A0A3Q0KU01_SCHMA Loading...

SAC3_GANP domain-containing protein AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KU01, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,523 aa.

						>A0A3Q0KU01_SCHMA|A0A3Q0KU01
MFSSSSSDKPTGLFAGISNDSCANLFQVPLTTNSNVPGPGLFGNLKTTTEIRTNIKESEPSSSSAHTIGKNSIASKTVFHSPRSGDGFEKDRNDRCVIDTNMNGNEHNSYFDVPVSSNNEKECLDSNNIQNAANLYWPAVKLSRLPIEYNTKSFLLKHFQSFGPVERIICQPSMDAAYIAFNSLSSANRAKRSGRECIASANIDLPSSVLFTMARCRRQTNSGSTPISPKLGPIKGKNIVSSMSPSRTSLKRTITSQSNIKQVMNKKQFSSVSVSSDNQLSSVSSQIPCYNTQPTVSSSITRSNVSAYNTNGLFNQKSSSATTLDERLFVLQENYRRDCELRSISESVDPKIQYSDICNNNTDEPIRHAPIKGTCEDMCPELERYCRAAHQRVSIFECLPTTMSANSSSWEMDHTRAVKDYQRSSADQPVPLPRELRPTSVLQRTMAYLLASIADRPEIDTSRSLWKPWYEFMWTRTRAIRKDIRQQNLCCPIVIGVIERIARFHIFCAARLVDQPVDTFDPRINSENLTQCLQTLKEMYSDLDSSITSENICPNEAEFRGYMLLMKLNDQNEINEAQRLPERLRQSKPVRFAFATHEALITNNYIRFFRLARQATCLVACLMHRYFVQIRSQALMKLSCAFAGHPKREVHYPLSTLTQQLGFENETESKDFCETWGLSVFDSNVIFEKQIQPQPPTLPWKEQRSFHLVENKRIGIPLSVLFNGSPINPSDAIPSPVQSSFDINGKYICSQKKHTQNDNDTLDYNNRIPDSNICNNNWNTPFMYQQPTTNSTLATTNSWLTERNIYNKKQISNELLEIVYNECVDEVLSYSTFSQTVLLEEMIINELIEKLIIDFIEDHLIDLFNNRLDPIRQIDKEIMENITNETLNLYLYSLVHREWTLELLYNEYVDQLINEQLHKLATSSLTISIANSLYNYSLLKCCFNHFHYLIWKHNKLIQKENLLNTMPTSISSDCLPLCLMMNNNEWNTNEDISTINVLKHSSYTRISLEMLKLDDQLTWSPMKPSSIFYKYPLGLYKSILMPTHTYSKTIQQQFTNIFHWIYNKLKHLPIVLLNEWPTTSVISNQLSGIIVIGYFDHSITKEQLMSMHSTNLVQSYDQDFIKDLLILAVTCSLQEIPCSSLEDIHHNNNDDDIYLVHLSNSISFEQKFQPNPFWSMNLQYGLSWIEDCFMKKMNRLNHHTFQNGSNANPKYALSSTTSSSSPSNTEMTTLYRKLHSLIDEYIDITLLRPLANLSEIWKLHGLVDPSLKSLIDKYHSIILNLIDQLIPMDKFFTNLLHNSLILSENILNLILIDYNNSNNNNNNNSNSACSSSGDYCRFQAQIKANNNNNNSNNDNSNGNNNEKNPNTLSISWNTYINHWLILSKQLKFNSSIHNWIMISFYKIEKDFIDSLNKIKTLTNDQFYNALPSINLAPNLNLFYGLIKNYEPCMTRSNAIHLSLHNVHRNNIETCLQSIRRRKSSTSIEHKESLSAKLNELSFKIQKIENSMNDTIKETKKYKLNTSI
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	28.3	Very low	28.7	Very low	240 Å²	240	147.5 Å²	147.5	100%	1.182	85%	0.846	S	S	*	*				0	100.5	0	-81.7	176.3	160.3	0	0	108
2	F	27.1	Very low	28.6	Very low	218 Å²	218	141.3 Å²	141.3	96%	0.956	84%	0.837	S	S	*	*			trans	-97.3	113.5	170.3	-73.2	-83.3	0	0	0	107.4
3	S	31.7	Very low	28.4	Very low	101 Å²	101	142.5 Å²	142.5	71%	0.706	84%	0.837	S	S	*	*			trans	-179.3	98.3	165.6	26.3	0	0	0	0	106
4	S	28.4	Very low	28.4	Very low	107 Å²	107	147.9 Å²	147.9	75%	0.748	85%	0.845	S	S	*	*				80.8	113.1	85.9	67.5	0	0	0	0	114.5
5	S	27.7	Very low	28.3	Very low	113 Å²	113	145.1 Å²	145.1	79%	0.79	85%	0.847	S	S	*	*			trans	98.9	144.2	136.8	77.2	0	0	0	0	121.3
6	S	31.2	Very low	28.3	Very low	108 Å²	108	140.5 Å²	140.5	76%	0.755	84%	0.84	S	S	*	*			trans	77.5	95.5	174.7	69.7	0	0	0	0	115.9
7	S	27.7	Very low	28.2	Very low	106 Å²	106	142.4 Å²	142.4	74%	0.741	84%	0.843	S	S	*	*				65.9	86.1	66.1	79.9	0	0	0	0	113.4
8	D	30.5	Very low	28.2	Very low	167 Å²	167	140.3 Å²	140.3	89%	0.893	84%	0.837	S	S	*	*			trans	-152.1	99.2	142.4	-90.6	-31.8	0	0	0	108.5
9	K	27.1	Very low	28.2	Very low	197 Å²	197	141.1 Å²	141.1	86%	0.857	84%	0.836	S	S	*	*			trans	-90.1	119	170.8	-79.3	-180	176.2	177.3	0	107.8	T11	K9-T11 PolarHBondContact O-N 3.18Å
10	P	27.5	Very low	28.2	Very low	128 Å²	128	142.2 Å²	142.2	83%	0.831	84%	0.838	S	S	*	*			trans	-77.6	109	160.6	30.4	-26.5	0	0	0	107.9	G12	P10-G12 PolarHBondContact O-N 3.43Å
11	T	28.6	Very low	28.1	Very low	138 Å²	138	140.8 Å²	140.8	85%	0.847	84%	0.836	S	S	*	*			trans	-65.2	107.9	166.4	43.8	0	0	0	0	109.6	K9	K9-T11 PolarHBondContact O-N 3.18Å
12	G	27.6	Very low	27.9	Very low	72 Å²	72	135.7 Å²	135.7	74%	0.742	82%	0.823	S	S	*	*			trans	-125.4	102.8	170	0	0	0	0	0	109.3	P10	P10-G12 PolarHBondContact O-N 3.43Å
13	L	26.6	Very low	28	Very low	158 Å²	158	129.5 Å²	129.5	83%	0.827	81%	0.812	S	S	*	*			trans	-34.7	126.3	176.8	-73.3	115	0	0	0	114.7
14	F	28.5	Very low	27.8	Very low	217 Å²	217	131.3 Å²	131.3	95%	0.952	81%	0.813	S	S	*	*				-175.4	68.2	126.7	-90.5	-66.5	0	0	0	107.9
15	A	26.4	Very low	27.7	Very low	106 Å²	106	133.5 Å²	133.5	88%	0.876	82%	0.816	S	S	*	*			trans	-105.4	123	156.7	0	0	0	0	0	106
16	G	27.7	Very low	27.8	Very low	72 Å²	72	137.9 Å²	137.9	74%	0.742	82%	0.821	S	S	*	*			trans	146	59.5	174.2	0	0	0	0	0	114.9
17	I	27.1	Very low	27.4	Very low	172 Å²	172	141.2 Å²	141.2	88%	0.882	83%	0.825	S	S	*	*			trans	-130.7	85.2	141.6	-55.6	-179.8	0	0	0	105.3
18	S	27.6	Very low	27.4	Very low	106 Å²	106	142 Å²	142	74%	0.741	83%	0.825	S	S	*	*			trans	-63.5	130.7	166.2	44.9	0	0	0	0	108.9	D20	S18-D20 PolarHBondContact O-N 3.33Å
19	N	28.4	Very low	27.2	Very low	154 Å²	154	139 Å²	139	82%	0.824	82%	0.815	S	S	*	*			trans	-46.8	117.4	166.1	-67.1	-31.2	0	0	0	110.4
20	D	28.7	Very low	27.1	Very low	163 Å²	163	137.4 Å²	137.4	87%	0.872	82%	0.815	S	S	*	*			trans	-171.5	77.3	154.7	-91.7	-24.5	0	0	0	109.6	S18	S18-D20 PolarHBondContact O-N 3.33Å
21	S	27.1	Very low	27.1	Very low	114 Å²	114	137.4 Å²	137.4	80%	0.797	81%	0.812	S	S	*	*			trans	179.3	52.6	149.1	64.5	0	0	0	0	110.9	A23	S21-A23 PolarHBondContact O-N 3.35Å
22	C	23.8	Very low	27	Very low	133 Å²	133	136.8 Å²	136.8	90%	0.899	81%	0.808	S	S	*	*			trans	-78.5	74.5	159.5	-78.7	0	0	0	0	107.9	N24	C22-N24 PolarHBondContact O-N 2.98Å
23	A	29.2	Very low	26.9	Very low	87 Å²	87	140.5 Å²	140.5	72%	0.719	81%	0.811	S	S	*	*			trans	-71.9	108.7	169.9	0	0	0	0	0	108.5	S21 L25	S21-A23 PolarHBondContact O-N 3.35Å; A23-L25 PolarHBondContact O-N 3.46Å
24	N	26.9	Very low	26.8	Very low	139 Å²	139	137.3 Å²	137.3	74%	0.743	80%	0.802	S	S	*	*			trans	-39.1	112.9	173.8	-66.3	-46.2	0	0	0	113.6	C22	C22-N24 PolarHBondContact O-N 2.98Å
25	L	26.3	Very low	26.7	Very low	154 Å²	154	134 Å²	134	81%	0.806	80%	0.795	S	S	*	*			trans	-132.7	42.9	166.7	-93.2	171.3	0	0	0	111.7	A23	A23-L25 PolarHBondContact O-N 3.46Å
26	F	28.6	Very low	26.8	Very low	204 Å²	204	135.6 Å²	135.6	90%	0.895	79%	0.793	S	S	*	*			trans	-159.2	64	160.8	-74.8	-62.6	0	0	0	110.5	V28	F26-V28 PolarHBondContact O-N 2.85Å
27	Q	24.3	Very low	26.7	Very low	178 Å²	178	137.8 Å²	137.8	83%	0.832	79%	0.794	S	S	*	*			trans	-89	93.4	158.7	-98	-179.5	-21.8	0	0	107.8	P29	Q27-P29 WeakPolarHBondContact O-CD 3.44Å
28	V	27	Very low	26.6	Very low	122 Å²	122	132.9 Å²	132.9	74%	0.739	79%	0.786	S	S	*	*			trans	-84.4	112.6	158.2	177.7	0	0	0	0	105.8	F26 L30	F26-V28 PolarHBondContact O-N 2.85Å; V28-L30 PolarHBondContact O-N 2.91Å; V28-L30 VanDerWaalsContact O-N 3.1Å
29	P	27.3	Very low	26.6	Very low	105 Å²	105	134.1 Å²	134.1	68%	0.682	79%	0.791	S	S	*	*			trans	-71.2	109.5	-176.5	27.3	-30.1	0	0	0	109.1	Q27 T31	Q27-P29 WeakPolarHBondContact O-CD 3.44Å; P29-T31 VanDerWaalsContact C-N 3.28Å; P29-T31 PolarHBondContact O-N 3.36Å
30	L	24	Very low	26.5	Very low	164 Å²	164	130.2 Å²	130.2	86%	0.859	79%	0.788	S	S	*	*			trans	-66.3	88.9	163.3	-83.7	151.4	0	0	0	108.1	V28 T32	V28-L30 PolarHBondContact O-N 2.91Å; V28-L30 VanDerWaalsContact O-N 3.1Å; L30-T32 VanDerWaalsContact C-N 3.35Å; L30-T32 PolarHBondContact O-N 3.28Å
31	T	28.2	Very low	26.5	Very low	127 Å²	127	130.4 Å²	130.4	78%	0.779	79%	0.788	S	S	*	*			trans	-71.6	96.2	165.1	51.7	0	0	0	0	108.3	P29 N33	P29-T31 VanDerWaalsContact C-N 3.28Å; P29-T31 PolarHBondContact O-N 3.36Å; T31-N33 PolarHBondContact O-N 3.42Å
32	T	25.3	Very low	26.4	Very low	125 Å²	125	134.6 Å²	134.6	77%	0.767	79%	0.792	S	S	*	*			trans	-60.1	116.3	160.1	49.7	0	0	0	0	108.9	L30	L30-T32 VanDerWaalsContact C-N 3.35Å; L30-T32 PolarHBondContact O-N 3.28Å
33	N	26.8	Very low	26.5	Very low	151 Å²	151	132 Å²	132	81%	0.807	79%	0.788	S	S	*	*			trans	-151.6	90.4	154.6	-97.5	-17.6	0	0	0	109.7	T31	T31-N33 PolarHBondContact O-N 3.42Å
34	S	24.1	Very low	26.3	Very low	90 Å²	90	135.4 Å²	135.4	63%	0.629	79%	0.794	S	S	*	*			trans	42.1	130.8	131	64.5	0	0	0	0	120.7
35	N	26.2	Very low	26.3	Very low	149 Å²	149	137.2 Å²	137.2	80%	0.797	80%	0.803	S	S	*	*			trans	86	80.1	145.5	-58.4	-15.2	0	0	0	118.2
36	V	27.2	Very low	26.3	Very low	139 Å²	139	139 Å²	139	84%	0.842	80%	0.804	S	S	*	*			trans	-140.2	120.6	134.3	-173.7	0	0	0	0	108.5
37	P	26.8	Very low	26.1	Very low	117 Å²	117	135.8 Å²	135.8	76%	0.76	80%	0.801	S	S	*	*			trans	-76.3	142.2	-173.6	31.6	-32.9	0	0	0	111.4
38	G	25.2	Very low	26.2	Very low	70 Å²	70	133.5 Å²	133.5	72%	0.722	80%	0.8	S	S	*	*			trans	-65.2	144.5	-179.5	0	0	0	0	0	113.4	G40	G38-G40 PolarHBondContact O-N 3.13Å
39	P	27.4	Very low	26.2	Very low	131 Å²	131	133.6 Å²	133.6	85%	0.851	80%	0.801	S	S	*	*			trans	-81.8	106.7	166.3	31.7	-26.3	0	0	0	108.4
40	G	25.5	Very low	25.9	Very low	73 Å²	73	137.9 Å²	137.9	75%	0.753	81%	0.812	S	S	*	*			trans	-67.6	134.2	171.2	0	0	0	0	0	112	G38	G38-G40 PolarHBondContact O-N 3.13Å
41	L	28.3	Very low	26.1	Very low	166 Å²	166	137.3 Å²	137.3	87%	0.869	81%	0.808	S	S	*	*			trans	-143	62.8	163.7	-90.9	167.9	0	0	0	108.4
42	F	25.6	Very low	25.8	Very low	203 Å²	203	141.6 Å²	141.6	89%	0.89	81%	0.81	S	S	*	*			trans	-126.7	103.8	155.1	-85.6	-78.2	0	0	0	107	N44	F42-N44 PolarHBondContact O-N 3.13Å
43	G	26.7	Very low	26	Very low	78 Å²	78	141.8 Å²	141.8	80%	0.804	81%	0.811	S	S	*	*			trans	-69	116	174.5	0	0	0	0	0	109.6	L45	G43-L45 PolarHBondContact O-N 3.26Å
44	N	24.9	Very low	25.8	Very low	158 Å²	158	141.2 Å²	141.2	85%	0.845	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-50.9	119.9	172.3	-69.4	-32.8	0	0	0	112.2	F42	F42-N44 PolarHBondContact O-N 3.13Å
45	L	26.7	Very low	26	Very low	178 Å²	178	144 Å²	144	93%	0.932	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-97.6	121.8	153.1	-92.1	155.2	0	0	0	107.8	G43	G43-L45 PolarHBondContact O-N 3.26Å
46	K	26.6	Very low	25.9	Very low	190 Å²	190	146.4 Å²	146.4	83%	0.826	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-66.4	131.4	-165.6	-70.8	169.8	174.1	175.9	0	112.1	T48	K46-T48 PolarHBondContact O-N 3.49Å
47	T	23.3	Very low	25.9	Very low	137 Å²	137	147.8 Å²	147.8	84%	0.84	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-55.7	118.2	154.5	43.7	0	0	0	0	111.3
48	T	28.1	Very low	25.7	Very low	130 Å²	130	147.4 Å²	147.4	80%	0.798	82%	0.815	S	S	*	*			trans	-99.9	95.8	162	40.8	0	0	0	0	109.3	K46	K46-T48 PolarHBondContact O-N 3.49Å
49	T	26.6	Very low	25.8	Very low	124 Å²	124	153.1 Å²	153.1	76%	0.761	82%	0.823	S	S	*	*			trans	9.8	113.6	146.8	46.3	0	0	0	0	118.7
50	E	21.3	Very low	25.8	Very low	196 Å²	196	152.3 Å²	152.3	92%	0.916	82%	0.818	S	S	*	*			trans	-59.4	125.2	152.1	-63.6	175.2	151.8	0	0	110.9
51	I	26.9	Very low	25.7	Very low	152 Å²	152	153.6 Å²	153.6	78%	0.779	82%	0.815	S	S	*	*			trans	-120.9	93.8	155.7	-63.4	-179.3	0	0	0	108.1
52	R	22.1	Very low	25.4	Very low	217 Å²	217	151.1 Å²	151.1	82%	0.819	81%	0.812	S	S	*	*			trans	-18.8	115.6	151.2	-145	176.7	-160.8	167.8	4.6	114.8
53	T	29.2	Very low	25.4	Very low	128 Å²	128	146.3 Å²	146.3	79%	0.785	80%	0.803	S	S	*	*			trans	-130.4	99.3	154.9	45.9	0	0	0	0	109.7	I55	T53-I55 PolarHBondContact O-N 3.31Å
54	N	23.4	Very low	25.2	Very low	140 Å²	140	147.9 Å²	147.9	75%	0.749	80%	0.802	S	S	*	*			trans	-65.1	119.2	166	-72.7	-39.8	0	0	0	109
55	I	29	Very low	25.2	Very low	147 Å²	147	145.2 Å²	145.2	75%	0.754	80%	0.802	S	S	*	*			trans	-125.9	103	156.2	-62.3	-179.3	0	0	0	107.1	T53 E57	T53-I55 PolarHBondContact O-N 3.31Å; I55-E57 HydrophobicContact CG2-CG 4.31Å
56	K	23	Very low	25.2	Very low	200 Å²	200	145.8 Å²	145.8	87%	0.87	80%	0.799	S	S	*	*			trans	-84.7	117.7	164.4	-75.6	177	172.2	-179.5	0	107.2
57	E	27.4	Very low	24.9	Very low	169 Å²	169	142.7 Å²	142.7	79%	0.79	80%	0.797	S	S	*	*			trans	-145.8	89	156.8	-69.5	-172.8	159.7	0	0	105.9	I55	I55-E57 HydrophobicContact CG2-CG 4.31Å
58	S	23.1	Very low	24.9	Very low	109 Å²	109	144.3 Å²	144.3	76%	0.762	80%	0.798	S	S	*	*				48.2	104.3	87.2	69.1	0	0	0	0	114.4
59	E	26.1	Very low	24.8	Very low	190 Å²	190	141.2 Å²	141.2	89%	0.888	79%	0.792	S	S	*	*			trans	-22.4	146.1	162.4	-58.4	174.1	157.9	0	0	116.9
60	P	28.6	Very low	24.5	Very low	114 Å²	114	145 Å²	145	74%	0.74	80%	0.798	S	S	*	*				-138.7	116.8	115.9	26.6	-8.4	0	0	0	110.8
61	S	22.7	Very low	24.7	Very low	99 Å²	99	143.5 Å²	143.5	69%	0.692	80%	0.796	S	S	*	*				76.4	123.8	84.1	77.6	0	0	0	0	114.5
62	S	23	Very low	24.4	Very low	115 Å²	115	141.7 Å²	141.7	80%	0.804	80%	0.797	S	S	*	*			trans	72.3	136	159	81.4	0	0	0	0	115.7
63	S	24.4	Very low	24.4	Very low	101 Å²	101	139.2 Å²	139.2	71%	0.706	80%	0.799	S	S	*	*			cis	-167.3	145.3	21	44.3	0	0	0	0	109.5
64	S	23.5	Very low	24.1	Very low	111 Å²	111	137.8 Å²	137.8	78%	0.776	80%	0.8	S	S	*	*			trans	38.8	119.4	144.2	62.7	0	0	0	0	119.8
65	A	24.6	Very low	24	Very low	103 Å²	103	136.4 Å²	136.4	85%	0.851	80%	0.801	S	S	*	*				-177.5	151.9	102.9	0	0	0	0	0	111.4
66	H	25.7	Very low	23.6	Very low	190 Å²	190	139.2 Å²	139.2	88%	0.88	81%	0.807	S	S	*	*			trans	-61.8	141	-164.1	-91.8	-80.1	0	0	0	116.8
67	T	20.7	Very low	23.6	Very low	125 Å²	125	135.3 Å²	135.3	77%	0.767	80%	0.801	S	S	*	*			trans	-49.7	129.6	153.4	-36.9	0	0	0	0	112.4
68	I	24.6	Very low	23.3	Very low	171 Å²	171	133.1 Å²	133.1	88%	0.877	80%	0.798	S	S	*	*			trans	-174	120.3	141.6	-81.4	139.2	0	0	0	101.4
69	G	25	Very low	23.3	Very low	65 Å²	65	137 Å²	137	67%	0.67	80%	0.802	S	S	*	*			cis	149.3	121.8	43.5	0	0	0	0	0	103.6
70	K	21.4	Very low	23.2	Very low	204 Å²	204	136 Å²	136	89%	0.887	80%	0.797	S	S	*	*			trans	-54.7	132.5	-175.8	-64.6	169	175.5	177.7	0	110.7
71	N	23.9	Very low	22.9	Very low	163 Å²	163	135.7 Å²	135.7	87%	0.872	80%	0.797	S	S	*	*			trans	-154.9	114.4	142.9	-96.7	-18	0	0	0	110.6
72	S	20.5	Very low	23	Very low	115 Å²	115	137.1 Å²	137.1	80%	0.804	81%	0.805	S	S	*	*			trans	-72.2	119.6	170.8	48	0	0	0	0	110.8
73	I	23.4	Very low	22.9	Very low	165 Å²	165	142.9 Å²	142.9	85%	0.846	81%	0.809	S	S	*	*			trans	-140.8	129.8	152.3	-61.6	-176.1	0	0	0	108.4
74	A	21.8	Very low	22.9	Very low	98 Å²	98	143.6 Å²	143.6	81%	0.81	81%	0.814	S	S	*	*			trans	-62.3	142.7	177.7	0	0	0	0	0	113.3
75	S	21.7	Very low	22.9	Very low	110 Å²	110	141.7 Å²	141.7	77%	0.769	81%	0.812	S	S	*	*			trans	-143.9	118.7	163.8	50.5	0	0	0	0	111.3
76	K	21.3	Very low	22.9	Very low	206 Å²	206	145 Å²	145	90%	0.896	82%	0.815	S	S	*	*			trans	-42.2	139.2	165.1	-68.9	163.9	170.4	173.5	0	112.5
77	T	23.2	Very low	22.7	Very low	119 Å²	119	138.8 Å²	138.8	73%	0.73	80%	0.803	S	S	*	*			trans	-128.2	117.2	161.6	29.2	0	0	0	0	110.7
78	V	20.6	Very low	22.9	Very low	122 Å²	122	143.2 Å²	143.2	74%	0.739	81%	0.812	S	S	*	*			trans	-72.2	126.9	171.8	171.4	0	0	0	0	108.3
79	F	23.5	Very low	22.8	Very low	192 Å²	192	143.9 Å²	143.9	84%	0.842	81%	0.811	S	S	*	*			trans	-107.3	117.3	170.9	-88	-83.8	0	0	0	110.2
80	H	23.2	Very low	22.8	Very low	169 Å²	169	150.3 Å²	150.3	78%	0.782	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-82.7	138.5	174.3	-94.8	-75.6	0	0	0	111.4
81	S	21.5	Very low	22.9	Very low	106 Å²	106	147.4 Å²	147.4	74%	0.741	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-70.5	139.2	166.6	56.4	0	0	0	0	112.9
82	P	25.4	Very low	23	Very low	130 Å²	130	151.1 Å²	151.1	84%	0.844	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-102.2	163.9	154.4	15.5	4.6	0	0	0	112
83	R	21.8	Very low	23	Very low	236 Å²	236	152.8 Å²	152.8	89%	0.891	82%	0.816	S	S	*	*			trans	-119.6	162.6	-154.7	-142.1	178.6	-177	177.7	-1.9	109.6
84	S	23.5	Very low	23.2	Very low	116 Å²	116	153 Å²	153	81%	0.811	82%	0.819	S	S	*	*			trans	79.5	129.2	138.9	62.8	0	0	0	0	122.6
85	G	24.3	Very low	23.2	Very low	71 Å²	71	159.1 Å²	159.1	73%	0.732	82%	0.821	S	S	*	*			trans	102	143.7	138.6	0	0	0	0	0	114.8
86	D	24.1	Very low	23.2	Very low	171 Å²	171	160 Å²	160	91%	0.914	83%	0.826	S	S	*	*			cis	-166.6	154.6	-15.4	-127.5	-21	0	0	0	105.1
87	G	21	Very low	23.2	Very low	61 Å²	61	155.9 Å²	155.9	63%	0.629	82%	0.818	S	S	*	*			trans	-70.3	174.6	-163.9	0	0	0	0	0	117.8
88	F	25.8	Very low	23.2	Very low	218 Å²	218	156.9 Å²	156.9	96%	0.956	82%	0.817	S	S	*	*			trans	-158	114.5	145.5	-101.1	-73.7	0	0	0	110.2
89	E	21.5	Very low	23.4	Very low	185 Å²	185	157.8 Å²	157.8	86%	0.864	82%	0.818	S	S	*	*			trans	-66.2	146	159.9	-71.1	170.6	138.9	0	0	110.5
90	K	25.9	Very low	23.3	Very low	200 Å²	200	153.7 Å²	153.7	87%	0.87	81%	0.809	S	S	*	*			trans	-164.7	127.8	134.7	-114.6	168.6	-175.1	171.6	0	113.9
91	D	23.3	Very low	23.3	Very low	143 Å²	143	151.4 Å²	151.4	77%	0.765	80%	0.802	S	S	*	*			trans	-41.3	151	165.4	-58.8	-63.2	0	0	0	115.7
92	R	25	Very low	23.5	Very low	240 Å²	240	155.7 Å²	155.7	91%	0.906	81%	0.813	S	S	*	*				-175.6	123.6	106.7	-96.9	168.3	-172.7	-167.9	1	112.8
93	N	21.8	Very low	23.3	Very low	151 Å²	151	156.5 Å²	156.5	81%	0.807	81%	0.81	S	S	*	*			trans	-58.2	145.4	156.2	-72.5	-46.6	0	0	0	110.8
94	D	26.3	Very low	23.4	Very low	170 Å²	170	148.3 Å²	148.3	91%	0.909	80%	0.799	S	S	*	*			trans	-151.9	134.5	140.1	-97.2	-32	0	0	0	112.1
95	R	22.3	Very low	23.3	Very low	226 Å²	226	150 Å²	150	85%	0.853	80%	0.799	S	S	*	*			trans	-92.5	153.8	-177.8	-67.9	172.5	173.5	172.6	-2.3	110.8
96	C	22.1	Very low	23.2	Very low	129 Å²	129	154.8 Å²	154.8	87%	0.872	80%	0.803	S	S	*	*			trans	-174.4	101.5	147.6	-99.9	0	0	0	0	105.7
97	V	21.7	Very low	23.1	Very low	119 Å²	119	153.7 Å²	153.7	72%	0.721	79%	0.792	S	S	*	*				57.5	137	65.3	-154	0	0	0	0	114.1
98	I	22.3	Very low	23.2	Very low	139 Å²	139	157.3 Å²	157.3	71%	0.713	80%	0.797	S	S	*	*			trans	82.5	125.3	161.5	-17.7	174	0	0	0	112.1
99	D	25.1	Very low	23	Very low	141 Å²	141	151.5 Å²	151.5	75%	0.754	78%	0.783	S	S	*	*			cis	-163.3	157.6	41.5	-129.4	-32.1	0	0	0	115.7
100	T	22.4	Very low	23	Very low	106 Å²	106	151.7 Å²	151.7	65%	0.65	78%	0.777	S	S	*	*			trans	-83.4	168.8	-175.2	43.5	0	0	0	0	115.8
101	N	21.9	Very low	22.9	Very low	121 Å²	121	152.8 Å²	152.8	65%	0.647	78%	0.782	S	S	*	*			trans	95	106.4	150.7	-62.6	-27.3	0	0	0	119.1
102	M	25.6	Very low	22.9	Very low	197 Å²	197	151.3 Å²	151.3	97%	0.97	77%	0.774	S	S	*	*				-135.4	110.1	127.5	-85.5	-61.6	173.6	0	0	109
103	N	22.5	Very low	22.8	Very low	146 Å²	146	145.8 Å²	145.8	78%	0.781	77%	0.767	S	S	*	*			trans	-77.5	157.9	174.1	-91.8	-29.9	0	0	0	111.4
104	G	22.3	Very low	23.5	Very low	64 Å²	64	143.5 Å²	143.5	66%	0.66	76%	0.761	S	S	*	*				111.2	91.4	125.8	0	0	0	0	0	118.3
105	N	21.7	Very low	23.2	Very low	152 Å²	152	141.7 Å²	141.7	81%	0.813	76%	0.755	S	S	*	*				58.4	157.5	119.3	-72.7	-7	0	0	0	123.3
106	E	22.8	Very low	23.2	Very low	171 Å²	171	136.4 Å²	136.4	80%	0.799	75%	0.753	S	S	*	*			trans	89.4	140	154.3	-49.7	-159.6	165.2	0	0	116
107	H	22.5	Very low	23.2	Very low	149 Å²	149	136 Å²	136	69%	0.69	75%	0.751	S	S	*	*			cis	-179.2	158.5	-19.6	-124.1	-80.9	0	0	0	103.9
108	N	23.1	Very low	23.3	Very low	137 Å²	137	137.7 Å²	137.7	73%	0.733	76%	0.756	S	S	*	*			trans	71.1	148.9	152.3	-59.5	-12.9	0	0	0	117.9
109	S	21.9	Very low	23.2	Very low	95 Å²	95	137.6 Å²	137.6	66%	0.664	76%	0.758	S	S	*	*			cis	177	145.3	-12.1	50.1	0	0	0	0	106.1
110	Y	19.8	Very low	23.1	Very low	189 Å²	189	138.1 Å²	138.1	74%	0.741	76%	0.755	S	S	*	*			trans	51.5	116.3	144.3	-101.1	-98.3	0	0	0	121.3
111	F	25.2	Very low	23.2	Very low	223 Å²	223	141.7 Å²	141.7	98%	0.978	76%	0.762	S	S	*	*			trans	-152.2	136.5	136.4	-105.9	-78.1	0	0	0	110.6
112	D	22.7	Very low	23.3	Very low	112 Å²	112	145.1 Å²	145.1	60%	0.599	77%	0.774	S	S	*	*			trans	-98.1	147.6	-163.6	-94.5	-43	0	0	0	114.3
113	V	22.9	Very low	23.2	Very low	125 Å²	125	141.4 Å²	141.4	76%	0.758	77%	0.766	S	S	*	*				70.2	152.7	129.9	175.8	0	0	0	0	119.2
114	P	36.9	Very low	23.3	Very low	103 Å²	103	142 Å²	142	67%	0.669	77%	0.768	S	S	*	*			cis	-141.2	171.6	-32.5	39.6	-20.7	0	0	0	116.9
115	V	20.4	Very low	23.7	Very low	132 Å²	132	146 Å²	146	80%	0.8	78%	0.775	S	S	*	*			trans	41.4	112.2	136	-175.9	0	0	0	0	120.5
116	S	21.9	Very low	24.3	Very low	115 Å²	115	143 Å²	143	80%	0.804	77%	0.766	S	S	*	*				161.8	122.2	113.1	52.6	0	0	0	0	112.5
117	S	22.7	Very low	24.9	Very low	119 Å²	119	139.9 Å²	139.9	83%	0.832	75%	0.754	S	S	*	*			trans	-151	113.4	142.2	59.7	0	0	0	0	108.2
118	N	22.5	Very low	25.5	Very low	155 Å²	155	139.5 Å²	139.5	83%	0.829	76%	0.758	S	S	*	*			trans	-86.4	123.3	163.5	-92.1	-19.4	0	0	0	107.5
119	N	21.3	Very low	26.2	Very low	138 Å²	138	139.5 Å²	139.5	74%	0.738	76%	0.756	S	S	*	*			trans	29.8	117.1	132.5	-65.3	-9.6	0	0	0	117.1
120	E	22.1	Very low	27	Very low	152 Å²	152	141.2 Å²	141.2	71%	0.71	75%	0.754	S	S	*	*				171.5	145.1	83.4	-120.9	175.1	-139.5	0	0	112.7
121	K	25.2	Very low	27.8	Very low	181 Å²	181	137.8 Å²	137.8	79%	0.787	75%	0.748	S	S	*	*			trans	88	71.5	157.5	-68.5	167.1	-179.3	136.2	0	118
122	E	22.9	Very low	28.3	Very low	192 Å²	192	130.2 Å²	130.2	90%	0.897	73%	0.727	S	S	*	*			trans	-60.6	133.8	149.8	-66.7	176.6	149.2	0	0	111.7
123	C	23	Very low	29.4	Very low	119 Å²	119	127.5 Å²	127.5	80%	0.804	72%	0.72	S	S	*	*			trans	-156.2	111.7	148.3	-96.5	0	0	0	0	110.5
124	L	26.2	Very low	30.9	Very low	158 Å²	158	126.3 Å²	126.3	83%	0.827	71%	0.709	S	S	*	*			trans	79.2	75.8	148.3	-64.9	154.9	0	0	0	119.4
125	D	29.3	Very low	32.4	Very low	149 Å²	149	125.6 Å²	125.6	80%	0.797	70%	0.7	S	S	*	*			trans	29.2	93.4	136.4	-74.3	-20.1	0	0	0	120.1
126	S	34.7	Very low	35	Very low	90 Å²	90	123.9 Å²	123.9	63%	0.629	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-2.5	171.9	45.4	0	0	0	0	115.4	N128 I129	S126-N128 PolarHBondContact O-N 3.24Å; S126-I129 PolarHBondContact O-N 3.06Å
127	N	36.4	Very low	38.1	Very low	104 Å²	104	120.6 Å²	120.6	56%	0.556	65%	0.649	S	S	*	*	H	α-helix	trans	-80.3	-15.8	-170.7	-75.9	-19.7	0	0	0	115.4	I129	N127-I129 VanDerWaalsContact C-N 3.33Å; N127-I129 PolarHBondContact O-N 3.37Å
128	N	34.5	Very low	41.4	Very low	142 Å²	142	116 Å²	116	76%	0.759	62%	0.616	S	S	*	*	H	α-helix	trans	-76.9	-17.4	174.3	-85.4	-27	0	0	0	113.6	S126	S126-N128 PolarHBondContact O-N 3.24Å
129	I	37.3	Very low	44.7	Very low	136 Å²	136	108.6 Å²	108.6	70%	0.697	58%	0.577	S	S	*	*	H	α-helix	trans	-81.7	-33.6	179.1	-62.9	176.7	0	0	0	111.5	S126 N127 A133	S126-I129 PolarHBondContact O-N 3.06Å; N127-I129 VanDerWaalsContact C-N 3.33Å; N127-I129 PolarHBondContact O-N 3.37Å; I129-A133 PolarHBondContact O-N 3.44Å
130	Q	39.1	Very low	48.1	Very low	132 Å²	132	102 Å²	102	62%	0.617	54%	0.542	S	S	*	.	H	α-helix	trans	-71.6	-34.8	-178.6	-84.1	178.7	-19.2	0	0	113.6	A133 N134	Q130-A133 PolarHBondContact O-N 3.47Å; Q130-N134 PolarHBondContact O-N 3.31Å
131	N	37.2	Very low	51.5	Low	116 Å²	116	97.8 Å²	97.8	62%	0.62	52%	0.521	S	S	*	.	H	α-helix	trans	-71.8	-33.4	179.1	-76.4	-19.7	0	0	0	113.1	N134	N131-N134 PolarHBondContact O-N 2.77Å
132	A	35.7	Very low	54.7	Low	64 Å²	64	89.1 Å²	89.1	53%	0.529	48%	0.484	S	S	.	.	H	α-helix	trans	-71.7	-32	174.2	0	0	0	0	0	112.6	N134	A132-N134 PolarHBondContact O-N 2.97Å
133	A	44.9	Very low	57.6	Low	56 Å²	56	81.2 Å²	81.2	46%	0.463	45%	0.45	S	S	.	.	H	α-helix	trans	-66	-24.4	176.6	0	0	0	0	0	113.2	I129 Q130	I129-A133 PolarHBondContact O-N 3.44Å; Q130-A133 PolarHBondContact O-N 3.47Å
134	N	55.2	Low	60.5	Low	99 Å²	99	83.3 Å²	83.3	53%	0.529	44%	0.441	S	S	.	.	H	α-helix	trans	-81.4	-21.5	-178.3	-81.5	-21.5	0	0	0	114.8	Q130 N131 A132 R218	Q130-N134 PolarHBondContact O-N 3.31Å; N131-N134 PolarHBondContact O-N 2.77Å; A132-N134 PolarHBondContact O-N 2.97Å; N134-R218 VanDerWaalsContact O-CD 3.3Å; N134-R218 WeakPolarHBondContact O-CD 3.27Å; N134-R218 PolarHBondContact O-NH1 2.88Å
135	L	67	Low	63.2	Low	89 Å²	89	75.8 Å²	75.8	47%	0.466	40%	0.401	S	S	.	.	H	α-helix	trans	-82.9	-23.6	-178.7	-90.9	135.1	0	0	0	114	R217 R218	L135-R217 WeakPolarHBondContact O-CA 3.25Å; L135-R218 PolarHBondContact O-N 3.02Å
136	Y	75.9	Confident	65.7	Low	95 Å²	95	70.7 Å²	70.7	37%	0.373	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	130.9	-172.4	-64.6	-91.9	0	0	0	111.6	R215 C216 R217	Y136-R215 HydrophobicContact CD1-CB 4.15Å; Y136-R215 HydrophobicContact CG-CB 4.32Å; Y136-C216 CarbonylContact C-O 3.57Å; Y136-C216 VanDerWaalsContact CA-O 3.29Å; Y136-C216 WeakPolarHBondContact CA-O 3.24Å; Y136-R217 VanDerWaalsContact CD1-CA 3.5Å; Y136-R217 HydrophobicContact CD1-CB 3.87Å; Y136-R217 HydrophobicContact CD1-CG 4.32Å; Y136-R217 HydrophobicContact CE1-CB 3.61Å; Y136-R217 HydrophobicContact CE1-CG 3.86Å
137	W	87.9	Confident	67.8	Low	46 Å²	46	71.8 Å²	71.8	17%	0.174	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	134.2	163.2	-63.5	116.4	0	0	0	110.1	A139 E166 A180 N182 R215 C216 R218	W137-A139 PolarHBondContact O-N 2.93Å; W137-E166 HydrophobicContact CD2-CB 3.93Å; W137-E166 HydrophobicContact CD2-CG 3.76Å; W137-E166 HydrophobicContact CE3-CB 4.44Å; W137-E166 HydrophobicContact CE3-CG 3.78Å; W137-E166 HydrophobicContact CG-CB 4.2Å; W137-E166 HydrophobicContact CG-CG 4.5Å; W137-E166 HydrophobicContact CH2-CG 3.68Å; W137-E166 WeakPolarHBondContact CH2-OE1 3.37Å; W137-E166 HydrophobicContact CZ2-CB 4.15Å; W137-E166 VanDerWaalsContact CZ2-CD 3.43Å; W137-E166 HydrophobicContact CZ2-CG 3.69Å; W137-E166 WeakPolarHBondContact CZ2-OE2 3.32Å; W137-E166 HydrophobicContact CZ3-CG 3.73Å; W137-A180 HydrophobicContact CB-CB 3.79Å; W137-A180 HydrophobicContact CG-CB 4.4Å; W137-N182 HydrophobicContact CE3-CB 4.46Å; W137-N182 VanDerWaalsContact CZ3-CA 3.42Å; W137-N182 HydrophobicContact CZ3-CB 3.86Å; W137-R215 CarbonylContact O-C 3.59Å; W137-R215 WeakPolarHBondContact O-CA 3.24Å; W137-C216 PolarHBondContact N-O 2.77Å; W137-C216 PolarHBondContact O-N 3.46Å; W137-R218 HydrophobicContact CD2-CG 4.28Å; W137-R218 VanDerWaalsContact CD2-NE 3.26Å; W137-R218 HydrophobicContact CG-CG 4.14Å; W137-R218 VanDerWaalsContact CZ2-NE 3.34Å
138	P	90.2	Very high	69.8	Low	22 Å²	22	74.3 Å²	74.3	14%	0.143	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	131.6	166.4	25.5	-31.1	0	0	0	109.7	F181 S183 L184 A187	P138-F181 WeakPolarHBondContact CD-O 3.26Å; P138-F181 PolarHBondContact O-N 3.46Å; P138-S183 VanDerWaalsContact CG-C 3.43Å; P138-L184 HydrophobicContact CB-CB 4.32Å; P138-L184 HydrophobicContact CB-CD1 3.92Å; P138-L184 HydrophobicContact CG-CB 4.32Å; P138-A187 HydrophobicContact CB-CB 4.15Å
139	A	92.6	Very high	72.2	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	163.9	-172.4	0	0	0	0	0	112.4	W137 I179 A180 A214 C216	W137-A139 PolarHBondContact O-N 2.93Å; A139-I179 CarbonylContact C-O 3.53Å; A139-I179 WeakPolarHBondContact CA-O 3.45Å; A139-I179 WeakPolarHBondContact CB-O 3.47Å; A139-A180 HydrophobicContact CB-CB 4.15Å; A139-A214 HydrophobicContact CB-CB 4.21Å; A139-A214 PolarHBondContact N-O 3.02Å; A139-A214 CarbonylContact O-C 3.56Å; A139-A214 PolarHBondContact O-N 3.38Å; A139-A214 VanDerWaalsContact O-O 3.05Å; A139-C216 HydrophobicContact CB-CB 4.25Å
140	V	93.1	Very high	74.6	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	126.5	170.9	-178.3	0	0	0	0	108.2	L142 Y178 I179 F181 A187 A190 K191 F211 T212 M213	V140-L142 HydrophobicContact CG1-CD2 4.24Å; V140-Y178 WeakPolarHBondContact O-CA 3.33Å; V140-I179 PolarHBondContact N-O 2.82Å; V140-I179 PolarHBondContact O-N 2.7Å; V140-F181 HydrophobicContact CG2-CD2 4.48Å; V140-F181 HydrophobicContact CG2-CE2 4.04Å; V140-A187 HydrophobicContact CG2-CB 4.19Å; V140-A187 WeakPolarHBondContact CG2-O 3.41Å; V140-A190 HydrophobicContact CG2-CB 4.08Å; V140-K191 HydrophobicContact CG2-CB 4.38Å; V140-F211 HydrophobicContact CG1-CB 4.4Å; V140-F211 HydrophobicContact CG1-CD1 3.91Å; V140-T212 CarbonylContact C-O 3.59Å; V140-T212 WeakPolarHBondContact CA-O 3.04Å; V140-M213 HydrophobicContact CG2-SD 4.33Å
141	K	93.7	Very high	76.8	Confident	63 Å²	63	60.3 Å²	60.3	27%	0.274	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	122.7	171.2	-179.7	-170.6	-176.5	-177	0	109.1	S143 A177 Y178 T212 A214	K141-S143 VanDerWaalsContact CE-OG 3.31Å; K141-S143 WeakPolarHBondContact CE-OG 3.37Å; K141-A177 CarbonylContact C-O 3.48Å; K141-A177 WeakPolarHBondContact CA-O 3.46Å; K141-Y178 HydrophobicContact CB-CD1 3.82Å; K141-Y178 HydrophobicContact CB-CE1 3.7Å; K141-Y178 HydrophobicContact CD-CE1 3.73Å; K141-Y178 HydrophobicContact CD-CE2 4.44Å; K141-Y178 WeakPolarHBondContact CD-OH 3.27Å; K141-Y178 VanDerWaalsContact CE-OH 3.26Å; K141-Y178 WeakPolarHBondContact CE-OH 3.46Å; K141-Y178 HydrophobicContact CG-CD1 4.05Å; K141-Y178 HydrophobicContact CG-CE1 3.63Å; K141-Y178 HydrophobicContact CG-CE2 4.23Å; K141-T212 PolarHBondContact N-O 2.89Å; K141-T212 PolarHBondContact O-N 3.13Å; K141-T212 PolarHBondContact O-OG1 3.41Å; K141-A214 HydrophobicContact CB-CB 4.11Å
142	L	91.4	Very high	79.3	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	122.8	166.6	-52.8	-178.2	0	0	0	107.6	V140 L145 L155 F159 A176 A177 I179 V209 L210 F211	V140-L142 HydrophobicContact CG1-CD2 4.24Å; L142-L145 HydrophobicContact CB-CB 4.5Å; L142-L145 HydrophobicContact CB-CD2 4.49Å; L142-L145 HydrophobicContact CD1-CD1 4.33Å; L142-L145 HydrophobicContact CD1-CD2 4.23Å; L142-L155 HydrophobicContact CD1-CD2 3.7Å; L142-F159 HydrophobicContact CD1-CE2 3.59Å; L142-F159 HydrophobicContact CD1-CZ 3.72Å; L142-F159 HydrophobicContact CD2-CZ 3.89Å; L142-F159 HydrophobicContact CG-CZ 4.32Å; L142-A176 CarbonylContact O-C 3.59Å; L142-A176 WeakPolarHBondContact O-CA 3.01Å; L142-A176 WeakPolarHBondContact O-CB 3.35Å; L142-A177 PolarHBondContact N-O 2.93Å; L142-A177 PolarHBondContact O-N 3.46Å; L142-I179 HydrophobicContact CD1-CD1 3.48Å; L142-I179 VanDerWaalsContact CD1-CD1 3.48Å; L142-I179 HydrophobicContact CD2-CD1 4.38Å; L142-I179 HydrophobicContact CG-CD1 3.68Å; L142-V209 HydrophobicContact CB-CG1 3.95Å; L142-V209 HydrophobicContact CD2-CG1 4.28Å; L142-L210 WeakPolarHBondContact CA-O 3.4Å; L142-F211 HydrophobicContact CD2-CD1 3.39Å; L142-F211 HydrophobicContact CD2-CD2 4.07Å; L142-F211 HydrophobicContact CD2-CE1 3.3Å; L142-F211 HydrophobicContact CD2-CE2 3.97Å; L142-F211 HydrophobicContact CD2-CG 3.8Å; L142-F211 HydrophobicContact CD2-CZ 3.6Å
143	S	84.8	Confident	81.7	Confident	26 Å²	26	62.7 Å²	62.7	18%	0.182	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	149.5	174.9	-46.3	0	0	0	0	109.3	K141 L145 D175 V209 L210	K141-S143 VanDerWaalsContact CE-OG 3.31Å; K141-S143 WeakPolarHBondContact CE-OG 3.37Å; S143-L145 VanDerWaalsContact C-N 3.29Å; S143-D175 CarbonylContact C-O 3.54Å; S143-V209 WeakPolarHBondContact O-CA 3.32Å; S143-L210 PolarHBondContact N-O 3.46Å; S143-L210 PolarHBondContact O-N 3.41Å
144	R	83.3	Confident	83.8	Confident	163 Å²	163	61.6 Å²	61.6	62%	0.615	30%	0.301	S	S	*	.	S	Bend	trans	63.1	35.1	-171.6	-49.7	179.6	179.2	176	-2.9	112.7	P146 D175 L210	R144-P146 WeakPolarHBondContact O-CD 3.46Å; R144-D175 CarbonylContact C-O 3.57Å; R144-D175 WeakPolarHBondContact CA-O 3.29Å; R144-D175 PolarHBondContact N-O 3.34Å; R144-L210 HydrophobicContact CG-CD1 4.48Å
145	L	83.9	Confident	85.5	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.276	C	S	.	.			trans	-81.4	113.7	176	-174	69.3	0	0	0	108.8	L142 S143 N150 L155 D175 A177 L205 V209	L142-L145 HydrophobicContact CB-CB 4.5Å; L142-L145 HydrophobicContact CB-CD2 4.49Å; L142-L145 HydrophobicContact CD1-CD1 4.33Å; L142-L145 HydrophobicContact CD1-CD2 4.23Å; S143-L145 VanDerWaalsContact C-N 3.29Å; L145-N150 HydrophobicContact CD2-CB 3.83Å; L145-N150 HydrophobicContact CG-CB 4.22Å; L145-L155 HydrophobicContact CD2-CD1 4.14Å; L145-L155 HydrophobicContact CD2-CD2 4.01Å; L145-D175 PolarHBondContact N-O 2.86Å; L145-A177 HydrophobicContact CD2-CB 3.71Å; L145-L205 HydrophobicContact CD1-CD2 3.37Å; L145-V209 HydrophobicContact CD1-CG1 4.26Å; L145-V209 HydrophobicContact CD1-CG2 4.07Å
146	P	80.2	Confident	86.7	Confident	42 Å²	42	56.1 Å²	56.1	27%	0.273	27%	0.271	S	S	.	.			trans	-60.3	150.4	178.4	-17.8	29.6	0	0	0	111.3	R144 E148 Y149 N150 P206	R144-P146 WeakPolarHBondContact O-CD 3.46Å; P146-E148 PolarHBondContact O-N 3.2Å; P146-E148 VanDerWaalsContact O-N 3.1Å; P146-Y149 HydrophobicContact CB-CD2 3.96Å; P146-Y149 HydrophobicContact CB-CE2 4.48Å; P146-Y149 HydrophobicContact CG-CD2 3.93Å; P146-Y149 HydrophobicContact CG-CE2 4.3Å; P146-Y149 PolarHBondContact O-N 2.89Å; P146-N150 PolarHBondContact O-N 3.1Å; P146-N150 VanDerWaalsContact O-N 3.16Å; P146-P206 HydrophobicContact CG-CG 3.88Å
147	I	78.7	Confident	87.2	Confident	113 Å²	113	57.3 Å²	57.3	58%	0.579	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-33.3	-172.1	-119.5	161.5	0	0	0	112.9	Y149 N150 P172	I147-Y149 VanDerWaalsContact C-N 3.27Å; I147-Y149 PolarHBondContact O-N 3.45Å; I147-N150 PolarHBondContact O-N 2.91Å; I147-N150 VanDerWaalsContact O-N 3.13Å; I147-P172 HydrophobicContact CD1-CB 4.24Å; I147-P172 HydrophobicContact CG1-CB 3.91Å
148	E	80.4	Confident	87.1	Confident	156 Å²	156	55.2 Å²	55.2	73%	0.729	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-36.2	178	-57.2	174.5	-146.9	0	0	112.5	P146	P146-E148 PolarHBondContact O-N 3.2Å; P146-E148 VanDerWaalsContact O-N 3.1Å
149	Y	84	Confident	87.2	Confident	50 Å²	50	54.2 Å²	54.2	20%	0.196	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-13.4	179	-58.6	-80.9	0	0	0	112.7	P146 I147 T151 F154 I203 L205 P206	P146-Y149 HydrophobicContact CB-CD2 3.96Å; P146-Y149 HydrophobicContact CB-CE2 4.48Å; P146-Y149 HydrophobicContact CG-CD2 3.93Å; P146-Y149 HydrophobicContact CG-CE2 4.3Å; P146-Y149 PolarHBondContact O-N 2.89Å; I147-Y149 VanDerWaalsContact C-N 3.27Å; I147-Y149 PolarHBondContact O-N 3.45Å; Y149-T151 PolarHBondContact O-N 3.48Å; Y149-F154 HydrophobicContact CD1-CD1 4.2Å; Y149-F154 HydrophobicContact CD1-CD2 4.47Å; Y149-F154 AromaticContact CD1-CE1 3.65Å; Y149-F154 HydrophobicContact CD1-CE1 3.65Å; Y149-F154 AromaticContact CD1-CE2 3.95Å; Y149-F154 HydrophobicContact CD1-CE2 3.95Å; Y149-F154 AromaticContact CD1-CZ 3.52Å; Y149-F154 HydrophobicContact CD1-CZ 3.52Å; Y149-F154 HydrophobicContact CE1-CE2 4.38Å; Y149-F154 HydrophobicContact CE1-CZ 4.12Å; Y149-F154 HydrophobicContact CG-CE1 4.32Å; Y149-F154 WeakPolarHBondContact O-CD1 3.49Å; Y149-I203 HydrophobicContact CE1-CG2 3.65Å; Y149-L205 HydrophobicContact CG-CD2 4.46Å; Y149-P206 HydrophobicContact CD2-CG 4.37Å; Y149-P206 HydrophobicContact CE2-CG 4Å
150	N	87.1	Confident	87.1	Confident	7 Å²	7	60 Å²	60	4%	0.037	29%	0.292	C	S	.	.			trans	-83.4	41.2	-178.6	-155.8	-13.2	0	0	0	112.5	L145 P146 I147 C170 Q171 P172 A176	L145-N150 HydrophobicContact CD2-CB 3.83Å; L145-N150 HydrophobicContact CG-CB 4.22Å; P146-N150 PolarHBondContact O-N 3.1Å; P146-N150 VanDerWaalsContact O-N 3.16Å; I147-N150 PolarHBondContact O-N 2.91Å; I147-N150 VanDerWaalsContact O-N 3.13Å; N150-C170 WeakPolarHBondContact OD1-CA 3.37Å; N150-C170 VanDerWaalsContact OD1-CB 3.24Å; N150-C170 WeakPolarHBondContact OD1-CB 3.4Å; N150-Q171 PolarHBondContact ND2-O 2.85Å; N150-P172 WeakPolarHBondContact ND2-CA 3.34Å; N150-A176 PolarHBondContact ND2-O 3.32Å
151	T	86.8	Confident	86.7	Confident	59 Å²	59	62.4 Å²	62.4	36%	0.362	31%	0.308	S	S	.	.			trans	-108.5	138.5	176.4	56.7	0	0	0	0	110.2	Y149 S153 F154 L155	Y149-T151 PolarHBondContact O-N 3.48Å; T151-S153 PolarHBondContact O-N 3.38Å; T151-F154 PolarHBondContact O-N 3.12Å; T151-F154 VanDerWaalsContact OG1-CB 3.25Å; T151-F154 WeakPolarHBondContact OG1-CB 3.42Å; T151-L155 WeakPolarHBondContact O-CG 3.33Å; T151-L155 PolarHBondContact O-N 3.41Å
152	K	89.1	Confident	86.5	Confident	141 Å²	141	59.9 Å²	59.9	61%	0.613	30%	0.297	S	S	*	.	H	α-helix	trans	-59.7	-34.7	-177	-169.4	178.9	179.3	-174.5	0	112.2	L156 I168	K152-L156 WeakPolarHBondContact O-CB 3.32Å; K152-L156 PolarHBondContact O-N 3.26Å; K152-I168 HydrophobicContact CG-CB 4.25Å; K152-I168 HydrophobicContact CG-CD1 4.5Å; K152-I168 HydrophobicContact CG-CG2 4.4Å
153	S	86.6	Confident	86.3	Confident	90 Å²	90	60.5 Å²	60.5	63%	0.629	30%	0.304	S	S	*	.	H	α-helix	trans	-66.4	-48.4	177.8	48.5	0	0	0	0	112.6	T151 K157	T151-S153 PolarHBondContact O-N 3.38Å; S153-K157 WeakPolarHBondContact O-CB 3.39Å; S153-K157 PolarHBondContact O-N 3.5Å; S153-K157 VanDerWaalsContact O-N 3.1Å
154	F	88.4	Confident	86.5	Confident	33 Å²	33	62.5 Å²	62.5	15%	0.145	32%	0.316	C	S	.	.	H	α-helix	trans	-61	-52.2	176.7	175.3	-95.2	0	0	0	111	Y149 T151 L156 K157 H158 I203 L205	Y149-F154 HydrophobicContact CD1-CD1 4.2Å; Y149-F154 HydrophobicContact CD1-CD2 4.47Å; Y149-F154 AromaticContact CD1-CE1 3.65Å; Y149-F154 HydrophobicContact CD1-CE1 3.65Å; Y149-F154 AromaticContact CD1-CE2 3.95Å; Y149-F154 HydrophobicContact CD1-CE2 3.95Å; Y149-F154 AromaticContact CD1-CZ 3.52Å; Y149-F154 HydrophobicContact CD1-CZ 3.52Å; Y149-F154 HydrophobicContact CE1-CE2 4.38Å; Y149-F154 HydrophobicContact CE1-CZ 4.12Å; Y149-F154 HydrophobicContact CG-CE1 4.32Å; Y149-F154 WeakPolarHBondContact O-CD1 3.49Å; T151-F154 PolarHBondContact O-N 3.12Å; T151-F154 VanDerWaalsContact OG1-CB 3.25Å; T151-F154 WeakPolarHBondContact OG1-CB 3.42Å; F154-L156 VanDerWaalsContact C-N 3.33Å; F154-L156 PolarHBondContact O-N 3.18Å; F154-K157 PolarHBondContact O-N 3.47Å; F154-H158 HydrophobicContact CE1-CB 4.42Å; F154-H158 HydrophobicContact CZ-CB 4.48Å; F154-H158 WeakPolarHBondContact O-CB 3.32Å; F154-H158 PolarHBondContact O-N 3.08Å; F154-I203 HydrophobicContact CE2-CB 4.27Å; F154-L205 HydrophobicContact CE1-CD2 4.06Å; F154-L205 HydrophobicContact CE1-CG 4.28Å; F154-L205 HydrophobicContact CZ-CG 4.42Å
155	L	91.1	Very high	86.9	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-63.1	-37.8	-177.8	-67.3	175.3	0	0	0	112.4	L142 L145 T151 F159 I168 A177 I179	L142-L155 HydrophobicContact CD1-CD2 3.7Å; L145-L155 HydrophobicContact CD2-CD1 4.14Å; L145-L155 HydrophobicContact CD2-CD2 4.01Å; T151-L155 WeakPolarHBondContact O-CG 3.33Å; T151-L155 PolarHBondContact O-N 3.41Å; L155-F159 HydrophobicContact CD2-CD2 4.21Å; L155-F159 HydrophobicContact CD2-CE2 3.9Å; L155-F159 WeakPolarHBondContact O-CB 3.47Å; L155-F159 WeakPolarHBondContact O-CD2 3.4Å; L155-F159 PolarHBondContact O-N 3.43Å; L155-I168 HydrophobicContact CB-CD1 4.09Å; L155-I168 HydrophobicContact CB-CG2 4.15Å; L155-I168 HydrophobicContact CD1-CG2 3.94Å; L155-A177 HydrophobicContact CD1-CB 3.44Å; L155-A177 VanDerWaalsContact CD1-CB 3.44Å; L155-I179 HydrophobicContact CD2-CD1 4.48Å
156	L	90.9	Very high	87.3	Confident	72 Å²	72	60.3 Å²	60.3	38%	0.377	32%	0.315	S	S	.	.	H	α-helix	trans	-63.7	-50.7	175.9	-171.9	73.1	0	0	0	110.8	K152 F154 H158 F159 Q160 V165 I168	K152-L156 WeakPolarHBondContact O-CB 3.32Å; K152-L156 PolarHBondContact O-N 3.26Å; F154-L156 VanDerWaalsContact C-N 3.33Å; F154-L156 PolarHBondContact O-N 3.18Å; L156-H158 VanDerWaalsContact C-N 3.33Å; L156-H158 PolarHBondContact O-N 3.49Å; L156-F159 PolarHBondContact O-N 2.71Å; L156-Q160 WeakPolarHBondContact O-CB 3.49Å; L156-Q160 PolarHBondContact O-N 3.45Å; L156-V165 HydrophobicContact CD1-CB 4.07Å; L156-V165 HydrophobicContact CD1-CG1 4.12Å; L156-I168 VanDerWaalsContact CA-CD1 3.47Å; L156-I168 HydrophobicContact CB-CD1 3.64Å; L156-I168 HydrophobicContact CD1-CD1 3.8Å; L156-I168 HydrophobicContact CG-CD1 4.36Å
157	K	86.3	Confident	87.9	Confident	121 Å²	121	62.4 Å²	62.4	53%	0.526	32%	0.317	S	S	.	.	H	α-helix	trans	-61.2	-41.9	-178.8	-169.3	179.6	178.6	-171.5	0	111.9	S153 F154 S200	S153-K157 WeakPolarHBondContact O-CB 3.39Å; S153-K157 PolarHBondContact O-N 3.5Å; S153-K157 VanDerWaalsContact O-N 3.1Å; F154-K157 PolarHBondContact O-N 3.47Å; K157-S200 WeakPolarHBondContact CE-O 3.34Å; K157-S200 PolarHBondContact NZ-O 3.21Å; K157-S200 VanDerWaalsContact NZ-O 3.13Å
158	H	86.8	Confident	88.6	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.009	29%	0.294	C	S	.	.	H	α-helix	trans	-68	-48.2	179.4	-167.8	75.2	0	0	0	112.1	F154 L156 S161 G194	F154-H158 HydrophobicContact CE1-CB 4.42Å; F154-H158 HydrophobicContact CZ-CB 4.48Å; F154-H158 WeakPolarHBondContact O-CB 3.32Å; F154-H158 PolarHBondContact O-N 3.08Å; L156-H158 VanDerWaalsContact C-N 3.33Å; L156-H158 PolarHBondContact O-N 3.49Å; H158-S161 PolarHBondContact O-OG 2.87Å; H158-G194 PolarHBondContact NE2-O 3.16Å
159	F	92.3	Very high	89.1	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-89.2	-17	-170	-76	-80.7	0	0	0	115.7	L142 L155 L156 S161 F162 V165 I179 F181 A190 L205 F211	L142-F159 HydrophobicContact CD1-CE2 3.59Å; L142-F159 HydrophobicContact CD1-CZ 3.72Å; L142-F159 HydrophobicContact CD2-CZ 3.89Å; L142-F159 HydrophobicContact CG-CZ 4.32Å; L155-F159 HydrophobicContact CD2-CD2 4.21Å; L155-F159 HydrophobicContact CD2-CE2 3.9Å; L155-F159 WeakPolarHBondContact O-CB 3.47Å; L155-F159 WeakPolarHBondContact O-CD2 3.4Å; L155-F159 PolarHBondContact O-N 3.43Å; L156-F159 PolarHBondContact O-N 2.71Å; F159-S161 PolarHBondContact O-N 3.16Å; F159-S161 VanDerWaalsContact O-N 3.16Å; F159-F162 HydrophobicContact CB-CD2 4.48Å; F159-F162 AromaticContact CD1-CD2 3.78Å; F159-F162 HydrophobicContact CD1-CD2 3.78Å; F159-F162 HydrophobicContact CD1-CE2 4.01Å; F159-F162 HydrophobicContact CE1-CD2 4.46Å; F159-F162 HydrophobicContact CE1-CE2 4.36Å; F159-F162 HydrophobicContact CG-CD2 4.48Å; F159-F162 PolarHBondContact O-N 2.99Å; F159-F162 VanDerWaalsContact O-N 3.1Å; F159-V165 HydrophobicContact CB-CG2 4.14Å; F159-I179 HydrophobicContact CB-CG2 3.89Å; F159-I179 HydrophobicContact CD1-CD1 4.38Å; F159-I179 HydrophobicContact CD2-CD1 3.63Å; F159-I179 HydrophobicContact CD2-CG1 3.93Å; F159-I179 HydrophobicContact CE1-CD1 4.31Å; F159-I179 HydrophobicContact CE2-CD1 3.58Å; F159-I179 HydrophobicContact CE2-CG1 4.38Å; F159-I179 HydrophobicContact CG-CD1 4.06Å; F159-I179 HydrophobicContact CG-CG1 4.15Å; F159-I179 HydrophobicContact CG-CG2 4.2Å; F159-I179 HydrophobicContact CZ-CD1 3.94Å; F159-F181 HydrophobicContact CB-CZ 4.04Å; F159-F181 HydrophobicContact CD1-CZ 4.06Å; F159-F181 HydrophobicContact CG-CZ 4.45Å; F159-A190 HydrophobicContact CD1-CB 3.93Å; F159-A190 HydrophobicContact CE1-CB 4.19Å; F159-L205 HydrophobicContact CE2-CD1 4.18Å; F159-L205 HydrophobicContact CZ-CD1 4.09Å; F159-F211 AromaticContact CE1-CE1 3.84Å; F159-F211 HydrophobicContact CE1-CE1 3.84Å; F159-F211 AromaticContact CZ-CE1 3.68Å; F159-F211 HydrophobicContact CZ-CE1 3.68Å; F159-F211 HydrophobicContact CZ-CZ 4.19Å
160	Q	90.2	Very high	89.4	Confident	123 Å²	123	52.8 Å²	52.8	58%	0.575	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-61.1	-23.1	176.8	-174.8	173.3	13.4	0	0	113	L156 F162 G163	L156-Q160 WeakPolarHBondContact O-CB 3.49Å; L156-Q160 PolarHBondContact O-N 3.45Å; Q160-F162 VanDerWaalsContact C-N 3.33Å; Q160-F162 PolarHBondContact O-N 3.14Å; Q160-G163 CarbonylContact C-O 3.56Å; Q160-G163 WeakPolarHBondContact CA-O 3.46Å; Q160-G163 PolarHBondContact O-N 3.2Å; Q160-G163 VanDerWaalsContact O-O 3.12Å
161	S	85.4	Confident	89.4	Confident	49 Å²	49	56 Å²	56	34%	0.343	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-66	-27.8	175	61.7	0	0	0	0	114.4	H158 F159 I198	H158-S161 PolarHBondContact O-OG 2.87Å; F159-S161 PolarHBondContact O-N 3.16Å; F159-S161 VanDerWaalsContact O-N 3.16Å; S161-I198 VanDerWaalsContact CB-CD1 3.45Å; S161-I198 WeakPolarHBondContact OG-CD1 3.44Å
162	F	89	Confident	89	Confident	10 Å²	10	55.9 Å²	55.9	4%	0.044	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-87	-12.4	178.2	-54.1	-74.8	0	0	0	112.7	F159 Q160 F181 S186 R189 A190 S193 I198	F159-F162 HydrophobicContact CB-CD2 4.48Å; F159-F162 AromaticContact CD1-CD2 3.78Å; F159-F162 HydrophobicContact CD1-CD2 3.78Å; F159-F162 HydrophobicContact CD1-CE2 4.01Å; F159-F162 HydrophobicContact CE1-CD2 4.46Å; F159-F162 HydrophobicContact CE1-CE2 4.36Å; F159-F162 HydrophobicContact CG-CD2 4.48Å; F159-F162 PolarHBondContact O-N 2.99Å; F159-F162 VanDerWaalsContact O-N 3.1Å; Q160-F162 VanDerWaalsContact C-N 3.33Å; Q160-F162 PolarHBondContact O-N 3.14Å; F162-F181 HydrophobicContact CB-CE1 4.35Å; F162-S186 WeakPolarHBondContact O-CB 3.5Å; F162-S186 PolarHBondContact O-OG 2.98Å; F162-R189 HydrophobicContact CD1-CG 4.26Å; F162-A190 HydrophobicContact CB-CB 3.87Å; F162-A190 HydrophobicContact CD2-CB 4.08Å; F162-A190 HydrophobicContact CG-CB 3.99Å; F162-S193 VanDerWaalsContact CE1-O 3.26Å; F162-S193 WeakPolarHBondContact CE1-O 3.13Å; F162-S193 VanDerWaalsContact CE1-OG 3.3Å; F162-S193 WeakPolarHBondContact CE1-OG 3.44Å; F162-S193 VanDerWaalsContact CZ-O 3.25Å; F162-S193 WeakPolarHBondContact CZ-O 3.14Å; F162-I198 HydrophobicContact CD1-CD1 4.24Å; F162-I198 HydrophobicContact CE1-CD1 3.48Å; F162-I198 VanDerWaalsContact CE1-CD1 3.48Å; F162-I198 HydrophobicContact CE2-CD1 3.8Å; F162-I198 HydrophobicContact CZ-CD1 3.2Å; F162-I198 HydrophobicContact CZ-CG1 4.33Å
163	G	88.1	Confident	88	Confident	14 Å²	14	54.6 Å²	54.6	14%	0.144	30%	0.301	C	S	.	.	S	Bend	trans	151.7	178.1	175.8	0	0	0	0	0	112.9	Q160 V165	Q160-G163 CarbonylContact C-O 3.56Å; Q160-G163 WeakPolarHBondContact CA-O 3.46Å; Q160-G163 PolarHBondContact O-N 3.2Å; Q160-G163 VanDerWaalsContact O-O 3.12Å; G163-V165 PolarHBondContact O-N 2.98Å
164	P	89	Confident	87.3	Confident	67 Å²	67	56.4 Å²	56.4	44%	0.435	30%	0.301	S	S	.	.			trans	-64.7	119.5	-178.6	-20.2	34.3	0	0	0	111.1	F181 N182	P164-F181 WeakPolarHBondContact O-CA 3.42Å; P164-N182 HydrophobicContact CB-CB 4.43Å; P164-N182 VanDerWaalsContact CG-ND2 3.35Å; P164-N182 WeakPolarHBondContact CG-ND2 3.39Å; P164-N182 PolarHBondContact O-N 3.38Å
165	V	91	Very high	87	Confident	27 Å²	27	58.7 Å²	58.7	16%	0.164	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	118.7	178.1	178.3	0	0	0	0	109.2	L156 F159 G163 I168 I179 A180 F181	L156-V165 HydrophobicContact CD1-CB 4.07Å; L156-V165 HydrophobicContact CD1-CG1 4.12Å; F159-V165 HydrophobicContact CB-CG2 4.14Å; G163-V165 PolarHBondContact O-N 2.98Å; V165-I168 HydrophobicContact CG1-CD1 3.94Å; V165-I168 HydrophobicContact CG1-CG1 3.55Å; V165-I179 HydrophobicContact CB-CG2 4.46Å; V165-I179 HydrophobicContact CG1-CG2 3.7Å; V165-I179 HydrophobicContact CG2-CG2 3.9Å; V165-A180 CarbonylContact C-O 3.56Å; V165-A180 WeakPolarHBondContact CA-O 3.29Å; V165-F181 HydrophobicContact CG2-CD1 4.18Å; V165-F181 HydrophobicContact CG2-CE1 3.74Å; V165-F181 HydrophobicContact CG2-CZ 4.31Å
166	E	92.6	Very high	86.9	Confident	91 Å²	91	58.9 Å²	58.9	43%	0.425	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	-34.7	-176.9	-70	-72.7	168.1	0	0	112.1	W137 A180 N182	W137-E166 HydrophobicContact CD2-CB 3.93Å; W137-E166 HydrophobicContact CD2-CG 3.76Å; W137-E166 HydrophobicContact CE3-CB 4.44Å; W137-E166 HydrophobicContact CE3-CG 3.78Å; W137-E166 HydrophobicContact CG-CB 4.2Å; W137-E166 HydrophobicContact CG-CG 4.5Å; W137-E166 HydrophobicContact CH2-CG 3.68Å; W137-E166 WeakPolarHBondContact CH2-OE1 3.37Å; W137-E166 HydrophobicContact CZ2-CB 4.15Å; W137-E166 VanDerWaalsContact CZ2-CD 3.43Å; W137-E166 HydrophobicContact CZ2-CG 3.69Å; W137-E166 WeakPolarHBondContact CZ2-OE2 3.32Å; W137-E166 HydrophobicContact CZ3-CG 3.73Å; E166-A180 PolarHBondContact N-O 3.37Å; E166-N182 HydrophobicContact CG-CB 3.9Å; E166-N182 WeakPolarHBondContact OE1-CB 3.49Å
167	R	91.7	Very high	87	Confident	86 Å²	86	55.4 Å²	55.4	33%	0.325	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	141.1	-177.4	-166.1	176.4	-177.9	149.8	10	111	I169 A180	R167-I169 HydrophobicContact CG-CG1 4.29Å; R167-A180 HydrophobicContact CB-CB 3.94Å; R167-A180 PolarHBondContact N-O 3.13Å; R167-A180 WeakPolarHBondContact O-CB 3.46Å; R167-A180 PolarHBondContact O-N 3.06Å
168	I	93.3	Very high	87.4	Confident	17 Å²	17	52.2 Å²	52.2	9%	0.087	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	128.6	170.1	-58.2	176.5	0	0	0	107.6	K152 L155 L156 V165 Y178 I179	K152-I168 HydrophobicContact CG-CB 4.25Å; K152-I168 HydrophobicContact CG-CD1 4.5Å; K152-I168 HydrophobicContact CG-CG2 4.4Å; L155-I168 HydrophobicContact CB-CD1 4.09Å; L155-I168 HydrophobicContact CB-CG2 4.15Å; L155-I168 HydrophobicContact CD1-CG2 3.94Å; L156-I168 VanDerWaalsContact CA-CD1 3.47Å; L156-I168 HydrophobicContact CB-CD1 3.64Å; L156-I168 HydrophobicContact CD1-CD1 3.8Å; L156-I168 HydrophobicContact CG-CD1 4.36Å; V165-I168 HydrophobicContact CG1-CD1 3.94Å; V165-I168 HydrophobicContact CG1-CG1 3.55Å; I168-Y178 CarbonylContact C-O 3.57Å; I168-Y178 WeakPolarHBondContact CA-O 3.42Å; I168-I179 HydrophobicContact CG1-CG2 4.48Å
169	I	92.3	Very high	87.8	Confident	57 Å²	57	52.1 Å²	52.1	29%	0.292	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	107.5	173.8	-53.9	173.8	0	0	0	107	R167 Q171 A177 Y178	R167-I169 HydrophobicContact CG-CG1 4.29Å; I169-Q171 HydrophobicContact CG2-CG 4.32Å; I169-A177 CarbonylContact O-C 3.57Å; I169-A177 VanDerWaalsContact O-CA 3.28Å; I169-A177 WeakPolarHBondContact O-CA 3.31Å; I169-Y178 PolarHBondContact N-O 3.4Å; I169-Y178 PolarHBondContact O-N 2.98Å
170	C	90.3	Very high	87.9	Confident	42 Å²	42	52.1 Å²	52.1	28%	0.284	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	131.9	173.1	-63.3	0	0	0	0	109.1	N150	N150-C170 WeakPolarHBondContact OD1-CA 3.37Å; N150-C170 VanDerWaalsContact OD1-CB 3.24Å; N150-C170 WeakPolarHBondContact OD1-CB 3.4Å
171	Q	86.9	Confident	88.1	Confident	74 Å²	74	46.3 Å²	46.3	35%	0.346	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	79.3	172	-67.6	-174.2	-36.2	0	0	109.1	N150 I169 S173 M174 D175 A176	N150-Q171 PolarHBondContact ND2-O 2.85Å; I169-Q171 HydrophobicContact CG2-CG 4.32Å; Q171-S173 PolarHBondContact O-N 2.87Å; Q171-M174 HydrophobicContact CB-CB 4.23Å; Q171-M174 PolarHBondContact O-N 3.11Å; Q171-M174 VanDerWaalsContact O-N 3.11Å; Q171-D175 PolarHBondContact O-N 3.32Å; Q171-A176 CarbonylContact C-O 3.48Å; Q171-A176 WeakPolarHBondContact CA-O 3.42Å; Q171-A176 WeakPolarHBondContact CB-O 3.29Å; Q171-A176 PolarHBondContact N-O 3.37Å; Q171-A176 PolarHBondContact O-N 3.42Å; Q171-A176 VanDerWaalsContact O-O 3.11Å
172	P	77.7	Confident	88.3	Confident	58 Å²	58	47 Å²	47	38%	0.377	26%	0.255	S	S	.	.	G	3₁₀ helix	trans	-58.5	-37.1	-177.7	-22.5	33.2	0	0	0	112.5	I147 N150 M174 D175	I147-P172 HydrophobicContact CD1-CB 4.24Å; I147-P172 HydrophobicContact CG1-CB 3.91Å; N150-P172 WeakPolarHBondContact ND2-CA 3.34Å; P172-M174 PolarHBondContact O-N 3.41Å; P172-M174 VanDerWaalsContact O-N 3.16Å; P172-D175 PolarHBondContact O-N 3.29Å
173	S	69.2	Low	88.2	Confident	114 Å²	114	48.2 Å²	48.2	80%	0.797	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-65.4	-16	179.2	55.6	0	0	0	0	114.9	Q171	Q171-S173 PolarHBondContact O-N 2.87Å
174	M	70.4	Confident	88.3	Confident	127 Å²	127	52.3 Å²	52.3	63%	0.626	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-115	9.3	-179.3	-62.3	-63.7	-62	0	0	112.1	Q171 P172 A176	Q171-M174 HydrophobicContact CB-CB 4.23Å; Q171-M174 PolarHBondContact O-N 3.11Å; Q171-M174 VanDerWaalsContact O-N 3.11Å; P172-M174 PolarHBondContact O-N 3.41Å; P172-M174 VanDerWaalsContact O-N 3.16Å; M174-A176 HydrophobicContact CB-CB 4.31Å; M174-A176 PolarHBondContact O-N 3.32Å; M174-A176 VanDerWaalsContact O-N 3.12Å
175	D	83.7	Confident	88.3	Confident	82 Å²	82	53 Å²	53	44%	0.439	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.6	42.4	-171.1	-60.1	-35.2	0	0	0	112.1	S143 R144 L145 Q171 P172	S143-D175 CarbonylContact C-O 3.54Å; R144-D175 CarbonylContact C-O 3.57Å; R144-D175 WeakPolarHBondContact CA-O 3.29Å; R144-D175 PolarHBondContact N-O 3.34Å; L145-D175 PolarHBondContact N-O 2.86Å; Q171-D175 PolarHBondContact O-N 3.32Å; P172-D175 PolarHBondContact O-N 3.29Å
176	A	88	Confident	88.3	Confident	3 Å²	3	52.4 Å²	52.4	3%	0.025	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	153.8	-173.5	0	0	0	0	0	112.9	L142 N150 Q171 M174	L142-A176 CarbonylContact O-C 3.59Å; L142-A176 WeakPolarHBondContact O-CA 3.01Å; L142-A176 WeakPolarHBondContact O-CB 3.35Å; N150-A176 PolarHBondContact ND2-O 3.32Å; Q171-A176 CarbonylContact C-O 3.48Å; Q171-A176 WeakPolarHBondContact CA-O 3.42Å; Q171-A176 WeakPolarHBondContact CB-O 3.29Å; Q171-A176 PolarHBondContact N-O 3.37Å; Q171-A176 PolarHBondContact O-N 3.42Å; Q171-A176 VanDerWaalsContact O-O 3.11Å; M174-A176 HydrophobicContact CB-CB 4.31Å; M174-A176 PolarHBondContact O-N 3.32Å; M174-A176 VanDerWaalsContact O-N 3.12Å
177	A	92.4	Very high	88.2	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	151.4	171.1	0	0	0	0	0	111.1	K141 L142 L145 L155 I169	K141-A177 CarbonylContact C-O 3.48Å; K141-A177 WeakPolarHBondContact CA-O 3.46Å; L142-A177 PolarHBondContact N-O 2.93Å; L142-A177 PolarHBondContact O-N 3.46Å; L145-A177 HydrophobicContact CD2-CB 3.71Å; L155-A177 HydrophobicContact CD1-CB 3.44Å; L155-A177 VanDerWaalsContact CD1-CB 3.44Å; I169-A177 CarbonylContact O-C 3.57Å; I169-A177 VanDerWaalsContact O-CA 3.28Å; I169-A177 WeakPolarHBondContact O-CA 3.31Å
178	Y	95.7	Very high	88.1	Confident	54 Å²	54	46.9 Å²	46.9	21%	0.212	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.9	177	-63.6	-102.7	0	0	0	109.6	V140 K141 I168 I169 A214	V140-Y178 WeakPolarHBondContact O-CA 3.33Å; K141-Y178 HydrophobicContact CB-CD1 3.82Å; K141-Y178 HydrophobicContact CB-CE1 3.7Å; K141-Y178 HydrophobicContact CD-CE1 3.73Å; K141-Y178 HydrophobicContact CD-CE2 4.44Å; K141-Y178 WeakPolarHBondContact CD-OH 3.27Å; K141-Y178 VanDerWaalsContact CE-OH 3.26Å; K141-Y178 WeakPolarHBondContact CE-OH 3.46Å; K141-Y178 HydrophobicContact CG-CD1 4.05Å; K141-Y178 HydrophobicContact CG-CE1 3.63Å; K141-Y178 HydrophobicContact CG-CE2 4.23Å; I168-Y178 CarbonylContact C-O 3.57Å; I168-Y178 WeakPolarHBondContact CA-O 3.42Å; I169-Y178 PolarHBondContact N-O 3.4Å; I169-Y178 PolarHBondContact O-N 2.98Å; Y178-A214 HydrophobicContact CD1-CB 3.94Å; Y178-A214 HydrophobicContact CE1-CB 4.09Å
179	I	94.5	Very high	87.8	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	112.7	175.6	-56.4	108.8	0	0	0	109	A139 V140 L142 L155 F159 V165 I168 F181	A139-I179 CarbonylContact C-O 3.53Å; A139-I179 WeakPolarHBondContact CA-O 3.45Å; A139-I179 WeakPolarHBondContact CB-O 3.47Å; V140-I179 PolarHBondContact N-O 2.82Å; V140-I179 PolarHBondContact O-N 2.7Å; L142-I179 HydrophobicContact CD1-CD1 3.48Å; L142-I179 VanDerWaalsContact CD1-CD1 3.48Å; L142-I179 HydrophobicContact CD2-CD1 4.38Å; L142-I179 HydrophobicContact CG-CD1 3.68Å; L155-I179 HydrophobicContact CD2-CD1 4.48Å; F159-I179 HydrophobicContact CB-CG2 3.89Å; F159-I179 HydrophobicContact CD1-CD1 4.38Å; F159-I179 HydrophobicContact CD2-CD1 3.63Å; F159-I179 HydrophobicContact CD2-CG1 3.93Å; F159-I179 HydrophobicContact CE1-CD1 4.31Å; F159-I179 HydrophobicContact CE2-CD1 3.58Å; F159-I179 HydrophobicContact CE2-CG1 4.38Å; F159-I179 HydrophobicContact CG-CD1 4.06Å; F159-I179 HydrophobicContact CG-CG1 4.15Å; F159-I179 HydrophobicContact CG-CG2 4.2Å; F159-I179 HydrophobicContact CZ-CD1 3.94Å; V165-I179 HydrophobicContact CB-CG2 4.46Å; V165-I179 HydrophobicContact CG1-CG2 3.7Å; V165-I179 HydrophobicContact CG2-CG2 3.9Å; I168-I179 HydrophobicContact CG1-CG2 4.48Å; I179-F181 HydrophobicContact CB-CE2 4.13Å; I179-F181 HydrophobicContact CG2-CD2 4.32Å; I179-F181 HydrophobicContact CG2-CE1 4.36Å; I179-F181 HydrophobicContact CG2-CE2 3.61Å; I179-F181 HydrophobicContact CG2-CZ 3.64Å
180	A	94.2	Very high	87.7	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	131.4	178.9	0	0	0	0	0	110.8	W137 A139 V165 E166 R167 C216	W137-A180 HydrophobicContact CB-CB 3.79Å; W137-A180 HydrophobicContact CG-CB 4.4Å; A139-A180 HydrophobicContact CB-CB 4.15Å; V165-A180 CarbonylContact C-O 3.56Å; V165-A180 WeakPolarHBondContact CA-O 3.29Å; E166-A180 PolarHBondContact N-O 3.37Å; R167-A180 HydrophobicContact CB-CB 3.94Å; R167-A180 PolarHBondContact N-O 3.13Å; R167-A180 WeakPolarHBondContact O-CB 3.46Å; R167-A180 PolarHBondContact O-N 3.06Å; A180-C216 HydrophobicContact CB-CB 3.71Å
181	F	95.2	Very high	87.6	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	157.4	179.9	-67.4	-88.3	0	0	0	111.1	P138 V140 F159 F162 P164 V165 I179 S183 A187 A190	P138-F181 WeakPolarHBondContact CD-O 3.26Å; P138-F181 PolarHBondContact O-N 3.46Å; V140-F181 HydrophobicContact CG2-CD2 4.48Å; V140-F181 HydrophobicContact CG2-CE2 4.04Å; F159-F181 HydrophobicContact CB-CZ 4.04Å; F159-F181 HydrophobicContact CD1-CZ 4.06Å; F159-F181 HydrophobicContact CG-CZ 4.45Å; F162-F181 HydrophobicContact CB-CE1 4.35Å; P164-F181 WeakPolarHBondContact O-CA 3.42Å; V165-F181 HydrophobicContact CG2-CD1 4.18Å; V165-F181 HydrophobicContact CG2-CE1 3.74Å; V165-F181 HydrophobicContact CG2-CZ 4.31Å; I179-F181 HydrophobicContact CB-CE2 4.13Å; I179-F181 HydrophobicContact CG2-CD2 4.32Å; I179-F181 HydrophobicContact CG2-CE1 4.36Å; I179-F181 HydrophobicContact CG2-CE2 3.61Å; I179-F181 HydrophobicContact CG2-CZ 3.64Å; F181-S183 PolarHBondContact O-N 2.88Å; F181-A187 HydrophobicContact CB-CB 4.27Å; F181-A187 HydrophobicContact CD2-CB 3.79Å; F181-A187 HydrophobicContact CG-CB 4.31Å; F181-A190 HydrophobicContact CE1-CB 4.32Å; F181-A190 HydrophobicContact CE2-CB 3.62Å; F181-A190 HydrophobicContact CZ-CB 3.42Å; F181-A190 VanDerWaalsContact CZ-CB 3.42Å
182	N	89.6	Confident	87.5	Confident	64 Å²	64	60.1 Å²	60.1	34%	0.342	31%	0.305	S	S	.	.	S	Bend	trans	-67.8	-24	177.3	74.8	-8.2	0	0	0	114	W137 P164 E166	W137-N182 HydrophobicContact CE3-CB 4.46Å; W137-N182 VanDerWaalsContact CZ3-CA 3.42Å; W137-N182 HydrophobicContact CZ3-CB 3.86Å; P164-N182 HydrophobicContact CB-CB 4.43Å; P164-N182 VanDerWaalsContact CG-ND2 3.35Å; P164-N182 WeakPolarHBondContact CG-ND2 3.39Å; P164-N182 PolarHBondContact O-N 3.38Å; E166-N182 HydrophobicContact CG-CB 3.9Å; E166-N182 WeakPolarHBondContact OE1-CB 3.49Å
183	S	87.4	Confident	87.6	Confident	35 Å²	35	58.7 Å²	58.7	25%	0.245	30%	0.296	C	S	.	.	S	Bend	trans	-138.8	149.8	-173.4	70.6	0	0	0	0	111.8	P138 F181 S185 S186 A187	P138-S183 VanDerWaalsContact CG-C 3.43Å; F181-S183 PolarHBondContact O-N 2.88Å; S183-S185 VanDerWaalsContact C-N 3.27Å; S183-S185 PolarHBondContact O-N 3.22Å; S183-S185 PolarHBondContact OG-OG 3.06Å; S183-S185 VanDerWaalsContact OG-OG 3.1Å; S183-S186 PolarHBondContact O-N 3.22Å; S183-S186 WeakPolarHBondContact OG-CB 3.31Å; S183-S186 PolarHBondContact OG-N 3.5Å; S183-S186 PolarHBondContact OG-OG 3.41Å; S183-S186 VanDerWaalsContact OG-OG 3.04Å; S183-A187 PolarHBondContact O-N 3.28Å
184	L	90.2	Very high	88.1	Confident	101 Å²	101	53.3 Å²	53.3	53%	0.529	26%	0.258	S	S	.	.	H	α-helix	trans	-67.4	-30	179	-178.6	62.4	0	0	0	111.9	P138 A187 N188 M213	P138-L184 HydrophobicContact CB-CB 4.32Å; P138-L184 HydrophobicContact CB-CD1 3.92Å; P138-L184 HydrophobicContact CG-CB 4.32Å; L184-A187 PolarHBondContact O-N 2.82Å; L184-N188 WeakPolarHBondContact O-CB 3.42Å; L184-N188 PolarHBondContact O-N 3.25Å; L184-N188 PolarHBondContact O-ND2 3.24Å; L184-M213 HydrophobicContact CD1-CE 3.7Å
185	S	87.9	Confident	88.5	Confident	81 Å²	81	53 Å²	53	57%	0.566	25%	0.25	S	S	*	.	H	α-helix	trans	-63.4	-44.9	175.4	45.5	0	0	0	0	111.6	S183 N188 R189	S183-S185 VanDerWaalsContact C-N 3.27Å; S183-S185 PolarHBondContact O-N 3.22Å; S183-S185 PolarHBondContact OG-OG 3.06Å; S183-S185 VanDerWaalsContact OG-OG 3.1Å; S185-N188 PolarHBondContact O-N 3.35Å; S185-R189 WeakPolarHBondContact O-CB 3.23Å; S185-R189 PolarHBondContact O-N 3.29Å
186	S	91	Very high	87.8	Confident	14 Å²	14	55.3 Å²	55.3	10%	0.098	26%	0.259	C	S	.	.	H	α-helix	trans	-63.7	-43.2	175.2	-65.1	0	0	0	0	112.5	F162 S183 N188 R189 A190	F162-S186 WeakPolarHBondContact O-CB 3.5Å; F162-S186 PolarHBondContact O-OG 2.98Å; S183-S186 PolarHBondContact O-N 3.22Å; S183-S186 WeakPolarHBondContact OG-CB 3.31Å; S183-S186 PolarHBondContact OG-N 3.5Å; S183-S186 PolarHBondContact OG-OG 3.41Å; S183-S186 VanDerWaalsContact OG-OG 3.04Å; S186-N188 PolarHBondContact O-N 2.87Å; S186-R189 PolarHBondContact O-N 3.4Å; S186-A190 WeakPolarHBondContact O-CB 3.33Å; S186-A190 PolarHBondContact O-N 3.23Å
187	A	90.7	Very high	86.3	Confident	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63.5	-40.9	176.6	0	0	0	0	0	112.5	P138 V140 F181 S183 L184 R189 A190 K191 M213	P138-A187 HydrophobicContact CB-CB 4.15Å; V140-A187 HydrophobicContact CG2-CB 4.19Å; V140-A187 WeakPolarHBondContact CG2-O 3.41Å; F181-A187 HydrophobicContact CB-CB 4.27Å; F181-A187 HydrophobicContact CD2-CB 3.79Å; F181-A187 HydrophobicContact CG-CB 4.31Å; S183-A187 PolarHBondContact O-N 3.28Å; L184-A187 PolarHBondContact O-N 2.82Å; A187-R189 VanDerWaalsContact C-N 3.35Å; A187-A190 PolarHBondContact O-N 2.96Å; A187-K191 PolarHBondContact O-N 2.84Å; A187-M213 HydrophobicContact CB-CE 3.83Å; A187-M213 HydrophobicContact CB-SD 4.39Å
188	N	89.5	Confident	84.5	Confident	62 Å²	62	61 Å²	61	33%	0.332	29%	0.293	S	S	.	.	H	α-helix	trans	-66.5	-36.6	174.7	-81.4	-36.7	0	0	0	112.3	L184 S185 S186 K191 R192	L184-N188 WeakPolarHBondContact O-CB 3.42Å; L184-N188 PolarHBondContact O-N 3.25Å; L184-N188 PolarHBondContact O-ND2 3.24Å; S185-N188 PolarHBondContact O-N 3.35Å; S186-N188 PolarHBondContact O-N 2.87Å; N188-K191 PolarHBondContact O-N 3.4Å; N188-R192 WeakPolarHBondContact O-CG 3.44Å; N188-R192 PolarHBondContact O-N 3.4Å
189	R	87.6	Confident	82.4	Confident	157 Å²	157	63.2 Å²	63.2	59%	0.592	32%	0.323	S	S	*	.	H	α-helix	trans	-63.5	-49.9	174.2	-162.9	-180	-73.8	-177.1	-3.9	110.1	F162 S185 S186 A187 K191 R192 S193	F162-R189 HydrophobicContact CD1-CG 4.26Å; S185-R189 WeakPolarHBondContact O-CB 3.23Å; S185-R189 PolarHBondContact O-N 3.29Å; S186-R189 PolarHBondContact O-N 3.4Å; A187-R189 VanDerWaalsContact C-N 3.35Å; R189-K191 VanDerWaalsContact C-N 3.29Å; R189-K191 PolarHBondContact O-N 3.32Å; R189-R192 PolarHBondContact O-N 2.98Å; R189-S193 PolarHBondContact O-N 3.4Å; R189-S193 PolarHBondContact O-OG 3.19Å
190	A	89.5	Confident	80.3	Confident	0 Å²	0	66.6 Å²	66.6	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-59.2	-34.3	174.5	0	0	0	0	0	113.5	V140 F159 F162 F181 S186 A187 G194	V140-A190 HydrophobicContact CG2-CB 4.08Å; F159-A190 HydrophobicContact CD1-CB 3.93Å; F159-A190 HydrophobicContact CE1-CB 4.19Å; F162-A190 HydrophobicContact CB-CB 3.87Å; F162-A190 HydrophobicContact CD2-CB 4.08Å; F162-A190 HydrophobicContact CG-CB 3.99Å; F181-A190 HydrophobicContact CE1-CB 4.32Å; F181-A190 HydrophobicContact CE2-CB 3.62Å; F181-A190 HydrophobicContact CZ-CB 3.42Å; F181-A190 VanDerWaalsContact CZ-CB 3.42Å; S186-A190 WeakPolarHBondContact O-CB 3.33Å; S186-A190 PolarHBondContact O-N 3.23Å; A187-A190 PolarHBondContact O-N 2.96Å; A190-G194 WeakPolarHBondContact O-CA 3.37Å; A190-G194 PolarHBondContact O-N 2.99Å
191	K	88.5	Confident	78.1	Confident	94 Å²	94	67 Å²	67	41%	0.409	35%	0.35	S	S	.	.	H	α-helix	trans	-69.2	-38.6	174.1	179.8	177.7	173.5	-166.5	0	112.5	V140 A187 N188 R189 F211 M213	V140-K191 HydrophobicContact CG2-CB 4.38Å; A187-K191 PolarHBondContact O-N 2.84Å; N188-K191 PolarHBondContact O-N 3.4Å; R189-K191 VanDerWaalsContact C-N 3.29Å; R189-K191 PolarHBondContact O-N 3.32Å; K191-F211 HydrophobicContact CG-CB 4.32Å; K191-M213 HydrophobicContact CB-SD 4.29Å; K191-M213 HydrophobicContact CD-CG 3.72Å; K191-M213 HydrophobicContact CD-SD 4.01Å
192	R	84.7	Confident	76.2	Confident	217 Å²	217	74 Å²	74	82%	0.819	39%	0.387	S	S	*	.	H	α-helix	trans	-80.4	-45.2	-176	-73.1	-178.9	-178.6	175.2	0.2	112.5	N188 R189	N188-R192 WeakPolarHBondContact O-CG 3.44Å; N188-R192 PolarHBondContact O-N 3.4Å; R189-R192 PolarHBondContact O-N 2.98Å
193	S	80.8	Confident	74.8	Confident	28 Å²	28	75.2 Å²	75.2	20%	0.196	39%	0.393	C	S	.	.	H	α-helix	trans	-116.3	7.3	-173.7	57.1	0	0	0	0	113.9	F162 R189 R195 E196	F162-S193 VanDerWaalsContact CE1-O 3.26Å; F162-S193 WeakPolarHBondContact CE1-O 3.13Å; F162-S193 VanDerWaalsContact CE1-OG 3.3Å; F162-S193 WeakPolarHBondContact CE1-OG 3.44Å; F162-S193 VanDerWaalsContact CZ-O 3.25Å; F162-S193 WeakPolarHBondContact CZ-O 3.14Å; R189-S193 PolarHBondContact O-N 3.4Å; R189-S193 PolarHBondContact O-OG 3.19Å; S193-R195 PolarHBondContact O-N 3.41Å; S193-E196 PolarHBondContact O-N 2.75Å; S193-E196 VanDerWaalsContact O-N 3.07Å
194	G	79.7	Confident	73.8	Confident	0 Å²	0	78 Å²	78	0%	0	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-11.8	179	0	0	0	0	0	116.3	H158 A190	H158-G194 PolarHBondContact NE2-O 3.16Å; A190-G194 WeakPolarHBondContact O-CA 3.37Å; A190-G194 PolarHBondContact O-N 2.99Å
195	R	78.1	Confident	73.3	Confident	120 Å²	120	73.8 Å²	73.8	45%	0.453	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-21.5	176.6	-71.2	-179.4	174.2	-168.1	-7	113.2	S193 V209 F211	S193-R195 PolarHBondContact O-N 3.41Å; R195-V209 PolarHBondContact NH2-O 3.23Å; R195-F211 HydrophobicContact CG-CD2 4.16Å; R195-F211 HydrophobicContact CG-CE2 3.53Å; R195-F211 HydrophobicContact CG-CZ 3.83Å
196	E	68.1	Low	72.6	Confident	131 Å²	131	71.8 Å²	71.8	61%	0.612	37%	0.368	S	S	*	.	S	Bend	trans	-82.3	140.4	-172.5	-66.3	174.4	175.5	0	0	111	S193 I198	S193-E196 PolarHBondContact O-N 2.75Å; S193-E196 VanDerWaalsContact O-N 3.07Å; E196-I198 PolarHBondContact O-N 3.49Å
197	C	57.9	Low	71.7	Confident	74 Å²	74	76.2 Å²	76.2	50%	0.5	40%	0.399	S	S	.	.			trans	-58.1	128.8	177.1	-173.3	0	0	0	0	110.8	D204	C197-D204 WeakPolarHBondContact CB-OD1 2.91Å
198	I	53.8	Low	70.9	Confident	49 Å²	49	78.9 Å²	78.9	25%	0.251	42%	0.418	S	S	.	.			trans	-113.6	129	172.8	-64.6	175.3	0	0	0	106.9	S161 F162 E196 S200 A201	S161-I198 VanDerWaalsContact CB-CD1 3.45Å; S161-I198 WeakPolarHBondContact OG-CD1 3.44Å; F162-I198 HydrophobicContact CD1-CD1 4.24Å; F162-I198 HydrophobicContact CE1-CD1 3.48Å; F162-I198 VanDerWaalsContact CE1-CD1 3.48Å; F162-I198 HydrophobicContact CE2-CD1 3.8Å; F162-I198 HydrophobicContact CZ-CD1 3.2Å; F162-I198 HydrophobicContact CZ-CG1 4.33Å; E196-I198 PolarHBondContact O-N 3.49Å; I198-S200 PolarHBondContact O-N 2.87Å; I198-A201 PolarHBondContact O-N 3.02Å
199	A	51.4	Low	70.6	Confident	101 Å²	101	76 Å²	76	84%	0.835	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48	-11.7	-166.5	0	0	0	0	0	117
200	S	50	Low	70.2	Confident	71 Å²	71	72.1 Å²	72.1	50%	0.497	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-13.5	178.1	59.1	0	0	0	0	115.3	K157 I198	K157-S200 WeakPolarHBondContact CE-O 3.34Å; K157-S200 PolarHBondContact NZ-O 3.21Å; K157-S200 VanDerWaalsContact NZ-O 3.13Å; I198-S200 PolarHBondContact O-N 2.87Å
201	A	49.3	Very low	70.3	Confident	9 Å²	9	73.2 Å²	73.2	7%	0.074	40%	0.397	C	S	.	.			trans	-133.6	91	179.8	0	0	0	0	0	110	I198 I203	I198-A201 PolarHBondContact O-N 3.02Å; A201-I203 PolarHBondContact O-N 3.46Å
