.28Å; I392-M395 WeakPolarHBondContact O-CB 3.15Å; I392-M395 PolarHBondContact O-N 3.24Å; I392-V407 HydrophobicContact CG2-CG1 4.03Å; I392-V407 WeakPolarHBondContact O-CG1 3.5Å; I392-L410 HydrophobicContact CG2-CD2 4.21Å; I392-L411 HydrophobicContact CG2-CD1 4.36Å; I392-L411 HydrophobicContact CG2-CD2 3.83Å; I392-L411 HydrophobicContact CG2-CG 3.95Å
393	L	94.9	Very high	94.9	Very high	7 Å²	7	61.9 Å²	61.9	4%	0.037	31%	0.308	C	S	.	.	H	α-helix	trans	-56.3	-47.9	174.6	-68.5	172.2	0	0	0	111.2	K389 M395 V396 L411 E426	K389-L393 HydrophobicContact CG-CD1 3.88Å; K389-L393 HydrophobicContact CG-CG 4.3Å; K389-L393 WeakPolarHBondContact O-CG 3.29Å; K389-L393 PolarHBondContact O-N 3.46Å; L393-M395 PolarHBondContact O-N 3.05Å; L393-V396 WeakPolarHBondContact O-CG1 3.19Å; L393-V396 VanDerWaalsContact O-CG2 3.31Å; L393-V396 WeakPolarHBondContact O-CG2 3.46Å; L393-V396 PolarHBondContact O-N 3.14Å; L393-L411 HydrophobicContact CD2-CD1 4.03Å; L393-L411 HydrophobicContact CD2-CD2 3.88Å; L393-E426 HydrophobicContact CD1-CB 4Å; L393-E426 HydrophobicContact CD1-CG 3.82Å; L393-E426 HydrophobicContact CD2-CB 4.21Å
394	S	95.8	Very high	95.2	Very high	59 Å²	59	56.6 Å²	56.6	41%	0.413	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-14.8	176.8	76.2	0	0	0	0	114.9	E390 R391 I392	E390-S394 WeakPolarHBondContact O-CB 3.29Å; E390-S394 PolarHBondContact O-N 2.89Å; E390-S394 PolarHBondContact O-OG 3.23Å; R391-S394 PolarHBondContact NH1-OG 2.88Å; R391-S394 PolarHBondContact O-N 3.03Å; R391-S394 PolarHBondContact O-OG 2.89Å; I392-S394 PolarHBondContact O-N 3.28Å
395	M	97.6	Very high	95.4	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.005	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-1.7	177.8	-68.4	174.2	55.6	0	0	114	L353 R361 V365 R391 I392 L393 L397 D398 V403 V407	L353-M395 HydrophobicContact CB-SD 4.1Å; L353-M395 HydrophobicContact CD2-CE 4.25Å; L353-M395 HydrophobicContact CD2-SD 4.04Å; R361-M395 HydrophobicContact CB-CE 3.99Å; R361-M395 HydrophobicContact CG-CE 4.46Å; V365-M395 HydrophobicContact CG2-CE 3.76Å; R391-M395 HydrophobicContact CG-SD 4.33Å; R391-M395 VanDerWaalsContact CZ-SD 3.57Å; R391-M395 VanDerWaalsContact NH2-CG 3.29Å; R391-M395 PolarHBondContact NH2-SD 3.45Å; R391-M395 VanDerWaalsContact NH2-SD 3.41Å; R391-M395 WeakPolarHBondContact O-CG 3.15Å; R391-M395 PolarHBondContact O-N 3.4Å; I392-M395 WeakPolarHBondContact O-CB 3.15Å; I392-M395 PolarHBondContact O-N 3.24Å; L393-M395 PolarHBondContact O-N 3.05Å; M395-L397 PolarHBondContact O-N 3.5Å; M395-D398 WeakPolarHBondContact O-CB 3.21Å; M395-D398 PolarHBondContact O-N 3.43Å; M395-V403 HydrophobicContact CE-CG1 3.67Å; M395-V407 HydrophobicContact CB-CB 4.35Å; M395-V407 HydrophobicContact CB-CG1 3.93Å; M395-V407 HydrophobicContact CB-CG2 3.68Å; M395-V407 HydrophobicContact CE-CG2 3.95Å
396	V	96.8	Very high	95.6	Very high	2 Å²	2	57.9 Å²	57.9	1%	0.012	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-19.9	167.3	-50.7	0	0	0	0	111.9	L393 A404 V407 V408 L411 H429 I430 L433	L393-V396 WeakPolarHBondContact O-CG1 3.19Å; L393-V396 VanDerWaalsContact O-CG2 3.31Å; L393-V396 WeakPolarHBondContact O-CG2 3.46Å; L393-V396 PolarHBondContact O-N 3.14Å; V396-A404 WeakPolarHBondContact O-CB 3.29Å; V396-V407 HydrophobicContact CG1-CG1 3.86Å; V396-V408 HydrophobicContact CB-CG2 4.04Å; V396-V408 HydrophobicContact CG1-CG2 3.87Å; V396-L411 HydrophobicContact CG1-CD1 3.48Å; V396-L411 VanDerWaalsContact CG1-CD1 3.48Å; V396-H429 HydrophobicContact CG2-CB 4.49Å; V396-I430 HydrophobicContact CG1-CG1 4.45Å; V396-L433 HydrophobicContact CB-CD1 3.71Å; V396-L433 HydrophobicContact CG2-CD1 3.84Å
397	L	95.6	Very high	96	Very high	110 Å²	110	53.5 Å²	53.5	58%	0.576	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	31.5	171.5	-62.7	177.2	0	0	0	112.3	M395 L433	M395-L397 PolarHBondContact O-N 3.5Å; L397-L433 HydrophobicContact CD2-CD2 3.79Å
398	D	97.6	Very high	96.2	Very high	22 Å²	22	44.1 Å²	44.1	12%	0.118	22%	0.221	C	C	.	.			trans	-61.1	142.4	175.6	-161.8	-64.4	0	0	0	111.8	R361 M395 D400 V403 A404	R361-D398 IonicContact CZ-OD1 3.39Å; R361-D398 IonicContact CZ-OD2 2.66Å; R361-D398 VanDerWaalsContact CZ-OD2 3.27Å; R361-D398 IonicContact NE-OD1 2.78Å; R361-D398 IonicContact NE-OD2 3.17Å; R361-D398 PolarHBondContact NE-OD2 3.36Å; R361-D398 VanDerWaalsContact NH2-CG 3.29Å; R361-D398 IonicContact NH2-OD1 3.02Å; R361-D398 PolarHBondContact NH2-OD1 3.46Å; R361-D398 IonicContact NH2-OD2 2.78Å; R361-D398 PolarHBondContact NH2-OD2 2.74Å; M395-D398 WeakPolarHBondContact O-CB 3.21Å; M395-D398 PolarHBondContact O-N 3.43Å; D398-D400 PolarHBondContact O-N 3.17Å; D398-D400 VanDerWaalsContact O-N 3.17Å; D398-D400 PolarHBondContact OD1-N 3.47Å; D398-V403 HydrophobicContact CB-CB 4.06Å; D398-V403 HydrophobicContact CB-CG1 4.04Å; D398-A404 HydrophobicContact CB-CB 4.38Å
399	K	95.1	Very high	96.2	Very high	197 Å²	197	45.5 Å²	45.5	86%	0.857	23%	0.229	S	C	*	.	S	Bend	trans	-63.7	-18.1	178.8	-64.2	-174	177.6	-176.7	0	113.2
400	D	95.9	Very high	96.4	Very high	46 Å²	46	42.5 Å²	42.5	25%	0.246	22%	0.216	C	C	.	.	S	Bend	trans	-104.6	113.9	168.8	-167.8	-38.1	0	0	0	109.6	S358 D398 D402 V403 A404	S358-D400 WeakPolarHBondContact CB-OD2 3.47Å; S358-D400 PolarHBondContact OG-OD2 2.89Å; D398-D400 PolarHBondContact O-N 3.17Å; D398-D400 VanDerWaalsContact O-N 3.17Å; D398-D400 PolarHBondContact OD1-N 3.47Å; D400-D402 PolarHBondContact O-N 3.34Å; D400-D402 PolarHBondContact OD1-N 3.02Å; D400-D402 VanDerWaalsContact OD1-N 3.11Å; D400-V403 HydrophobicContact CB-CB 4.45Å; D400-V403 HydrophobicContact CB-CG2 3.96Å; D400-V403 WeakPolarHBondContact O-CB 3.33Å; D400-V403 PolarHBondContact O-N 2.96Å; D400-A404 PolarHBondContact O-N 3.42Å
401	P	94.4	Very high	96.5	Very high	53 Å²	53	36.2 Å²	36.2	34%	0.344	19%	0.187	S	C	.	.	H	α-helix	trans	-70.2	-17.3	-173	31.4	-37.5	0	0	0	113.3	V403 V405 H438	P401-V403 VanDerWaalsContact C-N 3.35Å; P401-V405 VanDerWaalsContact O-CG2 3.26Å; P401-V405 WeakPolarHBondContact O-CG2 3.4Å; P401-V405 PolarHBondContact O-N 3.31Å; P401-V405 VanDerWaalsContact O-N 3.1Å; P401-H438 HydrophobicContact CB-CB 4.23Å
402	D	95.9	Very high	96.4	Very high	93 Å²	93	34.6 Å²	34.6	50%	0.497	18%	0.182	S	C	.	.	H	α-helix	trans	-74.8	-27.9	172.9	-74.9	-14.8	0	0	0	111.1	L362 D400 E406 H438	L362-D402 WeakPolarHBondContact CD1-O 3.33Å; D400-D402 PolarHBondContact O-N 3.34Å; D400-D402 PolarHBondContact OD1-N 3.02Å; D400-D402 VanDerWaalsContact OD1-N 3.11Å; D402-E406 WeakPolarHBondContact O-CG 3.34Å; D402-H438 IonicContact OD1-CE1 3.94Å
403	V	97.8	Very high	96.2	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-70	-47.9	170	180	0	0	0	0	109.9	R361 L362 M395 D398 D400 P401 V405 E406 V407	R361-V403 HydrophobicContact CB-CG1 4.16Å; L362-V403 HydrophobicContact CB-CG2 4.04Å; L362-V403 HydrophobicContact CD1-CG2 4.25Å; M395-V403 HydrophobicContact CE-CG1 3.67Å; D398-V403 HydrophobicContact CB-CB 4.06Å; D398-V403 HydrophobicContact CB-CG1 4.04Å; D400-V403 HydrophobicContact CB-CB 4.45Å; D400-V403 HydrophobicContact CB-CG2 3.96Å; D400-V403 WeakPolarHBondContact O-CB 3.33Å; D400-V403 PolarHBondContact O-N 2.96Å; P401-V403 VanDerWaalsContact C-N 3.35Å; V403-V405 VanDerWaalsContact C-N 3.29Å; V403-V405 PolarHBondContact O-N 3.08Å; V403-E406 PolarHBondContact O-N 2.85Å; V403-E406 VanDerWaalsContact O-N 3.12Å; V403-V407 HydrophobicContact CG1-CG2 4.19Å; V403-V407 VanDerWaalsContact O-CG2 3.25Å; V403-V407 WeakPolarHBondContact O-CG2 3.4Å; V403-V407 PolarHBondContact O-N 3.17Å
404	A	97.9	Very high	96	Very high	1 Å²	1	36.5 Å²	36.5	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-57.7	-39.6	179.7	0	0	0	0	0	112.7	V396 D398 D400 V407 V408 L441	V396-A404 WeakPolarHBondContact O-CB 3.29Å; D398-A404 HydrophobicContact CB-CB 4.38Å; D400-A404 PolarHBondContact O-N 3.42Å; A404-V407 PolarHBondContact O-N 3.27Å; A404-V408 WeakPolarHBondContact O-CG2 3.1Å; A404-V408 PolarHBondContact O-N 3.47Å; A404-L441 HydrophobicContact CB-CD1 3.78Å; A404-L441 HydrophobicContact CB-CD2 4.06Å
405	V	97.8	Very high	95.6	Very high	25 Å²	25	33.8 Å²	33.8	15%	0.152	17%	0.173	C	C	.	.	H	α-helix	trans	-56	-51.5	173.4	165	0	0	0	0	111.6	P401 V403 V407 V408 N409 G440 L441	P401-V405 VanDerWaalsContact O-CG2 3.26Å; P401-V405 WeakPolarHBondContact O-CG2 3.4Å; P401-V405 PolarHBondContact O-N 3.31Å; P401-V405 VanDerWaalsContact O-N 3.1Å; V403-V405 VanDerWaalsContact C-N 3.29Å; V403-V405 PolarHBondContact O-N 3.08Å; V405-V407 VanDerWaalsContact C-N 3.25Å; V405-V407 PolarHBondContact O-N 3.21Å; V405-V408 PolarHBondContact O-N 3.02Å; V405-N409 PolarHBondContact O-N 3.48Å; V405-N409 PolarHBondContact O-ND2 2.9Å; V405-G440 VanDerWaalsContact CG2-C 3.44Å; V405-L441 HydrophobicContact CG2-CB 4.03Å; V405-L441 HydrophobicContact CG2-CD1 4.48Å; V405-L441 VanDerWaalsContact CG2-N 3.33Å
406	E	98.1	Very high	95	Very high	29 Å²	29	38.5 Å²	38.5	14%	0.136	19%	0.194	C	C	.	.	H	α-helix	trans	-69.7	-26	-176.8	-61.3	-71.3	-150.5	0	0	112.5	L362 V365 R366 Q369 D402 V403 N409 L410	L362-E406 HydrophobicContact CD1-CB 4.32Å; L362-E406 HydrophobicContact CD1-CG 3.68Å; V365-E406 HydrophobicContact CB-CB 4.47Å; V365-E406 VanDerWaalsContact CG1-C 3.44Å; V365-E406 HydrophobicContact CG1-CB 3.66Å; V365-E406 VanDerWaalsContact CG1-O 3.29Å; V365-E406 WeakPolarHBondContact CG1-O 3.29Å; R366-E406 IonicContact CZ-OE1 3.7Å; R366-E406 IonicContact NE-OE1 3Å; R366-E406 PolarHBondContact NE-OE1 3.37Å; R366-E406 IonicContact NH2-OE1 3.83Å; R366-E406 PolarHBondContact NH2-OE1 2.89Å; Q369-E406 PolarHBondContact NE2-O 3.35Å; Q369-E406 PolarHBondContact NE2-OE2 2.77Å; D402-E406 WeakPolarHBondContact O-CG 3.34Å; V403-E406 PolarHBondContact O-N 2.85Å; V403-E406 VanDerWaalsContact O-N 3.12Å; E406-N409 PolarHBondContact OE2-ND2 2.91Å; E406-L410 WeakPolarHBondContact O-CB 3.25Å; E406-L410 PolarHBondContact O-N 3.04Å
407	V	98	Very high	94.2	Very high	1 Å²	1	39.6 Å²	39.6	1%	0.006	20%	0.202	C	C	.	.	H	α-helix	trans	-72.7	-44.1	175	173.3	0	0	0	0	111.2	V365 I392 M395 V396 V403 A404 V405 N409 L410 L411	V365-V407 HydrophobicContact CG1-CG2 4.05Å; V365-V407 HydrophobicContact CG2-CG2 3.71Å; I392-V407 HydrophobicContact CG2-CG1 4.03Å; I392-V407 WeakPolarHBondContact O-CG1 3.5Å; M395-V407 HydrophobicContact CB-CB 4.35Å; M395-V407 HydrophobicContact CB-CG1 3.93Å; M395-V407 HydrophobicContact CB-CG2 3.68Å; M395-V407 HydrophobicContact CE-CG2 3.95Å; V396-V407 HydrophobicContact CG1-CG1 3.86Å; V403-V407 HydrophobicContact CG1-CG2 4.19Å; V403-V407 VanDerWaalsContact O-CG2 3.25Å; V403-V407 WeakPolarHBondContact O-CG2 3.4Å; V403-V407 PolarHBondContact O-N 3.17Å; A404-V407 PolarHBondContact O-N 3.27Å; V405-V407 VanDerWaalsContact C-N 3.25Å; V405-V407 PolarHBondContact O-N 3.21Å; V407-N409 VanDerWaalsContact C-N 3.31Å; V407-N409 PolarHBondContact O-N 3.06Å; V407-L410 WeakPolarHBondContact O-CB 3.22Å; V407-L410 PolarHBondContact O-N 3.41Å; V407-L410 VanDerWaalsContact O-N 3.13Å; V407-L411 HydrophobicContact CG1-CD1 4.1Å; V407-L411 WeakPolarHBondContact O-CG 3.4Å; V407-L411 PolarHBondContact O-N 3.03Å
408	V	97.4	Very high	93.1	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.8	-38.2	173.8	176.4	0	0	0	0	110.8	V396 A404 V405 L410 L411 L412 I430 L433 L441 A444 A445 F448	V396-V408 HydrophobicContact CB-CG2 4.04Å; V396-V408 HydrophobicContact CG1-CG2 3.87Å; A404-V408 WeakPolarHBondContact O-CG2 3.1Å; A404-V408 PolarHBondContact O-N 3.47Å; V405-V408 PolarHBondContact O-N 3.02Å; V408-L410 VanDerWaalsContact C-N 3.34Å; V408-L410 PolarHBondContact O-N 3.22Å; V408-L411 PolarHBondContact O-N 3.2Å; V408-L412 PolarHBondContact O-N 3.45Å; V408-I430 HydrophobicContact CG1-CG2 3.93Å; V408-I430 HydrophobicContact CG2-CG2 4.45Å; V408-L433 HydrophobicContact CG2-CD1 4.06Å; V408-L441 HydrophobicContact CG2-CD1 3.87Å; V408-A444 HydrophobicContact CB-CB 4.13Å; V408-A444 HydrophobicContact CG1-CB 3.95Å; V408-A445 HydrophobicContact CG1-CB 4.49Å; V408-F448 HydrophobicContact CG1-CB 4.44Å
409	N	96.5	Very high	91.4	Very high	52 Å²	52	44.8 Å²	44.8	28%	0.278	23%	0.226	S	C	.	.	H	α-helix	trans	-59	-44.1	169.9	-67.8	-23.1	0	0	0	111.6	V405 E406 V407 L412 M413	V405-N409 PolarHBondContact O-N 3.48Å; V405-N409 PolarHBondContact O-ND2 2.9Å; E406-N409 PolarHBondContact OE2-ND2 2.91Å; V407-N409 VanDerWaalsContact C-N 3.31Å; V407-N409 PolarHBondContact O-N 3.06Å; N409-L412 PolarHBondContact O-N 3.24Å; N409-M413 VanDerWaalsContact O-CG 3.29Å; N409-M413 WeakPolarHBondContact O-CG 3.09Å; N409-M413 PolarHBondContact O-N 3.03Å
410	L	96.1	Very high	89.9	Confident	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-64.2	-41.6	178.2	175.1	62	0	0	0	112.2	V365 L368 Q369 Y372 I392 E406 V407 V408 M413 I414	V365-L410 HydrophobicContact CG1-CB 4.2Å; V365-L410 HydrophobicContact CG1-CD2 4.06Å; L368-L410 HydrophobicContact CB-CD1 4.04Å; L368-L410 HydrophobicContact CB-CD2 3.97Å; L368-L410 HydrophobicContact CD1-CD2 4.07Å; Q369-L410 HydrophobicContact CG-CB 4.08Å; Q369-L410 HydrophobicContact CG-CD1 4.19Å; Y372-L410 HydrophobicContact CD2-CD1 3.45Å; Y372-L410 VanDerWaalsContact CD2-CD1 3.45Å; Y372-L410 HydrophobicContact CE2-CD1 3.84Å; Y372-L410 HydrophobicContact CG-CD1 4.33Å; I392-L410 HydrophobicContact CG2-CD2 4.21Å; E406-L410 WeakPolarHBondContact O-CB 3.25Å; E406-L410 PolarHBondContact O-N 3.04Å; V407-L410 WeakPolarHBondContact O-CB 3.22Å; V407-L410 PolarHBondContact O-N 3.41Å; V407-L410 VanDerWaalsContact O-N 3.13Å; V408-L410 VanDerWaalsContact C-N 3.34Å; V408-L410 PolarHBondContact O-N 3.22Å; L410-M413 WeakPolarHBondContact O-CB 3.45Å; L410-M413 PolarHBondContact O-N 3.27Å; L410-M413 VanDerWaalsContact O-N 3.13Å; L410-I414 HydrophobicContact CD1-CD1 4.36Å; L410-I414 HydrophobicContact CG-CD1 4.15Å; L410-I414 WeakPolarHBondContact O-CG1 3.35Å; L410-I414 PolarHBondContact O-N 3.23Å
411	L	95.2	Very high	88.6	Confident	2 Å²	2	42.1 Å²	42.1	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-65.1	-39.2	176.1	-72.1	162.3	0	0	0	111.6	I392 L393 V396 V407 V408 M413 I414 Q415 L422 I430	I392-L411 HydrophobicContact CG2-CD1 4.36Å; I392-L411 HydrophobicContact CG2-CD2 3.83Å; I392-L411 HydrophobicContact CG2-CG 3.95Å; L393-L411 HydrophobicContact CD2-CD1 4.03Å; L393-L411 HydrophobicContact CD2-CD2 3.88Å; V396-L411 HydrophobicContact CG1-CD1 3.48Å; V396-L411 VanDerWaalsContact CG1-CD1 3.48Å; V407-L411 HydrophobicContact CG1-CD1 4.1Å; V407-L411 WeakPolarHBondContact O-CG 3.4Å; V407-L411 PolarHBondContact O-N 3.03Å; V408-L411 PolarHBondContact O-N 3.2Å; L411-M413 VanDerWaalsContact C-N 3.31Å; L411-M413 PolarHBondContact O-N 2.94Å; L411-I414 HydrophobicContact CD2-CD1 4.49Å; L411-I414 PolarHBondContact O-N 3.47Å; L411-Q415 VanDerWaalsContact O-CB 3.25Å; L411-Q415 WeakPolarHBondContact O-CB 3.28Å; L411-Q415 PolarHBondContact O-N 3.02Å; L411-L422 HydrophobicContact CB-CD1 4.22Å; L411-L422 HydrophobicContact CD2-CD1 4.08Å; L411-I430 HydrophobicContact CB-CD1 4.21Å; L411-I430 HydrophobicContact CD1-CD1 4.02Å
412	L	93.2	Very high	88	Confident	22 Å²	22	40.1 Å²	40.1	12%	0.115	21%	0.207	C	C	.	.	H	α-helix	trans	-63	-35.7	170.2	-177.8	53.3	0	0	0	112.4	V408 N409 H416 A447 F448 H451	V408-L412 PolarHBondContact O-N 3.45Å; N409-L412 PolarHBondContact O-N 3.24Å; L412-H416 PolarHBondContact O-CD2 3.31Å; L412-H416 VanDerWaalsContact O-CD2 3.26Å; L412-H416 PolarHBondContact O-N 3.1Å; L412-H416 VanDerWaalsContact O-N 3.13Å; L412-A447 HydrophobicContact CD2-CB 3.95Å; L412-F448 HydrophobicContact CB-CD2 4.04Å; L412-F448 HydrophobicContact CD1-CD2 4.21Å; L412-H451 HydrophobicContact CD1-CB 3.88Å
413	M	92.3	Very high	87.4	Confident	46 Å²	46	41.4 Å²	41.4	23%	0.227	21%	0.212	C	C	.	.	H	α-helix	trans	-68	-38.8	174.2	-68.5	-144.1	64.1	0	0	112.8	Q369 Q373 N409 L410 L411 H416 S417	Q369-M413 HydrophobicContact CB-SD 4.49Å; Q373-M413 HydrophobicContact CB-CE 4.3Å; Q373-M413 HydrophobicContact CG-CE 3.57Å; Q373-M413 HydrophobicContact CG-SD 4.02Å; N409-M413 VanDerWaalsContact O-CG 3.29Å; N409-M413 WeakPolarHBondContact O-CG 3.09Å; N409-M413 PolarHBondContact O-N 3.03Å; L410-M413 WeakPolarHBondContact O-CB 3.45Å; L410-M413 PolarHBondContact O-N 3.27Å; L410-M413 VanDerWaalsContact O-N 3.13Å; L411-M413 VanDerWaalsContact C-N 3.31Å; L411-M413 PolarHBondContact O-N 2.94Å; M413-H416 PolarHBondContact O-N 3.41Å; M413-S417 WeakPolarHBondContact O-CB 3.35Å; M413-S417 PolarHBondContact O-N 2.84Å; M413-S417 PolarHBondContact O-OG 3.41Å
414	I	90.8	Very high	86.7	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-62.9	-51.4	174.3	-68.5	162.3	0	0	0	109.5	Y372 T385 L410 L411 H416 S417 T418	Y372-I414 HydrophobicContact CD1-CG1 3.92Å; Y372-I414 HydrophobicContact CD2-CG1 4.35Å; Y372-I414 HydrophobicContact CE1-CG1 3.76Å; Y372-I414 HydrophobicContact CE2-CD1 4.37Å; Y372-I414 HydrophobicContact CE2-CG1 4.21Å; Y372-I414 HydrophobicContact CG-CG1 4.23Å; T385-I414 HydrophobicContact CG2-CD1 4.25Å; T385-I414 HydrophobicContact CG2-CG2 4.21Å; L410-I414 HydrophobicContact CD1-CD1 4.36Å; L410-I414 HydrophobicContact CG-CD1 4.15Å; L410-I414 WeakPolarHBondContact O-CG1 3.35Å; L410-I414 PolarHBondContact O-N 3.23Å; L411-I414 HydrophobicContact CD2-CD1 4.49Å; L411-I414 PolarHBondContact O-N 3.47Å; I414-H416 PolarHBondContact O-N 3.05Å; I414-H416 VanDerWaalsContact O-N 3.07Å; I414-S417 WeakPolarHBondContact O-CA 3.36Å; I414-S417 PolarHBondContact O-N 3.17Å; I414-T418 HydrophobicContact CG2-CG2 4.31Å; I414-T418 PolarHBondContact O-N 3.07Å; I414-T418 PolarHBondContact O-OG1 2.98Å
415	Q	87.3	Confident	86	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.009	26%	0.255	C	S	.	.	H	α-helix	trans	-57.1	-19.6	175.9	177.6	65.7	26.6	0	0	114.7	L411 D421 L422 F448	L411-Q415 VanDerWaalsContact O-CB 3.25Å; L411-Q415 WeakPolarHBondContact O-CB 3.28Å; L411-Q415 PolarHBondContact O-N 3.02Å; Q415-D421 PolarHBondContact NE2-OD1 2.8Å; Q415-D421 PolarHBondContact NE2-OD2 3.35Å; Q415-L422 HydrophobicContact CB-CD1 4.31Å; Q415-F448 HydrophobicContact CB-CE2 4.12Å; Q415-F448 HydrophobicContact CG-CE2 4.11Å; Q415-F448 HydrophobicContact CG-CZ 4.46Å
416	H	85.2	Confident	85.6	Confident	99 Å²	99	50.6 Å²	50.6	46%	0.458	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-7.1	173.2	-78.3	-37	0	0	0	114.3	L412 M413 I414 H451	L412-H416 PolarHBondContact O-CD2 3.31Å; L412-H416 VanDerWaalsContact O-CD2 3.26Å; L412-H416 PolarHBondContact O-N 3.1Å; L412-H416 VanDerWaalsContact O-N 3.13Å; M413-H416 PolarHBondContact O-N 3.41Å; I414-H416 PolarHBondContact O-N 3.05Å; I414-H416 VanDerWaalsContact O-N 3.07Å; H416-H451 AromaticContact CE1-CD2 3.29Å; H416-H451 PolarHBondContact CE1-CD2 3.11Å; H416-H451 AromaticContact CE1-CE1 3.47Å; H416-H451 PolarHBondContact CE1-CE1 3.09Å; H416-H451 VanDerWaalsContact CE1-CE1 3.47Å; H416-H451 AromaticContact CE1-CG 3.49Å; H416-H451 VanDerWaalsContact CE1-CG 3.49Å; H416-H451 AromaticContact CE1-ND1 3.59Å; H416-H451 AromaticContact CE1-NE2 3.28Å; H416-H451 PolarHBondContact CE1-NE2 3.41Å; H416-H451 VanDerWaalsContact CE1-NE2 3.28Å; H416-H451 AromaticContact ND1-CD2 3.43Å; H416-H451 PolarHBondContact ND1-CD2 3.49Å; H416-H451 AromaticContact ND1-CE1 3.51Å; H416-H451 AromaticContact ND1-NE2 3.04Å; H416-H451 PolarHBondContact ND1-NE2 2.72Å
417	S	79.6	Confident	85.1	Confident	26 Å²	26	49.2 Å²	49.2	18%	0.182	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-125.2	-28.4	-164	-56.3	0	0	0	0	114.4	M413 I414	M413-S417 WeakPolarHBondContact O-CB 3.35Å; M413-S417 PolarHBondContact O-N 2.84Å; M413-S417 PolarHBondContact O-OG 3.41Å; I414-S417 WeakPolarHBondContact O-CA 3.36Å; I414-S417 PolarHBondContact O-N 3.17Å
418	T	73	Confident	84.7	Confident	40 Å²	40	50.3 Å²	50.3	25%	0.245	26%	0.258	C	S	.	.			trans	-84.1	150.8	168.5	49.1	0	0	0	0	110.8	I414 D420	I414-T418 HydrophobicContact CG2-CG2 4.31Å; I414-T418 PolarHBondContact O-N 3.07Å; I414-T418 PolarHBondContact O-OG1 2.98Å; T418-D420 VanDerWaalsContact CB-O 3.24Å; T418-D420 WeakPolarHBondContact CB-O 3.41Å; T418-D420 PolarHBondContact OG1-O 3.1Å
419	E	61.8	Low	84.2	Confident	200 Å²	200	55.4 Å²	55.4	94%	0.935	28%	0.282	S	S	*	.	S	Bend	trans	-80.9	-31.7	170	-64.1	-169.9	163.4	0	0	111.1
420	D	64.6	Low	84.1	Confident	138 Å²	138	53 Å²	53	74%	0.738	27%	0.268	S	S	*	.	S	Bend	trans	-74.1	133	164.8	-64.2	-39.7	0	0	0	110.5	T418	T418-D420 VanDerWaalsContact CB-O 3.24Å; T418-D420 WeakPolarHBondContact CB-O 3.41Å; T418-D420 PolarHBondContact OG1-O 3.1Å
421	D	68	Low	84	Confident	49 Å²	49	53.1 Å²	53.1	26%	0.262	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-74.7	156.7	174.5	-105.7	47	0	0	0	112.4	Q415 M423 K452 R455	Q415-D421 PolarHBondContact NE2-OD1 2.8Å; Q415-D421 PolarHBondContact NE2-OD2 3.35Å; D421-M423 PolarHBondContact O-N 3.21Å; D421-K452 IonicContact OD2-NZ 3.74Å; D421-K452 PolarHBondContact OD2-NZ 3.17Å; D421-R455 IonicContact OD1-CZ 2.68Å; D421-R455 IonicContact OD1-NH1 2.62Å; D421-R455 PolarHBondContact OD1-NH1 3.34Å; D421-R455 IonicContact OD1-NH2 2.62Å; D421-R455 PolarHBondContact OD1-NH2 3.4Å; D421-R455 IonicContact OD2-CZ 2.65Å; D421-R455 IonicContact OD2-NH1 2.93Å; D421-R455 IonicContact OD2-NH2 2.71Å
422	L	82.4	Confident	83.8	Confident	11 Å²	11	55.4 Å²	55.4	6%	0.058	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-63.1	131.5	157.8	-67.5	174.6	0	0	0	109	L411 Q415 F448 K452	L411-L422 HydrophobicContact CB-CD1 4.22Å; L411-L422 HydrophobicContact CD2-CD1 4.08Å; Q415-L422 HydrophobicContact CB-CD1 4.31Å; L422-F448 HydrophobicContact CD1-CE2 3.89Å; L422-F448 HydrophobicContact CD1-CZ 4Å; L422-K452 PolarHBondContact O-NZ 2.91Å
423	M	83.4	Confident	83.9	Confident	120 Å²	120	55 Å²	55	59%	0.591	28%	0.282	S	S	*	.	P	Polyproline II helix	trans	-60.8	159	-177.7	-58.6	-66.2	-67.3	0	0	110.4	D421 E425 E426 S427	D421-M423 PolarHBondContact O-N 3.21Å; M423-E425 VanDerWaalsContact C-N 3.33Å; M423-E425 PolarHBondContact O-N 3.25Å; M423-E426 HydrophobicContact CB-CB 4.44Å; M423-E426 HydrophobicContact CB-CG 3.96Å; M423-E426 PolarHBondContact N-OE2 3.25Å; M423-E426 WeakPolarHBondContact O-CB 3.16Å; M423-E426 PolarHBondContact O-N 2.98Å; M423-S427 PolarHBondContact O-N 3.09Å; M423-S427 PolarHBondContact O-OG 3.44Å; M423-S427 VanDerWaalsContact O-OG 3.07Å
424	E	81.9	Confident	84.1	Confident	32 Å²	32	52.8 Å²	52.8	15%	0.15	27%	0.271	C	S	.	.	H	α-helix	trans	-70.1	-32.8	-175.9	-151.4	51.5	-145.7	0	0	112.3	E426 S427 G428 Y431 K452 F1220	E424-E426 VanDerWaalsContact C-N 3.27Å; E424-E426 PolarHBondContact O-N 3.33Å; E424-S427 PolarHBondContact O-N 3.09Å; E424-G428 PolarHBondContact O-N 3.13Å; E424-Y431 WeakPolarHBondContact OE1-CE2 3.37Å; E424-Y431 PolarHBondContact OE1-OH 3.1Å; E424-K452 IonicContact OE2-NZ 2.77Å; E424-K452 PolarHBondContact OE2-NZ 3.36Å; E424-F1220 HydrophobicContact CG-CD2 4.28Å; E424-F1220 WeakPolarHBondContact OE1-CD2 3.27Å; E424-F1220 WeakPolarHBondContact OE1-CE2 3.35Å
425	E	84.4	Confident	84.2	Confident	167 Å²	167	53.7 Å²	53.7	78%	0.78	27%	0.274	S	S	*	.	H	α-helix	trans	-57.9	-37.1	167.9	-59.7	-175.2	162.6	0	0	112.7	M423 H429	M423-E425 VanDerWaalsContact C-N 3.33Å; M423-E425 PolarHBondContact O-N 3.25Å; E425-H429 PolarHBondContact O-CE1 3.42Å; E425-H429 PolarHBondContact O-ND1 2.9Å
426	E	87.8	Confident	84.4	Confident	21 Å²	21	54.6 Å²	54.6	10%	0.098	28%	0.282	C	S	.	.	H	α-helix	trans	-76.4	-41.2	179.8	-60.4	170.8	170	0	0	110.9	K389 L393 M423 E424 G428 H429	K389-E426 WeakPolarHBondContact CD-OE1 3.44Å; K389-E426 WeakPolarHBondContact CE-OE1 3.4Å; K389-E426 IonicContact NZ-OE1 2.89Å; K389-E426 PolarHBondContact NZ-OE1 2.88Å; K389-E426 IonicContact NZ-OE2 3.56Å; L393-E426 HydrophobicContact CD1-CB 4Å; L393-E426 HydrophobicContact CD1-CG 3.82Å; L393-E426 HydrophobicContact CD2-CB 4.21Å; M423-E426 HydrophobicContact CB-CB 4.44Å; M423-E426 HydrophobicContact CB-CG 3.96Å; M423-E426 PolarHBondContact N-OE2 3.25Å; M423-E426 WeakPolarHBondContact O-CB 3.16Å; M423-E426 PolarHBondContact O-N 2.98Å; E424-E426 VanDerWaalsContact C-N 3.27Å; E424-E426 PolarHBondContact O-N 3.33Å; E426-G428 VanDerWaalsContact C-N 3.28Å; E426-G428 PolarHBondContact O-N 3.3Å; E426-H429 WeakPolarHBondContact O-CB 3.25Å; E426-H429 PolarHBondContact O-N 3.31Å
427	S	89	Confident	84.7	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-65.2	-33.7	175.2	-58	0	0	0	0	111.5	M423 E424 H429 I430 Y431 K452	M423-S427 PolarHBondContact O-N 3.09Å; M423-S427 PolarHBondContact O-OG 3.44Å; M423-S427 VanDerWaalsContact O-OG 3.07Å; E424-S427 PolarHBondContact O-N 3.09Å; S427-H429 PolarHBondContact O-N 3.37Å; S427-I430 WeakPolarHBondContact O-CA 3.46Å; S427-I430 WeakPolarHBondContact O-CB 3.32Å; S427-I430 PolarHBondContact O-N 2.76Å; S427-Y431 WeakPolarHBondContact CB-OH 3.36Å; S427-Y431 PolarHBondContact O-N 3.43Å; S427-K452 WeakPolarHBondContact OG-CE 3.47Å
428	G	87.9	Confident	85.3	Confident	25 Å²	25	55.7 Å²	55.7	26%	0.258	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-24.4	172.6	0	0	0	0	0	114.8	E424 E426 I430 P432	E424-G428 PolarHBondContact O-N 3.13Å; E426-G428 VanDerWaalsContact C-N 3.28Å; E426-G428 PolarHBondContact O-N 3.3Å; G428-I430 VanDerWaalsContact C-N 3.25Å; G428-I430 PolarHBondContact O-N 2.82Å; G428-P432 WeakPolarHBondContact O-CD 3.06Å
429	H	88.8	Confident	86.3	Confident	107 Å²	107	56.5 Å²	56.5	50%	0.495	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-19.2	172.4	-69.3	73.6	0	0	0	113.1	V396 E425 E426 S427	V396-H429 HydrophobicContact CG2-CB 4.49Å; E425-H429 PolarHBondContact O-CE1 3.42Å; E425-H429 PolarHBondContact O-ND1 2.9Å; E426-H429 WeakPolarHBondContact O-CB 3.25Å; E426-H429 PolarHBondContact O-N 3.31Å; S427-H429 PolarHBondContact O-N 3.37Å
430	I	94	Very high	87.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-34.2	-176.5	-53.4	174.8	0	0	0	111	V396 V408 L411 S427 G428 L433 A445 F448	V396-I430 HydrophobicContact CG1-CG1 4.45Å; V408-I430 HydrophobicContact CG1-CG2 3.93Å; V408-I430 HydrophobicContact CG2-CG2 4.45Å; L411-I430 HydrophobicContact CB-CD1 4.21Å; L411-I430 HydrophobicContact CD1-CD1 4.02Å; S427-I430 WeakPolarHBondContact O-CA 3.46Å; S427-I430 WeakPolarHBondContact O-CB 3.32Å; S427-I430 PolarHBondContact O-N 2.76Å; G428-I430 VanDerWaalsContact C-N 3.25Å; G428-I430 PolarHBondContact O-N 2.82Å; I430-L433 WeakPolarHBondContact O-CB 3.42Å; I430-L433 WeakPolarHBondContact O-CG 3.47Å; I430-L433 PolarHBondContact O-N 3.35Å; I430-A445 HydrophobicContact CG2-CB 4.02Å; I430-F448 HydrophobicContact CB-CD1 4.3Å; I430-F448 HydrophobicContact CD1-CD1 4.04Å; I430-F448 HydrophobicContact CD1-CD2 3.93Å; I430-F448 HydrophobicContact CD1-CE1 3.86Å; I430-F448 HydrophobicContact CD1-CE2 3.74Å; I430-F448 HydrophobicContact CD1-CG 4.09Å; I430-F448 HydrophobicContact CD1-CZ 3.71Å; I430-F448 HydrophobicContact CG2-CB 4.15Å; I430-F448 HydrophobicContact CG2-CD1 3.99Å; I430-F448 HydrophobicContact CG2-CG 4.07Å
431	Y	92.6	Very high	89.3	Confident	4 Å²	4	42.7 Å²	42.7	2%	0.016	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-57.5	-43.9	-175.5	-58.8	-30.9	0	0	0	115.5	E424 S427 L433 V434 F448 L449 F480 F1220	E424-Y431 WeakPolarHBondContact OE1-CE2 3.37Å; E424-Y431 PolarHBondContact OE1-OH 3.1Å; S427-Y431 WeakPolarHBondContact CB-OH 3.36Å; S427-Y431 PolarHBondContact O-N 3.43Å; Y431-L433 PolarHBondContact O-N 2.94Å; Y431-V434 VanDerWaalsContact O-CG2 3.28Å; Y431-V434 WeakPolarHBondContact O-CG2 3.26Å; Y431-V434 PolarHBondContact O-N 3.06Å; Y431-V434 VanDerWaalsContact O-N 3.14Å; Y431-F448 HydrophobicContact CE1-CD1 4.33Å; Y431-F448 HydrophobicContact CE1-CE1 4.24Å; Y431-L449 HydrophobicContact CD1-CD1 4.07Å; Y431-L449 HydrophobicContact CE1-CD1 3.97Å; Y431-F480 HydrophobicContact CD1-CE2 4.15Å; Y431-F480 HydrophobicContact CD2-CE2 4.15Å; Y431-F480 AromaticContact CG-CE2 3.82Å; Y431-F480 HydrophobicContact CG-CE2 3.82Å; Y431-F480 HydrophobicContact CG-CZ 4.38Å; Y431-F1220 HydrophobicContact CE2-CE2 4.46Å
432	P	92.8	Very high	90.7	Very high	50 Å²	50	40.3 Å²	40.3	33%	0.325	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-56.9	-27.3	175.7	-23	30.5	0	0	0	113.2	G428 V434 Y435 F486	G428-P432 WeakPolarHBondContact O-CD 3.06Å; P432-V434 PolarHBondContact O-N 2.9Å; P432-Y435 PolarHBondContact O-N 2.74Å; P432-F486 HydrophobicContact CB-CD2 4.4Å; P432-F486 HydrophobicContact CB-CE2 4.27Å; P432-F486 HydrophobicContact CB-CZ 4.35Å; P432-F486 HydrophobicContact CG-CD2 4.44Å; P432-F486 HydrophobicContact CG-CE1 4Å; P432-F486 HydrophobicContact CG-CE2 3.84Å; P432-F486 HydrophobicContact CG-CZ 3.61Å
433	L	94.8	Very high	91.3	Very high	13 Å²	13	40.7 Å²	40.7	7%	0.068	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-69.9	-16	-176	-49.2	178.6	0	0	0	112.7	V396 L397 V408 I430 Y431 Y435 A436 L441 A442 A445	V396-L433 HydrophobicContact CB-CD1 3.71Å; V396-L433 HydrophobicContact CG2-CD1 3.84Å; L397-L433 HydrophobicContact CD2-CD2 3.79Å; V408-L433 HydrophobicContact CG2-CD1 4.06Å; I430-L433 WeakPolarHBondContact O-CB 3.42Å; I430-L433 WeakPolarHBondContact O-CG 3.47Å; I430-L433 PolarHBondContact O-N 3.35Å; Y431-L433 PolarHBondContact O-N 2.94Å; L433-Y435 PolarHBondContact O-N 3.35Å; L433-A436 WeakPolarHBondContact O-CB 3.25Å; L433-A436 PolarHBondContact O-N 3.42Å; L433-L441 HydrophobicContact CB-CG 4.39Å; L433-L441 HydrophobicContact CD1-CD1 4.3Å; L433-L441 HydrophobicContact CD2-CD2 4.38Å; L433-A442 VanDerWaalsContact O-CA 3.32Å; L433-A442 WeakPolarHBondContact O-CA 3.42Å; L433-A445 HydrophobicContact CB-CB 3.68Å
434	V	95.1	Very high	91.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-64.6	-16.8	170	-48.9	0	0	0	0	112.3	Y431 P432 A445 L449 F480 L493 S496 R549	Y431-V434 VanDerWaalsContact O-CG2 3.28Å; Y431-V434 WeakPolarHBondContact O-CG2 3.26Å; Y431-V434 PolarHBondContact O-N 3.06Å; Y431-V434 VanDerWaalsContact O-N 3.14Å; P432-V434 PolarHBondContact O-N 2.9Å; V434-A445 HydrophobicContact CG1-CB 3.86Å; V434-L449 HydrophobicContact CG1-CB 4.36Å; V434-L449 HydrophobicContact CG1-CD2 4.03Å; V434-F480 HydrophobicContact CG2-CE1 4.37Å; V434-F480 HydrophobicContact CG2-CZ 4.42Å; V434-L493 HydrophobicContact CB-CD1 4.33Å; V434-L493 HydrophobicContact CG2-CD1 3.75Å; V434-S496 PolarHBondContact O-OG 3.35Å; V434-R549 PolarHBondContact O-NH2 3.43Å
435	Y	93.6	Very high	92.6	Very high	23 Å²	23	33.9 Å²	33.9	9%	0.09	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-96.3	-4.2	172.5	-62.6	-79.8	0	0	0	113.3	P432 L433 F486 H487 L493 R549	P432-Y435 PolarHBondContact O-N 2.74Å; L433-Y435 PolarHBondContact O-N 3.35Å; Y435-F486 HydrophobicContact CD2-CB 3.59Å; Y435-F486 HydrophobicContact CD2-CD2 4.07Å; Y435-F486 HydrophobicContact CD2-CG 4.29Å; Y435-F486 HydrophobicContact CE2-CB 3.66Å; Y435-F486 AromaticContact CE2-CD2 3.94Å; Y435-F486 HydrophobicContact CE2-CD2 3.94Å; Y435-F486 HydrophobicContact CE2-CG 4.33Å; Y435-F486 HydrophobicContact CG-CB 4.36Å; Y435-H487 HydrophobicContact CD1-CB 3.52Å; Y435-H487 AromaticContact CD1-CD2 3.96Å; Y435-H487 HydrophobicContact CE1-CB 3.52Å; Y435-H487 HydrophobicContact CG-CB 4.24Å; Y435-L493 HydrophobicContact CE1-CB 4.07Å; Y435-R549 VanDerWaalsContact C-NH2 3.26Å; Y435-R549 PolarHBondContact O-NH2 2.96Å
436	A	92.4	Very high	93.2	Very high	22 Å²	22	25.9 Å²	25.9	18%	0.182	16%	0.155	C	C	.	.			trans	-55.1	143.8	-175.8	0	0	0	0	0	113.9	L433 H438 L441 A442 R549	L433-A436 WeakPolarHBondContact O-CB 3.25Å; L433-A436 PolarHBondContact O-N 3.42Å; A436-H438 VanDerWaalsContact C-N 3.3Å; A436-H438 PolarHBondContact O-N 3.41Å; A436-L441 HydrophobicContact CB-CD2 4.35Å; A436-A442 HydrophobicContact CB-CB 4.38Å; A436-R549 PolarHBondContact O-NE 3.21Å; A436-R549 PolarHBondContact O-NH2 2.74Å
437	S	90.9	Very high	93.6	Very high	90 Å²	90	26 Å²	26	63%	0.629	16%	0.16	S	C	*	.	S	Bend	trans	-66.2	-29.8	176.4	-73.4	0	0	0	0	112.9	R439	S437-R439 PolarHBondContact O-N 3.03Å
438	H	92.8	Very high	93.8	Very high	58 Å²	58	26.1 Å²	26.1	27%	0.269	16%	0.16	S	C	.	.	S	Bend	trans	-78.1	103.6	174.4	-174	-126.4	0	0	0	110.6	P401 D402 A436 G440 L441 A442	P401-H438 HydrophobicContact CB-CB 4.23Å; D402-H438 IonicContact OD1-CE1 3.94Å; A436-H438 VanDerWaalsContact C-N 3.3Å; A436-H438 PolarHBondContact O-N 3.41Å; H438-G440 PolarHBondContact O-N 2.59Å; H438-G440 VanDerWaalsContact O-N 3.09Å; H438-L441 HydrophobicContact CB-CB 4.27Å; H438-L441 PolarHBondContact ND1-N 2.99Å; H438-L441 PolarHBondContact O-N 2.7Å; H438-A442 PolarHBondContact O-N 3.04Å
439	R	93.3	Very high	94.1	Very high	57 Å²	57	24.9 Å²	24.9	22%	0.215	15%	0.148	C	C	.	.	H	α-helix	trans	-54.1	-33	-177.7	-167.1	178.9	-171.1	-65.6	-8.4	113.8	S437 A442 S443 D495 R549	S437-R439 PolarHBondContact O-N 3.03Å; R439-A442 PolarHBondContact O-N 2.92Å; R439-S443 PolarHBondContact NH1-OG 3.11Å; R439-S443 VanDerWaalsContact NH1-OG 3.13Å; R439-S443 WeakPolarHBondContact O-CB 3.31Å; R439-S443 PolarHBondContact O-N 3.41Å; R439-S443 PolarHBondContact O-OG 3.31Å; R439-D495 IonicContact CZ-OD1 2.94Å; R439-D495 IonicContact CZ-OD2 2.81Å; R439-D495 IonicContact NE-OD1 2.73Å; R439-D495 PolarHBondContact NE-OD1 3.34Å; R439-D495 IonicContact NE-OD2 2.68Å; R439-D495 PolarHBondContact NE-OD2 3.35Å; R439-D495 PolarHBondContact NH2-O 3.19Å; R439-D495 IonicContact NH2-OD1 2.83Å; R439-D495 PolarHBondContact NH2-OD1 2.79Å; R439-D495 IonicContact NH2-OD2 3.2Å; R439-R549 HydrophobicContact CB-CB 3.98Å; R439-R549 HydrophobicContact CB-CG 4.09Å; R439-R549 HydrophobicContact CG-CB 4.23Å; R439-R549 HydrophobicContact CG-CG 4.49Å
440	G	94.1	Very high	94.3	Very high	32 Å²	32	20.1 Å²	20.1	33%	0.33	13%	0.126	S	C	.	.	H	α-helix	trans	-61.1	-47.7	176	0	0	0	0	0	112.2	V405 H438 S443 A444	V405-G440 VanDerWaalsContact CG2-C 3.44Å; H438-G440 PolarHBondContact O-N 2.59Å; H438-G440 VanDerWaalsContact O-N 3.09Å; G440-S443 PolarHBondContact O-N 3.06Å; G440-A444 PolarHBondContact O-N 2.69Å; G440-A444 VanDerWaalsContact O-N 3.11Å
441	L	95.9	Very high	94.1	Very high	15 Å²	15	22.1 Å²	22.1	8%	0.079	14%	0.135	C	C	.	.	H	α-helix	trans	-67	-42.4	178.8	-177.4	59.1	0	0	0	110.8	A404 V405 V408 L433 A436 H438 S443 A444 A445	A404-L441 HydrophobicContact CB-CD1 3.78Å; A404-L441 HydrophobicContact CB-CD2 4.06Å; V405-L441 HydrophobicContact CG2-CB 4.03Å; V405-L441 HydrophobicContact CG2-CD1 4.48Å; V405-L441 VanDerWaalsContact CG2-N 3.33Å; V408-L441 HydrophobicContact CG2-CD1 3.87Å; L433-L441 HydrophobicContact CB-CG 4.39Å; L433-L441 HydrophobicContact CD1-CD1 4.3Å; L433-L441 HydrophobicContact CD2-CD2 4.38Å; A436-L441 HydrophobicContact CB-CD2 4.35Å; H438-L441 HydrophobicContact CB-CB 4.27Å; H438-L441 PolarHBondContact ND1-N 2.99Å; H438-L441 PolarHBondContact O-N 2.7Å; L441-S443 PolarHBondContact O-N 3Å; L441-A444 PolarHBondContact O-N 2.83Å; L441-A444 VanDerWaalsContact O-N 3.16Å; L441-A445 PolarHBondContact O-N 2.98Å
442	A	96.1	Very high	93.9	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.4	-38.4	178.7	0	0	0	0	0	113.3	L433 A436 H438 R439 G446 S496 R549	L433-A442 VanDerWaalsContact O-CA 3.32Å; L433-A442 WeakPolarHBondContact O-CA 3.42Å; A436-A442 HydrophobicContact CB-CB 4.38Å; H438-A442 PolarHBondContact O-N 3.04Å; R439-A442 PolarHBondContact O-N 2.92Å; A442-G446 PolarHBondContact O-N 3.31Å; A442-S496 WeakPolarHBondContact CB-OG 3.29Å; A442-S496 VanDerWaalsContact O-CB 3.28Å; A442-S496 WeakPolarHBondContact O-CB 3.26Å; A442-S496 PolarHBondContact O-OG 2.95Å; A442-R549 VanDerWaalsContact CB-CZ 3.43Å; A442-R549 VanDerWaalsContact CB-NH2 3.27Å
443	S	95.6	Very high	93.7	Very high	19 Å²	19	20.3 Å²	20.3	13%	0.133	12%	0.122	C	C	.	.	H	α-helix	trans	-71.2	-28.8	172.5	-69.1	0	0	0	0	113.5	R439 G440 L441 A447	R439-S443 PolarHBondContact NH1-OG 3.11Å; R439-S443 VanDerWaalsContact NH1-OG 3.13Å; R439-S443 WeakPolarHBondContact O-CB 3.31Å; R439-S443 PolarHBondContact O-N 3.41Å; R439-S443 PolarHBondContact O-OG 3.31Å; G440-S443 PolarHBondContact O-N 3.06Å; L441-S443 PolarHBondContact O-N 3Å; S443-A447 PolarHBondContact O-N 3.01Å
444	A	96.9	Very high	93.4	Very high	7 Å²	7	23 Å²	23	6%	0.058	13%	0.133	C	C	.	.	H	α-helix	trans	-70.3	-46.2	172.5	0	0	0	0	0	111.4	V408 G440 L441 G446 A447 F448	V408-A444 HydrophobicContact CB-CB 4.13Å; V408-A444 HydrophobicContact CG1-CB 3.95Å; G440-A444 PolarHBondContact O-N 2.69Å; G440-A444 VanDerWaalsContact O-N 3.11Å; L441-A444 PolarHBondContact O-N 2.83Å; L441-A444 VanDerWaalsContact O-N 3.16Å; A444-G446 VanDerWaalsContact C-N 3.31Å; A444-G446 PolarHBondContact O-N 3.03Å; A444-A447 WeakPolarHBondContact O-CB 3.32Å; A444-A447 PolarHBondContact O-N 2.89Å; A444-A447 VanDerWaalsContact O-N 3.13Å; A444-F448 PolarHBondContact O-N 3.23Å
445	A	96.7	Very high	92.9	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.008	15%	0.15	C	C	.	.	H	α-helix	trans	-63.5	-37.5	173.5	0	0	0	0	0	111.9	V408 I430 L433 V434 L441 A447 F448 L449	V408-A445 HydrophobicContact CG1-CB 4.49Å; I430-A445 HydrophobicContact CG2-CB 4.02Å; L433-A445 HydrophobicContact CB-CB 3.68Å; V434-A445 HydrophobicContact CG1-CB 3.86Å; L441-A445 PolarHBondContact O-N 2.98Å; A445-A447 VanDerWaalsContact C-N 3.32Å; A445-A447 PolarHBondContact O-N 3.26Å; A445-F448 WeakPolarHBondContact O-CB 3.29Å; A445-F448 PolarHBondContact O-N 3.05Å; A445-L449 WeakPolarHBondContact O-CB 3.43Å; A445-L449 PolarHBondContact O-N 3.1Å
446	G	95.8	Very high	92.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-62.2	-35.9	171.8	0	0	0	0	0	113	A442 A444 C450 L497	A442-G446 PolarHBondContact O-N 3.31Å; A444-G446 VanDerWaalsContact C-N 3.31Å; A444-G446 PolarHBondContact O-N 3.03Å; G446-C450 WeakPolarHBondContact O-CB 3.45Å; G446-C450 PolarHBondContact O-N 3.12Å; G446-L497 WeakPolarHBondContact O-CD2 3.41Å
447	A	95.9	Very high	92	Very high	24 Å²	24	26.2 Å²	26.2	20%	0.198	14%	0.143	C	C	.	.	H	α-helix	trans	-66.5	-40.8	172.5	0	0	0	0	0	112.2	L412 S443 A444 A445 H451 V500	L412-A447 HydrophobicContact CD2-CB 3.95Å; S443-A447 PolarHBondContact O-N 3.01Å; A444-A447 WeakPolarHBondContact O-CB 3.32Å; A444-A447 PolarHBondContact O-N 2.89Å; A444-A447 VanDerWaalsContact O-N 3.13Å; A445-A447 VanDerWaalsContact C-N 3.32Å; A445-A447 PolarHBondContact O-N 3.26Å; A447-H451 PolarHBondContact O-N 3.31Å; A447-H451 VanDerWaalsContact O-N 3.1Å; A447-V500 HydrophobicContact CB-CG1 4Å
448	F	94.8	Very high	91.5	Very high	1 Å²	1	26.8 Å²	26.8	0%	0.004	14%	0.143	C	C	.	.	H	α-helix	trans	-62.6	-52.9	174.9	-173.6	-85.2	0	0	0	111.9	V408 L412 Q415 L422 I430 Y431 A444 A445 C450 H451 K452	V408-F448 HydrophobicContact CG1-CB 4.44Å; L412-F448 HydrophobicContact CB-CD2 4.04Å; L412-F448 HydrophobicContact CD1-CD2 4.21Å; Q415-F448 HydrophobicContact CB-CE2 4.12Å; Q415-F448 HydrophobicContact CG-CE2 4.11Å; Q415-F448 HydrophobicContact CG-CZ 4.46Å; L422-F448 HydrophobicContact CD1-CE2 3.89Å; L422-F448 HydrophobicContact CD1-CZ 4Å; I430-F448 HydrophobicContact CB-CD1 4.3Å; I430-F448 HydrophobicContact CD1-CD1 4.04Å; I430-F448 HydrophobicContact CD1-CD2 3.93Å; I430-F448 HydrophobicContact CD1-CE1 3.86Å; I430-F448 HydrophobicContact CD1-CE2 3.74Å; I430-F448 HydrophobicContact CD1-CG 4.09Å; I430-F448 HydrophobicContact CD1-CZ 3.71Å; I430-F448 HydrophobicContact CG2-CB 4.15Å; I430-F448 HydrophobicContact CG2-CD1 3.99Å; I430-F448 HydrophobicContact CG2-CG 4.07Å; Y431-F448 HydrophobicContact CE1-CD1 4.33Å; Y431-F448 HydrophobicContact CE1-CE1 4.24Å; A444-F448 PolarHBondContact O-N 3.23Å; A445-F448 WeakPolarHBondContact O-CB 3.29Å; A445-F448 PolarHBondContact O-N 3.05Å; F448-C450 PolarHBondContact O-N 2.79Å; F448-H451 WeakPolarHBondContact O-CB 3.33Å; F448-H451 PolarHBondContact O-N 3.46Å; F448-K452 HydrophobicContact CE1-CG 4.11Å; F448-K452 PolarHBondContact O-N 3.41Å; F448-K452 VanDerWaalsContact O-N 3.13Å
449	L	93.4	Very high	90.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-58.1	-46.5	177	177.5	63	0	0	0	111.4	Y431 V434 A445 H451 K452 L453 F480 L493 L497	Y431-L449 HydrophobicContact CD1-CD1 4.07Å; Y431-L449 HydrophobicContact CE1-CD1 3.97Å; V434-L449 HydrophobicContact CG1-CB 4.36Å; V434-L449 HydrophobicContact CG1-CD2 4.03Å; A445-L449 WeakPolarHBondContact O-CB 3.43Å; A445-L449 PolarHBondContact O-N 3.1Å; L449-H451 PolarHBondContact O-N 3.05Å; L449-K452 PolarHBondContact O-N 2.95Å; L449-L453 HydrophobicContact CD1-CD1 4.16Å; L449-L453 HydrophobicContact CD1-CD2 4.41Å; L449-L453 HydrophobicContact CD1-CG 3.99Å; L449-L453 HydrophobicContact CD2-CD1 4.46Å; L449-L453 HydrophobicContact CG-CD1 3.87Å; L449-L453 HydrophobicContact CG-CG 4.16Å; L449-L453 WeakPolarHBondContact O-CB 3.42Å; L449-L453 VanDerWaalsContact O-CG 3.29Å; L449-L453 WeakPolarHBondContact O-CG 3.39Å; L449-L453 PolarHBondContact O-N 2.86Å; L449-F480 HydrophobicContact CD1-CD2 3.84Å; L449-F480 HydrophobicContact CD1-CE2 3.67Å; L449-F480 HydrophobicContact CD1-CG 4.33Å; L449-F480 HydrophobicContact CD1-CZ 4.04Å; L449-F480 HydrophobicContact CD2-CD1 4Å; L449-F480 HydrophobicContact CD2-CE1 3.53Å; L449-F480 HydrophobicContact CD2-CE2 4.11Å; L449-F480 HydrophobicContact CD2-CG 4.5Å; L449-F480 HydrophobicContact CD2-CZ 3.59Å; L449-F480 HydrophobicContact CG-CZ 4.47Å; L449-L493 HydrophobicContact CD2-CD1 3.92Å; L449-L497 HydrophobicContact CD2-CD2 4.49Å
450	C	93.2	Very high	89.3	Confident	7 Å²	7	31.7 Å²	31.7	5%	0.047	18%	0.176	C	C	.	.	H	α-helix	trans	-59.7	-30.1	177.1	-173.2	0	0	0	0	112.7	G446 F448 K454 L497 V500	G446-C450 WeakPolarHBondContact O-CB 3.45Å; G446-C450 PolarHBondContact O-N 3.12Å; F448-C450 PolarHBondContact O-N 2.79Å; C450-K454 WeakPolarHBondContact O-CB 3.37Å; C450-K454 VanDerWaalsContact O-CG 3.26Å; C450-K454 WeakPolarHBondContact O-CG 3.3Å; C450-K454 PolarHBondContact O-N 3.39Å; C450-K454 VanDerWaalsContact O-N 3.16Å; C450-K454 VanDerWaalsContact SG-CE 3.56Å; C450-L497 HydrophobicContact CB-CD2 3.89Å; C450-V500 HydrophobicContact CB-CB 4.09Å; C450-V500 HydrophobicContact CB-CG2 3.56Å
451	H	90.3	Very high	87.7	Confident	41 Å²	41	31.6 Å²	31.6	19%	0.19	17%	0.17	C	C	.	.	H	α-helix	trans	-72.6	-48.7	174.7	-179.5	39	0	0	0	112.4	L412 H416 A447 F448 L449 K454 R455	L412-H451 HydrophobicContact CD1-CB 3.88Å; H416-H451 AromaticContact CE1-CD2 3.29Å; H416-H451 PolarHBondContact CE1-CD2 3.11Å; H416-H451 AromaticContact CE1-CE1 3.47Å; H416-H451 PolarHBondContact CE1-CE1 3.09Å; H416-H451 VanDerWaalsContact CE1-CE1 3.47Å; H416-H451 AromaticContact CE1-CG 3.49Å; H416-H451 VanDerWaalsContact CE1-CG 3.49Å; H416-H451 AromaticContact CE1-ND1 3.59Å; H416-H451 AromaticContact CE1-NE2 3.28Å; H416-H451 PolarHBondContact CE1-NE2 3.41Å; H416-H451 VanDerWaalsContact CE1-NE2 3.28Å; H416-H451 AromaticContact ND1-CD2 3.43Å; H416-H451 PolarHBondContact ND1-CD2 3.49Å; H416-H451 AromaticContact ND1-CE1 3.51Å; H416-H451 AromaticContact ND1-NE2 3.04Å; H416-H451 PolarHBondContact ND1-NE2 2.72Å; A447-H451 PolarHBondContact O-N 3.31Å; A447-H451 VanDerWaalsContact O-N 3.1Å; F448-H451 WeakPolarHBondContact O-CB 3.33Å; F448-H451 PolarHBondContact O-N 3.46Å; L449-H451 PolarHBondContact O-N 3.05Å; H451-K454 PolarHBondContact O-N 2.89Å; H451-R455 WeakPolarHBondContact CE1-CD 3.49Å; H451-R455 PolarHBondContact O-N 3.3Å
452	K	88.3	Confident	85.7	Confident	15 Å²	15	39.9 Å²	39.9	7%	0.065	21%	0.209	C	C	.	.	H	α-helix	trans	-57.3	-51.3	174.8	-81.2	-87.3	-167	171.8	0	110.8	D421 L422 E424 S427 F448 L449 K454 R455 V456 F1220	D421-K452 IonicContact OD2-NZ 3.74Å; D421-K452 PolarHBondContact OD2-NZ 3.17Å; L422-K452 PolarHBondContact O-NZ 2.91Å; E424-K452 IonicContact OE2-NZ 2.77Å; E424-K452 PolarHBondContact OE2-NZ 3.36Å; S427-K452 WeakPolarHBondContact OG-CE 3.47Å; F448-K452 HydrophobicContact CE1-CG 4.11Å; F448-K452 PolarHBondContact O-N 3.41Å; F448-K452 VanDerWaalsContact O-N 3.13Å; L449-K452 PolarHBondContact O-N 2.95Å; K452-K454 PolarHBondContact O-N 3.13Å; K452-R455 WeakPolarHBondContact O-CB 3.3Å; K452-R455 PolarHBondContact O-N 2.92Å; K452-R455 VanDerWaalsContact O-N 3.1Å; K452-V456 PolarHBondContact O-N 3.34Å; K452-F1220 HydrophobicContact CB-CE1 4.06Å
453	L	88.4	Confident	83.7	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-53.6	-48.2	176.6	-69.5	175.7	0	0	0	112.6	L449 R455 V456 V457 F473 I476 L477	L449-L453 HydrophobicContact CD1-CD1 4.16Å; L449-L453 HydrophobicContact CD1-CD2 4.41Å; L449-L453 HydrophobicContact CD1-CG 3.99Å; L449-L453 HydrophobicContact CD2-CD1 4.46Å; L449-L453 HydrophobicContact CG-CD1 3.87Å; L449-L453 HydrophobicContact CG-CG 4.16Å; L449-L453 WeakPolarHBondContact O-CB 3.42Å; L449-L453 VanDerWaalsContact O-CG 3.29Å; L449-L453 WeakPolarHBondContact O-CG 3.39Å; L449-L453 PolarHBondContact O-N 2.86Å; L453-R455 VanDerWaalsContact C-N 3.31Å; L453-R455 PolarHBondContact O-N 2.8Å; L453-V456 PolarHBondContact O-N 2.99Å; L453-V457 PolarHBondContact O-N 3.36Å; L453-V457 VanDerWaalsContact O-N 3.14Å; L453-F473 HydrophobicContact CB-CD2 4.41Å; L453-F473 HydrophobicContact CB-CE2 4.13Å; L453-F473 HydrophobicContact CD1-CE2 3.99Å; L453-F473 HydrophobicContact CD1-CZ 4.4Å; L453-I476 HydrophobicContact CD2-CB 4.09Å; L453-I476 HydrophobicContact CD2-CG2 3.41Å; L453-I476 VanDerWaalsContact CD2-CG2 3.41Å; L453-L477 HydrophobicContact CD1-CD1 4.07Å
454	K	87.4	Confident	81.7	Confident	69 Å²	69	53.6 Å²	53.6	30%	0.3	28%	0.281	S	S	.	.	H	α-helix	trans	-68.2	-29	-179.5	-75.7	178.1	175.4	-178.7	0	113.1	C450 H451 K452 T458 V500 E504	C450-K454 WeakPolarHBondContact O-CB 3.37Å; C450-K454 VanDerWaalsContact O-CG 3.26Å; C450-K454 WeakPolarHBondContact O-CG 3.3Å; C450-K454 PolarHBondContact O-N 3.39Å; C450-K454 VanDerWaalsContact O-N 3.16Å; C450-K454 VanDerWaalsContact SG-CE 3.56Å; H451-K454 PolarHBondContact O-N 2.89Å; K452-K454 PolarHBondContact O-N 3.13Å; K454-T458 WeakPolarHBondContact O-CG2 3.31Å; K454-T458 PolarHBondContact O-N 3.13Å; K454-T458 VanDerWaalsContact O-N 3.11Å; K454-T458 PolarHBondContact O-OG1 3.48Å; K454-V500 PolarHBondContact NZ-O 2.91Å; K454-V500 VanDerWaalsContact NZ-O 3.12Å; K454-E504 WeakPolarHBondContact CE-OE1 3.02Å; K454-E504 IonicContact NZ-OE1 2.67Å; K454-E504 PolarHBondContact NZ-OE1 3.49Å; K454-E504 IonicContact NZ-OE2 2.7Å
455	R	84.3	Confident	80	Confident	94 Å²	94	57.6 Å²	57.6	36%	0.355	30%	0.301	S	S	.	.	H	α-helix	trans	-64.6	-45.6	172.4	-80.7	-178.4	57.8	173.6	-12.2	111.6	D421 H451 K452 L453 V457 T458 T459	D421-R455 IonicContact OD1-CZ 2.68Å; D421-R455 IonicContact OD1-NH1 2.62Å; D421-R455 PolarHBondContact OD1-NH1 3.34Å; D421-R455 IonicContact OD1-NH2 2.62Å; D421-R455 PolarHBondContact OD1-NH2 3.4Å; D421-R455 IonicContact OD2-CZ 2.65Å; D421-R455 IonicContact OD2-NH1 2.93Å; D421-R455 IonicContact OD2-NH2 2.71Å; H451-R455 WeakPolarHBondContact CE1-CD 3.49Å; H451-R455 PolarHBondContact O-N 3.3Å; K452-R455 WeakPolarHBondContact O-CB 3.3Å; K452-R455 PolarHBondContact O-N 2.92Å; K452-R455 VanDerWaalsContact O-N 3.1Å; L453-R455 VanDerWaalsContact C-N 3.31Å; L453-R455 PolarHBondContact O-N 2.8Å; R455-V457 PolarHBondContact O-N 3.45Å; R455-T458 WeakPolarHBondContact CA-OG1 3.07Å; R455-T458 CarbonylContact O-C 3.58Å; R455-T458 PolarHBondContact O-N 3.38Å; R455-T458 VanDerWaalsContact O-N 3.1Å; R455-T458 PolarHBondContact O-OG1 2.92Å; R455-T459 PolarHBondContact O-N 3.03Å; R455-T459 PolarHBondContact O-OG1 3.01Å
456	V	83.4	Confident	78.3	Confident	10 Å²	10	63.8 Å²	63.8	6%	0.061	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-43.1	177.4	-178.6	0	0	0	0	111.5	K452 L453 T458 T459 Q460 I476 F1220	K452-V456 PolarHBondContact O-N 3.34Å; L453-V456 PolarHBondContact O-N 2.99Å; V456-T458 VanDerWaalsContact C-N 3.29Å; V456-T458 PolarHBondContact O-N 2.96Å; V456-T459 WeakPolarHBondContact CA-OG1 3.46Å; V456-T459 PolarHBondContact O-N 2.84Å; V456-T459 VanDerWaalsContact O-N 3.16Å; V456-T459 PolarHBondContact O-OG1 3.1Å; V456-Q460 HydrophobicContact CG1-CG 4.21Å; V456-Q460 VanDerWaalsContact CG1-NE2 3.33Å; V456-Q460 WeakPolarHBondContact O-CB 3.26Å; V456-Q460 WeakPolarHBondContact O-CG 3.37Å; V456-Q460 PolarHBondContact O-N 2.82Å; V456-I476 HydrophobicContact CB-CD1 4.05Å; V456-I476 HydrophobicContact CG1-CD1 3.72Å; V456-I476 HydrophobicContact CG1-CG1 4.49Å; V456-F1220 HydrophobicContact CG2-CD1 3.54Å; V456-F1220 HydrophobicContact CG2-CE1 4.1Å
457	V	84.1	Confident	76.7	Confident	10 Å²	10	68.8 Å²	68.8	6%	0.061	36%	0.356	C	S	.	.	H	α-helix	trans	-57.2	-43.3	173	177	0	0	0	0	111.1	L453 R455 T459 Q460 S461 N469 A472 F473 I476	L453-V457 PolarHBondContact O-N 3.36Å; L453-V457 VanDerWaalsContact O-N 3.14Å; R455-V457 PolarHBondContact O-N 3.45Å; V457-T459 VanDerWaalsContact C-N 3.35Å; V457-T459 PolarHBondContact O-N 3.29Å; V457-Q460 PolarHBondContact O-N 3.22Å; V457-S461 VanDerWaalsContact O-CB 3.3Å; V457-S461 WeakPolarHBondContact O-CB 3.49Å; V457-S461 PolarHBondContact O-N 3.46Å; V457-S461 PolarHBondContact O-OG 3.14Å; V457-N469 HydrophobicContact CG1-CB 4.07Å; V457-A472 HydrophobicContact CG1-CB 4.25Å; V457-A472 HydrophobicContact CG2-CB 4.27Å; V457-F473 HydrophobicContact CG2-CB 4.15Å; V457-I476 HydrophobicContact CG2-CD1 3.67Å
458	T	80.2	Confident	75.5	Confident	102 Å²	102	70.6 Å²	70.6	63%	0.626	37%	0.367	S	S	*	.	H	α-helix	trans	-74.8	-13.6	179	55.1	0	0	0	0	115.7	K454 R455 V456	K454-T458 WeakPolarHBondContact O-CG2 3.31Å; K454-T458 PolarHBondContact O-N 3.13Å; K454-T458 VanDerWaalsContact O-N 3.11Å; K454-T458 PolarHBondContact O-OG1 3.48Å; R455-T458 WeakPolarHBondContact CA-OG1 3.07Å; R455-T458 CarbonylContact O-C 3.58Å; R455-T458 PolarHBondContact O-N 3.38Å; R455-T458 VanDerWaalsContact O-N 3.1Å; R455-T458 PolarHBondContact O-OG1 2.92Å; V456-T458 VanDerWaalsContact C-N 3.29Å; V456-T458 PolarHBondContact O-N 2.96Å
459	T	73.9	Confident	74.8	Confident	108 Å²	108	72.4 Å²	72.4	66%	0.663	38%	0.376	S	S	*	.	H	α-helix	trans	-91.1	-30.3	171.2	51.2	0	0	0	0	112.2	R455 V456 V457	R455-T459 PolarHBondContact O-N 3.03Å; R455-T459 PolarHBondContact O-OG1 3.01Å; V456-T459 WeakPolarHBondContact CA-OG1 3.46Å; V456-T459 PolarHBondContact O-N 2.84Å; V456-T459 VanDerWaalsContact O-N 3.16Å; V456-T459 PolarHBondContact O-OG1 3.1Å; V457-T459 VanDerWaalsContact C-N 3.35Å; V457-T459 PolarHBondContact O-N 3.29Å
460	Q	66.3	Low	74.4	Confident	109 Å²	109	74.2 Å²	74.2	51%	0.509	39%	0.386	S	S	.	.	H	α-helix	trans	-82.6	-38.7	178.3	-66.8	178.4	-4.9	0	0	112.8	V456 V457 Q462	V456-Q460 HydrophobicContact CG1-CG 4.21Å; V456-Q460 VanDerWaalsContact CG1-NE2 3.33Å; V456-Q460 WeakPolarHBondContact O-CB 3.26Å; V456-Q460 WeakPolarHBondContact O-CG 3.37Å; V456-Q460 PolarHBondContact O-N 2.82Å; V457-Q460 PolarHBondContact O-N 3.22Å; Q460-Q462 PolarHBondContact O-N 3.13Å
461	S	59.9	Low	74.2	Confident	31 Å²	31	75.1 Å²	75.1	22%	0.217	39%	0.394	C	S	.	.			trans	-82.3	111.1	178.4	-68.8	0	0	0	0	112.7	V457 N469	V457-S461 VanDerWaalsContact O-CB 3.3Å; V457-S461 WeakPolarHBondContact O-CB 3.49Å; V457-S461 PolarHBondContact O-N 3.46Å; V457-S461 PolarHBondContact O-OG 3.14Å; S461-N469 WeakPolarHBondContact CB-OD1 2.96Å; S461-N469 PolarHBondContact OG-OD1 2.8Å
462	Q	55.2	Low	74	Confident	189 Å²	189	74.1 Å²	74.1	88%	0.883	39%	0.393	S	S	*	.			trans	-93.1	-7.1	167.2	-67.4	-168	-0.5	0	0	114.1	Q460	Q460-Q462 PolarHBondContact O-N 3.13Å
463	D	52.9	Low	74.2	Confident	133 Å²	133	73.6 Å²	73.6	71%	0.711	39%	0.39	S	S	*	.	S	Bend	trans	-111	135.3	-179	-76	-52.8	0	0	0	112.4	D465	D463-D465 PolarHBondContact O-N 3.23Å
464	D	54	Low	74.3	Confident	174 Å²	174	73.5 Å²	73.5	93%	0.93	39%	0.39	S	S	*	.			trans	-73.7	29.5	-173.2	-95.9	-27.8	0	0	0	115.1
465	D	61.9	Low	74.5	Confident	90 Å²	90	73.4 Å²	73.4	48%	0.481	39%	0.391	S	S	.	.			trans	-93.1	108.1	177.1	-170.6	-3.5	0	0	0	112.5	D463 K467 S468 N469	D463-D465 PolarHBondContact O-N 3.23Å; D465-K467 PolarHBondContact O-N 3.26Å; D465-K467 VanDerWaalsContact O-N 3.11Å; D465-K467 PolarHBondContact OD1-N 3.36Å; D465-S468 WeakPolarHBondContact O-CB 3.41Å; D465-S468 PolarHBondContact O-N 3.08Å; D465-N469 PolarHBondContact O-N 2.68Å; D465-N469 VanDerWaalsContact O-N 3.12Å; D465-N469 PolarHBondContact O-ND2 2.84Å
466	D	61.3	Low	74.7	Confident	131 Å²	131	69.4 Å²	69.4	70%	0.701	38%	0.376	S	S	*	.	H	α-helix	trans	-48.3	-34.9	173.1	-78.4	-28.7	0	0	0	113.4	N469 N470	D466-N469 PolarHBondContact O-N 3.43Å; D466-N470 PolarHBondContact O-N 3.15Å; D466-N470 VanDerWaalsContact O-N 3.11Å
467	K	62	Low	75.2	Confident	106 Å²	106	69 Å²	69	46%	0.461	37%	0.374	S	S	.	.	H	α-helix	trans	-71.6	-35.5	178	-83.9	-176.7	161.9	-86	0	112.6	D465 A471 D509	D465-K467 PolarHBondContact O-N 3.26Å; D465-K467 VanDerWaalsContact O-N 3.11Å; D465-K467 PolarHBondContact OD1-N 3.36Å; K467-A471 PolarHBondContact O-N 2.82Å; K467-D509 IonicContact NZ-OD2 2.7Å; K467-D509 PolarHBondContact NZ-OD2 2.92Å
468	S	69.9	Low	75.6	Confident	61 Å²	61	68.5 Å²	68.5	43%	0.427	37%	0.371	S	S	.	.	H	α-helix	trans	-64.4	-44.3	173.3	-167.3	0	0	0	0	110.7	D465 N470 A471 A472	D465-S468 WeakPolarHBondContact O-CB 3.41Å; D465-S468 PolarHBondContact O-N 3.08Å; S468-N470 PolarHBondContact O-N 2.78Å; S468-A471 PolarHBondContact O-N 3.49Å; S468-A471 VanDerWaalsContact O-N 3.15Å; S468-A472 PolarHBondContact O-N 2.79Å
469	N	80.8	Confident	76	Confident	39 Å²	39	65 Å²	65	21%	0.209	35%	0.35	C	S	.	.	H	α-helix	trans	-63.1	-39.5	-179.9	-68.9	-40.3	0	0	0	113.2	V457 S461 D465 D466 F473	V457-N469 HydrophobicContact CG1-CB 4.07Å; S461-N469 WeakPolarHBondContact CB-OD1 2.96Å; S461-N469 PolarHBondContact OG-OD1 2.8Å; D465-N469 PolarHBondContact O-N 2.68Å; D465-N469 VanDerWaalsContact O-N 3.12Å; D465-N469 PolarHBondContact O-ND2 2.84Å; D466-N469 PolarHBondContact O-N 3.43Å; N469-F473 WeakPolarHBondContact O-CB 3.45Å; N469-F473 PolarHBondContact O-N 2.97Å
470	N	85.4	Confident	76.8	Confident	38 Å²	38	59.9 Å²	59.9	20%	0.203	32%	0.319	C	S	.	.	H	α-helix	trans	-66.8	-38.2	173.4	-78.1	-4.6	0	0	0	112.3	D466 S468 F473 F474 D507 T510	D466-N470 PolarHBondContact O-N 3.15Å; D466-N470 VanDerWaalsContact O-N 3.11Å; S468-N470 PolarHBondContact O-N 2.78Å; N470-F473 PolarHBondContact O-N 3.06Å; N470-F474 WeakPolarHBondContact O-CD2 3.25Å; N470-F474 PolarHBondContact O-N 2.87Å; N470-F474 VanDerWaalsContact O-N 3.09Å; N470-D507 PolarHBondContact ND2-OD2 2.83Å; N470-T510 HydrophobicContact CB-CG2 4.29Å
471	A	87.4	Confident	78	Confident	26 Å²	26	55.9 Å²	55.9	22%	0.215	30%	0.299	C	S	.	.	H	α-helix	trans	-64.8	-46.4	176.2	0	0	0	0	0	111.5	K467 S468 F473 F474 Q475 T510	K467-A471 PolarHBondContact O-N 2.82Å; S468-A471 PolarHBondContact O-N 3.49Å; S468-A471 VanDerWaalsContact O-N 3.15Å; A471-F473 PolarHBondContact O-N 3.44Å; A471-F474 PolarHBondContact O-N 2.77Å; A471-Q475 WeakPolarHBondContact O-CG 3.41Å; A471-Q475 PolarHBondContact O-N 3.11Å; A471-T510 HydrophobicContact CB-CG2 4.08Å
472	A	88.1	Confident	79.4	Confident	20 Å²	20	57 Å²	57	17%	0.165	30%	0.302	C	S	.	.	H	α-helix	trans	-59.9	-43.2	174.9	0	0	0	0	0	112.2	V457 S468 F474 Q475 I476	V457-A472 HydrophobicContact CG1-CB 4.25Å; V457-A472 HydrophobicContact CG2-CB 4.27Å; S468-A472 PolarHBondContact O-N 2.79Å; A472-F474 VanDerWaalsContact C-N 3.29Å; A472-F474 PolarHBondContact O-N 2.82Å; A472-Q475 PolarHBondContact O-N 3.28Å; A472-I476 WeakPolarHBondContact O-CG1 3.45Å; A472-I476 PolarHBondContact O-N 3.4Å; A472-I476 VanDerWaalsContact O-N 3.14Å
473	F	91.2	Very high	80.7	Confident	4 Å²	4	51.3 Å²	51.3	2%	0.018	28%	0.276	C	S	.	.	H	α-helix	trans	-57.2	-41.3	174.4	176.7	-95.3	0	0	0	112.3	L453 V457 N469 N470 A471 L477 A501 E504	L453-F473 HydrophobicContact CB-CD2 4.41Å; L453-F473 HydrophobicContact CB-CE2 4.13Å; L453-F473 HydrophobicContact CD1-CE2 3.99Å; L453-F473 HydrophobicContact CD1-CZ 4.4Å; V457-F473 HydrophobicContact CG2-CB 4.15Å; N469-F473 WeakPolarHBondContact O-CB 3.45Å; N469-F473 PolarHBondContact O-N 2.97Å; N470-F473 PolarHBondContact O-N 3.06Å; A471-F473 PolarHBondContact O-N 3.44Å; F473-L477 HydrophobicContact CE1-CD2 3.87Å; F473-L477 HydrophobicContact CZ-CD2 4.25Å; F473-L477 VanDerWaalsContact O-CB 3.23Å; F473-L477 WeakPolarHBondContact O-CB 3.23Å; F473-L477 PolarHBondContact O-N 3.21Å; F473-A501 HydrophobicContact CE1-CB 4.24Å; F473-A501 HydrophobicContact CE2-CB 4.44Å; F473-A501 HydrophobicContact CZ-CB 3.66Å; F473-E504 HydrophobicContact CD1-CB 3.79Å; F473-E504 HydrophobicContact CD1-CG 4.12Å; F473-E504 HydrophobicContact CE1-CB 3.74Å; F473-E504 HydrophobicContact CE1-CG 4.27Å; F473-E504 HydrophobicContact CG-CG 4.41Å; F473-E504 HydrophobicContact CZ-CB 4.47Å
474	F	91.4	Very high	81.9	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-67.9	-41.1	176.2	-74.7	-55.7	0	0	0	113.1	N470 A471 A472 I476 L477 I478 E504 T510 M511 L514 L529	N470-F474 WeakPolarHBondContact O-CD2 3.25Å; N470-F474 PolarHBondContact O-N 2.87Å; N470-F474 VanDerWaalsContact O-N 3.09Å; A471-F474 PolarHBondContact O-N 2.77Å; A472-F474 VanDerWaalsContact C-N 3.29Å; A472-F474 PolarHBondContact O-N 2.82Å; F474-I476 PolarHBondContact O-N 3.44Å; F474-L477 PolarHBondContact O-N 2.95Å; F474-I478 HydrophobicContact CB-CD1 4.5Å; F474-I478 WeakPolarHBondContact O-CB 3.43Å; F474-I478 WeakPolarHBondContact O-CD1 3.45Å; F474-I478 WeakPolarHBondContact O-CG1 3.23Å; F474-I478 PolarHBondContact O-N 3.06Å; F474-E504 VanDerWaalsContact CZ-O 3.27Å; F474-E504 WeakPolarHBondContact CZ-O 3.36Å; F474-T510 HydrophobicContact CD2-CG2 3.99Å; F474-T510 HydrophobicContact CE2-CG2 4.19Å; F474-M511 HydrophobicContact CD2-CG 4.48Å; F474-M511 HydrophobicContact CE1-CE 3.54Å; F474-M511 HydrophobicContact CE1-CG 4.07Å; F474-M511 HydrophobicContact CE2-CG 3.84Å; F474-M511 HydrophobicContact CZ-CE 3.41Å; F474-M511 VanDerWaalsContact CZ-CE 3.41Å; F474-M511 HydrophobicContact CZ-CG 3.6Å; F474-M511 HydrophobicContact CZ-SD 4.35Å; F474-L514 HydrophobicContact CB-CD1 4.17Å; F474-L514 HydrophobicContact CD2-CD1 4.44Å; F474-L529 HydrophobicContact CD1-CD1 4.28Å; F474-L529 HydrophobicContact CG-CD1 4.48Å
475	Q	90.1	Very high	83	Confident	66 Å²	66	44.8 Å²	44.8	31%	0.308	24%	0.236	S	C	.	.	H	α-helix	trans	-58	-50.7	177.5	-64.8	-65.9	13.3	0	0	111.5	A471 A472 L477 I478 S479 L521	A471-Q475 WeakPolarHBondContact O-CG 3.41Å; A471-Q475 PolarHBondContact O-N 3.11Å; A472-Q475 PolarHBondContact O-N 3.28Å; Q475-L477 VanDerWaalsContact C-N 3.31Å; Q475-L477 PolarHBondContact O-N 3.45Å; Q475-I478 PolarHBondContact O-N 3.14Å; Q475-S479 PolarHBondContact O-N 2.84Å; Q475-S479 PolarHBondContact O-OG 3.13Å; Q475-L521 VanDerWaalsContact NE2-CD2 3.33Å
476	I	90.3	Very high	83.8	Confident	10 Å²	10	44 Å²	44	5%	0.051	23%	0.229	C	C	.	.	H	α-helix	trans	-66.5	-35.7	-179	-51.1	156.3	0	0	0	110.7	L453 V456 V457 A472 F474 F480 L1219	L453-I476 HydrophobicContact CD2-CB 4.09Å; L453-I476 HydrophobicContact CD2-CG2 3.41Å; L453-I476 VanDerWaalsContact CD2-CG2 3.41Å; V456-I476 HydrophobicContact CB-CD1 4.05Å; V456-I476 HydrophobicContact CG1-CD1 3.72Å; V456-I476 HydrophobicContact CG1-CG1 4.49Å; V457-I476 HydrophobicContact CG2-CD1 3.67Å; A472-I476 WeakPolarHBondContact O-CG1 3.45Å; A472-I476 PolarHBondContact O-N 3.4Å; A472-I476 VanDerWaalsContact O-N 3.14Å; F474-I476 PolarHBondContact O-N 3.44Å; I476-F480 WeakPolarHBondContact O-CB 3.4Å; I476-F480 PolarHBondContact O-N 2.95Å; I476-L1219 HydrophobicContact CG2-CD1 4.08Å; I476-L1219 HydrophobicContact CG2-CD2 4.2Å; I476-L1219 HydrophobicContact CG2-CG 3.97Å
477	L	92.6	Very high	84.9	Confident	1 Å²	1	40.6 Å²	40.6	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-68.3	-36.2	175.5	-178	63.6	0	0	0	113.1	L453 F473 F474 Q475 Y481 L493 L497 L505 I532	L453-L477 HydrophobicContact CD1-CD1 4.07Å; F473-L477 HydrophobicContact CE1-CD2 3.87Å; F473-L477 HydrophobicContact CZ-CD2 4.25Å; F473-L477 VanDerWaalsContact O-CB 3.23Å; F473-L477 WeakPolarHBondContact O-CB 3.23Å; F473-L477 PolarHBondContact O-N 3.21Å; F474-L477 PolarHBondContact O-N 2.95Å; Q475-L477 VanDerWaalsContact C-N 3.31Å; Q475-L477 PolarHBondContact O-N 3.45Å; L477-Y481 WeakPolarHBondContact O-CB 3.49Å; L477-Y481 PolarHBondContact O-N 3.02Å; L477-L493 HydrophobicContact CD1-CD1 4.49Å; L477-L493 HydrophobicContact CD1-CD2 3.94Å; L477-L493 HydrophobicContact CD1-CG 4.37Å; L477-L497 HydrophobicContact CD1-CD1 3.6Å; L477-L497 HydrophobicContact CD2-CD1 4.24Å; L477-L505 HydrophobicContact CD2-CD2 4.45Å; L477-I532 HydrophobicContact CD2-CD1 4.47Å; L477-I532 HydrophobicContact CD2-CG2 4.49Å; L477-I532 HydrophobicContact CG-CD1 4.29Å
478	I	92.1	Very high	85.7	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-65.4	-50	173.8	-72.7	160.3	0	0	0	109.7	F474 Q475 F480 Y481 I482 L521 E525 A528 L529	F474-I478 HydrophobicContact CB-CD1 4.5Å; F474-I478 WeakPolarHBondContact O-CB 3.43Å; F474-I478 WeakPolarHBondContact O-CD1 3.45Å; F474-I478 WeakPolarHBondContact O-CG1 3.23Å; F474-I478 PolarHBondContact O-N 3.06Å; Q475-I478 PolarHBondContact O-N 3.14Å; I478-F480 PolarHBondContact O-N 2.97Å; I478-Y481 WeakPolarHBondContact O-CB 3.44Å; I478-Y481 PolarHBondContact O-N 3Å; I478-Y481 VanDerWaalsContact O-N 3.07Å; I478-I482 HydrophobicContact CG2-CD1 3.76Å; I478-I482 WeakPolarHBondContact O-CG1 3.34Å; I478-I482 PolarHBondContact O-N 3.23Å; I478-L521 HydrophobicContact CD1-CD1 4.49Å; I478-E525 HydrophobicContact CG2-CB 3.77Å; I478-E525 HydrophobicContact CG2-CG 3.75Å; I478-A528 HydrophobicContact CG2-CB 4Å; I478-L529 HydrophobicContact CD1-CB 3.82Å; I478-L529 HydrophobicContact CD1-CD1 4.24Å; I478-L529 HydrophobicContact CD1-CD2 4.19Å; I478-L529 HydrophobicContact CD1-CG 4.3Å; I478-L529 HydrophobicContact CG1-CB 4.24Å
479	S	89.7	Confident	86.4	Confident	28 Å²	28	43.3 Å²	43.3	20%	0.196	22%	0.216	C	C	.	.	H	α-helix	trans	-59.9	-44.3	177.5	-60.9	0	0	0	0	111.7	Q475 Y481 I482 Q483 L1219	Q475-S479 PolarHBondContact O-N 2.84Å; Q475-S479 PolarHBondContact O-OG 3.13Å; S479-Y481 VanDerWaalsContact C-N 3.32Å; S479-Y481 PolarHBondContact O-N 3.16Å; S479-I482 PolarHBondContact O-N 3.49Å; S479-Q483 WeakPolarHBondContact O-CB 3.45Å; S479-Q483 WeakPolarHBondContact O-CG 3.47Å; S479-Q483 PolarHBondContact O-N 3.34Å; S479-L1219 VanDerWaalsContact CB-CD1 3.41Å