202	N	54.7	Low	70.2	Confident	145 Å²	145	71.8 Å²	71.8	78%	0.775	40%	0.397	S	S	*	.			trans	-64.4	38.1	-177.9	-80.5	-11.3	0	0	0	115.3
203	I	60.9	Low	70.5	Confident	91 Å²	91	64.7 Å²	64.7	47%	0.467	37%	0.374	S	S	.	.			trans	-143	117.7	179.8	-46.4	175.5	0	0	0	110	Y149 F154 A201	Y149-I203 HydrophobicContact CE1-CG2 3.65Å; F154-I203 HydrophobicContact CE2-CB 4.27Å; A201-I203 PolarHBondContact O-N 3.46Å
204	D	66.7	Low	70.8	Confident	94 Å²	94	64.5 Å²	64.5	50%	0.503	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-74.3	144.5	174.1	-71.8	-33.5	0	0	0	111.6	C197	C197-D204 WeakPolarHBondContact CB-OD1 2.91Å
205	L	77.7	Confident	70.9	Confident	11 Å²	11	74.2 Å²	74.2	6%	0.058	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-74.9	133.5	168.2	-83.5	152.9	0	0	0	109.4	L145 Y149 F154 F159 V209 F211	L145-L205 HydrophobicContact CD1-CD2 3.37Å; Y149-L205 HydrophobicContact CG-CD2 4.46Å; F154-L205 HydrophobicContact CE1-CD2 4.06Å; F154-L205 HydrophobicContact CE1-CG 4.28Å; F154-L205 HydrophobicContact CZ-CG 4.42Å; F159-L205 HydrophobicContact CE2-CD1 4.18Å; F159-L205 HydrophobicContact CZ-CD1 4.09Å; L205-V209 HydrophobicContact CD2-CG2 4.3Å; L205-F211 HydrophobicContact CD1-CZ 4.01Å
206	P	74.2	Confident	70.9	Confident	39 Å²	39	68.9 Å²	68.9	25%	0.253	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-59.3	145.2	-179.5	14.8	-23.1	0	0	0	112.1	P146 Y149 S208 V209	P146-P206 HydrophobicContact CG-CG 3.88Å; Y149-P206 HydrophobicContact CD2-CG 4.37Å; Y149-P206 HydrophobicContact CE2-CG 4Å; P206-S208 PolarHBondContact O-N 2.85Å; P206-V209 HydrophobicContact CG-CG2 4.02Å; P206-V209 WeakPolarHBondContact O-CB 3.42Å; P206-V209 WeakPolarHBondContact O-CG2 3.38Å; P206-V209 PolarHBondContact O-N 3.48Å
207	S	71.7	Confident	71.3	Confident	107 Å²	107	70.3 Å²	70.3	75%	0.748	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-19.4	-176.7	56.8	0	0	0	0	114	V209	S207-V209 PolarHBondContact O-N 3.03Å
208	S	74.7	Confident	71.8	Confident	57 Å²	57	70.5 Å²	70.5	40%	0.399	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-21.2	174.2	57.4	0	0	0	0	113.8	P206 L210	P206-S208 PolarHBondContact O-N 2.85Å; S208-L210 PolarHBondContact O-N 3.46Å
209	V	82.7	Confident	71.8	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	40%	0.398	C	S	.	.			trans	-74.9	120.5	-176.7	-176	0	0	0	0	110.9	L142 S143 L145 R195 L205 P206 S207 F211	L142-V209 HydrophobicContact CB-CG1 3.95Å; L142-V209 HydrophobicContact CD2-CG1 4.28Å; S143-V209 WeakPolarHBondContact O-CA 3.32Å; L145-V209 HydrophobicContact CD1-CG1 4.26Å; L145-V209 HydrophobicContact CD1-CG2 4.07Å; R195-V209 PolarHBondContact NH2-O 3.23Å; L205-V209 HydrophobicContact CD2-CG2 4.3Å; P206-V209 HydrophobicContact CG-CG2 4.02Å; P206-V209 WeakPolarHBondContact O-CB 3.42Å; P206-V209 WeakPolarHBondContact O-CG2 3.38Å; P206-V209 PolarHBondContact O-N 3.48Å; S207-V209 PolarHBondContact O-N 3.03Å; V209-F211 HydrophobicContact CB-CE2 4.26Å; V209-F211 HydrophobicContact CG1-CD2 4.34Å; V209-F211 HydrophobicContact CG1-CE2 3.89Å; V209-F211 WeakPolarHBondContact O-CD2 3.35Å
210	L	80.2	Confident	71	Confident	77 Å²	77	75.8 Å²	75.8	40%	0.403	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	128.5	-179.5	-79.6	149	0	0	0	111.4	L142 S143 R144 S208	L142-L210 WeakPolarHBondContact CA-O 3.4Å; S143-L210 PolarHBondContact N-O 3.46Å; S143-L210 PolarHBondContact O-N 3.41Å; R144-L210 HydrophobicContact CG-CD1 4.48Å; S208-L210 PolarHBondContact O-N 3.46Å
211	F	90.1	Very high	70.2	Confident	22 Å²	22	79.5 Å²	79.5	10%	0.096	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	115.7	-178.9	-71.3	-117.3	0	0	0	110.3	V140 L142 F159 K191 R195 L205 V209	V140-F211 HydrophobicContact CG1-CB 4.4Å; V140-F211 HydrophobicContact CG1-CD1 3.91Å; L142-F211 HydrophobicContact CD2-CD1 3.39Å; L142-F211 HydrophobicContact CD2-CD2 4.07Å; L142-F211 HydrophobicContact CD2-CE1 3.3Å; L142-F211 HydrophobicContact CD2-CE2 3.97Å; L142-F211 HydrophobicContact CD2-CG 3.8Å; L142-F211 HydrophobicContact CD2-CZ 3.6Å; F159-F211 AromaticContact CE1-CE1 3.84Å; F159-F211 HydrophobicContact CE1-CE1 3.84Å; F159-F211 AromaticContact CZ-CE1 3.68Å; F159-F211 HydrophobicContact CZ-CE1 3.68Å; F159-F211 HydrophobicContact CZ-CZ 4.19Å; K191-F211 HydrophobicContact CG-CB 4.32Å; R195-F211 HydrophobicContact CG-CD2 4.16Å; R195-F211 HydrophobicContact CG-CE2 3.53Å; R195-F211 HydrophobicContact CG-CZ 3.83Å; L205-F211 HydrophobicContact CD1-CZ 4.01Å; V209-F211 HydrophobicContact CB-CE2 4.26Å; V209-F211 HydrophobicContact CG1-CD2 4.34Å; V209-F211 HydrophobicContact CG1-CE2 3.89Å; V209-F211 WeakPolarHBondContact O-CD2 3.35Å
212	T	86.2	Confident	69.1	Low	65 Å²	65	84.7 Å²	84.7	40%	0.399	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	148.6	178.2	50.5	0	0	0	0	110.9	V140 K141	V140-T212 CarbonylContact C-O 3.59Å; V140-T212 WeakPolarHBondContact CA-O 3.04Å; K141-T212 PolarHBondContact N-O 2.89Å; K141-T212 PolarHBondContact O-N 3.13Å; K141-T212 PolarHBondContact O-OG1 3.41Å
213	M	90.8	Very high	67.7	Low	68 Å²	68	81.2 Å²	81.2	34%	0.335	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	140.1	175	-76	-57.1	-67.1	0	0	110	V140 L184 A187 K191	V140-M213 HydrophobicContact CG2-SD 4.33Å; L184-M213 HydrophobicContact CD1-CE 3.7Å; A187-M213 HydrophobicContact CB-CE 3.83Å; A187-M213 HydrophobicContact CB-SD 4.39Å; K191-M213 HydrophobicContact CB-SD 4.29Å; K191-M213 HydrophobicContact CD-CG 3.72Å; K191-M213 HydrophobicContact CD-SD 4.01Å
214	A	88.4	Confident	66	Low	23 Å²	23	82.7 Å²	82.7	19%	0.19	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	-179.5	178.9	0	0	0	0	0	110.8	A139 K141 Y178	A139-A214 HydrophobicContact CB-CB 4.21Å; A139-A214 PolarHBondContact N-O 3.02Å; A139-A214 CarbonylContact O-C 3.56Å; A139-A214 PolarHBondContact O-N 3.38Å; A139-A214 VanDerWaalsContact O-O 3.05Å; K141-A214 HydrophobicContact CB-CB 4.11Å; Y178-A214 HydrophobicContact CD1-CB 3.94Å; Y178-A214 HydrophobicContact CE1-CB 4.09Å
215	R	82.1	Confident	63.9	Low	205 Å²	205	84.9 Å²	84.9	77%	0.774	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.7	134.2	175.1	-70.4	-177.4	-175.5	152.1	0.5	109.1	Y136 W137	Y136-R215 HydrophobicContact CD1-CB 4.15Å; Y136-R215 HydrophobicContact CG-CB 4.32Å; W137-R215 CarbonylContact O-C 3.59Å; W137-R215 WeakPolarHBondContact O-CA 3.24Å
216	C	78.2	Confident	61.4	Low	8 Å²	8	90 Å²	90	5%	0.054	52%	0.515	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	125.6	179.2	-79.3	0	0	0	0	110.7	Y136 W137 A139 A180	Y136-C216 CarbonylContact C-O 3.57Å; Y136-C216 VanDerWaalsContact CA-O 3.29Å; Y136-C216 WeakPolarHBondContact CA-O 3.24Å; W137-C216 PolarHBondContact N-O 2.77Å; W137-C216 PolarHBondContact O-N 3.46Å; A139-C216 HydrophobicContact CB-CB 4.25Å; A180-C216 HydrophobicContact CB-CB 3.71Å
217	R	75.1	Confident	59.1	Low	160 Å²	160	95.5 Å²	95.5	60%	0.604	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67	135.7	-175.8	-163.9	173.9	177.9	179.3	-1	111.5	L135 Y136 Q219	L135-R217 WeakPolarHBondContact O-CA 3.25Å; Y136-R217 VanDerWaalsContact CD1-CA 3.5Å; Y136-R217 HydrophobicContact CD1-CB 3.87Å; Y136-R217 HydrophobicContact CD1-CG 4.32Å; Y136-R217 HydrophobicContact CE1-CB 3.61Å; Y136-R217 HydrophobicContact CE1-CG 3.86Å; R217-Q219 PolarHBondContact O-N 3.21Å
218	R	69.8	Low	57	Low	78 Å²	78	95.5 Å²	95.5	29%	0.294	54%	0.541	S	S	.	.	P	Polyproline II helix	trans	-74.1	116.1	168.8	-56.6	-158.6	178.4	151.9	-8.1	108.1	N134 L135 W137	N134-R218 VanDerWaalsContact O-CD 3.3Å; N134-R218 WeakPolarHBondContact O-CD 3.27Å; N134-R218 PolarHBondContact O-NH1 2.88Å; L135-R218 PolarHBondContact O-N 3.02Å; W137-R218 HydrophobicContact CD2-CG 4.28Å; W137-R218 VanDerWaalsContact CD2-NE 3.26Å; W137-R218 HydrophobicContact CG-CG 4.14Å; W137-R218 VanDerWaalsContact CZ2-NE 3.34Å
219	Q	54.1	Low	55.2	Low	127 Å²	127	98 Å²	98	59%	0.593	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-79.2	123.6	172.6	-94.4	171.1	-37.3	0	0	108.5	R217 N221	R217-Q219 PolarHBondContact O-N 3.21Å; Q219-N221 PolarHBondContact O-N 3.11Å
220	T	33.4	Very low	52.3	Low	135 Å²	135	106.8 Å²	106.8	83%	0.828	59%	0.594	S	S	*	*			trans	-80.9	93.3	170.1	50.1	0	0	0	0	107.6	S222	T220-S222 PolarHBondContact O-N 2.99Å; T220-S222 VanDerWaalsContact O-N 3.16Å
221	N	34.1	Very low	49.6	Very low	148 Å²	148	111.1 Å²	111.1	79%	0.791	62%	0.616	S	S	*	*			trans	-65.9	114.3	179.3	-76	-3.6	0	0	0	109.9	Q219	Q219-N221 PolarHBondContact O-N 3.11Å
222	S	25.7	Very low	46.5	Very low	119 Å²	119	113.2 Å²	113.2	83%	0.832	65%	0.645	S	S	*	*			trans	-91.5	124.7	156.5	40	0	0	0	0	106.9	T220	T220-S222 PolarHBondContact O-N 2.99Å; T220-S222 VanDerWaalsContact O-N 3.16Å
223	G	24.6	Very low	43.9	Very low	72 Å²	72	116.2 Å²	116.2	74%	0.742	67%	0.665	S	S	*	*	S	Bend	trans	82.9	85.9	161.8	0	0	0	0	0	117.6
224	S	25	Very low	40.8	Very low	122 Å²	122	121.2 Å²	121.2	85%	0.853	69%	0.691	S	S	*	*				164.5	109.6	125	46.3	0	0	0	0	109.6
225	T	24.3	Very low	37.7	Very low	140 Å²	140	129.4 Å²	129.4	86%	0.859	72%	0.723	S	S	*	*			trans	-88.9	141.8	177.9	39	0	0	0	0	111.4
226	P	25	Very low	34.8	Very low	119 Å²	119	123.3 Å²	123.3	77%	0.773	72%	0.723	S	S	*	*			trans	-126.2	108.1	135.9	27.3	-10.9	0	0	0	111.4
227	I	24.5	Very low	32.3	Very low	153 Å²	153	132.6 Å²	132.6	79%	0.785	76%	0.763	S	S	*	*			trans	52	107.8	135.4	-54.4	174.2	0	0	0	119.4
228	S	28.2	Very low	29.8	Very low	107 Å²	107	132.4 Å²	132.4	75%	0.748	77%	0.774	S	S	*	*			trans	50.4	139.5	130.9	-45.8	0	0	0	0	120.7
229	P	36.6	Very low	27.7	Very low	111 Å²	111	135.7 Å²	135.7	72%	0.721	80%	0.796	S	S	*	*			cis	-153.7	163.4	45.2	39.6	-17.1	0	0	0	119.4
230	K	22.7	Very low	26.2	Very low	184 Å²	184	136 Å²	136	80%	0.8	81%	0.806	S	S	*	*			trans	81.1	115.5	137.5	-83.3	173.9	-177.3	-178.2	0	122.4
231	L	21.9	Very low	25.7	Very low	167 Å²	167	134.3 Å²	134.3	87%	0.874	80%	0.8	S	S	*	*				85.2	116.9	129.1	-85	144.8	0	0	0	120.5
232	G	25.9	Very low	25.2	Very low	67 Å²	67	130.8 Å²	130.8	69%	0.691	79%	0.787	S	S	*	*			trans	144.4	116	144.5	0	0	0	0	0	115.4
233	P	32.2	Very low	25	Very low	128 Å²	128	133.4 Å²	133.4	83%	0.831	79%	0.788	S	S	*	*			trans	-88.7	133.5	-169.8	34.6	-30.7	0	0	0	112.1
234	I	25.7	Very low	25	Very low	172 Å²	172	134.4 Å²	134.4	88%	0.882	78%	0.783	S	S	*	*			trans	-123.1	110.9	160.8	-60.6	-179.4	0	0	0	108.9
235	K	23.4	Very low	25.3	Very low	196 Å²	196	134.4 Å²	134.4	85%	0.852	78%	0.781	S	S	*	*			trans	-48.3	140.5	175	-68.6	171.2	173	178.2	0	111.6
236	G	21	Very low	25.3	Very low	76 Å²	76	133.2 Å²	133.2	78%	0.784	78%	0.778	S	S	*	*			trans	-57.3	143.7	174.6	0	0	0	0	0	113.1
237	K	24.9	Very low	25.1	Very low	204 Å²	204	139 Å²	139	89%	0.887	79%	0.785	S	S	*	*			trans	-136.9	107.5	146.7	-101.4	-178.8	177.4	179	0	108	I239	K237-I239 PolarHBondContact O-N 3.41Å
238	N	22.4	Very low	25.2	Very low	156 Å²	156	137.9 Å²	137.9	83%	0.834	79%	0.785	S	S	*	*			trans	-52	117.8	158.5	-72.1	-32.3	0	0	0	109
239	I	26.4	Very low	25.1	Very low	147 Å²	147	138.2 Å²	138.2	75%	0.754	79%	0.787	S	S	*	*			trans	-133.8	99.7	144.8	-60.2	-176.5	0	0	0	107.2	K237 S241	K237-I239 PolarHBondContact O-N 3.41Å; I239-S241 PolarHBondContact O-N 2.95Å
240	V	21.8	Very low	24.5	Very low	134 Å²	134	141.5 Å²	141.5	81%	0.812	80%	0.798	S	S	*	*			trans	-70.2	105.2	162	174.3	0	0	0	0	106.9
241	S	24.5	Very low	24.5	Very low	99 Å²	99	140.9 Å²	140.9	69%	0.692	80%	0.795	S	S	*	*			trans	-134.2	100.6	155.8	52.1	0	0	0	0	109.7	I239 M243	I239-S241 PolarHBondContact O-N 2.95Å; S241-M243 PolarHBondContact O-N 3.43Å
242	S	21.7	Very low	24.6	Very low	74 Å²	74	144.7 Å²	144.7	52%	0.517	80%	0.798	S	S	.	*			trans	-43.1	118.8	167.6	48.8	0	0	0	0	113.8
243	M	23.3	Very low	24.4	Very low	174 Å²	174	146.8 Å²	146.8	86%	0.857	80%	0.798	S	S	*	*			trans	-140.9	88.5	153.8	-81.4	-102.1	87.1	0	0	107.4	S241	S241-M243 PolarHBondContact O-N 3.43Å
244	S	23.7	Very low	24	Very low	92 Å²	92	148.7 Å²	148.7	64%	0.643	80%	0.799	S	S	*	*			trans	-87.2	143.8	173.6	44.1	0	0	0	0	110.9
245	P	30.4	Very low	23.8	Very low	123 Å²	123	146 Å²	146	80%	0.799	79%	0.791	S	S	*	*			trans	-103.3	128.6	-147.5	23.4	-5.6	0	0	0	112.1	R247	P245-R247 PolarHBondContact O-N 2.93Å
246	S	25.1	Very low	23.7	Very low	115 Å²	115	141.5 Å²	141.5	80%	0.804	78%	0.784	S	S	*	*			trans	-80.9	101.7	172.1	47.2	0	0	0	0	110.6	T248	S246-T248 PolarHBondContact O-N 3.16Å
247	R	21.5	Very low	23.9	Very low	241 Å²	241	147.4 Å²	147.4	91%	0.909	79%	0.791	S	S	*	*			trans	-52.4	118.5	154.5	-85.6	177.5	163.9	-164.2	-3.1	109.1	P245	P245-R247 PolarHBondContact O-N 2.93Å
248	T	26.8	Very low	23.8	Very low	128 Å²	128	142.1 Å²	142.1	79%	0.785	78%	0.78	S	S	*	*			trans	-132.9	122.1	151.3	34.4	0	0	0	0	110.4	S246	S246-T248 PolarHBondContact O-N 3.16Å
249	S	24.7	Very low	23.8	Very low	114 Å²	114	141.4 Å²	141.4	80%	0.797	78%	0.776	S	S	*	*			trans	-34.7	131.1	168.2	18.8	0	0	0	0	114.8	K251	S249-K251 PolarHBondContact O-N 2.84Å
250	L	24.5	Very low	23.7	Very low	181 Å²	181	141.5 Å²	141.5	95%	0.948	78%	0.776	S	S	*	*			trans	-56.8	90	167	-72.7	141.4	0	0	0	111.3
251	K	23.4	Very low	23.9	Very low	171 Å²	171	144.5 Å²	144.5	74%	0.743	78%	0.778	S	S	*	*			trans	-97.2	107.8	152.2	-92.5	-176.8	176.1	179.4	0	107.3	S249 T253	S249-K251 PolarHBondContact O-N 2.84Å; K251-T253 VanDerWaalsContact C-N 3.28Å; K251-T253 PolarHBondContact O-N 3.4Å
252	R	22.5	Very low	23.9	Very low	246 Å²	246	147.6 Å²	147.6	93%	0.928	78%	0.782	S	S	*	*			trans	-66.3	86	170.7	-110.7	-179.6	-168.8	173.8	3.5	108.2
253	T	22.1	Very low	24.1	Very low	112 Å²	112	150.2 Å²	150.2	69%	0.687	80%	0.795	S	S	*	*			trans	-103.5	108.7	160	36.2	0	0	0	0	107.3	K251 T255	K251-T253 VanDerWaalsContact C-N 3.28Å; K251-T253 PolarHBondContact O-N 3.4Å; T253-T255 VanDerWaalsContact C-N 3.33Å; T253-T255 PolarHBondContact O-N 2.85Å
254	I	23.6	Very low	24.2	Very low	168 Å²	168	150.2 Å²	150.2	86%	0.862	80%	0.795	S	S	*	*			trans	-68.7	94.2	168.9	-62.6	166.9	0	0	0	105.7
255	T	21.9	Very low	24.3	Very low	115 Å²	115	152.9 Å²	152.9	71%	0.706	80%	0.802	S	S	*	*			trans	-100	109.3	163.7	7	0	0	0	0	107.8	T253 Q257	T253-T255 VanDerWaalsContact C-N 3.33Å; T253-T255 PolarHBondContact O-N 2.85Å; T255-Q257 PolarHBondContact O-N 2.71Å
256	S	22.1	Very low	24	Very low	102 Å²	102	156.9 Å²	156.9	71%	0.713	81%	0.807	S	S	*	*			trans	-26.6	115.9	158.9	48.7	0	0	0	0	113.6
257	Q	24.2	Very low	24	Very low	199 Å²	199	160.9 Å²	160.9	93%	0.93	81%	0.81	S	S	*	*			trans	-104.7	88.1	158.7	-77.4	-174.1	-12.1	0	0	108.6	T255	T255-Q257 PolarHBondContact O-N 2.71Å
258	S	23.1	Very low	24	Very low	93 Å²	93	158.6 Å²	158.6	65%	0.65	81%	0.809	S	S	*	*			trans	-81.3	140.9	152	50.4	0	0	0	0	108.8
259	N	23.4	Very low	24	Very low	142 Å²	142	162.3 Å²	162.3	76%	0.759	82%	0.815	S	S	*	*			trans	94.6	79.5	165.5	-53.8	-25.2	0	0	0	117.9
260	I	24.7	Very low	23.9	Very low	148 Å²	148	162.3 Å²	162.3	76%	0.759	82%	0.815	S	S	*	*				-128.7	104.5	127.8	-62.3	-177.9	0	0	0	107.1	Q262	I260-Q262 HydrophobicContact CG2-CG 4.23Å; I260-Q262 PolarHBondContact O-N 2.88Å
261	K	24.7	Very low	23.9	Very low	197 Å²	197	159.2 Å²	159.2	86%	0.857	81%	0.808	S	S	*	*			trans	-63	95	165.8	-75.7	176.3	174.1	176.9	0	107.8	V263	K261-V263 PolarHBondContact O-N 3.2Å
262	Q	24.6	Very low	24.1	Very low	164 Å²	164	157.8 Å²	157.8	77%	0.766	81%	0.813	S	S	*	*			trans	-79.2	114.7	166.1	-84	-175	-13.7	0	0	109.4	I260 M264	I260-Q262 HydrophobicContact CG2-CG 4.23Å; I260-Q262 PolarHBondContact O-N 2.88Å; Q262-M264 PolarHBondContact O-N 3.19Å
263	V	26.5	Very low	24.1	Very low	129 Å²	129	151.1 Å²	151.1	78%	0.782	80%	0.804	S	S	*	*			trans	-62.9	96.7	167.1	175	0	0	0	0	108	K261 N265	K261-V263 PolarHBondContact O-N 3.2Å; V263-N265 PolarHBondContact O-N 3.06Å; V263-N265 VanDerWaalsContact O-N 3.16Å
264	M	24.8	Very low	24.3	Very low	174 Å²	174	152.5 Å²	152.5	86%	0.857	81%	0.813	S	S	*	*			trans	-76.4	91.9	172.9	-81.8	-88.7	-116.7	0	0	109.5	Q262 K266	Q262-M264 PolarHBondContact O-N 3.19Å; M264-K266 PolarHBondContact O-N 3.25Å
265	N	26	Very low	24.3	Very low	148 Å²	148	149.5 Å²	149.5	79%	0.791	81%	0.806	S	S	*	*			trans	-76.6	107.3	162.9	-96.7	-17.8	0	0	0	109.2	V263 K267	V263-N265 PolarHBondContact O-N 3.06Å; V263-N265 VanDerWaalsContact O-N 3.16Å; N265-K267 PolarHBondContact O-N 3Å
266	K	23.2	Very low	24.5	Very low	208 Å²	208	149.7 Å²	149.7	90%	0.904	81%	0.812	S	S	*	*			trans	-51.8	118.7	168.7	-75.4	173.6	172.8	175.9	0	110.3	M264	M264-K266 PolarHBondContact O-N 3.25Å
267	K	25.8	Very low	24.6	Very low	199 Å²	199	151.7 Å²	151.7	87%	0.865	82%	0.815	S	S	*	*			trans	-124.6	131.2	155.6	-83.7	-170.7	177.1	-178.1	0	109.6	N265	N265-K267 PolarHBondContact O-N 3Å
268	Q	22.5	Very low	24.8	Very low	193 Å²	193	150.1 Å²	150.1	90%	0.902	81%	0.813	S	S	*	*			trans	-61.2	131.6	-167.6	-66.6	145.8	-42.9	0	0	111.9
269	F	25.3	Very low	24.9	Very low	205 Å²	205	154.4 Å²	154.4	90%	0.899	82%	0.823	S	S	*	*			trans	-111.5	118.4	154.2	-93.2	-80.4	0	0	0	108.1
270	S	23.7	Very low	24.9	Very low	115 Å²	115	156 Å²	156	80%	0.804	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-64.8	119.6	-178.2	47.9	0	0	0	0	112.3
271	S	24.2	Very low	25	Very low	115 Å²	115	154.4 Å²	154.4	80%	0.804	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-102.1	125.6	162.8	55.2	0	0	0	0	109.6
272	V	27.1	Very low	24.9	Very low	141 Å²	141	150.2 Å²	150.2	86%	0.855	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-65.3	135.1	177.4	170.9	0	0	0	0	110.5
273	S	23.7	Very low	25.1	Very low	106 Å²	106	149 Å²	149	74%	0.741	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-73.5	132.6	-174.2	46.5	0	0	0	0	114
274	V	26.7	Very low	24.8	Very low	142 Å²	142	147.6 Å²	147.6	86%	0.861	83%	0.828	S	S	*	*			trans	-130.1	119.9	146.7	-179.5	0	0	0	0	107.2
275	S	23.1	Very low	24.9	Very low	104 Å²	104	144.3 Å²	144.3	73%	0.727	82%	0.821	S	S	*	*			trans	-75.6	133.8	-173.2	40.2	0	0	0	0	113.1
276	S	26.2	Very low	24.8	Very low	119 Å²	119	145.5 Å²	145.5	83%	0.832	82%	0.822	S	S	*	*			trans	-157	111.3	146.4	-17.3	0	0	0	0	108.1
277	D	23.6	Very low	24.8	Very low	145 Å²	145	143.3 Å²	143.3	78%	0.775	82%	0.819	S	S	*	*			trans	-60.5	133.4	176.9	-63	-58.6	0	0	0	111.3
278	N	29	Very low	24.7	Very low	165 Å²	165	138.2 Å²	138.2	88%	0.882	81%	0.806	S	S	*	*				-164.4	123.2	126.9	-96	-26.8	0	0	0	110.9
279	Q	23.5	Very low	24.6	Very low	183 Å²	183	135 Å²	135	86%	0.855	80%	0.803	S	S	*	*			trans	-67.7	124.7	-176.1	-61	168	-4.6	0	0	110.2
280	L	25.1	Very low	24.5	Very low	176 Å²	176	134.7 Å²	134.7	92%	0.921	80%	0.798	S	S	*	*			trans	-149.2	124.3	147.5	-101	129.4	0	0	0	109.4
281	S	26.8	Very low	24.4	Very low	114 Å²	114	137 Å²	137	80%	0.797	80%	0.801	S	S	*	*			trans	-58.2	128.1	-165.9	45.6	0	0	0	0	114.5
282	S	22.6	Very low	24.4	Very low	109 Å²	109	137.3 Å²	137.3	76%	0.762	80%	0.798	S	S	*	*			trans	-63.9	129.7	168.9	53.7	0	0	0	0	113.4
283	V	27.2	Very low	24.1	Very low	139 Å²	139	139.4 Å²	139.4	84%	0.842	80%	0.799	S	S	*	*			trans	-124.1	94.3	147.9	178.8	0	0	0	0	107.4	S285	V283-S285 PolarHBondContact O-N 2.77Å
284	S	21.9	Very low	24.2	Very low	100 Å²	100	140.2 Å²	140.2	70%	0.699	80%	0.802	S	S	*	*			trans	-72.6	114.1	169.3	161.7	0	0	0	0	108.8
285	S	25.9	Very low	24	Very low	104 Å²	104	140.2 Å²	140.2	73%	0.727	80%	0.802	S	S	*	*			trans	-123.5	104	159	53.8	0	0	0	0	108.7	V283 I287	V283-S285 PolarHBondContact O-N 2.77Å; S285-I287 PolarHBondContact O-N 3.45Å
286	Q	24.6	Very low	24	Very low	174 Å²	174	141.7 Å²	141.7	81%	0.813	81%	0.806	S	S	*	*			trans	-66.5	121.8	176.1	-69	170.1	-26.3	0	0	108.7	P288	Q286-P288 VanDerWaalsContact O-CD 3.25Å; Q286-P288 WeakPolarHBondContact O-CD 3.4Å
287	I	23.5	Very low	23.7	Very low	161 Å²	161	141.1 Å²	141.1	83%	0.826	80%	0.802	S	S	*	*			trans	-72.4	112.8	175.8	-61.4	167.7	0	0	0	107.6	S285	S285-I287 PolarHBondContact O-N 3.45Å
288	P	23.6	Very low	23.7	Very low	93 Å²	93	139.7 Å²	139.7	60%	0.604	80%	0.804	S	S	*	*			trans	-84.9	123.2	179.3	1.8	17.4	0	0	0	110	Q286 Y290	Q286-P288 VanDerWaalsContact O-CD 3.25Å; Q286-P288 WeakPolarHBondContact O-CD 3.4Å; P288-Y290 WeakPolarHBondContact O-CD2 3.5Å; P288-Y290 PolarHBondContact O-N 3.37Å; P288-Y290 VanDerWaalsContact O-N 3.16Å
289	C	18.9	Very low	23.5	Very low	125 Å²	125	137.1 Å²	137.1	85%	0.845	80%	0.798	S	S	*	*			trans	-65.8	107.3	170.6	-63	0	0	0	0	110.3	N291	C289-N291 PolarHBondContact O-N 3.3Å
290	Y	24.1	Very low	23.5	Very low	199 Å²	199	135.9 Å²	135.9	78%	0.78	80%	0.796	S	S	*	*			trans	-74.8	104.7	172.3	-82.6	-89.9	0	0	0	110.6	P288	P288-Y290 WeakPolarHBondContact O-CD2 3.5Å; P288-Y290 PolarHBondContact O-N 3.37Å; P288-Y290 VanDerWaalsContact O-N 3.16Å
291	N	20.5	Very low	23.5	Very low	164 Å²	164	133.8 Å²	133.8	88%	0.877	79%	0.791	S	S	*	*			trans	-93.3	104.4	159.5	-92	-16.2	0	0	0	108.2	C289	C289-N291 PolarHBondContact O-N 3.3Å
292	T	25.6	Very low	23.3	Very low	120 Å²	120	139.9 Å²	139.9	74%	0.736	80%	0.796	S	S	*	*			trans	-130.3	106.8	165.9	40.8	0	0	0	0	108.9
293	Q	20.8	Very low	23.4	Very low	186 Å²	186	140 Å²	140	87%	0.869	80%	0.797	S	S	*	*			trans	-69.2	137.5	163.5	-75	-165.6	-29.7	0	0	109.4	T295	Q293-T295 PolarHBondContact O-N 3.28Å
294	P	24.5	Very low	23.3	Very low	123 Å²	123	141.1 Å²	141.1	80%	0.799	80%	0.798	S	S	*	*			trans	-83.3	109.5	-176.4	31	-30.4	0	0	0	110.6	V296	P294-V296 PolarHBondContact O-N 2.87Å
295	T	23.9	Very low	23.4	Very low	141 Å²	141	143.4 Å²	143.4	87%	0.865	81%	0.808	S	S	*	*			trans	-76.7	109.9	164.4	42.3	0	0	0	0	109.5	Q293 S297	Q293-T295 PolarHBondContact O-N 3.28Å; T295-S297 PolarHBondContact O-N 3.21Å
296	V	22.1	Very low	23.4	Very low	135 Å²	135	142.5 Å²	142.5	82%	0.818	80%	0.802	S	S	*	*			trans	-62.2	117.9	169.4	177.2	0	0	0	0	109.4	P294	P294-V296 PolarHBondContact O-N 2.87Å
297	S	20.5	Very low	23.5	Very low	108 Å²	108	138.9 Å²	138.9	76%	0.755	80%	0.802	S	S	*	*			trans	177.6	102.5	151	-80.1	0	0	0	0	109.8	T295	T295-S297 PolarHBondContact O-N 3.21Å
298	S	23.9	Very low	23.7	Very low	115 Å²	115	141 Å²	141	80%	0.804	80%	0.801	S	S	*	*			trans	174.3	111.9	134	35.5	0	0	0	0	111.8
299	S	24.6	Very low	24	Very low	110 Å²	110	143.4 Å²	143.4	77%	0.769	81%	0.808	S	S	*	*			trans	38.2	107.1	139	53.8	0	0	0	0	119.6	T301	S299-T301 PolarHBondContact O-N 3.23Å
300	I	23.1	Very low	24.5	Very low	158 Å²	158	143 Å²	143	81%	0.81	80%	0.802	S	S	*	*			trans	-44.2	117.8	158.9	-61.3	155.2	0	0	0	111.7
301	T	25.8	Very low	24.8	Very low	132 Å²	132	139.8 Å²	139.8	81%	0.81	80%	0.799	S	S	*	*			trans	-129.9	106.5	147.8	41.3	0	0	0	0	108.4	S299 S303	S299-T301 PolarHBondContact O-N 3.23Å; T301-S303 PolarHBondContact O-N 3.33Å
302	R	21.3	Very low	25.5	Very low	242 Å²	242	134.7 Å²	134.7	91%	0.913	78%	0.784	S	S	*	*			trans	-63.4	119.8	171.8	-88.4	174.7	167.1	170.7	-5.2	109.2
303	S	24.3	Very low	25.9	Very low	112 Å²	112	137.1 Å²	137.1	78%	0.783	79%	0.792	S	S	*	*			trans	-135.6	141	157.5	52.7	0	0	0	0	109.6	T301	T301-S303 PolarHBondContact O-N 3.33Å
304	N	25.7	Very low	26.7	Very low	161 Å²	161	133.8 Å²	133.8	86%	0.861	78%	0.775	S	S	*	*			trans	-61.8	140.2	-154.9	-71.9	-32.4	0	0	0	115.2	S306	N304-S306 PolarHBondContact O-N 3.07Å; N304-S306 VanDerWaalsContact O-N 3.17Å
305	V	25	Very low	27.6	Very low	149 Å²	149	134.3 Å²	134.3	90%	0.903	77%	0.771	S	S	*	*			trans	-58.1	106.3	175.3	179.3	0	0	0	0	110
306	S	25.8	Very low	28.4	Very low	85 Å²	85	136.1 Å²	136.1	59%	0.594	77%	0.769	S	S	*	*			trans	-104.8	126.2	157.4	51.6	0	0	0	0	107.5	N304 Y308	N304-S306 PolarHBondContact O-N 3.07Å; N304-S306 VanDerWaalsContact O-N 3.17Å; S306-Y308 PolarHBondContact O-N 3.47Å
307	A	26.9	Very low	29.4	Very low	98 Å²	98	139 Å²	139	81%	0.81	77%	0.771	S	S	*	*			trans	-56.3	104.7	-174.5	0	0	0	0	0	110.7	N309	A307-N309 PolarHBondContact O-N 2.85Å; A307-N309 VanDerWaalsContact O-N 3.11Å
308	Y	27.6	Very low	30.8	Very low	205 Å²	205	136.3 Å²	136.3	80%	0.804	75%	0.753	S	S	*	*			trans	-68.1	109.6	175.2	-91.4	-85.1	0	0	0	109.6	S306 T310	S306-Y308 PolarHBondContact O-N 3.47Å; Y308-T310 VanDerWaalsContact C-N 3.29Å; Y308-T310 PolarHBondContact O-N 3.14Å
309	N	28.6	Very low	32.5	Very low	143 Å²	143	135.8 Å²	135.8	77%	0.765	75%	0.749	S	S	*	*			trans	-72.7	77.2	173.2	-151.2	-4	0	0	0	109.1	A307 N311	A307-N309 PolarHBondContact O-N 2.85Å; A307-N309 VanDerWaalsContact O-N 3.11Å; N309-N311 VanDerWaalsContact C-N 3.26Å; N309-N311 PolarHBondContact O-N 3.48Å
310	T	29.1	Very low	35	Very low	117 Å²	117	133.6 Å²	133.6	72%	0.718	73%	0.734	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	42.8	-178.1	48.2	0	0	0	0	113.2	Y308	Y308-T310 VanDerWaalsContact C-N 3.29Å; Y308-T310 PolarHBondContact O-N 3.14Å
311	N	31.8	Very low	37.9	Very low	132 Å²	132	126.3 Å²	126.3	71%	0.706	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.8	-5.3	172.3	-75.6	-19.4	0	0	0	113.6	N309	N309-N311 VanDerWaalsContact C-N 3.26Å; N309-N311 PolarHBondContact O-N 3.48Å
312	G	33.5	Very low	40.6	Very low	56 Å²	56	124.4 Å²	124.4	58%	0.577	69%	0.685	S	S	*	*	S	Bend	trans	-78.3	-25.2	-174.3	0	0	0	0	0	116.2
313	L	34.9	Very low	43.8	Very low	171 Å²	171	115.9 Å²	115.9	90%	0.895	66%	0.66	S	S	*	*	S	Bend	trans	-85.5	-20.8	-164.7	-146.8	75	0	0	0	114.7
314	F	37.4	Very low	46.8	Very low	117 Å²	117	113.6 Å²	113.6	51%	0.513	64%	0.638	S	S	.	*	S	Bend	trans	-91.8	-16.8	-178.6	-119.6	-90.7	0	0	0	114.4	Q316	F314-Q316 PolarHBondContact O-N 2.94Å
315	N	42.9	Very low	49.9	Very low	134 Å²	134	111.2 Å²	111.2	72%	0.717	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79	-15.7	-177.9	-90.7	-6.1	0	0	0	114.4
316	Q	40.7	Very low	53.1	Low	178 Å²	178	108 Å²	108	83%	0.832	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.2	-5.5	-172.8	-74.9	-168.4	-10.9	0	0	116.2	F314	F314-Q316 PolarHBondContact O-N 2.94Å
317	K	43.4	Very low	56.2	Low	195 Å²	195	106.9 Å²	106.9	85%	0.848	58%	0.584	S	S	*	*			trans	-147	49.7	174.4	-70.5	-171.2	179	177.9	0	114	S319	K317-S319 PolarHBondContact O-N 3.48Å
318	S	49.5	Very low	59.4	Low	53 Å²	53	102.9 Å²	102.9	37%	0.371	55%	0.548	S	S	.	.			trans	-71.4	84	167.5	41	0	0	0	0	110	S320 K746	S318-S320 PolarHBondContact O-N 2.7Å; S318-K746 WeakPolarHBondContact OG-CE 3.47Å
319	S	61.3	Low	62.5	Low	104 Å²	104	99.2 Å²	99.2	73%	0.727	54%	0.537	S	S	*	.			trans	-56.6	130	160.5	48.1	0	0	0	0	108.3	K317 A321	K317-S319 PolarHBondContact O-N 3.48Å; S319-A321 PolarHBondContact O-N 2.85Å
320	S	76.4	Confident	65.5	Low	64 Å²	64	93.7 Å²	93.7	45%	0.448	51%	0.509	S	S	.	.			trans	-55.7	119.6	174.1	48.1	0	0	0	0	109.9	S318 T322	S318-S320 PolarHBondContact O-N 2.7Å; S320-T322 PolarHBondContact O-N 3.06Å
321	A	84.1	Confident	68.5	Low	4 Å²	4	88.8 Å²	88.8	3%	0.033	48%	0.478	C	S	.	.			trans	-86.8	88.8	176.5	0	0	0	0	0	109.2	S319 E326 R327 V330 F741 G745	S319-A321 PolarHBondContact O-N 2.85Å; A321-E326 WeakPolarHBondContact CA-OE2 3.46Å; A321-E326 HydrophobicContact CB-CB 3.85Å; A321-R327 HydrophobicContact CB-CG 3.9Å; A321-R327 WeakPolarHBondContact O-CG 3.44Å; A321-R327 PolarHBondContact O-NE 3.22Å; A321-R327 VanDerWaalsContact O-NE 3.07Å; A321-V330 HydrophobicContact CB-CG2 4.45Å; A321-F741 HydrophobicContact CB-CD1 4.16Å; A321-F741 HydrophobicContact CB-CE1 3.78Å; A321-G745 PolarHBondContact N-O 3.22Å
322	T	82.8	Confident	71.5	Confident	93 Å²	93	86.3 Å²	86.3	57%	0.571	46%	0.462	S	S	*	.			trans	-93.5	-31.4	-175.9	55.7	0	0	0	0	112	S320 E326	S320-T322 PolarHBondContact O-N 3.06Å; T322-E326 PolarHBondContact N-OE2 3.07Å; T322-E326 PolarHBondContact OG1-OE2 3.07Å
323	T	88.5	Confident	74.1	Confident	62 Å²	62	87.3 Å²	87.3	38%	0.38	45%	0.451	S	S	.	.	S	Bend	trans	-86.7	158.1	178.9	68.6	0	0	0	0	112	D325 E326 R327	T323-D325 VanDerWaalsContact C-N 3.3Å; T323-D325 PolarHBondContact O-N 3.14Å; T323-E326 PolarHBondContact N-OE2 3.12Å; T323-E326 VanDerWaalsContact N-OE2 3.15Å; T323-E326 PolarHBondContact O-N 3.08Å; T323-E326 WeakPolarHBondContact OG1-CB 3.48Å; T323-E326 WeakPolarHBondContact OG1-CG 3.38Å; T323-E326 PolarHBondContact OG1-N 3.28Å; T323-E326 PolarHBondContact OG1-OE1 3.49Å; T323-E326 PolarHBondContact OG1-OE2 3.18Å; T323-R327 WeakPolarHBondContact O-CG 3.42Å; T323-R327 PolarHBondContact O-N 3.49Å; T323-R327 VanDerWaalsContact O-N 3.1Å
324	L	87.6	Confident	76.7	Confident	64 Å²	64	79.5 Å²	79.5	34%	0.335	41%	0.411	S	S	.	.	H	α-helix	trans	-58.2	-43.2	176.5	-175.6	122.4	0	0	0	111.9	R327 L328 Y385 A388 A389	L324-R327 PolarHBondContact O-N 2.98Å; L324-L328 WeakPolarHBondContact O-CB 3.49Å; L324-L328 PolarHBondContact O-N 3.25Å; L324-Y385 HydrophobicContact CD1-CD1 4.11Å; L324-Y385 HydrophobicContact CG-CD1 4.1Å; L324-A388 HydrophobicContact CD1-CB 3.65Å; L324-A388 HydrophobicContact CD2-CB 4.43Å; L324-A389 HydrophobicContact CD2-CB 3.71Å
325	D	89.8	Confident	79.2	Confident	111 Å²	111	76 Å²	76	59%	0.594	40%	0.395	S	S	*	.	H	α-helix	trans	-69	-38.6	-179	-65.7	-35.3	0	0	0	112.1	T323 L328 F329	T323-D325 VanDerWaalsContact C-N 3.3Å; T323-D325 PolarHBondContact O-N 3.14Å; D325-L328 PolarHBondContact O-N 3.2Å; D325-F329 WeakPolarHBondContact O-CB 3.37Å; D325-F329 PolarHBondContact O-N 3.27Å
326	E	91.5	Very high	81.4	Confident	81 Å²	81	77 Å²	77	38%	0.379	39%	0.388	S	S	.	.	H	α-helix	trans	-61.9	-45.2	173.8	-76.6	163.4	-168.1	0	0	111.6	A321 T322 T323 L328 F329 V330	A321-E326 WeakPolarHBondContact CA-OE2 3.46Å; A321-E326 HydrophobicContact CB-CB 3.85Å; T322-E326 PolarHBondContact N-OE2 3.07Å; T322-E326 PolarHBondContact OG1-OE2 3.07Å; T323-E326 PolarHBondContact N-OE2 3.12Å; T323-E326 VanDerWaalsContact N-OE2 3.15Å; T323-E326 PolarHBondContact O-N 3.08Å; T323-E326 WeakPolarHBondContact OG1-CB 3.48Å; T323-E326 WeakPolarHBondContact OG1-CG 3.38Å; T323-E326 PolarHBondContact OG1-N 3.28Å; T323-E326 PolarHBondContact OG1-OE1 3.49Å; T323-E326 PolarHBondContact OG1-OE2 3.18Å; E326-L328 VanDerWaalsContact C-N 3.35Å; E326-F329 PolarHBondContact O-N 3.05Å; E326-V330 WeakPolarHBondContact O-CG2 3.3Å; E326-V330 PolarHBondContact O-N 3.2Å; E326-V330 VanDerWaalsContact O-N 3.09Å
327	R	92.6	Very high	83.7	Confident	62 Å²	62	72.7 Å²	72.7	23%	0.234	36%	0.364	C	S	.	.	H	α-helix	trans	-63.9	-42.5	177.5	-70.6	-175.9	-177	-177.4	5.3	111.4	A321 T323 L324 V330 L331 Y385 F741	A321-R327 HydrophobicContact CB-CG 3.9Å; A321-R327 WeakPolarHBondContact O-CG 3.44Å; A321-R327 PolarHBondContact O-NE 3.22Å; A321-R327 VanDerWaalsContact O-NE 3.07Å; T323-R327 WeakPolarHBondContact O-CG 3.42Å; T323-R327 PolarHBondContact O-N 3.49Å; T323-R327 VanDerWaalsContact O-N 3.1Å; L324-R327 PolarHBondContact O-N 2.98Å; R327-V330 PolarHBondContact O-N 2.98Å; R327-L331 VanDerWaalsContact O-CG 3.31Å; R327-L331 WeakPolarHBondContact O-CG 2.98Å; R327-L331 PolarHBondContact O-N 3.47Å; R327-Y385 HydrophobicContact CB-CD1 4.24Å; R327-Y385 HydrophobicContact CB-CE1 4.04Å; R327-Y385 PolarHBondContact NH1-OH 3.49Å; R327-Y385 VanDerWaalsContact NH1-OH 3.12Å; R327-F741 HydrophobicContact CB-CD2 4.48Å; R327-F741 HydrophobicContact CB-CE1 4.43Å; R327-F741 HydrophobicContact CB-CE2 3.8Å; R327-F741 HydrophobicContact CB-CZ 3.77Å; R327-F741 HydrophobicContact CG-CD1 4.28Å; R327-F741 HydrophobicContact CG-CD2 4.11Å; R327-F741 HydrophobicContact CG-CE1 4.06Å; R327-F741 HydrophobicContact CG-CE2 3.87Å; R327-F741 HydrophobicContact CG-CG 4.31Å; R327-F741 HydrophobicContact CG-CZ 3.85Å
328	L	93	Very high	85.7	Confident	14 Å²	14	65.7 Å²	65.7	7%	0.073	34%	0.336	C	S	.	.	H	α-helix	trans	-60.1	-46.2	176.5	178.4	57	0	0	0	111.5	L324 D325 E326 L331 Q332 L382 C386 A389	L324-L328 WeakPolarHBondContact O-CB 3.49Å; L324-L328 PolarHBondContact O-N 3.25Å; D325-L328 PolarHBondContact O-N 3.2Å; E326-L328 VanDerWaalsContact C-N 3.35Å; L328-L331 PolarHBondContact O-N 3.09Å; L328-Q332 HydrophobicContact CD1-CG 4Å; L328-Q332 HydrophobicContact CG-CG 4.42Å; L328-Q332 WeakPolarHBondContact O-CB 3.26Å; L328-Q332 VanDerWaalsContact O-CG 3.32Å; L328-Q332 WeakPolarHBondContact O-CG 3.35Å; L328-Q332 PolarHBondContact O-N 2.94Å; L328-L382 HydrophobicContact CD1-CD1 4.03Å; L328-C386 HydrophobicContact CD1-CB 4.41Å; L328-C386 VanDerWaalsContact CD1-SG 3.52Å; L328-A389 HydrophobicContact CD2-CB 3.65Å
329	F	92.7	Very high	87.4	Confident	128 Å²	128	64.5 Å²	64.5	56%	0.561	33%	0.328	S	S	*	.	H	α-helix	trans	-59.6	-48.5	178.9	-179.2	-99	0	0	0	111.9	D325 E326 L331 Q332 E333	D325-F329 WeakPolarHBondContact O-CB 3.37Å; D325-F329 PolarHBondContact O-N 3.27Å; E326-F329 PolarHBondContact O-N 3.05Å; F329-L331 VanDerWaalsContact C-N 3.34Å; F329-L331 PolarHBondContact O-N 3.33Å; F329-Q332 PolarHBondContact O-N 2.9Å; F329-E333 HydrophobicContact CD1-CG 4.46Å; F329-E333 HydrophobicContact CE1-CG 4.02Å; F329-E333 HydrophobicContact CE2-CG 4.29Å; F329-E333 HydrophobicContact CZ-CG 3.93Å; F329-E333 PolarHBondContact O-N 3.45Å
330	V	91.9	Very high	88.5	Confident	28 Å²	28	63.7 Å²	63.7	17%	0.17	31%	0.312	C	S	.	.	H	α-helix	trans	-60	-43.6	178.2	172.9	0	0	0	0	111.4	A321 E326 R327 N334 F741 Y747	A321-V330 HydrophobicContact CB-CG2 4.45Å; E326-V330 WeakPolarHBondContact O-CG2 3.3Å; E326-V330 PolarHBondContact O-N 3.2Å; E326-V330 VanDerWaalsContact O-N 3.09Å; R327-V330 PolarHBondContact O-N 2.98Å; V330-N334 VanDerWaalsContact O-CG 3.3Å; V330-N334 PolarHBondContact O-N 3.25Å; V330-N334 VanDerWaalsContact O-N 3.12Å; V330-N334 PolarHBondContact O-ND2 2.89Å; V330-N334 VanDerWaalsContact O-ND2 3.14Å; V330-F741 HydrophobicContact CB-CE1 4.19Å; V330-F741 HydrophobicContact CB-CZ 4.09Å; V330-F741 HydrophobicContact CG1-CE1 4.04Å; V330-F741 HydrophobicContact CG1-CZ 4.1Å; V330-Y747 HydrophobicContact CG1-CD2 3.73Å; V330-Y747 HydrophobicContact CG1-CE2 4.36Å; V330-Y747 HydrophobicContact CG1-CG 3.96Å
331	L	93.1	Very high	88.7	Confident	13 Å²	13	65.3 Å²	65.3	7%	0.068	32%	0.316	C	S	.	.	H	α-helix	trans	-67	-37.2	178.6	-69.7	172.8	0	0	0	112.6	R327 L328 F329 Y335 E381 L382 Y385 F741 Y747	R327-L331 VanDerWaalsContact O-CG 3.31Å; R327-L331 WeakPolarHBondContact O-CG 2.98Å; R327-L331 PolarHBondContact O-N 3.47Å; L328-L331 PolarHBondContact O-N 3.09Å; F329-L331 VanDerWaalsContact C-N 3.34Å; F329-L331 PolarHBondContact O-N 3.33Å; L331-Y335 VanDerWaalsContact O-CB 3.32Å; L331-Y335 WeakPolarHBondContact O-CB 3.31Å; L331-Y335 PolarHBondContact O-N 3.05Å; L331-E381 HydrophobicContact CD1-CG 3.9Å; L331-L382 HydrophobicContact CB-CD1 3.72Å; L331-Y385 HydrophobicContact CD1-CD2 3.4Å; L331-Y385 HydrophobicContact CD1-CE2 3.91Å; L331-Y385 HydrophobicContact CD1-CG 4.23Å; L331-F741 HydrophobicContact CD1-CE2 4.02Å; L331-F741 HydrophobicContact CD2-CE2 4.11Å; L331-F741 HydrophobicContact CD2-CZ 4.4Å; L331-F741 HydrophobicContact CG-CE2 3.9Å; L331-F741 HydrophobicContact CG-CZ 4.05Å; L331-Y747 HydrophobicContact CD2-CE2 4.37Å
332	Q	92.9	Very high	88.3	Confident	81 Å²	81	67.9 Å²	67.9	38%	0.379	32%	0.324	S	S	.	.	H	α-helix	trans	-67.3	-40.7	177	-76.4	177.5	-16.7	0	0	112.3	L328 F329 Y335 R336 L382	L328-Q332 HydrophobicContact CD1-CG 4Å; L328-Q332 HydrophobicContact CG-CG 4.42Å; L328-Q332 WeakPolarHBondContact O-CB 3.26Å; L328-Q332 VanDerWaalsContact O-CG 3.32Å; L328-Q332 WeakPolarHBondContact O-CG 3.35Å; L328-Q332 PolarHBondContact O-N 2.94Å; F329-Q332 PolarHBondContact O-N 2.9Å; Q332-Y335 WeakPolarHBondContact O-CB 3.44Å; Q332-Y335 PolarHBondContact O-N 3.18Å; Q332-R336 WeakPolarHBondContact O-CB 3.16Å; Q332-R336 PolarHBondContact O-N 2.85Å; Q332-L382 HydrophobicContact CG-CD1 3.8Å
333	E	89.5	Confident	87.7	Confident	76 Å²	76	66.6 Å²	66.6	36%	0.355	32%	0.319	S	S	.	.	H	α-helix	trans	-65.3	-41.2	176	-73.5	-59	122.5	0	0	111.8	F329 Y335 R336 R337	F329-E333 HydrophobicContact CD1-CG 4.46Å; F329-E333 HydrophobicContact CE1-CG 4.02Å; F329-E333 HydrophobicContact CE2-CG 4.29Å; F329-E333 HydrophobicContact CZ-CG 3.93Å; F329-E333 PolarHBondContact O-N 3.45Å; E333-Y335 VanDerWaalsContact C-N 3.34Å; E333-R336 PolarHBondContact O-N 3.41Å; E333-R337 PolarHBondContact O-N 2.98Å
334	N	88.7	Confident	87	Confident	7 Å²	7	68.3 Å²	68.3	4%	0.037	33%	0.325	C	S	.	.	H	α-helix	trans	-65.4	-39.4	173.3	-68.7	-29.1	0	0	0	111.7	V330 R337 D338 Y747	V330-N334 VanDerWaalsContact O-CG 3.3Å; V330-N334 PolarHBondContact O-N 3.25Å; V330-N334 VanDerWaalsContact O-N 3.12Å; V330-N334 PolarHBondContact O-ND2 2.89Å; V330-N334 VanDerWaalsContact O-ND2 3.14Å; N334-R337 PolarHBondContact O-N 3.35Å; N334-R337 PolarHBondContact OD1-NH1 3.32Å; N334-D338 PolarHBondContact O-N 3.31Å; N334-D338 VanDerWaalsContact O-N 3.1Å; N334-Y747 WeakPolarHBondContact ND2-CE1 3.2Å; N334-Y747 WeakPolarHBondContact ND2-CE2 3.26Å; N334-Y747 PolarHBondContact ND2-OH 3.16Å
335	Y	91.1	Very high	85.7	Confident	45 Å²	45	69 Å²	69	18%	0.176	34%	0.335	C	S	.	.	H	α-helix	trans	-57.9	-50.2	173.6	-177.9	-96.3	0	0	0	112.5	L331 Q332 E333 R337 D338 C339 L382 L432 E435	L331-Y335 VanDerWaalsContact O-CB 3.32Å; L331-Y335 WeakPolarHBondContact O-CB 3.31Å; L331-Y335 PolarHBondContact O-N 3.05Å; Q332-Y335 WeakPolarHBondContact O-CB 3.44Å; Q332-Y335 PolarHBondContact O-N 3.18Å; E333-Y335 VanDerWaalsContact C-N 3.34Å; Y335-R337 VanDerWaalsContact C-N 3.34Å; Y335-R337 PolarHBondContact O-N 2.62Å; Y335-D338 PolarHBondContact O-N 3Å; Y335-C339 VanDerWaalsContact CE1-SG 3.56Å; Y335-C339 VanDerWaalsContact CZ-SG 3.58Å; Y335-C339 PolarHBondContact O-N 2.77Å; Y335-C339 PolarHBondContact O-SG 2.88Å; Y335-C339 VanDerWaalsContact O-SG 3.4Å; Y335-L382 HydrophobicContact CD1-CD2 4.44Å; Y335-L382 HydrophobicContact CD2-CD2 3.62Å; Y335-L382 HydrophobicContact CE2-CD2 4.33Å; Y335-L382 HydrophobicContact CG-CD2 3.69Å; Y335-L432 HydrophobicContact CD2-CD1 3.7Å; Y335-L432 HydrophobicContact CE2-CD1 3.62Å; Y335-L432 HydrophobicContact CE2-CG 4.12Å; Y335-E435 HydrophobicContact CE2-CG 4.16Å; Y335-E435 WeakPolarHBondContact CE2-OE1 3.38Å; Y335-E435 WeakPolarHBondContact CE2-OE2 3.43Å; Y335-E435 PolarHBondContact OH-OE1 2.82Å; Y335-E435 PolarHBondContact OH-OE2 3.45Å
336	R	88.9	Confident	84.1	Confident	153 Å²	153	69.9 Å²	69.9	58%	0.577	34%	0.336	S	S	*	.	H	α-helix	trans	-58	-47.2	178.7	-175.6	-175.6	173.9	120.9	6.2	111.5	Q332 E333 D338 C339 E340	Q332-R336 WeakPolarHBondContact O-CB 3.16Å; Q332-R336 PolarHBondContact O-N 2.85Å; E333-R336 PolarHBondContact O-N 3.41Å; R336-D338 VanDerWaalsContact C-N 3.33Å; R336-D338 PolarHBondContact O-N 3.22Å; R336-C339 PolarHBondContact O-N 2.62Å; R336-E340 IonicContact CZ-OE1 3.57Å; R336-E340 IonicContact NE-OE1 2.88Å; R336-E340 PolarHBondContact NE-OE1 3.01Å; R336-E340 IonicContact NH2-OE1 3.37Å; R336-E340 PolarHBondContact NH2-OE1 3.3Å; R336-E340 WeakPolarHBondContact O-CG 3.48Å; R336-E340 PolarHBondContact O-N 3.49Å
337	R	88.2	Confident	82	Confident	88 Å²	88	70.2 Å²	70.2	33%	0.332	35%	0.347	S	S	.	.	H	α-helix	trans	-58.8	-43.5	179.1	-167.7	-177.3	-54.9	110.5	8.6	112.2	E333 N334 Y335 E340 L341	E333-R337 PolarHBondContact O-N 2.98Å; N334-R337 PolarHBondContact O-N 3.35Å; N334-R337 PolarHBondContact OD1-NH1 3.32Å; Y335-R337 VanDerWaalsContact C-N 3.34Å; Y335-R337 PolarHBondContact O-N 2.62Å; R337-E340 PolarHBondContact O-N 2.94Å; R337-L341 HydrophobicContact CG-CD1 4.43Å; R337-L341 WeakPolarHBondContact O-CG 3.35Å; R337-L341 PolarHBondContact O-N 3.42Å
338	D	85.6	Confident	79.4	Confident	48 Å²	48	71.6 Å²	71.6	26%	0.257	36%	0.362	S	S	.	.	H	α-helix	trans	-72.8	-32	-178.5	-66.3	-30.1	0	0	0	112.8	N334 Y335 R336 L341 R342 L432 R434	N334-D338 PolarHBondContact O-N 3.31Å; N334-D338 VanDerWaalsContact O-N 3.1Å; Y335-D338 PolarHBondContact O-N 3Å; R336-D338 VanDerWaalsContact C-N 3.33Å; R336-D338 PolarHBondContact O-N 3.22Å; D338-L341 PolarHBondContact O-N 3.17Å; D338-R342 PolarHBondContact O-N 3.5Å; D338-L432 HydrophobicContact CB-CD1 3.79Å; D338-L432 HydrophobicContact CB-CD2 4.5Å; D338-R434 IonicContact OD2-CZ 3.53Å; D338-R434 IonicContact OD2-NH1 3.8Å; D338-R434 PolarHBondContact OD2-NH1 3.43Å; D338-R434 IonicContact OD2-NH2 2.87Å; D338-R434 PolarHBondContact OD2-NH2 3.47Å
339	C	84.6	Confident	76.8	Confident	29 Å²	29	76.9 Å²	76.9	20%	0.196	39%	0.39	C	S	.	.	H	α-helix	trans	-63.3	-42	169.1	-72	0	0	0	0	111.7	Y335 R336 R342 S343	Y335-C339 VanDerWaalsContact CE1-SG 3.56Å; Y335-C339 VanDerWaalsContact CZ-SG 3.58Å; Y335-C339 PolarHBondContact O-N 2.77Å; Y335-C339 PolarHBondContact O-SG 2.88Å; Y335-C339 VanDerWaalsContact O-SG 3.4Å; R336-C339 PolarHBondContact O-N 2.62Å; C339-R342 PolarHBondContact O-N 3.13Å; C339-S343 PolarHBondContact O-N 3.2Å
340	E	84.3	Confident	74.4	Confident	86 Å²	86	75.7 Å²	75.7	40%	0.402	40%	0.396	S	S	.	.	H	α-helix	trans	-66.3	-40.8	175.8	-71	172.4	-176.4	0	0	111.9	R336 R337 R342 S343 I344	R336-E340 IonicContact CZ-OE1 3.57Å; R336-E340 IonicContact NE-OE1 2.88Å; R336-E340 PolarHBondContact NE-OE1 3.01Å; R336-E340 IonicContact NH2-OE1 3.37Å; R336-E340 PolarHBondContact NH2-OE1 3.3Å; R336-E340 WeakPolarHBondContact O-CG 3.48Å; R336-E340 PolarHBondContact O-N 3.49Å; R337-E340 PolarHBondContact O-N 2.94Å; E340-R342 VanDerWaalsContact C-N 3.29Å; E340-R342 PolarHBondContact O-N 3.39Å; E340-S343 PolarHBondContact O-N 3.41Å; E340-S343 PolarHBondContact O-OG 2.98Å; E340-I344 WeakPolarHBondContact O-CD1 3.41Å; E340-I344 VanDerWaalsContact O-CG1 3.23Å; E340-I344 WeakPolarHBondContact O-CG1 3.49Å; E340-I344 PolarHBondContact O-N 3.47Å
341	L	80.4	Confident	71.9	Confident	99 Å²	99	83 Å²	83	52%	0.518	43%	0.425	S	S	.	.	H	α-helix	trans	-62.7	-37.2	175.1	-73	172.4	0	0	0	112.2	R337 D338 S345	R337-L341 HydrophobicContact CG-CD1 4.43Å; R337-L341 WeakPolarHBondContact O-CG 3.35Å; R337-L341 PolarHBondContact O-N 3.42Å; D338-L341 PolarHBondContact O-N 3.17Å; L341-S345 PolarHBondContact O-N 3.33Å
342	R	75.7	Confident	69.2	Low	57 Å²	57	89.4 Å²	89.4	22%	0.215	46%	0.458	C	S	.	.	H	α-helix	trans	-68.2	-44.9	176.5	-169.8	179.4	-177	172.2	11.2	112	D338 C339 E340 I344 S345 E346 V430 P431	D338-R342 PolarHBondContact O-N 3.5Å; C339-R342 PolarHBondContact O-N 3.13Å; E340-R342 VanDerWaalsContact C-N 3.29Å; E340-R342 PolarHBondContact O-N 3.39Å; R342-I344 VanDerWaalsContact C-N 3.26Å; R342-I344 PolarHBondContact O-N 2.87Å; R342-S345 WeakPolarHBondContact CA-OG 3.49Å; R342-S345 PolarHBondContact O-N 3.49Å; R342-S345 VanDerWaalsContact O-N 3.11Å; R342-S345 PolarHBondContact O-OG 3.3Å; R342-E346 IonicContact NE-OE1 3.13Å; R342-E346 PolarHBondContact NE-OE1 3Å; R342-E346 PolarHBondContact O-N 2.91Å; R342-V430 PolarHBondContact NH1-O 3.47Å; R342-P431 PolarHBondContact NH1-O 2.97Å
343	S	71.2	Confident	66.2	Low	66 Å²	66	94 Å²	94	46%	0.462	48%	0.48	S	S	.	.	H	α-helix	trans	-63.7	-34.3	178.1	64.5	0	0	0	0	112	C339 E340 E346 S347	C339-S343 PolarHBondContact O-N 3.2Å; E340-S343 PolarHBondContact O-N 3.41Å; E340-S343 PolarHBondContact O-OG 2.98Å; S343-E346 PolarHBondContact O-N 3.21Å; S343-S347 PolarHBondContact O-N 3.36Å; S343-S347 PolarHBondContact O-OG 2.96Å
344	I	73.2	Confident	63.1	Low	98 Å²	98	98.4 Å²	98.4	50%	0.503	49%	0.494	S	S	.	.	H	α-helix	trans	-63.6	-46.9	171.8	-66.2	163.5	0	0	0	110.3	E340 R342 E346 S347 V348	E340-I344 WeakPolarHBondContact O-CD1 3.41Å; E340-I344 VanDerWaalsContact O-CG1 3.23Å; E340-I344 WeakPolarHBondContact O-CG1 3.49Å; E340-I344 PolarHBondContact O-N 3.47Å; R342-I344 VanDerWaalsContact C-N 3.26Å; R342-I344 PolarHBondContact O-N 2.87Å; I344-E346 VanDerWaalsContact C-N 3.27Å; I344-E346 PolarHBondContact O-N 3.19Å; I344-S347 PolarHBondContact O-N 3.47Å; I344-S347 PolarHBondContact O-OG 3.47Å; I344-V348 PolarHBondContact O-N 3.28Å
345	S	61.3	Low	60.4	Low	79 Å²	79	102.4 Å²	102.4	55%	0.552	52%	0.523	S	S	*	.	H	α-helix	trans	-61.9	-31.7	179.8	69.8	0	0	0	0	113.9	L341 R342	L341-S345 PolarHBondContact O-N 3.33Å; R342-S345 WeakPolarHBondContact CA-OG 3.49Å; R342-S345 PolarHBondContact O-N 3.49Å; R342-S345 VanDerWaalsContact O-N 3.11Å; R342-S345 PolarHBondContact O-OG 3.3Å
346	E	55.9	Low	57.4	Low	129 Å²	129	107.2 Å²	107.2	60%	0.603	55%	0.552	S	S	*	*	H	α-helix	trans	-76.5	-22	175.4	-71	173.7	-172.5	0	0	112.7	R342 S343 I344	R342-E346 IonicContact NE-OE1 3.13Å; R342-E346 PolarHBondContact NE-OE1 3Å; R342-E346 PolarHBondContact O-N 2.91Å; S343-E346 PolarHBondContact O-N 3.21Å; I344-E346 VanDerWaalsContact C-N 3.27Å; I344-E346 PolarHBondContact O-N 3.19Å
347	S	46.5	Very low	54.7	Low	89 Å²	89	106.7 Å²	106.7	62%	0.622	56%	0.559	S	S	*	*	H	α-helix	trans	-90.2	-12.1	-178.1	72.6	0	0	0	0	115.1	S343 I344 D349	S343-S347 PolarHBondContact O-N 3.36Å; S343-S347 PolarHBondContact O-OG 2.96Å; I344-S347 PolarHBondContact O-N 3.47Å; I344-S347 PolarHBondContact O-OG 3.47Å; S347-D349 PolarHBondContact O-N 2.88Å
348	V	39.8	Very low	51.9	Low	91 Å²	91	106.1 Å²	106.1	55%	0.552	57%	0.567	S	S	*	*	S	Bend	trans	-74.1	118.3	176	178.9	0	0	0	0	108.6	I344	I344-V348 PolarHBondContact O-N 3.28Å
349	D	37.5	Very low	49.4	Very low	124 Å²	124	109 Å²	109	66%	0.663	58%	0.583	S	S	*	*			trans	-34.2	124.9	-179	-108.8	-39.1	0	0	0	112.5	S347 K351	S347-D349 PolarHBondContact O-N 2.88Å; D349-K351 PolarHBondContact O-N 3.31Å
350	P	41.7	Very low	47.3	Very low	104 Å²	104	114.8 Å²	114.8	68%	0.675	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	10.6	-174.5	5.7	-5.4	0	0	0	115.3	Y354	P350-Y354 WeakPolarHBondContact O-CE2 3.47Å
351	K	40.8	Very low	45.6	Very low	181 Å²	181	117.8 Å²	117.8	79%	0.787	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.8	-9.7	179.6	-73.8	-174	175.8	-178.8	0	114.7	D349	D349-K351 PolarHBondContact O-N 3.31Å
352	I	35.9	Very low	43.5	Very low	148 Å²	148	117.3 Å²	117.3	76%	0.759	63%	0.632	S	S	*	*	S	Bend	trans	-110.1	6.2	-174.5	-53.9	-179.5	0	0	0	113.4
353	Q	29	Very low	41.5	Very low	177 Å²	177	121.5 Å²	121.5	83%	0.827	66%	0.658	S	S	*	*			trans	-123.1	37.3	177.8	-133.1	174.8	19.5	0	0	114.3	S355	Q353-S355 PolarHBondContact O-N 3.36Å
354	Y	26.1	Very low	39.6	Very low	169 Å²	169	126.1 Å²	126.1	66%	0.663	67%	0.673	S	S	*	*			trans	-90.2	82.6	158.6	-72	-85.9	0	0	0	108.6	P350	P350-Y354 WeakPolarHBondContact O-CE2 3.47Å
355	S	30.7	Very low	37.5	Very low	91 Å²	91	126.6 Å²	126.6	64%	0.636	68%	0.682	S	S	*	*			trans	-108.1	86.2	156.8	59.4	0	0	0	0	107.1	Q353 I357	Q353-S355 PolarHBondContact O-N 3.36Å; S355-I357 PolarHBondContact O-N 2.9Å
356	D	28.6	Very low	36.4	Very low	146 Å²	146	128.8 Å²	128.8	78%	0.781	69%	0.686	S	S	*	*			trans	18.4	64.8	150.7	-53.7	-27.1	0	0	0	117.8
357	I	32.9	Very low	35.7	Very low	142 Å²	142	133.7 Å²	133.7	73%	0.728	70%	0.699	S	S	*	*			trans	-124.3	72.5	155.7	-52	178.1	0	0	0	106.9	S355	S355-I357 PolarHBondContact O-N 2.9Å
358	C	28.3	Very low	35.8	Very low	75 Å²	75	138.4 Å²	138.4	51%	0.507	71%	0.711	S	S	.	*			trans	-68.1	136.9	162.5	-60.2	0	0	0	0	107.9	N360	C358-N360 PolarHBondContact O-N 3.19Å
359	N	32.4	Very low	36.7	Very low	110 Å²	110	137.5 Å²	137.5	59%	0.588	71%	0.713	S	S	*	*			trans	-70.1	115	171.5	-162.8	11.7	0	0	0	106.8	N361 T362	N359-N361 PolarHBondContact O-N 3.46Å; N359-T362 PolarHBondContact O-N 2.81Å
360	N	41.8	Very low	38.4	Very low	150 Å²	150	135.3 Å²	135.3	80%	0.802	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.5	-7.8	-168.3	-75.5	-5.1	0	0	0	116.7	C358	C358-N360 PolarHBondContact O-N 3.19Å
361	N	47.4	Very low	40.5	Very low	149 Å²	149	131.8 Å²	131.8	80%	0.797	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.7	-15.6	-176.9	-65.4	-14.6	0	0	0	114.7	N359	N359-N361 PolarHBondContact O-N 3.46Å
362	T	37.3	Very low	42.8	Very low	88 Å²	88	131.4 Å²	131.4	54%	0.54	68%	0.679	S	S	.	*			trans	-153.8	104.5	-178.8	55.4	0	0	0	0	110	N359 E364	N359-T362 PolarHBondContact O-N 2.81Å; T362-E364 PolarHBondContact O-N 3.34Å
363	D	33.9	Very low	45.6	Very low	146 Å²	146	124.8 Å²	124.8	78%	0.781	65%	0.648	S	S	*	*			trans	-69.2	51.7	176.3	-69.6	-45.9	0	0	0	113.2
364	E	31.7	Very low	48.7	Very low	163 Å²	163	120.1 Å²	120.1	76%	0.762	63%	0.631	S	S	*	*			trans	-107.2	141.7	167.7	-78.9	-154.1	159.8	0	0	111.7	T362 I366	T362-E364 PolarHBondContact O-N 3.34Å; E364-I366 PolarHBondContact O-N 2.84Å
365	P	29.3	Very low	52.1	Low	107 Å²	107	112.5 Å²	112.5	70%	0.695	60%	0.602	S	S	*	*			trans	-66.7	131.5	-177.3	26	-32.9	0	0	0	111.9	R367	P365-R367 PolarHBondContact O-N 2.9Å
366	I	37.1	Very low	55.2	Low	125 Å²	125	111.8 Å²	111.8	64%	0.641	59%	0.589	S	S	*	*			trans	-60.1	97.7	179.9	-57	169.8	0	0	0	109.3	E364 H368 A369	E364-I366 PolarHBondContact O-N 2.84Å; I366-H368 PolarHBondContact O-N 3.4Å; I366-A369 HydrophobicContact CG2-CB 4.4Å
367	R	41.2	Very low	58.4	Low	233 Å²	233	105.6 Å²	105.6	88%	0.879	56%	0.556	S	S	*	*			trans	-50.4	130.8	161.6	-69.5	-176.1	177.9	-160.2	0.5	107.7	P365 A369	P365-R367 PolarHBondContact O-N 2.9Å; R367-A369 PolarHBondContact O-N 3.11Å; R367-A369 VanDerWaalsContact O-N 3.17Å
368	H	49.8	Very low	61.5	Low	187 Å²	187	99.6 Å²	99.6	87%	0.866	53%	0.525	S	S	*	.	S	Bend	trans	-12.6	106.4	-176.4	-63.5	-74.6	0	0	0	113.6	I366	I366-H368 PolarHBondContact O-N 3.4Å
369	A	57.9	Low	64.8	Low	72 Å²	72	96.1 Å²	96.1	60%	0.595	50%	0.501	S	S	*	.	P	Polyproline II helix	trans	-50.7	133.4	-178.5	0	0	0	0	0	110.3	I366 R367 I371	I366-A369 HydrophobicContact CG2-CB 4.4Å; R367-A369 PolarHBondContact O-N 3.11Å; R367-A369 VanDerWaalsContact O-N 3.17Å; A369-I371 PolarHBondContact O-N 3.49Å
370	P	72.7	Confident	67.8	Low	78 Å²	78	91.2 Å²	91.2	51%	0.506	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-56.8	134.6	-177.7	20.7	-31	0	0	0	110.4	K372 N488	P370-K372 PolarHBondContact O-N 3.38Å; P370-K372 VanDerWaalsContact O-N 3.13Å; P370-N488 HydrophobicContact CB-CB 4.45Å
371	I	85.4	Confident	70.4	Confident	31 Å²	31	85.2 Å²	85.2	16%	0.159	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-61.6	118.6	179.5	-55.1	172.7	0	0	0	107.5	A369 V430 P433 L436 Q487	A369-I371 PolarHBondContact O-N 3.49Å; I371-V430 HydrophobicContact CD1-CG1 3.59Å; I371-P433 HydrophobicContact CG2-CG 4.22Å; I371-L436 HydrophobicContact CB-CD1 4.21Å; I371-L436 HydrophobicContact CG2-CD1 3.72Å; I371-Q487 WeakPolarHBondContact O-CB 3.45Å; I371-Q487 VanDerWaalsContact O-CG 3.25Å; I371-Q487 WeakPolarHBondContact O-CG 3.34Å
372	K	88.9	Confident	72.6	Confident	173 Å²	173	79.6 Å²	79.6	75%	0.752	41%	0.412	S	S	*	.	P	Polyproline II helix	trans	-88.7	118.7	172.2	-68	-176.4	-179.8	179.2	0	109	P370 P433	P370-K372 PolarHBondContact O-N 3.38Å; P370-K372 VanDerWaalsContact O-N 3.13Å; K372-P433 WeakPolarHBondContact O-CB 3.37Å
373	G	94.7	Very high	75.4	Confident	9 Å²	9	77.1 Å²	77.1	9%	0.093	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-67.5	143.7	177.3	0	0	0	0	0	112.4	P433 L436 Q487	G373-P433 WeakPolarHBondContact CA-O 3.42Å; G373-L436 CarbonylContact C-O 3.44Å; G373-L436 WeakPolarHBondContact CA-O 3.46Å; G373-Q487 VanDerWaalsContact CA-OE1 3.24Å
374	T	95.3	Very high	78.4	Confident	79 Å²	79	70.3 Å²	70.3	49%	0.485	36%	0.358	S	S	.	.			trans	-125.5	10.9	179.9	62.6	0	0	0	0	112.5	E376 P433 R434 L436	T374-E376 PolarHBondContact O-N 3.16Å; T374-P433 HydrophobicContact CG2-CB 4.09Å; T374-P433 PolarHBondContact N-O 3.43Å; T374-R434 WeakPolarHBondContact OG1-CA 3.37Å; T374-R434 PolarHBondContact OG1-N 3.07Å; T374-L436 PolarHBondContact N-O 3.47Å; T374-L436 VanDerWaalsContact N-O 3.17Å
375	C	96	Very high	81.4	Confident	8 Å²	8	63 Å²	63	5%	0.054	32%	0.324	C	S	.	.			trans	-77.2	104.3	175.8	-171.4	0	0	0	0	110.6	D377 R434 L436 R437 P438	C375-D377 VanDerWaalsContact C-N 3.27Å; C375-D377 PolarHBondContact O-N 3.43Å; C375-D377 PolarHBondContact SG-O 3.35Å; C375-R434 VanDerWaalsContact CB-O 3.28Å; C375-R434 WeakPolarHBondContact CB-O 2.93Å; C375-L436 WeakPolarHBondContact CB-O 3.41Å; C375-L436 PolarHBondContact N-O 2.82Å; C375-R437 HydrophobicContact CB-CG 4.03Å; C375-P438 WeakPolarHBondContact O-CD 3.44Å
376	E	95.8	Very high	84.5	Confident	77 Å²	77	59.4 Å²	59.4	36%	0.36	30%	0.301	S	S	.	.			trans	-77.2	-10.7	178.1	-66.2	-59	142.9	0	0	113.7	T374 R444	T374-E376 PolarHBondContact O-N 3.16Å; E376-R444 PolarHBondContact O-NH2 3.37Å
377	D	97	Very high	87.3	Confident	15 Å²	15	53.7 Å²	53.7	8%	0.08	27%	0.271	C	S	.	.	S	Bend	trans	-96.2	157.6	-179	-64.2	-28	0	0	0	112.4	C375 C379 R384 R437 V441 V737 Q738	C375-D377 VanDerWaalsContact C-N 3.27Å; C375-D377 PolarHBondContact O-N 3.43Å; C375-D377 PolarHBondContact SG-O 3.35Å; D377-C379 WeakPolarHBondContact CB-O 3.23Å; D377-C379 PolarHBondContact O-N 2.95Å; D377-R384 IonicContact OD2-CZ 3.06Å; D377-R384 IonicContact OD2-NH1 2.66Å; D377-R384 PolarHBondContact OD2-NH1 3.17Å; D377-R384 IonicContact OD2-NH2 2.72Å; D377-R384 PolarHBondContact OD2-NH2 3.49Å; D377-R437 WeakPolarHBondContact O-CD 3.28Å; D377-R437 WeakPolarHBondContact O-CG 3.43Å; D377-V441 WeakPolarHBondContact O-CG1 3.22Å; D377-V737 WeakPolarHBondContact OD1-CA 3.4Å; D377-Q738 PolarHBondContact OD1-N 3.16Å; D377-Q738 PolarHBondContact OD2-N 2.84Å
378	M	97.3	Very high	89.7	Confident	17 Å²	17	43.5 Å²	43.5	8%	0.084	24%	0.236	C	C	.	.	S	Bend	trans	-65.4	-23	174.3	-64	-170.4	-67.9	0	0	113.2	T415 V418 K419 R437 T445 Y448 P734	M378-T415 VanDerWaalsContact CE-O 3.23Å; M378-T415 WeakPolarHBondContact CE-O 3.4Å; M378-V418 HydrophobicContact CB-CG2 4.36Å; M378-V418 HydrophobicContact CE-CG2 4.49Å; M378-V418 HydrophobicContact SD-CG2 4.38Å; M378-K419 WeakPolarHBondContact O-CB 3.35Å; M378-K419 PolarHBondContact O-N 3.03Å; M378-R437 WeakPolarHBondContact O-CD 3.49Å; M378-R437 PolarHBondContact O-NH1 3.28Å; M378-T445 HydrophobicContact CB-CG2 4.21Å; M378-T445 HydrophobicContact CG-CG2 4.23Å; M378-T445 HydrophobicContact SD-CG2 4.34Å; M378-Y448 HydrophobicContact CE-CD1 3.72Å; M378-Y448 HydrophobicContact CE-CD2 4.16Å; M378-Y448 HydrophobicContact CE-CE1 3.86Å; M378-Y448 HydrophobicContact CE-CE2 4.29Å; M378-Y448 HydrophobicContact CE-CG 3.88Å; M378-Y448 HydrophobicContact SD-CD1 3.47Å; M378-Y448 WeakPolarHBondContact SD-CD1 3.47Å; M378-Y448 HydrophobicContact SD-CD2 4.31Å; M378-Y448 HydrophobicContact SD-CE1 4.21Å; M378-Y448 HydrophobicContact SD-CG 3.53Å; M378-Y448 VanDerWaalsContact SD-CG 3.53Å; M378-P734 HydrophobicContact CE-CB 4.42Å
379	C	97.7	Very high	91.7	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.007	21%	0.21	C	C	.	.	S	Bend	trans	-136.6	128.9	174.2	-176.7	0	0	0	0	108.8	D377 E383 R384 R387 A417	D377-C379 WeakPolarHBondContact CB-O 3.23Å; D377-C379 PolarHBondContact O-N 2.95Å; C379-E383 PolarHBondContact SG-OE1 2.88Å; C379-R384 HydrophobicContact CB-CG 3.92Å; C379-R384 PolarHBondContact O-NH1 3.36Å; C379-R387 PolarHBondContact SG-NH2 2.97Å; C379-R387 VanDerWaalsContact SG-NH2 3.39Å; C379-A417 HydrophobicContact CB-CB 3.91Å; C379-A417 WeakPolarHBondContact CB-O 3.33Å; C379-A417 PolarHBondContact N-O 2.93Å
380	P	96.6	Very high	93.3	Very high	7 Å²	7	38.1 Å²	38.1	5%	0.045	21%	0.206	C	C	.	.			trans	-55	143.1	175.6	-24.5	33.2	0	0	0	112.5	L382 E383 R384 K419	P380-L382 PolarHBondContact O-N 3.49Å; P380-E383 HydrophobicContact CB-CB 4.34Å; P380-E383 WeakPolarHBondContact O-CB 3.3Å; P380-E383 PolarHBondContact O-N 3.46Å; P380-R384 PolarHBondContact O-N 2.93Å; P380-R384 VanDerWaalsContact O-N 3.1Å; P380-K419 HydrophobicContact CG-CD 4.26Å
381	E	95.5	Very high	94.1	Very high	24 Å²	24	40.8 Å²	40.8	11%	0.112	21%	0.212	C	C	.	.	H	α-helix	trans	-56.4	-48.8	-175.3	-176.1	-180	-158.7	0	0	112.9	L331 E383 R384 Y385 S739 S740	L331-E381 HydrophobicContact CD1-CG 3.9Å; E381-E383 PolarHBondContact O-N 3.49Å; E381-R384 WeakPolarHBondContact O-CB 3.37Å; E381-R384 PolarHBondContact O-N 3.46Å; E381-R384 VanDerWaalsContact O-N 3.1Å; E381-Y385 HydrophobicContact CG-CD2 3.97Å; E381-Y385 HydrophobicContact CG-CE2 3.73Å; E381-Y385 WeakPolarHBondContact O-CD2 3.4Å; E381-Y385 PolarHBondContact O-N 3.31Å; E381-S739 WeakPolarHBondContact OE1-CA 3.28Å; E381-S740 PolarHBondContact OE1-N 2.63Å; E381-S740 VanDerWaalsContact OE2-CB 3.26Å; E381-S740 WeakPolarHBondContact OE2-CB 3.46Å; E381-S740 PolarHBondContact OE2-N 3.48Å; E381-S740 VanDerWaalsContact OE2-N 3.13Å; E381-S740 PolarHBondContact OE2-OG 2.9Å
382	L	94.6	Very high	94.4	Very high	31 Å²	31	46 Å²	46	16%	0.162	23%	0.229	C	C	.	.	H	α-helix	trans	-56.3	-39.7	176.8	175.4	64	0	0	0	111.9	L328 L331 Q332 Y335 P380 C386	L328-L382 HydrophobicContact CD1-CD1 4.03Å; L331-L382 HydrophobicContact CB-CD1 3.72Å; Q332-L382 HydrophobicContact CG-CD1 3.8Å; Y335-L382 HydrophobicContact CD1-CD2 4.44Å; Y335-L382 HydrophobicContact CD2-CD2 3.62Å; Y335-L382 HydrophobicContact CE2-CD2 4.33Å; Y335-L382 HydrophobicContact CG-CD2 3.69Å; P380-L382 PolarHBondContact O-N 3.49Å; L382-C386 WeakPolarHBondContact O-CB 3Å; L382-C386 PolarHBondContact O-N 3.32Å; L382-C386 PolarHBondContact O-SG 3.38Å
383	E	95.7	Very high	94.5	Very high	36 Å²	36	38.6 Å²	38.6	17%	0.168	20%	0.198	C	C	.	.	H	α-helix	trans	-67.6	-39.3	179	-171.9	-170.6	133.8	0	0	111.6	C379 P380 E381 Y385 C386 R387 K419 D420	C379-E383 PolarHBondContact SG-OE1 2.88Å; P380-E383 HydrophobicContact CB-CB 4.34Å; P380-E383 WeakPolarHBondContact O-CB 3.3Å; P380-E383 PolarHBondContact O-N 3.46Å; E381-E383 PolarHBondContact O-N 3.49Å; E383-Y385 PolarHBondContact O-N 2.86Å; E383-C386 PolarHBondContact O-N 3.49Å; E383-R387 HydrophobicContact CG-CG 4.13Å; E383-R387 WeakPolarHBondContact O-CB 3.01Å; E383-R387 WeakPolarHBondContact O-CG 3.27Å; E383-R387 PolarHBondContact O-N 3.32Å; E383-R387 IonicContact OE1-CZ 3.58Å; E383-R387 IonicContact OE1-NE 3.8Å; E383-R387 PolarHBondContact OE1-NE 3.47Å; E383-R387 IonicContact OE1-NH2 3.6Å; E383-K419 WeakPolarHBondContact OE1-CA 3.3Å; E383-K419 VanDerWaalsContact OE2-CG 3.27Å; E383-K419 WeakPolarHBondContact OE2-CG 3.42Å; E383-D420 PolarHBondContact OE1-N 2.71Å
384	R	95.9	Very high	94.4	Very high	3 Å²	3	39.3 Å²	39.3	1%	0.011	20%	0.202	C	C	.	.	H	α-helix	trans	-57.1	-50.7	177.4	-62.8	-170.1	-61.7	-103.6	11.9	111	D377 C379 P380 E381 R387 A388 M412 H414 A417 Q738	D377-R384 IonicContact OD2-CZ 3.06Å; D377-R384 IonicContact OD2-NH1 2.66Å; D377-R384 PolarHBondContact OD2-NH1 3.17Å; D377-R384 IonicContact OD2-NH2 2.72Å; D377-R384 PolarHBondContact OD2-NH2 3.49Å; C379-R384 HydrophobicContact CB-CG 3.92Å; C379-R384 PolarHBondContact O-NH1 3.36Å; P380-R384 PolarHBondContact O-N 2.93Å; P380-R384 VanDerWaalsContact O-N 3.1Å; E381-R384 WeakPolarHBondContact O-CB 3.37Å; E381-R384 PolarHBondContact O-N 3.46Å; E381-R384 VanDerWaalsContact O-N 3.1Å; R384-R387 PolarHBondContact O-N 3.38Å; R384-A388 WeakPolarHBondContact O-CB 3.3Å; R384-A388 PolarHBondContact O-N 2.85Å; R384-M412 HydrophobicContact CB-SD 3.8Å; R384-M412 HydrophobicContact CG-SD 4.25Å; R384-H414 PolarHBondContact NE-ND1 2.86Å; R384-A417 HydrophobicContact CG-CB 3.84Å; R384-Q738 PolarHBondContact NH2-O 3.19Å
385	Y	95.2	Very high	94.2	Very high	11 Å²	11	38 Å²	38	4%	0.043	19%	0.191	C	C	.	.	H	α-helix	trans	-65.6	-41.9	178.3	-72.9	-71.4	0	0	0	112.3	L324 R327 L331 E381 E383 R387 A388 A389 H414	L324-Y385 HydrophobicContact CD1-CD1 4.11Å; L324-Y385 HydrophobicContact CG-CD1 4.1Å; R327-Y385 HydrophobicContact CB-CD1 4.24Å; R327-Y385 HydrophobicContact CB-CE1 4.04Å; R327-Y385 PolarHBondContact NH1-OH 3.49Å; R327-Y385 VanDerWaalsContact NH1-OH 3.12Å; L331-Y385 HydrophobicContact CD1-CD2 3.4Å; L331-Y385 HydrophobicContact CD1-CE2 3.91Å; L331-Y385 HydrophobicContact CD1-CG 4.23Å; E381-Y385 HydrophobicContact CG-CD2 3.97Å; E381-Y385 HydrophobicContact CG-CE2 3.73Å; E381-Y385 WeakPolarHBondContact O-CD2 3.4Å; E381-Y385 PolarHBondContact O-N 3.31Å; E383-Y385 PolarHBondContact O-N 2.86Å; Y385-R387 PolarHBondContact O-N 2.88Å; Y385-A388 PolarHBondContact O-N 2.81Å; Y385-A389 WeakPolarHBondContact O-CB 3.31Å; Y385-A389 PolarHBondContact O-N 3.32Å; Y385-H414 AromaticContact CE1-CE1 3.7Å; Y385-H414 AromaticContact CZ-CE1 3.74Å
386	C	94.3	Very high	94.2	Very high	31 Å²	31	38.4 Å²	38.4	21%	0.209	19%	0.192	C	C	.	.	H	α-helix	trans	-56.5	-49.5	173	-78.7	0	0	0	0	111.3	L328 L382 E383 A389 H390	L328-C386 HydrophobicContact CD1-CB 4.41Å; L328-C386 VanDerWaalsContact CD1-SG 3.52Å; L382-C386 WeakPolarHBondContact O-CB 3Å; L382-C386 PolarHBondContact O-N 3.32Å; L382-C386 PolarHBondContact O-SG 3.38Å; E383-C386 PolarHBondContact O-N 3.49Å; C386-A389 PolarHBondContact O-N 3.44Å; C386-H390 PolarHBondContact O-N 2.89Å; C386-H390 VanDerWaalsContact O-N 3.09Å; C386-H390 PolarHBondContact O-ND1 3Å
387	R	95	Very high	94.1	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.015	18%	0.175	C	C	.	.	H	α-helix	trans	-68.5	-38.1	-176.7	-73.6	-165.2	-62.4	118.1	-12.7	112.2	C379 E383 R384 Y385 H390 Q391 R392 E397 M412 V418	C379-R387 PolarHBondContact SG-NH2 2.97Å; C379-R387 VanDerWaalsContact SG-NH2 3.39Å; E383-R387 HydrophobicContact CG-CG 4.13Å; E383-R387 WeakPolarHBondContact O-CB 3.01Å; E383-R387 WeakPolarHBondContact O-CG 3.27Å; E383-R387 PolarHBondContact O-N 3.32Å; E383-R387 IonicContact OE1-CZ 3.58Å; E383-R387 IonicContact OE1-NE 3.8Å; E383-R387 PolarHBondContact OE1-NE 3.47Å; E383-R387 IonicContact OE1-NH2 3.6Å; R384-R387 PolarHBondContact O-N 3.38Å; Y385-R387 PolarHBondContact O-N 2.88Å; R387-H390 PolarHBondContact O-N 3.47Å; R387-Q391 PolarHBondContact O-N 3.23Å; R387-R392 HydrophobicContact CB-CB 4.35Å; R387-R392 HydrophobicContact CG-CB 4.46Å; R387-R392 PolarHBondContact NH1-O 2.84Å; R387-R392 PolarHBondContact O-N 2.98Å; R387-E397 IonicContact CZ-OE1 3.38Å; R387-E397 IonicContact CZ-OE2 2.72Å; R387-E397 IonicContact NH1-OE1 2.71Å; R387-E397 PolarHBondContact NH1-OE1 2.9Å; R387-E397 IonicContact NH1-OE2 2.6Å; R387-E397 PolarHBondContact NH1-OE2 2.96Å; R387-E397 IonicContact NH2-OE1 3.5Å; R387-E397 PolarHBondContact NH2-OE1 3.46Å; R387-E397 IonicContact NH2-OE2 3.63Å; R387-M412 HydrophobicContact CB-CE 3.65Å; R387-V418 PolarHBondContact NH2-O 3.48Å
388	A	92	Very high	93.9	Very high	19 Å²	19	34.1 Å²	34.1	16%	0.157	17%	0.172	C	C	.	.	H	α-helix	trans	-62.4	-47.3	173.8	0	0	0	0	0	111.9	L324 R384 Y385 H390 Q391 M412	L324-A388 HydrophobicContact CD1-CB 3.65Å; L324-A388 HydrophobicContact CD2-CB 4.43Å; R384-A388 WeakPolarHBondContact O-CB 3.3Å; R384-A388 PolarHBondContact O-N 2.85Å; Y385-A388 PolarHBondContact O-N 2.81Å; A388-H390 VanDerWaalsContact C-N 3.28Å; A388-H390 PolarHBondContact O-N 2.93Å; A388-Q391 PolarHBondContact O-N 3.28Å; A388-Q391 VanDerWaalsContact O-N 3.1Å; A388-M412 HydrophobicContact CB-CB 4.24Å
389	A	91.8	Very high	93.4	Very high	38 Å²	38	35.8 Å²	35.8	31%	0.314	18%	0.181	S	C	.	.	H	α-helix	trans	-60.8	-36.2	177.7	0	0	0	0	0	112.8	L324 L328 Y385 C386 Q391	L324-A389 HydrophobicContact CD2-CB 3.71Å; L328-A389 HydrophobicContact CD2-CB 3.65Å; Y385-A389 WeakPolarHBondContact O-CB 3.31Å; Y385-A389 PolarHBondContact O-N 3.32Å; C386-A389 PolarHBondContact O-N 3.44Å; A389-Q391 VanDerWaalsContact C-N 3.33Å; A389-Q391 PolarHBondContact O-N 3.37Å
390	H	90.9	Very high	92.7	Very high	109 Å²	109	39 Å²	39	51%	0.505	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.7	10.4	178.7	-64.5	93.7	0	0	0	114.1	C386 R387 A388 R392	C386-H390 PolarHBondContact O-N 2.89Å; C386-H390 VanDerWaalsContact O-N 3.09Å; C386-H390 PolarHBondContact O-ND1 3Å; R387-H390 PolarHBondContact O-N 3.47Å; A388-H390 VanDerWaalsContact C-N 3.28Å; A388-H390 PolarHBondContact O-N 2.93Å; H390-R392 HydrophobicContact CB-CG 4.48Å; H390-R392 PolarHBondContact O-N 3.13Å; H390-R392 VanDerWaalsContact O-N 3.14Å
391	Q	89.7	Confident	92	Very high	134 Å²	134	44.4 Å²	44.4	63%	0.626	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.2	34.1	-176.9	-61	177.9	-6.8	0	0	113.6	R387 A388 A389 V393	R387-Q391 PolarHBondContact O-N 3.23Å; A388-Q391 PolarHBondContact O-N 3.28Å; A388-Q391 VanDerWaalsContact O-N 3.1Å; A389-Q391 VanDerWaalsContact C-N 3.33Å; A389-Q391 PolarHBondContact O-N 3.37Å; Q391-V393 PolarHBondContact O-N 2.97Å
392	R	91.8	Very high	91.3	Very high	141 Å²	141	44 Å²	44	53%	0.532	23%	0.234	S	C	.	.			trans	-98.3	56.7	175.8	-75.5	-166.3	-94.8	147.4	-6.7	111	R387 H390	R387-R392 HydrophobicContact CB-CB 4.35Å; R387-R392 HydrophobicContact CG-CB 4.46Å; R387-R392 PolarHBondContact NH1-O 2.84Å; R387-R392 PolarHBondContact O-N 2.98Å; H390-R392 HydrophobicContact CB-CG 4.48Å; H390-R392 PolarHBondContact O-N 3.13Å; H390-R392 VanDerWaalsContact O-N 3.14Å
393	V	92.4	Very high	90.2	Very high	16 Å²	16	46.4 Å²	46.4	10%	0.097	25%	0.245	C	C	.	.			trans	-105.2	126.3	179	-171.7	0	0	0	0	109.3	Q391 E397 C398 M412	Q391-V393 PolarHBondContact O-N 2.97Å; V393-E397 HydrophobicContact CG1-CB 4.34Å; V393-C398 HydrophobicContact CG1-CB 3.88Å; V393-M412 HydrophobicContact CG1-CB 4.21Å; V393-M412 HydrophobicContact CG2-CB 4.03Å; V393-M412 HydrophobicContact CG2-CE 3.99Å
394	S	93	Very high	88.9	Confident	25 Å²	25	50.8 Å²	50.8	18%	0.175	28%	0.28	C	S	.	.			trans	-80.3	155.7	174.8	-176.3	0	0	0	0	111.6	F396 E397 C398 F472	S394-F396 PolarHBondContact O-N 3.41Å; S394-F396 VanDerWaalsContact O-N 3.1Å; S394-F396 WeakPolarHBondContact OG-CD2 3.36Å; S394-F396 PolarHBondContact OG-N 3.4Å; S394-E397 CarbonylContact O-C 3.58Å; S394-E397 PolarHBondContact O-N 3Å; S394-C398 PolarHBondContact O-N 2.85Å; S394-F472 VanDerWaalsContact CB-CD2 3.49Å; S394-F472 WeakPolarHBondContact OG-CD2 3.45Å
395	I	91.1	Very high	87.3	Confident	50 Å²	50	53 Å²	53	26%	0.256	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-24.8	169.1	-166.4	172.2	0	0	0	113	C398 M403 W410 L465 P468	I395-C398 PolarHBondContact O-SG 3.31Å; I395-C398 VanDerWaalsContact O-SG 3.32Å; I395-M403 HydrophobicContact CD1-CE 3.75Å; I395-M403 HydrophobicContact CG1-CE 3.47Å; I395-M403 VanDerWaalsContact CG1-CE 3.47Å; I395-W410 HydrophobicContact CB-CH2 4.27Å; I395-W410 HydrophobicContact CB-CZ3 4.33Å; I395-L465 HydrophobicContact CD1-CD1 4.34Å; I395-L465 HydrophobicContact CG2-CD1 4.15Å; I395-P468 HydrophobicContact CG2-CB 4.41Å