480	F	90.8	Very high	86.8	Confident	1 Å²	1	41.5 Å²	41.5	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-58.1	-43.2	172.2	173.6	-89.8	0	0	0	112.2	Y431 V434 L449 I476 I478 S484 L493 L1219	Y431-F480 HydrophobicContact CD1-CE2 4.15Å; Y431-F480 HydrophobicContact CD2-CE2 4.15Å; Y431-F480 AromaticContact CG-CE2 3.82Å; Y431-F480 HydrophobicContact CG-CE2 3.82Å; Y431-F480 HydrophobicContact CG-CZ 4.38Å; V434-F480 HydrophobicContact CG2-CE1 4.37Å; V434-F480 HydrophobicContact CG2-CZ 4.42Å; L449-F480 HydrophobicContact CD1-CD2 3.84Å; L449-F480 HydrophobicContact CD1-CE2 3.67Å; L449-F480 HydrophobicContact CD1-CG 4.33Å; L449-F480 HydrophobicContact CD1-CZ 4.04Å; L449-F480 HydrophobicContact CD2-CD1 4Å; L449-F480 HydrophobicContact CD2-CE1 3.53Å; L449-F480 HydrophobicContact CD2-CE2 4.11Å; L449-F480 HydrophobicContact CD2-CG 4.5Å; L449-F480 HydrophobicContact CD2-CZ 3.59Å; L449-F480 HydrophobicContact CG-CZ 4.47Å; I476-F480 WeakPolarHBondContact O-CB 3.4Å; I476-F480 PolarHBondContact O-N 2.95Å; I478-F480 PolarHBondContact O-N 2.97Å; F480-S484 WeakPolarHBondContact O-CB 3.36Å; F480-S484 PolarHBondContact O-N 2.94Å; F480-S484 PolarHBondContact O-OG 3.31Å; F480-L493 HydrophobicContact CD1-CD1 4.44Å; F480-L493 HydrophobicContact CD1-CD2 4.25Å; F480-L493 HydrophobicContact CE1-CD1 3.96Å; F480-L493 HydrophobicContact CE1-CD2 4.36Å; F480-L1219 HydrophobicContact CB-CD2 4.14Å
481	Y	90.9	Very high	87.2	Confident	26 Å²	26	39.9 Å²	39.9	10%	0.102	20%	0.199	C	C	.	.	H	α-helix	trans	-64	-43.5	179.6	177.5	-97	0	0	0	112.2	L477 I478 S479 E488 H489 G490 L493 A528 I532	L477-Y481 WeakPolarHBondContact O-CB 3.49Å; L477-Y481 PolarHBondContact O-N 3.02Å; I478-Y481 WeakPolarHBondContact O-CB 3.44Å; I478-Y481 PolarHBondContact O-N 3Å; I478-Y481 VanDerWaalsContact O-N 3.07Å; S479-Y481 VanDerWaalsContact C-N 3.32Å; S479-Y481 PolarHBondContact O-N 3.16Å; Y481-E488 VanDerWaalsContact OH-C 3.23Å; Y481-E488 PolarHBondContact OH-O 3.3Å; Y481-H489 VanDerWaalsContact OH-C 3.3Å; Y481-H489 WeakPolarHBondContact OH-CA 3.47Å; Y481-H489 PolarHBondContact OH-N 2.63Å; Y481-G490 PolarHBondContact OH-N 3Å; Y481-L493 HydrophobicContact CD2-CD2 3.81Å; Y481-L493 HydrophobicContact CG-CD2 4.48Å; Y481-A528 HydrophobicContact CD1-CB 3.54Å; Y481-A528 HydrophobicContact CE1-CB 3.97Å; Y481-I532 HydrophobicContact CG-CD1 4.46Å
482	I	88.8	Confident	87.5	Confident	54 Å²	54	40.7 Å²	40.7	28%	0.277	20%	0.196	S	C	.	.	H	α-helix	trans	-71.8	-54.3	179.2	-64.6	169.4	0	0	0	110.8	I478 S479 S484 E485 E524 E525 A528	I478-I482 HydrophobicContact CG2-CD1 3.76Å; I478-I482 WeakPolarHBondContact O-CG1 3.34Å; I478-I482 PolarHBondContact O-N 3.23Å; S479-I482 PolarHBondContact O-N 3.49Å; I482-S484 VanDerWaalsContact C-N 3.26Å; I482-S484 PolarHBondContact O-N 2.88Å; I482-E485 PolarHBondContact O-N 3.14Å; I482-E524 HydrophobicContact CD1-CB 4.13Å; I482-E525 HydrophobicContact CD1-CG 4.09Å; I482-A528 HydrophobicContact CD1-CB 4.11Å; I482-A528 HydrophobicContact CG1-CB 4.03Å
483	Q	83	Confident	87.9	Confident	70 Å²	70	39.8 Å²	39.8	33%	0.327	19%	0.189	S	C	.	.	H	α-helix	trans	-67.5	-21.6	-172.8	-66.8	171.5	-3.6	0	0	114.2	S479 I1215 L1216	S479-Q483 WeakPolarHBondContact O-CB 3.45Å; S479-Q483 WeakPolarHBondContact O-CG 3.47Å; S479-Q483 PolarHBondContact O-N 3.34Å; Q483-I1215 HydrophobicContact CG-CG2 4.33Å; Q483-L1216 HydrophobicContact CB-CD2 4.18Å
484	S	77.7	Confident	88.1	Confident	10 Å²	10	39.7 Å²	39.7	7%	0.07	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-21.1	-176.2	62	0	0	0	0	114.2	F480 I482 F486	F480-S484 WeakPolarHBondContact O-CB 3.36Å; F480-S484 PolarHBondContact O-N 2.94Å; F480-S484 PolarHBondContact O-OG 3.31Å; I482-S484 VanDerWaalsContact C-N 3.26Å; I482-S484 PolarHBondContact O-N 2.88Å; S484-F486 WeakPolarHBondContact O-CD1 3.46Å; S484-F486 WeakPolarHBondContact O-CE1 3.49Å; S484-F486 VanDerWaalsContact O-CG 3.31Å; S484-F486 WeakPolarHBondContact O-CG 3.44Å; S484-F486 PolarHBondContact O-N 3.35Å
485	E	78.4	Confident	88.3	Confident	159 Å²	159	39.7 Å²	39.7	74%	0.743	19%	0.188	S	C	*	.			trans	49.2	7.7	-179.1	-61.9	-171.5	161.5	0	0	116.2	I482 H487	I482-E485 PolarHBondContact O-N 3.14Å; E485-H487 VanDerWaalsContact C-N 3.26Å; E485-H487 PolarHBondContact O-N 3.2Å; E485-H487 VanDerWaalsContact O-N 3.17Å
486	F	78.6	Confident	88.6	Confident	75 Å²	75	36.5 Å²	36.5	33%	0.329	17%	0.174	S	C	.	.	S	Bend	trans	-70.5	-14.7	-171	-61.8	-37.7	0	0	0	114.7	P432 Y435 S484	P432-F486 HydrophobicContact CB-CD2 4.4Å; P432-F486 HydrophobicContact CB-CE2 4.27Å; P432-F486 HydrophobicContact CB-CZ 4.35Å; P432-F486 HydrophobicContact CG-CD2 4.44Å; P432-F486 HydrophobicContact CG-CE1 4Å; P432-F486 HydrophobicContact CG-CE2 3.84Å; P432-F486 HydrophobicContact CG-CZ 3.61Å; Y435-F486 HydrophobicContact CD2-CB 3.59Å; Y435-F486 HydrophobicContact CD2-CD2 4.07Å; Y435-F486 HydrophobicContact CD2-CG 4.29Å; Y435-F486 HydrophobicContact CE2-CB 3.66Å; Y435-F486 AromaticContact CE2-CD2 3.94Å; Y435-F486 HydrophobicContact CE2-CD2 3.94Å; Y435-F486 HydrophobicContact CE2-CG 4.33Å; Y435-F486 HydrophobicContact CG-CB 4.36Å; S484-F486 WeakPolarHBondContact O-CD1 3.46Å; S484-F486 WeakPolarHBondContact O-CE1 3.49Å; S484-F486 VanDerWaalsContact O-CG 3.31Å; S484-F486 WeakPolarHBondContact O-CG 3.44Å; S484-F486 PolarHBondContact O-N 3.35Å
487	H	83	Confident	88.9	Confident	58 Å²	58	36.1 Å²	36.1	27%	0.269	17%	0.171	S	C	.	.			trans	-166.5	137.7	177.8	-154.5	-45.4	0	0	0	112.9	Y435 E485 H489 Y492	Y435-H487 HydrophobicContact CD1-CB 3.52Å; Y435-H487 AromaticContact CD1-CD2 3.96Å; Y435-H487 HydrophobicContact CE1-CB 3.52Å; Y435-H487 HydrophobicContact CG-CB 4.24Å; E485-H487 VanDerWaalsContact C-N 3.26Å; E485-H487 PolarHBondContact O-N 3.2Å; E485-H487 VanDerWaalsContact O-N 3.17Å; H487-H489 AromaticContact CE1-CD2 3.99Å; H487-H489 AromaticContact CE1-CE1 3.18Å; H487-H489 PolarHBondContact CE1-CE1 2.76Å; H487-H489 AromaticContact CE1-CG 3.77Å; H487-H489 AromaticContact CE1-ND1 3.25Å; H487-H489 PolarHBondContact CE1-ND1 2.89Å; H487-H489 VanDerWaalsContact CE1-ND1 3.25Å; H487-H489 AromaticContact CE1-NE2 3.69Å; H487-H489 AromaticContact ND1-CE1 3.85Å; H487-H489 AromaticContact ND1-CG 3.87Å; H487-H489 PolarHBondContact ND1-N 2.63Å; H487-H489 AromaticContact ND1-ND1 3.44Å; H487-H489 PolarHBondContact ND1-ND1 3.43Å; H487-H489 AromaticContact NE2-CE1 3.45Å; H487-H489 PolarHBondContact NE2-CE1 2.83Å; H487-H489 AromaticContact NE2-ND1 3.77Å; H487-H489 PolarHBondContact O-N 3.15Å; H487-H489 VanDerWaalsContact O-N 3.08Å; H487-Y492 AromaticContact CD2-CD2 3.55Å; H487-Y492 AromaticContact CD2-CE2 3.97Å; H487-Y492 AromaticContact NE2-CD2 3.35Å; H487-Y492 WeakPolarHBondContact NE2-CD2 3.42Å; H487-Y492 AromaticContact NE2-CE2 3.31Å; H487-Y492 VanDerWaalsContact NE2-CE2 3.31Å; H487-Y492 WeakPolarHBondContact NE2-CE2 3.44Å
488	E	79.3	Confident	89	Confident	156 Å²	156	37.9 Å²	37.9	73%	0.729	18%	0.178	S	C	*	.	S	Bend	trans	-58.9	-17.6	175.1	-56.2	-173.1	120.9	0	0	116.3	Y481	Y481-E488 VanDerWaalsContact OH-C 3.23Å; Y481-E488 PolarHBondContact OH-O 3.3Å
489	H	85	Confident	88.9	Confident	69 Å²	69	42.3 Å²	42.3	32%	0.319	21%	0.205	S	C	.	.			trans	-139.8	140	-169.8	75.5	22.3	0	0	0	114.5	Y481 H487 A491 Y492	Y481-H489 VanDerWaalsContact OH-C 3.3Å; Y481-H489 WeakPolarHBondContact OH-CA 3.47Å; Y481-H489 PolarHBondContact OH-N 2.63Å; H487-H489 AromaticContact CE1-CD2 3.99Å; H487-H489 AromaticContact CE1-CE1 3.18Å; H487-H489 PolarHBondContact CE1-CE1 2.76Å; H487-H489 AromaticContact CE1-CG 3.77Å; H487-H489 AromaticContact CE1-ND1 3.25Å; H487-H489 PolarHBondContact CE1-ND1 2.89Å; H487-H489 VanDerWaalsContact CE1-ND1 3.25Å; H487-H489 AromaticContact CE1-NE2 3.69Å; H487-H489 AromaticContact ND1-CE1 3.85Å; H487-H489 AromaticContact ND1-CG 3.87Å; H487-H489 PolarHBondContact ND1-N 2.63Å; H487-H489 AromaticContact ND1-ND1 3.44Å; H487-H489 PolarHBondContact ND1-ND1 3.43Å; H487-H489 AromaticContact NE2-CE1 3.45Å; H487-H489 PolarHBondContact NE2-CE1 2.83Å; H487-H489 AromaticContact NE2-ND1 3.77Å; H487-H489 PolarHBondContact O-N 3.15Å; H487-H489 VanDerWaalsContact O-N 3.08Å; H489-A491 PolarHBondContact O-N 2.79Å; H489-Y492 AromaticContact CE1-CD2 3.6Å; H489-Y492 AromaticContact CE1-CE2 3.55Å
490	G	89.8	Confident	89.1	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-10	-174.8	0	0	0	0	0	115.2	Y481 Y492 L493 V494 E531	Y481-G490 PolarHBondContact OH-N 3Å; G490-Y492 PolarHBondContact O-N 3.26Å; G490-L493 PolarHBondContact O-N 3.1Å; G490-L493 VanDerWaalsContact O-N 3.13Å; G490-V494 WeakPolarHBondContact O-CG2 3.39Å; G490-V494 PolarHBondContact O-N 3.29Å; G490-E531 VanDerWaalsContact N-CG 3.28Å; G490-E531 PolarHBondContact N-OE1 3.02Å
491	A	93.2	Very high	89.2	Confident	5 Å²	5	43.2 Å²	43.2	4%	0.041	21%	0.21	C	C	.	.	H	α-helix	trans	-52	-32.4	-174.1	0	0	0	0	0	115.6	H489 C535	H489-A491 PolarHBondContact O-N 2.79Å; A491-C535 WeakPolarHBondContact CA-SG 3.26Å; A491-C535 VanDerWaalsContact CB-SG 3.55Å; A491-C535 PolarHBondContact N-SG 3.25Å
492	Y	94.8	Very high	89	Confident	42 Å²	42	42.8 Å²	42.8	17%	0.165	21%	0.213	C	C	.	.	H	α-helix	trans	-89.6	-37.8	178.4	-69.8	-56.4	0	0	0	113.2	H487 H489 G490 D495 S496 P546 A547 R549	H487-Y492 AromaticContact CD2-CD2 3.55Å; H487-Y492 AromaticContact CD2-CE2 3.97Å; H487-Y492 AromaticContact NE2-CD2 3.35Å; H487-Y492 WeakPolarHBondContact NE2-CD2 3.42Å; H487-Y492 AromaticContact NE2-CE2 3.31Å; H487-Y492 VanDerWaalsContact NE2-CE2 3.31Å; H487-Y492 WeakPolarHBondContact NE2-CE2 3.44Å; H489-Y492 AromaticContact CE1-CD2 3.6Å; H489-Y492 AromaticContact CE1-CE2 3.55Å; G490-Y492 PolarHBondContact O-N 3.26Å; Y492-D495 PolarHBondContact O-N 2.77Å; Y492-S496 PolarHBondContact O-N 3.08Å; Y492-S496 PolarHBondContact O-OG 3.11Å; Y492-P546 HydrophobicContact CD1-CB 4.15Å; Y492-P546 HydrophobicContact CD1-CG 3.57Å; Y492-P546 HydrophobicContact CE1-CB 3.92Å; Y492-P546 HydrophobicContact CE1-CG 3.73Å; Y492-A547 WeakPolarHBondContact CE1-O 3.43Å; Y492-A547 PolarHBondContact OH-O 2.96Å; Y492-R549 HydrophobicContact CD1-CG 4.39Å; Y492-R549 HydrophobicContact CE1-CG 4.29Å; Y492-R549 PolarHBondContact O-NH1 3.1Å
493	L	95.4	Very high	89.1	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-60.4	-46.7	175.1	178.5	58.4	0	0	0	110.8	V434 Y435 L449 L477 F480 Y481 G490 D495 S496 L497	V434-L493 HydrophobicContact CB-CD1 4.33Å; V434-L493 HydrophobicContact CG2-CD1 3.75Å; Y435-L493 HydrophobicContact CE1-CB 4.07Å; L449-L493 HydrophobicContact CD2-CD1 3.92Å; L477-L493 HydrophobicContact CD1-CD1 4.49Å; L477-L493 HydrophobicContact CD1-CD2 3.94Å; L477-L493 HydrophobicContact CD1-CG 4.37Å; F480-L493 HydrophobicContact CD1-CD1 4.44Å; F480-L493 HydrophobicContact CD1-CD2 4.25Å; F480-L493 HydrophobicContact CE1-CD1 3.96Å; F480-L493 HydrophobicContact CE1-CD2 4.36Å; Y481-L493 HydrophobicContact CD2-CD2 3.81Å; Y481-L493 HydrophobicContact CG-CD2 4.48Å; G490-L493 PolarHBondContact O-N 3.1Å; G490-L493 VanDerWaalsContact O-N 3.13Å; L493-D495 PolarHBondContact O-N 3.33Å; L493-S496 WeakPolarHBondContact O-CB 3.31Å; L493-S496 PolarHBondContact O-N 3.06Å; L493-L497 HydrophobicContact CD1-CD1 3.8Å; L493-L497 HydrophobicContact CD1-CG 4.27Å; L493-L497 HydrophobicContact CG-CD1 4.05Å; L493-L497 WeakPolarHBondContact O-CG 3.34Å; L493-L497 PolarHBondContact O-N 3.29Å
494	V	95.8	Very high	89.5	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.006	22%	0.216	C	C	.	.	H	α-helix	trans	-59.6	-42.8	176.6	171.8	0	0	0	0	111.8	G490 S496 L497 W498 L505 I532 C535 A536	G490-V494 WeakPolarHBondContact O-CG2 3.39Å; G490-V494 PolarHBondContact O-N 3.29Å; V494-S496 VanDerWaalsContact C-N 3.35Å; V494-S496 PolarHBondContact O-N 3.33Å; V494-L497 PolarHBondContact O-N 3.48Å; V494-W498 HydrophobicContact CG1-CE3 3.88Å; V494-W498 HydrophobicContact CG1-CZ3 4.07Å; V494-W498 WeakPolarHBondContact O-CA 3.34Å; V494-W498 WeakPolarHBondContact O-CB 3.45Å; V494-W498 PolarHBondContact O-N 2.85Å; V494-L505 HydrophobicContact CG1-CD1 4.47Å; V494-I532 HydrophobicContact CG2-CG2 4.2Å; V494-C535 HydrophobicContact CB-CB 4.34Å; V494-C535 HydrophobicContact CG2-CB 4.02Å; V494-A536 HydrophobicContact CG1-CB 4.15Å
495	D	95.9	Very high	90.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-68.4	-32.8	179	178	60	0	0	0	113.4	R439 Y492 L493 W498 Q539 P546 R549	R439-D495 IonicContact CZ-OD1 2.94Å; R439-D495 IonicContact CZ-OD2 2.81Å; R439-D495 IonicContact NE-OD1 2.73Å; R439-D495 PolarHBondContact NE-OD1 3.34Å; R439-D495 IonicContact NE-OD2 2.68Å; R439-D495 PolarHBondContact NE-OD2 3.35Å; R439-D495 PolarHBondContact NH2-O 3.19Å; R439-D495 IonicContact NH2-OD1 2.83Å; R439-D495 PolarHBondContact NH2-OD1 2.79Å; R439-D495 IonicContact NH2-OD2 3.2Å; Y492-D495 PolarHBondContact O-N 2.77Å; L493-D495 PolarHBondContact O-N 3.33Å; D495-W498 WeakPolarHBondContact O-CB 3.43Å; D495-Q539 PolarHBondContact OD1-NE2 3Å; D495-P546 HydrophobicContact CB-CG 3.93Å; D495-P546 VanDerWaalsContact CG-CD 3.47Å; D495-R549 WeakPolarHBondContact OD2-CD 3.3Å; D495-R549 IonicContact OD2-CZ 3.93Å; D495-R549 IonicContact OD2-NE 3.91Å; D495-R549 IonicContact OD2-NH1 3.4Å; D495-R549 PolarHBondContact OD2-NH1 2.59Å; D495-R549 VanDerWaalsContact OD2-NH1 3.09Å
496	S	96.1	Very high	91.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-68.5	-44.4	175.9	-63.3	0	0	0	0	111.5	V434 A442 Y492 L493 V494 R549	V434-S496 PolarHBondContact O-OG 3.35Å; A442-S496 WeakPolarHBondContact CB-OG 3.29Å; A442-S496 VanDerWaalsContact O-CB 3.28Å; A442-S496 WeakPolarHBondContact O-CB 3.26Å; A442-S496 PolarHBondContact O-OG 2.95Å; Y492-S496 PolarHBondContact O-N 3.08Å; Y492-S496 PolarHBondContact O-OG 3.11Å; L493-S496 WeakPolarHBondContact O-CB 3.31Å; L493-S496 PolarHBondContact O-N 3.06Å; V494-S496 VanDerWaalsContact C-N 3.35Å; V494-S496 PolarHBondContact O-N 3.33Å; S496-R549 PolarHBondContact OG-NH1 2.91Å; S496-R549 PolarHBondContact OG-NH2 3.29Å
497	L	96.1	Very high	91.8	Very high	1 Å²	1	34.4 Å²	34.4	1%	0.005	18%	0.18	C	C	.	.	H	α-helix	trans	-78.6	-16.3	178	-67.7	173.1	0	0	0	113.4	G446 L449 C450 L477 L493 V494 T499 V500 A501 L505	G446-L497 WeakPolarHBondContact O-CD2 3.41Å; L449-L497 HydrophobicContact CD2-CD2 4.49Å; C450-L497 HydrophobicContact CB-CD2 3.89Å; L477-L497 HydrophobicContact CD1-CD1 3.6Å; L477-L497 HydrophobicContact CD2-CD1 4.24Å; L493-L497 HydrophobicContact CD1-CD1 3.8Å; L493-L497 HydrophobicContact CD1-CG 4.27Å; L493-L497 HydrophobicContact CG-CD1 4.05Å; L493-L497 WeakPolarHBondContact O-CG 3.34Å; L493-L497 PolarHBondContact O-N 3.29Å; V494-L497 PolarHBondContact O-N 3.48Å; L497-T499 PolarHBondContact O-N 3.28Å; L497-V500 HydrophobicContact CD2-CG2 4.31Å; L497-V500 WeakPolarHBondContact O-CG2 3.25Å; L497-V500 PolarHBondContact O-N 2.84Å; L497-A501 HydrophobicContact CB-CB 4.26Å; L497-A501 PolarHBondContact O-N 2.73Å; L497-L505 HydrophobicContact CB-CD1 3.78Å
498	W	94.6	Very high	92.4	Very high	39 Å²	39	32.3 Å²	32.3	15%	0.148	17%	0.169	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-30.1	-170.8	-162.3	-113.5	0	0	0	116	V494 D495 L505 A536 Q539 A540	V494-W498 HydrophobicContact CG1-CE3 3.88Å; V494-W498 HydrophobicContact CG1-CZ3 4.07Å; V494-W498 WeakPolarHBondContact O-CA 3.34Å; V494-W498 WeakPolarHBondContact O-CB 3.45Å; V494-W498 PolarHBondContact O-N 2.85Å; D495-W498 WeakPolarHBondContact O-CB 3.43Å; W498-L505 HydrophobicContact CE3-CB 4.43Å; W498-L505 HydrophobicContact CE3-CD1 4.15Å; W498-L505 HydrophobicContact CZ3-CB 4.17Å; W498-A536 WeakPolarHBondContact CH2-O 3.35Å; W498-A536 HydrophobicContact CZ3-CB 4.17Å; W498-Q539 HydrophobicContact CD2-CB 4.5Å; W498-Q539 HydrophobicContact CD2-CG 3.82Å; W498-Q539 HydrophobicContact CE3-CB 4.36Å; W498-Q539 HydrophobicContact CE3-CG 4.15Å; W498-Q539 HydrophobicContact CG-CG 4.29Å; W498-Q539 HydrophobicContact CH2-CB 4.11Å; W498-Q539 HydrophobicContact CH2-CG 4.3Å; W498-Q539 HydrophobicContact CZ2-CB 4.23Å; W498-Q539 HydrophobicContact CZ2-CG 3.96Å; W498-Q539 HydrophobicContact CZ3-CB 4.18Å; W498-Q539 HydrophobicContact CZ3-CG 4.38Å; W498-A540 HydrophobicContact CH2-CB 3.91Å; W498-A540 HydrophobicContact CZ2-CB 4.18Å
499	T	90.8	Very high	93	Very high	92 Å²	92	28.4 Å²	28.4	56%	0.564	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-11.8	-178.9	42.1	0	0	0	0	114.6	L497	L497-T499 PolarHBondContact O-N 3.28Å
500	V	93.4	Very high	93.4	Very high	49 Å²	49	25.6 Å²	25.6	30%	0.297	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.4	-27.5	-169.7	-68.2	0	0	0	0	114.3	A447 C450 K454 L497	A447-V500 HydrophobicContact CB-CG1 4Å; C450-V500 HydrophobicContact CB-CB 4.09Å; C450-V500 HydrophobicContact CB-CG2 3.56Å; K454-V500 PolarHBondContact NZ-O 2.91Å; K454-V500 VanDerWaalsContact NZ-O 3.12Å; L497-V500 HydrophobicContact CD2-CG2 4.31Å; L497-V500 WeakPolarHBondContact O-CG2 3.25Å; L497-V500 PolarHBondContact O-N 2.84Å
501	A	92.4	Very high	93.6	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	14%	0.142	C	C	.	.	S	Bend	trans	-114.2	31.4	170.1	0	0	0	0	0	111.1	F473 L497 S503 E504 L505	F473-A501 HydrophobicContact CE1-CB 4.24Å; F473-A501 HydrophobicContact CE2-CB 4.44Å; F473-A501 HydrophobicContact CZ-CB 3.66Å; L497-A501 HydrophobicContact CB-CB 4.26Å; L497-A501 PolarHBondContact O-N 2.73Å; A501-S503 PolarHBondContact O-N 2.97Å; A501-E504 WeakPolarHBondContact CA-OE2 3.4Å; A501-E504 HydrophobicContact CB-CB 4.42Å; A501-E504 PolarHBondContact O-N 3.08Å; A501-L505 HydrophobicContact CB-CD1 4.25Å; A501-L505 HydrophobicContact CB-CG 4.35Å; A501-L505 WeakPolarHBondContact O-CB 3.44Å; A501-L505 VanDerWaalsContact O-CG 3.3Å; A501-L505 WeakPolarHBondContact O-CG 3.5Å; A501-L505 PolarHBondContact O-N 3.19Å
502	G	88	Confident	93.7	Very high	17 Å²	17	25.6 Å²	25.6	18%	0.175	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-5.8	-172.8	0	0	0	0	0	115.2	R506	G502-R506 WeakPolarHBondContact O-CD 3.26Å; G502-R506 WeakPolarHBondContact O-CG 2.73Å; G502-R506 PolarHBondContact O-NH1 3.44Å
503	S	90.3	Very high	93.6	Very high	82 Å²	82	26.5 Å²	26.5	57%	0.573	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-49.3	171.1	7.9	0	0	0	0	109.9	A501 R506 D507	A501-S503 PolarHBondContact O-N 2.97Å; S503-R506 WeakPolarHBondContact O-CB 3.19Å; S503-R506 PolarHBondContact O-N 3.4Å; S503-D507 PolarHBondContact O-N 3.35Å
504	E	92.2	Very high	93.4	Very high	19 Å²	19	27 Å²	27	9%	0.089	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-65.2	-52.1	-177.3	-57.7	83.1	161.3	0	0	109.5	K454 F473 F474 A501 R506 D507	K454-E504 WeakPolarHBondContact CE-OE1 3.02Å; K454-E504 IonicContact NZ-OE1 2.67Å; K454-E504 PolarHBondContact NZ-OE1 3.49Å; K454-E504 IonicContact NZ-OE2 2.7Å; F473-E504 HydrophobicContact CD1-CB 3.79Å; F473-E504 HydrophobicContact CD1-CG 4.12Å; F473-E504 HydrophobicContact CE1-CB 3.74Å; F473-E504 HydrophobicContact CE1-CG 4.27Å; F473-E504 HydrophobicContact CG-CG 4.41Å; F473-E504 HydrophobicContact CZ-CB 4.47Å; F474-E504 VanDerWaalsContact CZ-O 3.27Å; F474-E504 WeakPolarHBondContact CZ-O 3.36Å; A501-E504 WeakPolarHBondContact CA-OE2 3.4Å; A501-E504 HydrophobicContact CB-CB 4.42Å; A501-E504 PolarHBondContact O-N 3.08Å; E504-R506 PolarHBondContact O-N 2.94Å; E504-D507 WeakPolarHBondContact O-CB 3.46Å; E504-D507 PolarHBondContact O-N 2.73Å
505	L	94.3	Very high	93.3	Very high	1 Å²	1	27 Å²	27	1%	0.005	15%	0.153	C	C	.	.	G	3₁₀ helix	trans	-64.3	-2.2	175.2	-64.9	170	0	0	0	114.5	L477 V494 L497 W498 A501 I532 A536	L477-L505 HydrophobicContact CD2-CD2 4.45Å; V494-L505 HydrophobicContact CG1-CD1 4.47Å; L497-L505 HydrophobicContact CB-CD1 3.78Å; W498-L505 HydrophobicContact CE3-CB 4.43Å; W498-L505 HydrophobicContact CE3-CD1 4.15Å; W498-L505 HydrophobicContact CZ3-CB 4.17Å; A501-L505 HydrophobicContact CB-CD1 4.25Å; A501-L505 HydrophobicContact CB-CG 4.35Å; A501-L505 WeakPolarHBondContact O-CB 3.44Å; A501-L505 VanDerWaalsContact O-CG 3.3Å; A501-L505 WeakPolarHBondContact O-CG 3.5Å; A501-L505 PolarHBondContact O-N 3.19Å; L505-I532 HydrophobicContact CD2-CG2 4.25Å; L505-A536 WeakPolarHBondContact O-CB 3.37Å
506	R	94.1	Very high	93	Very high	62 Å²	62	30 Å²	30	23%	0.234	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-106.3	-3.4	170.5	-74	-179.2	169.6	69.8	9.3	113.5	G502 S503 E504 W508 D567	G502-R506 WeakPolarHBondContact O-CD 3.26Å; G502-R506 WeakPolarHBondContact O-CG 2.73Å; G502-R506 PolarHBondContact O-NH1 3.44Å; S503-R506 WeakPolarHBondContact O-CB 3.19Å; S503-R506 PolarHBondContact O-N 3.4Å; E504-R506 PolarHBondContact O-N 2.94Å; R506-W508 VanDerWaalsContact C-N 3.27Å; R506-W508 HydrophobicContact CB-CH2 4.42Å; R506-W508 HydrophobicContact CB-CZ2 4.25Å; R506-W508 HydrophobicContact CG-CH2 4.4Å; R506-W508 HydrophobicContact CG-CZ2 4.18Å; R506-W508 VanDerWaalsContact O-CD2 3.31Å; R506-W508 PolarHBondContact O-N 3.05Å; R506-D567 IonicContact CZ-OD2 3.63Å; R506-D567 VanDerWaalsContact CZ-OD2 3.24Å; R506-D567 IonicContact NE-OD1 3.69Å; R506-D567 PolarHBondContact NE-OD1 2.9Å; R506-D567 IonicContact NE-OD2 2.66Å; R506-D567 PolarHBondContact NE-OD2 3.15Å; R506-D567 IonicContact NH2-OD2 2.63Å; R506-D567 PolarHBondContact NH2-OD2 3.44Å
507	D	94.3	Very high	92.6	Very high	27 Å²	27	33.9 Å²	33.9	14%	0.144	19%	0.187	C	C	.	.			trans	-84.5	69.2	179.8	-169.6	3.2	0	0	0	111.8	N470 S503 E504 D509 T510 M511	N470-D507 PolarHBondContact ND2-OD2 2.83Å; S503-D507 PolarHBondContact O-N 3.35Å; E504-D507 WeakPolarHBondContact O-CB 3.46Å; E504-D507 PolarHBondContact O-N 2.73Å; D507-D509 PolarHBondContact O-N 2.9Å; D507-D509 WeakPolarHBondContact OD1-CB 3.38Å; D507-D509 PolarHBondContact OD1-N 3.27Å; D507-T510 VanDerWaalsContact CG-OG1 3.22Å; D507-T510 PolarHBondContact O-N 2.79Å; D507-T510 PolarHBondContact OD1-N 3.1Å; D507-T510 VanDerWaalsContact OD1-N 3.09Å; D507-T510 PolarHBondContact OD1-OG1 2.97Å; D507-T510 VanDerWaalsContact OD2-CB 3.25Å; D507-T510 WeakPolarHBondContact OD2-CB 3.36Å; D507-T510 PolarHBondContact OD2-OG1 2.72Å; D507-M511 WeakPolarHBondContact O-CG 3.45Å; D507-M511 PolarHBondContact O-N 3.43Å; D507-M511 VanDerWaalsContact O-N 3.14Å
508	W	94.6	Very high	91.1	Very high	14 Å²	14	42.3 Å²	42.3	5%	0.053	23%	0.233	C	C	.	.	H	α-helix	trans	-64.6	-21.7	176.2	-49.4	-56.3	0	0	0	112.8	R506 T512 A540 D567 R570 I571 H574 F575	R506-W508 VanDerWaalsContact C-N 3.27Å; R506-W508 HydrophobicContact CB-CH2 4.42Å; R506-W508 HydrophobicContact CB-CZ2 4.25Å; R506-W508 HydrophobicContact CG-CH2 4.4Å; R506-W508 HydrophobicContact CG-CZ2 4.18Å; R506-W508 VanDerWaalsContact O-CD2 3.31Å; R506-W508 PolarHBondContact O-N 3.05Å; W508-T512 WeakPolarHBondContact O-CB 3.5Å; W508-T512 WeakPolarHBondContact O-CG2 3.32Å; W508-T512 PolarHBondContact O-N 3.41Å; W508-T512 PolarHBondContact O-OG1 3.35Å; W508-A540 HydrophobicContact CZ2-CB 4.2Å; W508-D567 HydrophobicContact CH2-CB 4.38Å; W508-R570 HydrophobicContact CZ3-CB 3.76Å; W508-I571 HydrophobicContact CD2-CG1 4.18Å; W508-I571 HydrophobicContact CE3-CG1 4.03Å; W508-I571 HydrophobicContact CH2-CD1 3.98Å; W508-I571 HydrophobicContact CH2-CG1 3.45Å; W508-I571 VanDerWaalsContact CH2-CG1 3.45Å; W508-I571 HydrophobicContact CZ2-CD1 3.88Å; W508-I571 HydrophobicContact CZ2-CG1 3.57Å; W508-I571 HydrophobicContact CZ3-CG1 3.68Å; W508-H574 PolarHBondContact O-NE2 3.02Å; W508-F575 HydrophobicContact CB-CE2 3.68Å; W508-F575 HydrophobicContact CB-CZ 3.8Å; W508-F575 HydrophobicContact CD2-CE2 4.32Å; W508-F575 AromaticContact CG-CE2 3.71Å; W508-F575 HydrophobicContact CG-CE2 3.71Å; W508-F575 HydrophobicContact CG-CZ 4.13Å
509	D	93.1	Very high	89.6	Confident	75 Å²	75	45.4 Å²	45.4	40%	0.401	26%	0.26	S	S	.	.	H	α-helix	trans	-65.1	-48.2	175.7	-164	64.5	0	0	0	110.4	K467 D507 T512 T513	K467-D509 IonicContact NZ-OD2 2.7Å; K467-D509 PolarHBondContact NZ-OD2 2.92Å; D507-D509 PolarHBondContact O-N 2.9Å; D507-D509 WeakPolarHBondContact OD1-CB 3.38Å; D507-D509 PolarHBondContact OD1-N 3.27Å; D509-T512 PolarHBondContact O-OG1 3.46Å; D509-T513 VanDerWaalsContact O-CB 3.26Å; D509-T513 WeakPolarHBondContact O-CB 3.42Å; D509-T513 PolarHBondContact O-N 3.15Å; D509-T513 PolarHBondContact O-OG1 2.97Å
510	T	92.8	Very high	88.3	Confident	10 Å²	10	43 Å²	43	6%	0.061	25%	0.253	C	S	.	.	H	α-helix	trans	-68.3	-44.9	174.6	-60.4	0	0	0	0	111.9	N470 A471 F474 D507 T512 T513 L514	N470-T510 HydrophobicContact CB-CG2 4.29Å; A471-T510 HydrophobicContact CB-CG2 4.08Å; F474-T510 HydrophobicContact CD2-CG2 3.99Å; F474-T510 HydrophobicContact CE2-CG2 4.19Å; D507-T510 VanDerWaalsContact CG-OG1 3.22Å; D507-T510 PolarHBondContact O-N 2.79Å; D507-T510 PolarHBondContact OD1-N 3.1Å; D507-T510 VanDerWaalsContact OD1-N 3.09Å; D507-T510 PolarHBondContact OD1-OG1 2.97Å; D507-T510 VanDerWaalsContact OD2-CB 3.25Å; D507-T510 WeakPolarHBondContact OD2-CB 3.36Å; D507-T510 PolarHBondContact OD2-OG1 2.72Å; T510-T512 PolarHBondContact O-N 2.85Å; T510-T513 PolarHBondContact O-N 3.17Å; T510-L514 HydrophobicContact CG2-CD1 4.25Å; T510-L514 WeakPolarHBondContact O-CG 3.32Å; T510-L514 PolarHBondContact O-N 3.18Å
511	M	94.4	Very high	87.8	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-56.1	-49.7	177.4	-64.9	174.4	179.8	0	0	112.4	F474 D507 L514 L515 L529 M533 A536	F474-M511 HydrophobicContact CD2-CG 4.48Å; F474-M511 HydrophobicContact CE1-CE 3.54Å; F474-M511 HydrophobicContact CE1-CG 4.07Å; F474-M511 HydrophobicContact CE2-CG 3.84Å; F474-M511 HydrophobicContact CZ-CE 3.41Å; F474-M511 VanDerWaalsContact CZ-CE 3.41Å; F474-M511 HydrophobicContact CZ-CG 3.6Å; F474-M511 HydrophobicContact CZ-SD 4.35Å; D507-M511 WeakPolarHBondContact O-CG 3.45Å; D507-M511 PolarHBondContact O-N 3.43Å; D507-M511 VanDerWaalsContact O-N 3.14Å; M511-L514 PolarHBondContact O-N 3.05Å; M511-L515 WeakPolarHBondContact O-CG 3.14Å; M511-L515 PolarHBondContact O-N 3.35Å; M511-L529 HydrophobicContact CB-CD1 4.29Å; M511-L529 HydrophobicContact CG-CD1 4.11Å; M511-M533 HydrophobicContact CB-CG 4.4Å; M511-M533 HydrophobicContact CB-SD 4.06Å; M511-M533 HydrophobicContact SD-CB 3.64Å; M511-M533 HydrophobicContact SD-CG 3.6Å; M511-M533 VanDerWaalsContact SD-CG 3.6Å; M511-M533 HydrophobicContact SD-SD 4.43Å; M511-A536 HydrophobicContact CE-CB 4.41Å
512	T	94.4	Very high	87.5	Confident	5 Å²	5	47.7 Å²	47.7	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-74.9	-27.6	-177.9	56.3	0	0	0	0	113.2	W508 D509 T510 L515 L516 M533 H574 F575 V578 L582	W508-T512 WeakPolarHBondContact O-CB 3.5Å; W508-T512 WeakPolarHBondContact O-CG2 3.32Å; W508-T512 PolarHBondContact O-N 3.41Å; W508-T512 PolarHBondContact O-OG1 3.35Å; D509-T512 PolarHBondContact O-OG1 3.46Å; T510-T512 PolarHBondContact O-N 2.85Å; T512-L515 PolarHBondContact O-N 3.42Å; T512-L516 WeakPolarHBondContact O-CB 3.5Å; T512-L516 WeakPolarHBondContact O-CG 3.22Å; T512-L516 PolarHBondContact O-N 3Å; T512-M533 HydrophobicContact CG2-SD 3.8Å; T512-H574 WeakPolarHBondContact CG2-NE2 3.39Å; T512-H574 PolarHBondContact OG1-CE1 3.06Å; T512-H574 PolarHBondContact OG1-NE2 3.49Å; T512-F575 HydrophobicContact CG2-CD1 4.32Å; T512-F575 HydrophobicContact CG2-CE1 3.42Å; T512-F575 VanDerWaalsContact CG2-CE1 3.42Å; T512-F575 HydrophobicContact CG2-CZ 3.84Å; T512-V578 HydrophobicContact CG2-CG1 3.98Å; T512-L582 HydrophobicContact CG2-CD1 4.26Å
513	T	92.7	Very high	87.5	Confident	60 Å²	60	53.5 Å²	53.5	37%	0.368	29%	0.292	S	S	.	.	H	α-helix	trans	-63.5	-47.9	171.8	-62.9	0	0	0	0	110.7	D509 T510 L515 L516 Q517	D509-T513 VanDerWaalsContact O-CB 3.26Å; D509-T513 WeakPolarHBondContact O-CB 3.42Å; D509-T513 PolarHBondContact O-N 3.15Å; D509-T513 PolarHBondContact O-OG1 2.97Å; T510-T513 PolarHBondContact O-N 3.17Å; T513-L515 VanDerWaalsContact C-N 3.31Å; T513-L515 PolarHBondContact O-N 2.98Å; T513-L516 PolarHBondContact O-N 3.31Å; T513-Q517 HydrophobicContact CG2-CG 4.28Å; T513-Q517 WeakPolarHBondContact O-CG 3.47Å; T513-Q517 PolarHBondContact O-N 2.97Å
514	L	91.5	Very high	87.3	Confident	14 Å²	14	56 Å²	56	7%	0.073	29%	0.294	C	S	.	.	H	α-helix	trans	-59.1	-41	176.1	-69.4	168.5	0	0	0	112	F474 T510 M511 L516 L521 L529	F474-L514 HydrophobicContact CB-CD1 4.17Å; F474-L514 HydrophobicContact CD2-CD1 4.44Å; T510-L514 HydrophobicContact CG2-CD1 4.25Å; T510-L514 WeakPolarHBondContact O-CG 3.32Å; T510-L514 PolarHBondContact O-N 3.18Å; M511-L514 PolarHBondContact O-N 3.05Å; L514-L516 PolarHBondContact O-N 3.42Å; L514-L521 HydrophobicContact CB-CD1 4.24Å; L514-L529 HydrophobicContact CB-CD2 3.81Å; L514-L529 HydrophobicContact CD1-CD2 4.15Å
515	L	92.9	Very high	87.3	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-10.6	176.3	-68.3	169	0	0	0	114.6	M511 T512 T513 E526 L529 L530 M533 L582 K585 Y586	M511-L515 WeakPolarHBondContact O-CG 3.14Å; M511-L515 PolarHBondContact O-N 3.35Å; T512-L515 PolarHBondContact O-N 3.42Å; T513-L515 VanDerWaalsContact C-N 3.31Å; T513-L515 PolarHBondContact O-N 2.98Å; L515-E526 HydrophobicContact CD2-CB 4.33Å; L515-L529 HydrophobicContact CD1-CD2 4.48Å; L515-L529 HydrophobicContact CD1-CG 4.32Å; L515-L529 HydrophobicContact CD2-CB 4.23Å; L515-L529 HydrophobicContact CD2-CD2 4.08Å; L515-L529 HydrophobicContact CD2-CG 4.23Å; L515-L529 HydrophobicContact CG-CD2 3.86Å; L515-L529 HydrophobicContact CG-CG 4.15Å; L515-L530 HydrophobicContact CD1-CD2 3.62Å; L515-L530 HydrophobicContact CD1-CG 4.04Å; L515-L530 HydrophobicContact CD2-CD2 4.34Å; L515-L530 HydrophobicContact CD2-CG 3.94Å; L515-M533 HydrophobicContact CD1-CE 3.89Å; L515-M533 HydrophobicContact CD1-SD 3.98Å; L515-L582 HydrophobicContact CB-CD2 3.9Å; L515-L582 HydrophobicContact CD1-CD2 4.45Å; L515-K585 WeakPolarHBondContact O-CD 3.42Å; L515-K585 PolarHBondContact O-NZ 3.24Å; L515-Y586 PolarHBondContact O-OH 2.69Å; L515-Y586 VanDerWaalsContact O-OH 3.14Å
516	L	91.1	Very high	87.2	Confident	63 Å²	63	58.4 Å²	58.4	33%	0.33	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-1.1	-177.3	-69.1	175.7	0	0	0	114.4	T512 T513 L514 V578 Q581 L582	T512-L516 WeakPolarHBondContact O-CB 3.5Å; T512-L516 WeakPolarHBondContact O-CG 3.22Å; T512-L516 PolarHBondContact O-N 3Å; T513-L516 PolarHBondContact O-N 3.31Å; L514-L516 PolarHBondContact O-N 3.42Å; L516-V578 HydrophobicContact CD1-CG1 3.93Å; L516-Q581 HydrophobicContact CD2-CB 4.5Å; L516-L582 HydrophobicContact CD1-CD2 4.42Å; L516-L582 HydrophobicContact CD2-CD2 3.82Å; L516-L582 HydrophobicContact CD2-CG 4.46Å; L516-L582 HydrophobicContact CG-CD2 3.94Å
517	Q	86.1	Confident	87.1	Confident	82 Å²	82	56.3 Å²	56.3	38%	0.383	30%	0.303	S	S	.	.			trans	-73	143.2	174.9	-83.1	170.6	-10.4	0	0	112.6	T513	T513-Q517 HydrophobicContact CG2-CG 4.28Å; T513-Q517 WeakPolarHBondContact O-CG 3.47Å; T513-Q517 PolarHBondContact O-N 2.97Å
518	D	64.6	Low	87.1	Confident	178 Å²	178	55.2 Å²	55.2	95%	0.952	30%	0.298	S	S	*	.	S	Bend	trans	-73.9	-27.5	176.4	-64	-55.5	0	0	0	112.9	G520	D518-G520 PolarHBondContact O-N 2.98Å
519	S	63.6	Low	87.1	Confident	104 Å²	104	54.6 Å²	54.6	73%	0.727	30%	0.296	S	S	*	.	S	Bend	trans	-80.6	52.2	169.3	59.3	0	0	0	0	110.4
520	G	63.7	Low	87.2	Confident	41 Å²	41	51 Å²	51	42%	0.423	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-69.8	160.2	-156.4	0	0	0	0	0	115.9	D518	D518-G520 PolarHBondContact O-N 2.98Å
521	L	82.9	Confident	87.3	Confident	20 Å²	20	51.3 Å²	51.3	11%	0.105	28%	0.277	C	S	.	.	P	Polyproline II helix	trans	-54.6	155	162.9	-65.8	176.1	0	0	0	111.7	Q475 I478 L514 E525 E526 L529	Q475-L521 VanDerWaalsContact NE2-CD2 3.33Å; I478-L521 HydrophobicContact CD1-CD1 4.49Å; L514-L521 HydrophobicContact CB-CD1 4.24Å; L521-E525 WeakPolarHBondContact CA-OE2 3.49Å; L521-E525 HydrophobicContact CB-CB 3.9Å; L521-E525 HydrophobicContact CD1-CB 4.49Å; L521-E525 HydrophobicContact CD2-CB 4.28Å; L521-E525 HydrophobicContact CG-CB 4.45Å; L521-E526 HydrophobicContact CB-CG 3.76Å; L521-L529 HydrophobicContact CD1-CB 4.37Å; L521-L529 HydrophobicContact CD1-CD2 3.58Å
522	M	86.9	Confident	87.3	Confident	127 Å²	127	51.3 Å²	51.3	63%	0.626	28%	0.277	S	S	*	.	P	Polyproline II helix	trans	-65.2	155	170	-62.1	-67.6	-75.5	0	0	111.1	E524 E525 E526	M522-E524 PolarHBondContact O-N 2.98Å; M522-E524 VanDerWaalsContact O-N 3.07Å; M522-E525 HydrophobicContact CB-CB 4.35Å; M522-E525 HydrophobicContact CB-CG 3.99Å; M522-E525 PolarHBondContact N-OE2 3Å; M522-E525 WeakPolarHBondContact O-CB 3.45Å; M522-E525 PolarHBondContact O-N 2.82Å; M522-E526 WeakPolarHBondContact O-CG 3.43Å; M522-E526 PolarHBondContact O-N 3.39Å
523	Y	86.6	Confident	87.4	Confident	139 Å²	139	51.1 Å²	51.1	55%	0.545	28%	0.276	S	S	.	.	H	α-helix	trans	-54.4	-32.9	-175.6	174.5	-98	0	0	0	114.7	G527 D589 K592	Y523-G527 PolarHBondContact O-N 3.02Å; Y523-D589 WeakPolarHBondContact CE2-OD2 3.47Å; Y523-D589 VanDerWaalsContact CZ-OD2 3.23Å; Y523-D589 PolarHBondContact OH-OD2 3.13Å; Y523-K592 VanDerWaalsContact O-CE 3.26Å; Y523-K592 WeakPolarHBondContact O-CE 3.35Å; Y523-K592 PolarHBondContact O-NZ 3.02Å; Y523-K592 VanDerWaalsContact O-NZ 3.11Å
524	E	87.3	Confident	87.5	Confident	135 Å²	135	48.4 Å²	48.4	63%	0.631	26%	0.259	S	S	*	.	H	α-helix	trans	-77	-44.3	176.9	-68.2	158.2	-157.6	0	0	111.3	I482 M522 E526 G527 A528	I482-E524 HydrophobicContact CD1-CB 4.13Å; M522-E524 PolarHBondContact O-N 2.98Å; M522-E524 VanDerWaalsContact O-N 3.07Å; E524-E526 VanDerWaalsContact C-N 3.33Å; E524-E526 PolarHBondContact O-N 3.43Å; E524-G527 WeakPolarHBondContact O-CA 3.25Å; E524-G527 PolarHBondContact O-N 3.44Å; E524-A528 PolarHBondContact O-N 3.37Å
525	E	91.3	Very high	87.7	Confident	48 Å²	48	47.8 Å²	47.8	22%	0.224	26%	0.256	C	S	.	.	H	α-helix	trans	-60.4	-39.8	175	-64.8	169.2	177.8	0	0	112	I478 I482 L521 M522 G527 A528 L529	I478-E525 HydrophobicContact CG2-CB 3.77Å; I478-E525 HydrophobicContact CG2-CG 3.75Å; I482-E525 HydrophobicContact CD1-CG 4.09Å; L521-E525 WeakPolarHBondContact CA-OE2 3.49Å; L521-E525 HydrophobicContact CB-CB 3.9Å; L521-E525 HydrophobicContact CD1-CB 4.49Å; L521-E525 HydrophobicContact CD2-CB 4.28Å; L521-E525 HydrophobicContact CG-CB 4.45Å; M522-E525 HydrophobicContact CB-CB 4.35Å; M522-E525 HydrophobicContact CB-CG 3.99Å; M522-E525 PolarHBondContact N-OE2 3Å; M522-E525 WeakPolarHBondContact O-CB 3.45Å; M522-E525 PolarHBondContact O-N 2.82Å; E525-G527 VanDerWaalsContact C-N 3.32Å; E525-G527 PolarHBondContact O-N 3.2Å; E525-A528 PolarHBondContact O-N 3.14Å; E525-L529 WeakPolarHBondContact O-CB 3.48Å; E525-L529 PolarHBondContact O-N 3.33Å
526	E	92.6	Very high	87.9	Confident	22 Å²	22	47.8 Å²	47.8	10%	0.103	26%	0.256	C	S	.	.	H	α-helix	trans	-60.7	-40.1	172	-68.2	-169.3	119.1	0	0	112.1	L515 L521 M522 E524 L530 K585 Y586	L515-E526 HydrophobicContact CD2-CB 4.33Å; L521-E526 HydrophobicContact CB-CG 3.76Å; M522-E526 WeakPolarHBondContact O-CG 3.43Å; M522-E526 PolarHBondContact O-N 3.39Å; E524-E526 VanDerWaalsContact C-N 3.33Å; E524-E526 PolarHBondContact O-N 3.43Å; E526-L530 WeakPolarHBondContact O-CB 3.45Å; E526-L530 WeakPolarHBondContact O-CD1 3.34Å; E526-L530 WeakPolarHBondContact O-CG 3.36Å; E526-L530 PolarHBondContact O-N 3.39Å; E526-K585 WeakPolarHBondContact OE1-CE 3.5Å; E526-K585 IonicContact OE1-NZ 3.28Å; E526-K585 PolarHBondContact OE1-NZ 3.34Å; E526-Y586 HydrophobicContact CB-CE1 4.34Å; E526-Y586 VanDerWaalsContact CD-OH 3.29Å; E526-Y586 WeakPolarHBondContact OE1-CE1 3.32Å; E526-Y586 PolarHBondContact OE1-OH 2.69Å; E526-Y586 WeakPolarHBondContact OE2-CE1 3.45Å
527	G	92.1	Very high	88.1	Confident	18 Å²	18	44.8 Å²	44.8	19%	0.186	24%	0.241	C	C	.	.	H	α-helix	trans	-66.6	-48.7	177.3	0	0	0	0	0	112	Y523 E524 E525 L530 E531	Y523-G527 PolarHBondContact O-N 3.02Å; E524-G527 WeakPolarHBondContact O-CA 3.25Å; E524-G527 PolarHBondContact O-N 3.44Å; E525-G527 VanDerWaalsContact C-N 3.32Å; E525-G527 PolarHBondContact O-N 3.2Å; G527-L530 PolarHBondContact O-N 2.82Å; G527-E531 PolarHBondContact O-N 3.2Å
528	A	92.9	Very high	88.5	Confident	5 Å²	5	42.2 Å²	42.2	4%	0.041	23%	0.227	C	C	.	.	H	α-helix	trans	-58.4	-47.8	176.3	0	0	0	0	0	112.3	I478 Y481 I482 E524 E525 L530 E531 I532	I478-A528 HydrophobicContact CG2-CB 4Å; Y481-A528 HydrophobicContact CD1-CB 3.54Å; Y481-A528 HydrophobicContact CE1-CB 3.97Å; I482-A528 HydrophobicContact CD1-CB 4.11Å; I482-A528 HydrophobicContact CG1-CB 4.03Å; E524-A528 PolarHBondContact O-N 3.37Å; E525-A528 PolarHBondContact O-N 3.14Å; A528-L530 PolarHBondContact O-N 3.36Å; A528-E531 PolarHBondContact O-N 3.41Å; A528-I532 WeakPolarHBondContact O-CB 3Å; A528-I532 VanDerWaalsContact O-CG1 3.28Å; A528-I532 WeakPolarHBondContact O-CG1 3.45Å; A528-I532 PolarHBondContact O-N 3.49Å
529	L	94.9	Very high	89.9	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-65.8	-38.1	178.8	-176.9	54.3	0	0	0	112.2	F474 I478 M511 L514 L515 L521 E525 M533	F474-L529 HydrophobicContact CD1-CD1 4.28Å; F474-L529 HydrophobicContact CG-CD1 4.48Å; I478-L529 HydrophobicContact CD1-CB 3.82Å; I478-L529 HydrophobicContact CD1-CD1 4.24Å; I478-L529 HydrophobicContact CD1-CD2 4.19Å; I478-L529 HydrophobicContact CD1-CG 4.3Å; I478-L529 HydrophobicContact CG1-CB 4.24Å; M511-L529 HydrophobicContact CB-CD1 4.29Å; M511-L529 HydrophobicContact CG-CD1 4.11Å; L514-L529 HydrophobicContact CB-CD2 3.81Å; L514-L529 HydrophobicContact CD1-CD2 4.15Å; L515-L529 HydrophobicContact CD1-CD2 4.48Å; L515-L529 HydrophobicContact CD1-CG 4.32Å; L515-L529 HydrophobicContact CD2-CB 4.23Å; L515-L529 HydrophobicContact CD2-CD2 4.08Å; L515-L529 HydrophobicContact CD2-CG 4.23Å; L515-L529 HydrophobicContact CG-CD2 3.86Å; L515-L529 HydrophobicContact CG-CG 4.15Å; L521-L529 HydrophobicContact CD1-CB 4.37Å; L521-L529 HydrophobicContact CD1-CD2 3.58Å; E525-L529 WeakPolarHBondContact O-CB 3.48Å; E525-L529 PolarHBondContact O-N 3.33Å; L529-M533 WeakPolarHBondContact O-CB 3.28Å; L529-M533 PolarHBondContact O-N 3.46Å
530	L	95	Very high	91.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.3	-46.2	173.5	-79.3	169.9	0	0	0	112.1	L515 E526 G527 A528 M533 I534 Y586 K592 L596	L515-L530 HydrophobicContact CD1-CD2 3.62Å; L515-L530 HydrophobicContact CD1-CG 4.04Å; L515-L530 HydrophobicContact CD2-CD2 4.34Å; L515-L530 HydrophobicContact CD2-CG 3.94Å; E526-L530 WeakPolarHBondContact O-CB 3.45Å; E526-L530 WeakPolarHBondContact O-CD1 3.34Å; E526-L530 WeakPolarHBondContact O-CG 3.36Å; E526-L530 PolarHBondContact O-N 3.39Å; G527-L530 PolarHBondContact O-N 2.82Å; A528-L530 PolarHBondContact O-N 3.36Å; L530-M533 HydrophobicContact CD2-CE 3.74Å; L530-M533 PolarHBondContact O-N 2.9Å; L530-I534 WeakPolarHBondContact O-CB 3.25Å; L530-I534 VanDerWaalsContact O-CG1 3.23Å; L530-I534 WeakPolarHBondContact O-CG1 3.44Å; L530-I534 PolarHBondContact O-N 3Å; L530-Y586 HydrophobicContact CD1-CD2 4.2Å; L530-Y586 HydrophobicContact CD1-CE2 4.12Å; L530-Y586 HydrophobicContact CD1-CG 4.47Å; L530-K592 HydrophobicContact CD1-CB 3.67Å; L530-K592 HydrophobicContact CD1-CD 3.76Å; L530-K592 HydrophobicContact CD1-CG 3.64Å; L530-L596 HydrophobicContact CD2-CD1 4.25Å; L530-L596 HydrophobicContact CD2-CD2 3.64Å; L530-L596 HydrophobicContact CD2-CG 3.95Å
531	E	94.9	Very high	92.7	Very high	16 Å²	16	27.7 Å²	27.7	8%	0.075	13%	0.134	C	C	.	.	H	α-helix	trans	-67	-43.6	178.9	170.7	50.6	-158.8	0	0	112.1	G490 G527 A528 M533 I534 C535 L595	G490-E531 VanDerWaalsContact N-CG 3.28Å; G490-E531 PolarHBondContact N-OE1 3.02Å; G527-E531 PolarHBondContact O-N 3.2Å; A528-E531 PolarHBondContact O-N 3.41Å; E531-M533 VanDerWaalsContact C-N 3.34Å; E531-M533 PolarHBondContact O-N 3.16Å; E531-I534 PolarHBondContact O-N 3Å; E531-C535 VanDerWaalsContact O-CB 3.31Å; E531-C535 WeakPolarHBondContact O-CB 3.39Å; E531-C535 PolarHBondContact O-N 3.49Å; E531-C535 PolarHBondContact OE1-SG 3.04Å; E531-L595 HydrophobicContact CB-CD1 3.87Å; E531-L595 WeakPolarHBondContact OE2-CD2 3.47Å
532	I	95.2	Very high	93.1	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-57.8	-46.8	173.1	-69.8	166.2	0	0	0	110.5	L477 Y481 V494 L505 A528 C535 A536	L477-I532 HydrophobicContact CD2-CD1 4.47Å; L477-I532 HydrophobicContact CD2-CG2 4.49Å; L477-I532 HydrophobicContact CG-CD1 4.29Å; Y481-I532 HydrophobicContact CG-CD1 4.46Å; V494-I532 HydrophobicContact CG2-CG2 4.2Å; L505-I532 HydrophobicContact CD2-CG2 4.25Å; A528-I532 WeakPolarHBondContact O-CB 3Å; A528-I532 VanDerWaalsContact O-CG1 3.28Å; A528-I532 WeakPolarHBondContact O-CG1 3.45Å; A528-I532 PolarHBondContact O-N 3.49Å; I532-C535 PolarHBondContact O-N 2.88Å; I532-A536 WeakPolarHBondContact O-CB 3.44Å; I532-A536 PolarHBondContact O-N 3.09Å
533	M	96.3	Very high	93.2	Very high	1 Å²	1	26 Å²	26	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-62.5	-49.7	178.9	178.5	179.3	77	0	0	112.1	M511 T512 L515 L529 L530 E531 C535 A536 I537 F575 L582 L596	M511-M533 HydrophobicContact CB-CG 4.4Å; M511-M533 HydrophobicContact CB-SD 4.06Å; M511-M533 HydrophobicContact SD-CB 3.64Å; M511-M533 HydrophobicContact SD-CG 3.6Å; M511-M533 VanDerWaalsContact SD-CG 3.6Å; M511-M533 HydrophobicContact SD-SD 4.43Å; T512-M533 HydrophobicContact CG2-SD 3.8Å; L515-M533 HydrophobicContact CD1-CE 3.89Å; L515-M533 HydrophobicContact CD1-SD 3.98Å; L529-M533 WeakPolarHBondContact O-CB 3.28Å; L529-M533 PolarHBondContact O-N 3.46Å; L530-M533 HydrophobicContact CD2-CE 3.74Å; L530-M533 PolarHBondContact O-N 2.9Å; E531-M533 VanDerWaalsContact C-N 3.34Å; E531-M533 PolarHBondContact O-N 3.16Å; M533-C535 VanDerWaalsContact C-N 3.33Å; M533-C535 PolarHBondContact O-N 2.87Å; M533-A536 PolarHBondContact O-N 2.89Å; M533-I537 HydrophobicContact CG-CD1 3.79Å; M533-I537 WeakPolarHBondContact O-CB 3.43Å; M533-I537 WeakPolarHBondContact O-CD1 3.49Å; M533-I537 VanDerWaalsContact O-CG1 3.23Å; M533-I537 WeakPolarHBondContact O-CG1 3.39Å; M533-I537 PolarHBondContact O-N 3.31Å; M533-F575 HydrophobicContact CE-CE1 3.99Å; M533-F575 HydrophobicContact CE-CZ 4.37Å; M533-F575 HydrophobicContact CG-CZ 4.06Å; M533-F575 HydrophobicContact SD-CE1 3.71Å; M533-F575 HydrophobicContact SD-CZ 3.63Å; M533-L582 HydrophobicContact CE-CD1 4.4Å; M533-L596 HydrophobicContact CE-CD2 4.41Å
534	I	95.8	Very high	93.2	Very high	2 Å²	2	22.4 Å²	22.4	1%	0.01	12%	0.121	C	C	.	.	H	α-helix	trans	-66	-36.4	-179	-66.6	-68.4	0	0	0	111.2	L530 E531 I537 R538 L595 A599	L530-I534 WeakPolarHBondContact O-CB 3.25Å; L530-I534 VanDerWaalsContact O-CG1 3.23Å; L530-I534 WeakPolarHBondContact O-CG1 3.44Å; L530-I534 PolarHBondContact O-N 3Å; E531-I534 PolarHBondContact O-N 3Å; I534-I537 HydrophobicContact CD1-CD1 4.29Å; I534-R538 PolarHBondContact O-N 3.02Å; I534-L595 HydrophobicContact CG1-CB 4.25Å; I534-A599 HydrophobicContact CD1-CB 3.74Å
535	C	95.4	Very high	93.2	Very high	2 Å²	2	17.8 Å²	17.8	1%	0.014	10%	0.103	C	C	.	.	H	α-helix	trans	-68.6	-37.9	172.9	-86.9	0	0	0	0	113.4	A491 V494 E531 I532 M533 R538 Q539	A491-C535 WeakPolarHBondContact CA-SG 3.26Å; A491-C535 VanDerWaalsContact CB-SG 3.55Å; A491-C535 PolarHBondContact N-SG 3.25Å; V494-C535 HydrophobicContact CB-CB 4.34Å; V494-C535 HydrophobicContact CG2-CB 4.02Å; E531-C535 VanDerWaalsContact O-CB 3.31Å; E531-C535 WeakPolarHBondContact O-CB 3.39Å; E531-C535 PolarHBondContact O-N 3.49Å; E531-C535 PolarHBondContact OE1-SG 3.04Å; I532-C535 PolarHBondContact O-N 2.88Å; M533-C535 VanDerWaalsContact C-N 3.33Å; M533-C535 PolarHBondContact O-N 2.87Å; C535-R538 PolarHBondContact O-N 2.92Å; C535-R538 PolarHBondContact SG-NH1 2.83Å; C535-Q539 WeakPolarHBondContact O-CB 3.37Å; C535-Q539 PolarHBondContact O-N 3.45Å
536	A	95.8	Very high	93.2	Very high	0 Å²	0	16 Å²	16	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-66.2	-41.5	174.1	0	0	0	0	0	112.3	V494 W498 L505 M511 I532 M533 Q539 A540	V494-A536 HydrophobicContact CG1-CB 4.15Å; W498-A536 WeakPolarHBondContact CH2-O 3.35Å; W498-A536 HydrophobicContact CZ3-CB 4.17Å; L505-A536 WeakPolarHBondContact O-CB 3.37Å; M511-A536 HydrophobicContact CE-CB 4.41Å; I532-A536 WeakPolarHBondContact O-CB 3.44Å; I532-A536 PolarHBondContact O-N 3.09Å; M533-A536 PolarHBondContact O-N 2.89Å; A536-Q539 PolarHBondContact O-N 3.07Å; A536-A540 WeakPolarHBondContact O-CB 3.42Å; A536-A540 PolarHBondContact O-N 3.39Å
537	I	95.9	Very high	92.9	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-59.1	-49.3	173.1	-70.5	163.2	0	0	0	110.6	M533 I534 Q539 A540 A541 I571 F575 Y602	M533-I537 HydrophobicContact CG-CD1 3.79Å; M533-I537 WeakPolarHBondContact O-CB 3.43Å; M533-I537 WeakPolarHBondContact O-CD1 3.49Å; M533-I537 VanDerWaalsContact O-CG1 3.23Å; M533-I537 WeakPolarHBondContact O-CG1 3.39Å; M533-I537 PolarHBondContact O-N 3.31Å; I534-I537 HydrophobicContact CD1-CD1 4.29Å; I537-Q539 PolarHBondContact O-N 3.13Å; I537-A540 PolarHBondContact O-N 2.94Å; I537-A541 WeakPolarHBondContact O-CB 3.32Å; I537-A541 PolarHBondContact O-N 2.82Å; I537-I571 HydrophobicContact CG2-CD1 4.23Å; I537-I571 HydrophobicContact CG2-CG2 3.89Å; I537-F575 HydrophobicContact CD1-CD2 4.08Å; I537-F575 HydrophobicContact CD1-CE1 4.13Å; I537-F575 HydrophobicContact CD1-CE2 3.4Å; I537-F575 VanDerWaalsContact CD1-CE2 3.4Å; I537-F575 HydrophobicContact CD1-CZ 3.45Å; I537-F575 VanDerWaalsContact CD1-CZ 3.45Å; I537-F575 HydrophobicContact CG1-CE2 3.9Å; I537-F575 HydrophobicContact CG1-CZ 4.31Å; I537-Y602 HydrophobicContact CG2-CD2 3.63Å; I537-Y602 HydrophobicContact CG2-CG 4.11Å
538	R	94.8	Very high	92.5	Very high	27 Å²	27	18.5 Å²	18.5	10%	0.102	12%	0.123	C	C	.	.	H	α-helix	trans	-56.1	-51.2	176.2	-175.1	-172.2	77	-116.3	-9	110.9	I534 C535 A540 A541 E542 Y602	I534-R538 PolarHBondContact O-N 3.02Å; C535-R538 PolarHBondContact O-N 2.92Å; C535-R538 PolarHBondContact SG-NH1 2.83Å; R538-A540 VanDerWaalsContact C-N 3.33Å; R538-A540 PolarHBondContact O-N 3.41Å; R538-A541 PolarHBondContact O-N 2.89Å; R538-E542 VanDerWaalsContact CG-CD 3.43Å; R538-E542 HydrophobicContact CG-CG 4.04Å; R538-E542 VanDerWaalsContact CG-OE2 3.26Å; R538-E542 WeakPolarHBondContact CG-OE2 3.44Å; R538-E542 IonicContact NE-OE2 3.59Å; R538-E542 WeakPolarHBondContact O-CB 3.11Å; R538-E542 WeakPolarHBondContact O-CG 3.37Å; R538-E542 PolarHBondContact O-N 3.48Å; R538-Y602 HydrophobicContact CB-CE1 3.96Å; R538-Y602 HydrophobicContact CB-CE2 4.03Å; R538-Y602 HydrophobicContact CG-CD1 4.42Å; R538-Y602 HydrophobicContact CG-CE1 3.62Å
539	Q	93.5	Very high	92.3	Very high	5 Å²	5	18.5 Å²	18.5	2%	0.023	12%	0.122	C	C	.	.	H	α-helix	trans	-69.3	-29.5	-174.5	-172	152.7	-19.4	0	0	113.2	D495 W498 C535 A536 I537 A543	D495-Q539 PolarHBondContact OD1-NE2 3Å; W498-Q539 HydrophobicContact CD2-CB 4.5Å; W498-Q539 HydrophobicContact CD2-CG 3.82Å; W498-Q539 HydrophobicContact CE3-CB 4.36Å; W498-Q539 HydrophobicContact CE3-CG 4.15Å; W498-Q539 HydrophobicContact CG-CG 4.29Å; W498-Q539 HydrophobicContact CH2-CB 4.11Å; W498-Q539 HydrophobicContact CH2-CG 4.3Å; W498-Q539 HydrophobicContact CZ2-CB 4.23Å; W498-Q539 HydrophobicContact CZ2-CG 3.96Å; W498-Q539 HydrophobicContact CZ3-CB 4.18Å; W498-Q539 HydrophobicContact CZ3-CG 4.38Å; C535-Q539 WeakPolarHBondContact O-CB 3.37Å; C535-Q539 PolarHBondContact O-N 3.45Å; A536-Q539 PolarHBondContact O-N 3.07Å; I537-Q539 PolarHBondContact O-N 3.13Å; Q539-A543 VanDerWaalsContact O-CA 3.3Å; Q539-A543 WeakPolarHBondContact O-CA 3.24Å; Q539-A543 PolarHBondContact O-N 2.71Å; Q539-A543 VanDerWaalsContact O-N 3.15Å
540	A	93.9	Very high	91.5	Very high	3 Å²	3	21.6 Å²	21.6	3%	0.025	14%	0.143	C	C	.	.	H	α-helix	trans	-67.7	-49.8	168.6	0	0	0	0	0	112.6	W498 W508 A536 I537 R538 D567 I571	W498-A540 HydrophobicContact CH2-CB 3.91Å; W498-A540 HydrophobicContact CZ2-CB 4.18Å; W508-A540 HydrophobicContact CZ2-CB 4.2Å; A536-A540 WeakPolarHBondContact O-CB 3.42Å; A536-A540 PolarHBondContact O-N 3.39Å; I537-A540 PolarHBondContact O-N 2.94Å; R538-A540 VanDerWaalsContact C-N 3.33Å; R538-A540 PolarHBondContact O-N 3.41Å; A540-D567 HydrophobicContact CB-CB 4.14Å; A540-I571 HydrophobicContact CB-CD1 3.79Å
541	A	92.8	Very high	89.9	Confident	11 Å²	11	27.9 Å²	27.9	9%	0.091	17%	0.173	C	C	.	.	H	α-helix	trans	-74.4	-37.3	-173.7	0	0	0	0	0	113.6	I537 R538 Q564 I571 Y602	I537-A541 WeakPolarHBondContact O-CB 3.32Å; I537-A541 PolarHBondContact O-N 2.82Å; R538-A541 PolarHBondContact O-N 2.89Å; A541-Q564 VanDerWaalsContact O-CG 3.3Å; A541-Q564 WeakPolarHBondContact O-CG 3.49Å; A541-Q564 PolarHBondContact O-NE2 2.86Å; A541-I571 HydrophobicContact CB-CD1 4.4Å; A541-Y602 HydrophobicContact CB-CG 4.41Å
542	E	90.4	Very high	88.2	Confident	81 Å²	81	29.9 Å²	29.9	38%	0.379	20%	0.197	S	C	.	.	H	α-helix	trans	-85.2	-26.3	178	-60.8	-175.8	155.8	0	0	112.8	R538 T544 Q564	R538-E542 VanDerWaalsContact CG-CD 3.43Å; R538-E542 HydrophobicContact CG-CG 4.04Å; R538-E542 VanDerWaalsContact CG-OE2 3.26Å; R538-E542 WeakPolarHBondContact CG-OE2 3.44Å; R538-E542 IonicContact NE-OE2 3.59Å; R538-E542 WeakPolarHBondContact O-CB 3.11Å; R538-E542 WeakPolarHBondContact O-CG 3.37Å; R538-E542 PolarHBondContact O-N 3.48Å; E542-T544 WeakPolarHBondContact CB-OG1 3.36Å; E542-T544 PolarHBondContact O-N 2.98Å; E542-Q564 VanDerWaalsContact C-NE2 3.29Å; E542-Q564 PolarHBondContact O-NE2 3.24Å; E542-Q564 VanDerWaalsContact O-NE2 3.08Å
543	A	88.9	Confident	86.5	Confident	31 Å²	31	36 Å²	36	26%	0.256	22%	0.224	S	C	.	.			trans	54.1	27.2	-171.9	0	0	0	0	0	114.4	Q539 L556 Q564	Q539-A543 VanDerWaalsContact O-CA 3.3Å; Q539-A543 WeakPolarHBondContact O-CA 3.24Å; Q539-A543 PolarHBondContact O-N 2.71Å; Q539-A543 VanDerWaalsContact O-N 3.15Å; A543-L556 HydrophobicContact CB-CD1 3.85Å; A543-L556 HydrophobicContact CB-CD2 4.3Å; A543-Q564 HydrophobicContact CB-CB 3.97Å; A543-Q564 HydrophobicContact CB-CG 3.88Å
544	T	86.8	Confident	85	Confident	62 Å²	62	42.8 Å²	42.8	38%	0.38	25%	0.253	S	S	.	.			trans	-120.5	139	177.5	42.7	0	0	0	0	112.1	E542	E542-T544 WeakPolarHBondContact CB-OG1 3.36Å; E542-T544 PolarHBondContact O-N 2.98Å
545	P	88.6	Confident	83.8	Confident	39 Å²	39	48.7 Å²	48.7	25%	0.253	29%	0.289	S	S	.	.			trans	-59.4	160.4	167.8	-23.6	34.9	0	0	0	112.3	R549	P545-R549 HydrophobicContact CB-CB 4.07Å
546	P	90.3	Very high	83	Confident	11 Å²	11	50.8 Å²	50.8	7%	0.071	30%	0.3	C	S	.	.			trans	-60.2	176	174.6	27.4	-37	0	0	0	113.5	Y492 D495 R549	Y492-P546 HydrophobicContact CD1-CB 4.15Å; Y492-P546 HydrophobicContact CD1-CG 3.57Å; Y492-P546 HydrophobicContact CE1-CB 3.92Å; Y492-P546 HydrophobicContact CE1-CG 3.73Å; D495-P546 HydrophobicContact CB-CG 3.93Å; D495-P546 VanDerWaalsContact CG-CD 3.47Å; P546-R549 HydrophobicContact CG-CB 4.38Å; P546-R549 PolarHBondContact O-N 3.45Å
547	A	86.9	Confident	82.4	Confident	47 Å²	47	54.2 Å²	54.2	39%	0.388	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	151.1	170.5	0	0	0	0	0	112.1	Y492 R549 T1099	Y492-A547 WeakPolarHBondContact CE1-O 3.43Å; Y492-A547 PolarHBondContact OH-O 2.96Å; A547-R549 PolarHBondContact O-N 3.02Å; A547-T1099 HydrophobicContact CB-CG2 3.63Å
548	G	84.3	Confident	81.9	Confident	44 Å²	44	62.3 Å²	62.3	45%	0.454	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	-40.1	-176.3	0	0	0	0	0	115.3
549	R	87.5	Confident	81.6	Confident	6 Å²	6	68.6 Å²	68.6	2%	0.023	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-9.6	-173.7	-70.1	-167.5	178.8	173.4	5.7	115.6	V434 Y435 A436 R439 A442 Y492 D495 S496 P545 P546 A547 Q551	V434-R549 PolarHBondContact O-NH2 3.43Å; Y435-R549 VanDerWaalsContact C-NH2 3.26Å; Y435-R549 PolarHBondContact O-NH2 2.96Å; A436-R549 PolarHBondContact O-NE 3.21Å; A436-R549 PolarHBondContact O-NH2 2.74Å; R439-R549 HydrophobicContact CB-CB 3.98Å; R439-R549 HydrophobicContact CB-CG 4.09Å; R439-R549 HydrophobicContact CG-CB 4.23Å; R439-R549 HydrophobicContact CG-CG 4.49Å; A442-R549 VanDerWaalsContact CB-CZ 3.43Å; A442-R549 VanDerWaalsContact CB-NH2 3.27Å; Y492-R549 HydrophobicContact CD1-CG 4.39Å; Y492-R549 HydrophobicContact CE1-CG 4.29Å; Y492-R549 PolarHBondContact O-NH1 3.1Å; D495-R549 WeakPolarHBondContact OD2-CD 3.3Å; D495-R549 IonicContact OD2-CZ 3.93Å; D495-R549 IonicContact OD2-NE 3.91Å; D495-R549 IonicContact OD2-NH1 3.4Å; D495-R549 PolarHBondContact OD2-NH1 2.59Å; D495-R549 VanDerWaalsContact OD2-NH1 3.09Å; S496-R549 PolarHBondContact OG-NH1 2.91Å; S496-R549 PolarHBondContact OG-NH2 3.29Å; P545-R549 HydrophobicContact CB-CB 4.07Å; P546-R549 HydrophobicContact CG-CB 4.38Å; P546-R549 PolarHBondContact O-N 3.45Å; A547-R549 PolarHBondContact O-N 3.02Å; R549-Q551 PolarHBondContact O-N 3.04Å
550	S	78.2	Confident	81.2	Confident	65 Å²	65	72.6 Å²	72.6	46%	0.455	41%	0.413	S	S	.	.			trans	-79.9	110.1	179.2	43.4	0	0	0	0	112.4	G552	S550-G552 PolarHBondContact O-N 3.13Å
551	Q	62.4	Low	80.9	Confident	132 Å²	132	77.3 Å²	77.3	62%	0.617	43%	0.433	S	S	*	.			trans	-72.2	62.9	174.3	-70.4	-172.7	-10.4	0	0	112.9	R549 K554	R549-Q551 PolarHBondContact O-N 3.04Å; Q551-K554 WeakPolarHBondContact O-CE 3.35Å
552	G	59.6	Low	80.8	Confident	57 Å²	57	83.6 Å²	83.6	59%	0.588	46%	0.458	S	S	*	.	S	Bend	trans	70.8	179.3	179.1	0	0	0	0	0	114.6	S550 K554	S550-G552 PolarHBondContact O-N 3.13Å; G552-K554 PolarHBondContact O-N 3.07Å
553	K	58.9	Low	80.8	Confident	130 Å²	130	82.6 Å²	82.6	57%	0.565	46%	0.455	S	S	*	.			trans	-76.6	63	179.3	-69.3	-176	173.4	179	0	111.8	V555 K1102 H1103	K553-V555 PolarHBondContact O-N 3.17Å; K553-K1102 PolarHBondContact NZ-O 3.29Å; K553-H1103 PolarHBondContact NZ-NE2 3.04Å
554	K	64	Low	80.9	Confident	144 Å²	144	83.3 Å²	83.3	63%	0.626	45%	0.453	S	S	*	.	P	Polyproline II helix	trans	-64.9	128.4	170.3	-71	177.8	-178.3	177.7	0	109.2	Q551 G552 L556	Q551-K554 WeakPolarHBondContact O-CE 3.35Å; G552-K554 PolarHBondContact O-N 3.07Å; K554-L556 PolarHBondContact O-N 2.68Å
555	V	71.6	Confident	81.2	Confident	125 Å²	125	86.2 Å²	86.2	76%	0.758	46%	0.462	S	S	*	.	P	Polyproline II helix	trans	-74.3	124.2	177.4	179.1	0	0	0	0	109	K553 S557	K553-V555 PolarHBondContact O-N 3.17Å; V555-S557 PolarHBondContact O-N 3.01Å
556	L	77.2	Confident	81.4	Confident	46 Å²	46	88.7 Å²	88.7	24%	0.241	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-57.2	131.2	178.5	-67	172.4	0	0	0	111.6	A543 K554 L560 K561	A543-L556 HydrophobicContact CB-CD1 3.85Å; A543-L556 HydrophobicContact CB-CD2 4.3Å; K554-L556 PolarHBondContact O-N 2.68Å; L556-L560 HydrophobicContact CD2-CB 4.4Å; L556-L560 HydrophobicContact CD2-CD1 4.27Å; L556-K561 HydrophobicContact CB-CG 3.74Å; L556-K561 VanDerWaalsContact O-CE 3.28Å; L556-K561 WeakPolarHBondContact O-CE 3.16Å
557	S	84.6	Confident	81.5	Confident	72 Å²	72	88.4 Å²	88.4	50%	0.503	47%	0.468	S	S	.	.	P	Polyproline II helix	trans	-60.4	149.9	172.1	175.7	0	0	0	0	111	V555 K559 L560 K561	V555-S557 PolarHBondContact O-N 3.01Å; S557-K559 PolarHBondContact O-N 3.26Å; S557-K559 VanDerWaalsContact O-N 3.14Å; S557-L560 PolarHBondContact O-N 2.71Å; S557-K561 PolarHBondContact O-N 3.42Å
558	M	85.2	Confident	81.8	Confident	170 Å²	170	89.7 Å²	89.7	84%	0.837	46%	0.463	S	S	*	.	H	α-helix	trans	-55.3	-34.3	179.6	-60.2	-168.6	-62.1	0	0	112.7	K562	M558-K562 PolarHBondContact O-N 2.86Å; M558-K562 VanDerWaalsContact O-N 3.13Å
559	K	87.9	Confident	82.2	Confident	160 Å²	160	90.2 Å²	90.2	70%	0.696	46%	0.457	S	S	*	.	H	α-helix	trans	-63.4	-44.2	174.3	-175.1	-178.5	176.9	-174.2	0	111.8	S557 K562 I563	S557-K559 PolarHBondContact O-N 3.26Å; S557-K559 VanDerWaalsContact O-N 3.14Å; K559-K562 PolarHBondContact O-N 2.93Å; K559-I563 HydrophobicContact CG-CD1 4.18Å; K559-I563 WeakPolarHBondContact O-CG1 3.49Å; K559-I563 PolarHBondContact O-N 3.37Å
560	L	84.7	Confident	82.5	Confident	89 Å²	89	96 Å²	96	47%	0.466	48%	0.479	S	S	.	.	H	α-helix	trans	-69.3	-40.6	179.9	-67.2	174.7	0	0	0	111.5	L556 S557 K562 I563 Q564	L556-L560 HydrophobicContact CD2-CB 4.4Å; L556-L560 HydrophobicContact CD2-CD1 4.27Å; S557-L560 PolarHBondContact O-N 2.71Å; L560-K562 VanDerWaalsContact C-N 3.33Å; L560-K562 PolarHBondContact O-N 2.95Å; L560-I563 PolarHBondContact O-N 3.45Å; L560-I563 VanDerWaalsContact O-N 3.17Å; L560-Q564 WeakPolarHBondContact O-CB 3.37Å; L560-Q564 PolarHBondContact O-N 3.36Å
561	K	89.1	Confident	83.3	Confident	102 Å²	102	92.9 Å²	92.9	44%	0.443	46%	0.457	S	S	.	.	H	α-helix	trans	-59.3	-42.1	174.7	-68.6	-171.9	179.8	-174.7	0	112.7	L556 S557 I563 Q564 E565	L556-K561 HydrophobicContact CB-CG 3.74Å; L556-K561 VanDerWaalsContact O-CE 3.28Å; L556-K561 WeakPolarHBondContact O-CE 3.16Å; S557-K561 PolarHBondContact O-N 3.42Å; K561-I563 VanDerWaalsContact C-N 3.33Å; K561-I563 PolarHBondContact O-N 3.26Å; K561-Q564 WeakPolarHBondContact O-CB 3.35Å; K561-Q564 PolarHBondContact O-N 2.97Å; K561-E565 WeakPolarHBondContact O-CB 2.97Å; K561-E565 PolarHBondContact O-N 3.4Å
562	K	90.8	Very high	84.8	Confident	143 Å²	143	86.6 Å²	86.6	62%	0.622	43%	0.428	S	S	*	.	H	α-helix	trans	-65.4	-36.2	176.5	-174.5	173.2	179.7	179.6	0	112.3	M558 K559 L560 Q566	M558-K562 PolarHBondContact O-N 2.86Å; M558-K562 VanDerWaalsContact O-N 3.13Å; K559-K562 PolarHBondContact O-N 2.93Å; L560-K562 VanDerWaalsContact C-N 3.33Å; L560-K562 PolarHBondContact O-N 2.95Å; K562-Q566 VanDerWaalsContact O-CB 3.24Å; K562-Q566 WeakPolarHBondContact O-CB 3.39Å; K562-Q566 PolarHBondContact O-N 3.39Å
563	I	88.9	Confident	86.4	Confident	60 Å²	60	86.6 Å²	86.6	31%	0.308	42%	0.416	S	S	.	.	H	α-helix	trans	-67.8	-46.4	175	-66.7	164	0	0	0	110.2	K559 L560 K561 E565 Q566 D567	K559-I563 HydrophobicContact CG-CD1 4.18Å; K559-I563 WeakPolarHBondContact O-CG1 3.49Å; K559-I563 PolarHBondContact O-N 3.37Å; L560-I563 PolarHBondContact O-N 3.45Å; L560-I563 VanDerWaalsContact O-N 3.17Å; K561-I563 VanDerWaalsContact C-N 3.33Å; K561-I563 PolarHBondContact O-N 3.26Å; I563-E565 PolarHBondContact O-N 2.92Å; I563-Q566 PolarHBondContact O-N 3.33Å; I563-D567 WeakPolarHBondContact O-CB 3.28Å; I563-D567 PolarHBondContact O-N 2.93Å
564	Q	92.6	Very high	88.1	Confident	45 Å²	45	82 Å²	82	21%	0.21	40%	0.397	C	S	.	.	H	α-helix	trans	-55.4	-47.8	174.9	178.8	-176.7	15.6	0	0	112.2	A541 E542 A543 L560 K561 D567 R568	A541-Q564 VanDerWaalsContact O-CG 3.3Å; A541-Q564 WeakPolarHBondContact O-CG 3.49Å; A541-Q564 PolarHBondContact O-NE2 2.86Å; E542-Q564 VanDerWaalsContact C-NE2 3.29Å; E542-Q564 PolarHBondContact O-NE2 3.24Å; E542-Q564 VanDerWaalsContact O-NE2 3.08Å; A543-Q564 HydrophobicContact CB-CB 3.97Å; A543-Q564 HydrophobicContact CB-CG 3.88Å; L560-Q564 WeakPolarHBondContact O-CB 3.37Å; L560-Q564 PolarHBondContact O-N 3.36Å; K561-Q564 WeakPolarHBondContact O-CB 3.35Å; K561-Q564 PolarHBondContact O-N 2.97Å; Q564-D567 PolarHBondContact O-N 2.76Å; Q564-R568 VanDerWaalsContact O-CB 3.26Å; Q564-R568 WeakPolarHBondContact O-CB 3.44Å; Q564-R568 PolarHBondContact O-N 2.92Å
565	E	91.3	Very high	89.6	Confident	123 Å²	123	75.3 Å²	75.3	58%	0.575	37%	0.368	S	S	*	.	H	α-helix	trans	-63.3	-45.8	178.1	-172.4	172	-151.9	0	0	111.4	K561 I563 R568 T569	K561-E565 WeakPolarHBondContact O-CB 2.97Å; K561-E565 PolarHBondContact O-N 3.4Å; I563-E565 PolarHBondContact O-N 2.92Å; E565-R568 PolarHBondContact O-N 3.12Å; E565-T569 PolarHBondContact O-N 3.28Å; E565-T569 PolarHBondContact O-OG1 3.47Å; E565-T569 VanDerWaalsContact O-OG1 3.06Å
566	Q	92.6	Very high	90.6	Very high	91 Å²	91	69.3 Å²	69.3	43%	0.425	33%	0.332	S	S	.	.	H	α-helix	trans	-63.4	-43.2	176.1	177.6	176.6	-14.5	0	0	113.1	K562 I563 R570	K562-Q566 VanDerWaalsContact O-CB 3.24Å; K562-Q566 WeakPolarHBondContact O-CB 3.39Å; K562-Q566 PolarHBondContact O-N 3.39Å; I563-Q566 PolarHBondContact O-N 3.33Å; Q566-R570 VanDerWaalsContact O-CG 3.31Å; Q566-R570 WeakPolarHBondContact O-CG 3.25Å; Q566-R570 PolarHBondContact O-N 3.06Å; Q566-R570 VanDerWaalsContact O-N 3.11Å
567	D	92.8	Very high	91.4	Very high	5 Å²	5	68.5 Å²	68.5	3%	0.027	33%	0.329	C	S	.	.	H	α-helix	trans	-67.1	-42.8	177.1	-73.5	-19.1	0	0	0	110.1	R506 W508 A540 I563 Q564 T569 R570 I571	R506-D567 IonicContact CZ-OD2 3.63Å; R506-D567 VanDerWaalsContact CZ-OD2 3.24Å; R506-D567 IonicContact NE-OD1 3.69Å; R506-D567 PolarHBondContact NE-OD1 2.9Å; R506-D567 IonicContact NE-OD2 2.66Å; R506-D567 PolarHBondContact NE-OD2 3.15Å; R506-D567 IonicContact NH2-OD2 2.63Å; R506-D567 PolarHBondContact NH2-OD2 3.44Å; W508-D567 HydrophobicContact CH2-CB 4.38Å; A540-D567 HydrophobicContact CB-CB 4.14Å; I563-D567 WeakPolarHBondContact O-CB 3.28Å; I563-D567 PolarHBondContact O-N 2.93Å; Q564-D567 PolarHBondContact O-N 2.76Å; D567-T569 PolarHBondContact O-N 3Å; D567-R570 WeakPolarHBondContact O-CB 3.33Å; D567-R570 PolarHBondContact O-N 3.37Å; D567-R570 VanDerWaalsContact O-N 3.15Å; D567-R570 IonicContact OD1-NH1 2.79Å; D567-I571 VanDerWaalsContact O-CG1 3.28Å; D567-I571 WeakPolarHBondContact O-CG1 3.4Å; D567-I571 PolarHBondContact O-N 2.87Å
568	R	93.8	Very high	91.8	Very high	75 Å²	75	66 Å²	66	28%	0.283	31%	0.311	S	S	.	.	H	α-helix	trans	-58.6	-44	174.3	-170.2	177	74.2	124	2.3	112.5	Q564 E565 R570 T572 Y602 D604	Q564-R568 VanDerWaalsContact O-CB 3.26Å; Q564-R568 WeakPolarHBondContact O-CB 3.44Å; Q564-R568 PolarHBondContact O-N 2.92Å; E565-R568 PolarHBondContact O-N 3.12Å; R568-R570 VanDerWaalsContact C-N 3.35Å; R568-R570 PolarHBondContact O-N 2.8Å; R568-T572 WeakPolarHBondContact O-CB 3.43Å; R568-T572 PolarHBondContact O-N 3.19Å; R568-T572 PolarHBondContact O-OG1 3.46Å; R568-Y602 WeakPolarHBondContact CG-O 3.49Å; R568-D604 IonicContact CZ-OD1 2.67Å; R568-D604 IonicContact CZ-OD2 3.2Å; R568-D604 IonicContact NH1-OD1 2.83Å; R568-D604 PolarHBondContact NH1-OD1 2.86Å; R568-D604 IonicContact NH2-OD1 3.21Å; R568-D604 PolarHBondContact NH2-OD1 2.92Å; R568-D604 IonicContact NH2-OD2 3.83Å; R568-D604 PolarHBondContact NH2-OD2 3.46Å
569	T	92.9	Very high	92.2	Very high	54 Å²	54	58 Å²	58	33%	0.331	27%	0.271	S	S	.	.	H	α-helix	trans	-60.9	-44.5	174.7	-55.1	0	0	0	0	111.1	E565 D567 T572 T573 M607	E565-T569 PolarHBondContact O-N 3.28Å; E565-T569 PolarHBondContact O-OG1 3.47Å; E565-T569 VanDerWaalsContact O-OG1 3.06Å; D567-T569 PolarHBondContact O-N 3Å; T569-T572 PolarHBondContact O-N 2.93Å; T569-T573 PolarHBondContact O-N 3.23Å; T569-T573 PolarHBondContact O-OG1 2.63Å; T569-M607 HydrophobicContact CG2-SD 4.25Å
570	R	94.1	Very high	92.4	Very high	127 Å²	127	50.8 Å²	50.8	48%	0.479	24%	0.241	S	C	.	.	H	α-helix	trans	-62.7	-49	179.5	-72.6	165.3	156.9	-168.3	-13.7	112.5	W508 Q566 D567 R568 T572 T573 H574	W508-R570 HydrophobicContact CZ3-CB 3.76Å; Q566-R570 VanDerWaalsContact O-CG 3.31Å; Q566-R570 WeakPolarHBondContact O-CG 3.25Å; Q566-R570 PolarHBondContact O-N 3.06Å; Q566-R570 VanDerWaalsContact O-N 3.11Å; D567-R570 WeakPolarHBondContact O-CB 3.33Å; D567-R570 PolarHBondContact O-N 3.37Å; D567-R570 VanDerWaalsContact O-N 3.15Å; D567-R570 IonicContact OD1-NH1 2.79Å; R568-R570 VanDerWaalsContact C-N 3.35Å; R568-R570 PolarHBondContact O-N 2.8Å; R570-T572 VanDerWaalsContact C-N 3.26Å; R570-T572 PolarHBondContact O-N 3.1Å; R570-T573 WeakPolarHBondContact CA-OG1 3.27Å; R570-T573 PolarHBondContact O-N 2.92Å; R570-T573 PolarHBondContact O-OG1 3.31Å; R570-H574 WeakPolarHBondContact O-CB 3.39Å; R570-H574 PolarHBondContact O-N 3.1Å