396	F	94.4	Very high	86.2	Confident	18 Å²	18	57.5 Å²	57.5	8%	0.079	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-10.5	177.6	-53.3	-69	0	0	0	113.7	S394 I453 R456 L465 P468 W469 F472	S394-F396 PolarHBondContact O-N 3.41Å; S394-F396 VanDerWaalsContact O-N 3.1Å; S394-F396 WeakPolarHBondContact OG-CD2 3.36Å; S394-F396 PolarHBondContact OG-N 3.4Å; F396-I453 HydrophobicContact CB-CG1 4.42Å; F396-I453 HydrophobicContact CD1-CG2 4.2Å; F396-I453 HydrophobicContact CE1-CG2 4.44Å; F396-I453 HydrophobicContact CG-CG2 4.31Å; F396-R456 HydrophobicContact CD1-CG 4.48Å; F396-R456 HydrophobicContact CE1-CB 4.03Å; F396-R456 HydrophobicContact CE1-CG 4.19Å; F396-L465 HydrophobicContact CE1-CD1 4.03Å; F396-L465 HydrophobicContact CE1-CD2 4.1Å; F396-L465 HydrophobicContact CE1-CG 4.26Å; F396-L465 HydrophobicContact CZ-CD1 3.64Å; F396-L465 HydrophobicContact CZ-CD2 4.29Å; F396-L465 HydrophobicContact CZ-CG 3.95Å; F396-P468 HydrophobicContact CE2-CB 4.38Å; F396-W469 HydrophobicContact CE2-CB 4.35Å; F396-W469 HydrophobicContact CZ-CB 3.92Å; F396-F472 HydrophobicContact CB-CD1 4.37Å; F396-F472 HydrophobicContact CB-CD2 4.43Å; F396-F472 HydrophobicContact CB-CE1 4.18Å; F396-F472 HydrophobicContact CB-CE2 4.2Å; F396-F472 HydrophobicContact CB-CG 4.49Å; F396-F472 HydrophobicContact CB-CZ 4.06Å; F396-F472 HydrophobicContact CD2-CB 3.68Å; F396-F472 AromaticContact CD2-CD1 3.87Å; F396-F472 HydrophobicContact CD2-CD1 3.87Å; F396-F472 AromaticContact CD2-CD2 3.88Å; F396-F472 HydrophobicContact CD2-CD2 3.88Å; F396-F472 HydrophobicContact CD2-CE1 4.5Å; F396-F472 HydrophobicContact CD2-CE2 4.47Å; F396-F472 AromaticContact CD2-CG 3.51Å; F396-F472 HydrophobicContact CD2-CG 3.51Å; F396-F472 HydrophobicContact CE2-CB 3.83Å; F396-F472 HydrophobicContact CE2-CG 4.17Å; F396-F472 HydrophobicContact CG-CD1 4.35Å; F396-F472 HydrophobicContact CG-CG 4.35Å
397	E	94.9	Very high	85	Confident	0 Å²	0	60 Å²	60	0%	0	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-3.5	-176.8	-61.2	175.4	137.5	0	0	112.4	R387 V393 S394 D413 V418 F472 R476	R387-E397 IonicContact CZ-OE1 3.38Å; R387-E397 IonicContact CZ-OE2 2.72Å; R387-E397 IonicContact NH1-OE1 2.71Å; R387-E397 PolarHBondContact NH1-OE1 2.9Å; R387-E397 IonicContact NH1-OE2 2.6Å; R387-E397 PolarHBondContact NH1-OE2 2.96Å; R387-E397 IonicContact NH2-OE1 3.5Å; R387-E397 PolarHBondContact NH2-OE1 3.46Å; R387-E397 IonicContact NH2-OE2 3.63Å; V393-E397 HydrophobicContact CG1-CB 4.34Å; S394-E397 CarbonylContact O-C 3.58Å; S394-E397 PolarHBondContact O-N 3Å; E397-D413 PolarHBondContact O-N 3.36Å; E397-V418 PolarHBondContact OE1-N 2.92Å; E397-V418 VanDerWaalsContact OE1-O 3.07Å; E397-F472 HydrophobicContact CG-CE2 3.62Å; E397-F472 HydrophobicContact CG-CZ 3.8Å; E397-R476 IonicContact OE1-CZ 3.86Å; E397-R476 IonicContact OE1-NE 3.94Å; E397-R476 PolarHBondContact OE1-NE 3.3Å; E397-R476 IonicContact OE1-NH2 3.71Å; E397-R476 PolarHBondContact OE1-NH2 2.99Å; E397-R476 VanDerWaalsContact OE1-NH2 3.14Å; E397-R476 IonicContact OE2-NH2 3.65Å; E397-R476 PolarHBondContact OE2-NH2 3.35Å
398	C	92.2	Very high	84	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.007	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-84.3	154.3	-178.4	64.6	0	0	0	0	112.3	V393 S394 I395 M403 W410 E411	V393-C398 HydrophobicContact CG1-CB 3.88Å; S394-C398 PolarHBondContact O-N 2.85Å; I395-C398 PolarHBondContact O-SG 3.31Å; I395-C398 VanDerWaalsContact O-SG 3.32Å; C398-M403 WeakPolarHBondContact SG-CG 3.48Å; C398-W410 HydrophobicContact CB-CB 4.11Å; C398-W410 HydrophobicContact CB-CG 4.37Å; C398-E411 CarbonylContact C-O 3.53Å; C398-E411 WeakPolarHBondContact CA-O 3.25Å
399	L	87.6	Confident	83.4	Confident	52 Å²	52	64 Å²	64	27%	0.272	37%	0.369	S	S	.	.			trans	-63.9	127.4	170.7	-76.3	169.2	0	0	0	109.3	T401 T402 E411 D413	L399-T401 PolarHBondContact O-N 2.94Å; L399-T402 HydrophobicContact CB-CG2 4.33Å; L399-T402 PolarHBondContact O-N 3.1Å; L399-T402 PolarHBondContact O-OG1 3.21Å; L399-E411 HydrophobicContact CD1-CB 3.97Å; L399-E411 PolarHBondContact N-O 3.27Å; L399-D413 HydrophobicContact CD2-CB 3.81Å; L399-D413 HydrophobicContact CG-CB 4.07Å
400	P	83.1	Confident	83.2	Confident	69 Å²	69	65.4 Å²	65.4	45%	0.448	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-53.7	-31	179.7	-28.2	35.1	0	0	0	113.7	T402 M403	P400-T402 PolarHBondContact O-N 3.01Å; P400-M403 PolarHBondContact O-N 3.34Å
401	T	80.2	Confident	83.1	Confident	120 Å²	120	65.9 Å²	65.9	74%	0.736	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-64.3	-25.2	177.6	50.4	0	0	0	0	113.6	L399	L399-T401 PolarHBondContact O-N 2.94Å
402	T	80.7	Confident	83.3	Confident	17 Å²	17	60.1 Å²	60.1	10%	0.104	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-97.6	-8	-178.4	65.4	0	0	0	0	113.4	L399 P400 S404 A405 W410 E411	L399-T402 HydrophobicContact CB-CG2 4.33Å; L399-T402 PolarHBondContact O-N 3.1Å; L399-T402 PolarHBondContact O-OG1 3.21Å; P400-T402 PolarHBondContact O-N 3.01Å; T402-S404 VanDerWaalsContact C-N 3.31Å; T402-S404 PolarHBondContact O-N 3.43Å; T402-A405 PolarHBondContact O-N 2.86Å; T402-W410 VanDerWaalsContact O-CD1 3.23Å; T402-E411 HydrophobicContact CG2-CB 3.93Å; T402-E411 HydrophobicContact CG2-CG 4Å; T402-E411 PolarHBondContact OG1-N 3.06Å
403	M	72.7	Confident	83.4	Confident	80 Å²	80	54.7 Å²	54.7	39%	0.394	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-33	-175.1	-73.1	-171.2	64.6	0	0	114	I395 C398 P400 A405	I395-M403 HydrophobicContact CD1-CE 3.75Å; I395-M403 HydrophobicContact CG1-CE 3.47Å; I395-M403 VanDerWaalsContact CG1-CE 3.47Å; C398-M403 WeakPolarHBondContact SG-CG 3.48Å; P400-M403 PolarHBondContact O-N 3.34Å; M403-A405 PolarHBondContact O-N 3.22Å
404	S	68	Low	83.5	Confident	128 Å²	128	56.2 Å²	56.2	90%	0.895	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-12.9	-179.2	-57.5	0	0	0	0	113.6	T402	T402-S404 VanDerWaalsContact C-N 3.31Å; T402-S404 PolarHBondContact O-N 3.43Å
405	A	61.9	Low	83.6	Confident	49 Å²	49	57 Å²	57	41%	0.405	33%	0.333	S	S	.	.	S	Bend	trans	-94.5	169.9	178.9	0	0	0	0	0	111.3	T402 M403 S409 W410	T402-A405 PolarHBondContact O-N 2.86Å; M403-A405 PolarHBondContact O-N 3.22Å; A405-S409 WeakPolarHBondContact CB-OG 3.28Å; A405-W410 PolarHBondContact O-NE1 3.38Å
406	N	71.7	Confident	83.8	Confident	106 Å²	106	58.6 Å²	58.6	57%	0.567	34%	0.336	S	S	*	.			trans	-58.6	152.5	179.1	61.5	19.3	0	0	0	111.1	S408 S409	N406-S408 PolarHBondContact ND2-OG 3.17Å; N406-S408 PolarHBondContact O-N 3.5Å; N406-S408 PolarHBondContact OD1-OG 3.28Å; N406-S409 PolarHBondContact O-N 3.31Å; N406-S409 PolarHBondContact O-OG 2.88Å; N406-S409 WeakPolarHBondContact OD1-CB 3.44Å; N406-S409 PolarHBondContact OD1-N 3.42Å; N406-S409 PolarHBondContact OD1-OG 2.85Å
407	S	69.4	Low	83.9	Confident	84 Å²	84	57.8 Å²	57.8	59%	0.587	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-58.4	-21.3	-175.3	62.4	0	0	0	0	114.3	S409	S407-S409 VanDerWaalsContact C-N 3.25Å; S407-S409 PolarHBondContact O-N 3.25Å
408	S	73.7	Confident	84.1	Confident	60 Å²	60	57.8 Å²	57.8	42%	0.42	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-70.9	-15	174.8	45.8	0	0	0	0	114.7	N406	N406-S408 PolarHBondContact ND2-OG 3.17Å; N406-S408 PolarHBondContact O-N 3.5Å; N406-S408 PolarHBondContact OD1-OG 3.28Å
409	S	80.7	Confident	84.3	Confident	47 Å²	47	58.8 Å²	58.8	33%	0.329	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-106.3	5.6	-179.2	62.6	0	0	0	0	113.6	A405 N406 S407 E411	A405-S409 WeakPolarHBondContact CB-OG 3.28Å; N406-S409 PolarHBondContact O-N 3.31Å; N406-S409 PolarHBondContact O-OG 2.88Å; N406-S409 WeakPolarHBondContact OD1-CB 3.44Å; N406-S409 PolarHBondContact OD1-N 3.42Å; N406-S409 PolarHBondContact OD1-OG 2.85Å; S407-S409 VanDerWaalsContact C-N 3.25Å; S407-S409 PolarHBondContact O-N 3.25Å; S409-E411 PolarHBondContact O-N 3.07Å
410	W	86.5	Confident	84.8	Confident	67 Å²	67	58.1 Å²	58.1	25%	0.254	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-68.8	124.2	178.2	-68.7	-10.5	0	0	0	111.2	I395 C398 T402 A405	I395-W410 HydrophobicContact CB-CH2 4.27Å; I395-W410 HydrophobicContact CB-CZ3 4.33Å; C398-W410 HydrophobicContact CB-CB 4.11Å; C398-W410 HydrophobicContact CB-CG 4.37Å; T402-W410 VanDerWaalsContact O-CD1 3.23Å; A405-W410 PolarHBondContact O-NE1 3.38Å
411	E	89.7	Confident	85.4	Confident	120 Å²	120	57 Å²	57	56%	0.561	32%	0.321	S	S	*	.	P	Polyproline II helix	trans	-97.3	143.8	175.4	-67.2	178.9	-179.2	0	0	110.3	C398 L399 T402 S409	C398-E411 CarbonylContact C-O 3.53Å; C398-E411 WeakPolarHBondContact CA-O 3.25Å; L399-E411 HydrophobicContact CD1-CB 3.97Å; L399-E411 PolarHBondContact N-O 3.27Å; T402-E411 HydrophobicContact CG2-CB 3.93Å; T402-E411 HydrophobicContact CG2-CG 4Å; T402-E411 PolarHBondContact OG1-N 3.06Å; S409-E411 PolarHBondContact O-N 3.07Å
412	M	93.2	Very high	85.8	Confident	13 Å²	13	57.1 Å²	57.1	6%	0.064	31%	0.313	C	S	.	.	B	Isolated β-bridge	trans	-77.4	125.5	-178.1	-178	173.3	-68.4	0	0	111.4	R384 R387 A388 V393 H414 A417	R384-M412 HydrophobicContact CB-SD 3.8Å; R384-M412 HydrophobicContact CG-SD 4.25Å; R387-M412 HydrophobicContact CB-CE 3.65Å; A388-M412 HydrophobicContact CB-CB 4.24Å; V393-M412 HydrophobicContact CG1-CB 4.21Å; V393-M412 HydrophobicContact CG2-CB 4.03Å; V393-M412 HydrophobicContact CG2-CE 3.99Å; M412-H414 PolarHBondContact O-N 2.85Å; M412-A417 HydrophobicContact CG-CB 4.31Å; M412-A417 HydrophobicContact SD-CB 3.8Å
413	D	94.2	Very high	86.1	Confident	26 Å²	26	64 Å²	64	14%	0.139	34%	0.337	C	S	.	.			trans	-79.2	103.1	160.4	-177	-14.1	0	0	0	108.2	E397 L399 T415 R416 A417	E397-D413 PolarHBondContact O-N 3.36Å; L399-D413 HydrophobicContact CD2-CB 3.81Å; L399-D413 HydrophobicContact CG-CB 4.07Å; D413-T415 PolarHBondContact O-N 3.01Å; D413-T415 VanDerWaalsContact O-N 3.1Å; D413-T415 WeakPolarHBondContact OD1-CB 3.31Å; D413-T415 PolarHBondContact OD1-N 3.07Å; D413-T415 PolarHBondContact OD1-OG1 3.03Å; D413-T415 PolarHBondContact OD2-OG1 3.12Å; D413-R416 HydrophobicContact CB-CB 4.24Å; D413-R416 HydrophobicContact CB-CG 4.17Å; D413-R416 PolarHBondContact O-N 2.98Å; D413-R416 VanDerWaalsContact OD2-CD 3.28Å; D413-R416 WeakPolarHBondContact OD2-CD 3.27Å; D413-R416 WeakPolarHBondContact OD2-CG 3.32Å; D413-R416 IonicContact OD2-NE 3.69Å; D413-R416 PolarHBondContact OD2-NE 2.78Å; D413-R416 VanDerWaalsContact OD2-NE 3.1Å; D413-A417 PolarHBondContact O-N 2.9Å
414	H	94.7	Very high	86.4	Confident	48 Å²	48	64.4 Å²	64.4	22%	0.222	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-30.2	-177.2	-70.1	-91.3	0	0	0	112.9	R384 Y385 M412 R416 A417 V737	R384-H414 PolarHBondContact NE-ND1 2.86Å; Y385-H414 AromaticContact CE1-CE1 3.7Å; Y385-H414 AromaticContact CZ-CE1 3.74Å; M412-H414 PolarHBondContact O-N 2.85Å; H414-R416 VanDerWaalsContact C-N 3.29Å; H414-R416 PolarHBondContact O-N 2.85Å; H414-A417 PolarHBondContact O-N 2.93Å; H414-V737 HydrophobicContact CB-CG2 3.99Å; H414-V737 WeakPolarHBondContact O-CG1 3.29Å
415	T	95	Very high	86.9	Confident	41 Å²	41	61.2 Å²	61.2	25%	0.252	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-24	179.9	69.9	0	0	0	0	113.1	M378 D413 P734	M378-T415 VanDerWaalsContact CE-O 3.23Å; M378-T415 WeakPolarHBondContact CE-O 3.4Å; D413-T415 PolarHBondContact O-N 3.01Å; D413-T415 VanDerWaalsContact O-N 3.1Å; D413-T415 WeakPolarHBondContact OD1-CB 3.31Å; D413-T415 PolarHBondContact OD1-N 3.07Å; D413-T415 PolarHBondContact OD1-OG1 3.03Å; D413-T415 PolarHBondContact OD2-OG1 3.12Å; T415-P734 WeakPolarHBondContact O-CB 3.19Å
416	R	95.7	Very high	87.5	Confident	84 Å²	84	63.8 Å²	63.8	32%	0.317	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.6	-11.2	178.9	-61.3	-178.6	-177.3	-155.9	-6.7	113.2	D413 H414 V418 Y448	D413-R416 HydrophobicContact CB-CB 4.24Å; D413-R416 HydrophobicContact CB-CG 4.17Å; D413-R416 PolarHBondContact O-N 2.98Å; D413-R416 VanDerWaalsContact OD2-CD 3.28Å; D413-R416 WeakPolarHBondContact OD2-CD 3.27Å; D413-R416 WeakPolarHBondContact OD2-CG 3.32Å; D413-R416 IonicContact OD2-NE 3.69Å; D413-R416 PolarHBondContact OD2-NE 2.78Å; D413-R416 VanDerWaalsContact OD2-NE 3.1Å; H414-R416 VanDerWaalsContact C-N 3.29Å; H414-R416 PolarHBondContact O-N 2.85Å; R416-V418 PolarHBondContact O-N 2.92Å; R416-Y448 WeakPolarHBondContact CB-OH 3.39Å; R416-Y448 WeakPolarHBondContact CG-OH 3.37Å
417	A	96.8	Very high	87.9	Confident	2 Å²	2	66.1 Å²	66.1	2%	0.017	36%	0.36	C	S	.	.			trans	-62.7	124.8	-179	0	0	0	0	0	111	C379 R384 M412 D413 H414	C379-A417 HydrophobicContact CB-CB 3.91Å; C379-A417 WeakPolarHBondContact CB-O 3.33Å; C379-A417 PolarHBondContact N-O 2.93Å; R384-A417 HydrophobicContact CG-CB 3.84Å; M412-A417 HydrophobicContact CG-CB 4.31Å; M412-A417 HydrophobicContact SD-CB 3.8Å; D413-A417 PolarHBondContact O-N 2.9Å; H414-A417 PolarHBondContact O-N 2.93Å
418	V	98	Very high	88.3	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.344	C	S	.	.			trans	-115	137.2	174	-174.2	0	0	0	0	108.9	M378 R387 E397 R416 D420 T445 Y448 L449 F472 R476	M378-V418 HydrophobicContact CB-CG2 4.36Å; M378-V418 HydrophobicContact CE-CG2 4.49Å; M378-V418 HydrophobicContact SD-CG2 4.38Å; R387-V418 PolarHBondContact NH2-O 3.48Å; E397-V418 PolarHBondContact OE1-N 2.92Å; E397-V418 VanDerWaalsContact OE1-O 3.07Å; R416-V418 PolarHBondContact O-N 2.92Å; V418-D420 PolarHBondContact O-N 3.45Å; V418-T445 HydrophobicContact CG1-CG2 3.56Å; V418-Y448 HydrophobicContact CG2-CD1 4.06Å; V418-Y448 HydrophobicContact CG2-CE1 3.92Å; V418-L449 HydrophobicContact CG1-CD2 4.37Å; V418-L449 HydrophobicContact CG2-CD2 4.13Å; V418-F472 HydrophobicContact CB-CZ 4.5Å; V418-R476 HydrophobicContact CB-CG 4.04Å; V418-R476 HydrophobicContact CG1-CB 3.97Å; V418-R476 HydrophobicContact CG1-CG 3.93Å; V418-R476 WeakPolarHBondContact O-CD 3.26Å; V418-R476 PolarHBondContact O-NE 3.49Å
419	K	97.8	Very high	88.6	Confident	22 Å²	22	65.4 Å²	65.4	10%	0.096	35%	0.347	C	S	.	.			trans	-48	123.1	179.8	-170.3	175.1	-176.7	-179.5	0	111.9	M378 P380 E383 E435 R476 A479 D483	M378-K419 WeakPolarHBondContact O-CB 3.35Å; M378-K419 PolarHBondContact O-N 3.03Å; P380-K419 HydrophobicContact CG-CD 4.26Å; E383-K419 WeakPolarHBondContact OE1-CA 3.3Å; E383-K419 VanDerWaalsContact OE2-CG 3.27Å; E383-K419 WeakPolarHBondContact OE2-CG 3.42Å; K419-E435 PolarHBondContact NZ-O 3.06Å; K419-R476 WeakPolarHBondContact O-CD 3.36Å; K419-A479 HydrophobicContact CB-CB 4.48Å; K419-A479 HydrophobicContact CG-CB 4.33Å; K419-A479 VanDerWaalsContact O-CB 3.28Å; K419-A479 WeakPolarHBondContact O-CB 3.25Å; K419-D483 IonicContact NZ-OD1 3.1Å; K419-D483 PolarHBondContact NZ-OD1 3.05Å; K419-D483 IonicContact NZ-OD2 3.04Å
420	D	96.8	Very high	88.7	Confident	38 Å²	38	66.8 Å²	66.8	20%	0.203	35%	0.353	C	S	.	.			trans	-81.5	152.9	177.3	-164.6	9.3	0	0	0	111.4	E383 V418 Q422 T475 R476	E383-D420 PolarHBondContact OE1-N 2.71Å; V418-D420 PolarHBondContact O-N 3.45Å; D420-Q422 PolarHBondContact O-N 3.2Å; D420-T475 WeakPolarHBondContact OD1-CB 3.42Å; D420-R476 IonicContact OD1-CZ 2.7Å; D420-R476 IonicContact OD1-NH1 3.68Å; D420-R476 PolarHBondContact OD1-NH1 3.44Å; D420-R476 IonicContact OD2-NH1 2.87Å
421	Y	95.9	Very high	88.9	Confident	46 Å²	46	64.5 Å²	64.5	18%	0.18	35%	0.347	C	S	.	.			trans	-81.7	112.6	179	173.6	-102	0	0	0	111.2	R423 T475 R478 K482	Y421-R423 HydrophobicContact CD1-CG 4.48Å; Y421-R423 HydrophobicContact CE1-CG 3.57Å; Y421-T475 VanDerWaalsContact CB-O 3.28Å; Y421-T475 WeakPolarHBondContact CB-O 3.26Å; Y421-R478 HydrophobicContact CD1-CG 4.43Å; Y421-R478 HydrophobicContact CD2-CB 4.02Å; Y421-R478 HydrophobicContact CD2-CG 3.77Å; Y421-R478 HydrophobicContact CE1-CG 4.49Å; Y421-R478 HydrophobicContact CE2-CG 3.85Å; Y421-R478 HydrophobicContact CG-CB 4.07Å; Y421-R478 HydrophobicContact CG-CG 4.07Å; Y421-K482 HydrophobicContact CD2-CD 4.45Å; Y421-K482 HydrophobicContact CE2-CB 4.48Å; Y421-K482 HydrophobicContact CE2-CD 4.23Å
422	Q	89.7	Confident	89	Confident	121 Å²	121	59.3 Å²	59.3	57%	0.565	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-102.5	127.3	169.1	-169.9	169.4	-24.8	0	0	110.9	D420 K482	D420-Q422 PolarHBondContact O-N 3.2Å; Q422-K482 PolarHBondContact O-NZ 3.39Å
423	R	85.7	Confident	88.9	Confident	161 Å²	161	61.1 Å²	61.1	61%	0.608	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-67.2	140.2	174.9	-67.2	178.3	-179.1	-107.5	2.5	110.3	Y421 S425 Q428	Y421-R423 HydrophobicContact CD1-CG 4.48Å; Y421-R423 HydrophobicContact CE1-CG 3.57Å; R423-S425 PolarHBondContact O-N 3.44Å; R423-Q428 PolarHBondContact O-NE2 2.87Å; R423-Q428 PolarHBondContact O-OE1 2.84Å
424	S	79.9	Confident	88.8	Confident	89 Å²	89	64.2 Å²	64.2	62%	0.622	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-69	117.4	171.9	-53.6	0	0	0	0	110.2
425	S	77.7	Confident	88.7	Confident	61 Å²	61	64 Å²	64	43%	0.427	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-95	159.6	167.6	47.6	0	0	0	0	109.8	R423 D427 Q428	R423-S425 PolarHBondContact O-N 3.44Å; S425-D427 PolarHBondContact O-N 3.03Å; S425-Q428 WeakPolarHBondContact O-CB 3.41Å; S425-Q428 PolarHBondContact O-N 2.73Å; S425-Q428 VanDerWaalsContact O-N 3.07Å; S425-Q428 WeakPolarHBondContact OG-CG 3.22Å; S425-Q428 PolarHBondContact OG-NE2 3.08Å
426	A	75	Confident	88.8	Confident	104 Å²	104	62 Å²	62	86%	0.86	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-31.3	177.8	0	0	0	0	0	112.6
427	D	79.4	Confident	88.9	Confident	155 Å²	155	58 Å²	58	83%	0.829	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	3.9	-179.8	-45.7	-44.5	0	0	0	113.5	S425	S425-D427 PolarHBondContact O-N 3.03Å
428	Q	77.8	Confident	88.9	Confident	56 Å²	56	59 Å²	59	26%	0.262	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-76.9	125.2	177.8	-105.6	169.8	41.8	0	0	110	R423 S425	R423-Q428 PolarHBondContact O-NE2 2.87Å; R423-Q428 PolarHBondContact O-OE1 2.84Å; S425-Q428 WeakPolarHBondContact O-CB 3.41Å; S425-Q428 PolarHBondContact O-N 2.73Å; S425-Q428 VanDerWaalsContact O-N 3.07Å; S425-Q428 WeakPolarHBondContact OG-CG 3.22Å; S425-Q428 PolarHBondContact OG-NE2 3.08Å
429	P	80.6	Confident	88.9	Confident	73 Å²	73	60.7 Å²	60.7	47%	0.474	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-63.9	155.4	175.6	28.7	-34.4	0	0	0	110.4
430	V	83.6	Confident	88.8	Confident	76 Å²	76	62.8 Å²	62.8	46%	0.461	35%	0.351	S	S	.	.	P	Polyproline II helix	trans	-58	127.7	170.7	-177.5	0	0	0	0	108	R342 I371 L432	R342-V430 PolarHBondContact NH1-O 3.47Å; I371-V430 HydrophobicContact CD1-CG1 3.59Å; V430-L432 PolarHBondContact O-N 3.33Å
431	P	89.1	Confident	88.8	Confident	19 Å²	19	61 Å²	61	12%	0.123	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-59.5	139.6	-174.3	27.5	-39.1	0	0	0	111.4	R342 E435 L436	R342-P431 PolarHBondContact NH1-O 2.97Å; P431-E435 WeakPolarHBondContact CA-OE2 3.46Å; P431-E435 HydrophobicContact CB-CB 4.48Å; P431-L436 HydrophobicContact CB-CD1 4.32Å; P431-L436 HydrophobicContact CB-CD2 3.98Å; P431-L436 HydrophobicContact CB-CG 4.12Å; P431-L436 HydrophobicContact CG-CD1 3.98Å; P431-L436 HydrophobicContact CG-CD2 4.05Å; P431-L436 HydrophobicContact CG-CG 4.26Å
432	L	91.4	Very high	88.9	Confident	11 Å²	11	58.9 Å²	58.9	6%	0.058	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-71.1	151.3	172.3	-64.9	177.5	0	0	0	110.1	Y335 D338 V430 R434 E435	Y335-L432 HydrophobicContact CD2-CD1 3.7Å; Y335-L432 HydrophobicContact CE2-CD1 3.62Å; Y335-L432 HydrophobicContact CE2-CG 4.12Å; D338-L432 HydrophobicContact CB-CD1 3.79Å; D338-L432 HydrophobicContact CB-CD2 4.5Å; V430-L432 PolarHBondContact O-N 3.33Å; L432-R434 HydrophobicContact CB-CG 4.2Å; L432-R434 VanDerWaalsContact CD1-NH2 3.3Å; L432-R434 PolarHBondContact O-N 3.03Å; L432-R434 VanDerWaalsContact O-N 3.14Å; L432-E435 HydrophobicContact CB-CG 4.33Å; L432-E435 PolarHBondContact N-OE2 2.62Å; L432-E435 WeakPolarHBondContact O-CB 3.36Å; L432-E435 PolarHBondContact O-N 2.85Å
433	P	92.6	Very high	89.3	Confident	50 Å²	50	57.5 Å²	57.5	33%	0.325	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-48.1	-42.3	176.4	-32.5	37.6	0	0	0	114.3	I371 K372 G373 T374 E435 L436	I371-P433 HydrophobicContact CG2-CG 4.22Å; K372-P433 WeakPolarHBondContact O-CB 3.37Å; G373-P433 WeakPolarHBondContact CA-O 3.42Å; T374-P433 HydrophobicContact CG2-CB 4.09Å; T374-P433 PolarHBondContact N-O 3.43Å; P433-E435 PolarHBondContact O-N 3.29Å; P433-L436 PolarHBondContact O-N 3.41Å; P433-L436 VanDerWaalsContact O-O 3.12Å
434	R	91.8	Very high	89.8	Confident	91 Å²	91	54.6 Å²	54.6	34%	0.343	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-69.1	-9.4	178.9	62.5	158.4	172.4	-109.3	-5.4	115.2	D338 T374 C375 L432	D338-R434 IonicContact OD2-CZ 3.53Å; D338-R434 IonicContact OD2-NH1 3.8Å; D338-R434 PolarHBondContact OD2-NH1 3.43Å; D338-R434 IonicContact OD2-NH2 2.87Å; D338-R434 PolarHBondContact OD2-NH2 3.47Å; T374-R434 WeakPolarHBondContact OG1-CA 3.37Å; T374-R434 PolarHBondContact OG1-N 3.07Å; C375-R434 VanDerWaalsContact CB-O 3.28Å; C375-R434 WeakPolarHBondContact CB-O 2.93Å; L432-R434 HydrophobicContact CB-CG 4.2Å; L432-R434 VanDerWaalsContact CD1-NH2 3.3Å; L432-R434 PolarHBondContact O-N 3.03Å; L432-R434 VanDerWaalsContact O-N 3.14Å
435	E	93.1	Very high	90.7	Very high	44 Å²	44	50.3 Å²	50.3	21%	0.206	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-90.3	-14	172.7	-61.8	-178.2	104.1	0	0	111.9	Y335 K419 P431 L432 P433	Y335-E435 HydrophobicContact CE2-CG 4.16Å; Y335-E435 WeakPolarHBondContact CE2-OE1 3.38Å; Y335-E435 WeakPolarHBondContact CE2-OE2 3.43Å; Y335-E435 PolarHBondContact OH-OE1 2.82Å; Y335-E435 PolarHBondContact OH-OE2 3.45Å; K419-E435 PolarHBondContact NZ-O 3.06Å; P431-E435 WeakPolarHBondContact CA-OE2 3.46Å; P431-E435 HydrophobicContact CB-CB 4.48Å; L432-E435 HydrophobicContact CB-CG 4.33Å; L432-E435 PolarHBondContact N-OE2 2.62Å; L432-E435 WeakPolarHBondContact O-CB 3.36Å; L432-E435 PolarHBondContact O-N 2.85Å; P433-E435 PolarHBondContact O-N 3.29Å
436	L	96.3	Very high	91.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.266	C	S	.	.	S	Bend	trans	-106.8	132.2	-176.5	-58.5	178.7	0	0	0	110.3	I371 G373 T374 C375 P431 P433 Q486 Q487	I371-L436 HydrophobicContact CB-CD1 4.21Å; I371-L436 HydrophobicContact CG2-CD1 3.72Å; G373-L436 CarbonylContact C-O 3.44Å; G373-L436 WeakPolarHBondContact CA-O 3.46Å; T374-L436 PolarHBondContact N-O 3.47Å; T374-L436 VanDerWaalsContact N-O 3.17Å; C375-L436 WeakPolarHBondContact CB-O 3.41Å; C375-L436 PolarHBondContact N-O 2.82Å; P431-L436 HydrophobicContact CB-CD1 4.32Å; P431-L436 HydrophobicContact CB-CD2 3.98Å; P431-L436 HydrophobicContact CB-CG 4.12Å; P431-L436 HydrophobicContact CG-CD1 3.98Å; P431-L436 HydrophobicContact CG-CD2 4.05Å; P431-L436 HydrophobicContact CG-CG 4.26Å; P433-L436 PolarHBondContact O-N 3.41Å; P433-L436 VanDerWaalsContact O-O 3.12Å; L436-Q486 HydrophobicContact CD1-CB 4.3Å; L436-Q486 HydrophobicContact CD2-CB 4.25Å; L436-Q487 HydrophobicContact CB-CG 4.16Å; L436-Q487 HydrophobicContact CD1-CG 3.76Å
437	R	97.4	Very high	92.7	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	23%	0.232	C	C	.	.			trans	-84.3	126.4	178.2	-69.5	169.8	-64.7	-178.4	4.5	110	C375 D377 M378 V441 L442 D483 Q487	C375-R437 HydrophobicContact CB-CG 4.03Å; D377-R437 WeakPolarHBondContact O-CD 3.28Å; D377-R437 WeakPolarHBondContact O-CG 3.43Å; M378-R437 WeakPolarHBondContact O-CD 3.49Å; M378-R437 PolarHBondContact O-NH1 3.28Å; R437-V441 HydrophobicContact CB-CB 4.07Å; R437-V441 HydrophobicContact CB-CG1 3.9Å; R437-V441 HydrophobicContact CG-CB 4.49Å; R437-V441 HydrophobicContact CG-CG1 3.79Å; R437-L442 HydrophobicContact CB-CD2 3.78Å; R437-L442 HydrophobicContact CB-CG 4.03Å; R437-L442 WeakPolarHBondContact O-CD1 3.47Å; R437-L442 WeakPolarHBondContact O-CG 3.39Å; R437-D483 IonicContact CZ-OD2 2.89Å; R437-D483 IonicContact NE-OD2 3.89Å; R437-D483 PolarHBondContact NE-OD2 3.09Å; R437-D483 IonicContact NH2-OD2 2.76Å; R437-D483 PolarHBondContact NH2-OD2 3.45Å; R437-Q487 PolarHBondContact O-NE2 3.11Å
438	P	97	Very high	93.6	Very high	22 Å²	22	36.5 Å²	36.5	14%	0.143	20%	0.195	C	C	.	.			trans	-68.1	169.3	173.9	28.7	-32.1	0	0	0	111.6	C375 S440 V441 L442	C375-P438 WeakPolarHBondContact O-CD 3.44Å; P438-S440 VanDerWaalsContact C-N 3.33Å; P438-S440 PolarHBondContact O-N 3.38Å; P438-V441 HydrophobicContact CG-CB 4.27Å; P438-V441 HydrophobicContact CG-CG2 3.73Å; P438-V441 PolarHBondContact O-N 2.95Å; P438-L442 WeakPolarHBondContact O-CG 3.47Å; P438-L442 PolarHBondContact O-N 3.34Å
439	T	97.5	Very high	94.6	Very high	35 Å²	35	33.8 Å²	33.8	22%	0.215	18%	0.182	C	C	.	.	H	α-helix	trans	-48.7	-47	-175.6	-58	0	0	0	0	114.3	V441 L442 Q443 I493 V494	T439-V441 VanDerWaalsContact C-N 3.31Å; T439-V441 PolarHBondContact O-N 3.33Å; T439-L442 PolarHBondContact O-N 3.07Å; T439-Q443 PolarHBondContact O-N 3.21Å; T439-I493 HydrophobicContact CG2-CB 3.96Å; T439-I493 HydrophobicContact CG2-CD1 4.43Å; T439-I493 HydrophobicContact CG2-CG2 3.8Å; T439-V494 HydrophobicContact CG2-CG2 3.88Å
440	S	96.3	Very high	95.4	Very high	67 Å²	67	30.4 Å²	30.4	47%	0.469	16%	0.16	S	C	.	.	H	α-helix	trans	-61.2	-39.3	-179.9	51.7	0	0	0	0	112.3	P438 Q443 R444	P438-S440 VanDerWaalsContact C-N 3.33Å; P438-S440 PolarHBondContact O-N 3.38Å; S440-Q443 PolarHBondContact O-N 3.14Å; S440-R444 WeakPolarHBondContact O-CB 3.4Å; S440-R444 PolarHBondContact O-N 2.93Å
441	V	97.7	Very high	96.1	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-75.6	-35.7	-179.8	-177.5	0	0	0	0	110.8	D377 R437 P438 T439 R444 T445	D377-V441 WeakPolarHBondContact O-CG1 3.22Å; R437-V441 HydrophobicContact CB-CB 4.07Å; R437-V441 HydrophobicContact CB-CG1 3.9Å; R437-V441 HydrophobicContact CG-CB 4.49Å; R437-V441 HydrophobicContact CG-CG1 3.79Å; P438-V441 HydrophobicContact CG-CB 4.27Å; P438-V441 HydrophobicContact CG-CG2 3.73Å; P438-V441 PolarHBondContact O-N 2.95Å; T439-V441 VanDerWaalsContact C-N 3.31Å; T439-V441 PolarHBondContact O-N 3.33Å; V441-R444 PolarHBondContact O-N 2.92Å; V441-T445 VanDerWaalsContact O-CB 3.3Å; V441-T445 WeakPolarHBondContact O-CB 3.5Å; V441-T445 PolarHBondContact O-N 2.9Å; V441-T445 PolarHBondContact O-OG1 3.35Å
442	L	98.2	Very high	96.4	Very high	2 Å²	2	28 Å²	28	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-62.8	-43	172.1	-65.7	170.4	0	0	0	111.3	R437 P438 T439 T445 M446 I480 D483 I484 L489	R437-L442 HydrophobicContact CB-CD2 3.78Å; R437-L442 HydrophobicContact CB-CG 4.03Å; R437-L442 WeakPolarHBondContact O-CD1 3.47Å; R437-L442 WeakPolarHBondContact O-CG 3.39Å; P438-L442 WeakPolarHBondContact O-CG 3.47Å; P438-L442 PolarHBondContact O-N 3.34Å; T439-L442 PolarHBondContact O-N 3.07Å; L442-T445 PolarHBondContact O-N 3Å; L442-M446 WeakPolarHBondContact O-CB 3.5Å; L442-M446 PolarHBondContact O-N 3.13Å; L442-I480 HydrophobicContact CD2-CB 4.42Å; L442-I480 HydrophobicContact CD2-CG1 4.38Å; L442-I480 HydrophobicContact CD2-CG2 4.13Å; L442-D483 HydrophobicContact CD1-CB 4.45Å; L442-D483 HydrophobicContact CD2-CB 3.83Å; L442-I484 HydrophobicContact CD1-CG1 3.79Å; L442-L489 HydrophobicContact CD1-CD1 3.68Å
443	Q	97.6	Very high	96.6	Very high	92 Å²	92	27.6 Å²	27.6	43%	0.43	15%	0.146	S	C	.	.	H	α-helix	trans	-60.3	-51.5	174	-176.3	-177	18.2	0	0	111.3	T439 S440 T445 M446 A447 I493	T439-Q443 PolarHBondContact O-N 3.21Å; S440-Q443 PolarHBondContact O-N 3.14Å; Q443-T445 VanDerWaalsContact C-N 3.33Å; Q443-T445 PolarHBondContact O-N 3.45Å; Q443-M446 PolarHBondContact O-N 2.97Å; Q443-A447 WeakPolarHBondContact O-CB 3.22Å; Q443-A447 PolarHBondContact O-N 3.43Å; Q443-I493 HydrophobicContact CB-CG2 3.75Å; Q443-I493 HydrophobicContact CG-CG2 3.88Å
444	R	96.7	Very high	96.8	Very high	99 Å²	99	25.2 Å²	25.2	37%	0.374	13%	0.131	S	C	.	.	H	α-helix	trans	-60.1	-41.8	177.4	-179.7	171.1	62.1	-148.5	-2.6	112.2	E376 S440 V441 A447 Y448	E376-R444 PolarHBondContact O-NH2 3.37Å; S440-R444 WeakPolarHBondContact O-CB 3.4Å; S440-R444 PolarHBondContact O-N 2.93Å; V441-R444 PolarHBondContact O-N 2.92Å; R444-A447 PolarHBondContact O-N 3.24Å; R444-Y448 WeakPolarHBondContact O-CB 3.25Å; R444-Y448 PolarHBondContact O-N 3.19Å
445	T	98	Very high	97	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.2	-46.1	177	-55.2	0	0	0	0	110.6	M378 V418 V441 L442 Q443 A447 Y448 L449 I480	M378-T445 HydrophobicContact CB-CG2 4.21Å; M378-T445 HydrophobicContact CG-CG2 4.23Å; M378-T445 HydrophobicContact SD-CG2 4.34Å; V418-T445 HydrophobicContact CG1-CG2 3.56Å; V441-T445 VanDerWaalsContact O-CB 3.3Å; V441-T445 WeakPolarHBondContact O-CB 3.5Å; V441-T445 PolarHBondContact O-N 2.9Å; V441-T445 PolarHBondContact O-OG1 3.35Å; L442-T445 PolarHBondContact O-N 3Å; Q443-T445 VanDerWaalsContact C-N 3.33Å; Q443-T445 PolarHBondContact O-N 3.45Å; T445-A447 VanDerWaalsContact C-N 3.31Å; T445-A447 PolarHBondContact O-N 3.24Å; T445-Y448 PolarHBondContact O-N 2.97Å; T445-L449 HydrophobicContact CG2-CD1 4.49Å; T445-L449 HydrophobicContact CG2-CG 4.49Å; T445-L449 WeakPolarHBondContact O-CG 3.42Å; T445-L449 PolarHBondContact O-N 3.35Å; T445-I480 HydrophobicContact CG2-CD1 4.04Å; T445-I480 HydrophobicContact CG2-CG1 4.48Å
446	M	98.2	Very high	97.1	Very high	2 Å²	2	25.8 Å²	25.8	1%	0.01	13%	0.133	C	C	.	.	H	α-helix	trans	-62	-41.9	177.8	-168.6	67.4	-130.3	0	0	111.1	L442 Q443 L449 L450 I480 V497 R500 I501	L442-M446 WeakPolarHBondContact O-CB 3.5Å; L442-M446 PolarHBondContact O-N 3.13Å; Q443-M446 PolarHBondContact O-N 2.97Å; M446-L449 PolarHBondContact O-N 3.38Å; M446-L450 HydrophobicContact CE-CD1 4.18Å; M446-L450 HydrophobicContact CE-CD2 3.64Å; M446-L450 HydrophobicContact CE-CG 3.72Å; M446-L450 WeakPolarHBondContact O-CG 3.46Å; M446-L450 PolarHBondContact O-N 2.97Å; M446-L450 VanDerWaalsContact O-N 3.11Å; M446-I480 HydrophobicContact CB-CD1 4.49Å; M446-I480 HydrophobicContact SD-CD1 4.18Å; M446-V497 HydrophobicContact CB-CG1 4.09Å; M446-V497 HydrophobicContact CB-CG2 4.14Å; M446-V497 HydrophobicContact CG-CG1 4.07Å; M446-V497 HydrophobicContact CG-CG2 4.46Å; M446-V497 HydrophobicContact SD-CG1 4.32Å; M446-R500 HydrophobicContact CE-CB 4Å; M446-R500 HydrophobicContact CG-CB 4.26Å; M446-R500 HydrophobicContact SD-CB 4.42Å; M446-I501 HydrophobicContact CE-CG1 4.47Å; M446-I501 HydrophobicContact SD-CD1 4.32Å; M446-I501 HydrophobicContact SD-CG1 3.8Å
447	A	97.4	Very high	96.9	Very high	18 Å²	18	26 Å²	26	15%	0.149	14%	0.135	C	C	.	.	H	α-helix	trans	-61	-45.2	176.1	0	0	0	0	0	112	Q443 R444 T445 L450 A451 D731	Q443-A447 WeakPolarHBondContact O-CB 3.22Å; Q443-A447 PolarHBondContact O-N 3.43Å; R444-A447 PolarHBondContact O-N 3.24Å; T445-A447 VanDerWaalsContact C-N 3.31Å; T445-A447 PolarHBondContact O-N 3.24Å; A447-L450 PolarHBondContact O-N 3.26Å; A447-A451 WeakPolarHBondContact O-CB 3.49Å; A447-A451 PolarHBondContact O-N 3.19Å; A447-D731 HydrophobicContact CB-CB 3.84Å
448	Y	98	Very high	96.5	Very high	9 Å²	9	29.5 Å²	29.5	4%	0.035	15%	0.151	C	C	.	.	H	α-helix	trans	-60	-45.8	174.5	172.5	-98.6	0	0	0	112.8	M378 R416 V418 R444 T445 L450 A451 S452 I453 D731 P734	M378-Y448 HydrophobicContact CE-CD1 3.72Å; M378-Y448 HydrophobicContact CE-CD2 4.16Å; M378-Y448 HydrophobicContact CE-CE1 3.86Å; M378-Y448 HydrophobicContact CE-CE2 4.29Å; M378-Y448 HydrophobicContact CE-CG 3.88Å; M378-Y448 HydrophobicContact SD-CD1 3.47Å; M378-Y448 WeakPolarHBondContact SD-CD1 3.47Å; M378-Y448 HydrophobicContact SD-CD2 4.31Å; M378-Y448 HydrophobicContact SD-CE1 4.21Å; M378-Y448 HydrophobicContact SD-CG 3.53Å; M378-Y448 VanDerWaalsContact SD-CG 3.53Å; R416-Y448 WeakPolarHBondContact CB-OH 3.39Å; R416-Y448 WeakPolarHBondContact CG-OH 3.37Å; V418-Y448 HydrophobicContact CG2-CD1 4.06Å; V418-Y448 HydrophobicContact CG2-CE1 3.92Å; R444-Y448 WeakPolarHBondContact O-CB 3.25Å; R444-Y448 PolarHBondContact O-N 3.19Å; T445-Y448 PolarHBondContact O-N 2.97Å; Y448-L450 PolarHBondContact O-N 3.49Å; Y448-A451 PolarHBondContact O-N 3.04Å; Y448-S452 WeakPolarHBondContact CD2-OG 3.5Å; Y448-S452 WeakPolarHBondContact CE2-OG 3.44Å; Y448-S452 VanDerWaalsContact O-CB 3.25Å; Y448-S452 WeakPolarHBondContact O-CB 3.33Å; Y448-S452 PolarHBondContact O-N 3.43Å; Y448-S452 PolarHBondContact O-OG 2.75Å; Y448-I453 HydrophobicContact CD1-CD1 4.3Å; Y448-I453 HydrophobicContact CE1-CD1 3.77Å; Y448-D731 WeakPolarHBondContact CA-O 3.33Å; Y448-P734 HydrophobicContact CE2-CB 4.22Å
449	L	98.4	Very high	96.1	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-58.3	-39	177.3	-71.1	177.9	0	0	0	111.4	V418 T445 M446 I453 A454 F472 M473 R476 T477 I480	V418-L449 HydrophobicContact CG1-CD2 4.37Å; V418-L449 HydrophobicContact CG2-CD2 4.13Å; T445-L449 HydrophobicContact CG2-CD1 4.49Å; T445-L449 HydrophobicContact CG2-CG 4.49Å; T445-L449 WeakPolarHBondContact O-CG 3.42Å; T445-L449 PolarHBondContact O-N 3.35Å; M446-L449 PolarHBondContact O-N 3.38Å; L449-I453 HydrophobicContact CD2-CD1 3.6Å; L449-I453 WeakPolarHBondContact O-CB 3.4Å; L449-I453 PolarHBondContact O-N 3.41Å; L449-A454 PolarHBondContact O-N 3.45Å; L449-F472 HydrophobicContact CD2-CE1 3.93Å; L449-M473 HydrophobicContact CB-CE 4.28Å; L449-M473 HydrophobicContact CB-SD 4.28Å; L449-M473 HydrophobicContact CD2-SD 4.31Å; L449-R476 HydrophobicContact CD1-CB 3.97Å; L449-R476 HydrophobicContact CD2-CB 4.17Å; L449-R476 HydrophobicContact CD2-CG 4.4Å; L449-T477 HydrophobicContact CD1-CG2 4.4Å; L449-I480 HydrophobicContact CD1-CD1 3.83Å
450	L	98.2	Very high	95.5	Very high	1 Å²	1	34.7 Å²	34.7	1%	0.005	18%	0.175	C	C	.	.	H	α-helix	trans	-72.4	-50.4	177.5	-63.7	-174.9	0	0	0	112.2	M446 A447 Y448 A454 R500 S719 F722 N723 I727	M446-L450 HydrophobicContact CE-CD1 4.18Å; M446-L450 HydrophobicContact CE-CD2 3.64Å; M446-L450 HydrophobicContact CE-CG 3.72Å; M446-L450 WeakPolarHBondContact O-CG 3.46Å; M446-L450 PolarHBondContact O-N 2.97Å; M446-L450 VanDerWaalsContact O-N 3.11Å; A447-L450 PolarHBondContact O-N 3.26Å; Y448-L450 PolarHBondContact O-N 3.49Å; L450-A454 HydrophobicContact CD2-CB 4.2Å; L450-A454 WeakPolarHBondContact O-CB 3.4Å; L450-R500 HydrophobicContact CD1-CB 4.41Å; L450-R500 HydrophobicContact CD1-CG 4.17Å; L450-S719 WeakPolarHBondContact O-CB 3.38Å; L450-F722 HydrophobicContact CD2-CB 3.66Å; L450-F722 HydrophobicContact CD2-CD2 3.84Å; L450-F722 HydrophobicContact CD2-CG 4.27Å; L450-N723 HydrophobicContact CD1-CB 3.86Å; L450-I727 HydrophobicContact CB-CD1 3.67Å; L450-I727 HydrophobicContact CD1-CD1 4.46Å
451	A	96.7	Very high	94.6	Very high	28 Å²	28	38.1 Å²	38.1	23%	0.231	19%	0.193	C	C	.	.	H	α-helix	trans	-69	-36.7	-174.9	0	0	0	0	0	113.3	A447 Y448 I727 D731 A732	A447-A451 WeakPolarHBondContact O-CB 3.49Å; A447-A451 PolarHBondContact O-N 3.19Å; Y448-A451 PolarHBondContact O-N 3.04Å; A451-I727 HydrophobicContact CB-CG2 3.81Å; A451-D731 HydrophobicContact CB-CB 4.05Å; A451-A732 HydrophobicContact CB-CB 3.87Å
452	S	95.4	Very high	93.7	Very high	16 Å²	16	41.3 Å²	41.3	11%	0.112	22%	0.216	C	C	.	.	H	α-helix	trans	-100.1	-26.1	-171.1	-62.8	0	0	0	0	114.5	Y448 R456 A732	Y448-S452 WeakPolarHBondContact CD2-OG 3.5Å; Y448-S452 WeakPolarHBondContact CE2-OG 3.44Å; Y448-S452 VanDerWaalsContact O-CB 3.25Å; Y448-S452 WeakPolarHBondContact O-CB 3.33Å; Y448-S452 PolarHBondContact O-N 3.43Å; Y448-S452 PolarHBondContact O-OG 2.75Å; S452-R456 PolarHBondContact O-NE 2.84Å; S452-A732 WeakPolarHBondContact OG-CA 3.42Å; S452-A732 PolarHBondContact OG-O 3.42Å; S452-A732 VanDerWaalsContact OG-O 3.13Å
453	I	96.8	Very high	92.6	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.015	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125.7	-35.8	-165	-61	152.1	0	0	0	113.3	F396 Y448 L449 D455 R456 W469 F472 M473	F396-I453 HydrophobicContact CB-CG1 4.42Å; F396-I453 HydrophobicContact CD1-CG2 4.2Å; F396-I453 HydrophobicContact CE1-CG2 4.44Å; F396-I453 HydrophobicContact CG-CG2 4.31Å; Y448-I453 HydrophobicContact CD1-CD1 4.3Å; Y448-I453 HydrophobicContact CE1-CD1 3.77Å; L449-I453 HydrophobicContact CD2-CD1 3.6Å; L449-I453 WeakPolarHBondContact O-CB 3.4Å; L449-I453 PolarHBondContact O-N 3.41Å; I453-D455 VanDerWaalsContact C-N 3.29Å; I453-D455 PolarHBondContact O-N 3.21Å; I453-R456 VanDerWaalsContact O-CB 3.32Å; I453-R456 WeakPolarHBondContact O-CB 3.47Å; I453-R456 WeakPolarHBondContact O-CG 3.46Å; I453-R456 PolarHBondContact O-N 3.43Å; I453-R456 VanDerWaalsContact O-N 3.11Å; I453-W469 PolarHBondContact O-NE1 2.91Å; I453-W469 VanDerWaalsContact O-NE1 3.08Å; I453-F472 HydrophobicContact CD1-CD1 4.34Å; I453-F472 HydrophobicContact CD1-CE1 3.55Å; I453-F472 HydrophobicContact CD1-CZ 4.3Å; I453-F472 HydrophobicContact CG2-CD1 4.12Å; I453-F472 HydrophobicContact CG2-CE1 4.42Å; I453-M473 HydrophobicContact CB-SD 4.21Å; I453-M473 HydrophobicContact CG2-CG 4.2Å; I453-M473 HydrophobicContact CG2-SD 3.68Å
454	A	97.1	Very high	91.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-40	-171.4	0	0	0	0	0	113.9	L449 L450 W469 L718 F722	L449-A454 PolarHBondContact O-N 3.45Å; L450-A454 HydrophobicContact CD2-CB 4.2Å; L450-A454 WeakPolarHBondContact O-CB 3.4Å; A454-W469 PolarHBondContact O-NE1 3.05Å; A454-L718 HydrophobicContact CB-CB 4.49Å; A454-L718 WeakPolarHBondContact O-CD1 3.42Å; A454-F722 HydrophobicContact CB-CD2 4.05Å; A454-F722 HydrophobicContact CB-CE2 4.13Å
455	D	95.9	Very high	91.6	Very high	30 Å²	30	47 Å²	47	16%	0.16	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-7.6	-176.5	-60.6	-36.6	0	0	0	114.4	I453 P457 E458 I459 P717 L718 S719	I453-D455 VanDerWaalsContact C-N 3.29Å; I453-D455 PolarHBondContact O-N 3.21Å; D455-P457 VanDerWaalsContact C-CD 3.41Å; D455-E458 PolarHBondContact O-N 3.5Å; D455-E458 VanDerWaalsContact O-N 3.07Å; D455-I459 HydrophobicContact CB-CD1 3.89Å; D455-I459 WeakPolarHBondContact O-CG1 3.03Å; D455-I459 PolarHBondContact O-N 3.27Å; D455-P717 WeakPolarHBondContact OD1-CB 3.48Å; D455-L718 WeakPolarHBondContact OD1-CA 3.38Å; D455-L718 WeakPolarHBondContact OD1-CB 3.44Å; D455-L718 PolarHBondContact OD1-N 3.35Å; D455-S719 PolarHBondContact OD1-N 3.32Å; D455-S719 PolarHBondContact OD1-OG 3.25Å; D455-S719 WeakPolarHBondContact OD2-CB 3.24Å; D455-S719 PolarHBondContact OD2-OG 3.43Å
456	R	94.1	Very high	91.3	Very high	117 Å²	117	48.2 Å²	48.2	44%	0.442	25%	0.252	S	S	.	.	H	α-helix	trans	-51.7	-44.9	-175.3	-69.3	-69.4	-178.2	178.1	-1.1	115.4	F396 S452 I453 E458 I459 D460 L465	F396-R456 HydrophobicContact CD1-CG 4.48Å; F396-R456 HydrophobicContact CE1-CB 4.03Å; F396-R456 HydrophobicContact CE1-CG 4.19Å; S452-R456 PolarHBondContact O-NE 2.84Å; I453-R456 VanDerWaalsContact O-CB 3.32Å; I453-R456 WeakPolarHBondContact O-CB 3.47Å; I453-R456 WeakPolarHBondContact O-CG 3.46Å; I453-R456 PolarHBondContact O-N 3.43Å; I453-R456 VanDerWaalsContact O-N 3.11Å; R456-E458 PolarHBondContact O-N 2.89Å; R456-I459 PolarHBondContact O-N 3.1Å; R456-D460 WeakPolarHBondContact O-CB 3.47Å; R456-D460 PolarHBondContact O-N 2.99Å; R456-L465 HydrophobicContact CB-CD2 3.92Å
457	P	92	Very high	91	Very high	4 Å²	4	50.7 Å²	50.7	3%	0.026	26%	0.263	C	S	.	.	H	α-helix	trans	-70.6	-14.4	-176.6	30.8	-38.3	0	0	0	113.3	D455 W466 W469 L718	D455-P457 VanDerWaalsContact C-CD 3.41Å; P457-W466 HydrophobicContact CB-CD2 3.69Å; P457-W466 HydrophobicContact CB-CE3 3.89Å; P457-W466 HydrophobicContact CB-CG 4.12Å; P457-W466 HydrophobicContact CB-CH2 4.27Å; P457-W466 HydrophobicContact CB-CZ2 4.07Å; P457-W466 HydrophobicContact CB-CZ3 4.18Å; P457-W466 HydrophobicContact CG-CD2 4.33Å; P457-W466 HydrophobicContact CG-CE3 4.04Å; P457-W466 HydrophobicContact CG-CH2 4.04Å; P457-W466 HydrophobicContact CG-CZ2 4.29Å; P457-W466 HydrophobicContact CG-CZ3 3.9Å; P457-W469 HydrophobicContact CB-CB 4.32Å; P457-W469 HydrophobicContact CB-CD2 4.47Å; P457-W469 HydrophobicContact CB-CG 4.22Å; P457-W469 VanDerWaalsContact CD-CD1 3.4Å; P457-W469 HydrophobicContact CG-CB 4.35Å; P457-W469 HydrophobicContact CG-CD2 3.68Å; P457-W469 HydrophobicContact CG-CE3 4.24Å; P457-W469 HydrophobicContact CG-CG 3.72Å; P457-W469 HydrophobicContact CG-CZ2 4.4Å; P457-L718 HydrophobicContact CG-CD1 4.39Å
458	E	90	Very high	90.8	Very high	75 Å²	75	52.1 Å²	52.1	35%	0.35	27%	0.27	S	S	.	.	H	α-helix	trans	-92.7	-26.4	175.3	-53.2	-154.7	136.1	0	0	112.4	D455 R456 W466 R713 L718	D455-E458 PolarHBondContact O-N 3.5Å; D455-E458 VanDerWaalsContact O-N 3.07Å; R456-E458 PolarHBondContact O-N 2.89Å; E458-W466 HydrophobicContact CG-CH2 4.1Å; E458-W466 HydrophobicContact CG-CZ2 4.01Å; E458-R713 VanDerWaalsContact CD-NH1 3.26Å; E458-R713 IonicContact OE1-CZ 3.45Å; E458-R713 IonicContact OE1-NH1 2.63Å; E458-R713 PolarHBondContact OE1-NH1 2.99Å; E458-R713 IonicContact OE1-NH2 3.68Å; E458-R713 PolarHBondContact OE1-NH2 2.96Å; E458-R713 IonicContact OE2-NH1 3.93Å; E458-R713 PolarHBondContact OE2-NH1 3.38Å; E458-L718 HydrophobicContact CG-CD1 3.93Å; E458-L718 HydrophobicContact CG-CG 4.33Å
459	I	87.6	Confident	90.7	Very high	118 Å²	118	51.7 Å²	51.7	61%	0.605	27%	0.269	S	S	*	.	H	α-helix	trans	-80	-32	175.2	-59	163.3	0	0	0	110.8	D455 R456 T461	D455-I459 HydrophobicContact CB-CD1 3.89Å; D455-I459 WeakPolarHBondContact O-CG1 3.03Å; D455-I459 PolarHBondContact O-N 3.27Å; R456-I459 PolarHBondContact O-N 3.1Å; I459-T461 PolarHBondContact O-N 3.24Å
460	D	85.2	Confident	90.7	Very high	48 Å²	48	52.3 Å²	52.3	26%	0.257	27%	0.271	S	S	.	.			trans	-67.4	119.1	-179.1	176.8	58.9	0	0	0	112.6	R456 S462 R463 L465	R456-D460 WeakPolarHBondContact O-CB 3.47Å; R456-D460 PolarHBondContact O-N 2.99Å; D460-S462 VanDerWaalsContact C-N 3.27Å; D460-S462 PolarHBondContact O-N 3.3Å; D460-S462 PolarHBondContact OD1-OG 3.25Å; D460-S462 WeakPolarHBondContact OD2-CB 3.31Å; D460-S462 PolarHBondContact OD2-N 3.38Å; D460-S462 PolarHBondContact OD2-OG 2.93Å; D460-R463 PolarHBondContact OD2-N 3.31Å; D460-L465 HydrophobicContact CB-CB 4Å; D460-L465 HydrophobicContact CB-CD2 3.68Å; D460-L465 WeakPolarHBondContact OD2-CB 3.07Å
461	T	78	Confident	90.5	Very high	138 Å²	138	56.5 Å²	56.5	85%	0.847	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-21.1	179.4	48.7	0	0	0	0	113.1	I459 R463	I459-T461 PolarHBondContact O-N 3.24Å; T461-R463 VanDerWaalsContact C-N 3.27Å; T461-R463 PolarHBondContact O-N 3.19Å
462	S	78.5	Confident	90.6	Very high	67 Å²	67	55.5 Å²	55.5	47%	0.469	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-19.6	-177.1	88.4	0	0	0	0	113.4	D460 S464	D460-S462 VanDerWaalsContact C-N 3.27Å; D460-S462 PolarHBondContact O-N 3.3Å; D460-S462 PolarHBondContact OD1-OG 3.25Å; D460-S462 WeakPolarHBondContact OD2-CB 3.31Å; D460-S462 PolarHBondContact OD2-N 3.38Å; D460-S462 PolarHBondContact OD2-OG 2.93Å; S462-S464 PolarHBondContact O-N 3.5Å; S462-S464 PolarHBondContact OG-N 3.49Å; S462-S464 PolarHBondContact OG-OG 3.45Å
463	R	75.6	Confident	90.7	Very high	210 Å²	210	54.7 Å²	54.7	79%	0.792	28%	0.276	S	S	*	.	S	Bend	trans	57.5	1.6	-171.6	-58.1	-174.2	176.1	-151.6	-0.9	115	D460 T461 L465	D460-R463 PolarHBondContact OD2-N 3.31Å; T461-R463 VanDerWaalsContact C-N 3.27Å; T461-R463 PolarHBondContact O-N 3.19Å; R463-L465 VanDerWaalsContact C-N 3.32Å
464	S	81.9	Confident	90.7	Very high	86 Å²	86	56.7 Å²	56.7	60%	0.601	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-9.2	-178.8	72.3	0	0	0	0	113.2	S462 W466 P468	S462-S464 PolarHBondContact O-N 3.5Å; S462-S464 PolarHBondContact OG-N 3.49Å; S462-S464 PolarHBondContact OG-OG 3.45Å; S464-W466 PolarHBondContact O-N 3.11Å; S464-P468 WeakPolarHBondContact O-CD 3.46Å
465	L	90.5	Very high	90.7	Very high	17 Å²	17	57.9 Å²	57.9	9%	0.089	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-13.3	-172.1	-164.2	60.2	0	0	0	114.5	I395 F396 R456 D460 R463 K467 P468 W469	I395-L465 HydrophobicContact CD1-CD1 4.34Å; I395-L465 HydrophobicContact CG2-CD1 4.15Å; F396-L465 HydrophobicContact CE1-CD1 4.03Å; F396-L465 HydrophobicContact CE1-CD2 4.1Å; F396-L465 HydrophobicContact CE1-CG 4.26Å; F396-L465 HydrophobicContact CZ-CD1 3.64Å; F396-L465 HydrophobicContact CZ-CD2 4.29Å; F396-L465 HydrophobicContact CZ-CG 3.95Å; R456-L465 HydrophobicContact CB-CD2 3.92Å; D460-L465 HydrophobicContact CB-CB 4Å; D460-L465 HydrophobicContact CB-CD2 3.68Å; D460-L465 WeakPolarHBondContact OD2-CB 3.07Å; R463-L465 VanDerWaalsContact C-N 3.32Å; L465-K467 PolarHBondContact O-N 3.02Å; L465-P468 HydrophobicContact CD1-CB 4.36Å; L465-P468 WeakPolarHBondContact O-CD 2.96Å; L465-W469 WeakPolarHBondContact O-CB 3.4Å; L465-W469 PolarHBondContact O-N 3.02Å
466	W	92.6	Very high	90.8	Very high	25 Å²	25	56.9 Å²	56.9	10%	0.095	28%	0.284	C	S	.	.	H	α-helix	trans	-58.6	-42.5	-177.6	-77.3	98.1	0	0	0	113.7	P457 E458 S464 W469 Y470 F507 R511 L512 L718	P457-W466 HydrophobicContact CB-CD2 3.69Å; P457-W466 HydrophobicContact CB-CE3 3.89Å; P457-W466 HydrophobicContact CB-CG 4.12Å; P457-W466 HydrophobicContact CB-CH2 4.27Å; P457-W466 HydrophobicContact CB-CZ2 4.07Å; P457-W466 HydrophobicContact CB-CZ3 4.18Å; P457-W466 HydrophobicContact CG-CD2 4.33Å; P457-W466 HydrophobicContact CG-CE3 4.04Å; P457-W466 HydrophobicContact CG-CH2 4.04Å; P457-W466 HydrophobicContact CG-CZ2 4.29Å; P457-W466 HydrophobicContact CG-CZ3 3.9Å; E458-W466 HydrophobicContact CG-CH2 4.1Å; E458-W466 HydrophobicContact CG-CZ2 4.01Å; S464-W466 PolarHBondContact O-N 3.11Å; W466-W469 HydrophobicContact CE3-CE3 4.09Å; W466-W469 HydrophobicContact CE3-CZ3 4.2Å; W466-W469 HydrophobicContact CZ3-CE3 4.3Å; W466-W469 HydrophobicContact CZ3-CZ3 4.05Å; W466-Y470 WeakPolarHBondContact O-CB 3.17Å; W466-Y470 PolarHBondContact O-N 3.38Å; W466-F507 HydrophobicContact CH2-CE1 4.39Å; W466-F507 HydrophobicContact CH2-CZ 4.47Å; W466-F507 HydrophobicContact CZ3-CE1 4.23Å; W466-R511 HydrophobicContact CH2-CG 4.01Å; W466-R511 VanDerWaalsContact CZ2-NH2 3.3Å; W466-R511 HydrophobicContact CZ3-CG 3.96Å; W466-L512 HydrophobicContact CD2-CD2 4.33Å; W466-L512 HydrophobicContact CE3-CD2 3.76Å; W466-L512 HydrophobicContact CZ3-CD2 4.39Å; W466-L718 HydrophobicContact CH2-CD1 4.2Å
467	K	92.2	Very high	91	Very high	54 Å²	54	51.3 Å²	51.3	24%	0.235	26%	0.263	C	S	.	.	H	α-helix	trans	-66.6	-57.8	178.3	175.9	177	-167.8	144.5	0	111.9	L465 W469 Y470 E471 D518 T519	L465-K467 PolarHBondContact O-N 3.02Å; K467-W469 PolarHBondContact O-N 2.95Å; K467-Y470 PolarHBondContact O-N 2.87Å; K467-E471 WeakPolarHBondContact CE-OE1 3.34Å; K467-E471 WeakPolarHBondContact O-CG 3.44Å; K467-E471 PolarHBondContact O-N 3.42Å; K467-D518 WeakPolarHBondContact CE-O 3.41Å; K467-D518 PolarHBondContact NZ-O 3.35Å; K467-D518 IonicContact NZ-OD2 3.05Å; K467-D518 PolarHBondContact NZ-OD2 2.87Å; K467-T519 HydrophobicContact CB-CG2 3.56Å; K467-T519 HydrophobicContact CD-CG2 4.02Å; K467-T519 WeakPolarHBondContact CD-OG1 3.14Å; K467-T519 HydrophobicContact CG-CG2 3.79Å; K467-T519 PolarHBondContact NZ-OG1 3.2Å; K467-T519 VanDerWaalsContact NZ-OG1 3.15Å
468	P	93	Very high	91.2	Very high	48 Å²	48	52.2 Å²	52.2	31%	0.312	27%	0.266	S	S	.	.	H	α-helix	trans	-55.8	-38.6	176.1	-24.6	32.1	0	0	0	112.9	I395 F396 S464 L465 F472	I395-P468 HydrophobicContact CG2-CB 4.41Å; F396-P468 HydrophobicContact CE2-CB 4.38Å; S464-P468 WeakPolarHBondContact O-CD 3.46Å; L465-P468 HydrophobicContact CD1-CB 4.36Å; L465-P468 WeakPolarHBondContact O-CD 2.96Å; P468-F472 WeakPolarHBondContact O-CB 3.45Å; P468-F472 PolarHBondContact O-N 2.83Å
469	W	96.1	Very high	91.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.3	-49	178.2	174.2	85.7	0	0	0	112.5	F396 I453 A454 P457 L465 W466 K467 F472 M473 F504 L718 F722	F396-W469 HydrophobicContact CE2-CB 4.35Å; F396-W469 HydrophobicContact CZ-CB 3.92Å; I453-W469 PolarHBondContact O-NE1 2.91Å; I453-W469 VanDerWaalsContact O-NE1 3.08Å; A454-W469 PolarHBondContact O-NE1 3.05Å; P457-W469 HydrophobicContact CB-CB 4.32Å; P457-W469 HydrophobicContact CB-CD2 4.47Å; P457-W469 HydrophobicContact CB-CG 4.22Å; P457-W469 VanDerWaalsContact CD-CD1 3.4Å; P457-W469 HydrophobicContact CG-CB 4.35Å; P457-W469 HydrophobicContact CG-CD2 3.68Å; P457-W469 HydrophobicContact CG-CE3 4.24Å; P457-W469 HydrophobicContact CG-CG 3.72Å; P457-W469 HydrophobicContact CG-CZ2 4.4Å; L465-W469 WeakPolarHBondContact O-CB 3.4Å; L465-W469 PolarHBondContact O-N 3.02Å; W466-W469 HydrophobicContact CE3-CE3 4.09Å; W466-W469 HydrophobicContact CE3-CZ3 4.2Å; W466-W469 HydrophobicContact CZ3-CE3 4.3Å; W466-W469 HydrophobicContact CZ3-CZ3 4.05Å; K467-W469 PolarHBondContact O-N 2.95Å; W469-F472 PolarHBondContact O-N 3.36Å; W469-M473 HydrophobicContact CD2-CG 4.25Å; W469-M473 HydrophobicContact CG-CG 4.44Å; W469-M473 HydrophobicContact CZ2-CG 4.23Å; W469-M473 WeakPolarHBondContact O-CB 3.46Å; W469-M473 WeakPolarHBondContact O-CG 3.37Å; W469-M473 PolarHBondContact O-N 3.31Å; W469-F504 AromaticContact CH2-CD2 3.96Å; W469-F504 HydrophobicContact CH2-CD2 3.96Å; W469-F504 AromaticContact CH2-CE2 3.57Å; W469-F504 HydrophobicContact CH2-CE2 3.57Å; W469-F504 HydrophobicContact CZ2-CD2 4.37Å; W469-F504 HydrophobicContact CZ2-CE2 4.1Å; W469-F504 AromaticContact CZ3-CE2 3.93Å; W469-F504 HydrophobicContact CZ3-CE2 3.93Å; W469-L718 HydrophobicContact CZ2-CD1 4.27Å; W469-F722 HydrophobicContact CH2-CE2 4.36Å; W469-F722 HydrophobicContact CH2-CZ 4.31Å; W469-F722 HydrophobicContact CZ2-CE2 4.08Å; W469-F722 HydrophobicContact CZ2-CZ 4.44Å
470	Y	96.7	Very high	92.2	Very high	13 Å²	13	43.1 Å²	43.1	5%	0.051	22%	0.222	C	C	.	.	H	α-helix	trans	-63.8	-47.2	179.7	175.3	-104.2	0	0	0	110.7	W466 K467 F472 M473 W474 F504 C508 L512 F520 N525	W466-Y470 WeakPolarHBondContact O-CB 3.17Å; W466-Y470 PolarHBondContact O-N 3.38Å; K467-Y470 PolarHBondContact O-N 2.87Å; Y470-F472 VanDerWaalsContact C-N 3.29Å; Y470-F472 PolarHBondContact O-N 3.17Å; Y470-M473 PolarHBondContact O-N 3.28Å; Y470-W474 HydrophobicContact CE1-CB 4.48Å; Y470-W474 HydrophobicContact CE2-CB 4.43Å; Y470-W474 WeakPolarHBondContact O-CB 3.4Å; Y470-W474 PolarHBondContact O-N 3.07Å; Y470-F504 HydrophobicContact CD2-CE2 4.45Å; Y470-F504 AromaticContact CD2-CZ 3.86Å; Y470-F504 HydrophobicContact CD2-CZ 3.86Å; Y470-F504 HydrophobicContact CE2-CE1 4.49Å; Y470-F504 HydrophobicContact CE2-CZ 4Å; Y470-C508 HydrophobicContact CD2-CB 4.26Å; Y470-C508 HydrophobicContact CE2-CB 3.99Å; Y470-L512 HydrophobicContact CD2-CD1 3.68Å; Y470-L512 HydrophobicContact CE2-CD1 4.39Å; Y470-L512 HydrophobicContact CG-CD1 3.81Å; Y470-F520 HydrophobicContact CD1-CD2 4.1Å; Y470-F520 HydrophobicContact CD2-CD2 4.22Å; Y470-F520 HydrophobicContact CD2-CE2 4.45Å; Y470-F520 AromaticContact CE1-CD2 3.64Å; Y470-F520 HydrophobicContact CE1-CD2 3.64Å; Y470-F520 HydrophobicContact CE1-CE2 4.25Å; Y470-F520 AromaticContact CE2-CD2 3.77Å; Y470-F520 HydrophobicContact CE2-CD2 3.77Å; Y470-F520 AromaticContact CE2-CE2 3.7Å; Y470-F520 HydrophobicContact CE2-CE2 3.7Å; Y470-F520 HydrophobicContact CG-CD2 4.38Å; Y470-F520 AromaticContact CZ-CD2 3.46Å; Y470-F520 VanDerWaalsContact CZ-CD2 3.46Å; Y470-F520 AromaticContact CZ-CE2 3.59Å; Y470-N525 PolarHBondContact OH-OD1 3.37Å
471	E	95.2	Very high	92.8	Very high	90 Å²	90	41.1 Å²	41.1	42%	0.421	21%	0.21	S	C	.	.	H	α-helix	trans	-57.9	-41.6	177	-71.8	177.8	173.4	0	0	111.9	K467 T475	K467-E471 WeakPolarHBondContact CE-OE1 3.34Å; K467-E471 WeakPolarHBondContact O-CG 3.44Å; K467-E471 PolarHBondContact O-N 3.42Å; E471-T475 WeakPolarHBondContact O-CG2 3.25Å; E471-T475 PolarHBondContact O-N 3.41Å; E471-T475 VanDerWaalsContact O-N 3.13Å; E471-T475 PolarHBondContact O-OG1 2.97Å
472	F	97.5	Very high	93.6	Very high	6 Å²	6	35.9 Å²	35.9	3%	0.026	18%	0.176	C	C	.	.	H	α-helix	trans	-66	-58.2	176.9	-172.1	-93.5	0	0	0	112	S394 F396 E397 V418 L449 I453 P468 W469 Y470 W474 T475 R476	S394-F472 VanDerWaalsContact CB-CD2 3.49Å; S394-F472 WeakPolarHBondContact OG-CD2 3.45Å; F396-F472 HydrophobicContact CB-CD1 4.37Å; F396-F472 HydrophobicContact CB-CD2 4.43Å; F396-F472 HydrophobicContact CB-CE1 4.18Å; F396-F472 HydrophobicContact CB-CE2 4.2Å; F396-F472 HydrophobicContact CB-CG 4.49Å; F396-F472 HydrophobicContact CB-CZ 4.06Å; F396-F472 HydrophobicContact CD2-CB 3.68Å; F396-F472 AromaticContact CD2-CD1 3.87Å; F396-F472 HydrophobicContact CD2-CD1 3.87Å; F396-F472 AromaticContact CD2-CD2 3.88Å; F396-F472 HydrophobicContact CD2-CD2 3.88Å; F396-F472 HydrophobicContact CD2-CE1 4.5Å; F396-F472 HydrophobicContact CD2-CE2 4.47Å; F396-F472 AromaticContact CD2-CG 3.51Å; F396-F472 HydrophobicContact CD2-CG 3.51Å; F396-F472 HydrophobicContact CE2-CB 3.83Å; F396-F472 HydrophobicContact CE2-CG 4.17Å; F396-F472 HydrophobicContact CG-CD1 4.35Å; F396-F472 HydrophobicContact CG-CG 4.35Å; E397-F472 HydrophobicContact CG-CE2 3.62Å; E397-F472 HydrophobicContact CG-CZ 3.8Å; V418-F472 HydrophobicContact CB-CZ 4.5Å; L449-F472 HydrophobicContact CD2-CE1 3.93Å; I453-F472 HydrophobicContact CD1-CD1 4.34Å; I453-F472 HydrophobicContact CD1-CE1 3.55Å; I453-F472 HydrophobicContact CD1-CZ 4.3Å; I453-F472 HydrophobicContact CG2-CD1 4.12Å; I453-F472 HydrophobicContact CG2-CE1 4.42Å; P468-F472 WeakPolarHBondContact O-CB 3.45Å; P468-F472 PolarHBondContact O-N 2.83Å; W469-F472 PolarHBondContact O-N 3.36Å; Y470-F472 VanDerWaalsContact C-N 3.29Å; Y470-F472 PolarHBondContact O-N 3.17Å; F472-W474 VanDerWaalsContact C-N 3.27Å; F472-W474 PolarHBondContact O-N 3.32Å; F472-T475 PolarHBondContact O-N 2.84Å; F472-T475 PolarHBondContact O-OG1 2.84Å; F472-R476 HydrophobicContact CD1-CG 4.03Å; F472-R476 HydrophobicContact CD2-CG 4.41Å; F472-R476 HydrophobicContact CE1-CG 3.67Å; F472-R476 HydrophobicContact CE2-CG 4.13Å; F472-R476 HydrophobicContact CG-CG 4.39Å; F472-R476 HydrophobicContact CZ-CG 3.76Å; F472-R476 VanDerWaalsContact O-CG 3.3Å; F472-R476 WeakPolarHBondContact O-CG 3.03Å; F472-R476 PolarHBondContact O-N 3.27Å
473	M	98.1	Very high	94.5	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-58.7	-41.5	-178.8	-71.9	-64.8	-73.3	0	0	111.5	L449 I453 W469 Y470 T477 F504	L449-M473 HydrophobicContact CB-CE 4.28Å; L449-M473 HydrophobicContact CB-SD 4.28Å; L449-M473 HydrophobicContact CD2-SD 4.31Å; I453-M473 HydrophobicContact CB-SD 4.21Å; I453-M473 HydrophobicContact CG2-CG 4.2Å; I453-M473 HydrophobicContact CG2-SD 3.68Å; W469-M473 HydrophobicContact CD2-CG 4.25Å; W469-M473 HydrophobicContact CG-CG 4.44Å; W469-M473 HydrophobicContact CZ2-CG 4.23Å; W469-M473 WeakPolarHBondContact O-CB 3.46Å; W469-M473 WeakPolarHBondContact O-CG 3.37Å; W469-M473 PolarHBondContact O-N 3.31Å; Y470-M473 PolarHBondContact O-N 3.28Å; M473-T477 WeakPolarHBondContact O-CB 3.3Å; M473-T477 VanDerWaalsContact O-CG2 3.22Å; M473-T477 WeakPolarHBondContact O-CG2 3.34Å; M473-T477 PolarHBondContact O-N 3.09Å; M473-T477 PolarHBondContact O-OG1 3.28Å; M473-F504 HydrophobicContact CB-CD2 4.4Å; M473-F504 HydrophobicContact CB-CE1 4.39Å; M473-F504 HydrophobicContact CB-CE2 3.58Å; M473-F504 HydrophobicContact CB-CZ 3.58Å; M473-F504 HydrophobicContact CG-CE2 4.31Å
474	W	96.5	Very high	95.5	Very high	45 Å²	45	22.9 Å²	22.9	17%	0.17	12%	0.117	C	C	.	.	H	α-helix	trans	-61.3	-46.5	178.6	178.6	78.9	0	0	0	112.5	Y470 F472 T477 R478 H505 I524 N528	Y470-W474 HydrophobicContact CE1-CB 4.48Å; Y470-W474 HydrophobicContact CE2-CB 4.43Å; Y470-W474 WeakPolarHBondContact O-CB 3.4Å; Y470-W474 PolarHBondContact O-N 3.07Å; F472-W474 VanDerWaalsContact C-N 3.27Å; F472-W474 PolarHBondContact O-N 3.32Å; W474-T477 PolarHBondContact O-OG1 3.38Å; W474-R478 VanDerWaalsContact CZ2-NH1 3.28Å; W474-R478 VanDerWaalsContact O-CB 3.27Å; W474-R478 WeakPolarHBondContact O-CB 3.31Å; W474-R478 PolarHBondContact O-N 3.1Å; W474-H505 AromaticContact CD1-CE1 3.75Å; W474-I524 HydrophobicContact CH2-CG2 4.43Å; W474-I524 HydrophobicContact CZ2-CG2 3.49Å; W474-I524 VanDerWaalsContact CZ2-CG2 3.49Å; W474-N528 PolarHBondContact NE1-ND2 3.22Å; W474-N528 VanDerWaalsContact NE1-ND2 3.18Å
475	T	97	Very high	96.1	Very high	24 Å²	24	25.2 Å²	25.2	15%	0.147	11%	0.112	C	C	.	.	H	α-helix	trans	-69.1	-44.8	178.4	51.2	0	0	0	0	112.1	D420 Y421 E471 F472 R478 A479	D420-T475 WeakPolarHBondContact OD1-CB 3.42Å; Y421-T475 VanDerWaalsContact CB-O 3.28Å; Y421-T475 WeakPolarHBondContact CB-O 3.26Å; E471-T475 WeakPolarHBondContact O-CG2 3.25Å; E471-T475 PolarHBondContact O-N 3.41Å; E471-T475 VanDerWaalsContact O-N 3.13Å; E471-T475 PolarHBondContact O-OG1 2.97Å; F472-T475 PolarHBondContact O-N 2.84Å; F472-T475 PolarHBondContact O-OG1 2.84Å; T475-R478 PolarHBondContact O-N 3.02Å; T475-A479 PolarHBondContact O-N 3.33Å
476	R	98.1	Very high	96.2	Very high	9 Å²	9	27.1 Å²	27.1	3%	0.034	12%	0.121	C	C	.	.	H	α-helix	trans	-66.3	-42.4	-177.5	-59.5	-46.6	179.6	-108.2	14.7	112.7	E397 V418 K419 D420 L449 F472 R478 A479 I480	E397-R476 IonicContact OE1-CZ 3.86Å; E397-R476 IonicContact OE1-NE 3.94Å; E397-R476 PolarHBondContact OE1-NE 3.3Å; E397-R476 IonicContact OE1-NH2 3.71Å; E397-R476 PolarHBondContact OE1-NH2 2.99Å; E397-R476 VanDerWaalsContact OE1-NH2 3.14Å; E397-R476 IonicContact OE2-NH2 3.65Å; E397-R476 PolarHBondContact OE2-NH2 3.35Å; V418-R476 HydrophobicContact CB-CG 4.04Å; V418-R476 HydrophobicContact CG1-CB 3.97Å; V418-R476 HydrophobicContact CG1-CG 3.93Å; V418-R476 WeakPolarHBondContact O-CD 3.26Å; V418-R476 PolarHBondContact O-NE 3.49Å; K419-R476 WeakPolarHBondContact O-CD 3.36Å; D420-R476 IonicContact OD1-CZ 2.7Å; D420-R476 IonicContact OD1-NH1 3.68Å; D420-R476 PolarHBondContact OD1-NH1 3.44Å; D420-R476 IonicContact OD2-NH1 2.87Å; L449-R476 HydrophobicContact CD1-CB 3.97Å; L449-R476 HydrophobicContact CD2-CB 4.17Å; L449-R476 HydrophobicContact CD2-CG 4.4Å; F472-R476 HydrophobicContact CD1-CG 4.03Å; F472-R476 HydrophobicContact CD2-CG 4.41Å; F472-R476 HydrophobicContact CE1-CG 3.67Å; F472-R476 HydrophobicContact CE2-CG 4.13Å; F472-R476 HydrophobicContact CG-CG 4.39Å; F472-R476 HydrophobicContact CZ-CG 3.76Å; F472-R476 VanDerWaalsContact O-CG 3.3Å; F472-R476 WeakPolarHBondContact O-CG 3.03Å; F472-R476 PolarHBondContact O-N 3.27Å; R476-R478 VanDerWaalsContact C-N 3.3Å; R476-R478 PolarHBondContact O-N 3.16Å; R476-A479 WeakPolarHBondContact O-CB 3.46Å; R476-A479 PolarHBondContact O-N 2.92Å; R476-I480 WeakPolarHBondContact O-CG1 3.29Å; R476-I480 PolarHBondContact O-N 3.19Å
477	T	98.3	Very high	96.3	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-65.7	-33.8	175.7	55.3	0	0	0	0	112.2	L449 M473 W474 I480 R481 I501	L449-T477 HydrophobicContact CD1-CG2 4.4Å; M473-T477 WeakPolarHBondContact O-CB 3.3Å; M473-T477 VanDerWaalsContact O-CG2 3.22Å; M473-T477 WeakPolarHBondContact O-CG2 3.34Å; M473-T477 PolarHBondContact O-N 3.09Å; M473-T477 PolarHBondContact O-OG1 3.28Å; W474-T477 PolarHBondContact O-OG1 3.38Å; T477-I480 WeakPolarHBondContact O-CB 3.5Å; T477-I480 PolarHBondContact O-N 3.21Å; T477-R481 WeakPolarHBondContact O-CG 3.09Å; T477-R481 PolarHBondContact O-N 3.23Å; T477-I501 HydrophobicContact CG2-CD1 4.44Å; T477-I501 HydrophobicContact CG2-CG1 3.89Å; T477-I501 HydrophobicContact CG2-CG2 4.33Å
478	R	97.8	Very high	96.3	Very high	24 Å²	24	30.1 Å²	30.1	9%	0.091	14%	0.141	C	C	.	.	H	α-helix	trans	-70.9	-34.7	174.7	-155.9	175.5	174.8	144.3	9.1	112.5	Y421 W474 T475 R476 R481 K482 N528	Y421-R478 HydrophobicContact CD1-CG 4.43Å; Y421-R478 HydrophobicContact CD2-CB 4.02Å; Y421-R478 HydrophobicContact CD2-CG 3.77Å; Y421-R478 HydrophobicContact CE1-CG 4.49Å; Y421-R478 HydrophobicContact CE2-CG 3.85Å; Y421-R478 HydrophobicContact CG-CB 4.07Å; Y421-R478 HydrophobicContact CG-CG 4.07Å; W474-R478 VanDerWaalsContact CZ2-NH1 3.28Å; W474-R478 VanDerWaalsContact O-CB 3.27Å; W474-R478 WeakPolarHBondContact O-CB 3.31Å; W474-R478 PolarHBondContact O-N 3.1Å; T475-R478 PolarHBondContact O-N 3.02Å; R476-R478 VanDerWaalsContact C-N 3.3Å; R476-R478 PolarHBondContact O-N 3.16Å; R478-R481 PolarHBondContact O-N 2.89Å; R478-K482 PolarHBondContact O-N 3.36Å; R478-N528 PolarHBondContact NH1-ND2 3.19Å; R478-N528 PolarHBondContact NH1-OD1 3.28Å
479	A	98.1	Very high	96.4	Very high	2 Å²	2	29.4 Å²	29.4	2%	0.017	14%	0.135	C	C	.	.	H	α-helix	trans	-64	-42.5	171.3	0	0	0	0	0	111.9	K419 T475 R476 R481 K482 D483	K419-A479 HydrophobicContact CB-CB 4.48Å; K419-A479 HydrophobicContact CG-CB 4.33Å; K419-A479 VanDerWaalsContact O-CB 3.28Å; K419-A479 WeakPolarHBondContact O-CB 3.25Å; T475-A479 PolarHBondContact O-N 3.33Å; R476-A479 WeakPolarHBondContact O-CB 3.46Å; R476-A479 PolarHBondContact O-N 2.92Å; A479-R481 PolarHBondContact O-N 3.19Å; A479-K482 WeakPolarHBondContact O-CB 3.45Å; A479-K482 PolarHBondContact O-N 3.05Å; A479-D483 PolarHBondContact O-N 3.43Å
480	I	98.6	Very high	96.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-56.5	-49.3	172.6	-70.6	170.9	0	0	0	110.6	L442 T445 M446 L449 R476 T477 K482 D483 I484 V497 I501	L442-I480 HydrophobicContact CD2-CB 4.42Å; L442-I480 HydrophobicContact CD2-CG1 4.38Å; L442-I480 HydrophobicContact CD2-CG2 4.13Å; T445-I480 HydrophobicContact CG2-CD1 4.04Å; T445-I480 HydrophobicContact CG2-CG1 4.48Å; M446-I480 HydrophobicContact CB-CD1 4.49Å; M446-I480 HydrophobicContact SD-CD1 4.18Å; L449-I480 HydrophobicContact CD1-CD1 3.83Å; R476-I480 WeakPolarHBondContact O-CG1 3.29Å; R476-I480 PolarHBondContact O-N 3.19Å; T477-I480 WeakPolarHBondContact O-CB 3.5Å; T477-I480 PolarHBondContact O-N 3.21Å; I480-K482 VanDerWaalsContact C-N 3.3Å; I480-K482 PolarHBondContact O-N 3.49Å; I480-D483 PolarHBondContact O-N 3.45Å; I480-I484 HydrophobicContact CG2-CD1 3.92Å; I480-I484 WeakPolarHBondContact O-CG1 3.19Å; I480-I484 PolarHBondContact O-N 3.31Å; I480-V497 HydrophobicContact CG2-CG1 3.53Å; I480-I501 HydrophobicContact CB-CD1 4.41Å; I480-I501 HydrophobicContact CG2-CD1 4.02Å
481	R	97.9	Very high	96	Very high	6 Å²	6	32.9 Å²	32.9	2%	0.023	16%	0.159	C	C	.	.	H	α-helix	trans	-62.6	-34.6	177.5	-71.1	173.5	59.4	-138.5	-9.1	113.1	T477 R478 A479 I484 R485 I501 N528 Q531 C532	T477-R481 WeakPolarHBondContact O-CG 3.09Å; T477-R481 PolarHBondContact O-N 3.23Å; R478-R481 PolarHBondContact O-N 2.89Å; A479-R481 PolarHBondContact O-N 3.19Å; R481-I484 PolarHBondContact O-N 3.4Å; R481-R485 PolarHBondContact O-N 3.21Å; R481-R485 VanDerWaalsContact O-N 3.09Å; R481-I501 HydrophobicContact CG-CD1 3.82Å; R481-N528 PolarHBondContact NH1-O 2.8Å; R481-N528 PolarHBondContact NH1-OD1 2.85Å; R481-Q531 VanDerWaalsContact NH2-OE1 3.16Å; R481-C532 VanDerWaalsContact CD-SG 3.52Å; R481-C532 PolarHBondContact NE-SG 3.03Å
482	K	95.8	Very high	95.9	Very high	28 Å²	28	31.6 Å²	31.6	12%	0.122	16%	0.159	C	C	.	.	H	α-helix	trans	-64.2	-45.9	174.9	-168	-173.7	179.3	-176.1	0	110.6	Y421 Q422 R478 A479 I480 I484 R485 Q486	Y421-K482 HydrophobicContact CD2-CD 4.45Å; Y421-K482 HydrophobicContact CE2-CB 4.48Å; Y421-K482 HydrophobicContact CE2-CD 4.23Å; Q422-K482 PolarHBondContact O-NZ 3.39Å; R478-K482 PolarHBondContact O-N 3.36Å; A479-K482 WeakPolarHBondContact O-CB 3.45Å; A479-K482 PolarHBondContact O-N 3.05Å; I480-K482 VanDerWaalsContact C-N 3.3Å; I480-K482 PolarHBondContact O-N 3.49Å; K482-I484 VanDerWaalsContact C-N 3.33Å; K482-I484 PolarHBondContact O-N 2.8Å; K482-R485 PolarHBondContact O-N 2.95Å; K482-Q486 HydrophobicContact CG-CG 4.33Å; K482-Q486 WeakPolarHBondContact O-CB 3.07Å; K482-Q486 VanDerWaalsContact O-CG 3.32Å; K482-Q486 WeakPolarHBondContact O-CG 3.25Å; K482-Q486 PolarHBondContact O-N 3.26Å
483	D	97.3	Very high	95.7	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-61.6	-40.8	177.3	-67.9	-14.6	0	0	0	111.7	K419 R437 L442 A479 I480 Q486 Q487	K419-D483 IonicContact NZ-OD1 3.1Å; K419-D483 PolarHBondContact NZ-OD1 3.05Å; K419-D483 IonicContact NZ-OD2 3.04Å; R437-D483 IonicContact CZ-OD2 2.89Å; R437-D483 IonicContact NE-OD2 3.89Å; R437-D483 PolarHBondContact NE-OD2 3.09Å; R437-D483 IonicContact NH2-OD2 2.76Å; R437-D483 PolarHBondContact NH2-OD2 3.45Å; L442-D483 HydrophobicContact CD1-CB 4.45Å; L442-D483 HydrophobicContact CD2-CB 3.83Å; A479-D483 PolarHBondContact O-N 3.43Å; I480-D483 PolarHBondContact O-N 3.45Å; D483-Q486 PolarHBondContact O-N 3.43Å; D483-Q487 WeakPolarHBondContact O-CB 3.42Å; D483-Q487 VanDerWaalsContact O-CG 3.32Å; D483-Q487 WeakPolarHBondContact O-CG 3.37Å; D483-Q487 PolarHBondContact O-N 3.49Å; D483-Q487 PolarHBondContact O-NE2 3.29Å
484	I	97	Very high	95.7	Very high	3 Å²	3	34.9 Å²	34.9	2%	0.015	18%	0.176	C	C	.	.	H	α-helix	trans	-59.2	-49.2	175.6	-69.5	163.5	0	0	0	110.8	L442 I480 R481 K482 Q487 N488 L489 V494 V497 I498 M539	L442-I484 HydrophobicContact CD1-CG1 3.79Å; I480-I484 HydrophobicContact CG2-CD1 3.92Å; I480-I484 WeakPolarHBondContact O-CG1 3.19Å; I480-I484 PolarHBondContact O-N 3.31Å; R481-I484 PolarHBondContact O-N 3.4Å; K482-I484 VanDerWaalsContact C-N 3.33Å; K482-I484 PolarHBondContact O-N 2.8Å; I484-Q487 PolarHBondContact O-N 3.28Å; I484-N488 PolarHBondContact O-N 3.45Å; I484-N488 VanDerWaalsContact O-N 3.1Å; I484-L489 HydrophobicContact CG2-CB 4.41Å; I484-L489 PolarHBondContact O-N 3.44Å; I484-L489 VanDerWaalsContact O-N 3.15Å; I484-V494 HydrophobicContact CB-CG1 4.41Å; I484-V494 HydrophobicContact CD1-CG1 3.83Å; I484-V494 HydrophobicContact CG1-CG1 3.92Å; I484-V494 HydrophobicContact CG2-CG1 3.6Å; I484-V497 HydrophobicContact CD1-CG1 4.35Å; I484-I498 HydrophobicContact CD1-CD1 4.27Å; I484-I498 HydrophobicContact CD1-CG1 3.94Å; I484-I498 HydrophobicContact CG2-CD1 4.4Å; I484-M539 HydrophobicContact CG2-CE 3.83Å
485	R	93.8	Very high	95.7	Very high	135 Å²	135	32.9 Å²	32.9	51%	0.509	17%	0.169	S	C	.	.	H	α-helix	trans	-67.2	-41.5	179.9	-73.3	-150.6	-62.3	-91.5	3.5	113	R481 K482 Q487 N488	R481-R485 PolarHBondContact O-N 3.21Å; R481-R485 VanDerWaalsContact O-N 3.09Å; K482-R485 PolarHBondContact O-N 2.95Å; R485-Q487 PolarHBondContact O-N 3.4Å; R485-N488 PolarHBondContact O-N 3.03Å
486	Q	92.9	Very high	95.7	Very high	57 Å²	57	32.1 Å²	32.1	27%	0.266	17%	0.166	S	C	.	.	H	α-helix	trans	-66.4	-25.6	-178.4	-74.1	-178.6	-54.8	0	0	113.1	L436 K482 D483	L436-Q486 HydrophobicContact CD1-CB 4.3Å; L436-Q486 HydrophobicContact CD2-CB 4.25Å; K482-Q486 HydrophobicContact CG-CG 4.33Å; K482-Q486 WeakPolarHBondContact O-CB 3.07Å; K482-Q486 VanDerWaalsContact O-CG 3.32Å; K482-Q486 WeakPolarHBondContact O-CG 3.25Å; K482-Q486 PolarHBondContact O-N 3.26Å; D483-Q486 PolarHBondContact O-N 3.43Å
487	Q	94.5	Very high	95.7	Very high	7 Å²	7	31.8 Å²	31.8	3%	0.033	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-0.6	177.9	-61.6	176.3	84.7	0	0	113	I371 G373 L436 R437 D483 I484 R485 L489	I371-Q487 WeakPolarHBondContact O-CB 3.45Å; I371-Q487 VanDerWaalsContact O-CG 3.25Å; I371-Q487 WeakPolarHBondContact O-CG 3.34Å; G373-Q487 VanDerWaalsContact CA-OE1 3.24Å; L436-Q487 HydrophobicContact CB-CG 4.16Å; L436-Q487 HydrophobicContact CD1-CG 3.76Å; R437-Q487 PolarHBondContact O-NE2 3.11Å; D483-Q487 WeakPolarHBondContact O-CB 3.42Å; D483-Q487 VanDerWaalsContact O-CG 3.32Å; D483-Q487 WeakPolarHBondContact O-CG 3.37Å; D483-Q487 PolarHBondContact O-N 3.49Å; D483-Q487 PolarHBondContact O-NE2 3.29Å; I484-Q487 PolarHBondContact O-N 3.28Å; R485-Q487 PolarHBondContact O-N 3.4Å; Q487-L489 VanDerWaalsContact C-N 3.31Å; Q487-L489 HydrophobicContact CB-CD1 4.23Å; Q487-L489 HydrophobicContact CB-CD2 3.78Å; Q487-L489 HydrophobicContact CB-CG 3.71Å; Q487-L489 PolarHBondContact O-N 3.4Å
488	N	93.4	Very high	95.8	Very high	136 Å²	136	31.8 Å²	31.8	73%	0.727	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.7	47.1	-175.2	-162.7	36.9	0	0	0	113.6	P370 I484 R485	P370-N488 HydrophobicContact CB-CB 4.45Å; I484-N488 PolarHBondContact O-N 3.45Å; I484-N488 VanDerWaalsContact O-N 3.1Å; R485-N488 PolarHBondContact O-N 3.03Å
489	L	94.1	Very high	95.8	Very high	33 Å²	33	31 Å²	31	17%	0.173	16%	0.162	C	C	.	.			trans	-80.1	127.3	-176.2	-53.3	174.7	0	0	0	111.2	L442 I484 Q487 V494 M539	L442-L489 HydrophobicContact CD1-CD1 3.68Å; I484-L489 HydrophobicContact CG2-CB 4.41Å; I484-L489 PolarHBondContact O-N 3.44Å; I484-L489 VanDerWaalsContact O-N 3.15Å; Q487-L489 VanDerWaalsContact C-N 3.31Å; Q487-L489 HydrophobicContact CB-CD1 4.23Å; Q487-L489 HydrophobicContact CB-CD2 3.78Å; Q487-L489 HydrophobicContact CB-CG 3.71Å; Q487-L489 PolarHBondContact O-N 3.4Å; L489-V494 HydrophobicContact CB-CG1 4.41Å; L489-V494 HydrophobicContact CB-CG2 3.89Å; L489-V494 HydrophobicContact CD1-CG2 4.15Å; L489-M539 WeakPolarHBondContact O-CE 3.31Å
490	C	92.3	Very high	95.8	Very high	52 Å²	52	33.7 Å²	33.7	35%	0.351	17%	0.172	S	C	.	.			trans	-133.7	103.3	171.2	-171.6	0	0	0	0	109.3
491	C	91.9	Very high	95.8	Very high	33 Å²	33	33.7 Å²	33.7	22%	0.223	17%	0.172	C	C	.	.	S	Bend	trans	-159.1	162.9	174.6	67.4	0	0	0	0	110.4	I493 V494 I495	C491-I493 PolarHBondContact O-N 2.98Å; C491-I493 VanDerWaalsContact O-N 3.16Å; C491-V494 PolarHBondContact O-N 3.02Å; C491-V494 VanDerWaalsContact SG-CG2 3.58Å; C491-I495 PolarHBondContact O-N 2.93Å
492	P	92.8	Very high	95.9	Very high	64 Å²	64	33.4 Å²	33.4	42%	0.416	17%	0.171	S	C	.	.	H	α-helix	trans	-58.1	-33.3	-176	-28.5	38.3	0	0	0	114.2	I495 G496 I552	P492-I495 PolarHBondContact O-N 3Å; P492-G496 PolarHBondContact O-N 2.82Å; P492-I552 HydrophobicContact CB-CG2 4.37Å; P492-I552 HydrophobicContact CG-CG2 3.48Å; P492-I552 VanDerWaalsContact CG-CG2 3.48Å
493	I	94.7	Very high	96	Very high	73 Å²	73	32.3 Å²	32.3	37%	0.374	17%	0.166	S	C	.	.	H	α-helix	trans	-63.7	-46.6	176.5	-61.3	174.1	0	0	0	110.5	T439 Q443 C491 G496 V497	T439-I493 HydrophobicContact CG2-CB 3.96Å; T439-I493 HydrophobicContact CG2-CD1 4.43Å; T439-I493 HydrophobicContact CG2-CG2 3.8Å; Q443-I493 HydrophobicContact CB-CG2 3.75Å; Q443-I493 HydrophobicContact CG-CG2 3.88Å; C491-I493 PolarHBondContact O-N 2.98Å; C491-I493 VanDerWaalsContact O-N 3.16Å; I493-G496 PolarHBondContact O-N 3.05Å; I493-V497 WeakPolarHBondContact O-CG2 3.15Å; I493-V497 PolarHBondContact O-N 3.11Å
494	V	97.3	Very high	96	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.012	17%	0.166	C	C	.	.	H	α-helix	trans	-66.6	-41.2	179.5	168.5	0	0	0	0	111.2	T439 I484 L489 C491 G496 V497 I498 M539	T439-V494 HydrophobicContact CG2-CG2 3.88Å; I484-V494 HydrophobicContact CB-CG1 4.41Å; I484-V494 HydrophobicContact CD1-CG1 3.83Å; I484-V494 HydrophobicContact CG1-CG1 3.92Å; I484-V494 HydrophobicContact CG2-CG1 3.6Å; L489-V494 HydrophobicContact CB-CG1 4.41Å; L489-V494 HydrophobicContact CB-CG2 3.89Å; L489-V494 HydrophobicContact CD1-CG2 4.15Å; C491-V494 PolarHBondContact O-N 3.02Å; C491-V494 VanDerWaalsContact SG-CG2 3.58Å; V494-G496 VanDerWaalsContact C-N 3.34Å; V494-G496 PolarHBondContact O-N 2.97Å; V494-V497 WeakPolarHBondContact O-CB 3.41Å; V494-V497 PolarHBondContact O-N 3.15Å; V494-V497 VanDerWaalsContact O-N 3.08Å; V494-I498 HydrophobicContact CG1-CD1 4.2Å; V494-I498 PolarHBondContact O-N 3.21Å; V494-M539 HydrophobicContact CG1-CE 3.93Å; V494-M539 HydrophobicContact CG1-SD 4.24Å
495	I	97.3	Very high	96.1	Very high	2 Å²	2	32.2 Å²	32.2	1%	0.01	17%	0.165	C	C	.	.	H	α-helix	trans	-54.8	-53.1	172.8	-71.8	174.2	0	0	0	109.4	C491 P492 V497 I498 E499 L536 M539 Y540 L543	C491-I495 PolarHBondContact O-N 2.93Å; P492-I495 PolarHBondContact O-N 3Å; I495-V497 PolarHBondContact O-N 3.43Å; I495-V497 VanDerWaalsContact O-N 3.15Å; I495-I498 PolarHBondContact O-N 3.18Å; I495-E499 HydrophobicContact CG2-CG 4.2Å; I495-E499 WeakPolarHBondContact CG2-OE1 3.47Å; I495-E499 VanDerWaalsContact O-CG 3.28Å; I495-E499 WeakPolarHBondContact O-CG 3.44Å; I495-E499 PolarHBondContact O-N 2.81Å; I495-L536 HydrophobicContact CG2-CD2 3.93Å; I495-M539 HydrophobicContact CD1-CB 4Å; I495-M539 HydrophobicContact CG1-CB 3.92Å; I495-M539 HydrophobicContact CG1-CG 4.49Å; I495-M539 HydrophobicContact CG1-SD 3.88Å; I495-Y540 HydrophobicContact CD1-CD1 4.3Å; I495-Y540 HydrophobicContact CD1-CE1 4.42Å; I495-Y540 HydrophobicContact CG2-CD1 4.43Å; I495-Y540 HydrophobicContact CG2-CE1 3.58Å; I495-L543 HydrophobicContact CD1-CD1 3.29Å; I495-L543 HydrophobicContact CD1-CG 4.44Å
496	G	96.7	Very high	96.4	Very high	8 Å²	8	25.9 Å²	25.9	8%	0.082	14%	0.141	C	C	.	.	H	α-helix	trans	-56.9	-32.4	177	0	0	0	0	0	113.7	P492 I493 V494 R500	P492-G496 PolarHBondContact O-N 2.82Å; I493-G496 PolarHBondContact O-N 3.05Å; V494-G496 VanDerWaalsContact C-N 3.34Å; V494-G496 PolarHBondContact O-N 2.97Å; G496-R500 WeakPolarHBondContact O-CD 3.26Å; G496-R500 VanDerWaalsContact O-CG 3.29Å; G496-R500 WeakPolarHBondContact O-CG 3.47Å; G496-R500 PolarHBondContact O-N 3.48Å; G496-R500 PolarHBondContact O-NH1 3.26Å
497	V	98.4	Very high	96.6	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.012	13%	0.129	C	C	.	.	H	α-helix	trans	-67.4	-46.5	173.8	169.7	0	0	0	0	111	M446 I480 I484 I493 V494 I495 E499 R500 I501	M446-V497 HydrophobicContact CB-CG1 4.09Å; M446-V497 HydrophobicContact CB-CG2 4.14Å; M446-V497 HydrophobicContact CG-CG1 4.07Å; M446-V497 HydrophobicContact CG-CG2 4.46Å; M446-V497 HydrophobicContact SD-CG1 4.32Å; I480-V497 HydrophobicContact CG2-CG1 3.53Å; I484-V497 HydrophobicContact CD1-CG1 4.35Å; I493-V497 WeakPolarHBondContact O-CG2 3.15Å; I493-V497 PolarHBondContact O-N 3.11Å; V494-V497 WeakPolarHBondContact O-CB 3.41Å; V494-V497 PolarHBondContact O-N 3.15Å; V494-V497 VanDerWaalsContact O-N 3.08Å; I495-V497 PolarHBondContact O-N 3.43Å; I495-V497 VanDerWaalsContact O-N 3.15Å; V497-E499 VanDerWaalsContact C-N 3.33Å; V497-E499 PolarHBondContact O-N 3.43Å; V497-R500 PolarHBondContact O-N 2.96Å; V497-I501 HydrophobicContact CG1-CD1 4.13Å; V497-I501 WeakPolarHBondContact O-CG1 3.18Å; V497-I501 PolarHBondContact O-N 3.4Å
498	I	98.5	Very high	96.8	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-66.7	-37.2	179.8	-60.6	170.9	0	0	0	111.2	I484 V494 I495 R500 I501 A502 C532 T535 L536 M539	I484-I498 HydrophobicContact CD1-CD1 4.27Å; I484-I498 HydrophobicContact CD1-CG1 3.94Å; I484-I498 HydrophobicContact CG2-CD1 4.4Å; V494-I498 HydrophobicContact CG1-CD1 4.2Å; V494-I498 PolarHBondContact O-N 3.21Å; I495-I498 PolarHBondContact O-N 3.18Å; I498-R500 VanDerWaalsContact C-N 3.33Å; I498-R500 PolarHBondContact O-N 3.24Å; I498-I501 PolarHBondContact O-N 2.84Å; I498-I501 VanDerWaalsContact O-N 3.15Å; I498-A502 PolarHBondContact O-N 3.49Å; I498-C532 HydrophobicContact CG2-CB 3.97Å; I498-T535 HydrophobicContact CD1-CG2 3.61Å; I498-L536 HydrophobicContact CB-CD2 3.92Å; I498-L536 HydrophobicContact CB-CG 4.26Å; I498-L536 HydrophobicContact CG2-CD1 4.05Å; I498-L536 HydrophobicContact CG2-CD2 3.91Å; I498-L536 HydrophobicContact CG2-CG 3.66Å; I498-M539 HydrophobicContact CD1-CE 3.74Å; I498-M539 HydrophobicContact CD1-SD 3.63Å
499	E	98.5	Very high	96.9	Very high	7 Å²	7	17.5 Å²	17.5	3%	0.033	10%	0.102	C	C	.	.	H	α-helix	trans	-54.8	-47.5	173.8	-72.6	-178.6	174.6	0	0	111.7	I495 V497 I501 A502 R503 L536 Y540 N555 F559	I495-E499 HydrophobicContact CG2-CG 4.2Å; I495-E499 WeakPolarHBondContact CG2-OE1 3.47Å; I495-E499 VanDerWaalsContact O-CG 3.28Å; I495-E499 WeakPolarHBondContact O-CG 3.44Å; I495-E499 PolarHBondContact O-N 2.81Å; V497-E499 VanDerWaalsContact C-N 3.33Å; V497-E499 PolarHBondContact O-N 3.43Å; E499-I501 VanDerWaalsContact C-N 3.33Å; E499-I501 PolarHBondContact O-N 2.86Å; E499-A502 PolarHBondContact O-N 3.33Å; E499-R503 WeakPolarHBondContact O-CG 3.35Å; E499-R503 PolarHBondContact O-N 3.27Å; E499-L536 HydrophobicContact CG-CD1 4.19Å; E499-L536 HydrophobicContact CG-CD2 3.89Å; E499-Y540 PolarHBondContact OE1-OH 3.14Å; E499-N555 WeakPolarHBondContact OE1-CB 3.45Å; E499-N555 WeakPolarHBondContact OE2-CB 3.34Å; E499-N555 PolarHBondContact OE2-ND2 2.85Å; E499-F559 VanDerWaalsContact CA-CZ 3.41Å; E499-F559 HydrophobicContact CB-CD2 4.33Å; E499-F559 HydrophobicContact CB-CE1 4.12Å; E499-F559 HydrophobicContact CB-CE2 3.43Å; E499-F559 VanDerWaalsContact CB-CE2 3.43Å; E499-F559 HydrophobicContact CB-CZ 3.3Å; E499-F559 VanDerWaalsContact CD-CE2 3.48Å; E499-F559 HydrophobicContact CG-CD2 3.65Å; E499-F559 HydrophobicContact CG-CE1 4.24Å; E499-F559 HydrophobicContact CG-CE2 3.22Å; E499-F559 HydrophobicContact CG-CG 4.34Å; E499-F559 HydrophobicContact CG-CZ 3.57Å; E499-F559 WeakPolarHBondContact O-CZ 3.47Å
500	R	98.5	Very high	97	Very high	59 Å²	59	16.1 Å²	16.1	22%	0.223	10%	0.096	C	C	.	.	H	α-helix	trans	-60.6	-41	176	-66.9	165.6	172.7	90.5	-0	112.5	M446 L450 G496 V497 I498 R503 F504 F722 N723	M446-R500 HydrophobicContact CE-CB 4Å; M446-R500 HydrophobicContact CG-CB 4.26Å; M446-R500 HydrophobicContact SD-CB 4.42Å; L450-R500 HydrophobicContact CD1-CB 4.41Å; L450-R500 HydrophobicContact CD1-CG 4.17Å; G496-R500 WeakPolarHBondContact O-CD 3.26Å; G496-R500 VanDerWaalsContact O-CG 3.29Å; G496-R500 WeakPolarHBondContact O-CG 3.47Å; G496-R500 PolarHBondContact O-N 3.48Å; G496-R500 PolarHBondContact O-NH1 3.26Å; V497-R500 PolarHBondContact O-N 2.96Å; I498-R500 VanDerWaalsContact C-N 3.33Å; I498-R500 PolarHBondContact O-N 3.24Å; R500-R503 PolarHBondContact O-N 3.49Å; R500-F504 PolarHBondContact O-N 3.26Å; R500-F504 VanDerWaalsContact O-N 3.09Å; R500-F722 WeakPolarHBondContact CA-O 3.36Å; R500-F722 WeakPolarHBondContact CG-O 3.25Å; R500-N723 VanDerWaalsContact CZ-OD1 3.26Å; R500-N723 PolarHBondContact NE-OD1 3.41Å; R500-N723 PolarHBondContact NH2-OD1 3.32Å
501	I	98.8	Very high	97.1	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-66.1	-40.7	177.8	-62.1	170.4	0	0	0	111	M446 T477 I480 R481 V497 I498 E499 F504 H505	M446-I501 HydrophobicContact CE-CG1 4.47Å; M446-I501 HydrophobicContact SD-CD1 4.32Å; M446-I501 HydrophobicContact SD-CG1 3.8Å; T477-I501 HydrophobicContact CG2-CD1 4.44Å; T477-I501 HydrophobicContact CG2-CG1 3.89Å; T477-I501 HydrophobicContact CG2-CG2 4.33Å; I480-I501 HydrophobicContact CB-CD1 4.41Å; I480-I501 HydrophobicContact CG2-CD1 4.02Å; R481-I501 HydrophobicContact CG-CD1 3.82Å; V497-I501 HydrophobicContact CG1-CD1 4.13Å; V497-I501 WeakPolarHBondContact O-CG1 3.18Å; V497-I501 PolarHBondContact O-N 3.4Å; I498-I501 PolarHBondContact O-N 2.84Å; I498-I501 VanDerWaalsContact O-N 3.15Å; E499-I501 VanDerWaalsContact C-N 3.33Å; E499-I501 PolarHBondContact O-N 2.86Å; I501-F504 WeakPolarHBondContact O-CB 3.34Å; I501-F504 PolarHBondContact O-N 3.5Å; I501-H505 PolarHBondContact O-CD2 2.82Å; I501-H505 PolarHBondContact O-N 2.65Å; I501-H505 VanDerWaalsContact O-N 3.11Å
502	A	98.7	Very high	97.2	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-63.6	-43.7	175.9	0	0	0	0	0	111.6	I498 E499 F504 H505 I506 L529 C532 L533 F559	I498-A502 PolarHBondContact O-N 3.49Å; E499-A502 PolarHBondContact O-N 3.33Å; A502-F504 VanDerWaalsContact C-N 3.32Å; A502-F504 PolarHBondContact O-N 3.36Å; A502-H505 PolarHBondContact O-N 2.77Å; A502-H505 VanDerWaalsContact O-N 3.17Å; A502-I506 VanDerWaalsContact O-CG1 3.31Å; A502-I506 WeakPolarHBondContact O-CG1 3.49Å; A502-I506 PolarHBondContact O-N 3.39Å; A502-L529 HydrophobicContact CB-CD1 3.97Å; A502-C532 HydrophobicContact CB-CB 4.04Å; A502-L533 HydrophobicContact CB-CD2 4.48Å; A502-F559 HydrophobicContact CB-CD1 4.33Å; A502-F559 HydrophobicContact CB-CE1 3.72Å
503	R	98.6	Very high	97.2	Very high	4 Å²	4	11.4 Å²	11.4	2%	0.015	6%	0.06	C	C	.	.	H	α-helix	trans	-59.5	-40.8	174.8	-65	-169.3	-168.2	100.3	-2.2	112.4	E499 R500 I506 F507 N555 E558 F559 L618 L721 F722	E499-R503 WeakPolarHBondContact O-CG 3.35Å; E499-R503 PolarHBondContact O-N 3.27Å; R500-R503 PolarHBondContact O-N 3.49Å; R503-I506 PolarHBondContact O-N 3.43Å; R503-F507 PolarHBondContact O-N 3.49Å; R503-N555 PolarHBondContact NH2-ND2 3Å; R503-E558 IonicContact CZ-OE1 3.41Å; R503-E558 IonicContact CZ-OE2 2.79Å; R503-E558 IonicContact NE-OE1 3.04Å; R503-E558 PolarHBondContact NE-OE1 3.22Å; R503-E558 IonicContact NE-OE2 2.72Å; R503-E558 IonicContact NH2-OE1 3.64Å; R503-E558 IonicContact NH2-OE2 3.83Å; R503-E558 PolarHBondContact NH2-OE2 2.71Å; R503-F559 HydrophobicContact CG-CE1 4.45Å; R503-F559 HydrophobicContact CG-CZ 4.05Å; R503-L618 HydrophobicContact CB-CD1 3.83Å; R503-L618 HydrophobicContact CG-CD1 3.62Å; R503-L721 WeakPolarHBondContact CD-O 3.29Å; R503-F722 HydrophobicContact CB-CD1 4.43Å; R503-F722 PolarHBondContact NH1-O 2.81Å
504	F	98.6	Very high	97	Very high	1 Å²	1	10.2 Å²	10.2	0%	0.004	6%	0.055	C	C	.	.	H	α-helix	trans	-56.1	-50.3	172.2	159.5	-101.9	0	0	0	112	W469 Y470 M473 R500 I501 A502 I506 F507 C508 F722	W469-F504 AromaticContact CH2-CD2 3.96Å; W469-F504 HydrophobicContact CH2-CD2 3.96Å; W469-F504 AromaticContact CH2-CE2 3.57Å; W469-F504 HydrophobicContact CH2-CE2 3.57Å; W469-F504 HydrophobicContact CZ2-CD2 4.37Å; W469-F504 HydrophobicContact CZ2-CE2 4.1Å; W469-F504 AromaticContact CZ3-CE2 3.93Å; W469-F504 HydrophobicContact CZ3-CE2 3.93Å; Y470-F504 HydrophobicContact CD2-CE2 4.45Å; Y470-F504 AromaticContact CD2-CZ 3.86Å; Y470-F504 HydrophobicContact CD2-CZ 3.86Å; Y470-F504 HydrophobicContact CE2-CE1 4.49Å; Y470-F504 HydrophobicContact CE2-CZ 4Å; M473-F504 HydrophobicContact CB-CD2 4.4Å; M473-F504 HydrophobicContact CB-CE1 4.39Å; M473-F504 HydrophobicContact CB-CE2 3.58Å; M473-F504 HydrophobicContact CB-CZ 3.58Å; M473-F504 HydrophobicContact CG-CE2 4.31Å; R500-F504 PolarHBondContact O-N 3.26Å; R500-F504 VanDerWaalsContact O-N 3.09Å; I501-F504 WeakPolarHBondContact O-CB 3.34Å; I501-F504 PolarHBondContact O-N 3.5Å; A502-F504 VanDerWaalsContact C-N 3.32Å; A502-F504 PolarHBondContact O-N 3.36Å; F504-I506 PolarHBondContact O-N 2.91Å; F504-F507 PolarHBondContact O-N 2.82Å; F504-C508 WeakPolarHBondContact CE2-SG 3.31Å; F504-C508 PolarHBondContact O-N 3.31Å; F504-C508 PolarHBondContact O-SG 3.48Å; F504-F722 HydrophobicContact CB-CD1 4.4Å; F504-F722 HydrophobicContact CB-CD2 4.31Å; F504-F722 HydrophobicContact CB-CE2 4.41Å; F504-F722 HydrophobicContact CB-CG 4.31Å; F504-F722 HydrophobicContact CD2-CE2 4.02Å; F504-F722 HydrophobicContact CD2-CZ 4.18Å
505	H	98.5	Very high	96.7	Very high	1 Å²	1	13 Å²	13	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-66.1	-35.3	179.8	-73.6	-65.2	0	0	0	113.4	W474 I501 A502 A509 N525 N528 L529	W474-H505 AromaticContact CD1-CE1 3.75Å; I501-H505 PolarHBondContact O-CD2 2.82Å; I501-H505 PolarHBondContact O-N 2.65Å; I501-H505 VanDerWaalsContact O-N 3.11Å; A502-H505 PolarHBondContact O-N 2.77Å; A502-H505 VanDerWaalsContact O-N 3.17Å; H505-A509 PolarHBondContact O-N 2.79Å; H505-A509 VanDerWaalsContact O-N 3.09Å; H505-N525 PolarHBondContact ND1-OD1 3.47Å; H505-N525 PolarHBondContact O-ND2 2.89Å; H505-N528 VanDerWaalsContact CE1-CB 3.49Å; H505-N528 WeakPolarHBondContact CE1-CB 3.2Å; H505-L529 HydrophobicContact CB-CB 3.85Å; H505-L529 HydrophobicContact CB-CD1 4.16Å; H505-L529 HydrophobicContact CB-CG 4.4Å
506	I	98.6	Very high	96.3	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	9%	0.088	C	C	.	.	H	α-helix	trans	-61.6	-48	175.4	-70.2	166.5	0	0	0	110.4	A502 R503 F504 A509 L529 Y562 L618 C621 L622	A502-I506 VanDerWaalsContact O-CG1 3.31Å; A502-I506 WeakPolarHBondContact O-CG1 3.49Å; A502-I506 PolarHBondContact O-N 3.39Å; R503-I506 PolarHBondContact O-N 3.43Å; F504-I506 PolarHBondContact O-N 2.91Å; I506-A509 WeakPolarHBondContact O-CB 3.44Å; I506-A509 PolarHBondContact O-N 3.46Å; I506-L529 HydrophobicContact CD1-CD1 4.26Å; I506-L529 HydrophobicContact CG1-CD1 3.77Å; I506-L529 HydrophobicContact CG1-CD2 3.62Å; I506-L529 HydrophobicContact CG1-CG 4.37Å; I506-Y562 HydrophobicContact CD1-CD1 4.34Å; I506-Y562 HydrophobicContact CD1-CD2 3.46Å; I506-Y562 VanDerWaalsContact CD1-CD2 3.46Å; I506-Y562 HydrophobicContact CD1-CE2 3.73Å; I506-Y562 HydrophobicContact CD1-CG 3.81Å; I506-L618 HydrophobicContact CB-CD2 4.35Å; I506-L618 HydrophobicContact CG2-CB 3.95Å; I506-L618 HydrophobicContact CG2-CD2 3.93Å; I506-L618 VanDerWaalsContact CG2-O 3.27Å; I506-L618 WeakPolarHBondContact CG2-O 3.3Å; I506-C621 HydrophobicContact CG2-CB 3.75Å; I506-C621 WeakPolarHBondContact O-CB 3.43Å; I506-L622 HydrophobicContact CD1-CD1 4.14Å; I506-L622 HydrophobicContact CD1-CG 4.45Å; I506-L622 HydrophobicContact CG1-CD1 4.45Å; I506-L622 HydrophobicContact CG1-CD2 4Å; I506-L622 HydrophobicContact CG1-CG 4.25Å; I506-L622 HydrophobicContact CG2-CD2 4.24Å; I506-L622 HydrophobicContact CG2-CG 3.87Å
507	F	98	Very high	95.9	Very high	1 Å²	1	20.7 Å²	20.7	0%	0.004	11%	0.114	C	C	.	.	H	α-helix	trans	-61.5	-49	178.2	172.9	-101.5	0	0	0	112	W466 R503 F504 A509 A510 R511 L618 L718 L721 F722	W466-F507 HydrophobicContact CH2-CE1 4.39Å; W466-F507 HydrophobicContact CH2-CZ 4.47Å; W466-F507 HydrophobicContact CZ3-CE1 4.23Å; R503-F507 PolarHBondContact O-N 3.49Å; F504-F507 PolarHBondContact O-N 2.82Å; F507-A509 PolarHBondContact O-N 3.38Å; F507-A510 PolarHBondContact O-N 3.46Å; F507-A510 VanDerWaalsContact O-N 3.14Å; F507-R511 HydrophobicContact CD1-CB 4.16Å; F507-R511 HydrophobicContact CD2-CB 4.42Å; F507-R511 HydrophobicContact CE1-CB 3.71Å; F507-R511 HydrophobicContact CE1-CG 3.67Å; F507-R511 HydrophobicContact CE2-CB 3.99Å; F507-R511 HydrophobicContact CE2-CG 4.26Å; F507-R511 HydrophobicContact CG-CB 4.5Å; F507-R511 HydrophobicContact CZ-CB 3.61Å; F507-R511 HydrophobicContact CZ-CG 3.48Å; F507-R511 VanDerWaalsContact CZ-CG 3.48Å; F507-R511 WeakPolarHBondContact O-CB 3.29Å; F507-R511 PolarHBondContact O-N 2.9Å; F507-L618 HydrophobicContact CB-CD2 4.19Å; F507-L718 HydrophobicContact CD1-CD2 4.23Å; F507-L718 HydrophobicContact CD2-CD2 4.3Å; F507-L718 HydrophobicContact CE1-CD1 3.99Å; F507-L718 HydrophobicContact CE1-CD2 3.59Å; F507-L718 HydrophobicContact CE1-CG 4.45Å; F507-L718 HydrophobicContact CE2-CD2 3.69Å; F507-L718 HydrophobicContact CZ-CD1 4.27Å; F507-L718 HydrophobicContact CZ-CD2 3.28Å; F507-L718 HydrophobicContact CZ-CG 4.43Å; F507-L721 HydrophobicContact CB-CD2 4.5Å; F507-L721 HydrophobicContact CD2-CD2 3.78Å; F507-L721 HydrophobicContact CE2-CD2 4.34Å; F507-L721 HydrophobicContact CG-CD2 4.29Å; F507-F722 HydrophobicContact CB-CE1 3.6Å; F507-F722 HydrophobicContact CB-CZ 4.26Å; F507-F722 AromaticContact CD1-CE1 3.91Å; F507-F722 HydrophobicContact CD1-CE1 3.91Å; F507-F722 AromaticContact CD1-CZ 3.73Å; F507-F722 HydrophobicContact CD1-CZ 3.73Å; F507-F722 HydrophobicContact CE1-CZ 4.38Å; F507-F722 AromaticContact CG-CE1 3.83Å; F507-F722 HydrophobicContact CG-CE1 3.83Å; F507-F722 HydrophobicContact CG-CZ 4.14Å
508	C	97.8	Very high	95.4	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-58.1	-35.1	179.4	-69.9	0	0	0	0	112.5	Y470 F504 A510 R511 L512 F520	Y470-C508 HydrophobicContact CD2-CB 4.26Å; Y470-C508 HydrophobicContact CE2-CB 3.99Å; F504-C508 WeakPolarHBondContact CE2-SG 3.31Å; F504-C508 PolarHBondContact O-N 3.31Å; F504-C508 PolarHBondContact O-SG 3.48Å; C508-A510 PolarHBondContact O-N 3.25Å; C508-R511 PolarHBondContact O-N 3.41Å; C508-L512 HydrophobicContact CB-CD1 4.19Å; C508-L512 WeakPolarHBondContact O-CB 3.34Å; C508-L512 PolarHBondContact O-N 2.93Å; C508-F520 HydrophobicContact CB-CE2 3.98Å; C508-F520 HydrophobicContact CB-CZ 4.48Å; C508-F520 WeakPolarHBondContact O-CZ 3.39Å
509	A	96.5	Very high	94.9	Very high	24 Å²	24	26.7 Å²	26.7	20%	0.198	15%	0.147	C	C	.	.	H	α-helix	trans	-58.8	-33	178.8	0	0	0	0	0	113.7	H505 I506 F507	H505-A509 PolarHBondContact O-N 2.79Å; H505-A509 VanDerWaalsContact O-N 3.09Å; I506-A509 WeakPolarHBondContact O-CB 3.44Å; I506-A509 PolarHBondContact O-N 3.46Å; F507-A509 PolarHBondContact O-N 3.38Å
510	A	96	Very high	94.7	Very high	4 Å²	4	26.4 Å²	26.4	3%	0.033	15%	0.145	C	C	.	.	H	α-helix	trans	-96.2	-41.5	176.9	0	0	0	0	0	112.1	F507 C508 L512 V513 C621 V709	F507-A510 PolarHBondContact O-N 3.46Å; F507-A510 VanDerWaalsContact O-N 3.14Å; C508-A510 PolarHBondContact O-N 3.25Å; A510-L512 PolarHBondContact O-N 3.47Å; A510-V513 WeakPolarHBondContact O-CG1 3.47Å; A510-C621 HydrophobicContact CB-CB 3.67Å; A510-V709 HydrophobicContact CB-CG1 4.26Å
511	R	94.6	Very high	94.5	Very high	23 Å²	23	25.9 Å²	25.9	9%	0.087	15%	0.147	C	C	.	.	H	α-helix	trans	-69.4	-33.9	-174.6	178.8	60.1	-175.3	81.2	-4	113.5	W466 F507 C508 R704 E710	W466-R511 HydrophobicContact CH2-CG 4.01Å; W466-R511 VanDerWaalsContact CZ2-NH2 3.3Å; W466-R511 HydrophobicContact CZ3-CG 3.96Å; F507-R511 HydrophobicContact CD1-CB 4.16Å; F507-R511 HydrophobicContact CD2-CB 4.42Å; F507-R511 HydrophobicContact CE1-CB 3.71Å; F507-R511 HydrophobicContact CE1-CG 3.67Å; F507-R511 HydrophobicContact CE2-CB 3.99Å; F507-R511 HydrophobicContact CE2-CG 4.26Å; F507-R511 HydrophobicContact CG-CB 4.5Å; F507-R511 HydrophobicContact CZ-CB 3.61Å; F507-R511 HydrophobicContact CZ-CG 3.48Å; F507-R511 VanDerWaalsContact CZ-CG 3.48Å; F507-R511 WeakPolarHBondContact O-CB 3.29Å; F507-R511 PolarHBondContact O-N 2.9Å; C508-R511 PolarHBondContact O-N 3.41Å; R511-R704 WeakPolarHBondContact O-CD 3.29Å; R511-R704 PolarHBondContact O-NE 3.32Å; R511-E710 WeakPolarHBondContact CD-OE1 3.47Å; R511-E710 VanDerWaalsContact CD-OE2 3.28Å; R511-E710 WeakPolarHBondContact CD-OE2 3.2Å; R511-E710 IonicContact NE-OE1 3.39Å; R511-E710 IonicContact NE-OE2 3.37Å
512	L	94.7	Very high	94.2	Very high	4 Å²	4	28.9 Å²	28.9	2%	0.021	17%	0.166	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.9	11.2	-174.5	-56.7	178.1	0	0	0	112.8	W466 Y470 C508 A510 D514 Q515 F520	W466-L512 HydrophobicContact CD2-CD2 4.33Å; W466-L512 HydrophobicContact CE3-CD2 3.76Å; W466-L512 HydrophobicContact CZ3-CD2 4.39Å; Y470-L512 HydrophobicContact CD2-CD1 3.68Å; Y470-L512 HydrophobicContact CE2-CD1 4.39Å; Y470-L512 HydrophobicContact CG-CD1 3.81Å; C508-L512 HydrophobicContact CB-CD1 4.19Å; C508-L512 WeakPolarHBondContact O-CB 3.34Å; C508-L512 PolarHBondContact O-N 2.93Å; A510-L512 PolarHBondContact O-N 3.47Å; L512-D514 PolarHBondContact O-N 2.79Å; L512-Q515 HydrophobicContact CB-CG 3.97Å; L512-Q515 HydrophobicContact CD2-CG 3.96Å; L512-Q515 VanDerWaalsContact O-CB 3.31Å; L512-Q515 WeakPolarHBondContact O-CB 3.49Å; L512-Q515 WeakPolarHBondContact O-CG 3.18Å; L512-Q515 PolarHBondContact O-N 3.45Å; L512-Q515 VanDerWaalsContact O-N 3.1Å; L512-F520 HydrophobicContact CB-CB 3.98Å; L512-F520 HydrophobicContact CB-CD1 3.81Å; L512-F520 HydrophobicContact CB-CD2 3.76Å; L512-F520 HydrophobicContact CB-CE1 4.2Å; L512-F520 HydrophobicContact CB-CE2 4.18Å; L512-F520 HydrophobicContact CB-CG 3.57Å; L512-F520 HydrophobicContact CB-CZ 4.38Å; L512-F520 HydrophobicContact CD1-CD2 3.75Å; L512-F520 HydrophobicContact CD1-CE2 4.25Å; L512-F520 HydrophobicContact CD1-CG 4.28Å; L512-F520 HydrophobicContact CG-CD2 4.41Å; L512-F520 WeakPolarHBondContact O-CD1 3.27Å
513	V	92.9	Very high	94	Very high	23 Å²	23	38.8 Å²	38.8	14%	0.139	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-30.3	-174.9	73.1	0	0	0	0	113.5	A510 E702 R704	A510-V513 WeakPolarHBondContact O-CG1 3.47Å; V513-E702 HydrophobicContact CG2-CB 3.69Å; V513-R704 HydrophobicContact CG1-CG 4.05Å
514	D	89.3	Confident	93.8	Very high	48 Å²	48	41.3 Å²	41.3	26%	0.257	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91	-4	-177.9	67.4	-11.1	0	0	0	113.9	L512 R704	L512-D514 PolarHBondContact O-N 2.79Å; D514-R704 HydrophobicContact CB-CG 4.17Å; D514-R704 VanDerWaalsContact CG-CG 3.45Å; D514-R704 VanDerWaalsContact OD1-CD 3.23Å; D514-R704 WeakPolarHBondContact OD1-CD 3.43Å; D514-R704 WeakPolarHBondContact OD2-CD 3.22Å; D514-R704 WeakPolarHBondContact OD2-CG 3.5Å
515	Q	91	Very high	93.7	Very high	60 Å²	60	41.3 Å²	41.3	28%	0.28	22%	0.217	S	C	.	.	S	Bend	trans	-73.5	151.2	179.1	-59.9	-57.1	-62.4	0	0	110.8	L512 T519 F520	L512-Q515 HydrophobicContact CB-CG 3.97Å; L512-Q515 HydrophobicContact CD2-CG 3.96Å; L512-Q515 VanDerWaalsContact O-CB 3.31Å; L512-Q515 WeakPolarHBondContact O-CB 3.49Å; L512-Q515 WeakPolarHBondContact O-CG 3.18Å; L512-Q515 PolarHBondContact O-N 3.45Å; L512-Q515 VanDerWaalsContact O-N 3.1Å; Q515-T519 HydrophobicContact CB-CG2 4.2Å; Q515-F520 HydrophobicContact CB-CB 4Å
516	P	88.9	Confident	93.6	Very high	68 Å²	68	43 Å²	43	44%	0.442	23%	0.229	S	C	.	.			trans	-64.6	150.1	177.1	27.2	-33.7	0	0	0	111.1	D518 T519 F520	P516-D518 VanDerWaalsContact CB-OD1 3.29Å; P516-D518 WeakPolarHBondContact CB-OD1 3.38Å; P516-D518 VanDerWaalsContact CG-OD1 3.28Å; P516-D518 WeakPolarHBondContact CG-OD1 3.45Å; P516-D518 PolarHBondContact O-N 2.97Å; P516-D518 VanDerWaalsContact O-N 3.11Å; P516-T519 WeakPolarHBondContact O-CA 3.33Å; P516-T519 VanDerWaalsContact O-CB 3.31Å; P516-T519 WeakPolarHBondContact O-CB 3.32Å; P516-T519 PolarHBondContact O-N 2.88Å; P516-F520 PolarHBondContact O-N 3.41Å
517	V	88.8	Confident	93.5	Very high	103 Å²	103	47.3 Å²	47.3	62%	0.624	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-27.7	-173.9	179.9	0	0	0	0	113.1	T519 F520 D521	V517-T519 PolarHBondContact O-N 3.32Å; V517-F520 WeakPolarHBondContact CA-O 3.44Å; V517-F520 CarbonylContact O-C 3.36Å; V517-D521 HydrophobicContact CG1-CB 4.33Å
518	D	88	Confident	93.4	Very high	110 Å²	110	47.3 Å²	47.3	59%	0.588	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-13.6	175.3	81	-44.6	0	0	0	113.4	K467 P516	K467-D518 WeakPolarHBondContact CE-O 3.41Å; K467-D518 PolarHBondContact NZ-O 3.35Å; K467-D518 IonicContact NZ-OD2 3.05Å; K467-D518 PolarHBondContact NZ-OD2 2.87Å; P516-D518 VanDerWaalsContact CB-OD1 3.29Å; P516-D518 WeakPolarHBondContact CB-OD1 3.38Å; P516-D518 VanDerWaalsContact CG-OD1 3.28Å; P516-D518 WeakPolarHBondContact CG-OD1 3.45Å; P516-D518 PolarHBondContact O-N 2.97Å; P516-D518 VanDerWaalsContact O-N 3.11Å
519	T	87.4	Confident	93.4	Very high	20 Å²	20	47.3 Å²	47.3	12%	0.123	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-41.5	-178.6	-63.8	0	0	0	0	110.7	K467 Q515 P516 V517	K467-T519 HydrophobicContact CB-CG2 3.56Å; K467-T519 HydrophobicContact CD-CG2 4.02Å; K467-T519 WeakPolarHBondContact CD-OG1 3.14Å; K467-T519 HydrophobicContact CG-CG2 3.79Å; K467-T519 PolarHBondContact NZ-OG1 3.2Å; K467-T519 VanDerWaalsContact NZ-OG1 3.15Å; Q515-T519 HydrophobicContact CB-CG2 4.2Å; P516-T519 WeakPolarHBondContact O-CA 3.33Å; P516-T519 VanDerWaalsContact O-CB 3.31Å; P516-T519 WeakPolarHBondContact O-CB 3.32Å; P516-T519 PolarHBondContact O-N 2.88Å; V517-T519 PolarHBondContact O-N 3.32Å
520	F	94.3	Very high	93.5	Very high	1 Å²	1	49 Å²	49	0%	0.004	26%	0.257	C	S	.	.			trans	-143	118.8	174.1	177.5	-104.1	0	0	0	109.6	Y470 C508 L512 Q515 P516 V517 P522 N525	Y470-F520 HydrophobicContact CD1-CD2 4.1Å; Y470-F520 HydrophobicContact CD2-CD2 4.22Å; Y470-F520 HydrophobicContact CD2-CE2 4.45Å; Y470-F520 AromaticContact CE1-CD2 3.64Å; Y470-F520 HydrophobicContact CE1-CD2 3.64Å; Y470-F520 HydrophobicContact CE1-CE2 4.25Å; Y470-F520 AromaticContact CE2-CD2 3.77Å; Y470-F520 HydrophobicContact CE2-CD2 3.77Å; Y470-F520 AromaticContact CE2-CE2 3.7Å; Y470-F520 HydrophobicContact CE2-CE2 3.7Å; Y470-F520 HydrophobicContact CG-CD2 4.38Å; Y470-F520 AromaticContact CZ-CD2 3.46Å; Y470-F520 VanDerWaalsContact CZ-CD2 3.46Å; Y470-F520 AromaticContact CZ-CE2 3.59Å; C508-F520 HydrophobicContact CB-CE2 3.98Å; C508-F520 HydrophobicContact CB-CZ 4.48Å; C508-F520 WeakPolarHBondContact O-CZ 3.39Å; L512-F520 HydrophobicContact CB-CB 3.98Å; L512-F520 HydrophobicContact CB-CD1 3.81Å; L512-F520 HydrophobicContact CB-CD2 3.76Å; L512-F520 HydrophobicContact CB-CE1 4.2Å; L512-F520 HydrophobicContact CB-CE2 4.18Å; L512-F520 HydrophobicContact CB-CG 3.57Å; L512-F520 HydrophobicContact CB-CZ 4.38Å; L512-F520 HydrophobicContact CD1-CD2 3.75Å; L512-F520 HydrophobicContact CD1-CE2 4.25Å; L512-F520 HydrophobicContact CD1-CG 4.28Å; L512-F520 HydrophobicContact CG-CD2 4.41Å; L512-F520 WeakPolarHBondContact O-CD1 3.27Å; Q515-F520 HydrophobicContact CB-CB 4Å; P516-F520 PolarHBondContact O-N 3.41Å; V517-F520 WeakPolarHBondContact CA-O 3.44Å; V517-F520 CarbonylContact O-C 3.36Å; F520-P522 HydrophobicContact CD1-CG 3.99Å; F520-P522 HydrophobicContact CE1-CB 4.01Å; F520-P522 HydrophobicContact CE1-CG 3.84Å; F520-P522 WeakPolarHBondContact O-CD 3.33Å; F520-N525 HydrophobicContact CE2-CB 3.61Å; F520-N525 HydrophobicContact CZ-CB 3.59Å
521	D	93.8	Very high	93.5	Very high	47 Å²	47	51.3 Å²	51.3	25%	0.251	27%	0.267	S	S	.	.			trans	-97.2	109.1	171.7	-176.9	-30	0	0	0	109.3	V517 R523 I524 N525	V517-D521 HydrophobicContact CG1-CB 4.33Å; D521-R523 PolarHBondContact O-N 3.14Å; D521-R523 WeakPolarHBondContact OD1-CA 3.43Å; D521-R523 VanDerWaalsContact OD1-CB 3.26Å; D521-R523 WeakPolarHBondContact OD1-CB 3.46Å; D521-R523 PolarHBondContact OD1-N 3.19Å; D521-I524 HydrophobicContact CB-CB 4.08Å; D521-I524 HydrophobicContact CB-CD1 4.01Å; D521-I524 HydrophobicContact CB-CG1 4.13Å; D521-I524 PolarHBondContact O-N 2.87Å; D521-I524 PolarHBondContact OD1-N 3.25Å; D521-I524 VanDerWaalsContact OD1-N 3.16Å; D521-I524 WeakPolarHBondContact OD2-CD1 3.5Å; D521-I524 WeakPolarHBondContact OD2-CG1 3.39Å; D521-N525 PolarHBondContact O-N 2.93Å
522	P	93.8	Very high	93.7	Very high	63 Å²	63	50.2 Å²	50.2	41%	0.409	26%	0.263	S	S	.	.	H	α-helix	trans	-60.7	-32.2	-179.3	-22.7	33.1	0	0	0	113.2	F520 S526	F520-P522 HydrophobicContact CD1-CG 3.99Å; F520-P522 HydrophobicContact CE1-CB 4.01Å; F520-P522 HydrophobicContact CE1-CG 3.84Å; F520-P522 WeakPolarHBondContact O-CD 3.33Å; P522-S526 VanDerWaalsContact O-CB 3.3Å; P522-S526 WeakPolarHBondContact O-CB 3.3Å; P522-S526 PolarHBondContact O-N 3.47Å
523	R	93.6	Very high	93.9	Very high	208 Å²	208	50.4 Å²	50.4	79%	0.785	26%	0.264	S	S	*	.	H	α-helix	trans	-69.5	-47.3	-179.5	-174.8	-177.7	-70.9	-175.4	-2.6	110.4	D521 N525 S526 E527	D521-R523 PolarHBondContact O-N 3.14Å; D521-R523 WeakPolarHBondContact OD1-CA 3.43Å; D521-R523 VanDerWaalsContact OD1-CB 3.26Å; D521-R523 WeakPolarHBondContact OD1-CB 3.46Å; D521-R523 PolarHBondContact OD1-N 3.19Å; R523-N525 VanDerWaalsContact C-N 3.33Å; R523-N525 PolarHBondContact O-N 3.48Å; R523-S526 PolarHBondContact O-N 2.94Å; R523-E527 PolarHBondContact O-N 3.49Å
524	I	94.1	Very high	94	Very high	57 Å²	57	53.5 Å²	53.5	29%	0.292	28%	0.277	S	S	.	.	H	α-helix	trans	-64.5	-39.3	177.7	-66.7	176.1	0	0	0	110.9	W474 D521 E527 N528	W474-I524 HydrophobicContact CH2-CG2 4.43Å; W474-I524 HydrophobicContact CZ2-CG2 3.49Å; W474-I524 VanDerWaalsContact CZ2-CG2 3.49Å; D521-I524 HydrophobicContact CB-CB 4.08Å; D521-I524 HydrophobicContact CB-CD1 4.01Å; D521-I524 HydrophobicContact CB-CG1 4.13Å; D521-I524 PolarHBondContact O-N 2.87Å; D521-I524 PolarHBondContact OD1-N 3.25Å; D521-I524 VanDerWaalsContact OD1-N 3.16Å; D521-I524 WeakPolarHBondContact OD2-CD1 3.5Å; D521-I524 WeakPolarHBondContact OD2-CG1 3.39Å; I524-E527 PolarHBondContact O-N 2.94Å; I524-N528 PolarHBondContact O-N 3.23Å; I524-N528 VanDerWaalsContact O-N 3.11Å; I524-N528 PolarHBondContact O-ND2 2.93Å
525	N	96.9	Very high	94.4	Very high	2 Å²	2	52 Å²	52	1%	0.011	27%	0.27	C	S	.	.	H	α-helix	trans	-62.7	-46.1	175.1	-174.6	66.8	0	0	0	111.5	Y470 H505 F520 D521 R523 E527 N528 L529	Y470-N525 PolarHBondContact OH-OD1 3.37Å; H505-N525 PolarHBondContact ND1-OD1 3.47Å; H505-N525 PolarHBondContact O-ND2 2.89Å; F520-N525 HydrophobicContact CE2-CB 3.61Å; F520-N525 HydrophobicContact CZ-CB 3.59Å; D521-N525 PolarHBondContact O-N 2.93Å; R523-N525 VanDerWaalsContact C-N 3.33Å; R523-N525 PolarHBondContact O-N 3.48Å; N525-E527 VanDerWaalsContact C-N 3.35Å; N525-E527 PolarHBondContact O-N 3.21Å; N525-N528 PolarHBondContact O-N 3.33Å; N525-L529 PolarHBondContact O-N 3.05Å
526	S	96	Very high	94.7	Very high	37 Å²	37	49.2 Å²	49.2	26%	0.259	26%	0.256	S	S	.	.	H	α-helix	trans	-61.5	-39.9	178	-168.8	0	0	0	0	112.7	P522 R523 L529 T530	P522-S526 VanDerWaalsContact O-CB 3.3Å; P522-S526 WeakPolarHBondContact O-CB 3.3Å; P522-S526 PolarHBondContact O-N 3.47Å; R523-S526 PolarHBondContact O-N 2.94Å; S526-L529 PolarHBondContact O-N 3.37Å; S526-T530 WeakPolarHBondContact O-CB 3.35Å; S526-T530 PolarHBondContact O-N 2.97Å; S526-T530 PolarHBondContact O-OG1 3.33Å
527	E	96.4	Very high	95	Very high	91 Å²	91	49 Å²	49	43%	0.425	25%	0.249	S	C	.	.	H	α-helix	trans	-61.2	-46.3	174.3	-170.5	-161.8	137.2	0	0	111.3	R523 I524 N525 T530 Q531	R523-E527 PolarHBondContact O-N 3.49Å; I524-E527 PolarHBondContact O-N 2.94Å; N525-E527 VanDerWaalsContact C-N 3.35Å; N525-E527 PolarHBondContact O-N 3.21Å; E527-T530 PolarHBondContact O-N 3.25Å; E527-Q531 VanDerWaalsContact O-CG 3.3Å; E527-Q531 WeakPolarHBondContact O-CG 3.44Å; E527-Q531 PolarHBondContact O-N 3.41Å; E527-Q531 PolarHBondContact OE1-NE2 3.03Å
528	N	96.8	Very high	95.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-65.2	-41.1	179.3	-79.4	-79.4	0	0	0	112.2	W474 R478 R481 H505 I524 N525 Q531 C532	W474-N528 PolarHBondContact NE1-ND2 3.22Å; W474-N528 VanDerWaalsContact NE1-ND2 3.18Å; R478-N528 PolarHBondContact NH1-ND2 3.19Å; R478-N528 PolarHBondContact NH1-OD1 3.28Å; R481-N528 PolarHBondContact NH1-O 2.8Å; R481-N528 PolarHBondContact NH1-OD1 2.85Å; H505-N528 VanDerWaalsContact CE1-CB 3.49Å; H505-N528 WeakPolarHBondContact CE1-CB 3.2Å; I524-N528 PolarHBondContact O-N 3.23Å; I524-N528 VanDerWaalsContact O-N 3.11Å; I524-N528 PolarHBondContact O-ND2 2.93Å; N525-N528 PolarHBondContact O-N 3.33Å; N528-Q531 PolarHBondContact O-N 3.01Å; N528-C532 PolarHBondContact O-N 2.94Å; N528-C532 PolarHBondContact O-SG 2.52Å
529	L	98.3	Very high	95.6	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.6	-48.7	173.5	178.3	51.8	0	0	0	111.2	A502 H505 I506 N525 S526 Q531 C532 L533 M566 L622	A502-L529 HydrophobicContact CB-CD1 3.97Å; H505-L529 HydrophobicContact CB-CB 3.85Å; H505-L529 HydrophobicContact CB-CD1 4.16Å; H505-L529 HydrophobicContact CB-CG 4.4Å; I506-L529 HydrophobicContact CD1-CD1 4.26Å; I506-L529 HydrophobicContact CG1-CD1 3.77Å; I506-L529 HydrophobicContact CG1-CD2 3.62Å; I506-L529 HydrophobicContact CG1-CG 4.37Å; N525-L529 PolarHBondContact O-N 3.05Å; S526-L529 PolarHBondContact O-N 3.37Å; L529-Q531 VanDerWaalsContact C-N 3.3Å; L529-Q531 PolarHBondContact O-N 3.4Å; L529-C532 WeakPolarHBondContact O-CB 3.43Å; L529-C532 PolarHBondContact O-N 3.5Å; L529-L533 HydrophobicContact CD1-CD1 4.07Å; L529-L533 HydrophobicContact CD1-CG 4.04Å; L529-L533 HydrophobicContact CG-CD1 4.13Å; L529-L533 WeakPolarHBondContact O-CG 3.25Å; L529-L533 PolarHBondContact O-N 3.2Å; L529-M566 HydrophobicContact CB-CE 4.41Å; L529-M566 HydrophobicContact CD2-CE 3.9Å; L529-M566 HydrophobicContact CD2-SD 3.4Å; L529-M566 WeakPolarHBondContact CD2-SD 3.29Å; L529-M566 HydrophobicContact CG-CE 3.97Å; L529-M566 HydrophobicContact CG-SD 3.99Å; L529-L622 HydrophobicContact CD2-CD2 4.23Å
530	T	97.1	Very high	95.9	Very high	59 Å²	59	43.5 Å²	43.5	36%	0.362	21%	0.211	S	C	.	.	H	α-helix	trans	-58.5	-43.2	178.8	-56.2	0	0	0	0	111.2	S526 E527 C532 L533 Q534 M566	S526-T530 WeakPolarHBondContact O-CB 3.35Å; S526-T530 PolarHBondContact O-N 2.97Å; S526-T530 PolarHBondContact O-OG1 3.33Å; E527-T530 PolarHBondContact O-N 3.25Å; T530-C532 PolarHBondContact O-N 3.02Å; T530-L533 PolarHBondContact O-N 2.81Å; T530-Q534 WeakPolarHBondContact O-CB 3.46Å; T530-Q534 PolarHBondContact O-N 3.16Å; T530-M566 WeakPolarHBondContact OG1-CE 3.38Å
531	Q	97.4	Very high	95.6	Very high	54 Å²	54	46.9 Å²	46.9	25%	0.252	24%	0.235	S	C	.	.	H	α-helix	trans	-66.8	-33.8	175.8	-67.2	169.5	9.3	0	0	113	R481 E527 N528 L529 T535	R481-Q531 VanDerWaalsContact NH2-OE1 3.16Å; E527-Q531 VanDerWaalsContact O-CG 3.3Å; E527-Q531 WeakPolarHBondContact O-CG 3.44Å; E527-Q531 PolarHBondContact O-N 3.41Å; E527-Q531 PolarHBondContact OE1-NE2 3.03Å; N528-Q531 PolarHBondContact O-N 3.01Å; L529-Q531 VanDerWaalsContact C-N 3.3Å; L529-Q531 PolarHBondContact O-N 3.4Å; Q531-T535 PolarHBondContact O-N 3.49Å; Q531-T535 VanDerWaalsContact O-N 3.09Å; Q531-T535 PolarHBondContact O-OG1 2.73Å
532	C	98.4	Very high	95.3	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64.1	-48.1	172.9	-63.4	0	0	0	0	110.5	R481 I498 A502 N528 L529 T530 Q534 T535 L536	R481-C532 VanDerWaalsContact CD-SG 3.52Å; R481-C532 PolarHBondContact NE-SG 3.03Å; I498-C532 HydrophobicContact CG2-CB 3.97Å; A502-C532 HydrophobicContact CB-CB 4.04Å; N528-C532 PolarHBondContact O-N 2.94Å; N528-C532 PolarHBondContact O-SG 2.52Å; L529-C532 WeakPolarHBondContact O-CB 3.43Å; L529-C532 PolarHBondContact O-N 3.5Å; T530-C532 PolarHBondContact O-N 3.02Å; C532-Q534 PolarHBondContact O-N 3.29Å; C532-T535 PolarHBondContact O-N 3.44Å; C532-L536 WeakPolarHBondContact O-CG 3.13Å; C532-L536 PolarHBondContact O-N 2.75Å
533	L	98.1	Very high	94.9	Very high	8 Å²	8	49.3 Å²	49.3	4%	0.042	24%	0.244	C	C	.	.	H	α-helix	trans	-63.9	-39.4	179.5	-66.1	176.2	0	0	0	112	A502 L529 T530 L536 K537 F559 M563 M566	A502-L533 HydrophobicContact CB-CD2 4.48Å; L529-L533 HydrophobicContact CD1-CD1 4.07Å; L529-L533 HydrophobicContact CD1-CG 4.04Å; L529-L533 HydrophobicContact CG-CD1 4.13Å; L529-L533 WeakPolarHBondContact O-CG 3.25Å; L529-L533 PolarHBondContact O-N 3.2Å; T530-L533 PolarHBondContact O-N 2.81Å; L533-L536 HydrophobicContact CD2-CD1 4.45Å; L533-L536 PolarHBondContact O-N 3.45Å; L533-K537 WeakPolarHBondContact O-CB 3.49Å; L533-K537 PolarHBondContact O-N 2.93Å; L533-F559 HydrophobicContact CD2-CD1 3.93Å; L533-M563 HydrophobicContact CB-CE 4.33Å; L533-M563 HydrophobicContact CB-CG 4.02Å; L533-M563 HydrophobicContact CD1-CG 4.37Å; L533-M563 HydrophobicContact CD2-CE 4.45Å; L533-M563 HydrophobicContact CD2-CG 4.24Å; L533-M563 HydrophobicContact CG-CG 4.44Å; L533-M563 WeakPolarHBondContact O-CE 3.49Å; L533-M566 HydrophobicContact CD1-CG 3.65Å
534	Q	96.8	Very high	94.1	Very high	88 Å²	88	43.3 Å²	43.3	41%	0.411	23%	0.228	S	C	.	.	H	α-helix	trans	-62.9	-44	174.2	-177.3	60.1	26.6	0	0	111.7	T530 C532 L536 K537 E538	T530-Q534 WeakPolarHBondContact O-CB 3.46Å; T530-Q534 PolarHBondContact O-N 3.16Å; C532-Q534 PolarHBondContact O-N 3.29Å; Q534-L536 VanDerWaalsContact C-N 3.31Å; Q534-L536 PolarHBondContact O-N 2.96Å; Q534-K537 WeakPolarHBondContact O-CB 3.42Å; Q534-K537 PolarHBondContact O-N 2.86Å; Q534-K537 VanDerWaalsContact O-N 3.16Å; Q534-E538 WeakPolarHBondContact CG-OE1 3.29Å; Q534-E538 PolarHBondContact NE2-OE1 3.39Å; Q534-E538 WeakPolarHBondContact O-CG 3.29Å; Q534-E538 PolarHBondContact O-N 2.85Å
535	T	97.3	Very high	92.5	Very high	17 Å²	17	43.5 Å²	43.5	10%	0.104	23%	0.234	C	C	.	.	H	α-helix	trans	-61.2	-41.8	176.4	-50.5	0	0	0	0	110.8	I498 Q531 C532 E538 M539	I498-T535 HydrophobicContact CD1-CG2 3.61Å; Q531-T535 PolarHBondContact O-N 3.49Å; Q531-T535 VanDerWaalsContact O-N 3.09Å; Q531-T535 PolarHBondContact O-OG1 2.73Å; C532-T535 PolarHBondContact O-N 3.44Å; T535-E538 PolarHBondContact O-N 3.27Å; T535-M539 HydrophobicContact CG2-CE 3.63Å; T535-M539 HydrophobicContact CG2-CG 4.46Å; T535-M539 HydrophobicContact CG2-SD 4.07Å; T535-M539 WeakPolarHBondContact O-CB 3.48Å; T535-M539 VanDerWaalsContact O-CG 3.27Å; T535-M539 WeakPolarHBondContact O-CG 3.46Å; T535-M539 PolarHBondContact O-N 3.48Å
536	L	97.4	Very high	90.5	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64.4	-41.2	174.8	-71.8	170.2	0	0	0	112	I495 I498 E499 C532 L533 Q534 E538 M539 Y540 F559 M563	I495-L536 HydrophobicContact CG2-CD2 3.93Å; I498-L536 HydrophobicContact CB-CD2 3.92Å; I498-L536 HydrophobicContact CB-CG 4.26Å; I498-L536 HydrophobicContact CG2-CD1 4.05Å; I498-L536 HydrophobicContact CG2-CD2 3.91Å; I498-L536 HydrophobicContact CG2-CG 3.66Å; E499-L536 HydrophobicContact CG-CD1 4.19Å; E499-L536 HydrophobicContact CG-CD2 3.89Å; C532-L536 WeakPolarHBondContact O-CG 3.13Å; C532-L536 PolarHBondContact O-N 2.75Å; L533-L536 HydrophobicContact CD2-CD1 4.45Å; L533-L536 PolarHBondContact O-N 3.45Å; Q534-L536 VanDerWaalsContact C-N 3.31Å; Q534-L536 PolarHBondContact O-N 2.96Å; L536-E538 VanDerWaalsContact C-N 3.31Å; L536-E538 PolarHBondContact O-N 3.1Å; L536-M539 PolarHBondContact O-N 2.89Å; L536-Y540 HydrophobicContact CB-CD2 4.32Å; L536-Y540 HydrophobicContact CB-CE2 3.88Å; L536-Y540 WeakPolarHBondContact O-CB 3.47Å; L536-Y540 WeakPolarHBondContact O-CD2 3.4Å; L536-Y540 VanDerWaalsContact O-CG 3.22Å; L536-Y540 PolarHBondContact O-N 2.88Å; L536-F559 HydrophobicContact CD1-CB 4.37Å; L536-F559 HydrophobicContact CD1-CD1 3.58Å; L536-F559 HydrophobicContact CD1-CE1 4.07Å; L536-F559 HydrophobicContact CD1-CG 3.93Å; L536-M563 HydrophobicContact CB-CE 4.07Å
537	K	94.6	Very high	88.5	Confident	65 Å²	65	54.7 Å²	54.7	28%	0.283	30%	0.299	S	S	.	.	H	α-helix	trans	-57.5	-46.1	178.2	174.3	168.2	-174.8	179.4	0	111.1	L533 Q534 S541 M563	L533-K537 WeakPolarHBondContact O-CB 3.49Å; L533-K537 PolarHBondContact O-N 2.93Å; Q534-K537 WeakPolarHBondContact O-CB 3.42Å; Q534-K537 PolarHBondContact O-N 2.86Å; Q534-K537 VanDerWaalsContact O-N 3.16Å; K537-S541 PolarHBondContact O-N 3.38Å; K537-S541 PolarHBondContact O-OG 3.16Å; K537-S541 VanDerWaalsContact O-OG 3.11Å; K537-M563 HydrophobicContact CB-CE 3.92Å; K537-M563 HydrophobicContact CB-SD 4.01Å
538	E	94.6	Very high	86.4	Confident	96 Å²	96	53.8 Å²	53.8	45%	0.449	30%	0.299	S	S	.	.	H	α-helix	trans	-64.9	-51.5	176.4	-69.2	161.5	-169.6	0	0	111.1	Q534 T535 L536 Y540 S541 D542	Q534-E538 WeakPolarHBondContact CG-OE1 3.29Å; Q534-E538 PolarHBondContact NE2-OE1 3.39Å; Q534-E538 WeakPolarHBondContact O-CG 3.29Å; Q534-E538 PolarHBondContact O-N 2.85Å; T535-E538 PolarHBondContact O-N 3.27Å; L536-E538 VanDerWaalsContact C-N 3.31Å; L536-E538 PolarHBondContact O-N 3.1Å; E538-Y540 VanDerWaalsContact C-N 3.33Å; E538-Y540 PolarHBondContact O-N 2.88Å; E538-S541 WeakPolarHBondContact O-CB 3.4Å; E538-S541 PolarHBondContact O-N 2.78Å; E538-D542 PolarHBondContact O-N 3.43Å
539	M	94.6	Very high	84.4	Confident	14 Å²	14	54.4 Å²	54.4	7%	0.069	30%	0.304	C	S	.	.	H	α-helix	trans	-61.6	-36.4	-179.1	-72.5	-179	175.3	0	0	113.8	I484 L489 V494 I495 I498 T535 L536 D542 L543	I484-M539 HydrophobicContact CG2-CE 3.83Å; L489-M539 WeakPolarHBondContact O-CE 3.31Å; V494-M539 HydrophobicContact CG1-CE 3.93Å; V494-M539 HydrophobicContact CG1-SD 4.24Å; I495-M539 HydrophobicContact CD1-CB 4Å; I495-M539 HydrophobicContact CG1-CB 3.92Å; I495-M539 HydrophobicContact CG1-CG 4.49Å; I495-M539 HydrophobicContact CG1-SD 3.88Å; I498-M539 HydrophobicContact CD1-CE 3.74Å; I498-M539 HydrophobicContact CD1-SD 3.63Å; T535-M539 HydrophobicContact CG2-CE 3.63Å; T535-M539 HydrophobicContact CG2-CG 4.46Å; T535-M539 HydrophobicContact CG2-SD 4.07Å; T535-M539 WeakPolarHBondContact O-CB 3.48Å; T535-M539 VanDerWaalsContact O-CG 3.27Å; T535-M539 WeakPolarHBondContact O-CG 3.46Å; T535-M539 PolarHBondContact O-N 3.48Å; L536-M539 PolarHBondContact O-N 2.89Å; M539-D542 PolarHBondContact O-N 3.05Å; M539-L543 WeakPolarHBondContact O-CG 3.28Å; M539-L543 PolarHBondContact O-N 2.94Å
540	Y	93.5	Very high	82.5	Confident	6 Å²	6	60.9 Å²	60.9	2%	0.024	33%	0.334	C	S	.	.	H	α-helix	trans	-66.5	-41.1	174.2	-67.4	-42.3	0	0	0	111.4	I495 E499 L536 E538 L543 D544 C553 E556 F559 R560	I495-Y540 HydrophobicContact CD1-CD1 4.3Å; I495-Y540 HydrophobicContact CD1-CE1 4.42Å; I495-Y540 HydrophobicContact CG2-CD1 4.43Å; I495-Y540 HydrophobicContact CG2-CE1 3.58Å; E499-Y540 PolarHBondContact OE1-OH 3.14Å; L536-Y540 HydrophobicContact CB-CD2 4.32Å; L536-Y540 HydrophobicContact CB-CE2 3.88Å; L536-Y540 WeakPolarHBondContact O-CB 3.47Å; L536-Y540 WeakPolarHBondContact O-CD2 3.4Å; L536-Y540 VanDerWaalsContact O-CG 3.22Å; L536-Y540 PolarHBondContact O-N 2.88Å; E538-Y540 VanDerWaalsContact C-N 3.33Å; E538-Y540 PolarHBondContact O-N 2.88Å; Y540-L543 PolarHBondContact O-N 3.41Å; Y540-D544 PolarHBondContact O-N 3.46Å; Y540-C553 HydrophobicContact CD1-CB 4.01Å; Y540-C553 HydrophobicContact CE1-CB 3.91Å; Y540-E556 HydrophobicContact CD1-CB 4.21Å; Y540-E556 HydrophobicContact CD1-CG 4.15Å; Y540-E556 HydrophobicContact CD2-CB 4.48Å; Y540-E556 HydrophobicContact CD2-CG 3.81Å; Y540-E556 HydrophobicContact CE1-CB 4.01Å; Y540-E556 HydrophobicContact CE1-CG 4.33Å; Y540-E556 HydrophobicContact CE2-CB 4.3Å; Y540-E556 HydrophobicContact CE2-CG 4Å; Y540-E556 HydrophobicContact CG-CB 4.46Å; Y540-E556 HydrophobicContact CG-CG 3.91Å; Y540-F559 HydrophobicContact CE2-CB 4.1Å; Y540-F559 WeakPolarHBondContact OH-CD2 3.1Å; Y540-R560 VanDerWaalsContact CB-NH2 3.32Å
541	S	89.2	Confident	81	Confident	72 Å²	72	65.5 Å²	65.5	50%	0.503	36%	0.356	S	S	.	.	H	α-helix	trans	-64.9	-38.9	175.7	-62.8	0	0	0	0	112.2	K537 E538 L543 D544	K537-S541 PolarHBondContact O-N 3.38Å; K537-S541 PolarHBondContact O-OG 3.16Å; K537-S541 VanDerWaalsContact O-OG 3.11Å; E538-S541 WeakPolarHBondContact O-CB 3.4Å; E538-S541 PolarHBondContact O-N 2.78Å; S541-L543 VanDerWaalsContact C-N 3.27Å; S541-L543 PolarHBondContact O-N 3.26Å; S541-D544 PolarHBondContact O-N 2.87Å
542	D	87.3	Confident	80.1	Confident	120 Å²	120	65.4 Å²	65.4	64%	0.642	36%	0.357	S	S	*	.	H	α-helix	trans	-66.8	-27.6	178.6	-68.2	-15.9	0	0	0	112.9	E538 M539	E538-D542 PolarHBondContact O-N 3.43Å; M539-D542 PolarHBondContact O-N 3.05Å
543	L	85	Confident	79.6	Confident	41 Å²	41	65.9 Å²	65.9	22%	0.215	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-3	177.8	-66.9	-179.3	0	0	0	113.8	I495 M539 Y540 S541 S545 I552	I495-L543 HydrophobicContact CD1-CD1 3.29Å; I495-L543 HydrophobicContact CD1-CG 4.44Å; M539-L543 WeakPolarHBondContact O-CG 3.28Å; M539-L543 PolarHBondContact O-N 2.94Å; Y540-L543 PolarHBondContact O-N 3.41Å; S541-L543 VanDerWaalsContact C-N 3.27Å; S541-L543 PolarHBondContact O-N 3.26Å; L543-S545 PolarHBondContact O-N 3.03Å; L543-I552 HydrophobicContact CD1-CG2 4.16Å
544	D	75.9	Confident	79.2	Confident	83 Å²	83	70.4 Å²	70.4	44%	0.444	39%	0.39	S	S	.	.			trans	-75.7	74.4	-177.2	-157.2	23.8	0	0	0	111	Y540 S541 S549	Y540-D544 PolarHBondContact O-N 3.46Å; S541-D544 PolarHBondContact O-N 2.87Å; D544-S549 PolarHBondContact OD1-OG 3.36Å
545	S	61.7	Low	79.1	Confident	61 Å²	61	68.9 Å²	68.9	43%	0.427	39%	0.385	S	S	.	.			trans	-88.7	127.6	160.9	59.9	0	0	0	0	108.5	L543 I547 T548	L543-S545 PolarHBondContact O-N 3.03Å; S545-I547 PolarHBondContact O-N 3.25Å; S545-T548 PolarHBondContact O-N 3.44Å; S545-T548 VanDerWaalsContact O-N 3.15Å; S545-T548 PolarHBondContact OG-OG1 2.89Å
546	S	54.6	Low	79	Confident	115 Å²	115	68.5 Å²	68.5	80%	0.804	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-12.4	-162.2	59.4	0	0	0	0	117.3
547	I	53.5	Low	78.9	Confident	159 Å²	159	69.5 Å²	69.5	82%	0.815	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.7	-17.3	-173.2	-59.2	172.6	0	0	0	112.3	S545	S545-I547 PolarHBondContact O-N 3.25Å
548	T	53.2	Low	79	Confident	71 Å²	71	68.3 Å²	68.3	44%	0.436	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.5	-13.1	-162	-19.7	0	0	0	0	114.9	S545 E550 N551 I552	S545-T548 PolarHBondContact O-N 3.44Å; S545-T548 VanDerWaalsContact O-N 3.15Å; S545-T548 PolarHBondContact OG-OG1 2.89Å; T548-E550 PolarHBondContact O-N 2.7Å; T548-N551 PolarHBondContact O-N 3.04Å; T548-I552 HydrophobicContact CG2-CD1 3.78Å; T548-I552 HydrophobicContact CG2-CG1 4.37Å; T548-I552 WeakPolarHBondContact O-CD1 3.29Å; T548-I552 VanDerWaalsContact O-CG1 3.31Å; T548-I552 WeakPolarHBondContact O-CG1 3.35Å
549	S	54.3	Low	79.1	Confident	14 Å²	14	63.8 Å²	63.8	10%	0.098	36%	0.364	C	S	.	.	H	α-helix	trans	-67.4	-28	-165.4	55.8	0	0	0	0	115.1	D544 N551 I552 C553 R583	D544-S549 PolarHBondContact OD1-OG 3.36Å; S549-N551 VanDerWaalsContact C-N 3.29Å; S549-N551 PolarHBondContact O-N 3.37Å; S549-I552 PolarHBondContact O-N 3.31Å; S549-I552 VanDerWaalsContact O-N 3.16Å; S549-C553 PolarHBondContact O-N 3.01Å; S549-R583 PolarHBondContact OG-NH2 2.82Å
550	E	57.6	Low	79.2	Confident	135 Å²	135	64 Å²	64	63%	0.631	36%	0.364	S	S	*	.	H	α-helix	trans	-60.8	-35.5	-179.4	-71.5	-168.5	166.8	0	0	113.4	T548 R583	T548-E550 PolarHBondContact O-N 2.7Å; E550-R583 WeakPolarHBondContact OE1-CD 3.14Å
551	N	65.3	Low	79.4	Confident	156 Å²	156	63.8 Å²	63.8	83%	0.834	36%	0.364	S	S	*	.	H	α-helix	trans	-86.3	-17.6	179.2	-77.4	-14.5	0	0	0	113.3	T548 S549	T548-N551 PolarHBondContact O-N 3.04Å; S549-N551 VanDerWaalsContact C-N 3.29Å; S549-N551 PolarHBondContact O-N 3.37Å
552	I	78.7	Confident	79.8	Confident	53 Å²	53	60.8 Å²	60.8	27%	0.272	34%	0.342	S	S	.	.	H	α-helix	trans	-87.8	-42.8	-170	-64.2	172.4	0	0	0	111.5	P492 L543 T548 S549	P492-I552 HydrophobicContact CB-CG2 4.37Å; P492-I552 HydrophobicContact CG-CG2 3.48Å; P492-I552 VanDerWaalsContact CG-CG2 3.48Å; L543-I552 HydrophobicContact CD1-CG2 4.16Å; T548-I552 HydrophobicContact CG2-CD1 3.78Å; T548-I552 HydrophobicContact CG2-CG1 4.37Å; T548-I552 WeakPolarHBondContact O-CD1 3.29Å; T548-I552 VanDerWaalsContact O-CG1 3.31Å; T548-I552 WeakPolarHBondContact O-CG1 3.35Å; S549-I552 PolarHBondContact O-N 3.31Å; S549-I552 VanDerWaalsContact O-N 3.16Å
553	C	89	Confident	80.2	Confident	10 Å²	10	56.3 Å²	56.3	7%	0.068	32%	0.318	C	S	.	.			trans	-128.6	73.2	-171.8	-68.5	0	0	0	0	112.2	Y540 S549 N555 E556	Y540-C553 HydrophobicContact CD1-CB 4.01Å; Y540-C553 HydrophobicContact CE1-CB 3.91Å; S549-C553 PolarHBondContact O-N 3.01Å; C553-N555 PolarHBondContact O-N 3.27Å; C553-N555 VanDerWaalsContact O-N 3.17Å; C553-E556 HydrophobicContact CB-CB 4.35Å; C553-E556 WeakPolarHBondContact O-CB 3.32Å; C553-E556 PolarHBondContact O-N 3.28Å; C553-E556 VanDerWaalsContact O-N 3.17Å
554	P	89.2	Confident	80.8	Confident	103 Å²	103	54.8 Å²	54.8	67%	0.669	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-26.8	-172.9	24.7	-35	0	0	0	114.1
555	N	94.5	Very high	81.8	Confident	55 Å²	55	50.9 Å²	50.9	29%	0.294	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	0.4	-177.9	-60.6	-30.3	0	0	0	113.5	E499 R503 C553 A557 E558 F559	E499-N555 WeakPolarHBondContact OE1-CB 3.45Å; E499-N555 WeakPolarHBondContact OE2-CB 3.34Å; E499-N555 PolarHBondContact OE2-ND2 2.85Å; R503-N555 PolarHBondContact NH2-ND2 3Å; C553-N555 PolarHBondContact O-N 3.27Å; C553-N555 VanDerWaalsContact O-N 3.17Å; N555-A557 VanDerWaalsContact C-N 3.26Å; N555-A557 PolarHBondContact O-N 2.72Å; N555-E558 VanDerWaalsContact O-CB 3.29Å; N555-E558 WeakPolarHBondContact O-CB 3.38Å; N555-E558 PolarHBondContact O-N 2.89Å; N555-F559 HydrophobicContact CB-CD2 4.09Å; N555-F559 HydrophobicContact CB-CE2 4.01Å; N555-F559 WeakPolarHBondContact O-CD2 3.29Å; N555-F559 PolarHBondContact O-N 2.65Å
556	E	95.3	Very high	83.4	Confident	9 Å²	9	48.8 Å²	48.8	4%	0.042	27%	0.272	C	S	.	.	H	α-helix	trans	-53.3	-45	-176.3	178.9	177.9	-167.9	0	0	111.7	Y540 C553 E558 F559 R560 R583 L584	Y540-E556 HydrophobicContact CD1-CB 4.21Å; Y540-E556 HydrophobicContact CD1-CG 4.15Å; Y540-E556 HydrophobicContact CD2-CB 4.48Å; Y540-E556 HydrophobicContact CD2-CG 3.81Å; Y540-E556 HydrophobicContact CE1-CB 4.01Å; Y540-E556 HydrophobicContact CE1-CG 4.33Å; Y540-E556 HydrophobicContact CE2-CB 4.3Å; Y540-E556 HydrophobicContact CE2-CG 4Å; Y540-E556 HydrophobicContact CG-CB 4.46Å; Y540-E556 HydrophobicContact CG-CG 3.91Å; C553-E556 HydrophobicContact CB-CB 4.35Å; C553-E556 WeakPolarHBondContact O-CB 3.32Å; C553-E556 PolarHBondContact O-N 3.28Å; C553-E556 VanDerWaalsContact O-N 3.17Å; E556-E558 VanDerWaalsContact C-N 3.29Å; E556-E558 PolarHBondContact O-N 3.28Å; E556-F559 PolarHBondContact O-N 3.28Å; E556-R560 HydrophobicContact CG-CG 3.93Å; E556-R560 VanDerWaalsContact O-CG 3.25Å; E556-R560 WeakPolarHBondContact O-CG 3.18Å; E556-R560 PolarHBondContact O-N 3.47Å; E556-R560 IonicContact OE1-CZ 2.82Å; E556-R560 IonicContact OE1-NE 2.75Å; E556-R560 PolarHBondContact OE1-NE 3.28Å; E556-R560 VanDerWaalsContact OE1-NE 3.13Å; E556-R560 IonicContact OE1-NH2 3.89Å; E556-R560 PolarHBondContact OE1-NH2 2.72Å; E556-R583 IonicContact OE2-CZ 2.64Å; E556-R583 IonicContact OE2-NH1 2.69Å; E556-R583 IonicContact OE2-NH2 3.18Å; E556-R583 PolarHBondContact OE2-NH2 2.95Å; E556-L584 HydrophobicContact CB-CD2 4.38Å; E556-L584 VanDerWaalsContact CD-CD1 3.49Å; E556-L584 HydrophobicContact CG-CD1 4.09Å; E556-L584 HydrophobicContact CG-CD2 4.04Å; E556-L584 VanDerWaalsContact OE1-CD1 3.31Å; E556-L584 WeakPolarHBondContact OE1-CD1 3.33Å
557	A	94.7	Very high	85.3	Confident	21 Å²	21	47.2 Å²	47.2	17%	0.174	25%	0.251	C	S	.	.	H	α-helix	trans	-55.8	-41.6	178	0	0	0	0	0	113	N555 G561 L584 S587 P589	N555-A557 VanDerWaalsContact C-N 3.26Å; N555-A557 PolarHBondContact O-N 2.72Å; A557-G561 PolarHBondContact O-N 3.47Å; A557-L584 HydrophobicContact CB-CD2 4.17Å; A557-S587 WeakPolarHBondContact CB-OG 3.46Å; A557-P589 HydrophobicContact CB-CG 4.36Å; A557-P589 WeakPolarHBondContact O-CB 3.26Å
558	E	96.9	Very high	87.1	Confident	41 Å²	41	39.7 Å²	39.7	19%	0.192	21%	0.212	C	C	.	.	H	α-helix	trans	-59.5	-51.6	176.8	-176	-166.8	166.3	0	0	110.6	R503 N555 E556 G561 Y562	R503-E558 IonicContact CZ-OE1 3.41Å; R503-E558 IonicContact CZ-OE2 2.79Å; R503-E558 IonicContact NE-OE1 3.04Å; R503-E558 PolarHBondContact NE-OE1 3.22Å; R503-E558 IonicContact NE-OE2 2.72Å; R503-E558 IonicContact NH2-OE1 3.64Å; R503-E558 IonicContact NH2-OE2 3.83Å; R503-E558 PolarHBondContact NH2-OE2 2.71Å; N555-E558 VanDerWaalsContact O-CB 3.29Å; N555-E558 WeakPolarHBondContact O-CB 3.38Å; N555-E558 PolarHBondContact O-N 2.89Å; E556-E558 VanDerWaalsContact C-N 3.29Å; E556-E558 PolarHBondContact O-N 3.28Å; E558-G561 WeakPolarHBondContact O-CA 3.37Å; E558-G561 PolarHBondContact O-N 2.97Å; E558-G561 VanDerWaalsContact O-N 3.17Å; E558-Y562 HydrophobicContact CG-CD2 4.33Å; E558-Y562 HydrophobicContact CG-CE1 4.26Å; E558-Y562 HydrophobicContact CG-CE2 3.58Å; E558-Y562 WeakPolarHBondContact CG-OH 3.34Å; E558-Y562 PolarHBondContact O-N 3.42Å; E558-Y562 WeakPolarHBondContact OE1-CE2 3.45Å; E558-Y562 VanDerWaalsContact OE1-CZ 3.23Å; E558-Y562 PolarHBondContact OE1-OH 3.05Å
559	F	98	Very high	89	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-73.2	-31.5	-176.1	-73.2	-81.9	0	0	0	113.2	E499 A502 R503 L533 L536 Y540 N555 E556 G561 Y562 M563	E499-F559 VanDerWaalsContact CA-CZ 3.41Å; E499-F559 HydrophobicContact CB-CD2 4.33Å; E499-F559 HydrophobicContact CB-CE1 4.12Å; E499-F559 HydrophobicContact CB-CE2 3.43Å; E499-F559 VanDerWaalsContact CB-CE2 3.43Å; E499-F559 HydrophobicContact CB-CZ 3.3Å; E499-F559 VanDerWaalsContact CD-CE2 3.48Å; E499-F559 HydrophobicContact CG-CD2 3.65Å; E499-F559 HydrophobicContact CG-CE1 4.24Å; E499-F559 HydrophobicContact CG-CE2 3.22Å; E499-F559 HydrophobicContact CG-CG 4.34Å; E499-F559 HydrophobicContact CG-CZ 3.57Å; E499-F559 WeakPolarHBondContact O-CZ 3.47Å; A502-F559 HydrophobicContact CB-CD1 4.33Å; A502-F559 HydrophobicContact CB-CE1 3.72Å; R503-F559 HydrophobicContact CG-CE1 4.45Å; R503-F559 HydrophobicContact CG-CZ 4.05Å; L533-F559 HydrophobicContact CD2-CD1 3.93Å; L536-F559 HydrophobicContact CD1-CB 4.37Å; L536-F559 HydrophobicContact CD1-CD1 3.58Å; L536-F559 HydrophobicContact CD1-CE1 4.07Å; L536-F559 HydrophobicContact CD1-CG 3.93Å; Y540-F559 HydrophobicContact CE2-CB 4.1Å; Y540-F559 WeakPolarHBondContact OH-CD2 3.1Å; N555-F559 HydrophobicContact CB-CD2 4.09Å; N555-F559 HydrophobicContact CB-CE2 4.01Å; N555-F559 WeakPolarHBondContact O-CD2 3.29Å; N555-F559 PolarHBondContact O-N 2.65Å; E556-F559 PolarHBondContact O-N 3.28Å; F559-G561 VanDerWaalsContact C-N 3.3Å; F559-Y562 AromaticContact CD1-CD2 3.7Å; F559-Y562 HydrophobicContact CD1-CD2 3.7Å; F559-Y562 HydrophobicContact CD1-CE2 4.27Å; F559-Y562 AromaticContact CE1-CD2 3.84Å; F559-Y562 HydrophobicContact CE1-CD2 3.84Å; F559-Y562 HydrophobicContact CE1-CE2 4.02Å; F559-Y562 HydrophobicContact CG-CD2 4.3Å; F559-Y562 HydrophobicContact CZ-CE2 4.32Å; F559-Y562 PolarHBondContact O-N 2.91Å; F559-M563 HydrophobicContact CB-CE 4.47Å; F559-M563 VanDerWaalsContact O-CG 3.28Å; F559-M563 WeakPolarHBondContact O-CG 3.34Å; F559-M563 PolarHBondContact O-N 3.39Å
560	R	96	Very high	90.8	Very high	19 Å²	19	42.6 Å²	42.6	7%	0.072	22%	0.224	C	C	.	.	H	α-helix	trans	-61	-41.3	168	-65.5	-65.8	-176.2	-160.3	3.9	110.9	Y540 E556 M563 L564 L580 L584 V590	Y540-R560 VanDerWaalsContact CB-NH2 3.32Å; E556-R560 HydrophobicContact CG-CG 3.93Å; E556-R560 VanDerWaalsContact O-CG 3.25Å; E556-R560 WeakPolarHBondContact O-CG 3.18Å; E556-R560 PolarHBondContact O-N 3.47Å; E556-R560 IonicContact OE1-CZ 2.82Å; E556-R560 IonicContact OE1-NE 2.75Å; E556-R560 PolarHBondContact OE1-NE 3.28Å; E556-R560 VanDerWaalsContact OE1-NE 3.13Å; E556-R560 IonicContact OE1-NH2 3.89Å; E556-R560 PolarHBondContact OE1-NH2 2.72Å; R560-M563 PolarHBondContact O-N 3.23Å; R560-L564 PolarHBondContact O-N 3.06Å; R560-L580 HydrophobicContact CB-CD1 4.38Å; R560-L580 HydrophobicContact CG-CD1 4.44Å; R560-L584 HydrophobicContact CG-CD1 4.4Å; R560-V590 HydrophobicContact CB-CG2 3.84Å
561	G	97.1	Very high	92.2	Very high	2 Å²	2	40.7 Å²	40.7	2%	0.021	22%	0.215	C	C	.	.	H	α-helix	trans	-59.3	-44.3	171.4	0	0	0	0	0	112.6	A557 E558 F559 L564 L565	A557-G561 PolarHBondContact O-N 3.47Å; E558-G561 WeakPolarHBondContact O-CA 3.37Å; E558-G561 PolarHBondContact O-N 2.97Å; E558-G561 VanDerWaalsContact O-N 3.17Å; F559-G561 VanDerWaalsContact C-N 3.3Å; G561-L564 PolarHBondContact O-N 3.28Å; G561-L565 WeakPolarHBondContact O-CB 3.38Å; G561-L565 WeakPolarHBondContact O-CG 3.31Å; G561-L565 PolarHBondContact O-N 2.64Å
562	Y	98.3	Very high	93.4	Very high	9 Å²	9	38.6 Å²	38.6	4%	0.035	20%	0.204	C	C	.	.	H	α-helix	trans	-63.9	-39.3	175.7	-63.8	-22.2	0	0	0	113.4	I506 E558 F559 L564 L565 M566 L618 V619 L622	I506-Y562 HydrophobicContact CD1-CD1 4.34Å; I506-Y562 HydrophobicContact CD1-CD2 3.46Å; I506-Y562 VanDerWaalsContact CD1-CD2 3.46Å; I506-Y562 HydrophobicContact CD1-CE2 3.73Å; I506-Y562 HydrophobicContact CD1-CG 3.81Å; E558-Y562 HydrophobicContact CG-CD2 4.33Å; E558-Y562 HydrophobicContact CG-CE1 4.26Å; E558-Y562 HydrophobicContact CG-CE2 3.58Å; E558-Y562 WeakPolarHBondContact CG-OH 3.34Å; E558-Y562 PolarHBondContact O-N 3.42Å; E558-Y562 WeakPolarHBondContact OE1-CE2 3.45Å; E558-Y562 VanDerWaalsContact OE1-CZ 3.23Å; E558-Y562 PolarHBondContact OE1-OH 3.05Å; F559-Y562 AromaticContact CD1-CD2 3.7Å; F559-Y562 HydrophobicContact CD1-CD2 3.7Å; F559-Y562 HydrophobicContact CD1-CE2 4.27Å; F559-Y562 AromaticContact CE1-CD2 3.84Å; F559-Y562 HydrophobicContact CE1-CD2 3.84Å; F559-Y562 HydrophobicContact CE1-CE2 4.02Å; F559-Y562 HydrophobicContact CG-CD2 4.3Å; F559-Y562 HydrophobicContact CZ-CE2 4.32Å; F559-Y562 PolarHBondContact O-N 2.91Å; Y562-L564 VanDerWaalsContact C-N 3.32Å; Y562-L564 PolarHBondContact O-N 2.76Å; Y562-L565 HydrophobicContact CD1-CD1 4.47Å; Y562-L565 PolarHBondContact O-N 3.43Å; Y562-M566 WeakPolarHBondContact O-CB 3.39Å; Y562-M566 VanDerWaalsContact O-CG 3.24Å; Y562-M566 WeakPolarHBondContact O-CG 3.32Å; Y562-M566 PolarHBondContact O-N 3.48Å; Y562-L618 HydrophobicContact CE1-CB 4.3Å; Y562-L618 WeakPolarHBondContact OH-CB 3.45Å; Y562-V619 HydrophobicContact CE1-CG2 3.84Å; Y562-L622 HydrophobicContact CD1-CD1 3.36Å; Y562-L622 HydrophobicContact CE1-CD1 4.17Å; Y562-L622 HydrophobicContact CG-CD1 3.73Å
563	M	96.7	Very high	93.9	Very high	26 Å²	26	38.1 Å²	38.1	13%	0.128	20%	0.201	C	C	.	.	H	α-helix	trans	-58.2	-44.5	175.3	-70.6	171.5	-159.5	0	0	111.4	L533 L536 K537 F559 R560 M566	L533-M563 HydrophobicContact CB-CE 4.33Å; L533-M563 HydrophobicContact CB-CG 4.02Å; L533-M563 HydrophobicContact CD1-CG 4.37Å; L533-M563 HydrophobicContact CD2-CE 4.45Å; L533-M563 HydrophobicContact CD2-CG 4.24Å; L533-M563 HydrophobicContact CG-CG 4.44Å; L533-M563 WeakPolarHBondContact O-CE 3.49Å; L536-M563 HydrophobicContact CB-CE 4.07Å; K537-M563 HydrophobicContact CB-CE 3.92Å; K537-M563 HydrophobicContact CB-SD 4.01Å; F559-M563 HydrophobicContact CB-CE 4.47Å; F559-M563 VanDerWaalsContact O-CG 3.28Å; F559-M563 WeakPolarHBondContact O-CG 3.34Å; F559-M563 PolarHBondContact O-N 3.39Å; R560-M563 PolarHBondContact O-N 3.23Å; M563-M566 PolarHBondContact O-N 3.34Å
564	L	96.2	Very high	93.9	Very high	8 Å²	8	37.8 Å²	37.8	4%	0.042	20%	0.198	C	C	.	.	H	α-helix	trans	-65.6	-48.4	176.2	-72.6	170.3	0	0	0	112.2	R560 G561 Y562 M566 K567 L568 I574 A577 V590 A593	R560-L564 PolarHBondContact O-N 3.06Å; G561-L564 PolarHBondContact O-N 3.28Å; Y562-L564 VanDerWaalsContact C-N 3.32Å; Y562-L564 PolarHBondContact O-N 2.76Å; L564-M566 PolarHBondContact O-N 2.91Å; L564-K567 CarbonylContact O-C 3.56Å; L564-K567 PolarHBondContact O-N 2.96Å; L564-L568 WeakPolarHBondContact O-CD2 3.44Å; L564-L568 PolarHBondContact O-N 2.97Å; L564-I574 HydrophobicContact CD2-CD1 3.93Å; L564-A577 HydrophobicContact CD1-CB 3.77Å; L564-A577 HydrophobicContact CD2-CB 3.35Å; L564-A577 HydrophobicContact CG-CB 3.99Å; L564-V590 HydrophobicContact CD1-CG1 3.95Å; L564-A593 HydrophobicContact CB-CB 3.66Å; L564-A593 HydrophobicContact CD1-CB 3.91Å; L564-A593 HydrophobicContact CG-CB 4.47Å
565	L	97.5	Very high	94	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.01	18%	0.181	C	C	.	.	H	α-helix	trans	-63.3	-23.3	179.3	-72.2	165.6	0	0	0	113.1	G561 Y562 K567 L568 A593 T596 V619 L622 M623 Y626	G561-L565 WeakPolarHBondContact O-CB 3.38Å; G561-L565 WeakPolarHBondContact O-CG 3.31Å; G561-L565 PolarHBondContact O-N 2.64Å; Y562-L565 HydrophobicContact CD1-CD1 4.47Å; Y562-L565 PolarHBondContact O-N 3.43Å; L565-K567 VanDerWaalsContact C-N 3.29Å; L565-L568 HydrophobicContact CD2-CD1 4.16Å; L565-L568 HydrophobicContact CD2-CD2 4.22Å; L565-A593 HydrophobicContact CD2-CB 4.32Å; L565-A593 HydrophobicContact CG-CB 4Å; L565-T596 HydrophobicContact CD2-CG2 4.21Å; L565-V619 HydrophobicContact CD1-CB 4.36Å; L565-V619 HydrophobicContact CD1-CG1 3.75Å; L565-V619 HydrophobicContact CD1-CG2 4.19Å; L565-L622 HydrophobicContact CB-CB 4.04Å; L565-L622 HydrophobicContact CB-CD1 3.91Å; L565-L622 HydrophobicContact CD1-CD1 4.22Å; L565-M623 HydrophobicContact CD2-CG 4.19Å; L565-Y626 VanDerWaalsContact O-CE2 3.27Å; L565-Y626 WeakPolarHBondContact O-CE2 3.32Å; L565-Y626 PolarHBondContact O-OH 2.94Å; L565-Y626 VanDerWaalsContact O-OH 3.06Å
566	M	95.7	Very high	93.7	Very high	16 Å²	16	36.9 Å²	36.9	8%	0.079	19%	0.185	C	C	.	.	H	α-helix	trans	-69.7	-26.8	174.6	-80.3	-77.5	-65.9	0	0	112.9	L529 T530 L533 Y562 M563 L564 L622 R625 Y626	L529-M566 HydrophobicContact CB-CE 4.41Å; L529-M566 HydrophobicContact CD2-CE 3.9Å; L529-M566 HydrophobicContact CD2-SD 3.4Å; L529-M566 WeakPolarHBondContact CD2-SD 3.29Å; L529-M566 HydrophobicContact CG-CE 3.97Å; L529-M566 HydrophobicContact CG-SD 3.99Å; T530-M566 WeakPolarHBondContact OG1-CE 3.38Å; L533-M566 HydrophobicContact CD1-CG 3.65Å; Y562-M566 WeakPolarHBondContact O-CB 3.39Å; Y562-M566 VanDerWaalsContact O-CG 3.24Å; Y562-M566 WeakPolarHBondContact O-CG 3.32Å; Y562-M566 PolarHBondContact O-N 3.48Å; M563-M566 PolarHBondContact O-N 3.34Å; L564-M566 PolarHBondContact O-N 2.91Å; M566-L622 HydrophobicContact CG-CD2 3.95Å; M566-L622 HydrophobicContact SD-CD2 3.53Å; M566-L622 VanDerWaalsContact SD-CD2 3.53Å; M566-R625 PolarHBondContact O-NH1 3.47Å; M566-R625 PolarHBondContact SD-NH1 3.3Å; M566-R625 PolarHBondContact SD-NH2 2.99Å; M566-Y626 VanDerWaalsContact C-OH 3.27Å; M566-Y626 PolarHBondContact O-OH 2.68Å
567	K	93.2	Very high	93.5	Very high	83 Å²	83	36.7 Å²	36.7	36%	0.361	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.2	43.4	-170.4	-66.2	-175.8	173.5	-172.2	0	112.5	L564 L565 N569 D570 E573 Y626	L564-K567 CarbonylContact O-C 3.56Å; L564-K567 PolarHBondContact O-N 2.96Å; L565-K567 VanDerWaalsContact C-N 3.29Å; K567-N569 PolarHBondContact O-N 3.36Å; K567-D570 HydrophobicContact CB-CB 4.04Å; K567-D570 WeakPolarHBondContact O-CB 3.38Å; K567-D570 PolarHBondContact O-N 2.92Å; K567-E573 HydrophobicContact CB-CG 4.13Å; K567-E573 HydrophobicContact CD-CG 3.6Å; K567-E573 WeakPolarHBondContact CD-OE1 3.35Å; K567-E573 IonicContact NZ-OE1 2.68Å; K567-E573 PolarHBondContact NZ-OE1 2.75Å; K567-Y626 PolarHBondContact N-OH 2.92Å
568	L	93	Very high	93.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-21.6	-178.4	-66.6	179.5	0	0	0	115.2	L564 L565 T596 H597 L600 Y626	L564-L568 WeakPolarHBondContact O-CD2 3.44Å; L564-L568 PolarHBondContact O-N 2.97Å; L565-L568 HydrophobicContact CD2-CD1 4.16Å; L565-L568 HydrophobicContact CD2-CD2 4.22Å; L568-T596 HydrophobicContact CD1-CG2 3.62Å; L568-H597 HydrophobicContact CD2-CB 3.94Å; L568-H597 PolarHBondContact O-CE1 3.44Å; L568-H597 PolarHBondContact O-ND1 2.9Å; L568-L600 HydrophobicContact CB-CD2 3.54Å; L568-L600 HydrophobicContact CD1-CD2 4.29Å; L568-Y626 HydrophobicContact CB-CE1 4.13Å; L568-Y626 HydrophobicContact CB-CE2 4.12Å; L568-Y626 HydrophobicContact CD1-CD2 3.85Å; L568-Y626 HydrophobicContact CD1-CE2 3.54Å; L568-Y626 HydrophobicContact CG-CE2 3.86Å; L568-Y626 PolarHBondContact N-OH 2.99Å