571	I	95.2	Very high	92.8	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-49.7	-51.8	172.6	-70.1	162.8	0	0	0	109.3	W508 I537 A540 A541 D567 T573 H574 F575 F603	W508-I571 HydrophobicContact CD2-CG1 4.18Å; W508-I571 HydrophobicContact CE3-CG1 4.03Å; W508-I571 HydrophobicContact CH2-CD1 3.98Å; W508-I571 HydrophobicContact CH2-CG1 3.45Å; W508-I571 VanDerWaalsContact CH2-CG1 3.45Å; W508-I571 HydrophobicContact CZ2-CD1 3.88Å; W508-I571 HydrophobicContact CZ2-CG1 3.57Å; W508-I571 HydrophobicContact CZ3-CG1 3.68Å; I537-I571 HydrophobicContact CG2-CD1 4.23Å; I537-I571 HydrophobicContact CG2-CG2 3.89Å; A540-I571 HydrophobicContact CB-CD1 3.79Å; A541-I571 HydrophobicContact CB-CD1 4.4Å; D567-I571 VanDerWaalsContact O-CG1 3.28Å; D567-I571 WeakPolarHBondContact O-CG1 3.4Å; D567-I571 PolarHBondContact O-N 2.87Å; I571-T573 PolarHBondContact O-N 2.69Å; I571-H574 PolarHBondContact O-N 3.25Å; I571-F575 HydrophobicContact CG2-CD2 3.89Å; I571-F575 WeakPolarHBondContact O-CB 3.49Å; I571-F575 WeakPolarHBondContact O-CD2 3.44Å; I571-F575 PolarHBondContact O-N 3.35Å; I571-F603 HydrophobicContact CG2-CD1 3.78Å; I571-F603 HydrophobicContact CG2-CE1 3.82Å
572	T	93.9	Very high	93	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.2	-44.6	-177.4	-53.2	0	0	0	0	112.1	R568 T569 R570 H574 I576 F603 D604 M607	R568-T572 WeakPolarHBondContact O-CB 3.43Å; R568-T572 PolarHBondContact O-N 3.19Å; R568-T572 PolarHBondContact O-OG1 3.46Å; T569-T572 PolarHBondContact O-N 2.93Å; R570-T572 VanDerWaalsContact C-N 3.26Å; R570-T572 PolarHBondContact O-N 3.1Å; T572-H574 VanDerWaalsContact C-N 3.32Å; T572-H574 PolarHBondContact O-N 3.03Å; T572-I576 HydrophobicContact CG2-CD1 3.5Å; T572-I576 VanDerWaalsContact CG2-CD1 3.5Å; T572-I576 HydrophobicContact CG2-CG1 4.22Å; T572-I576 VanDerWaalsContact O-CG1 3.27Å; T572-I576 WeakPolarHBondContact O-CG1 3.37Å; T572-I576 PolarHBondContact O-N 2.81Å; T572-F603 HydrophobicContact CG2-CB 4.11Å; T572-F603 WeakPolarHBondContact OG1-CA 3.21Å; T572-D604 HydrophobicContact CG2-CB 4.22Å; T572-D604 PolarHBondContact OG1-N 3.49Å; T572-M607 HydrophobicContact CG2-CB 3.91Å; T572-M607 HydrophobicContact CG2-CG 4.02Å; T572-M607 HydrophobicContact CG2-SD 3.53Å; T572-M607 VanDerWaalsContact CG2-SD 3.53Å
573	T	92.8	Very high	93.2	Very high	57 Å²	57	40.1 Å²	40.1	35%	0.35	19%	0.192	S	C	.	.	H	α-helix	trans	-65.9	-31.1	178	48.6	0	0	0	0	114.1	T569 R570 I571 M607	T569-T573 PolarHBondContact O-N 3.23Å; T569-T573 PolarHBondContact O-OG1 2.63Å; R570-T573 WeakPolarHBondContact CA-OG1 3.27Å; R570-T573 PolarHBondContact O-N 2.92Å; R570-T573 PolarHBondContact O-OG1 3.31Å; I571-T573 PolarHBondContact O-N 2.69Å; T573-M607 HydrophobicContact CG2-CE 3.6Å; T573-M607 HydrophobicContact CG2-SD 4.49Å
574	H	94.2	Very high	93.3	Very high	35 Å²	35	40.1 Å²	40.1	16%	0.162	20%	0.198	C	C	.	.	H	α-helix	trans	-85.3	-48.1	-179.1	173.4	81.2	0	0	0	111.9	W508 T512 R570 I571 T572 P577 V578	W508-H574 PolarHBondContact O-NE2 3.02Å; T512-H574 WeakPolarHBondContact CG2-NE2 3.39Å; T512-H574 PolarHBondContact OG1-CE1 3.06Å; T512-H574 PolarHBondContact OG1-NE2 3.49Å; R570-H574 WeakPolarHBondContact O-CB 3.39Å; R570-H574 PolarHBondContact O-N 3.1Å; I571-H574 PolarHBondContact O-N 3.25Å; T572-H574 VanDerWaalsContact C-N 3.32Å; T572-H574 PolarHBondContact O-N 3.03Å; H574-P577 VanDerWaalsContact O-CD 3.29Å; H574-P577 WeakPolarHBondContact O-CD 3.46Å; H574-P577 WeakPolarHBondContact O-CG 3.46Å; H574-V578 WeakPolarHBondContact O-CG2 3.32Å
575	F	95.3	Very high	93.3	Very high	2 Å²	2	42.2 Å²	42.2	1%	0.009	21%	0.206	C	C	.	.	H	α-helix	trans	-80.6	-24.9	-172.5	-77.8	-75.9	0	0	0	115.2	W508 T512 M533 I537 I571 V578 L579 F603	W508-F575 HydrophobicContact CB-CE2 3.68Å; W508-F575 HydrophobicContact CB-CZ 3.8Å; W508-F575 HydrophobicContact CD2-CE2 4.32Å; W508-F575 AromaticContact CG-CE2 3.71Å; W508-F575 HydrophobicContact CG-CE2 3.71Å; W508-F575 HydrophobicContact CG-CZ 4.13Å; T512-F575 HydrophobicContact CG2-CD1 4.32Å; T512-F575 HydrophobicContact CG2-CE1 3.42Å; T512-F575 VanDerWaalsContact CG2-CE1 3.42Å; T512-F575 HydrophobicContact CG2-CZ 3.84Å; M533-F575 HydrophobicContact CE-CE1 3.99Å; M533-F575 HydrophobicContact CE-CZ 4.37Å; M533-F575 HydrophobicContact CG-CZ 4.06Å; M533-F575 HydrophobicContact SD-CE1 3.71Å; M533-F575 HydrophobicContact SD-CZ 3.63Å; I537-F575 HydrophobicContact CD1-CD2 4.08Å; I537-F575 HydrophobicContact CD1-CE1 4.13Å; I537-F575 HydrophobicContact CD1-CE2 3.4Å; I537-F575 VanDerWaalsContact CD1-CE2 3.4Å; I537-F575 HydrophobicContact CD1-CZ 3.45Å; I537-F575 VanDerWaalsContact CD1-CZ 3.45Å; I537-F575 HydrophobicContact CG1-CE2 3.9Å; I537-F575 HydrophobicContact CG1-CZ 4.31Å; I571-F575 HydrophobicContact CG2-CD2 3.89Å; I571-F575 WeakPolarHBondContact O-CB 3.49Å; I571-F575 WeakPolarHBondContact O-CD2 3.44Å; I571-F575 PolarHBondContact O-N 3.35Å; F575-V578 PolarHBondContact O-N 3.27Å; F575-L579 WeakPolarHBondContact O-CB 3.48Å; F575-L579 PolarHBondContact O-N 3.02Å; F575-F603 HydrophobicContact CB-CE1 3.76Å; F575-F603 HydrophobicContact CB-CE2 4.15Å; F575-F603 HydrophobicContact CB-CZ 3.36Å; F575-F603 HydrophobicContact CG-CE1 4.38Å; F575-F603 HydrophobicContact CG-CZ 4.27Å
576	I	93.3	Very high	93.4	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-56.1	-46.6	176.7	-71.9	176	0	0	0	112.9	T572 P580 F603 M607 Y608 L614 H617	T572-I576 HydrophobicContact CG2-CD1 3.5Å; T572-I576 VanDerWaalsContact CG2-CD1 3.5Å; T572-I576 HydrophobicContact CG2-CG1 4.22Å; T572-I576 VanDerWaalsContact O-CG1 3.27Å; T572-I576 WeakPolarHBondContact O-CG1 3.37Å; T572-I576 PolarHBondContact O-N 2.81Å; I576-P580 VanDerWaalsContact O-CD 3.3Å; I576-P580 WeakPolarHBondContact O-CD 3.48Å; I576-F603 HydrophobicContact CG1-CD2 4.01Å; I576-F603 HydrophobicContact CG1-CE2 4.19Å; I576-M607 HydrophobicContact CD1-CB 4.43Å; I576-Y608 HydrophobicContact CB-CE1 4.39Å; I576-Y608 HydrophobicContact CD1-CD1 4.33Å; I576-Y608 HydrophobicContact CD1-CD2 4.17Å; I576-Y608 HydrophobicContact CD1-CE1 4.1Å; I576-Y608 HydrophobicContact CD1-CE2 3.91Å; I576-Y608 HydrophobicContact CD1-CG 4.37Å; I576-Y608 HydrophobicContact CG1-CE1 4.13Å; I576-Y608 HydrophobicContact CG1-CE2 4.11Å; I576-Y608 HydrophobicContact CG2-CD1 4.15Å; I576-Y608 HydrophobicContact CG2-CE1 3.43Å; I576-Y608 VanDerWaalsContact CG2-CE1 3.43Å; I576-L614 HydrophobicContact CB-CD2 4.05Å; I576-L614 HydrophobicContact CD1-CD1 4.16Å; I576-L614 HydrophobicContact CG2-CB 4.3Å; I576-L614 HydrophobicContact CG2-CD2 3.69Å; I576-L614 HydrophobicContact CG2-CG 4.49Å; I576-H617 HydrophobicContact CG2-CB 3.58Å
577	P	92.7	Very high	93.3	Very high	28 Å²	28	33.3 Å²	33.3	18%	0.182	17%	0.166	C	C	.	.	H	α-helix	trans	-75.7	-25.6	175.7	27.2	-34.4	0	0	0	114.9	H574 Q581 W613	H574-P577 VanDerWaalsContact O-CD 3.29Å; H574-P577 WeakPolarHBondContact O-CD 3.46Å; H574-P577 WeakPolarHBondContact O-CG 3.46Å; P577-Q581 PolarHBondContact O-NE2 3.17Å; P577-W613 HydrophobicContact CG-CZ3 4.36Å
578	V	94.1	Very high	93.2	Very high	21 Å²	21	37.5 Å²	37.5	13%	0.127	20%	0.202	C	C	.	.	H	α-helix	trans	-90.4	-40.1	-173.6	177.7	0	0	0	0	112.8	T512 L516 H574 F575 Q581 L582	T512-V578 HydrophobicContact CG2-CG1 3.98Å; L516-V578 HydrophobicContact CD1-CG1 3.93Å; H574-V578 WeakPolarHBondContact O-CG2 3.32Å; F575-V578 PolarHBondContact O-N 3.27Å; V578-Q581 VanDerWaalsContact O-CB 3.29Å; V578-Q581 WeakPolarHBondContact O-CB 3.45Å; V578-Q581 PolarHBondContact O-N 2.93Å; V578-L582 HydrophobicContact CG1-CD1 3.92Å; V578-L582 HydrophobicContact CG1-CG 4.17Å; V578-L582 PolarHBondContact O-N 3.23Å
579	L	94.1	Very high	93.2	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-56.3	-41.1	-173.8	179.9	66.6	0	0	0	114.3	F575 Q581 L582 L583 L596 A599 P600 F603 L621	F575-L579 WeakPolarHBondContact O-CB 3.48Å; F575-L579 PolarHBondContact O-N 3.02Å; L579-Q581 PolarHBondContact O-N 3.47Å; L579-Q581 VanDerWaalsContact O-N 3.15Å; L579-L582 PolarHBondContact O-N 3Å; L579-L583 HydrophobicContact CD1-CD1 4.23Å; L579-L583 HydrophobicContact CD1-CD2 4.34Å; L579-L583 HydrophobicContact CD1-CG 3.91Å; L579-L583 HydrophobicContact CD2-CD1 4.32Å; L579-L583 HydrophobicContact CG-CD1 3.82Å; L579-L583 HydrophobicContact CG-CG 4.02Å; L579-L583 WeakPolarHBondContact O-CB 3.38Å; L579-L583 VanDerWaalsContact O-CG 3.31Å; L579-L583 WeakPolarHBondContact O-CG 3.48Å; L579-L583 PolarHBondContact O-N 3.26Å; L579-L596 HydrophobicContact CD1-CB 4.33Å; L579-L596 HydrophobicContact CD1-CD2 3.97Å; L579-A599 HydrophobicContact CD1-CB 4.41Å; L579-A599 HydrophobicContact CD2-CB 4.43Å; L579-P600 HydrophobicContact CD2-CG 3.47Å; L579-P600 VanDerWaalsContact CD2-CG 3.47Å; L579-F603 HydrophobicContact CD2-CE2 4.12Å; L579-F603 HydrophobicContact CD2-CZ 4.09Å; L579-L621 HydrophobicContact CD2-CD1 4.43Å
580	P	91.6	Very high	93.3	Very high	9 Å²	9	33.9 Å²	33.9	6%	0.058	19%	0.191	C	C	.	.	H	α-helix	trans	-62.1	-21.2	176.6	-23.7	35.3	0	0	0	114.1	I576 S584 L620	I576-P580 VanDerWaalsContact O-CD 3.3Å; I576-P580 WeakPolarHBondContact O-CD 3.48Å; P580-S584 WeakPolarHBondContact O-CB 3.37Å; P580-S584 PolarHBondContact O-N 3.41Å; P580-L620 HydrophobicContact CB-CB 4.06Å; P580-L620 HydrophobicContact CG-CB 4.17Å
581	Q	92.1	Very high	93.1	Very high	108 Å²	108	34.6 Å²	34.6	51%	0.505	20%	0.199	S	C	.	.	H	α-helix	trans	-81.3	-47	176.7	-53.5	175.9	64.1	0	0	110.1	L516 P577 V578 L579 S584 K585	L516-Q581 HydrophobicContact CD2-CB 4.5Å; P577-Q581 PolarHBondContact O-NE2 3.17Å; V578-Q581 VanDerWaalsContact O-CB 3.29Å; V578-Q581 WeakPolarHBondContact O-CB 3.45Å; V578-Q581 PolarHBondContact O-N 2.93Å; L579-Q581 PolarHBondContact O-N 3.47Å; L579-Q581 VanDerWaalsContact O-N 3.15Å; Q581-S584 WeakPolarHBondContact O-CA 3.48Å; Q581-S584 WeakPolarHBondContact O-CB 3.26Å; Q581-S584 PolarHBondContact O-N 3.13Å; Q581-K585 PolarHBondContact O-N 2.93Å
582	L	94.3	Very high	93	Very high	0 Å²	0	35 Å²	35	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-58.2	-48.7	173.2	-65.6	169.3	0	0	0	111.6	T512 L515 L516 M533 V578 L579 S584 K585 Y586 L596	T512-L582 HydrophobicContact CG2-CD1 4.26Å; L515-L582 HydrophobicContact CB-CD2 3.9Å; L515-L582 HydrophobicContact CD1-CD2 4.45Å; L516-L582 HydrophobicContact CD1-CD2 4.42Å; L516-L582 HydrophobicContact CD2-CD2 3.82Å; L516-L582 HydrophobicContact CD2-CG 4.46Å; L516-L582 HydrophobicContact CG-CD2 3.94Å; M533-L582 HydrophobicContact CE-CD1 4.4Å; V578-L582 HydrophobicContact CG1-CD1 3.92Å; V578-L582 HydrophobicContact CG1-CG 4.17Å; V578-L582 PolarHBondContact O-N 3.23Å; L579-L582 PolarHBondContact O-N 3Å; L582-S584 PolarHBondContact O-N 3.38Å; L582-K585 PolarHBondContact O-N 3Å; L582-Y586 HydrophobicContact CD2-CE2 4.03Å; L582-Y586 VanDerWaalsContact O-CD2 3.27Å; L582-Y586 WeakPolarHBondContact O-CD2 3.32Å; L582-Y586 PolarHBondContact O-N 2.96Å; L582-L596 HydrophobicContact CB-CD1 4.13Å; L582-L596 HydrophobicContact CB-CD2 3.92Å; L582-L596 HydrophobicContact CD1-CD2 4.03Å
583	L	94.3	Very high	93.1	Very high	1 Å²	1	35 Å²	35	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-58.8	-28	175.2	-70.3	173.1	0	0	0	112.7	L579 S587 M593 L596 L597 L621 Q624 I628	L579-L583 HydrophobicContact CD1-CD1 4.23Å; L579-L583 HydrophobicContact CD1-CD2 4.34Å; L579-L583 HydrophobicContact CD1-CG 3.91Å; L579-L583 HydrophobicContact CD2-CD1 4.32Å; L579-L583 HydrophobicContact CG-CD1 3.82Å; L579-L583 HydrophobicContact CG-CG 4.02Å; L579-L583 WeakPolarHBondContact O-CB 3.38Å; L579-L583 VanDerWaalsContact O-CG 3.31Å; L579-L583 WeakPolarHBondContact O-CG 3.48Å; L579-L583 PolarHBondContact O-N 3.26Å; L583-S587 WeakPolarHBondContact O-CA 3.48Å; L583-S587 VanDerWaalsContact O-CB 3.23Å; L583-S587 WeakPolarHBondContact O-CB 3.49Å; L583-S587 PolarHBondContact O-N 3.45Å; L583-M593 HydrophobicContact CB-CE 4.19Å; L583-M593 HydrophobicContact CD2-CE 3.44Å; L583-M593 VanDerWaalsContact CD2-CE 3.44Å; L583-M593 HydrophobicContact CD2-SD 4.09Å; L583-M593 HydrophobicContact CG-CE 4.41Å; L583-L596 HydrophobicContact CD2-CB 3.75Å; L583-L597 HydrophobicContact CD2-CD2 4.28Å; L583-L597 HydrophobicContact CD2-CG 4.4Å; L583-L621 HydrophobicContact CD1-CD1 3.85Å; L583-Q624 HydrophobicContact CD1-CB 4.43Å; L583-I628 HydrophobicContact CB-CD1 4.45Å; L583-I628 HydrophobicContact CD2-CD1 4.15Å
584	S	91.8	Very high	93.1	Very high	60 Å²	60	33.4 Å²	33.4	42%	0.42	19%	0.192	S	C	.	.	H	α-helix	trans	-79.3	-46.9	176.3	-161.5	0	0	0	0	111.8	P580 Q581 L582 S587	P580-S584 WeakPolarHBondContact O-CB 3.37Å; P580-S584 PolarHBondContact O-N 3.41Å; Q581-S584 WeakPolarHBondContact O-CA 3.48Å; Q581-S584 WeakPolarHBondContact O-CB 3.26Å; Q581-S584 PolarHBondContact O-N 3.13Å; L582-S584 PolarHBondContact O-N 3.38Å; S584-S587 WeakPolarHBondContact O-CB 3.25Å; S584-S587 PolarHBondContact O-N 3.43Å; S584-S587 PolarHBondContact O-OG 3.27Å; S584-S587 VanDerWaalsContact O-OG 3.05Å
585	K	92.1	Very high	93	Very high	89 Å²	89	33 Å²	33	39%	0.387	19%	0.191	S	C	.	.	H	α-helix	trans	-56.9	-51.5	178.3	178.7	175.1	172.8	-175.4	0	110.7	L515 E526 Q581 L582 S587	L515-K585 WeakPolarHBondContact O-CD 3.42Å; L515-K585 PolarHBondContact O-NZ 3.24Å; E526-K585 WeakPolarHBondContact OE1-CE 3.5Å; E526-K585 IonicContact OE1-NZ 3.28Å; E526-K585 PolarHBondContact OE1-NZ 3.34Å; Q581-K585 PolarHBondContact O-N 2.93Å; L582-K585 PolarHBondContact O-N 3Å; K585-S587 VanDerWaalsContact C-N 3.32Å; K585-S587 PolarHBondContact O-N 3.47Å
586	Y	92.9	Very high	93	Very high	11 Å²	11	33 Å²	33	4%	0.043	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.6	10.7	-175.8	-57.7	-66.3	0	0	0	114.1	L515 E526 L530 L582 A588 D589 K592 M593 L596	L515-Y586 PolarHBondContact O-OH 2.69Å; L515-Y586 VanDerWaalsContact O-OH 3.14Å; E526-Y586 HydrophobicContact CB-CE1 4.34Å; E526-Y586 VanDerWaalsContact CD-OH 3.29Å; E526-Y586 WeakPolarHBondContact OE1-CE1 3.32Å; E526-Y586 PolarHBondContact OE1-OH 2.69Å; E526-Y586 WeakPolarHBondContact OE2-CE1 3.45Å; L530-Y586 HydrophobicContact CD1-CD2 4.2Å; L530-Y586 HydrophobicContact CD1-CE2 4.12Å; L530-Y586 HydrophobicContact CD1-CG 4.47Å; L582-Y586 HydrophobicContact CD2-CE2 4.03Å; L582-Y586 VanDerWaalsContact O-CD2 3.27Å; L582-Y586 WeakPolarHBondContact O-CD2 3.32Å; L582-Y586 PolarHBondContact O-N 2.96Å; Y586-A588 PolarHBondContact O-N 3.34Å; Y586-D589 PolarHBondContact O-N 3.23Å; Y586-K592 HydrophobicContact CD1-CD 3.57Å; Y586-K592 HydrophobicContact CE1-CD 3.94Å; Y586-K592 HydrophobicContact CG-CB 4.36Å; Y586-K592 HydrophobicContact CG-CD 4.22Å; Y586-M593 WeakPolarHBondContact O-CG 3.33Å; Y586-L596 HydrophobicContact CD2-CD1 3.74Å; Y586-L596 HydrophobicContact CG-CD1 4.32Å
587	S	91.8	Very high	93.1	Very high	17 Å²	17	33 Å²	33	12%	0.119	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-8.7	-168.2	67.7	0	0	0	0	117.2	L583 S584 K585 K631 H632	L583-S587 WeakPolarHBondContact O-CA 3.48Å; L583-S587 VanDerWaalsContact O-CB 3.23Å; L583-S587 WeakPolarHBondContact O-CB 3.49Å; L583-S587 PolarHBondContact O-N 3.45Å; S584-S587 WeakPolarHBondContact O-CB 3.25Å; S584-S587 PolarHBondContact O-N 3.43Å; S584-S587 PolarHBondContact O-OG 3.27Å; S584-S587 VanDerWaalsContact O-OG 3.05Å; K585-S587 VanDerWaalsContact C-N 3.32Å; K585-S587 PolarHBondContact O-N 3.47Å; S587-K631 PolarHBondContact OG-NZ 2.72Å; S587-H632 PolarHBondContact O-NE2 3.15Å
588	A	91.1	Very high	93.1	Very high	93 Å²	93	36.3 Å²	36.3	77%	0.769	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-17.2	174.7	0	0	0	0	0	114.2	Y586	Y586-A588 PolarHBondContact O-N 3.34Å
589	D	93.6	Very high	93.1	Very high	19 Å²	19	35.4 Å²	35.4	10%	0.102	20%	0.195	C	C	.	.			trans	-93.7	113.2	-172.8	-176.7	-49.5	0	0	0	110.2	Y523 Y586 E591 K592 M593	Y523-D589 WeakPolarHBondContact CE2-OD2 3.47Å; Y523-D589 VanDerWaalsContact CZ-OD2 3.23Å; Y523-D589 PolarHBondContact OH-OD2 3.13Å; Y586-D589 PolarHBondContact O-N 3.23Å; D589-E591 PolarHBondContact OD1-N 3.45Å; D589-E591 VanDerWaalsContact OD1-N 3.16Å; D589-K592 HydrophobicContact CB-CB 4.13Å; D589-K592 HydrophobicContact CB-CD 4.37Å; D589-K592 HydrophobicContact CB-CG 4.45Å; D589-K592 WeakPolarHBondContact OD1-CB 3.3Å; D589-K592 WeakPolarHBondContact OD1-CG 2.94Å; D589-K592 PolarHBondContact OD1-N 2.63Å; D589-K592 VanDerWaalsContact OD2-CD 3.26Å; D589-K592 WeakPolarHBondContact OD2-CD 3.21Å; D589-K592 IonicContact OD2-NZ 3.12Å; D589-K592 PolarHBondContact OD2-NZ 3.24Å; D589-M593 WeakPolarHBondContact O-CB 3.48Å; D589-M593 WeakPolarHBondContact O-CG 3.48Å; D589-M593 PolarHBondContact O-N 3.22Å; D589-M593 VanDerWaalsContact O-N 3.12Å
590	A	93.6	Very high	93.1	Very high	34 Å²	34	35.3 Å²	35.3	28%	0.281	19%	0.194	S	C	.	.	H	α-helix	trans	-66.6	-40.7	-174.1	0	0	0	0	0	112.7	S594 D634 V637	A590-S594 WeakPolarHBondContact O-CB 3.49Å; A590-S594 PolarHBondContact O-N 3.46Å; A590-D634 HydrophobicContact CB-CB 4.11Å; A590-V637 HydrophobicContact CB-CG2 4.06Å; A590-V637 WeakPolarHBondContact O-CG2 3.36Å
591	E	91.1	Very high	93.1	Very high	142 Å²	142	37.5 Å²	37.5	66%	0.664	21%	0.205	S	C	*	.	H	α-helix	trans	-67.1	-56.5	-176.9	-67	171.7	-168.2	0	0	110.6	D589 M593 S594 L595	D589-E591 PolarHBondContact OD1-N 3.45Å; D589-E591 VanDerWaalsContact OD1-N 3.16Å; E591-M593 PolarHBondContact O-N 3.18Å; E591-S594 WeakPolarHBondContact O-CB 3.38Å; E591-S594 PolarHBondContact O-N 3.03Å; E591-S594 PolarHBondContact O-OG 3.37Å; E591-L595 PolarHBondContact O-N 3.35Å
592	K	93.6	Very high	93.2	Very high	7 Å²	7	33.4 Å²	33.4	3%	0.03	19%	0.185	C	C	.	.	H	α-helix	trans	-58.4	-36.8	178.6	-66.6	-177.8	-175.9	61.7	0	111.5	Y523 L530 Y586 D589 L595 L596	Y523-K592 VanDerWaalsContact O-CE 3.26Å; Y523-K592 WeakPolarHBondContact O-CE 3.35Å; Y523-K592 PolarHBondContact O-NZ 3.02Å; Y523-K592 VanDerWaalsContact O-NZ 3.11Å; L530-K592 HydrophobicContact CD1-CB 3.67Å; L530-K592 HydrophobicContact CD1-CD 3.76Å; L530-K592 HydrophobicContact CD1-CG 3.64Å; Y586-K592 HydrophobicContact CD1-CD 3.57Å; Y586-K592 HydrophobicContact CE1-CD 3.94Å; Y586-K592 HydrophobicContact CG-CB 4.36Å; Y586-K592 HydrophobicContact CG-CD 4.22Å; D589-K592 HydrophobicContact CB-CB 4.13Å; D589-K592 HydrophobicContact CB-CD 4.37Å; D589-K592 HydrophobicContact CB-CG 4.45Å; D589-K592 WeakPolarHBondContact OD1-CB 3.3Å; D589-K592 WeakPolarHBondContact OD1-CG 2.94Å; D589-K592 PolarHBondContact OD1-N 2.63Å; D589-K592 VanDerWaalsContact OD2-CD 3.26Å; D589-K592 WeakPolarHBondContact OD2-CD 3.21Å; D589-K592 IonicContact OD2-NZ 3.12Å; D589-K592 PolarHBondContact OD2-NZ 3.24Å; K592-L595 PolarHBondContact O-N 2.9Å; K592-L596 WeakPolarHBondContact O-CG 3.48Å; K592-L596 PolarHBondContact O-N 3.48Å
593	M	94.9	Very high	93.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-71.4	-37.2	176.3	-69.3	-62.7	-62.6	0	0	113.2	L583 Y586 D589 E591 L595 L596 L597 I628 V637	L583-M593 HydrophobicContact CB-CE 4.19Å; L583-M593 HydrophobicContact CD2-CE 3.44Å; L583-M593 VanDerWaalsContact CD2-CE 3.44Å; L583-M593 HydrophobicContact CD2-SD 4.09Å; L583-M593 HydrophobicContact CG-CE 4.41Å; Y586-M593 WeakPolarHBondContact O-CG 3.33Å; D589-M593 WeakPolarHBondContact O-CB 3.48Å; D589-M593 WeakPolarHBondContact O-CG 3.48Å; D589-M593 PolarHBondContact O-N 3.22Å; D589-M593 VanDerWaalsContact O-N 3.12Å; E591-M593 PolarHBondContact O-N 3.18Å; M593-L595 PolarHBondContact O-N 3.07Å; M593-L596 PolarHBondContact O-N 3.26Å; M593-L596 HydrophobicContact SD-CD1 4.23Å; M593-L597 WeakPolarHBondContact O-CB 3.47Å; M593-L597 WeakPolarHBondContact O-CD1 3.4Å; M593-L597 VanDerWaalsContact O-CG 3.23Å; M593-L597 WeakPolarHBondContact O-CG 3.38Å; M593-L597 PolarHBondContact O-N 3.23Å; M593-I628 HydrophobicContact CE-CD1 3.26Å; M593-I628 HydrophobicContact CE-CG1 3.56Å; M593-I628 HydrophobicContact CE-CG2 4.14Å; M593-V637 HydrophobicContact CB-CG2 4.3Å
594	S	92.8	Very high	93	Very high	24 Å²	24	35.5 Å²	35.5	17%	0.168	20%	0.196	C	C	.	.	H	α-helix	trans	-60.5	-33.8	175	82.5	0	0	0	0	112.1	A590 E591 R598	A590-S594 WeakPolarHBondContact O-CB 3.49Å; A590-S594 PolarHBondContact O-N 3.46Å; E591-S594 WeakPolarHBondContact O-CB 3.38Å; E591-S594 PolarHBondContact O-N 3.03Å; E591-S594 PolarHBondContact O-OG 3.37Å; S594-R598 WeakPolarHBondContact O-CD 3.24Å; S594-R598 WeakPolarHBondContact O-CG 2.99Å
595	L	92.6	Very high	92.9	Very high	27 Å²	27	33 Å²	33	14%	0.141	18%	0.178	C	C	.	.	H	α-helix	trans	-73.6	-51.7	175.1	-60.2	179.9	0	0	0	111.7	E531 I534 E591 K592 M593 L597 R598	E531-L595 HydrophobicContact CB-CD1 3.87Å; E531-L595 WeakPolarHBondContact OE2-CD2 3.47Å; I534-L595 HydrophobicContact CG1-CB 4.25Å; E591-L595 PolarHBondContact O-N 3.35Å; K592-L595 PolarHBondContact O-N 2.9Å; M593-L595 PolarHBondContact O-N 3.07Å; L595-L597 VanDerWaalsContact C-N 3.33Å; L595-L597 PolarHBondContact O-N 3.36Å; L595-R598 WeakPolarHBondContact O-CB 3.32Å; L595-R598 PolarHBondContact O-N 2.91Å
596	L	95.5	Very high	92.8	Very high	1 Å²	1	32.2 Å²	32.2	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-60.4	-38.2	-178.7	-76.2	167	0	0	0	113.2	L530 M533 L579 L582 L583 Y586 K592 M593 R598 A599	L530-L596 HydrophobicContact CD2-CD1 4.25Å; L530-L596 HydrophobicContact CD2-CD2 3.64Å; L530-L596 HydrophobicContact CD2-CG 3.95Å; M533-L596 HydrophobicContact CE-CD2 4.41Å; L579-L596 HydrophobicContact CD1-CB 4.33Å; L579-L596 HydrophobicContact CD1-CD2 3.97Å; L582-L596 HydrophobicContact CB-CD1 4.13Å; L582-L596 HydrophobicContact CB-CD2 3.92Å; L582-L596 HydrophobicContact CD1-CD2 4.03Å; L583-L596 HydrophobicContact CD2-CB 3.75Å; Y586-L596 HydrophobicContact CD2-CD1 3.74Å; Y586-L596 HydrophobicContact CG-CD1 4.32Å; K592-L596 WeakPolarHBondContact O-CG 3.48Å; K592-L596 PolarHBondContact O-N 3.48Å; M593-L596 PolarHBondContact O-N 3.26Å; M593-L596 HydrophobicContact SD-CD1 4.23Å; L596-R598 PolarHBondContact O-N 3.12Å; L596-R598 VanDerWaalsContact O-N 3.17Å; L596-A599 WeakPolarHBondContact O-CB 3.41Å; L596-A599 PolarHBondContact O-N 3.39Å; L596-A599 VanDerWaalsContact O-N 3.09Å
597	L	94.7	Very high	92.5	Very high	1 Å²	1	33 Å²	33	1%	0.005	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-17.7	177.1	-75.4	167.5	0	0	0	113.7	L583 M593 L595 I628 V637 A640 C641 L644	L583-L597 HydrophobicContact CD2-CD2 4.28Å; L583-L597 HydrophobicContact CD2-CG 4.4Å; M593-L597 WeakPolarHBondContact O-CB 3.47Å; M593-L597 WeakPolarHBondContact O-CD1 3.4Å; M593-L597 VanDerWaalsContact O-CG 3.23Å; M593-L597 WeakPolarHBondContact O-CG 3.38Å; M593-L597 PolarHBondContact O-N 3.23Å; L595-L597 VanDerWaalsContact C-N 3.33Å; L595-L597 PolarHBondContact O-N 3.36Å; L597-I628 HydrophobicContact CD1-CG2 4.3Å; L597-I628 HydrophobicContact CD2-CD1 4.18Å; L597-V637 HydrophobicContact CD1-CG1 3.92Å; L597-A640 HydrophobicContact CB-CB 3.71Å; L597-A640 HydrophobicContact CD1-CB 4.02Å; L597-C641 VanDerWaalsContact CD1-SG 3.55Å; L597-L644 HydrophobicContact CD2-CD2 4.17Å
598	R	92.6	Very high	92.4	Very high	98 Å²	98	32.2 Å²	32.2	37%	0.37	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	-21.3	175.8	-62.5	166	71.5	-178.7	3.5	112.6	S594 L595 L596 L601 Y602	S594-R598 WeakPolarHBondContact O-CD 3.24Å; S594-R598 WeakPolarHBondContact O-CG 2.99Å; L595-R598 WeakPolarHBondContact O-CB 3.32Å; L595-R598 PolarHBondContact O-N 2.91Å; L596-R598 PolarHBondContact O-N 3.12Å; L596-R598 VanDerWaalsContact O-N 3.17Å; R598-L601 WeakPolarHBondContact O-CB 3.42Å; R598-L601 PolarHBondContact O-N 3.4Å; R598-Y602 HydrophobicContact CB-CE2 4.38Å; R598-Y602 WeakPolarHBondContact O-CD2 3.36Å; R598-Y602 WeakPolarHBondContact O-CE2 3.39Å
599	A	94.1	Very high	92	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.008	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-55.6	-45.8	-175.3	0	0	0	0	0	113.9	I534 L579 L596 L601 Y602 F603	I534-A599 HydrophobicContact CD1-CB 3.74Å; L579-A599 HydrophobicContact CD1-CB 4.41Å; L579-A599 HydrophobicContact CD2-CB 4.43Å; L596-A599 WeakPolarHBondContact O-CB 3.41Å; L596-A599 PolarHBondContact O-N 3.39Å; L596-A599 VanDerWaalsContact O-N 3.09Å; A599-L601 PolarHBondContact O-N 3.11Å; A599-L601 VanDerWaalsContact O-N 3.16Å; A599-Y602 PolarHBondContact O-N 2.85Å; A599-Y602 VanDerWaalsContact O-N 3.09Å; A599-F603 HydrophobicContact CB-CE1 4.11Å; A599-F603 HydrophobicContact CB-CZ 4.04Å; A599-F603 WeakPolarHBondContact O-CD1 3.38Å; A599-F603 WeakPolarHBondContact O-CE1 3.36Å
600	P	93.5	Very high	91.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.183	C	C	.	.	G	3₁₀ helix	trans	-63.3	-22.1	-178.9	-23.7	35.4	0	0	0	115.2	L579 Y602 F603 L621 L644	L579-P600 HydrophobicContact CD2-CG 3.47Å; L579-P600 VanDerWaalsContact CD2-CG 3.47Å; P600-Y602 PolarHBondContact O-N 3.18Å; P600-F603 HydrophobicContact CB-CD2 4.14Å; P600-F603 HydrophobicContact CB-CE2 4.16Å; P600-F603 HydrophobicContact CG-CE2 4.21Å; P600-F603 WeakPolarHBondContact O-CB 3.26Å; P600-F603 PolarHBondContact O-N 3.11Å; P600-F603 VanDerWaalsContact O-N 3.1Å; P600-L621 HydrophobicContact CG-CD2 4.46Å; P600-L644 HydrophobicContact CB-CD1 3.67Å; P600-L644 HydrophobicContact CG-CD1 4.13Å; P600-L644 HydrophobicContact CG-CD2 4.07Å
601	L	92.6	Very high	90.9	Very high	54 Å²	54	33.6 Å²	33.6	28%	0.283	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-66.9	-16.7	178.2	-53.1	176.5	0	0	0	112	R598 A599 L643 L644 T647	R598-L601 WeakPolarHBondContact O-CB 3.42Å; R598-L601 PolarHBondContact O-N 3.4Å; A599-L601 PolarHBondContact O-N 3.11Å; A599-L601 VanDerWaalsContact O-N 3.16Å; L601-L643 HydrophobicContact CD1-CD2 3.58Å; L601-L643 HydrophobicContact CD1-CG 3.93Å; L601-L643 HydrophobicContact CD2-CG 4.26Å; L601-L644 HydrophobicContact CD2-CD1 4.21Å; L601-T647 HydrophobicContact CD2-CG2 4.36Å
602	Y	93.8	Very high	90.3	Very high	22 Å²	22	35.4 Å²	35.4	9%	0.086	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-99.1	-3.2	176.9	-50.1	-54.4	0	0	0	113.2	I537 R538 A541 R568 R598 A599 P600	I537-Y602 HydrophobicContact CG2-CD2 3.63Å; I537-Y602 HydrophobicContact CG2-CG 4.11Å; R538-Y602 HydrophobicContact CB-CE1 3.96Å; R538-Y602 HydrophobicContact CB-CE2 4.03Å; R538-Y602 HydrophobicContact CG-CD1 4.42Å; R538-Y602 HydrophobicContact CG-CE1 3.62Å; A541-Y602 HydrophobicContact CB-CG 4.41Å; R568-Y602 WeakPolarHBondContact CG-O 3.49Å; R598-Y602 HydrophobicContact CB-CE2 4.38Å; R598-Y602 WeakPolarHBondContact O-CD2 3.36Å; R598-Y602 WeakPolarHBondContact O-CE2 3.39Å; A599-Y602 PolarHBondContact O-N 2.85Å; A599-Y602 VanDerWaalsContact O-N 3.09Å; P600-Y602 PolarHBondContact O-N 3.18Å
603	F	92.9	Very high	89.6	Confident	8 Å²	8	41.6 Å²	41.6	4%	0.035	21%	0.211	C	C	.	.	S	Bend	trans	-82.2	165.3	-176.1	-64.8	-0.4	0	0	0	112.7	I571 T572 F575 I576 L579 A599 P600 L605	I571-F603 HydrophobicContact CG2-CD1 3.78Å; I571-F603 HydrophobicContact CG2-CE1 3.82Å; T572-F603 HydrophobicContact CG2-CB 4.11Å; T572-F603 WeakPolarHBondContact OG1-CA 3.21Å; F575-F603 HydrophobicContact CB-CE1 3.76Å; F575-F603 HydrophobicContact CB-CE2 4.15Å; F575-F603 HydrophobicContact CB-CZ 3.36Å; F575-F603 HydrophobicContact CG-CE1 4.38Å; F575-F603 HydrophobicContact CG-CZ 4.27Å; I576-F603 HydrophobicContact CG1-CD2 4.01Å; I576-F603 HydrophobicContact CG1-CE2 4.19Å; L579-F603 HydrophobicContact CD2-CE2 4.12Å; L579-F603 HydrophobicContact CD2-CZ 4.09Å; A599-F603 HydrophobicContact CB-CE1 4.11Å; A599-F603 HydrophobicContact CB-CZ 4.04Å; A599-F603 WeakPolarHBondContact O-CD1 3.38Å; A599-F603 WeakPolarHBondContact O-CE1 3.36Å; P600-F603 HydrophobicContact CB-CD2 4.14Å; P600-F603 HydrophobicContact CB-CE2 4.16Å; P600-F603 HydrophobicContact CG-CE2 4.21Å; P600-F603 WeakPolarHBondContact O-CB 3.26Å; P600-F603 PolarHBondContact O-N 3.11Å; P600-F603 VanDerWaalsContact O-N 3.1Å; F603-L605 HydrophobicContact CB-CD2 4.09Å; F603-L605 PolarHBondContact O-N 2.93Å
604	D	91.1	Very high	88.9	Confident	38 Å²	38	41.6 Å²	41.6	20%	0.203	21%	0.211	C	C	.	.			trans	-89.5	79.1	164.6	-152.7	5.8	0	0	0	109.8	R568 T572 D606 M607	R568-D604 IonicContact CZ-OD1 2.67Å; R568-D604 IonicContact CZ-OD2 3.2Å; R568-D604 IonicContact NH1-OD1 2.83Å; R568-D604 PolarHBondContact NH1-OD1 2.86Å; R568-D604 IonicContact NH2-OD1 3.21Å; R568-D604 PolarHBondContact NH2-OD1 2.92Å; R568-D604 IonicContact NH2-OD2 3.83Å; R568-D604 PolarHBondContact NH2-OD2 3.46Å; T572-D604 HydrophobicContact CG2-CB 4.22Å; T572-D604 PolarHBondContact OG1-N 3.49Å; D604-D606 PolarHBondContact O-N 3.29Å; D604-M607 HydrophobicContact CB-CG 4.15Å; D604-M607 HydrophobicContact CB-SD 4.3Å; D604-M607 VanDerWaalsContact O-CB 3.27Å; D604-M607 WeakPolarHBondContact O-CB 3.47Å; D604-M607 WeakPolarHBondContact O-CG 3.31Å; D604-M607 PolarHBondContact O-N 3.23Å
605	L	90.6	Very high	88.4	Confident	8 Å²	8	44.3 Å²	44.3	4%	0.042	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-25.9	-167.1	-67	176.3	0	0	0	114.5	F603 M607 Y608 T647 L648 F655	F603-L605 HydrophobicContact CB-CD2 4.09Å; F603-L605 PolarHBondContact O-N 2.93Å; L605-M607 PolarHBondContact O-N 3.33Å; L605-M607 VanDerWaalsContact O-N 3.1Å; L605-Y608 HydrophobicContact CD2-CD2 4.23Å; L605-Y608 HydrophobicContact CD2-CE2 3.95Å; L605-Y608 WeakPolarHBondContact O-CB 3.34Å; L605-Y608 WeakPolarHBondContact O-CD2 3.48Å; L605-Y608 PolarHBondContact O-N 3.11Å; L605-T647 HydrophobicContact CD1-CG2 3.68Å; L605-L648 HydrophobicContact CD1-CD2 4.37Å; L605-L648 HydrophobicContact CD2-CD2 4.37Å; L605-F655 HydrophobicContact CB-CZ 4.3Å; L605-F655 WeakPolarHBondContact O-CE1 3.42Å
606	D	88.6	Confident	88	Confident	72 Å²	72	49.1 Å²	49.1	39%	0.385	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-18.8	175.5	-66.4	-34	0	0	0	113	D604 Y608 S609 S610 H653	D604-D606 PolarHBondContact O-N 3.29Å; D606-Y608 PolarHBondContact O-N 2.87Å; D606-S609 PolarHBondContact O-N 3.08Å; D606-S610 PolarHBondContact O-N 2.86Å; D606-H653 IonicContact OD1-CE1 2.8Å; D606-H653 IonicContact OD1-CG 3.73Å; D606-H653 IonicContact OD1-ND1 3.91Å; D606-H653 PolarHBondContact OD1-ND1 3.1Å
607	M	88.3	Confident	87.7	Confident	26 Å²	26	50.1 Å²	50.1	13%	0.128	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-24.4	172.5	-66.8	-165.1	67.9	0	0	113.8	T569 T572 T573 I576 D604 L605 S609 S610 T611 L614	T569-M607 HydrophobicContact CG2-SD 4.25Å; T572-M607 HydrophobicContact CG2-CB 3.91Å; T572-M607 HydrophobicContact CG2-CG 4.02Å; T572-M607 HydrophobicContact CG2-SD 3.53Å; T572-M607 VanDerWaalsContact CG2-SD 3.53Å; T573-M607 HydrophobicContact CG2-CE 3.6Å; T573-M607 HydrophobicContact CG2-SD 4.49Å; I576-M607 HydrophobicContact CD1-CB 4.43Å; D604-M607 HydrophobicContact CB-CG 4.15Å; D604-M607 HydrophobicContact CB-SD 4.3Å; D604-M607 VanDerWaalsContact O-CB 3.27Å; D604-M607 WeakPolarHBondContact O-CB 3.47Å; D604-M607 WeakPolarHBondContact O-CG 3.31Å; D604-M607 PolarHBondContact O-N 3.23Å; L605-M607 PolarHBondContact O-N 3.33Å; L605-M607 VanDerWaalsContact O-N 3.1Å; M607-S609 PolarHBondContact O-N 2.87Å; M607-S610 WeakPolarHBondContact CA-OG 3.45Å; M607-T611 WeakPolarHBondContact O-CB 3.15Å; M607-T611 PolarHBondContact O-N 2.93Å; M607-L614 HydrophobicContact CB-CD1 4.13Å; M607-L614 HydrophobicContact CE-CD1 4.17Å
608	Y	87.9	Confident	87.5	Confident	1 Å²	1	50 Å²	50	0%	0.004	25%	0.245	C	C	.	.	H	α-helix	trans	-62.9	-22.9	172	-80.2	-69.9	0	0	0	113.4	I576 L605 D606 E615 H617 L618 L621	I576-Y608 HydrophobicContact CB-CE1 4.39Å; I576-Y608 HydrophobicContact CD1-CD1 4.33Å; I576-Y608 HydrophobicContact CD1-CD2 4.17Å; I576-Y608 HydrophobicContact CD1-CE1 4.1Å; I576-Y608 HydrophobicContact CD1-CE2 3.91Å; I576-Y608 HydrophobicContact CD1-CG 4.37Å; I576-Y608 HydrophobicContact CG1-CE1 4.13Å; I576-Y608 HydrophobicContact CG1-CE2 4.11Å; I576-Y608 HydrophobicContact CG2-CD1 4.15Å; I576-Y608 HydrophobicContact CG2-CE1 3.43Å; I576-Y608 VanDerWaalsContact CG2-CE1 3.43Å; L605-Y608 HydrophobicContact CD2-CD2 4.23Å; L605-Y608 HydrophobicContact CD2-CE2 3.95Å; L605-Y608 WeakPolarHBondContact O-CB 3.34Å; L605-Y608 WeakPolarHBondContact O-CD2 3.48Å; L605-Y608 PolarHBondContact O-N 3.11Å; D606-Y608 PolarHBondContact O-N 2.87Å; Y608-E615 WeakPolarHBondContact O-CA 3.48Å; Y608-H617 HydrophobicContact CE1-CB 4.26Å; Y608-L618 HydrophobicContact CD1-CB 3.68Å; Y608-L618 HydrophobicContact CD1-CD1 4.2Å; Y608-L618 HydrophobicContact CD1-CG 4.48Å; Y608-L618 HydrophobicContact CD2-CD1 4.29Å; Y608-L618 HydrophobicContact CE1-CB 4.07Å; Y608-L618 HydrophobicContact CE1-CD1 4.41Å; Y608-L618 HydrophobicContact CG-CB 4.27Å; Y608-L618 HydrophobicContact CG-CD1 4.13Å; Y608-L621 HydrophobicContact CE2-CD2 4.46Å; Y608-L621 WeakPolarHBondContact OH-CD2 3.35Å
609	S	84.3	Confident	87.3	Confident	52 Å²	52	48.6 Å²	48.6	36%	0.364	24%	0.244	S	C	.	.	H	α-helix	trans	-116.7	-22.7	-179.6	-63	0	0	0	0	114.1	D606 M607 T611 T654	D606-S609 PolarHBondContact O-N 3.08Å; M607-S609 PolarHBondContact O-N 2.87Å; S609-T611 VanDerWaalsContact C-N 3.26Å; S609-T611 PolarHBondContact O-N 3.42Å; S609-T654 VanDerWaalsContact CB-OG1 3.25Å; S609-T654 WeakPolarHBondContact CB-OG1 3.39Å; S609-T654 PolarHBondContact OG-OG1 3.42Å
610	S	81.8	Confident	87.2	Confident	91 Å²	91	52.8 Å²	52.8	64%	0.636	27%	0.266	S	S	*	.	H	α-helix	trans	-75.7	-14.2	172.4	69.8	0	0	0	0	113.8	D606 M607	D606-S610 PolarHBondContact O-N 2.86Å; M607-S610 WeakPolarHBondContact CA-OG 3.45Å
611	T	82.1	Confident	87.1	Confident	32 Å²	32	52.8 Å²	52.8	20%	0.196	27%	0.266	C	S	.	.			trans	-133.7	100.1	-166.8	-55.8	0	0	0	0	110.9	M607 S609 W613 L614 E615	M607-T611 WeakPolarHBondContact O-CB 3.15Å; M607-T611 PolarHBondContact O-N 2.93Å; S609-T611 VanDerWaalsContact C-N 3.26Å; S609-T611 PolarHBondContact O-N 3.42Å; T611-W613 VanDerWaalsContact CG2-CD1 3.49Å; T611-W613 HydrophobicContact CG2-CG 4.27Å; T611-W613 VanDerWaalsContact CG2-NE1 3.35Å; T611-W613 PolarHBondContact O-N 2.66Å; T611-L614 HydrophobicContact CG2-CB 4.38Å; T611-L614 HydrophobicContact CG2-CD1 3.81Å; T611-L614 HydrophobicContact CG2-CG 3.83Å; T611-L614 WeakPolarHBondContact O-CB 3.38Å; T611-L614 PolarHBondContact O-N 3.01Å; T611-E615 PolarHBondContact O-N 3.09Å
612	Q	77.7	Confident	87.2	Confident	180 Å²	180	50.3 Å²	50.3	84%	0.841	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-27.9	-168.7	-166.4	177.1	15.6	0	0	115.3
613	W	79.3	Confident	87.1	Confident	138 Å²	138	52.6 Å²	52.6	52%	0.523	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-16.7	177.2	73.7	-94.9	0	0	0	114	P577 T611 K616	P577-W613 HydrophobicContact CG-CZ3 4.36Å; T611-W613 VanDerWaalsContact CG2-CD1 3.49Å; T611-W613 HydrophobicContact CG2-CG 4.27Å; T611-W613 VanDerWaalsContact CG2-NE1 3.35Å; T611-W613 PolarHBondContact O-N 2.66Å; W613-K616 WeakPolarHBondContact O-CE 3.34Å
614	L	80.9	Confident	87.1	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-25.7	175.4	-66.1	178.7	0	0	0	112.5	I576 M607 T611 K616 H617	I576-L614 HydrophobicContact CB-CD2 4.05Å; I576-L614 HydrophobicContact CD1-CD1 4.16Å; I576-L614 HydrophobicContact CG2-CB 4.3Å; I576-L614 HydrophobicContact CG2-CD2 3.69Å; I576-L614 HydrophobicContact CG2-CG 4.49Å; M607-L614 HydrophobicContact CB-CD1 4.13Å; M607-L614 HydrophobicContact CE-CD1 4.17Å; T611-L614 HydrophobicContact CG2-CB 4.38Å; T611-L614 HydrophobicContact CG2-CD1 3.81Å; T611-L614 HydrophobicContact CG2-CG 3.83Å; T611-L614 WeakPolarHBondContact O-CB 3.38Å; T611-L614 PolarHBondContact O-N 3.01Å; L614-K616 VanDerWaalsContact C-N 3.28Å; L614-K616 PolarHBondContact O-N 3.35Å; L614-H617 WeakPolarHBondContact O-CB 3.14Å; L614-H617 PolarHBondContact O-N 3.23Å
615	E	80.8	Confident	87.2	Confident	81 Å²	81	52.2 Å²	52.2	38%	0.379	27%	0.269	S	S	.	.	H	α-helix	trans	-53.5	-42.7	-176.8	-165.5	-165.7	153.6	0	0	112.5	Y608 T611 H617 L618 R658	Y608-E615 WeakPolarHBondContact O-CA 3.48Å; T611-E615 PolarHBondContact O-N 3.09Å; E615-H617 PolarHBondContact O-N 3.36Å; E615-H617 VanDerWaalsContact O-N 3.08Å; E615-L618 WeakPolarHBondContact O-CB 3.32Å; E615-L618 PolarHBondContact O-N 3.03Å; E615-R658 IonicContact OE1-CZ 3.92Å; E615-R658 IonicContact OE1-NH1 3.06Å; E615-R658 PolarHBondContact OE1-NH1 3.35Å
616	K	86.1	Confident	87.4	Confident	127 Å²	127	52.6 Å²	52.6	55%	0.552	27%	0.273	S	S	*	.	H	α-helix	trans	-57.8	-23.9	177.5	72.9	-173.3	-174.8	178.5	0	114.2	W613 L614	W613-K616 WeakPolarHBondContact O-CE 3.34Å; L614-K616 VanDerWaalsContact C-N 3.28Å; L614-K616 PolarHBondContact O-N 3.35Å
617	H	88.7	Confident	87.6	Confident	22 Å²	22	51.7 Å²	51.7	10%	0.102	27%	0.269	C	S	.	.	H	α-helix	trans	-83.2	-13.8	177.9	-66.3	-84.7	0	0	0	112.5	I576 Y608 L614 E615 L621	I576-H617 HydrophobicContact CG2-CB 3.58Å; Y608-H617 HydrophobicContact CE1-CB 4.26Å; L614-H617 WeakPolarHBondContact O-CB 3.14Å; L614-H617 PolarHBondContact O-N 3.23Å; E615-H617 PolarHBondContact O-N 3.36Å; E615-H617 VanDerWaalsContact O-N 3.08Å; H617-L621 WeakPolarHBondContact O-CB 3.25Å; H617-L621 PolarHBondContact O-N 3.16Å
618	L	89.9	Confident	87.9	Confident	0 Å²	0	50.4 Å²	50.4	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-67.1	-45	171.5	-176.1	64.1	0	0	0	110.9	Y608 E615 L620 L621 L622 F655	Y608-L618 HydrophobicContact CD1-CB 3.68Å; Y608-L618 HydrophobicContact CD1-CD1 4.2Å; Y608-L618 HydrophobicContact CD1-CG 4.48Å; Y608-L618 HydrophobicContact CD2-CD1 4.29Å; Y608-L618 HydrophobicContact CE1-CB 4.07Å; Y608-L618 HydrophobicContact CE1-CD1 4.41Å; Y608-L618 HydrophobicContact CG-CB 4.27Å; Y608-L618 HydrophobicContact CG-CD1 4.13Å; E615-L618 WeakPolarHBondContact O-CB 3.32Å; E615-L618 PolarHBondContact O-N 3.03Å; L618-L620 VanDerWaalsContact C-N 3.31Å; L618-L620 PolarHBondContact O-N 3.21Å; L618-L621 PolarHBondContact O-N 3.49Å; L618-L622 HydrophobicContact CD1-CD1 4.38Å; L618-L622 HydrophobicContact CD1-CG 4.31Å; L618-L622 HydrophobicContact CG-CD1 3.99Å; L618-L622 HydrophobicContact CG-CG 4.34Å; L618-L622 WeakPolarHBondContact O-CB 3.41Å; L618-L622 VanDerWaalsContact O-CG 3.3Å; L618-L622 WeakPolarHBondContact O-CG 3.21Å; L618-L622 PolarHBondContact O-N 3Å; L618-F655 HydrophobicContact CD1-CD2 4.1Å; L618-F655 HydrophobicContact CD1-CE2 4.12Å; L618-F655 HydrophobicContact CD2-CB 3.55Å; L618-F655 HydrophobicContact CD2-CD1 4.19Å; L618-F655 HydrophobicContact CD2-CD2 3.73Å; L618-F655 HydrophobicContact CD2-CG 3.55Å
619	D	89	Confident	88.3	Confident	68 Å²	68	50.4 Å²	50.4	36%	0.364	26%	0.263	S	S	.	.	H	α-helix	trans	-61.9	-40.7	176.5	-65.8	-52.1	0	0	0	111.7	L622 S623 R658	D619-L622 PolarHBondContact O-N 2.85Å; D619-S623 WeakPolarHBondContact O-CB 3.49Å; D619-S623 PolarHBondContact O-N 3.25Å; D619-R658 IonicContact OD1-CZ 3.27Å; D619-R658 IonicContact OD1-NE 2.69Å; D619-R658 PolarHBondContact OD1-NE 2.93Å; D619-R658 IonicContact OD1-NH2 3.9Å; D619-R658 PolarHBondContact OD1-NH2 3.34Å; D619-R658 IonicContact OD2-CZ 3.68Å; D619-R658 IonicContact OD2-NH2 2.7Å; D619-R658 PolarHBondContact OD2-NH2 2.67Å
620	L	91.3	Very high	88.7	Confident	88 Å²	88	52.3 Å²	52.3	46%	0.461	27%	0.265	S	S	.	.	H	α-helix	trans	-61.2	-45.1	174.9	-66.4	174.7	0	0	0	111.3	P580 L618 Q624	P580-L620 HydrophobicContact CB-CB 4.06Å; P580-L620 HydrophobicContact CG-CB 4.17Å; L618-L620 VanDerWaalsContact C-N 3.31Å; L618-L620 PolarHBondContact O-N 3.21Å; L620-Q624 WeakPolarHBondContact O-CB 3.09Å; L620-Q624 VanDerWaalsContact O-CG 3.23Å; L620-Q624 WeakPolarHBondContact O-CG 3.45Å; L620-Q624 PolarHBondContact O-N 2.87Å
621	L	92	Very high	89.2	Confident	1 Å²	1	53.4 Å²	53.4	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-63.8	-48.6	176.3	178.8	61.3	0	0	0	111.9	L579 L583 P600 Y608 H617 L618 S623 Q624 I625 L648	L579-L621 HydrophobicContact CD2-CD1 4.43Å; L583-L621 HydrophobicContact CD1-CD1 3.85Å; P600-L621 HydrophobicContact CG-CD2 4.46Å; Y608-L621 HydrophobicContact CE2-CD2 4.46Å; Y608-L621 WeakPolarHBondContact OH-CD2 3.35Å; H617-L621 WeakPolarHBondContact O-CB 3.25Å; H617-L621 PolarHBondContact O-N 3.16Å; L618-L621 PolarHBondContact O-N 3.49Å; L621-S623 VanDerWaalsContact C-N 3.34Å; L621-S623 PolarHBondContact O-N 3.01Å; L621-Q624 PolarHBondContact O-N 3.3Å; L621-I625 HydrophobicContact CD1-CD1 3.95Å; L621-I625 HydrophobicContact CD1-CG1 4.17Å; L621-I625 HydrophobicContact CG-CD1 3.84Å; L621-I625 HydrophobicContact CG-CG1 4.49Å; L621-I625 WeakPolarHBondContact O-CD1 3.49Å; L621-I625 VanDerWaalsContact O-CG1 3.26Å; L621-I625 WeakPolarHBondContact O-CG1 3.45Å; L621-I625 PolarHBondContact O-N 3.43Å; L621-L648 HydrophobicContact CD2-CD1 4.44Å
622	L	93.3	Very high	89.7	Confident	2 Å²	2	52.7 Å²	52.7	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-60.6	-42.4	179.5	-69.5	174.2	0	0	0	111.8	L618 D619 C626 L648 R658 A659 V662 F663	L618-L622 HydrophobicContact CD1-CD1 4.38Å; L618-L622 HydrophobicContact CD1-CG 4.31Å; L618-L622 HydrophobicContact CG-CD1 3.99Å; L618-L622 HydrophobicContact CG-CG 4.34Å; L618-L622 WeakPolarHBondContact O-CB 3.41Å; L618-L622 VanDerWaalsContact O-CG 3.3Å; L618-L622 WeakPolarHBondContact O-CG 3.21Å; L618-L622 PolarHBondContact O-N 3Å; D619-L622 PolarHBondContact O-N 2.85Å; L622-C626 PolarHBondContact O-N 3.15Å; L622-C626 VanDerWaalsContact O-N 3.14Å; L622-C626 PolarHBondContact O-SG 3.06Å; L622-L648 HydrophobicContact CD2-CD1 4.04Å; L622-R658 HydrophobicContact CD1-CG 4.43Å; L622-A659 HydrophobicContact CD2-CB 3.97Å; L622-V662 HydrophobicContact CB-CG1 4.27Å; L622-V662 HydrophobicContact CD1-CG2 4.45Å; L622-F663 HydrophobicContact CD2-CD2 4.47Å; L622-F663 HydrophobicContact CD2-CE1 4.47Å; L622-F663 HydrophobicContact CD2-CE2 3.47Å; L622-F663 VanDerWaalsContact CD2-CE2 3.47Å; L622-F663 HydrophobicContact CD2-CZ 3.47Å; L622-F663 VanDerWaalsContact CD2-CZ 3.47Å
623	S	92.6	Very high	90.4	Very high	70 Å²	70	45.7 Å²	45.7	49%	0.49	22%	0.223	S	C	.	.	H	α-helix	trans	-66.2	-42.5	176.4	-174.6	0	0	0	0	112.4	D619 L621 C626 T627	D619-S623 WeakPolarHBondContact O-CB 3.49Å; D619-S623 PolarHBondContact O-N 3.25Å; L621-S623 VanDerWaalsContact C-N 3.34Å; L621-S623 PolarHBondContact O-N 3.01Å; S623-C626 PolarHBondContact O-N 3.03Å; S623-T627 WeakPolarHBondContact O-CB 3.27Å; S623-T627 PolarHBondContact O-N 2.98Å; S623-T627 PolarHBondContact O-OG1 3.3Å
624	Q	92.5	Very high	91.2	Very high	38 Å²	38	41.9 Å²	41.9	18%	0.178	21%	0.212	C	C	.	.	H	α-helix	trans	-62.7	-46.7	174.6	-73.8	-68.8	5.9	0	0	111.3	L583 L620 L621 C626 T627 I628	L583-Q624 HydrophobicContact CD1-CB 4.43Å; L620-Q624 WeakPolarHBondContact O-CB 3.09Å; L620-Q624 VanDerWaalsContact O-CG 3.23Å; L620-Q624 WeakPolarHBondContact O-CG 3.45Å; L620-Q624 PolarHBondContact O-N 2.87Å; L621-Q624 PolarHBondContact O-N 3.3Å; Q624-C626 VanDerWaalsContact C-N 3.31Å; Q624-C626 PolarHBondContact O-N 3.46Å; Q624-T627 CarbonylContact O-C 3.6Å; Q624-T627 WeakPolarHBondContact O-CA 3.42Å; Q624-T627 WeakPolarHBondContact O-CB 3.47Å; Q624-T627 PolarHBondContact O-N 3.11Å; Q624-I628 HydrophobicContact CB-CD1 4.35Å; Q624-I628 VanDerWaalsContact O-CD1 3.3Å; Q624-I628 WeakPolarHBondContact O-CD1 3.48Å; Q624-I628 WeakPolarHBondContact O-CG1 3.44Å; Q624-I628 PolarHBondContact O-N 2.75Å
625	I	93.6	Very high	91.7	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-56.2	-45.2	177.1	-64.5	160.2	0	0	0	111	L621 T627 I628 V629 L644 V645 L648 F663	L621-I625 HydrophobicContact CD1-CD1 3.95Å; L621-I625 HydrophobicContact CD1-CG1 4.17Å; L621-I625 HydrophobicContact CG-CD1 3.84Å; L621-I625 HydrophobicContact CG-CG1 4.49Å; L621-I625 WeakPolarHBondContact O-CD1 3.49Å; L621-I625 VanDerWaalsContact O-CG1 3.26Å; L621-I625 WeakPolarHBondContact O-CG1 3.45Å; L621-I625 PolarHBondContact O-N 3.43Å; I625-T627 VanDerWaalsContact C-N 3.33Å; I625-T627 PolarHBondContact O-N 2.79Å; I625-I628 PolarHBondContact O-N 3.32Å; I625-V629 WeakPolarHBondContact O-CG2 3.29Å; I625-V629 PolarHBondContact O-N 3.43Å; I625-L644 HydrophobicContact CD1-CD2 3.55Å; I625-L644 HydrophobicContact CD1-CG 3.87Å; I625-L644 HydrophobicContact CG1-CD2 3.99Å; I625-V645 HydrophobicContact CG2-CG2 4.22Å; I625-L648 HydrophobicContact CD1-CD1 3.68Å; I625-F663 HydrophobicContact CB-CE1 4.05Å; I625-F663 HydrophobicContact CB-CZ 4.19Å; I625-F663 HydrophobicContact CD1-CZ 4.02Å; I625-F663 HydrophobicContact CG2-CE1 3.63Å; I625-F663 HydrophobicContact CG2-CZ 3.91Å
626	C	94.3	Very high	92.2	Very high	16 Å²	16	42.8 Å²	42.8	11%	0.108	23%	0.234	C	C	.	.	H	α-helix	trans	-62.4	-39.8	176.3	-63.9	0	0	0	0	112.4	L622 S623 Q624 K630 V662 L666	L622-C626 PolarHBondContact O-N 3.15Å; L622-C626 VanDerWaalsContact O-N 3.14Å; L622-C626 PolarHBondContact O-SG 3.06Å; S623-C626 PolarHBondContact O-N 3.03Å; Q624-C626 VanDerWaalsContact C-N 3.31Å; Q624-C626 PolarHBondContact O-N 3.46Å; C626-K630 WeakPolarHBondContact O-CB 3.42Å; C626-K630 VanDerWaalsContact O-CG 3.28Å; C626-K630 WeakPolarHBondContact O-CG 3.42Å; C626-K630 PolarHBondContact O-N 2.78Å; C626-K630 VanDerWaalsContact O-N 3.08Å; C626-V662 WeakPolarHBondContact SG-CG1 3.45Å; C626-L666 HydrophobicContact CB-CD1 4.28Å; C626-L666 HydrophobicContact CB-CD2 4.33Å
627	T	94.1	Very high	92.7	Very high	52 Å²	52	36.8 Å²	36.8	32%	0.319	21%	0.208	S	C	.	.	H	α-helix	trans	-65.7	-40.6	176.7	-57.4	0	0	0	0	111.7	S623 Q624 I625 K630 K631	S623-T627 WeakPolarHBondContact O-CB 3.27Å; S623-T627 PolarHBondContact O-N 2.98Å; S623-T627 PolarHBondContact O-OG1 3.3Å; Q624-T627 CarbonylContact O-C 3.6Å; Q624-T627 WeakPolarHBondContact O-CA 3.42Å; Q624-T627 WeakPolarHBondContact O-CB 3.47Å; Q624-T627 PolarHBondContact O-N 3.11Å; I625-T627 VanDerWaalsContact C-N 3.33Å; I625-T627 PolarHBondContact O-N 2.79Å; T627-K630 PolarHBondContact O-N 3.15Å; T627-K631 HydrophobicContact CG2-CD 4.36Å; T627-K631 WeakPolarHBondContact O-CG 3.44Å; T627-K631 PolarHBondContact O-N 3.11Å
628	I	94.6	Very high	93	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-66.5	-47.2	179	-64	156.3	0	0	0	110.3	L583 M593 L597 Q624 I625 K630 K631 H632 V637	L583-I628 HydrophobicContact CB-CD1 4.45Å; L583-I628 HydrophobicContact CD2-CD1 4.15Å; M593-I628 HydrophobicContact CE-CD1 3.26Å; M593-I628 HydrophobicContact CE-CG1 3.56Å; M593-I628 HydrophobicContact CE-CG2 4.14Å; L597-I628 HydrophobicContact CD1-CG2 4.3Å; L597-I628 HydrophobicContact CD2-CD1 4.18Å; Q624-I628 HydrophobicContact CB-CD1 4.35Å; Q624-I628 VanDerWaalsContact O-CD1 3.3Å; Q624-I628 WeakPolarHBondContact O-CD1 3.48Å; Q624-I628 WeakPolarHBondContact O-CG1 3.44Å; Q624-I628 PolarHBondContact O-N 2.75Å; I625-I628 PolarHBondContact O-N 3.32Å; I628-K630 VanDerWaalsContact C-N 3.28Å; I628-K630 PolarHBondContact O-N 3.01Å; I628-K631 PolarHBondContact O-N 3.4Å; I628-K631 VanDerWaalsContact O-N 3.15Å; I628-H632 PolarHBondContact O-CD2 3.22Å; I628-H632 PolarHBondContact O-N 3.47Å; I628-V637 HydrophobicContact CG2-CG1 3.67Å
629	V	94.8	Very high	93.1	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-60.2	-37.1	175.4	173.5	0	0	0	0	111.8	I625 L638 C641 L666 L670 R700 L704	I625-V629 WeakPolarHBondContact O-CG2 3.29Å; I625-V629 PolarHBondContact O-N 3.43Å; V629-L638 HydrophobicContact CB-CD2 4.47Å; V629-L638 HydrophobicContact CG1-CD2 4.15Å; V629-L638 HydrophobicContact CG2-CD2 4.4Å; V629-C641 HydrophobicContact CG2-CB 3.69Å; V629-L666 HydrophobicContact CB-CD2 4.2Å; V629-L666 HydrophobicContact CG1-CD2 4.12Å; V629-L666 HydrophobicContact CG2-CD2 4.5Å; V629-L670 HydrophobicContact CG1-CD1 4.29Å; V629-R700 HydrophobicContact CG1-CB 4.16Å; V629-R700 HydrophobicContact CG1-CG 4.28Å; V629-R700 WeakPolarHBondContact O-CD 3.4Å; V629-R700 WeakPolarHBondContact O-CG 3.32Å; V629-R700 PolarHBondContact O-NE 2.99Å; V629-L704 HydrophobicContact CG1-CD1 4.29Å
630	K	92.9	Very high	93.4	Very high	91 Å²	91	39.5 Å²	39.5	40%	0.396	22%	0.221	S	C	.	.	H	α-helix	trans	-70.3	-31.6	175.6	-74.7	175.9	180	-173.2	0	113.7	C626 T627 I628 L666 E669 R700	C626-K630 WeakPolarHBondContact O-CB 3.42Å; C626-K630 VanDerWaalsContact O-CG 3.28Å; C626-K630 WeakPolarHBondContact O-CG 3.42Å; C626-K630 PolarHBondContact O-N 2.78Å; C626-K630 VanDerWaalsContact O-N 3.08Å; T627-K630 PolarHBondContact O-N 3.15Å; I628-K630 VanDerWaalsContact C-N 3.28Å; I628-K630 PolarHBondContact O-N 3.01Å; K630-L666 HydrophobicContact CD-CD1 4.33Å; K630-L666 HydrophobicContact CG-CD1 3.94Å; K630-E669 WeakPolarHBondContact CE-OE2 3.44Å; K630-E669 IonicContact NZ-OE1 2.7Å; K630-E669 PolarHBondContact NZ-OE1 3.19Å; K630-E669 VanDerWaalsContact NZ-OE1 3.12Å; K630-E669 IonicContact NZ-OE2 3.42Å; K630-E669 PolarHBondContact NZ-OE2 2.75Å; K630-R700 VanDerWaalsContact O-CZ 3.22Å; K630-R700 PolarHBondContact O-NH2 3.18Å; K630-R700 VanDerWaalsContact O-NH2 3.09Å
631	K	91.9	Very high	93.6	Very high	114 Å²	114	35.3 Å²	35.3	50%	0.496	20%	0.199	S	C	.	.	H	α-helix	trans	-80.4	-46.5	178.8	-76.2	-178.8	178	-170.5	0	112.8	S587 T627 I628 R700	S587-K631 PolarHBondContact OG-NZ 2.72Å; T627-K631 HydrophobicContact CG2-CD 4.36Å; T627-K631 WeakPolarHBondContact O-CG 3.44Å; T627-K631 PolarHBondContact O-N 3.11Å; I628-K631 PolarHBondContact O-N 3.4Å; I628-K631 VanDerWaalsContact O-N 3.15Å; K631-R700 PolarHBondContact O-NH2 2.87Å
632	H	94.1	Very high	93.6	Very high	17 Å²	17	35.4 Å²	35.4	8%	0.079	20%	0.2	C	C	.	.			trans	-88.3	155.5	-167.2	-76.9	-92.5	0	0	0	113.7	S587 I628 V637 R700	S587-H632 PolarHBondContact O-NE2 3.15Å; I628-H632 PolarHBondContact O-CD2 3.22Å; I628-H632 PolarHBondContact O-N 3.47Å; H632-V637 HydrophobicContact CB-CB 4.4Å; H632-V637 HydrophobicContact CB-CG1 3.84Å; H632-R700 PolarHBondContact O-NE 2.96Å; H632-R700 PolarHBondContact O-NH2 3.26Å; H632-R700 VanDerWaalsContact O-NH2 3.09Å
633	T	92.7	Very high	93.7	Very high	34 Å²	34	39.9 Å²	39.9	21%	0.209	22%	0.223	C	C	.	.			trans	-127.8	-0.5	168.4	54.6	0	0	0	0	112.1	K699	T633-K699 VanDerWaalsContact O-CD 3.32Å; T633-K699 WeakPolarHBondContact O-CD 3.39Å; T633-K699 WeakPolarHBondContact O-CE 3.42Å; T633-K699 PolarHBondContact O-NZ 2.83Å
634	D	94.4	Very high	93.7	Very high	57 Å²	57	36.6 Å²	36.6	31%	0.305	20%	0.2	S	C	.	.			trans	-65.3	143.7	177.2	169	-108.2	0	0	0	112.5	A590 A636 V637 L638	A590-D634 HydrophobicContact CB-CB 4.11Å; D634-A636 WeakPolarHBondContact OD1-CA 3.36Å; D634-A636 WeakPolarHBondContact OD1-CB 3.4Å; D634-A636 PolarHBondContact OD1-N 3.04Å; D634-A636 PolarHBondContact OD2-N 3.01Å; D634-V637 HydrophobicContact CB-CB 4.33Å; D634-V637 HydrophobicContact CB-CG2 4.3Å; D634-V637 WeakPolarHBondContact OD1-CG2 3.24Å; D634-V637 PolarHBondContact OD1-N 2.93Å; D634-L638 VanDerWaalsContact O-CB 3.26Å; D634-L638 WeakPolarHBondContact O-CB 3.35Å; D634-L638 WeakPolarHBondContact O-CD1 3.32Å; D634-L638 WeakPolarHBondContact O-CG 3.42Å; D634-L638 PolarHBondContact O-N 2.83Å; D634-L638 VanDerWaalsContact O-N 3.13Å
635	A	91.3	Very high	93.7	Very high	53 Å²	53	34.8 Å²	34.8	44%	0.438	19%	0.192	S	C	.	.	H	α-helix	trans	-72	-34.3	-178	0	0	0	0	0	113.5	Q639	A635-Q639 VanDerWaalsContact O-CB 3.3Å; A635-Q639 WeakPolarHBondContact O-CB 3.26Å; A635-Q639 WeakPolarHBondContact O-CG 3.32Å; A635-Q639 PolarHBondContact O-N 3.39Å; A635-Q639 VanDerWaalsContact O-N 3.11Å; A635-Q639 PolarHBondContact O-NE2 3.42Å
636	A	92.8	Very high	93.6	Very high	48 Å²	48	37.4 Å²	37.4	40%	0.397	21%	0.21	S	C	.	.	H	α-helix	trans	-76.4	-45.7	-179.1	0	0	0	0	0	111.5	D634 Q639 A640	D634-A636 WeakPolarHBondContact OD1-CA 3.36Å; D634-A636 WeakPolarHBondContact OD1-CB 3.4Å; D634-A636 PolarHBondContact OD1-N 3.04Å; D634-A636 PolarHBondContact OD2-N 3.01Å; A636-Q639 PolarHBondContact O-N 2.7Å; A636-A640 WeakPolarHBondContact O-CB 3.46Å; A636-A640 PolarHBondContact O-N 2.99Å
637	V	95.8	Very high	93.5	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-58.3	-48.4	173.4	175.3	0	0	0	0	110.9	A590 M593 L597 I628 H632 D634 Q639 A640 C641	A590-V637 HydrophobicContact CB-CG2 4.06Å; A590-V637 WeakPolarHBondContact O-CG2 3.36Å; M593-V637 HydrophobicContact CB-CG2 4.3Å; L597-V637 HydrophobicContact CD1-CG1 3.92Å; I628-V637 HydrophobicContact CG2-CG1 3.67Å; H632-V637 HydrophobicContact CB-CB 4.4Å; H632-V637 HydrophobicContact CB-CG1 3.84Å; D634-V637 HydrophobicContact CB-CB 4.33Å; D634-V637 HydrophobicContact CB-CG2 4.3Å; D634-V637 WeakPolarHBondContact OD1-CG2 3.24Å; D634-V637 PolarHBondContact OD1-N 2.93Å; V637-Q639 PolarHBondContact O-N 2.94Å; V637-A640 PolarHBondContact O-N 3.19Å; V637-C641 WeakPolarHBondContact O-CB 3.46Å; V637-C641 PolarHBondContact O-N 3.04Å
638	L	94.9	Very high	93.4	Very high	5 Å²	5	36 Å²	36	3%	0.026	20%	0.201	C	C	.	.	H	α-helix	trans	-67.6	-34.3	-179.5	-69.7	176.1	0	0	0	112.7	V629 D634 A642 K699 R700 A703	V629-L638 HydrophobicContact CB-CD2 4.47Å; V629-L638 HydrophobicContact CG1-CD2 4.15Å; V629-L638 HydrophobicContact CG2-CD2 4.4Å; D634-L638 VanDerWaalsContact O-CB 3.26Å; D634-L638 WeakPolarHBondContact O-CB 3.35Å; D634-L638 WeakPolarHBondContact O-CD1 3.32Å; D634-L638 WeakPolarHBondContact O-CG 3.42Å; D634-L638 PolarHBondContact O-N 2.83Å; D634-L638 VanDerWaalsContact O-N 3.13Å; L638-A642 WeakPolarHBondContact O-CB 3.33Å; L638-A642 PolarHBondContact O-N 3.19Å; L638-K699 HydrophobicContact CD1-CG 4.35Å; L638-R700 HydrophobicContact CD1-CG 4.12Å; L638-R700 HydrophobicContact CD2-CG 4.01Å; L638-A703 HydrophobicContact CB-CB 3.74Å
639	Q	93.1	Very high	93.2	Very high	129 Å²	129	36.9 Å²	36.9	60%	0.603	21%	0.207	S	C	*	.	H	α-helix	trans	-68.5	-41.6	172.3	-78.3	172.1	66.5	0	0	112.6	A635 A636 V637 A642 L643	A635-Q639 VanDerWaalsContact O-CB 3.3Å; A635-Q639 WeakPolarHBondContact O-CB 3.26Å; A635-Q639 WeakPolarHBondContact O-CG 3.32Å; A635-Q639 PolarHBondContact O-N 3.39Å; A635-Q639 VanDerWaalsContact O-N 3.11Å; A635-Q639 PolarHBondContact O-NE2 3.42Å; A636-Q639 PolarHBondContact O-N 2.7Å; V637-Q639 PolarHBondContact O-N 2.94Å; Q639-A642 PolarHBondContact O-N 2.97Å; Q639-L643 PolarHBondContact O-N 3.06Å
640	A	93.9	Very high	93	Very high	14 Å²	14	39 Å²	39	12%	0.116	22%	0.222	C	C	.	.	H	α-helix	trans	-62.9	-42.9	175.6	0	0	0	0	0	111.3	L597 A636 V637 L643 L644	L597-A640 HydrophobicContact CB-CB 3.71Å; L597-A640 HydrophobicContact CD1-CB 4.02Å; A636-A640 WeakPolarHBondContact O-CB 3.46Å; A636-A640 PolarHBondContact O-N 2.99Å; V637-A640 PolarHBondContact O-N 3.19Å; A640-L643 PolarHBondContact O-N 3.42Å; A640-L644 WeakPolarHBondContact O-CB 3.22Å; A640-L644 PolarHBondContact O-N 3.02Å
641	C	95.1	Very high	92.5	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-57.8	-47.1	170	-80.5	0	0	0	0	112.2	L597 V629 V637 L643 L644 V645	L597-C641 VanDerWaalsContact CD1-SG 3.55Å; V629-C641 HydrophobicContact CG2-CB 3.69Å; V637-C641 WeakPolarHBondContact O-CB 3.46Å; V637-C641 PolarHBondContact O-N 3.04Å; C641-L643 PolarHBondContact O-N 2.88Å; C641-L644 PolarHBondContact O-N 2.6Å; C641-V645 WeakPolarHBondContact O-CB 3.46Å; C641-V645 VanDerWaalsContact O-CG2 3.23Å; C641-V645 WeakPolarHBondContact O-CG2 3.2Å; C641-V645 PolarHBondContact O-N 2.95Å
642	A	93.9	Very high	92.1	Very high	3 Å²	3	41.6 Å²	41.6	3%	0.025	25%	0.245	C	C	.	.	H	α-helix	trans	-62.4	-43.6	179.6	0	0	0	0	0	112.7	L638 Q639 L644 V645 S646 A703 A707	L638-A642 WeakPolarHBondContact O-CB 3.33Å; L638-A642 PolarHBondContact O-N 3.19Å; Q639-A642 PolarHBondContact O-N 2.97Å; A642-L644 VanDerWaalsContact C-N 3.34Å; A642-L644 PolarHBondContact O-N 3.39Å; A642-V645 PolarHBondContact O-N 3.41Å; A642-S646 PolarHBondContact O-N 3.37Å; A642-A703 VanDerWaalsContact CB-O 3.28Å; A642-A703 WeakPolarHBondContact CB-O 3.32Å; A642-A707 HydrophobicContact CB-CB 4.13Å; A642-A707 WeakPolarHBondContact O-CB 3.36Å
643	L	93.5	Very high	91.8	Very high	96 Å²	96	42 Å²	42	50%	0.503	25%	0.247	S	C	.	.	H	α-helix	trans	-62.4	-40.8	175.7	-179.8	57.6	0	0	0	111.7	L601 Q639 A640 C641 S646 T647	L601-L643 HydrophobicContact CD1-CD2 3.58Å; L601-L643 HydrophobicContact CD1-CG 3.93Å; L601-L643 HydrophobicContact CD2-CG 4.26Å; Q639-L643 PolarHBondContact O-N 3.06Å; A640-L643 PolarHBondContact O-N 3.42Å; C641-L643 PolarHBondContact O-N 2.88Å; L643-S646 PolarHBondContact O-N 3.48Å; L643-T647 PolarHBondContact O-N 2.86Å; L643-T647 PolarHBondContact O-OG1 3.32Å
644	L	92.9	Very high	91.6	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-68	-41.3	176.1	-176.3	52.5	0	0	0	112.1	L597 P600 L601 I625 A640 C641 A642 T647 L648	L597-L644 HydrophobicContact CD2-CD2 4.17Å; P600-L644 HydrophobicContact CB-CD1 3.67Å; P600-L644 HydrophobicContact CG-CD1 4.13Å; P600-L644 HydrophobicContact CG-CD2 4.07Å; L601-L644 HydrophobicContact CD2-CD1 4.21Å; I625-L644 HydrophobicContact CD1-CD2 3.55Å; I625-L644 HydrophobicContact CD1-CG 3.87Å; I625-L644 HydrophobicContact CG1-CD2 3.99Å; A640-L644 WeakPolarHBondContact O-CB 3.22Å; A640-L644 PolarHBondContact O-N 3.02Å; C641-L644 PolarHBondContact O-N 2.6Å; A642-L644 VanDerWaalsContact C-N 3.34Å; A642-L644 PolarHBondContact O-N 3.39Å; L644-T647 PolarHBondContact O-N 2.89Å; L644-T647 VanDerWaalsContact O-N 3.15Å; L644-L648 HydrophobicContact CD1-CD1 3.9Å; L644-L648 HydrophobicContact CD1-CG 3.96Å; L644-L648 HydrophobicContact CG-CD1 3.91Å; L644-L648 HydrophobicContact CG-CG 4.42Å; L644-L648 WeakPolarHBondContact O-CG 3.46Å; L644-L648 PolarHBondContact O-N 3.29Å
645	V	92.9	Very high	91.4	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-58.4	-47	172.1	167.1	0	0	0	0	110.9	I625 C641 A642 T647 L648 C649 F663 L704	I625-V645 HydrophobicContact CG2-CG2 4.22Å; C641-V645 WeakPolarHBondContact O-CB 3.46Å; C641-V645 VanDerWaalsContact O-CG2 3.23Å; C641-V645 WeakPolarHBondContact O-CG2 3.2Å; C641-V645 PolarHBondContact O-N 2.95Å; A642-V645 PolarHBondContact O-N 3.41Å; V645-T647 PolarHBondContact O-N 3.08Å; V645-L648 PolarHBondContact O-N 3.1Å; V645-C649 WeakPolarHBondContact O-CB 3.11Å; V645-C649 PolarHBondContact O-N 2.87Å; V645-C649 PolarHBondContact O-SG 3.44Å; V645-F663 HydrophobicContact CB-CD2 4.33Å; V645-F663 HydrophobicContact CB-CE2 4.38Å; V645-F663 HydrophobicContact CG1-CB 4.23Å; V645-F663 HydrophobicContact CG1-CD2 3.88Å; V645-F663 HydrophobicContact CG1-CE2 4.41Å; V645-F663 HydrophobicContact CG1-CG 4.03Å; V645-F663 HydrophobicContact CG2-CD1 3.85Å; V645-F663 HydrophobicContact CG2-CD2 3.96Å; V645-F663 HydrophobicContact CG2-CE1 3.75Å; V645-F663 HydrophobicContact CG2-CE2 3.86Å; V645-F663 HydrophobicContact CG2-CG 3.96Å; V645-F663 HydrophobicContact CG2-CZ 3.75Å; V645-L704 HydrophobicContact CB-CD2 4.44Å; V645-L704 HydrophobicContact CG1-CD2 4.41Å; V645-L704 HydrophobicContact CG2-CD2 4Å
646	S	92.1	Very high	91.4	Very high	54 Å²	54	41.8 Å²	41.8	38%	0.378	24%	0.243	S	C	.	.	H	α-helix	trans	-58.8	-36.6	175.6	-171.2	0	0	0	0	112.5	A642 L643 S650	A642-S646 PolarHBondContact O-N 3.37Å; L643-S646 PolarHBondContact O-N 3.48Å; S646-S650 PolarHBondContact O-N 2.78Å
647	T	92.1	Very high	91.3	Very high	40 Å²	40	43.6 Å²	43.6	25%	0.245	25%	0.253	C	S	.	.	H	α-helix	trans	-75.7	-46.7	-177.9	-51.8	0	0	0	0	111.1	L601 L605 L643 L644 V645 C649 S650	L601-T647 HydrophobicContact CD2-CG2 4.36Å; L605-T647 HydrophobicContact CD1-CG2 3.68Å; L643-T647 PolarHBondContact O-N 2.86Å; L643-T647 PolarHBondContact O-OG1 3.32Å; L644-T647 PolarHBondContact O-N 2.89Å; L644-T647 VanDerWaalsContact O-N 3.15Å; V645-T647 PolarHBondContact O-N 3.08Å; T647-C649 VanDerWaalsContact C-N 3.29Å; T647-C649 PolarHBondContact O-N 3.13Å; T647-S650 VanDerWaalsContact O-CB 3.24Å; T647-S650 WeakPolarHBondContact O-CB 3.27Å; T647-S650 PolarHBondContact O-N 2.95Å; T647-S650 VanDerWaalsContact O-N 3.14Å
648	L	91.5	Very high	91	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-68.9	-25.2	178.2	-65.1	171.6	0	0	0	113.1	L605 L621 L622 I625 L644 V645 S650 F655 A659 F663	L605-L648 HydrophobicContact CD1-CD2 4.37Å; L605-L648 HydrophobicContact CD2-CD2 4.37Å; L621-L648 HydrophobicContact CD2-CD1 4.44Å; L622-L648 HydrophobicContact CD2-CD1 4.04Å; I625-L648 HydrophobicContact CD1-CD1 3.68Å; L644-L648 HydrophobicContact CD1-CD1 3.9Å; L644-L648 HydrophobicContact CD1-CG 3.96Å; L644-L648 HydrophobicContact CG-CD1 3.91Å; L644-L648 HydrophobicContact CG-CG 4.42Å; L644-L648 WeakPolarHBondContact O-CG 3.46Å; L644-L648 PolarHBondContact O-N 3.29Å; V645-L648 PolarHBondContact O-N 3.1Å; L648-S650 VanDerWaalsContact C-N 3.34Å; L648-F655 HydrophobicContact CB-CE2 4.36Å; L648-F655 HydrophobicContact CD2-CE2 3.78Å; L648-F655 HydrophobicContact CD2-CZ 4.01Å; L648-A659 HydrophobicContact CB-CB 4.14Å; L648-A659 WeakPolarHBondContact O-CB 3.45Å; L648-F663 HydrophobicContact CB-CE2 4.43Å; L648-F663 HydrophobicContact CD1-CE2 4.34Å; L648-F663 HydrophobicContact CD1-CZ 4.44Å
649	C	91	Very high	90.9	Very high	18 Å²	18	47.3 Å²	47.3	12%	0.122	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	6.3	172.9	-65.3	0	0	0	0	113.9	V645 T647 H660	V645-C649 WeakPolarHBondContact O-CB 3.11Å; V645-C649 PolarHBondContact O-N 2.87Å; V645-C649 PolarHBondContact O-SG 3.44Å; T647-C649 VanDerWaalsContact C-N 3.29Å; T647-C649 PolarHBondContact O-N 3.13Å; C649-H660 PolarHBondContact O-CE1 3.06Å; C649-H660 PolarHBondContact O-NE2 3.18Å
650	S	89.2	Confident	90.8	Very high	46 Å²	46	44.7 Å²	44.7	32%	0.322	25%	0.254	S	S	.	.			trans	-71.9	132.3	178.3	178.2	0	0	0	0	111.6	S646 T647 L648 S652 H653 S656	S646-S650 PolarHBondContact O-N 2.78Å; T647-S650 VanDerWaalsContact O-CB 3.24Å; T647-S650 WeakPolarHBondContact O-CB 3.27Å; T647-S650 PolarHBondContact O-N 2.95Å; T647-S650 VanDerWaalsContact O-N 3.14Å; L648-S650 VanDerWaalsContact C-N 3.34Å; S650-S652 WeakPolarHBondContact CB-OG 3.45Å; S650-S652 PolarHBondContact O-N 3.14Å; S650-S652 PolarHBondContact OG-N 3.04Å; S650-S652 PolarHBondContact OG-OG 2.63Å; S650-H653 PolarHBondContact O-N 2.88Å; S650-S656 WeakPolarHBondContact O-CB 3.25Å
651	E	84.1	Confident	90.8	Very high	182 Å²	182	48.9 Å²	48.9	85%	0.85	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-11.1	175.1	-64	-174.1	166.9	0	0	113.7	H653	E651-H653 PolarHBondContact O-N 3.22Å
652	S	83.8	Confident	90.7	Very high	76 Å²	76	50.7 Å²	50.7	53%	0.531	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-25.3	171	50.4	0	0	0	0	113.9	S650	S650-S652 WeakPolarHBondContact CB-OG 3.45Å; S650-S652 PolarHBondContact O-N 3.14Å; S650-S652 PolarHBondContact OG-N 3.04Å; S650-S652 PolarHBondContact OG-OG 2.63Å
653	H	86.9	Confident	90.7	Very high	26 Å²	26	50.6 Å²	50.6	12%	0.12	28%	0.284	C	S	.	.	S	Bend	trans	-109.5	136.8	-171.8	-57.8	-55.5	0	0	0	112.5	D606 S650 E651 F655 S656	D606-H653 IonicContact OD1-CE1 2.8Å; D606-H653 IonicContact OD1-CG 3.73Å; D606-H653 IonicContact OD1-ND1 3.91Å; D606-H653 PolarHBondContact OD1-ND1 3.1Å; S650-H653 PolarHBondContact O-N 2.88Å; E651-H653 PolarHBondContact O-N 3.22Å; H653-F655 HydrophobicContact CB-CD1 4.11Å; H653-F655 HydrophobicContact CB-CE1 3.69Å; H653-F655 HydrophobicContact CB-CE2 4.16Å; H653-F655 HydrophobicContact CB-CZ 3.71Å; H653-F655 AromaticContact CG-CZ 3.96Å; H653-F655 PolarHBondContact O-N 3.46Å; H653-S656 VanDerWaalsContact O-CB 3.22Å; H653-S656 WeakPolarHBondContact O-CB 3.46Å; H653-S656 PolarHBondContact O-N 3.44Å; H653-S656 VanDerWaalsContact O-N 3.1Å; H653-S656 PolarHBondContact O-OG 2.89Å
654	T	88.3	Confident	90.7	Very high	112 Å²	112	46.7 Å²	46.7	69%	0.687	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-21.4	-176.7	45.8	0	0	0	0	113.9	S609	S609-T654 VanDerWaalsContact CB-OG1 3.25Å; S609-T654 WeakPolarHBondContact CB-OG1 3.39Å; S609-T654 PolarHBondContact OG-OG1 3.42Å
655	F	90	Very high	90.8	Very high	9 Å²	9	51.5 Å²	51.5	4%	0.039	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-0.9	174.8	62.9	-100.7	0	0	0	114.5	L605 L618 L648 H653 S657 R658 A659	L605-F655 HydrophobicContact CB-CZ 4.3Å; L605-F655 WeakPolarHBondContact O-CE1 3.42Å; L618-F655 HydrophobicContact CD1-CD2 4.1Å; L618-F655 HydrophobicContact CD1-CE2 4.12Å; L618-F655 HydrophobicContact CD2-CB 3.55Å; L618-F655 HydrophobicContact CD2-CD1 4.19Å; L618-F655 HydrophobicContact CD2-CD2 3.73Å; L618-F655 HydrophobicContact CD2-CG 3.55Å; L648-F655 HydrophobicContact CB-CE2 4.36Å; L648-F655 HydrophobicContact CD2-CE2 3.78Å; L648-F655 HydrophobicContact CD2-CZ 4.01Å; H653-F655 HydrophobicContact CB-CD1 4.11Å; H653-F655 HydrophobicContact CB-CE1 3.69Å; H653-F655 HydrophobicContact CB-CE2 4.16Å; H653-F655 HydrophobicContact CB-CZ 3.71Å; H653-F655 AromaticContact CG-CZ 3.96Å; H653-F655 PolarHBondContact O-N 3.46Å; F655-S657 PolarHBondContact O-N 3.24Å; F655-S657 VanDerWaalsContact O-N 3.13Å; F655-R658 VanDerWaalsContact O-CB 3.25Å; F655-R658 WeakPolarHBondContact O-CB 3.46Å; F655-R658 PolarHBondContact O-N 2.98Å; F655-A659 PolarHBondContact O-N 3.42Å
656	S	90.9	Very high	90.9	Very high	18 Å²	18	51.6 Å²	51.6	13%	0.126	29%	0.287	C	S	.	.	H	α-helix	trans	-52.3	-37.5	-173.9	51.1	0	0	0	0	114.1	S650 H653 R658 A659 H660	S650-S656 WeakPolarHBondContact O-CB 3.25Å; H653-S656 VanDerWaalsContact O-CB 3.22Å; H653-S656 WeakPolarHBondContact O-CB 3.46Å; H653-S656 PolarHBondContact O-N 3.44Å; H653-S656 VanDerWaalsContact O-N 3.1Å; H653-S656 PolarHBondContact O-OG 2.89Å; S656-R658 VanDerWaalsContact C-N 3.32Å; S656-R658 PolarHBondContact O-N 3.13Å; S656-A659 PolarHBondContact O-N 2.68Å; S656-H660 WeakPolarHBondContact O-CB 3.44Å; S656-H660 PolarHBondContact O-CD2 3.2Å; S656-H660 PolarHBondContact O-N 3.09Å
657	S	90.8	Very high	91	Very high	87 Å²	87	49.1 Å²	49.1	61%	0.608	27%	0.27	S	S	*	.	H	α-helix	trans	-61.2	-34.5	176.1	58	0	0	0	0	113.8	F655 L661	F655-S657 PolarHBondContact O-N 3.24Å; F655-S657 VanDerWaalsContact O-N 3.13Å; S657-L661 PolarHBondContact O-N 3.21Å; S657-L661 VanDerWaalsContact O-N 3.14Å
658	R	90.9	Very high	91.1	Very high	83 Å²	83	50.3 Å²	50.3	31%	0.313	28%	0.275	S	S	.	.	H	α-helix	trans	-68.1	-46.2	174.5	-166.5	-170.3	-162.8	133.5	0.8	110.5	E615 D619 L622 F655 S656 L661 V662	E615-R658 IonicContact OE1-CZ 3.92Å; E615-R658 IonicContact OE1-NH1 3.06Å; E615-R658 PolarHBondContact OE1-NH1 3.35Å; D619-R658 IonicContact OD1-CZ 3.27Å; D619-R658 IonicContact OD1-NE 2.69Å; D619-R658 PolarHBondContact OD1-NE 2.93Å; D619-R658 IonicContact OD1-NH2 3.9Å; D619-R658 PolarHBondContact OD1-NH2 3.34Å; D619-R658 IonicContact OD2-CZ 3.68Å; D619-R658 IonicContact OD2-NH2 2.7Å; D619-R658 PolarHBondContact OD2-NH2 2.67Å; L622-R658 HydrophobicContact CD1-CG 4.43Å; F655-R658 VanDerWaalsContact O-CB 3.25Å; F655-R658 WeakPolarHBondContact O-CB 3.46Å; F655-R658 PolarHBondContact O-N 2.98Å; S656-R658 VanDerWaalsContact C-N 3.32Å; S656-R658 PolarHBondContact O-N 3.13Å; R658-L661 PolarHBondContact O-N 3.05Å; R658-V662 PolarHBondContact O-N 2.75Å; R658-V662 VanDerWaalsContact O-N 3.12Å
659	A	92.3	Very high	91.2	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.5	-44.3	176.2	0	0	0	0	0	111.7	L622 L648 F655 S656 L661 V662 F663	L622-A659 HydrophobicContact CD2-CB 3.97Å; L648-A659 HydrophobicContact CB-CB 4.14Å; L648-A659 WeakPolarHBondContact O-CB 3.45Å; F655-A659 PolarHBondContact O-N 3.42Å; S656-A659 PolarHBondContact O-N 2.68Å; A659-L661 VanDerWaalsContact C-N 3.28Å; A659-L661 PolarHBondContact O-N 3.48Å; A659-V662 PolarHBondContact O-N 2.76Å; A659-F663 HydrophobicContact CB-CD2 4.25Å; A659-F663 HydrophobicContact CB-CE2 4.17Å; A659-F663 WeakPolarHBondContact O-CD2 3.27Å; A659-F663 PolarHBondContact O-N 3.16Å
660	H	91.2	Very high	91.4	Very high	73 Å²	73	54.2 Å²	54.2	34%	0.338	29%	0.291	S	S	.	.	H	α-helix	trans	-56.5	-39.7	174.5	-80.6	-59.8	0	0	0	112.7	C649 S656 S664 K708	C649-H660 PolarHBondContact O-CE1 3.06Å; C649-H660 PolarHBondContact O-NE2 3.18Å; S656-H660 WeakPolarHBondContact O-CB 3.44Å; S656-H660 PolarHBondContact O-CD2 3.2Å; S656-H660 PolarHBondContact O-N 3.09Å; H660-S664 VanDerWaalsContact O-CB 3.29Å; H660-S664 WeakPolarHBondContact O-CB 3.48Å; H660-S664 PolarHBondContact O-N 3.45Å; H660-S664 PolarHBondContact O-OG 3.16Å; H660-K708 PolarHBondContact O-NZ 3.31Å
661	L	92.9	Very high	91.6	Very high	103 Å²	103	52.5 Å²	52.5	54%	0.539	28%	0.279	S	S	.	.	H	α-helix	trans	-67.4	-51.6	177.8	178.7	61.2	0	0	0	111.7	S657 R658 A659 F663 S664 Q665	S657-L661 PolarHBondContact O-N 3.21Å; S657-L661 VanDerWaalsContact O-N 3.14Å; R658-L661 PolarHBondContact O-N 3.05Å; A659-L661 VanDerWaalsContact C-N 3.28Å; A659-L661 PolarHBondContact O-N 3.48Å; L661-F663 PolarHBondContact O-N 2.97Å; L661-S664 WeakPolarHBondContact O-CA 3.43Å; L661-S664 VanDerWaalsContact O-CB 3.24Å; L661-S664 WeakPolarHBondContact O-CB 3.25Å; L661-S664 PolarHBondContact O-N 2.9Å; L661-Q665 PolarHBondContact O-N 3.41Å; L661-Q665 VanDerWaalsContact O-N 3.08Å
662	V	94.4	Very high	92.1	Very high	37 Å²	37	50.9 Å²	50.9	22%	0.224	27%	0.271	C	S	.	.	H	α-helix	trans	-61	-48.7	-179.2	172.8	0	0	0	0	111.2	L622 C626 R658 A659 S664 Q665 L666	L622-V662 HydrophobicContact CB-CG1 4.27Å; L622-V662 HydrophobicContact CD1-CG2 4.45Å; C626-V662 WeakPolarHBondContact SG-CG1 3.45Å; R658-V662 PolarHBondContact O-N 2.75Å; R658-V662 VanDerWaalsContact O-N 3.12Å; A659-V662 PolarHBondContact O-N 2.76Å; V662-S664 PolarHBondContact O-N 3.24Å; V662-Q665 PolarHBondContact O-N 3.1Å; V662-L666 PolarHBondContact O-N 3.33Å; V662-L666 VanDerWaalsContact O-N 3.11Å
663	F	93.8	Very high	92.5	Very high	1 Å²	1	49.7 Å²	49.7	0%	0.004	26%	0.263	C	S	.	.	H	α-helix	trans	-76.2	2.6	175.1	-55.8	-51.8	0	0	0	113.5	L622 I625 V645 L648 A659 L661 L666 K708	L622-F663 HydrophobicContact CD2-CD2 4.47Å; L622-F663 HydrophobicContact CD2-CE1 4.47Å; L622-F663 HydrophobicContact CD2-CE2 3.47Å; L622-F663 VanDerWaalsContact CD2-CE2 3.47Å; L622-F663 HydrophobicContact CD2-CZ 3.47Å; L622-F663 VanDerWaalsContact CD2-CZ 3.47Å; I625-F663 HydrophobicContact CB-CE1 4.05Å; I625-F663 HydrophobicContact CB-CZ 4.19Å; I625-F663 HydrophobicContact CD1-CZ 4.02Å; I625-F663 HydrophobicContact CG2-CE1 3.63Å; I625-F663 HydrophobicContact CG2-CZ 3.91Å; V645-F663 HydrophobicContact CB-CD2 4.33Å; V645-F663 HydrophobicContact CB-CE2 4.38Å; V645-F663 HydrophobicContact CG1-CB 4.23Å; V645-F663 HydrophobicContact CG1-CD2 3.88Å; V645-F663 HydrophobicContact CG1-CE2 4.41Å; V645-F663 HydrophobicContact CG1-CG 4.03Å; V645-F663 HydrophobicContact CG2-CD1 3.85Å; V645-F663 HydrophobicContact CG2-CD2 3.96Å; V645-F663 HydrophobicContact CG2-CE1 3.75Å; V645-F663 HydrophobicContact CG2-CE2 3.86Å; V645-F663 HydrophobicContact CG2-CG 3.96Å; V645-F663 HydrophobicContact CG2-CZ 3.75Å; L648-F663 HydrophobicContact CB-CE2 4.43Å; L648-F663 HydrophobicContact CD1-CE2 4.34Å; L648-F663 HydrophobicContact CD1-CZ 4.44Å; A659-F663 HydrophobicContact CB-CD2 4.25Å; A659-F663 HydrophobicContact CB-CE2 4.17Å; A659-F663 WeakPolarHBondContact O-CD2 3.27Å; A659-F663 PolarHBondContact O-N 3.16Å; L661-F663 PolarHBondContact O-N 2.97Å; F663-L666 HydrophobicContact CD1-CD2 4.21Å; F663-K708 PolarHBondContact O-NZ 3.4Å
664	S	93	Very high	92.8	Very high	14 Å²	14	48.4 Å²	48.4	10%	0.098	26%	0.257	C	S	.	.	H	α-helix	trans	-84.6	-52.5	163.5	-69.3	0	0	0	0	109.4	H660 L661 V662 L666 M667 D668 K708 R712	H660-S664 VanDerWaalsContact O-CB 3.29Å; H660-S664 WeakPolarHBondContact O-CB 3.48Å; H660-S664 PolarHBondContact O-N 3.45Å; H660-S664 PolarHBondContact O-OG 3.16Å; L661-S664 WeakPolarHBondContact O-CA 3.43Å; L661-S664 VanDerWaalsContact O-CB 3.24Å; L661-S664 WeakPolarHBondContact O-CB 3.25Å; L661-S664 PolarHBondContact O-N 2.9Å; V662-S664 PolarHBondContact O-N 3.24Å; S664-L666 VanDerWaalsContact C-N 3.29Å; S664-L666 PolarHBondContact O-N 2.93Å; S664-M667 CarbonylContact O-C 3.57Å; S664-M667 WeakPolarHBondContact O-CA 3.13Å; S664-M667 WeakPolarHBondContact O-CB 3.34Å; S664-M667 PolarHBondContact O-N 3.37Å; S664-D668 VanDerWaalsContact C-OD2 3.23Å; S664-D668 VanDerWaalsContact O-CG 3.25Å; S664-D668 PolarHBondContact O-N 3.29Å; S664-K708 VanDerWaalsContact N-NZ 3.16Å; S664-K708 PolarHBondContact OG-NZ 3.07Å; S664-R712 PolarHBondContact OG-NH1 3.37Å
665	Q	94.3	Very high	93	Very high	102 Å²	102	46.3 Å²	46.3	48%	0.477	24%	0.241	S	C	.	.	H	α-helix	trans	-55.6	-43.5	179.4	-66.8	165.7	-39.4	0	0	111.7	L661 V662 M667 D668 E669	L661-Q665 PolarHBondContact O-N 3.41Å; L661-Q665 VanDerWaalsContact O-N 3.08Å; V662-Q665 PolarHBondContact O-N 3.1Å; Q665-M667 VanDerWaalsContact C-N 3.3Å; Q665-M667 PolarHBondContact O-N 3.14Å; Q665-D668 WeakPolarHBondContact O-CB 3.39Å; Q665-D668 PolarHBondContact O-N 3.19Å; Q665-E669 WeakPolarHBondContact O-CG 3.44Å; Q665-E669 PolarHBondContact O-N 3.03Å
666	L	94.9	Very high	93.1	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-56.5	-40.5	173.5	177.9	65.4	0	0	0	113.4	C626 V629 K630 V662 F663 S664 L670 L704	C626-L666 HydrophobicContact CB-CD1 4.28Å; C626-L666 HydrophobicContact CB-CD2 4.33Å; V629-L666 HydrophobicContact CB-CD2 4.2Å; V629-L666 HydrophobicContact CG1-CD2 4.12Å; V629-L666 HydrophobicContact CG2-CD2 4.5Å; K630-L666 HydrophobicContact CD-CD1 4.33Å; K630-L666 HydrophobicContact CG-CD1 3.94Å; V662-L666 PolarHBondContact O-N 3.33Å; V662-L666 VanDerWaalsContact O-N 3.11Å; F663-L666 HydrophobicContact CD1-CD2 4.21Å; S664-L666 VanDerWaalsContact C-N 3.29Å; S664-L666 PolarHBondContact O-N 2.93Å; L666-L670 HydrophobicContact CD1-CD1 4.26Å; L666-L670 HydrophobicContact CG-CD1 4.14Å; L666-L670 WeakPolarHBondContact O-CB 3.33Å; L666-L670 WeakPolarHBondContact O-CD1 3.41Å; L666-L670 WeakPolarHBondContact O-CG 3.32Å; L666-L670 PolarHBondContact O-N 3.14Å; L666-L670 VanDerWaalsContact O-N 3.09Å; L666-L704 HydrophobicContact CD2-CD1 4Å; L666-L704 HydrophobicContact CG-CD1 4.4Å
667	M	93.9	Very high	93.1	Very high	2 Å²	2	52 Å²	52	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-77.6	-30.2	179.1	-81.7	-75.4	-63.4	0	0	112.3	S664 Q665 T671 I701 L704 W713	S664-M667 CarbonylContact O-C 3.57Å; S664-M667 WeakPolarHBondContact O-CA 3.13Å; S664-M667 WeakPolarHBondContact O-CB 3.34Å; S664-M667 PolarHBondContact O-N 3.37Å; Q665-M667 VanDerWaalsContact C-N 3.3Å; Q665-M667 PolarHBondContact O-N 3.14Å; M667-T671 VanDerWaalsContact O-CB 3.23Å; M667-T671 WeakPolarHBondContact O-CB 3.24Å; M667-T671 PolarHBondContact O-N 2.86Å; M667-T671 PolarHBondContact O-OG1 3.1Å; M667-I701 HydrophobicContact CE-CG2 4.15Å; M667-I701 HydrophobicContact SD-CG1 4.47Å; M667-L704 HydrophobicContact CG-CB 4.44Å; M667-L704 HydrophobicContact CG-CD1 3.89Å; M667-L704 HydrophobicContact SD-CB 3.61Å; M667-L704 HydrophobicContact SD-CD1 3.57Å; M667-L704 VanDerWaalsContact SD-CD1 3.57Å; M667-L704 HydrophobicContact SD-CG 4.24Å; M667-W713 HydrophobicContact CB-CH2 3.53Å; M667-W713 HydrophobicContact CB-CZ2 3.17Å; M667-W713 HydrophobicContact CB-CZ3 4.34Å; M667-W713 HydrophobicContact CE-CD2 4.28Å; M667-W713 HydrophobicContact CE-CE3 3.94Å; M667-W713 HydrophobicContact CE-CH2 4.23Å; M667-W713 HydrophobicContact CE-CZ3 3.91Å; M667-W713 HydrophobicContact CG-CH2 4.02Å; M667-W713 HydrophobicContact CG-CZ2 4.17Å
668	D	94.4	Very high	93	Very high	65 Å²	65	48.8 Å²	48.8	35%	0.348	25%	0.248	S	C	.	.	H	α-helix	trans	-62.9	-51.5	171.7	-61.3	-45.2	0	0	0	110	S664 Q665 L670 T671 E672 R712 W713	S664-D668 VanDerWaalsContact C-OD2 3.23Å; S664-D668 VanDerWaalsContact O-CG 3.25Å; S664-D668 PolarHBondContact O-N 3.29Å; Q665-D668 WeakPolarHBondContact O-CB 3.39Å; Q665-D668 PolarHBondContact O-N 3.19Å; D668-L670 PolarHBondContact O-N 3.35Å; D668-T671 PolarHBondContact O-N 3.11Å; D668-E672 PolarHBondContact O-N 3.16Å; D668-R712 IonicContact OD1-CZ 3.72Å; D668-R712 IonicContact OD1-NH2 3.86Å; D668-R712 PolarHBondContact OD1-NH2 3.4Å; D668-R712 IonicContact OD2-NH2 3.44Å; D668-R712 PolarHBondContact OD2-NH2 3.09Å; D668-W713 PolarHBondContact OD1-NE1 3.45Å
669	E	94.6	Very high	92.9	Very high	89 Å²	89	47.6 Å²	47.6	42%	0.416	25%	0.252	S	S	.	.	H	α-helix	trans	-58.9	-46	176	-67.2	168.5	153.2	0	0	113	K630 Q665 T671 E672 C673	K630-E669 WeakPolarHBondContact CE-OE2 3.44Å; K630-E669 IonicContact NZ-OE1 2.7Å; K630-E669 PolarHBondContact NZ-OE1 3.19Å; K630-E669 VanDerWaalsContact NZ-OE1 3.12Å; K630-E669 IonicContact NZ-OE2 3.42Å; K630-E669 PolarHBondContact NZ-OE2 2.75Å; Q665-E669 WeakPolarHBondContact O-CG 3.44Å; Q665-E669 PolarHBondContact O-N 3.03Å; E669-T671 VanDerWaalsContact C-N 3.32Å; E669-T671 PolarHBondContact O-N 3.33Å; E669-E672 PolarHBondContact O-N 2.77Å; E669-C673 WeakPolarHBondContact O-CB 3.18Å; E669-C673 PolarHBondContact O-N 3.01Å
670	L	94.5	Very high	92.6	Very high	11 Å²	11	50.9 Å²	50.9	6%	0.058	27%	0.269	C	S	.	.	H	α-helix	trans	-64.8	-37	178.4	-73.7	169.4	0	0	0	111.7	V629 L666 D668 C673 F674 R700 I701 L704	V629-L670 HydrophobicContact CG1-CD1 4.29Å; L666-L670 HydrophobicContact CD1-CD1 4.26Å; L666-L670 HydrophobicContact CG-CD1 4.14Å; L666-L670 WeakPolarHBondContact O-CB 3.33Å; L666-L670 WeakPolarHBondContact O-CD1 3.41Å; L666-L670 WeakPolarHBondContact O-CG 3.32Å; L666-L670 PolarHBondContact O-N 3.14Å; L666-L670 VanDerWaalsContact O-N 3.09Å; D668-L670 PolarHBondContact O-N 3.35Å; L670-C673 PolarHBondContact O-N 3.39Å; L670-F674 PolarHBondContact O-N 3.1Å; L670-R700 HydrophobicContact CD1-CB 3.97Å; L670-R700 HydrophobicContact CD2-CB 4.09Å; L670-I701 HydrophobicContact CB-CD1 4.14Å; L670-I701 HydrophobicContact CB-CG1 3.8Å; L670-L704 HydrophobicContact CD1-CD1 4.02Å
671	T	94.1	Very high	92.5	Very high	10 Å²	10	47.4 Å²	47.4	6%	0.061	25%	0.253	C	S	.	.	H	α-helix	trans	-68.8	-41.2	177.5	-62.7	0	0	0	0	111.5	M667 D668 E669 F674 N675 W713 L715	M667-T671 VanDerWaalsContact O-CB 3.23Å; M667-T671 WeakPolarHBondContact O-CB 3.24Å; M667-T671 PolarHBondContact O-N 2.86Å; M667-T671 PolarHBondContact O-OG1 3.1Å; D668-T671 PolarHBondContact O-N 3.11Å; E669-T671 VanDerWaalsContact C-N 3.32Å; E669-T671 PolarHBondContact O-N 3.33Å; T671-F674 PolarHBondContact O-N 3.13Å; T671-N675 WeakPolarHBondContact CG2-ND2 3.34Å; T671-N675 WeakPolarHBondContact O-CB 3.24Å; T671-N675 VanDerWaalsContact O-CG 3.27Å; T671-N675 PolarHBondContact O-N 3.41Å; T671-N675 PolarHBondContact O-ND2 3.4Å; T671-W713 HydrophobicContact CG2-CB 4.34Å; T671-W713 HydrophobicContact CG2-CG 4.46Å; T671-L715 HydrophobicContact CG2-CD2 4.01Å; T671-L715 HydrophobicContact CG2-CG 4.42Å
672	E	93.6	Very high	92.2	Very high	148 Å²	148	44.3 Å²	44.3	69%	0.692	24%	0.237	S	C	*	.	H	α-helix	trans	-60.4	-45.6	173.4	-174	169.3	-155.6	0	0	111.1	D668 E669 F674 N675 S676	D668-E672 PolarHBondContact O-N 3.16Å; E669-E672 PolarHBondContact O-N 2.77Å; E672-F674 PolarHBondContact O-N 3.34Å; E672-N675 PolarHBondContact O-N 2.85Å; E672-S676 PolarHBondContact O-N 3.43Å
673	C	92.6	Very high	91.7	Very high	51 Å²	51	49.2 Å²	49.2	35%	0.345	26%	0.258	S	S	.	.	H	α-helix	trans	-62.7	-38.9	176.7	-178.3	0	0	0	0	113.6	E669 L670 S676 Y677	E669-C673 WeakPolarHBondContact O-CB 3.18Å; E669-C673 PolarHBondContact O-N 3.01Å; L670-C673 PolarHBondContact O-N 3.39Å; C673-S676 PolarHBondContact O-OG 3.49Å; C673-Y677 WeakPolarHBondContact O-CD2 3.08Å
674	F	94	Very high	91	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.5	-45.5	172.6	170.9	-107.7	0	0	0	111.7	L670 T671 E672 S676 Y677 L678 A694 A697 L698 I701 L715 L722	L670-F674 PolarHBondContact O-N 3.1Å; T671-F674 PolarHBondContact O-N 3.13Å; E672-F674 PolarHBondContact O-N 3.34Å; F674-S676 VanDerWaalsContact C-N 3.3Å; F674-S676 PolarHBondContact O-N 2.93Å; F674-Y677 PolarHBondContact O-N 3.06Å; F674-L678 HydrophobicContact CE1-CD1 4.36Å; F674-L678 HydrophobicContact CE1-CD2 4.42Å; F674-L678 HydrophobicContact CZ-CD1 3.99Å; F674-L678 PolarHBondContact O-N 3.29Å; F674-A694 HydrophobicContact CD2-CB 4.36Å; F674-A697 HydrophobicContact CB-CB 4.24Å; F674-L698 HydrophobicContact CD1-CD1 4.4Å; F674-L698 HydrophobicContact CD2-CB 4.13Å; F674-L698 HydrophobicContact CD2-CD1 4.07Å; F674-L698 HydrophobicContact CD2-CD2 4.38Å; F674-L698 HydrophobicContact CD2-CG 4.44Å; F674-L698 HydrophobicContact CE1-CD1 4.36Å; F674-L698 HydrophobicContact CE2-CB 4.36Å; F674-L698 HydrophobicContact CE2-CD1 4.04Å; F674-L698 HydrophobicContact CE2-CD2 3.79Å; F674-L698 HydrophobicContact CE2-CG 4.31Å; F674-L698 HydrophobicContact CG-CD1 4.25Å; F674-L698 HydrophobicContact CZ-CD1 4.18Å; F674-L698 HydrophobicContact CZ-CD2 4.2Å; F674-I701 HydrophobicContact CB-CD1 4.21Å; F674-L715 HydrophobicContact CD1-CD2 4.01Å; F674-L715 HydrophobicContact CE1-CD2 4.35Å; F674-L722 HydrophobicContact CE2-CD2 4.08Å; F674-L722 HydrophobicContact CZ-CD2 4.04Å
675	N	91.5	Very high	90.4	Very high	68 Å²	68	55 Å²	55	36%	0.364	31%	0.312	S	S	.	.	H	α-helix	trans	-66.9	-27.6	-176.7	-74.5	-29.7	0	0	0	113.3	T671 E672 Y677 L678	T671-N675 WeakPolarHBondContact CG2-ND2 3.34Å; T671-N675 WeakPolarHBondContact O-CB 3.24Å; T671-N675 VanDerWaalsContact O-CG 3.27Å; T671-N675 PolarHBondContact O-N 3.41Å; T671-N675 PolarHBondContact O-ND2 3.4Å; E672-N675 PolarHBondContact O-N 2.85Å; N675-Y677 VanDerWaalsContact C-N 3.3Å; N675-Y677 PolarHBondContact O-N 3.26Å; N675-L678 PolarHBondContact O-N 3.02Å
676	S	92	Very high	89.8	Confident	74 Å²	74	51.5 Å²	51.5	52%	0.517	30%	0.301	S	S	.	.	H	α-helix	trans	-64.8	-30.3	176.5	53.7	0	0	0	0	113.7	E672 C673 F674	E672-S676 PolarHBondContact O-N 3.43Å; C673-S676 PolarHBondContact O-OG 3.49Å; F674-S676 VanDerWaalsContact C-N 3.3Å; F674-S676 PolarHBondContact O-N 2.93Å
677	Y	90.9	Very high	89.4	Confident	73 Å²	73	56.2 Å²	56.2	29%	0.286	33%	0.326	S	S	.	.	H	α-helix	trans	-93.4	-16.9	177.7	-63.1	-72.5	0	0	0	113.6	C673 F674 N675 S679 D680 L681 N693	C673-Y677 WeakPolarHBondContact O-CD2 3.08Å; F674-Y677 PolarHBondContact O-N 3.06Å; N675-Y677 VanDerWaalsContact C-N 3.3Å; N675-Y677 PolarHBondContact O-N 3.26Å; Y677-S679 VanDerWaalsContact C-N 3.31Å; Y677-S679 PolarHBondContact O-N 2.78Å; Y677-D680 PolarHBondContact O-N 3.29Å; Y677-D680 VanDerWaalsContact O-N 3.11Å; Y677-L681 WeakPolarHBondContact O-CG 3.48Å; Y677-L681 PolarHBondContact O-N 3.14Å; Y677-N693 HydrophobicContact CD2-CB 4.27Å; Y677-N693 HydrophobicContact CE2-CB 3.7Å
678	L	89.6	Confident	89.1	Confident	19 Å²	19	64.6 Å²	64.6	10%	0.099	37%	0.365	C	S	.	.	H	α-helix	trans	-57.2	-39	-174.3	-178.9	63.9	0	0	0	113.5	F674 N675 D680 L682 L722	F674-L678 HydrophobicContact CE1-CD1 4.36Å; F674-L678 HydrophobicContact CE1-CD2 4.42Å; F674-L678 HydrophobicContact CZ-CD1 3.99Å; F674-L678 PolarHBondContact O-N 3.29Å; N675-L678 PolarHBondContact O-N 3.02Å; L678-D680 VanDerWaalsContact C-N 3.33Å; L678-D680 PolarHBondContact O-N 2.61Å; L678-L682 HydrophobicContact CD1-CD1 4.04Å; L678-L682 HydrophobicContact CD1-CG 4.12Å; L678-L682 HydrophobicContact CG-CD1 4.04Å; L678-L682 HydrophobicContact CG-CG 4.48Å; L678-L682 WeakPolarHBondContact O-CB 3.48Å; L678-L682 VanDerWaalsContact O-CG 3.26Å; L678-L682 WeakPolarHBondContact O-CG 3.32Å; L678-L682 PolarHBondContact O-N 3.34Å; L678-L722 HydrophobicContact CD1-CB 4.37Å
679	S	87.6	Confident	88.8	Confident	57 Å²	57	66.9 Å²	66.9	40%	0.399	38%	0.378	S	S	.	.	H	α-helix	trans	-54.7	-49.3	175.6	161.1	0	0	0	0	112	Y677 L682 Q683	Y677-S679 VanDerWaalsContact C-N 3.31Å; Y677-S679 PolarHBondContact O-N 2.78Å; S679-L682 PolarHBondContact O-N 3.43Å; S679-Q683 WeakPolarHBondContact O-CG 3.42Å; S679-Q683 PolarHBondContact O-N 3.11Å; S679-Q683 VanDerWaalsContact O-N 3.1Å; S679-Q683 PolarHBondContact O-NE2 3.38Å; S679-Q683 PolarHBondContact OG-NE2 3.2Å
680	D	87.4	Confident	88.5	Confident	69 Å²	69	62.7 Å²	62.7	37%	0.369	36%	0.358	S	S	.	.	H	α-helix	trans	-85.7	-29.4	-167.1	-55.3	-14.1	0	0	0	109.8	Y677 L678 Q683 G684 A685 A686	Y677-D680 PolarHBondContact O-N 3.29Å; Y677-D680 VanDerWaalsContact O-N 3.11Å; L678-D680 VanDerWaalsContact C-N 3.33Å; L678-D680 PolarHBondContact O-N 2.61Å; D680-Q683 PolarHBondContact O-N 2.7Å; D680-G684 PolarHBondContact O-N 2.68Å; D680-G684 VanDerWaalsContact O-N 3.12Å; D680-A685 PolarHBondContact O-N 3.09Å; D680-A686 HydrophobicContact CB-CB 4.27Å; D680-A686 PolarHBondContact O-N 2.93Å; D680-A686 VanDerWaalsContact O-N 3.11Å
681	L	87.7	Confident	88.3	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-56.9	-52.6	163.6	-73.4	172.3	0	0	0	111.5	Y677 Q683 G684 A686 V691 A694 L722 R726 L736	Y677-L681 WeakPolarHBondContact O-CG 3.48Å; Y677-L681 PolarHBondContact O-N 3.14Å; L681-Q683 VanDerWaalsContact C-N 3.27Å; L681-Q683 PolarHBondContact O-N 3.29Å; L681-G684 PolarHBondContact O-N 3.11Å; L681-G684 VanDerWaalsContact O-N 3.11Å; L681-A686 HydrophobicContact CD2-CB 3.93Å; L681-A686 HydrophobicContact CG-CB 4.26Å; L681-V691 HydrophobicContact CD2-CB 4.45Å; L681-V691 HydrophobicContact CD2-CG2 3.74Å; L681-A694 HydrophobicContact CD1-CB 3.6Å; L681-L722 HydrophobicContact CB-CD1 4.19Å; L681-L722 HydrophobicContact CD1-CD1 4.41Å; L681-R726 PolarHBondContact O-NH1 3.25Å; L681-R726 PolarHBondContact O-NH2 3.02Å; L681-L736 HydrophobicContact CD1-CD2 4.43Å; L681-L736 HydrophobicContact CD2-CD2 4.27Å
682	L	86.9	Confident	88.2	Confident	39 Å²	39	69.1 Å²	69.1	20%	0.204	38%	0.384	C	S	.	.	H	α-helix	trans	-66	-28.7	-178.2	-71.5	175.1	0	0	0	112.9	L678 S679 G684 E721 N725	L678-L682 HydrophobicContact CD1-CD1 4.04Å; L678-L682 HydrophobicContact CD1-CG 4.12Å; L678-L682 HydrophobicContact CG-CD1 4.04Å; L678-L682 HydrophobicContact CG-CG 4.48Å; L678-L682 WeakPolarHBondContact O-CB 3.48Å; L678-L682 VanDerWaalsContact O-CG 3.26Å; L678-L682 WeakPolarHBondContact O-CG 3.32Å; L678-L682 PolarHBondContact O-N 3.34Å; S679-L682 PolarHBondContact O-N 3.43Å; L682-G684 VanDerWaalsContact C-N 3.35Å; L682-E721 HydrophobicContact CD1-CG 4.06Å; L682-E721 HydrophobicContact CD2-CG 3.94Å; L682-N725 HydrophobicContact CD2-CB 3.8Å; L682-N725 PolarHBondContact O-ND2 3.49Å
683	Q	84.6	Confident	88.1	Confident	140 Å²	140	64.9 Å²	64.9	65%	0.654	37%	0.367	S	S	*	.	H	α-helix	trans	-81.6	-9.6	174.6	-72.2	176.2	76.2	0	0	114	S679 D680 L681 A685	S679-Q683 WeakPolarHBondContact O-CG 3.42Å; S679-Q683 PolarHBondContact O-N 3.11Å; S679-Q683 VanDerWaalsContact O-N 3.1Å; S679-Q683 PolarHBondContact O-NE2 3.38Å; S679-Q683 PolarHBondContact OG-NE2 3.2Å; D680-Q683 PolarHBondContact O-N 2.7Å; L681-Q683 VanDerWaalsContact C-N 3.27Å; L681-Q683 PolarHBondContact O-N 3.29Å; Q683-A685 HydrophobicContact CB-CB 4.22Å; Q683-A685 PolarHBondContact O-N 2.91Å
684	G	78.3	Confident	88.1	Confident	63 Å²	63	62.5 Å²	62.5	65%	0.649	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.5	26.2	-172.6	0	0	0	0	0	113.2	D680 L681 L682	D680-G684 PolarHBondContact O-N 2.68Å; D680-G684 VanDerWaalsContact O-N 3.12Å; L681-G684 PolarHBondContact O-N 3.11Å; L681-G684 VanDerWaalsContact O-N 3.11Å; L682-G684 VanDerWaalsContact C-N 3.35Å
685	A	80.7	Confident	88	Confident	73 Å²	73	62.6 Å²	62.6	60%	0.603	35%	0.351	S	S	*	.			trans	-109.7	-7.1	-176.3	0	0	0	0	0	113.6	D680 Q683	D680-A685 PolarHBondContact O-N 3.09Å; Q683-A685 HydrophobicContact CB-CB 4.22Å; Q683-A685 PolarHBondContact O-N 2.91Å
686	A	83.1	Confident	88.1	Confident	28 Å²	28	59.4 Å²	59.4	23%	0.231	33%	0.334	C	S	.	.			trans	-66	144.9	172.9	0	0	0	0	0	111.8	D680 L681 V691	D680-A686 HydrophobicContact CB-CB 4.27Å; D680-A686 PolarHBondContact O-N 2.93Å; D680-A686 VanDerWaalsContact O-N 3.11Å; L681-A686 HydrophobicContact CD2-CB 3.93Å; L681-A686 HydrophobicContact CG-CB 4.26Å; A686-V691 HydrophobicContact CB-CG2 4.39Å
687	D	86.2	Confident	88.3	Confident	102 Å²	102	55.9 Å²	55.9	55%	0.545	31%	0.31	S	S	.	.			trans	-85.7	172.7	169.7	51.4	11.2	0	0	0	111.8	D689 G690 V691	D687-D689 PolarHBondContact O-N 2.96Å; D687-G690 PolarHBondContact O-N 3.44Å; D687-G690 VanDerWaalsContact O-N 3.1Å; D687-G690 WeakPolarHBondContact OD1-CA 3.39Å; D687-G690 PolarHBondContact OD1-N 2.86Å; D687-V691 WeakPolarHBondContact O-CG2 3.42Å; D687-V691 PolarHBondContact O-N 3.02Å
688	E	86.6	Confident	88.4	Confident	177 Å²	177	52.4 Å²	52.4	83%	0.827	30%	0.296	S	S	*	.	H	α-helix	trans	-58.2	-38.1	179.3	-64.3	177.9	179.6	0	0	111.6	V691 Y692	E688-V691 PolarHBondContact O-N 3.2Å; E688-Y692 WeakPolarHBondContact O-CB 3.42Å; E688-Y692 PolarHBondContact O-N 3.07Å
689	D	88.2	Confident	88.7	Confident	114 Å²	114	53.8 Å²	53.8	61%	0.61	30%	0.301	S	S	*	.	H	α-helix	trans	-63.6	-44.2	173.6	-79.9	-27.8	0	0	0	111.8	D687 Y692 N693	D687-D689 PolarHBondContact O-N 2.96Å; D689-Y692 PolarHBondContact O-N 3.2Å; D689-N693 WeakPolarHBondContact O-CB 3.36Å; D689-N693 PolarHBondContact O-N 2.93Å; D689-N693 PolarHBondContact O-ND2 2.96Å
690	G	89.2	Confident	89	Confident	1 Å²	1	52.8 Å²	52.8	1%	0.01	29%	0.289	C	S	.	.	H	α-helix	trans	-63.2	-40.7	175.8	0	0	0	0	0	113.1	D687 A694	D687-G690 PolarHBondContact O-N 3.44Å; D687-G690 VanDerWaalsContact O-N 3.1Å; D687-G690 WeakPolarHBondContact OD1-CA 3.39Å; D687-G690 PolarHBondContact OD1-N 2.86Å; G690-A694 WeakPolarHBondContact O-CB 3.35Å; G690-A694 PolarHBondContact O-N 3Å
691	V	89.9	Confident	89.4	Confident	26 Å²	26	49.5 Å²	49.5	16%	0.158	27%	0.271	C	S	.	.	H	α-helix	trans	-61.8	-51	172.8	175.8	0	0	0	0	110.5	L681 A686 D687 E688 N693 A694 A695 D733	L681-V691 HydrophobicContact CD2-CB 4.45Å; L681-V691 HydrophobicContact CD2-CG2 3.74Å; A686-V691 HydrophobicContact CB-CG2 4.39Å; D687-V691 WeakPolarHBondContact O-CG2 3.42Å; D687-V691 PolarHBondContact O-N 3.02Å; E688-V691 PolarHBondContact O-N 3.2Å; V691-N693 PolarHBondContact O-N 3.1Å; V691-A694 PolarHBondContact O-N 3.24Å; V691-A695 WeakPolarHBondContact O-CB 3.3Å; V691-A695 PolarHBondContact O-N 2.89Å; V691-D733 HydrophobicContact CG1-CB 4.14Å
692	Y	91.2	Very high	89.7	Confident	130 Å²	130	49.8 Å²	49.8	51%	0.51	27%	0.273	S	S	.	.	H	α-helix	trans	-61.7	-41.8	-179.5	177.3	-97	0	0	0	113.1	E688 D689 A695 S696	E688-Y692 WeakPolarHBondContact O-CB 3.42Å; E688-Y692 PolarHBondContact O-N 3.07Å; D689-Y692 PolarHBondContact O-N 3.2Å; Y692-A695 PolarHBondContact O-N 2.91Å; Y692-S696 VanDerWaalsContact O-CB 3.22Å; Y692-S696 WeakPolarHBondContact O-CB 3.45Å; Y692-S696 PolarHBondContact O-N 3.47Å; Y692-S696 PolarHBondContact O-OG 3.28Å
693	N	91.7	Very high	90	Very high	59 Å²	59	48.6 Å²	48.6	32%	0.316	27%	0.27	S	S	.	.	H	α-helix	trans	-66.1	-43.3	177.8	-81.1	-69.5	0	0	0	111.6	Y677 D689 V691 S696 A697	Y677-N693 HydrophobicContact CD2-CB 4.27Å; Y677-N693 HydrophobicContact CE2-CB 3.7Å; D689-N693 WeakPolarHBondContact O-CB 3.36Å; D689-N693 PolarHBondContact O-N 2.93Å; D689-N693 PolarHBondContact O-ND2 2.96Å; V691-N693 PolarHBondContact O-N 3.1Å; N693-S696 PolarHBondContact O-N 3.25Å; N693-A697 WeakPolarHBondContact O-CB 3.35Å; N693-A697 PolarHBondContact O-N 3Å
694	A	92.5	Very high	90.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.4	-42.3	175.8	0	0	0	0	0	112.5	F674 L681 G690 V691 A697 L698 L736	F674-A694 HydrophobicContact CD2-CB 4.36Å; L681-A694 HydrophobicContact CD1-CB 3.6Å; G690-A694 WeakPolarHBondContact O-CB 3.35Å; G690-A694 PolarHBondContact O-N 3Å; V691-A694 PolarHBondContact O-N 3.24Å; A694-A697 PolarHBondContact O-N 3.3Å; A694-L698 VanDerWaalsContact O-CB 3.27Å; A694-L698 WeakPolarHBondContact O-CB 3.33Å; A694-L698 PolarHBondContact O-N 2.94Å; A694-L736 HydrophobicContact CB-CD1 4.28Å
695	A	93.1	Very high	91.1	Very high	2 Å²	2	39.3 Å²	39.3	2%	0.017	21%	0.209	C	C	.	.	H	α-helix	trans	-60.5	-48.4	174.9	0	0	0	0	0	110.7	V691 Y692 A697 L698 K699 E735 L736	V691-A695 WeakPolarHBondContact O-CB 3.3Å; V691-A695 PolarHBondContact O-N 2.89Å; Y692-A695 PolarHBondContact O-N 2.91Å; A695-A697 PolarHBondContact O-N 3.15Å; A695-L698 PolarHBondContact O-N 3.12Å; A695-K699 VanDerWaalsContact O-CB 3.24Å; A695-K699 WeakPolarHBondContact O-CB 3.39Å; A695-K699 PolarHBondContact O-N 3.07Å; A695-E735 HydrophobicContact CB-CB 4.26Å; A695-L736 HydrophobicContact CB-CB 3.98Å; A695-L736 HydrophobicContact CB-CD1 4.2Å
696	S	93.8	Very high	91.4	Very high	1 Å²	1	38.9 Å²	38.9	1%	0.007	20%	0.202	C	C	.	.	H	α-helix	trans	-59.5	-45.4	177.2	-65.8	0	0	0	0	112.7	Y692 N693 R700	Y692-S696 VanDerWaalsContact O-CB 3.22Å; Y692-S696 WeakPolarHBondContact O-CB 3.45Å; Y692-S696 PolarHBondContact O-N 3.47Å; Y692-S696 PolarHBondContact O-OG 3.28Å; N693-S696 PolarHBondContact O-N 3.25Å; S696-R700 VanDerWaalsContact O-CD 3.3Å; S696-R700 WeakPolarHBondContact O-CD 3.28Å; S696-R700 VanDerWaalsContact O-CG 3.25Å; S696-R700 WeakPolarHBondContact O-CG 3.44Å; S696-R700 PolarHBondContact O-N 2.84Å
697	A	94.8	Very high	91.6	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-61.3	-47.5	174.9	0	0	0	0	0	111.2	F674 N693 A694 A695 K699 R700 I701	F674-A697 HydrophobicContact CB-CB 4.24Å; N693-A697 WeakPolarHBondContact O-CB 3.35Å; N693-A697 PolarHBondContact O-N 3Å; A694-A697 PolarHBondContact O-N 3.3Å; A695-A697 PolarHBondContact O-N 3.15Å; A697-K699 PolarHBondContact O-N 3.34Å; A697-R700 PolarHBondContact O-N 3.33Å; A697-I701 VanDerWaalsContact O-CG1 3.29Å; A697-I701 WeakPolarHBondContact O-CG1 3.43Å; A697-I701 PolarHBondContact O-N 3.06Å
698	L	94.2	Very high	91.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-69.3	-32.1	-177.5	-160.8	62.8	0	0	0	112.7	F674 A694 A695 I701 A702 L736 A739 A740 C743	F674-L698 HydrophobicContact CD1-CD1 4.4Å; F674-L698 HydrophobicContact CD2-CB 4.13Å; F674-L698 HydrophobicContact CD2-CD1 4.07Å; F674-L698 HydrophobicContact CD2-CD2 4.38Å; F674-L698 HydrophobicContact CD2-CG 4.44Å; F674-L698 HydrophobicContact CE1-CD1 4.36Å; F674-L698 HydrophobicContact CE2-CB 4.36Å; F674-L698 HydrophobicContact CE2-CD1 4.04Å; F674-L698 HydrophobicContact CE2-CD2 3.79Å; F674-L698 HydrophobicContact CE2-CG 4.31Å; F674-L698 HydrophobicContact CG-CD1 4.25Å; F674-L698 HydrophobicContact CZ-CD1 4.18Å; F674-L698 HydrophobicContact CZ-CD2 4.2Å; A694-L698 VanDerWaalsContact O-CB 3.27Å; A694-L698 WeakPolarHBondContact O-CB 3.33Å; A694-L698 PolarHBondContact O-N 2.94Å; A695-L698 PolarHBondContact O-N 3.12Å; L698-I701 HydrophobicContact CD1-CD1 4.44Å; L698-I701 PolarHBondContact O-N 3.4Å; L698-A702 VanDerWaalsContact O-CB 3.28Å; L698-A702 WeakPolarHBondContact O-CB 3.37Å; L698-A702 PolarHBondContact O-N 2.91Å; L698-L736 HydrophobicContact CD2-CD1 4.09Å; L698-A739 HydrophobicContact CB-CB 3.97Å; L698-A739 HydrophobicContact CD2-CB 4.11Å; L698-A739 HydrophobicContact CG-CB 3.86Å; L698-A740 HydrophobicContact CD2-CB 3.69Å; L698-C743 HydrophobicContact CD1-CB 4.26Å; L698-C743 VanDerWaalsContact CD1-SG 3.6Å
699	K	94.4	Very high	91.7	Very high	48 Å²	48	28.5 Å²	28.5	21%	0.209	15%	0.149	C	C	.	.	H	α-helix	trans	-65.1	-41.8	173.8	-164.7	-179.9	-163.9	-177	0	111.6	T633 L638 A695 A697 A702 A703 E735 A739	T633-K699 VanDerWaalsContact O-CD 3.32Å; T633-K699 WeakPolarHBondContact O-CD 3.39Å; T633-K699 WeakPolarHBondContact O-CE 3.42Å; T633-K699 PolarHBondContact O-NZ 2.83Å; L638-K699 HydrophobicContact CD1-CG 4.35Å; A695-K699 VanDerWaalsContact O-CB 3.24Å; A695-K699 WeakPolarHBondContact O-CB 3.39Å; A695-K699 PolarHBondContact O-N 3.07Å; A697-K699 PolarHBondContact O-N 3.34Å; K699-A702 PolarHBondContact O-N 2.98Å; K699-A703 PolarHBondContact O-N 3.22Å; K699-A703 VanDerWaalsContact O-N 3.16Å; K699-E735 VanDerWaalsContact CD-OE2 3.32Å; K699-E735 WeakPolarHBondContact CD-OE2 3.37Å; K699-E735 VanDerWaalsContact CE-OE2 3.3Å; K699-E735 WeakPolarHBondContact CE-OE2 3.45Å; K699-E735 IonicContact NZ-OE1 2.89Å; K699-E735 PolarHBondContact NZ-OE1 2.65Å; K699-E735 IonicContact NZ-OE2 2.76Å; K699-E735 PolarHBondContact NZ-OE2 3.42Å; K699-A739 HydrophobicContact CB-CB 4.45Å
700	R	95.6	Very high	91.7	Very high	35 Å²	35	23.2 Å²	23.2	13%	0.132	12%	0.121	C	C	.	.	H	α-helix	trans	-65.7	-44.9	173.3	-67.2	161	-178.7	154.4	0.9	111.7	V629 K630 K631 H632 L638 L670 S696 A697 A703 L704	V629-R700 HydrophobicContact CG1-CB 4.16Å; V629-R700 HydrophobicContact CG1-CG 4.28Å; V629-R700 WeakPolarHBondContact O-CD 3.4Å; V629-R700 WeakPolarHBondContact O-CG 3.32Å; V629-R700 PolarHBondContact O-NE 2.99Å; K630-R700 VanDerWaalsContact O-CZ 3.22Å; K630-R700 PolarHBondContact O-NH2 3.18Å; K630-R700 VanDerWaalsContact O-NH2 3.09Å; K631-R700 PolarHBondContact O-NH2 2.87Å; H632-R700 PolarHBondContact O-NE 2.96Å; H632-R700 PolarHBondContact O-NH2 3.26Å; H632-R700 VanDerWaalsContact O-NH2 3.09Å; L638-R700 HydrophobicContact CD1-CG 4.12Å; L638-R700 HydrophobicContact CD2-CG 4.01Å; L670-R700 HydrophobicContact CD1-CB 3.97Å; L670-R700 HydrophobicContact CD2-CB 4.09Å; S696-R700 VanDerWaalsContact O-CD 3.3Å; S696-R700 WeakPolarHBondContact O-CD 3.28Å; S696-R700 VanDerWaalsContact O-CG 3.25Å; S696-R700 WeakPolarHBondContact O-CG 3.44Å; S696-R700 PolarHBondContact O-N 2.84Å; A697-R700 PolarHBondContact O-N 3.33Å; R700-A703 PolarHBondContact O-N 3.38Å; R700-L704 PolarHBondContact O-N 3.4Å
701	I	95	Very high	91.6	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-58.2	-50.3	173.3	-69.7	167.3	0	0	0	110.2	M667 L670 F674 A697 L698 A703 L704 C705 L715	M667-I701 HydrophobicContact CE-CG2 4.15Å; M667-I701 HydrophobicContact SD-CG1 4.47Å; L670-I701 HydrophobicContact CB-CD1 4.14Å; L670-I701 HydrophobicContact CB-CG1 3.8Å; F674-I701 HydrophobicContact CB-CD1 4.21Å; A697-I701 VanDerWaalsContact O-CG1 3.29Å; A697-I701 WeakPolarHBondContact O-CG1 3.43Å; A697-I701 PolarHBondContact O-N 3.06Å; L698-I701 HydrophobicContact CD1-CD1 4.44Å; L698-I701 PolarHBondContact O-N 3.4Å; I701-A703 VanDerWaalsContact C-N 3.31Å; I701-A703 PolarHBondContact O-N 3.27Å; I701-L704 PolarHBondContact O-N 3.23Å; I701-L704 VanDerWaalsContact O-N 3.11Å; I701-C705 WeakPolarHBondContact O-CB 3.47Å; I701-C705 PolarHBondContact O-N 3.35Å; I701-C705 PolarHBondContact O-SG 3.39Å; I701-L715 HydrophobicContact CG2-CD1 3.75Å
702	A	93.9	Very high	91.5	Very high	6 Å²	6	30 Å²	30	5%	0.05	15%	0.147	C	C	.	.	H	α-helix	trans	-56.8	-42.2	-178.4	0	0	0	0	0	112.6	L698 K699 C705 S706 K742 C743 F746	L698-A702 VanDerWaalsContact O-CB 3.28Å; L698-A702 WeakPolarHBondContact O-CB 3.37Å; L698-A702 PolarHBondContact O-N 2.91Å; K699-A702 PolarHBondContact O-N 2.98Å; A702-C705 PolarHBondContact O-N 3.13Å; A702-S706 PolarHBondContact O-N 3.32Å; A702-K742 HydrophobicContact CB-CB 3.86Å; A702-C743 VanDerWaalsContact CA-SG 3.58Å; A702-F746 WeakPolarHBondContact O-CD2 3.09Å; A702-F746 VanDerWaalsContact O-CE2 3.28Å; A702-F746 WeakPolarHBondContact O-CE2 3.41Å
703	A	93.9	Very high	91.4	Very high	15 Å²	15	25.2 Å²	25.2	12%	0.124	13%	0.129	C	C	.	.	H	α-helix	trans	-61.8	-49.7	174.7	0	0	0	0	0	111.6	L638 A642 K699 R700 I701 C705 S706	L638-A703 HydrophobicContact CB-CB 3.74Å; A642-A703 VanDerWaalsContact CB-O 3.28Å; A642-A703 WeakPolarHBondContact CB-O 3.32Å; K699-A703 PolarHBondContact O-N 3.22Å; K699-A703 VanDerWaalsContact O-N 3.16Å; R700-A703 PolarHBondContact O-N 3.38Å; I701-A703 VanDerWaalsContact C-N 3.31Å; I701-A703 PolarHBondContact O-N 3.27Å; A703-C705 VanDerWaalsContact C-N 3.33Å; A703-C705 PolarHBondContact O-N 3.09Å; A703-S706 WeakPolarHBondContact O-CB 3.24Å; A703-S706 PolarHBondContact O-N 3.24Å; A703-S706 PolarHBondContact O-OG 3.5Å
704	L	92.5	Very high	91.3	Very high	6 Å²	6	29.8 Å²	29.8	3%	0.031	15%	0.148	C	C	.	.	H	α-helix	trans	-65.3	-32.9	178.8	-67	175.5	0	0	0	112.9	V629 V645 L666 M667 L670 R700 I701 S706 A707 K708	V629-L704 HydrophobicContact CG1-CD1 4.29Å; V645-L704 HydrophobicContact CB-CD2 4.44Å; V645-L704 HydrophobicContact CG1-CD2 4.41Å; V645-L704 HydrophobicContact CG2-CD2 4Å; L666-L704 HydrophobicContact CD2-CD1 4Å; L666-L704 HydrophobicContact CG-CD1 4.4Å; M667-L704 HydrophobicContact CG-CB 4.44Å; M667-L704 HydrophobicContact CG-CD1 3.89Å; M667-L704 HydrophobicContact SD-CB 3.61Å; M667-L704 HydrophobicContact SD-CD1 3.57Å; M667-L704 VanDerWaalsContact SD-CD1 3.57Å; M667-L704 HydrophobicContact SD-CG 4.24Å; L670-L704 HydrophobicContact CD1-CD1 4.02Å; R700-L704 PolarHBondContact O-N 3.4Å; I701-L704 PolarHBondContact O-N 3.23Å; I701-L704 VanDerWaalsContact O-N 3.11Å; L704-S706 PolarHBondContact O-N 2.82Å; L704-A707 PolarHBondContact O-N 3.35Å; L704-K708 PolarHBondContact O-N 2.94Å
705	C	91.9	Very high	91.1	Very high	1 Å²	1	30 Å²	30	1%	0.007	15%	0.15	C	C	.	.	H	α-helix	trans	-61.8	-24.3	174.7	-68.9	0	0	0	0	113.5	I701 A702 A703 A707 P710 F746 W750	I701-C705 WeakPolarHBondContact O-CB 3.47Å; I701-C705 PolarHBondContact O-N 3.35Å; I701-C705 PolarHBondContact O-SG 3.39Å; A702-C705 PolarHBondContact O-N 3.13Å; A703-C705 VanDerWaalsContact C-N 3.33Å; A703-C705 PolarHBondContact O-N 3.09Å; C705-A707 VanDerWaalsContact C-N 3.25Å; C705-A707 PolarHBondContact O-N 3.24Å; C705-P710 HydrophobicContact CB-CB 4.33Å; C705-P710 HydrophobicContact CB-CG 4.2Å; C705-P710 WeakPolarHBondContact SG-CB 3.36Å; C705-F746 HydrophobicContact CB-CB 3.81Å; C705-F746 HydrophobicContact CB-CD2 3.77Å; C705-F746 HydrophobicContact CB-CG 4.17Å; C705-W750 PolarHBondContact O-NE1 3.49Å
706	S	88.3	Confident	91.1	Very high	64 Å²	64	30.1 Å²	30.1	45%	0.448	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-24.3	174.1	74.9	0	0	0	0	112.9	A702 A703 L704	A702-S706 PolarHBondContact O-N 3.32Å; A703-S706 WeakPolarHBondContact O-CB 3.24Å; A703-S706 PolarHBondContact O-N 3.24Å; A703-S706 PolarHBondContact O-OG 3.5Å; L704-S706 PolarHBondContact O-N 2.82Å
707	A	87	Confident	91	Very high	17 Å²	17	34.1 Å²	34.1	14%	0.14	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-26.3	-174.9	0	0	0	0	0	113.9	A642 L704 C705	A642-A707 HydrophobicContact CB-CB 4.13Å; A642-A707 WeakPolarHBondContact O-CB 3.36Å; L704-A707 PolarHBondContact O-N 3.35Å; C705-A707 VanDerWaalsContact C-N 3.25Å; C705-A707 PolarHBondContact O-N 3.24Å
708	K	86.3	Confident	90.9	Very high	29 Å²	29	35.4 Å²	35.4	13%	0.126	18%	0.18	C	C	.	.	S	Bend	trans	-137.7	136.4	-171.6	-176.2	173.9	177.1	178.9	0	111.2	H660 F663 S664 L704 P710	H660-K708 PolarHBondContact O-NZ 3.31Å; F663-K708 PolarHBondContact O-NZ 3.4Å; S664-K708 VanDerWaalsContact N-NZ 3.16Å; S664-K708 PolarHBondContact OG-NZ 3.07Å; L704-K708 PolarHBondContact O-N 2.94Å; K708-P710 VanDerWaalsContact O-CD 3.26Å; K708-P710 WeakPolarHBondContact O-CD 3.22Å
709	D	88.9	Confident	90.9	Very high	44 Å²	44	35.4 Å²	35.4	24%	0.235	18%	0.18	C	C	.	.			trans	-54.7	113.9	178.1	-179.3	0.5	0	0	0	112.5	T711 W713 W750 N754	D709-T711 VanDerWaalsContact CG-OG1 3.28Å; D709-T711 VanDerWaalsContact OD1-CB 3.27Å; D709-T711 WeakPolarHBondContact OD1-CB 3.46Å; D709-T711 VanDerWaalsContact OD1-CG2 3.24Å; D709-T711 WeakPolarHBondContact OD1-CG2 3.22Å; D709-T711 PolarHBondContact OD1-N 3.03Å; D709-T711 PolarHBondContact OD1-OG1 2.94Å; D709-T711 PolarHBondContact OD2-OG1 2.95Å; D709-W713 WeakPolarHBondContact O-CZ3 3.45Å; D709-W750 HydrophobicContact CB-CD2 3.82Å; D709-W750 HydrophobicContact CB-CE3 3.61Å; D709-W750 HydrophobicContact CB-CG 4.23Å; D709-W750 HydrophobicContact CB-CZ3 4.05Å; D709-N754 PolarHBondContact OD2-ND2 3.05Å
710	P	88.2	Confident	90.9	Very high	2 Å²	2	33.5 Å²	33.5	1%	0.013	17%	0.172	C	C	.	.			trans	-92.2	3.8	-178.7	38.9	-36.2	0	0	0	113.6	C705 K708 R712 W713 H747	C705-P710 HydrophobicContact CB-CB 4.33Å; C705-P710 HydrophobicContact CB-CG 4.2Å; C705-P710 WeakPolarHBondContact SG-CB 3.36Å; K708-P710 VanDerWaalsContact O-CD 3.26Å; K708-P710 WeakPolarHBondContact O-CD 3.22Å; P710-R712 VanDerWaalsContact C-N 3.27Å; P710-R712 PolarHBondContact O-N 3.5Å; P710-W713 HydrophobicContact CB-CE3 4.43Å; P710-W713 PolarHBondContact O-N 3.21Å; P710-H747 HydrophobicContact CG-CB 4.11Å
711	T	87.2	Confident	90.7	Very high	37 Å²	37	37 Å²	37	23%	0.227	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-62.1	-32.2	-169	53	0	0	0	0	113.6	D709 W713 E714 W750 A751 N754	D709-T711 VanDerWaalsContact CG-OG1 3.28Å; D709-T711 VanDerWaalsContact OD1-CB 3.27Å; D709-T711 WeakPolarHBondContact OD1-CB 3.46Å; D709-T711 VanDerWaalsContact OD1-CG2 3.24Å; D709-T711 WeakPolarHBondContact OD1-CG2 3.22Å; D709-T711 PolarHBondContact OD1-N 3.03Å; D709-T711 PolarHBondContact OD1-OG1 2.94Å; D709-T711 PolarHBondContact OD2-OG1 2.95Å; T711-W713 PolarHBondContact O-N 3.28Å; T711-W713 VanDerWaalsContact O-N 3.17Å; T711-E714 PolarHBondContact O-N 3.14Å; T711-W750 HydrophobicContact CG2-CB 4.23Å; T711-A751 HydrophobicContact CG2-CB 4.17Å; T711-N754 PolarHBondContact OG1-ND2 3.42Å
712	R	88.3	Confident	90.6	Very high	132 Å²	132	37 Å²	37	50%	0.498	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-64.5	-14.5	179	73.5	173.3	-129.8	-164.2	2.3	115.9	S664 D668 P710	S664-R712 PolarHBondContact OG-NH1 3.37Å; D668-R712 IonicContact OD1-CZ 3.72Å; D668-R712 IonicContact OD1-NH2 3.86Å; D668-R712 PolarHBondContact OD1-NH2 3.4Å; D668-R712 IonicContact OD2-NH2 3.44Å; D668-R712 PolarHBondContact OD2-NH2 3.09Å; P710-R712 VanDerWaalsContact C-N 3.27Å; P710-R712 PolarHBondContact O-N 3.5Å
713	W	88.8	Confident	90.6	Very high	31 Å²	31	36.8 Å²	36.8	12%	0.117	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-98.1	-1.7	-179.2	-71.2	-80.8	0	0	0	113.3	M667 D668 T671 D709 P710 T711 L715	M667-W713 HydrophobicContact CB-CH2 3.53Å; M667-W713 HydrophobicContact CB-CZ2 3.17Å; M667-W713 HydrophobicContact CB-CZ3 4.34Å; M667-W713 HydrophobicContact CE-CD2 4.28Å; M667-W713 HydrophobicContact CE-CE3 3.94Å; M667-W713 HydrophobicContact CE-CH2 4.23Å; M667-W713 HydrophobicContact CE-CZ3 3.91Å; M667-W713 HydrophobicContact CG-CH2 4.02Å; M667-W713 HydrophobicContact CG-CZ2 4.17Å; D668-W713 PolarHBondContact OD1-NE1 3.45Å; T671-W713 HydrophobicContact CG2-CB 4.34Å; T671-W713 HydrophobicContact CG2-CG 4.46Å; D709-W713 WeakPolarHBondContact O-CZ3 3.45Å; P710-W713 HydrophobicContact CB-CE3 4.43Å; P710-W713 PolarHBondContact O-N 3.21Å; T711-W713 PolarHBondContact O-N 3.28Å; T711-W713 VanDerWaalsContact O-N 3.17Å; W713-L715 HydrophobicContact CB-CD1 3.92Å; W713-L715 HydrophobicContact CB-CG 3.95Å; W713-L715 PolarHBondContact O-N 2.76Å
714	E	88.5	Confident	90.4	Very high	155 Å²	155	39.4 Å²	39.4	72%	0.724	20%	0.196	S	C	*	.			trans	56	2.8	176.5	-54	-161.8	140.7	0	0	117	T711 L716 D717	T711-E714 PolarHBondContact O-N 3.14Å; E714-L716 PolarHBondContact O-N 3.14Å; E714-D717 PolarHBondContact O-N 3.2Å
715	L	88.4	Confident	90.3	Very high	5 Å²	5	41.5 Å²	41.5	3%	0.026	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-40.4	-26.2	-179.1	-75.3	165.8	0	0	0	117.1	T671 F674 I701 W713 D717 S718 C719	T671-L715 HydrophobicContact CG2-CD2 4.01Å; T671-L715 HydrophobicContact CG2-CG 4.42Å; F674-L715 HydrophobicContact CD1-CD2 4.01Å; F674-L715 HydrophobicContact CE1-CD2 4.35Å; I701-L715 HydrophobicContact CG2-CD1 3.75Å; W713-L715 HydrophobicContact CB-CD1 3.92Å; W713-L715 HydrophobicContact CB-CG 3.95Å; W713-L715 PolarHBondContact O-N 2.76Å; L715-D717 VanDerWaalsContact C-N 3.31Å; L715-D717 PolarHBondContact O-N 3.02Å; L715-S718 PolarHBondContact O-N 3.34Å; L715-C719 WeakPolarHBondContact O-CB 3.5Å; L715-C719 PolarHBondContact O-N 3.04Å; L715-C719 PolarHBondContact O-SG 3.03Å
716	L	92.5	Very high	90.1	Very high	3 Å²	3	41.9 Å²	41.9	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-55.7	-43.1	-178.4	173.6	60.2	0	0	0	112.5	E714 M720 A744 H747 L748 K771	E714-L716 PolarHBondContact O-N 3.14Å; L716-M720 HydrophobicContact CD1-CG 3.76Å; L716-M720 HydrophobicContact CG-CG 4.39Å; L716-M720 WeakPolarHBondContact O-CB 3.31Å; L716-M720 WeakPolarHBondContact O-CG 3.35Å; L716-M720 PolarHBondContact O-N 3.42Å; L716-A744 HydrophobicContact CD1-CB 3.61Å; L716-H747 HydrophobicContact CB-CB 4.22Å; L716-L748 HydrophobicContact CD1-CD1 4.43Å; L716-L748 HydrophobicContact CD1-CG 4.16Å; L716-L748 HydrophobicContact CD2-CD2 3.62Å; L716-L748 HydrophobicContact CD2-CG 4.05Å; L716-K771 HydrophobicContact CD2-CB 4.26Å; L716-K771 HydrophobicContact CD2-CD 3.62Å; L716-K771 HydrophobicContact CG-CD 4.43Å
717	D	92.2	Very high	90	Very high	85 Å²	85	40 Å²	40	46%	0.455	19%	0.194	S	C	.	.	H	α-helix	trans	-73.3	-40	-176.3	-67.5	-23	0	0	0	111.3	E714 L715 M720 E721 K771	E714-D717 PolarHBondContact O-N 3.2Å; L715-D717 VanDerWaalsContact C-N 3.31Å; L715-D717 PolarHBondContact O-N 3.02Å; D717-M720 CarbonylContact O-C 3.52Å; D717-M720 PolarHBondContact O-N 3.41Å; D717-E721 PolarHBondContact O-N 2.84Å; D717-K771 VanDerWaalsContact OD1-CE 3.24Å; D717-K771 WeakPolarHBondContact OD1-CE 3.32Å; D717-K771 IonicContact OD1-NZ 3.24Å; D717-K771 PolarHBondContact OD1-NZ 3Å; D717-K771 IonicContact OD2-NZ 2.82Å; D717-K771 PolarHBondContact OD2-NZ 2.98Å
718	S	92.9	Very high	90	Very high	29 Å²	29	46.7 Å²	46.7	20%	0.203	22%	0.222	C	C	.	.	H	α-helix	trans	-57.4	-49.2	171.2	-52.9	0	0	0	0	112.6	L715 M720 E721 L722	L715-S718 PolarHBondContact O-N 3.34Å; S718-M720 VanDerWaalsContact C-N 3.32Å; S718-M720 PolarHBondContact O-N 3.49Å; S718-E721 PolarHBondContact O-N 2.98Å; S718-L722 WeakPolarHBondContact O-CB 3.37Å; S718-L722 PolarHBondContact O-N 3.17Å
719	C	94.4	Very high	89.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-40.3	175.7	-66	0	0	0	0	111.5	L715 E721 L723 A740 A744	L715-C719 WeakPolarHBondContact O-CB 3.5Å; L715-C719 PolarHBondContact O-N 3.04Å; L715-C719 PolarHBondContact O-SG 3.03Å; C719-E721 VanDerWaalsContact C-N 3.3Å; C719-E721 PolarHBondContact O-N 3.23Å; C719-L723 WeakPolarHBondContact O-CB 3.34Å; C719-L723 WeakPolarHBondContact O-CD1 3.31Å; C719-L723 WeakPolarHBondContact O-CG 3.4Å; C719-L723 PolarHBondContact O-N 3Å; C719-A740 HydrophobicContact CB-CB 4.37Å; C719-A744 HydrophobicContact CB-CB 4.13Å
720	M	93.4	Very high	89.6	Confident	7 Å²	7	52.4 Å²	52.4	3%	0.034	26%	0.258	C	S	.	.	H	α-helix	trans	-73.1	-17.4	178.8	-75.4	-63.8	-61.2	0	0	113.9	L716 D717 S718 L723 K724 A744 L774 F775 V778	L716-M720 HydrophobicContact CD1-CG 3.76Å; L716-M720 HydrophobicContact CG-CG 4.39Å; L716-M720 WeakPolarHBondContact O-CB 3.31Å; L716-M720 WeakPolarHBondContact O-CG 3.35Å; L716-M720 PolarHBondContact O-N 3.42Å; D717-M720 CarbonylContact O-C 3.52Å; D717-M720 PolarHBondContact O-N 3.41Å; S718-M720 VanDerWaalsContact C-N 3.32Å; S718-M720 PolarHBondContact O-N 3.49Å; M720-L723 HydrophobicContact SD-CD1 4.37Å; M720-K724 WeakPolarHBondContact O-CE 3.09Å; M720-K724 WeakPolarHBondContact O-CG 3.28Å; M720-K724 PolarHBondContact O-NZ 2.86Å; M720-A744 HydrophobicContact SD-CB 4.49Å; M720-L774 HydrophobicContact CE-CB 4.01Å; M720-L774 HydrophobicContact CE-CD2 3.83Å; M720-L774 HydrophobicContact CE-CG 3.55Å; M720-F775 HydrophobicContact CE-CB 4.34Å; M720-F775 HydrophobicContact SD-CB 4.12Å; M720-F775 HydrophobicContact SD-CD2 3.68Å; M720-F775 HydrophobicContact SD-CG 4.4Å; M720-V778 HydrophobicContact CE-CB 4.4Å; M720-V778 HydrophobicContact CE-CG2 3.62Å; M720-V778 HydrophobicContact SD-CG2 4.43Å
721	E	92.3	Very high	89.4	Confident	109 Å²	109	55.6 Å²	55.6	51%	0.509	28%	0.275	S	S	.	.	H	α-helix	trans	-83.1	-49.9	170.7	-169.9	163.3	-155.9	0	0	110.4	L682 D717 S718 C719 L723 K724 N725	L682-E721 HydrophobicContact CD1-CG 4.06Å; L682-E721 HydrophobicContact CD2-CG 3.94Å; D717-E721 PolarHBondContact O-N 2.84Å; S718-E721 PolarHBondContact O-N 2.98Å; C719-E721 VanDerWaalsContact C-N 3.3Å; C719-E721 PolarHBondContact O-N 3.23Å; E721-L723 PolarHBondContact O-N 3.36Å; E721-K724 PolarHBondContact O-N 2.88Å; E721-N725 WeakPolarHBondContact O-CB 3.06Å; E721-N725 PolarHBondContact O-N 2.98Å
722	L	93	Very high	89.1	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-54.4	-48.3	175.7	-179.5	63.4	0	0	0	112.5	F674 L678 L681 S718 K724 N725 R726 L736	F674-L722 HydrophobicContact CE2-CD2 4.08Å; F674-L722 HydrophobicContact CZ-CD2 4.04Å; L678-L722 HydrophobicContact CD1-CB 4.37Å; L681-L722 HydrophobicContact CB-CD1 4.19Å; L681-L722 HydrophobicContact CD1-CD1 4.41Å; S718-L722 WeakPolarHBondContact O-CB 3.37Å; S718-L722 PolarHBondContact O-N 3.17Å; L722-K724 VanDerWaalsContact C-N 3.34Å; L722-K724 PolarHBondContact O-N 3.44Å; L722-N725 PolarHBondContact O-N 2.89Å; L722-R726 HydrophobicContact CD1-CG 4.14Å; L722-R726 WeakPolarHBondContact O-CB 3.42Å; L722-R726 WeakPolarHBondContact O-CG 3.39Å; L722-R726 PolarHBondContact O-N 3.28Å; L722-L736 HydrophobicContact CD1-CD2 4.38Å; L722-L736 HydrophobicContact CD2-CD1 3.99Å; L722-L736 HydrophobicContact CD2-CD2 4.2Å; L722-L736 HydrophobicContact CD2-CG 4.02Å
723	L	92.9	Very high	89.2	Confident	1 Å²	1	52.5 Å²	52.5	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-59.2	-41.1	178.9	-76	166	0	0	0	112.7	C719 M720 E721 I727 L737 A740 L741 V778	C719-L723 WeakPolarHBondContact O-CB 3.34Å; C719-L723 WeakPolarHBondContact O-CD1 3.31Å; C719-L723 WeakPolarHBondContact O-CG 3.4Å; C719-L723 PolarHBondContact O-N 3Å; M720-L723 HydrophobicContact SD-CD1 4.37Å; E721-L723 PolarHBondContact O-N 3.36Å; L723-I727 WeakPolarHBondContact O-CB 3.41Å; L723-I727 VanDerWaalsContact O-CD1 3.28Å; L723-I727 WeakPolarHBondContact O-CD1 3.31Å; L723-I727 WeakPolarHBondContact O-CG1 3.4Å; L723-I727 PolarHBondContact O-N 2.88Å; L723-L737 HydrophobicContact CD2-CD2 3.84Å; L723-A740 HydrophobicContact CD1-CB 4.19Å; L723-A740 HydrophobicContact CD2-CB 3.86Å; L723-A740 HydrophobicContact CG-CB 3.84Å; L723-L741 HydrophobicContact CD1-CD2 4.08Å; L723-L741 HydrophobicContact CD1-CG 4.45Å; L723-L741 HydrophobicContact CD2-CD2 4.09Å; L723-L741 HydrophobicContact CD2-CG 3.88Å; L723-V778 HydrophobicContact CB-CG1 3.97Å; L723-V778 HydrophobicContact CD1-CG1 4.23Å
724	K	90.4	Very high	89.2	Confident	71 Å²	71	52.7 Å²	52.7	31%	0.309	27%	0.269	S	S	.	.	H	α-helix	trans	-68.5	-51.2	177.8	-67.6	-177.3	-147.6	96.2	0	110.9	M720 E721 L722 R726 I727 E728 V778	M720-K724 WeakPolarHBondContact O-CE 3.09Å; M720-K724 WeakPolarHBondContact O-CG 3.28Å; M720-K724 PolarHBondContact O-NZ 2.86Å; E721-K724 PolarHBondContact O-N 2.88Å; L722-K724 VanDerWaalsContact C-N 3.34Å; L722-K724 PolarHBondContact O-N 3.44Å; K724-R726 VanDerWaalsContact C-N 3.28Å; K724-R726 PolarHBondContact O-N 3.48Å; K724-I727 PolarHBondContact O-N 2.99Å; K724-E728 WeakPolarHBondContact O-CB 3.4Å; K724-E728 WeakPolarHBondContact O-CG 3.39Å; K724-E728 PolarHBondContact O-N 3.11Å; K724-V778 HydrophobicContact CG-CG2 4.29Å
725	N	89.9	Confident	89.3	Confident	49 Å²	49	49.2 Å²	49.2	26%	0.262	25%	0.253	S	S	.	.	H	α-helix	trans	-51.7	-48.4	-178.4	175.5	-75.6	0	0	0	111	L682 E721 L722 E728 S729	L682-N725 HydrophobicContact CD2-CB 3.8Å; L682-N725 PolarHBondContact O-ND2 3.49Å; E721-N725 WeakPolarHBondContact O-CB 3.06Å; E721-N725 PolarHBondContact O-N 2.98Å; L722-N725 PolarHBondContact O-N 2.89Å; N725-E728 PolarHBondContact O-N 3.32Å; N725-S729 WeakPolarHBondContact O-CB 3.37Å; N725-S729 PolarHBondContact O-N 3.13Å; N725-S729 PolarHBondContact O-OG 3.15Å
726	R	87.8	Confident	89.6	Confident	10 Å²	10	49 Å²	49	4%	0.038	25%	0.252	C	S	.	.	H	α-helix	trans	-68.6	-40.9	179.4	-73.6	-62.7	-175.8	-80.1	14.4	114.9	L681 L722 K724 E728 S729 L730 D731 L737	L681-R726 PolarHBondContact O-NH1 3.25Å; L681-R726 PolarHBondContact O-NH2 3.02Å; L722-R726 HydrophobicContact CD1-CG 4.14Å; L722-R726 WeakPolarHBondContact O-CB 3.42Å; L722-R726 WeakPolarHBondContact O-CG 3.39Å; L722-R726 PolarHBondContact O-N 3.28Å; K724-R726 VanDerWaalsContact C-N 3.28Å; K724-R726 PolarHBondContact O-N 3.48Å; R726-E728 VanDerWaalsContact C-N 3.32Å; R726-S729 WeakPolarHBondContact CA-OG 3.41Å; R726-S729 PolarHBondContact O-N 3.42Å; R726-S729 PolarHBondContact O-OG 3.45Å; R726-L730 PolarHBondContact O-N 2.68Å; R726-D731 WeakPolarHBondContact CB-O 3.2Å; R726-D731 WeakPolarHBondContact CD-OD2 3.16Å; R726-D731 IonicContact CZ-OD2 3.77Å; R726-D731 IonicContact NE-OD2 2.83Å; R726-D731 PolarHBondContact NE-OD2 3.18Å; R726-D731 IonicContact NH2-OD2 3.62Å; R726-D731 PolarHBondContact O-N 3.45Å; R726-D731 VanDerWaalsContact O-N 3.1Å; R726-L737 HydrophobicContact CB-CD2 3.74Å; R726-L737 HydrophobicContact CG-CD2 4.17Å
727	I	86.7	Confident	89.7	Confident	25 Å²	25	49 Å²	49	13%	0.128	25%	0.252	C	S	.	.	H	α-helix	trans	-67.1	-35.2	174.9	-68.4	167.9	0	0	0	111.1	L723 K724 V778 T781	L723-I727 WeakPolarHBondContact O-CB 3.41Å; L723-I727 VanDerWaalsContact O-CD1 3.28Å; L723-I727 WeakPolarHBondContact O-CD1 3.31Å; L723-I727 WeakPolarHBondContact O-CG1 3.4Å; L723-I727 PolarHBondContact O-N 2.88Å; K724-I727 PolarHBondContact O-N 2.99Å; I727-V778 HydrophobicContact CD1-CG1 3.95Å; I727-T781 HydrophobicContact CG2-CG2 3.58Å
728	E	86.8	Confident	89.8	Confident	156 Å²	156	45.8 Å²	45.8	73%	0.729	24%	0.235	S	C	*	.	H	α-helix	trans	-76.1	-29.8	177	-71	172	-160.3	0	0	112.6	K724 N725 R726	K724-E728 WeakPolarHBondContact O-CB 3.4Å; K724-E728 WeakPolarHBondContact O-CG 3.39Å; K724-E728 PolarHBondContact O-N 3.11Å; N725-E728 PolarHBondContact O-N 3.32Å; R726-E728 VanDerWaalsContact C-N 3.32Å
729	S	84.5	Confident	89.9	Confident	67 Å²	67	44.5 Å²	44.5	47%	0.469	23%	0.226	S	C	.	.	H	α-helix	trans	-86.3	-7.7	175.3	71.3	0	0	0	0	114.6	N725 R726 D731	N725-S729 WeakPolarHBondContact O-CB 3.37Å; N725-S729 PolarHBondContact O-N 3.13Å; N725-S729 PolarHBondContact O-OG 3.15Å; R726-S729 WeakPolarHBondContact CA-OG 3.41Å; R726-S729 PolarHBondContact O-N 3.42Å; R726-S729 PolarHBondContact O-OG 3.45Å; S729-D731 PolarHBondContact O-N 3.22Å; S729-D731 WeakPolarHBondContact OG-CB 3.2Å; S729-D731 PolarHBondContact OG-N 2.83Å
730	L	83.2	Confident	89.9	Confident	126 Å²	126	44.5 Å²	44.5	66%	0.66	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.1	31	-171.3	-54.3	175.3	0	0	0	113.5	R726 F732	R726-L730 PolarHBondContact O-N 2.68Å; L730-F732 HydrophobicContact CB-CE2 3.98Å; L730-F732 HydrophobicContact CB-CZ 4.26Å; L730-F732 HydrophobicContact CD2-CE2 4.12Å; L730-F732 HydrophobicContact CD2-CZ 3.78Å; L730-F732 WeakPolarHBondContact O-CD2 3.36Å
731	D	82.9	Confident	90	Very high	69 Å²	69	44.1 Å²	44.1	37%	0.369	23%	0.225	S	C	.	.			trans	-98.6	118.2	174.4	176.3	27.8	0	0	0	109.1	R726 S729	R726-D731 WeakPolarHBondContact CB-O 3.2Å; R726-D731 WeakPolarHBondContact CD-OD2 3.16Å; R726-D731 IonicContact CZ-OD2 3.77Å; R726-D731 IonicContact NE-OD2 2.83Å; R726-D731 PolarHBondContact NE-OD2 3.18Å; R726-D731 IonicContact NH2-OD2 3.62Å; R726-D731 PolarHBondContact O-N 3.45Å; R726-D731 VanDerWaalsContact O-N 3.1Å; S729-D731 PolarHBondContact O-N 3.22Å; S729-D731 WeakPolarHBondContact OG-CB 3.2Å; S729-D731 PolarHBondContact OG-N 2.83Å
732	F	82.2	Confident	90.2	Very high	55 Å²	55	41.9 Å²	41.9	24%	0.241	21%	0.213	C	C	.	.			trans	-124.4	60.9	-163.2	-61.5	-59.5	0	0	0	113	L730 T734 L737 L785 Q787	L730-F732 HydrophobicContact CB-CE2 3.98Å; L730-F732 HydrophobicContact CB-CZ 4.26Å; L730-F732 HydrophobicContact CD2-CE2 4.12Å; L730-F732 HydrophobicContact CD2-CZ 3.78Å; L730-F732 WeakPolarHBondContact O-CD2 3.36Å; F732-T734 PolarHBondContact O-N 3.19Å; F732-T734 VanDerWaalsContact O-N 3.13Å; F732-L737 HydrophobicContact CB-CD1 4.5Å; F732-L737 HydrophobicContact CD1-CD1 4.06Å; F732-L785 HydrophobicContact CD1-CD1 4.45Å; F732-L785 HydrophobicContact CE1-CD1 3.98Å; F732-L785 HydrophobicContact CE1-CD2 3.93Å; F732-L785 HydrophobicContact CZ-CD2 3.79Å; F732-Q787 HydrophobicContact CB-CG 4.38Å
733	D	89.3	Confident	90.3	Very high	50 Å²	50	42 Å²	42	27%	0.267	21%	0.214	S	C	.	.			trans	-65.4	109.9	163.3	-174.2	-78.4	0	0	0	110.2	V691 E735 L736 L737	V691-D733 HydrophobicContact CG1-CB 4.14Å; D733-E735 PolarHBondContact OD1-N 3.22Å; D733-E735 VanDerWaalsContact OD1-N 3.16Å; D733-L736 HydrophobicContact CB-CB 4.04Å; D733-L736 WeakPolarHBondContact OD1-CB 3.37Å; D733-L736 PolarHBondContact OD1-N 3.46Å; D733-L737 WeakPolarHBondContact O-CB 3.39Å; D733-L737 WeakPolarHBondContact O-CG 3.23Å; D733-L737 PolarHBondContact O-N 3.34Å; D733-L737 VanDerWaalsContact O-N 3.07Å
734	T	90.1	Very high	90.4	Very high	35 Å²	35	42 Å²	42	22%	0.215	21%	0.214	C	C	.	.	H	α-helix	trans	-65	-41	-174.1	-64.9	0	0	0	0	112.5	F732 V738 E789 I790	F732-T734 PolarHBondContact O-N 3.19Å; F732-T734 VanDerWaalsContact O-N 3.13Å; T734-V738 HydrophobicContact CG2-CG2 4.2Å; T734-V738 WeakPolarHBondContact O-CB 3.41Å; T734-V738 WeakPolarHBondContact O-CG2 3.46Å; T734-V738 PolarHBondContact O-N 3.07Å; T734-E789 HydrophobicContact CG2-CB 3.71Å; T734-E789 HydrophobicContact CG2-CG 4.34Å; T734-E789 WeakPolarHBondContact CG2-OE2 3.4Å; T734-I790 HydrophobicContact CG2-CG1 4.21Å
735	E	90.5	Very high	90.6	Very high	81 Å²	81	38.6 Å²	38.6	38%	0.379	20%	0.199	S	C	.	.	H	α-helix	trans	-67.8	-46.7	-177.9	-68.7	-138.9	160.9	0	0	111.6	A695 K699 D733 A739	A695-E735 HydrophobicContact CB-CB 4.26Å; K699-E735 VanDerWaalsContact CD-OE2 3.32Å; K699-E735 WeakPolarHBondContact CD-OE2 3.37Å; K699-E735 VanDerWaalsContact CE-OE2 3.3Å; K699-E735 WeakPolarHBondContact CE-OE2 3.45Å; K699-E735 IonicContact NZ-OE1 2.89Å; K699-E735 PolarHBondContact NZ-OE1 2.65Å; K699-E735 IonicContact NZ-OE2 2.76Å; K699-E735 PolarHBondContact NZ-OE2 3.42Å; D733-E735 PolarHBondContact OD1-N 3.22Å; D733-E735 VanDerWaalsContact OD1-N 3.16Å; E735-A739 WeakPolarHBondContact O-CB 3.23Å; E735-A739 PolarHBondContact O-N 2.98Å
736	L	93.3	Very high	90.9	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-61.5	-45.5	178.7	-174.4	64.8	0	0	0	111.3	L681 A694 A695 L698 L722 D733 A739 A740	L681-L736 HydrophobicContact CD1-CD2 4.43Å; L681-L736 HydrophobicContact CD2-CD2 4.27Å; A694-L736 HydrophobicContact CB-CD1 4.28Å; A695-L736 HydrophobicContact CB-CB 3.98Å; A695-L736 HydrophobicContact CB-CD1 4.2Å; L698-L736 HydrophobicContact CD2-CD1 4.09Å; L722-L736 HydrophobicContact CD1-CD2 4.38Å; L722-L736 HydrophobicContact CD2-CD1 3.99Å; L722-L736 HydrophobicContact CD2-CD2 4.2Å; L722-L736 HydrophobicContact CD2-CG 4.02Å; D733-L736 HydrophobicContact CB-CB 4.04Å; D733-L736 WeakPolarHBondContact OD1-CB 3.37Å; D733-L736 PolarHBondContact OD1-N 3.46Å; L736-A739 PolarHBondContact O-N 2.86Å; L736-A740 VanDerWaalsContact O-CB 3.26Å; L736-A740 WeakPolarHBondContact O-CB 3.49Å; L736-A740 PolarHBondContact O-N 3.03Å
737	L	94.1	Very high	91.2	Very high	4 Å²	4	38.9 Å²	38.9	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-72.3	-40.8	-178.5	-66.1	173.8	0	0	0	112.2	L723 R726 F732 D733 A739 A740 L741 I790	L723-L737 HydrophobicContact CD2-CD2 3.84Å; R726-L737 HydrophobicContact CB-CD2 3.74Å; R726-L737 HydrophobicContact CG-CD2 4.17Å; F732-L737 HydrophobicContact CB-CD1 4.5Å; F732-L737 HydrophobicContact CD1-CD1 4.06Å; D733-L737 WeakPolarHBondContact O-CB 3.39Å; D733-L737 WeakPolarHBondContact O-CG 3.23Å; D733-L737 PolarHBondContact O-N 3.34Å; D733-L737 VanDerWaalsContact O-N 3.07Å; L737-A739 VanDerWaalsContact C-N 3.35Å; L737-A740 PolarHBondContact O-N 3.05Å; L737-L741 WeakPolarHBondContact O-CB 3.28Å; L737-L741 VanDerWaalsContact O-CG 3.31Å; L737-L741 WeakPolarHBondContact O-CG 3.46Å; L737-L741 PolarHBondContact O-N 3.22Å; L737-I790 HydrophobicContact CB-CD1 4.16Å; L737-I790 HydrophobicContact CB-CG1 4.44Å; L737-I790 HydrophobicContact CD1-CD1 3.77Å
738	V	94.7	Very high	91.6	Very high	16 Å²	16	37.7 Å²	37.7	10%	0.097	19%	0.193	C	C	.	.	H	α-helix	trans	-63.5	-40.4	173.2	166.3	0	0	0	0	111	T734 K742 E789 I790 Q793	T734-V738 HydrophobicContact CG2-CG2 4.2Å; T734-V738 WeakPolarHBondContact O-CB 3.41Å; T734-V738 WeakPolarHBondContact O-CG2 3.46Å; T734-V738 PolarHBondContact O-N 3.07Å; V738-K742 HydrophobicContact CG1-CD 4.09Å; V738-K742 VanDerWaalsContact CG1-NZ 3.35Å; V738-K742 VanDerWaalsContact O-CG 3.29Å; V738-K742 WeakPolarHBondContact O-CG 3.23Å; V738-K742 PolarHBondContact O-N 2.89Å; V738-K742 VanDerWaalsContact O-N 3.12Å; V738-E789 HydrophobicContact CG2-CB 4.33Å; V738-I790 HydrophobicContact CG2-CG1 4.25Å; V738-Q793 HydrophobicContact CG1-CG 4.35Å
739	A	94.7	Very high	91.9	Very high	2 Å²	2	32.5 Å²	32.5	2%	0.017	17%	0.169	C	C	.	.	H	α-helix	trans	-66.3	-44.8	175.3	0	0	0	0	0	112.1	L698 K699 E735 L736 L737 L741 K742 C743	L698-A739 HydrophobicContact CB-CB 3.97Å; L698-A739 HydrophobicContact CD2-CB 4.11Å; L698-A739 HydrophobicContact CG-CB 3.86Å; K699-A739 HydrophobicContact CB-CB 4.45Å; E735-A739 WeakPolarHBondContact O-CB 3.23Å; E735-A739 PolarHBondContact O-N 2.98Å; L736-A739 PolarHBondContact O-N 2.86Å; L737-A739 VanDerWaalsContact C-N 3.35Å; A739-L741 PolarHBondContact O-N 2.86Å; A739-K742 PolarHBondContact O-N 3.47Å; A739-C743 PolarHBondContact O-N 3.44Å; A739-C743 PolarHBondContact O-SG 3.18Å; A739-C743 VanDerWaalsContact O-SG 3.35Å
740	A	95.6	Very high	92.3	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-63.1	-41.7	177.9	0	0	0	0	0	112.6	L698 C719 L723 L736 L737 C743 A744	L698-A740 HydrophobicContact CD2-CB 3.69Å; C719-A740 HydrophobicContact CB-CB 4.37Å; L723-A740 HydrophobicContact CD1-CB 4.19Å; L723-A740 HydrophobicContact CD2-CB 3.86Å; L723-A740 HydrophobicContact CG-CB 3.84Å; L736-A740 VanDerWaalsContact O-CB 3.26Å; L736-A740 WeakPolarHBondContact O-CB 3.49Å; L736-A740 PolarHBondContact O-N 3.03Å; L737-A740 PolarHBondContact O-N 3.05Å; A740-C743 PolarHBondContact O-N 3.17Å; A740-A744 WeakPolarHBondContact O-CB 3.46Å; A740-A744 PolarHBondContact O-N 3.25Å
741	L	96.3	Very high	92.7	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-58.7	-45.9	172.7	-77.1	171.6	0	0	0	111.4	L723 L737 A739 A745 F775 V778 I790 A794 L797	L723-L741 HydrophobicContact CD1-CD2 4.08Å; L723-L741 HydrophobicContact CD1-CG 4.45Å; L723-L741 HydrophobicContact CD2-CD2 4.09Å; L723-L741 HydrophobicContact CD2-CG 3.88Å; L737-L741 WeakPolarHBondContact O-CB 3.28Å; L737-L741 VanDerWaalsContact O-CG 3.31Å; L737-L741 WeakPolarHBondContact O-CG 3.46Å; L737-L741 PolarHBondContact O-N 3.22Å; A739-L741 PolarHBondContact O-N 2.86Å; L741-A745 VanDerWaalsContact O-CB 3.25Å; L741-A745 WeakPolarHBondContact O-CB 3.38Å; L741-A745 PolarHBondContact O-N 3.07Å; L741-F775 HydrophobicContact CD2-CE2 4.04Å; L741-F775 HydrophobicContact CD2-CZ 4.09Å; L741-V778 HydrophobicContact CD2-CG1 4.44Å; L741-I790 HydrophobicContact CD1-CG2 4.07Å; L741-A794 HydrophobicContact CD1-CB 4.17Å; L741-L797 HydrophobicContact CB-CD1 4.02Å