569	N	91.9	Very high	92.9	Very high	95 Å²	95	47.3 Å²	47.3	51%	0.508	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-5.1	176.2	-68	-39.6	0	0	0	113.2	K567 L600 Q629	K567-N569 PolarHBondContact O-N 3.36Å; N569-L600 WeakPolarHBondContact OD1-CD2 3.44Å; N569-Q629 PolarHBondContact ND2-OE1 3.16Å; N569-Q629 PolarHBondContact OD1-NE2 2.87Å
570	D	91.4	Very high	92.5	Very high	52 Å²	52	48.7 Å²	48.7	28%	0.278	23%	0.231	S	C	.	.			trans	-97.1	104.2	-177.9	-169.9	-14.9	0	0	0	110.4	K567 N572 E573 I574	K567-D570 HydrophobicContact CB-CB 4.04Å; K567-D570 WeakPolarHBondContact O-CB 3.38Å; K567-D570 PolarHBondContact O-N 2.92Å; D570-N572 PolarHBondContact O-N 3.45Å; D570-N572 WeakPolarHBondContact OD1-CB 3.49Å; D570-N572 PolarHBondContact OD1-N 2.95Å; D570-N572 PolarHBondContact OD1-ND2 3.03Å; D570-E573 HydrophobicContact CB-CB 4.44Å; D570-E573 HydrophobicContact CB-CG 4.08Å; D570-E573 PolarHBondContact O-N 3.36Å; D570-I574 PolarHBondContact O-N 3.41Å
571	Q	88.4	Confident	92.2	Very high	95 Å²	95	50.3 Å²	50.3	44%	0.444	24%	0.244	S	C	.	.	H	α-helix	trans	-61.5	-27.9	-179.3	-168.4	59.1	41.2	0	0	112.3	I574 N575	Q571-I574 PolarHBondContact O-N 3.43Å; Q571-N575 PolarHBondContact NE2-OD1 3.1Å; Q571-N575 VanDerWaalsContact NE2-OD1 3.1Å; Q571-N575 PolarHBondContact O-N 3.25Å; Q571-N575 PolarHBondContact O-ND2 3.05Å; Q571-N575 PolarHBondContact O-OD1 2.86Å
572	N	89.8	Confident	91.9	Very high	112 Å²	112	54.6 Å²	54.6	60%	0.599	26%	0.263	S	S	*	.	H	α-helix	trans	-67	-40.8	-180	-62.3	-45.5	0	0	0	111.4	D570 I574 N575 E576	D570-N572 PolarHBondContact O-N 3.45Å; D570-N572 WeakPolarHBondContact OD1-CB 3.49Å; D570-N572 PolarHBondContact OD1-N 2.95Å; D570-N572 PolarHBondContact OD1-ND2 3.03Å; N572-I574 VanDerWaalsContact C-N 3.3Å; N572-I574 PolarHBondContact O-N 3.2Å; N572-N575 PolarHBondContact O-N 2.89Å; N572-E576 WeakPolarHBondContact O-CG 3.47Å; N572-E576 PolarHBondContact O-N 3.03Å
573	E	88.4	Confident	91.5	Very high	42 Å²	42	57.8 Å²	57.8	20%	0.196	28%	0.275	C	S	.	.	H	α-helix	trans	-68.1	-33.1	179.4	-63.6	-75.7	-177.3	0	0	111.8	K567 D570 A577	K567-E573 HydrophobicContact CB-CG 4.13Å; K567-E573 HydrophobicContact CD-CG 3.6Å; K567-E573 WeakPolarHBondContact CD-OE1 3.35Å; K567-E573 IonicContact NZ-OE1 2.68Å; K567-E573 PolarHBondContact NZ-OE1 2.75Å; D570-E573 HydrophobicContact CB-CB 4.44Å; D570-E573 HydrophobicContact CB-CG 4.08Å; D570-E573 PolarHBondContact O-N 3.36Å; E573-A577 WeakPolarHBondContact O-CB 3.22Å; E573-A577 PolarHBondContact O-N 3.26Å
574	I	89.9	Confident	91.3	Very high	4 Å²	4	56.8 Å²	56.8	2%	0.021	27%	0.27	C	S	.	.	H	α-helix	trans	-66.7	-44	173.6	-61.9	-68.7	0	0	0	110.4	L564 D570 Q571 N572 A577 Q578 F594 H597	L564-I574 HydrophobicContact CD2-CD1 3.93Å; D570-I574 PolarHBondContact O-N 3.41Å; Q571-I574 PolarHBondContact O-N 3.43Å; N572-I574 VanDerWaalsContact C-N 3.3Å; N572-I574 PolarHBondContact O-N 3.2Å; I574-A577 PolarHBondContact O-N 3.39Å; I574-Q578 WeakPolarHBondContact O-CG 3.22Å; I574-Q578 PolarHBondContact O-N 3.28Å; I574-Q578 VanDerWaalsContact O-N 3.11Å; I574-F594 HydrophobicContact CD1-CD1 4.48Å; I574-F594 HydrophobicContact CG2-CD1 4.38Å; I574-F594 HydrophobicContact CG2-CE1 4.07Å; I574-H597 HydrophobicContact CD1-CB 3.85Å
575	N	91	Very high	91.2	Very high	58 Å²	58	60.7 Å²	60.7	31%	0.31	28%	0.284	S	S	.	.	H	α-helix	trans	-64.9	-40.5	176.7	-63.9	-11.6	0	0	0	111.6	Q571 N572 A577 Q578	Q571-N575 PolarHBondContact NE2-OD1 3.1Å; Q571-N575 VanDerWaalsContact NE2-OD1 3.1Å; Q571-N575 PolarHBondContact O-N 3.25Å; Q571-N575 PolarHBondContact O-ND2 3.05Å; Q571-N575 PolarHBondContact O-OD1 2.86Å; N572-N575 PolarHBondContact O-N 2.89Å; N575-A577 VanDerWaalsContact C-N 3.34Å; N575-A577 PolarHBondContact O-N 3.35Å; N575-Q578 WeakPolarHBondContact O-CB 3.31Å; N575-Q578 PolarHBondContact O-N 3.18Å
576	E	89.3	Confident	91	Very high	81 Å²	81	65.1 Å²	65.1	38%	0.379	31%	0.305	S	S	.	.	H	α-helix	trans	-63.3	-39.3	172.8	-72	-56.7	136.6	0	0	111.7	N572 Q578 R579	N572-E576 WeakPolarHBondContact O-CG 3.47Å; N572-E576 PolarHBondContact O-N 3.03Å; E576-Q578 PolarHBondContact O-N 2.88Å; E576-R579 VanDerWaalsContact CD-NH1 3.3Å; E576-R579 WeakPolarHBondContact O-CB 3.48Å; E576-R579 PolarHBondContact O-N 3.41Å; E576-R579 IonicContact OE1-CZ 3.36Å; E576-R579 IonicContact OE1-NH1 3.61Å; E576-R579 PolarHBondContact OE1-NH1 3.46Å; E576-R579 IonicContact OE1-NH2 2.72Å; E576-R579 IonicContact OE2-NH1 3.67Å; E576-R579 PolarHBondContact OE2-NH1 3.06Å
577	A	89.4	Confident	91	Very high	5 Å²	5	65.3 Å²	65.3	4%	0.041	31%	0.308	C	S	.	.	H	α-helix	trans	-65.6	-26.3	176.5	0	0	0	0	0	113.5	L564 E573 I574 N575 R579 L580 F594	L564-A577 HydrophobicContact CD1-CB 3.77Å; L564-A577 HydrophobicContact CD2-CB 3.35Å; L564-A577 HydrophobicContact CG-CB 3.99Å; E573-A577 WeakPolarHBondContact O-CB 3.22Å; E573-A577 PolarHBondContact O-N 3.26Å; I574-A577 PolarHBondContact O-N 3.39Å; N575-A577 VanDerWaalsContact C-N 3.34Å; N575-A577 PolarHBondContact O-N 3.35Å; A577-R579 PolarHBondContact O-N 2.84Å; A577-L580 HydrophobicContact CB-CD1 4.13Å; A577-L580 WeakPolarHBondContact O-CB 3.42Å; A577-L580 WeakPolarHBondContact O-CG 3.14Å; A577-L580 PolarHBondContact O-N 3.1Å; A577-F594 HydrophobicContact CB-CE1 4.11Å; A577-F594 HydrophobicContact CB-CZ 3.79Å
578	Q	90	Very high	91.2	Very high	104 Å²	104	70.1 Å²	70.1	49%	0.486	33%	0.329	S	S	.	.	H	α-helix	trans	-67.7	-18.8	171.7	-68.1	175.9	-11	0	0	112.8	I574 N575 E576 R585 F594	I574-Q578 WeakPolarHBondContact O-CG 3.22Å; I574-Q578 PolarHBondContact O-N 3.28Å; I574-Q578 VanDerWaalsContact O-N 3.11Å; N575-Q578 WeakPolarHBondContact O-CB 3.31Å; N575-Q578 PolarHBondContact O-N 3.18Å; E576-Q578 PolarHBondContact O-N 2.88Å; Q578-R585 VanDerWaalsContact O-CD 3.24Å; Q578-R585 WeakPolarHBondContact O-CD 2.72Å; Q578-R585 PolarHBondContact O-NH1 3.48Å; Q578-F594 HydrophobicContact CG-CZ 4.44Å
579	R	90.2	Very high	91.4	Very high	180 Å²	180	72.2 Å²	72.2	68%	0.679	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	-4.3	175.3	-58.4	-179.2	-175.2	150.2	6.2	113.7	E576 A577	E576-R579 VanDerWaalsContact CD-NH1 3.3Å; E576-R579 WeakPolarHBondContact O-CB 3.48Å; E576-R579 PolarHBondContact O-N 3.41Å; E576-R579 IonicContact OE1-CZ 3.36Å; E576-R579 IonicContact OE1-NH1 3.61Å; E576-R579 PolarHBondContact OE1-NH1 3.46Å; E576-R579 IonicContact OE1-NH2 2.72Å; E576-R579 IonicContact OE2-NH1 3.67Å; E576-R579 PolarHBondContact OE2-NH1 3.06Å; A577-R579 PolarHBondContact O-N 2.84Å
580	L	90.3	Very high	91.6	Very high	30 Å²	30	67.7 Å²	67.7	16%	0.157	32%	0.318	C	S	.	.	S	Bend	trans	-61.9	150.9	174.4	-67.6	170.1	0	0	0	110.7	R560 A577 L584 R585	R560-L580 HydrophobicContact CB-CD1 4.38Å; R560-L580 HydrophobicContact CG-CD1 4.44Å; A577-L580 HydrophobicContact CB-CD1 4.13Å; A577-L580 WeakPolarHBondContact O-CB 3.42Å; A577-L580 WeakPolarHBondContact O-CG 3.14Å; A577-L580 PolarHBondContact O-N 3.1Å; L580-L584 HydrophobicContact CB-CB 4.25Å; L580-L584 HydrophobicContact CD2-CD1 4.37Å; L580-R585 HydrophobicContact CB-CG 3.94Å; L580-R585 VanDerWaalsContact O-CD 3.23Å; L580-R585 WeakPolarHBondContact O-CD 3.18Å; L580-R585 VanDerWaalsContact O-CG 3.29Å; L580-R585 WeakPolarHBondContact O-CG 3.32Å; L580-R585 PolarHBondContact O-NE 3.33Å
581	P	89.5	Confident	91.9	Very high	53 Å²	53	71.9 Å²	71.9	34%	0.344	33%	0.33	S	S	.	.			trans	-50.3	145.9	171	-28.4	33.6	0	0	0	112.6	R583 L584 R585	P581-R583 HydrophobicContact CB-CG 4.23Å; P581-R583 PolarHBondContact O-N 2.86Å; P581-R583 VanDerWaalsContact O-N 3.12Å; P581-L584 PolarHBondContact O-N 3.22Å; P581-R585 PolarHBondContact O-N 2.62Å
582	E	89.5	Confident	92.4	Very high	91 Å²	91	69.1 Å²	69.1	43%	0.425	32%	0.317	S	S	.	.	H	α-helix	trans	-54.7	-38.2	-175.3	-175.4	61.2	-172.1	0	0	112.8	L584 R585 Q586	E582-L584 VanDerWaalsContact C-N 3.25Å; E582-L584 PolarHBondContact O-N 3.37Å; E582-R585 PolarHBondContact O-N 3.24Å; E582-R585 IonicContact OE2-CZ 2.84Å; E582-R585 IonicContact OE2-NE 3.19Å; E582-R585 PolarHBondContact OE2-NE 2.87Å; E582-R585 IonicContact OE2-NH2 3.13Å; E582-R585 PolarHBondContact OE2-NH2 2.93Å; E582-Q586 HydrophobicContact CG-CG 4.13Å; E582-Q586 WeakPolarHBondContact O-CB 3.17Å; E582-Q586 WeakPolarHBondContact O-CG 3.3Å; E582-Q586 PolarHBondContact O-N 2.81Å; E582-Q586 WeakPolarHBondContact OE1-CG 3.31Å; E582-Q586 PolarHBondContact OE1-NE2 3.45Å
583	R	89.8	Confident	92.8	Very high	77 Å²	77	63.8 Å²	63.8	29%	0.291	29%	0.288	S	S	.	.	H	α-helix	trans	-54.5	-40.3	175	74.3	178.1	-179	85.2	7.4	112.7	S549 E550 E556 P581 S587	S549-R583 PolarHBondContact OG-NH2 2.82Å; E550-R583 WeakPolarHBondContact OE1-CD 3.14Å; E556-R583 IonicContact OE2-CZ 2.64Å; E556-R583 IonicContact OE2-NH1 2.69Å; E556-R583 IonicContact OE2-NH2 3.18Å; E556-R583 PolarHBondContact OE2-NH2 2.95Å; P581-R583 HydrophobicContact CB-CG 4.23Å; P581-R583 PolarHBondContact O-N 2.86Å; P581-R583 VanDerWaalsContact O-N 3.12Å; R583-S587 PolarHBondContact O-N 3.49Å
584	L	92.2	Very high	93.2	Very high	4 Å²	4	64.1 Å²	64.1	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-80.4	-39.9	-179.8	-66.4	179.2	0	0	0	110.7	E556 A557 R560 L580 P581 E582 Q586 S587 V590	E556-L584 HydrophobicContact CB-CD2 4.38Å; E556-L584 VanDerWaalsContact CD-CD1 3.49Å; E556-L584 HydrophobicContact CG-CD1 4.09Å; E556-L584 HydrophobicContact CG-CD2 4.04Å; E556-L584 VanDerWaalsContact OE1-CD1 3.31Å; E556-L584 WeakPolarHBondContact OE1-CD1 3.33Å; A557-L584 HydrophobicContact CB-CD2 4.17Å; R560-L584 HydrophobicContact CG-CD1 4.4Å; L580-L584 HydrophobicContact CB-CB 4.25Å; L580-L584 HydrophobicContact CD2-CD1 4.37Å; P581-L584 PolarHBondContact O-N 3.22Å; E582-L584 VanDerWaalsContact C-N 3.25Å; E582-L584 PolarHBondContact O-N 3.37Å; L584-Q586 VanDerWaalsContact C-N 3.29Å; L584-Q586 PolarHBondContact O-N 3.19Å; L584-S587 VanDerWaalsContact O-CB 3.28Å; L584-S587 WeakPolarHBondContact O-CB 3.34Å; L584-S587 PolarHBondContact O-N 2.84Å; L584-S587 VanDerWaalsContact O-N 3.14Å; L584-S587 PolarHBondContact O-OG 3.27Å; L584-V590 VanDerWaalsContact O-CB 3.29Å; L584-V590 WeakPolarHBondContact O-CB 3.41Å; L584-V590 WeakPolarHBondContact O-CG2 3.44Å
585	R	94.2	Very high	93.5	Very high	91 Å²	91	64.9 Å²	64.9	34%	0.343	30%	0.296	S	S	.	.	H	α-helix	trans	-61	-38.6	176.7	-64.3	-167.6	-55.5	-176.8	-1.7	112.5	Q578 L580 P581 E582 S587 R591	Q578-R585 VanDerWaalsContact O-CD 3.24Å; Q578-R585 WeakPolarHBondContact O-CD 2.72Å; Q578-R585 PolarHBondContact O-NH1 3.48Å; L580-R585 HydrophobicContact CB-CG 3.94Å; L580-R585 VanDerWaalsContact O-CD 3.23Å; L580-R585 WeakPolarHBondContact O-CD 3.18Å; L580-R585 VanDerWaalsContact O-CG 3.29Å; L580-R585 WeakPolarHBondContact O-CG 3.32Å; L580-R585 PolarHBondContact O-NE 3.33Å; P581-R585 PolarHBondContact O-N 2.62Å; E582-R585 PolarHBondContact O-N 3.24Å; E582-R585 IonicContact OE2-CZ 2.84Å; E582-R585 IonicContact OE2-NE 3.19Å; E582-R585 PolarHBondContact OE2-NE 2.87Å; E582-R585 IonicContact OE2-NH2 3.13Å; E582-R585 PolarHBondContact OE2-NH2 2.93Å; R585-S587 VanDerWaalsContact C-N 3.32Å; R585-R591 VanDerWaalsContact O-CG 3.3Å; R585-R591 WeakPolarHBondContact O-CG 3.44Å
586	Q	94.8	Very high	93.8	Very high	95 Å²	95	62.1 Å²	62.1	44%	0.444	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-7.4	178.6	-61.6	-57.7	-18.3	0	0	113.9	E582 L584 R591	E582-Q586 HydrophobicContact CG-CG 4.13Å; E582-Q586 WeakPolarHBondContact O-CB 3.17Å; E582-Q586 WeakPolarHBondContact O-CG 3.3Å; E582-Q586 PolarHBondContact O-N 2.81Å; E582-Q586 WeakPolarHBondContact OE1-CG 3.31Å; E582-Q586 PolarHBondContact OE1-NE2 3.45Å; L584-Q586 VanDerWaalsContact C-N 3.29Å; L584-Q586 PolarHBondContact O-N 3.19Å; Q586-R591 WeakPolarHBondContact O-CD 3.33Å
587	S	95.8	Very high	94.2	Very high	20 Å²	20	58.9 Å²	58.9	14%	0.14	27%	0.266	C	S	.	.	S	Bend	trans	-63.2	143.2	177.9	76.1	0	0	0	0	111.7	A557 R583 L584 R585 P589 V590 R591	A557-S587 WeakPolarHBondContact CB-OG 3.46Å; R583-S587 PolarHBondContact O-N 3.49Å; L584-S587 VanDerWaalsContact O-CB 3.28Å; L584-S587 WeakPolarHBondContact O-CB 3.34Å; L584-S587 PolarHBondContact O-N 2.84Å; L584-S587 VanDerWaalsContact O-N 3.14Å; L584-S587 PolarHBondContact O-OG 3.27Å; R585-S587 VanDerWaalsContact C-N 3.32Å; S587-P589 VanDerWaalsContact C-CD 3.47Å; S587-V590 PolarHBondContact O-N 2.8Å; S587-V590 WeakPolarHBondContact OG-CG2 3.33Å; S587-R591 WeakPolarHBondContact O-CB 3.5Å; S587-R591 WeakPolarHBondContact O-CG 3.45Å; S587-R591 PolarHBondContact O-N 3.49Å
588	K	97	Very high	94.5	Very high	183 Å²	183	62.7 Å²	62.7	80%	0.796	28%	0.283	S	S	*	.	H	α-helix	trans	-53.2	-44.4	-179	-176.3	-179.5	179.1	-178.4	0	113.4	F592	K588-F592 VanDerWaalsContact O-CB 3.28Å; K588-F592 WeakPolarHBondContact O-CB 3.45Å; K588-F592 PolarHBondContact O-N 3.17Å
589	P	97	Very high	94.8	Very high	44 Å²	44	57.8 Å²	57.8	29%	0.286	26%	0.26	S	S	.	.	H	α-helix	trans	-65.2	-41.2	-179.5	-20.5	33.3	0	0	0	113.4	A557 S587 F592 A593	A557-P589 HydrophobicContact CB-CG 4.36Å; A557-P589 WeakPolarHBondContact O-CB 3.26Å; S587-P589 VanDerWaalsContact C-CD 3.47Å; P589-F592 PolarHBondContact O-N 3.24Å; P589-A593 PolarHBondContact O-N 3.43Å
590	V	96.7	Very high	95	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-71.5	-43.8	-180	174.8	0	0	0	0	111	R560 L564 L584 S587 F592 A593 F594	R560-V590 HydrophobicContact CB-CG2 3.84Å; L564-V590 HydrophobicContact CD1-CG1 3.95Å; L584-V590 VanDerWaalsContact O-CB 3.29Å; L584-V590 WeakPolarHBondContact O-CB 3.41Å; L584-V590 WeakPolarHBondContact O-CG2 3.44Å; S587-V590 PolarHBondContact O-N 2.8Å; S587-V590 WeakPolarHBondContact OG-CG2 3.33Å; V590-F592 VanDerWaalsContact C-N 3.27Å; V590-F592 PolarHBondContact O-N 2.91Å; V590-A593 WeakPolarHBondContact O-CB 3.08Å; V590-A593 PolarHBondContact O-N 3.5Å; V590-A593 VanDerWaalsContact O-N 3.09Å; V590-F594 HydrophobicContact CG1-CD2 3.93Å; V590-F594 HydrophobicContact CG1-CE2 3.53Å; V590-F594 HydrophobicContact CG1-CZ 4.32Å; V590-F594 WeakPolarHBondContact O-CD2 3.42Å; V590-F594 PolarHBondContact O-N 3.47Å
591	R	97.5	Very high	95.1	Very high	140 Å²	140	52.8 Å²	52.8	53%	0.528	25%	0.246	S	C	.	.	H	α-helix	trans	-59.1	-38.8	173.2	-70.7	-176.1	63	90.2	5.9	112.3	R585 Q586 S587 F594 A595	R585-R591 VanDerWaalsContact O-CG 3.3Å; R585-R591 WeakPolarHBondContact O-CG 3.44Å; Q586-R591 WeakPolarHBondContact O-CD 3.33Å; S587-R591 WeakPolarHBondContact O-CB 3.5Å; S587-R591 WeakPolarHBondContact O-CG 3.45Å; S587-R591 PolarHBondContact O-N 3.49Å; R591-F594 PolarHBondContact O-N 3.02Å; R591-A595 WeakPolarHBondContact O-CB 3.06Å; R591-A595 PolarHBondContact O-N 3.46Å
592	F	98.3	Very high	95.3	Very high	38 Å²	38	53.7 Å²	53.7	17%	0.167	25%	0.251	C	S	.	.	H	α-helix	trans	-63.6	-41.9	175	-174.3	-81.9	0	0	0	111.6	K588 P589 V590 A595 T596 L611 A615 V619 M623	K588-F592 VanDerWaalsContact O-CB 3.28Å; K588-F592 WeakPolarHBondContact O-CB 3.45Å; K588-F592 PolarHBondContact O-N 3.17Å; P589-F592 PolarHBondContact O-N 3.24Å; V590-F592 VanDerWaalsContact C-N 3.27Å; V590-F592 PolarHBondContact O-N 2.91Å; F592-A595 PolarHBondContact O-N 3.21Å; F592-T596 WeakPolarHBondContact CE1-OG1 3.32Å; F592-T596 WeakPolarHBondContact O-CB 3.29Å; F592-T596 PolarHBondContact O-N 2.79Å; F592-T596 PolarHBondContact O-OG1 3.19Å; F592-L611 HydrophobicContact CD2-CD2 4.37Å; F592-L611 HydrophobicContact CE2-CB 4.27Å; F592-L611 HydrophobicContact CE2-CD2 3.89Å; F592-L611 HydrophobicContact CZ-CB 3.94Å; F592-L611 HydrophobicContact CZ-CD2 4.37Å; F592-L611 WeakPolarHBondContact CZ-O 3.49Å; F592-A615 HydrophobicContact CE1-CB 4.31Å; F592-A615 HydrophobicContact CZ-CB 3.82Å; F592-V619 HydrophobicContact CD1-CG1 3.76Å; F592-V619 HydrophobicContact CE1-CG1 3.31Å; F592-V619 HydrophobicContact CZ-CG1 4.08Å; F592-M623 HydrophobicContact CE1-SD 3.76Å; F592-M623 HydrophobicContact CZ-SD 4.03Å
593	A	97.7	Very high	95.5	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-62.5	-43.9	175.5	0	0	0	0	0	111.9	L564 L565 P589 V590 T596 H597	L564-A593 HydrophobicContact CB-CB 3.66Å; L564-A593 HydrophobicContact CD1-CB 3.91Å; L564-A593 HydrophobicContact CG-CB 4.47Å; L565-A593 HydrophobicContact CD2-CB 4.32Å; L565-A593 HydrophobicContact CG-CB 4Å; P589-A593 PolarHBondContact O-N 3.43Å; V590-A593 WeakPolarHBondContact O-CB 3.08Å; V590-A593 PolarHBondContact O-N 3.5Å; V590-A593 VanDerWaalsContact O-N 3.09Å; A593-T596 WeakPolarHBondContact O-CB 3.11Å; A593-T596 PolarHBondContact O-N 3.36Å; A593-H597 PolarHBondContact O-N 3.35Å
594	F	96.5	Very high	95.7	Very high	48 Å²	48	50.1 Å²	50.1	21%	0.211	24%	0.241	C	C	.	.	H	α-helix	trans	-60.8	-45.3	173.7	-74.6	-52.3	0	0	0	112.6	I574 A577 Q578 V590 R591 T596 H597 E598	I574-F594 HydrophobicContact CD1-CD1 4.48Å; I574-F594 HydrophobicContact CG2-CD1 4.38Å; I574-F594 HydrophobicContact CG2-CE1 4.07Å; A577-F594 HydrophobicContact CB-CE1 4.11Å; A577-F594 HydrophobicContact CB-CZ 3.79Å; Q578-F594 HydrophobicContact CG-CZ 4.44Å; V590-F594 HydrophobicContact CG1-CD2 3.93Å; V590-F594 HydrophobicContact CG1-CE2 3.53Å; V590-F594 HydrophobicContact CG1-CZ 4.32Å; V590-F594 WeakPolarHBondContact O-CD2 3.42Å; V590-F594 PolarHBondContact O-N 3.47Å; R591-F594 PolarHBondContact O-N 3.02Å; F594-T596 PolarHBondContact O-N 2.88Å; F594-H597 PolarHBondContact O-N 3.45Å; F594-E598 WeakPolarHBondContact O-CB 3.44Å; F594-E598 PolarHBondContact O-N 2.79Å
595	A	97.6	Very high	95.9	Very high	21 Å²	21	51.8 Å²	51.8	17%	0.174	25%	0.247	C	C	.	.	H	α-helix	trans	-62.5	-32.3	176.8	0	0	0	0	0	112.5	R591 F592 A599 L611	R591-A595 WeakPolarHBondContact O-CB 3.06Å; R591-A595 PolarHBondContact O-N 3.46Å; F592-A595 PolarHBondContact O-N 3.21Å; A595-A599 WeakPolarHBondContact O-CB 3.32Å; A595-A599 PolarHBondContact O-N 3Å; A595-A599 VanDerWaalsContact O-N 3.14Å; A595-L611 HydrophobicContact CB-CD1 4.16Å; A595-L611 WeakPolarHBondContact O-CD1 3.46Å
596	T	97.7	Very high	96.1	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-73.8	-43	176.4	-54.1	0	0	0	0	111.3	L565 L568 F592 A593 F594 A599 L600 F608 M623	L565-T596 HydrophobicContact CD2-CG2 4.21Å; L568-T596 HydrophobicContact CD1-CG2 3.62Å; F592-T596 WeakPolarHBondContact CE1-OG1 3.32Å; F592-T596 WeakPolarHBondContact O-CB 3.29Å; F592-T596 PolarHBondContact O-N 2.79Å; F592-T596 PolarHBondContact O-OG1 3.19Å; A593-T596 WeakPolarHBondContact O-CB 3.11Å; A593-T596 PolarHBondContact O-N 3.36Å; F594-T596 PolarHBondContact O-N 2.88Å; T596-A599 PolarHBondContact O-N 3.46Å; T596-L600 WeakPolarHBondContact O-CB 3.3Å; T596-L600 PolarHBondContact O-N 3.47Å; T596-F608 HydrophobicContact CG2-CD2 3.86Å; T596-F608 HydrophobicContact CG2-CE2 3.53Å; T596-F608 HydrophobicContact CG2-CZ 4.48Å; T596-M623 HydrophobicContact CG2-CE 3.63Å; T596-M623 HydrophobicContact CG2-CG 4.32Å; T596-M623 HydrophobicContact CG2-SD 4.26Å
597	H	96.1	Very high	96.2	Very high	12 Å²	12	49.1 Å²	49.1	6%	0.056	24%	0.237	C	C	.	.	H	α-helix	trans	-57.8	-48.6	172.3	173.7	69.1	0	0	0	111	L568 I574 A593 F594 A599 L600 I601	L568-H597 HydrophobicContact CD2-CB 3.94Å; L568-H597 PolarHBondContact O-CE1 3.44Å; L568-H597 PolarHBondContact O-ND1 2.9Å; I574-H597 HydrophobicContact CD1-CB 3.85Å; A593-H597 PolarHBondContact O-N 3.35Å; F594-H597 PolarHBondContact O-N 3.45Å; H597-A599 VanDerWaalsContact C-N 3.32Å; H597-A599 PolarHBondContact O-N 2.91Å; H597-L600 WeakPolarHBondContact O-CB 3.36Å; H597-L600 PolarHBondContact O-N 3.32Å; H597-I601 WeakPolarHBondContact CE1-CG2 3.23Å; H597-I601 WeakPolarHBondContact O-CG1 3.46Å; H597-I601 PolarHBondContact O-N 3.48Å
598	E	95.8	Very high	96.3	Very high	85 Å²	85	48.1 Å²	48.1	40%	0.397	23%	0.23	S	C	.	.	H	α-helix	trans	-56.7	-44.6	176.7	-169.2	-162.1	153.2	0	0	111.7	F594 L600 I601 T602 R607	F594-E598 WeakPolarHBondContact O-CB 3.44Å; F594-E598 PolarHBondContact O-N 2.79Å; E598-L600 VanDerWaalsContact C-N 3.3Å; E598-L600 PolarHBondContact O-N 2.9Å; E598-I601 WeakPolarHBondContact O-CG1 3.3Å; E598-T602 WeakPolarHBondContact O-CB 3.47Å; E598-T602 WeakPolarHBondContact O-CG2 3.39Å; E598-T602 PolarHBondContact O-N 3.5Å; E598-T602 PolarHBondContact O-OG1 3.42Å; E598-R607 IonicContact OE1-CZ 3.51Å; E598-R607 IonicContact OE1-NH1 3.56Å; E598-R607 PolarHBondContact OE1-NH1 2.93Å; E598-R607 IonicContact OE1-NH2 3.85Å; E598-R607 IonicContact OE2-CZ 3.51Å; E598-R607 IonicContact OE2-NH1 3.22Å; E598-R607 PolarHBondContact OE2-NH1 3.48Å; E598-R607 IonicContact OE2-NH2 2.78Å; E598-R607 PolarHBondContact OE2-NH2 3.28Å
599	A	97.1	Very high	96.3	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.008	19%	0.192	C	C	.	.	H	α-helix	trans	-65.1	-33	177.5	0	0	0	0	0	112.9	A595 T596 H597 N603 N604 R607 F608 L611	A595-A599 WeakPolarHBondContact O-CB 3.32Å; A595-A599 PolarHBondContact O-N 3Å; A595-A599 VanDerWaalsContact O-N 3.14Å; T596-A599 PolarHBondContact O-N 3.46Å; H597-A599 VanDerWaalsContact C-N 3.32Å; H597-A599 PolarHBondContact O-N 2.91Å; A599-N603 PolarHBondContact O-N 3.45Å; A599-N604 PolarHBondContact O-N 3.5Å; A599-R607 HydrophobicContact CB-CB 4.21Å; A599-R607 HydrophobicContact CB-CG 4.02Å; A599-F608 HydrophobicContact CB-CB 4.08Å; A599-L611 HydrophobicContact CB-CD1 4.25Å
600	L	94.9	Very high	96.4	Very high	5 Å²	5	43.7 Å²	43.7	3%	0.026	20%	0.203	C	C	.	.	H	α-helix	trans	-71.7	-52.4	177.3	-176.9	68.7	0	0	0	111.5	L568 N569 T596 H597 E598 T602 N603 Y626 I630	L568-L600 HydrophobicContact CB-CD2 3.54Å; L568-L600 HydrophobicContact CD1-CD2 4.29Å; N569-L600 WeakPolarHBondContact OD1-CD2 3.44Å; T596-L600 WeakPolarHBondContact O-CB 3.3Å; T596-L600 PolarHBondContact O-N 3.47Å; H597-L600 WeakPolarHBondContact O-CB 3.36Å; H597-L600 PolarHBondContact O-N 3.32Å; E598-L600 VanDerWaalsContact C-N 3.3Å; E598-L600 PolarHBondContact O-N 2.9Å; L600-T602 PolarHBondContact O-N 2.92Å; L600-N603 WeakPolarHBondContact O-CA 3.31Å; L600-N603 PolarHBondContact O-N 3.24Å; L600-Y626 HydrophobicContact CD2-CD1 4.21Å; L600-Y626 HydrophobicContact CD2-CE1 4.42Å; L600-I630 HydrophobicContact CD1-CD1 3.57Å; L600-I630 HydrophobicContact CD1-CG1 3.51Å
601	I	92.7	Very high	96.5	Very high	100 Å²	100	44.5 Å²	44.5	51%	0.513	21%	0.207	S	C	.	.	H	α-helix	trans	-67.5	-36.3	-176.9	66.3	178.8	0	0	0	112.4	H597 E598 N603	H597-I601 WeakPolarHBondContact CE1-CG2 3.23Å; H597-I601 WeakPolarHBondContact O-CG1 3.46Å; H597-I601 PolarHBondContact O-N 3.48Å; E598-I601 WeakPolarHBondContact O-CG1 3.3Å; I601-N603 PolarHBondContact O-N 3.27Å
602	T	93.5	Very high	96.5	Very high	72 Å²	72	37.9 Å²	37.9	44%	0.442	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.2	-4.8	174.6	59.2	0	0	0	0	112.1	E598 L600 N604 K637	E598-T602 WeakPolarHBondContact O-CB 3.47Å; E598-T602 WeakPolarHBondContact O-CG2 3.39Å; E598-T602 PolarHBondContact O-N 3.5Å; E598-T602 PolarHBondContact O-OG1 3.42Å; L600-T602 PolarHBondContact O-N 2.92Å; T602-N604 PolarHBondContact O-N 2.91Å; T602-K637 PolarHBondContact O-NZ 3.3Å
603	N	92.2	Very high	96.4	Very high	28 Å²	28	41.3 Å²	41.3	15%	0.15	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	50.1	-174.4	179.8	10.4	0	0	0	110.4	A599 L600 I601 K637	A599-N603 PolarHBondContact O-N 3.45Å; L600-N603 WeakPolarHBondContact O-CA 3.31Å; L600-N603 PolarHBondContact O-N 3.24Å; I601-N603 PolarHBondContact O-N 3.27Å; N603-K637 VanDerWaalsContact CB-NZ 3.31Å; N603-K637 VanDerWaalsContact ND2-CD 3.32Å; N603-K637 WeakPolarHBondContact ND2-CD 3.45Å; N603-K637 WeakPolarHBondContact ND2-CE 3.47Å; N603-K637 PolarHBondContact ND2-NZ 3.24Å; N603-K637 PolarHBondContact O-NZ 3.28Å
604	N	95.5	Very high	96.3	Very high	66 Å²	66	47.6 Å²	47.6	35%	0.353	22%	0.223	S	C	.	.			trans	-97.1	75	173.9	-172.1	-24.4	0	0	0	108.5	A599 T602 I606 R607 F608	A599-N604 PolarHBondContact O-N 3.5Å; T602-N604 PolarHBondContact O-N 2.91Å; N604-I606 PolarHBondContact O-N 2.96Å; N604-R607 HydrophobicContact CB-CB 4.11Å; N604-R607 VanDerWaalsContact CG-CB 3.43Å; N604-R607 PolarHBondContact O-N 2.92Å; N604-R607 VanDerWaalsContact O-N 3.07Å; N604-R607 VanDerWaalsContact OD1-CB 3.28Å; N604-R607 WeakPolarHBondContact OD1-CB 3.28Å; N604-R607 PolarHBondContact OD1-N 3.37Å; N604-F608 PolarHBondContact O-N 3.41Å
605	Y	96.2	Very high	96.4	Very high	39 Å²	39	45.7 Å²	45.7	15%	0.153	22%	0.217	C	C	.	.	H	α-helix	trans	-57.2	-35	-176.6	52.9	-95.6	0	0	0	112.8	F608 F609 A634 L638 L661	Y605-F608 PolarHBondContact O-N 3.25Å; Y605-F609 VanDerWaalsContact O-CD2 3.28Å; Y605-F609 WeakPolarHBondContact O-CD2 3.34Å; Y605-F609 PolarHBondContact O-N 3.27Å; Y605-A634 HydrophobicContact CD1-CB 3.47Å; Y605-A634 VanDerWaalsContact CD1-CB 3.47Å; Y605-A634 HydrophobicContact CD2-CB 4Å; Y605-A634 HydrophobicContact CE1-CB 3.92Å; Y605-A634 HydrophobicContact CE2-CB 4.39Å; Y605-A634 HydrophobicContact CG-CB 3.52Å; Y605-L638 WeakPolarHBondContact OH-CD2 3.19Å; Y605-L661 HydrophobicContact CD2-CD2 3.57Å; Y605-L661 HydrophobicContact CE2-CD2 4.23Å; Y605-L661 HydrophobicContact CG-CD2 4.07Å
606	I	96.8	Very high	96.3	Very high	69 Å²	69	48.8 Å²	48.8	35%	0.354	23%	0.233	S	C	.	.	H	α-helix	trans	-61.8	-48.4	174.9	-58.7	-59.8	0	0	0	111.1	N604 F608 R610 Q660	N604-I606 PolarHBondContact O-N 2.96Å; I606-F608 VanDerWaalsContact C-N 3.35Å; I606-R610 VanDerWaalsContact O-CB 3.3Å; I606-R610 WeakPolarHBondContact O-CB 3.23Å; I606-R610 PolarHBondContact O-N 3.3Å; I606-Q660 HydrophobicContact CD1-CB 3.63Å; I606-Q660 HydrophobicContact CD1-CG 3.61Å
607	R	97.5	Very high	96.3	Very high	60 Å²	60	49.2 Å²	49.2	23%	0.226	24%	0.237	C	C	.	.	H	α-helix	trans	-64.6	-40.9	176.9	-176.9	175.9	175.8	-174.4	-8.6	111	E598 A599 N604 R610 L611	E598-R607 IonicContact OE1-CZ 3.51Å; E598-R607 IonicContact OE1-NH1 3.56Å; E598-R607 PolarHBondContact OE1-NH1 2.93Å; E598-R607 IonicContact OE1-NH2 3.85Å; E598-R607 IonicContact OE2-CZ 3.51Å; E598-R607 IonicContact OE2-NH1 3.22Å; E598-R607 PolarHBondContact OE2-NH1 3.48Å; E598-R607 IonicContact OE2-NH2 2.78Å; E598-R607 PolarHBondContact OE2-NH2 3.28Å; A599-R607 HydrophobicContact CB-CB 4.21Å; A599-R607 HydrophobicContact CB-CG 4.02Å; N604-R607 HydrophobicContact CB-CB 4.11Å; N604-R607 VanDerWaalsContact CG-CB 3.43Å; N604-R607 PolarHBondContact O-N 2.92Å; N604-R607 VanDerWaalsContact O-N 3.07Å; N604-R607 VanDerWaalsContact OD1-CB 3.28Å; N604-R607 WeakPolarHBondContact OD1-CB 3.28Å; N604-R607 PolarHBondContact OD1-N 3.37Å; R607-R610 WeakPolarHBondContact O-CB 3.48Å; R607-R610 PolarHBondContact O-N 2.94Å; R607-L611 HydrophobicContact CG-CD1 4.36Å; R607-L611 WeakPolarHBondContact O-CG 3.28Å; R607-L611 PolarHBondContact O-N 2.98Å
608	F	98.2	Very high	96.4	Very high	0 Å²	0	49 Å²	49	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.3	-51.5	178.3	-178	-86.8	0	0	0	111.9	T596 A599 N604 Y605 I606 R610 L611 A612 M623 F627 I630	T596-F608 HydrophobicContact CG2-CD2 3.86Å; T596-F608 HydrophobicContact CG2-CE2 3.53Å; T596-F608 HydrophobicContact CG2-CZ 4.48Å; A599-F608 HydrophobicContact CB-CB 4.08Å; N604-F608 PolarHBondContact O-N 3.41Å; Y605-F608 PolarHBondContact O-N 3.25Å; I606-F608 VanDerWaalsContact C-N 3.35Å; F608-R610 VanDerWaalsContact C-N 3.29Å; F608-R610 PolarHBondContact O-N 2.91Å; F608-L611 CarbonylContact O-C 3.55Å; F608-L611 WeakPolarHBondContact O-CB 3.46Å; F608-L611 PolarHBondContact O-N 2.63Å; F608-L611 VanDerWaalsContact O-N 3.1Å; F608-A612 PolarHBondContact O-N 2.65Å; F608-M623 HydrophobicContact CD1-CE 4.25Å; F608-M623 HydrophobicContact CD2-CE 4.11Å; F608-M623 HydrophobicContact CE1-CE 3.81Å; F608-M623 HydrophobicContact CE2-CE 3.69Å; F608-M623 HydrophobicContact CG-CE 4.38Å; F608-M623 HydrophobicContact CZ-CB 4.15Å; F608-M623 HydrophobicContact CZ-CE 3.52Å; F608-F627 AromaticContact CE1-CD1 3.87Å; F608-F627 HydrophobicContact CE1-CD1 3.87Å; F608-F627 AromaticContact CE1-CE1 3.86Å; F608-F627 HydrophobicContact CE1-CE1 3.86Å; F608-F627 HydrophobicContact CZ-CD1 4.46Å; F608-F627 HydrophobicContact CZ-CE1 4.47Å; F608-I630 HydrophobicContact CB-CD1 4.06Å; F608-I630 HydrophobicContact CD1-CD1 3.23Å; F608-I630 HydrophobicContact CD1-CG2 4.4Å; F608-I630 HydrophobicContact CD2-CD1 3.23Å; F608-I630 HydrophobicContact CE1-CD1 3.29Å; F608-I630 HydrophobicContact CE2-CD1 3.26Å; F608-I630 HydrophobicContact CG-CD1 3.2Å; F608-I630 HydrophobicContact CZ-CD1 3.3Å
609	F	98	Very high	96.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-69.8	-26.9	178.9	-76.5	-69.1	0	0	0	112.6	Y605 A612 R613 F627 I630 R631 L661 L708	Y605-F609 VanDerWaalsContact O-CD2 3.28Å; Y605-F609 WeakPolarHBondContact O-CD2 3.34Å; Y605-F609 PolarHBondContact O-N 3.27Å; F609-A612 HydrophobicContact CD1-CB 4.41Å; F609-A612 PolarHBondContact O-N 3Å; F609-R613 WeakPolarHBondContact O-CG 3.49Å; F609-R613 PolarHBondContact O-N 3.43Å; F609-F627 AromaticContact CE1-CD1 3.88Å; F609-F627 HydrophobicContact CE1-CD1 3.88Å; F609-F627 HydrophobicContact CE1-CD2 4.38Å; F609-F627 HydrophobicContact CE1-CE1 4.01Å; F609-F627 HydrophobicContact CE1-CG 4.08Å; F609-F627 HydrophobicContact CE1-CZ 4.33Å; F609-F627 HydrophobicContact CZ-CD1 4.36Å; F609-F627 HydrophobicContact CZ-CG 4.45Å; F609-I630 HydrophobicContact CD2-CG2 4.48Å; F609-I630 HydrophobicContact CE2-CG2 3.83Å; F609-R631 HydrophobicContact CE2-CG 4.38Å; F609-R631 HydrophobicContact CZ-CG 4.03Å; F609-L661 WeakPolarHBondContact CE1-O 3.19Å; F609-L661 HydrophobicContact CE2-CB 4.31Å; F609-L661 HydrophobicContact CE2-CD2 4.3Å; F609-L661 VanDerWaalsContact CE2-O 3.31Å; F609-L661 WeakPolarHBondContact CE2-O 3.24Å; F609-L661 WeakPolarHBondContact CZ-O 3.33Å; F609-L708 HydrophobicContact CD1-CD2 4.04Å; F609-L708 HydrophobicContact CE1-CD2 4.27Å
610	R	98.1	Very high	96.6	Very high	134 Å²	134	45.8 Å²	45.8	51%	0.506	22%	0.222	S	C	.	.	H	α-helix	trans	-63	-42.6	167.8	-175.2	171.3	65.4	-171.8	1	111.9	I606 R607 F608 R613 Q614	I606-R610 VanDerWaalsContact O-CB 3.3Å; I606-R610 WeakPolarHBondContact O-CB 3.23Å; I606-R610 PolarHBondContact O-N 3.3Å; R607-R610 WeakPolarHBondContact O-CB 3.48Å; R607-R610 PolarHBondContact O-N 2.94Å; F608-R610 VanDerWaalsContact C-N 3.29Å; F608-R610 PolarHBondContact O-N 2.91Å; R610-R613 PolarHBondContact O-N 3.39Å; R610-Q614 WeakPolarHBondContact O-CG 3.24Å; R610-Q614 PolarHBondContact O-N 3.5Å
611	L	98.1	Very high	96.7	Very high	16 Å²	16	45.8 Å²	45.8	8%	0.084	22%	0.222	C	C	.	.	H	α-helix	trans	-65.4	-42.4	173.1	-70.4	170	0	0	0	111.2	F592 A595 A599 R607 F608 R613 Q614 A615 M623	F592-L611 HydrophobicContact CD2-CD2 4.37Å; F592-L611 HydrophobicContact CE2-CB 4.27Å; F592-L611 HydrophobicContact CE2-CD2 3.89Å; F592-L611 HydrophobicContact CZ-CB 3.94Å; F592-L611 HydrophobicContact CZ-CD2 4.37Å; F592-L611 WeakPolarHBondContact CZ-O 3.49Å; A595-L611 HydrophobicContact CB-CD1 4.16Å; A595-L611 WeakPolarHBondContact O-CD1 3.46Å; A599-L611 HydrophobicContact CB-CD1 4.25Å; R607-L611 HydrophobicContact CG-CD1 4.36Å; R607-L611 WeakPolarHBondContact O-CG 3.28Å; R607-L611 PolarHBondContact O-N 2.98Å; F608-L611 CarbonylContact O-C 3.55Å; F608-L611 WeakPolarHBondContact O-CB 3.46Å; F608-L611 PolarHBondContact O-N 2.63Å; F608-L611 VanDerWaalsContact O-N 3.1Å; L611-R613 VanDerWaalsContact C-N 3.25Å; L611-R613 PolarHBondContact O-N 3.03Å; L611-Q614 CarbonylContact O-C 3.52Å; L611-Q614 WeakPolarHBondContact O-CA 3.25Å; L611-Q614 PolarHBondContact O-N 2.92Å; L611-A615 PolarHBondContact O-N 3.35Å; L611-M623 HydrophobicContact CB-CE 4.26Å
612	A	97.4	Very high	97	Very high	1 Å²	1	41.1 Å²	41.1	1%	0.008	20%	0.198	C	C	.	.	H	α-helix	trans	-56.8	-39.2	175.3	0	0	0	0	0	111.9	F608 F609 Q614 A615 M623 F627 L708 K712	F608-A612 PolarHBondContact O-N 2.65Å; F609-A612 HydrophobicContact CD1-CB 4.41Å; F609-A612 PolarHBondContact O-N 3Å; A612-Q614 VanDerWaalsContact C-N 3.34Å; A612-Q614 PolarHBondContact O-N 2.89Å; A612-A615 WeakPolarHBondContact O-CB 3.44Å; A612-A615 PolarHBondContact O-N 2.93Å; A612-M623 HydrophobicContact CB-CE 3.77Å; A612-M623 HydrophobicContact CB-SD 4.39Å; A612-F627 HydrophobicContact CB-CE1 4.32Å; A612-F627 HydrophobicContact CB-CZ 4.38Å; A612-L708 HydrophobicContact CB-CD1 4.49Å; A612-K712 VanDerWaalsContact O-CE 3.22Å; A612-K712 WeakPolarHBondContact O-CE 3.4Å; A612-K712 PolarHBondContact O-NZ 2.98Å
613	R	96.9	Very high	97.2	Very high	110 Å²	110	37.7 Å²	37.7	42%	0.415	18%	0.177	S	C	.	.	H	α-helix	trans	-66.3	-31.5	173.2	-71.2	178.4	-166.2	99.3	15.6	113.6	F609 R610 L611 Q659 L708 K712	F609-R613 WeakPolarHBondContact O-CG 3.49Å; F609-R613 PolarHBondContact O-N 3.43Å; R610-R613 PolarHBondContact O-N 3.39Å; L611-R613 VanDerWaalsContact C-N 3.25Å; L611-R613 PolarHBondContact O-N 3.03Å; R613-Q659 PolarHBondContact NH2-O 3.06Å; R613-L708 HydrophobicContact CG-CD1 3.7Å; R613-K712 PolarHBondContact O-NZ 3.02Å
614	Q	96.5	Very high	97.4	Very high	132 Å²	132	37 Å²	37	62%	0.617	17%	0.173	S	C	*	.	H	α-helix	trans	-85.8	-18.3	177.7	-67.8	173	-7.1	0	0	113.9	R610 L611 A612	R610-Q614 WeakPolarHBondContact O-CG 3.24Å; R610-Q614 PolarHBondContact O-N 3.5Å; L611-Q614 CarbonylContact O-C 3.52Å; L611-Q614 WeakPolarHBondContact O-CA 3.25Å; L611-Q614 PolarHBondContact O-N 2.92Å; A612-Q614 VanDerWaalsContact C-N 3.34Å; A612-Q614 PolarHBondContact O-N 2.89Å
615	A	97.4	Very high	97.3	Very high	8 Å²	8	37.8 Å²	37.8	7%	0.066	17%	0.171	C	C	.	.	S	Bend	trans	-59.2	151.1	-179.3	0	0	0	0	0	112.7	F592 L611 A612 V619 A620 M623 K712	F592-A615 HydrophobicContact CE1-CB 4.31Å; F592-A615 HydrophobicContact CZ-CB 3.82Å; L611-A615 PolarHBondContact O-N 3.35Å; A612-A615 WeakPolarHBondContact O-CB 3.44Å; A612-A615 PolarHBondContact O-N 2.93Å; A615-V619 HydrophobicContact CB-CB 3.98Å; A615-V619 HydrophobicContact CB-CG1 3.62Å; A615-A620 HydrophobicContact CB-CB 4.01Å; A615-M623 HydrophobicContact CB-SD 4.07Å; A615-K712 WeakPolarHBondContact O-CD 3.3Å; A615-K712 PolarHBondContact O-NZ 3.38Å
616	T	96.6	Very high	97.3	Very high	86 Å²	86	36.5 Å²	36.5	53%	0.528	17%	0.166	S	C	.	.			trans	-68.3	167.7	164.1	63.7	0	0	0	0	110.2	L618 V619 A620	T616-L618 PolarHBondContact O-N 3.32Å; T616-V619 PolarHBondContact O-N 3.39Å; T616-V619 VanDerWaalsContact OG1-CG2 3.28Å; T616-V619 WeakPolarHBondContact OG1-CG2 3.5Å; T616-A620 WeakPolarHBondContact O-CB 3.21Å; T616-A620 PolarHBondContact O-N 3.43Å
617	C	97.1	Very high	97.3	Very high	10 Å²	10	33.3 Å²	33.3	7%	0.068	15%	0.15	C	C	.	.	H	α-helix	trans	-53.2	-52.4	-179.8	-178.9	0	0	0	0	112.3	V619 A620 C621 K712 R713 L721	C617-V619 PolarHBondContact O-N 3.31Å; C617-A620 WeakPolarHBondContact O-CB 3.35Å; C617-A620 PolarHBondContact O-N 2.91Å; C617-C621 PolarHBondContact O-N 3.09Å; C617-C621 PolarHBondContact O-SG 3Å; C617-K712 HydrophobicContact CB-CB 4.02Å; C617-R713 HydrophobicContact CB-CB 4.28Å; C617-L721 HydrophobicContact CB-CD1 4.4Å
618	L	98.2	Very high	97.1	Very high	8 Å²	8	32 Å²	32	4%	0.042	15%	0.148	C	C	.	.	H	α-helix	trans	-67.6	-36.8	-177.6	-62.9	179.2	0	0	0	113.3	R503 I506 F507 Y562 T616 A620 C621 L622 L721	R503-L618 HydrophobicContact CB-CD1 3.83Å; R503-L618 HydrophobicContact CG-CD1 3.62Å; I506-L618 HydrophobicContact CB-CD2 4.35Å; I506-L618 HydrophobicContact CG2-CB 3.95Å; I506-L618 HydrophobicContact CG2-CD2 3.93Å; I506-L618 VanDerWaalsContact CG2-O 3.27Å; I506-L618 WeakPolarHBondContact CG2-O 3.3Å; F507-L618 HydrophobicContact CB-CD2 4.19Å; Y562-L618 HydrophobicContact CE1-CB 4.3Å; Y562-L618 WeakPolarHBondContact OH-CB 3.45Å; T616-L618 PolarHBondContact O-N 3.32Å; L618-A620 VanDerWaalsContact C-N 3.34Å; L618-C621 WeakPolarHBondContact O-CB 3.29Å; L618-C621 PolarHBondContact O-N 2.88Å; L618-L622 PolarHBondContact O-N 3.44Å; L618-L721 HydrophobicContact CD1-CD1 4.32Å; L618-L721 HydrophobicContact CD2-CD1 4.18Å; L618-L721 HydrophobicContact CD2-CD2 4.12Å; L618-L721 HydrophobicContact CD2-CG 4.12Å; L618-L721 HydrophobicContact CG-CD1 3.99Å; L618-L721 HydrophobicContact CG-CG 4.41Å
619	V	98.3	Very high	97	Very high	17 Å²	17	34.7 Å²	34.7	10%	0.103	16%	0.161	C	C	.	.	H	α-helix	trans	-63.9	-43	173.3	171.9	0	0	0	0	110.3	Y562 L565 F592 A615 T616 C617 C621 L622 M623	Y562-V619 HydrophobicContact CE1-CG2 3.84Å; L565-V619 HydrophobicContact CD1-CB 4.36Å; L565-V619 HydrophobicContact CD1-CG1 3.75Å; L565-V619 HydrophobicContact CD1-CG2 4.19Å; F592-V619 HydrophobicContact CD1-CG1 3.76Å; F592-V619 HydrophobicContact CE1-CG1 3.31Å; F592-V619 HydrophobicContact CZ-CG1 4.08Å; A615-V619 HydrophobicContact CB-CB 3.98Å; A615-V619 HydrophobicContact CB-CG1 3.62Å; T616-V619 PolarHBondContact O-N 3.39Å; T616-V619 VanDerWaalsContact OG1-CG2 3.28Å; T616-V619 WeakPolarHBondContact OG1-CG2 3.5Å; C617-V619 PolarHBondContact O-N 3.31Å; V619-C621 VanDerWaalsContact C-N 3.33Å; V619-C621 PolarHBondContact O-N 2.91Å; V619-L622 PolarHBondContact O-N 3.22Å; V619-M623 HydrophobicContact CG1-CG 4.43Å; V619-M623 HydrophobicContact CG1-SD 4.11Å; V619-M623 WeakPolarHBondContact O-CG 3.33Å; V619-M623 PolarHBondContact O-N 2.96Å
620	A	98	Very high	96.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-63.8	-37.6	175.7	0	0	0	0	0	111.9	A615 T616 C617 L618 L622 M623 H624 V709 K712	A615-A620 HydrophobicContact CB-CB 4.01Å; T616-A620 WeakPolarHBondContact O-CB 3.21Å; T616-A620 PolarHBondContact O-N 3.43Å; C617-A620 WeakPolarHBondContact O-CB 3.35Å; C617-A620 PolarHBondContact O-N 2.91Å; L618-A620 VanDerWaalsContact C-N 3.34Å; A620-L622 VanDerWaalsContact C-N 3.31Å; A620-L622 PolarHBondContact O-N 3.41Å; A620-M623 PolarHBondContact O-N 2.88Å; A620-H624 PolarHBondContact O-N 3.31Å; A620-V709 HydrophobicContact CB-CB 4.38Å; A620-V709 HydrophobicContact CB-CG1 4.03Å; A620-V709 HydrophobicContact CB-CG2 4.14Å; A620-K712 HydrophobicContact CB-CD 3.77Å
621	C	98.1	Very high	96.7	Very high	6 Å²	6	28.7 Å²	28.7	4%	0.041	14%	0.138	C	C	.	.	H	α-helix	trans	-59.5	-40.5	172.3	-65.4	0	0	0	0	112.2	I506 A510 C617 L618 V619 H624 V709	I506-C621 HydrophobicContact CG2-CB 3.75Å; I506-C621 WeakPolarHBondContact O-CB 3.43Å; A510-C621 HydrophobicContact CB-CB 3.67Å; C617-C621 PolarHBondContact O-N 3.09Å; C617-C621 PolarHBondContact O-SG 3Å; L618-C621 WeakPolarHBondContact O-CB 3.29Å; L618-C621 PolarHBondContact O-N 2.88Å; V619-C621 VanDerWaalsContact C-N 3.33Å; V619-C621 PolarHBondContact O-N 2.91Å; C621-H624 WeakPolarHBondContact O-CB 3.29Å; C621-V709 HydrophobicContact CB-CG1 4.39Å; C621-V709 VanDerWaalsContact SG-CG1 3.54Å
622	L	97.9	Very high	96.6	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	14%	0.14	C	C	.	.	H	α-helix	trans	-70	-41.1	174.9	-73.3	175.3	0	0	0	112.1	I506 L529 Y562 L565 M566 L618 V619 A620 H624 R625	I506-L622 HydrophobicContact CD1-CD1 4.14Å; I506-L622 HydrophobicContact CD1-CG 4.45Å; I506-L622 HydrophobicContact CG1-CD1 4.45Å; I506-L622 HydrophobicContact CG1-CD2 4Å; I506-L622 HydrophobicContact CG1-CG 4.25Å; I506-L622 HydrophobicContact CG2-CD2 4.24Å; I506-L622 HydrophobicContact CG2-CG 3.87Å; L529-L622 HydrophobicContact CD2-CD2 4.23Å; Y562-L622 HydrophobicContact CD1-CD1 3.36Å; Y562-L622 HydrophobicContact CE1-CD1 4.17Å; Y562-L622 HydrophobicContact CG-CD1 3.73Å; L565-L622 HydrophobicContact CB-CB 4.04Å; L565-L622 HydrophobicContact CB-CD1 3.91Å; L565-L622 HydrophobicContact CD1-CD1 4.22Å; M566-L622 HydrophobicContact CG-CD2 3.95Å; M566-L622 HydrophobicContact SD-CD2 3.53Å; M566-L622 VanDerWaalsContact SD-CD2 3.53Å; L618-L622 PolarHBondContact O-N 3.44Å; V619-L622 PolarHBondContact O-N 3.22Å; A620-L622 VanDerWaalsContact C-N 3.31Å; A620-L622 PolarHBondContact O-N 3.41Å; L622-H624 PolarHBondContact O-N 2.96Å; L622-R625 WeakPolarHBondContact O-CD 3.48Å; L622-R625 WeakPolarHBondContact O-CG 3.47Å
623	M	97.9	Very high	96.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.8	-28.3	177.6	-69.9	179.8	70.2	0	0	113	L565 F592 T596 F608 L611 A612 A615 V619 A620 R625 Y626 F627	L565-M623 HydrophobicContact CD2-CG 4.19Å; F592-M623 HydrophobicContact CE1-SD 3.76Å; F592-M623 HydrophobicContact CZ-SD 4.03Å; T596-M623 HydrophobicContact CG2-CE 3.63Å; T596-M623 HydrophobicContact CG2-CG 4.32Å; T596-M623 HydrophobicContact CG2-SD 4.26Å; F608-M623 HydrophobicContact CD1-CE 4.25Å; F608-M623 HydrophobicContact CD2-CE 4.11Å; F608-M623 HydrophobicContact CE1-CE 3.81Å; F608-M623 HydrophobicContact CE2-CE 3.69Å; F608-M623 HydrophobicContact CG-CE 4.38Å; F608-M623 HydrophobicContact CZ-CB 4.15Å; F608-M623 HydrophobicContact CZ-CE 3.52Å; L611-M623 HydrophobicContact CB-CE 4.26Å; A612-M623 HydrophobicContact CB-CE 3.77Å; A612-M623 HydrophobicContact CB-SD 4.39Å; A615-M623 HydrophobicContact CB-SD 4.07Å; V619-M623 HydrophobicContact CG1-CG 4.43Å; V619-M623 HydrophobicContact CG1-SD 4.11Å; V619-M623 WeakPolarHBondContact O-CG 3.33Å; V619-M623 PolarHBondContact O-N 2.96Å; A620-M623 PolarHBondContact O-N 2.88Å; M623-R625 PolarHBondContact O-N 3.49Å; M623-R625 VanDerWaalsContact O-N 3.09Å; M623-Y626 PolarHBondContact O-N 3.12Å; M623-F627 HydrophobicContact CB-CE1 4.25Å; M623-F627 WeakPolarHBondContact O-CD1 3.37Å
624	H	96.3	Very high	96.3	Very high	14 Å²	14	26.4 Å²	26.4	7%	0.065	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-51	-35.2	-179.4	-171.5	-106.8	0	0	0	113.2	A620 C621 L622 Y626 F627 Q703 S705	A620-H624 PolarHBondContact O-N 3.31Å; C621-H624 WeakPolarHBondContact O-CB 3.29Å; L622-H624 PolarHBondContact O-N 2.96Å; H624-Y626 PolarHBondContact O-N 3.48Å; H624-Y626 VanDerWaalsContact O-N 3.12Å; H624-F627 AromaticContact CD2-CD2 3.51Å; H624-F627 AromaticContact CD2-CE2 3.56Å; H624-F627 WeakPolarHBondContact O-CB 3.41Å; H624-F627 WeakPolarHBondContact O-CG 3.33Å; H624-F627 PolarHBondContact O-N 3.47Å; H624-F627 VanDerWaalsContact O-N 3.09Å; H624-Q703 PolarHBondContact CE1-O 3.42Å; H624-Q703 VanDerWaalsContact CE1-O 3.24Å; H624-Q703 PolarHBondContact NE2-O 3.42Å; H624-Q703 VanDerWaalsContact NE2-O 3.16Å; H624-S705 PolarHBondContact CD2-OG 3.28Å; H624-S705 PolarHBondContact NE2-OG 3.25Å
625	R	94.7	Very high	96.1	Very high	82 Å²	82	20.1 Å²	20.1	31%	0.309	10%	0.104	S	C	.	.	G	3₁₀ helix	trans	-62.9	-19.1	179.6	75.1	-171.4	32	-162.7	-8.2	114.5	M566 L622 M623	M566-R625 PolarHBondContact O-NH1 3.47Å; M566-R625 PolarHBondContact SD-NH1 3.3Å; M566-R625 PolarHBondContact SD-NH2 2.99Å; L622-R625 WeakPolarHBondContact O-CD 3.48Å; L622-R625 WeakPolarHBondContact O-CG 3.47Å; M623-R625 PolarHBondContact O-N 3.49Å; M623-R625 VanDerWaalsContact O-N 3.09Å
626	Y	95.8	Very high	95.8	Very high	12 Å²	12	23.2 Å²	23.2	5%	0.047	12%	0.118	C	C	.	.	G	3₁₀ helix	trans	-99.5	-2.9	179.9	-54.9	-75.1	0	0	0	112.6	L565 M566 K567 L568 L600 M623 H624 V628 Q629 I630	L565-Y626 VanDerWaalsContact O-CE2 3.27Å; L565-Y626 WeakPolarHBondContact O-CE2 3.32Å; L565-Y626 PolarHBondContact O-OH 2.94Å; L565-Y626 VanDerWaalsContact O-OH 3.06Å; M566-Y626 VanDerWaalsContact C-OH 3.27Å; M566-Y626 PolarHBondContact O-OH 2.68Å; K567-Y626 PolarHBondContact N-OH 2.92Å; L568-Y626 HydrophobicContact CB-CE1 4.13Å; L568-Y626 HydrophobicContact CB-CE2 4.12Å; L568-Y626 HydrophobicContact CD1-CD2 3.85Å; L568-Y626 HydrophobicContact CD1-CE2 3.54Å; L568-Y626 HydrophobicContact CG-CE2 3.86Å; L568-Y626 PolarHBondContact N-OH 2.99Å; L600-Y626 HydrophobicContact CD2-CD1 4.21Å; L600-Y626 HydrophobicContact CD2-CE1 4.42Å; M623-Y626 PolarHBondContact O-N 3.12Å; H624-Y626 PolarHBondContact O-N 3.48Å; H624-Y626 VanDerWaalsContact O-N 3.12Å; Y626-V628 PolarHBondContact O-N 2.91Å; Y626-Q629 PolarHBondContact O-N 3.15Å; Y626-I630 WeakPolarHBondContact O-CG1 3.32Å; Y626-I630 PolarHBondContact O-N 3Å
627	F	95.9	Very high	95.4	Very high	3 Å²	3	23.3 Å²	23.3	1%	0.013	11%	0.111	C	C	.	.	H	α-helix	trans	-60.9	-46	-175.1	-75.6	8.5	0	0	0	111.5	F608 F609 A612 M623 H624 I630 R631 L708 V709	F608-F627 AromaticContact CE1-CD1 3.87Å; F608-F627 HydrophobicContact CE1-CD1 3.87Å; F608-F627 AromaticContact CE1-CE1 3.86Å; F608-F627 HydrophobicContact CE1-CE1 3.86Å; F608-F627 HydrophobicContact CZ-CD1 4.46Å; F608-F627 HydrophobicContact CZ-CE1 4.47Å; F609-F627 AromaticContact CE1-CD1 3.88Å; F609-F627 HydrophobicContact CE1-CD1 3.88Å; F609-F627 HydrophobicContact CE1-CD2 4.38Å; F609-F627 HydrophobicContact CE1-CE1 4.01Å; F609-F627 HydrophobicContact CE1-CG 4.08Å; F609-F627 HydrophobicContact CE1-CZ 4.33Å; F609-F627 HydrophobicContact CZ-CD1 4.36Å; F609-F627 HydrophobicContact CZ-CG 4.45Å; A612-F627 HydrophobicContact CB-CE1 4.32Å; A612-F627 HydrophobicContact CB-CZ 4.38Å; M623-F627 HydrophobicContact CB-CE1 4.25Å; M623-F627 WeakPolarHBondContact O-CD1 3.37Å; H624-F627 AromaticContact CD2-CD2 3.51Å; H624-F627 AromaticContact CD2-CE2 3.56Å; H624-F627 WeakPolarHBondContact O-CB 3.41Å; H624-F627 WeakPolarHBondContact O-CG 3.33Å; H624-F627 PolarHBondContact O-N 3.47Å; H624-F627 VanDerWaalsContact O-N 3.09Å; F627-I630 PolarHBondContact O-N 2.99Å; F627-R631 VanDerWaalsContact O-CB 3.25Å; F627-R631 WeakPolarHBondContact O-CB 3.5Å; F627-R631 WeakPolarHBondContact O-CD 3.4Å; F627-R631 WeakPolarHBondContact O-CG 3.36Å; F627-R631 PolarHBondContact O-N 2.9Å; F627-L708 HydrophobicContact CE2-CD2 3.59Å; F627-L708 HydrophobicContact CE2-CG 4.35Å; F627-L708 HydrophobicContact CZ-CD2 3.59Å; F627-L708 HydrophobicContact CZ-CG 4.23Å; F627-V709 HydrophobicContact CE2-CG2 4.22Å; F627-V709 HydrophobicContact CZ-CG2 4.28Å
628	V	94.4	Very high	95	Very high	32 Å²	32	23.3 Å²	23.3	19%	0.194	11%	0.111	C	C	.	.	H	α-helix	trans	-60.5	-51.8	176.4	-179.4	0	0	0	0	110.2	Y626 I630 R631 S632 F672 W700 E702	Y626-V628 PolarHBondContact O-N 2.91Å; V628-I630 VanDerWaalsContact C-N 3.29Å; V628-I630 PolarHBondContact O-N 3.12Å; V628-R631 PolarHBondContact O-N 2.9Å; V628-S632 WeakPolarHBondContact O-CB 3.37Å; V628-S632 PolarHBondContact O-N 3.38Å; V628-S632 PolarHBondContact O-OG 2.69Å; V628-F672 HydrophobicContact CG1-CE2 4.48Å; V628-W700 HydrophobicContact CG1-CB 4.23Å; V628-W700 HydrophobicContact CG2-CG 4.37Å; V628-E702 HydrophobicContact CG2-CG 3.83Å
629	Q	94.5	Very high	94.5	Very high	56 Å²	56	23.4 Å²	23.4	26%	0.262	11%	0.112	S	C	.	.	H	α-helix	trans	-51.2	-48.1	178.8	177.3	-176.8	-19.5	0	0	112	N569 Y626 Q633	N569-Q629 PolarHBondContact ND2-OE1 3.16Å; N569-Q629 PolarHBondContact OD1-NE2 2.87Å; Y626-Q629 PolarHBondContact O-N 3.15Å; Q629-Q633 WeakPolarHBondContact O-CB 3.47Å; Q629-Q633 VanDerWaalsContact O-CG 3.23Å; Q629-Q633 WeakPolarHBondContact O-CG 3.46Å; Q629-Q633 PolarHBondContact O-N 3.45Å
630	I	95.5	Very high	93.8	Very high	3 Å²	3	26.8 Å²	26.8	2%	0.015	14%	0.135	C	C	.	.	H	α-helix	trans	-76	-38.5	-175	-64.6	172.6	0	0	0	111.8	L600 F608 F609 Y626 F627 V628 S632 Q633 A634	L600-I630 HydrophobicContact CD1-CD1 3.57Å; L600-I630 HydrophobicContact CD1-CG1 3.51Å; F608-I630 HydrophobicContact CB-CD1 4.06Å; F608-I630 HydrophobicContact CD1-CD1 3.23Å; F608-I630 HydrophobicContact CD1-CG2 4.4Å; F608-I630 HydrophobicContact CD2-CD1 3.23Å; F608-I630 HydrophobicContact CE1-CD1 3.29Å; F608-I630 HydrophobicContact CE2-CD1 3.26Å; F608-I630 HydrophobicContact CG-CD1 3.2Å; F608-I630 HydrophobicContact CZ-CD1 3.3Å; F609-I630 HydrophobicContact CD2-CG2 4.48Å; F609-I630 HydrophobicContact CE2-CG2 3.83Å; Y626-I630 WeakPolarHBondContact O-CG1 3.32Å; Y626-I630 PolarHBondContact O-N 3Å; F627-I630 PolarHBondContact O-N 2.99Å; V628-I630 VanDerWaalsContact C-N 3.29Å; V628-I630 PolarHBondContact O-N 3.12Å; I630-S632 VanDerWaalsContact C-N 3.33Å; I630-Q633 PolarHBondContact O-N 3.06Å; I630-A634 VanDerWaalsContact O-CB 3.26Å; I630-A634 WeakPolarHBondContact O-CB 3.49Å; I630-A634 PolarHBondContact O-N 2.79Å
631	R	95.8	Very high	93.1	Very high	5 Å²	5	30.3 Å²	30.3	2%	0.019	17%	0.165	C	C	.	.	H	α-helix	trans	-59.9	-46.3	174.1	-73.4	166.2	178	-178.7	1.5	110.3	F609 F627 V628 A634 L635 L661 G662 F663 E668 F672	F609-R631 HydrophobicContact CE2-CG 4.38Å; F609-R631 HydrophobicContact CZ-CG 4.03Å; F627-R631 VanDerWaalsContact O-CB 3.25Å; F627-R631 WeakPolarHBondContact O-CB 3.5Å; F627-R631 WeakPolarHBondContact O-CD 3.4Å; F627-R631 WeakPolarHBondContact O-CG 3.36Å; F627-R631 PolarHBondContact O-N 2.9Å; V628-R631 PolarHBondContact O-N 2.9Å; R631-A634 PolarHBondContact O-N 3.34Å; R631-L635 PolarHBondContact O-N 3.48Å; R631-L661 HydrophobicContact CG-CB 4.25Å; R631-L661 PolarHBondContact NE-O 3.01Å; R631-G662 PolarHBondContact NH2-O 3.43Å; R631-F663 HydrophobicContact CB-CZ 4.37Å; R631-F663 HydrophobicContact CG-CE1 4.43Å; R631-F663 HydrophobicContact CG-CE2 4.39Å; R631-F663 HydrophobicContact CG-CZ 3.96Å; R631-F663 VanDerWaalsContact CZ-CD1 3.47Å; R631-E668 IonicContact CZ-OE1 2.77Å; R631-E668 IonicContact NH1-OE1 3.21Å; R631-E668 PolarHBondContact NH1-OE1 3.5Å; R631-E668 IonicContact NH2-OE1 3Å; R631-F672 HydrophobicContact CB-CE1 3.71Å; R631-F672 HydrophobicContact CB-CE2 4.37Å; R631-F672 HydrophobicContact CB-CZ 3.6Å
632	S	94.4	Very high	92.4	Very high	18 Å²	18	32.8 Å²	32.8	13%	0.126	18%	0.175	C	C	.	.	H	α-helix	trans	-58.2	-50.5	175.2	-56.5	0	0	0	0	112.2	V628 I630 A634 L635 M636 W676	V628-S632 WeakPolarHBondContact O-CB 3.37Å; V628-S632 PolarHBondContact O-N 3.38Å; V628-S632 PolarHBondContact O-OG 2.69Å; I630-S632 VanDerWaalsContact C-N 3.33Å; S632-A634 VanDerWaalsContact C-N 3.28Å; S632-A634 PolarHBondContact O-N 2.89Å; S632-L635 PolarHBondContact O-N 3.38Å; S632-M636 WeakPolarHBondContact O-CG 3.38Å; S632-M636 PolarHBondContact O-N 3.28Å; S632-M636 VanDerWaalsContact O-N 3.14Å; S632-W676 VanDerWaalsContact CB-CH2 3.46Å; S632-W676 WeakPolarHBondContact OG-CZ2 3.16Å
633	Q	93.9	Very high	91	Very high	62 Å²	62	34.1 Å²	34.1	29%	0.29	19%	0.186	S	C	.	.	H	α-helix	trans	-62.7	-33.8	178	-78.2	-179.7	-2.7	0	0	113	Q629 I630 K637	Q629-Q633 WeakPolarHBondContact O-CB 3.47Å; Q629-Q633 VanDerWaalsContact O-CG 3.23Å; Q629-Q633 WeakPolarHBondContact O-CG 3.46Å; Q629-Q633 PolarHBondContact O-N 3.45Å; I630-Q633 PolarHBondContact O-N 3.06Å; Q633-K637 PolarHBondContact O-N 2.99Å; Q633-K637 VanDerWaalsContact O-N 3.15Å
634	A	94.5	Very high	89.2	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-70.3	-44	176.2	0	0	0	0	0	111.9	Y605 I630 R631 S632 M636 K637 L638 L661	Y605-A634 HydrophobicContact CD1-CB 3.47Å; Y605-A634 VanDerWaalsContact CD1-CB 3.47Å; Y605-A634 HydrophobicContact CD2-CB 4Å; Y605-A634 HydrophobicContact CE1-CB 3.92Å; Y605-A634 HydrophobicContact CE2-CB 4.39Å; Y605-A634 HydrophobicContact CG-CB 3.52Å; I630-A634 VanDerWaalsContact O-CB 3.26Å; I630-A634 WeakPolarHBondContact O-CB 3.49Å; I630-A634 PolarHBondContact O-N 2.79Å; R631-A634 PolarHBondContact O-N 3.34Å; S632-A634 VanDerWaalsContact C-N 3.28Å; S632-A634 PolarHBondContact O-N 2.89Å; A634-M636 VanDerWaalsContact C-N 3.32Å; A634-M636 PolarHBondContact O-N 3.12Å; A634-K637 PolarHBondContact O-N 2.86Å; A634-L638 WeakPolarHBondContact O-CB 3.41Å; A634-L638 VanDerWaalsContact O-CG 3.29Å; A634-L638 WeakPolarHBondContact O-CG 3.46Å; A634-L638 PolarHBondContact O-N 2.97Å; A634-L661 HydrophobicContact CB-CD1 4.16Å; A634-L661 HydrophobicContact CB-CD2 3.47Å; A634-L661 VanDerWaalsContact CB-CD2 3.47Å; A634-L661 HydrophobicContact CB-CG 4.49Å
635	L	92.9	Very high	87.6	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.9	-43.9	175.9	-73.3	-172.4	0	0	0	111.7	R631 S632 K637 L638 S639 L657 F672 W676 L678	R631-L635 PolarHBondContact O-N 3.48Å; S632-L635 PolarHBondContact O-N 3.38Å; L635-K637 PolarHBondContact O-N 3.21Å; L635-L638 PolarHBondContact O-N 3.24Å; L635-S639 WeakPolarHBondContact O-CB 3.41Å; L635-S639 PolarHBondContact O-N 3.04Å; L635-S639 PolarHBondContact O-OG 2.95Å; L635-L657 HydrophobicContact CD2-CD2 4.23Å; L635-F672 HydrophobicContact CD1-CD1 3.73Å; L635-F672 HydrophobicContact CD1-CE1 3.52Å; L635-F672 HydrophobicContact CG-CE1 4.23Å; L635-W676 HydrophobicContact CD1-CB 4.05Å; L635-W676 HydrophobicContact CD1-CD2 4.25Å; L635-W676 HydrophobicContact CD1-CG 3.87Å; L635-L678 HydrophobicContact CD1-CD1 4.33Å; L635-L678 HydrophobicContact CD2-CD1 4.24Å
636	M	90.3	Very high	85.9	Confident	72 Å²	72	41.9 Å²	41.9	36%	0.355	25%	0.252	S	S	.	.	H	α-helix	trans	-61.6	-43	175.6	-66.5	-61.2	-71.9	0	0	112.1	S632 A634 S639 C640 W676 P693	S632-M636 WeakPolarHBondContact O-CG 3.38Å; S632-M636 PolarHBondContact O-N 3.28Å; S632-M636 VanDerWaalsContact O-N 3.14Å; A634-M636 VanDerWaalsContact C-N 3.32Å; A634-M636 PolarHBondContact O-N 3.12Å; M636-S639 PolarHBondContact O-OG 3.32Å; M636-C640 WeakPolarHBondContact O-CB 3.42Å; M636-C640 PolarHBondContact O-N 3.08Å; M636-C640 PolarHBondContact O-SG 3.44Å; M636-W676 HydrophobicContact CG-CZ3 4.32Å; M636-W676 HydrophobicContact SD-CZ3 4.17Å; M636-P693 HydrophobicContact SD-CB 3.89Å; M636-P693 HydrophobicContact SD-CG 4.04Å; M636-P693 VanDerWaalsContact SD-O 3.39Å
637	K	88.7	Confident	84.1	Confident	89 Å²	89	50.3 Å²	50.3	39%	0.387	29%	0.289	S	S	.	.	H	α-helix	trans	-67.2	-40.3	177.1	-83.4	-171.8	169.6	177.6	0	112.7	T602 N603 Q633 A634 L635 A641	T602-K637 PolarHBondContact O-NZ 3.3Å; N603-K637 VanDerWaalsContact CB-NZ 3.31Å; N603-K637 VanDerWaalsContact ND2-CD 3.32Å; N603-K637 WeakPolarHBondContact ND2-CD 3.45Å; N603-K637 WeakPolarHBondContact ND2-CE 3.47Å; N603-K637 PolarHBondContact ND2-NZ 3.24Å; N603-K637 PolarHBondContact O-NZ 3.28Å; Q633-K637 PolarHBondContact O-N 2.99Å; Q633-K637 VanDerWaalsContact O-N 3.15Å; A634-K637 PolarHBondContact O-N 2.86Å; L635-K637 PolarHBondContact O-N 3.21Å; K637-A641 WeakPolarHBondContact O-CB 3.4Å; K637-A641 PolarHBondContact O-N 3.26Å
638	L	89.4	Confident	82.8	Confident	10 Å²	10	59.3 Å²	59.3	5%	0.052	32%	0.322	C	S	.	.	H	α-helix	trans	-65.2	-44.5	178	-72.6	169.3	0	0	0	110.8	Y605 A634 L635 A641 F642 L657 F687	Y605-L638 WeakPolarHBondContact OH-CD2 3.19Å; A634-L638 WeakPolarHBondContact O-CB 3.41Å; A634-L638 VanDerWaalsContact O-CG 3.29Å; A634-L638 WeakPolarHBondContact O-CG 3.46Å; A634-L638 PolarHBondContact O-N 2.97Å; L635-L638 PolarHBondContact O-N 3.24Å; L638-A641 PolarHBondContact O-N 3.05Å; L638-F642 HydrophobicContact CB-CD2 4.42Å; L638-F642 HydrophobicContact CB-CE2 4.31Å; L638-F642 HydrophobicContact CD2-CE2 3.96Å; L638-F642 HydrophobicContact CD2-CZ 4.47Å; L638-F642 WeakPolarHBondContact O-CD2 3.37Å; L638-F642 WeakPolarHBondContact O-CG 3.47Å; L638-F642 PolarHBondContact O-N 2.86Å; L638-L657 HydrophobicContact CD1-CD1 3.57Å; L638-F687 HydrophobicContact CB-CE1 4.16Å; L638-F687 HydrophobicContact CB-CE2 4.47Å; L638-F687 HydrophobicContact CB-CZ 3.86Å
639	S	87	Confident	82	Confident	10 Å²	10	62.5 Å²	62.5	7%	0.07	34%	0.335	C	S	.	.	H	α-helix	trans	-62.3	-45	176.5	68.9	0	0	0	0	111.8	L635 M636 A641 F642 A643 P693	L635-S639 WeakPolarHBondContact O-CB 3.41Å; L635-S639 PolarHBondContact O-N 3.04Å; L635-S639 PolarHBondContact O-OG 2.95Å; M636-S639 PolarHBondContact O-OG 3.32Å; S639-A641 VanDerWaalsContact C-N 3.34Å; S639-A641 PolarHBondContact O-N 3.45Å; S639-F642 PolarHBondContact O-N 3.47Å; S639-A643 VanDerWaalsContact O-CB 3.29Å; S639-A643 WeakPolarHBondContact O-CB 3.45Å; S639-A643 PolarHBondContact O-N 2.93Å; S639-P693 VanDerWaalsContact CB-CD 3.4Å; S639-P693 WeakPolarHBondContact OG-CD 3.44Å; S639-P693 WeakPolarHBondContact OG-CG 3.35Å
640	C	83.8	Confident	81.6	Confident	87 Å²	87	61.3 Å²	61.3	59%	0.588	33%	0.332	S	S	*	.	H	α-helix	trans	-61.3	-40.7	175.6	-69.6	0	0	0	0	112.6	M636 F642	M636-C640 WeakPolarHBondContact O-CB 3.42Å; M636-C640 PolarHBondContact O-N 3.08Å; M636-C640 PolarHBondContact O-SG 3.44Å; C640-F642 VanDerWaalsContact C-N 3.34Å
641	A	84.3	Confident	81.3	Confident	75 Å²	75	64.9 Å²	64.9	62%	0.62	35%	0.348	S	S	*	.	H	α-helix	trans	-67.2	-34.8	178.8	0	0	0	0	0	112.5	K637 L638 S639	K637-A641 WeakPolarHBondContact O-CB 3.4Å; K637-A641 PolarHBondContact O-N 3.26Å; L638-A641 PolarHBondContact O-N 3.05Å; S639-A641 VanDerWaalsContact C-N 3.34Å; S639-A641 PolarHBondContact O-N 3.45Å
642	F	82.6	Confident	81.1	Confident	57 Å²	57	66.1 Å²	66.1	25%	0.25	35%	0.353	C	S	.	.	H	α-helix	trans	-90.4	-17.9	-179.1	-64	-46.4	0	0	0	114.4	L638 S639 C640 G644 H645 V650 Y652 F687	L638-F642 HydrophobicContact CB-CD2 4.42Å; L638-F642 HydrophobicContact CB-CE2 4.31Å; L638-F642 HydrophobicContact CD2-CE2 3.96Å; L638-F642 HydrophobicContact CD2-CZ 4.47Å; L638-F642 WeakPolarHBondContact O-CD2 3.37Å; L638-F642 WeakPolarHBondContact O-CG 3.47Å; L638-F642 PolarHBondContact O-N 2.86Å; S639-F642 PolarHBondContact O-N 3.47Å; C640-F642 VanDerWaalsContact C-N 3.34Å; F642-G644 PolarHBondContact O-N 2.88Å; F642-G644 VanDerWaalsContact O-N 3.09Å; F642-H645 PolarHBondContact O-N 3.09Å; F642-V650 HydrophobicContact CB-CB 4.08Å; F642-V650 HydrophobicContact CB-CG1 4.39Å; F642-V650 HydrophobicContact CB-CG2 3.96Å; F642-V650 HydrophobicContact CD1-CB 4.37Å; F642-V650 HydrophobicContact CD1-CG1 3.82Å; F642-V650 HydrophobicContact CD1-CG2 4.24Å; F642-V650 HydrophobicContact CD2-CG1 4.29Å; F642-V650 HydrophobicContact CE1-CG1 4.12Å; F642-V650 HydrophobicContact CG-CB 4.17Å; F642-V650 HydrophobicContact CG-CG1 3.92Å; F642-V650 HydrophobicContact CG-CG2 4.29Å; F642-V650 HydrophobicContact CZ-CG1 4.49Å; F642-Y652 AromaticContact CE2-CD2 3.73Å; F642-Y652 HydrophobicContact CE2-CD2 3.73Å; F642-Y652 HydrophobicContact CE2-CE2 4.16Å; F642-Y652 HydrophobicContact CE2-CG 4.33Å; F642-Y652 AromaticContact CZ-CD2 3.74Å; F642-Y652 HydrophobicContact CZ-CD2 3.74Å; F642-Y652 AromaticContact CZ-CE2 3.94Å; F642-Y652 HydrophobicContact CZ-CE2 3.94Å; F642-F687 HydrophobicContact CB-CB 3.92Å; F642-F687 HydrophobicContact CB-CG 4.4Å; F642-F687 HydrophobicContact CD2-CB 4.29Å; F642-F687 AromaticContact CD2-CD2 3.6Å; F642-F687 HydrophobicContact CD2-CD2 3.6Å; F642-F687 HydrophobicContact CD2-CE2 4.02Å; F642-F687 AromaticContact CD2-CG 3.93Å; F642-F687 HydrophobicContact CD2-CG 3.93Å; F642-F687 HydrophobicContact CE2-CD2 4.12Å; F642-F687 HydrophobicContact CE2-CE2 4.19Å
643	A	67.9	Low	81.1	Confident	29 Å²	29	67.6 Å²	67.6	24%	0.24	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-19.3	176.9	0	0	0	0	0	114.1	S639 H645 K689	S639-A643 VanDerWaalsContact O-CB 3.29Å; S639-A643 WeakPolarHBondContact O-CB 3.45Å; S639-A643 PolarHBondContact O-N 2.93Å; A643-H645 VanDerWaalsContact C-N 3.34Å; A643-H645 PolarHBondContact O-N 2.95Å; A643-K689 WeakPolarHBondContact O-CD 3.3Å; A643-K689 WeakPolarHBondContact O-CG 3.36Å
644	G	61.7	Low	81.2	Confident	63 Å²	63	65 Å²	65	65%	0.649	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-13.4	-179.4	0	0	0	0	0	115.4	F642 P646	F642-G644 PolarHBondContact O-N 2.88Å; F642-G644 VanDerWaalsContact O-N 3.09Å; G644-P646 VanDerWaalsContact O-CD 3.27Å; G644-P646 WeakPolarHBondContact O-CD 3.44Å
645	H	62.5	Low	81.3	Confident	92 Å²	92	67.7 Å²	67.7	43%	0.426	37%	0.369	S	S	.	.			trans	-74.6	113.5	-176.6	-164	-88.4	0	0	0	110.6	F642 A643 K647 R648 V650	F642-H645 PolarHBondContact O-N 3.09Å; A643-H645 VanDerWaalsContact C-N 3.34Å; A643-H645 PolarHBondContact O-N 2.95Å; H645-K647 VanDerWaalsContact C-N 3.26Å; H645-K647 PolarHBondContact O-N 2.81Å; H645-R648 PolarHBondContact ND1-N 3.39Å; H645-V650 HydrophobicContact CB-CG2 4.37Å
646	P	58	Low	81.4	Confident	105 Å²	105	70 Å²	70	68%	0.682	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.7	-10.5	-159.6	24.7	-33.7	0	0	0	115.6	G644	G644-P646 VanDerWaalsContact O-CD 3.27Å; G644-P646 WeakPolarHBondContact O-CD 3.44Å
647	K	58	Low	81.6	Confident	189 Å²	189	66.5 Å²	66.5	82%	0.822	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-144.8	1.8	-170.1	-65.4	-170.8	178.1	-177.5	0	116.2	H645	H645-K647 VanDerWaalsContact C-N 3.26Å; H645-K647 PolarHBondContact O-N 2.81Å
648	R	68.4	Low	82	Confident	192 Å²	192	63 Å²	63	73%	0.725	35%	0.352	S	S	*	.			trans	-146.6	137.9	-174.3	-60.6	-175.4	178.5	167.9	-1.9	111.5	H645	H645-R648 PolarHBondContact ND1-N 3.39Å
649	E	78.4	Confident	82.2	Confident	98 Å²	98	69.3 Å²	69.3	46%	0.458	38%	0.382	S	S	.	.			trans	-55.1	139.5	158.4	52.5	178	-162.7	0	0	110.5	H651 I686 E688	E649-H651 VanDerWaalsContact CD-NE2 3.27Å; E649-H651 IonicContact OE1-CD2 2.72Å; E649-H651 IonicContact OE1-CE1 3.28Å; E649-H651 IonicContact OE1-NE2 3.44Å; E649-H651 PolarHBondContact OE1-NE2 3.36Å; E649-I686 HydrophobicContact CB-CG2 3.75Å; E649-I686 HydrophobicContact CG-CG2 4.49Å; E649-E688 HydrophobicContact CB-CG 4.46Å
650	V	85	Confident	82.6	Confident	32 Å²	32	71.2 Å²	71.2	19%	0.194	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	116.6	176.7	178.4	0	0	0	0	108.7	F642 H645 Y652 F687	F642-V650 HydrophobicContact CB-CB 4.08Å; F642-V650 HydrophobicContact CB-CG1 4.39Å; F642-V650 HydrophobicContact CB-CG2 3.96Å; F642-V650 HydrophobicContact CD1-CB 4.37Å; F642-V650 HydrophobicContact CD1-CG1 3.82Å; F642-V650 HydrophobicContact CD1-CG2 4.24Å; F642-V650 HydrophobicContact CD2-CG1 4.29Å; F642-V650 HydrophobicContact CE1-CG1 4.12Å; F642-V650 HydrophobicContact CG-CB 4.17Å; F642-V650 HydrophobicContact CG-CG1 3.92Å; F642-V650 HydrophobicContact CG-CG2 4.29Å; F642-V650 HydrophobicContact CZ-CG1 4.49Å; H645-V650 HydrophobicContact CB-CG2 4.37Å; V650-Y652 PolarHBondContact O-N 3.36Å; V650-F687 HydrophobicContact CB-CB 4.41Å; V650-F687 PolarHBondContact N-O 3.38Å; V650-F687 PolarHBondContact O-N 3.29Å
651	H	89.4	Confident	83.2	Confident	78 Å²	78	67.1 Å²	67.1	36%	0.361	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	102.8	174.9	-70.3	-101.5	0	0	0	109.1	E649 N684	E649-H651 VanDerWaalsContact CD-NE2 3.27Å; E649-H651 IonicContact OE1-CD2 2.72Å; E649-H651 IonicContact OE1-CE1 3.28Å; E649-H651 IonicContact OE1-NE2 3.44Å; E649-H651 PolarHBondContact OE1-NE2 3.36Å; H651-N684 HydrophobicContact CB-CB 4.03Å
652	Y	91.6	Very high	83.7	Confident	30 Å²	30	63.8 Å²	63.8	12%	0.118	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	120.9	179.6	-165.3	-101.1	0	0	0	110.9	F642 V650 L654 T656 L657 Q660 N684 V685 F687	F642-Y652 AromaticContact CE2-CD2 3.73Å; F642-Y652 HydrophobicContact CE2-CD2 3.73Å; F642-Y652 HydrophobicContact CE2-CE2 4.16Å; F642-Y652 HydrophobicContact CE2-CG 4.33Å; F642-Y652 AromaticContact CZ-CD2 3.74Å; F642-Y652 HydrophobicContact CZ-CD2 3.74Å; F642-Y652 AromaticContact CZ-CE2 3.94Å; F642-Y652 HydrophobicContact CZ-CE2 3.94Å; V650-Y652 PolarHBondContact O-N 3.36Å; Y652-L654 PolarHBondContact O-N 2.76Å; Y652-T656 HydrophobicContact CE1-CG2 4.26Å; Y652-L657 HydrophobicContact CD1-CB 4.05Å; Y652-L657 HydrophobicContact CD1-CD1 4.26Å; Y652-L657 HydrophobicContact CE1-CB 3.87Å; Y652-L657 HydrophobicContact CE1-CD1 3.91Å; Y652-L657 HydrophobicContact CE1-CG 4.49Å; Y652-Q660 PolarHBondContact OH-NE2 2.78Å; Y652-Q660 PolarHBondContact OH-OE1 2.6Å; Y652-N684 CarbonylContact O-C 3.58Å; Y652-N684 VanDerWaalsContact O-CA 3.31Å; Y652-N684 WeakPolarHBondContact O-CA 3.31Å; Y652-V685 PolarHBondContact N-O 2.79Å; Y652-V685 PolarHBondContact O-N 3.25Å; Y652-F687 HydrophobicContact CD1-CE2 4.49Å; Y652-F687 HydrophobicContact CG-CE2 4.16Å
653	P	95.4	Very high	84.3	Confident	50 Å²	50	61.7 Å²	61.7	33%	0.325	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	123.3	-177	-25.7	34.2	0	0	0	112.7	S655 T656 L657 N684	P653-S655 PolarHBondContact O-N 2.97Å; P653-T656 WeakPolarHBondContact O-CB 3.25Å; P653-T656 PolarHBondContact O-N 2.81Å; P653-L657 PolarHBondContact O-N 2.98Å; P653-L657 VanDerWaalsContact O-N 3.1Å; P653-N684 WeakPolarHBondContact CA-OD1 3.44Å
654	L	95.3	Very high	85.6	Confident	6 Å²	6	61.9 Å²	61.9	3%	0.031	32%	0.321	C	S	.	.	H	α-helix	trans	-61.9	-35	-179.3	-175.2	67.9	0	0	0	111.6	Y652 T656 L657 T658 E666 S669 K670 V680 S683 V685	Y652-L654 PolarHBondContact O-N 2.76Å; L654-T656 VanDerWaalsContact C-N 3.31Å; L654-T656 PolarHBondContact O-N 3.37Å; L654-L657 PolarHBondContact O-N 2.92Å; L654-T658 WeakPolarHBondContact O-CB 3.19Å; L654-T658 PolarHBondContact O-N 3.04Å; L654-T658 PolarHBondContact O-OG1 3.34Å; L654-E666 HydrophobicContact CD2-CB 3.95Å; L654-E666 HydrophobicContact CG-CB 4.33Å; L654-S669 WeakPolarHBondContact CD1-OG 3.23Å; L654-K670 HydrophobicContact CD2-CB 4.07Å; L654-V680 HydrophobicContact CD2-CG1 4.11Å; L654-S683 WeakPolarHBondContact CB-O 3.25Å; L654-S683 PolarHBondContact N-O 3.48Å; L654-V685 HydrophobicContact CD1-CG2 3.53Å
655	S	96.1	Very high	87.1	Confident	58 Å²	58	62.5 Å²	62.5	41%	0.406	31%	0.31	S	S	.	.	H	α-helix	trans	-58.9	-41.8	174.2	62.4	0	0	0	0	112.3	P653 T658 Q659 E666	P653-S655 PolarHBondContact O-N 2.97Å; S655-T658 PolarHBondContact O-N 3.11Å; S655-Q659 PolarHBondContact O-N 3.25Å; S655-E666 WeakPolarHBondContact CA-OE1 3.37Å; S655-E666 WeakPolarHBondContact CB-OE1 3.4Å
656	T	95.6	Very high	88.7	Confident	47 Å²	47	62.1 Å²	62.1	29%	0.288	31%	0.308	S	S	.	.	H	α-helix	trans	-68.9	-42.1	177.8	-61.1	0	0	0	0	110.4	Y652 P653 L654 Q659 Q660	Y652-T656 HydrophobicContact CE1-CG2 4.26Å; P653-T656 WeakPolarHBondContact O-CB 3.25Å; P653-T656 PolarHBondContact O-N 2.81Å; L654-T656 VanDerWaalsContact C-N 3.31Å; L654-T656 PolarHBondContact O-N 3.37Å; T656-Q659 PolarHBondContact O-N 2.96Å; T656-Q660 HydrophobicContact CG2-CG 4.28Å; T656-Q660 WeakPolarHBondContact O-CB 3.27Å; T656-Q660 VanDerWaalsContact O-CG 3.22Å; T656-Q660 WeakPolarHBondContact O-CG 3.24Å; T656-Q660 PolarHBondContact O-N 2.95Å
657	L	94.8	Very high	90.4	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-63.1	-44.2	176.2	-167.9	68.6	0	0	0	111.8	L635 L638 Y652 P653 L654 Q659 Q660 L661 C673 V685	L635-L657 HydrophobicContact CD2-CD2 4.23Å; L638-L657 HydrophobicContact CD1-CD1 3.57Å; Y652-L657 HydrophobicContact CD1-CB 4.05Å; Y652-L657 HydrophobicContact CD1-CD1 4.26Å; Y652-L657 HydrophobicContact CE1-CB 3.87Å; Y652-L657 HydrophobicContact CE1-CD1 3.91Å; Y652-L657 HydrophobicContact CE1-CG 4.49Å; P653-L657 PolarHBondContact O-N 2.98Å; P653-L657 VanDerWaalsContact O-N 3.1Å; L654-L657 PolarHBondContact O-N 2.92Å; L657-Q659 VanDerWaalsContact C-N 3.32Å; L657-Q659 PolarHBondContact O-N 3.1Å; L657-Q660 PolarHBondContact O-N 3.29Å; L657-L661 HydrophobicContact CD1-CD1 3.54Å; L657-L661 HydrophobicContact CD1-CG 3.97Å; L657-L661 HydrophobicContact CG-CD1 3.94Å; L657-L661 HydrophobicContact CG-CG 4.38Å; L657-L661 WeakPolarHBondContact O-CB 3.41Å; L657-L661 PolarHBondContact O-N 2.97Å; L657-C673 VanDerWaalsContact CD2-SG 3.57Å; L657-V685 HydrophobicContact CD2-CG2 3.86Å
658	T	96.2	Very high	92.1	Very high	16 Å²	16	52.7 Å²	52.7	10%	0.098	26%	0.264	C	S	.	.	H	α-helix	trans	-55.9	-49	176.4	-61.2	0	0	0	0	110.1	L654 S655 G662 F663 E666 S669	L654-T658 WeakPolarHBondContact O-CB 3.19Å; L654-T658 PolarHBondContact O-N 3.04Å; L654-T658 PolarHBondContact O-OG1 3.34Å; S655-T658 PolarHBondContact O-N 3.11Å; T658-G662 PolarHBondContact O-N 3.01Å; T658-G662 VanDerWaalsContact O-N 3.1Å; T658-F663 HydrophobicContact CG2-CB 3.95Å; T658-F663 PolarHBondContact O-N 3.11Å; T658-F663 VanDerWaalsContact O-N 3.1Å; T658-E666 HydrophobicContact CG2-CG 4.5Å; T658-S669 VanDerWaalsContact OG1-CB 3.23Å; T658-S669 WeakPolarHBondContact OG1-CB 3.15Å
659	Q	95.2	Very high	93.4	Very high	142 Å²	142	43.5 Å²	43.5	66%	0.664	23%	0.229	S	C	*	.	H	α-helix	trans	-66.2	-43.1	176.6	-169	-174.8	22.5	0	0	112.2	R613 S655 T656 L657	R613-Q659 PolarHBondContact NH2-O 3.06Å; S655-Q659 PolarHBondContact O-N 3.25Å; T656-Q659 PolarHBondContact O-N 2.96Å; L657-Q659 VanDerWaalsContact C-N 3.32Å; L657-Q659 PolarHBondContact O-N 3.1Å
660	Q	95.8	Very high	94.1	Very high	50 Å²	50	42.7 Å²	42.7	23%	0.234	22%	0.224	C	C	.	.	H	α-helix	trans	-70.1	-40.8	-175.9	-75.7	175.5	-8.8	0	0	113.1	I606 Y652 T656 L657	I606-Q660 HydrophobicContact CD1-CB 3.63Å; I606-Q660 HydrophobicContact CD1-CG 3.61Å; Y652-Q660 PolarHBondContact OH-NE2 2.78Å; Y652-Q660 PolarHBondContact OH-OE1 2.6Å; T656-Q660 HydrophobicContact CG2-CG 4.28Å; T656-Q660 WeakPolarHBondContact O-CB 3.27Å; T656-Q660 VanDerWaalsContact O-CG 3.22Å; T656-Q660 WeakPolarHBondContact O-CG 3.24Å; T656-Q660 PolarHBondContact O-N 2.95Å; L657-Q660 PolarHBondContact O-N 3.29Å
661	L	95.6	Very high	94.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	7.9	-176.4	-59.1	-171.8	0	0	0	113.9	Y605 F609 R631 A634 L657 F663	Y605-L661 HydrophobicContact CD2-CD2 3.57Å; Y605-L661 HydrophobicContact CE2-CD2 4.23Å; Y605-L661 HydrophobicContact CG-CD2 4.07Å; F609-L661 WeakPolarHBondContact CE1-O 3.19Å; F609-L661 HydrophobicContact CE2-CB 4.31Å; F609-L661 HydrophobicContact CE2-CD2 4.3Å; F609-L661 VanDerWaalsContact CE2-O 3.31Å; F609-L661 WeakPolarHBondContact CE2-O 3.24Å; F609-L661 WeakPolarHBondContact CZ-O 3.33Å; R631-L661 HydrophobicContact CG-CB 4.25Å; R631-L661 PolarHBondContact NE-O 3.01Å; A634-L661 HydrophobicContact CB-CD1 4.16Å; A634-L661 HydrophobicContact CB-CD2 3.47Å; A634-L661 VanDerWaalsContact CB-CD2 3.47Å; A634-L661 HydrophobicContact CB-CG 4.49Å; L657-L661 HydrophobicContact CD1-CD1 3.54Å; L657-L661 HydrophobicContact CD1-CG 3.97Å; L657-L661 HydrophobicContact CG-CD1 3.94Å; L657-L661 HydrophobicContact CG-CG 4.38Å; L657-L661 WeakPolarHBondContact O-CB 3.41Å; L657-L661 PolarHBondContact O-N 2.97Å; L661-F663 VanDerWaalsContact C-N 3.28Å; L661-F663 HydrophobicContact CB-CD2 3.81Å; L661-F663 HydrophobicContact CB-CE2 3.65Å; L661-F663 HydrophobicContact CD1-CE2 3.95Å; L661-F663 HydrophobicContact CG-CE2 4.41Å; L661-F663 PolarHBondContact O-N 2.91Å
662	G	94.6	Very high	94.8	Very high	5 Å²	5	41 Å²	41	5%	0.052	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	40.5	173.4	0	0	0	0	0	113	R631 T658	R631-G662 PolarHBondContact NH2-O 3.43Å; T658-G662 PolarHBondContact O-N 3.01Å; T658-G662 VanDerWaalsContact O-N 3.1Å
663	F	96	Very high	94.9	Very high	14 Å²	14	39.6 Å²	39.6	6%	0.061	21%	0.211	C	C	.	.			trans	-72	153.8	166.7	-71.1	-75.6	0	0	0	109.8	R631 T658 L661 E668 F672	R631-F663 HydrophobicContact CB-CZ 4.37Å; R631-F663 HydrophobicContact CG-CE1 4.43Å; R631-F663 HydrophobicContact CG-CE2 4.39Å; R631-F663 HydrophobicContact CG-CZ 3.96Å; R631-F663 VanDerWaalsContact CZ-CD1 3.47Å; T658-F663 HydrophobicContact CG2-CB 3.95Å; T658-F663 PolarHBondContact O-N 3.11Å; T658-F663 VanDerWaalsContact O-N 3.1Å; L661-F663 VanDerWaalsContact C-N 3.28Å; L661-F663 HydrophobicContact CB-CD2 3.81Å; L661-F663 HydrophobicContact CB-CE2 3.65Å; L661-F663 HydrophobicContact CD1-CE2 3.95Å; L661-F663 HydrophobicContact CG-CE2 4.41Å; L661-F663 PolarHBondContact O-N 2.91Å; F663-E668 HydrophobicContact CD1-CB 4.28Å; F663-E668 HydrophobicContact CD1-CG 3.82Å; F663-E668 HydrophobicContact CE1-CG 4.42Å; F663-F672 HydrophobicContact CE1-CB 3.69Å; F663-F672 HydrophobicContact CE1-CD1 4.22Å; F663-F672 HydrophobicContact CE1-CD2 4.18Å; F663-F672 AromaticContact CE1-CG 3.77Å; F663-F672 HydrophobicContact CE1-CG 3.77Å; F663-F672 HydrophobicContact CZ-CB 3.77Å; F663-F672 AromaticContact CZ-CD1 3.6Å; F663-F672 HydrophobicContact CZ-CD1 3.6Å; F663-F672 HydrophobicContact CZ-CD2 4.34Å; F663-F672 HydrophobicContact CZ-CE1 4.27Å; F663-F672 AromaticContact CZ-CG 3.64Å; F663-F672 HydrophobicContact CZ-CG 3.64Å
664	E	93.9	Very high	94.7	Very high	32 Å²	32	41.4 Å²	41.4	15%	0.15	22%	0.215	C	C	.	.	S	Bend	trans	-73.9	-32.7	-177.9	-67.7	-72.7	138.9	0	0	111.9	E668 S705 F706 H707 L708	E664-E668 WeakPolarHBondContact CB-OE2 3.34Å; E664-E668 PolarHBondContact N-OE2 3.2Å; E664-S705 WeakPolarHBondContact OE1-CA 3.32Å; E664-S705 WeakPolarHBondContact OE1-CB 3.17Å; E664-F706 VanDerWaalsContact CD-N 3.27Å; E664-F706 PolarHBondContact OE1-N 2.97Å; E664-F706 PolarHBondContact OE2-N 3.07Å; E664-F706 VanDerWaalsContact OE2-N 3.11Å; E664-H707 PolarHBondContact OE1-N 3.26Å; E664-H707 WeakPolarHBondContact OE2-CB 3.48Å; E664-H707 IonicContact OE2-CE1 3.52Å; E664-H707 IonicContact OE2-CG 2.97Å; E664-H707 PolarHBondContact OE2-N 3.35Å; E664-H707 IonicContact OE2-ND1 3.91Å; E664-H707 PolarHBondContact OE2-ND1 2.99Å; E664-L708 PolarHBondContact OE1-N 3.24Å; E664-L708 VanDerWaalsContact OE1-N 3.08Å
665	N	94.1	Very high	94.6	Very high	77 Å²	77	43.9 Å²	43.9	41%	0.412	23%	0.231	S	C	.	.	S	Bend	trans	-157.8	169.3	177.1	54.1	32.9	0	0	0	111.4	T667 E668 S669	N665-T667 PolarHBondContact ND2-OG1 2.98Å; N665-T667 PolarHBondContact O-N 3.32Å; N665-T667 PolarHBondContact OD1-N 3.14Å; N665-T667 PolarHBondContact OD1-OG1 3.3Å; N665-E668 PolarHBondContact O-N 3.39Å; N665-E668 WeakPolarHBondContact OD1-CB 3.45Å; N665-E668 PolarHBondContact OD1-N 3.36Å; N665-S669 PolarHBondContact O-N 3.07Å
666	E	94.8	Very high	94.4	Very high	84 Å²	84	42.1 Å²	42.1	39%	0.393	22%	0.215	S	C	.	.	H	α-helix	trans	-63.4	-28.5	179.1	-68.9	-176.7	-177	0	0	112.6	L654 S655 T658 S669 K670	L654-E666 HydrophobicContact CD2-CB 3.95Å; L654-E666 HydrophobicContact CG-CB 4.33Å; S655-E666 WeakPolarHBondContact CA-OE1 3.37Å; S655-E666 WeakPolarHBondContact CB-OE1 3.4Å; T658-E666 HydrophobicContact CG2-CG 4.5Å; E666-S669 PolarHBondContact O-N 3.24Å; E666-K670 WeakPolarHBondContact O-CB 3.3Å; E666-K670 PolarHBondContact O-N 3.45Å
667	T	93.8	Very high	94.1	Very high	88 Å²	88	42.1 Å²	42.1	54%	0.54	23%	0.225	S	C	.	.	H	α-helix	trans	-65.7	-45.3	176.2	46.8	0	0	0	0	112.4	N665 S669 K670 D671	N665-T667 PolarHBondContact ND2-OG1 2.98Å; N665-T667 PolarHBondContact O-N 3.32Å; N665-T667 PolarHBondContact OD1-N 3.14Å; N665-T667 PolarHBondContact OD1-OG1 3.3Å; T667-S669 VanDerWaalsContact C-N 3.3Å; T667-S669 PolarHBondContact O-N 3.15Å; T667-K670 PolarHBondContact O-N 2.92Å; T667-D671 VanDerWaalsContact O-CG 3.23Å; T667-D671 PolarHBondContact O-N 2.91Å
668	E	94	Very high	93.9	Very high	7 Å²	7	42.4 Å²	42.4	3%	0.033	23%	0.226	C	C	.	.	H	α-helix	trans	-63.1	-40.7	175.8	-170.7	-161.6	166.9	0	0	110.4	R631 F663 E664 N665 K670 F672 W700	R631-E668 IonicContact CZ-OE1 2.77Å; R631-E668 IonicContact NH1-OE1 3.21Å; R631-E668 PolarHBondContact NH1-OE1 3.5Å; R631-E668 IonicContact NH2-OE1 3Å; F663-E668 HydrophobicContact CD1-CB 4.28Å; F663-E668 HydrophobicContact CD1-CG 3.82Å; F663-E668 HydrophobicContact CE1-CG 4.42Å; E664-E668 WeakPolarHBondContact CB-OE2 3.34Å; E664-E668 PolarHBondContact N-OE2 3.2Å; N665-E668 PolarHBondContact O-N 3.39Å; N665-E668 WeakPolarHBondContact OD1-CB 3.45Å; N665-E668 PolarHBondContact OD1-N 3.36Å; E668-K670 VanDerWaalsContact C-N 3.35Å; E668-F672 VanDerWaalsContact O-CB 3.3Å; E668-F672 WeakPolarHBondContact O-CB 3.15Å; E668-F672 PolarHBondContact O-N 2.86Å; E668-W700 HydrophobicContact CG-CZ2 4.32Å
669	S	95.1	Very high	93.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.4	-41	176.7	-172.3	0	0	0	0	111.7	L654 T658 N665 E666 T667 C673	L654-S669 WeakPolarHBondContact CD1-OG 3.23Å; T658-S669 VanDerWaalsContact OG1-CB 3.23Å; T658-S669 WeakPolarHBondContact OG1-CB 3.15Å; N665-S669 PolarHBondContact O-N 3.07Å; E666-S669 PolarHBondContact O-N 3.24Å; T667-S669 VanDerWaalsContact C-N 3.3Å; T667-S669 PolarHBondContact O-N 3.15Å; S669-C673 PolarHBondContact O-N 2.9Å; S669-C673 PolarHBondContact O-SG 3.43Å
670	K	95	Very high	93.4	Very high	81 Å²	81	38.3 Å²	38.3	35%	0.352	21%	0.213	S	C	.	.	H	α-helix	trans	-63.3	-54.1	176.4	176.1	177.4	175.6	-178.1	0	110.8	L654 E666 T667 E668 F672 C673 E674 V680	L654-K670 HydrophobicContact CD2-CB 4.07Å; E666-K670 WeakPolarHBondContact O-CB 3.3Å; E666-K670 PolarHBondContact O-N 3.45Å; T667-K670 PolarHBondContact O-N 2.92Å; E668-K670 VanDerWaalsContact C-N 3.35Å; K670-F672 PolarHBondContact O-N 3.14Å; K670-C673 PolarHBondContact O-N 3.32Å; K670-E674 WeakPolarHBondContact CE-OE1 3.39Å; K670-E674 HydrophobicContact CG-CG 4.33Å; K670-E674 IonicContact NZ-OE1 2.78Å; K670-E674 PolarHBondContact O-N 3.39Å; K670-V680 HydrophobicContact CD-CB 4.47Å; K670-V680 HydrophobicContact CD-CG1 4.28Å; K670-V680 HydrophobicContact CG-CB 4.04Å; K670-V680 HydrophobicContact CG-CG1 4.05Å; K670-V680 HydrophobicContact CG-CG2 4.09Å
671	D	93.7	Very high	93.1	Very high	75 Å²	75	41.7 Å²	41.7	40%	0.401	23%	0.227	S	C	.	.	H	α-helix	trans	-57.4	-39.7	-179.1	-66.4	-11.5	0	0	0	111.1	T667 T675 W700	T667-D671 VanDerWaalsContact O-CG 3.23Å; T667-D671 PolarHBondContact O-N 2.91Å; D671-T675 VanDerWaalsContact O-CB 3.26Å; D671-T675 WeakPolarHBondContact O-CB 2.9Å; D671-T675 PolarHBondContact O-N 2.91Å; D671-T675 PolarHBondContact O-OG1 3.26Å; D671-W700 HydrophobicContact CB-CH2 4.14Å
672	F	94.2	Very high	92.6	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.4	-45.7	175.3	-170	-91.5	0	0	0	111.9	V628 R631 L635 F663 E668 K670 T675 W676 W700	V628-F672 HydrophobicContact CG1-CE2 4.48Å; R631-F672 HydrophobicContact CB-CE1 3.71Å; R631-F672 HydrophobicContact CB-CE2 4.37Å; R631-F672 HydrophobicContact CB-CZ 3.6Å; L635-F672 HydrophobicContact CD1-CD1 3.73Å; L635-F672 HydrophobicContact CD1-CE1 3.52Å; L635-F672 HydrophobicContact CG-CE1 4.23Å; F663-F672 HydrophobicContact CE1-CB 3.69Å; F663-F672 HydrophobicContact CE1-CD1 4.22Å; F663-F672 HydrophobicContact CE1-CD2 4.18Å; F663-F672 AromaticContact CE1-CG 3.77Å; F663-F672 HydrophobicContact CE1-CG 3.77Å; F663-F672 HydrophobicContact CZ-CB 3.77Å; F663-F672 AromaticContact CZ-CD1 3.6Å; F663-F672 HydrophobicContact CZ-CD1 3.6Å; F663-F672 HydrophobicContact CZ-CD2 4.34Å; F663-F672 HydrophobicContact CZ-CE1 4.27Å; F663-F672 AromaticContact CZ-CG 3.64Å; F663-F672 HydrophobicContact CZ-CG 3.64Å; E668-F672 VanDerWaalsContact O-CB 3.3Å; E668-F672 WeakPolarHBondContact O-CB 3.15Å; E668-F672 PolarHBondContact O-N 2.86Å; K670-F672 PolarHBondContact O-N 3.14Å; F672-T675 PolarHBondContact O-N 3.37Å; F672-W676 AromaticContact CE1-CD1 3.79Å; F672-W676 AromaticContact CE1-NE1 3.64Å; F672-W676 AromaticContact CE2-NE1 3.91Å; F672-W676 AromaticContact CZ-CD1 3.97Å; F672-W676 AromaticContact CZ-NE1 3.4Å; F672-W676 PolarHBondContact O-N 3.3Å; F672-W700 HydrophobicContact CB-CH2 3.84Å; F672-W700 HydrophobicContact CB-CZ2 4.31Å; F672-W700 HydrophobicContact CB-CZ3 4.04Å; F672-W700 AromaticContact CD2-CD2 3.62Å; F672-W700 HydrophobicContact CD2-CD2 3.62Å; F672-W700 AromaticContact CD2-CE2 3.73Å; F672-W700 AromaticContact CD2-CE3 3.73Å; F672-W700 HydrophobicContact CD2-CE3 3.73Å; F672-W700 HydrophobicContact CD2-CG 4.19Å; F672-W700 HydrophobicContact CD2-CH2 4.04Å; F672-W700 AromaticContact CD2-CZ2 3.94Å; F672-W700 HydrophobicContact CD2-CZ2 3.94Å; F672-W700 AromaticContact CD2-CZ3 3.95Å; F672-W700 HydrophobicContact CD2-CZ3 3.95Å; F672-W700 HydrophobicContact CE2-CD2 4.04Å; F672-W700 HydrophobicContact CE2-CE3 4.38Å; F672-W700 HydrophobicContact CE2-CG 4.13Å; F672-W700 HydrophobicContact CG-CH2 4.46Å; F672-W700 HydrophobicContact CG-CZ3 4.43Å
673	C	93.4	Very high	92.4	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-64.6	-44.1	178.5	-66.1	0	0	0	0	112.3	L657 S669 K670 T675 W676 G677 L678 V680 V685	L657-C673 VanDerWaalsContact CD2-SG 3.57Å; S669-C673 PolarHBondContact O-N 2.9Å; S669-C673 PolarHBondContact O-SG 3.43Å; K670-C673 PolarHBondContact O-N 3.32Å; C673-T675 VanDerWaalsContact C-N 3.31Å; C673-T675 PolarHBondContact O-N 2.95Å; C673-W676 CarbonylContact O-C 3.59Å; C673-W676 WeakPolarHBondContact O-CA 3.23Å; C673-W676 WeakPolarHBondContact O-CB 3.36Å; C673-W676 PolarHBondContact O-N 2.87Å; C673-G677 PolarHBondContact O-N 2.9Å; C673-L678 HydrophobicContact CB-CB 4.23Å; C673-L678 HydrophobicContact CB-CD1 4.46Å; C673-L678 WeakPolarHBondContact O-CB 3.26Å; C673-L678 PolarHBondContact O-N 3.01Å; C673-V680 HydrophobicContact CB-CG2 4.04Å; C673-V685 HydrophobicContact CB-CG1 4.35Å; C673-V685 HydrophobicContact CB-CG2 4.44Å
674	E	92.8	Very high	92.2	Very high	87 Å²	87	51.9 Å²	51.9	41%	0.407	29%	0.287	S	S	.	.	H	α-helix	trans	-63.9	-37.5	178.2	-70.5	-178.1	165.4	0	0	111.9	K670 W676 G677 L678 V680	K670-E674 WeakPolarHBondContact CE-OE1 3.39Å; K670-E674 HydrophobicContact CG-CG 4.33Å; K670-E674 IonicContact NZ-OE1 2.78Å; K670-E674 PolarHBondContact O-N 3.39Å; E674-W676 PolarHBondContact O-N 2.92Å; E674-G677 PolarHBondContact O-N 3.06Å; E674-L678 WeakPolarHBondContact CA-O 3.44Å; E674-V680 HydrophobicContact CG-CG2 4.22Å
675	T	91.4	Very high	92.1	Very high	58 Å²	58	50.4 Å²	50.4	36%	0.356	28%	0.279	S	S	.	.	H	α-helix	trans	-62.9	-26.9	174.3	-60.9	0	0	0	0	112.2	D671 F672 C673 G677 P696 W700	D671-T675 VanDerWaalsContact O-CB 3.26Å; D671-T675 WeakPolarHBondContact O-CB 2.9Å; D671-T675 PolarHBondContact O-N 2.91Å; D671-T675 PolarHBondContact O-OG1 3.26Å; F672-T675 PolarHBondContact O-N 3.37Å; C673-T675 VanDerWaalsContact C-N 3.31Å; C673-T675 PolarHBondContact O-N 2.95Å; T675-G677 VanDerWaalsContact C-N 3.31Å; T675-P696 HydrophobicContact CG2-CB 3.44Å; T675-P696 VanDerWaalsContact CG2-CB 3.44Å; T675-P696 HydrophobicContact CG2-CG 3.78Å; T675-W700 HydrophobicContact CG2-CE3 4.16Å; T675-W700 HydrophobicContact CG2-CZ3 4.47Å
676	W	91.6	Very high	91.9	Very high	22 Å²	22	47.5 Å²	47.5	8%	0.083	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	7.4	173.7	-82	74.2	0	0	0	113.8	S632 L635 M636 F672 C673 E674 P693 Q694 P695	S632-W676 VanDerWaalsContact CB-CH2 3.46Å; S632-W676 WeakPolarHBondContact OG-CZ2 3.16Å; L635-W676 HydrophobicContact CD1-CB 4.05Å; L635-W676 HydrophobicContact CD1-CD2 4.25Å; L635-W676 HydrophobicContact CD1-CG 3.87Å; M636-W676 HydrophobicContact CG-CZ3 4.32Å; M636-W676 HydrophobicContact SD-CZ3 4.17Å; F672-W676 AromaticContact CE1-CD1 3.79Å; F672-W676 AromaticContact CE1-NE1 3.64Å; F672-W676 AromaticContact CE2-NE1 3.91Å; F672-W676 AromaticContact CZ-CD1 3.97Å; F672-W676 AromaticContact CZ-NE1 3.4Å; F672-W676 PolarHBondContact O-N 3.3Å; C673-W676 CarbonylContact O-C 3.59Å; C673-W676 WeakPolarHBondContact O-CA 3.23Å; C673-W676 WeakPolarHBondContact O-CB 3.36Å; C673-W676 PolarHBondContact O-N 2.87Å; E674-W676 PolarHBondContact O-N 2.92Å; W676-P693 HydrophobicContact CB-CB 4.44Å; W676-P693 HydrophobicContact CE3-CB 3.8Å; W676-P693 CarbonylContact O-C 3.52Å; W676-P693 WeakPolarHBondContact O-CA 3.49Å; W676-Q694 CarbonylContact C-O 3.54Å; W676-Q694 WeakPolarHBondContact CA-O 3.46Å; W676-Q694 PolarHBondContact O-N 3.42Å; W676-P695 HydrophobicContact CH2-CB 4.1Å; W676-P695 HydrophobicContact CZ3-CB 4.32Å
677	G	89.8	Confident	91.5	Very high	47 Å²	47	43.8 Å²	43.8	49%	0.485	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	13.4	178.6	0	0	0	0	0	114.9	C673 E674 T675	C673-G677 PolarHBondContact O-N 2.9Å; E674-G677 PolarHBondContact O-N 3.06Å; T675-G677 VanDerWaalsContact C-N 3.31Å
678	L	90.4	Very high	90.8	Very high	5 Å²	5	42.9 Å²	42.9	3%	0.026	24%	0.236	C	C	.	.			trans	-90.2	141	175.8	-61.4	174.4	0	0	0	111	L635 C673 E674 V685 F687 P693	L635-L678 HydrophobicContact CD1-CD1 4.33Å; L635-L678 HydrophobicContact CD2-CD1 4.24Å; C673-L678 HydrophobicContact CB-CB 4.23Å; C673-L678 HydrophobicContact CB-CD1 4.46Å; C673-L678 WeakPolarHBondContact O-CB 3.26Å; C673-L678 PolarHBondContact O-N 3.01Å; E674-L678 WeakPolarHBondContact CA-O 3.44Å; L678-V685 HydrophobicContact CB-CG1 4.17Å; L678-V685 HydrophobicContact CD1-CG1 4.06Å; L678-F687 HydrophobicContact CD1-CE1 3.87Å; L678-F687 HydrophobicContact CD1-CZ 4.41Å; L678-F687 HydrophobicContact CD2-CD1 4.4Å; L678-P693 HydrophobicContact CD1-CB 4.48Å; L678-P693 HydrophobicContact CD1-CG 4.33Å; L678-P693 HydrophobicContact CD2-CB 4.46Å; L678-P693 HydrophobicContact CD2-CG 4.12Å; L678-P693 HydrophobicContact CG-CB 4.45Å; L678-P693 HydrophobicContact CG-CG 4.48Å
679	S	89.6	Confident	89.8	Confident	47 Å²	47	49.8 Å²	49.8	33%	0.329	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	139.3	175	50.6	0	0	0	0	111	I686	S679-I686 PolarHBondContact O-N 3.22Å
680	V	91.1	Very high	88.6	Confident	25 Å²	25	58.6 Å²	58.6	15%	0.152	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	116.1	176.4	-174.8	0	0	0	0	108.9	L654 K670 C673 E674 N684 V685	L654-V680 HydrophobicContact CD2-CG1 4.11Å; K670-V680 HydrophobicContact CD-CB 4.47Å; K670-V680 HydrophobicContact CD-CG1 4.28Å; K670-V680 HydrophobicContact CG-CB 4.04Å; K670-V680 HydrophobicContact CG-CG1 4.05Å; K670-V680 HydrophobicContact CG-CG2 4.09Å; C673-V680 HydrophobicContact CB-CG2 4.04Å; E674-V680 HydrophobicContact CG-CG2 4.22Å; V680-N684 CarbonylContact C-O 3.57Å; V680-N684 WeakPolarHBondContact CA-O 3.4Å; V680-V685 HydrophobicContact CG2-CG2 4.14Å
681	F	89.5	Confident	87.5	Confident	121 Å²	121	58 Å²	58	53%	0.531	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	138.8	-176.8	-173.6	-99.6	0	0	0	110.3	S683 N684 I686	F681-S683 PolarHBondContact O-N 3.35Å; F681-S683 VanDerWaalsContact O-N 3.11Å; F681-N684 PolarHBondContact N-O 3.12Å; F681-N684 WeakPolarHBondContact O-CA 2.93Å; F681-N684 WeakPolarHBondContact O-CB 3.38Å; F681-N684 PolarHBondContact O-N 3.31Å; F681-N684 VanDerWaalsContact O-O 3.11Å; F681-I686 HydrophobicContact CB-CD1 3.82Å; F681-I686 HydrophobicContact CB-CG1 4.44Å
682	D	86.9	Confident	86.8	Confident	122 Å²	122	60.5 Å²	60.5	65%	0.652	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.4	43.5	179.9	-69.5	-11.2	0	0	0	114.6	N684	D682-N684 PolarHBondContact O-N 3Å; D682-N684 PolarHBondContact O-ND2 2.97Å
683	S	90.4	Very high	86.3	Confident	73 Å²	73	60.8 Å²	60.8	51%	0.51	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	59.7	23.8	-176.2	-59.4	0	0	0	0	115	L654 F681	L654-S683 WeakPolarHBondContact CB-O 3.25Å; L654-S683 PolarHBondContact N-O 3.48Å; F681-S683 PolarHBondContact O-N 3.35Å; F681-S683 VanDerWaalsContact O-N 3.11Å
684	N	91.6	Very high	85.8	Confident	39 Å²	39	67.6 Å²	67.6	21%	0.209	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	138.3	170.5	-60.8	-58.6	0	0	0	110.2	H651 Y652 P653 V680 F681 D682	H651-N684 HydrophobicContact CB-CB 4.03Å; Y652-N684 CarbonylContact O-C 3.58Å; Y652-N684 VanDerWaalsContact O-CA 3.31Å; Y652-N684 WeakPolarHBondContact O-CA 3.31Å; P653-N684 WeakPolarHBondContact CA-OD1 3.44Å; V680-N684 CarbonylContact C-O 3.57Å; V680-N684 WeakPolarHBondContact CA-O 3.4Å; F681-N684 PolarHBondContact N-O 3.12Å; F681-N684 WeakPolarHBondContact O-CA 2.93Å; F681-N684 WeakPolarHBondContact O-CB 3.38Å; F681-N684 PolarHBondContact O-N 3.31Å; F681-N684 VanDerWaalsContact O-O 3.11Å; D682-N684 PolarHBondContact O-N 3Å; D682-N684 PolarHBondContact O-ND2 2.97Å
685	V	91.6	Very high	85.4	Confident	0 Å²	0	68.1 Å²	68.1	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	125.6	165.6	-175.9	0	0	0	0	107.3	Y652 L654 L657 C673 L678 V680 F687	Y652-V685 PolarHBondContact N-O 2.79Å; Y652-V685 PolarHBondContact O-N 3.25Å; L654-V685 HydrophobicContact CD1-CG2 3.53Å; L657-V685 HydrophobicContact CD2-CG2 3.86Å; C673-V685 HydrophobicContact CB-CG1 4.35Å; C673-V685 HydrophobicContact CB-CG2 4.44Å; L678-V685 HydrophobicContact CB-CG1 4.17Å; L678-V685 HydrophobicContact CD1-CG1 4.06Å; V680-V685 HydrophobicContact CG2-CG2 4.14Å; V685-F687 HydrophobicContact CB-CE2 4.38Å; V685-F687 HydrophobicContact CG1-CE2 4.1Å; V685-F687 HydrophobicContact CG1-CZ 4.13Å
686	I	88.7	Confident	85.1	Confident	16 Å²	16	67 Å²	67	8%	0.082	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	120.8	-178.7	-51.7	-178.7	0	0	0	108.6	E649 S679 F681 E688	E649-I686 HydrophobicContact CB-CG2 3.75Å; E649-I686 HydrophobicContact CG-CG2 4.49Å; S679-I686 PolarHBondContact O-N 3.22Å; F681-I686 HydrophobicContact CB-CD1 3.82Å; F681-I686 HydrophobicContact CB-CG1 4.44Å; I686-E688 HydrophobicContact CG2-CG 3.88Å
687	F	87.2	Confident	84.7	Confident	6 Å²	6	73 Å²	73	3%	0.026	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	110.5	169.2	-67.6	-79.6	0	0	0	109.5	L638 F642 V650 Y652 L678 V685	L638-F687 HydrophobicContact CB-CE1 4.16Å; L638-F687 HydrophobicContact CB-CE2 4.47Å; L638-F687 HydrophobicContact CB-CZ 3.86Å; F642-F687 HydrophobicContact CB-CB 3.92Å; F642-F687 HydrophobicContact CB-CG 4.4Å; F642-F687 HydrophobicContact CD2-CB 4.29Å; F642-F687 AromaticContact CD2-CD2 3.6Å; F642-F687 HydrophobicContact CD2-CD2 3.6Å; F642-F687 HydrophobicContact CD2-CE2 4.02Å; F642-F687 AromaticContact CD2-CG 3.93Å; F642-F687 HydrophobicContact CD2-CG 3.93Å; F642-F687 HydrophobicContact CE2-CD2 4.12Å; F642-F687 HydrophobicContact CE2-CE2 4.19Å; V650-F687 HydrophobicContact CB-CB 4.41Å; V650-F687 PolarHBondContact N-O 3.38Å; V650-F687 PolarHBondContact O-N 3.29Å; Y652-F687 HydrophobicContact CD1-CE2 4.49Å; Y652-F687 HydrophobicContact CG-CE2 4.16Å; L678-F687 HydrophobicContact CD1-CE1 3.87Å; L678-F687 HydrophobicContact CD1-CZ 4.41Å; L678-F687 HydrophobicContact CD2-CD1 4.4Å; V685-F687 HydrophobicContact CB-CE2 4.38Å; V685-F687 HydrophobicContact CG1-CE2 4.1Å; V685-F687 HydrophobicContact CG1-CZ 4.13Å
688	E	79.6	Confident	84.3	Confident	69 Å²	69	77.1 Å²	77.1	32%	0.322	40%	0.404	S	S	.	.			trans	-100.8	146.8	176.1	-62.9	179.4	-147.3	0	0	110.6	E649 I686 Q690 I691	E649-E688 HydrophobicContact CB-CG 4.46Å; I686-E688 HydrophobicContact CG2-CG 3.88Å; E688-Q690 VanDerWaalsContact C-N 3.25Å; E688-Q690 PolarHBondContact O-N 3.45Å; E688-I691 HydrophobicContact CB-CB 4.22Å; E688-I691 HydrophobicContact CB-CD1 4.44Å; E688-I691 HydrophobicContact CB-CG1 4.21Å; E688-I691 HydrophobicContact CG-CD1 4.49Å; E688-I691 PolarHBondContact O-N 3.36Å; E688-I691 VanDerWaalsContact OE2-CD1 3.22Å; E688-I691 WeakPolarHBondContact OE2-CD1 3.46Å
689	K	71.4	Confident	83.9	Confident	152 Å²	152	82.6 Å²	82.6	66%	0.661	44%	0.44	S	S	*	.	S	Bend	trans	-63.4	-32.7	178.6	-177.2	176.2	179.6	-175.3	0	112.7	A643	A643-K689 WeakPolarHBondContact O-CD 3.3Å; A643-K689 WeakPolarHBondContact O-CG 3.36Å
690	Q	70.7	Confident	83.8	Confident	186 Å²	186	81.8 Å²	81.8	87%	0.869	43%	0.43	S	S	*	.	S	Bend	trans	-88	-19.5	-175.6	-62.1	-154.5	-3.3	0	0	113.6	E688	E688-Q690 VanDerWaalsContact C-N 3.25Å; E688-Q690 PolarHBondContact O-N 3.45Å
691	I	72.9	Confident	83.5	Confident	67 Å²	67	87.6 Å²	87.6	34%	0.344	45%	0.453	S	S	.	.			trans	-105.9	99.1	-177	-53.1	-178.3	0	0	0	108.3	E688	E688-I691 HydrophobicContact CB-CB 4.22Å; E688-I691 HydrophobicContact CB-CD1 4.44Å; E688-I691 HydrophobicContact CB-CG1 4.21Å; E688-I691 HydrophobicContact CG-CD1 4.49Å; E688-I691 PolarHBondContact O-N 3.36Å; E688-I691 VanDerWaalsContact OE2-CD1 3.22Å; E688-I691 WeakPolarHBondContact OE2-CD1 3.46Å
692	Q	77.9	Confident	83.4	Confident	129 Å²	129	85.9 Å²	85.9	60%	0.603	45%	0.446	S	S	*	.			trans	-82.4	142.5	169.8	-67.2	-170.8	-2.2	0	0	110.1	Q694	Q692-Q694 PolarHBondContact O-N 2.75Å
693	P	83.3	Confident	83.5	Confident	5 Å²	5	84.2 Å²	84.2	3%	0.032	44%	0.435	C	S	.	.			trans	-57.6	126	172.8	-12.9	22.3	0	0	0	109.6	M636 S639 W676 L678	M636-P693 HydrophobicContact SD-CB 3.89Å; M636-P693 HydrophobicContact SD-CG 4.04Å; M636-P693 VanDerWaalsContact SD-O 3.39Å; S639-P693 VanDerWaalsContact CB-CD 3.4Å; S639-P693 WeakPolarHBondContact OG-CD 3.44Å; S639-P693 WeakPolarHBondContact OG-CG 3.35Å; W676-P693 HydrophobicContact CB-CB 4.44Å; W676-P693 HydrophobicContact CE3-CB 3.8Å; W676-P693 CarbonylContact O-C 3.52Å; W676-P693 WeakPolarHBondContact O-CA 3.49Å; L678-P693 HydrophobicContact CD1-CB 4.48Å; L678-P693 HydrophobicContact CD1-CG 4.33Å; L678-P693 HydrophobicContact CD2-CB 4.46Å; L678-P693 HydrophobicContact CD2-CG 4.12Å; L678-P693 HydrophobicContact CG-CB 4.45Å; L678-P693 HydrophobicContact CG-CG 4.48Å
694	Q	83.1	Confident	83.6	Confident	143 Å²	143	83.9 Å²	83.9	67%	0.668	42%	0.422	S	S	*	.			trans	-107	137.8	176.8	-64	-166.4	14.2	0	0	109.9	W676 Q692	W676-Q694 CarbonylContact C-O 3.54Å; W676-Q694 WeakPolarHBondContact CA-O 3.46Å; W676-Q694 PolarHBondContact O-N 3.42Å; Q692-Q694 PolarHBondContact O-N 2.75Å
695	P	84.8	Confident	83.7	Confident	98 Å²	98	82.3 Å²	82.3	64%	0.636	41%	0.414	S	S	*	.			trans	-61.1	138.3	175.5	26.6	-33.2	0	0	0	109.7	W676	W676-P695 HydrophobicContact CH2-CB 4.1Å; W676-P695 HydrophobicContact CZ3-CB 4.32Å
696	P	84.9	Confident	83.7	Confident	35 Å²	35	87.1 Å²	87.1	23%	0.227	44%	0.435	C	S	.	.			trans	-65.6	149.7	-178.5	26.7	-35.6	0	0	0	112.4	T675 L698	T675-P696 HydrophobicContact CG2-CB 3.44Å; T675-P696 VanDerWaalsContact CG2-CB 3.44Å; T675-P696 HydrophobicContact CG2-CG 3.78Å; P696-L698 VanDerWaalsContact C-N 3.27Å; P696-L698 WeakPolarHBondContact CB-O 3.47Å; P696-L698 WeakPolarHBondContact CG-O 3.28Å; P696-L698 PolarHBondContact O-N 3.03Å
697	T	82.8	Confident	83.9	Confident	147 Å²	147	92.1 Å²	92.1	90%	0.902	46%	0.458	S	S	*	.	S	Bend	trans	-63.2	-33.4	176.4	49.8	0	0	0	0	112.8
698	L	81.8	Confident	84.3	Confident	135 Å²	135	92.7 Å²	92.7	71%	0.707	46%	0.461	S	S	*	.	S	Bend	trans	-106	134.9	172.4	-67.6	173.5	0	0	0	109.5	P696 W700	P696-L698 VanDerWaalsContact C-N 3.27Å; P696-L698 WeakPolarHBondContact CB-O 3.47Å; P696-L698 WeakPolarHBondContact CG-O 3.28Å; P696-L698 PolarHBondContact O-N 3.03Å; L698-W700 PolarHBondContact O-N 3.44Å
699	P	82.6	Confident	85.1	Confident	119 Å²	119	89.5 Å²	89.5	77%	0.773	45%	0.446	S	S	*	.			trans	-54.2	138.8	174.5	-25.3	33.8	0	0	0	111.5	K701	P699-K701 PolarHBondContact O-N 3.41Å
700	W	87.6	Confident	86	Confident	30 Å²	30	82.6 Å²	82.6	11%	0.114	42%	0.417	C	S	.	.			trans	-55.3	127.7	173.9	178.1	-96.7	0	0	0	110.1	V628 E668 D671 F672 T675 L698 E702	V628-W700 HydrophobicContact CG1-CB 4.23Å; V628-W700 HydrophobicContact CG2-CG 4.37Å; E668-W700 HydrophobicContact CG-CZ2 4.32Å; D671-W700 HydrophobicContact CB-CH2 4.14Å; F672-W700 HydrophobicContact CB-CH2 3.84Å; F672-W700 HydrophobicContact CB-CZ2 4.31Å; F672-W700 HydrophobicContact CB-CZ3 4.04Å; F672-W700 AromaticContact CD2-CD2 3.62Å; F672-W700 HydrophobicContact CD2-CD2 3.62Å; F672-W700 AromaticContact CD2-CE2 3.73Å; F672-W700 AromaticContact CD2-CE3 3.73Å; F672-W700 HydrophobicContact CD2-CE3 3.73Å; F672-W700 HydrophobicContact CD2-CG 4.19Å; F672-W700 HydrophobicContact CD2-CH2 4.04Å; F672-W700 AromaticContact CD2-CZ2 3.94Å; F672-W700 HydrophobicContact CD2-CZ2 3.94Å; F672-W700 AromaticContact CD2-CZ3 3.95Å; F672-W700 HydrophobicContact CD2-CZ3 3.95Å; F672-W700 HydrophobicContact CE2-CD2 4.04Å; F672-W700 HydrophobicContact CE2-CE3 4.38Å; F672-W700 HydrophobicContact CE2-CG 4.13Å; F672-W700 HydrophobicContact CG-CH2 4.46Å; F672-W700 HydrophobicContact CG-CZ3 4.43Å; T675-W700 HydrophobicContact CG2-CE3 4.16Å; T675-W700 HydrophobicContact CG2-CZ3 4.47Å; L698-W700 PolarHBondContact O-N 3.44Å; W700-E702 PolarHBondContact O-N 2.93Å
701	K	84.8	Confident	87.2	Confident	148 Å²	148	76.8 Å²	76.8	64%	0.643	39%	0.391	S	S	*	.			trans	-77.2	107.9	174.7	-175.1	-177.5	177.8	-172.4	0	108.4	P699 Q703	P699-K701 PolarHBondContact O-N 3.41Å; K701-Q703 PolarHBondContact O-N 3.41Å
702	E	86.7	Confident	88.2	Confident	84 Å²	84	76.3 Å²	76.3	39%	0.393	39%	0.387	S	S	.	.			trans	-58.8	134.8	177.7	-63.6	91.9	175.4	0	0	111.3	V513 V628 W700	V513-E702 HydrophobicContact CG2-CB 3.69Å; V628-E702 HydrophobicContact CG2-CG 3.83Å; W700-E702 PolarHBondContact O-N 2.93Å
703	Q	89.3	Confident	89	Confident	87 Å²	87	71.6 Å²	71.6	41%	0.407	36%	0.364	S	S	.	.			trans	-107.4	162.5	179.1	-61.1	-173	-0.3	0	0	110.1	H624 K701 S705	H624-Q703 PolarHBondContact CE1-O 3.42Å; H624-Q703 VanDerWaalsContact CE1-O 3.24Å; H624-Q703 PolarHBondContact NE2-O 3.42Å; H624-Q703 VanDerWaalsContact NE2-O 3.16Å; K701-Q703 PolarHBondContact O-N 3.41Å; Q703-S705 PolarHBondContact O-N 2.7Å
704	R	92.2	Very high	89.4	Confident	67 Å²	67	77.8 Å²	77.8	25%	0.253	40%	0.395	S	S	.	.			trans	-70.1	125.4	174.4	-74.6	174	61	-146.8	-5.2	110.8	R511 V513 D514 F706 E710	R511-R704 WeakPolarHBondContact O-CD 3.29Å; R511-R704 PolarHBondContact O-NE 3.32Å; V513-R704 HydrophobicContact CG1-CG 4.05Å; D514-R704 HydrophobicContact CB-CG 4.17Å; D514-R704 VanDerWaalsContact CG-CG 3.45Å; D514-R704 VanDerWaalsContact OD1-CD 3.23Å; D514-R704 WeakPolarHBondContact OD1-CD 3.43Å; D514-R704 WeakPolarHBondContact OD2-CD 3.22Å; D514-R704 WeakPolarHBondContact OD2-CG 3.5Å; R704-F706 PolarHBondContact O-N 3.42Å; R704-E710 IonicContact CZ-OE1 2.79Å; R704-E710 IonicContact CZ-OE2 3.72Å; R704-E710 IonicContact NE-OE1 3.8Å; R704-E710 PolarHBondContact NE-OE1 3.49Å; R704-E710 IonicContact NH2-OE1 3.68Å; R704-E710 PolarHBondContact NH2-OE1 3.39Å; R704-E710 IonicContact NH2-OE2 3.14Å; R704-E710 PolarHBondContact NH2-OE2 3.23Å
705	S	93.5	Very high	89.8	Confident	5 Å²	5	74.9 Å²	74.9	4%	0.035	40%	0.403	C	S	.	.			trans	-88	89.4	173.4	-63.5	0	0	0	0	111.1	H624 E664 Q703 V709 E710	H624-S705 PolarHBondContact CD2-OG 3.28Å; H624-S705 PolarHBondContact NE2-OG 3.25Å; E664-S705 WeakPolarHBondContact OE1-CA 3.32Å; E664-S705 WeakPolarHBondContact OE1-CB 3.17Å; Q703-S705 PolarHBondContact O-N 2.7Å; S705-V709 VanDerWaalsContact O-CB 3.31Å; S705-V709 WeakPolarHBondContact O-CB 3.39Å; S705-V709 PolarHBondContact O-N 3.11Å; S705-V709 VanDerWaalsContact O-N 3.16Å; S705-E710 PolarHBondContact O-N 3.32Å; S705-E710 VanDerWaalsContact O-N 3.15Å
706	F	92.4	Very high	90.2	Very high	101 Å²	101	73.8 Å²	73.8	44%	0.443	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-55.5	-176.7	-177.4	-98.3	0	0	0	112.4	E664 R704 E710 N711	E664-F706 VanDerWaalsContact CD-N 3.27Å; E664-F706 PolarHBondContact OE1-N 2.97Å; E664-F706 PolarHBondContact OE2-N 3.07Å; E664-F706 VanDerWaalsContact OE2-N 3.11Å; R704-F706 PolarHBondContact O-N 3.42Å; F706-E710 HydrophobicContact CD2-CB 4.18Å; F706-E710 CarbonylContact O-C 3.59Å; F706-E710 PolarHBondContact O-N 2.86Å; F706-E710 VanDerWaalsContact O-N 3.14Å; F706-N711 WeakPolarHBondContact O-CB 3.41Å; F706-N711 PolarHBondContact O-N 3.1Å
707	H	93.3	Very high	90.8	Very high	121 Å²	121	74.6 Å²	74.6	56%	0.56	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-41.9	-175.6	-57.7	93.9	0	0	0	111.7	E664	E664-H707 PolarHBondContact OE1-N 3.26Å; E664-H707 WeakPolarHBondContact OE2-CB 3.48Å; E664-H707 IonicContact OE2-CE1 3.52Å; E664-H707 IonicContact OE2-CG 2.97Å; E664-H707 PolarHBondContact OE2-N 3.35Å; E664-H707 IonicContact OE2-ND1 3.91Å; E664-H707 PolarHBondContact OE2-ND1 2.99Å
708	L	94.1	Very high	91.4	Very high	18 Å²	18	67.6 Å²	67.6	9%	0.094	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-28	-175.2	-173.2	58.8	0	0	0	113.3	F609 A612 R613 F627 E664 K712	F609-L708 HydrophobicContact CD1-CD2 4.04Å; F609-L708 HydrophobicContact CE1-CD2 4.27Å; A612-L708 HydrophobicContact CB-CD1 4.49Å; R613-L708 HydrophobicContact CG-CD1 3.7Å; F627-L708 HydrophobicContact CE2-CD2 3.59Å; F627-L708 HydrophobicContact CE2-CG 4.35Å; F627-L708 HydrophobicContact CZ-CD2 3.59Å; F627-L708 HydrophobicContact CZ-CG 4.23Å; E664-L708 PolarHBondContact OE1-N 3.24Å; E664-L708 VanDerWaalsContact OE1-N 3.08Å; L708-K712 WeakPolarHBondContact O-CE 3.41Å
709	V	96.5	Very high	92.2	Very high	2 Å²	2	61.5 Å²	61.5	1%	0.012	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118	-60.7	-175.7	-178.6	0	0	0	0	112	A510 A620 C621 F627 S705 K712	A510-V709 HydrophobicContact CB-CG1 4.26Å; A620-V709 HydrophobicContact CB-CB 4.38Å; A620-V709 HydrophobicContact CB-CG1 4.03Å; A620-V709 HydrophobicContact CB-CG2 4.14Å; C621-V709 HydrophobicContact CB-CG1 4.39Å; C621-V709 VanDerWaalsContact SG-CG1 3.54Å; F627-V709 HydrophobicContact CE2-CG2 4.22Å; F627-V709 HydrophobicContact CZ-CG2 4.28Å; S705-V709 VanDerWaalsContact O-CB 3.31Å; S705-V709 WeakPolarHBondContact O-CB 3.39Å; S705-V709 PolarHBondContact O-N 3.11Å; S705-V709 VanDerWaalsContact O-N 3.16Å; V709-K712 WeakPolarHBondContact O-CB 3.47Å; V709-K712 PolarHBondContact O-N 3Å
710	E	91.9	Very high	92.9	Very high	7 Å²	7	57.7 Å²	57.7	3%	0.033	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-70.3	-37	-170.2	-66	-171.3	-149.3	0	0	113.6	R511 R704 S705 F706 K712 R713	R511-E710 WeakPolarHBondContact CD-OE1 3.47Å; R511-E710 VanDerWaalsContact CD-OE2 3.28Å; R511-E710 WeakPolarHBondContact CD-OE2 3.2Å; R511-E710 IonicContact NE-OE1 3.39Å; R511-E710 IonicContact NE-OE2 3.37Å; R704-E710 IonicContact CZ-OE1 2.79Å; R704-E710 IonicContact CZ-OE2 3.72Å; R704-E710 IonicContact NE-OE1 3.8Å; R704-E710 PolarHBondContact NE-OE1 3.49Å; R704-E710 IonicContact NH2-OE1 3.68Å; R704-E710 PolarHBondContact NH2-OE1 3.39Å; R704-E710 IonicContact NH2-OE2 3.14Å; R704-E710 PolarHBondContact NH2-OE2 3.23Å; S705-E710 PolarHBondContact O-N 3.32Å; S705-E710 VanDerWaalsContact O-N 3.15Å; F706-E710 HydrophobicContact CD2-CB 4.18Å; F706-E710 CarbonylContact O-C 3.59Å; F706-E710 PolarHBondContact O-N 2.86Å; F706-E710 VanDerWaalsContact O-N 3.14Å; E710-K712 PolarHBondContact O-N 3.25Å; E710-R713 WeakPolarHBondContact O-CG 3.46Å; E710-R713 PolarHBondContact O-N 3.36Å; E710-R713 IonicContact OE2-NH2 3.32Å
711	N	94.3	Very high	93.4	Very high	64 Å²	64	57.3 Å²	57.3	34%	0.342	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-62	-18.4	-178.1	-165.2	33.4	0	0	0	112.7	F706 R713 I714	F706-N711 WeakPolarHBondContact O-CB 3.41Å; F706-N711 PolarHBondContact O-N 3.1Å; N711-R713 PolarHBondContact O-N 3.28Å; N711-R713 VanDerWaalsContact O-N 3.17Å; N711-I714 WeakPolarHBondContact O-CB 3.41Å; N711-I714 WeakPolarHBondContact O-CG2 3.49Å; N711-I714 PolarHBondContact O-N 2.9Å; N711-I714 VanDerWaalsContact O-N 3.11Å
712	K	95.5	Very high	94	Very high	57 Å²	57	50.3 Å²	50.3	25%	0.248	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-64.6	-15	173.2	-64.3	169.6	175.6	-83.5	0	113.7	A612 R613 A615 C617 A620 L708 V709 E710	A612-K712 VanDerWaalsContact O-CE 3.22Å; A612-K712 WeakPolarHBondContact O-CE 3.4Å; A612-K712 PolarHBondContact O-NZ 2.98Å; R613-K712 PolarHBondContact O-NZ 3.02Å; A615-K712 WeakPolarHBondContact O-CD 3.3Å; A615-K712 PolarHBondContact O-NZ 3.38Å; C617-K712 HydrophobicContact CB-CB 4.02Å; A620-K712 HydrophobicContact CB-CD 3.77Å; L708-K712 WeakPolarHBondContact O-CE 3.41Å; V709-K712 WeakPolarHBondContact O-CB 3.47Å; V709-K712 PolarHBondContact O-N 3Å; E710-K712 PolarHBondContact O-N 3.25Å
713	R	94.2	Very high	94.5	Very high	31 Å²	31	47.2 Å²	47.2	12%	0.117	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-100	4.5	175.7	87.2	-156	161.3	82	-11.9	113.3	E458 C617 E710 N711 G715 I716	E458-R713 VanDerWaalsContact CD-NH1 3.26Å; E458-R713 IonicContact OE1-CZ 3.45Å; E458-R713 IonicContact OE1-NH1 2.63Å; E458-R713 PolarHBondContact OE1-NH1 2.99Å; E458-R713 IonicContact OE1-NH2 3.68Å; E458-R713 PolarHBondContact OE1-NH2 2.96Å; E458-R713 IonicContact OE2-NH1 3.93Å; E458-R713 PolarHBondContact OE2-NH1 3.38Å; C617-R713 HydrophobicContact CB-CB 4.28Å; E710-R713 WeakPolarHBondContact O-CG 3.46Å; E710-R713 PolarHBondContact O-N 3.36Å; E710-R713 IonicContact OE2-NH2 3.32Å; N711-R713 PolarHBondContact O-N 3.28Å; N711-R713 VanDerWaalsContact O-N 3.17Å; R713-G715 PolarHBondContact O-N 2.91Å; R713-I716 WeakPolarHBondContact O-CA 3.44Å; R713-I716 WeakPolarHBondContact O-CB 3.43Å; R713-I716 PolarHBondContact O-N 3.12Å
714	I	91.3	Very high	94.7	Very high	135 Å²	135	45.7 Å²	45.7	69%	0.692	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	126.5	-173.2	-165.9	164.8	0	0	0	110.9	N711 I716	N711-I714 WeakPolarHBondContact O-CB 3.41Å; N711-I714 WeakPolarHBondContact O-CG2 3.49Å; N711-I714 PolarHBondContact O-N 2.9Å; N711-I714 VanDerWaalsContact O-N 3.11Å; I714-I716 VanDerWaalsContact C-N 3.31Å; I714-I716 PolarHBondContact O-N 3.25Å
715	G	90.6	Very high	94.7	Very high	81 Å²	81	45.2 Å²	45.2	84%	0.835	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.3	-4.8	-175	0	0	0	0	0	116.2	R713	R713-G715 PolarHBondContact O-N 2.91Å
716	I	95.1	Very high	94.7	Very high	75 Å²	75	50.2 Å²	50.2	39%	0.385	30%	0.299	S	S	.	.			trans	-103.4	114.3	177.3	-53.3	175.4	0	0	0	109	R713 I714 V720 L721	R713-I716 WeakPolarHBondContact O-CA 3.44Å; R713-I716 WeakPolarHBondContact O-CB 3.43Å; R713-I716 PolarHBondContact O-N 3.12Å; I714-I716 VanDerWaalsContact C-N 3.31Å; I714-I716 PolarHBondContact O-N 3.25Å; I716-V720 HydrophobicContact CG2-CB 4.1Å; I716-V720 HydrophobicContact CG2-CG1 3.93Å; I716-L721 HydrophobicContact CG2-CB 4.46Å
717	P	95.7	Very high	94.7	Very high	52 Å²	52	46.8 Å²	46.8	34%	0.338	29%	0.286	S	S	.	.			trans	-67.1	154.6	176.4	27.6	-33	0	0	0	111.6	D455 S719 V720 L721	D455-P717 WeakPolarHBondContact OD1-CB 3.48Å; P717-S719 PolarHBondContact O-N 2.83Å; P717-V720 HydrophobicContact CG-CB 3.95Å; P717-V720 HydrophobicContact CG-CG2 3.62Å; P717-V720 PolarHBondContact O-N 2.95Å; P717-V720 VanDerWaalsContact O-N 3.16Å; P717-L721 PolarHBondContact O-N 2.88Å
718	L	97.1	Very high	94.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-58.9	-36.7	-179.5	-61	-176.2	0	0	0	111.9	A454 D455 P457 E458 W466 W469 F507 V720 L721 F722	A454-L718 HydrophobicContact CB-CB 4.49Å; A454-L718 WeakPolarHBondContact O-CD1 3.42Å; D455-L718 WeakPolarHBondContact OD1-CA 3.38Å; D455-L718 WeakPolarHBondContact OD1-CB 3.44Å; D455-L718 PolarHBondContact OD1-N 3.35Å; P457-L718 HydrophobicContact CG-CD1 4.39Å; E458-L718 HydrophobicContact CG-CD1 3.93Å; E458-L718 HydrophobicContact CG-CG 4.33Å; W466-L718 HydrophobicContact CH2-CD1 4.2Å; W469-L718 HydrophobicContact CZ2-CD1 4.27Å; F507-L718 HydrophobicContact CD1-CD2 4.23Å; F507-L718 HydrophobicContact CD2-CD2 4.3Å; F507-L718 HydrophobicContact CE1-CD1 3.99Å; F507-L718 HydrophobicContact CE1-CD2 3.59Å; F507-L718 HydrophobicContact CE1-CG 4.45Å; F507-L718 HydrophobicContact CE2-CD2 3.69Å; F507-L718 HydrophobicContact CZ-CD1 4.27Å; F507-L718 HydrophobicContact CZ-CD2 3.28Å; F507-L718 HydrophobicContact CZ-CG 4.43Å; L718-V720 PolarHBondContact O-N 2.63Å; L718-L721 HydrophobicContact CD2-CD2 4.38Å; L718-L721 WeakPolarHBondContact O-CB 3.23Å; L718-L721 PolarHBondContact O-N 2.81Å; L718-F722 HydrophobicContact CB-CE2 3.88Å; L718-F722 HydrophobicContact CB-CZ 3.9Å; L718-F722 HydrophobicContact CD2-CZ 4.35Å; L718-F722 HydrophobicContact CG-CZ 4.48Å; L718-F722 VanDerWaalsContact O-CD2 3.25Å; L718-F722 WeakPolarHBondContact O-CD2 3.37Å; L718-F722 WeakPolarHBondContact O-CG 3.41Å; L718-F722 PolarHBondContact O-N 3.21Å
719	S	97.3	Very high	94.5	Very high	8 Å²	8	49.5 Å²	49.5	6%	0.056	31%	0.31	C	S	.	.	H	α-helix	trans	-55.2	-52.6	175.4	66.7	0	0	0	0	110.9	L450 D455 P717 F722 N723 I727	L450-S719 WeakPolarHBondContact O-CB 3.38Å; D455-S719 PolarHBondContact OD1-N 3.32Å; D455-S719 PolarHBondContact OD1-OG 3.25Å; D455-S719 WeakPolarHBondContact OD2-CB 3.24Å; D455-S719 PolarHBondContact OD2-OG 3.43Å; P717-S719 PolarHBondContact O-N 2.83Å; S719-F722 PolarHBondContact O-N 3.48Å; S719-N723 VanDerWaalsContact O-CB 3.3Å; S719-N723 WeakPolarHBondContact O-CB 3.33Å; S719-N723 PolarHBondContact O-N 3.04Å; S719-I727 WeakPolarHBondContact O-CD1 3.05Å
720	V	97.6	Very high	94.3	Very high	39 Å²	39	52.3 Å²	52.3	24%	0.236	33%	0.33	C	S	.	.	H	α-helix	trans	-65	-41	176.5	174.7	0	0	0	0	111.7	I716 P717 L718 F722 N723 G724	I716-V720 HydrophobicContact CG2-CB 4.1Å; I716-V720 HydrophobicContact CG2-CG1 3.93Å; P717-V720 HydrophobicContact CG-CB 3.95Å; P717-V720 HydrophobicContact CG-CG2 3.62Å; P717-V720 PolarHBondContact O-N 2.95Å; P717-V720 VanDerWaalsContact O-N 3.16Å; L718-V720 PolarHBondContact O-N 2.63Å; V720-F722 VanDerWaalsContact C-N 3.32Å; V720-F722 PolarHBondContact O-N 3.49Å; V720-N723 PolarHBondContact O-N 3.26Å; V720-G724 PolarHBondContact O-N 3.21Å
721	L	97.6	Very high	94.3	Very high	22 Å²	22	54.8 Å²	54.8	12%	0.115	34%	0.343	C	S	.	.	H	α-helix	trans	-58.3	-43.1	177.5	-177.1	66.8	0	0	0	112.1	R503 F507 C617 L618 I716 P717 L718	R503-L721 WeakPolarHBondContact CD-O 3.29Å; F507-L721 HydrophobicContact CB-CD2 4.5Å; F507-L721 HydrophobicContact CD2-CD2 3.78Å; F507-L721 HydrophobicContact CE2-CD2 4.34Å; F507-L721 HydrophobicContact CG-CD2 4.29Å; C617-L721 HydrophobicContact CB-CD1 4.4Å; L618-L721 HydrophobicContact CD1-CD1 4.32Å; L618-L721 HydrophobicContact CD2-CD1 4.18Å; L618-L721 HydrophobicContact CD2-CD2 4.12Å; L618-L721 HydrophobicContact CD2-CG 4.12Å; L618-L721 HydrophobicContact CG-CD1 3.99Å; L618-L721 HydrophobicContact CG-CG 4.41Å; I716-L721 HydrophobicContact CG2-CB 4.46Å; P717-L721 PolarHBondContact O-N 2.88Å; L718-L721 HydrophobicContact CD2-CD2 4.38Å; L718-L721 WeakPolarHBondContact O-CB 3.23Å; L718-L721 PolarHBondContact O-N 2.81Å
722	F	98.2	Very high	94.1	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-77.5	-36.1	180	-56	-22.3	0	0	0	112	L450 A454 W469 R500 R503 F504 F507 L718 S719 V720 G724	L450-F722 HydrophobicContact CD2-CB 3.66Å; L450-F722 HydrophobicContact CD2-CD2 3.84Å; L450-F722 HydrophobicContact CD2-CG 4.27Å; A454-F722 HydrophobicContact CB-CD2 4.05Å; A454-F722 HydrophobicContact CB-CE2 4.13Å; W469-F722 HydrophobicContact CH2-CE2 4.36Å; W469-F722 HydrophobicContact CH2-CZ 4.31Å; W469-F722 HydrophobicContact CZ2-CE2 4.08Å; W469-F722 HydrophobicContact CZ2-CZ 4.44Å; R500-F722 WeakPolarHBondContact CA-O 3.36Å; R500-F722 WeakPolarHBondContact CG-O 3.25Å; R503-F722 HydrophobicContact CB-CD1 4.43Å; R503-F722 PolarHBondContact NH1-O 2.81Å; F504-F722 HydrophobicContact CB-CD1 4.4Å; F504-F722 HydrophobicContact CB-CD2 4.31Å; F504-F722 HydrophobicContact CB-CE2 4.41Å; F504-F722 HydrophobicContact CB-CG 4.31Å; F504-F722 HydrophobicContact CD2-CE2 4.02Å; F504-F722 HydrophobicContact CD2-CZ 4.18Å; F507-F722 HydrophobicContact CB-CE1 3.6Å; F507-F722 HydrophobicContact CB-CZ 4.26Å; F507-F722 AromaticContact CD1-CE1 3.91Å; F507-F722 HydrophobicContact CD1-CE1 3.91Å; F507-F722 AromaticContact CD1-CZ 3.73Å; F507-F722 HydrophobicContact CD1-CZ 3.73Å; F507-F722 HydrophobicContact CE1-CZ 4.38Å; F507-F722 AromaticContact CG-CE1 3.83Å; F507-F722 HydrophobicContact CG-CE1 3.83Å; F507-F722 HydrophobicContact CG-CZ 4.14Å; L718-F722 HydrophobicContact CB-CE2 3.88Å; L718-F722 HydrophobicContact CB-CZ 3.9Å; L718-F722 HydrophobicContact CD2-CZ 4.35Å; L718-F722 HydrophobicContact CG-CZ 4.48Å; L718-F722 VanDerWaalsContact O-CD2 3.25Å; L718-F722 WeakPolarHBondContact O-CD2 3.37Å; L718-F722 WeakPolarHBondContact O-CG 3.41Å; L718-F722 PolarHBondContact O-N 3.21Å; S719-F722 PolarHBondContact O-N 3.48Å; V720-F722 VanDerWaalsContact C-N 3.32Å; V720-F722 PolarHBondContact O-N 3.49Å; F722-G724 VanDerWaalsContact C-N 3.3Å; F722-G724 PolarHBondContact O-N 3.44Å
723	N	97.2	Very high	93.9	Very high	20 Å²	20	56.9 Å²	56.9	11%	0.107	36%	0.361	C	S	.	.	H	α-helix	trans	-67.9	-30.9	177.6	-163.7	42.4	0	0	0	112.5	L450 R500 S719 V720 S725 P726 I727	L450-N723 HydrophobicContact CD1-CB 3.86Å; R500-N723 VanDerWaalsContact CZ-OD1 3.26Å; R500-N723 PolarHBondContact NE-OD1 3.41Å; R500-N723 PolarHBondContact NH2-OD1 3.32Å; S719-N723 VanDerWaalsContact O-CB 3.3Å; S719-N723 WeakPolarHBondContact O-CB 3.33Å; S719-N723 PolarHBondContact O-N 3.04Å; V720-N723 PolarHBondContact O-N 3.26Å; N723-S725 WeakPolarHBondContact CB-O 3.41Å; N723-S725 PolarHBondContact ND2-O 3.42Å; N723-S725 PolarHBondContact ND2-OG 2.86Å; N723-S725 VanDerWaalsContact ND2-OG 3.13Å; N723-S725 PolarHBondContact O-N 3.12Å; N723-P726 PolarHBondContact ND2-O 3.45Å; N723-P726 VanDerWaalsContact ND2-O 3.09Å; N723-I727 HydrophobicContact CB-CD1 4.01Å; N723-I727 HydrophobicContact CB-CG1 3.67Å; N723-I727 WeakPolarHBondContact ND2-CG1 3.25Å
724	G	93.6	Very high	93.5	Very high	55 Å²	55	57.2 Å²	57.2	57%	0.567	37%	0.367	S	S	*	.	S	Bend	trans	80.4	-5.9	-172.5	0	0	0	0	0	113.5	V720 F722	V720-G724 PolarHBondContact O-N 3.21Å; F722-G724 VanDerWaalsContact C-N 3.3Å; F722-G724 PolarHBondContact O-N 3.44Å
725	S	92.1	Very high	93.3	Very high	56 Å²	56	53.3 Å²	53.3	39%	0.392	35%	0.352	S	S	.	.	S	Bend	trans	-152.8	168.5	179.2	69.9	0	0	0	0	109.9	N723	N723-S725 WeakPolarHBondContact CB-O 3.41Å; N723-S725 PolarHBondContact ND2-O 3.42Å; N723-S725 PolarHBondContact ND2-OG 2.86Å; N723-S725 VanDerWaalsContact ND2-OG 3.13Å; N723-S725 PolarHBondContact O-N 3.12Å
726	P	93.2	Very high	93.3	Very high	110 Å²	110	55.2 Å²	55.2	71%	0.714	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-51.4	143.6	169.9	-26.8	36.2	0	0	0	112.2	N723	N723-P726 PolarHBondContact ND2-O 3.45Å; N723-P726 VanDerWaalsContact ND2-O 3.09Å
727	I	93.1	Very high	93.2	Very high	30 Å²	30	53.8 Å²	53.8	15%	0.154	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-95.9	144.5	177.3	-69.5	160.9	0	0	0	109.3	L450 A451 S719 N723 P729	L450-I727 HydrophobicContact CB-CD1 3.67Å; L450-I727 HydrophobicContact CD1-CD1 4.46Å; A451-I727 HydrophobicContact CB-CG2 3.81Å; S719-I727 WeakPolarHBondContact O-CD1 3.05Å; N723-I727 HydrophobicContact CB-CD1 4.01Å; N723-I727 HydrophobicContact CB-CG1 3.67Å; N723-I727 WeakPolarHBondContact ND2-CG1 3.25Å; I727-P729 WeakPolarHBondContact O-CD 3.48Å
728	N	92	Very high	92.9	Very high	90 Å²	90	56.5 Å²	56.5	48%	0.481	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-74.3	120.6	173.5	-173.8	-8.9	0	0	0	110	S730 D731	N728-S730 PolarHBondContact ND2-OG 2.93Å; N728-S730 PolarHBondContact O-N 3.27Å; N728-S730 VanDerWaalsContact O-N 3.08Å; N728-S730 PolarHBondContact OD1-N 3.4Å; N728-S730 VanDerWaalsContact OD1-N 3.13Å; N728-S730 PolarHBondContact OD1-OG 2.84Å; N728-D731 WeakPolarHBondContact O-CB 3.42Å; N728-D731 PolarHBondContact O-N 3.27Å
729	P	89.9	Confident	92.6	Very high	105 Å²	105	59.2 Å²	59.2	68%	0.682	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-57	-25.5	178.9	-25.2	34.9	0	0	0	114.2	I727 D731 A732	I727-P729 WeakPolarHBondContact O-CD 3.48Å; P729-D731 PolarHBondContact O-N 3.49Å; P729-A732 WeakPolarHBondContact O-CB 3.37Å; P729-A732 PolarHBondContact O-N 3.49Å
730	S	92.2	Very high	92.3	Very high	62 Å²	62	60.4 Å²	60.4	43%	0.434	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-63.4	-25	176.9	63.8	0	0	0	0	113.1	N728 A732 I733	N728-S730 PolarHBondContact ND2-OG 2.93Å; N728-S730 PolarHBondContact O-N 3.27Å; N728-S730 VanDerWaalsContact O-N 3.08Å; N728-S730 PolarHBondContact OD1-N 3.4Å; N728-S730 VanDerWaalsContact OD1-N 3.13Å; N728-S730 PolarHBondContact OD1-OG 2.84Å; S730-A732 PolarHBondContact O-N 3.37Å; S730-I733 PolarHBondContact O-N 2.95Å; S730-I733 VanDerWaalsContact O-N 3.14Å
731	D	92.3	Very high	92	Very high	58 Å²	58	59 Å²	59	31%	0.31	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-68.1	-16.1	179.3	-61.2	-23.3	0	0	0	112.2	A447 Y448 A451 N728 P729 I733	A447-D731 HydrophobicContact CB-CB 3.84Å; Y448-D731 WeakPolarHBondContact CA-O 3.33Å; A451-D731 HydrophobicContact CB-CB 4.05Å; N728-D731 WeakPolarHBondContact O-CB 3.42Å; N728-D731 PolarHBondContact O-N 3.27Å; P729-D731 PolarHBondContact O-N 3.49Å; D731-I733 VanDerWaalsContact C-N 3.28Å; D731-I733 PolarHBondContact O-N 2.9Å
732	A	90.8	Very high	91.5	Very high	37 Å²	37	60.5 Å²	60.5	31%	0.306	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-73.4	-19.1	174.9	0	0	0	0	0	113.1	A451 S452 P729 S730 P734	A451-A732 HydrophobicContact CB-CB 3.87Å; S452-A732 WeakPolarHBondContact OG-CA 3.42Å; S452-A732 PolarHBondContact OG-O 3.42Å; S452-A732 VanDerWaalsContact OG-O 3.13Å; P729-A732 WeakPolarHBondContact O-CB 3.37Å; P729-A732 PolarHBondContact O-N 3.49Å; S730-A732 PolarHBondContact O-N 3.37Å; A732-P734 WeakPolarHBondContact O-CD 3.17Å
733	I	91	Very high	90.8	Very high	128 Å²	128	68.8 Å²	68.8	66%	0.656	42%	0.421	S	S	*	.	S	Bend	trans	-89.6	111.7	-175.5	-55.2	173	0	0	0	108.8	S730 D731	S730-I733 PolarHBondContact O-N 2.95Å; S730-I733 VanDerWaalsContact O-N 3.14Å; D731-I733 VanDerWaalsContact C-N 3.28Å; D731-I733 PolarHBondContact O-N 2.9Å
734	P	86.7	Confident	90.2	Very high	39 Å²	39	73.6 Å²	73.6	25%	0.253	45%	0.447	S	S	.	.	P	Polyproline II helix	trans	-67.2	138.3	-179.5	27.4	-32.8	0	0	0	111	M378 T415 Y448 A732	M378-P734 HydrophobicContact CE-CB 4.42Å; T415-P734 WeakPolarHBondContact O-CB 3.19Å; Y448-P734 HydrophobicContact CE2-CB 4.22Å; A732-P734 WeakPolarHBondContact O-CD 3.17Å
735	S	86.9	Confident	89.7	Confident	53 Å²	53	71.1 Å²	71.1	37%	0.371	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-71.2	153.2	174.6	-54.3	0	0	0	0	111.2	V737	S735-V737 PolarHBondContact O-N 3.49Å
736	P	90.5	Very high	89.4	Confident	121 Å²	121	73.2 Å²	73.2	79%	0.786	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-55.1	134.2	169.3	-22.9	33.3	0	0	0	110.7
737	V	92.9	Very high	89.1	Confident	45 Å²	45	71.1 Å²	71.1	27%	0.273	40%	0.401	S	S	.	.	P	Polyproline II helix	trans	-82.1	148.4	178.8	-71.2	0	0	0	0	111.7	D377 H414 S735	D377-V737 WeakPolarHBondContact OD1-CA 3.4Å; H414-V737 HydrophobicContact CB-CG2 3.99Å; H414-V737 WeakPolarHBondContact O-CG1 3.29Å; S735-V737 PolarHBondContact O-N 3.49Å
738	Q	89.5	Confident	88.6	Confident	109 Å²	109	74 Å²	74	51%	0.509	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-71.4	136	170.6	-63.8	-175.1	-11.4	0	0	110.4	D377 R384	D377-Q738 PolarHBondContact OD1-N 3.16Å; D377-Q738 PolarHBondContact OD2-N 2.84Å; R384-Q738 PolarHBondContact NH2-O 3.19Å
739	S	90.2	Very high	87	Confident	57 Å²	57	74.1 Å²	74.1	40%	0.399	42%	0.423	S	S	.	.			trans	-122.1	129.3	174.8	172.5	0	0	0	0	108.6	E381 F741	E381-S739 WeakPolarHBondContact OE1-CA 3.28Å; S739-F741 PolarHBondContact O-N 2.87Å; S739-F741 PolarHBondContact OG-N 2.82Å; S739-F741 VanDerWaalsContact OG-N 3.08Å; S739-F741 PolarHBondContact OG-O 2.96Å
740	S	90.7	Very high	85.2	Confident	33 Å²	33	74.1 Å²	74.1	23%	0.231	43%	0.425	C	S	.	.	S	Bend	trans	-75.8	0.3	170.5	-59	0	0	0	0	112.4	E381 Y747 I748	E381-S740 PolarHBondContact OE1-N 2.63Å; E381-S740 VanDerWaalsContact OE2-CB 3.26Å; E381-S740 WeakPolarHBondContact OE2-CB 3.46Å; E381-S740 PolarHBondContact OE2-N 3.48Å; E381-S740 VanDerWaalsContact OE2-N 3.13Å; E381-S740 PolarHBondContact OE2-OG 2.9Å; S740-Y747 VanDerWaalsContact CB-CE2 3.48Å; S740-Y747 CarbonylContact O-C 3.56Å; S740-Y747 WeakPolarHBondContact O-CA 3.42Å; S740-Y747 WeakPolarHBondContact O-CD2 3.12Å; S740-I748 PolarHBondContact O-N 3.34Å
741	F	91.5	Very high	82.6	Confident	8 Å²	8	79.4 Å²	79.4	4%	0.035	44%	0.443	C	S	.	.	B	Isolated β-bridge	trans	-114.6	138.3	178.4	-55.7	-88.9	0	0	0	110.7	A321 R327 V330 L331 S739 K746 Y747	A321-F741 HydrophobicContact CB-CD1 4.16Å; A321-F741 HydrophobicContact CB-CE1 3.78Å; R327-F741 HydrophobicContact CB-CD2 4.48Å; R327-F741 HydrophobicContact CB-CE1 4.43Å; R327-F741 HydrophobicContact CB-CE2 3.8Å; R327-F741 HydrophobicContact CB-CZ 3.77Å; R327-F741 HydrophobicContact CG-CD1 4.28Å; R327-F741 HydrophobicContact CG-CD2 4.11Å; R327-F741 HydrophobicContact CG-CE1 4.06Å; R327-F741 HydrophobicContact CG-CE2 3.87Å; R327-F741 HydrophobicContact CG-CG 4.31Å; R327-F741 HydrophobicContact CG-CZ 3.85Å; V330-F741 HydrophobicContact CB-CE1 4.19Å; V330-F741 HydrophobicContact CB-CZ 4.09Å; V330-F741 HydrophobicContact CG1-CE1 4.04Å; V330-F741 HydrophobicContact CG1-CZ 4.1Å; L331-F741 HydrophobicContact CD1-CE2 4.02Å; L331-F741 HydrophobicContact CD2-CE2 4.11Å; L331-F741 HydrophobicContact CD2-CZ 4.4Å; L331-F741 HydrophobicContact CG-CE2 3.9Å; L331-F741 HydrophobicContact CG-CZ 4.05Å; S739-F741 PolarHBondContact O-N 2.87Å; S739-F741 PolarHBondContact OG-N 2.82Å; S739-F741 VanDerWaalsContact OG-N 3.08Å; S739-F741 PolarHBondContact OG-O 2.96Å; F741-K746 CarbonylContact C-O 3.59Å; F741-K746 VanDerWaalsContact CA-O 3.31Å; F741-K746 WeakPolarHBondContact CA-O 3.26Å; F741-Y747 HydrophobicContact CD1-CD2 4.48Å; F741-Y747 HydrophobicContact CE1-CD2 4.07Å; F741-Y747 HydrophobicContact CZ-CD2 4.23Å
742	D	88.2	Confident	79.9	Confident	55 Å²	55	86.1 Å²	86.1	29%	0.294	47%	0.47	S	S	.	.			trans	-72.6	178.1	170.6	71.1	15.4	0	0	0	112	N744 G745 K746 I748	D742-N744 PolarHBondContact O-N 2.86Å; D742-N744 VanDerWaalsContact O-N 3.15Å; D742-N744 VanDerWaalsContact OD1-C 3.28Å; D742-N744 VanDerWaalsContact OD1-CA 3.3Å; D742-N744 WeakPolarHBondContact OD1-CA 3.27Å; D742-N744 WeakPolarHBondContact OD1-CB 3.39Å; D742-N744 PolarHBondContact OD1-N 3.12Å; D742-G745 PolarHBondContact O-N 3.01Å; D742-G745 PolarHBondContact OD1-N 3.39Å; D742-K746 PolarHBondContact N-O 3.24Å; D742-K746 WeakPolarHBondContact OD1-CB 3.26Å; D742-K746 PolarHBondContact OD1-N 2.89Å; D742-K746 VanDerWaalsContact OD2-CB 3.31Å; D742-K746 WeakPolarHBondContact OD2-CB 3.22Å; D742-I748 HydrophobicContact CB-CD1 4.03Å; D742-I748 HydrophobicContact CB-CG1 4.12Å
743	I	83.1	Confident	76.9	Confident	173 Å²	173	93.9 Å²	93.9	89%	0.887	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.8	178.9	-68.3	161.6	0	0	0	112.1	G745	I743-G745 VanDerWaalsContact C-N 3.33Å
744	N	84	Confident	73.8	Confident	122 Å²	122	96 Å²	96	65%	0.652	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	6.6	178.8	-59.3	-32.8	0	0	0	112.6	D742 K746	D742-N744 PolarHBondContact O-N 2.86Å; D742-N744 VanDerWaalsContact O-N 3.15Å; D742-N744 VanDerWaalsContact OD1-C 3.28Å; D742-N744 VanDerWaalsContact OD1-CA 3.3Å; D742-N744 WeakPolarHBondContact OD1-CA 3.27Å; D742-N744 WeakPolarHBondContact OD1-CB 3.39Å; D742-N744 PolarHBondContact OD1-N 3.12Å; N744-K746 VanDerWaalsContact C-N 3.29Å; N744-K746 PolarHBondContact O-N 3.11Å
745	G	82.7	Confident	71	Confident	2 Å²	2	99.9 Å²	99.9	2%	0.021	53%	0.526	C	S	.	.	S	Bend	trans	74	15.5	-178.2	0	0	0	0	0	114	A321 D742 I743	A321-G745 PolarHBondContact N-O 3.22Å; D742-G745 PolarHBondContact O-N 3.01Å; D742-G745 PolarHBondContact OD1-N 3.39Å; I743-G745 VanDerWaalsContact C-N 3.33Å
746	K	86.3	Confident	68	Low	100 Å²	100	105.6 Å²	105.6	44%	0.435	55%	0.547	S	S	.	.			trans	-87.8	134.5	178.8	-134.4	176.7	-176.5	178.3	0	110.2	S318 F741 D742 N744 I748	S318-K746 WeakPolarHBondContact OG-CE 3.47Å; F741-K746 CarbonylContact C-O 3.59Å; F741-K746 VanDerWaalsContact CA-O 3.31Å; F741-K746 WeakPolarHBondContact CA-O 3.26Å; D742-K746 PolarHBondContact N-O 3.24Å; D742-K746 WeakPolarHBondContact OD1-CB 3.26Å; D742-K746 PolarHBondContact OD1-N 2.89Å; D742-K746 VanDerWaalsContact OD2-CB 3.31Å; D742-K746 WeakPolarHBondContact OD2-CB 3.22Å; N744-K746 VanDerWaalsContact C-N 3.29Å; N744-K746 PolarHBondContact O-N 3.11Å; K746-I748 PolarHBondContact O-N 3.02Å
747	Y	86.4	Confident	65	Low	67 Å²	67	107.3 Å²	107.3	26%	0.263	55%	0.55	S	S	.	.	B	Isolated β-bridge	trans	-68.8	124.7	179.9	-176.1	-101.7	0	0	0	111.3	V330 L331 N334 S740 F741 C749	V330-Y747 HydrophobicContact CG1-CD2 3.73Å; V330-Y747 HydrophobicContact CG1-CE2 4.36Å; V330-Y747 HydrophobicContact CG1-CG 3.96Å; L331-Y747 HydrophobicContact CD2-CE2 4.37Å; N334-Y747 WeakPolarHBondContact ND2-CE1 3.2Å; N334-Y747 WeakPolarHBondContact ND2-CE2 3.26Å; N334-Y747 PolarHBondContact ND2-OH 3.16Å; S740-Y747 VanDerWaalsContact CB-CE2 3.48Å; S740-Y747 CarbonylContact O-C 3.56Å; S740-Y747 WeakPolarHBondContact O-CA 3.42Å; S740-Y747 WeakPolarHBondContact O-CD2 3.12Å; F741-Y747 HydrophobicContact CD1-CD2 4.48Å; F741-Y747 HydrophobicContact CE1-CD2 4.07Å; F741-Y747 HydrophobicContact CZ-CD2 4.23Å; Y747-C749 HydrophobicContact CE1-CB 4.43Å; Y747-C749 PolarHBondContact O-N 3.16Å
748	I	81.9	Confident	61.9	Low	91 Å²	91	112 Å²	112	47%	0.467	57%	0.573	S	S	.	*			trans	-89.5	101	177.2	-51.8	170	0	0	0	107.2	S740 D742 K746 S750	S740-I748 PolarHBondContact O-N 3.34Å; D742-I748 HydrophobicContact CB-CD1 4.03Å; D742-I748 HydrophobicContact CB-CG1 4.12Å; K746-I748 PolarHBondContact O-N 3.02Å; I748-S750 PolarHBondContact O-N 3.32Å; I748-S750 VanDerWaalsContact O-N 3.09Å
749	C	59.2	Low	58.9	Low	91 Å²	91	113.9 Å²	113.9	62%	0.615	59%	0.587	S	S	*	*			trans	-65.8	112	171.1	-170.6	0	0	0	0	108.2	Y747 Q751	Y747-C749 HydrophobicContact CE1-CB 4.43Å; Y747-C749 PolarHBondContact O-N 3.16Å; C749-Q751 PolarHBondContact O-N 3.35Å
750	S	53	Low	55.9	Low	105 Å²	105	118.6 Å²	118.6	73%	0.734	61%	0.608	S	S	*	*			trans	-68.6	79.4	176.6	47.9	0	0	0	0	110.1	I748 K752	I748-S750 PolarHBondContact O-N 3.32Å; I748-S750 VanDerWaalsContact O-N 3.09Å; S750-K752 PolarHBondContact O-N 3.43Å
751	Q	38	Very low	52.9	Low	174 Å²	174	123.7 Å²	123.7	81%	0.813	64%	0.637	S	S	*	*			trans	-58	121.6	157.8	-69.4	-173.5	-16.2	0	0	106.3	C749 K753	C749-Q751 PolarHBondContact O-N 3.35Å; Q751-K753 PolarHBondContact O-N 3.07Å
752	K	34.7	Very low	49.7	Very low	198 Å²	198	131.4 Å²	131.4	86%	0.861	68%	0.678	S	S	*	*			trans	-39.7	119	170	-74.9	177.6	176.3	178.4	0	106.9	S750 H754	S750-K752 PolarHBondContact O-N 3.43Å; K752-H754 PolarHBondContact O-N 2.89Å
753	K	27.7	Very low	46.8	Very low	200 Å²	200	135.8 Å²	135.8	87%	0.87	70%	0.702	S	S	*	*			trans	-48	110.2	169.7	-79	-178.1	175.2	-179.9	0	105.7	Q751 T755	Q751-K753 PolarHBondContact O-N 3.07Å; K753-T755 VanDerWaalsContact C-N 3.3Å; K753-T755 PolarHBondContact O-N 3.19Å
754	H	26.3	Very low	44.1	Very low	172 Å²	172	137.1 Å²	137.1	80%	0.796	70%	0.697	S	S	*	*			trans	-56.8	107.2	163.8	-94.7	-79.5	0	0	0	104.3	K752 Q756	K752-H754 PolarHBondContact O-N 2.89Å; H754-Q756 PolarHBondContact O-N 3.28Å
755	T	26.4	Very low	41.4	Very low	121 Å²	121	137.8 Å²	137.8	74%	0.742	70%	0.701	S	S	*	*			trans	-57.4	85.4	155.6	26.8	0	0	0	0	105.9	K753 N757	K753-T755 VanDerWaalsContact C-N 3.3Å; K753-T755 PolarHBondContact O-N 3.19Å; T755-N757 PolarHBondContact O-N 3.22Å
756	Q	25.7	Very low	38.7	Very low	174 Å²	174	145.6 Å²	145.6	81%	0.813	74%	0.742	S	S	*	*			trans	-65.5	94	155.8	-78.8	-177.3	-20.9	0	0	105.2	H754	H754-Q756 PolarHBondContact O-N 3.28Å
757	N	27	Very low	35.8	Very low	157 Å²	157	152.5 Å²	152.5	84%	0.84	77%	0.765	S	S	*	*			trans	-174.4	61.7	141.5	-85	-9.8	0	0	0	105.9	T755 N759	T755-N757 PolarHBondContact O-N 3.22Å; N757-N759 VanDerWaalsContact C-N 3.34Å; N757-N759 PolarHBondContact O-N 2.82Å
758	D	26.6	Very low	32.9	Very low	143 Å²	143	156.6 Å²	156.6	77%	0.765	79%	0.79	S	S	*	*			trans	-74.3	96.8	157.6	-74.1	-35.3	0	0	0	105.9
759	N	27.9	Very low	30.4	Very low	149 Å²	149	157.3 Å²	157.3	80%	0.797	80%	0.8	S	S	*	*			trans	173	74.3	152.3	-84.5	-16.3	0	0	0	106.6	N757	N757-N759 VanDerWaalsContact C-N 3.34Å; N757-N759 PolarHBondContact O-N 2.82Å
760	D	26.3	Very low	28.8	Very low	156 Å²	156	160.8 Å²	160.8	83%	0.834	81%	0.813	S	S	*	*			trans	-158.6	95.8	148.5	-88.3	-30.8	0	0	0	106.7	L762	D760-L762 PolarHBondContact O-N 3.11Å; D760-L762 VanDerWaalsContact O-N 3.08Å
761	T	27.8	Very low	27.4	Very low	139 Å²	139	160.1 Å²	160.1	85%	0.853	81%	0.808	S	S	*	*			trans	-34.8	112.4	158.6	12	0	0	0	0	109.5	D763	T761-D763 PolarHBondContact O-N 2.58Å
762	L	25	Very low	26.8	Very low	171 Å²	171	159.3 Å²	159.3	90%	0.895	81%	0.809	S	S	*	*			trans	-63.7	82.8	172.3	-82.3	158.1	0	0	0	108.9	D760 Y764	D760-L762 PolarHBondContact O-N 3.11Å; D760-L762 VanDerWaalsContact O-N 3.08Å; L762-Y764 PolarHBondContact O-N 3.19Å
763	D	26.1	Very low	26.4	Very low	146 Å²	146	157.4 Å²	157.4	78%	0.781	81%	0.807	S	S	*	*			trans	-73.6	112.5	168.5	-148.4	-4.8	0	0	0	107.5	T761 N765	T761-D763 PolarHBondContact O-N 2.58Å; D763-N765 PolarHBondContact O-N 2.85Å
764	Y	26.6	Very low	26.2	Very low	201 Å²	201	153.8 Å²	153.8	79%	0.788	81%	0.806	S	S	*	*	S	Bend	trans	-79.6	53.4	-166.4	-140.9	-85.6	0	0	0	111	L762	L762-Y764 PolarHBondContact O-N 3.19Å
765	N	27.5	Very low	26	Very low	137 Å²	137	151.8 Å²	151.8	73%	0.733	80%	0.801	S	S	*	*			trans	-162	87.3	174.6	-82.6	-46.2	0	0	0	110	D763	D763-N765 PolarHBondContact O-N 2.85Å
766	N	25.6	Very low	26	Very low	165 Å²	165	153.5 Å²	153.5	88%	0.882	81%	0.806	S	S	*	*			trans	-161	94.4	146.7	-91.6	-32.1	0	0	0	109.5	I768	N766-I768 PolarHBondContact O-N 3.42Å
767	R	26.3	Very low	25.8	Very low	245 Å²	245	152 Å²	152	93%	0.925	80%	0.803	S	S	*	*			trans	-53.2	126.3	159.2	-76	177.2	177.8	177.3	-0.9	107.7
768	I	24.2	Very low	25.7	Very low	154 Å²	154	155.8 Å²	155.8	79%	0.79	81%	0.806	S	S	*	*			trans	-48.3	125.9	177.4	-64.1	162.6	0	0	0	109	N766 D770	N766-I768 PolarHBondContact O-N 3.42Å; I768-D770 PolarHBondContact O-N 2.87Å
769	P	29.7	Very low	25.6	Very low	105 Å²	105	155.4 Å²	155.4	68%	0.682	80%	0.804	S	S	*	*			trans	-77.8	115.6	-179.5	29.6	-30	0	0	0	109.7	S771	P769-S771 PolarHBondContact O-N 3.38Å
770	D	25.5	Very low	25.4	Very low	165 Å²	165	154.6 Å²	154.6	88%	0.882	80%	0.804	S	S	*	*			trans	-53	105	165.4	-73.1	-41	0	0	0	109.8	I768	I768-D770 PolarHBondContact O-N 2.87Å
771	S	23.6	Very low	26	Very low	91 Å²	91	152.4 Å²	152.4	64%	0.636	80%	0.799	S	S	*	*			trans	-134.8	97.9	171.3	50.8	0	0	0	0	109.2	P769	P769-S771 PolarHBondContact O-N 3.38Å
772	N	26.8	Very low	25.8	Very low	156 Å²	156	155.7 Å²	155.7	83%	0.834	80%	0.801	S	S	*	*			trans	163.4	72.7	133.2	-78.7	-21.1	0	0	0	108.6	C774	N772-C774 PolarHBondContact O-N 3.1Å
773	I	25.2	Very low	25.6	Very low	158 Å²	158	154.9 Å²	154.9	81%	0.81	80%	0.795	S	S	*	*			trans	-70.1	104	162.4	-66.3	169.6	0	0	0	106.4	N775	I773-N775 PolarHBondContact O-N 3.26Å
774	C	23.3	Very low	25.5	Very low	124 Å²	124	158.4 Å²	158.4	84%	0.838	80%	0.799	S	S	*	*			trans	-72	108.2	162.8	-79.7	0	0	0	0	108.6	N772	N772-C774 PolarHBondContact O-N 3.1Å
775	N	22.1	Very low	25.3	Very low	130 Å²	130	156.3 Å²	156.3	70%	0.695	80%	0.796	S	S	*	*			trans	-37.1	130.5	171.1	-70.5	-33.7	0	0	0	114.4	I773	I773-N775 PolarHBondContact O-N 3.26Å
776	N	27.6	Very low	25	Very low	158 Å²	158	158 Å²	158	85%	0.845	80%	0.8	S	S	*	*			trans	-143.8	100.2	143	-90.4	-29.6	0	0	0	108.8	W778	N776-W778 PolarHBondContact O-N 2.82Å
777	N	21.9	Very low	25	Very low	141 Å²	141	156.2 Å²	156.2	75%	0.754	80%	0.797	S	S	*	*			trans	-63.3	119.9	172.7	-79.5	-18.6	0	0	0	111.5
778	W	23.9	Very low	24.7	Very low	238 Å²	238	149.7 Å²	149.7	90%	0.902	79%	0.785	S	S	*	*			trans	-140.5	94.8	148.7	-75.2	77.9	0	0	0	109.6	N776	N776-W778 PolarHBondContact O-N 2.82Å
779	N	24.1	Very low	24.7	Very low	135 Å²	135	149.2 Å²	149.2	72%	0.722	79%	0.789	S	S	*	*			trans	31.8	109	142.6	-61.8	-10.9	0	0	0	121.3
780	T	23.5	Very low	24.3	Very low	132 Å²	132	151.2 Å²	151.2	81%	0.81	79%	0.794	S	S	*	*				38.4	153.1	118.3	42.1	0	0	0	0	123.1
781	P	40.3	Very low	24.2	Very low	110 Å²	110	148.1 Å²	148.1	71%	0.714	79%	0.785	S	S	*	*			trans	-108.3	155.4	-131	39.9	-33.5	0	0	0	114.9
782	F	23.5	Very low	24.2	Very low	207 Å²	207	149.2 Å²	149.2	91%	0.908	79%	0.788	S	S	*	*			trans	-117.4	107.1	158.8	-88.5	-81.2	0	0	0	111.1
783	M	20.3	Very low	23.9	Very low	155 Å²	155	149.3 Å²	149.3	76%	0.764	79%	0.788	S	S	*	*			trans	-70.2	128.2	167.5	-157	171.9	76.7	0	0	108.7
784	Y	23.7	Very low	23.8	Very low	220 Å²	220	145.3 Å²	145.3	86%	0.863	78%	0.779	S	S	*	*			trans	-125.3	133.1	154.6	-107.1	-82.9	0	0	0	109.1
785	Q	23.3	Very low	23.8	Very low	156 Å²	156	145.3 Å²	145.3	73%	0.729	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-77.2	147.3	-154.4	-68	160.2	-46.4	0	0	114
786	Q	20.2	Very low	24	Very low	174 Å²	174	145.6 Å²	145.6	81%	0.813	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-66.5	143.9	150.8	-73.7	173.1	-23.6	0	0	110.4
787	P	25.6	Very low	23.9	Very low	126 Å²	126	145.4 Å²	145.4	82%	0.818	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-96.7	116.1	145.7	4.8	15.1	0	0	0	108.7
788	T	20.4	Very low	24	Very low	109 Å²	109	143.4 Å²	143.4	67%	0.669	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-70.3	133.5	167.5	42.4	0	0	0	0	110.4
789	T	24.2	Very low	23.9	Very low	143 Å²	143	143.2 Å²	143.2	88%	0.877	78%	0.777	S	S	*	*			trans	-130.3	115.9	155.4	51.7	0	0	0	0	109
790	N	22.1	Very low	24	Very low	148 Å²	148	145.4 Å²	145.4	79%	0.791	79%	0.787	S	S	*	*			trans	-74.2	158.2	-178.5	-76.5	-29.6	0	0	0	113.1
791	S	22.4	Very low	24.3	Very low	99 Å²	99	145.7 Å²	145.7	69%	0.692	79%	0.789	S	S	*	*			trans	85.8	106.8	140.6	91.9	0	0	0	0	120.5
792	T	23.2	Very low	23.9	Very low	114 Å²	114	149.3 Å²	149.3	70%	0.699	80%	0.797	S	S	*	*				75.8	118.8	117.4	54.7	0	0	0	0	121.7
793	L	21.8	Very low	24.3	Very low	158 Å²	158	150.8 Å²	150.8	83%	0.827	80%	0.796	S	S	*	*				79.7	107	125	-71.1	162	0	0	0	119.5
794	A	23	Very low	24.9	Very low	75 Å²	75	150.1 Å²	150.1	62%	0.62	80%	0.796	S	S	*	*				89.8	120	113.8	0	0	0	0	0	119.7
795	T	23	Very low	25.6	Very low	124 Å²	124	146.3 Å²	146.3	76%	0.761	79%	0.789	S	S	*	*			trans	62.9	117.2	138.8	42.6	0	0	0	0	118.9
796	T	26.4	Very low	26.3	Very low	135 Å²	135	148.6 Å²	148.6	83%	0.828	79%	0.792	S	S	*	*				-177.5	115.1	103.7	28.5	0	0	0	0	112.3
797	N	25	Very low	27.2	Very low	154 Å²	154	145.8 Å²	145.8	82%	0.824	78%	0.783	S	S	*	*			trans	22.6	124.2	138.5	-65.1	-17.1	0	0	0	121.9
798	S	23.2	Very low	28	Very low	99 Å²	99	148.3 Å²	148.3	69%	0.692	78%	0.781	S	S	*	*				81.1	143.1	120.9	-165.6	0	0	0	0	119.3