742	K	95.1	Very high	93.1	Very high	62 Å²	62	24 Å²	24	27%	0.27	12%	0.116	S	C	.	.	H	α-helix	trans	-63.1	-50	177.6	-75.3	168.2	-180	169.1	0	112.1	A702 V738 A739 A744 A745 F746 Q793 L797	A702-K742 HydrophobicContact CB-CB 3.86Å; V738-K742 HydrophobicContact CG1-CD 4.09Å; V738-K742 VanDerWaalsContact CG1-NZ 3.35Å; V738-K742 VanDerWaalsContact O-CG 3.29Å; V738-K742 WeakPolarHBondContact O-CG 3.23Å; V738-K742 PolarHBondContact O-N 2.89Å; V738-K742 VanDerWaalsContact O-N 3.12Å; A739-K742 PolarHBondContact O-N 3.47Å; K742-A744 PolarHBondContact O-N 3.24Å; K742-A745 PolarHBondContact O-N 3.33Å; K742-F746 HydrophobicContact CB-CD2 4.26Å; K742-F746 HydrophobicContact CB-CE2 3.97Å; K742-F746 HydrophobicContact CG-CE2 4.45Å; K742-F746 WeakPolarHBondContact O-CB 3.13Å; K742-F746 WeakPolarHBondContact O-CD2 3.4Å; K742-F746 WeakPolarHBondContact O-CG 3.4Å; K742-F746 PolarHBondContact O-N 3.02Å; K742-Q793 VanDerWaalsContact CE-CD 3.46Å; K742-Q793 VanDerWaalsContact NZ-OE1 3.08Å; K742-L797 HydrophobicContact CG-CD1 4.3Å
743	C	94.6	Very high	93.4	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.02	12%	0.124	C	C	.	.	H	α-helix	trans	-56.9	-48.9	178	-72.7	0	0	0	0	112.2	L698 A702 A739 A740 H747	L698-C743 HydrophobicContact CD1-CB 4.26Å; L698-C743 VanDerWaalsContact CD1-SG 3.6Å; A702-C743 VanDerWaalsContact CA-SG 3.58Å; A739-C743 PolarHBondContact O-N 3.44Å; A739-C743 PolarHBondContact O-SG 3.18Å; A739-C743 VanDerWaalsContact O-SG 3.35Å; A740-C743 PolarHBondContact O-N 3.17Å; C743-H747 WeakPolarHBondContact O-CB 3.49Å; C743-H747 PolarHBondContact O-N 2.74Å
744	A	95.7	Very high	93.4	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-64.6	-42.4	178.3	0	0	0	0	0	112.3	L716 C719 M720 A740 K742 L748 F775	L716-A744 HydrophobicContact CD1-CB 3.61Å; C719-A744 HydrophobicContact CB-CB 4.13Å; M720-A744 HydrophobicContact SD-CB 4.49Å; A740-A744 WeakPolarHBondContact O-CB 3.46Å; A740-A744 PolarHBondContact O-N 3.25Å; K742-A744 PolarHBondContact O-N 3.24Å; A744-L748 WeakPolarHBondContact O-CG 3.3Å; A744-L748 PolarHBondContact O-N 2.82Å; A744-L748 VanDerWaalsContact O-N 3.07Å; A744-F775 HydrophobicContact CB-CD2 3.75Å; A744-F775 HydrophobicContact CB-CE2 3.61Å
745	A	95.7	Very high	93.2	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-64.5	-48.3	176.8	0	0	0	0	0	112.4	L741 K742 H747 L748 M749 F775 L797 L801	L741-A745 VanDerWaalsContact O-CB 3.25Å; L741-A745 WeakPolarHBondContact O-CB 3.38Å; L741-A745 PolarHBondContact O-N 3.07Å; K742-A745 PolarHBondContact O-N 3.33Å; A745-H747 PolarHBondContact O-N 2.89Å; A745-L748 CarbonylContact O-C 3.59Å; A745-L748 WeakPolarHBondContact O-CB 3.47Å; A745-L748 PolarHBondContact O-N 3.43Å; A745-L748 VanDerWaalsContact O-N 3.1Å; A745-M749 WeakPolarHBondContact O-CG 3.47Å; A745-M749 PolarHBondContact O-N 2.87Å; A745-F775 HydrophobicContact CB-CE1 4.12Å; A745-F775 HydrophobicContact CB-CE2 4.43Å; A745-F775 HydrophobicContact CB-CZ 3.75Å; A745-L797 HydrophobicContact CB-CB 4.15Å; A745-L797 HydrophobicContact CB-CD1 3.93Å; A745-L797 HydrophobicContact CB-CD2 3.82Å; A745-L797 HydrophobicContact CB-CG 4.18Å; A745-L801 HydrophobicContact CB-CD1 4.16Å
746	F	94.4	Very high	93	Very high	45 Å²	45	22 Å²	22	20%	0.197	11%	0.112	C	C	.	.	H	α-helix	trans	-62.6	-40.9	178.3	-66.9	-42.8	0	0	0	111.8	A702 C705 K742 L748 M749 W750	A702-F746 WeakPolarHBondContact O-CD2 3.09Å; A702-F746 VanDerWaalsContact O-CE2 3.28Å; A702-F746 WeakPolarHBondContact O-CE2 3.41Å; C705-F746 HydrophobicContact CB-CB 3.81Å; C705-F746 HydrophobicContact CB-CD2 3.77Å; C705-F746 HydrophobicContact CB-CG 4.17Å; K742-F746 HydrophobicContact CB-CD2 4.26Å; K742-F746 HydrophobicContact CB-CE2 3.97Å; K742-F746 HydrophobicContact CG-CE2 4.45Å; K742-F746 WeakPolarHBondContact O-CB 3.13Å; K742-F746 WeakPolarHBondContact O-CD2 3.4Å; K742-F746 WeakPolarHBondContact O-CG 3.4Å; K742-F746 PolarHBondContact O-N 3.02Å; F746-L748 VanDerWaalsContact C-N 3.31Å; F746-L748 PolarHBondContact O-N 3.37Å; F746-M749 HydrophobicContact CD1-SD 4.14Å; F746-M749 PolarHBondContact O-N 3.5Å; F746-M749 VanDerWaalsContact O-N 3.1Å; F746-W750 VanDerWaalsContact O-CD1 3.24Å; F746-W750 PolarHBondContact O-N 3.46Å
747	H	94.5	Very high	92.6	Very high	20 Å²	20	26.9 Å²	26.9	9%	0.093	14%	0.138	C	C	.	.	H	α-helix	trans	-58	-42.6	172.1	-174.9	121.5	0	0	0	111.6	P710 L716 C743 A745 M749 W750 A751	P710-H747 HydrophobicContact CG-CB 4.11Å; L716-H747 HydrophobicContact CB-CB 4.22Å; C743-H747 WeakPolarHBondContact O-CB 3.49Å; C743-H747 PolarHBondContact O-N 2.74Å; A745-H747 PolarHBondContact O-N 2.89Å; H747-M749 VanDerWaalsContact C-N 3.33Å; H747-M749 PolarHBondContact O-N 2.93Å; H747-W750 PolarHBondContact O-N 2.99Å; H747-A751 WeakPolarHBondContact O-CB 3.38Å; H747-A751 PolarHBondContact O-N 2.98Å
748	L	94.8	Very high	92	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-68	-28	175.7	-70.7	174.2	0	0	0	113.6	L716 A744 A745 F746 K752 L768 K771 V772 F775 L801 Y805	L716-L748 HydrophobicContact CD1-CD1 4.43Å; L716-L748 HydrophobicContact CD1-CG 4.16Å; L716-L748 HydrophobicContact CD2-CD2 3.62Å; L716-L748 HydrophobicContact CD2-CG 4.05Å; A744-L748 WeakPolarHBondContact O-CG 3.3Å; A744-L748 PolarHBondContact O-N 2.82Å; A744-L748 VanDerWaalsContact O-N 3.07Å; A745-L748 CarbonylContact O-C 3.59Å; A745-L748 WeakPolarHBondContact O-CB 3.47Å; A745-L748 PolarHBondContact O-N 3.43Å; A745-L748 VanDerWaalsContact O-N 3.1Å; F746-L748 VanDerWaalsContact C-N 3.31Å; F746-L748 PolarHBondContact O-N 3.37Å; L748-K752 PolarHBondContact O-N 3.21Å; L748-L768 HydrophobicContact CD2-CD1 3.8Å; L748-K771 HydrophobicContact CD2-CB 4.15Å; L748-V772 HydrophobicContact CD1-CG2 4.39Å; L748-V772 HydrophobicContact CD2-CG2 3.87Å; L748-F775 HydrophobicContact CD1-CB 3.56Å; L748-F775 HydrophobicContact CD1-CD1 4.17Å; L748-F775 HydrophobicContact CD1-CD2 4.32Å; L748-F775 HydrophobicContact CD1-CG 3.75Å; L748-L801 HydrophobicContact CB-CD2 4.02Å; L748-L801 HydrophobicContact CD1-CD1 4.23Å; L748-Y805 PolarHBondContact O-OH 2.94Å
749	M	94.2	Very high	91.2	Very high	46 Å²	46	36.4 Å²	36.4	23%	0.227	19%	0.187	C	C	.	.	H	α-helix	trans	-73.7	-45.5	173.4	-66	178.9	-173.6	0	0	111.8	A745 F746 H747 K752 L753 D800 L801 L804	A745-M749 WeakPolarHBondContact O-CG 3.47Å; A745-M749 PolarHBondContact O-N 2.87Å; F746-M749 HydrophobicContact CD1-SD 4.14Å; F746-M749 PolarHBondContact O-N 3.5Å; F746-M749 VanDerWaalsContact O-N 3.1Å; H747-M749 VanDerWaalsContact C-N 3.33Å; H747-M749 PolarHBondContact O-N 2.93Å; M749-K752 WeakPolarHBondContact O-CB 3.48Å; M749-K752 PolarHBondContact O-N 3.26Å; M749-L753 PolarHBondContact O-N 3.16Å; M749-L753 VanDerWaalsContact O-N 3.17Å; M749-D800 HydrophobicContact CE-CB 4.09Å; M749-L801 HydrophobicContact CE-CD2 4.1Å; M749-L801 HydrophobicContact CE-CG 4.13Å; M749-L801 HydrophobicContact CG-CD2 3.73Å; M749-L804 HydrophobicContact CB-CD2 4.04Å; M749-L804 HydrophobicContact CG-CD2 3.76Å
750	W	92.9	Very high	90.5	Very high	63 Å²	63	38.2 Å²	38.2	24%	0.239	20%	0.199	C	C	.	.	H	α-helix	trans	-67.1	-39.8	175.4	-76.5	104.7	0	0	0	112.4	C705 D709 T711 F746 H747 K752 L753 N754	C705-W750 PolarHBondContact O-NE1 3.49Å; D709-W750 HydrophobicContact CB-CD2 3.82Å; D709-W750 HydrophobicContact CB-CE3 3.61Å; D709-W750 HydrophobicContact CB-CG 4.23Å; D709-W750 HydrophobicContact CB-CZ3 4.05Å; T711-W750 HydrophobicContact CG2-CB 4.23Å; F746-W750 VanDerWaalsContact O-CD1 3.24Å; F746-W750 PolarHBondContact O-N 3.46Å; H747-W750 PolarHBondContact O-N 2.99Å; W750-K752 PolarHBondContact O-N 2.53Å; W750-L753 HydrophobicContact CE3-CD2 3.79Å; W750-L753 HydrophobicContact CZ3-CD2 3.66Å; W750-L753 WeakPolarHBondContact O-CB 3.12Å; W750-L753 PolarHBondContact O-N 2.94Å; W750-N754 PolarHBondContact O-N 3.32Å
751	A	91.9	Very high	90	Very high	15 Å²	15	40.9 Å²	40.9	12%	0.124	22%	0.221	C	C	.	.	H	α-helix	trans	-59.4	-32.4	172.5	0	0	0	0	0	112.6	T711 H747 A755 L768	T711-A751 HydrophobicContact CG2-CB 4.17Å; H747-A751 WeakPolarHBondContact O-CB 3.38Å; H747-A751 PolarHBondContact O-N 2.98Å; A751-A755 VanDerWaalsContact O-CB 3.31Å; A751-A755 WeakPolarHBondContact O-CB 3.41Å; A751-A755 PolarHBondContact O-N 2.88Å; A751-L768 HydrophobicContact CB-CD1 3.73Å; A751-L768 HydrophobicContact CB-CD2 4Å
752	K	89.7	Confident	89.3	Confident	7 Å²	7	47.4 Å²	47.4	3%	0.03	25%	0.252	C	S	.	.	H	α-helix	trans	-66.3	-45	171.3	177.3	61.2	174.6	175.1	0	111.8	L748 M749 W750 A755 V756 L804 Y805 L819	L748-K752 PolarHBondContact O-N 3.21Å; M749-K752 WeakPolarHBondContact O-CB 3.48Å; M749-K752 PolarHBondContact O-N 3.26Å; W750-K752 PolarHBondContact O-N 2.53Å; K752-A755 PolarHBondContact O-N 3.4Å; K752-V756 WeakPolarHBondContact O-CG2 3.3Å; K752-V756 PolarHBondContact O-N 3.33Å; K752-V756 VanDerWaalsContact O-N 3.1Å; K752-L804 HydrophobicContact CB-CD2 4.12Å; K752-L804 HydrophobicContact CB-CG 4.4Å; K752-L804 HydrophobicContact CG-CD1 3.93Å; K752-L804 HydrophobicContact CG-CD2 4.15Å; K752-L804 HydrophobicContact CG-CG 3.9Å; K752-Y805 HydrophobicContact CB-CE1 4.44Å; K752-Y805 HydrophobicContact CB-CE2 4.05Å; K752-Y805 HydrophobicContact CD-CD1 4.47Å; K752-Y805 HydrophobicContact CD-CE1 4.07Å; K752-L819 HydrophobicContact CD-CD1 3.86Å
753	L	89.5	Confident	88.9	Confident	78 Å²	78	49.6 Å²	49.6	41%	0.408	27%	0.27	S	S	.	.	H	α-helix	trans	-63.4	-44.7	178.6	-174.4	64.7	0	0	0	111	M749 W750 A755 V756 N757	M749-L753 PolarHBondContact O-N 3.16Å; M749-L753 VanDerWaalsContact O-N 3.17Å; W750-L753 HydrophobicContact CE3-CD2 3.79Å; W750-L753 HydrophobicContact CZ3-CD2 3.66Å; W750-L753 WeakPolarHBondContact O-CB 3.12Å; W750-L753 PolarHBondContact O-N 2.94Å; L753-A755 VanDerWaalsContact C-N 3.34Å; L753-A755 PolarHBondContact O-N 3.46Å; L753-V756 WeakPolarHBondContact O-CB 3.43Å; L753-V756 PolarHBondContact O-N 2.82Å; L753-V756 VanDerWaalsContact O-N 3.08Å; L753-N757 PolarHBondContact O-N 3.47Å
754	N	88.2	Confident	88.4	Confident	36 Å²	36	53.3 Å²	53.3	19%	0.193	29%	0.29	C	S	.	.	H	α-helix	trans	-64.4	-37.7	176.9	-69	-9.5	0	0	0	111.8	D709 T711 W750 V756 N757 L758	D709-N754 PolarHBondContact OD2-ND2 3.05Å; T711-N754 PolarHBondContact OG1-ND2 3.42Å; W750-N754 PolarHBondContact O-N 3.32Å; N754-V756 VanDerWaalsContact C-N 3.3Å; N754-V756 PolarHBondContact O-N 2.89Å; N754-N757 PolarHBondContact O-N 3.28Å; N754-L758 HydrophobicContact CB-CD1 4.35Å; N754-L758 VanDerWaalsContact O-CB 3.27Å; N754-L758 WeakPolarHBondContact O-CB 3.41Å; N754-L758 WeakPolarHBondContact O-CG 3.36Å; N754-L758 PolarHBondContact O-N 3.15Å
755	A	87.2	Confident	88.1	Confident	5 Å²	5	53.4 Å²	53.4	4%	0.041	29%	0.29	C	S	.	.	H	α-helix	trans	-64	-32.1	172.3	0	0	0	0	0	113.4	A751 K752 L753 N759 P760 L765 L768 L819	A751-A755 VanDerWaalsContact O-CB 3.31Å; A751-A755 WeakPolarHBondContact O-CB 3.41Å; A751-A755 PolarHBondContact O-N 2.88Å; K752-A755 PolarHBondContact O-N 3.4Å; L753-A755 VanDerWaalsContact C-N 3.34Å; L753-A755 PolarHBondContact O-N 3.46Å; A755-N759 PolarHBondContact O-N 3Å; A755-P760 HydrophobicContact CB-CG 4.17Å; A755-P760 VanDerWaalsContact O-CD 3.25Å; A755-P760 WeakPolarHBondContact O-CD 3.21Å; A755-L765 HydrophobicContact CB-CD2 3.95Å; A755-L768 HydrophobicContact CB-CD2 4.38Å; A755-L819 HydrophobicContact CB-CD1 4.15Å
756	V	85.6	Confident	87.7	Confident	60 Å²	60	55.2 Å²	55.2	36%	0.364	30%	0.301	S	S	.	.	H	α-helix	trans	-71.8	-41.7	173.5	173.8	0	0	0	0	111.2	K752 L753 N754 L816	K752-V756 WeakPolarHBondContact O-CG2 3.3Å; K752-V756 PolarHBondContact O-N 3.33Å; K752-V756 VanDerWaalsContact O-N 3.1Å; L753-V756 WeakPolarHBondContact O-CB 3.43Å; L753-V756 PolarHBondContact O-N 2.82Å; L753-V756 VanDerWaalsContact O-N 3.08Å; N754-V756 VanDerWaalsContact C-N 3.3Å; N754-V756 PolarHBondContact O-N 2.89Å; V756-L816 HydrophobicContact CB-CD1 4.34Å; V756-L816 HydrophobicContact CG2-CD1 3.62Å
757	N	84.3	Confident	87.5	Confident	103 Å²	103	57.9 Å²	57.9	55%	0.551	31%	0.314	S	S	*	.	H	α-helix	trans	-75.9	-39.2	-176	-67.8	-17.7	0	0	0	113.2	L753 N754	L753-N757 PolarHBondContact O-N 3.47Å; N754-N757 PolarHBondContact O-N 3.28Å
758	L	83.4	Confident	87.3	Confident	132 Å²	132	58 Å²	58	69%	0.691	32%	0.315	S	S	*	.	H	α-helix	trans	-96.5	-15.9	-170.4	-59.4	174.8	0	0	0	114.3	N754	N754-L758 HydrophobicContact CB-CD1 4.35Å; N754-L758 VanDerWaalsContact O-CB 3.27Å; N754-L758 WeakPolarHBondContact O-CB 3.41Å; N754-L758 WeakPolarHBondContact O-CG 3.36Å; N754-L758 PolarHBondContact O-N 3.15Å
759	N	77.6	Confident	87.2	Confident	87 Å²	87	61.5 Å²	61.5	47%	0.465	33%	0.329	S	S	.	.			trans	47.6	59.8	-174	-68.4	-75.5	0	0	0	113.8	A755	A755-N759 PolarHBondContact O-N 3Å
760	P	80.3	Confident	87.2	Confident	40 Å²	40	65.9 Å²	65.9	26%	0.26	35%	0.346	S	S	.	.			trans	-70.6	171.8	-176.7	33.7	-37.2	0	0	0	112.4	A755 D764 L765	A755-P760 HydrophobicContact CB-CG 4.17Å; A755-P760 VanDerWaalsContact O-CD 3.25Å; A755-P760 WeakPolarHBondContact O-CD 3.21Å; P760-D764 HydrophobicContact CB-CB 4.2Å; P760-L765 HydrophobicContact CG-CD2 3.75Å; P760-L765 HydrophobicContact CG-CG 4.37Å
761	A	83.8	Confident	87.2	Confident	57 Å²	57	64.9 Å²	64.9	47%	0.471	34%	0.343	S	S	.	.			trans	-69	155.6	-173.7	0	0	0	0	0	112.2	V763 D764 L765	A761-V763 PolarHBondContact O-N 3.45Å; A761-V763 VanDerWaalsContact O-N 3.11Å; A761-D764 WeakPolarHBondContact CB-OD2 3.37Å; A761-D764 PolarHBondContact N-OD2 2.88Å; A761-D764 WeakPolarHBondContact O-CB 3.29Å; A761-D764 PolarHBondContact O-N 2.93Å; A761-L765 WeakPolarHBondContact O-CG 3.32Å; A761-L765 PolarHBondContact O-N 3.09Å; A761-L765 VanDerWaalsContact O-N 3.13Å
762	E	82.6	Confident	87.3	Confident	137 Å²	137	64.1 Å²	64.1	64%	0.64	34%	0.338	S	S	*	.	H	α-helix	trans	-57.2	-32.3	-179.3	-172.4	172.6	-172.3	0	0	112.4	D764 L765 T766 A818	E762-D764 PolarHBondContact O-N 3.43Å; E762-L765 PolarHBondContact O-N 3.17Å; E762-T766 HydrophobicContact CG-CG2 4.45Å; E762-T766 WeakPolarHBondContact O-CG2 3.5Å; E762-T766 PolarHBondContact O-N 3.07Å; E762-A818 HydrophobicContact CG-CB 3.88Å
763	V	85.3	Confident	87.5	Confident	107 Å²	107	70.6 Å²	70.6	65%	0.648	36%	0.362	S	S	*	.	H	α-helix	trans	-57.3	-49.7	174.3	-177.8	0	0	0	0	110.9	A761 L765 T766 H767	A761-V763 PolarHBondContact O-N 3.45Å; A761-V763 VanDerWaalsContact O-N 3.11Å; V763-L765 VanDerWaalsContact C-N 3.34Å; V763-L765 PolarHBondContact O-N 3.44Å; V763-T766 PolarHBondContact O-N 2.94Å; V763-T766 VanDerWaalsContact O-N 3.15Å; V763-T766 PolarHBondContact O-OG1 3.38Å; V763-H767 PolarHBondContact O-N 3.49Å
764	D	85.9	Confident	87.8	Confident	82 Å²	82	70.5 Å²	70.5	44%	0.439	36%	0.361	S	S	.	.	H	α-helix	trans	-64.1	-40.5	-179.5	-46.7	-41.9	0	0	0	110.9	P760 A761 E762 H767 L768	P760-D764 HydrophobicContact CB-CB 4.2Å; A761-D764 WeakPolarHBondContact CB-OD2 3.37Å; A761-D764 PolarHBondContact N-OD2 2.88Å; A761-D764 WeakPolarHBondContact O-CB 3.29Å; A761-D764 PolarHBondContact O-N 2.93Å; E762-D764 PolarHBondContact O-N 3.43Å; D764-H767 WeakPolarHBondContact O-CB 3.4Å; D764-H767 PolarHBondContact O-N 3.06Å; D764-H767 VanDerWaalsContact O-N 3.17Å; D764-L768 PolarHBondContact O-N 3.28Å
765	L	87.9	Confident	88.1	Confident	1 Å²	1	68.8 Å²	68.8	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-62.5	-42.5	173.9	-58.5	176.9	0	0	0	111.4	A755 P760 A761 E762 V763 H767 L768 R769 V815 L816 A818 L819	A755-L765 HydrophobicContact CB-CD2 3.95Å; P760-L765 HydrophobicContact CG-CD2 3.75Å; P760-L765 HydrophobicContact CG-CG 4.37Å; A761-L765 WeakPolarHBondContact O-CG 3.32Å; A761-L765 PolarHBondContact O-N 3.09Å; A761-L765 VanDerWaalsContact O-N 3.13Å; E762-L765 PolarHBondContact O-N 3.17Å; V763-L765 VanDerWaalsContact C-N 3.34Å; V763-L765 PolarHBondContact O-N 3.44Å; L765-H767 VanDerWaalsContact C-N 3.29Å; L765-H767 PolarHBondContact O-N 3.39Å; L765-L768 PolarHBondContact O-N 2.88Å; L765-R769 WeakPolarHBondContact O-CB 3.46Å; L765-R769 PolarHBondContact O-N 3.16Å; L765-V815 HydrophobicContact CD1-CG1 3.88Å; L765-V815 WeakPolarHBondContact CD1-O 3.19Å; L765-L816 HydrophobicContact CD1-CD2 4.4Å; L765-L816 HydrophobicContact CD2-CD2 4.11Å; L765-A818 HydrophobicContact CB-CB 3.87Å; L765-A818 HydrophobicContact CD1-CB 4.25Å; L765-L819 HydrophobicContact CB-CD2 3.88Å; L765-L819 HydrophobicContact CB-CG 4.13Å; L765-L819 HydrophobicContact CD2-CD1 3.91Å; L765-L819 HydrophobicContact CD2-CD2 3.76Å; L765-L819 HydrophobicContact CD2-CG 3.77Å; L765-L819 HydrophobicContact CG-CD2 4.42Å; L765-L819 HydrophobicContact CG-CG 4.45Å; L765-L819 WeakPolarHBondContact O-CD2 3.26Å
766	T	87.6	Confident	88.5	Confident	39 Å²	39	68.7 Å²	68.7	24%	0.239	35%	0.351	C	S	.	.	H	α-helix	trans	-67.5	-29.6	174.7	68.7	0	0	0	0	112.9	E762 V763 K770	E762-T766 HydrophobicContact CG-CG2 4.45Å; E762-T766 WeakPolarHBondContact O-CG2 3.5Å; E762-T766 PolarHBondContact O-N 3.07Å; V763-T766 PolarHBondContact O-N 2.94Å; V763-T766 VanDerWaalsContact O-N 3.15Å; V763-T766 PolarHBondContact O-OG1 3.38Å; T766-K770 WeakPolarHBondContact O-CG 3.21Å; T766-K770 PolarHBondContact O-N 3.35Å; T766-K770 VanDerWaalsContact O-N 3.17Å
767	H	90.4	Very high	88.9	Confident	101 Å²	101	74.2 Å²	74.2	47%	0.468	37%	0.365	S	S	.	.	H	α-helix	trans	-69.8	-49	174.3	-179.5	-136.4	0	0	0	111.6	V763 D764 L765 R769 K770 K771	V763-H767 PolarHBondContact O-N 3.49Å; D764-H767 WeakPolarHBondContact O-CB 3.4Å; D764-H767 PolarHBondContact O-N 3.06Å; D764-H767 VanDerWaalsContact O-N 3.17Å; L765-H767 VanDerWaalsContact C-N 3.29Å; L765-H767 PolarHBondContact O-N 3.39Å; H767-R769 VanDerWaalsContact C-N 3.3Å; H767-R769 PolarHBondContact O-N 2.83Å; H767-K770 WeakPolarHBondContact O-CA 3.48Å; H767-K770 WeakPolarHBondContact O-CB 3.49Å; H767-K770 PolarHBondContact O-N 2.96Å; H767-K771 PolarHBondContact O-N 3.46Å; H767-K771 VanDerWaalsContact O-N 3.09Å
768	L	91.2	Very high	89.4	Confident	23 Å²	23	69.8 Å²	69.8	12%	0.12	34%	0.342	C	S	.	.	H	α-helix	trans	-57.1	-43.1	174.7	-179.5	54.3	0	0	0	111.3	L748 A751 A755 D764 L765 K770 K771 V772 Y805 L819	L748-L768 HydrophobicContact CD2-CD1 3.8Å; A751-L768 HydrophobicContact CB-CD1 3.73Å; A751-L768 HydrophobicContact CB-CD2 4Å; A755-L768 HydrophobicContact CB-CD2 4.38Å; D764-L768 PolarHBondContact O-N 3.28Å; L765-L768 PolarHBondContact O-N 2.88Å; L768-K770 VanDerWaalsContact C-N 3.3Å; L768-K770 PolarHBondContact O-N 3.47Å; L768-K771 PolarHBondContact O-N 3.14Å; L768-K771 VanDerWaalsContact O-N 3.12Å; L768-V772 WeakPolarHBondContact O-CG2 3.48Å; L768-V772 PolarHBondContact O-N 3.16Å; L768-Y805 HydrophobicContact CD2-CE1 4.42Å; L768-Y805 HydrophobicContact CG-CE1 4.31Å; L768-L819 HydrophobicContact CB-CD2 4.01Å; L768-L819 HydrophobicContact CD2-CD2 3.84Å; L768-L819 HydrophobicContact CG-CD2 4.05Å
769	R	92.4	Very high	89.9	Confident	73 Å²	73	63.5 Å²	63.5	28%	0.275	31%	0.309	S	S	.	.	H	α-helix	trans	-61.6	-32.3	173.8	-173.8	-179.5	58.4	-174.8	-7	113.6	L765 H767 R773 A818 V820	L765-R769 WeakPolarHBondContact O-CB 3.46Å; L765-R769 PolarHBondContact O-N 3.16Å; H767-R769 VanDerWaalsContact C-N 3.3Å; H767-R769 PolarHBondContact O-N 2.83Å; R769-R773 WeakPolarHBondContact O-CB 3.46Å; R769-R773 PolarHBondContact O-N 3.17Å; R769-R773 VanDerWaalsContact O-N 3.09Å; R769-A818 VanDerWaalsContact CD-O 3.22Å; R769-A818 WeakPolarHBondContact CD-O 3.15Å; R769-A818 PolarHBondContact NE-O 2.88Å; R769-A818 PolarHBondContact NH1-O 3.09Å; R769-A818 VanDerWaalsContact NH1-O 3.14Å; R769-V820 WeakPolarHBondContact CD-O 3.41Å
770	K	93	Very high	90.8	Very high	137 Å²	137	61.1 Å²	61.1	60%	0.596	30%	0.295	S	S	*	.	H	α-helix	trans	-65.9	-44.6	172.4	-71.5	168.3	-175.9	174.8	0	110.6	T766 H767 L768 R773 L774	T766-K770 WeakPolarHBondContact O-CG 3.21Å; T766-K770 PolarHBondContact O-N 3.35Å; T766-K770 VanDerWaalsContact O-N 3.17Å; H767-K770 WeakPolarHBondContact O-CA 3.48Å; H767-K770 WeakPolarHBondContact O-CB 3.49Å; H767-K770 PolarHBondContact O-N 2.96Å; L768-K770 VanDerWaalsContact C-N 3.3Å; L768-K770 PolarHBondContact O-N 3.47Å; K770-R773 PolarHBondContact O-N 3.43Å; K770-L774 PolarHBondContact O-N 3.14Å
771	K	93.8	Very high	91.4	Very high	42 Å²	42	62.1 Å²	62.1	18%	0.183	30%	0.301	C	S	.	.	H	α-helix	trans	-62.7	-44.8	177.3	-66.4	-160.3	175.3	-164.6	0	112.2	L716 D717 L748 H767 L768 R773 L774 F775	L716-K771 HydrophobicContact CD2-CB 4.26Å; L716-K771 HydrophobicContact CD2-CD 3.62Å; L716-K771 HydrophobicContact CG-CD 4.43Å; D717-K771 VanDerWaalsContact OD1-CE 3.24Å; D717-K771 WeakPolarHBondContact OD1-CE 3.32Å; D717-K771 IonicContact OD1-NZ 3.24Å; D717-K771 PolarHBondContact OD1-NZ 3Å; D717-K771 IonicContact OD2-NZ 2.82Å; D717-K771 PolarHBondContact OD2-NZ 2.98Å; L748-K771 HydrophobicContact CD2-CB 4.15Å; H767-K771 PolarHBondContact O-N 3.46Å; H767-K771 VanDerWaalsContact O-N 3.09Å; L768-K771 PolarHBondContact O-N 3.14Å; L768-K771 VanDerWaalsContact O-N 3.12Å; K771-R773 PolarHBondContact O-N 3.37Å; K771-L774 WeakPolarHBondContact O-CB 3.38Å; K771-L774 PolarHBondContact O-N 3.24Å; K771-L774 VanDerWaalsContact O-N 3.15Å; K771-F775 PolarHBondContact O-N 3.21Å
772	V	94.4	Very high	91.8	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-56.3	-49.2	173.1	175	0	0	0	0	111.7	L748 L768 L774 F775 C776 Y805 H821	L748-V772 HydrophobicContact CD1-CG2 4.39Å; L748-V772 HydrophobicContact CD2-CG2 3.87Å; L768-V772 WeakPolarHBondContact O-CG2 3.48Å; L768-V772 PolarHBondContact O-N 3.16Å; V772-L774 PolarHBondContact O-N 3.12Å; V772-F775 PolarHBondContact O-N 3.29Å; V772-C776 PolarHBondContact O-N 3.23Å; V772-C776 PolarHBondContact O-SG 3.22Å; V772-C776 VanDerWaalsContact O-SG 3.36Å; V772-Y805 HydrophobicContact CG1-CD2 4.26Å; V772-Y805 HydrophobicContact CG1-CG 4.2Å; V772-Y805 HydrophobicContact CG2-CD1 3.99Å; V772-Y805 HydrophobicContact CG2-CD2 4.12Å; V772-Y805 HydrophobicContact CG2-CE1 3.61Å; V772-Y805 HydrophobicContact CG2-CE2 3.75Å; V772-Y805 HydrophobicContact CG2-CG 4.23Å; V772-Y805 VanDerWaalsContact CG2-CZ 3.45Å; V772-H821 HydrophobicContact CG1-CB 4.49Å
773	R	94.3	Very high	92.4	Very high	143 Å²	143	53.3 Å²	53.3	54%	0.54	25%	0.25	S	S	.	.	H	α-helix	trans	-59.5	-36.4	178.2	-176.7	-171.6	-64.4	170.2	-3.5	112.3	R769 K770 K771 R777	R769-R773 WeakPolarHBondContact O-CB 3.46Å; R769-R773 PolarHBondContact O-N 3.17Å; R769-R773 VanDerWaalsContact O-N 3.09Å; K770-R773 PolarHBondContact O-N 3.43Å; K771-R773 PolarHBondContact O-N 3.37Å; R773-R777 PolarHBondContact O-N 2.8Å
774	L	93.8	Very high	92.5	Very high	76 Å²	76	52.4 Å²	52.4	40%	0.398	25%	0.248	S	C	.	.	H	α-helix	trans	-68.6	-43.8	178	-167.4	67.9	0	0	0	111.1	M720 K770 K771 V772 R777 V778	M720-L774 HydrophobicContact CE-CB 4.01Å; M720-L774 HydrophobicContact CE-CD2 3.83Å; M720-L774 HydrophobicContact CE-CG 3.55Å; K770-L774 PolarHBondContact O-N 3.14Å; K771-L774 WeakPolarHBondContact O-CB 3.38Å; K771-L774 PolarHBondContact O-N 3.24Å; K771-L774 VanDerWaalsContact O-N 3.15Å; V772-L774 PolarHBondContact O-N 3.12Å; L774-R777 PolarHBondContact O-N 3.03Å; L774-V778 PolarHBondContact O-N 2.95Å; L774-V778 VanDerWaalsContact O-N 3.1Å
775	F	95.9	Very high	92.7	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.2	-46.7	173.8	-175.9	-93.3	0	0	0	111.8	M720 L741 A744 A745 L748 K771 V772 R777 V778 C779 L797 L801	M720-F775 HydrophobicContact CE-CB 4.34Å; M720-F775 HydrophobicContact SD-CB 4.12Å; M720-F775 HydrophobicContact SD-CD2 3.68Å; M720-F775 HydrophobicContact SD-CG 4.4Å; L741-F775 HydrophobicContact CD2-CE2 4.04Å; L741-F775 HydrophobicContact CD2-CZ 4.09Å; A744-F775 HydrophobicContact CB-CD2 3.75Å; A744-F775 HydrophobicContact CB-CE2 3.61Å; A745-F775 HydrophobicContact CB-CE1 4.12Å; A745-F775 HydrophobicContact CB-CE2 4.43Å; A745-F775 HydrophobicContact CB-CZ 3.75Å; L748-F775 HydrophobicContact CD1-CB 3.56Å; L748-F775 HydrophobicContact CD1-CD1 4.17Å; L748-F775 HydrophobicContact CD1-CD2 4.32Å; L748-F775 HydrophobicContact CD1-CG 3.75Å; K771-F775 PolarHBondContact O-N 3.21Å; V772-F775 PolarHBondContact O-N 3.29Å; F775-R777 PolarHBondContact O-N 3.2Å; F775-V778 PolarHBondContact O-N 3.42Å; F775-C779 WeakPolarHBondContact CE1-SG 3.48Å; F775-C779 WeakPolarHBondContact CZ-SG 3.11Å; F775-C779 PolarHBondContact O-N 2.87Å; F775-L797 HydrophobicContact CE1-CB 4.5Å; F775-L801 HydrophobicContact CD1-CD1 3.36Å; F775-L801 HydrophobicContact CE1-CD1 3.36Å; F775-L801 HydrophobicContact CG-CD1 4.39Å; F775-L801 HydrophobicContact CZ-CD1 4.39Å
776	C	95.3	Very high	92.6	Very high	3 Å²	3	56.6 Å²	56.6	2%	0.02	27%	0.271	C	S	.	.	H	α-helix	trans	-59.4	-29.8	176.2	-66.4	0	0	0	0	113.2	V772 Q780 L798 L827	V772-C776 PolarHBondContact O-N 3.23Å; V772-C776 PolarHBondContact O-SG 3.22Å; V772-C776 VanDerWaalsContact O-SG 3.36Å; C776-Q780 WeakPolarHBondContact O-CB 3.45Å; C776-Q780 PolarHBondContact O-N 3.44Å; C776-L798 HydrophobicContact CB-CD1 3.95Å; C776-L827 HydrophobicContact CB-CD2 4.33Å
777	R	93.6	Very high	92.7	Very high	176 Å²	176	58.9 Å²	58.9	66%	0.664	28%	0.278	S	S	*	.	H	α-helix	trans	-72.2	-41.9	171.9	174.4	173.7	-75.4	-171.9	-6.8	112.3	R773 L774 F775 Q780 T781	R773-R777 PolarHBondContact O-N 2.8Å; L774-R777 PolarHBondContact O-N 3.03Å; F775-R777 PolarHBondContact O-N 3.2Å; R777-Q780 WeakPolarHBondContact O-CB 3.45Å; R777-Q780 PolarHBondContact O-N 2.77Å; R777-T781 PolarHBondContact O-N 3.18Å; R777-T781 VanDerWaalsContact O-N 3.13Å; R777-T781 PolarHBondContact O-OG1 3.43Å
778	V	94.5	Very high	92.7	Very high	9 Å²	9	57.6 Å²	57.6	6%	0.055	28%	0.278	C	S	.	.	H	α-helix	trans	-60	-48.8	174.9	170.1	0	0	0	0	109.9	M720 L723 K724 I727 L741 L774 F775 Q780 T781 C782	M720-V778 HydrophobicContact CE-CB 4.4Å; M720-V778 HydrophobicContact CE-CG2 3.62Å; M720-V778 HydrophobicContact SD-CG2 4.43Å; L723-V778 HydrophobicContact CB-CG1 3.97Å; L723-V778 HydrophobicContact CD1-CG1 4.23Å; K724-V778 HydrophobicContact CG-CG2 4.29Å; I727-V778 HydrophobicContact CD1-CG1 3.95Å; L741-V778 HydrophobicContact CD2-CG1 4.44Å; L774-V778 PolarHBondContact O-N 2.95Å; L774-V778 VanDerWaalsContact O-N 3.1Å; F775-V778 PolarHBondContact O-N 3.42Å; V778-Q780 VanDerWaalsContact C-N 3.29Å; V778-Q780 PolarHBondContact O-N 3.21Å; V778-T781 PolarHBondContact O-N 3.47Å; V778-T781 VanDerWaalsContact O-N 3.12Å; V778-C782 PolarHBondContact O-N 3.39Å; V778-C782 PolarHBondContact O-SG 3.06Å
779	C	95.4	Very high	92.7	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-59.2	-37.1	174	-65.7	0	0	0	0	113	F775 T781 C782 L783 A794 L798	F775-C779 WeakPolarHBondContact CE1-SG 3.48Å; F775-C779 WeakPolarHBondContact CZ-SG 3.11Å; F775-C779 PolarHBondContact O-N 2.87Å; C779-T781 VanDerWaalsContact C-N 3.34Å; C779-T781 PolarHBondContact O-N 3.12Å; C779-C782 WeakPolarHBondContact O-CB 3.5Å; C779-C782 PolarHBondContact O-N 2.93Å; C779-C782 VanDerWaalsContact O-N 3.13Å; C779-L783 WeakPolarHBondContact O-CG 3.34Å; C779-L783 PolarHBondContact O-N 3.31Å; C779-L783 VanDerWaalsContact O-N 3.08Å; C779-A794 HydrophobicContact CB-CB 4.19Å; C779-L798 HydrophobicContact CB-CB 4.14Å; C779-L798 HydrophobicContact CB-CD1 4.28Å; C779-L798 HydrophobicContact CB-CD2 4.35Å; C779-L798 HydrophobicContact CB-CG 4.5Å
780	Q	94.9	Very high	92.8	Very high	37 Å²	37	58.6 Å²	58.6	17%	0.173	29%	0.285	C	S	.	.	H	α-helix	trans	-58.3	-45.4	175	-165.6	-171.3	-24.5	0	0	111.3	C776 R777 V778 C782 L783 S826 L827 E830	C776-Q780 WeakPolarHBondContact O-CB 3.45Å; C776-Q780 PolarHBondContact O-N 3.44Å; R777-Q780 WeakPolarHBondContact O-CB 3.45Å; R777-Q780 PolarHBondContact O-N 2.77Å; V778-Q780 VanDerWaalsContact C-N 3.29Å; V778-Q780 PolarHBondContact O-N 3.21Å; Q780-C782 VanDerWaalsContact C-N 3.29Å; Q780-C782 PolarHBondContact O-N 3.15Å; Q780-L783 WeakPolarHBondContact O-CB 3.37Å; Q780-L783 PolarHBondContact O-N 2.92Å; Q780-L783 VanDerWaalsContact O-N 3.16Å; Q780-S826 PolarHBondContact NE2-OG 2.79Å; Q780-S826 PolarHBondContact OE1-OG 3.17Å; Q780-L827 HydrophobicContact CB-CD1 3.8Å; Q780-L827 HydrophobicContact CG-CD1 3.73Å; Q780-E830 HydrophobicContact CG-CB 4.38Å; Q780-E830 HydrophobicContact CG-CG 3.66Å
781	T	93	Very high	92.9	Very high	62 Å²	62	52.6 Å²	52.6	38%	0.38	26%	0.259	S	S	.	.	H	α-helix	trans	-65.9	-32.5	176	-46.6	0	0	0	0	112	I727 R777 V778 C779 L783 S784	I727-T781 HydrophobicContact CG2-CG2 3.58Å; R777-T781 PolarHBondContact O-N 3.18Å; R777-T781 VanDerWaalsContact O-N 3.13Å; R777-T781 PolarHBondContact O-OG1 3.43Å; V778-T781 PolarHBondContact O-N 3.47Å; V778-T781 VanDerWaalsContact O-N 3.12Å; C779-T781 VanDerWaalsContact C-N 3.34Å; C779-T781 PolarHBondContact O-N 3.12Å; T781-L783 VanDerWaalsContact C-N 3.28Å; T781-L783 PolarHBondContact O-N 3.45Å; T781-S784 PolarHBondContact O-N 2.83Å; T781-S784 PolarHBondContact O-OG 2.92Å
782	C	93.8	Very high	92.9	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.007	25%	0.253	C	S	.	.	H	α-helix	trans	-67.1	-24	173.5	-61.4	0	0	0	0	113.7	V778 C779 Q780 S784 L785 I790 R791 A794	V778-C782 PolarHBondContact O-N 3.39Å; V778-C782 PolarHBondContact O-SG 3.06Å; C779-C782 WeakPolarHBondContact O-CB 3.5Å; C779-C782 PolarHBondContact O-N 2.93Å; C779-C782 VanDerWaalsContact O-N 3.13Å; Q780-C782 VanDerWaalsContact C-N 3.29Å; Q780-C782 PolarHBondContact O-N 3.15Å; C782-S784 VanDerWaalsContact C-N 3.25Å; C782-S784 PolarHBondContact O-N 2.83Å; C782-L785 HydrophobicContact CB-CD1 4.37Å; C782-L785 PolarHBondContact O-N 3.46Å; C782-I790 HydrophobicContact CB-CG2 4.35Å; C782-R791 WeakPolarHBondContact O-CA 3.4Å; C782-R791 WeakPolarHBondContact O-CB 3.29Å; C782-R791 WeakPolarHBondContact O-CG 3.41Å; C782-A794 HydrophobicContact CB-CB 3.46Å; C782-A794 VanDerWaalsContact CB-CB 3.46Å
783	L	93.3	Very high	92.9	Very high	8 Å²	8	52.7 Å²	52.7	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-66.9	-25.7	179.2	-66.3	-175.7	0	0	0	113.2	C779 Q780 T781 R791 F795 L798 E830 L831 F834	C779-L783 WeakPolarHBondContact O-CG 3.34Å; C779-L783 PolarHBondContact O-N 3.31Å; C779-L783 VanDerWaalsContact O-N 3.08Å; Q780-L783 WeakPolarHBondContact O-CB 3.37Å; Q780-L783 PolarHBondContact O-N 2.92Å; Q780-L783 VanDerWaalsContact O-N 3.16Å; T781-L783 VanDerWaalsContact C-N 3.28Å; T781-L783 PolarHBondContact O-N 3.45Å; L783-R791 VanDerWaalsContact O-CD 3.3Å; L783-R791 WeakPolarHBondContact O-CD 3.31Å; L783-R791 WeakPolarHBondContact O-CG 3.19Å; L783-F795 HydrophobicContact CD2-CB 3.68Å; L783-F795 HydrophobicContact CD2-CD2 3.96Å; L783-F795 HydrophobicContact CD2-CG 4.33Å; L783-L798 HydrophobicContact CD1-CD2 3.97Å; L783-E830 HydrophobicContact CD1-CB 3.66Å; L783-L831 HydrophobicContact CD1-CD2 4.38Å; L783-F834 HydrophobicContact CD2-CD2 4.11Å
784	S	88.8	Confident	93.1	Very high	87 Å²	87	45.9 Å²	45.9	61%	0.608	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.5	23.6	178.9	62.9	0	0	0	0	113.4	T781 C782	T781-S784 PolarHBondContact O-N 2.83Å; T781-S784 PolarHBondContact O-OG 2.92Å; C782-S784 VanDerWaalsContact C-N 3.25Å; C782-S784 PolarHBondContact O-N 2.83Å
785	L	89.2	Confident	93.2	Very high	21 Å²	21	42.2 Å²	42.2	11%	0.11	22%	0.215	C	C	.	.			trans	-98.7	139.3	174.8	-62.6	178.7	0	0	0	111.1	F732 C782 Q787 I790 R791	F732-L785 HydrophobicContact CD1-CD1 4.45Å; F732-L785 HydrophobicContact CE1-CD1 3.98Å; F732-L785 HydrophobicContact CE1-CD2 3.93Å; F732-L785 HydrophobicContact CZ-CD2 3.79Å; C782-L785 HydrophobicContact CB-CD1 4.37Å; C782-L785 PolarHBondContact O-N 3.46Å; L785-Q787 PolarHBondContact O-N 3.08Å; L785-I790 HydrophobicContact CD1-CG2 4.12Å; L785-R791 WeakPolarHBondContact O-CD 3.22Å; L785-R791 PolarHBondContact O-NH1 3.23Å
786	D	85.5	Confident	93.2	Very high	151 Å²	151	44.8 Å²	44.8	81%	0.807	23%	0.227	S	C	*	.	S	Bend	trans	-63.6	-29.1	174.2	-61	-49.3	0	0	0	112	T788 R791	D786-T788 PolarHBondContact O-N 2.7Å; D786-R791 PolarHBondContact O-NH1 3.26Å
787	Q	89.8	Confident	93.3	Very high	86 Å²	86	45.2 Å²	45.2	40%	0.402	23%	0.229	S	C	.	.			trans	-62	103.6	179.7	-66.9	-62.9	-5.7	0	0	112.1	F732 L785 E789 I790 R791	F732-Q787 HydrophobicContact CB-CG 4.38Å; L785-Q787 PolarHBondContact O-N 3.08Å; Q787-E789 PolarHBondContact O-N 2.96Å; Q787-I790 HydrophobicContact CB-CB 4.29Å; Q787-I790 HydrophobicContact CB-CD1 3.85Å; Q787-I790 HydrophobicContact CB-CG1 4.13Å; Q787-I790 HydrophobicContact CG-CD1 4.21Å; Q787-I790 PolarHBondContact O-N 2.68Å; Q787-R791 VanDerWaalsContact O-CB 3.26Å; Q787-R791 WeakPolarHBondContact O-CB 3.19Å; Q787-R791 PolarHBondContact O-N 3.05Å
788	T	90.5	Very high	93.4	Very high	75 Å²	75	36.8 Å²	36.8	46%	0.46	20%	0.198	S	C	.	.	H	α-helix	trans	-62.9	-41.6	-167.3	59.1	0	0	0	0	113.4	D786 D792	D786-T788 PolarHBondContact O-N 2.7Å; T788-D792 WeakPolarHBondContact O-CB 3.48Å; T788-D792 PolarHBondContact O-N 3.32Å
789	E	91.1	Very high	93.5	Very high	114 Å²	114	36.5 Å²	36.5	53%	0.533	20%	0.196	S	C	.	.	H	α-helix	trans	-68.8	-45.4	-178.9	-65.4	-173	-158.7	0	0	112.6	T734 V738 Q787 Q793	T734-E789 HydrophobicContact CG2-CB 3.71Å; T734-E789 HydrophobicContact CG2-CG 4.34Å; T734-E789 WeakPolarHBondContact CG2-OE2 3.4Å; V738-E789 HydrophobicContact CG2-CB 4.33Å; Q787-E789 PolarHBondContact O-N 2.96Å; E789-Q793 WeakPolarHBondContact O-CB 3.38Å; E789-Q793 PolarHBondContact O-N 3.37Å
790	I	94.7	Very high	93.5	Very high	2 Å²	2	39.8 Å²	39.8	1%	0.01	21%	0.214	C	C	.	.	H	α-helix	trans	-62.5	-49.6	178.1	-54.1	176.4	0	0	0	109.8	T734 L737 V738 L741 C782 L785 Q787 A794	T734-I790 HydrophobicContact CG2-CG1 4.21Å; L737-I790 HydrophobicContact CB-CD1 4.16Å; L737-I790 HydrophobicContact CB-CG1 4.44Å; L737-I790 HydrophobicContact CD1-CD1 3.77Å; V738-I790 HydrophobicContact CG2-CG1 4.25Å; L741-I790 HydrophobicContact CD1-CG2 4.07Å; C782-I790 HydrophobicContact CB-CG2 4.35Å; L785-I790 HydrophobicContact CD1-CG2 4.12Å; Q787-I790 HydrophobicContact CB-CB 4.29Å; Q787-I790 HydrophobicContact CB-CD1 3.85Å; Q787-I790 HydrophobicContact CB-CG1 4.13Å; Q787-I790 HydrophobicContact CG-CD1 4.21Å; Q787-I790 PolarHBondContact O-N 2.68Å; I790-A794 VanDerWaalsContact O-CB 3.28Å; I790-A794 WeakPolarHBondContact O-CB 3.42Å; I790-A794 PolarHBondContact O-N 2.83Å
791	R	94.8	Very high	93.5	Very high	12 Å²	12	38 Å²	38	5%	0.045	21%	0.205	C	C	.	.	H	α-helix	trans	-62.2	-52.4	-177.9	-174.3	-161.8	54.9	-114.3	-1.9	112	C782 L783 L785 D786 Q787 Q793 A794 F795 F834 Y838	C782-R791 WeakPolarHBondContact O-CA 3.4Å; C782-R791 WeakPolarHBondContact O-CB 3.29Å; C782-R791 WeakPolarHBondContact O-CG 3.41Å; L783-R791 VanDerWaalsContact O-CD 3.3Å; L783-R791 WeakPolarHBondContact O-CD 3.31Å; L783-R791 WeakPolarHBondContact O-CG 3.19Å; L785-R791 WeakPolarHBondContact O-CD 3.22Å; L785-R791 PolarHBondContact O-NH1 3.23Å; D786-R791 PolarHBondContact O-NH1 3.26Å; Q787-R791 VanDerWaalsContact O-CB 3.26Å; Q787-R791 WeakPolarHBondContact O-CB 3.19Å; Q787-R791 PolarHBondContact O-N 3.05Å; R791-Q793 VanDerWaalsContact C-N 3.34Å; R791-Q793 PolarHBondContact O-N 3.34Å; R791-A794 PolarHBondContact O-N 3.25Å; R791-F795 PolarHBondContact O-N 3.41Å; R791-F834 HydrophobicContact CG-CD2 4.33Å; R791-F834 HydrophobicContact CG-CE2 4.01Å; R791-Y838 VanDerWaalsContact CZ-CE1 3.47Å
792	D	94.2	Very high	93.6	Very high	11 Å²	11	35.1 Å²	35.1	6%	0.059	19%	0.188	C	C	.	.	H	α-helix	trans	-66.1	-38.7	-177.8	-70.3	9.9	0	0	0	111.1	T788 F795 E796 K862 Q866	T788-D792 WeakPolarHBondContact O-CB 3.48Å; T788-D792 PolarHBondContact O-N 3.32Å; D792-F795 PolarHBondContact O-N 3.02Å; D792-E796 PolarHBondContact O-N 3.27Å; D792-E796 VanDerWaalsContact O-N 3.16Å; D792-K862 VanDerWaalsContact OD2-CE 3.28Å; D792-K862 WeakPolarHBondContact OD2-CE 3.42Å; D792-K862 IonicContact OD2-NZ 2.67Å; D792-K862 PolarHBondContact OD2-NZ 3.11Å; D792-Q866 VanDerWaalsContact CG-NE2 3.35Å; D792-Q866 PolarHBondContact OD2-NE2 3.23Å
793	Q	95.6	Very high	93.6	Very high	32 Å²	32	37.2 Å²	37.2	15%	0.15	20%	0.198	C	C	.	.	H	α-helix	trans	-67.8	-39	177.1	-171.3	65.1	93.8	0	0	112	V738 K742 E789 R791 F795 E796 L797	V738-Q793 HydrophobicContact CG1-CG 4.35Å; K742-Q793 VanDerWaalsContact CE-CD 3.46Å; K742-Q793 VanDerWaalsContact NZ-OE1 3.08Å; E789-Q793 WeakPolarHBondContact O-CB 3.38Å; E789-Q793 PolarHBondContact O-N 3.37Å; R791-Q793 VanDerWaalsContact C-N 3.34Å; R791-Q793 PolarHBondContact O-N 3.34Å; Q793-F795 VanDerWaalsContact C-N 3.33Å; Q793-E796 PolarHBondContact NE2-OE2 2.93Å; Q793-E796 PolarHBondContact O-N 3.17Å; Q793-L797 HydrophobicContact CG-CD1 3.96Å; Q793-L797 HydrophobicContact CG-CG 4.4Å; Q793-L797 WeakPolarHBondContact O-CG 3.2Å; Q793-L797 PolarHBondContact O-N 3.19Å; Q793-L797 VanDerWaalsContact O-N 3.1Å
794	A	96.8	Very high	93.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.5	-41	173.9	0	0	0	0	0	111.5	L741 C779 C782 I790 R791 L798	L741-A794 HydrophobicContact CD1-CB 4.17Å; C779-A794 HydrophobicContact CB-CB 4.19Å; C782-A794 HydrophobicContact CB-CB 3.46Å; C782-A794 VanDerWaalsContact CB-CB 3.46Å; I790-A794 VanDerWaalsContact O-CB 3.28Å; I790-A794 WeakPolarHBondContact O-CB 3.42Å; I790-A794 PolarHBondContact O-N 2.83Å; R791-A794 PolarHBondContact O-N 3.25Å; A794-L798 WeakPolarHBondContact O-CB 3.36Å; A794-L798 PolarHBondContact O-N 2.67Å
795	F	97	Very high	93.7	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-60.8	-45.5	176.2	-177	-90.1	0	0	0	112.7	L783 R791 D792 Q793 C799 L831 F834 L835 Q866	L783-F795 HydrophobicContact CD2-CB 3.68Å; L783-F795 HydrophobicContact CD2-CD2 3.96Å; L783-F795 HydrophobicContact CD2-CG 4.33Å; R791-F795 PolarHBondContact O-N 3.41Å; D792-F795 PolarHBondContact O-N 3.02Å; Q793-F795 VanDerWaalsContact C-N 3.33Å; F795-C799 PolarHBondContact O-N 3.38Å; F795-C799 PolarHBondContact O-SG 3.16Å; F795-L831 HydrophobicContact CD2-CD2 3.77Å; F795-L831 HydrophobicContact CE2-CD2 3.51Å; F795-L831 HydrophobicContact CZ-CD2 4.34Å; F795-F834 HydrophobicContact CB-CD2 4.22Å; F795-F834 HydrophobicContact CB-CE1 4.16Å; F795-F834 HydrophobicContact CB-CE2 3.82Å; F795-F834 HydrophobicContact CB-CZ 3.81Å; F795-F834 HydrophobicContact CD1-CD1 4.04Å; F795-F834 AromaticContact CD1-CE1 3.68Å; F795-F834 HydrophobicContact CD1-CE1 3.68Å; F795-F834 HydrophobicContact CD1-CZ 4.13Å; F795-F834 HydrophobicContact CD2-CB 3.93Å; F795-F834 AromaticContact CD2-CD1 3.31Å; F795-F834 HydrophobicContact CD2-CD1 3.31Å; F795-F834 AromaticContact CD2-CD2 3.81Å; F795-F834 HydrophobicContact CD2-CD2 3.81Å; F795-F834 AromaticContact CD2-CE1 3.74Å; F795-F834 HydrophobicContact CD2-CE1 3.74Å; F795-F834 HydrophobicContact CD2-CE2 4.17Å; F795-F834 AromaticContact CD2-CG 3.37Å; F795-F834 HydrophobicContact CD2-CG 3.37Å; F795-F834 HydrophobicContact CD2-CZ 4.15Å; F795-F834 HydrophobicContact CE1-CD1 4.04Å; F795-F834 AromaticContact CE1-CE1 3.94Å; F795-F834 HydrophobicContact CE1-CE1 3.94Å; F795-F834 HydrophobicContact CE2-CB 3.88Å; F795-F834 AromaticContact CE2-CD1 3.29Å; F795-F834 HydrophobicContact CE2-CD1 3.29Å; F795-F834 HydrophobicContact CE2-CD2 4.5Å; F795-F834 AromaticContact CE2-CE1 3.97Å; F795-F834 HydrophobicContact CE2-CE1 3.97Å; F795-F834 AromaticContact CE2-CG 3.63Å; F795-F834 HydrophobicContact CE2-CG 3.63Å; F795-F834 AromaticContact CG-CD1 3.7Å; F795-F834 HydrophobicContact CG-CD1 3.7Å; F795-F834 HydrophobicContact CG-CD2 4.17Å; F795-F834 AromaticContact CG-CE1 3.58Å; F795-F834 HydrophobicContact CG-CE1 3.58Å; F795-F834 HydrophobicContact CG-CE2 4.04Å; F795-F834 HydrophobicContact CG-CG 4.02Å; F795-F834 AromaticContact CG-CZ 3.77Å; F795-F834 HydrophobicContact CG-CZ 3.77Å; F795-F834 AromaticContact CZ-CD1 3.67Å; F795-F834 HydrophobicContact CZ-CD1 3.67Å; F795-F834 HydrophobicContact CZ-CE1 4.07Å; F795-F834 HydrophobicContact CZ-CG 4.45Å; F795-L835 HydrophobicContact CZ-CD2 4.24Å; F795-Q866 HydrophobicContact CD1-CB 4.16Å; F795-Q866 HydrophobicContact CD1-CG 4.16Å; F795-Q866 HydrophobicContact CE1-CB 3.9Å; F795-Q866 HydrophobicContact CE1-CG 4.41Å
796	E	95.9	Very high	93.8	Very high	53 Å²	53	34.3 Å²	34.3	25%	0.248	18%	0.176	C	C	.	.	H	α-helix	trans	-63.8	-51.5	178.9	-70.9	179.8	167.8	0	0	112.1	D792 Q793 L798 C799 D800 Q866	D792-E796 PolarHBondContact O-N 3.27Å; D792-E796 VanDerWaalsContact O-N 3.16Å; Q793-E796 PolarHBondContact NE2-OE2 2.93Å; Q793-E796 PolarHBondContact O-N 3.17Å; E796-L798 VanDerWaalsContact C-N 3.29Å; E796-L798 PolarHBondContact O-N 2.63Å; E796-C799 WeakPolarHBondContact O-CB 3.39Å; E796-C799 PolarHBondContact O-N 3.22Å; E796-C799 VanDerWaalsContact O-N 3.16Å; E796-D800 PolarHBondContact O-N 3.32Å; E796-Q866 HydrophobicContact CG-CG 4.35Å
797	L	96.2	Very high	93.7	Very high	12 Å²	12	29.3 Å²	29.3	6%	0.063	16%	0.155	C	C	.	.	H	α-helix	trans	-63.9	-35.8	180	-64.9	173.7	0	0	0	111.9	L741 K742 A745 F775 Q793 L801	L741-L797 HydrophobicContact CB-CD1 4.02Å; K742-L797 HydrophobicContact CG-CD1 4.3Å; A745-L797 HydrophobicContact CB-CB 4.15Å; A745-L797 HydrophobicContact CB-CD1 3.93Å; A745-L797 HydrophobicContact CB-CD2 3.82Å; A745-L797 HydrophobicContact CB-CG 4.18Å; F775-L797 HydrophobicContact CE1-CB 4.5Å; Q793-L797 HydrophobicContact CG-CD1 3.96Å; Q793-L797 HydrophobicContact CG-CG 4.4Å; Q793-L797 WeakPolarHBondContact O-CG 3.2Å; Q793-L797 PolarHBondContact O-N 3.19Å; Q793-L797 VanDerWaalsContact O-N 3.1Å; L797-L801 WeakPolarHBondContact O-CB 3.48Å; L797-L801 WeakPolarHBondContact O-CG 3.42Å; L797-L801 PolarHBondContact O-N 3Å
798	L	96.4	Very high	93.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.9	-44.4	173.6	177.8	63.6	0	0	0	111.6	C776 C779 L783 A794 E796 L802 L827 L831	C776-L798 HydrophobicContact CB-CD1 3.95Å; C779-L798 HydrophobicContact CB-CB 4.14Å; C779-L798 HydrophobicContact CB-CD1 4.28Å; C779-L798 HydrophobicContact CB-CD2 4.35Å; C779-L798 HydrophobicContact CB-CG 4.5Å; L783-L798 HydrophobicContact CD1-CD2 3.97Å; A794-L798 WeakPolarHBondContact O-CB 3.36Å; A794-L798 PolarHBondContact O-N 2.67Å; E796-L798 VanDerWaalsContact C-N 3.29Å; E796-L798 PolarHBondContact O-N 2.63Å; L798-L802 HydrophobicContact CD1-CD1 3.8Å; L798-L802 HydrophobicContact CD1-CG 4.01Å; L798-L802 HydrophobicContact CG-CD1 3.9Å; L798-L802 HydrophobicContact CG-CG 4.46Å; L798-L802 VanDerWaalsContact O-CB 3.22Å; L798-L802 WeakPolarHBondContact O-CB 3.4Å; L798-L802 WeakPolarHBondContact O-CG 3.38Å; L798-L802 PolarHBondContact O-N 3.03Å; L798-L827 HydrophobicContact CD1-CD1 4.37Å; L798-L827 HydrophobicContact CD1-CD2 4.28Å; L798-L827 HydrophobicContact CD2-CD1 3.75Å; L798-L831 HydrophobicContact CD2-CD2 3.72Å; L798-L831 HydrophobicContact CD2-CG 4.29Å; L798-L831 HydrophobicContact CG-CD2 4.35Å
799	C	96.5	Very high	92.9	Very high	3 Å²	3	26.3 Å²	26.3	2%	0.02	15%	0.145	C	C	.	.	H	α-helix	trans	-61	-47.7	176.1	-73.5	0	0	0	0	112	F795 E796 L802 L803 L873	F795-C799 PolarHBondContact O-N 3.38Å; F795-C799 PolarHBondContact O-SG 3.16Å; E796-C799 WeakPolarHBondContact O-CB 3.39Å; E796-C799 PolarHBondContact O-N 3.22Å; E796-C799 VanDerWaalsContact O-N 3.16Å; C799-L802 PolarHBondContact O-N 2.7Å; C799-L803 WeakPolarHBondContact O-CB 3.44Å; C799-L803 PolarHBondContact O-N 2.91Å; C799-L873 HydrophobicContact CB-CD1 4.43Å; C799-L873 WeakPolarHBondContact O-CD2 3.34Å
800	D	95.4	Very high	92.2	Very high	69 Å²	69	21.2 Å²	21.2	37%	0.369	12%	0.122	S	C	.	.	H	α-helix	trans	-70.5	-37.4	-177.3	-77.4	-19.3	0	0	0	112.4	M749 E796 L803 L804 K872	M749-D800 HydrophobicContact CE-CB 4.09Å; E796-D800 PolarHBondContact O-N 3.32Å; D800-L803 PolarHBondContact O-N 3.49Å; D800-L804 WeakPolarHBondContact O-CB 3.35Å; D800-L804 PolarHBondContact O-N 3.36Å; D800-K872 IonicContact OD1-NZ 2.86Å
801	L	94.9	Very high	90.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-68.8	-40.7	173.7	-74.4	175.2	0	0	0	113	A745 L748 M749 F775 L797 L803 L804 Y805	A745-L801 HydrophobicContact CB-CD1 4.16Å; L748-L801 HydrophobicContact CB-CD2 4.02Å; L748-L801 HydrophobicContact CD1-CD1 4.23Å; M749-L801 HydrophobicContact CE-CD2 4.1Å; M749-L801 HydrophobicContact CE-CG 4.13Å; M749-L801 HydrophobicContact CG-CD2 3.73Å; F775-L801 HydrophobicContact CD1-CD1 3.36Å; F775-L801 HydrophobicContact CE1-CD1 3.36Å; F775-L801 HydrophobicContact CG-CD1 4.39Å; F775-L801 HydrophobicContact CZ-CD1 4.39Å; L797-L801 WeakPolarHBondContact O-CB 3.48Å; L797-L801 WeakPolarHBondContact O-CG 3.42Å; L797-L801 PolarHBondContact O-N 3Å; L801-L803 VanDerWaalsContact C-N 3.27Å; L801-L803 PolarHBondContact O-N 3.4Å; L801-L804 HydrophobicContact CD2-CD2 4.45Å; L801-L804 PolarHBondContact O-N 2.91Å; L801-Y805 HydrophobicContact CD2-CD2 4.31Å; L801-Y805 HydrophobicContact CD2-CE2 4.08Å; L801-Y805 WeakPolarHBondContact O-CB 3.49Å; L801-Y805 PolarHBondContact O-N 3.36Å
802	L	95	Very high	89.5	Confident	1 Å²	1	33 Å²	33	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-63	-34.8	174.8	-76.6	176	0	0	0	111.6	L798 C799 G806 P823 L827 L831 L873 V878	L798-L802 HydrophobicContact CD1-CD1 3.8Å; L798-L802 HydrophobicContact CD1-CG 4.01Å; L798-L802 HydrophobicContact CG-CD1 3.9Å; L798-L802 HydrophobicContact CG-CG 4.46Å; L798-L802 VanDerWaalsContact O-CB 3.22Å; L798-L802 WeakPolarHBondContact O-CB 3.4Å; L798-L802 WeakPolarHBondContact O-CG 3.38Å; L798-L802 PolarHBondContact O-N 3.03Å; C799-L802 PolarHBondContact O-N 2.7Å; L802-G806 WeakPolarHBondContact O-CA 3.35Å; L802-G806 PolarHBondContact O-N 3.23Å; L802-P823 HydrophobicContact CD2-CB 4.44Å; L802-L827 HydrophobicContact CD1-CD2 4.39Å; L802-L831 HydrophobicContact CD1-CD1 3.83Å; L802-L873 HydrophobicContact CB-CD2 3.78Å; L802-L873 HydrophobicContact CD1-CD1 4.42Å; L802-V878 HydrophobicContact CB-CG1 4.13Å
803	L	93.9	Very high	88.8	Confident	45 Å²	45	37 Å²	37	24%	0.236	21%	0.206	C	C	.	.	H	α-helix	trans	-69.3	-46.2	172.6	-175.2	61.2	0	0	0	112	C799 D800 L801 G806 K872 L873 Y876	C799-L803 WeakPolarHBondContact O-CB 3.44Å; C799-L803 PolarHBondContact O-N 2.91Å; D800-L803 PolarHBondContact O-N 3.49Å; L801-L803 VanDerWaalsContact C-N 3.27Å; L801-L803 PolarHBondContact O-N 3.4Å; L803-G806 PolarHBondContact O-N 2.98Å; L803-K872 HydrophobicContact CD2-CB 4.1Å; L803-K872 HydrophobicContact CD2-CD 4.15Å; L803-L873 HydrophobicContact CB-CD2 4.22Å; L803-Y876 HydrophobicContact CD1-CD2 3.6Å; L803-Y876 HydrophobicContact CD1-CG 3.81Å
804	L	92.6	Very high	87.9	Confident	55 Å²	55	39.1 Å²	39.1	29%	0.288	22%	0.223	S	C	.	.	H	α-helix	trans	-67.2	-35.4	-177.3	179.9	62.1	0	0	0	113.5	M749 K752 D800 L801 S809	M749-L804 HydrophobicContact CB-CD2 4.04Å; M749-L804 HydrophobicContact CG-CD2 3.76Å; K752-L804 HydrophobicContact CB-CD2 4.12Å; K752-L804 HydrophobicContact CB-CG 4.4Å; K752-L804 HydrophobicContact CG-CD1 3.93Å; K752-L804 HydrophobicContact CG-CD2 4.15Å; K752-L804 HydrophobicContact CG-CG 3.9Å; D800-L804 WeakPolarHBondContact O-CB 3.35Å; D800-L804 PolarHBondContact O-N 3.36Å; L801-L804 HydrophobicContact CD2-CD2 4.45Å; L801-L804 PolarHBondContact O-N 2.91Å; L804-S809 WeakPolarHBondContact O-CB 3.31Å; L804-S809 PolarHBondContact O-OG 2.95Å
805	Y	92.5	Very high	87	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	0.3	176.5	-76.1	-93.2	0	0	0	113.8	L748 K752 L768 V772 L801 L819 V820 H821	L748-Y805 PolarHBondContact O-OH 2.94Å; K752-Y805 HydrophobicContact CB-CE1 4.44Å; K752-Y805 HydrophobicContact CB-CE2 4.05Å; K752-Y805 HydrophobicContact CD-CD1 4.47Å; K752-Y805 HydrophobicContact CD-CE1 4.07Å; L768-Y805 HydrophobicContact CD2-CE1 4.42Å; L768-Y805 HydrophobicContact CG-CE1 4.31Å; V772-Y805 HydrophobicContact CG1-CD2 4.26Å; V772-Y805 HydrophobicContact CG1-CG 4.2Å; V772-Y805 HydrophobicContact CG2-CD1 3.99Å; V772-Y805 HydrophobicContact CG2-CD2 4.12Å; V772-Y805 HydrophobicContact CG2-CE1 3.61Å; V772-Y805 HydrophobicContact CG2-CE2 3.75Å; V772-Y805 HydrophobicContact CG2-CG 4.23Å; V772-Y805 VanDerWaalsContact CG2-CZ 3.45Å; L801-Y805 HydrophobicContact CD2-CD2 4.31Å; L801-Y805 HydrophobicContact CD2-CE2 4.08Å; L801-Y805 WeakPolarHBondContact O-CB 3.49Å; L801-Y805 PolarHBondContact O-N 3.36Å; Y805-L819 HydrophobicContact CD1-CB 4.23Å; Y805-L819 HydrophobicContact CE1-CB 4.42Å; Y805-L819 HydrophobicContact CE1-CD2 4.31Å; Y805-V820 WeakPolarHBondContact O-CA 3.34Å; Y805-H821 PolarHBondContact O-N 2.92Å
806	G	89.8	Confident	86.3	Confident	0 Å²	0	42.8 Å²	42.8	0%	0	25%	0.245	C	C	.	.	S	Bend	trans	-66.9	157.5	177.1	0	0	0	0	0	113.7	L802 L803 V808 S809	L802-G806 WeakPolarHBondContact O-CA 3.35Å; L802-G806 PolarHBondContact O-N 3.23Å; L803-G806 PolarHBondContact O-N 2.98Å; G806-V808 PolarHBondContact O-N 3.36Å; G806-S809 WeakPolarHBondContact O-CB 3.09Å; G806-S809 PolarHBondContact O-N 3.16Å; G806-S809 VanDerWaalsContact O-N 3.11Å
807	A	85	Confident	85.7	Confident	45 Å²	45	48.4 Å²	48.4	37%	0.372	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-26.2	-174.6	0	0	0	0	0	114.4	V820	A807-V820 HydrophobicContact CB-CG1 3.94Å
808	V	82.4	Confident	85.2	Confident	41 Å²	41	48.4 Å²	48.4	25%	0.248	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-38.7	179.7	170.3	0	0	0	0	113.1	G806 V810 R811 Y876	G806-V808 PolarHBondContact O-N 3.36Å; V808-V810 PolarHBondContact O-N 2.98Å; V808-V810 VanDerWaalsContact O-N 3.15Å; V808-R811 VanDerWaalsContact CG1-NH2 3.31Å; V808-R811 PolarHBondContact O-N 3.08Å; V808-Y876 HydrophobicContact CG1-CD1 4.3Å; V808-Y876 WeakPolarHBondContact CG2-O 3.37Å
809	S	79.6	Confident	84.8	Confident	58 Å²	58	48.4 Å²	48.4	41%	0.406	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-26.3	177.4	175.6	0	0	0	0	112.5	L804 G806	L804-S809 WeakPolarHBondContact O-CB 3.31Å; L804-S809 PolarHBondContact O-OG 2.95Å; G806-S809 WeakPolarHBondContact O-CB 3.09Å; G806-S809 PolarHBondContact O-N 3.16Å; G806-S809 VanDerWaalsContact O-N 3.11Å
810	V	77.9	Confident	84.5	Confident	6 Å²	6	49.9 Å²	49.9	4%	0.036	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-0.4	-172.3	169.5	0	0	0	0	113.4	V808 G812 E813 L816 R817 V820	V808-V810 PolarHBondContact O-N 2.98Å; V808-V810 VanDerWaalsContact O-N 3.15Å; V810-G812 PolarHBondContact O-N 3.35Å; V810-E813 PolarHBondContact O-N 3.46Å; V810-L816 VanDerWaalsContact CG1-C 3.45Å; V810-L816 HydrophobicContact CG1-CB 3.98Å; V810-L816 HydrophobicContact CG2-CB 4.19Å; V810-R817 HydrophobicContact CG1-CB 4.42Å; V810-R817 HydrophobicContact CG1-CG 3.87Å; V810-V820 HydrophobicContact CB-CG2 3.99Å; V810-V820 HydrophobicContact CG1-CG2 4.05Å; V810-V820 HydrophobicContact CG2-CG2 3.95Å
811	R	64.9	Low	84.2	Confident	192 Å²	192	47.4 Å²	47.4	73%	0.725	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-15.7	-170.6	-78.7	-163.3	-76.8	-147	3.6	116.6	V808	V808-R811 VanDerWaalsContact CG1-NH2 3.31Å; V808-R811 PolarHBondContact O-N 3.08Å
812	G	67.6	Low	83.9	Confident	70 Å²	70	51.4 Å²	51.4	72%	0.722	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-35.2	173	0	0	0	0	0	114.6	V810	V810-G812 PolarHBondContact O-N 3.35Å
813	E	78.4	Confident	83.8	Confident	96 Å²	96	51.7 Å²	51.7	45%	0.449	28%	0.283	S	S	.	.			trans	-118.9	114.1	-164.3	-72.2	-57.2	153.8	0	0	112.6	V810 V815 L816	V810-E813 PolarHBondContact O-N 3.46Å; E813-V815 VanDerWaalsContact C-N 3.35Å; E813-V815 PolarHBondContact O-N 3.32Å; E813-L816 HydrophobicContact CB-CB 4.3Å; E813-L816 HydrophobicContact CB-CD1 3.9Å; E813-L816 HydrophobicContact CB-CG 3.99Å; E813-L816 HydrophobicContact CG-CD1 4.31Å; E813-L816 PolarHBondContact O-N 2.85Å
814	P	76.9	Confident	83.8	Confident	76 Å²	76	52.1 Å²	52.1	49%	0.494	29%	0.29	S	S	.	.	S	Bend	trans	-70	-30.2	-174.1	28.1	-34.2	0	0	0	113.2	R817	P814-R817 VanDerWaalsContact O-CB 3.32Å; P814-R817 WeakPolarHBondContact O-CB 3.36Å; P814-R817 WeakPolarHBondContact O-CD 3.45Å; P814-R817 WeakPolarHBondContact O-CG 3.28Å; P814-R817 PolarHBondContact O-N 2.97Å
815	V	77.6	Confident	83.8	Confident	72 Å²	72	55.2 Å²	55.2	44%	0.436	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-64.6	-41.9	179.5	-177.5	0	0	0	0	110.8	L765 E813 R817 A818	L765-V815 HydrophobicContact CD1-CG1 3.88Å; L765-V815 WeakPolarHBondContact CD1-O 3.19Å; E813-V815 VanDerWaalsContact C-N 3.35Å; E813-V815 PolarHBondContact O-N 3.32Å; V815-R817 PolarHBondContact O-N 3.19Å; V815-A818 PolarHBondContact O-N 3.44Å
816	L	83.4	Confident	83.9	Confident	4 Å²	4	58 Å²	58	2%	0.021	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-70.5	-2.2	-178	-57.7	-178	0	0	0	113.9	V756 L765 V810 E813 A818 L819	V756-L816 HydrophobicContact CB-CD1 4.34Å; V756-L816 HydrophobicContact CG2-CD1 3.62Å; L765-L816 HydrophobicContact CD1-CD2 4.4Å; L765-L816 HydrophobicContact CD2-CD2 4.11Å; V810-L816 VanDerWaalsContact CG1-C 3.45Å; V810-L816 HydrophobicContact CG1-CB 3.98Å; V810-L816 HydrophobicContact CG2-CB 4.19Å; E813-L816 HydrophobicContact CB-CB 4.3Å; E813-L816 HydrophobicContact CB-CD1 3.9Å; E813-L816 HydrophobicContact CB-CG 3.99Å; E813-L816 HydrophobicContact CG-CD1 4.31Å; E813-L816 PolarHBondContact O-N 2.85Å; L816-A818 PolarHBondContact O-N 3.22Å; L816-L819 HydrophobicContact CB-CD1 4.39Å; L816-L819 HydrophobicContact CD2-CD1 4Å; L816-L819 WeakPolarHBondContact O-CB 3.44Å; L816-L819 PolarHBondContact O-N 3.45Å
817	R	83.8	Confident	84.1	Confident	172 Å²	172	58.1 Å²	58.1	65%	0.649	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-59.2	-29.9	173.6	-68.6	175.8	-174.5	169.9	3.9	112.6	V810 P814 V815 L819 V820	V810-R817 HydrophobicContact CG1-CB 4.42Å; V810-R817 HydrophobicContact CG1-CG 3.87Å; P814-R817 VanDerWaalsContact O-CB 3.32Å; P814-R817 WeakPolarHBondContact O-CB 3.36Å; P814-R817 WeakPolarHBondContact O-CD 3.45Å; P814-R817 WeakPolarHBondContact O-CG 3.28Å; P814-R817 PolarHBondContact O-N 2.97Å; V815-R817 PolarHBondContact O-N 3.19Å; R817-L819 PolarHBondContact O-N 2.95Å; R817-V820 PolarHBondContact O-N 3.45Å; R817-V820 VanDerWaalsContact O-N 3.15Å
818	A	85.4	Confident	84.5	Confident	11 Å²	11	58.8 Å²	58.8	9%	0.091	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-61	-23.3	174	0	0	0	0	0	113.6	E762 L765 R769 V815 L816	E762-A818 HydrophobicContact CG-CB 3.88Å; L765-A818 HydrophobicContact CB-CB 3.87Å; L765-A818 HydrophobicContact CD1-CB 4.25Å; R769-A818 VanDerWaalsContact CD-O 3.22Å; R769-A818 WeakPolarHBondContact CD-O 3.15Å; R769-A818 PolarHBondContact NE-O 2.88Å; R769-A818 PolarHBondContact NH1-O 3.09Å; R769-A818 VanDerWaalsContact NH1-O 3.14Å; V815-A818 PolarHBondContact O-N 3.44Å; L816-A818 PolarHBondContact O-N 3.22Å
819	L	87.1	Confident	85.1	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.329	C	S	.	.	G	3₁₀ helix	trans	-79.5	-19	176.5	-66.4	175	0	0	0	114.3	K752 A755 L765 L768 Y805 L816 R817 H821	K752-L819 HydrophobicContact CD-CD1 3.86Å; A755-L819 HydrophobicContact CB-CD1 4.15Å; L765-L819 HydrophobicContact CB-CD2 3.88Å; L765-L819 HydrophobicContact CB-CG 4.13Å; L765-L819 HydrophobicContact CD2-CD1 3.91Å; L765-L819 HydrophobicContact CD2-CD2 3.76Å; L765-L819 HydrophobicContact CD2-CG 3.77Å; L765-L819 HydrophobicContact CG-CD2 4.42Å; L765-L819 HydrophobicContact CG-CG 4.45Å; L765-L819 WeakPolarHBondContact O-CD2 3.26Å; L768-L819 HydrophobicContact CB-CD2 4.01Å; L768-L819 HydrophobicContact CD2-CD2 3.84Å; L768-L819 HydrophobicContact CG-CD2 4.05Å; Y805-L819 HydrophobicContact CD1-CB 4.23Å; Y805-L819 HydrophobicContact CE1-CB 4.42Å; Y805-L819 HydrophobicContact CE1-CD2 4.31Å; L816-L819 HydrophobicContact CB-CD1 4.39Å; L816-L819 HydrophobicContact CD2-CD1 4Å; L816-L819 WeakPolarHBondContact O-CB 3.44Å; L816-L819 PolarHBondContact O-N 3.45Å; R817-L819 PolarHBondContact O-N 2.95Å; L819-H821 PolarHBondContact O-N 3.44Å
820	V	89.8	Confident	85.8	Confident	35 Å²	35	59.7 Å²	59.7	21%	0.212	32%	0.324	C	S	.	.			trans	-59.7	125.7	-166.1	174.2	0	0	0	0	111	R769 Y805 A807 V810 R817	R769-V820 WeakPolarHBondContact CD-O 3.41Å; Y805-V820 WeakPolarHBondContact O-CA 3.34Å; A807-V820 HydrophobicContact CB-CG1 3.94Å; V810-V820 HydrophobicContact CB-CG2 3.99Å; V810-V820 HydrophobicContact CG1-CG2 4.05Å; V810-V820 HydrophobicContact CG2-CG2 3.95Å; R817-V820 PolarHBondContact O-N 3.45Å; R817-V820 VanDerWaalsContact O-N 3.15Å
821	H	89.6	Confident	86.7	Confident	17 Å²	17	59.4 Å²	59.4	8%	0.079	32%	0.322	C	S	.	.			trans	-115.6	140.1	173.4	-170.7	30.6	0	0	0	109.5	V772 Y805 L819	V772-H821 HydrophobicContact CG1-CB 4.49Å; Y805-H821 PolarHBondContact O-N 2.92Å; L819-H821 PolarHBondContact O-N 3.44Å
822	L	89.4	Confident	88	Confident	84 Å²	84	51 Å²	51	44%	0.44	29%	0.294	S	S	.	.			trans	-127.4	146.6	170	-65.1	174.3	0	0	0	107.2
823	P	93.2	Very high	89.3	Confident	6 Å²	6	49.4 Å²	49.4	4%	0.039	27%	0.272	C	S	.	.			trans	-63.7	154.8	179.2	25.8	-33.1	0	0	0	111.8	L802 L827 R828 L879	L802-P823 HydrophobicContact CD2-CB 4.44Å; P823-L827 HydrophobicContact CB-CB 4.02Å; P823-L827 HydrophobicContact CB-CD2 3.8Å; P823-L827 HydrophobicContact CB-CG 3.99Å; P823-R828 HydrophobicContact CB-CG 4.27Å; P823-R828 HydrophobicContact CG-CG 4.04Å; P823-R828 VanDerWaalsContact O-CZ 3.24Å; P823-R828 PolarHBondContact O-NH1 3.04Å; P823-R828 VanDerWaalsContact O-NH1 3.16Å; P823-R828 PolarHBondContact O-NH2 2.93Å; P823-L879 HydrophobicContact CG-CD2 3.96Å
824	S	93	Very high	90.1	Very high	55 Å²	55	45 Å²	45	39%	0.385	25%	0.251	S	S	.	.			trans	-75.8	162.1	164.1	51.8	0	0	0	0	110.5	S826 L827 R828	S824-S826 PolarHBondContact O-N 3.16Å; S824-S826 PolarHBondContact OG-OG 2.97Å; S824-L827 WeakPolarHBondContact O-CA 3.16Å; S824-L827 WeakPolarHBondContact O-CB 3.1Å; S824-L827 PolarHBondContact O-N 2.9Å; S824-L827 WeakPolarHBondContact OG-CB 3.24Å; S824-L827 PolarHBondContact OG-N 3.33Å; S824-R828 WeakPolarHBondContact O-CG 3.15Å; S824-R828 PolarHBondContact O-N 3.28Å
825	D	92.2	Very high	90.9	Very high	120 Å²	120	41.3 Å²	41.3	64%	0.642	23%	0.227	S	C	*	.	H	α-helix	trans	-63.5	-31.2	178.6	-57.3	-67.8	0	0	0	112.8	R828 A829	D825-R828 VanDerWaalsContact CG-NH1 3.35Å; D825-R828 PolarHBondContact O-N 3.34Å; D825-R828 IonicContact OD1-CZ 3.86Å; D825-R828 IonicContact OD1-NH1 3.88Å; D825-R828 PolarHBondContact OD1-NH1 3.38Å; D825-R828 IonicContact OD2-NH1 2.68Å; D825-A829 PolarHBondContact O-N 3.09Å
826	S	94.3	Very high	91.5	Very high	57 Å²	57	41.9 Å²	41.9	40%	0.399	23%	0.227	S	C	.	.	H	α-helix	trans	-56.8	-50	167.4	63.9	0	0	0	0	111.6	Q780 S824 R828 A829 E830	Q780-S826 PolarHBondContact NE2-OG 2.79Å; Q780-S826 PolarHBondContact OE1-OG 3.17Å; S824-S826 PolarHBondContact O-N 3.16Å; S824-S826 PolarHBondContact OG-OG 2.97Å; S826-R828 VanDerWaalsContact C-N 3.32Å; S826-R828 PolarHBondContact O-N 3.01Å; S826-A829 WeakPolarHBondContact O-CA 3.27Å; S826-A829 WeakPolarHBondContact O-CB 3.26Å; S826-A829 PolarHBondContact O-N 3.1Å; S826-E830 WeakPolarHBondContact O-CG 3.1Å; S826-E830 PolarHBondContact O-N 3.38Å
827	L	94.5	Very high	91.9	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-69	-30.1	-178.4	-170.6	59.6	0	0	0	112.1	C776 Q780 L798 L802 P823 S824 A829 L831	C776-L827 HydrophobicContact CB-CD2 4.33Å; Q780-L827 HydrophobicContact CB-CD1 3.8Å; Q780-L827 HydrophobicContact CG-CD1 3.73Å; L798-L827 HydrophobicContact CD1-CD1 4.37Å; L798-L827 HydrophobicContact CD1-CD2 4.28Å; L798-L827 HydrophobicContact CD2-CD1 3.75Å; L802-L827 HydrophobicContact CD1-CD2 4.39Å; P823-L827 HydrophobicContact CB-CB 4.02Å; P823-L827 HydrophobicContact CB-CD2 3.8Å; P823-L827 HydrophobicContact CB-CG 3.99Å; S824-L827 WeakPolarHBondContact O-CA 3.16Å; S824-L827 WeakPolarHBondContact O-CB 3.1Å; S824-L827 PolarHBondContact O-N 2.9Å; S824-L827 WeakPolarHBondContact OG-CB 3.24Å; S824-L827 PolarHBondContact OG-N 3.33Å; L827-A829 VanDerWaalsContact C-N 3.31Å; L827-L831 HydrophobicContact CG-CD1 4.39Å; L827-L831 WeakPolarHBondContact O-CB 3.42Å; L827-L831 WeakPolarHBondContact O-CD1 3.39Å; L827-L831 WeakPolarHBondContact O-CG 3.3Å; L827-L831 PolarHBondContact O-N 3.09Å; L827-L831 VanDerWaalsContact O-N 3.13Å
828	R	94.4	Very high	92.2	Very high	59 Å²	59	40.5 Å²	40.5	22%	0.223	23%	0.228	C	C	.	.	H	α-helix	trans	-64.7	-35.6	169.4	-65.4	-175.6	-179.8	80.8	22.2	112	P823 S824 D825 S826 A832 L879	P823-R828 HydrophobicContact CB-CG 4.27Å; P823-R828 HydrophobicContact CG-CG 4.04Å; P823-R828 VanDerWaalsContact O-CZ 3.24Å; P823-R828 PolarHBondContact O-NH1 3.04Å; P823-R828 VanDerWaalsContact O-NH1 3.16Å; P823-R828 PolarHBondContact O-NH2 2.93Å; S824-R828 WeakPolarHBondContact O-CG 3.15Å; S824-R828 PolarHBondContact O-N 3.28Å; D825-R828 VanDerWaalsContact CG-NH1 3.35Å; D825-R828 PolarHBondContact O-N 3.34Å; D825-R828 IonicContact OD1-CZ 3.86Å; D825-R828 IonicContact OD1-NH1 3.88Å; D825-R828 PolarHBondContact OD1-NH1 3.38Å; D825-R828 IonicContact OD2-NH1 2.68Å; S826-R828 VanDerWaalsContact C-N 3.32Å; S826-R828 PolarHBondContact O-N 3.01Å; R828-A832 PolarHBondContact O-N 2.99Å; R828-L879 HydrophobicContact CB-CD2 4.38Å; R828-L879 HydrophobicContact CG-CD2 3.78Å
829	A	93.5	Very high	92.5	Very high	53 Å²	53	40.1 Å²	40.1	44%	0.438	22%	0.224	S	C	.	.	H	α-helix	trans	-73.1	-48.8	177	0	0	0	0	0	111.6	D825 S826 L827 L831 A832 S833	D825-A829 PolarHBondContact O-N 3.09Å; S826-A829 WeakPolarHBondContact O-CA 3.27Å; S826-A829 WeakPolarHBondContact O-CB 3.26Å; S826-A829 PolarHBondContact O-N 3.1Å; L827-A829 VanDerWaalsContact C-N 3.31Å; A829-L831 VanDerWaalsContact C-N 3.29Å; A829-L831 PolarHBondContact O-N 3.17Å; A829-A832 CarbonylContact O-C 3.54Å; A829-A832 WeakPolarHBondContact O-CA 3.42Å; A829-A832 WeakPolarHBondContact O-CB 3.34Å; A829-A832 PolarHBondContact O-N 2.84Å; A829-S833 PolarHBondContact O-N 2.93Å; A829-S833 PolarHBondContact O-OG 2.87Å
830	E	95.2	Very high	92.7	Very high	65 Å²	65	40.7 Å²	40.7	30%	0.304	23%	0.227	S	C	.	.	H	α-helix	trans	-61.6	-36.5	178.7	-52.9	-49.2	161.9	0	0	112.8	Q780 L783 S826 A832 S833 F834	Q780-E830 HydrophobicContact CG-CB 4.38Å; Q780-E830 HydrophobicContact CG-CG 3.66Å; L783-E830 HydrophobicContact CD1-CB 3.66Å; S826-E830 WeakPolarHBondContact O-CG 3.1Å; S826-E830 PolarHBondContact O-N 3.38Å; E830-A832 PolarHBondContact O-N 2.79Å; E830-S833 WeakPolarHBondContact CA-OG 3.46Å; E830-S833 PolarHBondContact O-OG 3.17Å; E830-S833 VanDerWaalsContact O-OG 3.09Å; E830-F834 WeakPolarHBondContact O-CB 3.28Å; E830-F834 PolarHBondContact O-N 3.27Å; E830-F834 VanDerWaalsContact O-N 3.13Å
831	L	95.7	Very high	92.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67	-18.8	173.6	-73.7	171.1	0	0	0	112.9	L783 F795 L798 L802 L827 A829 Y870 L873	L783-L831 HydrophobicContact CD1-CD2 4.38Å; F795-L831 HydrophobicContact CD2-CD2 3.77Å; F795-L831 HydrophobicContact CE2-CD2 3.51Å; F795-L831 HydrophobicContact CZ-CD2 4.34Å; L798-L831 HydrophobicContact CD2-CD2 3.72Å; L798-L831 HydrophobicContact CD2-CG 4.29Å; L798-L831 HydrophobicContact CG-CD2 4.35Å; L802-L831 HydrophobicContact CD1-CD1 3.83Å; L827-L831 HydrophobicContact CG-CD1 4.39Å; L827-L831 WeakPolarHBondContact O-CB 3.42Å; L827-L831 WeakPolarHBondContact O-CD1 3.39Å; L827-L831 WeakPolarHBondContact O-CG 3.3Å; L827-L831 PolarHBondContact O-N 3.09Å; L827-L831 VanDerWaalsContact O-N 3.13Å; A829-L831 VanDerWaalsContact C-N 3.29Å; A829-L831 PolarHBondContact O-N 3.17Å; L831-Y870 HydrophobicContact CB-CD2 4.19Å; L831-Y870 HydrophobicContact CB-CE2 3.88Å; L831-Y870 VanDerWaalsContact O-CD2 3.31Å; L831-Y870 WeakPolarHBondContact O-CD2 3.34Å; L831-Y870 WeakPolarHBondContact O-CE2 3.49Å; L831-L873 HydrophobicContact CD1-CD1 4.11Å
832	A	93.9	Very high	91.3	Very high	15 Å²	15	45.1 Å²	45.1	12%	0.124	25%	0.25	C	S	.	.	H	α-helix	trans	-94.4	-40.2	178.7	0	0	0	0	0	112.6	R828 A829 E830 L835 L836 N886	R828-A832 PolarHBondContact O-N 2.99Å; A829-A832 CarbonylContact O-C 3.54Å; A829-A832 WeakPolarHBondContact O-CA 3.42Å; A829-A832 WeakPolarHBondContact O-CB 3.34Å; A829-A832 PolarHBondContact O-N 2.84Å; E830-A832 PolarHBondContact O-N 2.79Å; A832-L835 PolarHBondContact O-N 3.1Å; A832-L836 PolarHBondContact O-N 3.1Å; A832-N886 WeakPolarHBondContact CB-ND2 3.47Å
833	S	94.1	Very high	89.7	Confident	37 Å²	37	44.5 Å²	44.5	26%	0.259	25%	0.253	S	S	.	.	H	α-helix	trans	-59.4	-47.2	171	45.6	0	0	0	0	110.6	A829 E830 L835 L836 D837	A829-S833 PolarHBondContact O-N 2.93Å; A829-S833 PolarHBondContact O-OG 2.87Å; E830-S833 WeakPolarHBondContact CA-OG 3.46Å; E830-S833 PolarHBondContact O-OG 3.17Å; E830-S833 VanDerWaalsContact O-OG 3.09Å; S833-L835 PolarHBondContact O-N 3.45Å; S833-L836 WeakPolarHBondContact O-CA 3.35Å; S833-L836 WeakPolarHBondContact O-CB 3.31Å; S833-L836 PolarHBondContact O-N 3.17Å; S833-D837 VanDerWaalsContact C-OD2 3.29Å; S833-D837 WeakPolarHBondContact CB-OD2 3.35Å; S833-D837 VanDerWaalsContact O-CG 3.23Å; S833-D837 PolarHBondContact O-N 3.38Å; S833-D837 VanDerWaalsContact O-OD2 3.05Å
834	F	95.2	Very high	87.8	Confident	2 Å²	2	47.4 Å²	47.4	1%	0.009	27%	0.266	C	S	.	.	H	α-helix	trans	-50.4	-37.7	176.7	-176.9	-79.4	0	0	0	113.7	L783 R791 F795 E830 Y838 V839 Q866	L783-F834 HydrophobicContact CD2-CD2 4.11Å; R791-F834 HydrophobicContact CG-CD2 4.33Å; R791-F834 HydrophobicContact CG-CE2 4.01Å; F795-F834 HydrophobicContact CB-CD2 4.22Å; F795-F834 HydrophobicContact CB-CE1 4.16Å; F795-F834 HydrophobicContact CB-CE2 3.82Å; F795-F834 HydrophobicContact CB-CZ 3.81Å; F795-F834 HydrophobicContact CD1-CD1 4.04Å; F795-F834 AromaticContact CD1-CE1 3.68Å; F795-F834 HydrophobicContact CD1-CE1 3.68Å; F795-F834 HydrophobicContact CD1-CZ 4.13Å; F795-F834 HydrophobicContact CD2-CB 3.93Å; F795-F834 AromaticContact CD2-CD1 3.31Å; F795-F834 HydrophobicContact CD2-CD1 3.31Å; F795-F834 AromaticContact CD2-CD2 3.81Å; F795-F834 HydrophobicContact CD2-CD2 3.81Å; F795-F834 AromaticContact CD2-CE1 3.74Å; F795-F834 HydrophobicContact CD2-CE1 3.74Å; F795-F834 HydrophobicContact CD2-CE2 4.17Å; F795-F834 AromaticContact CD2-CG 3.37Å; F795-F834 HydrophobicContact CD2-CG 3.37Å; F795-F834 HydrophobicContact CD2-CZ 4.15Å; F795-F834 HydrophobicContact CE1-CD1 4.04Å; F795-F834 AromaticContact CE1-CE1 3.94Å; F795-F834 HydrophobicContact CE1-CE1 3.94Å; F795-F834 HydrophobicContact CE2-CB 3.88Å; F795-F834 AromaticContact CE2-CD1 3.29Å; F795-F834 HydrophobicContact CE2-CD1 3.29Å; F795-F834 HydrophobicContact CE2-CD2 4.5Å; F795-F834 AromaticContact CE2-CE1 3.97Å; F795-F834 HydrophobicContact CE2-CE1 3.97Å; F795-F834 AromaticContact CE2-CG 3.63Å; F795-F834 HydrophobicContact CE2-CG 3.63Å; F795-F834 AromaticContact CG-CD1 3.7Å; F795-F834 HydrophobicContact CG-CD1 3.7Å; F795-F834 HydrophobicContact CG-CD2 4.17Å; F795-F834 AromaticContact CG-CE1 3.58Å; F795-F834 HydrophobicContact CG-CE1 3.58Å; F795-F834 HydrophobicContact CG-CE2 4.04Å; F795-F834 HydrophobicContact CG-CG 4.02Å; F795-F834 AromaticContact CG-CZ 3.77Å; F795-F834 HydrophobicContact CG-CZ 3.77Å; F795-F834 AromaticContact CZ-CD1 3.67Å; F795-F834 HydrophobicContact CZ-CD1 3.67Å; F795-F834 HydrophobicContact CZ-CE1 4.07Å; F795-F834 HydrophobicContact CZ-CG 4.45Å; E830-F834 WeakPolarHBondContact O-CB 3.28Å; E830-F834 PolarHBondContact O-N 3.27Å; E830-F834 VanDerWaalsContact O-N 3.13Å; F834-Y838 HydrophobicContact CB-CD2 4.35Å; F834-Y838 HydrophobicContact CD1-CD2 4.48Å; F834-Y838 AromaticContact CD2-CD2 3.48Å; F834-Y838 HydrophobicContact CD2-CD2 3.48Å; F834-Y838 VanDerWaalsContact CD2-CD2 3.48Å; F834-Y838 AromaticContact CD2-CE2 3.94Å; F834-Y838 HydrophobicContact CD2-CE2 3.94Å; F834-Y838 AromaticContact CE2-CD2 3.76Å; F834-Y838 HydrophobicContact CE2-CD2 3.76Å; F834-Y838 HydrophobicContact CE2-CE2 4.37Å; F834-Y838 HydrophobicContact CE2-CG 4.43Å; F834-Y838 AromaticContact CG-CD2 3.88Å; F834-Y838 HydrophobicContact CG-CD2 3.88Å; F834-Y838 HydrophobicContact CZ-CD2 4.35Å; F834-Y838 PolarHBondContact O-N 2.92Å; F834-Y838 VanDerWaalsContact O-N 3.11Å; F834-V839 HydrophobicContact CE1-CG2 4.28Å; F834-Q866 HydrophobicContact CE1-CB 4.34Å; F834-Q866 HydrophobicContact CE1-CG 4.35Å
835	L	94.2	Very high	85.8	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.282	C	S	.	.	I	π-helix	trans	-69.6	-38.3	175.6	-71.8	-170.5	0	0	0	113	F795 A832 S833 V839 F840 L867 Y870 V887	F795-L835 HydrophobicContact CZ-CD2 4.24Å; A832-L835 PolarHBondContact O-N 3.1Å; S833-L835 PolarHBondContact O-N 3.45Å; L835-V839 HydrophobicContact CD2-CB 4.17Å; L835-V839 HydrophobicContact CD2-CG1 4.5Å; L835-V839 HydrophobicContact CD2-CG2 3.83Å; L835-V839 CarbonylContact O-C 3.58Å; L835-V839 WeakPolarHBondContact O-CA 3.18Å; L835-V839 WeakPolarHBondContact O-CB 3.2Å; L835-V839 PolarHBondContact O-N 3.45Å; L835-F840 HydrophobicContact CB-CD2 4.23Å; L835-F840 HydrophobicContact CB-CE2 4.18Å; L835-F840 HydrophobicContact CD1-CE2 4.43Å; L835-F840 VanDerWaalsContact O-CD2 3.29Å; L835-F840 WeakPolarHBondContact O-CD2 3.41Å; L835-F840 PolarHBondContact O-N 2.99Å; L835-L867 HydrophobicContact CD1-CD1 4.12Å; L835-L867 HydrophobicContact CD2-CD1 4.11Å; L835-Y870 HydrophobicContact CD1-CD1 3.55Å; L835-Y870 HydrophobicContact CD1-CD2 3.86Å; L835-Y870 HydrophobicContact CD1-CE1 3.88Å; L835-Y870 HydrophobicContact CD1-CE2 4.17Å; L835-Y870 HydrophobicContact CD1-CG 3.52Å; L835-Y870 HydrophobicContact CG-CD2 4.22Å; L835-Y870 HydrophobicContact CG-CG 4.23Å; L835-V887 HydrophobicContact CD1-CG2 4Å
836	L	90	Very high	83.7	Confident	84 Å²	84	50.3 Å²	50.3	44%	0.44	28%	0.276	S	S	.	.	I	π-helix	trans	-70.2	-46.8	178.5	-61.7	172.8	0	0	0	110.5	A832 S833 F840	A832-L836 PolarHBondContact O-N 3.1Å; S833-L836 WeakPolarHBondContact O-CA 3.35Å; S833-L836 WeakPolarHBondContact O-CB 3.31Å; S833-L836 PolarHBondContact O-N 3.17Å; L836-F840 CarbonylContact O-C 3.57Å
837	D	91.1	Very high	81.5	Confident	79 Å²	79	55.5 Å²	55.5	42%	0.422	30%	0.299	S	S	.	.	I	π-helix	trans	-76	-38.4	-170.2	-54.5	-35.1	0	0	0	112.8	S833 N841	S833-D837 VanDerWaalsContact C-OD2 3.29Å; S833-D837 WeakPolarHBondContact CB-OD2 3.35Å; S833-D837 VanDerWaalsContact O-CG 3.23Å; S833-D837 PolarHBondContact O-N 3.38Å; S833-D837 VanDerWaalsContact O-OD2 3.05Å; D837-N841 PolarHBondContact O-ND2 2.85Å
838	Y	90.3	Very high	79.5	Confident	68 Å²	68	60.2 Å²	60.2	27%	0.267	32%	0.324	S	S	.	.	I	π-helix	trans	-117.3	-21.3	-170.9	-50.8	-66.1	0	0	0	115.1	R791 F834 K863	R791-Y838 VanDerWaalsContact CZ-CE1 3.47Å; F834-Y838 HydrophobicContact CB-CD2 4.35Å; F834-Y838 HydrophobicContact CD1-CD2 4.48Å; F834-Y838 AromaticContact CD2-CD2 3.48Å; F834-Y838 HydrophobicContact CD2-CD2 3.48Å; F834-Y838 VanDerWaalsContact CD2-CD2 3.48Å; F834-Y838 AromaticContact CD2-CE2 3.94Å; F834-Y838 HydrophobicContact CD2-CE2 3.94Å; F834-Y838 AromaticContact CE2-CD2 3.76Å; F834-Y838 HydrophobicContact CE2-CD2 3.76Å; F834-Y838 HydrophobicContact CE2-CE2 4.37Å; F834-Y838 HydrophobicContact CE2-CG 4.43Å; F834-Y838 AromaticContact CG-CD2 3.88Å; F834-Y838 HydrophobicContact CG-CD2 3.88Å; F834-Y838 HydrophobicContact CZ-CD2 4.35Å; F834-Y838 PolarHBondContact O-N 2.92Å; F834-Y838 VanDerWaalsContact O-N 3.11Å; Y838-K863 WeakPolarHBondContact O-CE 3.49Å
839	V	91.8	Very high	77.5	Confident	2 Å²	2	64 Å²	64	1%	0.012	35%	0.349	C	S	.	.	I	π-helix	trans	-101.9	-45.5	179.1	177.7	0	0	0	0	112.1	F834 L835 K863 Q866 L867 F898	F834-V839 HydrophobicContact CE1-CG2 4.28Å; L835-V839 HydrophobicContact CD2-CB 4.17Å; L835-V839 HydrophobicContact CD2-CG1 4.5Å; L835-V839 HydrophobicContact CD2-CG2 3.83Å; L835-V839 CarbonylContact O-C 3.58Å; L835-V839 WeakPolarHBondContact O-CA 3.18Å; L835-V839 WeakPolarHBondContact O-CB 3.2Å; L835-V839 PolarHBondContact O-N 3.45Å; V839-K863 HydrophobicContact CG1-CB 4.46Å; V839-Q866 HydrophobicContact CG2-CB 4.27Å; V839-L867 HydrophobicContact CG1-CB 4.11Å; V839-F898 HydrophobicContact CG1-CE1 4.23Å; V839-F898 HydrophobicContact CG1-CE2 3.92Å; V839-F898 HydrophobicContact CG1-CZ 3.7Å; V839-F898 WeakPolarHBondContact O-CE2 3.46Å
840	F	90.9	Very high	75.7	Confident	13 Å²	13	65.2 Å²	65.2	6%	0.057	35%	0.348	C	S	.	.	S	Bend	trans	-101.9	46.1	-177.8	-59.5	-55.1	0	0	0	112.9	L835 L836 L867 N886 H890 Y894 F898	L835-F840 HydrophobicContact CB-CD2 4.23Å; L835-F840 HydrophobicContact CB-CE2 4.18Å; L835-F840 HydrophobicContact CD1-CE2 4.43Å; L835-F840 VanDerWaalsContact O-CD2 3.29Å; L835-F840 WeakPolarHBondContact O-CD2 3.41Å; L835-F840 PolarHBondContact O-N 2.99Å; L836-F840 CarbonylContact O-C 3.57Å; F840-L867 HydrophobicContact CE1-CD2 4.2Å; F840-L867 HydrophobicContact CE2-CD1 4.23Å; F840-L867 HydrophobicContact CZ-CD1 3.68Å; F840-L867 HydrophobicContact CZ-CD2 4.1Å; F840-N886 WeakPolarHBondContact CE2-O 3.37Å; F840-H890 HydrophobicContact CD1-CB 3.72Å; F840-H890 AromaticContact CD1-CG 3.8Å; F840-H890 HydrophobicContact CD2-CB 4.35Å; F840-H890 AromaticContact CD2-CD2 3.6Å; F840-H890 AromaticContact CD2-CG 3.68Å; F840-H890 AromaticContact CD2-ND1 3.93Å; F840-H890 AromaticContact CD2-NE2 3.88Å; F840-H890 HydrophobicContact CE1-CB 3.56Å; F840-H890 AromaticContact CE1-CG 3.97Å; F840-H890 HydrophobicContact CE2-CB 4.22Å; F840-H890 AromaticContact CE2-CD2 3.6Å; F840-H890 AromaticContact CE2-CG 3.85Å; F840-H890 HydrophobicContact CG-CB 4.12Å; F840-H890 AromaticContact CG-CG 3.66Å; F840-H890 AromaticContact CG-ND1 3.67Å; F840-H890 HydrophobicContact CZ-CB 3.82Å; F840-H890 AromaticContact CZ-CG 3.99Å; F840-Y894 HydrophobicContact CB-CE2 3.95Å; F840-Y894 AromaticContact CD1-CD2 3.73Å; F840-Y894 HydrophobicContact CD1-CD2 3.73Å; F840-Y894 AromaticContact CD1-CE2 3.97Å; F840-Y894 HydrophobicContact CD1-CE2 3.97Å; F840-Y894 HydrophobicContact CD1-CG 4.23Å; F840-Y894 HydrophobicContact CE1-CD2 4.42Å; F840-Y894 HydrophobicContact CG-CE2 4.36Å; F840-Y894 PolarHBondContact O-OH 2.93Å; F840-Y894 VanDerWaalsContact O-OH 3.08Å; F840-F898 AromaticContact CD1-CD2 3.91Å; F840-F898 HydrophobicContact CD1-CD2 3.91Å; F840-F898 AromaticContact CD1-CE2 3.95Å; F840-F898 HydrophobicContact CD1-CE2 3.95Å; F840-F898 AromaticContact CE1-CD2 3.62Å; F840-F898 HydrophobicContact CE1-CD2 3.62Å; F840-F898 HydrophobicContact CE1-CE2 4.05Å; F840-F898 HydrophobicContact CE1-CG 4.4Å
841	N	83.3	Confident	73.7	Confident	72 Å²	72	68.4 Å²	68.4	39%	0.385	36%	0.363	S	S	.	.			trans	-99.6	145.7	178.7	-164	-32.2	0	0	0	111	D837 S843	D837-N841 PolarHBondContact O-ND2 2.85Å; N841-S843 PolarHBondContact OD1-N 3.24Å; N841-S843 PolarHBondContact OD1-OG 3.36Å
842	D	66.2	Low	72.2	Confident	73 Å²	73	71 Å²	71	39%	0.39	38%	0.377	S	S	.	.			trans	-92.9	-6.1	-176.5	-68	-33.4	0	0	0	114.6	E844 N845 K893 Y894	D842-E844 PolarHBondContact O-N 3.08Å; D842-N845 PolarHBondContact O-N 2.77Å; D842-N845 PolarHBondContact O-ND2 3.47Å; D842-K893 WeakPolarHBondContact OD1-CE 3.48Å; D842-K893 IonicContact OD1-NZ 3.17Å; D842-K893 PolarHBondContact OD1-NZ 3.11Å; D842-K893 IonicContact OD2-NZ 2.82Å; D842-K893 PolarHBondContact OD2-NZ 2.93Å; D842-Y894 PolarHBondContact OD1-OH 3.07Å
843	S	56.4	Low	71.1	Confident	71 Å²	71	75 Å²	75	50%	0.497	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-2.3	-170.9	61.4	0	0	0	0	116.4	N841	N841-S843 PolarHBondContact OD1-N 3.24Å; N841-S843 PolarHBondContact OD1-OG 3.36Å
844	E	53.7	Low	70	Confident	66 Å²	66	79.2 Å²	79.2	31%	0.308	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.7	8.4	-175	-77.4	157.2	-150.5	0	0	113.8	D842 I846 K856 K863	D842-E844 PolarHBondContact O-N 3.08Å; E844-I846 PolarHBondContact O-N 2.69Å; E844-K856 VanDerWaalsContact O-CE 3.28Å; E844-K856 WeakPolarHBondContact O-CE 3.23Å; E844-K856 PolarHBondContact O-NZ 2.94Å; E844-K863 IonicContact OE1-NZ 2.77Å; E844-K863 PolarHBondContact OE1-NZ 3.11Å; E844-K863 IonicContact OE2-NZ 3.5Å; E844-K863 PolarHBondContact OE2-NZ 3.09Å
845	N	50.3	Low	69.1	Low	134 Å²	134	85.1 Å²	85.1	72%	0.717	44%	0.436	S	S	*	.			trans	-82.6	26.8	168.8	-65.9	-62.2	0	0	0	113.3	D842	D842-N845 PolarHBondContact O-N 2.77Å; D842-N845 PolarHBondContact O-ND2 3.47Å
846	I	48.6	Very low	68.4	Low	103 Å²	103	89 Å²	89	53%	0.528	45%	0.454	S	S	.	.	S	Bend	trans	-83.1	129.5	165.3	-55	178	0	0	0	107.3	E844 L848 K856	E844-I846 PolarHBondContact O-N 2.69Å; I846-L848 HydrophobicContact CB-CG 4.4Å; I846-L848 HydrophobicContact CG2-CD2 3.82Å; I846-L848 HydrophobicContact CG2-CG 4Å; I846-L848 PolarHBondContact O-N 3.24Å; I846-K856 PolarHBondContact O-NZ 2.64Å
847	D	48.7	Very low	68.1	Low	165 Å²	165	89.2 Å²	89.2	88%	0.882	46%	0.458	S	S	*	.			trans	-71.6	116.3	168	-61.8	-50.6	0	0	0	108.1
848	L	52.2	Low	67.7	Low	104 Å²	104	88.5 Å²	88.5	55%	0.545	46%	0.463	S	S	.	.			trans	-128.1	154.5	-179.7	-64.8	174.3	0	0	0	108.3	I846 D852	I846-L848 HydrophobicContact CB-CG 4.4Å; I846-L848 HydrophobicContact CG2-CD2 3.82Å; I846-L848 HydrophobicContact CG2-CG 4Å; I846-L848 PolarHBondContact O-N 3.24Å; L848-D852 HydrophobicContact CB-CB 4.08Å; L848-D852 HydrophobicContact CD1-CB 4.5Å
849	D	53.3	Low	67.5	Low	139 Å²	139	88.6 Å²	88.6	74%	0.743	47%	0.468	S	S	*	.			trans	-65	164.3	-172.7	-59.2	-58	0	0	0	113.5	E851 D852	D849-E851 PolarHBondContact O-N 3.19Å; D849-E851 VanDerWaalsContact O-N 3.07Å; D849-D852 PolarHBondContact O-N 2.6Å
850	D	54.9	Low	67.4	Low	78 Å²	78	90.8 Å²	90.8	42%	0.417	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-53.4	-33	-175.9	-77.1	-28.3	0	0	0	113.4	D852 L853	D850-D852 PolarHBondContact O-N 3.21Å; D850-D852 VanDerWaalsContact O-N 3.15Å; D850-L853 VanDerWaalsContact O-CB 3.23Å; D850-L853 WeakPolarHBondContact O-CB 3.43Å; D850-L853 PolarHBondContact O-N 3.03Å
851	E	54.1	Low	67.3	Low	132 Å²	132	94.5 Å²	94.5	62%	0.617	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-65.6	-11.7	177.7	-65.2	-177.1	-164.9	0	0	113.9	D849 K855 R1209	D849-E851 PolarHBondContact O-N 3.19Å; D849-E851 VanDerWaalsContact O-N 3.07Å; E851-K855 WeakPolarHBondContact O-CE 3.44Å; E851-K855 PolarHBondContact O-NZ 3.25Å; E851-R1209 IonicContact OE1-CZ 2.79Å; E851-R1209 IonicContact OE1-NH2 2.64Å; E851-R1209 PolarHBondContact OE1-NH2 2.66Å
852	D	64.2	Low	67.7	Low	55 Å²	55	94.2 Å²	94.2	29%	0.294	49%	0.492	S	S	.	.	G	3₁₀ helix	trans	-99.8	-7.7	171.2	-81.4	-22	0	0	0	113.5	L848 D849 D850 E854 K855 K856	L848-D852 HydrophobicContact CB-CB 4.08Å; L848-D852 HydrophobicContact CD1-CB 4.5Å; D849-D852 PolarHBondContact O-N 2.6Å; D850-D852 PolarHBondContact O-N 3.21Å; D850-D852 VanDerWaalsContact O-N 3.15Å; D852-E854 PolarHBondContact O-N 2.86Å; D852-K855 PolarHBondContact O-N 2.92Å; D852-K855 WeakPolarHBondContact OD1-CD 3.42Å; D852-K855 IonicContact OD1-NZ 2.72Å; D852-K855 PolarHBondContact OD1-NZ 3.47Å; D852-K856 VanDerWaalsContact O-CB 3.3Å; D852-K856 WeakPolarHBondContact O-CB 3.23Å; D852-K856 PolarHBondContact O-N 3.18Å
853	L	69.3	Low	69	Low	98 Å²	98	91.4 Å²	91.4	51%	0.513	48%	0.477	S	S	.	.	H	α-helix	trans	-63.5	-41	-176.8	-176.4	60.2	0	0	0	112.3	D850 K856 V857	D850-L853 VanDerWaalsContact O-CB 3.23Å; D850-L853 WeakPolarHBondContact O-CB 3.43Å; D850-L853 PolarHBondContact O-N 3.03Å; L853-K856 WeakPolarHBondContact O-CB 3.35Å; L853-K856 PolarHBondContact O-N 3.4Å; L853-V857 WeakPolarHBondContact O-CG2 3.16Å; L853-V857 PolarHBondContact O-N 2.88Å
854	E	71.5	Confident	70.8	Confident	125 Å²	125	90.1 Å²	90.1	58%	0.584	46%	0.461	S	S	*	.	H	α-helix	trans	-69.5	-41	179.3	-61.5	-166.5	137.3	0	0	112	D852 K856 V857 A858	D852-E854 PolarHBondContact O-N 2.86Å; E854-K856 VanDerWaalsContact C-N 3.28Å; E854-K856 PolarHBondContact O-N 2.81Å; E854-V857 PolarHBondContact O-N 3.33Å; E854-V857 VanDerWaalsContact O-N 3.16Å; E854-A858 WeakPolarHBondContact O-CB 3.37Å; E854-A858 PolarHBondContact O-N 3.22Å
855	K	76.3	Confident	72.8	Confident	126 Å²	126	91.1 Å²	91.1	55%	0.548	47%	0.468	S	S	.	.	H	α-helix	trans	-59.8	-41.7	173.2	-56.4	170.9	-152.5	146.9	0	110.3	E851 D852 A858 L859	E851-K855 WeakPolarHBondContact O-CE 3.44Å; E851-K855 PolarHBondContact O-NZ 3.25Å; D852-K855 PolarHBondContact O-N 2.92Å; D852-K855 WeakPolarHBondContact OD1-CD 3.42Å; D852-K855 IonicContact OD1-NZ 2.72Å; D852-K855 PolarHBondContact OD1-NZ 3.47Å; K855-A858 PolarHBondContact O-N 3.35Å; K855-L859 WeakPolarHBondContact O-CB 3.29Å; K855-L859 PolarHBondContact O-N 2.92Å
856	K	80.1	Confident	74.9	Confident	83 Å²	83	84.9 Å²	84.9	36%	0.361	44%	0.435	S	S	.	.	H	α-helix	trans	-64.7	-39.5	175.1	-164.5	166.3	-168	161.6	0	112.2	E844 I846 D852 L853 E854 L860	E844-K856 VanDerWaalsContact O-CE 3.28Å; E844-K856 WeakPolarHBondContact O-CE 3.23Å; E844-K856 PolarHBondContact O-NZ 2.94Å; I846-K856 PolarHBondContact O-NZ 2.64Å; D852-K856 VanDerWaalsContact O-CB 3.3Å; D852-K856 WeakPolarHBondContact O-CB 3.23Å; D852-K856 PolarHBondContact O-N 3.18Å; L853-K856 WeakPolarHBondContact O-CB 3.35Å; L853-K856 PolarHBondContact O-N 3.4Å; E854-K856 VanDerWaalsContact C-N 3.28Å; E854-K856 PolarHBondContact O-N 2.81Å; K856-L860 WeakPolarHBondContact O-CB 3.44Å; K856-L860 PolarHBondContact O-N 3.36Å
857	V	82.6	Confident	77.3	Confident	88 Å²	88	80 Å²	80	53%	0.533	41%	0.41	S	S	.	.	H	α-helix	trans	-66.8	-42.8	173.6	168.3	0	0	0	0	111.8	L853 E854 L860 Q861	L853-V857 WeakPolarHBondContact O-CG2 3.16Å; L853-V857 PolarHBondContact O-N 2.88Å; E854-V857 PolarHBondContact O-N 3.33Å; E854-V857 VanDerWaalsContact O-N 3.16Å; V857-L860 PolarHBondContact O-N 3.07Å; V857-Q861 WeakPolarHBondContact O-CB 3.33Å; V857-Q861 PolarHBondContact O-N 2.98Å
858	A	82.8	Confident	79.6	Confident	64 Å²	64	73 Å²	73	53%	0.529	38%	0.376	S	S	.	.	H	α-helix	trans	-63.8	-46	176.9	0	0	0	0	0	111.9	E854 K855 Q861 K862	E854-A858 WeakPolarHBondContact O-CB 3.37Å; E854-A858 PolarHBondContact O-N 3.22Å; K855-A858 PolarHBondContact O-N 3.35Å; A858-Q861 PolarHBondContact O-N 3.41Å; A858-K862 PolarHBondContact O-N 2.83Å
859	L	86.3	Confident	81.7	Confident	69 Å²	69	68.3 Å²	68.3	36%	0.361	35%	0.353	S	S	.	.	H	α-helix	trans	-62.7	-43.8	175.4	-179.2	59	0	0	0	111.9	K855 Q861 K862 K863	K855-L859 WeakPolarHBondContact O-CB 3.29Å; K855-L859 PolarHBondContact O-N 2.92Å; L859-Q861 VanDerWaalsContact C-N 3.32Å; L859-Q861 PolarHBondContact O-N 2.92Å; L859-K862 WeakPolarHBondContact O-CB 3.24Å; L859-K862 PolarHBondContact O-N 3.47Å; L859-K863 PolarHBondContact O-N 3.34Å
860	L	88.9	Confident	83.8	Confident	49 Å²	49	61.8 Å²	61.8	26%	0.257	32%	0.318	S	S	.	.	H	α-helix	trans	-60	-42.2	173.3	172.7	57	0	0	0	111.4	K856 V857 K862 K863 R864 D897 F898	K856-L860 WeakPolarHBondContact O-CB 3.44Å; K856-L860 PolarHBondContact O-N 3.36Å; V857-L860 PolarHBondContact O-N 3.07Å; L860-K862 VanDerWaalsContact C-N 3.32Å; L860-K862 PolarHBondContact O-N 2.95Å; L860-K863 PolarHBondContact O-N 2.95Å; L860-R864 HydrophobicContact CD1-CG 3.99Å; L860-R864 HydrophobicContact CG-CG 4.41Å; L860-R864 WeakPolarHBondContact O-CB 3.5Å; L860-R864 VanDerWaalsContact O-CG 3.24Å; L860-R864 WeakPolarHBondContact O-CG 3.26Å; L860-R864 PolarHBondContact O-N 3.44Å; L860-D897 HydrophobicContact CD1-CB 3.75Å; L860-F898 HydrophobicContact CD1-CE1 4.01Å; L860-F898 HydrophobicContact CD1-CZ 4.36Å
861	Q	90.6	Very high	85.8	Confident	90 Å²	90	58.3 Å²	58.3	42%	0.421	30%	0.3	S	S	.	.	H	α-helix	trans	-66.3	-33.8	177.2	-173.6	53.6	48.1	0	0	112.2	V857 A858 L859 R864 N865	V857-Q861 WeakPolarHBondContact O-CB 3.33Å; V857-Q861 PolarHBondContact O-N 2.98Å; A858-Q861 PolarHBondContact O-N 3.41Å; L859-Q861 VanDerWaalsContact C-N 3.32Å; L859-Q861 PolarHBondContact O-N 2.92Å; Q861-R864 PolarHBondContact O-N 2.91Å; Q861-N865 PolarHBondContact NE2-OD1 3.32Å; Q861-N865 VanDerWaalsContact O-CG 3.22Å; Q861-N865 PolarHBondContact O-N 3.35Å; Q861-N865 PolarHBondContact O-OD1 3.44Å
862	K	90.8	Very high	87.8	Confident	67 Å²	67	56 Å²	56	29%	0.291	29%	0.288	S	S	.	.	H	α-helix	trans	-61.5	-51.6	170.3	-163.2	-170.8	-169.5	-168.3	0	111.3	D792 A858 L859 L860 R864 N865 Q866	D792-K862 VanDerWaalsContact OD2-CE 3.28Å; D792-K862 WeakPolarHBondContact OD2-CE 3.42Å; D792-K862 IonicContact OD2-NZ 2.67Å; D792-K862 PolarHBondContact OD2-NZ 3.11Å; A858-K862 PolarHBondContact O-N 2.83Å; L859-K862 WeakPolarHBondContact O-CB 3.24Å; L859-K862 PolarHBondContact O-N 3.47Å; L860-K862 VanDerWaalsContact C-N 3.32Å; L860-K862 PolarHBondContact O-N 2.95Å; K862-R864 VanDerWaalsContact C-N 3.31Å; K862-R864 PolarHBondContact O-N 2.98Å; K862-N865 WeakPolarHBondContact O-CB 3.15Å; K862-N865 PolarHBondContact O-N 3.37Å; K862-N865 VanDerWaalsContact O-N 3.08Å; K862-Q866 WeakPolarHBondContact O-CG 3.31Å; K862-Q866 PolarHBondContact O-N 3.06Å
863	K	92.8	Very high	89.3	Confident	14 Å²	14	53.5 Å²	53.5	6%	0.061	27%	0.274	C	S	.	.	H	α-helix	trans	-59.4	-39.6	176	-68.5	-178.9	-177.7	-177.2	0	112.5	Y838 V839 E844 L859 L860 Q866 L867 F898	Y838-K863 WeakPolarHBondContact O-CE 3.49Å; V839-K863 HydrophobicContact CG1-CB 4.46Å; E844-K863 IonicContact OE1-NZ 2.77Å; E844-K863 PolarHBondContact OE1-NZ 3.11Å; E844-K863 IonicContact OE2-NZ 3.5Å; E844-K863 PolarHBondContact OE2-NZ 3.09Å; L859-K863 PolarHBondContact O-N 3.34Å; L860-K863 PolarHBondContact O-N 2.95Å; K863-Q866 PolarHBondContact O-N 3.46Å; K863-L867 WeakPolarHBondContact O-CB 3.18Å; K863-L867 PolarHBondContact O-N 3.01Å; K863-F898 HydrophobicContact CB-CE1 3.98Å; K863-F898 HydrophobicContact CB-CZ 3.91Å; K863-F898 HydrophobicContact CD-CZ 4.49Å
864	R	95	Very high	90.5	Very high	44 Å²	44	49 Å²	49	17%	0.166	25%	0.251	C	S	.	.	H	α-helix	trans	-62.9	-39.7	174	-75.1	172	62.2	72.3	3	112.1	L860 Q861 K862 G868 D897 F898 D900 I901	L860-R864 HydrophobicContact CD1-CG 3.99Å; L860-R864 HydrophobicContact CG-CG 4.41Å; L860-R864 WeakPolarHBondContact O-CB 3.5Å; L860-R864 VanDerWaalsContact O-CG 3.24Å; L860-R864 WeakPolarHBondContact O-CG 3.26Å; L860-R864 PolarHBondContact O-N 3.44Å; Q861-R864 PolarHBondContact O-N 2.91Å; K862-R864 VanDerWaalsContact C-N 3.31Å; K862-R864 PolarHBondContact O-N 2.98Å; R864-G868 PolarHBondContact O-N 3.32Å; R864-D897 WeakPolarHBondContact CD-O 3.33Å; R864-D897 PolarHBondContact NH1-O 2.94Å; R864-F898 HydrophobicContact CG-CD1 3.78Å; R864-F898 HydrophobicContact CG-CE1 3.77Å; R864-D900 IonicContact CZ-OD1 2.87Å; R864-D900 IonicContact CZ-OD2 3.72Å; R864-D900 IonicContact NH1-OD1 3.77Å; R864-D900 PolarHBondContact NH1-OD1 2.92Å; R864-D900 IonicContact NH1-OD2 3.68Å; R864-D900 IonicContact NH2-OD1 2.73Å; R864-D900 PolarHBondContact NH2-OD1 2.87Å; R864-D900 IonicContact NH2-OD2 2.7Å; R864-D900 PolarHBondContact NH2-OD2 3.29Å; R864-I901 HydrophobicContact CB-CD1 3.84Å; R864-I901 HydrophobicContact CG-CD1 3.98Å
865	N	95.2	Very high	91.6	Very high	86 Å²	86	44.8 Å²	44.8	46%	0.46	23%	0.232	S	C	.	.	H	α-helix	trans	-63.9	-47.5	173.8	-71.4	-14.1	0	0	0	111.5	Q861 K862 G868 G869	Q861-N865 PolarHBondContact NE2-OD1 3.32Å; Q861-N865 VanDerWaalsContact O-CG 3.22Å; Q861-N865 PolarHBondContact O-N 3.35Å; Q861-N865 PolarHBondContact O-OD1 3.44Å; K862-N865 WeakPolarHBondContact O-CB 3.15Å; K862-N865 PolarHBondContact O-N 3.37Å; K862-N865 VanDerWaalsContact O-N 3.08Å; N865-G868 CarbonylContact O-C 3.59Å; N865-G868 WeakPolarHBondContact O-CA 3.39Å; N865-G868 PolarHBondContact O-N 3.05Å; N865-G869 PolarHBondContact O-N 2.9Å
866	Q	95.8	Very high	92.4	Very high	4 Å²	4	44.8 Å²	44.8	2%	0.019	23%	0.23	C	C	.	.	H	α-helix	trans	-60.6	-49.8	178.7	-69.1	165.2	-18.4	0	0	111.9	D792 F795 E796 F834 V839 K862 K863 G868 G869 Y870	D792-Q866 VanDerWaalsContact CG-NE2 3.35Å; D792-Q866 PolarHBondContact OD2-NE2 3.23Å; F795-Q866 HydrophobicContact CD1-CB 4.16Å; F795-Q866 HydrophobicContact CD1-CG 4.16Å; F795-Q866 HydrophobicContact CE1-CB 3.9Å; F795-Q866 HydrophobicContact CE1-CG 4.41Å; E796-Q866 HydrophobicContact CG-CG 4.35Å; F834-Q866 HydrophobicContact CE1-CB 4.34Å; F834-Q866 HydrophobicContact CE1-CG 4.35Å; V839-Q866 HydrophobicContact CG2-CB 4.27Å; K862-Q866 WeakPolarHBondContact O-CG 3.31Å; K862-Q866 PolarHBondContact O-N 3.06Å; K863-Q866 PolarHBondContact O-N 3.46Å; Q866-G868 VanDerWaalsContact C-N 3.28Å; Q866-G868 PolarHBondContact O-N 3.49Å; Q866-G869 WeakPolarHBondContact O-CA 3.33Å; Q866-G869 PolarHBondContact O-N 2.91Å; Q866-Y870 PolarHBondContact O-N 3.46Å; Q866-Y870 VanDerWaalsContact O-N 3.09Å
867	L	97.1	Very high	92.9	Very high	0 Å²	0	43 Å²	43	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-59.6	-40.7	174.7	-176.1	60.3	0	0	0	111.8	L835 V839 F840 K863 G869 Y870 C871 V887 F898 I901 I902	L835-L867 HydrophobicContact CD1-CD1 4.12Å; L835-L867 HydrophobicContact CD2-CD1 4.11Å; V839-L867 HydrophobicContact CG1-CB 4.11Å; F840-L867 HydrophobicContact CE1-CD2 4.2Å; F840-L867 HydrophobicContact CE2-CD1 4.23Å; F840-L867 HydrophobicContact CZ-CD1 3.68Å; F840-L867 HydrophobicContact CZ-CD2 4.1Å; K863-L867 WeakPolarHBondContact O-CB 3.18Å; K863-L867 PolarHBondContact O-N 3.01Å; L867-G869 VanDerWaalsContact C-N 3.3Å; L867-G869 PolarHBondContact O-N 3.33Å; L867-Y870 PolarHBondContact O-N 2.96Å; L867-C871 WeakPolarHBondContact O-CB 3.47Å; L867-C871 PolarHBondContact O-N 2.83Å; L867-C871 PolarHBondContact O-SG 2.96Å; L867-V887 HydrophobicContact CD1-CG1 4.2Å; L867-V887 HydrophobicContact CD1-CG2 4.03Å; L867-F898 HydrophobicContact CD2-CB 3.62Å; L867-F898 HydrophobicContact CD2-CD1 3.69Å; L867-F898 HydrophobicContact CD2-CD2 4.21Å; L867-F898 HydrophobicContact CD2-CE1 4.45Å; L867-F898 HydrophobicContact CD2-CG 3.57Å; L867-I901 HydrophobicContact CD2-CG2 4.26Å; L867-I901 HydrophobicContact CG-CG2 4.19Å; L867-I902 HydrophobicContact CD2-CG1 4.38Å
868	G	96.9	Very high	93.4	Very high	18 Å²	18	39.1 Å²	39.1	19%	0.186	21%	0.212	C	C	.	.	H	α-helix	trans	-59.3	-38.8	171.8	0	0	0	0	0	112.7	R864 N865 Q866 C871 K872	R864-G868 PolarHBondContact O-N 3.32Å; N865-G868 CarbonylContact O-C 3.59Å; N865-G868 WeakPolarHBondContact O-CA 3.39Å; N865-G868 PolarHBondContact O-N 3.05Å; Q866-G868 VanDerWaalsContact C-N 3.28Å; Q866-G868 PolarHBondContact O-N 3.49Å; G868-C871 PolarHBondContact O-N 3.24Å; G868-K872 WeakPolarHBondContact O-CG 3.42Å; G868-K872 PolarHBondContact O-N 2.78Å
869	G	96.4	Very high	94	Very high	6 Å²	6	36.2 Å²	36.2	6%	0.062	19%	0.187	C	C	.	.	H	α-helix	trans	-53.8	-60.1	170.9	0	0	0	0	0	112.5	N865 Q866 L867 C871 K872 L873	N865-G869 PolarHBondContact O-N 2.9Å; Q866-G869 WeakPolarHBondContact O-CA 3.33Å; Q866-G869 PolarHBondContact O-N 2.91Å; L867-G869 VanDerWaalsContact C-N 3.3Å; L867-G869 PolarHBondContact O-N 3.33Å; G869-C871 VanDerWaalsContact C-N 3.34Å; G869-C871 PolarHBondContact O-N 3.18Å; G869-K872 WeakPolarHBondContact O-CB 3.23Å; G869-K872 PolarHBondContact O-N 3.2Å; G869-K872 VanDerWaalsContact O-N 3.15Å; G869-L873 PolarHBondContact O-N 2.97Å
870	Y	97.6	Very high	94.3	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.008	20%	0.196	C	C	.	.	H	α-helix	trans	-58.9	-43.4	178.5	-169.1	-89	0	0	0	112.4	L831 L835 Q866 L867 K872 L873 V874 L879 A883 N886 V887	L831-Y870 HydrophobicContact CB-CD2 4.19Å; L831-Y870 HydrophobicContact CB-CE2 3.88Å; L831-Y870 VanDerWaalsContact O-CD2 3.31Å; L831-Y870 WeakPolarHBondContact O-CD2 3.34Å; L831-Y870 WeakPolarHBondContact O-CE2 3.49Å; L835-Y870 HydrophobicContact CD1-CD1 3.55Å; L835-Y870 HydrophobicContact CD1-CD2 3.86Å; L835-Y870 HydrophobicContact CD1-CE1 3.88Å; L835-Y870 HydrophobicContact CD1-CE2 4.17Å; L835-Y870 HydrophobicContact CD1-CG 3.52Å; L835-Y870 HydrophobicContact CG-CD2 4.22Å; L835-Y870 HydrophobicContact CG-CG 4.23Å; Q866-Y870 PolarHBondContact O-N 3.46Å; Q866-Y870 VanDerWaalsContact O-N 3.09Å; L867-Y870 PolarHBondContact O-N 2.96Å; Y870-K872 VanDerWaalsContact C-N 3.29Å; Y870-K872 PolarHBondContact O-N 2.6Å; Y870-L873 WeakPolarHBondContact O-CB 3.29Å; Y870-L873 PolarHBondContact O-N 3.19Å; Y870-V874 HydrophobicContact CD1-CG2 3.99Å; Y870-V874 HydrophobicContact CE1-CG2 3.81Å; Y870-V874 PolarHBondContact O-N 3.49Å; Y870-L879 HydrophobicContact CD2-CD1 4.08Å; Y870-L879 HydrophobicContact CE1-CD1 4.16Å; Y870-L879 HydrophobicContact CE2-CD1 3.63Å; Y870-A883 HydrophobicContact CE1-CB 4.49Å; Y870-N886 PolarHBondContact OH-ND2 3.05Å; Y870-V887 HydrophobicContact CD1-CG2 4.01Å; Y870-V887 HydrophobicContact CE1-CG2 4.17Å
871	C	97.4	Very high	94.4	Very high	4 Å²	4	36.2 Å²	36.2	3%	0.027	19%	0.188	C	C	.	.	H	α-helix	trans	-61.4	-35.7	178.5	-68.1	0	0	0	0	112.3	L867 G868 G869 V874 L875 T905	L867-C871 WeakPolarHBondContact O-CB 3.47Å; L867-C871 PolarHBondContact O-N 2.83Å; L867-C871 PolarHBondContact O-SG 2.96Å; G868-C871 PolarHBondContact O-N 3.24Å; G869-C871 VanDerWaalsContact C-N 3.34Å; G869-C871 PolarHBondContact O-N 3.18Å; C871-V874 PolarHBondContact O-N 2.99Å; C871-L875 WeakPolarHBondContact O-CB 3.39Å; C871-L875 VanDerWaalsContact O-CG 3.24Å; C871-L875 WeakPolarHBondContact O-CG 3.17Å; C871-L875 PolarHBondContact O-N 3.35Å; C871-T905 HydrophobicContact CB-CG2 4.19Å; C871-T905 WeakPolarHBondContact CB-OG1 3.01Å
872	K	96	Very high	94.5	Very high	85 Å²	85	34.6 Å²	34.6	37%	0.37	19%	0.186	S	C	.	.	H	α-helix	trans	-60	-46.3	170.9	-63.9	155.3	-165.3	171	0	110.9	D800 L803 G868 G869 Y870 V874 L875 Y876	D800-K872 IonicContact OD1-NZ 2.86Å; L803-K872 HydrophobicContact CD2-CB 4.1Å; L803-K872 HydrophobicContact CD2-CD 4.15Å; G868-K872 WeakPolarHBondContact O-CG 3.42Å; G868-K872 PolarHBondContact O-N 2.78Å; G869-K872 WeakPolarHBondContact O-CB 3.23Å; G869-K872 PolarHBondContact O-N 3.2Å; G869-K872 VanDerWaalsContact O-N 3.15Å; Y870-K872 VanDerWaalsContact C-N 3.29Å; Y870-K872 PolarHBondContact O-N 2.6Å; K872-V874 VanDerWaalsContact C-N 3.28Å; K872-V874 PolarHBondContact O-N 3.04Å; K872-L875 PolarHBondContact O-N 3.32Å; K872-Y876 HydrophobicContact CB-CD2 4.09Å; K872-Y876 HydrophobicContact CB-CE2 4.37Å; K872-Y876 WeakPolarHBondContact O-CB 3.37Å; K872-Y876 VanDerWaalsContact O-CD2 3.26Å; K872-Y876 WeakPolarHBondContact O-CD2 3.3Å; K872-Y876 PolarHBondContact O-N 3.06Å
873	L	96	Very high	94.7	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-58.1	-39.7	-178.5	-63.8	179.6	0	0	0	112.5	C799 L802 L803 L831 G869 Y870 G877 V878 L879	C799-L873 HydrophobicContact CB-CD1 4.43Å; C799-L873 WeakPolarHBondContact O-CD2 3.34Å; L802-L873 HydrophobicContact CB-CD2 3.78Å; L802-L873 HydrophobicContact CD1-CD1 4.42Å; L803-L873 HydrophobicContact CB-CD2 4.22Å; L831-L873 HydrophobicContact CD1-CD1 4.11Å; G869-L873 PolarHBondContact O-N 2.97Å; Y870-L873 WeakPolarHBondContact O-CB 3.29Å; Y870-L873 PolarHBondContact O-N 3.19Å; L873-G877 PolarHBondContact O-N 2.89Å; L873-V878 HydrophobicContact CB-CB 4.39Å; L873-V878 HydrophobicContact CD2-CB 4.11Å; L873-V878 HydrophobicContact CD2-CG1 4.18Å; L873-V878 HydrophobicContact CD2-CG2 4.34Å; L873-V878 PolarHBondContact O-N 3.19Å; L873-L879 HydrophobicContact CB-CD1 3.85Å; L873-L879 HydrophobicContact CB-CG 3.93Å; L873-L879 HydrophobicContact CD1-CD1 4.23Å; L873-L879 PolarHBondContact O-N 2.95Å
874	V	95.4	Very high	94.9	Very high	4 Å²	4	31.6 Å²	31.6	2%	0.024	18%	0.177	C	C	.	.	H	α-helix	trans	-72.2	-46.7	176.4	-173	0	0	0	0	111.6	Y870 C871 K872 Y876 G877 L879 L881 A883 A884	Y870-V874 HydrophobicContact CD1-CG2 3.99Å; Y870-V874 HydrophobicContact CE1-CG2 3.81Å; Y870-V874 PolarHBondContact O-N 3.49Å; C871-V874 PolarHBondContact O-N 2.99Å; K872-V874 VanDerWaalsContact C-N 3.28Å; K872-V874 PolarHBondContact O-N 3.04Å; V874-Y876 VanDerWaalsContact C-N 3.34Å; V874-Y876 PolarHBondContact O-N 3.48Å; V874-G877 PolarHBondContact O-N 3.43Å; V874-G877 VanDerWaalsContact O-N 3.16Å; V874-L879 HydrophobicContact CG2-CB 4.04Å; V874-L879 HydrophobicContact CG2-CD1 3.97Å; V874-L881 HydrophobicContact CG1-CD1 4.29Å; V874-A883 HydrophobicContact CG2-CB 3.98Å; V874-A884 HydrophobicContact CG1-CB 4.09Å
875	L	94.3	Very high	94.9	Very high	36 Å²	36	29.8 Å²	29.8	19%	0.188	17%	0.17	C	C	.	.	H	α-helix	trans	-70	-28.2	-177.3	-67.2	177.9	0	0	0	113.7	C871 K872 T905 K908 I912	C871-L875 WeakPolarHBondContact O-CB 3.39Å; C871-L875 VanDerWaalsContact O-CG 3.24Å; C871-L875 WeakPolarHBondContact O-CG 3.17Å; C871-L875 PolarHBondContact O-N 3.35Å; K872-L875 PolarHBondContact O-N 3.32Å; L875-T905 HydrophobicContact CD1-CG2 4.22Å; L875-T905 HydrophobicContact CD2-CG2 4.08Å; L875-T905 HydrophobicContact CG-CG2 4.13Å; L875-K908 HydrophobicContact CD1-CB 3.77Å; L875-K908 HydrophobicContact CD1-CG 4.03Å; L875-K908 HydrophobicContact CD2-CB 3.53Å; L875-K908 HydrophobicContact CG-CB 4.24Å; L875-I912 HydrophobicContact CB-CD1 4.25Å; L875-I912 HydrophobicContact CD2-CD1 3.8Å; L875-I912 WeakPolarHBondContact O-CD1 3.46Å
876	Y	92.3	Very high	94.8	Very high	126 Å²	126	27.5 Å²	27.5	49%	0.494	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	12.7	173.3	-65.4	-69.3	0	0	0	113.1	L803 V808 K872 V874 V878	L803-Y876 HydrophobicContact CD1-CD2 3.6Å; L803-Y876 HydrophobicContact CD1-CG 3.81Å; V808-Y876 HydrophobicContact CG1-CD1 4.3Å; V808-Y876 WeakPolarHBondContact CG2-O 3.37Å; K872-Y876 HydrophobicContact CB-CD2 4.09Å; K872-Y876 HydrophobicContact CB-CE2 4.37Å; K872-Y876 WeakPolarHBondContact O-CB 3.37Å; K872-Y876 VanDerWaalsContact O-CD2 3.26Å; K872-Y876 WeakPolarHBondContact O-CD2 3.3Å; K872-Y876 PolarHBondContact O-N 3.06Å; V874-Y876 VanDerWaalsContact C-N 3.34Å; V874-Y876 PolarHBondContact O-N 3.48Å; Y876-V878 VanDerWaalsContact C-N 3.33Å; Y876-V878 PolarHBondContact O-N 3.46Å
877	G	91.1	Very high	94.8	Very high	47 Å²	47	27.4 Å²	27.4	49%	0.485	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.1	32.9	168.6	0	0	0	0	0	114.9	L873 V874	L873-G877 PolarHBondContact O-N 2.89Å; V874-G877 PolarHBondContact O-N 3.43Å; V874-G877 VanDerWaalsContact O-N 3.16Å
878	V	93.6	Very high	94.7	Very high	5 Å²	5	27.4 Å²	27.4	3%	0.03	16%	0.158	C	C	.	.	S	Bend	trans	-87.3	-36.2	167.6	-173.9	0	0	0	0	110	L802 L873 Y876	L802-V878 HydrophobicContact CB-CG1 4.13Å; L873-V878 HydrophobicContact CB-CB 4.39Å; L873-V878 HydrophobicContact CD2-CB 4.11Å; L873-V878 HydrophobicContact CD2-CG1 4.18Å; L873-V878 HydrophobicContact CD2-CG2 4.34Å; L873-V878 PolarHBondContact O-N 3.19Å; Y876-V878 VanDerWaalsContact C-N 3.33Å; Y876-V878 PolarHBondContact O-N 3.46Å
879	L	94.4	Very high	94.5	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.021	16%	0.156	C	C	.	.	S	Bend	trans	-100.3	150.7	160.7	-62.4	175.5	0	0	0	109.1	P823 R828 Y870 L873 V874 A883	P823-L879 HydrophobicContact CG-CD2 3.96Å; R828-L879 HydrophobicContact CB-CD2 4.38Å; R828-L879 HydrophobicContact CG-CD2 3.78Å; Y870-L879 HydrophobicContact CD2-CD1 4.08Å; Y870-L879 HydrophobicContact CE1-CD1 4.16Å; Y870-L879 HydrophobicContact CE2-CD1 3.63Å; L873-L879 HydrophobicContact CB-CD1 3.85Å; L873-L879 HydrophobicContact CB-CG 3.93Å; L873-L879 HydrophobicContact CD1-CD1 4.23Å; L873-L879 PolarHBondContact O-N 2.95Å; V874-L879 HydrophobicContact CG2-CB 4.04Å; V874-L879 HydrophobicContact CG2-CD1 3.97Å; L879-A883 HydrophobicContact CB-CB 4.06Å; L879-A883 HydrophobicContact CD1-CB 4.38Å
880	D	92	Very high	94.3	Very high	102 Å²	102	29.3 Å²	29.3	55%	0.545	16%	0.16	S	C	.	.			trans	-63.3	147.9	172.6	-71	-69	0	0	0	111.2	S882 A883	D880-S882 WeakPolarHBondContact CB-OG 3.36Å; D880-S882 PolarHBondContact O-N 3Å; D880-A883 VanDerWaalsContact O-CB 3.28Å; D880-A883 WeakPolarHBondContact O-CB 3.41Å; D880-A883 PolarHBondContact O-N 2.88Å
881	L	92.1	Very high	94.1	Very high	16 Å²	16	30.2 Å²	30.2	8%	0.084	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-58.4	-24.9	-177.3	-157.8	73.1	0	0	0	112.4	V874 A883 A884 I912 N913 Q916 I920	V874-L881 HydrophobicContact CG1-CD1 4.29Å; L881-A883 VanDerWaalsContact C-N 3.26Å; L881-A883 PolarHBondContact O-N 2.91Å; L881-A884 WeakPolarHBondContact O-CB 3.49Å; L881-A884 PolarHBondContact O-N 3.29Å; L881-I912 HydrophobicContact CD1-CD1 4.46Å; L881-N913 HydrophobicContact CD2-CB 4.31Å; L881-Q916 HydrophobicContact CD2-CB 4.19Å; L881-Q916 HydrophobicContact CD2-CG 4.02Å; L881-I920 VanDerWaalsContact C-CD1 3.48Å; L881-I920 HydrophobicContact CB-CD1 3.81Å; L881-I920 HydrophobicContact CD2-CD1 3.69Å; L881-I920 HydrophobicContact CG-CD1 3.56Å; L881-I920 WeakPolarHBondContact O-CD1 3.45Å
882	S	93.1	Very high	93.7	Very high	55 Å²	55	31 Å²	31	39%	0.385	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-58.6	-30.1	171.9	39.3	0	0	0	0	113.9	D880 A884 T885	D880-S882 WeakPolarHBondContact CB-OG 3.36Å; D880-S882 PolarHBondContact O-N 3Å; S882-A884 PolarHBondContact O-N 2.94Å; S882-T885 WeakPolarHBondContact O-CG2 3.07Å; S882-T885 PolarHBondContact O-N 3.15Å; S882-T885 PolarHBondContact O-OG1 2.95Å
883	A	94.9	Very high	93.3	Very high	16 Å²	16	32.2 Å²	32.2	13%	0.132	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-61.9	-15.8	177.3	0	0	0	0	0	113.4	Y870 V874 L879 D880 L881 T885 N886	Y870-A883 HydrophobicContact CE1-CB 4.49Å; V874-A883 HydrophobicContact CG2-CB 3.98Å; L879-A883 HydrophobicContact CB-CB 4.06Å; L879-A883 HydrophobicContact CD1-CB 4.38Å; D880-A883 VanDerWaalsContact O-CB 3.28Å; D880-A883 WeakPolarHBondContact O-CB 3.41Å; D880-A883 PolarHBondContact O-N 2.88Å; L881-A883 VanDerWaalsContact C-N 3.26Å; L881-A883 PolarHBondContact O-N 2.91Å; A883-T885 PolarHBondContact O-N 3.25Å; A883-N886 WeakPolarHBondContact O-CB 3.33Å; A883-N886 PolarHBondContact O-N 3.18Å
884	A	95.6	Very high	93	Very high	2 Å²	2	33 Å²	33	2%	0.017	18%	0.177	C	C	.	.	G	3₁₀ helix	trans	-63.1	-13.7	169.4	0	0	0	0	0	113.8	V874 L881 S882 N886 V887 F888 I920	V874-A884 HydrophobicContact CG1-CB 4.09Å; L881-A884 WeakPolarHBondContact O-CB 3.49Å; L881-A884 PolarHBondContact O-N 3.29Å; S882-A884 PolarHBondContact O-N 2.94Å; A884-N886 PolarHBondContact O-N 3.28Å; A884-V887 PolarHBondContact O-N 3.44Å; A884-V887 VanDerWaalsContact O-N 3.13Å; A884-F888 HydrophobicContact CB-CD1 4.28Å; A884-F888 HydrophobicContact CB-CD2 4.37Å; A884-F888 HydrophobicContact CB-CE1 3.86Å; A884-F888 HydrophobicContact CB-CE2 3.96Å; A884-F888 HydrophobicContact CB-CZ 3.68Å; A884-F888 WeakPolarHBondContact O-CB 3.47Å; A884-F888 WeakPolarHBondContact O-CD1 3.39Å; A884-F888 WeakPolarHBondContact O-CG 3.46Å; A884-F888 PolarHBondContact O-N 3.38Å; A884-I920 HydrophobicContact CB-CG2 4.2Å
885	T	95	Very high	92.7	Very high	6 Å²	6	37.4 Å²	37.4	4%	0.037	20%	0.196	C	C	.	.	H	α-helix	trans	-55.2	-41.3	170.8	49.7	0	0	0	0	111.8	S882 A883 V887 F888 K889 I920 L923 Q927	S882-T885 WeakPolarHBondContact O-CG2 3.07Å; S882-T885 PolarHBondContact O-N 3.15Å; S882-T885 PolarHBondContact O-OG1 2.95Å; A883-T885 PolarHBondContact O-N 3.25Å; T885-V887 PolarHBondContact O-N 3.2Å; T885-F888 PolarHBondContact O-N 3.48Å; T885-K889 WeakPolarHBondContact O-CG 3.48Å; T885-K889 PolarHBondContact O-N 3.28Å; T885-I920 HydrophobicContact CG2-CG2 4.09Å; T885-L923 HydrophobicContact CG2-CB 4.17Å; T885-L923 HydrophobicContact CG2-CD2 3.81Å; T885-L923 HydrophobicContact CG2-CG 3.83Å; T885-Q927 VanDerWaalsContact CB-OE1 3.22Å
886	N	93.9	Very high	92.4	Very high	39 Å²	39	44.8 Å²	44.8	21%	0.209	23%	0.227	C	C	.	.	H	α-helix	trans	-66.9	-3.9	-177.5	-51.6	-13.9	0	0	0	112.9	A832 F840 Y870 A883 A884 H890	A832-N886 WeakPolarHBondContact CB-ND2 3.47Å; F840-N886 WeakPolarHBondContact CE2-O 3.37Å; Y870-N886 PolarHBondContact OH-ND2 3.05Å; A883-N886 WeakPolarHBondContact O-CB 3.33Å; A883-N886 PolarHBondContact O-N 3.18Å; A884-N886 PolarHBondContact O-N 3.28Å; N886-H890 PolarHBondContact O-CD2 2.98Å
887	V	95.3	Very high	92.3	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.006	21%	0.214	C	C	.	.	H	α-helix	trans	-121.4	-42.1	-179.9	177.1	0	0	0	0	110.8	L835 L867 Y870 A884 T885 K889 H890 I902	L835-V887 HydrophobicContact CD1-CG2 4Å; L867-V887 HydrophobicContact CD1-CG1 4.2Å; L867-V887 HydrophobicContact CD1-CG2 4.03Å; Y870-V887 HydrophobicContact CD1-CG2 4.01Å; Y870-V887 HydrophobicContact CE1-CG2 4.17Å; A884-V887 PolarHBondContact O-N 3.44Å; A884-V887 VanDerWaalsContact O-N 3.13Å; T885-V887 PolarHBondContact O-N 3.2Å; V887-K889 VanDerWaalsContact C-N 3.31Å; V887-K889 PolarHBondContact O-N 2.87Å; V887-H890 PolarHBondContact O-N 3.04Å; V887-I902 HydrophobicContact CG1-CB 4.36Å; V887-I902 HydrophobicContact CG1-CD1 4.46Å; V887-I902 HydrophobicContact CG1-CG1 3.73Å; V887-I902 HydrophobicContact CG1-CG2 4.11Å
888	F	95.1	Very high	92.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-67.9	-27.6	-175.6	-69.8	0.4	0	0	0	113.7	A884 T885 H890 Y891 I902 T905 V906 I920 V921 S924	A884-F888 HydrophobicContact CB-CD1 4.28Å; A884-F888 HydrophobicContact CB-CD2 4.37Å; A884-F888 HydrophobicContact CB-CE1 3.86Å; A884-F888 HydrophobicContact CB-CE2 3.96Å; A884-F888 HydrophobicContact CB-CZ 3.68Å; A884-F888 WeakPolarHBondContact O-CB 3.47Å; A884-F888 WeakPolarHBondContact O-CD1 3.39Å; A884-F888 WeakPolarHBondContact O-CG 3.46Å; A884-F888 PolarHBondContact O-N 3.38Å; T885-F888 PolarHBondContact O-N 3.48Å; F888-H890 VanDerWaalsContact C-N 3.27Å; F888-H890 PolarHBondContact O-N 2.97Å; F888-Y891 WeakPolarHBondContact O-CB 3.44Å; F888-Y891 PolarHBondContact O-N 3.1Å; F888-I902 HydrophobicContact CD1-CG2 4.19Å; F888-T905 HydrophobicContact CE1-CG2 4.03Å; F888-V906 HydrophobicContact CD1-CG2 3.61Å; F888-V906 HydrophobicContact CD2-CG2 4.29Å; F888-V906 HydrophobicContact CE1-CB 4.24Å; F888-V906 HydrophobicContact CE1-CG2 3.37Å; F888-V906 HydrophobicContact CE2-CG2 4.09Å; F888-V906 HydrophobicContact CG-CG2 4.08Å; F888-V906 HydrophobicContact CZ-CB 4.24Å; F888-V906 HydrophobicContact CZ-CG2 3.64Å; F888-I920 HydrophobicContact CD2-CG2 3.92Å; F888-I920 HydrophobicContact CE2-CG2 3.87Å; F888-V921 HydrophobicContact CD2-CG2 4.13Å; F888-V921 HydrophobicContact CE2-CG2 4.22Å; F888-S924 WeakPolarHBondContact CB-OG 3.37Å
889	K	92.9	Very high	92.4	Very high	33 Å²	33	38.7 Å²	38.7	14%	0.143	19%	0.192	C	C	.	.	G	3₁₀ helix	trans	-54.9	-43.7	172.1	-70.8	-178.6	176.7	-169.7	0	112.2	T885 V887 Y891 Q927 L928 E931 L948	T885-K889 WeakPolarHBondContact O-CG 3.48Å; T885-K889 PolarHBondContact O-N 3.28Å; V887-K889 VanDerWaalsContact C-N 3.31Å; V887-K889 PolarHBondContact O-N 2.87Å; K889-Y891 VanDerWaalsContact C-N 3.26Å; K889-Y891 PolarHBondContact O-N 3.13Å; K889-Q927 VanDerWaalsContact CE-OE1 3.32Å; K889-L928 HydrophobicContact CB-CD1 3.85Å; K889-L928 HydrophobicContact CB-CD2 4.23Å; K889-L928 HydrophobicContact CB-CG 4.09Å; K889-L928 HydrophobicContact CD-CD2 4.07Å; K889-L928 HydrophobicContact CD-CG 3.98Å; K889-L928 HydrophobicContact CG-CD1 3.87Å; K889-L928 HydrophobicContact CG-CD2 4.21Å; K889-L928 HydrophobicContact CG-CG 3.75Å; K889-E931 IonicContact NZ-OE1 2.65Å; K889-E931 PolarHBondContact NZ-OE1 3.26Å; K889-E931 IonicContact NZ-OE2 2.68Å; K889-E931 PolarHBondContact NZ-OE2 3.21Å; K889-L948 VanDerWaalsContact O-CD2 3.3Å; K889-L948 WeakPolarHBondContact O-CD2 3.41Å
890	H	92.1	Very high	92.4	Very high	31 Å²	31	42.4 Å²	42.4	14%	0.144	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-81	-3	-168.4	-60.2	-80.6	0	0	0	113.6	F840 N886 V887 F888 S892 K893 Y894	F840-H890 HydrophobicContact CD1-CB 3.72Å; F840-H890 AromaticContact CD1-CG 3.8Å; F840-H890 HydrophobicContact CD2-CB 4.35Å; F840-H890 AromaticContact CD2-CD2 3.6Å; F840-H890 AromaticContact CD2-CG 3.68Å; F840-H890 AromaticContact CD2-ND1 3.93Å; F840-H890 AromaticContact CD2-NE2 3.88Å; F840-H890 HydrophobicContact CE1-CB 3.56Å; F840-H890 AromaticContact CE1-CG 3.97Å; F840-H890 HydrophobicContact CE2-CB 4.22Å; F840-H890 AromaticContact CE2-CD2 3.6Å; F840-H890 AromaticContact CE2-CG 3.85Å; F840-H890 HydrophobicContact CG-CB 4.12Å; F840-H890 AromaticContact CG-CG 3.66Å; F840-H890 AromaticContact CG-ND1 3.67Å; F840-H890 HydrophobicContact CZ-CB 3.82Å; F840-H890 AromaticContact CZ-CG 3.99Å; N886-H890 PolarHBondContact O-CD2 2.98Å; V887-H890 PolarHBondContact O-N 3.04Å; F888-H890 VanDerWaalsContact C-N 3.27Å; F888-H890 PolarHBondContact O-N 2.97Å; H890-S892 VanDerWaalsContact C-N 3.31Å; H890-S892 PolarHBondContact O-N 3.18Å; H890-K893 PolarHBondContact O-N 3.24Å; H890-Y894 HydrophobicContact CB-CD2 3.93Å; H890-Y894 HydrophobicContact CB-CE2 4.39Å; H890-Y894 AromaticContact ND1-CE2 3.94Å; H890-Y894 PolarHBondContact O-N 2.73Å; H890-Y894 VanDerWaalsContact O-N 3.09Å
891	Y	92.9	Very high	92.6	Very high	21 Å²	21	38.9 Å²	38.9	8%	0.082	19%	0.193	C	C	.	.	G	3₁₀ helix	trans	-62.5	-27.7	-173.5	-178.9	-131.6	0	0	0	115.2	F888 K889 F895 G899 I902 K903 L948 K951 L952	F888-Y891 WeakPolarHBondContact O-CB 3.44Å; F888-Y891 PolarHBondContact O-N 3.1Å; K889-Y891 VanDerWaalsContact C-N 3.26Å; K889-Y891 PolarHBondContact O-N 3.13Å; Y891-F895 HydrophobicContact CD2-CD2 4.33Å; Y891-F895 AromaticContact CE2-CD2 3.83Å; Y891-F895 HydrophobicContact CE2-CD2 3.83Å; Y891-F895 AromaticContact CE2-CE2 3.91Å; Y891-F895 HydrophobicContact CE2-CE2 3.91Å; Y891-G899 WeakPolarHBondContact CE2-O 3.21Å; Y891-I902 HydrophobicContact CD2-CB 3.9Å; Y891-I902 HydrophobicContact CD2-CG2 3.8Å; Y891-I902 HydrophobicContact CG-CG2 3.98Å; Y891-K903 HydrophobicContact CE2-CB 4.04Å; Y891-L948 HydrophobicContact CD1-CD1 4.12Å; Y891-L948 HydrophobicContact CG-CD1 4.46Å; Y891-K951 HydrophobicContact CD1-CB 4.32Å; Y891-K951 HydrophobicContact CE1-CB 3.94Å; Y891-L952 HydrophobicContact CD1-CD2 3.75Å; Y891-L952 HydrophobicContact CD1-CG 4.19Å; Y891-L952 HydrophobicContact CE1-CD2 4.18Å
892	S	89.6	Confident	92.7	Very high	21 Å²	21	38.1 Å²	38.1	15%	0.147	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-45.5	178.6	-164	0	0	0	0	111.8	H890 K951	H890-S892 VanDerWaalsContact C-N 3.31Å; H890-S892 PolarHBondContact O-N 3.18Å; S892-K951 PolarHBondContact OG-NZ 3.15Å
893	K	88.4	Confident	92.8	Very high	111 Å²	111	41.2 Å²	41.2	48%	0.483	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-57.5	-175.3	-170.2	174.9	-179.5	-166.8	0	111.5	D842 H890 F895	D842-K893 WeakPolarHBondContact OD1-CE 3.48Å; D842-K893 IonicContact OD1-NZ 3.17Å; D842-K893 PolarHBondContact OD1-NZ 3.11Å; D842-K893 IonicContact OD2-NZ 2.82Å; D842-K893 PolarHBondContact OD2-NZ 2.93Å; H890-K893 PolarHBondContact O-N 3.24Å; K893-F895 VanDerWaalsContact C-N 3.27Å; K893-F895 PolarHBondContact O-N 3.33Å
894	Y	89.2	Confident	92.8	Very high	16 Å²	16	45.1 Å²	45.1	6%	0.063	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	39.9	-179.8	-51.6	-87.5	0	0	0	112.2	F840 D842 H890 K896 D897 F898 G899	F840-Y894 HydrophobicContact CB-CE2 3.95Å; F840-Y894 AromaticContact CD1-CD2 3.73Å; F840-Y894 HydrophobicContact CD1-CD2 3.73Å; F840-Y894 AromaticContact CD1-CE2 3.97Å; F840-Y894 HydrophobicContact CD1-CE2 3.97Å; F840-Y894 HydrophobicContact CD1-CG 4.23Å; F840-Y894 HydrophobicContact CE1-CD2 4.42Å; F840-Y894 HydrophobicContact CG-CE2 4.36Å; F840-Y894 PolarHBondContact O-OH 2.93Å; F840-Y894 VanDerWaalsContact O-OH 3.08Å; D842-Y894 PolarHBondContact OD1-OH 3.07Å; H890-Y894 HydrophobicContact CB-CD2 3.93Å; H890-Y894 HydrophobicContact CB-CE2 4.39Å; H890-Y894 AromaticContact ND1-CE2 3.94Å; H890-Y894 PolarHBondContact O-N 2.73Å; H890-Y894 VanDerWaalsContact O-N 3.09Å; Y894-K896 VanDerWaalsContact C-N 3.29Å; Y894-K896 PolarHBondContact O-N 2.63Å; Y894-D897 PolarHBondContact O-N 3.08Å; Y894-F898 HydrophobicContact CD1-CD2 4.46Å; Y894-F898 HydrophobicContact CD1-CE2 4.28Å; Y894-F898 HydrophobicContact CG-CD2 4.02Å; Y894-F898 HydrophobicContact CG-CE2 4.25Å; Y894-F898 PolarHBondContact O-N 2.65Å; Y894-G899 PolarHBondContact O-N 3.03Å
895	F	88.4	Confident	92.8	Very high	98 Å²	98	45.3 Å²	45.3	43%	0.43	21%	0.212	S	C	.	.	H	α-helix	trans	-64.2	-34.4	-178.4	-178.1	-97.4	0	0	0	112.5	Y891 K893 G899	Y891-F895 HydrophobicContact CD2-CD2 4.33Å; Y891-F895 AromaticContact CE2-CD2 3.83Å; Y891-F895 HydrophobicContact CE2-CD2 3.83Å; Y891-F895 AromaticContact CE2-CE2 3.91Å; Y891-F895 HydrophobicContact CE2-CE2 3.91Å; K893-F895 VanDerWaalsContact C-N 3.27Å; K893-F895 PolarHBondContact O-N 3.33Å; F895-G899 WeakPolarHBondContact O-CA 3.37Å; F895-G899 PolarHBondContact O-N 3.31Å
896	K	88.6	Confident	92.7	Very high	190 Å²	190	45.1 Å²	45.1	83%	0.826	21%	0.211	S	C	*	.	H	α-helix	trans	-63.2	-42.6	176.3	-173.7	-170.4	176.8	-168.9	0	111.6	Y894	Y894-K896 VanDerWaalsContact C-N 3.29Å; Y894-K896 PolarHBondContact O-N 2.63Å
897	D	89.4	Confident	92.6	Very high	43 Å²	43	45.6 Å²	45.6	23%	0.23	22%	0.217	C	C	.	.	H	α-helix	trans	-101.2	-32.2	-160.9	-49.2	-51.9	0	0	0	112.9	L860 R864 Y894	L860-D897 HydrophobicContact CD1-CB 3.75Å; R864-D897 WeakPolarHBondContact CD-O 3.33Å; R864-D897 PolarHBondContact NH1-O 2.94Å; Y894-D897 PolarHBondContact O-N 3.08Å
898	F	94.3	Very high	92.5	Very high	5 Å²	5	49.6 Å²	49.6	2%	0.022	23%	0.234	C	C	.	.	H	α-helix	trans	-129.8	-1.5	-177.4	-54.6	-50.7	0	0	0	114	V839 F840 L860 K863 R864 L867 Y894 D900 I901 I902	V839-F898 HydrophobicContact CG1-CE1 4.23Å; V839-F898 HydrophobicContact CG1-CE2 3.92Å; V839-F898 HydrophobicContact CG1-CZ 3.7Å; V839-F898 WeakPolarHBondContact O-CE2 3.46Å; F840-F898 AromaticContact CD1-CD2 3.91Å; F840-F898 HydrophobicContact CD1-CD2 3.91Å; F840-F898 AromaticContact CD1-CE2 3.95Å; F840-F898 HydrophobicContact CD1-CE2 3.95Å; F840-F898 AromaticContact CE1-CD2 3.62Å; F840-F898 HydrophobicContact CE1-CD2 3.62Å; F840-F898 HydrophobicContact CE1-CE2 4.05Å; F840-F898 HydrophobicContact CE1-CG 4.4Å; L860-F898 HydrophobicContact CD1-CE1 4.01Å; L860-F898 HydrophobicContact CD1-CZ 4.36Å; K863-F898 HydrophobicContact CB-CE1 3.98Å; K863-F898 HydrophobicContact CB-CZ 3.91Å; K863-F898 HydrophobicContact CD-CZ 4.49Å; R864-F898 HydrophobicContact CG-CD1 3.78Å; R864-F898 HydrophobicContact CG-CE1 3.77Å; L867-F898 HydrophobicContact CD2-CB 3.62Å; L867-F898 HydrophobicContact CD2-CD1 3.69Å; L867-F898 HydrophobicContact CD2-CD2 4.21Å; L867-F898 HydrophobicContact CD2-CE1 4.45Å; L867-F898 HydrophobicContact CD2-CG 3.57Å; Y894-F898 HydrophobicContact CD1-CD2 4.46Å; Y894-F898 HydrophobicContact CD1-CE2 4.28Å; Y894-F898 HydrophobicContact CG-CD2 4.02Å; Y894-F898 HydrophobicContact CG-CE2 4.25Å; Y894-F898 PolarHBondContact O-N 2.65Å; F898-D900 VanDerWaalsContact C-N 3.27Å; F898-D900 PolarHBondContact O-N 3.09Å; F898-D900 VanDerWaalsContact O-N 3.15Å; F898-I901 PolarHBondContact O-N 3.32Å; F898-I901 VanDerWaalsContact O-N 3.11Å; F898-I902 HydrophobicContact CB-CD1 3.8Å; F898-I902 HydrophobicContact CB-CG1 4.21Å; F898-I902 WeakPolarHBondContact O-CG1 3.28Å; F898-I902 PolarHBondContact O-N 2.87Å
899	G	92.5	Very high	92.4	Very high	3 Å²	3	49.7 Å²	49.7	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-58.8	-31.2	-170	0	0	0	0	0	114.9	Y891 Y894 F895 K903	Y891-G899 WeakPolarHBondContact CE2-O 3.21Å; Y894-G899 PolarHBondContact O-N 3.03Å; F895-G899 WeakPolarHBondContact O-CA 3.37Å; F895-G899 PolarHBondContact O-N 3.31Å; G899-K903 WeakPolarHBondContact O-CB 3.46Å; G899-K903 PolarHBondContact O-N 3.02Å
900	D	94.3	Very high	92.3	Very high	81 Å²	81	49.4 Å²	49.4	43%	0.433	23%	0.234	S	C	.	.	H	α-helix	trans	-70.1	-47.3	174.5	65	-36.9	0	0	0	112.6	R864 F898 I902 K903 E904	R864-D900 IonicContact CZ-OD1 2.87Å; R864-D900 IonicContact CZ-OD2 3.72Å; R864-D900 IonicContact NH1-OD1 3.77Å; R864-D900 PolarHBondContact NH1-OD1 2.92Å; R864-D900 IonicContact NH1-OD2 3.68Å; R864-D900 IonicContact NH2-OD1 2.73Å; R864-D900 PolarHBondContact NH2-OD1 2.87Å; R864-D900 IonicContact NH2-OD2 2.7Å; R864-D900 PolarHBondContact NH2-OD2 3.29Å; F898-D900 VanDerWaalsContact C-N 3.27Å; F898-D900 PolarHBondContact O-N 3.09Å; F898-D900 VanDerWaalsContact O-N 3.15Å; D900-I902 PolarHBondContact O-N 2.82Å; D900-K903 PolarHBondContact O-N 3.31Å; D900-E904 PolarHBondContact O-N 3.13Å
901	I	96.3	Very high	92.2	Very high	28 Å²	28	54.7 Å²	54.7	14%	0.144	26%	0.262	C	S	.	.	H	α-helix	trans	-61.2	-46	178.2	-60.4	171.7	0	0	0	110.1	R864 L867 F898 T905	R864-I901 HydrophobicContact CB-CD1 3.84Å; R864-I901 HydrophobicContact CG-CD1 3.98Å; L867-I901 HydrophobicContact CD2-CG2 4.26Å; L867-I901 HydrophobicContact CG-CG2 4.19Å; F898-I901 PolarHBondContact O-N 3.32Å; F898-I901 VanDerWaalsContact O-N 3.11Å; I901-T905 WeakPolarHBondContact O-CB 3.49Å; I901-T905 PolarHBondContact O-N 3.24Å; I901-T905 PolarHBondContact O-OG1 3.2Å
902	I	95.6	Very high	92.1	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-67.3	-43	-179.8	-57.2	169	0	0	0	110.3	L867 V887 F888 Y891 F898 D900 T905 V906	L867-I902 HydrophobicContact CD2-CG1 4.38Å; V887-I902 HydrophobicContact CG1-CB 4.36Å; V887-I902 HydrophobicContact CG1-CD1 4.46Å; V887-I902 HydrophobicContact CG1-CG1 3.73Å; V887-I902 HydrophobicContact CG1-CG2 4.11Å; F888-I902 HydrophobicContact CD1-CG2 4.19Å; Y891-I902 HydrophobicContact CD2-CB 3.9Å; Y891-I902 HydrophobicContact CD2-CG2 3.8Å; Y891-I902 HydrophobicContact CG-CG2 3.98Å; F898-I902 HydrophobicContact CB-CD1 3.8Å; F898-I902 HydrophobicContact CB-CG1 4.21Å; F898-I902 WeakPolarHBondContact O-CG1 3.28Å; F898-I902 PolarHBondContact O-N 2.87Å; D900-I902 PolarHBondContact O-N 2.82Å; I902-T905 PolarHBondContact O-N 3.4Å; I902-V906 WeakPolarHBondContact O-CG2 3.44Å; I902-V906 PolarHBondContact O-N 3.32Å
903	K	93.8	Very high	92.2	Very high	120 Å²	120	59.8 Å²	59.8	52%	0.522	29%	0.288	S	S	.	.	H	α-helix	trans	-64.5	-39.7	177.8	178.3	-179.3	174.6	-174.4	0	113.3	Y891 G899 D900 S907	Y891-K903 HydrophobicContact CE2-CB 4.04Å; G899-K903 WeakPolarHBondContact O-CB 3.46Å; G899-K903 PolarHBondContact O-N 3.02Å; D900-K903 PolarHBondContact O-N 3.31Å; K903-S907 WeakPolarHBondContact O-CB 3.28Å; K903-S907 PolarHBondContact O-N 3.46Å; K903-S907 PolarHBondContact O-OG 3.13Å
904	E	95.3	Very high	92.3	Very high	98 Å²	98	56.8 Å²	56.8	46%	0.458	28%	0.28	S	S	.	.	H	α-helix	trans	-67.7	-39.1	173.2	-176.9	69.2	165.1	0	0	110.3	D900 S907 K908	D900-E904 PolarHBondContact O-N 3.13Å; E904-S907 CarbonylContact O-C 3.57Å; E904-S907 WeakPolarHBondContact O-CA 3.14Å; E904-S907 WeakPolarHBondContact O-CB 3.35Å; E904-S907 PolarHBondContact O-N 2.84Å; E904-S907 VanDerWaalsContact O-N 3.1Å; E904-K908 HydrophobicContact CG-CG 4.26Å; E904-K908 VanDerWaalsContact O-CG 3.26Å; E904-K908 WeakPolarHBondContact O-CG 3.45Å; E904-K908 PolarHBondContact O-N 3.11Å; E904-K908 WeakPolarHBondContact OE1-CE 3.3Å; E904-K908 IonicContact OE1-NZ 2.68Å; E904-K908 PolarHBondContact OE1-NZ 2.83Å
905	T	95.1	Very high	92.5	Very high	6 Å²	6	59.4 Å²	59.4	4%	0.037	29%	0.294	C	S	.	.	H	α-helix	trans	-63.9	-43.9	176.1	-56.8	0	0	0	0	112.3	C871 L875 F888 I901 I902 S907 K908 S909	C871-T905 HydrophobicContact CB-CG2 4.19Å; C871-T905 WeakPolarHBondContact CB-OG1 3.01Å; L875-T905 HydrophobicContact CD1-CG2 4.22Å; L875-T905 HydrophobicContact CD2-CG2 4.08Å; L875-T905 HydrophobicContact CG-CG2 4.13Å; F888-T905 HydrophobicContact CE1-CG2 4.03Å; I901-T905 WeakPolarHBondContact O-CB 3.49Å; I901-T905 PolarHBondContact O-N 3.24Å; I901-T905 PolarHBondContact O-OG1 3.2Å; I902-T905 PolarHBondContact O-N 3.4Å; T905-S907 VanDerWaalsContact C-N 3.31Å; T905-S907 PolarHBondContact O-N 3.33Å; T905-K908 PolarHBondContact O-N 2.71Å; T905-S909 WeakPolarHBondContact O-CB 3.23Å; T905-S909 PolarHBondContact O-N 2.62Å; T905-S909 PolarHBondContact O-OG 3.24Å
906	V	93.3	Very high	92.7	Very high	3 Å²	3	58.3 Å²	58.3	2%	0.018	29%	0.291	C	S	.	.	H	α-helix	trans	-55	-48.5	168.5	170.2	0	0	0	0	110.1	F888 I902 S909 K910 L952	F888-V906 HydrophobicContact CD1-CG2 3.61Å; F888-V906 HydrophobicContact CD2-CG2 4.29Å; F888-V906 HydrophobicContact CE1-CB 4.24Å; F888-V906 HydrophobicContact CE1-CG2 3.37Å; F888-V906 HydrophobicContact CE2-CG2 4.09Å; F888-V906 HydrophobicContact CG-CG2 4.08Å; F888-V906 HydrophobicContact CZ-CB 4.24Å; F888-V906 HydrophobicContact CZ-CG2 3.64Å; I902-V906 WeakPolarHBondContact O-CG2 3.44Å; I902-V906 PolarHBondContact O-N 3.32Å; V906-S909 PolarHBondContact O-N 2.77Å; V906-S909 PolarHBondContact O-OG 3.17Å; V906-K910 PolarHBondContact O-N 3.23Å; V906-L952 HydrophobicContact CG2-CD2 4.29Å
907	S	92.3	Very high	92.9	Very high	49 Å²	49	49.3 Å²	49.3	34%	0.343	25%	0.252	S	S	.	.	H	α-helix	trans	-64.7	-42	-177.2	-58.3	0	0	0	0	113	K903 E904 T905 K910	K903-S907 WeakPolarHBondContact O-CB 3.28Å; K903-S907 PolarHBondContact O-N 3.46Å; K903-S907 PolarHBondContact O-OG 3.13Å; E904-S907 CarbonylContact O-C 3.57Å; E904-S907 WeakPolarHBondContact O-CA 3.14Å; E904-S907 WeakPolarHBondContact O-CB 3.35Å; E904-S907 PolarHBondContact O-N 2.84Å; E904-S907 VanDerWaalsContact O-N 3.1Å; T905-S907 VanDerWaalsContact C-N 3.31Å; T905-S907 PolarHBondContact O-N 3.33Å; S907-K910 PolarHBondContact O-N 3.43Å
908	K	93	Very high	93.1	Very high	85 Å²	85	47.2 Å²	47.2	37%	0.37	24%	0.241	S	C	.	.	H	α-helix	trans	-69	-40.1	176.6	-64.8	-73.5	169.1	178.1	0	112.1	L875 E904 T905 K910 L911 I912	L875-K908 HydrophobicContact CD1-CB 3.77Å; L875-K908 HydrophobicContact CD1-CG 4.03Å; L875-K908 HydrophobicContact CD2-CB 3.53Å; L875-K908 HydrophobicContact CG-CB 4.24Å; E904-K908 HydrophobicContact CG-CG 4.26Å; E904-K908 VanDerWaalsContact O-CG 3.26Å; E904-K908 WeakPolarHBondContact O-CG 3.45Å; E904-K908 PolarHBondContact O-N 3.11Å; E904-K908 WeakPolarHBondContact OE1-CE 3.3Å; E904-K908 IonicContact OE1-NZ 2.68Å; E904-K908 PolarHBondContact OE1-NZ 2.83Å; T905-K908 PolarHBondContact O-N 2.71Å; K908-K910 PolarHBondContact O-N 3.19Å; K908-L911 WeakPolarHBondContact O-CB 3.47Å; K908-L911 PolarHBondContact O-N 3.33Å; K908-I912 WeakPolarHBondContact O-CG1 3.34Å; K908-I912 PolarHBondContact O-N 3.28Å
909	S	93.4	Very high	93.1	Very high	1 Å²	1	50.7 Å²	50.7	1%	0.007	26%	0.255	C	S	.	.	H	α-helix	trans	-56.9	-34.5	176.8	75	0	0	0	0	112.1	T905 V906 I912 N913 S917	T905-S909 WeakPolarHBondContact O-CB 3.23Å; T905-S909 PolarHBondContact O-N 2.62Å; T905-S909 PolarHBondContact O-OG 3.24Å; V906-S909 PolarHBondContact O-N 2.77Å; V906-S909 PolarHBondContact O-OG 3.17Å; S909-I912 PolarHBondContact O-N 2.68Å; S909-N913 CarbonylContact O-C 3.51Å; S909-N913 PolarHBondContact O-N 2.91Å; S909-S917 WeakPolarHBondContact OG-CB 3.34Å; S909-S917 PolarHBondContact OG-OG 3.15Å
910	K	90.4	Very high	93.2	Very high	27 Å²	27	50.9 Å²	50.9	12%	0.117	26%	0.256	C	S	.	.	H	α-helix	trans	-70.6	-29.2	175.6	-64.9	-178.3	-169.2	-164	0	113.9	V906 S907 K908 P914 S917 S955	V906-K910 PolarHBondContact O-N 3.23Å; S907-K910 PolarHBondContact O-N 3.43Å; K908-K910 PolarHBondContact O-N 3.19Å; K910-P914 WeakPolarHBondContact O-CA 3.22Å; K910-P914 WeakPolarHBondContact O-CB 3.34Å; K910-P914 WeakPolarHBondContact O-CD 3.14Å; K910-S917 WeakPolarHBondContact CG-OG 3.33Å; K910-S955 VanDerWaalsContact NZ-C 3.27Å; K910-S955 PolarHBondContact NZ-O 3.02Å; K910-S955 PolarHBondContact NZ-OG 3.01Å
911	L	90.1	Very high	93.2	Very high	142 Å²	142	47 Å²	47	74%	0.743	24%	0.235	S	C	*	.	H	α-helix	trans	-76.4	-30.1	173.8	-61.4	177	0	0	0	111.9	K908	K908-L911 WeakPolarHBondContact O-CB 3.47Å; K908-L911 PolarHBondContact O-N 3.33Å
912	I	90.7	Very high	93.2	Very high	94 Å²	94	45.8 Å²	45.8	48%	0.482	23%	0.229	S	C	.	.	H	α-helix	trans	-75.2	-56.8	176.8	-63.5	160.7	0	0	0	110.6	L875 L881 K908 S909	L875-I912 HydrophobicContact CB-CD1 4.25Å; L875-I912 HydrophobicContact CD2-CD1 3.8Å; L875-I912 WeakPolarHBondContact O-CD1 3.46Å; L881-I912 HydrophobicContact CD1-CD1 4.46Å; K908-I912 WeakPolarHBondContact O-CG1 3.34Å; K908-I912 PolarHBondContact O-N 3.28Å; S909-I912 PolarHBondContact O-N 2.68Å
913	N	92.3	Very high	93.1	Very high	56 Å²	56	48.6 Å²	48.6	30%	0.299	24%	0.244	S	C	.	.			trans	-149	100.9	174.5	-174.4	-19.3	0	0	0	110.2	L881 S909 I915 Q916 S917	L881-N913 HydrophobicContact CD2-CB 4.31Å; S909-N913 CarbonylContact O-C 3.51Å; S909-N913 PolarHBondContact O-N 2.91Å; N913-I915 PolarHBondContact O-N 3.42Å; N913-I915 PolarHBondContact OD1-N 2.92Å; N913-Q916 HydrophobicContact CB-CB 3.89Å; N913-Q916 VanDerWaalsContact ND2-CB 3.31Å; N913-Q916 WeakPolarHBondContact ND2-CB 3.48Å; N913-Q916 PolarHBondContact ND2-OE1 3.38Å; N913-Q916 PolarHBondContact O-N 3.4Å; N913-Q916 PolarHBondContact OD1-N 2.99Å; N913-Q916 VanDerWaalsContact OD1-N 3.13Å; N913-S917 VanDerWaalsContact O-CB 3.27Å; N913-S917 WeakPolarHBondContact O-CB 3.46Å; N913-S917 PolarHBondContact O-N 3.34Å
914	P	90.5	Very high	93.2	Very high	48 Å²	48	42.9 Å²	42.9	31%	0.312	22%	0.219	S	C	.	.	H	α-helix	trans	-64.8	-37.9	-173.3	23.3	-32.1	0	0	0	112.9	K910 A918 Q966	K910-P914 WeakPolarHBondContact O-CA 3.22Å; K910-P914 WeakPolarHBondContact O-CB 3.34Å; K910-P914 WeakPolarHBondContact O-CD 3.14Å; P914-A918 PolarHBondContact O-N 3.04Å; P914-Q966 HydrophobicContact CB-CG 3.66Å; P914-Q966 WeakPolarHBondContact O-CG 3.34Å
915	I	92.8	Very high	93.2	Very high	70 Å²	70	38.3 Å²	38.3	36%	0.359	20%	0.198	S	C	.	.	H	α-helix	trans	-72.1	-43.9	-178.9	-63	176.6	0	0	0	110.3	N913 A918 K919 K965 A969	N913-I915 PolarHBondContact O-N 3.42Å; N913-I915 PolarHBondContact OD1-N 2.92Å; I915-A918 PolarHBondContact O-N 3.29Å; I915-K919 WeakPolarHBondContact O-CG 3.28Å; I915-K919 PolarHBondContact O-N 2.93Å; I915-K919 VanDerWaalsContact O-N 3.08Å; I915-K965 HydrophobicContact CD1-CB 4.36Å; I915-A969 HydrophobicContact CG2-CB 3.82Å
916	Q	92.9	Very high	93.1	Very high	76 Å²	76	39.2 Å²	39.2	36%	0.355	20%	0.201	S	C	.	.	H	α-helix	trans	-67	-40.7	178.1	-169.4	180	0.1	0	0	111.5	L881 N913 A918 K919 I920	L881-Q916 HydrophobicContact CD2-CB 4.19Å; L881-Q916 HydrophobicContact CD2-CG 4.02Å; N913-Q916 HydrophobicContact CB-CB 3.89Å; N913-Q916 VanDerWaalsContact ND2-CB 3.31Å; N913-Q916 WeakPolarHBondContact ND2-CB 3.48Å; N913-Q916 PolarHBondContact ND2-OE1 3.38Å; N913-Q916 PolarHBondContact O-N 3.4Å; N913-Q916 PolarHBondContact OD1-N 2.99Å; N913-Q916 VanDerWaalsContact OD1-N 3.13Å; Q916-A918 VanDerWaalsContact C-N 3.28Å; Q916-A918 PolarHBondContact O-N 3.44Å; Q916-K919 WeakPolarHBondContact O-CB 3.38Å; Q916-K919 PolarHBondContact O-N 2.99Å; Q916-K919 VanDerWaalsContact O-N 3.11Å; Q916-I920 HydrophobicContact CG-CD1 3.92Å; Q916-I920 WeakPolarHBondContact O-CD1 3.25Å; Q916-I920 VanDerWaalsContact O-CG1 3.25Å; Q916-I920 WeakPolarHBondContact O-CG1 3.24Å; Q916-I920 PolarHBondContact O-N 3.09Å
917	S	92.7	Very high	93.1	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-54.6	-42.6	172.2	175.6	0	0	0	0	112.3	S909 K910 N913 I920 V921	S909-S917 WeakPolarHBondContact OG-CB 3.34Å; S909-S917 PolarHBondContact OG-OG 3.15Å; K910-S917 WeakPolarHBondContact CG-OG 3.33Å; N913-S917 VanDerWaalsContact O-CB 3.27Å; N913-S917 WeakPolarHBondContact O-CB 3.46Å; N913-S917 PolarHBondContact O-N 3.34Å; S917-I920 PolarHBondContact O-N 2.9Å; S917-V921 WeakPolarHBondContact O-CG2 3.29Å; S917-V921 PolarHBondContact O-N 3.42Å