799	W	23.5	Very low	29.2	Very low	235 Å²	235	150.4 Å²	150.4	89%	0.89	78%	0.78	S	S	*	*			trans	86.7	103.1	178.6	-61.1	77.4	0	0	0	115.6
800	L	26.2	Very low	29.9	Very low	181 Å²	181	149.8 Å²	149.8	95%	0.948	77%	0.768	S	S	*	*			trans	176.6	72.3	131.7	-89.2	167.3	0	0	0	110.1
801	T	29	Very low	30.8	Very low	138 Å²	138	147.8 Å²	147.8	85%	0.847	76%	0.756	S	S	*	*			trans	-99.9	109.1	159.6	26.7	0	0	0	0	108.3
802	E	31.2	Very low	32	Very low	186 Å²	186	145.8 Å²	145.8	87%	0.869	74%	0.742	S	S	*	*			trans	179.8	12.9	143.1	-107.4	179.2	-174.6	0	0	116.8
803	R	31.9	Very low	33.2	Very low	237 Å²	237	145 Å²	145	89%	0.894	73%	0.733	S	S	*	*	S	Bend	trans	-107.1	7.8	-175.4	-125.2	177.5	-164.9	157.8	4.9	119.3
804	N	33.6	Very low	34.7	Very low	141 Å²	141	143.1 Å²	143.1	75%	0.754	72%	0.72	S	S	*	*			trans	-107.1	12.9	-176.3	-78	-11.8	0	0	0	116.7
805	I	38.6	Very low	36	Very low	141 Å²	141	144.5 Å²	144.5	72%	0.723	72%	0.717	S	S	*	*	S	Bend	trans	-80	-23	177.5	-65	175.6	0	0	0	112.6
806	Y	37.8	Very low	37.2	Very low	204 Å²	204	144.5 Å²	144.5	80%	0.8	71%	0.712	S	S	*	*	H	α-helix	trans	-77.7	-35.1	-173.7	-123.8	-91	0	0	0	114.2	K808	Y806-K808 PolarHBondContact O-N 2.93Å
807	N	39.7	Very low	38.4	Very low	114 Å²	114	144 Å²	144	61%	0.61	70%	0.7	S	S	*	*	H	α-helix	trans	-79.2	-20	-174.7	-71.5	-4.9	0	0	0	114.3
808	K	41.6	Very low	40.1	Very low	180 Å²	180	141.1 Å²	141.1	78%	0.783	68%	0.684	S	S	*	*	H	α-helix	trans	-75.1	-29.5	178.8	-118.8	-178.9	-179.2	-177.5	0	113.1	Y806 S812	Y806-K808 PolarHBondContact O-N 2.93Å; K808-S812 PolarHBondContact O-N 2.92Å; K808-S812 PolarHBondContact O-OG 3.21Å
809	K	45.5	Very low	41.6	Very low	152 Å²	152	140.3 Å²	140.3	66%	0.661	67%	0.674	S	S	*	*	H	α-helix	trans	-76.5	-29.2	-178.2	-125.3	178.8	-177.2	-178.3	0	113	S812 N813	K809-S812 PolarHBondContact O-OG 3.38Å; K809-N813 WeakPolarHBondContact O-CB 3.45Å; K809-N813 VanDerWaalsContact O-CG 3.25Å; K809-N813 PolarHBondContact O-N 2.97Å; K809-N813 PolarHBondContact O-OD1 2.98Å
810	Q	39.3	Very low	43	Very low	131 Å²	131	136.6 Å²	136.6	61%	0.612	66%	0.661	S	S	*	*	H	α-helix	trans	-72.7	-42.1	179.1	-162.2	170.6	-1.4	0	0	111.3	S812 N813 E814	Q810-S812 PolarHBondContact O-N 2.93Å; Q810-N813 PolarHBondContact O-N 3.1Å; Q810-E814 PolarHBondContact O-N 3.38Å; Q810-E814 VanDerWaalsContact O-N 3.08Å
811	I	40.7	Very low	44.5	Very low	106 Å²	106	131.8 Å²	131.8	54%	0.544	64%	0.636	S	S	.	*	H	α-helix	trans	-67.4	-36.6	177.2	-59.8	172	0	0	0	111.4	N813 L815	I811-N813 VanDerWaalsContact C-N 3.33Å; I811-L815 HydrophobicContact CG2-CD1 4.36Å; I811-L815 PolarHBondContact O-N 3.34Å; I811-L815 VanDerWaalsContact O-N 3.17Å
812	S	47.9	Very low	45.6	Very low	57 Å²	57	131.5 Å²	131.5	40%	0.399	63%	0.625	S	S	.	*	H	α-helix	trans	-67.7	-34.3	175.9	65.3	0	0	0	0	112.8	K808 K809 Q810 L816	K808-S812 PolarHBondContact O-N 2.92Å; K808-S812 PolarHBondContact O-OG 3.21Å; K809-S812 PolarHBondContact O-OG 3.38Å; Q810-S812 PolarHBondContact O-N 2.93Å; S812-L816 WeakPolarHBondContact O-CB 3.36Å; S812-L816 PolarHBondContact O-N 3.32Å
813	N	47.6	Very low	46.4	Very low	97 Å²	97	125.7 Å²	125.7	52%	0.519	60%	0.604	S	S	.	*	H	α-helix	trans	-74.6	-39.3	180	-75.2	0.5	0	0	0	111.9	K809 Q810 I811 L815 L816 E817	K809-N813 WeakPolarHBondContact O-CB 3.45Å; K809-N813 VanDerWaalsContact O-CG 3.25Å; K809-N813 PolarHBondContact O-N 2.97Å; K809-N813 PolarHBondContact O-OD1 2.98Å; Q810-N813 PolarHBondContact O-N 3.1Å; I811-N813 VanDerWaalsContact C-N 3.33Å; N813-L815 VanDerWaalsContact C-N 3.34Å; N813-L815 PolarHBondContact O-N 2.97Å; N813-L816 PolarHBondContact O-N 3.4Å; N813-E817 WeakPolarHBondContact O-CB 3.47Å; N813-E817 PolarHBondContact O-N 2.76Å
814	E	54.5	Low	47	Very low	118 Å²	118	116.8 Å²	116.8	55%	0.551	58%	0.576	S	S	*	*	H	α-helix	trans	-61.5	-42	172.3	-88	-178.6	155.1	0	0	111.6	Q810 L816 E817 I818	Q810-E814 PolarHBondContact O-N 3.38Å; Q810-E814 VanDerWaalsContact O-N 3.08Å; E814-L816 VanDerWaalsContact C-N 3.35Å; E814-L816 PolarHBondContact O-N 2.94Å; E814-E817 PolarHBondContact O-N 2.85Å; E814-I818 VanDerWaalsContact O-CG1 3.25Å; E814-I818 WeakPolarHBondContact O-CG1 3.18Å; E814-I818 PolarHBondContact O-N 3.36Å
815	L	49.6	Very low	47.5	Very low	104 Å²	104	115.2 Å²	115.2	55%	0.545	57%	0.568	S	S	.	*	H	α-helix	trans	-64.7	-38.7	175.2	-80.3	168.9	0	0	0	112.4	I811 N813 E817 I818 V819	I811-L815 HydrophobicContact CG2-CD1 4.36Å; I811-L815 PolarHBondContact O-N 3.34Å; I811-L815 VanDerWaalsContact O-N 3.17Å; N813-L815 VanDerWaalsContact C-N 3.34Å; N813-L815 PolarHBondContact O-N 2.97Å; L815-E817 VanDerWaalsContact C-N 3.33Å; L815-I818 PolarHBondContact O-N 3.25Å; L815-V819 VanDerWaalsContact O-CG2 3.3Å; L815-V819 WeakPolarHBondContact O-CG2 3.28Å; L815-V819 PolarHBondContact O-N 2.88Å
816	L	48.6	Very low	47.9	Very low	125 Å²	125	113.8 Å²	113.8	65%	0.654	56%	0.558	S	S	*	*	H	α-helix	trans	-65.9	-38.3	176.4	-156.7	89.6	0	0	0	111.4	S812 N813 E814 V819 Y820	S812-L816 WeakPolarHBondContact O-CB 3.36Å; S812-L816 PolarHBondContact O-N 3.32Å; N813-L816 PolarHBondContact O-N 3.4Å; E814-L816 VanDerWaalsContact C-N 3.35Å; E814-L816 PolarHBondContact O-N 2.94Å; L816-V819 PolarHBondContact O-N 3.27Å; L816-Y820 WeakPolarHBondContact O-CB 3.44Å; L816-Y820 PolarHBondContact O-N 3.31Å
817	E	52	Low	48.2	Very low	123 Å²	123	109 Å²	109	58%	0.575	55%	0.55	S	S	*	*	H	α-helix	trans	-70.8	-36.6	178.7	-160.2	172	-159.2	0	0	111.6	N813 E814 L815 Y820 N821	N813-E817 WeakPolarHBondContact O-CB 3.47Å; N813-E817 PolarHBondContact O-N 2.76Å; E814-E817 PolarHBondContact O-N 2.85Å; L815-E817 VanDerWaalsContact C-N 3.33Å; E817-Y820 PolarHBondContact O-N 2.91Å; E817-N821 VanDerWaalsContact O-CB 3.31Å; E817-N821 WeakPolarHBondContact O-CB 3.46Å; E817-N821 PolarHBondContact O-N 2.91Å; E817-N821 PolarHBondContact O-ND2 2.64Å; E817-N821 VanDerWaalsContact O-ND2 3.12Å
818	I	60.9	Low	48.3	Very low	95 Å²	95	108.3 Å²	108.3	49%	0.487	55%	0.546	S	S	.	.	H	α-helix	trans	-63.2	-48.1	172	-68.5	164	0	0	0	110.7	E814 L815 Y820 N821 E822	E814-I818 VanDerWaalsContact O-CG1 3.25Å; E814-I818 WeakPolarHBondContact O-CG1 3.18Å; E814-I818 PolarHBondContact O-N 3.36Å; L815-I818 PolarHBondContact O-N 3.25Å; I818-Y820 VanDerWaalsContact C-N 3.33Å; I818-Y820 PolarHBondContact O-N 3.24Å; I818-N821 PolarHBondContact O-N 3.33Å; I818-E822 PolarHBondContact O-N 2.95Å
819	V	54.7	Low	48.4	Very low	81 Å²	81	102.5 Å²	102.5	49%	0.491	53%	0.528	S	S	.	.	H	α-helix	trans	-65.1	-39.5	178.6	173.5	0	0	0	0	111.1	L815 L816 E822 C823	L815-V819 VanDerWaalsContact O-CG2 3.3Å; L815-V819 WeakPolarHBondContact O-CG2 3.28Å; L815-V819 PolarHBondContact O-N 2.88Å; L816-V819 PolarHBondContact O-N 3.27Å; V819-E822 PolarHBondContact O-N 3.14Å; V819-C823 WeakPolarHBondContact O-CB 3.47Å; V819-C823 PolarHBondContact O-N 3.38Å; V819-C823 PolarHBondContact O-SG 2.96Å
820	Y	52.3	Low	48.2	Very low	158 Å²	158	102 Å²	102	62%	0.62	52%	0.523	S	S	*	.	H	α-helix	trans	-63.5	-44.9	176.3	-174.3	-96.1	0	0	0	111.4	L816 E817 I818 C823 V824	L816-Y820 WeakPolarHBondContact O-CB 3.44Å; L816-Y820 PolarHBondContact O-N 3.31Å; E817-Y820 PolarHBondContact O-N 2.91Å; I818-Y820 VanDerWaalsContact C-N 3.33Å; I818-Y820 PolarHBondContact O-N 3.24Å; Y820-C823 PolarHBondContact O-N 3.05Å; Y820-V824 HydrophobicContact CD1-CG2 4.02Å; Y820-V824 HydrophobicContact CE1-CG2 3.68Å; Y820-V824 HydrophobicContact CE2-CG2 4.43Å; Y820-V824 WeakPolarHBondContact O-CB 3.35Å; Y820-V824 VanDerWaalsContact O-CG2 3.25Å; Y820-V824 WeakPolarHBondContact O-CG2 3.5Å; Y820-V824 PolarHBondContact O-N 3.06Å
821	N	56.9	Low	48.1	Very low	79 Å²	79	98.3 Å²	98.3	42%	0.422	51%	0.511	S	S	.	.	H	α-helix	trans	-68.6	-38.2	178.1	-71.4	-29.9	0	0	0	112.1	E817 I818 V824 D825	E817-N821 VanDerWaalsContact O-CB 3.31Å; E817-N821 WeakPolarHBondContact O-CB 3.46Å; E817-N821 PolarHBondContact O-N 2.91Å; E817-N821 PolarHBondContact O-ND2 2.64Å; E817-N821 VanDerWaalsContact O-ND2 3.12Å; I818-N821 PolarHBondContact O-N 3.33Å; N821-V824 PolarHBondContact O-N 3.26Å; N821-D825 VanDerWaalsContact O-CB 3.32Å; N821-D825 WeakPolarHBondContact O-CB 3.47Å; N821-D825 PolarHBondContact O-N 3.42Å
822	E	52.6	Low	48.1	Very low	132 Å²	132	97.3 Å²	97.3	62%	0.617	51%	0.51	S	S	*	.	H	α-helix	trans	-61.8	-44.5	171.9	-86.4	-172.4	150.7	0	0	111.6	I818 V819 D825 E826	I818-E822 PolarHBondContact O-N 2.95Å; V819-E822 PolarHBondContact O-N 3.14Å; E822-D825 PolarHBondContact O-N 2.96Å; E822-E826 VanDerWaalsContact O-CB 3.26Å; E822-E826 WeakPolarHBondContact O-CB 3.31Å; E822-E826 PolarHBondContact O-N 3.19Å
823	C	48.4	Very low	47.7	Very low	64 Å²	64	100.8 Å²	100.8	43%	0.432	52%	0.518	S	S	.	.	H	α-helix	trans	-66.3	-37.8	176.7	-76.1	0	0	0	0	112.5	V819 Y820 E826 V827	V819-C823 WeakPolarHBondContact O-CB 3.47Å; V819-C823 PolarHBondContact O-N 3.38Å; V819-C823 PolarHBondContact O-SG 2.96Å; Y820-C823 PolarHBondContact O-N 3.05Å; C823-E826 PolarHBondContact O-N 2.95Å; C823-V827 WeakPolarHBondContact O-CB 3.32Å; C823-V827 VanDerWaalsContact O-CG2 3.25Å; C823-V827 WeakPolarHBondContact O-CG2 3.43Å; C823-V827 PolarHBondContact O-N 3.09Å
824	V	45	Very low	47.2	Very low	50 Å²	50	99.5 Å²	99.5	30%	0.303	52%	0.517	S	S	.	.	H	α-helix	trans	-68.7	-41.7	176.6	169.7	0	0	0	0	110.8	Y820 N821 E826 V827 L828	Y820-V824 HydrophobicContact CD1-CG2 4.02Å; Y820-V824 HydrophobicContact CE1-CG2 3.68Å; Y820-V824 HydrophobicContact CE2-CG2 4.43Å; Y820-V824 WeakPolarHBondContact O-CB 3.35Å; Y820-V824 VanDerWaalsContact O-CG2 3.25Å; Y820-V824 WeakPolarHBondContact O-CG2 3.5Å; Y820-V824 PolarHBondContact O-N 3.06Å; N821-V824 PolarHBondContact O-N 3.26Å; V824-E826 VanDerWaalsContact C-N 3.33Å; V824-V827 PolarHBondContact O-N 3.34Å; V824-L828 HydrophobicContact CG1-CD1 3.77Å; V824-L828 HydrophobicContact CG1-CG 4.3Å; V824-L828 WeakPolarHBondContact O-CB 3.36Å; V824-L828 VanDerWaalsContact O-CG 3.27Å; V824-L828 WeakPolarHBondContact O-CG 3.41Å; V824-L828 PolarHBondContact O-N 3.44Å
825	D	43.4	Very low	46.5	Very low	108 Å²	108	100.1 Å²	100.1	58%	0.578	52%	0.52	S	S	*	.	H	α-helix	trans	-66.1	-36.9	175	-78.7	-20.5	0	0	0	111.5	N821 E822 L828 S829	N821-D825 VanDerWaalsContact O-CB 3.32Å; N821-D825 WeakPolarHBondContact O-CB 3.47Å; N821-D825 PolarHBondContact O-N 3.42Å; E822-D825 PolarHBondContact O-N 2.96Å; D825-L828 PolarHBondContact O-N 2.85Å; D825-S829 WeakPolarHBondContact O-CB 3.32Å; D825-S829 PolarHBondContact O-N 2.96Å
826	E	46.6	Very low	46.2	Very low	112 Å²	112	98.9 Å²	98.9	52%	0.523	52%	0.517	S	S	.	.	H	α-helix	trans	-66.2	-42.3	174.5	-158.6	179.7	-166.8	0	0	110.9	E822 C823 V824 S829 Y830	E822-E826 VanDerWaalsContact O-CB 3.26Å; E822-E826 WeakPolarHBondContact O-CB 3.31Å; E822-E826 PolarHBondContact O-N 3.19Å; C823-E826 PolarHBondContact O-N 2.95Å; V824-E826 VanDerWaalsContact C-N 3.33Å; E826-S829 WeakPolarHBondContact O-CB 3.42Å; E826-S829 PolarHBondContact O-N 3.23Å; E826-S829 PolarHBondContact O-OG 3.01Å; E826-Y830 HydrophobicContact CG-CE2 4.2Å; E826-Y830 WeakPolarHBondContact O-CD2 3.48Å; E826-Y830 WeakPolarHBondContact O-CE2 3.22Å; E826-Y830 PolarHBondContact O-N 3.24Å
827	V	44.7	Very low	46	Very low	104 Å²	104	95.8 Å²	95.8	63%	0.63	50%	0.503	S	S	*	.	H	α-helix	trans	-67.3	-41.1	174.9	172.1	0	0	0	0	112.1	C823 V824 S829 Y830	C823-V827 WeakPolarHBondContact O-CB 3.32Å; C823-V827 VanDerWaalsContact O-CG2 3.25Å; C823-V827 WeakPolarHBondContact O-CG2 3.43Å; C823-V827 PolarHBondContact O-N 3.09Å; V824-V827 PolarHBondContact O-N 3.34Å; V827-S829 VanDerWaalsContact C-N 3.27Å; V827-S829 PolarHBondContact O-N 3.02Å; V827-Y830 PolarHBondContact O-N 2.66Å
828	L	42.1	Very low	45.5	Very low	99 Å²	99	95 Å²	95	52%	0.518	50%	0.502	S	S	.	.	H	α-helix	trans	-67.3	-29.6	174.8	-72.5	171.2	0	0	0	111.5	V824 D825 Y830 S831	V824-L828 HydrophobicContact CG1-CD1 3.77Å; V824-L828 HydrophobicContact CG1-CG 4.3Å; V824-L828 WeakPolarHBondContact O-CB 3.36Å; V824-L828 VanDerWaalsContact O-CG 3.27Å; V824-L828 WeakPolarHBondContact O-CG 3.41Å; V824-L828 PolarHBondContact O-N 3.44Å; D825-L828 PolarHBondContact O-N 2.85Å; L828-Y830 VanDerWaalsContact C-N 3.25Å; L828-Y830 PolarHBondContact O-N 2.87Å; L828-S831 WeakPolarHBondContact O-CB 3.3Å; L828-S831 PolarHBondContact O-N 3.22Å; L828-S831 VanDerWaalsContact O-N 3.07Å; L828-S831 PolarHBondContact O-OG 3.06Å
829	S	42.9	Very low	44.6	Very low	57 Å²	57	95.7 Å²	95.7	40%	0.399	51%	0.506	S	S	.	.	H	α-helix	trans	-62.2	-33.6	173.4	83.6	0	0	0	0	112	D825 E826 V827 S831 T832	D825-S829 WeakPolarHBondContact O-CB 3.32Å; D825-S829 PolarHBondContact O-N 2.96Å; E826-S829 WeakPolarHBondContact O-CB 3.42Å; E826-S829 PolarHBondContact O-N 3.23Å; E826-S829 PolarHBondContact O-OG 3.01Å; V827-S829 VanDerWaalsContact C-N 3.27Å; V827-S829 PolarHBondContact O-N 3.02Å; S829-S831 VanDerWaalsContact C-N 3.27Å; S829-S831 PolarHBondContact O-N 2.86Å; S829-T832 PolarHBondContact O-N 3.44Å; S829-T832 PolarHBondContact O-OG1 3.48Å
830	Y	40.5	Very low	44.2	Very low	142 Å²	142	97.7 Å²	97.7	56%	0.557	51%	0.51	S	S	*	.	H	α-helix	trans	-71.3	-15.9	175.3	-68.3	-70.1	0	0	0	114.1	E826 V827 L828 T832 F833 S834	E826-Y830 HydrophobicContact CG-CE2 4.2Å; E826-Y830 WeakPolarHBondContact O-CD2 3.48Å; E826-Y830 WeakPolarHBondContact O-CE2 3.22Å; E826-Y830 PolarHBondContact O-N 3.24Å; V827-Y830 PolarHBondContact O-N 2.66Å; L828-Y830 VanDerWaalsContact C-N 3.25Å; L828-Y830 PolarHBondContact O-N 2.87Å; Y830-T832 VanDerWaalsContact C-N 3.3Å; Y830-F833 PolarHBondContact O-N 3.03Å; Y830-S834 PolarHBondContact O-N 3.03Å; Y830-S834 PolarHBondContact O-OG 2.99Å
831	S	37.2	Very low	43.8	Very low	53 Å²	53	94.6 Å²	94.6	37%	0.371	50%	0.501	S	S	.	.	H	α-helix	trans	-69.9	-31.2	173.6	85.1	0	0	0	0	111.9	L828 S829 S834 Q835	L828-S831 WeakPolarHBondContact O-CB 3.3Å; L828-S831 PolarHBondContact O-N 3.22Å; L828-S831 VanDerWaalsContact O-N 3.07Å; L828-S831 PolarHBondContact O-OG 3.06Å; S829-S831 VanDerWaalsContact C-N 3.27Å; S829-S831 PolarHBondContact O-N 2.86Å; S831-S834 WeakPolarHBondContact CA-OG 3.49Å; S831-S834 PolarHBondContact O-OG 2.82Å; S831-Q835 VanDerWaalsContact O-CG 3.3Å; S831-Q835 WeakPolarHBondContact O-CG 3.45Å; S831-Q835 PolarHBondContact O-N 3.07Å; S831-Q835 VanDerWaalsContact O-N 3.14Å
832	T	41.1	Very low	43.2	Very low	85 Å²	85	96.8 Å²	96.8	52%	0.521	51%	0.511	S	S	.	.	H	α-helix	trans	-71.8	-38.4	174.5	64.1	0	0	0	0	110.9	S829 Y830 Q835 T836	S829-T832 PolarHBondContact O-N 3.44Å; S829-T832 PolarHBondContact O-OG1 3.48Å; Y830-T832 VanDerWaalsContact C-N 3.3Å; T832-Q835 PolarHBondContact O-N 3.16Å; T832-T836 PolarHBondContact O-N 3.01Å; T832-T836 PolarHBondContact O-OG1 3.47Å; T832-T836 VanDerWaalsContact O-OG1 3.08Å
833	F	40.7	Very low	43.1	Very low	130 Å²	130	94.6 Å²	94.6	57%	0.57	50%	0.502	S	S	*	.	H	α-helix	trans	-63.4	-44.5	174.9	-174.7	-104.5	0	0	0	112.1	Y830 Q835 T836 V837	Y830-F833 PolarHBondContact O-N 3.03Å; F833-Q835 VanDerWaalsContact C-N 3.33Å; F833-Q835 PolarHBondContact O-N 3.26Å; F833-T836 VanDerWaalsContact CA-OG1 3.32Å; F833-T836 WeakPolarHBondContact CA-OG1 3.42Å; F833-T836 PolarHBondContact O-N 3.3Å; F833-T836 PolarHBondContact O-OG1 3.29Å; F833-V837 HydrophobicContact CD1-CG2 4.22Å; F833-V837 HydrophobicContact CE1-CG2 3.83Å; F833-V837 HydrophobicContact CE2-CG2 4.2Å; F833-V837 HydrophobicContact CZ-CG2 3.81Å; F833-V837 WeakPolarHBondContact O-CG2 3.41Å; F833-V837 PolarHBondContact O-N 3.01Å
834	S	37.2	Very low	43.3	Very low	70 Å²	70	96.1 Å²	96.1	49%	0.49	51%	0.505	S	S	.	.	H	α-helix	trans	-64.6	-36.7	176.7	64.1	0	0	0	0	112.3	Y830 S831 L838	Y830-S834 PolarHBondContact O-N 3.03Å; Y830-S834 PolarHBondContact O-OG 2.99Å; S831-S834 WeakPolarHBondContact CA-OG 3.49Å; S831-S834 PolarHBondContact O-OG 2.82Å; S834-L838 WeakPolarHBondContact O-CB 3.26Å; S834-L838 PolarHBondContact O-N 2.96Å
835	Q	39	Very low	43.3	Very low	131 Å²	131	97.8 Å²	97.8	61%	0.612	51%	0.512	S	S	*	.	H	α-helix	trans	-65.4	-42.4	173.3	-75.1	175.7	1.4	0	0	112.5	S831 T832 F833 L838 L839	S831-Q835 VanDerWaalsContact O-CG 3.3Å; S831-Q835 WeakPolarHBondContact O-CG 3.45Å; S831-Q835 PolarHBondContact O-N 3.07Å; S831-Q835 VanDerWaalsContact O-N 3.14Å; T832-Q835 PolarHBondContact O-N 3.16Å; F833-Q835 VanDerWaalsContact C-N 3.33Å; F833-Q835 PolarHBondContact O-N 3.26Å; Q835-L838 PolarHBondContact O-N 3.24Å; Q835-L839 WeakPolarHBondContact O-CB 3.28Å; Q835-L839 PolarHBondContact O-N 3.17Å
836	T	43.6	Very low	43.9	Very low	78 Å²	78	99.2 Å²	99.2	48%	0.479	52%	0.515	S	S	.	.	H	α-helix	trans	-65	-42.3	177	40.1	0	0	0	0	112.5	T832 F833 L838 L839 E840	T832-T836 PolarHBondContact O-N 3.01Å; T832-T836 PolarHBondContact O-OG1 3.47Å; T832-T836 VanDerWaalsContact O-OG1 3.08Å; F833-T836 VanDerWaalsContact CA-OG1 3.32Å; F833-T836 WeakPolarHBondContact CA-OG1 3.42Å; F833-T836 PolarHBondContact O-N 3.3Å; F833-T836 PolarHBondContact O-OG1 3.29Å; T836-L838 VanDerWaalsContact C-N 3.35Å; T836-L838 PolarHBondContact O-N 3.23Å; T836-L839 PolarHBondContact O-N 3.2Å; T836-E840 WeakPolarHBondContact O-CG 3.28Å; T836-E840 PolarHBondContact O-N 3.44Å
837	V	45.1	Very low	44.2	Very low	61 Å²	61	98.6 Å²	98.6	37%	0.37	52%	0.515	S	S	.	.	H	α-helix	trans	-64.8	-40.9	177.7	173.1	0	0	0	0	110.9	F833 L839 E840 E841	F833-V837 HydrophobicContact CD1-CG2 4.22Å; F833-V837 HydrophobicContact CE1-CG2 3.83Å; F833-V837 HydrophobicContact CE2-CG2 4.2Å; F833-V837 HydrophobicContact CZ-CG2 3.81Å; F833-V837 WeakPolarHBondContact O-CG2 3.41Å; F833-V837 PolarHBondContact O-N 3.01Å; V837-L839 VanDerWaalsContact C-N 3.31Å; V837-L839 PolarHBondContact O-N 2.84Å; V837-E840 PolarHBondContact O-N 3.48Å; V837-E841 WeakPolarHBondContact O-CB 3.35Å; V837-E841 PolarHBondContact O-N 3.49Å
838	L	41.6	Very low	44.5	Very low	106 Å²	106	97.6 Å²	97.6	56%	0.555	51%	0.506	S	S	*	.	H	α-helix	trans	-63.4	-38.6	176.8	-156	89.1	0	0	0	111.7	S834 Q835 T836 E841 M842	S834-L838 WeakPolarHBondContact O-CB 3.26Å; S834-L838 PolarHBondContact O-N 2.96Å; Q835-L838 PolarHBondContact O-N 3.24Å; T836-L838 VanDerWaalsContact C-N 3.35Å; T836-L838 PolarHBondContact O-N 3.23Å; L838-E841 PolarHBondContact O-N 3.23Å; L838-M842 VanDerWaalsContact O-CG 3.31Å; L838-M842 WeakPolarHBondContact O-CG 3.29Å; L838-M842 PolarHBondContact O-N 3.05Å
839	L	41.8	Very low	45.1	Very low	109 Å²	109	99.1 Å²	99.1	57%	0.571	51%	0.51	S	S	*	.	H	α-helix	trans	-71.5	-38.6	-179.7	-144.1	150	0	0	0	111.4	Q835 T836 V837 M842 I843	Q835-L839 WeakPolarHBondContact O-CB 3.28Å; Q835-L839 PolarHBondContact O-N 3.17Å; T836-L839 PolarHBondContact O-N 3.2Å; V837-L839 VanDerWaalsContact C-N 3.31Å; V837-L839 PolarHBondContact O-N 2.84Å; L839-M842 PolarHBondContact O-N 2.94Å; L839-I843 HydrophobicContact CD2-CD1 3.82Å; L839-I843 HydrophobicContact CD2-CG1 4.47Å; L839-I843 WeakPolarHBondContact O-CG1 3.46Å; L839-I843 PolarHBondContact O-N 3.47Å; L839-I843 VanDerWaalsContact O-N 3.11Å
840	E	46	Very low	46	Very low	124 Å²	124	102.9 Å²	102.9	58%	0.579	52%	0.519	S	S	*	.	H	α-helix	trans	-63.7	-42.1	171.3	-73.6	-179.2	175.1	0	0	111.9	T836 V837 M842 I843 I844	T836-E840 WeakPolarHBondContact O-CG 3.28Å; T836-E840 PolarHBondContact O-N 3.44Å; V837-E840 PolarHBondContact O-N 3.48Å; E840-M842 PolarHBondContact O-N 3.26Å; E840-I843 PolarHBondContact O-N 2.86Å; E840-I844 VanDerWaalsContact O-CG1 3.3Å; E840-I844 WeakPolarHBondContact O-CG1 3.28Å; E840-I844 PolarHBondContact O-N 3.27Å
841	E	43.7	Very low	46.7	Very low	92 Å²	92	101.6 Å²	101.6	43%	0.43	52%	0.521	S	S	.	.	H	α-helix	trans	-63.8	-39.8	177	-170	175.6	-176.1	0	0	111.9	V837 L838 I844 N845	V837-E841 WeakPolarHBondContact O-CB 3.35Å; V837-E841 PolarHBondContact O-N 3.49Å; L838-E841 PolarHBondContact O-N 3.23Å; E841-I844 PolarHBondContact O-N 3.4Å; E841-N845 WeakPolarHBondContact O-CB 3.35Å; E841-N845 PolarHBondContact O-N 2.8Å; E841-N845 PolarHBondContact O-ND2 2.9Å
842	M	44.3	Very low	47.5	Very low	126 Å²	126	102.6 Å²	102.6	62%	0.621	52%	0.522	S	S	*	.	H	α-helix	trans	-62.6	-43.6	174.5	-73.6	-179.5	69.6	0	0	112.1	L838 L839 E840 N845 E846	L838-M842 VanDerWaalsContact O-CG 3.31Å; L838-M842 WeakPolarHBondContact O-CG 3.29Å; L838-M842 PolarHBondContact O-N 3.05Å; L839-M842 PolarHBondContact O-N 2.94Å; E840-M842 PolarHBondContact O-N 3.26Å; M842-N845 PolarHBondContact O-N 3.21Å; M842-E846 WeakPolarHBondContact O-CB 3.44Å; M842-E846 PolarHBondContact O-N 3.44Å
843	I	51.2	Low	48.5	Very low	85 Å²	85	102.6 Å²	102.6	44%	0.436	52%	0.518	S	S	.	.	H	α-helix	trans	-65.5	-41.2	178.5	-68.4	167.6	0	0	0	111.1	L839 E840 E846 L847	L839-I843 HydrophobicContact CD2-CD1 3.82Å; L839-I843 HydrophobicContact CD2-CG1 4.47Å; L839-I843 WeakPolarHBondContact O-CG1 3.46Å; L839-I843 PolarHBondContact O-N 3.47Å; L839-I843 VanDerWaalsContact O-N 3.11Å; E840-I843 PolarHBondContact O-N 2.86Å; I843-E846 PolarHBondContact O-N 3.29Å; I843-L847 HydrophobicContact CG2-CD1 4.22Å; I843-L847 WeakPolarHBondContact O-CB 3.49Å; I843-L847 PolarHBondContact O-N 3.43Å
844	I	50.9	Low	49.6	Very low	97 Å²	97	100.1 Å²	100.1	50%	0.497	51%	0.51	S	S	.	.	H	α-helix	trans	-64.2	-43.8	177.9	-70	167.8	0	0	0	110.5	E840 E841 L847 I848	E840-I844 VanDerWaalsContact O-CG1 3.3Å; E840-I844 WeakPolarHBondContact O-CG1 3.28Å; E840-I844 PolarHBondContact O-N 3.27Å; E841-I844 PolarHBondContact O-N 3.4Å; I844-L847 PolarHBondContact O-N 3.47Å; I844-I848 HydrophobicContact CG2-CD1 3.75Å; I844-I848 HydrophobicContact CG2-CG1 4.36Å; I844-I848 VanDerWaalsContact O-CG1 3.3Å; I844-I848 WeakPolarHBondContact O-CG1 3.37Å; I844-I848 PolarHBondContact O-N 3.04Å
845	N	46.3	Very low	50.8	Low	84 Å²	84	103.4 Å²	103.4	45%	0.449	52%	0.516	S	S	.	.	H	α-helix	trans	-64	-41.5	178.6	-76.2	-32.3	0	0	0	111.9	E841 M842 L847 I848 E849	E841-N845 WeakPolarHBondContact O-CB 3.35Å; E841-N845 PolarHBondContact O-N 2.8Å; E841-N845 PolarHBondContact O-ND2 2.9Å; M842-N845 PolarHBondContact O-N 3.21Å; N845-L847 VanDerWaalsContact C-N 3.33Å; N845-L847 PolarHBondContact O-N 3.29Å; N845-I848 PolarHBondContact O-N 2.96Å; N845-E849 WeakPolarHBondContact O-CB 3.43Å; N845-E849 PolarHBondContact O-N 3.2Å
846	E	54.8	Low	51.6	Low	138 Å²	138	101 Å²	101	65%	0.645	51%	0.507	S	S	*	.	H	α-helix	trans	-64.8	-37.8	176.6	-159.9	178.9	-173.6	0	0	111.6	M842 I843 K850	M842-E846 WeakPolarHBondContact O-CB 3.44Å; M842-E846 PolarHBondContact O-N 3.44Å; I843-E846 PolarHBondContact O-N 3.29Å; E846-K850 WeakPolarHBondContact O-CB 3.23Å; E846-K850 PolarHBondContact O-N 3.23Å
847	L	53.7	Low	52.2	Low	100 Å²	100	102.8 Å²	102.8	52%	0.524	51%	0.51	S	S	.	.	H	α-helix	trans	-66.8	-41.5	174.3	-101.1	160.2	0	0	0	113	I843 I844 N845 K850 L851	I843-L847 HydrophobicContact CG2-CD1 4.22Å; I843-L847 WeakPolarHBondContact O-CB 3.49Å; I843-L847 PolarHBondContact O-N 3.43Å; I844-L847 PolarHBondContact O-N 3.47Å; N845-L847 VanDerWaalsContact C-N 3.33Å; N845-L847 PolarHBondContact O-N 3.29Å; L847-K850 PolarHBondContact O-N 3.4Å; L847-L851 WeakPolarHBondContact O-CB 3.44Å; L847-L851 PolarHBondContact O-N 3.23Å
848	I	51	Low	53.2	Low	83 Å²	83	105.2 Å²	105.2	43%	0.426	52%	0.52	S	S	.	.	H	α-helix	trans	-63.8	-44.8	176.8	-71.9	169.1	0	0	0	109.9	I844 N845 K850 L851 I852	I844-I848 HydrophobicContact CG2-CD1 3.75Å; I844-I848 HydrophobicContact CG2-CG1 4.36Å; I844-I848 VanDerWaalsContact O-CG1 3.3Å; I844-I848 WeakPolarHBondContact O-CG1 3.37Å; I844-I848 PolarHBondContact O-N 3.04Å; N845-I848 PolarHBondContact O-N 2.96Å; I848-K850 VanDerWaalsContact C-N 3.31Å; I848-K850 PolarHBondContact O-N 3.4Å; I848-L851 PolarHBondContact O-N 3.02Å; I848-I852 HydrophobicContact CG2-CD1 3.68Å; I848-I852 HydrophobicContact CG2-CG1 4.39Å; I848-I852 WeakPolarHBondContact O-CB 3.49Å; I848-I852 VanDerWaalsContact O-CG1 3.23Å; I848-I852 WeakPolarHBondContact O-CG1 3.33Å; I848-I852 PolarHBondContact O-N 2.83Å
849	E	54.2	Low	54	Low	130 Å²	130	105 Å²	105	61%	0.607	52%	0.517	S	S	*	.	H	α-helix	trans	-61.6	-42.7	178.8	-162.5	170.5	-159	0	0	110.9	N845 I852 I853	N845-E849 WeakPolarHBondContact O-CB 3.43Å; N845-E849 PolarHBondContact O-N 3.2Å; E849-I852 PolarHBondContact O-N 3.23Å; E849-I853 HydrophobicContact CG-CD1 4.39Å; E849-I853 VanDerWaalsContact O-CG1 3.31Å; E849-I853 WeakPolarHBondContact O-CG1 3.06Å; E849-I853 PolarHBondContact O-N 3.24Å
850	K	62	Low	54.7	Low	137 Å²	137	104.5 Å²	104.5	60%	0.596	51%	0.514	S	S	*	.	H	α-helix	trans	-65.2	-44.7	176.5	-140.8	178.3	-173.4	-179.7	0	113.1	E846 L847 I848 I852 I853 D854	E846-K850 WeakPolarHBondContact O-CB 3.23Å; E846-K850 PolarHBondContact O-N 3.23Å; L847-K850 PolarHBondContact O-N 3.4Å; I848-K850 VanDerWaalsContact C-N 3.31Å; I848-K850 PolarHBondContact O-N 3.4Å; K850-I852 VanDerWaalsContact C-N 3.29Å; K850-I852 PolarHBondContact O-N 3.02Å; K850-I853 PolarHBondContact O-N 3.21Å; K850-D854 VanDerWaalsContact O-CG 3.28Å; K850-D854 PolarHBondContact O-N 3.4Å
851	L	56.4	Low	55.5	Low	115 Å²	115	103.1 Å²	103.1	60%	0.602	51%	0.509	S	S	*	.	H	α-helix	trans	-61.8	-36.9	176.1	-100.9	161.3	0	0	0	112.5	L847 I848 F855	L847-L851 WeakPolarHBondContact O-CB 3.44Å; L847-L851 PolarHBondContact O-N 3.23Å; I848-L851 PolarHBondContact O-N 3.02Å; L851-F855 WeakPolarHBondContact O-CB 3.15Å; L851-F855 PolarHBondContact O-N 3.4Å
852	I	52.9	Low	56.1	Low	73 Å²	73	103.6 Å²	103.6	37%	0.374	52%	0.515	S	S	.	.	H	α-helix	trans	-68.1	-43.2	176.7	-71	168.7	0	0	0	110.3	I848 E849 K850 I856	I848-I852 HydrophobicContact CG2-CD1 3.68Å; I848-I852 HydrophobicContact CG2-CG1 4.39Å; I848-I852 WeakPolarHBondContact O-CB 3.49Å; I848-I852 VanDerWaalsContact O-CG1 3.23Å; I848-I852 WeakPolarHBondContact O-CG1 3.33Å; I848-I852 PolarHBondContact O-N 2.83Å; E849-I852 PolarHBondContact O-N 3.23Å; K850-I852 VanDerWaalsContact C-N 3.29Å; K850-I852 PolarHBondContact O-N 3.02Å; I852-I856 HydrophobicContact CG2-CD1 3.66Å; I852-I856 HydrophobicContact CG2-CG1 4.42Å; I852-I856 WeakPolarHBondContact O-CB 3.35Å; I852-I856 WeakPolarHBondContact O-CG1 2.97Å; I852-I856 PolarHBondContact O-N 2.93Å
853	I	61.6	Low	56.9	Low	85 Å²	85	101.8 Å²	101.8	44%	0.436	51%	0.507	S	S	.	.	H	α-helix	trans	-63.2	-50.5	178	-68.1	166.1	0	0	0	110.4	E849 K850 F855 I856 E857	E849-I853 HydrophobicContact CG-CD1 4.39Å; E849-I853 VanDerWaalsContact O-CG1 3.31Å; E849-I853 WeakPolarHBondContact O-CG1 3.06Å; E849-I853 PolarHBondContact O-N 3.24Å; K850-I853 PolarHBondContact O-N 3.21Å; I853-F855 VanDerWaalsContact C-N 3.32Å; I853-F855 PolarHBondContact O-N 3.3Å; I853-I856 PolarHBondContact O-N 3.22Å; I853-I856 VanDerWaalsContact O-N 3.12Å; I853-E857 PolarHBondContact O-N 3.48Å
854	D	63.6	Low	56.9	Low	78 Å²	78	104.4 Å²	104.4	42%	0.417	52%	0.516	S	S	.	.	H	α-helix	trans	-60.3	-43.2	-179.9	-66.3	-11.9	0	0	0	110.8	K850 I856 E857 D858	K850-D854 VanDerWaalsContact O-CG 3.28Å; K850-D854 PolarHBondContact O-N 3.4Å; D854-I856 VanDerWaalsContact C-N 3.35Å; D854-I856 PolarHBondContact O-N 3.11Å; D854-E857 PolarHBondContact O-N 3.49Å; D854-D858 PolarHBondContact O-N 3.1Å
855	F	63.5	Low	57.5	Low	140 Å²	140	103.9 Å²	103.9	61%	0.614	51%	0.514	S	S	*	.	H	α-helix	trans	-64.5	-37.6	177	-174.4	-95.6	0	0	0	112.5	L851 I853 H859	L851-F855 WeakPolarHBondContact O-CB 3.15Å; L851-F855 PolarHBondContact O-N 3.4Å; I853-F855 VanDerWaalsContact C-N 3.32Å; I853-F855 PolarHBondContact O-N 3.3Å; F855-H859 AromaticContact CE1-CD2 3.91Å; F855-H859 AromaticContact CZ-CD2 3.66Å; F855-H859 VanDerWaalsContact O-CB 3.26Å; F855-H859 WeakPolarHBondContact O-CB 3.5Å; F855-H859 PolarHBondContact O-N 2.76Å; F855-H859 VanDerWaalsContact O-N 3.16Å
856	I	55.1	Low	58.3	Low	80 Å²	80	105.4 Å²	105.4	41%	0.41	52%	0.522	S	S	.	.	H	α-helix	trans	-70.3	-43.3	177.9	-71.7	169.3	0	0	0	110.7	I852 I853 D854 H859 L860	I852-I856 HydrophobicContact CG2-CD1 3.66Å; I852-I856 HydrophobicContact CG2-CG1 4.42Å; I852-I856 WeakPolarHBondContact O-CB 3.35Å; I852-I856 WeakPolarHBondContact O-CG1 2.97Å; I852-I856 PolarHBondContact O-N 2.93Å; I853-I856 PolarHBondContact O-N 3.22Å; I853-I856 VanDerWaalsContact O-N 3.12Å; D854-I856 VanDerWaalsContact C-N 3.35Å; D854-I856 PolarHBondContact O-N 3.11Å; I856-H859 PolarHBondContact O-N 3.46Å; I856-L860 HydrophobicContact CG2-CD1 3.66Å; I856-L860 HydrophobicContact CG2-CG 4.2Å; I856-L860 VanDerWaalsContact O-CB 3.28Å; I856-L860 WeakPolarHBondContact O-CB 3.46Å; I856-L860 VanDerWaalsContact O-CG 3.29Å; I856-L860 WeakPolarHBondContact O-CG 3.31Å; I856-L860 PolarHBondContact O-N 3.02Å
857	E	57.6	Low	58.7	Low	116 Å²	116	107.9 Å²	107.9	54%	0.542	53%	0.525	S	S	.	.	H	α-helix	trans	-61.5	-49.1	178.5	-78.1	-169	160.9	0	0	111.4	I853 D854 H859 L860 I861	I853-E857 PolarHBondContact O-N 3.48Å; D854-E857 PolarHBondContact O-N 3.49Å; E857-H859 VanDerWaalsContact C-N 3.34Å; E857-H859 PolarHBondContact O-N 3.31Å; E857-L860 PolarHBondContact O-N 3.1Å; E857-I861 VanDerWaalsContact O-CG1 3.25Å; E857-I861 WeakPolarHBondContact O-CG1 3.48Å; E857-I861 PolarHBondContact O-N 3.42Å
858	D	64.4	Low	58.4	Low	111 Å²	111	105.8 Å²	105.8	59%	0.594	51%	0.514	S	S	*	.	H	α-helix	trans	-60.1	-44.6	178.8	-78.9	-15.4	0	0	0	111.5	D854 L860 I861 D862	D854-D858 PolarHBondContact O-N 3.1Å; D858-L860 PolarHBondContact O-N 2.82Å; D858-I861 PolarHBondContact O-N 2.93Å; D858-D862 PolarHBondContact O-N 2.74Å
859	H	59.7	Low	58.5	Low	103 Å²	103	106.4 Å²	106.4	48%	0.477	52%	0.519	S	S	.	.	H	α-helix	trans	-73.3	-29.6	-176.6	-138.8	-51.6	0	0	0	112.8	F855 I856 E857 L863	F855-H859 AromaticContact CE1-CD2 3.91Å; F855-H859 AromaticContact CZ-CD2 3.66Å; F855-H859 VanDerWaalsContact O-CB 3.26Å; F855-H859 WeakPolarHBondContact O-CB 3.5Å; F855-H859 PolarHBondContact O-N 2.76Å; F855-H859 VanDerWaalsContact O-N 3.16Å; I856-H859 PolarHBondContact O-N 3.46Å; E857-H859 VanDerWaalsContact C-N 3.34Å; E857-H859 PolarHBondContact O-N 3.31Å; H859-L863 WeakPolarHBondContact O-CB 3.37Å; H859-L863 PolarHBondContact O-N 2.88Å
860	L	55.4	Low	58.5	Low	98 Å²	98	103.3 Å²	103.3	51%	0.513	51%	0.51	S	S	.	.	H	α-helix	trans	-72.3	-43	172.9	-78.7	175.5	0	0	0	111.2	I856 E857 D858 D862 L863 F864	I856-L860 HydrophobicContact CG2-CD1 3.66Å; I856-L860 HydrophobicContact CG2-CG 4.2Å; I856-L860 VanDerWaalsContact O-CB 3.28Å; I856-L860 WeakPolarHBondContact O-CB 3.46Å; I856-L860 VanDerWaalsContact O-CG 3.29Å; I856-L860 WeakPolarHBondContact O-CG 3.31Å; I856-L860 PolarHBondContact O-N 3.02Å; E857-L860 PolarHBondContact O-N 3.1Å; D858-L860 PolarHBondContact O-N 2.82Å; L860-D862 VanDerWaalsContact C-N 3.33Å; L860-D862 PolarHBondContact O-N 3.27Å; L860-L863 PolarHBondContact O-N 3.49Å; L860-F864 WeakPolarHBondContact O-CB 3.39Å; L860-F864 PolarHBondContact O-N 2.83Å
861	I	62.6	Low	58	Low	95 Å²	95	101.9 Å²	101.9	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-60.9	-44.5	176.5	-68.9	166	0	0	0	110.4	E857 D858 F864 N865	E857-I861 VanDerWaalsContact O-CG1 3.25Å; E857-I861 WeakPolarHBondContact O-CG1 3.48Å; E857-I861 PolarHBondContact O-N 3.42Å; D858-I861 PolarHBondContact O-N 2.93Å; I861-F864 PolarHBondContact O-N 3.47Å; I861-N865 PolarHBondContact O-N 3.1Å; I861-N865 PolarHBondContact O-ND2 3.03Å
862	D	56.5	Low	57.7	Low	101 Å²	101	104.2 Å²	104.2	54%	0.54	51%	0.508	S	S	.	.	H	α-helix	trans	-64.9	-40.1	176.2	-92.6	-3.5	0	0	0	112.5	D858 L860 F864 N866	D858-D862 PolarHBondContact O-N 2.74Å; L860-D862 VanDerWaalsContact C-N 3.33Å; L860-D862 PolarHBondContact O-N 3.27Å; D862-F864 VanDerWaalsContact C-N 3.33Å; D862-N866 VanDerWaalsContact O-CB 3.29Å; D862-N866 WeakPolarHBondContact O-CB 3.17Å; D862-N866 VanDerWaalsContact O-CG 3.25Å; D862-N866 PolarHBondContact O-N 2.86Å; D862-N866 PolarHBondContact O-ND2 2.85Å
863	L	61.2	Low	58	Low	88 Å²	88	107.8 Å²	107.8	46%	0.461	52%	0.524	S	S	.	.	H	α-helix	trans	-64.7	-38.5	173.9	-96.1	163.2	0	0	0	112	H859 L860 R867	H859-L863 WeakPolarHBondContact O-CB 3.37Å; H859-L863 PolarHBondContact O-N 2.88Å; L860-L863 PolarHBondContact O-N 3.49Å; L863-R867 WeakPolarHBondContact O-CB 3.29Å; L863-R867 VanDerWaalsContact O-CG 3.26Å; L863-R867 WeakPolarHBondContact O-CG 3.36Å; L863-R867 PolarHBondContact O-N 3.28Å
864	F	51.8	Low	57.7	Low	141 Å²	141	108.4 Å²	108.4	62%	0.618	53%	0.527	S	S	*	.	H	α-helix	trans	-65.6	-48.5	-179.9	-140.6	-94.3	0	0	0	110.9	L860 I861 D862 R867 L868	L860-F864 WeakPolarHBondContact O-CB 3.39Å; L860-F864 PolarHBondContact O-N 2.83Å; I861-F864 PolarHBondContact O-N 3.47Å; D862-F864 VanDerWaalsContact C-N 3.33Å; F864-R867 PolarHBondContact O-N 3.28Å; F864-L868 HydrophobicContact CD1-CD1 3.38Å; F864-L868 HydrophobicContact CE1-CD1 3.43Å; F864-L868 VanDerWaalsContact CE1-CD1 3.43Å; F864-L868 HydrophobicContact CG-CD1 4.47Å; F864-L868 PolarHBondContact O-N 3.26Å
865	N	63.8	Low	56.6	Low	85 Å²	85	109.3 Å²	109.3	46%	0.455	53%	0.531	S	S	.	.	H	α-helix	trans	-65.1	-43.3	179.8	-70.6	-32.5	0	0	0	111.8	I861 R867 L868 D869	I861-N865 PolarHBondContact O-N 3.1Å; I861-N865 PolarHBondContact O-ND2 3.03Å; N865-R867 PolarHBondContact O-N 3.06Å; N865-L868 PolarHBondContact O-N 3.41Å; N865-D869 PolarHBondContact O-N 2.9Å
866	N	63.5	Low	56	Low	116 Å²	116	110.6 Å²	110.6	62%	0.62	54%	0.537	S	S	*	.	H	α-helix	trans	-64	-26.2	178.6	-78.1	-46.4	0	0	0	113.7	D862	D862-N866 VanDerWaalsContact O-CB 3.29Å; D862-N866 WeakPolarHBondContact O-CB 3.17Å; D862-N866 VanDerWaalsContact O-CG 3.25Å; D862-N866 PolarHBondContact O-N 2.86Å; D862-N866 PolarHBondContact O-ND2 2.85Å
867	R	61.8	Low	55.9	Low	190 Å²	190	114 Å²	114	72%	0.717	55%	0.551	S	S	*	*	H	α-helix	trans	-85.7	-27.8	177.8	-72.8	-81.9	-174.4	174.4	1	113.1	L863 F864 N865 I871	L863-R867 WeakPolarHBondContact O-CB 3.29Å; L863-R867 VanDerWaalsContact O-CG 3.26Å; L863-R867 WeakPolarHBondContact O-CG 3.36Å; L863-R867 PolarHBondContact O-N 3.28Å; F864-R867 PolarHBondContact O-N 3.28Å; N865-R867 PolarHBondContact O-N 3.06Å; R867-I871 WeakPolarHBondContact O-CD1 3.4Å
868	L	48.3	Very low	55.5	Low	56 Å²	56	112.9 Å²	112.9	29%	0.293	55%	0.548	S	S	.	.	H	α-helix	trans	-84.3	-31.5	-175.2	-103.4	144	0	0	0	114.1	F864 N865 I871 R872	F864-L868 HydrophobicContact CD1-CD1 3.38Å; F864-L868 HydrophobicContact CE1-CD1 3.43Å; F864-L868 VanDerWaalsContact CE1-CD1 3.43Å; F864-L868 HydrophobicContact CG-CD1 4.47Å; F864-L868 PolarHBondContact O-N 3.26Å; N865-L868 PolarHBondContact O-N 3.41Å; L868-I871 PolarHBondContact O-N 3.04Å; L868-R872 PolarHBondContact O-N 3.44Å
869	D	52.3	Low	54.5	Low	97 Å²	97	112.7 Å²	112.7	52%	0.519	55%	0.545	S	S	.	.	H	α-helix	trans	-62.1	-40.6	-177.5	-79.6	-20.9	0	0	0	114.9	N865 I871 R872 Q873	N865-D869 PolarHBondContact O-N 2.9Å; D869-I871 VanDerWaalsContact C-N 3.29Å; D869-I871 PolarHBondContact O-N 3.26Å; D869-R872 PolarHBondContact O-N 3.43Å; D869-Q873 PolarHBondContact O-N 3Å
870	P	53.6	Low	54.2	Low	65 Å²	65	115.9 Å²	115.9	42%	0.422	56%	0.56	S	S	.	*	H	α-helix	trans	-66.3	-34.1	175.3	-16.6	29.2	0	0	0	112.2	Q873 I874	P870-Q873 PolarHBondContact O-N 3.36Å; P870-I874 WeakPolarHBondContact O-CG1 3.45Å; P870-I874 PolarHBondContact O-N 3.26Å
871	I	51.8	Low	54	Low	107 Å²	107	117.9 Å²	117.9	55%	0.549	57%	0.571	S	S	.	*	H	α-helix	trans	-69.9	-44.4	-178.8	-60.8	174.7	0	0	0	109.5	R867 L868 D869 Q873 I874 D875	R867-I871 WeakPolarHBondContact O-CD1 3.4Å; L868-I871 PolarHBondContact O-N 3.04Å; D869-I871 VanDerWaalsContact C-N 3.29Å; D869-I871 PolarHBondContact O-N 3.26Å; I871-Q873 PolarHBondContact O-N 2.95Å; I871-I874 PolarHBondContact O-N 2.98Å; I871-D875 WeakPolarHBondContact O-CB 3.35Å; I871-D875 PolarHBondContact O-N 3.29Å
872	R	51.2	Low	53.2	Low	164 Å²	164	118 Å²	118	62%	0.619	57%	0.571	S	S	*	*	H	α-helix	trans	-62.2	-28.8	176.5	-75.4	-177.9	173.9	-172.7	0	113.9	L868 D869 K876	L868-R872 PolarHBondContact O-N 3.44Å; D869-R872 PolarHBondContact O-N 3.43Å; R872-K876 PolarHBondContact O-N 3.06Å
873	Q	57.9	Low	52.4	Low	148 Å²	148	114.8 Å²	114.8	69%	0.692	56%	0.555	S	S	*	*	H	α-helix	trans	-74	-41.9	175.6	-94.9	175.8	-21.1	0	0	112.3	D869 P870 I871 D875 K876	D869-Q873 PolarHBondContact O-N 3Å; P870-Q873 PolarHBondContact O-N 3.36Å; I871-Q873 PolarHBondContact O-N 2.95Å; Q873-D875 VanDerWaalsContact C-N 3.32Å; Q873-K876 PolarHBondContact O-N 3.09Å
874	I	55.2	Low	51.9	Low	98 Å²	98	117.9 Å²	117.9	50%	0.503	57%	0.573	S	S	.	*	H	α-helix	trans	-68.6	-35.7	176.5	-65.4	170.2	0	0	0	110.6	P870 I871 K876 E877 I878	P870-I874 WeakPolarHBondContact O-CG1 3.45Å; P870-I874 PolarHBondContact O-N 3.26Å; I871-I874 PolarHBondContact O-N 2.98Å; I874-K876 VanDerWaalsContact C-N 3.28Å; I874-K876 PolarHBondContact O-N 2.98Å; I874-E877 PolarHBondContact O-N 3.09Å; I874-I878 HydrophobicContact CG2-CD1 3.46Å; I874-I878 VanDerWaalsContact CG2-CD1 3.46Å; I874-I878 HydrophobicContact CG2-CG1 4.09Å; I874-I878 WeakPolarHBondContact O-CG1 3.26Å; I874-I878 PolarHBondContact O-N 3.27Å
875	D	41.4	Very low	51.9	Low	96 Å²	96	119.9 Å²	119.9	51%	0.513	58%	0.584	S	S	.	*	H	α-helix	trans	-59.1	-39.1	177.6	-146.5	19.8	0	0	0	111.5	I871 Q873 M879	I871-D875 WeakPolarHBondContact O-CB 3.35Å; I871-D875 PolarHBondContact O-N 3.29Å; Q873-D875 VanDerWaalsContact C-N 3.32Å; D875-M879 WeakPolarHBondContact O-CB 3.5Å; D875-M879 WeakPolarHBondContact O-CG 3.46Å; D875-M879 PolarHBondContact O-N 3.41Å
876	K	50.4	Low	51.2	Low	168 Å²	168	121 Å²	121	73%	0.73	59%	0.594	S	S	*	*	H	α-helix	trans	-69	-37.7	176.5	-83.2	-174.6	175.2	179.9	0	114	R872 Q873 I874	R872-K876 PolarHBondContact O-N 3.06Å; Q873-K876 PolarHBondContact O-N 3.09Å; I874-K876 VanDerWaalsContact C-N 3.28Å; I874-K876 PolarHBondContact O-N 2.98Å
877	E	54.1	Low	50.5	Low	151 Å²	151	117.2 Å²	117.2	71%	0.706	57%	0.574	S	S	*	*	H	α-helix	trans	-76.5	-33.2	-178.8	-89.5	-172.8	156	0	0	113	I874	I874-E877 PolarHBondContact O-N 3.09Å
878	I	49	Very low	50.3	Low	93 Å²	93	114.1 Å²	114.1	48%	0.477	57%	0.571	S	S	.	*	H	α-helix	trans	-84.6	-35	-178.4	-61.4	-178.4	0	0	0	111.1	I874 E880 N881	I874-I878 HydrophobicContact CG2-CD1 3.46Å; I874-I878 VanDerWaalsContact CG2-CD1 3.46Å; I874-I878 HydrophobicContact CG2-CG1 4.09Å; I874-I878 WeakPolarHBondContact O-CG1 3.26Å; I874-I878 PolarHBondContact O-N 3.27Å; I878-E880 PolarHBondContact O-N 3.12Å; I878-N881 PolarHBondContact O-N 2.78Å
879	M	42.6	Very low	50.7	Low	107 Å²	107	119 Å²	119	53%	0.527	60%	0.597	S	S	.	*	H	α-helix	trans	-64.7	-21.5	-179.8	-75.1	-74.9	-79.2	0	0	113.5	D875 T883	D875-M879 WeakPolarHBondContact O-CB 3.5Å; D875-M879 WeakPolarHBondContact O-CG 3.46Å; D875-M879 PolarHBondContact O-N 3.41Å; M879-T883 HydrophobicContact CB-CG2 4.36Å; M879-T883 WeakPolarHBondContact O-CB 3.33Å; M879-T883 WeakPolarHBondContact O-CG2 3.29Å; M879-T883 PolarHBondContact O-OG1 3.44Å; M879-T883 HydrophobicContact SD-CG2 3.73Å
880	E	53.4	Low	50.9	Low	169 Å²	169	122.4 Å²	122.4	79%	0.79	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.3	-25	-179.2	-143.1	169.1	-157.7	0	0	113.3	I878	I878-E880 PolarHBondContact O-N 3.12Å
881	N	52.1	Low	50.9	Low	140 Å²	140	122.3 Å²	122.3	75%	0.749	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105	-21.3	-167.4	-81.8	-38.6	0	0	0	116.5	I878	I878-N881 PolarHBondContact O-N 2.78Å
882	I	45.2	Very low	51.5	Low	98 Å²	98	125.9 Å²	125.9	50%	0.503	61%	0.607	S	S	.	*	S	Bend	trans	-122.5	-8.3	-169.9	-56.8	-179.6	0	0	0	112.6	L887	I882-L887 HydrophobicContact CB-CD1 4.4Å; I882-L887 HydrophobicContact CG2-CD1 4.01Å
883	T	40.8	Very low	52.4	Low	33 Å²	33	121.1 Å²	121.1	20%	0.202	60%	0.599	C	S	.	*	T	Hydrogen-bonded Turn	trans	-85	-17.6	-157	54.5	0	0	0	0	117.5	M879 L887	M879-T883 HydrophobicContact CB-CG2 4.36Å; M879-T883 WeakPolarHBondContact O-CB 3.33Å; M879-T883 WeakPolarHBondContact O-CG2 3.29Å; M879-T883 PolarHBondContact O-OG1 3.44Å; M879-T883 HydrophobicContact SD-CG2 3.73Å; T883-L887 HydrophobicContact CG2-CD1 3.88Å; T883-L887 HydrophobicContact CG2-CD2 3.51Å; T883-L887 HydrophobicContact CG2-CG 4.23Å; T883-L887 WeakPolarHBondContact O-CB 3.4Å
884	N	50.1	Low	52.8	Low	154 Å²	154	117 Å²	117	82%	0.824	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.5	-16.2	-166.5	-90.3	-7.9	0	0	0	117.6
885	E	50.8	Low	53.5	Low	183 Å²	183	116.3 Å²	116.3	86%	0.855	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.3	-37	173.1	-81.4	-161.9	149.3	0	0	116.1
886	T	49.6	Very low	55	Low	107 Å²	107	117.6 Å²	117.6	66%	0.656	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-18.6	179.9	34.8	0	0	0	0	113.4	N888	T886-N888 PolarHBondContact O-N 3.45Å
887	L	49.8	Very low	56.1	Low	38 Å²	38	115.4 Å²	115.4	20%	0.199	57%	0.571	C	S	.	*	H	α-helix	trans	-66.7	-34.6	-173.9	-136.9	84.6	0	0	0	112.8	I882 T883 L889 Y890 L891	I882-L887 HydrophobicContact CB-CD1 4.4Å; I882-L887 HydrophobicContact CG2-CD1 4.01Å; T883-L887 HydrophobicContact CG2-CD1 3.88Å; T883-L887 HydrophobicContact CG2-CD2 3.51Å; T883-L887 HydrophobicContact CG2-CG 4.23Å; T883-L887 WeakPolarHBondContact O-CB 3.4Å; L887-L889 VanDerWaalsContact C-N 3.33Å; L887-L889 PolarHBondContact O-N 3.29Å; L887-Y890 PolarHBondContact O-N 3.27Å; L887-L891 HydrophobicContact CB-CD1 4.02Å; L887-L891 HydrophobicContact CB-CG 4.34Å; L887-L891 HydrophobicContact CD2-CD1 3.46Å; L887-L891 VanDerWaalsContact CD2-CD1 3.46Å; L887-L891 HydrophobicContact CD2-CD2 4.07Å; L887-L891 HydrophobicContact CD2-CG 3.64Å; L887-L891 HydrophobicContact CG-CD1 3.85Å; L887-L891 HydrophobicContact CG-CG 3.78Å; L887-L891 WeakPolarHBondContact O-CA 3.23Å; L887-L891 WeakPolarHBondContact O-CB 3.35Å; L887-L891 VanDerWaalsContact O-CG 3.25Å; L887-L891 WeakPolarHBondContact O-CG 3.29Å; L887-L891 PolarHBondContact O-N 3.42Å
888	N	56.1	Low	56.8	Low	124 Å²	124	112.2 Å²	112.2	66%	0.663	56%	0.556	S	S	*	*	H	α-helix	trans	-65.8	-31.7	-170.4	-82.7	-27.6	0	0	0	114.3	T886	T886-N888 PolarHBondContact O-N 3.45Å
889	L	57.4	Low	58	Low	160 Å²	160	116 Å²	116	84%	0.838	57%	0.565	S	S	*	*	H	α-helix	trans	-82.9	-34.8	177	-74.2	170.7	0	0	0	112.6	L887	L887-L889 VanDerWaalsContact C-N 3.33Å; L887-L889 PolarHBondContact O-N 3.29Å
890	Y	56	Low	59.4	Low	168 Å²	168	114.1 Å²	114.1	66%	0.659	56%	0.559	S	S	*	*	H	α-helix	trans	-81.2	-30.1	177.7	-146	-91	0	0	0	112.4	L887 Y892 S893 L894	L887-Y890 PolarHBondContact O-N 3.27Å; Y890-Y892 VanDerWaalsContact C-N 3.29Å; Y890-Y892 PolarHBondContact O-N 3.36Å; Y890-S893 PolarHBondContact O-N 3.35Å; Y890-S893 PolarHBondContact O-OG 3.21Å; Y890-L894 HydrophobicContact CD1-CD1 4.1Å; Y890-L894 HydrophobicContact CE1-CD1 3.95Å; Y890-L894 VanDerWaalsContact O-CB 3.27Å; Y890-L894 WeakPolarHBondContact O-CB 3.38Å; Y890-L894 PolarHBondContact O-N 3.33Å
891	L	55.4	Low	60.4	Low	63 Å²	63	110.1 Å²	110.1	33%	0.33	54%	0.543	S	S	.	.	H	α-helix	trans	-56.9	-44.4	172	-93.4	165.5	0	0	0	110.8	L887 S893 L894 V895	L887-L891 HydrophobicContact CB-CD1 4.02Å; L887-L891 HydrophobicContact CB-CG 4.34Å; L887-L891 HydrophobicContact CD2-CD1 3.46Å; L887-L891 VanDerWaalsContact CD2-CD1 3.46Å; L887-L891 HydrophobicContact CD2-CD2 4.07Å; L887-L891 HydrophobicContact CD2-CG 3.64Å; L887-L891 HydrophobicContact CG-CD1 3.85Å; L887-L891 HydrophobicContact CG-CG 3.78Å; L887-L891 WeakPolarHBondContact O-CA 3.23Å; L887-L891 WeakPolarHBondContact O-CB 3.35Å; L887-L891 VanDerWaalsContact O-CG 3.25Å; L887-L891 WeakPolarHBondContact O-CG 3.29Å; L887-L891 PolarHBondContact O-N 3.42Å; L891-S893 VanDerWaalsContact C-N 3.31Å; L891-S893 PolarHBondContact O-N 3.21Å; L891-L894 PolarHBondContact O-N 3.28Å; L891-V895 HydrophobicContact CD2-CG2 4.3Å; L891-V895 VanDerWaalsContact O-CB 3.28Å; L891-V895 WeakPolarHBondContact O-CB 3.43Å; L891-V895 WeakPolarHBondContact O-CG2 3.07Å; L891-V895 PolarHBondContact O-N 3.16Å
892	Y	62.9	Low	61.2	Low	182 Å²	182	109.3 Å²	109.3	71%	0.714	53%	0.534	S	S	*	.	H	α-helix	trans	-64.2	-40.4	-175.8	-155.6	-84.2	0	0	0	111.3	Y890 H896	Y890-Y892 VanDerWaalsContact C-N 3.29Å; Y890-Y892 PolarHBondContact O-N 3.36Å; Y892-H896 WeakPolarHBondContact O-CB 3.42Å; Y892-H896 PolarHBondContact O-N 3.29Å
893	S	71	Confident	62.6	Low	64 Å²	64	109.2 Å²	109.2	45%	0.448	54%	0.535	S	S	.	.	H	α-helix	trans	-72.5	-34.5	175.1	67.7	0	0	0	0	112.5	Y890 L891 R897	Y890-S893 PolarHBondContact O-N 3.35Å; Y890-S893 PolarHBondContact O-OG 3.21Å; L891-S893 VanDerWaalsContact C-N 3.31Å; L891-S893 PolarHBondContact O-N 3.21Å; S893-R897 WeakPolarHBondContact O-CB 3.41Å; S893-R897 PolarHBondContact O-N 2.87Å; S893-R897 VanDerWaalsContact O-N 3.1Å
894	L	66.3	Low	64	Low	62 Å²	62	112.9 Å²	112.9	33%	0.325	55%	0.552	S	S	.	*	H	α-helix	trans	-70.9	-47.8	179	-153.9	107.1	0	0	0	111.7	Y890 L891 H896 R897 E898	Y890-L894 HydrophobicContact CD1-CD1 4.1Å; Y890-L894 HydrophobicContact CE1-CD1 3.95Å; Y890-L894 VanDerWaalsContact O-CB 3.27Å; Y890-L894 WeakPolarHBondContact O-CB 3.38Å; Y890-L894 PolarHBondContact O-N 3.33Å; L891-L894 PolarHBondContact O-N 3.28Å; L894-H896 VanDerWaalsContact C-N 3.28Å; L894-H896 PolarHBondContact O-N 2.79Å; L894-R897 WeakPolarHBondContact O-CB 3.4Å; L894-R897 PolarHBondContact O-N 3.18Å; L894-E898 HydrophobicContact CD2-CG 4.46Å; L894-E898 WeakPolarHBondContact O-CG 3.23Å; L894-E898 PolarHBondContact O-N 3.33Å
895	V	69.9	Low	65	Low	83 Å²	83	113 Å²	113	50%	0.503	54%	0.542	S	S	.	.	H	α-helix	trans	-58.6	-42.4	176.8	170.2	0	0	0	0	110.2	L891 R897 E898 W899	L891-V895 HydrophobicContact CD2-CG2 4.3Å; L891-V895 VanDerWaalsContact O-CB 3.28Å; L891-V895 WeakPolarHBondContact O-CB 3.43Å; L891-V895 WeakPolarHBondContact O-CG2 3.07Å; L891-V895 PolarHBondContact O-N 3.16Å; V895-R897 VanDerWaalsContact C-N 3.33Å; V895-R897 PolarHBondContact O-N 3.17Å; V895-E898 PolarHBondContact O-N 2.89Å; V895-W899 VanDerWaalsContact O-CB 3.3Å; V895-W899 WeakPolarHBondContact O-CB 3.16Å; V895-W899 PolarHBondContact O-N 3.21Å
896	H	72.2	Confident	65.9	Low	122 Å²	122	108.2 Å²	108.2	57%	0.565	52%	0.522	S	S	*	.	H	α-helix	trans	-64.7	-39.3	176.4	-158.8	-36.9	0	0	0	111.8	Y892 L894 T900	Y892-H896 WeakPolarHBondContact O-CB 3.42Å; Y892-H896 PolarHBondContact O-N 3.29Å; L894-H896 VanDerWaalsContact C-N 3.28Å; L894-H896 PolarHBondContact O-N 2.79Å; H896-T900 PolarHBondContact O-N 3.35Å; H896-T900 PolarHBondContact O-OG1 3.45Å
897	R	73.1	Confident	66.9	Low	122 Å²	122	109 Å²	109	46%	0.46	52%	0.519	S	S	.	.	H	α-helix	trans	-66	-44.3	176.3	-173.5	176.7	59.2	64.9	8.6	112	S893 L894 V895 T900 L901	S893-R897 WeakPolarHBondContact O-CB 3.41Å; S893-R897 PolarHBondContact O-N 2.87Å; S893-R897 VanDerWaalsContact O-N 3.1Å; L894-R897 WeakPolarHBondContact O-CB 3.4Å; L894-R897 PolarHBondContact O-N 3.18Å; V895-R897 VanDerWaalsContact C-N 3.33Å; V895-R897 PolarHBondContact O-N 3.17Å; R897-T900 PolarHBondContact O-N 3.19Å; R897-L901 HydrophobicContact CG-CD1 4.36Å; R897-L901 WeakPolarHBondContact O-CG 3.31Å; R897-L901 PolarHBondContact O-N 2.94Å
898	E	70.2	Confident	67.8	Low	84 Å²	84	114.3 Å²	114.3	39%	0.393	54%	0.537	S	S	.	.	H	α-helix	trans	-67.5	-42	179.5	-64.8	-53.1	148	0	0	111.7	L894 V895 T900 L901 E902	L894-E898 HydrophobicContact CD2-CG 4.46Å; L894-E898 WeakPolarHBondContact O-CG 3.23Å; L894-E898 PolarHBondContact O-N 3.33Å; V895-E898 PolarHBondContact O-N 2.89Å; E898-T900 PolarHBondContact O-N 3.21Å; E898-L901 PolarHBondContact O-N 3.44Å; E898-L901 VanDerWaalsContact O-N 3.1Å; E898-E902 PolarHBondContact O-N 3.36Å
899	W	73.2	Confident	68.3	Low	174 Å²	174	110.3 Å²	110.3	66%	0.659	52%	0.517	S	S	*	.	H	α-helix	trans	-55.9	-40.9	172.8	-176.3	-71.7	0	0	0	111.7	V895 L903	V895-W899 VanDerWaalsContact O-CB 3.3Å; V895-W899 WeakPolarHBondContact O-CB 3.16Å; V895-W899 PolarHBondContact O-N 3.21Å; W899-L903 PolarHBondContact O-N 2.97Å
900	T	72.4	Confident	68.7	Low	67 Å²	67	107.5 Å²	107.5	41%	0.411	50%	0.503	S	S	.	.	H	α-helix	trans	-69.6	-37.3	179.5	-40	0	0	0	0	111.5	H896 R897 E898 L904	H896-T900 PolarHBondContact O-N 3.35Å; H896-T900 PolarHBondContact O-OG1 3.45Å; R897-T900 PolarHBondContact O-N 3.19Å; E898-T900 PolarHBondContact O-N 3.21Å; T900-L904 PolarHBondContact O-N 3.45Å
901	L	74.4	Confident	69.4	Low	85 Å²	85	106.2 Å²	106.2	45%	0.445	50%	0.503	S	S	.	.	H	α-helix	trans	-69.7	-38.4	176.5	-75.8	169.6	0	0	0	112.3	R897 E898 L903 L904 Y905	R897-L901 HydrophobicContact CG-CD1 4.36Å; R897-L901 WeakPolarHBondContact O-CG 3.31Å; R897-L901 PolarHBondContact O-N 2.94Å; E898-L901 PolarHBondContact O-N 3.44Å; E898-L901 VanDerWaalsContact O-N 3.1Å; L901-L903 VanDerWaalsContact C-N 3.35Å; L901-L904 PolarHBondContact O-N 3.42Å; L901-Y905 VanDerWaalsContact O-CB 3.23Å; L901-Y905 WeakPolarHBondContact O-CB 3.45Å; L901-Y905 PolarHBondContact O-N 3.16Å
902	E	69.3	Low	69.9	Low	122 Å²	122	106.8 Å²	106.8	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-64.8	-40.7	177.4	-170.7	172.2	-173.1	0	0	111.4	E898 Y905 N906	E898-E902 PolarHBondContact O-N 3.36Å; E902-Y905 PolarHBondContact O-N 3.04Å; E902-N906 WeakPolarHBondContact O-CB 3.1Å; E902-N906 VanDerWaalsContact O-CG 3.28Å; E902-N906 PolarHBondContact O-N 3.06Å; E902-N906 PolarHBondContact O-ND2 2.93Å
903	L	72.9	Confident	69.9	Low	97 Å²	97	101.9 Å²	101.9	51%	0.508	49%	0.491	S	S	.	.	H	α-helix	trans	-62.6	-44.7	174.9	-128.2	132.2	0	0	0	111.8	W899 L901 E907	W899-L903 PolarHBondContact O-N 2.97Å; L901-L903 VanDerWaalsContact C-N 3.35Å; L903-E907 PolarHBondContact O-N 3.38Å; L903-E907 VanDerWaalsContact O-N 3.11Å
904	L	71.2	Confident	69.8	Low	109 Å²	109	103.6 Å²	103.6	57%	0.571	50%	0.496	S	S	*	.	H	α-helix	trans	-66.3	-38.3	175.9	-107.4	145.2	0	0	0	112.7	T900 L901 Y908	T900-L904 PolarHBondContact O-N 3.45Å; L901-L904 PolarHBondContact O-N 3.42Å; L904-Y908 WeakPolarHBondContact O-CB 3.35Å; L904-Y908 PolarHBondContact O-N 3.23Å
905	Y	70.6	Confident	70	Confident	156 Å²	156	105.7 Å²	105.7	61%	0.612	50%	0.503	S	S	*	.	H	α-helix	trans	-68.5	-44.1	178.8	-174.8	-100.6	0	0	0	111	L901 E902 Y908 V909	L901-Y905 VanDerWaalsContact O-CB 3.23Å; L901-Y905 WeakPolarHBondContact O-CB 3.45Å; L901-Y905 PolarHBondContact O-N 3.16Å; E902-Y905 PolarHBondContact O-N 3.04Å; Y905-Y908 PolarHBondContact O-N 2.9Å; Y905-V909 HydrophobicContact CD1-CG2 3.84Å; Y905-V909 HydrophobicContact CD2-CG2 4.31Å; Y905-V909 HydrophobicContact CE1-CG2 3.48Å; Y905-V909 VanDerWaalsContact CE1-CG2 3.48Å; Y905-V909 HydrophobicContact CE2-CG2 3.97Å; Y905-V909 HydrophobicContact CG-CG2 4.25Å; Y905-V909 WeakPolarHBondContact O-CB 3.45Å; Y905-V909 VanDerWaalsContact O-CG2 3.26Å; Y905-V909 WeakPolarHBondContact O-CG2 3.39Å; Y905-V909 PolarHBondContact O-N 3.04Å
906	N	69.6	Low	69.8	Low	83 Å²	83	106.6 Å²	106.6	44%	0.444	50%	0.502	S	S	.	.	H	α-helix	trans	-63.5	-41.8	177	-72.5	-27	0	0	0	111.6	E902 Y908 V909 D910	E902-N906 WeakPolarHBondContact O-CB 3.1Å; E902-N906 VanDerWaalsContact O-CG 3.28Å; E902-N906 PolarHBondContact O-N 3.06Å; E902-N906 PolarHBondContact O-ND2 2.93Å; N906-Y908 PolarHBondContact O-N 3.22Å; N906-V909 PolarHBondContact O-N 3.28Å; N906-D910 WeakPolarHBondContact O-CB 3.22Å; N906-D910 PolarHBondContact O-N 3.15Å
907	E	72	Confident	69.3	Low	125 Å²	125	105.7 Å²	105.7	58%	0.584	50%	0.501	S	S	*	.	H	α-helix	trans	-61.7	-42.2	172.6	-81.9	-165.3	151.6	0	0	112.5	L903 Q911	L903-E907 PolarHBondContact O-N 3.38Å; L903-E907 VanDerWaalsContact O-N 3.11Å; E907-Q911 WeakPolarHBondContact O-CB 3.35Å; E907-Q911 WeakPolarHBondContact O-CG 3.32Å; E907-Q911 PolarHBondContact O-N 3.42Å
908	Y	67.6	Low	69.2	Low	149 Å²	149	106 Å²	106	58%	0.584	51%	0.508	S	S	*	.	H	α-helix	trans	-69.9	-38.9	-179.6	-163.3	-96	0	0	0	112.2	L904 Y905 N906 Q911 L912	L904-Y908 WeakPolarHBondContact O-CB 3.35Å; L904-Y908 PolarHBondContact O-N 3.23Å; Y905-Y908 PolarHBondContact O-N 2.9Å; N906-Y908 PolarHBondContact O-N 3.22Å; Y908-Q911 PolarHBondContact O-N 2.89Å; Y908-L912 HydrophobicContact CD1-CD1 4.29Å; Y908-L912 HydrophobicContact CE1-CD1 3.59Å; Y908-L912 WeakPolarHBondContact O-CB 3.23Å; Y908-L912 PolarHBondContact O-N 2.81Å
909	V	65.8	Low	69.1	Low	39 Å²	39	106.7 Å²	106.7	24%	0.236	51%	0.509	C	S	.	.	H	α-helix	trans	-67.7	-45.1	176.1	169.8	0	0	0	0	110.4	Y905 N906 Q911 L912 I913	Y905-V909 HydrophobicContact CD1-CG2 3.84Å; Y905-V909 HydrophobicContact CD2-CG2 4.31Å; Y905-V909 HydrophobicContact CE1-CG2 3.48Å; Y905-V909 VanDerWaalsContact CE1-CG2 3.48Å; Y905-V909 HydrophobicContact CE2-CG2 3.97Å; Y905-V909 HydrophobicContact CG-CG2 4.25Å; Y905-V909 WeakPolarHBondContact O-CB 3.45Å; Y905-V909 VanDerWaalsContact O-CG2 3.26Å; Y905-V909 WeakPolarHBondContact O-CG2 3.39Å; Y905-V909 PolarHBondContact O-N 3.04Å; N906-V909 PolarHBondContact O-N 3.28Å; V909-Q911 VanDerWaalsContact C-N 3.32Å; V909-Q911 PolarHBondContact O-N 3.13Å; V909-L912 PolarHBondContact O-N 3.27Å; V909-I913 HydrophobicContact CG1-CD1 3.45Å; V909-I913 VanDerWaalsContact CG1-CD1 3.45Å; V909-I913 HydrophobicContact CG1-CG1 4.03Å; V909-I913 VanDerWaalsContact O-CB 3.3Å; V909-I913 WeakPolarHBondContact O-CB 3.2Å; V909-I913 VanDerWaalsContact O-CG1 3.28Å; V909-I913 WeakPolarHBondContact O-CG1 3.31Å; V909-I913 PolarHBondContact O-N 3.06Å
910	D	66.7	Low	68.4	Low	102 Å²	102	103.2 Å²	103.2	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-62.1	-40.3	175.9	-89	-16	0	0	0	111.6	N906 N914	N906-D910 WeakPolarHBondContact O-CB 3.22Å; N906-D910 PolarHBondContact O-N 3.15Å; D910-N914 WeakPolarHBondContact O-CB 3.41Å; D910-N914 VanDerWaalsContact O-CG 3.25Å; D910-N914 PolarHBondContact O-N 3.31Å; D910-N914 PolarHBondContact O-ND2 2.7Å
911	Q	71.3	Confident	67.9	Low	140 Å²	140	102.7 Å²	102.7	65%	0.654	51%	0.505	S	S	*	.	H	α-helix	trans	-64.1	-46.1	174	-80.7	-172.1	-4.2	0	0	112.1	E907 Y908 V909 N914 E915	E907-Q911 WeakPolarHBondContact O-CB 3.35Å; E907-Q911 WeakPolarHBondContact O-CG 3.32Å; E907-Q911 PolarHBondContact O-N 3.42Å; Y908-Q911 PolarHBondContact O-N 2.89Å; V909-Q911 VanDerWaalsContact C-N 3.32Å; V909-Q911 PolarHBondContact O-N 3.13Å; Q911-N914 PolarHBondContact O-N 3.11Å; Q911-E915 WeakPolarHBondContact O-CB 3.33Å; Q911-E915 PolarHBondContact O-N 3.45Å
912	L	65.5	Low	67.3	Low	75 Å²	75	101.5 Å²	101.5	39%	0.393	50%	0.502	S	S	.	.	H	α-helix	trans	-74.1	-38.2	-173.6	-158.9	140.1	0	0	0	112.1	Y908 V909 E915 Q916	Y908-L912 HydrophobicContact CD1-CD1 4.29Å; Y908-L912 HydrophobicContact CE1-CD1 3.59Å; Y908-L912 WeakPolarHBondContact O-CB 3.23Å; Y908-L912 PolarHBondContact O-N 2.81Å; V909-L912 PolarHBondContact O-N 3.27Å; L912-E915 PolarHBondContact O-N 3.21Å; L912-Q916 HydrophobicContact CD2-CG 4.33Å; L912-Q916 WeakPolarHBondContact O-CB 3.45Å; L912-Q916 VanDerWaalsContact O-CG 3.29Å; L912-Q916 WeakPolarHBondContact O-CG 3Å; L912-Q916 PolarHBondContact O-N 3.38Å
913	I	62.5	Low	67	Low	79 Å²	79	98.3 Å²	98.3	41%	0.405	49%	0.493	S	S	.	.	H	α-helix	trans	-62.9	-51.9	172	-69.4	178.2	0	0	0	109	V909 E915 Q916 L917	V909-I913 HydrophobicContact CG1-CD1 3.45Å; V909-I913 VanDerWaalsContact CG1-CD1 3.45Å; V909-I913 HydrophobicContact CG1-CG1 4.03Å; V909-I913 VanDerWaalsContact O-CB 3.3Å; V909-I913 WeakPolarHBondContact O-CB 3.2Å; V909-I913 VanDerWaalsContact O-CG1 3.28Å; V909-I913 WeakPolarHBondContact O-CG1 3.31Å; V909-I913 PolarHBondContact O-N 3.06Å; I913-E915 VanDerWaalsContact C-N 3.27Å; I913-E915 PolarHBondContact O-N 3.28Å; I913-Q916 PolarHBondContact O-N 3.37Å; I913-L917 HydrophobicContact CG2-CD1 4.05Å; I913-L917 VanDerWaalsContact O-CB 3.24Å; I913-L917 WeakPolarHBondContact O-CB 3.39Å; I913-L917 PolarHBondContact O-N 3.23Å
914	N	69.3	Low	66.1	Low	101 Å²	101	96.8 Å²	96.8	54%	0.54	49%	0.49	S	S	.	.	H	α-helix	trans	-59.7	-37.8	179.5	-78	-47.6	0	0	0	112.3	D910 Q911 H918	D910-N914 WeakPolarHBondContact O-CB 3.41Å; D910-N914 VanDerWaalsContact O-CG 3.25Å; D910-N914 PolarHBondContact O-N 3.31Å; D910-N914 PolarHBondContact O-ND2 2.7Å; Q911-N914 PolarHBondContact O-N 3.11Å; N914-H918 WeakPolarHBondContact O-CB 3.36Å; N914-H918 PolarHBondContact O-N 2.88Å
915	E	71.2	Confident	65.6	Low	105 Å²	105	96.7 Å²	96.7	49%	0.491	49%	0.49	S	S	.	.	H	α-helix	trans	-67.5	-41.1	177.7	-153	-162	155.5	0	0	112.4	Q911 L912 I913 K919	Q911-E915 WeakPolarHBondContact O-CB 3.33Å; Q911-E915 PolarHBondContact O-N 3.45Å; L912-E915 PolarHBondContact O-N 3.21Å; I913-E915 VanDerWaalsContact C-N 3.27Å; I913-E915 PolarHBondContact O-N 3.28Å; E915-K919 WeakPolarHBondContact O-CB 3.11Å; E915-K919 WeakPolarHBondContact O-CG 3.46Å; E915-K919 PolarHBondContact O-N 3.16Å; E915-K919 WeakPolarHBondContact OE1-CE 3.38Å; E915-K919 IonicContact OE1-NZ 2.77Å; E915-K919 PolarHBondContact OE1-NZ 2.77Å
916	Q	65	Low	64.9	Low	103 Å²	103	93.6 Å²	93.6	48%	0.481	49%	0.487	S	S	.	.	H	α-helix	trans	-73.4	-40.9	178.3	-67.5	-61.9	-16.4	0	0	112.2	L912 I913 H918 K919 L920	L912-Q916 HydrophobicContact CD2-CG 4.33Å; L912-Q916 WeakPolarHBondContact O-CB 3.45Å; L912-Q916 VanDerWaalsContact O-CG 3.29Å; L912-Q916 WeakPolarHBondContact O-CG 3Å; L912-Q916 PolarHBondContact O-N 3.38Å; I913-Q916 PolarHBondContact O-N 3.37Å; Q916-H918 VanDerWaalsContact C-N 3.32Å; Q916-H918 PolarHBondContact O-N 2.81Å; Q916-K919 PolarHBondContact O-N 3.07Å; Q916-L920 WeakPolarHBondContact O-CB 3.49Å; Q916-L920 PolarHBondContact O-N 3.37Å
917	L	61.1	Low	64.5	Low	103 Å²	103	94.5 Å²	94.5	54%	0.539	49%	0.491	S	S	.	.	H	α-helix	trans	-64.2	-40.7	177.1	-137.5	154.9	0	0	0	110	I913 L920 A921	I913-L917 HydrophobicContact CG2-CD1 4.05Å; I913-L917 VanDerWaalsContact O-CB 3.24Å; I913-L917 WeakPolarHBondContact O-CB 3.39Å; I913-L917 PolarHBondContact O-N 3.23Å; L917-L920 PolarHBondContact O-N 3.2Å; L917-A921 VanDerWaalsContact O-CB 3.25Å; L917-A921 WeakPolarHBondContact O-CB 3.44Å; L917-A921 PolarHBondContact O-N 3.38Å
918	H	71.1	Confident	63.7	Low	128 Å²	128	91.1 Å²	91.1	59%	0.593	48%	0.481	S	S	*	.	H	α-helix	trans	-66.3	-38.1	173.2	-163	-59.5	0	0	0	112.4	N914 Q916 T922	N914-H918 WeakPolarHBondContact O-CB 3.36Å; N914-H918 PolarHBondContact O-N 2.88Å; Q916-H918 VanDerWaalsContact C-N 3.32Å; Q916-H918 PolarHBondContact O-N 2.81Å; H918-T922 WeakPolarHBondContact O-CB 3.34Å; H918-T922 VanDerWaalsContact O-CG2 3.29Å; H918-T922 WeakPolarHBondContact O-CG2 3.33Å; H918-T922 PolarHBondContact O-N 3.09Å; H918-T922 PolarHBondContact O-OG1 3.18Å
919	K	67.3	Low	63.5	Low	99 Å²	99	88.3 Å²	88.3	43%	0.43	48%	0.475	S	S	.	.	H	α-helix	trans	-64.4	-40.9	172.9	-79	171.3	-172.1	160.7	0	112	E915 Q916 T922 S923	E915-K919 WeakPolarHBondContact O-CB 3.11Å; E915-K919 WeakPolarHBondContact O-CG 3.46Å; E915-K919 PolarHBondContact O-N 3.16Å; E915-K919 WeakPolarHBondContact OE1-CE 3.38Å; E915-K919 IonicContact OE1-NZ 2.77Å; E915-K919 PolarHBondContact OE1-NZ 2.77Å; Q916-K919 PolarHBondContact O-N 3.07Å; K919-T922 WeakPolarHBondContact CA-OG1 3.48Å; K919-T922 PolarHBondContact O-OG1 2.86Å; K919-S923 WeakPolarHBondContact O-CB 3.25Å; K919-S923 PolarHBondContact O-N 3.09Å
920	L	60.5	Low	62.9	Low	101 Å²	101	89 Å²	89	53%	0.529	49%	0.485	S	S	.	.	H	α-helix	trans	-69.3	-47.3	179.9	-155.3	102	0	0	0	111.2	Q916 L917 T922 S923 S924	Q916-L920 WeakPolarHBondContact O-CB 3.49Å; Q916-L920 PolarHBondContact O-N 3.37Å; L917-L920 PolarHBondContact O-N 3.2Å; L920-T922 PolarHBondContact O-N 3.35Å; L920-S923 PolarHBondContact O-N 3.11Å; L920-S923 PolarHBondContact O-OG 3.44Å; L920-S924 WeakPolarHBondContact O-CB 2.98Å; L920-S924 PolarHBondContact O-N 3.23Å; L920-S924 PolarHBondContact O-OG 3.38Å
921	A	61.2	Low	62.3	Low	55 Å²	55	88.6 Å²	88.6	46%	0.455	48%	0.483	S	S	.	.	H	α-helix	trans	-61.2	-44.4	177.4	0	0	0	0	0	111.5	L917 S923 S924 L925	L917-A921 VanDerWaalsContact O-CB 3.25Å; L917-A921 WeakPolarHBondContact O-CB 3.44Å; L917-A921 PolarHBondContact O-N 3.38Å; A921-S923 PolarHBondContact O-N 3.37Å; A921-S924 PolarHBondContact O-N 2.78Å; A921-L925 VanDerWaalsContact O-CB 3.29Å; A921-L925 WeakPolarHBondContact O-CB 3.42Å; A921-L925 PolarHBondContact O-N 2.73Å
922	T	62.1	Low	61.4	Low	60 Å²	60	85.5 Å²	85.5	37%	0.368	48%	0.477	S	S	.	.	H	α-helix	trans	-65.6	-37.9	175.3	48.5	0	0	0	0	112.7	H918 K919 L920 T926	H918-T922 WeakPolarHBondContact O-CB 3.34Å; H918-T922 VanDerWaalsContact O-CG2 3.29Å; H918-T922 WeakPolarHBondContact O-CG2 3.33Å; H918-T922 PolarHBondContact O-N 3.09Å; H918-T922 PolarHBondContact O-OG1 3.18Å; K919-T922 WeakPolarHBondContact CA-OG1 3.48Å; K919-T922 PolarHBondContact O-OG1 2.86Å; L920-T922 PolarHBondContact O-N 3.35Å; T922-T926 WeakPolarHBondContact O-CB 3.41Å; T922-T926 PolarHBondContact O-N 3.1Å; T922-T926 PolarHBondContact O-OG1 3.44Å
923	S	61.9	Low	61.1	Low	56 Å²	56	87.1 Å²	87.1	39%	0.392	49%	0.485	S	S	.	.	H	α-helix	trans	-64.9	-42.8	176.2	79.8	0	0	0	0	111.8	K919 L920 A921 T926 I927	K919-S923 WeakPolarHBondContact O-CB 3.25Å; K919-S923 PolarHBondContact O-N 3.09Å; L920-S923 PolarHBondContact O-N 3.11Å; L920-S923 PolarHBondContact O-OG 3.44Å; A921-S923 PolarHBondContact O-N 3.37Å; S923-T926 PolarHBondContact O-N 3.3Å; S923-I927 VanDerWaalsContact O-CG1 3.29Å; S923-I927 WeakPolarHBondContact O-CG1 3.27Å; S923-I927 PolarHBondContact O-N 3.25Å
924	S	53.4	Low	60.6	Low	64 Å²	64	90.1 Å²	90.1	45%	0.448	49%	0.493	S	S	.	.	H	α-helix	trans	-67.5	-44.8	-180	-53.5	0	0	0	0	111.3	L920 A921 T926 I927 S928	L920-S924 WeakPolarHBondContact O-CB 2.98Å; L920-S924 PolarHBondContact O-N 3.23Å; L920-S924 PolarHBondContact O-OG 3.38Å; A921-S924 PolarHBondContact O-N 2.78Å; S924-T926 VanDerWaalsContact C-N 3.32Å; S924-T926 PolarHBondContact O-N 2.94Å; S924-I927 PolarHBondContact O-N 3.07Å; S924-S928 PolarHBondContact O-N 2.83Å
925	L	61.7	Low	59.8	Low	107 Å²	107	90 Å²	90	56%	0.56	49%	0.492	S	S	*	.	H	α-helix	trans	-60.7	-41.3	173.8	-173	72.3	0	0	0	111.5	A921 I927 S928 I929	A921-L925 VanDerWaalsContact O-CB 3.29Å; A921-L925 WeakPolarHBondContact O-CB 3.42Å; A921-L925 PolarHBondContact O-N 2.73Å; L925-I927 PolarHBondContact O-N 3.33Å; L925-S928 PolarHBondContact O-N 3.31Å; L925-I929 HydrophobicContact CD1-CD1 4.4Å; L925-I929 HydrophobicContact CD2-CD1 4.42Å; L925-I929 HydrophobicContact CG-CD1 3.9Å; L925-I929 WeakPolarHBondContact O-CB 3.46Å; L925-I929 VanDerWaalsContact O-CG1 3.25Å; L925-I929 WeakPolarHBondContact O-CG1 3.25Å; L925-I929 PolarHBondContact O-N 3.49Å
926	T	56.9	Low	59.1	Low	91 Å²	91	92.8 Å²	92.8	56%	0.558	50%	0.499	S	S	*	.	H	α-helix	trans	-64.8	-40	178.6	-54.9	0	0	0	0	111.5	T922 S923 S924 A930	T922-T926 WeakPolarHBondContact O-CB 3.41Å; T922-T926 PolarHBondContact O-N 3.1Å; T922-T926 PolarHBondContact O-OG1 3.44Å; S923-T926 PolarHBondContact O-N 3.3Å; S924-T926 VanDerWaalsContact C-N 3.32Å; S924-T926 PolarHBondContact O-N 2.94Å; T926-A930 WeakPolarHBondContact O-CB 3.37Å; T926-A930 PolarHBondContact O-N 3.41Å
927	I	61.1	Low	58.6	Low	103 Å²	103	90.7 Å²	90.7	53%	0.528	50%	0.496	S	S	.	.	H	α-helix	trans	-67	-43.9	176.4	-67.9	164.3	0	0	0	110.8	S923 S924 L925 A930 N931	S923-I927 VanDerWaalsContact O-CG1 3.29Å; S923-I927 WeakPolarHBondContact O-CG1 3.27Å; S923-I927 PolarHBondContact O-N 3.25Å; S924-I927 PolarHBondContact O-N 3.07Å; L925-I927 PolarHBondContact O-N 3.33Å; I927-A930 PolarHBondContact O-N 2.87Å; I927-N931 PolarHBondContact O-N 2.75Å
928	S	54.5	Low	57.8	Low	54 Å²	54	89.9 Å²	89.9	38%	0.378	49%	0.491	S	S	.	.	H	α-helix	trans	-60.8	-46.6	176.7	174.6	0	0	0	0	111.8	S924 L925 A930 N931 S932	S924-S928 PolarHBondContact O-N 2.83Å; L925-S928 PolarHBondContact O-N 3.31Å; S928-A930 VanDerWaalsContact C-N 3.33Å; S928-A930 PolarHBondContact O-N 3.25Å; S928-N931 PolarHBondContact O-N 3.16Å; S928-S932 WeakPolarHBondContact O-CB 3.49Å; S928-S932 PolarHBondContact O-N 2.87Å
929	I	64	Low	57	Low	89 Å²	89	89.8 Å²	89.8	46%	0.456	50%	0.495	S	S	.	.	H	α-helix	trans	-61	-42.3	175.3	-68.1	168.4	0	0	0	110.8	L925 N931 S932 L933	L925-I929 HydrophobicContact CD1-CD1 4.4Å; L925-I929 HydrophobicContact CD2-CD1 4.42Å; L925-I929 HydrophobicContact CG-CD1 3.9Å; L925-I929 WeakPolarHBondContact O-CB 3.46Å; L925-I929 VanDerWaalsContact O-CG1 3.25Å; L925-I929 WeakPolarHBondContact O-CG1 3.25Å; L925-I929 PolarHBondContact O-N 3.49Å; I929-N931 PolarHBondContact O-N 3.08Å; I929-S932 PolarHBondContact O-N 3.43Å; I929-L933 HydrophobicContact CG2-CD1 3.94Å; I929-L933 HydrophobicContact CG2-CG 4.42Å; I929-L933 WeakPolarHBondContact O-CB 3.47Å; I929-L933 VanDerWaalsContact O-CG 3.28Å; I929-L933 WeakPolarHBondContact O-CG 3.42Å; I929-L933 PolarHBondContact O-N 2.93Å
930	A	52.1	Low	56.4	Low	54 Å²	54	90.9 Å²	90.9	45%	0.446	50%	0.5	S	S	.	.	H	α-helix	trans	-63.1	-41.4	177.6	0	0	0	0	0	112.4	T926 I927 S928 L933 Y934	T926-A930 WeakPolarHBondContact O-CB 3.37Å; T926-A930 PolarHBondContact O-N 3.41Å; I927-A930 PolarHBondContact O-N 2.87Å; S928-A930 VanDerWaalsContact C-N 3.33Å; S928-A930 PolarHBondContact O-N 3.25Å; A930-L933 PolarHBondContact O-N 3.23Å; A930-Y934 WeakPolarHBondContact O-CB 3.24Å; A930-Y934 PolarHBondContact O-N 3.21Å
931	N	54.9	Low	55.9	Low	94 Å²	94	90.2 Å²	90.2	50%	0.503	50%	0.502	S	S	.	.	H	α-helix	trans	-67.1	-42.1	177.1	-76.3	-13.5	0	0	0	112	I927 S928 I929 L933 Y934 N935	I927-N931 PolarHBondContact O-N 2.75Å; S928-N931 PolarHBondContact O-N 3.16Å; I929-N931 PolarHBondContact O-N 3.08Å; N931-L933 PolarHBondContact O-N 3.26Å; N931-Y934 PolarHBondContact O-N 2.82Å; N931-N935 WeakPolarHBondContact O-CB 3.31Å; N931-N935 VanDerWaalsContact O-CG 3.3Å; N931-N935 PolarHBondContact O-N 2.87Å; N931-N935 PolarHBondContact O-ND2 3.47Å
932	S	52.6	Low	55.2	Low	74 Å²	74	91.1 Å²	91.1	52%	0.517	51%	0.505	S	S	.	.	H	α-helix	trans	-59.3	-46.1	174.4	175.2	0	0	0	0	111.9	S928 I929 Y934 N935 Y936	S928-S932 WeakPolarHBondContact O-CB 3.49Å; S928-S932 PolarHBondContact O-N 2.87Å; I929-S932 PolarHBondContact O-N 3.43Å; S932-Y934 PolarHBondContact O-N 2.96Å; S932-N935 PolarHBondContact O-N 2.9Å; S932-Y936 WeakPolarHBondContact O-CB 3.42Å; S932-Y936 PolarHBondContact O-N 3.34Å
933	L	57.7	Low	54.9	Low	110 Å²	110	94 Å²	94	58%	0.576	51%	0.512	S	S	*	.	H	α-helix	trans	-65.5	-37.8	176.2	-70.1	172.9	0	0	0	112.6	I929 A930 N931 Y936 S937	I929-L933 HydrophobicContact CG2-CD1 3.94Å; I929-L933 HydrophobicContact CG2-CG 4.42Å; I929-L933 WeakPolarHBondContact O-CB 3.47Å; I929-L933 VanDerWaalsContact O-CG 3.28Å; I929-L933 WeakPolarHBondContact O-CG 3.42Å; I929-L933 PolarHBondContact O-N 2.93Å; A930-L933 PolarHBondContact O-N 3.23Å; N931-L933 PolarHBondContact O-N 3.26Å; L933-Y936 PolarHBondContact O-N 3.18Å; L933-S937 WeakPolarHBondContact O-CB 3.45Å; L933-S937 PolarHBondContact O-N 3.3Å