918	A	93.3	Very high	93	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-67.7	-37.1	176.4	0	0	0	0	0	113.3	P914 I915 Q916 I920 C922 F956 Q966 L970	P914-A918 PolarHBondContact O-N 3.04Å; I915-A918 PolarHBondContact O-N 3.29Å; Q916-A918 VanDerWaalsContact C-N 3.28Å; Q916-A918 PolarHBondContact O-N 3.44Å; A918-I920 VanDerWaalsContact C-N 3.34Å; A918-C922 PolarHBondContact O-N 3.34Å; A918-C922 VanDerWaalsContact O-N 3.1Å; A918-F956 HydrophobicContact CB-CE1 3.97Å; A918-F956 HydrophobicContact CB-CZ 4.08Å; A918-Q966 HydrophobicContact CB-CB 3.76Å; A918-Q966 HydrophobicContact CB-CG 4.45Å; A918-Q966 WeakPolarHBondContact CB-O 3.3Å; A918-L970 HydrophobicContact CB-CB 4.26Å
919	K	94.4	Very high	92.9	Very high	77 Å²	77	37.3 Å²	37.3	34%	0.335	19%	0.189	S	C	.	.	H	α-helix	trans	-63.9	-38.9	171.7	-69.1	176.4	157.7	-81.1	0	111.8	I915 Q916 C922 L923 A969 D973	I915-K919 WeakPolarHBondContact O-CG 3.28Å; I915-K919 PolarHBondContact O-N 2.93Å; I915-K919 VanDerWaalsContact O-N 3.08Å; Q916-K919 WeakPolarHBondContact O-CB 3.38Å; Q916-K919 PolarHBondContact O-N 2.99Å; Q916-K919 VanDerWaalsContact O-N 3.11Å; K919-C922 WeakPolarHBondContact O-CB 3.46Å; K919-C922 PolarHBondContact O-N 3.12Å; K919-L923 WeakPolarHBondContact O-CB 3.26Å; K919-L923 PolarHBondContact O-N 2.95Å; K919-A969 HydrophobicContact CG-CB 4.48Å; K919-D973 WeakPolarHBondContact CG-OD2 3.26Å; K919-D973 IonicContact NZ-OD1 3.73Å; K919-D973 PolarHBondContact NZ-OD1 3.08Å; K919-D973 IonicContact NZ-OD2 3.78Å; K919-D973 PolarHBondContact NZ-OD2 3.31Å
920	I	94.8	Very high	92.7	Very high	7 Å²	7	39.5 Å²	39.5	4%	0.036	20%	0.204	C	C	.	.	H	α-helix	trans	-68.9	-41.7	177.7	-65.8	155.6	0	0	0	111.3	L881 A884 T885 F888 Q916 S917 A918 C922 L923 S924	L881-I920 VanDerWaalsContact C-CD1 3.48Å; L881-I920 HydrophobicContact CB-CD1 3.81Å; L881-I920 HydrophobicContact CD2-CD1 3.69Å; L881-I920 HydrophobicContact CG-CD1 3.56Å; L881-I920 WeakPolarHBondContact O-CD1 3.45Å; A884-I920 HydrophobicContact CB-CG2 4.2Å; T885-I920 HydrophobicContact CG2-CG2 4.09Å; F888-I920 HydrophobicContact CD2-CG2 3.92Å; F888-I920 HydrophobicContact CE2-CG2 3.87Å; Q916-I920 HydrophobicContact CG-CD1 3.92Å; Q916-I920 WeakPolarHBondContact O-CD1 3.25Å; Q916-I920 VanDerWaalsContact O-CG1 3.25Å; Q916-I920 WeakPolarHBondContact O-CG1 3.24Å; Q916-I920 PolarHBondContact O-N 3.09Å; S917-I920 PolarHBondContact O-N 2.9Å; A918-I920 VanDerWaalsContact C-N 3.34Å; I920-C922 PolarHBondContact O-N 3.16Å; I920-L923 PolarHBondContact O-N 3.2Å; I920-L923 VanDerWaalsContact O-N 3.11Å; I920-S924 PolarHBondContact O-N 2.91Å; I920-S924 PolarHBondContact O-OG 3.2Å; I920-S924 VanDerWaalsContact O-OG 3.08Å
921	V	94.6	Very high	92.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-56.6	-38.8	170.4	163.2	0	0	0	0	111.5	F888 S917 L925 L952 F956 L970 F1000	F888-V921 HydrophobicContact CD2-CG2 4.13Å; F888-V921 HydrophobicContact CE2-CG2 4.22Å; S917-V921 WeakPolarHBondContact O-CG2 3.29Å; S917-V921 PolarHBondContact O-N 3.42Å; V921-L925 WeakPolarHBondContact O-CG 3.42Å; V921-L952 HydrophobicContact CG1-CB 4.11Å; V921-L952 HydrophobicContact CG1-CD1 4.18Å; V921-F956 HydrophobicContact CG1-CE2 4.41Å; V921-L970 HydrophobicContact CB-CD1 4.43Å; V921-L970 HydrophobicContact CG1-CD1 3.89Å; V921-F1000 HydrophobicContact CG1-CE1 4.07Å; V921-F1000 HydrophobicContact CG1-CZ 3.97Å
922	C	95.2	Very high	92.4	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.014	18%	0.182	C	C	.	.	H	α-helix	trans	-66.2	-48.5	172.6	-156.5	0	0	0	0	111.5	A918 K919 I920 S924 L925 Q926 L970	A918-C922 PolarHBondContact O-N 3.34Å; A918-C922 VanDerWaalsContact O-N 3.1Å; K919-C922 WeakPolarHBondContact O-CB 3.46Å; K919-C922 PolarHBondContact O-N 3.12Å; I920-C922 PolarHBondContact O-N 3.16Å; C922-S924 PolarHBondContact O-N 2.95Å; C922-L925 PolarHBondContact O-N 2.98Å; C922-L925 VanDerWaalsContact O-N 3.12Å; C922-Q926 VanDerWaalsContact O-CG 3.32Å; C922-Q926 WeakPolarHBondContact O-CG 3.16Å; C922-Q926 PolarHBondContact O-N 3.15Å; C922-Q926 PolarHBondContact SG-NE2 2.8Å; C922-Q926 VanDerWaalsContact SG-NE2 3.36Å; C922-L970 HydrophobicContact CB-CG 4.1Å; C922-L970 PolarHBondContact SG-O 3.33Å
923	L	94.9	Very high	92.1	Very high	60 Å²	60	34.5 Å²	34.5	31%	0.314	18%	0.178	S	C	.	.	H	α-helix	trans	-60.8	-38.6	-178	-177.2	61.7	0	0	0	113	T885 K919 I920 L925 Q926 Q927	T885-L923 HydrophobicContact CG2-CB 4.17Å; T885-L923 HydrophobicContact CG2-CD2 3.81Å; T885-L923 HydrophobicContact CG2-CG 3.83Å; K919-L923 WeakPolarHBondContact O-CB 3.26Å; K919-L923 PolarHBondContact O-N 2.95Å; I920-L923 PolarHBondContact O-N 3.2Å; I920-L923 VanDerWaalsContact O-N 3.11Å; L923-L925 VanDerWaalsContact C-N 3.31Å; L923-L925 PolarHBondContact O-N 2.95Å; L923-Q926 PolarHBondContact O-N 3.07Å; L923-Q927 HydrophobicContact CD1-CG 4.36Å; L923-Q927 WeakPolarHBondContact O-CB 3.48Å; L923-Q927 WeakPolarHBondContact O-CG 3.36Å; L923-Q927 PolarHBondContact O-N 2.62Å
924	S	95.5	Very high	91.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.4	-42.5	173.9	-59.2	0	0	0	0	112.5	F888 I920 C922 L928	F888-S924 WeakPolarHBondContact CB-OG 3.37Å; I920-S924 PolarHBondContact O-N 2.91Å; I920-S924 PolarHBondContact O-OG 3.2Å; I920-S924 VanDerWaalsContact O-OG 3.08Å; C922-S924 PolarHBondContact O-N 2.95Å; S924-L928 PolarHBondContact O-N 2.7Å
925	L	95.3	Very high	91	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	21%	0.211	C	C	.	.	H	α-helix	trans	-73.4	-36.9	178.3	-65.2	168.9	0	0	0	111.5	V921 C922 L923 F929 I945 L948 A949 F993 I996 F1000	V921-L925 WeakPolarHBondContact O-CG 3.42Å; C922-L925 PolarHBondContact O-N 2.98Å; C922-L925 VanDerWaalsContact O-N 3.12Å; L923-L925 VanDerWaalsContact C-N 3.31Å; L923-L925 PolarHBondContact O-N 2.95Å; L925-F929 VanDerWaalsContact O-CB 3.24Å; L925-F929 WeakPolarHBondContact O-CB 3.47Å; L925-F929 PolarHBondContact O-N 3.3Å; L925-I945 HydrophobicContact CD2-CG2 3.92Å; L925-L948 HydrophobicContact CD2-CB 4.36Å; L925-L948 HydrophobicContact CD2-CD2 3.82Å; L925-L948 HydrophobicContact CD2-CG 3.91Å; L925-A949 HydrophobicContact CD1-CB 3.85Å; L925-A949 HydrophobicContact CD2-CB 4.1Å; L925-F993 HydrophobicContact CB-CE2 3.82Å; L925-F993 HydrophobicContact CB-CZ 3.97Å; L925-I996 HydrophobicContact CD1-CG2 4.26Å; L925-I996 HydrophobicContact CD2-CG2 4.41Å; L925-F1000 HydrophobicContact CD1-CE2 3.61Å; L925-F1000 HydrophobicContact CD1-CZ 3.74Å
926	Q	93.7	Very high	89.7	Confident	25 Å²	25	41.1 Å²	41.1	12%	0.117	23%	0.228	C	C	.	.	H	α-helix	trans	-62.5	-43.1	174.9	-71.4	173	-0.8	0	0	111.3	C922 L923 F929 S930 D973 F977 F993	C922-Q926 VanDerWaalsContact O-CG 3.32Å; C922-Q926 WeakPolarHBondContact O-CG 3.16Å; C922-Q926 PolarHBondContact O-N 3.15Å; C922-Q926 PolarHBondContact SG-NE2 2.8Å; C922-Q926 VanDerWaalsContact SG-NE2 3.36Å; L923-Q926 PolarHBondContact O-N 3.07Å; Q926-F929 PolarHBondContact O-N 3.12Å; Q926-S930 WeakPolarHBondContact O-CB 3.41Å; Q926-S930 PolarHBondContact O-N 3.22Å; Q926-S930 PolarHBondContact O-OG 3.22Å; Q926-D973 PolarHBondContact NE2-O 3.32Å; Q926-F977 HydrophobicContact CB-CD1 4.44Å; Q926-F977 HydrophobicContact CB-CD2 3.87Å; Q926-F977 HydrophobicContact CB-CE1 4.31Å; Q926-F977 HydrophobicContact CB-CE2 3.73Å; Q926-F977 HydrophobicContact CB-CG 4.22Å; Q926-F977 HydrophobicContact CB-CZ 3.96Å; Q926-F977 HydrophobicContact CG-CB 4.07Å; Q926-F977 HydrophobicContact CG-CD1 3.85Å; Q926-F977 HydrophobicContact CG-CD2 3.72Å; Q926-F977 HydrophobicContact CG-CE1 4.17Å; Q926-F977 HydrophobicContact CG-CE2 4.06Å; Q926-F977 HydrophobicContact CG-CG 3.6Å; Q926-F977 HydrophobicContact CG-CZ 4.27Å; Q926-F993 HydrophobicContact CG-CE1 3.98Å; Q926-F993 HydrophobicContact CG-CE2 4.06Å; Q926-F993 HydrophobicContact CG-CZ 3.61Å
927	Q	91.9	Very high	88.4	Confident	56 Å²	56	41.7 Å²	41.7	26%	0.262	23%	0.23	S	C	.	.	H	α-helix	trans	-62.6	-53.7	176.6	-77.9	175	-17.8	0	0	111.7	T885 K889 L923 F929 S930 E931	T885-Q927 VanDerWaalsContact CB-OE1 3.22Å; K889-Q927 VanDerWaalsContact CE-OE1 3.32Å; L923-Q927 HydrophobicContact CD1-CG 4.36Å; L923-Q927 WeakPolarHBondContact O-CB 3.48Å; L923-Q927 WeakPolarHBondContact O-CG 3.36Å; L923-Q927 PolarHBondContact O-N 2.62Å; Q927-F929 VanDerWaalsContact C-N 3.27Å; Q927-F929 PolarHBondContact O-N 3.45Å; Q927-S930 CarbonylContact O-C 3.59Å; Q927-S930 WeakPolarHBondContact O-CA 3.45Å; Q927-S930 WeakPolarHBondContact O-CB 3.46Å; Q927-S930 PolarHBondContact O-N 3.45Å; Q927-E931 VanDerWaalsContact C-CD 3.48Å; Q927-E931 WeakPolarHBondContact CB-OE1 3.12Å; Q927-E931 WeakPolarHBondContact O-CG 3.47Å; Q927-E931 PolarHBondContact O-N 3.2Å
928	L	90.4	Very high	87.3	Confident	39 Å²	39	47.6 Å²	47.6	20%	0.204	26%	0.262	C	S	.	.	H	α-helix	trans	-56.1	-41	176.2	-78.1	166.9	0	0	0	112.9	K889 S924 E931 M932 I945 L948	K889-L928 HydrophobicContact CB-CD1 3.85Å; K889-L928 HydrophobicContact CB-CD2 4.23Å; K889-L928 HydrophobicContact CB-CG 4.09Å; K889-L928 HydrophobicContact CD-CD2 4.07Å; K889-L928 HydrophobicContact CD-CG 3.98Å; K889-L928 HydrophobicContact CG-CD1 3.87Å; K889-L928 HydrophobicContact CG-CD2 4.21Å; K889-L928 HydrophobicContact CG-CG 3.75Å; S924-L928 PolarHBondContact O-N 2.7Å; L928-E931 WeakPolarHBondContact CA-OE2 3.44Å; L928-E931 PolarHBondContact O-N 3.17Å; L928-M932 VanDerWaalsContact O-CB 3.32Å; L928-M932 WeakPolarHBondContact O-CB 3.14Å; L928-M932 PolarHBondContact O-N 2.79Å; L928-I945 HydrophobicContact CB-CD1 3.94Å; L928-I945 HydrophobicContact CB-CG1 3.98Å; L928-I945 HydrophobicContact CD1-CG1 4.5Å; L928-L948 HydrophobicContact CD1-CD2 3.43Å; L928-L948 VanDerWaalsContact CD1-CD2 3.43Å
929	F	90.7	Very high	86.2	Confident	2 Å²	2	55 Å²	55	1%	0.009	30%	0.296	C	S	.	.	H	α-helix	trans	-69.5	-32.8	177.7	177.3	-86.1	0	0	0	112.3	L925 Q926 Q927 M932 L933 F942 F977 N990 A992 F993 I996	L925-F929 VanDerWaalsContact O-CB 3.24Å; L925-F929 WeakPolarHBondContact O-CB 3.47Å; L925-F929 PolarHBondContact O-N 3.3Å; Q926-F929 PolarHBondContact O-N 3.12Å; Q927-F929 VanDerWaalsContact C-N 3.27Å; Q927-F929 PolarHBondContact O-N 3.45Å; F929-M932 HydrophobicContact CD2-CE 3.75Å; F929-M932 HydrophobicContact CD2-SD 4.46Å; F929-M932 HydrophobicContact CE2-CE 3.62Å; F929-M932 HydrophobicContact CZ-CE 4.31Å; F929-L933 HydrophobicContact CD1-CD1 4.11Å; F929-L933 HydrophobicContact CE1-CD1 3.35Å; F929-L933 HydrophobicContact CE1-CG 4.01Å; F929-L933 HydrophobicContact CZ-CD1 3.79Å; F929-L933 HydrophobicContact CZ-CD2 4.47Å; F929-L933 HydrophobicContact CZ-CG 4.14Å; F929-L933 WeakPolarHBondContact O-CG 3.39Å; F929-L933 PolarHBondContact O-N 2.88Å; F929-F942 HydrophobicContact CD2-CD2 4.16Å; F929-F942 HydrophobicContact CD2-CE2 4.07Å; F929-F942 HydrophobicContact CE2-CD2 4.08Å; F929-F942 AromaticContact CE2-CE2 3.8Å; F929-F942 HydrophobicContact CE2-CE2 3.8Å; F929-F977 AromaticContact CD1-CE1 3.67Å; F929-F977 HydrophobicContact CD1-CE1 3.67Å; F929-F977 AromaticContact CD1-CZ 3.96Å; F929-F977 HydrophobicContact CD1-CZ 3.96Å; F929-F977 HydrophobicContact CE1-CE1 4.18Å; F929-N990 HydrophobicContact CE1-CB 4.4Å; F929-A992 HydrophobicContact CE2-CB 3.98Å; F929-A992 HydrophobicContact CZ-CB 4Å; F929-F993 HydrophobicContact CB-CD2 3.92Å; F929-F993 HydrophobicContact CB-CE2 4.36Å; F929-F993 HydrophobicContact CD1-CB 4.32Å; F929-F993 HydrophobicContact CD1-CD2 4.23Å; F929-F993 HydrophobicContact CD2-CD2 4.36Å; F929-F993 HydrophobicContact CE1-CB 4.33Å; F929-F993 HydrophobicContact CG-CB 4.47Å; F929-F993 AromaticContact CG-CD2 3.88Å; F929-F993 HydrophobicContact CG-CD2 3.88Å; F929-F993 HydrophobicContact CZ-CB 4.47Å; F929-I996 HydrophobicContact CB-CD1 4.38Å; F929-I996 HydrophobicContact CD2-CD1 3.64Å; F929-I996 HydrophobicContact CE2-CD1 4.43Å; F929-I996 HydrophobicContact CG-CD1 4.31Å
930	S	90.3	Very high	85	Confident	46 Å²	46	57.4 Å²	57.4	32%	0.322	31%	0.309	S	S	.	.	H	α-helix	trans	-69.5	-42.2	170.7	-73.6	0	0	0	0	112.4	Q926 Q927 L933 T934	Q926-S930 WeakPolarHBondContact O-CB 3.41Å; Q926-S930 PolarHBondContact O-N 3.22Å; Q926-S930 PolarHBondContact O-OG 3.22Å; Q927-S930 CarbonylContact O-C 3.59Å; Q927-S930 WeakPolarHBondContact O-CA 3.45Å; Q927-S930 WeakPolarHBondContact O-CB 3.46Å; Q927-S930 PolarHBondContact O-N 3.45Å; S930-L933 PolarHBondContact O-N 3.46Å; S930-T934 PolarHBondContact O-N 3.11Å; S930-T934 PolarHBondContact O-OG1 2.97Å; S930-T934 VanDerWaalsContact O-OG1 3.13Å
931	E	87.3	Confident	84.3	Confident	61 Å²	61	59.6 Å²	59.6	29%	0.285	32%	0.32	S	S	.	.	H	α-helix	trans	-59.6	-48	176.6	-74.6	140.2	-151.5	0	0	110.9	K889 Q927 L928 L933 T934 E935	K889-E931 IonicContact NZ-OE1 2.65Å; K889-E931 PolarHBondContact NZ-OE1 3.26Å; K889-E931 IonicContact NZ-OE2 2.68Å; K889-E931 PolarHBondContact NZ-OE2 3.21Å; Q927-E931 VanDerWaalsContact C-CD 3.48Å; Q927-E931 WeakPolarHBondContact CB-OE1 3.12Å; Q927-E931 WeakPolarHBondContact O-CG 3.47Å; Q927-E931 PolarHBondContact O-N 3.2Å; L928-E931 WeakPolarHBondContact CA-OE2 3.44Å; L928-E931 PolarHBondContact O-N 3.17Å; E931-L933 VanDerWaalsContact C-N 3.32Å; E931-L933 PolarHBondContact O-N 3.08Å; E931-T934 WeakPolarHBondContact CA-OG1 3.38Å; E931-T934 PolarHBondContact O-N 3.18Å; E931-T934 VanDerWaalsContact O-N 3.1Å; E931-T934 PolarHBondContact O-OG1 3.31Å; E931-E935 WeakPolarHBondContact O-CB 3.38Å; E931-E935 PolarHBondContact O-N 3.45Å
932	M	87.3	Confident	83.9	Confident	20 Å²	20	61.2 Å²	61.2	10%	0.099	33%	0.328	C	S	.	.	H	α-helix	trans	-52.8	-44.4	171.5	-176.1	-156.7	78.6	0	0	112.9	L928 F929 G936 H937 D941 F942 I945	L928-M932 VanDerWaalsContact O-CB 3.32Å; L928-M932 WeakPolarHBondContact O-CB 3.14Å; L928-M932 PolarHBondContact O-N 2.79Å; F929-M932 HydrophobicContact CD2-CE 3.75Å; F929-M932 HydrophobicContact CD2-SD 4.46Å; F929-M932 HydrophobicContact CE2-CE 3.62Å; F929-M932 HydrophobicContact CZ-CE 4.31Å; M932-G936 PolarHBondContact O-N 3.16Å; M932-H937 HydrophobicContact CB-CB 4.45Å; M932-H937 HydrophobicContact CG-CB 3.85Å; M932-H937 PolarHBondContact O-N 2.81Å; M932-H937 VanDerWaalsContact O-N 3.15Å; M932-D941 HydrophobicContact CG-CB 4.22Å; M932-F942 HydrophobicContact CE-CD2 4.25Å; M932-F942 HydrophobicContact SD-CB 3.84Å; M932-F942 HydrophobicContact SD-CD2 4.04Å; M932-F942 HydrophobicContact SD-CG 4.46Å; M932-I945 HydrophobicContact CB-CD1 4.21Å; M932-I945 HydrophobicContact SD-CD1 4.03Å
933	L	84.3	Confident	83.5	Confident	77 Å²	77	64.8 Å²	64.8	40%	0.403	35%	0.35	S	S	.	.	H	α-helix	trans	-71.4	-29.7	177.9	-75.6	-178.9	0	0	0	113.9	F929 S930 E931 P989	F929-L933 HydrophobicContact CD1-CD1 4.11Å; F929-L933 HydrophobicContact CE1-CD1 3.35Å; F929-L933 HydrophobicContact CE1-CG 4.01Å; F929-L933 HydrophobicContact CZ-CD1 3.79Å; F929-L933 HydrophobicContact CZ-CD2 4.47Å; F929-L933 HydrophobicContact CZ-CG 4.14Å; F929-L933 WeakPolarHBondContact O-CG 3.39Å; F929-L933 PolarHBondContact O-N 2.88Å; S930-L933 PolarHBondContact O-N 3.46Å; E931-L933 VanDerWaalsContact C-N 3.32Å; E931-L933 PolarHBondContact O-N 3.08Å; L933-P989 HydrophobicContact CD1-CB 4.11Å
934	T	81.6	Confident	83.1	Confident	116 Å²	116	65.9 Å²	65.9	71%	0.712	35%	0.353	S	S	*	.	H	α-helix	trans	-82.4	-30.5	179.2	44.7	0	0	0	0	113.6	S930 E931	S930-T934 PolarHBondContact O-N 3.11Å; S930-T934 PolarHBondContact O-OG1 2.97Å; S930-T934 VanDerWaalsContact O-OG1 3.13Å; E931-T934 WeakPolarHBondContact CA-OG1 3.38Å; E931-T934 PolarHBondContact O-N 3.18Å; E931-T934 VanDerWaalsContact O-N 3.1Å; E931-T934 PolarHBondContact O-OG1 3.31Å
935	E	77.4	Confident	83	Confident	129 Å²	129	66.4 Å²	66.4	60%	0.603	36%	0.356	S	S	*	.	H	α-helix	trans	-92.8	-10.9	-177	-68.6	171.8	-152.4	0	0	112.8	E931 H937	E931-E935 WeakPolarHBondContact O-CB 3.38Å; E931-E935 PolarHBondContact O-N 3.45Å; E935-H937 WeakPolarHBondContact CB-NE2 3.26Å; E935-H937 IonicContact OE2-CD2 2.78Å; E935-H937 IonicContact OE2-CE1 2.74Å; E935-H937 IonicContact OE2-NE2 3.22Å; E935-H937 PolarHBondContact OE2-NE2 3.47Å
936	G	65.9	Low	82.8	Confident	68 Å²	68	69.5 Å²	69.5	70%	0.701	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.1	24.3	177.5	0	0	0	0	0	113.9	M932	M932-G936 PolarHBondContact O-N 3.16Å
937	H	65.4	Low	82.6	Confident	88 Å²	88	72.4 Å²	72.4	41%	0.407	38%	0.381	S	S	.	.			trans	-67.7	160.1	-175	-73.2	-41.2	0	0	0	113.7	M932 E935 D941	M932-H937 HydrophobicContact CB-CB 4.45Å; M932-H937 HydrophobicContact CG-CB 3.85Å; M932-H937 PolarHBondContact O-N 2.81Å; M932-H937 VanDerWaalsContact O-N 3.15Å; E935-H937 WeakPolarHBondContact CB-NE2 3.26Å; E935-H937 IonicContact OE2-CD2 2.78Å; E935-H937 IonicContact OE2-CE1 2.74Å; E935-H937 IonicContact OE2-NE2 3.22Å; E935-H937 PolarHBondContact OE2-NE2 3.47Å; H937-D941 HydrophobicContact CB-CB 4.08Å
938	D	69.6	Low	82.7	Confident	124 Å²	124	69.9 Å²	69.9	66%	0.663	37%	0.369	S	S	*	.			trans	-92.3	-179.2	-156.6	-141	-27.2	0	0	0	112.6	Q940 D941	D938-Q940 PolarHBondContact O-N 3.11Å; D938-Q940 VanDerWaalsContact O-N 3.11Å; D938-D941 PolarHBondContact N-OD2 2.94Å; D938-D941 VanDerWaalsContact N-OD2 3.11Å; D938-D941 PolarHBondContact O-N 3.47Å
939	Q	69.3	Low	82.9	Confident	156 Å²	156	68 Å²	68	73%	0.729	36%	0.36	S	S	*	.	H	α-helix	trans	-60.4	-22.4	175.4	-170.7	170.8	13.3	0	0	112.6	T943	Q939-T943 WeakPolarHBondContact O-CG2 3.48Å; Q939-T943 PolarHBondContact O-N 3.13Å
940	Q	70.6	Confident	82.9	Confident	128 Å²	128	72.8 Å²	72.8	60%	0.598	38%	0.377	S	S	*	.	H	α-helix	trans	-64	-52.2	176.9	-178.6	171.3	-39.2	0	0	111.8	D938 F942 T943 E944	D938-Q940 PolarHBondContact O-N 3.11Å; D938-Q940 VanDerWaalsContact O-N 3.11Å; Q940-F942 VanDerWaalsContact C-N 3.26Å; Q940-F942 PolarHBondContact O-N 2.87Å; Q940-T943 WeakPolarHBondContact O-CA 3.26Å; Q940-T943 WeakPolarHBondContact O-CB 3.41Å; Q940-T943 PolarHBondContact O-N 2.78Å; Q940-T943 PolarHBondContact O-OG1 3.22Å; Q940-E944 PolarHBondContact NE2-OE1 3.47Å; Q940-E944 PolarHBondContact O-N 2.7Å
941	D	78.4	Confident	82.9	Confident	52 Å²	52	73.1 Å²	73.1	28%	0.278	37%	0.373	S	S	.	.	H	α-helix	trans	-59.8	-38	-177.3	-54.9	-88.4	0	0	0	111.8	M932 H937 D938 T943 E944 I945	M932-D941 HydrophobicContact CG-CB 4.22Å; H937-D941 HydrophobicContact CB-CB 4.08Å; D938-D941 PolarHBondContact N-OD2 2.94Å; D938-D941 VanDerWaalsContact N-OD2 3.11Å; D938-D941 PolarHBondContact O-N 3.47Å; D941-T943 VanDerWaalsContact C-N 3.28Å; D941-T943 PolarHBondContact O-N 2.73Å; D941-E944 PolarHBondContact O-N 2.92Å; D941-E944 VanDerWaalsContact O-N 3.12Å; D941-I945 VanDerWaalsContact O-CG1 3.32Å; D941-I945 WeakPolarHBondContact O-CG1 3.33Å; D941-I945 PolarHBondContact O-N 3.07Å
942	F	86.4	Confident	83.1	Confident	35 Å²	35	70.2 Å²	70.2	15%	0.154	36%	0.36	C	S	.	.	H	α-helix	trans	-60.1	-35.5	171.8	-172.7	-106.1	0	0	0	112.8	F929 M932 Q940 R946 A992 E995 I996	F929-F942 HydrophobicContact CD2-CD2 4.16Å; F929-F942 HydrophobicContact CD2-CE2 4.07Å; F929-F942 HydrophobicContact CE2-CD2 4.08Å; F929-F942 AromaticContact CE2-CE2 3.8Å; F929-F942 HydrophobicContact CE2-CE2 3.8Å; M932-F942 HydrophobicContact CE-CD2 4.25Å; M932-F942 HydrophobicContact SD-CB 3.84Å; M932-F942 HydrophobicContact SD-CD2 4.04Å; M932-F942 HydrophobicContact SD-CG 4.46Å; Q940-F942 VanDerWaalsContact C-N 3.26Å; Q940-F942 PolarHBondContact O-N 2.87Å; F942-R946 VanDerWaalsContact O-CB 3.25Å; F942-R946 WeakPolarHBondContact O-CB 3.28Å; F942-R946 PolarHBondContact O-N 2.85Å; F942-R946 VanDerWaalsContact O-N 3.15Å; F942-A992 HydrophobicContact CE2-CB 4.2Å; F942-A992 HydrophobicContact CZ-CB 4.33Å; F942-E995 HydrophobicContact CZ-CB 4.13Å; F942-I996 HydrophobicContact CD2-CD1 3.99Å; F942-I996 HydrophobicContact CD2-CG1 4.47Å; F942-I996 HydrophobicContact CE2-CD1 3.56Å; F942-I996 HydrophobicContact CE2-CG1 3.85Å; F942-I996 HydrophobicContact CZ-CD1 4.36Å; F942-I996 HydrophobicContact CZ-CG1 4.17Å
943	T	86.8	Confident	83.2	Confident	77 Å²	77	69.3 Å²	69.3	47%	0.472	36%	0.355	S	S	.	.	H	α-helix	trans	-72.3	-33.6	173.8	68.2	0	0	0	0	112.9	Q939 Q940 D941 R946 E947	Q939-T943 WeakPolarHBondContact O-CG2 3.48Å; Q939-T943 PolarHBondContact O-N 3.13Å; Q940-T943 WeakPolarHBondContact O-CA 3.26Å; Q940-T943 WeakPolarHBondContact O-CB 3.41Å; Q940-T943 PolarHBondContact O-N 2.78Å; Q940-T943 PolarHBondContact O-OG1 3.22Å; D941-T943 VanDerWaalsContact C-N 3.28Å; D941-T943 PolarHBondContact O-N 2.73Å; T943-R946 CarbonylContact O-C 3.54Å; T943-R946 WeakPolarHBondContact O-CB 3.47Å; T943-R946 PolarHBondContact O-N 3.16Å; T943-E947 PolarHBondContact O-N 3.46Å
944	E	88.1	Confident	83.4	Confident	82 Å²	82	71.2 Å²	71.2	38%	0.383	36%	0.363	S	S	.	.	H	α-helix	trans	-69.2	-44	176.6	-64.6	-167.8	-155.4	0	0	112	Q940 D941 R946 E947 L948	Q940-E944 PolarHBondContact NE2-OE1 3.47Å; Q940-E944 PolarHBondContact O-N 2.7Å; D941-E944 PolarHBondContact O-N 2.92Å; D941-E944 VanDerWaalsContact O-N 3.12Å; E944-R946 PolarHBondContact O-N 3.45Å; E944-E947 PolarHBondContact O-N 3.05Å; E944-L948 WeakPolarHBondContact O-CB 3.15Å; E944-L948 PolarHBondContact O-N 3.44Å
945	I	91.8	Very high	83.7	Confident	12 Å²	12	67.6 Å²	67.6	6%	0.062	34%	0.343	C	S	.	.	H	α-helix	trans	-60.3	-36.2	172.4	-60.9	165.3	0	0	0	110.5	L925 L928 M932 D941 L948 A949 I996	L925-I945 HydrophobicContact CD2-CG2 3.92Å; L928-I945 HydrophobicContact CB-CD1 3.94Å; L928-I945 HydrophobicContact CB-CG1 3.98Å; L928-I945 HydrophobicContact CD1-CG1 4.5Å; M932-I945 HydrophobicContact CB-CD1 4.21Å; M932-I945 HydrophobicContact SD-CD1 4.03Å; D941-I945 VanDerWaalsContact O-CG1 3.32Å; D941-I945 WeakPolarHBondContact O-CG1 3.33Å; D941-I945 PolarHBondContact O-N 3.07Å; I945-L948 WeakPolarHBondContact O-CB 3.45Å; I945-L948 PolarHBondContact O-N 3.25Å; I945-A949 WeakPolarHBondContact O-CB 3.47Å; I945-A949 PolarHBondContact O-N 3.12Å; I945-I996 HydrophobicContact CB-CD1 4.36Å; I945-I996 HydrophobicContact CG2-CD1 3.66Å; I945-I996 HydrophobicContact CG2-CG1 4.28Å; I945-I996 HydrophobicContact CG2-CG2 4.19Å
946	R	91.7	Very high	83.9	Confident	66 Å²	66	62 Å²	62	25%	0.249	32%	0.317	C	S	.	.	H	α-helix	trans	-72.4	-34.7	176.8	-172.7	176.4	171.7	170.3	-0.4	113	F942 T943 E944 R950 I996 E999	F942-R946 VanDerWaalsContact O-CB 3.25Å; F942-R946 WeakPolarHBondContact O-CB 3.28Å; F942-R946 PolarHBondContact O-N 2.85Å; F942-R946 VanDerWaalsContact O-N 3.15Å; T943-R946 CarbonylContact O-C 3.54Å; T943-R946 WeakPolarHBondContact O-CB 3.47Å; T943-R946 PolarHBondContact O-N 3.16Å; E944-R946 PolarHBondContact O-N 3.45Å; R946-R950 PolarHBondContact O-N 3.18Å; R946-R950 VanDerWaalsContact O-N 3.11Å; R946-I996 HydrophobicContact CB-CG1 4.43Å; R946-E999 HydrophobicContact CG-CG 3.8Å; R946-E999 IonicContact CZ-OE1 2.75Å; R946-E999 VanDerWaalsContact CZ-OE1 3.28Å; R946-E999 IonicContact NE-OE1 3.43Å; R946-E999 PolarHBondContact NE-OE1 3.44Å; R946-E999 IonicContact NH2-OE1 3.56Å; R946-E999 PolarHBondContact NH2-OE1 2.96Å
947	E	90.1	Very high	84.4	Confident	87 Å²	87	60.5 Å²	60.5	41%	0.407	30%	0.301	S	S	.	.	H	α-helix	trans	-69	-41.5	170.6	-173.1	174.2	136.1	0	0	111.5	T943 E944 A949 R950 K951	T943-E947 PolarHBondContact O-N 3.46Å; E944-E947 PolarHBondContact O-N 3.05Å; E947-A949 VanDerWaalsContact C-N 3.32Å; E947-A949 PolarHBondContact O-N 2.86Å; E947-R950 WeakPolarHBondContact O-CB 3.11Å; E947-R950 PolarHBondContact O-N 2.88Å; E947-R950 VanDerWaalsContact O-N 3.11Å; E947-K951 HydrophobicContact CG-CD 4.32Å; E947-K951 HydrophobicContact CG-CG 4.47Å; E947-K951 WeakPolarHBondContact O-CG 3.27Å; E947-K951 PolarHBondContact O-N 2.93Å; E947-K951 WeakPolarHBondContact OE1-CE 3.3Å; E947-K951 IonicContact OE1-NZ 2.63Å; E947-K951 PolarHBondContact OE1-NZ 3.01Å
948	L	93.4	Very high	84.9	Confident	3 Å²	3	62.7 Å²	62.7	2%	0.016	32%	0.32	C	S	.	.	H	α-helix	trans	-55.6	-47	172.3	175.3	62.2	0	0	0	111.1	K889 Y891 L925 L928 E944 I945 R950 K951 L952	K889-L948 VanDerWaalsContact O-CD2 3.3Å; K889-L948 WeakPolarHBondContact O-CD2 3.41Å; Y891-L948 HydrophobicContact CD1-CD1 4.12Å; Y891-L948 HydrophobicContact CG-CD1 4.46Å; L925-L948 HydrophobicContact CD2-CB 4.36Å; L925-L948 HydrophobicContact CD2-CD2 3.82Å; L925-L948 HydrophobicContact CD2-CG 3.91Å; L928-L948 HydrophobicContact CD1-CD2 3.43Å; L928-L948 VanDerWaalsContact CD1-CD2 3.43Å; E944-L948 WeakPolarHBondContact O-CB 3.15Å; E944-L948 PolarHBondContact O-N 3.44Å; I945-L948 WeakPolarHBondContact O-CB 3.45Å; I945-L948 PolarHBondContact O-N 3.25Å; L948-R950 VanDerWaalsContact C-N 3.33Å; L948-R950 PolarHBondContact O-N 3.32Å; L948-K951 PolarHBondContact O-N 2.96Å; L948-L952 HydrophobicContact CD1-CD1 3.8Å; L948-L952 HydrophobicContact CD1-CG 4.08Å; L948-L952 HydrophobicContact CG-CD1 3.87Å; L948-L952 HydrophobicContact CG-CG 4.49Å; L948-L952 WeakPolarHBondContact O-CB 3.46Å; L948-L952 VanDerWaalsContact O-CG 3.3Å; L948-L952 WeakPolarHBondContact O-CG 3.44Å; L948-L952 PolarHBondContact O-N 3.08Å
949	A	94.2	Very high	85.4	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-57.6	-42.9	174.6	0	0	0	0	0	112.4	L925 I945 E947 L952 A953 I996 E999 F1000	L925-A949 HydrophobicContact CD1-CB 3.85Å; L925-A949 HydrophobicContact CD2-CB 4.1Å; I945-A949 WeakPolarHBondContact O-CB 3.47Å; I945-A949 PolarHBondContact O-N 3.12Å; E947-A949 VanDerWaalsContact C-N 3.32Å; E947-A949 PolarHBondContact O-N 2.86Å; A949-L952 PolarHBondContact O-N 2.68Å; A949-A953 WeakPolarHBondContact O-CB 3.48Å; A949-A953 PolarHBondContact O-N 3.43Å; A949-I996 HydrophobicContact CB-CG2 3.59Å; A949-E999 HydrophobicContact CB-CB 4.33Å; A949-F1000 HydrophobicContact CB-CE2 3.77Å; A949-F1000 HydrophobicContact CB-CZ 4.27Å; A949-F1000 WeakPolarHBondContact O-CZ 3.24Å
950	R	91.1	Very high	85.8	Confident	101 Å²	101	54.7 Å²	54.7	38%	0.381	28%	0.282	S	S	.	.	H	α-helix	trans	-64.9	-44	176	-167.6	-177.7	-59.7	125.1	6.7	112.6	R946 E947 L948 L952 A953 M954 E999	R946-R950 PolarHBondContact O-N 3.18Å; R946-R950 VanDerWaalsContact O-N 3.11Å; E947-R950 WeakPolarHBondContact O-CB 3.11Å; E947-R950 PolarHBondContact O-N 2.88Å; E947-R950 VanDerWaalsContact O-N 3.11Å; L948-R950 VanDerWaalsContact C-N 3.33Å; L948-R950 PolarHBondContact O-N 3.32Å; R950-L952 VanDerWaalsContact C-N 3.34Å; R950-L952 PolarHBondContact O-N 3.24Å; R950-A953 PolarHBondContact O-N 2.97Å; R950-M954 PolarHBondContact O-N 3.38Å; R950-E999 IonicContact CZ-OE1 3.84Å; R950-E999 IonicContact CZ-OE2 3.57Å; R950-E999 IonicContact NE-OE1 2.93Å; R950-E999 IonicContact NE-OE2 3.04Å; R950-E999 PolarHBondContact NE-OE2 2.81Å; R950-E999 IonicContact NH2-OE1 2.6Å; R950-E999 PolarHBondContact NH2-OE1 3.45Å; R950-E999 IonicContact NH2-OE2 2.67Å; R950-E999 PolarHBondContact NH2-OE2 3.23Å
951	K	90	Very high	86.1	Confident	53 Å²	53	58.9 Å²	58.9	23%	0.23	29%	0.292	C	S	.	.	H	α-helix	trans	-59.5	-43	173.6	-74.6	172.8	177.7	160.8	0	111	Y891 S892 E947 L948	Y891-K951 HydrophobicContact CD1-CB 4.32Å; Y891-K951 HydrophobicContact CE1-CB 3.94Å; S892-K951 PolarHBondContact OG-NZ 3.15Å; E947-K951 HydrophobicContact CG-CD 4.32Å; E947-K951 HydrophobicContact CG-CG 4.47Å; E947-K951 WeakPolarHBondContact O-CG 3.27Å; E947-K951 PolarHBondContact O-N 2.93Å; E947-K951 WeakPolarHBondContact OE1-CE 3.3Å; E947-K951 IonicContact OE1-NZ 2.63Å; E947-K951 PolarHBondContact OE1-NZ 3.01Å; L948-K951 PolarHBondContact O-N 2.96Å
952	L	91.4	Very high	86.2	Confident	1 Å²	1	66 Å²	66	1%	0.005	32%	0.315	C	S	.	.	H	α-helix	trans	-72.2	-35.2	177.6	-69.3	171.6	0	0	0	112.7	Y891 V906 V921 L948 A949 R950 M954 S955 F1000	Y891-L952 HydrophobicContact CD1-CD2 3.75Å; Y891-L952 HydrophobicContact CD1-CG 4.19Å; Y891-L952 HydrophobicContact CE1-CD2 4.18Å; V906-L952 HydrophobicContact CG2-CD2 4.29Å; V921-L952 HydrophobicContact CG1-CB 4.11Å; V921-L952 HydrophobicContact CG1-CD1 4.18Å; L948-L952 HydrophobicContact CD1-CD1 3.8Å; L948-L952 HydrophobicContact CD1-CG 4.08Å; L948-L952 HydrophobicContact CG-CD1 3.87Å; L948-L952 HydrophobicContact CG-CG 4.49Å; L948-L952 WeakPolarHBondContact O-CB 3.46Å; L948-L952 VanDerWaalsContact O-CG 3.3Å; L948-L952 WeakPolarHBondContact O-CG 3.44Å; L948-L952 PolarHBondContact O-N 3.08Å; A949-L952 PolarHBondContact O-N 2.68Å; R950-L952 VanDerWaalsContact C-N 3.34Å; R950-L952 PolarHBondContact O-N 3.24Å; L952-M954 VanDerWaalsContact C-N 3.27Å; L952-M954 PolarHBondContact O-N 3.3Å; L952-S955 WeakPolarHBondContact O-CB 3.4Å; L952-S955 PolarHBondContact O-N 3.11Å; L952-S955 PolarHBondContact O-OG 2.97Å; L952-F1000 HydrophobicContact CB-CE1 4.42Å; L952-F1000 HydrophobicContact CB-CZ 4.24Å
953	A	90.6	Very high	86.1	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60.5	-35.6	175.6	0	0	0	0	0	112.4	A949 R950 S955 F956 E999 F1000 F1002 K1003	A949-A953 WeakPolarHBondContact O-CB 3.48Å; A949-A953 PolarHBondContact O-N 3.43Å; R950-A953 PolarHBondContact O-N 2.97Å; A953-S955 PolarHBondContact O-N 3.03Å; A953-F956 PolarHBondContact O-N 3.08Å; A953-E999 WeakPolarHBondContact CB-O 3.32Å; A953-F1000 HydrophobicContact CB-CD1 3.62Å; A953-F1000 HydrophobicContact CB-CE1 3.81Å; A953-F1000 HydrophobicContact CB-CG 4.18Å; A953-F1002 HydrophobicContact CB-CE1 3.98Å; A953-F1002 HydrophobicContact CB-CZ 4.45Å; A953-K1003 VanDerWaalsContact O-CE 3.28Å; A953-K1003 WeakPolarHBondContact O-CE 3.39Å
954	M	88.6	Confident	86.1	Confident	117 Å²	117	64.8 Å²	64.8	58%	0.576	30%	0.301	S	S	*	.	H	α-helix	trans	-64.4	-25.6	175.4	-71.9	-63	-79.5	0	0	113.5	R950 L952 F956 G957 F1002	R950-M954 PolarHBondContact O-N 3.38Å; L952-M954 VanDerWaalsContact C-N 3.27Å; L952-M954 PolarHBondContact O-N 3.3Å; M954-F956 PolarHBondContact O-N 3.14Å; M954-F956 VanDerWaalsContact O-N 3.1Å; M954-G957 PolarHBondContact O-N 3.31Å; M954-F1002 HydrophobicContact SD-CE2 4.15Å; M954-F1002 HydrophobicContact SD-CZ 3.79Å
955	S	85.9	Confident	86.2	Confident	41 Å²	41	68.4 Å²	68.4	29%	0.287	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-2.6	178.2	77.3	0	0	0	0	114.9	K910 L952 A953	K910-S955 VanDerWaalsContact NZ-C 3.27Å; K910-S955 PolarHBondContact NZ-O 3.02Å; K910-S955 PolarHBondContact NZ-OG 3.01Å; L952-S955 WeakPolarHBondContact O-CB 3.4Å; L952-S955 PolarHBondContact O-N 3.11Å; L952-S955 PolarHBondContact O-OG 2.97Å; A953-S955 PolarHBondContact O-N 3.03Å
956	F	82.4	Confident	86.2	Confident	12 Å²	12	69.1 Å²	69.1	5%	0.053	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	10.8	177.4	-69.9	-85.3	0	0	0	114.3	A918 V921 A953 M954 S963 Q966 L967 L970 F1000	A918-F956 HydrophobicContact CB-CE1 3.97Å; A918-F956 HydrophobicContact CB-CZ 4.08Å; V921-F956 HydrophobicContact CG1-CE2 4.41Å; A953-F956 PolarHBondContact O-N 3.08Å; M954-F956 PolarHBondContact O-N 3.14Å; M954-F956 VanDerWaalsContact O-N 3.1Å; F956-S963 WeakPolarHBondContact O-CB 3.5Å; F956-S963 PolarHBondContact O-OG 3.14Å; F956-Q966 HydrophobicContact CD1-CB 4.3Å; F956-Q966 HydrophobicContact CE1-CB 3.99Å; F956-L967 HydrophobicContact CB-CD2 4.18Å; F956-L967 HydrophobicContact CD1-CD2 4.08Å; F956-L967 HydrophobicContact CD1-CG 4.31Å; F956-L967 HydrophobicContact CD2-CD2 4.03Å; F956-L967 HydrophobicContact CE2-CD2 4.47Å; F956-L967 HydrophobicContact CG-CD2 3.81Å; F956-L967 HydrophobicContact CG-CG 4.39Å; F956-L970 HydrophobicContact CE2-CD1 4.25Å; F956-L970 HydrophobicContact CZ-CD1 4.11Å; F956-F1000 HydrophobicContact CE2-CD1 4.41Å; F956-F1000 HydrophobicContact CE2-CE1 4.07Å
957	G	76.8	Confident	86.1	Confident	35 Å²	35	66 Å²	66	36%	0.361	31%	0.307	S	S	.	.			trans	74.5	-166.7	171.7	0	0	0	0	0	114.4	M954 K1003	M954-G957 PolarHBondContact O-N 3.31Å; G957-K1003 PolarHBondContact O-NZ 3.3Å
958	V	75.9	Confident	86.3	Confident	135 Å²	135	62.8 Å²	62.8	82%	0.818	29%	0.293	S	S	*	.	S	Bend	trans	-105.6	-32.2	178	-173.5	0	0	0	0	111.7	L960	V958-L960 PolarHBondContact O-N 2.78Å
959	D	79.3	Confident	86.3	Confident	71 Å²	71	63.2 Å²	63.2	38%	0.38	30%	0.298	S	S	.	.			trans	-73.5	88.4	174.1	-174.7	-15.4	0	0	0	111.2	R961 R962 S963	D959-R961 PolarHBondContact O-N 3.38Å; D959-R961 WeakPolarHBondContact OD1-CA 3.42Å; D959-R961 WeakPolarHBondContact OD1-CB 3.48Å; D959-R961 PolarHBondContact OD1-N 3.18Å; D959-R962 HydrophobicContact CB-CG 4.41Å; D959-R962 PolarHBondContact O-N 3.06Å; D959-R962 PolarHBondContact OD1-N 3.01Å; D959-R962 WeakPolarHBondContact OD2-CD 3.38Å; D959-R962 WeakPolarHBondContact OD2-CG 3.45Å; D959-R962 IonicContact OD2-CZ 3.9Å; D959-R962 IonicContact OD2-NE 3.03Å; D959-R962 PolarHBondContact OD2-NE 3.23Å; D959-R962 IonicContact OD2-NH2 2.71Å; D959-S963 PolarHBondContact O-N 2.82Å; D959-S963 PolarHBondContact O-OG 2.9Å
960	L	78.7	Confident	86.3	Confident	40 Å²	40	63.2 Å²	63.2	21%	0.209	30%	0.298	C	S	.	.	H	α-helix	trans	-65.1	-17.7	179.2	-49.6	-173.7	0	0	0	113	V958 R964 K1003 L1005	V958-L960 PolarHBondContact O-N 2.78Å; L960-R964 PolarHBondContact O-N 2.85Å; L960-K1003 HydrophobicContact CD2-CB 4.25Å; L960-K1003 HydrophobicContact CD2-CD 3.95Å; L960-K1003 WeakPolarHBondContact CD2-O 3.23Å; L960-L1005 HydrophobicContact CB-CD2 4.04Å; L960-L1005 HydrophobicContact CB-CG 4.22Å; L960-L1005 HydrophobicContact CD1-CD2 4.47Å
961	R	77.5	Confident	86.4	Confident	217 Å²	217	58.4 Å²	58.4	82%	0.819	28%	0.28	S	S	*	.	H	α-helix	trans	-72.8	-36.8	176.7	-60.3	-174.2	176.8	-147	0.7	110.8	D959	D959-R961 PolarHBondContact O-N 3.38Å; D959-R961 WeakPolarHBondContact OD1-CA 3.42Å; D959-R961 WeakPolarHBondContact OD1-CB 3.48Å; D959-R961 PolarHBondContact OD1-N 3.18Å
962	R	80.1	Confident	86.6	Confident	200 Å²	200	57.8 Å²	57.8	76%	0.755	28%	0.279	S	S	*	.	H	α-helix	trans	-70.5	-37	173.1	-67.4	179.6	-155.2	-142.8	1.8	112.5	D959 Q966	D959-R962 HydrophobicContact CB-CG 4.41Å; D959-R962 PolarHBondContact O-N 3.06Å; D959-R962 PolarHBondContact OD1-N 3.01Å; D959-R962 WeakPolarHBondContact OD2-CD 3.38Å; D959-R962 WeakPolarHBondContact OD2-CG 3.45Å; D959-R962 IonicContact OD2-CZ 3.9Å; D959-R962 IonicContact OD2-NE 3.03Å; D959-R962 PolarHBondContact OD2-NE 3.23Å; D959-R962 IonicContact OD2-NH2 2.71Å; R962-Q966 PolarHBondContact O-NE2 3.24Å
963	S	83.1	Confident	86.7	Confident	3 Å²	3	59.4 Å²	59.4	2%	0.021	29%	0.287	C	S	.	.	H	α-helix	trans	-89.3	-11	-177.2	52.3	0	0	0	0	115.9	F956 D959 K965 Q966 L967	F956-S963 WeakPolarHBondContact O-CB 3.5Å; F956-S963 PolarHBondContact O-OG 3.14Å; D959-S963 PolarHBondContact O-N 2.82Å; D959-S963 PolarHBondContact O-OG 2.9Å; S963-K965 PolarHBondContact O-N 2.89Å; S963-Q966 VanDerWaalsContact CA-OE1 3.31Å; S963-Q966 WeakPolarHBondContact O-CB 3.14Å; S963-Q966 PolarHBondContact O-N 2.91Å; S963-L967 PolarHBondContact O-N 2.59Å; S963-L967 VanDerWaalsContact O-N 3.12Å
964	R	88.6	Confident	86.8	Confident	84 Å²	84	59.4 Å²	59.4	32%	0.317	29%	0.287	S	S	.	.	H	α-helix	trans	-35.1	-62.4	177.6	-177.8	171.9	-171.5	176.7	5.2	114.9	L960 Q966 L967 V968 L1005 D1008	L960-R964 PolarHBondContact O-N 2.85Å; R964-Q966 VanDerWaalsContact C-N 3.28Å; R964-Q966 PolarHBondContact O-N 2.65Å; R964-L967 PolarHBondContact O-N 2.78Å; R964-V968 WeakPolarHBondContact O-CG2 3.42Å; R964-V968 PolarHBondContact O-N 3.03Å; R964-L1005 HydrophobicContact CB-CD1 4.32Å; R964-L1005 HydrophobicContact CG-CD1 4.26Å; R964-D1008 WeakPolarHBondContact CD-OD2 3.44Å; R964-D1008 WeakPolarHBondContact CG-OD2 3.49Å; R964-D1008 IonicContact CZ-OD1 3.61Å; R964-D1008 IonicContact CZ-OD2 3.76Å; R964-D1008 VanDerWaalsContact NE-CG 3.26Å; R964-D1008 IonicContact NE-OD1 2.76Å; R964-D1008 PolarHBondContact NE-OD1 3.47Å; R964-D1008 IonicContact NE-OD2 3.65Å; R964-D1008 PolarHBondContact NE-OD2 3.34Å; R964-D1008 IonicContact NH2-OD1 2.77Å; R964-D1008 PolarHBondContact NH2-OD1 3.19Å; R964-D1008 IonicContact NH2-OD2 2.59Å
965	K	89.5	Confident	87	Confident	159 Å²	159	53.9 Å²	53.9	69%	0.691	26%	0.26	S	S	*	.	H	α-helix	trans	-65.2	-28.8	-174.9	-66.9	-172.1	180	-177.2	0	113.4	I915 S963 A969	I915-K965 HydrophobicContact CD1-CB 4.36Å; S963-K965 PolarHBondContact O-N 2.89Å; K965-A969 WeakPolarHBondContact O-CB 3.38Å; K965-A969 PolarHBondContact O-N 3.48Å
966	Q	90.9	Very high	87.3	Confident	27 Å²	27	58 Å²	58	13%	0.126	27%	0.269	C	S	.	.	H	α-helix	trans	-71.1	-50.1	177.1	-66.8	115.3	70.7	0	0	110.9	P914 A918 F956 R962 S963 R964 A969 L970	P914-Q966 HydrophobicContact CB-CG 3.66Å; P914-Q966 WeakPolarHBondContact O-CG 3.34Å; A918-Q966 HydrophobicContact CB-CB 3.76Å; A918-Q966 HydrophobicContact CB-CG 4.45Å; A918-Q966 WeakPolarHBondContact CB-O 3.3Å; F956-Q966 HydrophobicContact CD1-CB 4.3Å; F956-Q966 HydrophobicContact CE1-CB 3.99Å; R962-Q966 PolarHBondContact O-NE2 3.24Å; S963-Q966 VanDerWaalsContact CA-OE1 3.31Å; S963-Q966 WeakPolarHBondContact O-CB 3.14Å; S963-Q966 PolarHBondContact O-N 2.91Å; R964-Q966 VanDerWaalsContact C-N 3.28Å; R964-Q966 PolarHBondContact O-N 2.65Å; Q966-A969 PolarHBondContact O-N 3.41Å; Q966-L970 PolarHBondContact O-N 3.02Å
967	L	90.9	Very high	87.7	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-42.4	-177.4	-67.6	163.1	0	0	0	111.1	F956 S963 R964 A969 L970 H971 K1003 L1004	F956-L967 HydrophobicContact CB-CD2 4.18Å; F956-L967 HydrophobicContact CD1-CD2 4.08Å; F956-L967 HydrophobicContact CD1-CG 4.31Å; F956-L967 HydrophobicContact CD2-CD2 4.03Å; F956-L967 HydrophobicContact CE2-CD2 4.47Å; F956-L967 HydrophobicContact CG-CD2 3.81Å; F956-L967 HydrophobicContact CG-CG 4.39Å; S963-L967 PolarHBondContact O-N 2.59Å; S963-L967 VanDerWaalsContact O-N 3.12Å; R964-L967 PolarHBondContact O-N 2.78Å; L967-A969 VanDerWaalsContact C-N 3.32Å; L967-A969 PolarHBondContact O-N 3.1Å; L967-L970 PolarHBondContact O-N 3.44Å; L967-H971 PolarHBondContact O-CD2 3.13Å; L967-H971 PolarHBondContact O-N 3.16Å; L967-K1003 HydrophobicContact CD1-CB 3.56Å; L967-K1003 WeakPolarHBondContact CD1-O 3.4Å; L967-K1003 HydrophobicContact CD2-CB 4.09Å; L967-K1003 HydrophobicContact CG-CB 4.49Å; L967-L1004 HydrophobicContact CB-CD2 3.96Å
968	V	93.1	Very high	88.3	Confident	19 Å²	19	56.6 Å²	56.6	12%	0.115	25%	0.253	C	S	.	.	H	α-helix	trans	-58.6	-43.4	173.6	172.6	0	0	0	0	111.5	R964 H971 L972 L1004 D1008	R964-V968 WeakPolarHBondContact O-CG2 3.42Å; R964-V968 PolarHBondContact O-N 3.03Å; V968-H971 PolarHBondContact O-N 3.38Å; V968-L972 HydrophobicContact CG1-CD1 3.9Å; V968-L972 HydrophobicContact CG1-CG 4.26Å; V968-L972 WeakPolarHBondContact O-CB 3.4Å; V968-L972 VanDerWaalsContact O-CG 3.25Å; V968-L972 WeakPolarHBondContact O-CG 3.45Å; V968-L972 PolarHBondContact O-N 3.13Å; V968-L1004 HydrophobicContact CG2-CD2 4.49Å; V968-D1008 HydrophobicContact CG2-CB 3.79Å
969	A	92.8	Very high	88.8	Confident	13 Å²	13	51 Å²	51	11%	0.107	22%	0.218	C	C	.	.	H	α-helix	trans	-64.3	-40.5	177.4	0	0	0	0	0	113.1	I915 K919 K965 Q966 L967 L972 D973	I915-A969 HydrophobicContact CG2-CB 3.82Å; K919-A969 HydrophobicContact CG-CB 4.48Å; K965-A969 WeakPolarHBondContact O-CB 3.38Å; K965-A969 PolarHBondContact O-N 3.48Å; Q966-A969 PolarHBondContact O-N 3.41Å; L967-A969 VanDerWaalsContact C-N 3.32Å; L967-A969 PolarHBondContact O-N 3.1Å; A969-L972 PolarHBondContact O-N 3.03Å; A969-D973 PolarHBondContact O-N 3.12Å; A969-D973 VanDerWaalsContact O-N 3.16Å
970	L	94.8	Very high	89	Confident	0 Å²	0	56 Å²	56	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-60.8	-46.2	174	177.7	157.4	0	0	0	111.3	A918 V921 C922 F956 Q966 L967 G974 L997 F1000	A918-L970 HydrophobicContact CB-CB 4.26Å; V921-L970 HydrophobicContact CB-CD1 4.43Å; V921-L970 HydrophobicContact CG1-CD1 3.89Å; C922-L970 HydrophobicContact CB-CG 4.1Å; C922-L970 PolarHBondContact SG-O 3.33Å; F956-L970 HydrophobicContact CE2-CD1 4.25Å; F956-L970 HydrophobicContact CZ-CD1 4.11Å; Q966-L970 PolarHBondContact O-N 3.02Å; L967-L970 PolarHBondContact O-N 3.44Å; L970-G974 PolarHBondContact O-N 3.31Å; L970-L997 HydrophobicContact CD2-CD1 3.71Å; L970-F1000 HydrophobicContact CD1-CD1 3.84Å; L970-F1000 HydrophobicContact CD1-CE1 3.75Å; L970-F1000 HydrophobicContact CD1-CG 4.37Å; L970-F1000 HydrophobicContact CD1-CZ 4.21Å; L970-F1000 HydrophobicContact CD2-CB 4.04Å; L970-F1000 HydrophobicContact CD2-CD1 4.03Å; L970-F1000 HydrophobicContact CD2-CD2 3.96Å; L970-F1000 HydrophobicContact CD2-CE2 4.44Å; L970-F1000 HydrophobicContact CD2-CG 3.74Å
971	H	94.3	Very high	88.3	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-69	-36.3	179.1	-78.7	-78	0	0	0	113.4	L967 V968 I975 L997 F1000 L1012 Y1033	L967-H971 PolarHBondContact O-CD2 3.13Å; L967-H971 PolarHBondContact O-N 3.16Å; V968-H971 PolarHBondContact O-N 3.38Å; H971-I975 WeakPolarHBondContact O-CD1 3.12Å; H971-I975 VanDerWaalsContact O-CG1 3.23Å; H971-I975 WeakPolarHBondContact O-CG1 3.28Å; H971-I975 PolarHBondContact O-N 3.47Å; H971-L997 PolarHBondContact CE1-O 3.19Å; H971-L997 VanDerWaalsContact CE1-O 3.31Å; H971-F1000 WeakPolarHBondContact NE2-CB 3.46Å; H971-L1012 HydrophobicContact CB-CD1 3.58Å; H971-L1012 HydrophobicContact CB-CD2 3.74Å; H971-L1012 HydrophobicContact CB-CG 4.3Å; H971-Y1033 AromaticContact ND1-CE2 3.8Å; H971-Y1033 AromaticContact ND1-CZ 3.77Å; H971-Y1033 PolarHBondContact ND1-OH 2.88Å
972	L	94.1	Very high	87.4	Confident	40 Å²	40	51.3 Å²	51.3	21%	0.209	23%	0.229	C	C	.	.	H	α-helix	trans	-64.8	-44	176.1	-71.7	172.8	0	0	0	112.2	V968 A969 R976 L1012 F1015	V968-L972 HydrophobicContact CG1-CD1 3.9Å; V968-L972 HydrophobicContact CG1-CG 4.26Å; V968-L972 WeakPolarHBondContact O-CB 3.4Å; V968-L972 VanDerWaalsContact O-CG 3.25Å; V968-L972 WeakPolarHBondContact O-CG 3.45Å; V968-L972 PolarHBondContact O-N 3.13Å; A969-L972 PolarHBondContact O-N 3.03Å; L972-R976 WeakPolarHBondContact O-CG 3.11Å; L972-R976 PolarHBondContact O-N 3.46Å; L972-L1012 HydrophobicContact CD2-CD2 3.81Å; L972-L1012 HydrophobicContact CG-CD2 4.02Å; L972-F1015 HydrophobicContact CB-CE1 4.49Å; L972-F1015 HydrophobicContact CD2-CB 4.3Å; L972-F1015 HydrophobicContact CD2-CD1 3.34Å; L972-F1015 HydrophobicContact CD2-CD2 4.15Å; L972-F1015 HydrophobicContact CD2-CE1 3.56Å; L972-F1015 HydrophobicContact CD2-CE2 4.35Å; L972-F1015 HydrophobicContact CD2-CG 3.65Å; L972-F1015 HydrophobicContact CD2-CZ 4.08Å
973	D	92.8	Very high	86.1	Confident	35 Å²	35	51.7 Å²	51.7	19%	0.187	24%	0.239	C	C	.	.	H	α-helix	trans	-69.5	-37.9	177.4	-75.3	13.3	0	0	0	111.8	K919 Q926 A969 R976 F977	K919-D973 WeakPolarHBondContact CG-OD2 3.26Å; K919-D973 IonicContact NZ-OD1 3.73Å; K919-D973 PolarHBondContact NZ-OD1 3.08Å; K919-D973 IonicContact NZ-OD2 3.78Å; K919-D973 PolarHBondContact NZ-OD2 3.31Å; Q926-D973 PolarHBondContact NE2-O 3.32Å; A969-D973 PolarHBondContact O-N 3.12Å; A969-D973 VanDerWaalsContact O-N 3.16Å; D973-R976 PolarHBondContact O-N 3.36Å; D973-F977 PolarHBondContact O-N 3.22Å
974	G	93.4	Very high	84.4	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-64.5	-39.5	175.9	0	0	0	0	0	113.9	L970 F977 A978	L970-G974 PolarHBondContact O-N 3.31Å; G974-F977 PolarHBondContact O-N 3.22Å; G974-A978 PolarHBondContact O-N 3.07Å; G974-A978 VanDerWaalsContact O-N 3.13Å
975	I	92.1	Very high	82.6	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.6	-43.3	174.7	-70.5	164.7	0	0	0	110.7	H971 F977 A978 F979 L994 L997 L1012 F1015 L1016 E1019 Y1033	H971-I975 WeakPolarHBondContact O-CD1 3.12Å; H971-I975 VanDerWaalsContact O-CG1 3.23Å; H971-I975 WeakPolarHBondContact O-CG1 3.28Å; H971-I975 PolarHBondContact O-N 3.47Å; I975-F977 VanDerWaalsContact C-N 3.34Å; I975-F977 PolarHBondContact O-N 3.41Å; I975-A978 WeakPolarHBondContact O-CB 3.38Å; I975-A978 PolarHBondContact O-N 2.92Å; I975-F979 HydrophobicContact CG2-CD2 4.16Å; I975-F979 HydrophobicContact CG2-CE2 4.3Å; I975-F979 WeakPolarHBondContact O-CD2 3.4Å; I975-F979 PolarHBondContact O-N 2.88Å; I975-L994 HydrophobicContact CG1-CD2 4.33Å; I975-L997 HydrophobicContact CG1-CD2 4.08Å; I975-L1012 HydrophobicContact CD1-CD2 4.3Å; I975-F1015 HydrophobicContact CB-CD1 4.25Å; I975-F1015 HydrophobicContact CB-CE1 4.05Å; I975-F1015 HydrophobicContact CD1-CD1 3.92Å; I975-F1015 HydrophobicContact CG2-CD1 3.92Å; I975-F1015 HydrophobicContact CG2-CE1 3.8Å; I975-L1016 HydrophobicContact CD1-CB 4.44Å; I975-L1016 HydrophobicContact CG1-CD1 4.39Å; I975-L1016 HydrophobicContact CG2-CD1 4.28Å; I975-E1019 HydrophobicContact CG2-CB 4.1Å; I975-E1019 HydrophobicContact CG2-CG 4.11Å; I975-Y1033 HydrophobicContact CD1-CE1 3.94Å; I975-Y1033 HydrophobicContact CG1-CE1 3.89Å
976	R	91.8	Very high	80.8	Confident	128 Å²	128	61.1 Å²	61.1	48%	0.483	31%	0.306	S	S	.	.	H	α-helix	trans	-63.3	-37.6	177.6	-76	168.5	170.1	161.8	-3.9	113.3	L972 D973 R980 F1015	L972-R976 WeakPolarHBondContact O-CG 3.11Å; L972-R976 PolarHBondContact O-N 3.46Å; D973-R976 PolarHBondContact O-N 3.36Å; R976-R980 PolarHBondContact O-N 2.95Å; R976-F1015 HydrophobicContact CG-CE1 4.36Å; R976-F1015 HydrophobicContact CG-CZ 4.12Å
977	F	91	Very high	79.3	Confident	18 Å²	18	67.4 Å²	67.4	8%	0.079	34%	0.336	C	S	.	.	H	α-helix	trans	-65	-42.6	174.3	175.1	-93.2	0	0	0	111.7	Q926 F929 D973 G974 I975 F979 R980 N990 F993	Q926-F977 HydrophobicContact CB-CD1 4.44Å; Q926-F977 HydrophobicContact CB-CD2 3.87Å; Q926-F977 HydrophobicContact CB-CE1 4.31Å; Q926-F977 HydrophobicContact CB-CE2 3.73Å; Q926-F977 HydrophobicContact CB-CG 4.22Å; Q926-F977 HydrophobicContact CB-CZ 3.96Å; Q926-F977 HydrophobicContact CG-CB 4.07Å; Q926-F977 HydrophobicContact CG-CD1 3.85Å; Q926-F977 HydrophobicContact CG-CD2 3.72Å; Q926-F977 HydrophobicContact CG-CE1 4.17Å; Q926-F977 HydrophobicContact CG-CE2 4.06Å; Q926-F977 HydrophobicContact CG-CG 3.6Å; Q926-F977 HydrophobicContact CG-CZ 4.27Å; F929-F977 AromaticContact CD1-CE1 3.67Å; F929-F977 HydrophobicContact CD1-CE1 3.67Å; F929-F977 AromaticContact CD1-CZ 3.96Å; F929-F977 HydrophobicContact CD1-CZ 3.96Å; F929-F977 HydrophobicContact CE1-CE1 4.18Å; D973-F977 PolarHBondContact O-N 3.22Å; G974-F977 PolarHBondContact O-N 3.22Å; I975-F977 VanDerWaalsContact C-N 3.34Å; I975-F977 PolarHBondContact O-N 3.41Å; F977-F979 VanDerWaalsContact C-N 3.3Å; F977-F979 PolarHBondContact O-N 2.74Å; F977-R980 WeakPolarHBondContact O-CB 3.18Å; F977-R980 PolarHBondContact O-N 3.44Å; F977-N990 HydrophobicContact CD1-CB 4.03Å; F977-N990 HydrophobicContact CE1-CB 3.87Å; F977-N990 HydrophobicContact CZ-CB 4.46Å; F977-N990 WeakPolarHBondContact O-CB 3.2Å; F977-N990 PolarHBondContact O-ND2 2.68Å; F977-F993 HydrophobicContact CD1-CB 4.03Å; F977-F993 AromaticContact CD1-CD1 3.76Å; F977-F993 HydrophobicContact CD1-CD1 3.76Å; F977-F993 HydrophobicContact CD1-CD2 4.25Å; F977-F993 HydrophobicContact CD1-CE1 4.3Å; F977-F993 AromaticContact CD1-CG 3.74Å; F977-F993 HydrophobicContact CD1-CG 3.74Å; F977-F993 HydrophobicContact CE1-CB 4.01Å; F977-F993 HydrophobicContact CE1-CD1 4.33Å; F977-F993 AromaticContact CE1-CD2 4Å; F977-F993 HydrophobicContact CE1-CD2 4Å; F977-F993 AromaticContact CE1-CG 3.84Å; F977-F993 HydrophobicContact CE1-CG 3.84Å
978	A	88.7	Confident	78.3	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-61	-34.3	-179.8	0	0	0	0	0	113.8	G974 I975 N990 V991 L994	G974-A978 PolarHBondContact O-N 3.07Å; G974-A978 VanDerWaalsContact O-N 3.13Å; I975-A978 WeakPolarHBondContact O-CB 3.38Å; I975-A978 PolarHBondContact O-N 2.92Å; A978-N990 WeakPolarHBondContact CA-O 3.26Å; A978-N990 CarbonylContact O-C 3.59Å; A978-V991 VanDerWaalsContact O-CG2 3.24Å; A978-V991 WeakPolarHBondContact O-CG2 3.2Å; A978-L994 HydrophobicContact CB-CD1 4.31Å; A978-L994 HydrophobicContact CB-CD2 3.57Å; A978-L994 HydrophobicContact CB-CG 3.69Å
979	F	87	Confident	77.4	Confident	17 Å²	17	70.4 Å²	70.4	8%	0.075	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.8	23.9	177.5	-58.5	-68.6	0	0	0	113.5	I975 F977 V981 V991 L994 L1016 E1019 C1020 A1024 V1030	I975-F979 HydrophobicContact CG2-CD2 4.16Å; I975-F979 HydrophobicContact CG2-CE2 4.3Å; I975-F979 WeakPolarHBondContact O-CD2 3.4Å; I975-F979 PolarHBondContact O-N 2.88Å; F977-F979 VanDerWaalsContact C-N 3.3Å; F977-F979 PolarHBondContact O-N 2.74Å; F979-V981 PolarHBondContact O-N 3.2Å; F979-V991 HydrophobicContact CD1-CG2 3.93Å; F979-V991 HydrophobicContact CE1-CG2 3.69Å; F979-V991 HydrophobicContact CZ-CG2 4.47Å; F979-L994 HydrophobicContact CE2-CD1 4.13Å; F979-L994 HydrophobicContact CZ-CD1 3.92Å; F979-L1016 HydrophobicContact CE2-CD1 3.8Å; F979-L1016 HydrophobicContact CZ-CD1 4.3Å; F979-E1019 HydrophobicContact CD2-CB 4.22Å; F979-C1020 HydrophobicContact CD2-CB 4.49Å; F979-C1020 HydrophobicContact CE1-CB 3.95Å; F979-C1020 VanDerWaalsContact CE1-SG 3.53Å; F979-C1020 HydrophobicContact CE2-CB 3.89Å; F979-C1020 HydrophobicContact CZ-CB 3.58Å; F979-C1020 WeakPolarHBondContact CZ-SG 3.35Å; F979-A1024 HydrophobicContact CE1-CB 4.17Å; F979-V1030 HydrophobicContact CE1-CG2 4.41Å; F979-V1030 HydrophobicContact CZ-CG2 4.06Å
980	R	83.2	Confident	77	Confident	176 Å²	176	70.6 Å²	70.6	66%	0.664	36%	0.355	S	S	*	.			trans	-71.1	102.5	174.1	-173.3	178.3	-178.4	-178.7	-0.9	110	R976 F977 P982	R976-R980 PolarHBondContact O-N 2.95Å; F977-R980 WeakPolarHBondContact O-CB 3.18Å; F977-R980 PolarHBondContact O-N 3.44Å; R980-P982 WeakPolarHBondContact O-CD 3.31Å
981	V	65	Low	76.7	Confident	112 Å²	112	70.8 Å²	70.8	68%	0.679	36%	0.356	S	S	*	.			trans	-61.2	123.8	-178.4	-177.6	0	0	0	0	111.3	F979	F979-V981 PolarHBondContact O-N 3.2Å
982	P	58.9	Low	76.4	Confident	47 Å²	47	72.4 Å²	72.4	31%	0.305	37%	0.369	S	S	.	.			trans	-64.6	157.3	167.1	-18.8	32.9	0	0	0	111.3	R980 E984 P989	R980-P982 WeakPolarHBondContact O-CD 3.31Å; P982-E984 PolarHBondContact O-N 2.92Å; P982-P989 HydrophobicContact CG-CG 4.34Å
983	Q	52.4	Low	76.3	Confident	207 Å²	207	70.6 Å²	70.6	97%	0.967	36%	0.36	S	S	*	.	S	Bend	trans	-73.1	-16	179.8	-72.8	-173.4	-31.3	0	0	113.7
984	E	46.9	Very low	76.2	Confident	183 Å²	183	68.9 Å²	68.9	86%	0.855	35%	0.351	S	S	*	.	S	Bend	trans	-140.5	130.6	175.5	-59.7	-175.7	157.5	0	0	109.7	P982	P982-E984 PolarHBondContact O-N 2.92Å
985	G	49.8	Very low	76.1	Confident	63 Å²	63	70.5 Å²	70.5	65%	0.649	36%	0.358	S	S	*	.			trans	110.7	147.7	175.3	0	0	0	0	0	116
986	E	53	Low	76.2	Confident	198 Å²	198	70.5 Å²	70.5	93%	0.925	36%	0.358	S	S	*	.	S	Bend	trans	-83.1	-12.8	179.4	-66.3	-167.5	127.5	0	0	114.1
987	E	59.8	Low	76.3	Confident	160 Å²	160	64.5 Å²	64.5	75%	0.748	34%	0.336	S	S	*	.			trans	-84.1	138.9	-178.2	-62	-165.8	155.2	0	0	111.9	P989	E987-P989 WeakPolarHBondContact O-CD 3.41Å
988	C	68.3	Low	76.4	Confident	17 Å²	17	64.2 Å²	64.2	12%	0.115	34%	0.336	C	S	.	.			trans	-104.2	88.9	175	-65.9	0	0	0	0	108.5	N990 V991 W1027	C988-N990 PolarHBondContact O-N 3.49Å; C988-N990 VanDerWaalsContact O-N 3.1Å; C988-V991 HydrophobicContact CB-CG2 3.62Å; C988-V991 WeakPolarHBondContact O-CG2 3.47Å; C988-V991 PolarHBondContact O-N 2.93Å; C988-W1027 HydrophobicContact CB-CH2 4.07Å; C988-W1027 HydrophobicContact CB-CZ3 3.98Å
989	P	74.3	Confident	76.6	Confident	64 Å²	64	65.3 Å²	65.3	42%	0.416	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-61.6	-26.8	-170.3	24.9	-35.7	0	0	0	112.7	L933 P982 E987 V991	L933-P989 HydrophobicContact CD1-CB 4.11Å; P982-P989 HydrophobicContact CG-CG 4.34Å; E987-P989 WeakPolarHBondContact O-CD 3.41Å; P989-V991 VanDerWaalsContact C-N 3.26Å; P989-V991 PolarHBondContact O-N 2.95Å
990	N	85.7	Confident	76.9	Confident	18 Å²	18	64.6 Å²	64.6	10%	0.096	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-75.2	-4.3	-177.5	-62.6	-9.2	0	0	0	115	F929 F977 A978 C988 A992 F993	F929-N990 HydrophobicContact CE1-CB 4.4Å; F977-N990 HydrophobicContact CD1-CB 4.03Å; F977-N990 HydrophobicContact CE1-CB 3.87Å; F977-N990 HydrophobicContact CZ-CB 4.46Å; F977-N990 WeakPolarHBondContact O-CB 3.2Å; F977-N990 PolarHBondContact O-ND2 2.68Å; A978-N990 WeakPolarHBondContact CA-O 3.26Å; A978-N990 CarbonylContact O-C 3.59Å; C988-N990 PolarHBondContact O-N 3.49Å; C988-N990 VanDerWaalsContact O-N 3.1Å; N990-A992 VanDerWaalsContact C-N 3.26Å; N990-A992 PolarHBondContact O-N 3.01Å; N990-F993 WeakPolarHBondContact O-CB 3.2Å; N990-F993 PolarHBondContact O-N 3.5Å
991	V	87.2	Confident	77.3	Confident	4 Å²	4	56.6 Å²	56.6	2%	0.024	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-67.5	-24.7	-172.8	175.2	0	0	0	0	113.3	A978 F979 C988 P989 F993 L994 W1027 S1029 V1030	A978-V991 VanDerWaalsContact O-CG2 3.24Å; A978-V991 WeakPolarHBondContact O-CG2 3.2Å; F979-V991 HydrophobicContact CD1-CG2 3.93Å; F979-V991 HydrophobicContact CE1-CG2 3.69Å; F979-V991 HydrophobicContact CZ-CG2 4.47Å; C988-V991 HydrophobicContact CB-CG2 3.62Å; C988-V991 WeakPolarHBondContact O-CG2 3.47Å; C988-V991 PolarHBondContact O-N 2.93Å; P989-V991 VanDerWaalsContact C-N 3.26Å; P989-V991 PolarHBondContact O-N 2.95Å; V991-F993 PolarHBondContact O-N 3.4Å; V991-L994 HydrophobicContact CG1-CD1 4.2Å; V991-L994 WeakPolarHBondContact O-CB 3.49Å; V991-L994 WeakPolarHBondContact O-CG 3.17Å; V991-L994 PolarHBondContact O-N 3.11Å; V991-W1027 HydrophobicContact CB-CE3 3.82Å; V991-W1027 HydrophobicContact CB-CZ3 3.88Å; V991-W1027 HydrophobicContact CG1-CE3 3.69Å; V991-W1027 HydrophobicContact CG1-CZ3 4.25Å; V991-W1027 HydrophobicContact CG2-CE3 3.98Å; V991-W1027 HydrophobicContact CG2-CZ3 3.67Å; V991-S1029 WeakPolarHBondContact O-CB 3.47Å; V991-V1030 HydrophobicContact CG1-CG2 3.43Å; V991-V1030 VanDerWaalsContact CG1-CG2 3.43Å
992	A	88.2	Confident	78.3	Confident	34 Å²	34	54.7 Å²	54.7	28%	0.281	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-62.1	-24.8	171.6	0	0	0	0	0	113	F929 F942 N990 L994 E995	F929-A992 HydrophobicContact CE2-CB 3.98Å; F929-A992 HydrophobicContact CZ-CB 4Å; F942-A992 HydrophobicContact CE2-CB 4.2Å; F942-A992 HydrophobicContact CZ-CB 4.33Å; N990-A992 VanDerWaalsContact C-N 3.26Å; N990-A992 PolarHBondContact O-N 3.01Å; A992-L994 PolarHBondContact O-N 3.46Å; A992-L994 VanDerWaalsContact O-N 3.07Å; A992-E995 PolarHBondContact O-N 3.37Å
993	F	91.8	Very high	79.7	Confident	1 Å²	1	53.4 Å²	53.4	0%	0.004	28%	0.281	C	S	.	.	H	α-helix	trans	-57.8	-23.4	174.9	-171.1	-101.9	0	0	0	113.2	L925 Q926 F929 F977 N990 V991 E995 I996 L997	L925-F993 HydrophobicContact CB-CE2 3.82Å; L925-F993 HydrophobicContact CB-CZ 3.97Å; Q926-F993 HydrophobicContact CG-CE1 3.98Å; Q926-F993 HydrophobicContact CG-CE2 4.06Å; Q926-F993 HydrophobicContact CG-CZ 3.61Å; F929-F993 HydrophobicContact CB-CD2 3.92Å; F929-F993 HydrophobicContact CB-CE2 4.36Å; F929-F993 HydrophobicContact CD1-CB 4.32Å; F929-F993 HydrophobicContact CD1-CD2 4.23Å; F929-F993 HydrophobicContact CD2-CD2 4.36Å; F929-F993 HydrophobicContact CE1-CB 4.33Å; F929-F993 HydrophobicContact CG-CB 4.47Å; F929-F993 AromaticContact CG-CD2 3.88Å; F929-F993 HydrophobicContact CG-CD2 3.88Å; F929-F993 HydrophobicContact CZ-CB 4.47Å; F977-F993 HydrophobicContact CD1-CB 4.03Å; F977-F993 AromaticContact CD1-CD1 3.76Å; F977-F993 HydrophobicContact CD1-CD1 3.76Å; F977-F993 HydrophobicContact CD1-CD2 4.25Å; F977-F993 HydrophobicContact CD1-CE1 4.3Å; F977-F993 AromaticContact CD1-CG 3.74Å; F977-F993 HydrophobicContact CD1-CG 3.74Å; F977-F993 HydrophobicContact CE1-CB 4.01Å; F977-F993 HydrophobicContact CE1-CD1 4.33Å; F977-F993 AromaticContact CE1-CD2 4Å; F977-F993 HydrophobicContact CE1-CD2 4Å; F977-F993 AromaticContact CE1-CG 3.84Å; F977-F993 HydrophobicContact CE1-CG 3.84Å; N990-F993 WeakPolarHBondContact O-CB 3.2Å; N990-F993 PolarHBondContact O-N 3.5Å; V991-F993 PolarHBondContact O-N 3.4Å; F993-E995 PolarHBondContact O-N 3.34Å; F993-I996 HydrophobicContact CD2-CB 4.39Å; F993-I996 HydrophobicContact CD2-CD1 3.97Å; F993-I996 HydrophobicContact CE2-CB 4.49Å; F993-I996 HydrophobicContact CE2-CD1 4.43Å; F993-I996 HydrophobicContact CE2-CG2 4.24Å; F993-I996 WeakPolarHBondContact O-CB 3.03Å; F993-I996 PolarHBondContact O-N 3.31Å; F993-L997 HydrophobicContact CE1-CD1 4.45Å; F993-L997 WeakPolarHBondContact O-CB 3.3Å; F993-L997 PolarHBondContact O-N 3.27Å
994	L	91.8	Very high	81.4	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.4	-22.2	175.9	-64.3	-179.4	0	0	0	113.3	I975 A978 F979 V991 A992 L997 S998 L1016 V1030 Y1033	I975-L994 HydrophobicContact CG1-CD2 4.33Å; A978-L994 HydrophobicContact CB-CD1 4.31Å; A978-L994 HydrophobicContact CB-CD2 3.57Å; A978-L994 HydrophobicContact CB-CG 3.69Å; F979-L994 HydrophobicContact CE2-CD1 4.13Å; F979-L994 HydrophobicContact CZ-CD1 3.92Å; V991-L994 HydrophobicContact CG1-CD1 4.2Å; V991-L994 WeakPolarHBondContact O-CB 3.49Å; V991-L994 WeakPolarHBondContact O-CG 3.17Å; V991-L994 PolarHBondContact O-N 3.11Å; A992-L994 PolarHBondContact O-N 3.46Å; A992-L994 VanDerWaalsContact O-N 3.07Å; L994-L997 HydrophobicContact CD2-CD2 3.98Å; L994-S998 PolarHBondContact O-N 2.92Å; L994-L1016 HydrophobicContact CD1-CD1 4.33Å; L994-V1030 HydrophobicContact CD1-CB 4.5Å; L994-V1030 HydrophobicContact CD1-CG2 3.9Å; L994-Y1033 HydrophobicContact CB-CD1 4.38Å; L994-Y1033 HydrophobicContact CB-CG 4.13Å; L994-Y1033 HydrophobicContact CD1-CD1 4.44Å; L994-Y1033 HydrophobicContact CD2-CD1 4Å; L994-Y1033 HydrophobicContact CD2-CE1 4.24Å; L994-Y1033 HydrophobicContact CD2-CG 4.47Å; L994-Y1033 WeakPolarHBondContact O-CD2 3.4Å
995	E	91.9	Very high	83.3	Confident	34 Å²	34	37.1 Å²	37.1	16%	0.159	21%	0.207	C	C	.	.	H	α-helix	trans	-77.5	-40.4	175.2	-52.6	-166.3	-163.6	0	0	111.7	F942 A992 F993 L997 S998 S1029 L1032	F942-E995 HydrophobicContact CZ-CB 4.13Å; A992-E995 PolarHBondContact O-N 3.37Å; F993-E995 PolarHBondContact O-N 3.34Å; E995-L997 VanDerWaalsContact C-N 3.28Å; E995-L997 PolarHBondContact O-N 3.35Å; E995-S998 WeakPolarHBondContact O-CB 3.29Å; E995-S998 PolarHBondContact O-N 2.89Å; E995-S998 VanDerWaalsContact O-N 3.14Å; E995-S998 PolarHBondContact O-OG 2.72Å; E995-S1029 WeakPolarHBondContact OE1-CA 3.32Å; E995-S1029 VanDerWaalsContact OE1-CB 3.26Å; E995-S1029 WeakPolarHBondContact OE1-CB 3.45Å; E995-S1029 PolarHBondContact OE1-OG 3.18Å; E995-L1032 HydrophobicContact CB-CD2 4.48Å; E995-L1032 HydrophobicContact CG-CD1 4.26Å; E995-L1032 HydrophobicContact CG-CD2 4.34Å
996	I	93.1	Very high	85	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-59.4	-44.1	168.9	-62.2	162.1	0	0	0	109.3	L925 F929 F942 I945 R946 A949 F993 S998 E999	L925-I996 HydrophobicContact CD1-CG2 4.26Å; L925-I996 HydrophobicContact CD2-CG2 4.41Å; F929-I996 HydrophobicContact CB-CD1 4.38Å; F929-I996 HydrophobicContact CD2-CD1 3.64Å; F929-I996 HydrophobicContact CE2-CD1 4.43Å; F929-I996 HydrophobicContact CG-CD1 4.31Å; F942-I996 HydrophobicContact CD2-CD1 3.99Å; F942-I996 HydrophobicContact CD2-CG1 4.47Å; F942-I996 HydrophobicContact CE2-CD1 3.56Å; F942-I996 HydrophobicContact CE2-CG1 3.85Å; F942-I996 HydrophobicContact CZ-CD1 4.36Å; F942-I996 HydrophobicContact CZ-CG1 4.17Å; I945-I996 HydrophobicContact CB-CD1 4.36Å; I945-I996 HydrophobicContact CG2-CD1 3.66Å; I945-I996 HydrophobicContact CG2-CG1 4.28Å; I945-I996 HydrophobicContact CG2-CG2 4.19Å; R946-I996 HydrophobicContact CB-CG1 4.43Å; A949-I996 HydrophobicContact CB-CG2 3.59Å; F993-I996 HydrophobicContact CD2-CB 4.39Å; F993-I996 HydrophobicContact CD2-CD1 3.97Å; F993-I996 HydrophobicContact CE2-CB 4.49Å; F993-I996 HydrophobicContact CE2-CD1 4.43Å; F993-I996 HydrophobicContact CE2-CG2 4.24Å; F993-I996 WeakPolarHBondContact O-CB 3.03Å; F993-I996 PolarHBondContact O-N 3.31Å; I996-S998 VanDerWaalsContact C-N 3.25Å; I996-S998 PolarHBondContact O-N 2.67Å; I996-E999 WeakPolarHBondContact O-CB 3.27Å; I996-E999 PolarHBondContact O-N 2.79Å
997	L	94.2	Very high	86.6	Confident	2 Å²	2	33.2 Å²	33.2	1%	0.01	18%	0.175	C	C	.	.	H	α-helix	trans	-64.6	-26.8	176.8	-163.9	63.3	0	0	0	113.1	L970 H971 I975 F993 L994 E995 E999 F1000 Y1033	L970-L997 HydrophobicContact CD2-CD1 3.71Å; H971-L997 PolarHBondContact CE1-O 3.19Å; H971-L997 VanDerWaalsContact CE1-O 3.31Å; I975-L997 HydrophobicContact CG1-CD2 4.08Å; F993-L997 HydrophobicContact CE1-CD1 4.45Å; F993-L997 WeakPolarHBondContact O-CB 3.3Å; F993-L997 PolarHBondContact O-N 3.27Å; L994-L997 HydrophobicContact CD2-CD2 3.98Å; E995-L997 VanDerWaalsContact C-N 3.28Å; E995-L997 PolarHBondContact O-N 3.35Å; L997-E999 VanDerWaalsContact C-N 3.26Å; L997-E999 PolarHBondContact O-N 2.86Å; L997-F1000 PolarHBondContact O-N 3.48Å; L997-Y1033 HydrophobicContact CB-CE2 4.25Å; L997-Y1033 HydrophobicContact CD2-CE1 4.32Å; L997-Y1033 HydrophobicContact CD2-CE2 4.01Å; L997-Y1033 HydrophobicContact CG-CE2 3.92Å
998	S	93	Very high	88	Confident	12 Å²	12	25.7 Å²	25.7	8%	0.084	14%	0.14	C	C	.	.	H	α-helix	trans	-64.5	-29.3	178.5	82.6	0	0	0	0	112.9	L994 E995 I996 F1000 S1001 L1032	L994-S998 PolarHBondContact O-N 2.92Å; E995-S998 WeakPolarHBondContact O-CB 3.29Å; E995-S998 PolarHBondContact O-N 2.89Å; E995-S998 VanDerWaalsContact O-N 3.14Å; E995-S998 PolarHBondContact O-OG 2.72Å; I996-S998 VanDerWaalsContact C-N 3.25Å; I996-S998 PolarHBondContact O-N 2.67Å; S998-F1000 PolarHBondContact O-N 2.91Å; S998-F1000 VanDerWaalsContact O-N 3.15Å; S998-S1001 WeakPolarHBondContact O-CB 3.3Å; S998-S1001 PolarHBondContact O-N 2.91Å; S998-S1001 PolarHBondContact O-OG 3.41Å; S998-L1032 WeakPolarHBondContact OG-CD2 3.32Å
999	E	93.8	Very high	88.9	Confident	23 Å²	23	25 Å²	25	11%	0.107	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-15.8	176.7	-61.6	-71.7	158.9	0	0	112.8	R946 A949 R950 A953 I996 L997 F1002	R946-E999 HydrophobicContact CG-CG 3.8Å; R946-E999 IonicContact CZ-OE1 2.75Å; R946-E999 VanDerWaalsContact CZ-OE1 3.28Å; R946-E999 IonicContact NE-OE1 3.43Å; R946-E999 PolarHBondContact NE-OE1 3.44Å; R946-E999 IonicContact NH2-OE1 3.56Å; R946-E999 PolarHBondContact NH2-OE1 2.96Å; A949-E999 HydrophobicContact CB-CB 4.33Å; R950-E999 IonicContact CZ-OE1 3.84Å; R950-E999 IonicContact CZ-OE2 3.57Å; R950-E999 IonicContact NE-OE1 2.93Å; R950-E999 IonicContact NE-OE2 3.04Å; R950-E999 PolarHBondContact NE-OE2 2.81Å; R950-E999 IonicContact NH2-OE1 2.6Å; R950-E999 PolarHBondContact NH2-OE1 3.45Å; R950-E999 IonicContact NH2-OE2 2.67Å; R950-E999 PolarHBondContact NH2-OE2 3.23Å; A953-E999 WeakPolarHBondContact CB-O 3.32Å; I996-E999 WeakPolarHBondContact O-CB 3.27Å; I996-E999 PolarHBondContact O-N 2.79Å; L997-E999 VanDerWaalsContact C-N 3.26Å; L997-E999 PolarHBondContact O-N 2.86Å; E999-F1002 WeakPolarHBondContact O-CD1 3.25Å; E999-F1002 WeakPolarHBondContact O-CE1 3.49Å
1000	F	92.9	Very high	89.5	Confident	1 Å²	1	24.6 Å²	24.6	0%	0.004	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-20.7	172.2	-67.1	-88.9	0	0	0	113.5	V921 L925 A949 L952 A953 F956 L970 H971 L997 S998 F1002 K1003	V921-F1000 HydrophobicContact CG1-CE1 4.07Å; V921-F1000 HydrophobicContact CG1-CZ 3.97Å; L925-F1000 HydrophobicContact CD1-CE2 3.61Å; L925-F1000 HydrophobicContact CD1-CZ 3.74Å; A949-F1000 HydrophobicContact CB-CE2 3.77Å; A949-F1000 HydrophobicContact CB-CZ 4.27Å; A949-F1000 WeakPolarHBondContact O-CZ 3.24Å; L952-F1000 HydrophobicContact CB-CE1 4.42Å; L952-F1000 HydrophobicContact CB-CZ 4.24Å; A953-F1000 HydrophobicContact CB-CD1 3.62Å; A953-F1000 HydrophobicContact CB-CE1 3.81Å; A953-F1000 HydrophobicContact CB-CG 4.18Å; F956-F1000 HydrophobicContact CE2-CD1 4.41Å; F956-F1000 HydrophobicContact CE2-CE1 4.07Å; L970-F1000 HydrophobicContact CD1-CD1 3.84Å; L970-F1000 HydrophobicContact CD1-CE1 3.75Å; L970-F1000 HydrophobicContact CD1-CG 4.37Å; L970-F1000 HydrophobicContact CD1-CZ 4.21Å; L970-F1000 HydrophobicContact CD2-CB 4.04Å; L970-F1000 HydrophobicContact CD2-CD1 4.03Å; L970-F1000 HydrophobicContact CD2-CD2 3.96Å; L970-F1000 HydrophobicContact CD2-CE2 4.44Å; L970-F1000 HydrophobicContact CD2-CG 3.74Å; H971-F1000 WeakPolarHBondContact NE2-CB 3.46Å; L997-F1000 PolarHBondContact O-N 3.48Å; S998-F1000 PolarHBondContact O-N 2.91Å; S998-F1000 VanDerWaalsContact O-N 3.15Å; F1000-F1002 PolarHBondContact O-N 2.95Å; F1000-F1002 VanDerWaalsContact O-N 3.1Å; F1000-K1003 PolarHBondContact O-N 2.72Å
1001	S	90.4	Very high	89.7	Confident	8 Å²	8	28.6 Å²	28.6	6%	0.056	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-64.5	-23	-170.5	68.9	0	0	0	0	113.9	S998 K1003 L1004 S1036	S998-S1001 WeakPolarHBondContact O-CB 3.3Å; S998-S1001 PolarHBondContact O-N 2.91Å; S998-S1001 PolarHBondContact O-OG 3.41Å; S1001-K1003 PolarHBondContact O-N 3.3Å; S1001-K1003 VanDerWaalsContact O-N 3.17Å; S1001-L1004 WeakPolarHBondContact O-CB 3.49Å; S1001-L1004 PolarHBondContact O-N 3.19Å; S1001-S1036 WeakPolarHBondContact CB-OG 3.37Å; S1001-S1036 VanDerWaalsContact OG-CB 3.29Å; S1001-S1036 WeakPolarHBondContact OG-CB 3.34Å; S1001-S1036 PolarHBondContact OG-OG 3.44Å
1002	F	87.1	Confident	89.9	Confident	73 Å²	73	28.4 Å²	28.4	32%	0.32	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-70.3	-6.7	175.1	85.9	-88.5	0	0	0	114.1	A953 M954 E999 F1000 R1040	A953-F1002 HydrophobicContact CB-CE1 3.98Å; A953-F1002 HydrophobicContact CB-CZ 4.45Å; M954-F1002 HydrophobicContact SD-CE2 4.15Å; M954-F1002 HydrophobicContact SD-CZ 3.79Å; E999-F1002 WeakPolarHBondContact O-CD1 3.25Å; E999-F1002 WeakPolarHBondContact O-CE1 3.49Å; F1000-F1002 PolarHBondContact O-N 2.95Å; F1000-F1002 VanDerWaalsContact O-N 3.1Å; F1002-R1040 VanDerWaalsContact C-NH1 3.29Å; F1002-R1040 VanDerWaalsContact CA-CZ 3.48Å; F1002-R1040 PolarHBondContact O-NH1 2.97Å; F1002-R1040 PolarHBondContact O-NH2 3.48Å
1003	K	87.3	Confident	89.8	Confident	19 Å²	19	27.4 Å²	27.4	8%	0.083	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-98.2	-4.3	170.6	-61.4	-67.9	-168.8	176.3	0	113.5	A953 G957 L960 L967 F1000 S1001	A953-K1003 VanDerWaalsContact O-CE 3.28Å; A953-K1003 WeakPolarHBondContact O-CE 3.39Å; G957-K1003 PolarHBondContact O-NZ 3.3Å; L960-K1003 HydrophobicContact CD2-CB 4.25Å; L960-K1003 HydrophobicContact CD2-CD 3.95Å; L960-K1003 WeakPolarHBondContact CD2-O 3.23Å; L967-K1003 HydrophobicContact CD1-CB 3.56Å; L967-K1003 WeakPolarHBondContact CD1-O 3.4Å; L967-K1003 HydrophobicContact CD2-CB 4.09Å; L967-K1003 HydrophobicContact CG-CB 4.49Å; F1000-K1003 PolarHBondContact O-N 2.72Å; S1001-K1003 PolarHBondContact O-N 3.3Å; S1001-K1003 VanDerWaalsContact O-N 3.17Å
1004	L	88.2	Confident	89.6	Confident	3 Å²	3	34.4 Å²	34.4	2%	0.016	18%	0.179	C	C	.	.	S	Bend	trans	-79.6	149.5	177.3	-69.1	172	0	0	0	112.9	L967 V968 S1001 D1008 C1009 L1012 L1037 R1040	L967-L1004 HydrophobicContact CB-CD2 3.96Å; V968-L1004 HydrophobicContact CG2-CD2 4.49Å; S1001-L1004 WeakPolarHBondContact O-CB 3.49Å; S1001-L1004 PolarHBondContact O-N 3.19Å; L1004-D1008 HydrophobicContact CD2-CB 4.14Å; L1004-C1009 VanDerWaalsContact CB-SG 3.55Å; L1004-L1012 HydrophobicContact CD1-CD1 3.55Å; L1004-L1012 HydrophobicContact CD2-CD1 3.89Å; L1004-L1012 HydrophobicContact CG-CD1 4.39Å; L1004-L1037 HydrophobicContact CD1-CD2 3.62Å; L1004-R1040 PolarHBondContact O-NH1 3.01Å
1005	L	86.8	Confident	89.5	Confident	46 Å²	46	36.1 Å²	36.1	24%	0.241	19%	0.186	C	C	.	.			trans	-83.4	150.8	167.7	-63.4	161.3	0	0	0	110.1	L960 R964 Q1007 D1008 C1009	L960-L1005 HydrophobicContact CB-CD2 4.04Å; L960-L1005 HydrophobicContact CB-CG 4.22Å; L960-L1005 HydrophobicContact CD1-CD2 4.47Å; R964-L1005 HydrophobicContact CB-CD1 4.32Å; R964-L1005 HydrophobicContact CG-CD1 4.26Å; L1005-Q1007 VanDerWaalsContact C-N 3.25Å; L1005-Q1007 PolarHBondContact O-N 2.99Å; L1005-Q1007 VanDerWaalsContact O-N 3.12Å; L1005-D1008 WeakPolarHBondContact CB-OD2 3.21Å; L1005-D1008 PolarHBondContact O-N 2.87Å; L1005-C1009 PolarHBondContact O-N 3.09Å
1006	P	85.4	Confident	89.2	Confident	44 Å²	44	34.6 Å²	34.6	29%	0.286	18%	0.179	S	C	.	.	H	α-helix	trans	-56.7	-32.7	-176.5	-27.7	35.5	0	0	0	115.1	C1009 A1010 T1041 Y1044	P1006-C1009 PolarHBondContact O-N 3.47Å; P1006-A1010 PolarHBondContact O-N 3.25Å; P1006-A1010 VanDerWaalsContact O-N 3.16Å; P1006-T1041 HydrophobicContact CB-CG2 4.42Å; P1006-Y1044 HydrophobicContact CG-CD2 3.92Å; P1006-Y1044 HydrophobicContact CG-CE2 4.19Å
1007	Q	86.4	Confident	88.8	Confident	134 Å²	134	40.8 Å²	40.8	63%	0.626	21%	0.206	S	C	*	.	H	α-helix	trans	-62.7	-42.2	175	-66.4	-179.1	-7.2	0	0	112.1	L1005 A1010 Q1011	L1005-Q1007 VanDerWaalsContact C-N 3.25Å; L1005-Q1007 PolarHBondContact O-N 2.99Å; L1005-Q1007 VanDerWaalsContact O-N 3.12Å; Q1007-A1010 PolarHBondContact O-N 3.46Å; Q1007-Q1011 PolarHBondContact O-N 2.99Å
1008	D	89.6	Confident	88.4	Confident	3 Å²	3	44.7 Å²	44.7	2%	0.016	23%	0.234	C	C	.	.	H	α-helix	trans	-75.1	-34.1	-179.7	-57.9	-56.1	0	0	0	111.2	R964 V968 L1004 L1005 A1010 Q1011 L1012	R964-D1008 WeakPolarHBondContact CD-OD2 3.44Å; R964-D1008 WeakPolarHBondContact CG-OD2 3.49Å; R964-D1008 IonicContact CZ-OD1 3.61Å; R964-D1008 IonicContact CZ-OD2 3.76Å; R964-D1008 VanDerWaalsContact NE-CG 3.26Å; R964-D1008 IonicContact NE-OD1 2.76Å; R964-D1008 PolarHBondContact NE-OD1 3.47Å; R964-D1008 IonicContact NE-OD2 3.65Å; R964-D1008 PolarHBondContact NE-OD2 3.34Å; R964-D1008 IonicContact NH2-OD1 2.77Å; R964-D1008 PolarHBondContact NH2-OD1 3.19Å; R964-D1008 IonicContact NH2-OD2 2.59Å; V968-D1008 HydrophobicContact CG2-CB 3.79Å; L1004-D1008 HydrophobicContact CD2-CB 4.14Å; L1005-D1008 WeakPolarHBondContact CB-OD2 3.21Å; L1005-D1008 PolarHBondContact O-N 2.87Å; D1008-A1010 VanDerWaalsContact C-N 3.29Å; D1008-A1010 PolarHBondContact O-N 2.94Å; D1008-Q1011 PolarHBondContact O-N 2.72Å; D1008-L1012 WeakPolarHBondContact O-CB 3.15Å; D1008-L1012 WeakPolarHBondContact O-CG 3.44Å; D1008-L1012 PolarHBondContact O-N 3.07Å
1009	C	87.6	Confident	87.9	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-57.3	-42.2	170.2	-66.1	0	0	0	0	111.9	L1004 L1005 P1006 A1013 L1037 T1041	L1004-C1009 VanDerWaalsContact CB-SG 3.55Å; L1005-C1009 PolarHBondContact O-N 3.09Å; P1006-C1009 PolarHBondContact O-N 3.47Å; C1009-A1013 WeakPolarHBondContact O-CB 3.47Å; C1009-A1013 PolarHBondContact O-N 2.91Å; C1009-L1037 HydrophobicContact CB-CB 4.24Å; C1009-L1037 HydrophobicContact CB-CD2 4.36Å; C1009-T1041 HydrophobicContact CB-CG2 4.26Å
1010	A	86.9	Confident	87.2	Confident	56 Å²	56	47.1 Å²	47.1	46%	0.463	25%	0.245	S	C	.	.	H	α-helix	trans	-65.9	-44.8	177.2	0	0	0	0	0	112.1	P1006 Q1007 D1008 A1013 Q1014	P1006-A1010 PolarHBondContact O-N 3.25Å; P1006-A1010 VanDerWaalsContact O-N 3.16Å; Q1007-A1010 PolarHBondContact O-N 3.46Å; D1008-A1010 VanDerWaalsContact C-N 3.29Å; D1008-A1010 PolarHBondContact O-N 2.94Å; A1010-A1013 PolarHBondContact O-N 2.79Å; A1010-Q1014 PolarHBondContact O-N 3.49Å
1011	Q	90.9	Very high	86.5	Confident	102 Å²	102	50 Å²	50	48%	0.477	26%	0.264	S	S	.	.	H	α-helix	trans	-61.3	-45.7	176.1	-176.6	-180	-5.3	0	0	111.9	Q1007 D1008 Q1014 F1015	Q1007-Q1011 PolarHBondContact O-N 2.99Å; D1008-Q1011 PolarHBondContact O-N 2.72Å; Q1011-Q1014 PolarHBondContact O-N 3.09Å; Q1011-F1015 PolarHBondContact O-N 3.11Å
1012	L	90.6	Very high	85.5	Confident	1 Å²	1	54.8 Å²	54.8	1%	0.005	30%	0.297	C	S	.	.	H	α-helix	trans	-69.6	-32.5	179	-70.8	167.2	0	0	0	112.3	H971 L972 I975 L1004 D1008 Q1014 F1015 L1016 L1037	H971-L1012 HydrophobicContact CB-CD1 3.58Å; H971-L1012 HydrophobicContact CB-CD2 3.74Å; H971-L1012 HydrophobicContact CB-CG 4.3Å; L972-L1012 HydrophobicContact CD2-CD2 3.81Å; L972-L1012 HydrophobicContact CG-CD2 4.02Å; I975-L1012 HydrophobicContact CD1-CD2 4.3Å; L1004-L1012 HydrophobicContact CD1-CD1 3.55Å; L1004-L1012 HydrophobicContact CD2-CD1 3.89Å; L1004-L1012 HydrophobicContact CG-CD1 4.39Å; D1008-L1012 WeakPolarHBondContact O-CB 3.15Å; D1008-L1012 WeakPolarHBondContact O-CG 3.44Å; D1008-L1012 PolarHBondContact O-N 3.07Å; L1012-Q1014 VanDerWaalsContact C-N 3.32Å; L1012-F1015 PolarHBondContact O-N 3.35Å; L1012-L1016 VanDerWaalsContact O-CB 3.25Å; L1012-L1016 WeakPolarHBondContact O-CB 2.99Å; L1012-L1016 PolarHBondContact O-N 3.36Å; L1012-L1037 HydrophobicContact CB-CD1 4.1Å
1013	A	87.1	Confident	84.6	Confident	13 Å²	13	54.4 Å²	54.4	11%	0.107	31%	0.308	C	S	.	.	H	α-helix	trans	-71.2	-24.7	172.7	0	0	0	0	0	113.1	C1009 A1010 K1017 L1037	C1009-A1013 WeakPolarHBondContact O-CB 3.47Å; C1009-A1013 PolarHBondContact O-N 2.91Å; A1010-A1013 PolarHBondContact O-N 2.79Å; A1013-K1017 WeakPolarHBondContact O-CG 3.39Å; A1013-L1037 HydrophobicContact CB-CB 4.45Å; A1013-L1037 HydrophobicContact CB-CD1 4.14Å
1014	Q	87.1	Confident	83.7	Confident	147 Å²	147	53.5 Å²	53.5	69%	0.687	30%	0.304	S	S	*	.	H	α-helix	trans	-75.2	-46	168.7	-174.8	177	0.2	0	0	111.1	A1010 Q1011 L1012 L1016 K1017 S1018	A1010-Q1014 PolarHBondContact O-N 3.49Å; Q1011-Q1014 PolarHBondContact O-N 3.09Å; L1012-Q1014 VanDerWaalsContact C-N 3.32Å; Q1014-L1016 VanDerWaalsContact C-N 3.34Å; Q1014-L1016 PolarHBondContact O-N 2.64Å; Q1014-K1017 WeakPolarHBondContact O-CB 2.9Å; Q1014-K1017 PolarHBondContact O-N 3.15Å; Q1014-S1018 PolarHBondContact O-N 2.83Å
1015	F	88.8	Confident	83	Confident	36 Å²	36	56.9 Å²	56.9	16%	0.158	32%	0.322	C	S	.	.	H	α-helix	trans	-62.3	-39.7	177.2	-175.6	-108.3	0	0	0	112.5	L972 I975 R976 Q1011 L1012 K1017 S1018 E1019	L972-F1015 HydrophobicContact CB-CE1 4.49Å; L972-F1015 HydrophobicContact CD2-CB 4.3Å; L972-F1015 HydrophobicContact CD2-CD1 3.34Å; L972-F1015 HydrophobicContact CD2-CD2 4.15Å; L972-F1015 HydrophobicContact CD2-CE1 3.56Å; L972-F1015 HydrophobicContact CD2-CE2 4.35Å; L972-F1015 HydrophobicContact CD2-CG 3.65Å; L972-F1015 HydrophobicContact CD2-CZ 4.08Å; I975-F1015 HydrophobicContact CB-CD1 4.25Å; I975-F1015 HydrophobicContact CB-CE1 4.05Å; I975-F1015 HydrophobicContact CD1-CD1 3.92Å; I975-F1015 HydrophobicContact CG2-CD1 3.92Å; I975-F1015 HydrophobicContact CG2-CE1 3.8Å; R976-F1015 HydrophobicContact CG-CE1 4.36Å; R976-F1015 HydrophobicContact CG-CZ 4.12Å; Q1011-F1015 PolarHBondContact O-N 3.11Å; L1012-F1015 PolarHBondContact O-N 3.35Å; F1015-K1017 PolarHBondContact O-N 3Å; F1015-S1018 PolarHBondContact O-N 3.34Å; F1015-S1018 PolarHBondContact O-OG 3.44Å; F1015-E1019 HydrophobicContact CD1-CG 4.1Å; F1015-E1019 HydrophobicContact CD2-CG 4.16Å; F1015-E1019 HydrophobicContact CE1-CG 3.65Å; F1015-E1019 HydrophobicContact CE2-CG 3.68Å; F1015-E1019 VanDerWaalsContact CE2-OE1 3.23Å; F1015-E1019 WeakPolarHBondContact CE2-OE1 3.38Å; F1015-E1019 HydrophobicContact CG-CG 4.35Å; F1015-E1019 HydrophobicContact CZ-CG 3.4Å; F1015-E1019 VanDerWaalsContact CZ-CG 3.4Å; F1015-E1019 WeakPolarHBondContact CZ-OE1 3.23Å; F1015-E1019 WeakPolarHBondContact O-CG 3.09Å; F1015-E1019 PolarHBondContact O-N 3.4Å; F1015-E1019 VanDerWaalsContact O-N 3.13Å
1016	L	87	Confident	82.3	Confident	3 Å²	3	57.9 Å²	57.9	2%	0.016	33%	0.333	C	S	.	.	H	α-helix	trans	-56.7	-32.5	172.1	-177.6	64.8	0	0	0	112.3	I975 F979 L994 L1012 Q1014 C1020 Y1033 R1034	I975-L1016 HydrophobicContact CD1-CB 4.44Å; I975-L1016 HydrophobicContact CG1-CD1 4.39Å; I975-L1016 HydrophobicContact CG2-CD1 4.28Å; F979-L1016 HydrophobicContact CE2-CD1 3.8Å; F979-L1016 HydrophobicContact CZ-CD1 4.3Å; L994-L1016 HydrophobicContact CD1-CD1 4.33Å; L1012-L1016 VanDerWaalsContact O-CB 3.25Å; L1012-L1016 WeakPolarHBondContact O-CB 2.99Å; L1012-L1016 PolarHBondContact O-N 3.36Å; Q1014-L1016 VanDerWaalsContact C-N 3.34Å; Q1014-L1016 PolarHBondContact O-N 2.64Å; L1016-C1020 WeakPolarHBondContact O-CB 3.46Å; L1016-C1020 PolarHBondContact O-N 2.9Å; L1016-Y1033 HydrophobicContact CD1-CD1 4.12Å; L1016-Y1033 HydrophobicContact CD1-CE1 4.22Å; L1016-Y1033 HydrophobicContact CD2-CD1 3.76Å; L1016-Y1033 HydrophobicContact CD2-CE1 4.1Å; L1016-R1034 HydrophobicContact CD2-CB 4.07Å
1017	K	84.3	Confident	82.1	Confident	129 Å²	129	59.8 Å²	59.8	56%	0.561	33%	0.334	S	S	*	.	H	α-helix	trans	-81.8	-17.7	177.9	-69.6	171.6	-175.3	178.5	0	114	A1013 Q1014 F1015	A1013-K1017 WeakPolarHBondContact O-CG 3.39Å; Q1014-K1017 WeakPolarHBondContact O-CB 2.9Å; Q1014-K1017 PolarHBondContact O-N 3.15Å; F1015-K1017 PolarHBondContact O-N 3Å
1018	S	85.8	Confident	82	Confident	85 Å²	85	58.2 Å²	58.2	59%	0.594	34%	0.335	S	S	*	.	H	α-helix	trans	-88.4	-31.5	174.8	54.4	0	0	0	0	112.9	Q1014 F1015	Q1014-S1018 PolarHBondContact O-N 2.83Å; F1015-S1018 PolarHBondContact O-N 3.34Å; F1015-S1018 PolarHBondContact O-OG 3.44Å
1019	E	82.3	Confident	81.8	Confident	74 Å²	74	58.8 Å²	58.8	35%	0.346	34%	0.34	S	S	.	.	H	α-helix	trans	-89.7	-24.9	179.9	-51.7	-79.7	121.8	0	0	112.9	I975 F979 F1015 P1021	I975-E1019 HydrophobicContact CG2-CB 4.1Å; I975-E1019 HydrophobicContact CG2-CG 4.11Å; F979-E1019 HydrophobicContact CD2-CB 4.22Å; F1015-E1019 HydrophobicContact CD1-CG 4.1Å; F1015-E1019 HydrophobicContact CD2-CG 4.16Å; F1015-E1019 HydrophobicContact CE1-CG 3.65Å; F1015-E1019 HydrophobicContact CE2-CG 3.68Å; F1015-E1019 VanDerWaalsContact CE2-OE1 3.23Å; F1015-E1019 WeakPolarHBondContact CE2-OE1 3.38Å; F1015-E1019 HydrophobicContact CG-CG 4.35Å; F1015-E1019 HydrophobicContact CZ-CG 3.4Å; F1015-E1019 VanDerWaalsContact CZ-CG 3.4Å; F1015-E1019 WeakPolarHBondContact CZ-OE1 3.23Å; F1015-E1019 WeakPolarHBondContact O-CG 3.09Å; F1015-E1019 PolarHBondContact O-N 3.4Å; F1015-E1019 VanDerWaalsContact O-N 3.13Å; E1019-P1021 WeakPolarHBondContact O-CD 3.33Å
1020	C	79.4	Confident	81.7	Confident	12 Å²	12	58.7 Å²	58.7	8%	0.081	34%	0.339	C	S	.	.	S	Bend	trans	-82.9	123.5	-175.5	-175.3	0	0	0	0	112.4	F979 L1016 L1025	F979-C1020 HydrophobicContact CD2-CB 4.49Å; F979-C1020 HydrophobicContact CE1-CB 3.95Å; F979-C1020 VanDerWaalsContact CE1-SG 3.53Å; F979-C1020 HydrophobicContact CE2-CB 3.89Å; F979-C1020 HydrophobicContact CZ-CB 3.58Å; F979-C1020 WeakPolarHBondContact CZ-SG 3.35Å; L1016-C1020 WeakPolarHBondContact O-CB 3.46Å; L1016-C1020 PolarHBondContact O-N 2.9Å; C1020-L1025 HydrophobicContact CB-CD2 4.2Å
1021	P	78.3	Confident	81.7	Confident	60 Å²	60	60.3 Å²	60.3	39%	0.39	34%	0.336	S	S	.	.			trans	-58.4	146.5	172.1	-24.9	35.1	0	0	0	112.6	E1019 A1023 A1024 L1025	E1019-P1021 WeakPolarHBondContact O-CD 3.33Å; P1021-A1023 PolarHBondContact O-N 3.05Å; P1021-A1023 VanDerWaalsContact O-N 3.13Å; P1021-A1024 HydrophobicContact CB-CB 4.45Å; P1021-A1024 PolarHBondContact O-N 3.12Å; P1021-L1025 PolarHBondContact O-N 2.95Å
1022	S	69.7	Low	81.5	Confident	109 Å²	109	58.2 Å²	58.2	76%	0.762	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-32.7	-174.8	53.1	0	0	0	0	114.1
1023	A	67.6	Low	81.5	Confident	65 Å²	65	58.2 Å²	58.2	54%	0.537	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-40.8	173.6	0	0	0	0	0	112.8	P1021 L1025 S1026	P1021-A1023 PolarHBondContact O-N 3.05Å; P1021-A1023 VanDerWaalsContact O-N 3.13Å; A1023-L1025 VanDerWaalsContact C-N 3.29Å; A1023-L1025 PolarHBondContact O-N 3.03Å; A1023-S1026 WeakPolarHBondContact O-CB 3.39Å; A1023-S1026 PolarHBondContact O-N 3.01Å; A1023-S1026 PolarHBondContact O-OG 3Å
1024	A	69	Low	81.6	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.008	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-72.5	-17.5	-175.2	0	0	0	0	0	113.7	F979 P1021 S1026 W1027 V1030	F979-A1024 HydrophobicContact CE1-CB 4.17Å; P1021-A1024 HydrophobicContact CB-CB 4.45Å; P1021-A1024 PolarHBondContact O-N 3.12Å; A1024-S1026 PolarHBondContact O-N 3.42Å; A1024-W1027 HydrophobicContact CB-CD2 3.98Å; A1024-W1027 HydrophobicContact CB-CE3 4.23Å; A1024-W1027 HydrophobicContact CB-CG 4.46Å; A1024-W1027 HydrophobicContact CB-CH2 4.4Å; A1024-W1027 HydrophobicContact CB-CZ2 4.2Å; A1024-W1027 HydrophobicContact CB-CZ3 4.43Å; A1024-W1027 WeakPolarHBondContact O-CB 3.28Å; A1024-W1027 PolarHBondContact O-N 3.16Å; A1024-V1030 WeakPolarHBondContact O-CG2 3.17Å
1025	L	71.7	Confident	81.6	Confident	74 Å²	74	62.5 Å²	62.5	39%	0.387	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-55.1	-20	169.3	-65.7	173.7	0	0	0	113.3	C1020 P1021 A1023	C1020-L1025 HydrophobicContact CB-CD2 4.2Å; P1021-L1025 PolarHBondContact O-N 2.95Å; A1023-L1025 VanDerWaalsContact C-N 3.29Å; A1023-L1025 PolarHBondContact O-N 3.03Å
1026	S	72.1	Confident	81.6	Confident	67 Å²	67	61.8 Å²	61.8	47%	0.469	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-85.3	-13.9	177.2	72.3	0	0	0	0	114.5	A1023 A1024 K1031	A1023-S1026 WeakPolarHBondContact O-CB 3.39Å; A1023-S1026 PolarHBondContact O-N 3.01Å; A1023-S1026 PolarHBondContact O-OG 3Å; A1024-S1026 PolarHBondContact O-N 3.42Å; S1026-K1031 WeakPolarHBondContact O-CD 3.47Å; S1026-K1031 WeakPolarHBondContact O-CE 3.16Å; S1026-K1031 PolarHBondContact O-NZ 3.38Å
1027	W	83.1	Confident	81.6	Confident	83 Å²	83	61.7 Å²	61.7	31%	0.314	33%	0.334	S	S	.	.	S	Bend	trans	-77.5	152	-168.8	-61.2	-0.7	0	0	0	113.1	C988 V991 A1024 S1029 V1030 K1031	C988-W1027 HydrophobicContact CB-CH2 4.07Å; C988-W1027 HydrophobicContact CB-CZ3 3.98Å; V991-W1027 HydrophobicContact CB-CE3 3.82Å; V991-W1027 HydrophobicContact CB-CZ3 3.88Å; V991-W1027 HydrophobicContact CG1-CE3 3.69Å; V991-W1027 HydrophobicContact CG1-CZ3 4.25Å; V991-W1027 HydrophobicContact CG2-CE3 3.98Å; V991-W1027 HydrophobicContact CG2-CZ3 3.67Å; A1024-W1027 HydrophobicContact CB-CD2 3.98Å; A1024-W1027 HydrophobicContact CB-CE3 4.23Å; A1024-W1027 HydrophobicContact CB-CG 4.46Å; A1024-W1027 HydrophobicContact CB-CH2 4.4Å; A1024-W1027 HydrophobicContact CB-CZ2 4.2Å; A1024-W1027 HydrophobicContact CB-CZ3 4.43Å; A1024-W1027 WeakPolarHBondContact O-CB 3.28Å; A1024-W1027 PolarHBondContact O-N 3.16Å; W1027-S1029 PolarHBondContact O-N 3.31Å; W1027-V1030 HydrophobicContact CB-CG2 4.29Å; W1027-V1030 PolarHBondContact O-N 3.39Å; W1027-K1031 WeakPolarHBondContact O-CG 3.34Å; W1027-K1031 PolarHBondContact O-N 2.76Å
1028	P	84.1	Confident	81.4	Confident	101 Å²	101	58.7 Å²	58.7	66%	0.656	32%	0.322	S	S	*	.	H	α-helix	trans	-58	-49.9	-174.8	-25.8	35.7	0	0	0	113.8	V1030 K1031 L1032	P1028-V1030 PolarHBondContact O-N 3.2Å; P1028-K1031 CarbonylContact O-C 3.59Å; P1028-K1031 WeakPolarHBondContact O-CB 3.2Å; P1028-K1031 PolarHBondContact O-N 3.03Å; P1028-K1031 VanDerWaalsContact O-N 3.14Å; P1028-L1032 WeakPolarHBondContact O-CB 3.41Å; P1028-L1032 PolarHBondContact O-N 3Å
1029	S	84.8	Confident	80.5	Confident	15 Å²	15	57.9 Å²	57.9	11%	0.105	32%	0.316	C	S	.	.	H	α-helix	trans	-63.8	-39.2	-177.2	-45.8	0	0	0	0	112.6	V991 E995 W1027 L1032 Y1033	V991-S1029 WeakPolarHBondContact O-CB 3.47Å; E995-S1029 WeakPolarHBondContact OE1-CA 3.32Å; E995-S1029 VanDerWaalsContact OE1-CB 3.26Å; E995-S1029 WeakPolarHBondContact OE1-CB 3.45Å; E995-S1029 PolarHBondContact OE1-OG 3.18Å; W1027-S1029 PolarHBondContact O-N 3.31Å; S1029-L1032 PolarHBondContact O-N 3.39Å; S1029-Y1033 WeakPolarHBondContact O-CB 3.33Å; S1029-Y1033 PolarHBondContact O-N 3.44Å
1030	V	86.1	Confident	79.5	Confident	0 Å²	0	58.4 Å²	58.4	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-63.9	-43.8	173.4	-176.7	0	0	0	0	110.9	F979 V991 L994 A1024 W1027 P1028 R1034	F979-V1030 HydrophobicContact CE1-CG2 4.41Å; F979-V1030 HydrophobicContact CZ-CG2 4.06Å; V991-V1030 HydrophobicContact CG1-CG2 3.43Å; V991-V1030 VanDerWaalsContact CG1-CG2 3.43Å; L994-V1030 HydrophobicContact CD1-CB 4.5Å; L994-V1030 HydrophobicContact CD1-CG2 3.9Å; A1024-V1030 WeakPolarHBondContact O-CG2 3.17Å; W1027-V1030 HydrophobicContact CB-CG2 4.29Å; W1027-V1030 PolarHBondContact O-N 3.39Å; P1028-V1030 PolarHBondContact O-N 3.2Å; V1030-R1034 WeakPolarHBondContact O-CB 3.22Å; V1030-R1034 PolarHBondContact O-N 2.95Å
1031	K	85.9	Confident	78.3	Confident	89 Å²	89	60.6 Å²	60.6	39%	0.387	33%	0.328	S	S	.	.	H	α-helix	trans	-63.6	-39.6	175.3	-74.7	165.7	170.5	164.5	0	112.2	S1026 W1027 P1028 R1035	S1026-K1031 WeakPolarHBondContact O-CD 3.47Å; S1026-K1031 WeakPolarHBondContact O-CE 3.16Å; S1026-K1031 PolarHBondContact O-NZ 3.38Å; W1027-K1031 WeakPolarHBondContact O-CG 3.34Å; W1027-K1031 PolarHBondContact O-N 2.76Å; P1028-K1031 CarbonylContact O-C 3.59Å; P1028-K1031 WeakPolarHBondContact O-CB 3.2Å; P1028-K1031 PolarHBondContact O-N 3.03Å; P1028-K1031 VanDerWaalsContact O-N 3.14Å; K1031-R1035 WeakPolarHBondContact O-CB 3.37Å; K1031-R1035 WeakPolarHBondContact O-CD 3.33Å; K1031-R1035 WeakPolarHBondContact O-CG 3.41Å; K1031-R1035 PolarHBondContact O-N 3.29Å
1032	L	87.6	Confident	76.8	Confident	59 Å²	59	61.5 Å²	61.5	31%	0.309	34%	0.336	S	S	.	.	H	α-helix	trans	-65.6	-53.9	178.6	-174.2	156.8	0	0	0	111	E995 S998 P1028 S1029 R1034 R1035 S1036	E995-L1032 HydrophobicContact CB-CD2 4.48Å; E995-L1032 HydrophobicContact CG-CD1 4.26Å; E995-L1032 HydrophobicContact CG-CD2 4.34Å; S998-L1032 WeakPolarHBondContact OG-CD2 3.32Å; P1028-L1032 WeakPolarHBondContact O-CB 3.41Å; P1028-L1032 PolarHBondContact O-N 3Å; S1029-L1032 PolarHBondContact O-N 3.39Å; L1032-R1034 PolarHBondContact O-N 3.03Å; L1032-R1035 WeakPolarHBondContact O-CB 3.21Å; L1032-R1035 PolarHBondContact O-N 3.29Å; L1032-S1036 PolarHBondContact O-N 3.46Å
1033	Y	90.8	Very high	75.7	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-62.4	-42	179	-179.6	-116.5	0	0	0	112.1	H971 I975 L994 L997 L1016 S1029 R1035 S1036 L1037	H971-Y1033 AromaticContact ND1-CE2 3.8Å; H971-Y1033 AromaticContact ND1-CZ 3.77Å; H971-Y1033 PolarHBondContact ND1-OH 2.88Å; I975-Y1033 HydrophobicContact CD1-CE1 3.94Å; I975-Y1033 HydrophobicContact CG1-CE1 3.89Å; L994-Y1033 HydrophobicContact CB-CD1 4.38Å; L994-Y1033 HydrophobicContact CB-CG 4.13Å; L994-Y1033 HydrophobicContact CD1-CD1 4.44Å; L994-Y1033 HydrophobicContact CD2-CD1 4Å; L994-Y1033 HydrophobicContact CD2-CE1 4.24Å; L994-Y1033 HydrophobicContact CD2-CG 4.47Å; L994-Y1033 WeakPolarHBondContact O-CD2 3.4Å; L997-Y1033 HydrophobicContact CB-CE2 4.25Å; L997-Y1033 HydrophobicContact CD2-CE1 4.32Å; L997-Y1033 HydrophobicContact CD2-CE2 4.01Å; L997-Y1033 HydrophobicContact CG-CE2 3.92Å; L1016-Y1033 HydrophobicContact CD1-CD1 4.12Å; L1016-Y1033 HydrophobicContact CD1-CE1 4.22Å; L1016-Y1033 HydrophobicContact CD2-CD1 3.76Å; L1016-Y1033 HydrophobicContact CD2-CE1 4.1Å; S1029-Y1033 WeakPolarHBondContact O-CB 3.33Å; S1029-Y1033 PolarHBondContact O-N 3.44Å; Y1033-R1035 PolarHBondContact O-N 3.35Å; Y1033-S1036 PolarHBondContact O-N 3.25Å; Y1033-S1036 VanDerWaalsContact O-N 3.1Å; Y1033-S1036 PolarHBondContact O-OG 2.91Å; Y1033-L1037 HydrophobicContact CE1-CD1 4Å; Y1033-L1037 PolarHBondContact O-N 2.86Å
1034	R	87.9	Confident	74.4	Confident	78 Å²	78	70.7 Å²	70.7	29%	0.294	35%	0.346	S	S	.	.	H	α-helix	trans	-60.1	-42.6	174.7	-177.2	167.6	67.5	82.4	-4.5	112.3	L1016 V1030 L1032 S1036 L1037 E1038	L1016-R1034 HydrophobicContact CD2-CB 4.07Å; V1030-R1034 WeakPolarHBondContact O-CB 3.22Å; V1030-R1034 PolarHBondContact O-N 2.95Å; L1032-R1034 PolarHBondContact O-N 3.03Å; R1034-S1036 VanDerWaalsContact C-N 3.3Å; R1034-S1036 PolarHBondContact O-N 3.38Å; R1034-L1037 PolarHBondContact O-N 3.07Å; R1034-E1038 VanDerWaalsContact CD-OE1 3.29Å; R1034-E1038 WeakPolarHBondContact CD-OE1 3.11Å; R1034-E1038 VanDerWaalsContact CG-CD 3.48Å; R1034-E1038 HydrophobicContact CG-CG 4.19Å; R1034-E1038 WeakPolarHBondContact CG-OE1 3.45Å; R1034-E1038 IonicContact CZ-OE1 2.95Å; R1034-E1038 IonicContact CZ-OE2 3.61Å; R1034-E1038 IonicContact NE-OE1 3.8Å; R1034-E1038 IonicContact NH1-OE1 3.68Å; R1034-E1038 PolarHBondContact NH1-OE1 3.13Å; R1034-E1038 IonicContact NH1-OE2 2.73Å; R1034-E1038 PolarHBondContact NH1-OE2 2.77Å; R1034-E1038 WeakPolarHBondContact O-CB 3.49Å; R1034-E1038 WeakPolarHBondContact O-CG 3.41Å; R1034-E1038 PolarHBondContact O-N 3.16Å
1035	R	87.6	Confident	72.8	Confident	173 Å²	173	79.2 Å²	79.2	65%	0.653	38%	0.383	S	S	*	.	H	α-helix	trans	-62	-34.9	174	-77.9	168.5	173.2	179.9	-2.7	112.5	K1031 L1032 Y1033 L1037 E1038 S1039	K1031-R1035 WeakPolarHBondContact O-CB 3.37Å; K1031-R1035 WeakPolarHBondContact O-CD 3.33Å; K1031-R1035 WeakPolarHBondContact O-CG 3.41Å; K1031-R1035 PolarHBondContact O-N 3.29Å; L1032-R1035 WeakPolarHBondContact O-CB 3.21Å; L1032-R1035 PolarHBondContact O-N 3.29Å; Y1033-R1035 PolarHBondContact O-N 3.35Å; R1035-L1037 VanDerWaalsContact C-N 3.3Å; R1035-L1037 PolarHBondContact O-N 3.49Å; R1035-E1038 PolarHBondContact O-N 3.44Å; R1035-S1039 WeakPolarHBondContact O-CB 3.26Å; R1035-S1039 PolarHBondContact O-N 3.19Å; R1035-S1039 PolarHBondContact O-OG 3.25Å
1036	S	88.6	Confident	70.7	Confident	21 Å²	21	82.8 Å²	82.8	15%	0.147	40%	0.402	C	S	.	.	H	α-helix	trans	-69.2	-28.9	179	92.1	0	0	0	0	112.6	S1001 L1032 Y1033 R1034	S1001-S1036 WeakPolarHBondContact CB-OG 3.37Å; S1001-S1036 VanDerWaalsContact OG-CB 3.29Å; S1001-S1036 WeakPolarHBondContact OG-CB 3.34Å; S1001-S1036 PolarHBondContact OG-OG 3.44Å; L1032-S1036 PolarHBondContact O-N 3.46Å; Y1033-S1036 PolarHBondContact O-N 3.25Å; Y1033-S1036 VanDerWaalsContact O-N 3.1Å; Y1033-S1036 PolarHBondContact O-OG 2.91Å; R1034-S1036 VanDerWaalsContact C-N 3.3Å; R1034-S1036 PolarHBondContact O-N 3.38Å
1037	L	87.4	Confident	69.1	Low	1 Å²	1	85.5 Å²	85.5	1%	0.005	42%	0.418	C	S	.	.	H	α-helix	trans	-77.9	-46.8	170.3	-58	179.2	0	0	0	112.3	L1004 C1009 L1012 A1013 Y1033 R1034 R1035	L1004-L1037 HydrophobicContact CD1-CD2 3.62Å; C1009-L1037 HydrophobicContact CB-CB 4.24Å; C1009-L1037 HydrophobicContact CB-CD2 4.36Å; L1012-L1037 HydrophobicContact CB-CD1 4.1Å; A1013-L1037 HydrophobicContact CB-CB 4.45Å; A1013-L1037 HydrophobicContact CB-CD1 4.14Å; Y1033-L1037 HydrophobicContact CE1-CD1 4Å; Y1033-L1037 PolarHBondContact O-N 2.86Å; R1034-L1037 PolarHBondContact O-N 3.07Å; R1035-L1037 VanDerWaalsContact C-N 3.3Å; R1035-L1037 PolarHBondContact O-N 3.49Å
1038	E	80.6	Confident	66.7	Low	66 Å²	66	89 Å²	89	31%	0.308	44%	0.443	S	S	.	.	H	α-helix	trans	-70.2	-37.1	-175.3	-72.6	172.3	176.3	0	0	113.6	R1034 R1035 R1040 T1041	R1034-E1038 VanDerWaalsContact CD-OE1 3.29Å; R1034-E1038 WeakPolarHBondContact CD-OE1 3.11Å; R1034-E1038 VanDerWaalsContact CG-CD 3.48Å; R1034-E1038 HydrophobicContact CG-CG 4.19Å; R1034-E1038 WeakPolarHBondContact CG-OE1 3.45Å; R1034-E1038 IonicContact CZ-OE1 2.95Å; R1034-E1038 IonicContact CZ-OE2 3.61Å; R1034-E1038 IonicContact NE-OE1 3.8Å; R1034-E1038 IonicContact NH1-OE1 3.68Å; R1034-E1038 PolarHBondContact NH1-OE1 3.13Å; R1034-E1038 IonicContact NH1-OE2 2.73Å; R1034-E1038 PolarHBondContact NH1-OE2 2.77Å; R1034-E1038 WeakPolarHBondContact O-CB 3.49Å; R1034-E1038 WeakPolarHBondContact O-CG 3.41Å; R1034-E1038 PolarHBondContact O-N 3.16Å; R1035-E1038 PolarHBondContact O-N 3.44Å; E1038-R1040 PolarHBondContact O-N 2.82Å; E1038-T1041 PolarHBondContact O-N 2.87Å; E1038-T1041 VanDerWaalsContact O-N 3.11Å; E1038-T1041 PolarHBondContact O-OG1 3.4Å
1039	S	65.2	Low	64.2	Low	67 Å²	67	93 Å²	93	47%	0.469	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-11.7	-178.3	56.2	0	0	0	0	114.9	R1035 S1042	R1035-S1039 WeakPolarHBondContact O-CB 3.26Å; R1035-S1039 PolarHBondContact O-N 3.19Å; R1035-S1039 PolarHBondContact O-OG 3.25Å; S1039-S1042 PolarHBondContact O-OG 3Å
1040	R	62.2	Low	61.7	Low	85 Å²	85	99.7 Å²	99.7	32%	0.321	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-20.2	175.1	-74.5	-170.6	151.9	-150.6	-2	114.5	F1002 L1004 E1038	F1002-R1040 VanDerWaalsContact C-NH1 3.29Å; F1002-R1040 VanDerWaalsContact CA-CZ 3.48Å; F1002-R1040 PolarHBondContact O-NH1 2.97Å; F1002-R1040 PolarHBondContact O-NH2 3.48Å; L1004-R1040 PolarHBondContact O-NH1 3.01Å; E1038-R1040 PolarHBondContact O-N 2.82Å
1041	T	54.3	Low	59.1	Low	59 Å²	59	104.2 Å²	104.2	36%	0.362	51%	0.514	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	-22.1	178.1	58.9	0	0	0	0	112.3	P1006 C1009 E1038	P1006-T1041 HydrophobicContact CB-CG2 4.42Å; C1009-T1041 HydrophobicContact CB-CG2 4.26Å; E1038-T1041 PolarHBondContact O-N 2.87Å; E1038-T1041 VanDerWaalsContact O-N 3.11Å; E1038-T1041 PolarHBondContact O-OG1 3.4Å
1042	S	47.2	Very low	56.5	Low	79 Å²	79	108.5 Å²	108.5	55%	0.552	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-72.5	-31.6	175.3	59.7	0	0	0	0	114.1	S1039 Y1044 K1045	S1039-S1042 PolarHBondContact O-OG 3Å; S1042-Y1044 PolarHBondContact O-N 2.9Å; S1042-Y1044 VanDerWaalsContact O-N 3.15Å; S1042-K1045 PolarHBondContact O-N 3.01Å
1043	K	46.9	Very low	53.6	Low	178 Å²	178	110.2 Å²	110.2	77%	0.774	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-72.6	0.7	-179.5	-69.6	-161.3	175.2	-166.8	0	115.2
1044	Y	40.2	Very low	50.6	Low	189 Å²	189	117.8 Å²	117.8	74%	0.741	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-127.9	26.1	178.9	-77.3	-77.9	0	0	0	112.7	P1006 S1042	P1006-Y1044 HydrophobicContact CG-CD2 3.92Å; P1006-Y1044 HydrophobicContact CG-CE2 4.19Å; S1042-Y1044 PolarHBondContact O-N 2.9Å; S1042-Y1044 VanDerWaalsContact O-N 3.15Å
1045	K	34.3	Very low	47.7	Very low	180 Å²	180	119.5 Å²	119.5	78%	0.783	62%	0.62	S	S	*	*			trans	-91.4	114.9	158.3	-78.5	-164.2	167.4	-160.1	0	108.8	S1042	S1042-K1045 PolarHBondContact O-N 3.01Å
1046	D	27.9	Very low	45	Very low	148 Å²	148	116.7 Å²	116.7	79%	0.791	63%	0.627	S	S	*	*			trans	-60.6	140	160.6	-75.8	-55.2	0	0	0	109.3	D1048	D1046-D1048 VanDerWaalsContact C-N 3.31Å; D1046-D1048 PolarHBondContact O-N 3.09Å; D1046-D1048 VanDerWaalsContact O-N 3.14Å
1047	P	39.3	Very low	42.1	Very low	125 Å²	125	122.8 Å²	122.8	81%	0.812	66%	0.657	S	S	*	*	S	Bend	trans	-89.3	59.3	-174.5	37.1	-37	0	0	0	112.1
1048	D	32.1	Very low	39.1	Very low	155 Å²	155	130.5 Å²	130.5	83%	0.829	69%	0.693	S	S	*	*			trans	-143	156.1	172	-107.3	-43.1	0	0	0	112.1	D1046	D1046-D1048 VanDerWaalsContact C-N 3.31Å; D1046-D1048 PolarHBondContact O-N 3.09Å; D1046-D1048 VanDerWaalsContact O-N 3.14Å
1049	E	31.9	Very low	36.7	Very low	186 Å²	186	132.7 Å²	132.7	87%	0.869	71%	0.71	S	S	*	*	S	Bend	trans	60.3	119.6	-170.2	-67.2	-168.7	-176.6	0	0	117.5
1050	E	31.5	Very low	35.1	Very low	156 Å²	156	135.5 Å²	135.5	73%	0.729	73%	0.727	S	S	*	*			cis	-150.8	157	-25	-142.4	-163.3	158.7	0	0	109.8	K1052	E1050-K1052 IonicContact OE1-NZ 3.84Å; E1050-K1052 PolarHBondContact OE1-NZ 3.37Å
1051	S	30.7	Very low	33.4	Very low	95 Å²	95	136.7 Å²	136.7	66%	0.664	74%	0.743	S	S	*	*			trans	-116.5	142.8	169.1	58.8	0	0	0	0	110.2
1052	K	32.2	Very low	32	Very low	179 Å²	179	139 Å²	139	78%	0.778	76%	0.758	S	S	*	*			trans	-178.1	108.1	146.4	-95.3	138.6	-144.2	156.9	0	113.4	E1050	E1050-K1052 IonicContact OE1-NZ 3.84Å; E1050-K1052 PolarHBondContact OE1-NZ 3.37Å
1053	A	26.4	Very low	31.1	Very low	94 Å²	94	143.8 Å²	143.8	78%	0.777	77%	0.768	S	S	*	*				-145.7	143.8	111.2	0	0	0	0	0	105.8
1054	D	28.6	Very low	30.1	Very low	160 Å²	160	146 Å²	146	86%	0.856	77%	0.772	S	S	*	*			cis	-148.1	170.8	2.8	-134.8	-33.5	0	0	0	110
1055	S	27.1	Very low	29.5	Very low	113 Å²	113	145.9 Å²	145.9	79%	0.79	78%	0.775	S	S	*	*			trans	-148.6	109.9	174.8	61.3	0	0	0	0	117.2
1056	S	30.3	Very low	29.1	Very low	115 Å²	115	148.5 Å²	148.5	80%	0.804	78%	0.78	S	S	*	*			trans	-160.3	136.1	156.6	61.2	0	0	0	0	107.3
1057	L	27.5	Very low	29	Very low	148 Å²	148	149.1 Å²	149.1	78%	0.775	78%	0.782	S	S	*	*	S	Bend	cis	-106.8	158.1	12.5	-58.2	153.1	0	0	0	110.3
1058	H	25.4	Very low	28.3	Very low	164 Å²	164	149.3 Å²	149.3	76%	0.759	78%	0.781	S	S	*	*			cis	-143.8	163.3	3	-110.7	-55.7	0	0	0	111
1059	T	30.3	Very low	27.9	Very low	111 Å²	111	146.1 Å²	146.1	68%	0.681	78%	0.776	S	S	*	*			trans	-61.3	163.5	174.4	36.4	0	0	0	0	115.3	V1061	T1059-V1061 HydrophobicContact CG2-CG2 4.03Å
1060	P	31.5	Very low	27.5	Very low	126 Å²	126	146.6 Å²	146.6	82%	0.818	78%	0.778	S	S	*	*			cis	-126.3	143.5	31.6	18.6	6.5	0	0	0	116.6
1061	V	26.2	Very low	27	Very low	110 Å²	110	142.1 Å²	142.1	67%	0.667	77%	0.774	S	S	*	*				83.1	86.3	70.8	177.7	0	0	0	0	115.7	T1059	T1059-V1061 HydrophobicContact CG2-CG2 4.03Å
1062	T	25.1	Very low	26.6	Very low	108 Å²	108	143.2 Å²	143.2	66%	0.663	78%	0.782	S	S	*	*			trans	90.6	137.8	137.6	65.7	0	0	0	0	125.2
1063	K	28.2	Very low	26.3	Very low	179 Å²	179	139.2 Å²	139.2	78%	0.778	78%	0.782	S	S	*	*			trans	87.2	100.6	137.7	-76.8	153.1	-168.2	165.8	0	122.2
1064	R	25.5	Very low	26.2	Very low	226 Å²	226	139.6 Å²	139.6	85%	0.853	78%	0.779	S	S	*	*				75.5	135.9	109.1	-129.1	-176.9	-168.9	174.7	4.4	120.6
1065	K	26.7	Very low	26	Very low	186 Å²	186	137 Å²	137	81%	0.809	77%	0.774	S	S	*	*			trans	75.1	113.6	159.7	-72.1	-174.6	173.2	-177.3	0	119.5
1066	R	27.3	Very low	25.9	Very low	235 Å²	235	137.7 Å²	137.7	89%	0.887	77%	0.773	S	S	*	*				24.3	114.7	114.5	-178.7	-156.6	-108.8	-172.2	-2	116.7
1067	I	24.5	Very low	25.5	Very low	161 Å²	161	136.1 Å²	136.1	83%	0.826	77%	0.767	S	S	*	*				-168.6	161.2	127.9	-102.3	157	0	0	0	110.3
1068	T	26.2	Very low	25.2	Very low	128 Å²	128	141 Å²	141	79%	0.785	78%	0.775	S	S	*	*			trans	-72.6	148.7	175.7	49.2	0	0	0	0	113.4
1069	A	23.6	Very low	25	Very low	88 Å²	88	136.8 Å²	136.8	73%	0.727	78%	0.776	S	S	*	*				178.6	155.1	125.4	0	0	0	0	0	114.6
1070	Q	22.7	Very low	24.6	Very low	196 Å²	196	137.2 Å²	137.2	92%	0.916	78%	0.784	S	S	*	*			trans	-15.9	147.1	158.4	-61	158	-61.9	0	0	120.1
1071	G	22.1	Very low	24.2	Very low	62 Å²	62	137.9 Å²	137.9	64%	0.639	78%	0.78	S	S	*	*				122.5	129.7	111	0	0	0	0	0	118.3
1072	S	22.1	Very low	24.2	Very low	118 Å²	118	138.8 Å²	138.8	83%	0.825	78%	0.78	S	S	*	*			trans	58.8	132.4	164.5	45	0	0	0	0	117.2
1073	A	24.2	Very low	24	Very low	95 Å²	95	141.8 Å²	141.8	79%	0.785	79%	0.786	S	S	*	*				65	136.8	52.5	0	0	0	0	0	112.2
1074	S	24.3	Very low	23.9	Very low	103 Å²	103	138 Å²	138	72%	0.72	78%	0.782	S	S	*	*			cis	-153.7	175.3	10.4	62	0	0	0	0	112.9
1075	S	26.2	Very low	23.7	Very low	106 Å²	106	132.3 Å²	132.3	74%	0.741	78%	0.777	S	S	*	*			trans	71.6	156.1	161.2	82.6	0	0	0	0	117.1
1076	T	23.6	Very low	23.6	Very low	127 Å²	127	129 Å²	129	78%	0.779	78%	0.777	S	S	*	*			cis	-149.1	161.5	5	-27.7	0	0	0	0	112.8
1077	A	22.9	Very low	23.5	Very low	82 Å²	82	123.1 Å²	123.1	68%	0.678	76%	0.762	S	S	*	*			trans	82.4	115.1	143.3	0	0	0	0	0	122.7
1078	R	21.3	Very low	23.5	Very low	251 Å²	251	122.7 Å²	122.7	95%	0.947	76%	0.757	S	S	*	*			trans	49.7	102	133.1	-68.2	178.9	166.1	166.1	-5.1	120.1
1079	G	21.6	Very low	23.4	Very low	75 Å²	75	121.7 Å²	121.7	77%	0.773	76%	0.755	S	S	*	*				116.3	135.1	86.9	0	0	0	0	0	119.6
1080	S	21	Very low	23.3	Very low	120 Å²	120	121.1 Å²	121.1	84%	0.839	74%	0.737	S	S	*	*			trans	73.3	136.2	154.9	-149	0	0	0	0	118.2
1081	L	24	Very low	23.5	Very low	140 Å²	140	119.7 Å²	119.7	73%	0.733	74%	0.735	S	S	*	*			cis	-166.9	161	-26.9	-157.5	71.1	0	0	0	108.1
1082	L	24.5	Very low	23.6	Very low	128 Å²	128	124 Å²	124	67%	0.67	74%	0.738	S	S	*	*			trans	68.4	123.3	167.8	-53.4	-175.8	0	0	0	115.9
1083	E	22.4	Very low	23.7	Very low	172 Å²	172	124.3 Å²	124.3	80%	0.804	74%	0.735	S	S	*	*				68.8	144.2	61.3	-70.2	-168.1	174.2	0	0	114.1
1084	S	24.4	Very low	23.7	Very low	99 Å²	99	124.9 Å²	124.9	69%	0.692	73%	0.731	S	S	*	*			cis	-161.5	170.4	-19.9	59.7	0	0	0	0	106
1085	S	22.9	Very low	23.7	Very low	107 Å²	107	124.6 Å²	124.6	75%	0.748	74%	0.735	S	S	*	*			cis	-177.6	164.4	41.9	45.9	0	0	0	0	109
1086	S	23.5	Very low	23.7	Very low	115 Å²	115	127.3 Å²	127.3	80%	0.804	74%	0.74	S	S	*	*			trans	-140.5	119.2	171.2	60.7	0	0	0	0	111.2
1087	I	25.5	Very low	23.9	Very low	112 Å²	112	126.4 Å²	126.4	57%	0.574	74%	0.735	S	S	*	*			trans	-78.8	122.6	-175.3	-61.9	172.4	0	0	0	110.2	R1140	I1087-R1140 HydrophobicContact CD1-CB 4.1Å
1088	Q	24	Very low	24	Very low	153 Å²	153	126.6 Å²	126.6	72%	0.715	73%	0.731	S	S	*	*			trans	-77.3	133.1	164.8	-70.8	173.3	-35.3	0	0	109.3
1089	S	23.9	Very low	24.3	Very low	106 Å²	106	120 Å²	120	74%	0.741	72%	0.719	S	S	*	*			trans	-108.9	122	173.5	52.7	0	0	0	0	111	N1138	S1089-N1138 WeakPolarHBondContact CA-O 3.37Å
1090	H	23.3	Very low	24.5	Very low	76 Å²	76	121.8 Å²	121.8	35%	0.352	71%	0.714	S	S	.	*	B	Isolated β-bridge	trans	-128.4	130	162.4	-48.6	-113.2	0	0	0	108.4	G1136 S1137 N1138	H1090-G1136 PolarHBondContact CD2-O 3.01Å; H1090-S1137 VanDerWaalsContact CB-N 3.33Å; H1090-N1138 PolarHBondContact N-O 3.4Å; H1090-N1138 PolarHBondContact O-N 3.25Å
1091	L	26.1	Very low	24.7	Very low	167 Å²	167	122 Å²	122	87%	0.874	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-80.2	145.1	175.5	-67.2	166	0	0	0	110.4
1092	H	23.9	Very low	24.6	Very low	151 Å²	151	124.2 Å²	124.2	70%	0.699	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-69.2	147.3	170.2	-88.8	-108.7	0	0	0	110.9	S1137	H1092-S1137 PolarHBondContact CD2-OG 3.41Å; H1092-S1137 WeakPolarHBondContact NE2-CB 3.43Å; H1092-S1137 PolarHBondContact NE2-OG 3.44Å
1093	T	23.9	Very low	24.5	Very low	125 Å²	125	125.4 Å²	125.4	77%	0.767	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-103.5	124.2	165.6	-49.2	0	0	0	0	107.4
1094	P	23.7	Very low	24.4	Very low	107 Å²	107	128.5 Å²	128.5	70%	0.695	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-68.4	136.1	169.5	29.3	-32.8	0	0	0	109.2
1095	A	26.1	Very low	24.4	Very low	97 Å²	97	129.8 Å²	129.8	80%	0.802	72%	0.721	S	S	*	*			trans	-107.5	103.7	174.9	0	0	0	0	0	108.6
1096	L	25.1	Very low	24.4	Very low	163 Å²	163	134.5 Å²	134.5	85%	0.853	73%	0.728	S	S	*	*			trans	-135	165.2	174	-80.5	-179	0	0	0	112.4
1097	T	27.2	Very low	24.4	Very low	109 Å²	109	140.3 Å²	140.3	67%	0.669	73%	0.732	S	S	*	*			trans	-68.9	137.1	-164	33.8	0	0	0	0	114.1
1098	S	25.5	Very low	24.3	Very low	85 Å²	85	139.6 Å²	139.6	59%	0.594	74%	0.743	S	S	*	*			trans	-150.1	118	163.4	-174	0	0	0	0	110.4	V1100	S1098-V1100 PolarHBondContact O-N 3.19Å
1099	T	27.6	Very low	24.3	Very low	114 Å²	114	138.6 Å²	138.6	70%	0.699	75%	0.748	S	S	*	*			trans	-79.9	45.5	-175.2	34.1	0	0	0	0	113.3	A547 L1101	A547-T1099 HydrophobicContact CB-CG2 3.63Å; T1099-L1101 PolarHBondContact O-N 2.89Å
1100	V	25.3	Very low	24.4	Very low	111 Å²	111	138.5 Å²	138.5	67%	0.673	75%	0.753	S	S	*	*			trans	-92.5	96.9	177.1	-178.7	0	0	0	0	111	S1098 K1102	S1098-V1100 PolarHBondContact O-N 3.19Å; V1100-K1102 PolarHBondContact O-N 3.39Å
1101	L	25.3	Very low	24.5	Very low	126 Å²	126	144.6 Å²	144.6	66%	0.66	78%	0.779	S	S	*	*			trans	-61.2	94.7	171.9	-77.2	166.1	0	0	0	111.1	T1099 H1103	T1099-L1101 PolarHBondContact O-N 2.89Å; L1101-H1103 PolarHBondContact O-CD2 3.21Å; L1101-H1103 PolarHBondContact O-N 2.84Å
1102	K	23.1	Very low	24.5	Very low	185 Å²	185	146.3 Å²	146.3	80%	0.804	78%	0.779	S	S	*	*			trans	-58.1	115.5	168.4	-80.3	177.5	177.4	168.3	0	110	K553 V1100	K553-K1102 PolarHBondContact NZ-O 3.29Å; V1100-K1102 PolarHBondContact O-N 3.39Å
1103	H	21.6	Very low	24.7	Very low	154 Å²	154	144.9 Å²	144.9	71%	0.713	78%	0.783	S	S	*	*			trans	-95.9	117.1	164.5	-84.4	-115.3	0	0	0	108.6	K553 L1101	K553-H1103 PolarHBondContact NZ-NE2 3.04Å; L1101-H1103 PolarHBondContact O-CD2 3.21Å; L1101-H1103 PolarHBondContact O-N 2.84Å
1104	R	21	Very low	24.7	Very low	237 Å²	237	145.6 Å²	145.6	89%	0.894	79%	0.788	S	S	*	*			trans	-71.9	134.2	160.5	-90.1	-174.3	171.1	-179.8	-1.7	107.7	K1106	R1104-K1106 PolarHBondContact O-N 3.23Å
1105	P	23.7	Very low	24.8	Very low	125 Å²	125	145.5 Å²	145.5	81%	0.812	80%	0.796	S	S	*	*			trans	-67.6	115.7	178	26.9	-33.4	0	0	0	110.4	R1107	P1105-R1107 PolarHBondContact O-N 3.1Å
1106	K	23	Very low	24.8	Very low	206 Å²	206	147.2 Å²	147.2	90%	0.896	80%	0.797	S	S	*	*			trans	-70.1	110.6	163.2	-78.2	-176.7	176.1	178.2	0	107.8	R1104 A1108	R1104-K1106 PolarHBondContact O-N 3.23Å; K1106-A1108 PolarHBondContact O-N 3.41Å; K1106-A1108 VanDerWaalsContact O-N 3.11Å
1107	R	23.1	Very low	24.8	Very low	237 Å²	237	145.5 Å²	145.5	89%	0.894	79%	0.793	S	S	*	*			trans	-73	101.3	176.5	-166	178.1	-169.5	-179.7	2.8	109.1	P1105 T1109	P1105-R1107 PolarHBondContact O-N 3.1Å; R1107-T1109 PolarHBondContact O-N 2.87Å
1108	A	23.9	Very low	24.7	Very low	97 Å²	97	145.2 Å²	145.2	80%	0.802	80%	0.795	S	S	*	*			trans	-65.3	120.9	-179.8	0	0	0	0	0	111.1	K1106 A1110	K1106-A1108 PolarHBondContact O-N 3.41Å; K1106-A1108 VanDerWaalsContact O-N 3.11Å; A1108-A1110 PolarHBondContact O-N 2.7Å
1109	T	23.7	Very low	24.7	Very low	132 Å²	132	148.7 Å²	148.7	81%	0.81	81%	0.807	S	S	*	*			trans	-86	96.2	176.6	50.9	0	0	0	0	110.2	R1107 K1111	R1107-T1109 PolarHBondContact O-N 2.87Å; T1109-K1111 PolarHBondContact O-N 2.76Å
1110	A	26	Very low	24.6	Very low	104 Å²	104	148.4 Å²	148.4	86%	0.86	81%	0.81	S	S	*	*			trans	-66.9	119.5	174.4	0	0	0	0	0	111	A1108	A1108-A1110 PolarHBondContact O-N 2.7Å
1111	K	25	Very low	24.6	Very low	205 Å²	205	146.4 Å²	146.4	89%	0.891	81%	0.811	S	S	*	*			trans	-79.6	126.4	168.8	-68.1	177.9	177.5	177.4	0	109.6	T1109	T1109-K1111 PolarHBondContact O-N 2.76Å
1112	K	26.7	Very low	24.6	Very low	202 Å²	202	146.1 Å²	146.1	88%	0.878	82%	0.82	S	S	*	*			trans	-140.7	160.4	155.6	-95.3	-166.9	178.8	179.2	0	110
1113	P	28.1	Very low	24.7	Very low	121 Å²	121	143.2 Å²	143.2	79%	0.786	82%	0.818	S	S	*	*			trans	-89	174.2	-144.8	34.1	-38.1	0	0	0	116.2
1114	T	24.2	Very low	24.9	Very low	141 Å²	141	142.9 Å²	142.9	87%	0.865	82%	0.82	S	S	*	*			trans	-62.4	137.1	-177.2	47.8	0	0	0	0	115.4
1115	A	25.8	Very low	25.2	Very low	105 Å²	105	137.5 Å²	137.5	87%	0.868	81%	0.814	S	S	*	*			trans	-139.9	157.6	149.7	0	0	0	0	0	109.1
1116	T	25.6	Very low	25.2	Very low	133 Å²	133	140 Å²	140	82%	0.816	82%	0.815	S	S	*	*			trans	-98.7	167.5	-158.1	42.5	0	0	0	0	116
1117	V	24.9	Very low	25.3	Very low	127 Å²	127	137.4 Å²	137.4	77%	0.77	81%	0.81	S	S	*	*			trans	110.4	130.2	150.3	-170.9	0	0	0	0	118.7
1118	S	26.5	Very low	25.2	Very low	103 Å²	103	134.1 Å²	134.1	72%	0.72	81%	0.805	S	S	*	*			trans	58.1	100.9	157.1	67.9	0	0	0	0	123.7
1119	D	24.2	Very low	25.2	Very low	157 Å²	157	134.8 Å²	134.8	84%	0.84	80%	0.804	S	S	*	*				77.2	155.7	104.6	-153.4	20.2	0	0	0	122.9
1120	S	26.6	Very low	25.2	Very low	109 Å²	109	137.1 Å²	137.1	76%	0.762	81%	0.805	S	S	*	*			trans	77.8	84.6	165.4	67.8	0	0	0	0	121.1
1121	G	24.4	Very low	25.1	Very low	68 Å²	68	138.8 Å²	138.8	70%	0.701	80%	0.8	S	S	*	*				86.4	114.9	106.7	0	0	0	0	0	122.8
1122	S	25.7	Very low	25.1	Very low	120 Å²	120	135.9 Å²	135.9	84%	0.839	79%	0.789	S	S	*	*			trans	72.1	156.2	150	84.9	0	0	0	0	118
1123	V	24.9	Very low	24.8	Very low	125 Å²	125	134.6 Å²	134.6	76%	0.758	78%	0.784	S	S	*	*			cis	-158.2	167.5	-15.6	119.2	0	0	0	0	109.4
1124	L	26.3	Very low	24.6	Very low	146 Å²	146	133.4 Å²	133.4	76%	0.764	78%	0.779	S	S	*	*			trans	-14.1	154.4	165.8	-53	166.2	0	0	0	118.3
1125	T	26.3	Very low	24.5	Very low	125 Å²	125	133 Å²	133	77%	0.767	78%	0.78	S	S	*	*			cis	-163	176.3	39	-29.3	0	0	0	0	112.3
1126	E	24.3	Very low	24.3	Very low	176 Å²	176	130 Å²	130	82%	0.822	76%	0.759	S	S	*	*			trans	-94.1	-160.1	-175.3	-58.9	163.4	114.2	0	0	114.8
1127	L	24.6	Very low	24.3	Very low	152 Å²	152	125.4 Å²	125.4	80%	0.796	73%	0.732	S	S	*	*			trans	94.8	126.9	174.8	-54	170.1	0	0	0	115.4
1128	E	22.1	Very low	24.3	Very low	169 Å²	169	124.2 Å²	124.2	79%	0.79	72%	0.722	S	S	*	*			cis	120.9	167.4	11.9	-81.4	-164.2	147.3	0	0	112.2
1129	S	24	Very low	24.3	Very low	111 Å²	111	126.8 Å²	126.8	78%	0.776	73%	0.725	S	S	*	*			trans	70.4	131.5	-168.5	64.5	0	0	0	0	115.9
1130	E	22.4	Very low	24.4	Very low	181 Å²	181	128.2 Å²	128.2	85%	0.846	72%	0.718	S	S	*	*			cis	83.3	149.5	37.9	-68.7	-174.6	179.8	0	0	114.8
1131	D	23.8	Very low	24.3	Very low	139 Å²	139	131.3 Å²	131.3	74%	0.743	72%	0.718	S	S	*	*			cis	-162	175.2	-44	-137.9	-33.7	0	0	0	111.3
1132	E	24.8	Very low	24	Very low	143 Å²	143	134.2 Å²	134.2	67%	0.668	72%	0.722	S	S	*	*			trans	60.1	150.5	146.1	-76.4	-166.7	151.1	0	0	127.7
1133	F	21.6	Very low	23.9	Very low	176 Å²	176	137.4 Å²	137.4	77%	0.772	72%	0.721	S	S	*	*			trans	80.4	169.8	143.8	-81.6	-52.9	0	0	0	127
1134	S	24.1	Very low	24.4	Very low	96 Å²	96	137.2 Å²	137.2	67%	0.671	72%	0.722	S	S	*	*			trans	-163	155.6	-147.7	60.2	0	0	0	0	115.7
1135	C	21.3	Very low	24.3	Very low	131 Å²	131	135.4 Å²	135.4	89%	0.885	73%	0.728	S	S	*	*			trans	-177.5	170.2	157.1	-110.3	0	0	0	0	112
1136	G	21.9	Very low	24.2	Very low	42 Å²	42	139.1 Å²	139.1	43%	0.433	73%	0.733	S	S	.	*			cis	158	103.3	-6.7	0	0	0	0	0	114.8	H1090	H1090-G1136 PolarHBondContact CD2-O 3.01Å
1137	S	25.5	Very low	24.2	Very low	37 Å²	37	142.5 Å²	142.5	26%	0.259	74%	0.738	S	S	.	*			trans	32.7	128.2	166.6	-165.4	0	0	0	0	124.7	H1090 H1092	H1090-S1137 VanDerWaalsContact CB-N 3.33Å; H1092-S1137 PolarHBondContact CD2-OG 3.41Å; H1092-S1137 WeakPolarHBondContact NE2-CB 3.43Å; H1092-S1137 PolarHBondContact NE2-OG 3.44Å
1138	N	25.8	Very low	24.2	Very low	103 Å²	103	138.8 Å²	138.8	55%	0.551	74%	0.737	S	S	*	*	B	Isolated β-bridge		163.3	176.6	123.5	-91.8	-73.7	0	0	0	117.2	S1089 H1090	S1089-N1138 WeakPolarHBondContact CA-O 3.37Å; H1090-N1138 PolarHBondContact N-O 3.4Å; H1090-N1138 PolarHBondContact O-N 3.25Å
1139	M	25.8	Very low	24.3	Very low	157 Å²	157	140.5 Å²	140.5	77%	0.773	74%	0.742	S	S	*	*			trans	-143.7	176.9	-168.5	-50.2	177.8	75.2	0	0	114.6
1140	R	25.8	Very low	24.2	Very low	187 Å²	187	140 Å²	140	71%	0.706	75%	0.745	S	S	*	*			trans	176.8	138.5	137.6	-103.3	174.4	175.8	-169.1	0.3	119.1	I1087	I1087-R1140 HydrophobicContact CD1-CB 4.1Å
1141	K	24	Very low	24.3	Very low	173 Å²	173	136.9 Å²	136.9	75%	0.752	74%	0.743	S	S	*	*			trans	62.5	161	144.6	-66.9	-179.1	176.8	-174	0	118.9
1142	V	20	Very low	24.4	Very low	129 Å²	129	135 Å²	135	78%	0.782	74%	0.741	S	S	*	*			cis	-150	146.9	35.4	172.2	0	0	0	0	115
1143	K	23.4	Very low	24.4	Very low	188 Å²	188	135 Å²	135	82%	0.817	75%	0.75	S	S	*	*			trans	-5.5	178.9	151	-52.9	-175.9	174.2	-172.7	0	122
1144	P	35.4	Very low	24.6	Very low	121 Å²	121	135.2 Å²	135.2	79%	0.786	75%	0.753	S	S	*	*				-141	175.4	-54	41.5	-24.5	0	0	0	115.3
1145	A	22.7	Very low	24.7	Very low	107 Å²	107	136.5 Å²	136.5	88%	0.884	76%	0.758	S	S	*	*			trans	-147.7	175.8	162.5	0	0	0	0	0	113
1146	K	25.9	Very low	24.8	Very low	203 Å²	203	135 Å²	135	88%	0.883	75%	0.748	S	S	*	*			trans	-121.9	154.2	-167.6	-56.9	171.6	178.4	174.7	0	113.3
1147	R	24.1	Very low	25	Very low	247 Å²	247	138.7 Å²	138.7	93%	0.932	76%	0.763	S	S	*	*				139.3	110.9	105	-163.9	-179.9	-156.4	177.5	4.1	117.2
1148	G	23.4	Very low	25	Very low	75 Å²	75	146.1 Å²	146.1	77%	0.773	79%	0.793	S	S	*	*			trans	89.5	169.4	152	0	0	0	0	0	118
1149	K	24	Very low	25	Very low	205 Å²	205	148.5 Å²	148.5	89%	0.891	80%	0.801	S	S	*	*			cis	-169.7	124.9	-16.2	-159.2	-170.9	-174.8	-165.7	0	112.1
1150	A	23	Very low	25.1	Very low	101 Å²	101	148.2 Å²	148.2	84%	0.835	80%	0.798	S	S	*	*			trans	63.1	170.3	170	0	0	0	0	0	115.9
1151	S	24.9	Very low	25.1	Very low	115 Å²	115	145.6 Å²	145.6	80%	0.804	80%	0.798	S	S	*	*			cis	-147.1	161.4	4.9	55.4	0	0	0	0	114
1152	S	24.2	Very low	25.2	Very low	100 Å²	100	143.9 Å²	143.9	70%	0.699	80%	0.796	S	S	*	*			trans	-53.8	156.3	174.3	53.3	0	0	0	0	118.7
1153	V	26.1	Very low	25.5	Very low	143 Å²	143	144.9 Å²	144.9	87%	0.867	80%	0.797	S	S	*	*				-140.7	153.5	124	172.7	0	0	0	0	108.8
1154	Q	26.5	Very low	25.6	Very low	179 Å²	179	140.4 Å²	140.4	84%	0.836	79%	0.79	S	S	*	*			trans	-126.3	146.2	177.1	-56.3	168.5	-85	0	0	111.3
1155	T	24.4	Very low	25.2	Very low	124 Å²	124	143.2 Å²	143.2	76%	0.761	79%	0.792	S	S	*	*			trans	-169.6	123.4	145.4	33.8	0	0	0	0	106.5
1156	S	24.5	Very low	25.3	Very low	98 Å²	98	146.7 Å²	146.7	69%	0.685	79%	0.794	S	S	*	*			cis	66.7	130	49.4	80.1	0	0	0	0	113.5
1157	T	25.4	Very low	25.4	Very low	120 Å²	120	144.9 Å²	144.9	74%	0.736	79%	0.794	S	S	*	*			cis	-177.3	149	-0.9	16	0	0	0	0	107.6
1158	Q	25.6	Very low	25.5	Very low	193 Å²	193	139.9 Å²	139.9	90%	0.902	79%	0.786	S	S	*	*				180	149	129	-101.9	164.8	-5	0	0	114.1
1159	Q	25.3	Very low	25.6	Very low	153 Å²	153	145 Å²	145	72%	0.715	79%	0.794	S	S	*	*			trans	-77.6	-179.7	166.6	-66	131.6	-114.5	0	0	109.9
1160	E	28	Very low	25.7	Very low	152 Å²	152	139.4 Å²	139.4	71%	0.71	78%	0.781	S	S	*	*			cis	-158.3	167.2	31.8	-131.6	93.9	-128.1	0	0	107.1
1161	D	26.8	Very low	25.8	Very low	132 Å²	132	142.2 Å²	142.2	71%	0.706	78%	0.781	S	S	*	*			cis	-164.1	-173.2	4.7	-161.5	-0.8	0	0	0	109.5
1162	L	26.8	Very low	25.9	Very low	136 Å²	136	143.8 Å²	143.8	71%	0.712	78%	0.779	S	S	*	*			trans	75.2	99.8	152.4	-68.5	161.2	0	0	0	121.8
1163	D	24.8	Very low	26.1	Very low	151 Å²	151	148.3 Å²	148.3	81%	0.807	79%	0.789	S	S	*	*				36.7	134.5	111.4	-79.8	-11.7	0	0	0	120.2
1164	S	26.9	Very low	26.1	Very low	94 Å²	94	148.9 Å²	148.9	66%	0.657	79%	0.787	S	S	*	*			cis	-169.8	-166.8	24.5	49.7	0	0	0	0	112.6
1165	H	25.7	Very low	26.3	Very low	180 Å²	180	145.6 Å²	145.6	83%	0.833	78%	0.775	S	S	*	*			trans	85.6	70.8	175.1	-64.5	-81	0	0	0	118.6
1166	L	25.8	Very low	26.4	Very low	179 Å²	179	147.1 Å²	147.1	94%	0.937	78%	0.777	S	S	*	*			trans	-124.8	123.1	145.5	-79.3	175.6	0	0	0	110
1167	N	27.5	Very low	26.6	Very low	165 Å²	165	147.8 Å²	147.8	88%	0.882	78%	0.782	S	S	*	*			trans	-162.2	160.3	165.2	-139.4	-25.8	0	0	0	111.3
1168	L	25.2	Very low	26.7	Very low	143 Å²	143	150.3 Å²	150.3	75%	0.749	78%	0.783	S	S	*	*			trans	69.7	78.2	169	-154	79.9	0	0	0	118.5
1169	L	26.1	Very low	26.9	Very low	181 Å²	181	152.9 Å²	152.9	95%	0.948	78%	0.784	S	S	*	*			trans	-134	94.6	137	-90.5	-177.8	0	0	0	110.2
1170	S	25.5	Very low	27.1	Very low	89 Å²	89	150.5 Å²	150.5	62%	0.622	79%	0.791	S	S	*	*			trans	-140.7	166.4	157.7	70	0	0	0	0	108.1
1171	L	26.1	Very low	27.1	Very low	160 Å²	160	146.7 Å²	146.7	84%	0.838	79%	0.792	S	S	*	*			trans	71	141	-164	-41.6	169.4	0	0	0	111.4
1172	I	25.9	Very low	27.2	Very low	148 Å²	148	145.8 Å²	145.8	76%	0.759	80%	0.796	S	S	*	*			cis	-136.3	126.9	9.2	-57.7	162.9	0	0	0	109.5
1173	E	28.6	Very low	27.3	Very low	195 Å²	195	146.2 Å²	146.2	91%	0.911	80%	0.799	S	S	*	*			trans	-139.9	109.1	146.5	-76.6	-157.5	154.9	0	0	109.3
1174	D	27.5	Very low	27.5	Very low	155 Å²	155	146.3 Å²	146.3	83%	0.829	80%	0.798	S	S	*	*			trans	-170.9	149.5	170.2	-102.4	-36.1	0	0	0	104.6
1175	D	29.7	Very low	27.7	Very low	109 Å²	109	147.4 Å²	147.4	58%	0.583	81%	0.806	S	S	*	*			cis	-142.3	-166.7	9.3	-172.7	-6.3	0	0	0	107.4	K1178	D1175-K1178 IonicContact OD2-NZ 2.75Å
1176	I	27.2	Very low	27.8	Very low	156 Å²	156	142.8 Å²	142.8	80%	0.8	81%	0.807	S	S	*	*			trans	82.5	99.5	179	-48.5	169.9	0	0	0	112
1177	S	28	Very low	28	Very low	113 Å²	113	143.7 Å²	143.7	79%	0.79	81%	0.806	S	S	*	*			cis	-158.7	156.6	46.2	48.3	0	0	0	0	114.1
1178	K	28.8	Very low	28.1	Very low	173 Å²	173	145.1 Å²	145.1	75%	0.752	81%	0.807	S	S	*	*			trans	-113.8	119.9	-176.4	-69.1	162.8	178.9	138.3	0	111.8	D1175	D1175-K1178 IonicContact OD2-NZ 2.75Å
1179	R	29.2	Very low	28.3	Very low	247 Å²	247	146.9 Å²	146.9	93%	0.932	81%	0.812	S	S	*	*			trans	-173.3	143.8	130.2	-114	175.7	174.9	174.2	-1.1	116.2
1180	A	29.3	Very low	28.5	Very low	102 Å²	102	144.2 Å²	144.2	84%	0.843	81%	0.806	S	S	*	*			trans	50.6	102.1	151.7	0	0	0	0	0	118
1181	G	27.6	Very low	28.6	Very low	72 Å²	72	148.5 Å²	148.5	74%	0.742	82%	0.816	S	S	*	*			trans	-102.3	169.5	169.9	0	0	0	0	0	113.7
1182	S	28.4	Very low	28.7	Very low	113 Å²	113	148.8 Å²	148.8	79%	0.79	82%	0.816	S	S	*	*			trans	-155.4	126.9	142	-32.8	0	0	0	0	109.6
1183	D	28.7	Very low	28.7	Very low	146 Å²	146	148 Å²	148	78%	0.781	81%	0.81	S	S	*	*			trans	58	114.1	138	-61.6	1.5	0	0	0	122.2
1184	I	29.6	Very low	28.8	Very low	152 Å²	152	146.7 Å²	146.7	78%	0.779	81%	0.808	S	S	*	*			trans	105	115.2	135.1	-64.2	158.7	0	0	0	119.9
1185	S	30.5	Very low	28.8	Very low	118 Å²	118	148.2 Å²	148.2	83%	0.825	80%	0.804	S	S	*	*			trans	76.4	134.9	149.5	70.1	0	0	0	0	121.6
1186	G	29.2	Very low	28.5	Very low	82 Å²	82	151.6 Å²	151.6	85%	0.845	82%	0.816	S	S	*	*			trans	114.4	60.9	146.3	0	0	0	0	0	117.6
1187	E	28.4	Very low	28.4	Very low	199 Å²	199	149.6 Å²	149.6	93%	0.93	82%	0.816	S	S	*	*			trans	-78.8	133.3	161.8	-67.6	174.5	150.6	0	0	110.4
1188	E	29.8	Very low	28.3	Very low	194 Å²	194	151.9 Å²	151.9	91%	0.907	82%	0.819	S	S	*	*			trans	-161.1	90.2	152.4	-123.8	173.8	-138.4	0	0	107.9
1189	E	30.6	Very low	28.4	Very low	181 Å²	181	153.4 Å²	153.4	85%	0.846	83%	0.826	S	S	*	*			trans	-71.9	136.8	165.2	-68.8	-164.1	125.6	0	0	109	E1191	E1189-E1191 PolarHBondContact O-N 3.32Å; E1189-E1191 VanDerWaalsContact O-N 3.09Å
1190	P	30.1	Very low	28.6	Very low	125 Å²	125	145.1 Å²	145.1	81%	0.812	82%	0.818	S	S	*	*			trans	-73.5	104.5	172.4	29.5	-32	0	0	0	109.5	I1192	P1190-I1192 PolarHBondContact O-N 3.11Å
1191	E	27.5	Very low	28.4	Very low	179 Å²	179	144.7 Å²	144.7	84%	0.836	81%	0.809	S	S	*	*			trans	-48.4	135.2	170.9	-64.2	-179.8	131.2	0	0	110.7	E1189 E1193	E1189-E1191 PolarHBondContact O-N 3.32Å; E1189-E1191 VanDerWaalsContact O-N 3.09Å; E1191-E1193 PolarHBondContact O-N 3.06Å; E1191-E1193 VanDerWaalsContact O-N 3.09Å
1192	I	28.6	Very low	28.3	Very low	165 Å²	165	150.7 Å²	150.7	85%	0.846	82%	0.818	S	S	*	*			trans	-79	92.9	168.2	-60.5	177.9	0	0	0	106.2	P1190 D1194	P1190-I1192 PolarHBondContact O-N 3.11Å; I1192-D1194 PolarHBondContact O-N 2.89Å; I1192-D1194 VanDerWaalsContact O-N 3.08Å
1193	E	26.1	Very low	28.2	Very low	133 Å²	133	153.4 Å²	153.4	62%	0.621	82%	0.815	S	S	*	*			trans	-54.5	113.3	177	-69.4	-180	108.5	0	0	110.7	E1191 Y1195	E1191-E1193 PolarHBondContact O-N 3.06Å; E1191-E1193 VanDerWaalsContact O-N 3.09Å; E1193-Y1195 HydrophobicContact CB-CD2 3.77Å; E1193-Y1195 HydrophobicContact CB-CE2 3.8Å; E1193-Y1195 HydrophobicContact CG-CE2 4.39Å; E1193-Y1195 PolarHBondContact O-N 3.44Å
1194	D	30.3	Very low	27.9	Very low	166 Å²	166	152.4 Å²	152.4	89%	0.888	82%	0.815	S	S	*	*			trans	-61.9	99	166.9	-86.6	-42.2	0	0	0	109.1	I1192	I1192-D1194 PolarHBondContact O-N 2.89Å; I1192-D1194 VanDerWaalsContact O-N 3.08Å
1195	Y	26.5	Very low	27.9	Very low	187 Å²	187	150.7 Å²	150.7	73%	0.733	81%	0.806	S	S	*	*			trans	-87.9	126.1	-177	-109.6	-84.4	0	0	0	113	E1193	E1193-Y1195 HydrophobicContact CB-CD2 3.77Å; E1193-Y1195 HydrophobicContact CB-CE2 3.8Å; E1193-Y1195 HydrophobicContact CG-CE2 4.39Å; E1193-Y1195 PolarHBondContact O-N 3.44Å
1196	E	24.6	Very low	27.7	Very low	180 Å²	180	150.1 Å²	150.1	84%	0.841	80%	0.8	S	S	*	*			trans	-56.9	146.6	-177.9	-59.3	-179.2	120.9	0	0	113.1	D1198	E1196-D1198 PolarHBondContact O-N 2.89Å; E1196-D1198 VanDerWaalsContact O-N 3.09Å
1197	S	25.3	Very low	27.6	Very low	114 Å²	114	150.7 Å²	150.7	80%	0.797	79%	0.791	S	S	*	*			trans	-73	101.1	175.7	-172.4	0	0	0	0	110.8	K1199	S1197-K1199 PolarHBondContact O-N 3.4Å
1198	D	25	Very low	27.8	Very low	161 Å²	161	145.6 Å²	145.6	86%	0.861	77%	0.773	S	S	*	*			trans	-70.1	90.1	-176.7	-151	6.8	0	0	0	110.8	E1196 G1200	E1196-D1198 PolarHBondContact O-N 2.89Å; E1196-D1198 VanDerWaalsContact O-N 3.09Å; D1198-G1200 PolarHBondContact O-N 3.4Å; D1198-G1200 VanDerWaalsContact O-N 3.07Å
1199	K	32	Very low	27.8	Very low	205 Å²	205	144.2 Å²	144.2	89%	0.891	76%	0.76	S	S	*	*			trans	-65.2	102.4	175.4	-71.5	-172.9	176.3	-172.7	0	110	S1197	S1197-K1199 PolarHBondContact O-N 3.4Å
1200	G	32.9	Very low	28	Very low	74 Å²	74	144.7 Å²	144.7	76%	0.763	76%	0.762	S	S	*	*			trans	-174.2	32.8	-174.6	0	0	0	0	0	118.5	D1198	D1198-G1200 PolarHBondContact O-N 3.4Å; D1198-G1200 VanDerWaalsContact O-N 3.07Å
1201	S	24.1	Very low	28	Very low	93 Å²	93	144 Å²	144	65%	0.65	76%	0.756	S	S	*	*			trans	-151.4	89.4	163.6	67.4	0	0	0	0	112.8	F1203	S1201-F1203 VanDerWaalsContact C-N 3.35Å; S1201-F1203 PolarHBondContact O-N 3.46Å
1202	E	25.2	Very low	28.3	Very low	198 Å²	198	141 Å²	141	93%	0.925	75%	0.754	S	S	*	*			trans	-67.3	97	159	-72.1	168.2	144.9	0	0	108.1
1203	F	27	Very low	28.5	Very low	170 Å²	170	137.4 Å²	137.4	75%	0.746	75%	0.749	S	S	*	*			trans	-89.5	110.6	152	-80.7	-89.6	0	0	0	105.8	S1201 L1205	S1201-F1203 VanDerWaalsContact C-N 3.35Å; S1201-F1203 PolarHBondContact O-N 3.46Å; F1203-L1205 PolarHBondContact O-N 3.36Å; F1203-L1205 VanDerWaalsContact O-N 3.09Å
1204	T	23.7	Very low	29.1	Very low	125 Å²	125	133 Å²	133	77%	0.767	73%	0.733	S	S	*	*			trans	-61.2	112.4	168.4	33.9	0	0	0	0	108.9
1205	L	29	Very low	29.6	Very low	115 Å²	115	129.9 Å²	129.9	60%	0.602	72%	0.715	S	S	*	*			trans	-59.4	154.9	144.3	-65	168.4	0	0	0	107.5	F1203 S1207	F1203-L1205 PolarHBondContact O-N 3.36Å; F1203-L1205 VanDerWaalsContact O-N 3.09Å; L1205-S1207 PolarHBondContact O-N 3.11Å
1206	P	25.4	Very low	30.5	Very low	107 Å²	107	122.9 Å²	122.9	70%	0.695	69%	0.691	S	S	*	*			trans	-51	131.7	160	-19.4	31.7	0	0	0	108	T1208	P1206-T1208 PolarHBondContact O-N 3.12Å
1207	S	28.1	Very low	31.7	Very low	93 Å²	93	117.5 Å²	117.5	65%	0.65	67%	0.667	S	S	*	*			trans	-62.5	93.8	-170.7	-171.4	0	0	0	0	112.2	L1205 R1209	L1205-S1207 PolarHBondContact O-N 3.11Å; S1207-R1209 PolarHBondContact O-N 3.36Å
1208	T	33	Very low	32.9	Very low	92 Å²	92	119.1 Å²	119.1	56%	0.564	66%	0.663	S	S	*	*			trans	-64.1	101.9	172	50.9	0	0	0	0	108.1	P1206 H1210	P1206-T1208 PolarHBondContact O-N 3.12Å; T1208-H1210 PolarHBondContact O-N 3.1Å
1209	R	29.8	Very low	34	Very low	165 Å²	165	112.3 Å²	112.3	62%	0.623	63%	0.626	S	S	*	*			trans	-53.1	125.2	175.8	-69.5	177.7	175.8	169.8	-0.9	108.5	E851 S1207 T1211	E851-R1209 IonicContact OE1-CZ 2.79Å; E851-R1209 IonicContact OE1-NH2 2.64Å; E851-R1209 PolarHBondContact OE1-NH2 2.66Å; S1207-R1209 PolarHBondContact O-N 3.36Å; R1209-T1211 PolarHBondContact O-N 3.46Å
1210	H	34.4	Very low	34.9	Very low	191 Å²	191	104.3 Å²	104.3	88%	0.884	59%	0.591	S	S	*	*			trans	-71.1	75.8	173.9	-80.3	-60.9	0	0	0	110.6	T1208 S1212	T1208-H1210 PolarHBondContact O-N 3.1Å; H1210-S1212 PolarHBondContact O-N 2.99Å; H1210-S1212 VanDerWaalsContact O-N 3.11Å
1211	T	29.7	Very low	35.3	Very low	111 Å²	111	109.3 Å²	109.3	68%	0.681	60%	0.601	S	S	*	*			trans	-72.7	93.1	160.8	44.6	0	0	0	0	108.6	R1209 A1213	R1209-T1211 PolarHBondContact O-N 3.46Å; T1211-A1213 PolarHBondContact O-N 3.26Å
1212	S	33.4	Very low	35.9	Very low	116 Å²	116	110.2 Å²	110.2	81%	0.811	60%	0.598	S	S	*	*	S	Bend	trans	-59.8	130.9	166.6	55	0	0	0	0	109.7	H1210	H1210-S1212 PolarHBondContact O-N 2.99Å; H1210-S1212 VanDerWaalsContact O-N 3.11Å
1213	A	33	Very low	36.4	Very low	89 Å²	89	105.5 Å²	105.5	74%	0.736	58%	0.581	S	S	*	*	S	Bend	trans	75.8	104.4	-157.5	0	0	0	0	0	112.5	T1211	T1211-A1213 PolarHBondContact O-N 3.26Å
1214	S	39.3	Very low	37	Very low	42 Å²	42	101.9 Å²	101.9	29%	0.294	57%	0.572	S	S	.	*			trans	-75.6	135	177.4	163.6	0	0	0	0	110.6	L1216 D1217	S1214-L1216 PolarHBondContact OG-N 3.11Å; S1214-D1217 VanDerWaalsContact CB-CG 3.41Å; S1214-D1217 WeakPolarHBondContact CB-OD1 3.37Å; S1214-D1217 WeakPolarHBondContact CB-OD2 3.43Å; S1214-D1217 VanDerWaalsContact OG-CG 3.24Å; S1214-D1217 PolarHBondContact OG-N 2.98Å; S1214-D1217 PolarHBondContact OG-OD1 3.48Å
1215	I	40.2	Very low	37.8	Very low	99 Å²	99	100.6 Å²	100.6	51%	0.508	56%	0.56	S	S	.	*	S	Bend	trans	-90.2	-18.4	171.8	-67.9	170.9	0	0	0	110.5	Q483 D1217 Q1218	Q483-I1215 HydrophobicContact CG-CG2 4.33Å; I1215-D1217 VanDerWaalsContact C-N 3.26Å; I1215-D1217 PolarHBondContact O-N 2.82Å; I1215-Q1218 WeakPolarHBondContact O-CB 3.33Å; I1215-Q1218 PolarHBondContact O-N 2.85Å
1216	L	44.9	Very low	38.3	Very low	41 Å²	41	99.7 Å²	99.7	22%	0.215	56%	0.558	C	S	.	*	S	Bend	trans	-65.8	-31.5	172.5	-64.8	172.2	0	0	0	111.3	Q483 S1214 Q1218 L1219 F1220	Q483-L1216 HydrophobicContact CB-CD2 4.18Å; S1214-L1216 PolarHBondContact OG-N 3.11Å; L1216-Q1218 PolarHBondContact O-N 2.98Å; L1216-L1219 VanDerWaalsContact O-CB 3.31Å; L1216-L1219 WeakPolarHBondContact O-CB 3.35Å; L1216-L1219 PolarHBondContact O-N 2.94Å; L1216-F1220 WeakPolarHBondContact O-CD2 3.41Å; L1216-F1220 PolarHBondContact O-N 3.43Å
1217	D	49.9	Very low	39.2	Very low	66 Å²	66	99.2 Å²	99.2	35%	0.353	55%	0.549	S	S	.	.	H	α-helix	trans	-57.3	-43	174.6	-56.6	3.9	0	0	0	109.8	S1214 I1215 L1219 F1220 D1221	S1214-D1217 VanDerWaalsContact CB-CG 3.41Å; S1214-D1217 WeakPolarHBondContact CB-OD1 3.37Å; S1214-D1217 WeakPolarHBondContact CB-OD2 3.43Å; S1214-D1217 VanDerWaalsContact OG-CG 3.24Å; S1214-D1217 PolarHBondContact OG-N 2.98Å; S1214-D1217 PolarHBondContact OG-OD1 3.48Å; I1215-D1217 VanDerWaalsContact C-N 3.26Å; I1215-D1217 PolarHBondContact O-N 2.82Å; D1217-L1219 PolarHBondContact O-N 3.1Å; D1217-L1219 VanDerWaalsContact O-N 3.09Å; D1217-F1220 PolarHBondContact O-N 2.77Å; D1217-F1220 VanDerWaalsContact O-N 3.11Å; D1217-D1221 WeakPolarHBondContact O-CB 3.39Å; D1217-D1221 PolarHBondContact O-N 3.33Å
1218	Q	51.6	Low	40	Very low	149 Å²	149	99.6 Å²	99.6	70%	0.696	54%	0.541	S	S	*	.	H	α-helix	trans	-69.6	-3.6	177	-54.6	-179.9	19.2	0	0	114.3	I1215 L1216	I1215-Q1218 WeakPolarHBondContact O-CB 3.33Å; I1215-Q1218 PolarHBondContact O-N 2.85Å; L1216-Q1218 PolarHBondContact O-N 2.98Å
1219	L	47.6	Very low	40.5	Very low	17 Å²	17	100.2 Å²	100.2	9%	0.089	54%	0.54	C	S	.	.	H	α-helix	trans	-98.5	-17.6	174.5	-164.1	68.3	0	0	0	112.5	I476 S479 F480 L1216 D1217	I476-L1219 HydrophobicContact CG2-CD1 4.08Å; I476-L1219 HydrophobicContact CG2-CD2 4.2Å; I476-L1219 HydrophobicContact CG2-CG 3.97Å; S479-L1219 VanDerWaalsContact CB-CD1 3.41Å; F480-L1219 HydrophobicContact CB-CD2 4.14Å; L1216-L1219 VanDerWaalsContact O-CB 3.31Å; L1216-L1219 WeakPolarHBondContact O-CB 3.35Å; L1216-L1219 PolarHBondContact O-N 2.94Å; D1217-L1219 PolarHBondContact O-N 3.1Å; D1217-L1219 VanDerWaalsContact O-N 3.09Å
1220	F	50.4	Low	41.4	Very low	37 Å²	37	94.8 Å²	94.8	16%	0.162	53%	0.533	C	S	.	.	H	α-helix	trans	-122.6	-13.5	-173.9	-66.7	-74.3	0	0	0	114.6	E424 Y431 K452 V456 L1216 D1217	E424-F1220 HydrophobicContact CG-CD2 4.28Å; E424-F1220 WeakPolarHBondContact OE1-CD2 3.27Å; E424-F1220 WeakPolarHBondContact OE1-CE2 3.35Å; Y431-F1220 HydrophobicContact CE2-CE2 4.46Å; K452-F1220 HydrophobicContact CB-CE1 4.06Å; V456-F1220 HydrophobicContact CG2-CD1 3.54Å; V456-F1220 HydrophobicContact CG2-CE1 4.1Å; L1216-F1220 WeakPolarHBondContact O-CD2 3.41Å; L1216-F1220 PolarHBondContact O-N 3.43Å; D1217-F1220 PolarHBondContact O-N 2.77Å; D1217-F1220 VanDerWaalsContact O-N 3.11Å
1221	D	42.2	Very low	42	Very low	180 Å²	180	86.1 Å²	86.1	96%	0.963	50%	0.501	S	S	*	.			trans	-73.9	0	161.6	-79.8	-22.6	0	0	0	113.1	D1217	D1217-D1221 WeakPolarHBondContact O-CB 3.39Å; D1217-D1221 PolarHBondContact O-N 3.33Å

Retrieved 1,221 of 1,221 residues in 1956.3 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).