934	Y	52.3	Low	54.8	Low	142 Å²	142	95.6 Å²	95.6	56%	0.557	52%	0.516	S	S	*	.	H	α-helix	trans	-62.1	-47.7	173.9	178.1	-100.5	0	0	0	111.2	A930 N931 S932 Y936 S937 L938	A930-Y934 WeakPolarHBondContact O-CB 3.24Å; A930-Y934 PolarHBondContact O-N 3.21Å; N931-Y934 PolarHBondContact O-N 2.82Å; S932-Y934 PolarHBondContact O-N 2.96Å; Y934-Y936 PolarHBondContact O-N 2.88Å; Y934-S937 PolarHBondContact O-N 2.93Å; Y934-S937 VanDerWaalsContact O-N 3.15Å; Y934-S937 PolarHBondContact O-OG 3.25Å; Y934-L938 PolarHBondContact O-N 3.43Å
935	N	53.7	Low	54.7	Low	98 Å²	98	98.1 Å²	98.1	52%	0.524	52%	0.521	S	S	.	.	H	α-helix	trans	-61.9	-42.1	177.5	-71.8	-19	0	0	0	111.8	N931 S932 S937 L938 L939	N931-N935 WeakPolarHBondContact O-CB 3.31Å; N931-N935 VanDerWaalsContact O-CG 3.3Å; N931-N935 PolarHBondContact O-N 2.87Å; N931-N935 PolarHBondContact O-ND2 3.47Å; S932-N935 PolarHBondContact O-N 2.9Å; N935-S937 VanDerWaalsContact C-N 3.34Å; N935-S937 PolarHBondContact O-N 3.17Å; N935-L938 PolarHBondContact O-N 3.46Å; N935-L939 WeakPolarHBondContact O-CB 3.44Å; N935-L939 PolarHBondContact O-N 2.99Å
936	Y	56.8	Low	54.5	Low	163 Å²	163	98.6 Å²	98.6	64%	0.639	52%	0.519	S	S	*	.	H	α-helix	trans	-61.2	-41.7	174	-174.1	-99.4	0	0	0	112	S932 L933 Y934 L939 K940	S932-Y936 WeakPolarHBondContact O-CB 3.42Å; S932-Y936 PolarHBondContact O-N 3.34Å; L933-Y936 PolarHBondContact O-N 3.18Å; Y934-Y936 PolarHBondContact O-N 2.88Å; Y936-L939 PolarHBondContact O-N 3.18Å; Y936-K940 WeakPolarHBondContact O-CB 3.5Å; Y936-K940 PolarHBondContact O-N 3.39Å
937	S	52.9	Low	54.5	Low	60 Å²	60	99.2 Å²	99.2	42%	0.42	52%	0.515	S	S	.	.	H	α-helix	trans	-65.6	-38.2	176.8	78.9	0	0	0	0	112.6	L933 Y934 N935 K940 C941	L933-S937 WeakPolarHBondContact O-CB 3.45Å; L933-S937 PolarHBondContact O-N 3.3Å; Y934-S937 PolarHBondContact O-N 2.93Å; Y934-S937 VanDerWaalsContact O-N 3.15Å; Y934-S937 PolarHBondContact O-OG 3.25Å; N935-S937 VanDerWaalsContact C-N 3.34Å; N935-S937 PolarHBondContact O-N 3.17Å; S937-K940 PolarHBondContact O-N 3.16Å; S937-C941 PolarHBondContact O-N 2.72Å
938	L	46	Very low	54.4	Low	85 Å²	85	100 Å²	100	45%	0.445	51%	0.512	S	S	.	.	H	α-helix	trans	-67.1	-45.7	176.9	-171.7	70.3	0	0	0	110.5	Y934 N935 K940 C941 C942	Y934-L938 PolarHBondContact O-N 3.43Å; N935-L938 PolarHBondContact O-N 3.46Å; L938-K940 VanDerWaalsContact C-N 3.32Å; L938-K940 PolarHBondContact O-N 2.68Å; L938-C941 WeakPolarHBondContact O-CB 3.49Å; L938-C941 PolarHBondContact O-N 2.87Å; L938-C941 VanDerWaalsContact O-N 3.12Å; L938-C942 PolarHBondContact O-N 2.97Å; L938-C942 PolarHBondContact O-SG 3.07Å; L938-C942 VanDerWaalsContact O-SG 3.35Å
939	L	52.8	Low	54.5	Low	126 Å²	126	101.5 Å²	101.5	66%	0.66	52%	0.515	S	S	*	.	H	α-helix	trans	-59.3	-43.7	176.7	-150.8	86.2	0	0	0	111.1	N935 Y936 C941 C942 F943	N935-L939 WeakPolarHBondContact O-CB 3.44Å; N935-L939 PolarHBondContact O-N 2.99Å; Y936-L939 PolarHBondContact O-N 3.18Å; L939-C941 PolarHBondContact O-N 2.61Å; L939-C942 PolarHBondContact O-N 3.17Å; L939-F943 WeakPolarHBondContact O-CB 3.33Å; L939-F943 PolarHBondContact O-N 3.36Å
940	K	55.3	Low	54.3	Low	123 Å²	123	100.4 Å²	100.4	54%	0.535	51%	0.51	S	S	.	.	H	α-helix	trans	-61.1	-42.9	174.2	-174.1	174.5	-179	176.2	0	112	Y936 S937 L938 F943 N944	Y936-K940 WeakPolarHBondContact O-CB 3.5Å; Y936-K940 PolarHBondContact O-N 3.39Å; S937-K940 PolarHBondContact O-N 3.16Å; L938-K940 VanDerWaalsContact C-N 3.32Å; L938-K940 PolarHBondContact O-N 2.68Å; K940-F943 PolarHBondContact O-N 3.25Å; K940-N944 WeakPolarHBondContact O-CB 3.36Å; K940-N944 PolarHBondContact O-N 3.43Å; K940-N944 PolarHBondContact O-OD1 3.17Å
941	C	48.9	Very low	55.4	Low	86 Å²	86	103.8 Å²	103.8	58%	0.581	51%	0.511	S	S	*	.	H	α-helix	trans	-62.7	-43.6	175.7	-111.5	0	0	0	0	112.2	S937 L938 L939 N944 H945	S937-C941 PolarHBondContact O-N 2.72Å; L938-C941 WeakPolarHBondContact O-CB 3.49Å; L938-C941 PolarHBondContact O-N 2.87Å; L938-C941 VanDerWaalsContact O-N 3.12Å; L939-C941 PolarHBondContact O-N 2.61Å; C941-N944 PolarHBondContact O-N 3.17Å; C941-H945 PolarHBondContact O-N 3.26Å
942	C	47.7	Very low	55.6	Low	75 Å²	75	104.3 Å²	104.3	51%	0.507	51%	0.509	S	S	.	.	H	α-helix	trans	-62.7	-44.7	176	-69.7	0	0	0	0	111.5	L938 L939 H945 F946	L938-C942 PolarHBondContact O-N 2.97Å; L938-C942 PolarHBondContact O-SG 3.07Å; L938-C942 VanDerWaalsContact O-SG 3.35Å; L939-C942 PolarHBondContact O-N 3.17Å; C942-H945 PolarHBondContact O-N 2.64Å; C942-F946 WeakPolarHBondContact O-CB 3.38Å; C942-F946 PolarHBondContact O-N 3.07Å
943	F	55.9	Low	56.1	Low	120 Å²	120	106.3 Å²	106.3	53%	0.526	51%	0.51	S	S	.	.	H	α-helix	trans	-64.3	-40.8	177.9	-160.7	-97	0	0	0	112	L939 K940 H945 F946 H947	L939-F943 WeakPolarHBondContact O-CB 3.33Å; L939-F943 PolarHBondContact O-N 3.36Å; K940-F943 PolarHBondContact O-N 3.25Å; F943-H945 VanDerWaalsContact C-N 3.35Å; F943-H945 PolarHBondContact O-N 3.44Å; F943-F946 PolarHBondContact O-N 3.29Å; F943-H947 AromaticContact CD1-CD2 3.73Å; F943-H947 AromaticContact CE1-CD2 3.31Å; F943-H947 WeakPolarHBondContact CE1-CD2 3.43Å; F943-H947 AromaticContact CE1-NE2 3.51Å; F943-H947 AromaticContact CZ-CD2 3.98Å; F943-H947 AromaticContact CZ-NE2 4Å; F943-H947 WeakPolarHBondContact O-CB 3.33Å; F943-H947 PolarHBondContact O-N 2.84Å
944	N	59.1	Low	56.6	Low	90 Å²	90	104.8 Å²	104.8	48%	0.481	50%	0.502	S	S	.	.	H	α-helix	trans	-63.9	-38.9	173.8	-71.7	-7.1	0	0	0	112.2	K940 C941 H947 Y948	K940-N944 WeakPolarHBondContact O-CB 3.36Å; K940-N944 PolarHBondContact O-N 3.43Å; K940-N944 PolarHBondContact O-OD1 3.17Å; C941-N944 PolarHBondContact O-N 3.17Å; N944-H947 PolarHBondContact O-N 3.34Å; N944-Y948 WeakPolarHBondContact O-CB 3.45Å; N944-Y948 PolarHBondContact O-N 3.41Å
945	H	51.6	Low	56.9	Low	117 Å²	117	102.6 Å²	102.6	54%	0.542	50%	0.496	S	S	.	.	H	α-helix	trans	-67.1	-40.9	176.4	-165.7	75	0	0	0	111.7	C941 C942 F943 Y948 L949	C941-H945 PolarHBondContact O-N 3.26Å; C942-H945 PolarHBondContact O-N 2.64Å; F943-H945 VanDerWaalsContact C-N 3.35Å; F943-H945 PolarHBondContact O-N 3.44Å; H945-Y948 WeakPolarHBondContact O-CB 3.2Å; H945-Y948 PolarHBondContact O-N 3.27Å; H945-L949 WeakPolarHBondContact O-CG 3.44Å; H945-L949 PolarHBondContact O-N 2.88Å
946	F	58.3	Low	57.4	Low	117 Å²	117	102.7 Å²	102.7	51%	0.513	50%	0.496	S	S	.	.	H	α-helix	trans	-61.3	-46	172.8	176.6	-108.3	0	0	0	111.8	C942 F943 Y948 L949 I950	C942-F946 WeakPolarHBondContact O-CB 3.38Å; C942-F946 PolarHBondContact O-N 3.07Å; F943-F946 PolarHBondContact O-N 3.29Å; F946-Y948 VanDerWaalsContact C-N 3.32Å; F946-Y948 PolarHBondContact O-N 3.16Å; F946-L949 WeakPolarHBondContact O-CB 3.42Å; F946-L949 PolarHBondContact O-N 3.31Å; F946-L949 VanDerWaalsContact O-N 3.09Å; F946-I950 HydrophobicContact CD1-CD1 3.87Å; F946-I950 HydrophobicContact CE1-CD1 3.29Å; F946-I950 HydrophobicContact CE1-CG1 4.31Å; F946-I950 HydrophobicContact CE2-CD1 4.14Å; F946-I950 HydrophobicContact CE2-CG1 4.44Å; F946-I950 HydrophobicContact CZ-CD1 3.45Å; F946-I950 VanDerWaalsContact CZ-CD1 3.45Å; F946-I950 HydrophobicContact CZ-CG1 4.21Å; F946-I950 PolarHBondContact O-N 2.89Å
947	H	56.2	Low	57.9	Low	103 Å²	103	97.8 Å²	97.8	48%	0.477	48%	0.48	S	S	.	.	H	α-helix	trans	-58.6	-42.1	173.7	-109.5	-86.8	0	0	0	112.6	F943 N944 L949 I950 W951	F943-H947 AromaticContact CD1-CD2 3.73Å; F943-H947 AromaticContact CE1-CD2 3.31Å; F943-H947 WeakPolarHBondContact CE1-CD2 3.43Å; F943-H947 AromaticContact CE1-NE2 3.51Å; F943-H947 AromaticContact CZ-CD2 3.98Å; F943-H947 AromaticContact CZ-NE2 4Å; F943-H947 WeakPolarHBondContact O-CB 3.33Å; F943-H947 PolarHBondContact O-N 2.84Å; N944-H947 PolarHBondContact O-N 3.34Å; H947-L949 VanDerWaalsContact C-N 3.31Å; H947-L949 PolarHBondContact O-N 2.78Å; H947-I950 PolarHBondContact O-N 3.31Å; H947-W951 WeakPolarHBondContact O-CB 3.37Å; H947-W951 PolarHBondContact O-N 2.79Å
948	Y	59.5	Low	58.2	Low	120 Å²	120	101.5 Å²	101.5	47%	0.471	49%	0.49	S	S	.	.	H	α-helix	trans	-61.1	-40	174.7	173.8	-97.3	0	0	0	112	N944 H945 F946 W951 K952	N944-Y948 WeakPolarHBondContact O-CB 3.45Å; N944-Y948 PolarHBondContact O-N 3.41Å; H945-Y948 WeakPolarHBondContact O-CB 3.2Å; H945-Y948 PolarHBondContact O-N 3.27Å; F946-Y948 VanDerWaalsContact C-N 3.32Å; F946-Y948 PolarHBondContact O-N 3.16Å; Y948-W951 HydrophobicContact CD2-CE3 4.47Å; Y948-W951 HydrophobicContact CE2-CE3 4.4Å; Y948-W951 HydrophobicContact CE2-CZ3 4.36Å; Y948-W951 PolarHBondContact O-N 2.86Å; Y948-K952 HydrophobicContact CE1-CD 4.38Å; Y948-K952 VanDerWaalsContact O-CB 3.3Å; Y948-K952 WeakPolarHBondContact O-CB 2.8Å; Y948-K952 PolarHBondContact O-N 2.69Å
949	L	56	Low	58.8	Low	85 Å²	85	103.1 Å²	103.1	45%	0.445	49%	0.494	S	S	.	.	H	α-helix	trans	-66.9	-42.8	176.3	-69.3	172.8	0	0	0	111.9	H945 F946 H947 K952 H953	H945-L949 WeakPolarHBondContact O-CG 3.44Å; H945-L949 PolarHBondContact O-N 2.88Å; F946-L949 WeakPolarHBondContact O-CB 3.42Å; F946-L949 PolarHBondContact O-N 3.31Å; F946-L949 VanDerWaalsContact O-N 3.09Å; H947-L949 VanDerWaalsContact C-N 3.31Å; H947-L949 PolarHBondContact O-N 2.78Å; L949-K952 PolarHBondContact O-N 3.22Å; L949-H953 WeakPolarHBondContact O-CB 3.45Å; L949-H953 PolarHBondContact O-N 3.5Å
950	I	60.1	Low	59.1	Low	66 Å²	66	102.7 Å²	102.7	34%	0.338	49%	0.488	S	S	.	.	H	α-helix	trans	-61.2	-47.7	173.4	-71.5	176.9	0	0	0	110.7	F946 H947 K952 H953 N954	F946-I950 HydrophobicContact CD1-CD1 3.87Å; F946-I950 HydrophobicContact CE1-CD1 3.29Å; F946-I950 HydrophobicContact CE1-CG1 4.31Å; F946-I950 HydrophobicContact CE2-CD1 4.14Å; F946-I950 HydrophobicContact CE2-CG1 4.44Å; F946-I950 HydrophobicContact CZ-CD1 3.45Å; F946-I950 VanDerWaalsContact CZ-CD1 3.45Å; F946-I950 HydrophobicContact CZ-CG1 4.21Å; F946-I950 PolarHBondContact O-N 2.89Å; H947-I950 PolarHBondContact O-N 3.31Å; I950-K952 VanDerWaalsContact C-N 3.31Å; I950-K952 PolarHBondContact O-N 2.98Å; I950-H953 WeakPolarHBondContact O-CB 3.45Å; I950-H953 PolarHBondContact O-N 3.49Å; I950-H953 VanDerWaalsContact O-N 3.15Å; I950-N954 WeakPolarHBondContact O-CB 3.39Å; I950-N954 PolarHBondContact O-N 3.06Å
951	W	75	Confident	59.4	Low	125 Å²	125	100.9 Å²	100.9	47%	0.473	49%	0.485	S	S	.	.	H	α-helix	trans	-58.9	-44.3	177.7	176.4	88.6	0	0	0	111.4	H947 Y948 H953 N954 K955	H947-W951 WeakPolarHBondContact O-CB 3.37Å; H947-W951 PolarHBondContact O-N 2.79Å; Y948-W951 HydrophobicContact CD2-CE3 4.47Å; Y948-W951 HydrophobicContact CE2-CE3 4.4Å; Y948-W951 HydrophobicContact CE2-CZ3 4.36Å; Y948-W951 PolarHBondContact O-N 2.86Å; W951-H953 VanDerWaalsContact C-N 3.33Å; W951-H953 PolarHBondContact O-N 3.06Å; W951-N954 PolarHBondContact O-N 2.79Å; W951-K955 HydrophobicContact CH2-CD 3.84Å; W951-K955 HydrophobicContact CZ2-CD 4.06Å; W951-K955 HydrophobicContact CZ3-CD 4.22Å; W951-K955 WeakPolarHBondContact O-CB 2.78Å; W951-K955 PolarHBondContact O-N 3.03Å
952	K	60.1	Low	59.3	Low	106 Å²	106	102.4 Å²	102.4	46%	0.461	49%	0.486	S	S	.	.	H	α-helix	trans	-63.4	-39.1	176.6	-172.3	177.4	179.6	-178.4	0	111.6	Y948 L949 I950 K955 L956	Y948-K952 HydrophobicContact CE1-CD 4.38Å; Y948-K952 VanDerWaalsContact O-CB 3.3Å; Y948-K952 WeakPolarHBondContact O-CB 2.8Å; Y948-K952 PolarHBondContact O-N 2.69Å; L949-K952 PolarHBondContact O-N 3.22Å; I950-K952 VanDerWaalsContact C-N 3.31Å; I950-K952 PolarHBondContact O-N 2.98Å; K952-K955 PolarHBondContact O-N 3.18Å; K952-L956 WeakPolarHBondContact O-CG 3.28Å; K952-L956 PolarHBondContact O-N 3.32Å; K952-L956 VanDerWaalsContact O-N 3.12Å
953	H	61.9	Low	59.3	Low	115 Å²	115	105 Å²	105	53%	0.532	50%	0.495	S	S	.	.	H	α-helix	trans	-66.1	-47.9	175.7	-175.3	56.3	0	0	0	111.8	L949 I950 W951 K955 L956 I957	L949-H953 WeakPolarHBondContact O-CB 3.45Å; L949-H953 PolarHBondContact O-N 3.5Å; I950-H953 WeakPolarHBondContact O-CB 3.45Å; I950-H953 PolarHBondContact O-N 3.49Å; I950-H953 VanDerWaalsContact O-N 3.15Å; W951-H953 VanDerWaalsContact C-N 3.33Å; W951-H953 PolarHBondContact O-N 3.06Å; H953-K955 VanDerWaalsContact C-N 3.28Å; H953-K955 PolarHBondContact O-N 3.07Å; H953-L956 WeakPolarHBondContact O-CA 3.17Å; H953-L956 WeakPolarHBondContact O-CB 3.35Å; H953-L956 PolarHBondContact O-N 3.35Å; H953-I957 WeakPolarHBondContact NE2-CD1 3.48Å; H953-I957 PolarHBondContact O-N 3.13Å
954	N	68	Low	58.8	Low	78 Å²	78	105 Å²	105	42%	0.417	50%	0.5	S	S	.	.	H	α-helix	trans	-59.9	-37.5	175.3	-74.7	-20.3	0	0	0	112.1	I950 W951 L956 I957 Q958	I950-N954 WeakPolarHBondContact O-CB 3.39Å; I950-N954 PolarHBondContact O-N 3.06Å; W951-N954 PolarHBondContact O-N 2.79Å; N954-L956 VanDerWaalsContact C-N 3.32Å; N954-L956 PolarHBondContact O-N 2.82Å; N954-I957 PolarHBondContact O-N 3.38Å; N954-Q958 WeakPolarHBondContact O-CB 3.39Å; N954-Q958 WeakPolarHBondContact O-CG 3.33Å; N954-Q958 PolarHBondContact O-N 2.71Å
955	K	59.7	Low	57.9	Low	97 Å²	97	105.6 Å²	105.6	42%	0.422	51%	0.507	S	S	.	.	H	α-helix	trans	-65.7	-33.7	174.4	-166.2	176.3	-174.1	171.8	0	112.5	W951 K952 H953 K959	W951-K955 HydrophobicContact CH2-CD 3.84Å; W951-K955 HydrophobicContact CZ2-CD 4.06Å; W951-K955 HydrophobicContact CZ3-CD 4.22Å; W951-K955 WeakPolarHBondContact O-CB 2.78Å; W951-K955 PolarHBondContact O-N 3.03Å; K952-K955 PolarHBondContact O-N 3.18Å; H953-K955 VanDerWaalsContact C-N 3.28Å; H953-K955 PolarHBondContact O-N 3.07Å; K955-K959 WeakPolarHBondContact O-CG 3.34Å; K955-K959 PolarHBondContact O-N 2.72Å
956	L	64.5	Low	56.8	Low	100 Å²	100	106.5 Å²	106.5	52%	0.524	51%	0.513	S	S	.	.	H	α-helix	trans	-70.5	-44.7	173.4	-72.2	169.9	0	0	0	111.1	K952 H953 N954 Q958 K959 E960	K952-L956 WeakPolarHBondContact O-CG 3.28Å; K952-L956 PolarHBondContact O-N 3.32Å; K952-L956 VanDerWaalsContact O-N 3.12Å; H953-L956 WeakPolarHBondContact O-CA 3.17Å; H953-L956 WeakPolarHBondContact O-CB 3.35Å; H953-L956 PolarHBondContact O-N 3.35Å; N954-L956 VanDerWaalsContact C-N 3.32Å; N954-L956 PolarHBondContact O-N 2.82Å; L956-Q958 VanDerWaalsContact C-N 3.32Å; L956-Q958 PolarHBondContact O-N 3.46Å; L956-K959 WeakPolarHBondContact O-CB 3.3Å; L956-K959 PolarHBondContact O-N 3.07Å; L956-K959 VanDerWaalsContact O-N 3.16Å; L956-E960 WeakPolarHBondContact O-CB 3.34Å; L956-E960 PolarHBondContact O-N 3.44Å
957	I	67.2	Low	55.8	Low	60 Å²	60	105.6 Å²	105.6	31%	0.308	52%	0.519	S	S	.	.	H	α-helix	trans	-60.7	-41.9	174.3	-68	169.4	0	0	0	111	H953 N954 K959 E960 N961	H953-I957 WeakPolarHBondContact NE2-CD1 3.48Å; H953-I957 PolarHBondContact O-N 3.13Å; N954-I957 PolarHBondContact O-N 3.38Å; I957-K959 VanDerWaalsContact C-N 3.35Å; I957-K959 PolarHBondContact O-N 2.92Å; I957-E960 PolarHBondContact O-N 3Å; I957-N961 WeakPolarHBondContact O-CB 3.46Å; I957-N961 PolarHBondContact O-N 2.76Å
958	Q	57.5	Low	54.8	Low	137 Å²	137	107.1 Å²	107.1	64%	0.64	54%	0.536	S	S	*	.	H	α-helix	trans	-65	-38.6	176.1	-78.3	179.9	-2.4	0	0	111.9	N954 L956 E960 N961 L962	N954-Q958 WeakPolarHBondContact O-CB 3.39Å; N954-Q958 WeakPolarHBondContact O-CG 3.33Å; N954-Q958 PolarHBondContact O-N 2.71Å; L956-Q958 VanDerWaalsContact C-N 3.32Å; L956-Q958 PolarHBondContact O-N 3.46Å; Q958-E960 VanDerWaalsContact C-N 3.34Å; Q958-N961 PolarHBondContact O-N 3.34Å; Q958-L962 WeakPolarHBondContact O-CB 3.18Å; Q958-L962 PolarHBondContact O-N 3.48Å
959	K	60.4	Low	53.5	Low	120 Å²	120	107 Å²	107	52%	0.522	55%	0.553	S	S	.	*	H	α-helix	trans	-64.2	-40.7	172.9	-80.4	179.8	174.8	-172	0	111.7	K955 L956 I957 L962 L963	K955-K959 WeakPolarHBondContact O-CG 3.34Å; K955-K959 PolarHBondContact O-N 2.72Å; L956-K959 WeakPolarHBondContact O-CB 3.3Å; L956-K959 PolarHBondContact O-N 3.07Å; L956-K959 VanDerWaalsContact O-N 3.16Å; I957-K959 VanDerWaalsContact C-N 3.35Å; I957-K959 PolarHBondContact O-N 2.92Å; K959-L962 PolarHBondContact O-N 3.29Å; K959-L963 WeakPolarHBondContact O-CB 3.29Å; K959-L963 WeakPolarHBondContact O-CD1 3.27Å; K959-L963 VanDerWaalsContact O-CG 3.25Å; K959-L963 WeakPolarHBondContact O-CG 3.45Å; K959-L963 PolarHBondContact O-N 2.98Å
960	E	58.1	Low	52.4	Low	116 Å²	116	109.9 Å²	109.9	54%	0.542	57%	0.567	S	S	.	*	H	α-helix	trans	-66.1	-44.6	176.8	-169.4	175.8	-178.6	0	0	111.3	L956 I957 Q958 L962 L963 N964	L956-E960 WeakPolarHBondContact O-CB 3.34Å; L956-E960 PolarHBondContact O-N 3.44Å; I957-E960 PolarHBondContact O-N 3Å; Q958-E960 VanDerWaalsContact C-N 3.34Å; E960-L962 PolarHBondContact O-N 2.77Å; E960-L963 WeakPolarHBondContact O-CB 3.26Å; E960-L963 PolarHBondContact O-N 3.12Å; E960-N964 WeakPolarHBondContact O-CB 3.4Å; E960-N964 PolarHBondContact O-N 3.13Å; E960-N964 PolarHBondContact O-ND2 2.86Å
961	N	60.9	Low	51	Low	86 Å²	86	111.4 Å²	111.4	46%	0.46	58%	0.584	S	S	.	*	H	α-helix	trans	-64.9	-38.3	173.7	-75.5	-21.6	0	0	0	112	I957 Q958 L963 N964 T965	I957-N961 WeakPolarHBondContact O-CB 3.46Å; I957-N961 PolarHBondContact O-N 2.76Å; Q958-N961 PolarHBondContact O-N 3.34Å; N961-L963 VanDerWaalsContact C-N 3.34Å; N961-N964 CarbonylContact O-C 3.37Å; N961-N964 PolarHBondContact O-N 2.84Å; N961-T965 VanDerWaalsContact O-CB 3.29Å; N961-T965 WeakPolarHBondContact O-CB 3.46Å; N961-T965 VanDerWaalsContact O-CG2 3.26Å; N961-T965 WeakPolarHBondContact O-CG2 3.2Å; N961-T965 PolarHBondContact O-N 3.36Å; N961-T965 PolarHBondContact O-OG1 3.46Å
962	L	48.6	Very low	49.1	Very low	117 Å²	117	110.3 Å²	110.3	61%	0.613	60%	0.595	S	S	*	*	H	α-helix	trans	-63.7	-41.8	174.7	-168.7	85.7	0	0	0	110.7	Q958 K959 E960 N964 T965 M966	Q958-L962 WeakPolarHBondContact O-CB 3.18Å; Q958-L962 PolarHBondContact O-N 3.48Å; K959-L962 PolarHBondContact O-N 3.29Å; E960-L962 PolarHBondContact O-N 2.77Å; L962-N964 VanDerWaalsContact C-N 3.34Å; L962-T965 PolarHBondContact O-N 3.34Å; L962-M966 WeakPolarHBondContact O-CG 3.47Å; L962-M966 PolarHBondContact O-N 2.93Å
963	L	46.6	Very low	47.9	Very low	131 Å²	131	112.2 Å²	112.2	69%	0.686	61%	0.61	S	S	*	*	H	α-helix	trans	-63.3	-40.9	173.7	-76.3	162.6	0	0	0	111.3	K959 E960 N961	K959-L963 WeakPolarHBondContact O-CB 3.29Å; K959-L963 WeakPolarHBondContact O-CD1 3.27Å; K959-L963 VanDerWaalsContact O-CG 3.25Å; K959-L963 WeakPolarHBondContact O-CG 3.45Å; K959-L963 PolarHBondContact O-N 2.98Å; E960-L963 WeakPolarHBondContact O-CB 3.26Å; E960-L963 PolarHBondContact O-N 3.12Å; N961-L963 VanDerWaalsContact C-N 3.34Å
964	N	46	Very low	46.5	Very low	119 Å²	119	111.2 Å²	111.2	64%	0.636	62%	0.615	S	S	*	*	H	α-helix	trans	-78.1	-19.6	-178.9	-69.3	-23.1	0	0	0	114.2	E960 N961 L962	E960-N964 WeakPolarHBondContact O-CB 3.4Å; E960-N964 PolarHBondContact O-N 3.13Å; E960-N964 PolarHBondContact O-ND2 2.86Å; N961-N964 CarbonylContact O-C 3.37Å; N961-N964 PolarHBondContact O-N 2.84Å; L962-N964 VanDerWaalsContact C-N 3.34Å
965	T	39	Very low	44.9	Very low	103 Å²	103	114 Å²	114	63%	0.632	63%	0.63	S	S	*	*	H	α-helix	trans	-102.5	1.8	-179.4	54.1	0	0	0	0	113.2	N961 L962 P967	N961-T965 VanDerWaalsContact O-CB 3.29Å; N961-T965 WeakPolarHBondContact O-CB 3.46Å; N961-T965 VanDerWaalsContact O-CG2 3.26Å; N961-T965 WeakPolarHBondContact O-CG2 3.2Å; N961-T965 PolarHBondContact O-N 3.36Å; N961-T965 PolarHBondContact O-OG1 3.46Å; L962-T965 PolarHBondContact O-N 3.34Å; T965-P967 WeakPolarHBondContact O-CD 3.45Å
966	M	30.2	Very low	43.7	Very low	136 Å²	136	114.9 Å²	114.9	67%	0.67	65%	0.645	S	S	*	*	S	Bend	trans	-63.6	118.6	173.1	-89.9	-157.6	146.1	0	0	110	L962 T968	L962-M966 WeakPolarHBondContact O-CG 3.47Å; L962-M966 PolarHBondContact O-N 2.93Å; M966-T968 PolarHBondContact O-N 3.39Å
967	P	35.5	Very low	42.3	Very low	97 Å²	97	116.5 Å²	116.5	63%	0.63	65%	0.653	S	S	*	*			trans	-65	122.7	-172.7	23.4	-31.4	0	0	0	110.7	T965 S969 I970	T965-P967 WeakPolarHBondContact O-CD 3.45Å; P967-S969 PolarHBondContact O-N 2.89Å; P967-I970 HydrophobicContact CG-CD1 4.38Å
968	T	36.8	Very low	40.6	Very low	136 Å²	136	118.1 Å²	118.1	83%	0.834	67%	0.669	S	S	*	*	S	Bend	trans	-65.6	112.3	174	48.3	0	0	0	0	109.2	M966	M966-T968 PolarHBondContact O-N 3.39Å
969	S	32.1	Very low	39.5	Very low	117 Å²	117	119.3 Å²	119.3	82%	0.818	68%	0.679	S	S	*	*			trans	94.1	104.1	178.8	82.6	0	0	0	0	116	P967	P967-S969 PolarHBondContact O-N 2.89Å
970	I	31.5	Very low	38.2	Very low	145 Å²	145	121.3 Å²	121.3	74%	0.744	69%	0.692	S	S	*	*			trans	-128.7	141	160.3	-68.6	173.8	0	0	0	106.5	P967	P967-I970 HydrophobicContact CG-CD1 4.38Å
971	S	31.3	Very low	37	Very low	99 Å²	99	123.2 Å²	123.2	69%	0.692	70%	0.703	S	S	*	*			trans	-51.5	154.6	-164.3	57.4	0	0	0	0	117.6	D973	S971-D973 VanDerWaalsContact C-N 3.29Å; S971-D973 PolarHBondContact O-N 3.25Å
972	S	36.1	Very low	35.6	Very low	102 Å²	102	126.2 Å²	126.2	71%	0.713	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.1	6.1	-162.8	60.5	0	0	0	0	120
973	D	33.6	Very low	34.6	Very low	145 Å²	145	128.3 Å²	128.3	78%	0.775	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.7	9.8	-168.8	-66.9	-0.1	0	0	0	114.2	S971	S971-D973 VanDerWaalsContact C-N 3.29Å; S971-D973 PolarHBondContact O-N 3.25Å
974	C	33.8	Very low	33.9	Very low	95 Å²	95	129.2 Å²	129.2	64%	0.642	74%	0.736	S	S	*	*			trans	-103.9	75.5	171.5	-74.8	0	0	0	0	111.1	P976 L977	C974-P976 VanDerWaalsContact C-N 3.32Å; C974-P976 WeakPolarHBondContact O-CD 3.39Å; C974-P976 VanDerWaalsContact O-N 3.15Å; C974-L977 PolarHBondContact O-N 2.96Å
975	L	34.4	Very low	33.2	Very low	137 Å²	137	131.4 Å²	131.4	72%	0.717	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.9	-17.2	-174.9	-156	71.7	0	0	0	117.3	L977	L975-L977 VanDerWaalsContact C-N 3.32Å; L975-L977 PolarHBondContact O-N 3.44Å
976	P	34	Very low	32.7	Very low	114 Å²	114	137.7 Å²	137.7	74%	0.74	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.1	-12.8	175.5	-21.6	34.9	0	0	0	115.5	C974	C974-P976 VanDerWaalsContact C-N 3.32Å; C974-P976 WeakPolarHBondContact O-CD 3.39Å; C974-P976 VanDerWaalsContact O-N 3.15Å
977	L	34.4	Very low	32.8	Very low	135 Å²	135	139 Å²	139	71%	0.707	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.8	-18.7	-179.6	-97.8	150	0	0	0	114.2	C974 L975 L979 M980	C974-L977 PolarHBondContact O-N 2.96Å; L975-L977 VanDerWaalsContact C-N 3.32Å; L975-L977 PolarHBondContact O-N 3.44Å; L977-L979 VanDerWaalsContact C-N 3.28Å; L977-L979 PolarHBondContact O-N 3.47Å; L977-M980 PolarHBondContact O-N 3.04Å
978	C	31.8	Very low	32.6	Very low	93 Å²	93	140.7 Å²	140.7	63%	0.628	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-71.5	-21	175.6	-91.6	0	0	0	0	113.5	M980	C978-M980 PolarHBondContact O-N 2.97Å
979	L	34.1	Very low	32.4	Very low	162 Å²	162	141.9 Å²	141.9	85%	0.848	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-73.1	-6.1	178.6	-76.3	170.9	0	0	0	114.1	L977	L977-L979 VanDerWaalsContact C-N 3.28Å; L977-L979 PolarHBondContact O-N 3.47Å
980	M	34.3	Very low	32.5	Very low	163 Å²	163	144.9 Å²	144.9	80%	0.803	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-103.7	-9.8	178.8	-77.7	-155.1	71.8	0	0	115.6	L977 C978	L977-M980 PolarHBondContact O-N 3.04Å; C978-M980 PolarHBondContact O-N 2.97Å
981	M	32.3	Very low	32.7	Very low	156 Å²	156	144 Å²	144	77%	0.768	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132.8	8.2	-162.3	-79.2	-81.5	-82	0	0	118.1
982	N	31.2	Very low	32.8	Very low	149 Å²	149	145.5 Å²	145.5	80%	0.797	77%	0.771	S	S	*	*			trans	-129	76.1	172.2	-88.2	-9.6	0	0	0	112.4
983	N	28.7	Very low	32.9	Very low	160 Å²	160	144.9 Å²	144.9	86%	0.856	77%	0.767	S	S	*	*			trans	-95	88.7	151	-83.4	-9.1	0	0	0	107.1
984	N	30.7	Very low	33.1	Very low	151 Å²	151	142.6 Å²	142.6	81%	0.807	76%	0.759	S	S	*	*	S	Bend	trans	-165.5	121.1	144.2	-87.7	-23.7	0	0	0	107.2
985	E	31.8	Very low	33	Very low	164 Å²	164	143.7 Å²	143.7	77%	0.766	76%	0.757	S	S	*	*	S	Bend	trans	78	89.9	169.8	-53.1	-175.4	-178.1	0	0	116.4
986	W	28.5	Very low	33.2	Very low	236 Å²	236	142.4 Å²	142.4	89%	0.894	75%	0.75	S	S	*	*				-179.5	130.6	99	-81.5	-20.8	0	0	0	111.8	T988	W986-T988 PolarHBondContact O-N 2.89Å
987	N	31	Very low	33.4	Very low	163 Å²	163	142.4 Å²	142.4	87%	0.872	75%	0.748	S	S	*	*			trans	-51.2	117.5	166.2	-77.7	-34.7	0	0	0	110.9
988	T	32.8	Very low	33.3	Very low	133 Å²	133	142.9 Å²	142.9	82%	0.816	75%	0.751	S	S	*	*			trans	-158	115.9	137.5	40.3	0	0	0	0	108.5	W986 E990	W986-T988 PolarHBondContact O-N 2.89Å; T988-E990 PolarHBondContact O-N 2.92Å; T988-E990 VanDerWaalsContact O-N 3.16Å
989	N	32.4	Very low	33.3	Very low	161 Å²	161	147 Å²	147	86%	0.861	76%	0.758	S	S	*	*			trans	-61.5	107.9	168.3	-69.1	-34.1	0	0	0	109
990	E	33.6	Very low	33.1	Very low	179 Å²	179	146.6 Å²	146.6	84%	0.836	75%	0.751	S	S	*	*			trans	173.1	144.9	142.3	-93.7	166.2	-167.9	0	0	107.2	T988	T988-E990 PolarHBondContact O-N 2.92Å; T988-E990 VanDerWaalsContact O-N 3.16Å
991	D	35.6	Very low	33	Very low	128 Å²	128	143.2 Å²	143.2	68%	0.684	74%	0.744	S	S	*	*			trans	91.4	25.9	178.7	-53.9	-21.3	0	0	0	119.9	S993 T994	D991-S993 PolarHBondContact O-N 3.43Å; D991-T994 PolarHBondContact O-OG1 3.34Å
992	I	33	Very low	32.9	Very low	129 Å²	129	141 Å²	141	66%	0.662	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.5	-9.4	163.2	-68	172.8	0	0	0	112.5	T994	I992-T994 VanDerWaalsContact C-N 3.35Å; I992-T994 PolarHBondContact O-N 3.04Å
993	S	38.5	Very low	32.8	Very low	89 Å²	89	145 Å²	145	62%	0.622	75%	0.749	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-21.1	-175.3	61.3	0	0	0	0	114.5	D991	D991-S993 PolarHBondContact O-N 3.43Å
994	T	37.6	Very low	33	Very low	98 Å²	98	143.3 Å²	143.3	60%	0.601	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85	-28.2	179.7	41.1	0	0	0	0	113.5	D991 I992	D991-T994 PolarHBondContact O-OG1 3.34Å; I992-T994 VanDerWaalsContact C-N 3.35Å; I992-T994 PolarHBondContact O-N 3.04Å
995	I	33	Very low	33.1	Very low	117 Å²	117	147 Å²	147	60%	0.6	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-74.3	-29.7	-178.8	-66.6	175.6	0	0	0	111.9	V997 L998	I995-V997 VanDerWaalsContact C-N 3.27Å; I995-V997 PolarHBondContact O-N 2.92Å; I995-L998 PolarHBondContact O-N 3.25Å
996	N	37.2	Very low	33.5	Very low	110 Å²	110	145.5 Å²	145.5	59%	0.588	74%	0.744	S	S	*	*	G	3₁₀ helix	trans	-74.5	-11.8	-178.2	-79.1	-19.1	0	0	0	114.7
997	V	40.1	Very low	34.6	Very low	115 Å²	115	137.1 Å²	137.1	70%	0.697	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-81.1	-21.8	178.7	-178.8	0	0	0	0	112.3	I995	I995-V997 VanDerWaalsContact C-N 3.27Å; I995-V997 PolarHBondContact O-N 2.92Å
998	L	30.6	Very low	35.6	Very low	144 Å²	144	135.3 Å²	135.3	75%	0.754	71%	0.711	S	S	*	*	S	Bend	trans	-96.8	-4.4	-172.6	-75.1	169.4	0	0	0	116	I995	I995-L998 PolarHBondContact O-N 3.25Å
999	K	32.9	Very low	36.9	Very low	179 Å²	179	136.1 Å²	136.1	78%	0.778	71%	0.705	S	S	*	*	S	Bend	trans	-88.1	-3.4	178	-86.7	-175.2	175.4	179.6	0	115.4
1000	H	30.4	Very low	37.9	Very low	154 Å²	154	132.8 Å²	132.8	71%	0.713	69%	0.686	S	S	*	*	S	Bend	trans	-113.5	14.3	-171.7	-79.3	-56.7	0	0	0	117.3
1001	S	31	Very low	39.1	Very low	93 Å²	93	127.9 Å²	127.9	65%	0.65	67%	0.665	S	S	*	*			trans	-108.9	102.1	169.3	63.4	0	0	0	0	111.4	Y1003	S1001-Y1003 PolarHBondContact O-N 3.17Å
1002	S	30.2	Very low	40.5	Very low	109 Å²	109	127.6 Å²	127.6	76%	0.762	66%	0.657	S	S	*	*			trans	-52.9	102.6	163.5	46	0	0	0	0	110.7	T1004	S1002-T1004 PolarHBondContact O-N 3.11Å; S1002-T1004 VanDerWaalsContact O-N 3.13Å
1003	Y	29.4	Very low	42.1	Very low	232 Å²	232	125.7 Å²	125.7	91%	0.91	65%	0.648	S	S	*	*			trans	4.3	85.6	158.3	-68.3	-89.6	0	0	0	117.1	S1001	S1001-Y1003 PolarHBondContact O-N 3.17Å
1004	T	33.3	Very low	43.4	Very low	126 Å²	126	124.5 Å²	124.5	77%	0.773	64%	0.635	S	S	*	*			trans	-100.2	115.5	146.6	43.7	0	0	0	0	107.3	S1002 I1006	S1002-T1004 PolarHBondContact O-N 3.11Å; S1002-T1004 VanDerWaalsContact O-N 3.13Å; T1004-I1006 PolarHBondContact O-N 2.69Å
1005	R	31.6	Very low	44.9	Very low	227 Å²	227	122.8 Å²	122.8	86%	0.857	62%	0.622	S	S	*	*	S	Bend	trans	-71.4	38.6	-169.2	-157.4	-175.9	-177.7	176.5	0.3	113.9
1006	I	40.1	Very low	46.8	Very low	134 Å²	134	123.6 Å²	123.6	69%	0.687	62%	0.623	S	S	*	*			trans	-138.4	60.7	-176.7	-43.5	175.6	0	0	0	108.3	T1004 L1011	T1004-I1006 PolarHBondContact O-N 2.69Å; I1006-L1011 HydrophobicContact CG2-CD1 4.1Å
1007	S	51.4	Low	48.3	Very low	60 Å²	60	123 Å²	123	42%	0.42	62%	0.619	S	S	.	*			trans	-74.3	132.3	159.2	72.2	0	0	0	0	107.2	E1009 M1010 L1011	S1007-E1009 PolarHBondContact O-N 3.11Å; S1007-M1010 PolarHBondContact O-N 2.71Å; S1007-M1010 PolarHBondContact OG-N 2.75Å; S1007-L1011 PolarHBondContact O-N 2.98Å
1008	L	52.4	Low	50	Low	125 Å²	125	117.6 Å²	117.6	65%	0.654	59%	0.587	S	S	*	*	H	α-helix	trans	-54.6	-26.2	176.2	-174.1	68.7	0	0	0	111.8	K1012	L1008-K1012 WeakPolarHBondContact O-CG 3.48Å; L1008-K1012 PolarHBondContact O-N 3.3Å; L1008-K1012 VanDerWaalsContact O-N 3.11Å
1009	E	59.7	Low	52.4	Low	150 Å²	150	114.6 Å²	114.6	70%	0.701	57%	0.565	S	S	*	*	H	α-helix	trans	-68.1	-36.3	174.8	-67.5	-177.2	155.8	0	0	113.1	S1007 K1012 L1013	S1007-E1009 PolarHBondContact O-N 3.11Å; E1009-K1012 WeakPolarHBondContact O-CB 3.4Å; E1009-K1012 PolarHBondContact O-N 3.33Å; E1009-L1013 PolarHBondContact O-N 2.79Å
1010	M	54	Low	54.6	Low	91 Å²	91	108.3 Å²	108.3	45%	0.448	54%	0.544	S	S	.	.	H	α-helix	trans	-72.2	-35.2	178	-161.1	147.2	-176	0	0	111.5	S1007 K1012 L1013 D1014	S1007-M1010 PolarHBondContact O-N 2.71Å; S1007-M1010 PolarHBondContact OG-N 2.75Å; M1010-K1012 VanDerWaalsContact C-N 3.32Å; M1010-K1012 PolarHBondContact O-N 3.04Å; M1010-L1013 WeakPolarHBondContact O-CB 3.04Å; M1010-L1013 PolarHBondContact O-N 3.14Å; M1010-L1013 VanDerWaalsContact O-N 3.16Å; M1010-D1014 PolarHBondContact O-N 3.33Å
1011	L	59.6	Low	57	Low	75 Å²	75	103.3 Å²	103.3	39%	0.393	53%	0.525	S	S	.	.	H	α-helix	trans	-62.7	-39	169.1	-73.9	171.5	0	0	0	111.8	I1006 S1007 L1013 D1014 D1015	I1006-L1011 HydrophobicContact CG2-CD1 4.1Å; S1007-L1011 PolarHBondContact O-N 2.98Å; L1011-L1013 VanDerWaalsContact C-N 3.32Å; L1011-L1013 PolarHBondContact O-N 3.15Å; L1011-D1014 PolarHBondContact O-N 3.37Å; L1011-D1015 VanDerWaalsContact O-CB 3.31Å; L1011-D1015 WeakPolarHBondContact O-CB 3.28Å; L1011-D1015 PolarHBondContact O-N 3.25Å
1012	K	65.5	Low	59.3	Low	122 Å²	122	99.8 Å²	99.8	53%	0.53	50%	0.498	S	S	.	.	H	α-helix	trans	-63.2	-38.5	172.3	-72.6	175.2	-177.2	178	0	111.8	L1008 E1009 M1010 Q1016	L1008-K1012 WeakPolarHBondContact O-CG 3.48Å; L1008-K1012 PolarHBondContact O-N 3.3Å; L1008-K1012 VanDerWaalsContact O-N 3.11Å; E1009-K1012 WeakPolarHBondContact O-CB 3.4Å; E1009-K1012 PolarHBondContact O-N 3.33Å; M1010-K1012 VanDerWaalsContact C-N 3.32Å; M1010-K1012 PolarHBondContact O-N 3.04Å; K1012-Q1016 VanDerWaalsContact O-CB 3.28Å; K1012-Q1016 WeakPolarHBondContact O-CB 3.15Å; K1012-Q1016 WeakPolarHBondContact O-CG 3.44Å; K1012-Q1016 PolarHBondContact O-N 3.42Å
1013	L	66.4	Low	61.2	Low	89 Å²	89	103.8 Å²	103.8	47%	0.466	50%	0.502	S	S	.	.	H	α-helix	trans	-68.9	-44.9	177.9	-161.1	90.8	0	0	0	111.4	E1009 M1010 L1011 Q1016 L1017	E1009-L1013 PolarHBondContact O-N 2.79Å; M1010-L1013 WeakPolarHBondContact O-CB 3.04Å; M1010-L1013 PolarHBondContact O-N 3.14Å; M1010-L1013 VanDerWaalsContact O-N 3.16Å; L1011-L1013 VanDerWaalsContact C-N 3.32Å; L1011-L1013 PolarHBondContact O-N 3.15Å; L1013-Q1016 CarbonylContact O-C 3.59Å; L1013-Q1016 WeakPolarHBondContact O-CB 3.41Å; L1013-Q1016 PolarHBondContact O-N 3.42Å; L1013-L1017 HydrophobicContact CD2-CD1 4.26Å; L1013-L1017 HydrophobicContact CG-CD1 4.39Å; L1013-L1017 WeakPolarHBondContact O-CB 3.44Å; L1013-L1017 WeakPolarHBondContact O-CG 3.41Å; L1013-L1017 PolarHBondContact O-N 3.37Å
1014	D	64	Low	62.7	Low	64 Å²	64	94.3 Å²	94.3	34%	0.342	47%	0.469	S	S	.	.	H	α-helix	trans	-63.6	-42.7	176.4	-76.9	-17.7	0	0	0	110.6	M1010 L1011 L1017 T1018	M1010-D1014 PolarHBondContact O-N 3.33Å; L1011-D1014 PolarHBondContact O-N 3.37Å; D1014-L1017 PolarHBondContact O-N 2.77Å; D1014-T1018 WeakPolarHBondContact O-CB 3.45Å; D1014-T1018 PolarHBondContact O-N 3.35Å; D1014-T1018 PolarHBondContact O-OG1 3.33Å
1015	D	70	Confident	64.3	Low	63 Å²	63	89.6 Å²	89.6	34%	0.337	44%	0.441	S	S	.	.	H	α-helix	trans	-62.5	-42.3	172.4	-81.7	-15.5	0	0	0	111	L1011 T1018 W1019 Q1169	L1011-D1015 VanDerWaalsContact O-CB 3.31Å; L1011-D1015 WeakPolarHBondContact O-CB 3.28Å; L1011-D1015 PolarHBondContact O-N 3.25Å; D1015-T1018 PolarHBondContact O-N 3.04Å; D1015-W1019 VanDerWaalsContact O-CD1 3.24Å; D1015-W1019 PolarHBondContact O-N 3.14Å; D1015-Q1169 PolarHBondContact OD1-NE2 3.21Å
1016	Q	72	Confident	66.4	Low	133 Å²	133	83.6 Å²	83.6	62%	0.621	43%	0.434	S	S	*	.	H	α-helix	trans	-61.2	-45.5	175.1	-81.4	176.9	0.5	0	0	112	K1012 L1013 W1019 S1020	K1012-Q1016 VanDerWaalsContact O-CB 3.28Å; K1012-Q1016 WeakPolarHBondContact O-CB 3.15Å; K1012-Q1016 WeakPolarHBondContact O-CG 3.44Å; K1012-Q1016 PolarHBondContact O-N 3.42Å; L1013-Q1016 CarbonylContact O-C 3.59Å; L1013-Q1016 WeakPolarHBondContact O-CB 3.41Å; L1013-Q1016 PolarHBondContact O-N 3.42Å; Q1016-W1019 PolarHBondContact O-N 3.24Å; Q1016-S1020 WeakPolarHBondContact O-CA 3.44Å; Q1016-S1020 WeakPolarHBondContact O-CB 3.44Å; Q1016-S1020 PolarHBondContact O-N 3.48Å
1017	L	70.5	Confident	68.1	Low	97 Å²	97	78.1 Å²	78.1	51%	0.508	41%	0.406	S	S	.	.	H	α-helix	trans	-66.1	-42	177.5	-72.4	170.2	0	0	0	111.1	L1013 D1014 W1019 S1020 K1064	L1013-L1017 HydrophobicContact CD2-CD1 4.26Å; L1013-L1017 HydrophobicContact CG-CD1 4.39Å; L1013-L1017 WeakPolarHBondContact O-CB 3.44Å; L1013-L1017 WeakPolarHBondContact O-CG 3.41Å; L1013-L1017 PolarHBondContact O-N 3.37Å; D1014-L1017 PolarHBondContact O-N 2.77Å; L1017-W1019 VanDerWaalsContact C-N 3.29Å; L1017-W1019 PolarHBondContact O-N 3.48Å; L1017-S1020 PolarHBondContact O-N 3.32Å; L1017-S1020 PolarHBondContact O-OG 2.96Å; L1017-K1064 PolarHBondContact O-NZ 3.21Å
1018	T	75.5	Confident	69.4	Low	2 Å²	2	75.4 Å²	75.4	1%	0.012	39%	0.387	C	S	.	.	H	α-helix	trans	-66.9	-29.3	-178.9	-57.8	0	0	0	0	112.6	D1014 D1015 W1060 K1064 P1170	D1014-T1018 WeakPolarHBondContact O-CB 3.45Å; D1014-T1018 PolarHBondContact O-N 3.35Å; D1014-T1018 PolarHBondContact O-OG1 3.33Å; D1015-T1018 PolarHBondContact O-N 3.04Å; T1018-W1060 PolarHBondContact O-NE1 3.26Å; T1018-K1064 WeakPolarHBondContact O-CE 3.28Å; T1018-K1064 PolarHBondContact O-NZ 3.07Å; T1018-K1064 VanDerWaalsContact O-NZ 3.1Å; T1018-P1170 HydrophobicContact CG2-CB 3.62Å; T1018-P1170 HydrophobicContact CG2-CG 3.72Å; T1018-P1170 WeakPolarHBondContact CG2-O 3.42Å
1019	W	80	Confident	70.6	Confident	82 Å²	82	75.8 Å²	75.8	31%	0.311	38%	0.38	S	S	.	.	H	α-helix	trans	-102.2	-9.1	174.6	-69.9	99	0	0	0	114.2	D1015 Q1016 L1017 W1060 N1063 F1168 P1170	D1015-W1019 VanDerWaalsContact O-CD1 3.24Å; D1015-W1019 PolarHBondContact O-N 3.14Å; Q1016-W1019 PolarHBondContact O-N 3.24Å; L1017-W1019 VanDerWaalsContact C-N 3.29Å; L1017-W1019 PolarHBondContact O-N 3.48Å; W1019-W1060 AromaticContact CE3-CD1 3.8Å; W1019-W1060 HydrophobicContact CH2-CB 4.05Å; W1019-W1060 AromaticContact CH2-CD1 4Å; W1019-W1060 HydrophobicContact CH2-CG 4.45Å; W1019-W1060 HydrophobicContact CZ3-CB 3.95Å; W1019-W1060 AromaticContact CZ3-CD1 3.73Å; W1019-W1060 HydrophobicContact CZ3-CG 4.25Å; W1019-N1063 HydrophobicContact CE3-CB 4.24Å; W1019-N1063 HydrophobicContact CZ3-CB 4.38Å; W1019-F1168 HydrophobicContact CH2-CD1 4.18Å; W1019-F1168 AromaticContact CH2-CE1 3.96Å; W1019-F1168 HydrophobicContact CH2-CE1 3.96Å; W1019-F1168 HydrophobicContact CZ2-CD1 4.09Å; W1019-F1168 HydrophobicContact CZ2-CE1 4.12Å; W1019-P1170 HydrophobicContact CH2-CG 4.21Å; W1019-P1170 HydrophobicContact CZ2-CG 3.55Å
1020	S	79.8	Confident	71.3	Confident	46 Å²	46	75.9 Å²	75.9	32%	0.322	38%	0.378	S	S	.	.	S	Bend	trans	-58.6	132.4	-179.9	63.4	0	0	0	0	110.6	Q1016 L1017 K1064	Q1016-S1020 WeakPolarHBondContact O-CA 3.44Å; Q1016-S1020 WeakPolarHBondContact O-CB 3.44Å; Q1016-S1020 PolarHBondContact O-N 3.48Å; L1017-S1020 PolarHBondContact O-N 3.32Å; L1017-S1020 PolarHBondContact O-OG 2.96Å; S1020-K1064 VanDerWaalsContact O-CD 3.31Å; S1020-K1064 WeakPolarHBondContact O-CD 3.48Å; S1020-K1064 VanDerWaalsContact O-CE 3.22Å; S1020-K1064 WeakPolarHBondContact O-CE 3.42Å; S1020-K1064 PolarHBondContact O-NZ 3.35Å
1021	P	79.5	Confident	72.6	Confident	50 Å²	50	74.1 Å²	74.1	33%	0.325	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-66	141	179.6	27.6	-33.3	0	0	0	110.2	K1064 H1067	P1021-K1064 WeakPolarHBondContact CA-O 3.36Å; P1021-H1067 WeakPolarHBondContact CB-CD2 3.26Å; P1021-H1067 WeakPolarHBondContact CG-CD2 3.42Å; P1021-H1067 VanDerWaalsContact CG-NE2 3.26Å; P1021-H1067 WeakPolarHBondContact CG-NE2 3.27Å
1022	M	79.7	Confident	73.7	Confident	18 Å²	18	71.7 Å²	71.7	9%	0.089	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-75.9	142.8	-179.4	-68.4	169.3	66.4	0	0	109.8	P1024 K1064 S1175 L1178 Q1179 L1182	M1022-P1024 VanDerWaalsContact O-CD 3.25Å; M1022-P1024 WeakPolarHBondContact O-CD 3.48Å; M1022-K1064 HydrophobicContact CG-CB 4.49Å; M1022-K1064 HydrophobicContact CG-CD 3.74Å; M1022-K1064 PolarHBondContact N-O 3.47Å; M1022-K1064 HydrophobicContact SD-CB 4.15Å; M1022-K1064 HydrophobicContact SD-CD 3.83Å; M1022-K1064 HydrophobicContact SD-CG 4.43Å; M1022-S1175 WeakPolarHBondContact CE-O 3.41Å; M1022-L1178 HydrophobicContact SD-CB 4.47Å; M1022-L1178 HydrophobicContact SD-CD2 3.85Å; M1022-L1178 HydrophobicContact SD-CG 4.31Å; M1022-Q1179 HydrophobicContact CE-CB 3.63Å; M1022-Q1179 HydrophobicContact CE-CG 4.31Å; M1022-L1182 HydrophobicContact CE-CD1 4.14Å
1023	K	71.6	Confident	74.6	Confident	194 Å²	194	66 Å²	66	84%	0.843	33%	0.331	S	S	*	.			trans	-82.5	111.4	174.1	-72.1	-176.3	179.7	179.9	0	108.4
1024	P	61	Low	75.4	Confident	33 Å²	33	61.7 Å²	61.7	21%	0.214	31%	0.309	C	S	.	.			trans	-78.8	158.7	-176.9	32.8	-36.7	0	0	0	112.7	M1022 Y1029 L1068	M1022-P1024 VanDerWaalsContact O-CD 3.25Å; M1022-P1024 WeakPolarHBondContact O-CD 3.48Å; P1024-Y1029 HydrophobicContact CG-CE2 3.66Å; P1024-Y1029 WeakPolarHBondContact CG-OH 3.37Å; P1024-L1068 HydrophobicContact CB-CD1 3.72Å; P1024-L1068 HydrophobicContact CB-CD2 3.49Å; P1024-L1068 VanDerWaalsContact CB-CD2 3.49Å; P1024-L1068 HydrophobicContact CB-CG 3.37Å; P1024-L1068 HydrophobicContact CG-CD1 4.02Å; P1024-L1068 HydrophobicContact CG-CD2 4.37Å; P1024-L1068 HydrophobicContact CG-CG 3.72Å
1025	S	66.4	Low	76.5	Confident	26 Å²	26	58.7 Å²	58.7	18%	0.182	29%	0.293	C	S	.	.			trans	-65.3	145.7	162.6	43.5	0	0	0	0	110.5	I1027 F1028 E1186	S1025-I1027 PolarHBondContact O-N 3.48Å; S1025-F1028 PolarHBondContact O-N 3.32Å; S1025-F1028 VanDerWaalsContact OG-CD2 3.31Å; S1025-F1028 WeakPolarHBondContact OG-CD2 3.31Å; S1025-F1028 WeakPolarHBondContact OG-CE2 3.42Å; S1025-E1186 WeakPolarHBondContact CB-OE1 3.36Å; S1025-E1186 WeakPolarHBondContact CB-OE2 3.46Å; S1025-E1186 PolarHBondContact OG-OE1 3.45Å; S1025-E1186 PolarHBondContact OG-OE2 3.3Å
1026	S	74.5	Confident	77	Confident	101 Å²	101	56.1 Å²	56.1	71%	0.706	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-18.5	-174.8	46.8	0	0	0	0	113.6	Y1029	S1026-Y1029 PolarHBondContact O-N 3.15Å
1027	I	76.1	Confident	77	Confident	19 Å²	19	54.7 Å²	54.7	10%	0.097	27%	0.27	C	S	.	.	H	α-helix	trans	-65.3	-39.6	-176.9	-158.8	169	0	0	0	112.9	S1025 Y1029 K1030 Y1031 E1186 F1189 M1190	S1025-I1027 PolarHBondContact O-N 3.48Å; I1027-Y1029 PolarHBondContact O-N 2.88Å; I1027-K1030 PolarHBondContact O-N 3.48Å; I1027-Y1031 HydrophobicContact CG1-CD2 4.37Å; I1027-Y1031 PolarHBondContact O-N 2.99Å; I1027-E1186 HydrophobicContact CG2-CB 4.44Å; I1027-E1186 HydrophobicContact CG2-CG 4.01Å; I1027-F1189 HydrophobicContact CD1-CD1 3.87Å; I1027-F1189 HydrophobicContact CD1-CE1 4.39Å; I1027-F1189 HydrophobicContact CG1-CD1 4.44Å; I1027-M1190 HydrophobicContact CD1-CG 3.42Å; I1027-M1190 VanDerWaalsContact CD1-CG 3.42Å; I1027-M1190 HydrophobicContact CD1-SD 3.23Å; I1027-M1190 WeakPolarHBondContact CD1-SD 3.22Å; I1027-M1190 HydrophobicContact CG1-SD 4.44Å
1028	F	78.8	Confident	77	Confident	4 Å²	4	53 Å²	53	2%	0.018	27%	0.266	C	S	.	.	H	α-helix	trans	-71.7	-18.1	-175.9	-62	-56.6	0	0	0	112.3	S1025 K1030 Y1031 L1033 L1068 P1069 S1087 I1185 E1186	S1025-F1028 PolarHBondContact O-N 3.32Å; S1025-F1028 VanDerWaalsContact OG-CD2 3.31Å; S1025-F1028 WeakPolarHBondContact OG-CD2 3.31Å; S1025-F1028 WeakPolarHBondContact OG-CE2 3.42Å; F1028-K1030 VanDerWaalsContact C-N 3.26Å; F1028-K1030 PolarHBondContact O-N 3.41Å; F1028-Y1031 WeakPolarHBondContact CA-O 3.35Å; F1028-Y1031 CarbonylContact O-C 3.37Å; F1028-L1033 HydrophobicContact CB-CD1 4.41Å; F1028-L1033 HydrophobicContact CD1-CD1 3.58Å; F1028-L1033 HydrophobicContact CD1-CD2 4.32Å; F1028-L1033 HydrophobicContact CD1-CG 3.72Å; F1028-L1033 HydrophobicContact CD2-CD1 4.17Å; F1028-L1033 HydrophobicContact CE1-CD1 3.79Å; F1028-L1033 HydrophobicContact CE1-CD2 4.03Å; F1028-L1033 HydrophobicContact CE1-CG 3.93Å; F1028-L1033 HydrophobicContact CE2-CD1 4.33Å; F1028-L1033 HydrophobicContact CG-CD1 3.79Å; F1028-L1033 HydrophobicContact CG-CG 4.36Å; F1028-L1033 HydrophobicContact CZ-CD1 4.16Å; F1028-L1068 HydrophobicContact CB-CD2 3.75Å; F1028-L1068 HydrophobicContact CD2-CD2 3.74Å; F1028-L1068 HydrophobicContact CG-CD2 3.93Å; F1028-P1069 WeakPolarHBondContact O-CD 3.46Å; F1028-P1069 WeakPolarHBondContact O-CG 3.41Å; F1028-S1087 WeakPolarHBondContact CD1-OG 3.31Å; F1028-S1087 WeakPolarHBondContact CE1-OG 3.49Å; F1028-I1185 HydrophobicContact CE1-CG2 4.05Å; F1028-I1185 HydrophobicContact CZ-CB 4.45Å; F1028-I1185 HydrophobicContact CZ-CG2 4.36Å; F1028-E1186 HydrophobicContact CE2-CB 4.46Å; F1028-E1186 HydrophobicContact CZ-CB 4.02Å
1029	Y	78.1	Confident	76.7	Confident	133 Å²	133	54.6 Å²	54.6	52%	0.522	27%	0.274	S	S	.	.	H	α-helix	trans	-67.2	-29.9	169.9	-71.5	-71.2	0	0	0	112.8	P1024 S1026 I1027 H1067 P1069	P1024-Y1029 HydrophobicContact CG-CE2 3.66Å; P1024-Y1029 WeakPolarHBondContact CG-OH 3.37Å; S1026-Y1029 PolarHBondContact O-N 3.15Å; I1027-Y1029 PolarHBondContact O-N 2.88Å; Y1029-H1067 VanDerWaalsContact CE1-O 3.3Å; Y1029-H1067 WeakPolarHBondContact CE1-O 3.35Å; Y1029-H1067 PolarHBondContact OH-O 3Å; Y1029-P1069 HydrophobicContact CD1-CG 4.49Å
1030	K	74.1	Confident	76	Confident	152 Å²	152	51 Å²	51	66%	0.661	26%	0.261	S	S	*	.	H	α-helix	trans	-90	-33.3	179.9	-166.1	176.2	177.1	-167.3	0	112.1	I1027 F1028	I1027-K1030 PolarHBondContact O-N 3.48Å; F1028-K1030 VanDerWaalsContact C-N 3.26Å; F1028-K1030 PolarHBondContact O-N 3.41Å
1031	Y	81.4	Confident	75.3	Confident	53 Å²	53	51.2 Å²	51.2	21%	0.208	26%	0.258	C	S	.	.	S	Bend	trans	-129	95.9	180	-56.9	-76	0	0	0	109.3	I1027 F1028 S1087 F1189 M1193	I1027-Y1031 HydrophobicContact CG1-CD2 4.37Å; I1027-Y1031 PolarHBondContact O-N 2.99Å; F1028-Y1031 WeakPolarHBondContact CA-O 3.35Å; F1028-Y1031 CarbonylContact O-C 3.37Å; Y1031-S1087 PolarHBondContact O-OG 3.29Å; Y1031-F1189 HydrophobicContact CD1-CE1 4.38Å; Y1031-F1189 AromaticContact CD1-CZ 3.94Å; Y1031-F1189 HydrophobicContact CD1-CZ 3.94Å; Y1031-F1189 AromaticContact CD2-CE1 3.54Å; Y1031-F1189 HydrophobicContact CD2-CE1 3.54Å; Y1031-F1189 AromaticContact CD2-CZ 3.96Å; Y1031-F1189 HydrophobicContact CD2-CZ 3.96Å; Y1031-F1189 HydrophobicContact CE2-CE1 4.16Å; Y1031-F1189 AromaticContact CG-CE1 3.68Å; Y1031-F1189 HydrophobicContact CG-CE1 3.68Å; Y1031-F1189 AromaticContact CG-CZ 3.61Å; Y1031-F1189 HydrophobicContact CG-CZ 3.61Å; Y1031-M1193 HydrophobicContact CD1-CE 4.04Å; Y1031-M1193 HydrophobicContact CD2-CE 3.99Å; Y1031-M1193 HydrophobicContact CE1-CE 3.44Å; Y1031-M1193 VanDerWaalsContact CE1-CE 3.44Å; Y1031-M1193 HydrophobicContact CE2-CE 3.36Å; Y1031-M1193 HydrophobicContact CE2-SD 3.95Å; Y1031-M1193 HydrophobicContact CG-CE 4.29Å; Y1031-M1193 VanDerWaalsContact OH-CE 3.29Å; Y1031-M1193 WeakPolarHBondContact OH-CE 3.31Å
1032	P	82.8	Confident	74.3	Confident	25 Å²	25	51.8 Å²	51.8	16%	0.162	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-60.5	155.2	-175.1	19.9	-33.4	0	0	0	114.2	P1069 V1071 Q1085 L1086 S1087	P1032-P1069 VanDerWaalsContact CA-O 3.27Å; P1032-P1069 WeakPolarHBondContact CA-O 3.13Å; P1032-P1069 HydrophobicContact CB-CB 4.16Å; P1032-P1069 HydrophobicContact CB-CG 4.2Å; P1032-P1069 WeakPolarHBondContact CB-O 3.3Å; P1032-V1071 HydrophobicContact CB-CG2 4.05Å; P1032-V1071 HydrophobicContact CG-CG2 4.16Å; P1032-Q1085 WeakPolarHBondContact CD-O 3.47Å; P1032-Q1085 VanDerWaalsContact CG-O 3.24Å; P1032-Q1085 WeakPolarHBondContact CG-O 3.37Å; P1032-L1086 HydrophobicContact CB-CD2 4.36Å; P1032-L1086 HydrophobicContact CG-CD2 4.22Å; P1032-L1086 CarbonylContact O-C 3.54Å; P1032-L1086 VanDerWaalsContact O-CA 3.24Å; P1032-L1086 WeakPolarHBondContact O-CA 3.47Å; P1032-L1086 WeakPolarHBondContact O-CD2 3.31Å; P1032-S1087 PolarHBondContact O-N 3.16Å; P1032-S1087 PolarHBondContact O-OG 3.02Å
1033	L	84.6	Confident	73	Confident	1 Å²	1	57.2 Å²	57.2	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.7	138.1	173.3	-79.9	152.3	0	0	0	110.2	F1028 L1068 P1069 I1070 V1071 L1182 I1185	F1028-L1033 HydrophobicContact CB-CD1 4.41Å; F1028-L1033 HydrophobicContact CD1-CD1 3.58Å; F1028-L1033 HydrophobicContact CD1-CD2 4.32Å; F1028-L1033 HydrophobicContact CD1-CG 3.72Å; F1028-L1033 HydrophobicContact CD2-CD1 4.17Å; F1028-L1033 HydrophobicContact CE1-CD1 3.79Å; F1028-L1033 HydrophobicContact CE1-CD2 4.03Å; F1028-L1033 HydrophobicContact CE1-CG 3.93Å; F1028-L1033 HydrophobicContact CE2-CD1 4.33Å; F1028-L1033 HydrophobicContact CG-CD1 3.79Å; F1028-L1033 HydrophobicContact CG-CG 4.36Å; F1028-L1033 HydrophobicContact CZ-CD1 4.16Å; L1033-L1068 HydrophobicContact CD1-CD2 3.78Å; L1033-P1069 PolarHBondContact N-O 3.27Å; L1033-I1070 CarbonylContact O-C 3.49Å; L1033-I1070 VanDerWaalsContact O-CA 3.28Å; L1033-I1070 WeakPolarHBondContact O-CA 3.35Å; L1033-I1070 WeakPolarHBondContact O-CG2 3.27Å; L1033-V1071 PolarHBondContact O-N 3.07Å; L1033-L1182 HydrophobicContact CD1-CD2 3.85Å; L1033-I1185 HydrophobicContact CD2-CD1 3.74Å; L1033-I1185 HydrophobicContact CD2-CG2 4.19Å
1034	G	83.5	Confident	71.8	Confident	0 Å²	0	55 Å²	55	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	121.1	170.5	0	0	0	0	0	110.2	V1071 G1088 I1089 I1090	G1034-V1071 CarbonylContact C-O 3.53Å; G1034-V1071 WeakPolarHBondContact CA-O 3.44Å; G1034-G1088 PolarHBondContact N-O 3.21Å; G1034-I1089 CarbonylContact O-C 3.42Å; G1034-I1089 VanDerWaalsContact O-CA 3.31Å; G1034-I1089 WeakPolarHBondContact O-CA 3.45Å; G1034-I1090 PolarHBondContact O-N 3.25Å
1035	L	85.9	Confident	71	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	114.4	168.8	-179.8	65.7	0	0	0	108.8	K1037 F1058 I1061 Y1062 I1070 V1071 L1072 L1073 I1090 I1092	L1035-K1037 PolarHBondContact O-N 3.41Å; L1035-F1058 HydrophobicContact CD2-CD2 4.18Å; L1035-F1058 HydrophobicContact CD2-CE2 3.63Å; L1035-F1058 HydrophobicContact CD2-CZ 4.09Å; L1035-F1058 HydrophobicContact CG-CD2 4.38Å; L1035-F1058 HydrophobicContact CG-CE2 3.82Å; L1035-I1061 HydrophobicContact CD1-CG2 4.19Å; L1035-Y1062 HydrophobicContact CD2-CD2 4.11Å; L1035-I1070 HydrophobicContact CB-CG2 3.3Å; L1035-I1070 HydrophobicContact CD2-CG2 4.48Å; L1035-V1071 PolarHBondContact N-O 3.47Å; L1035-L1072 HydrophobicContact CB-CD1 4.29Å; L1035-L1072 HydrophobicContact CD2-CD1 4.1Å; L1035-L1072 HydrophobicContact CG-CD1 4.34Å; L1035-L1073 PolarHBondContact O-N 2.95Å; L1035-I1090 HydrophobicContact CD1-CB 3.78Å; L1035-I1090 HydrophobicContact CD1-CG2 3.78Å; L1035-I1092 HydrophobicContact CD1-CD1 4.43Å
1036	Y	81.3	Confident	70.5	Confident	9 Å²	9	65 Å²	65	4%	0.035	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	120.7	-177	-170.5	-99	0	0	0	110.9	S1038 L1073 W1076 I1090 V1091 H1108	Y1036-S1038 WeakPolarHBondContact CD1-O 3.16Å; Y1036-S1038 VanDerWaalsContact CE1-CB 3.44Å; Y1036-S1038 WeakPolarHBondContact CE1-O 3.36Å; Y1036-S1038 WeakPolarHBondContact OH-CB 3.17Å; Y1036-L1073 HydrophobicContact CD2-CB 3.9Å; Y1036-W1076 HydrophobicContact CD2-CE3 4.17Å; Y1036-W1076 HydrophobicContact CE2-CE3 4.15Å; Y1036-I1090 WeakPolarHBondContact CB-O 3.49Å; Y1036-I1090 PolarHBondContact N-O 3.44Å; Y1036-V1091 HydrophobicContact CD1-CG1 4.14Å; Y1036-H1108 AromaticContact CD1-NE2 3.77Å; Y1036-H1108 AromaticContact CE1-CE1 2.96Å; Y1036-H1108 WeakPolarHBondContact CE1-CE1 3.41Å; Y1036-H1108 AromaticContact CE1-ND1 4Å; Y1036-H1108 AromaticContact CE1-NE2 3.03Å; Y1036-H1108 WeakPolarHBondContact CE1-NE2 3.13Å; Y1036-H1108 AromaticContact CZ-CE1 3.08Å; Y1036-H1108 AromaticContact CZ-ND1 3.7Å; Y1036-H1108 AromaticContact CZ-NE2 3.24Å; Y1036-H1108 PolarHBondContact OH-CE1 2.91Å; Y1036-H1108 PolarHBondContact OH-ND1 3.31Å; Y1036-H1108 PolarHBondContact OH-NE2 2.76Å
1037	K	71.9	Confident	69.8	Low	104 Å²	104	63.1 Å²	63.1	45%	0.452	32%	0.319	S	S	.	.			trans	-79.2	-33.7	-169	-168.3	-174	-176.3	178.4	0	113.3	L1035 F1058 L1072 L1073 N1074	L1035-K1037 PolarHBondContact O-N 3.41Å; K1037-F1058 HydrophobicContact CB-CE2 4.31Å; K1037-F1058 HydrophobicContact CB-CZ 4.43Å; K1037-F1058 HydrophobicContact CG-CE2 4.2Å; K1037-F1058 HydrophobicContact CG-CZ 3.94Å; K1037-L1072 HydrophobicContact CB-CD2 4.34Å; K1037-L1072 HydrophobicContact CB-CG 4.33Å; K1037-L1072 HydrophobicContact CD-CD2 3.76Å; K1037-L1072 HydrophobicContact CG-CD2 4.17Å; K1037-L1073 WeakPolarHBondContact CB-O 3.49Å; K1037-L1073 PolarHBondContact N-O 2.88Å; K1037-N1074 WeakPolarHBondContact CD-OD1 3.36Å
1038	S	70.3	Confident	69.4	Low	60 Å²	60	71 Å²	71	42%	0.42	35%	0.353	S	S	.	.	S	Bend	trans	-78.2	127.3	-176.5	-170.6	0	0	0	0	110.2	Y1036 L1040	Y1036-S1038 WeakPolarHBondContact CD1-O 3.16Å; Y1036-S1038 VanDerWaalsContact CE1-CB 3.44Å; Y1036-S1038 WeakPolarHBondContact CE1-O 3.36Å; Y1036-S1038 WeakPolarHBondContact OH-CB 3.17Å; S1038-L1040 PolarHBondContact O-N 3.17Å
1039	I	70.3	Confident	68.8	Low	37 Å²	37	74.3 Å²	74.3	19%	0.19	37%	0.373	C	S	.	.			trans	-79.8	117.5	-179.4	-60.3	160.3	0	0	0	107.8	M1041 F1054 I1092	I1039-M1041 HydrophobicContact CG2-CE 3.56Å; I1039-M1041 HydrophobicContact CG2-CG 3.94Å; I1039-M1041 PolarHBondContact O-N 2.9Å; I1039-F1054 HydrophobicContact CD1-CB 3.71Å; I1039-F1054 HydrophobicContact CG1-CB 4.23Å; I1039-F1054 HydrophobicContact CG2-CB 3.71Å; I1039-F1054 HydrophobicContact CG2-CD1 4.4Å; I1039-F1054 HydrophobicContact CG2-CG 3.98Å; I1039-I1092 WeakPolarHBondContact CA-O 3.46Å
1040	L	63.5	Low	68.3	Low	7 Å²	7	69.2 Å²	69.2	4%	0.037	36%	0.355	C	S	.	.	B	Isolated β-bridge	trans	-77	103.4	-179.8	-79.9	175	0	0	0	110.5	S1038 V1091 I1092 G1093 Y1094 F1095 L1104 M1107 H1108	S1038-L1040 PolarHBondContact O-N 3.17Å; L1040-V1091 HydrophobicContact CD1-CG1 3.56Å; L1040-V1091 HydrophobicContact CG-CG1 4.31Å; L1040-I1092 PolarHBondContact N-O 2.78Å; L1040-G1093 VanDerWaalsContact O-CA 3.31Å; L1040-G1093 WeakPolarHBondContact O-CA 3.47Å; L1040-Y1094 PolarHBondContact O-N 3.17Å; L1040-Y1094 VanDerWaalsContact O-N 3.16Å; L1040-F1095 HydrophobicContact CB-CE1 3.9Å; L1040-F1095 HydrophobicContact CB-CZ 4.13Å; L1040-F1095 HydrophobicContact CD1-CE1 3.93Å; L1040-F1095 HydrophobicContact CD1-CZ 4.17Å; L1040-L1104 HydrophobicContact CD1-CD2 3.82Å; L1040-L1104 HydrophobicContact CD1-CG 4.01Å; L1040-M1107 HydrophobicContact CD2-CB 3.72Å; L1040-H1108 WeakPolarHBondContact CD2-CE1 3.24Å; L1040-H1108 VanDerWaalsContact CD2-NE2 3.31Å; L1040-H1108 WeakPolarHBondContact CD2-NE2 3.38Å; L1040-H1108 WeakPolarHBondContact CG-NE2 3.14Å
1041	M	65.4	Low	68	Low	50 Å²	50	68 Å²	68	25%	0.246	35%	0.352	C	S	.	.			trans	-128.1	140.7	176.2	-68.2	-68.6	138.5	0	0	110.3	I1039 T1043 F1054 G1093	I1039-M1041 HydrophobicContact CG2-CE 3.56Å; I1039-M1041 HydrophobicContact CG2-CG 3.94Å; I1039-M1041 PolarHBondContact O-N 2.9Å; M1041-T1043 PolarHBondContact O-N 3.34Å; M1041-F1054 HydrophobicContact CE-CD1 4.05Å; M1041-F1054 HydrophobicContact CE-CD2 3.44Å; M1041-F1054 VanDerWaalsContact CE-CD2 3.44Å; M1041-F1054 HydrophobicContact CE-CE1 3.85Å; M1041-F1054 HydrophobicContact CE-CE2 3.22Å; M1041-F1054 HydrophobicContact CE-CG 3.85Å; M1041-F1054 HydrophobicContact CE-CZ 3.44Å; M1041-F1054 VanDerWaalsContact CE-CZ 3.44Å; M1041-F1054 HydrophobicContact SD-CD2 4.32Å; M1041-F1054 HydrophobicContact SD-CE2 4.02Å; M1041-G1093 VanDerWaalsContact CE-C 3.45Å
1042	P	58.8	Low	67.6	Low	62 Å²	62	71.4 Å²	71.4	40%	0.403	37%	0.369	S	S	.	.			trans	-57	130.3	168.3	-20.3	31.4	0	0	0	110.2	H1044	P1042-H1044 PolarHBondContact O-N 3Å
1043	T	52.9	Low	67.1	Low	132 Å²	132	71.9 Å²	71.9	81%	0.81	37%	0.369	S	S	*	.	S	Bend	trans	-66.4	-10.2	-171.6	47.6	0	0	0	0	114.5	M1041	M1041-T1043 PolarHBondContact O-N 3.34Å
1044	H	46.5	Very low	66.8	Low	146 Å²	146	72.2 Å²	72.2	68%	0.676	37%	0.371	S	S	*	.	S	Bend	trans	-103	121.5	179.1	-66.3	-74.3	0	0	0	110.3	P1042	P1042-H1044 PolarHBondContact O-N 3Å
1045	T	43.4	Very low	66.5	Low	124 Å²	124	75.5 Å²	75.5	76%	0.761	39%	0.391	S	S	*	.	S	Bend	trans	72.6	64	157.5	49.5	0	0	0	0	119.3
1046	Y	55.5	Low	66.4	Low	147 Å²	147	77.9 Å²	77.9	58%	0.576	40%	0.404	S	S	*	.			trans	-142.2	148.6	161	-69	-71.7	0	0	0	114.4	I1050	Y1046-I1050 HydrophobicContact CD1-CD1 3.54Å; Y1046-I1050 HydrophobicContact CE1-CD1 4.48Å; Y1046-I1050 HydrophobicContact CG-CD1 4.14Å
1047	S	61.4	Low	66.5	Low	61 Å²	61	77.6 Å²	77.6	43%	0.427	40%	0.403	S	S	.	.			trans	-73	152.1	-172.2	82.1	0	0	0	0	112.3	T1049 I1050	S1047-T1049 PolarHBondContact O-N 3.02Å; S1047-T1049 VanDerWaalsContact OG-CB 3.32Å; S1047-T1049 WeakPolarHBondContact OG-CB 3.41Å; S1047-T1049 PolarHBondContact OG-N 3.16Å; S1047-T1049 PolarHBondContact OG-OG1 2.94Å; S1047-I1050 PolarHBondContact O-N 3.33Å
1048	K	66.2	Low	67.1	Low	183 Å²	183	74.1 Å²	74.1	80%	0.796	39%	0.388	S	S	*	.	H	α-helix	trans	-49.1	-27.1	171.8	-72.3	-178	177	179.2	0	113	Q1052	K1048-Q1052 WeakPolarHBondContact O-CB 3.44Å; K1048-Q1052 PolarHBondContact O-N 3.24Å
1049	T	66.6	Low	67.8	Low	74 Å²	74	75.9 Å²	75.9	45%	0.454	39%	0.389	S	S	.	.	H	α-helix	trans	-65.3	-42.9	179	-33.1	0	0	0	0	112.5	S1047 Q1052 Q1053	S1047-T1049 PolarHBondContact O-N 3.02Å; S1047-T1049 VanDerWaalsContact OG-CB 3.32Å; S1047-T1049 WeakPolarHBondContact OG-CB 3.41Å; S1047-T1049 PolarHBondContact OG-N 3.16Å; S1047-T1049 PolarHBondContact OG-OG1 2.94Å; T1049-Q1052 PolarHBondContact O-N 3.41Å; T1049-Q1053 WeakPolarHBondContact O-CG 3.41Å; T1049-Q1053 PolarHBondContact O-N 3.48Å
1050	I	67.4	Low	68.7	Low	26 Å²	26	74.1 Å²	74.1	13%	0.133	38%	0.38	C	S	.	.	H	α-helix	trans	-67.4	-43.7	179.8	-67.6	168.2	0	0	0	109.8	Y1046 S1047 Q1052 Q1053 F1054 L1133	Y1046-I1050 HydrophobicContact CD1-CD1 3.54Å; Y1046-I1050 HydrophobicContact CE1-CD1 4.48Å; Y1046-I1050 HydrophobicContact CG-CD1 4.14Å; S1047-I1050 PolarHBondContact O-N 3.33Å; I1050-Q1052 VanDerWaalsContact C-N 3.27Å; I1050-Q1052 PolarHBondContact O-N 2.92Å; I1050-Q1053 WeakPolarHBondContact O-CB 3.43Å; I1050-Q1053 PolarHBondContact O-N 3.47Å; I1050-Q1053 VanDerWaalsContact O-N 3.11Å; I1050-F1054 HydrophobicContact CG2-CD2 3.75Å; I1050-F1054 HydrophobicContact CG2-CE2 3.66Å; I1050-F1054 WeakPolarHBondContact O-CD2 3.35Å; I1050-F1054 PolarHBondContact O-N 3.05Å; I1050-L1133 HydrophobicContact CD1-CD1 4Å; I1050-L1133 HydrophobicContact CG1-CD1 4.41Å
1051	Q	69.3	Low	69.8	Low	128 Å²	128	73.8 Å²	73.8	60%	0.598	38%	0.378	S	S	*	.	H	α-helix	trans	-59.3	-40.3	176	-166.6	175.5	10.4	0	0	111.7	T1055	Q1051-T1055 WeakPolarHBondContact O-CB 3.39Å; Q1051-T1055 PolarHBondContact O-N 3.31Å; Q1051-T1055 PolarHBondContact O-OG1 3.44Å
1052	Q	72.7	Confident	70.7	Confident	123 Å²	123	76.5 Å²	76.5	58%	0.575	39%	0.387	S	S	*	.	H	α-helix	trans	-66	-38	175.5	-167.8	173.8	6.9	0	0	112.5	K1048 T1049 I1050 T1055 N1056	K1048-Q1052 WeakPolarHBondContact O-CB 3.44Å; K1048-Q1052 PolarHBondContact O-N 3.24Å; T1049-Q1052 PolarHBondContact O-N 3.41Å; I1050-Q1052 VanDerWaalsContact C-N 3.27Å; I1050-Q1052 PolarHBondContact O-N 2.92Å; Q1052-T1055 WeakPolarHBondContact O-CB 3.35Å; Q1052-T1055 PolarHBondContact O-N 2.91Å; Q1052-N1056 VanDerWaalsContact O-CG 3.22Å; Q1052-N1056 PolarHBondContact O-N 2.96Å; Q1052-N1056 PolarHBondContact O-ND2 3.38Å
1053	Q	71.9	Confident	72	Confident	35 Å²	35	75.7 Å²	75.7	16%	0.164	38%	0.379	C	S	.	.	H	α-helix	trans	-63.6	-47.3	175.8	-74.8	-178.8	-14.1	0	0	112.2	T1049 I1050 T1055 N1056 I1057	T1049-Q1053 WeakPolarHBondContact O-CG 3.41Å; T1049-Q1053 PolarHBondContact O-N 3.48Å; I1050-Q1053 WeakPolarHBondContact O-CB 3.43Å; I1050-Q1053 PolarHBondContact O-N 3.47Å; I1050-Q1053 VanDerWaalsContact O-N 3.11Å; Q1053-T1055 VanDerWaalsContact C-N 3.26Å; Q1053-T1055 PolarHBondContact O-N 3.35Å; Q1053-N1056 WeakPolarHBondContact O-CB 3.35Å; Q1053-N1056 PolarHBondContact O-N 3.5Å; Q1053-N1056 VanDerWaalsContact O-N 3.1Å; Q1053-I1057 WeakPolarHBondContact O-CG1 3.2Å; Q1053-I1057 PolarHBondContact O-N 3.12Å
1054	F	77.5	Confident	73.5	Confident	9 Å²	9	69.6 Å²	69.6	4%	0.039	34%	0.341	C	S	.	.	H	α-helix	trans	-64.4	-32.7	175.7	-78.8	-74.2	0	0	0	112.4	I1039 M1041 I1050 N1056 I1057 F1058 I1092 G1093 C1131	I1039-F1054 HydrophobicContact CD1-CB 3.71Å; I1039-F1054 HydrophobicContact CG1-CB 4.23Å; I1039-F1054 HydrophobicContact CG2-CB 3.71Å; I1039-F1054 HydrophobicContact CG2-CD1 4.4Å; I1039-F1054 HydrophobicContact CG2-CG 3.98Å; M1041-F1054 HydrophobicContact CE-CD1 4.05Å; M1041-F1054 HydrophobicContact CE-CD2 3.44Å; M1041-F1054 VanDerWaalsContact CE-CD2 3.44Å; M1041-F1054 HydrophobicContact CE-CE1 3.85Å; M1041-F1054 HydrophobicContact CE-CE2 3.22Å; M1041-F1054 HydrophobicContact CE-CG 3.85Å; M1041-F1054 HydrophobicContact CE-CZ 3.44Å; M1041-F1054 VanDerWaalsContact CE-CZ 3.44Å; M1041-F1054 HydrophobicContact SD-CD2 4.32Å; M1041-F1054 HydrophobicContact SD-CE2 4.02Å; I1050-F1054 HydrophobicContact CG2-CD2 3.75Å; I1050-F1054 HydrophobicContact CG2-CE2 3.66Å; I1050-F1054 WeakPolarHBondContact O-CD2 3.35Å; I1050-F1054 PolarHBondContact O-N 3.05Å; F1054-N1056 VanDerWaalsContact C-N 3.34Å; F1054-I1057 HydrophobicContact CD1-CD1 4.36Å; F1054-I1057 PolarHBondContact O-N 2.97Å; F1054-F1058 WeakPolarHBondContact O-CB 3.31Å; F1054-F1058 PolarHBondContact O-N 3.44Å; F1054-I1092 HydrophobicContact CD1-CG2 3.71Å; F1054-I1092 HydrophobicContact CE1-CG2 4.39Å; F1054-G1093 WeakPolarHBondContact CE1-O 3.34Å; F1054-C1131 HydrophobicContact CE1-CB 4.16Å; F1054-C1131 HydrophobicContact CZ-CB 4.08Å
1055	T	78.9	Confident	75.3	Confident	68 Å²	68	62.7 Å²	62.7	42%	0.417	31%	0.309	S	S	.	.	H	α-helix	trans	-63.3	-40.4	172.2	-53.6	0	0	0	0	111.5	Q1051 Q1052 Q1053 F1058 H1059	Q1051-T1055 WeakPolarHBondContact O-CB 3.39Å; Q1051-T1055 PolarHBondContact O-N 3.31Å; Q1051-T1055 PolarHBondContact O-OG1 3.44Å; Q1052-T1055 WeakPolarHBondContact O-CB 3.35Å; Q1052-T1055 PolarHBondContact O-N 2.91Å; Q1053-T1055 VanDerWaalsContact C-N 3.26Å; Q1053-T1055 PolarHBondContact O-N 3.35Å; T1055-F1058 PolarHBondContact O-N 3.48Å; T1055-H1059 PolarHBondContact O-N 2.94Å
1056	N	82.1	Confident	77	Confident	51 Å²	51	63.4 Å²	63.4	27%	0.273	30%	0.302	S	S	.	.	H	α-helix	trans	-69.2	-38.3	176.3	-65.7	-24.2	0	0	0	112.3	Q1052 Q1053 F1054 H1059 W1060 F1168	Q1052-N1056 VanDerWaalsContact O-CG 3.22Å; Q1052-N1056 PolarHBondContact O-N 2.96Å; Q1052-N1056 PolarHBondContact O-ND2 3.38Å; Q1053-N1056 WeakPolarHBondContact O-CB 3.35Å; Q1053-N1056 PolarHBondContact O-N 3.5Å; Q1053-N1056 VanDerWaalsContact O-N 3.1Å; F1054-N1056 VanDerWaalsContact C-N 3.34Å; N1056-H1059 PolarHBondContact O-N 3.29Å; N1056-W1060 PolarHBondContact O-N 2.94Å; N1056-F1168 HydrophobicContact CB-CB 4.21Å; N1056-F1168 HydrophobicContact CB-CD1 3.75Å; N1056-F1168 HydrophobicContact CB-CD2 3.53Å; N1056-F1168 HydrophobicContact CB-CE1 3.86Å; N1056-F1168 HydrophobicContact CB-CE2 3.66Å; N1056-F1168 HydrophobicContact CB-CG 3.56Å; N1056-F1168 HydrophobicContact CB-CZ 3.8Å
1057	I	83.8	Confident	78.2	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-62.9	-44.5	173.9	-67.2	168	0	0	0	110.2	Q1053 F1054 H1059 W1060 I1061 I1092 C1131 L1158 F1168 W1174	Q1053-I1057 WeakPolarHBondContact O-CG1 3.2Å; Q1053-I1057 PolarHBondContact O-N 3.12Å; F1054-I1057 HydrophobicContact CD1-CD1 4.36Å; F1054-I1057 PolarHBondContact O-N 2.97Å; I1057-H1059 VanDerWaalsContact C-N 3.29Å; I1057-H1059 PolarHBondContact O-N 3.22Å; I1057-W1060 PolarHBondContact O-N 3.11Å; I1057-W1060 VanDerWaalsContact O-N 3.14Å; I1057-I1061 HydrophobicContact CG2-CD1 4Å; I1057-I1061 HydrophobicContact CG2-CG1 4.42Å; I1057-I1061 WeakPolarHBondContact O-CG1 3.47Å; I1057-I1061 PolarHBondContact O-N 2.73Å; I1057-I1092 HydrophobicContact CG2-CG2 4.49Å; I1057-C1131 HydrophobicContact CD1-CB 4.3Å; I1057-L1158 HydrophobicContact CG2-CD1 3.79Å; I1057-F1168 HydrophobicContact CG1-CE2 4.08Å; I1057-F1168 HydrophobicContact CG1-CZ 4.11Å; I1057-W1174 HydrophobicContact CG1-CH2 4.37Å; I1057-W1174 HydrophobicContact CG1-CZ3 4.28Å
1058	F	85.9	Confident	79	Confident	31 Å²	31	58.6 Å²	58.6	14%	0.136	28%	0.278	C	S	.	.	H	α-helix	trans	-55.8	-45.8	173.3	173.2	-87.9	0	0	0	111.3	L1035 K1037 F1054 T1055 W1060 I1061 Y1062 L1072 I1092	L1035-F1058 HydrophobicContact CD2-CD2 4.18Å; L1035-F1058 HydrophobicContact CD2-CE2 3.63Å; L1035-F1058 HydrophobicContact CD2-CZ 4.09Å; L1035-F1058 HydrophobicContact CG-CD2 4.38Å; L1035-F1058 HydrophobicContact CG-CE2 3.82Å; K1037-F1058 HydrophobicContact CB-CE2 4.31Å; K1037-F1058 HydrophobicContact CB-CZ 4.43Å; K1037-F1058 HydrophobicContact CG-CE2 4.2Å; K1037-F1058 HydrophobicContact CG-CZ 3.94Å; F1054-F1058 WeakPolarHBondContact O-CB 3.31Å; F1054-F1058 PolarHBondContact O-N 3.44Å; T1055-F1058 PolarHBondContact O-N 3.48Å; F1058-W1060 VanDerWaalsContact C-N 3.34Å; F1058-W1060 PolarHBondContact O-N 3.47Å; F1058-I1061 PolarHBondContact O-N 3.09Å; F1058-Y1062 VanDerWaalsContact O-CB 3.29Å; F1058-Y1062 WeakPolarHBondContact O-CB 3.35Å; F1058-Y1062 PolarHBondContact O-N 3.23Å; F1058-L1072 HydrophobicContact CE2-CD1 4.13Å; F1058-L1072 HydrophobicContact CZ-CD1 3.63Å; F1058-I1092 HydrophobicContact CB-CD1 3.76Å; F1058-I1092 HydrophobicContact CD2-CD1 3.85Å; F1058-I1092 HydrophobicContact CG-CD1 4.28Å
1059	H	84	Confident	79.4	Confident	97 Å²	97	52.2 Å²	52.2	45%	0.449	26%	0.255	S	S	.	.	H	α-helix	trans	-64.5	-37.9	177.3	-169.5	65.6	0	0	0	112.7	T1055 N1056 I1057 Y1062 N1063	T1055-H1059 PolarHBondContact O-N 2.94Å; N1056-H1059 PolarHBondContact O-N 3.29Å; I1057-H1059 VanDerWaalsContact C-N 3.29Å; I1057-H1059 PolarHBondContact O-N 3.22Å; H1059-Y1062 PolarHBondContact O-N 3.47Å; H1059-N1063 PolarHBondContact CD2-ND2 2.9Å; H1059-N1063 PolarHBondContact NE2-ND2 2.8Å; H1059-N1063 WeakPolarHBondContact O-CB 3.44Å; H1059-N1063 PolarHBondContact O-N 2.87Å
1060	W	88.5	Confident	80.1	Confident	1 Å²	1	50.4 Å²	50.4	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-64.6	-47	175.3	176.8	77.9	0	0	0	112.3	T1018 W1019 N1056 I1057 F1058 Y1062 N1063 K1064 L1158 F1168 P1170 W1174 L1178	T1018-W1060 PolarHBondContact O-NE1 3.26Å; W1019-W1060 AromaticContact CE3-CD1 3.8Å; W1019-W1060 HydrophobicContact CH2-CB 4.05Å; W1019-W1060 AromaticContact CH2-CD1 4Å; W1019-W1060 HydrophobicContact CH2-CG 4.45Å; W1019-W1060 HydrophobicContact CZ3-CB 3.95Å; W1019-W1060 AromaticContact CZ3-CD1 3.73Å; W1019-W1060 HydrophobicContact CZ3-CG 4.25Å; N1056-W1060 PolarHBondContact O-N 2.94Å; I1057-W1060 PolarHBondContact O-N 3.11Å; I1057-W1060 VanDerWaalsContact O-N 3.14Å; F1058-W1060 VanDerWaalsContact C-N 3.34Å; F1058-W1060 PolarHBondContact O-N 3.47Å; W1060-Y1062 VanDerWaalsContact C-N 3.34Å; W1060-Y1062 PolarHBondContact O-N 2.84Å; W1060-N1063 PolarHBondContact O-N 3.27Å; W1060-K1064 HydrophobicContact CD2-CG 4.15Å; W1060-K1064 HydrophobicContact CH2-CG 4.26Å; W1060-K1064 HydrophobicContact CZ2-CD 4.07Å; W1060-K1064 HydrophobicContact CZ2-CG 3.72Å; W1060-K1064 WeakPolarHBondContact O-CB 3.44Å; W1060-K1064 WeakPolarHBondContact O-CG 3.4Å; W1060-K1064 PolarHBondContact O-N 2.91Å; W1060-L1158 HydrophobicContact CZ3-CD1 4.49Å; W1060-F1168 HydrophobicContact CB-CE1 4.11Å; W1060-F1168 HydrophobicContact CB-CZ 4.36Å; W1060-P1170 HydrophobicContact CD2-CB 4.43Å; W1060-P1170 HydrophobicContact CG-CB 4.21Å; W1060-P1170 HydrophobicContact CG-CG 4.09Å; W1060-W1174 HydrophobicContact CD2-CE3 4.28Å; W1060-W1174 HydrophobicContact CE3-CE3 4.16Å; W1060-W1174 HydrophobicContact CH2-CB 3.45Å; W1060-W1174 VanDerWaalsContact CH2-CB 3.45Å; W1060-W1174 HydrophobicContact CZ2-CB 3.74Å; W1060-W1174 HydrophobicContact CZ3-CB 4.06Å; W1060-W1174 HydrophobicContact CZ3-CE3 4.32Å; W1060-L1178 HydrophobicContact CH2-CB 4.4Å; W1060-L1178 HydrophobicContact CH2-CD2 4.11Å; W1060-L1178 HydrophobicContact CZ3-CD2 4.1Å
1061	I	86.5	Confident	80.7	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-61.7	-45	175.8	-67.4	176.9	0	0	0	110.3	L1035 I1057 F1058 N1063 K1064 L1065 I1092 V1129 L1178	L1035-I1061 HydrophobicContact CD1-CG2 4.19Å; I1057-I1061 HydrophobicContact CG2-CD1 4Å; I1057-I1061 HydrophobicContact CG2-CG1 4.42Å; I1057-I1061 WeakPolarHBondContact O-CG1 3.47Å; I1057-I1061 PolarHBondContact O-N 2.73Å; F1058-I1061 PolarHBondContact O-N 3.09Å; I1061-N1063 VanDerWaalsContact C-N 3.32Å; I1061-N1063 PolarHBondContact O-N 2.85Å; I1061-K1064 PolarHBondContact O-N 2.94Å; I1061-L1065 HydrophobicContact CG2-CD1 3.71Å; I1061-L1065 HydrophobicContact CG2-CG 4.31Å; I1061-L1065 WeakPolarHBondContact O-CB 3.31Å; I1061-L1065 WeakPolarHBondContact O-CG 3.3Å; I1061-L1065 PolarHBondContact O-N 2.67Å; I1061-I1092 HydrophobicContact CD1-CD1 3.76Å; I1061-I1092 HydrophobicContact CD1-CG1 4.18Å; I1061-V1129 HydrophobicContact CD1-CB 4.34Å; I1061-V1129 HydrophobicContact CD1-CG1 4.08Å; I1061-V1129 HydrophobicContact CD1-CG2 4.06Å; I1061-L1178 HydrophobicContact CG1-CD2 4.48Å
1062	Y	85.7	Confident	81.2	Confident	107 Å²	107	48.6 Å²	48.6	42%	0.42	24%	0.238	S	C	.	.	H	α-helix	trans	-58.7	-42.8	177.2	-174.2	-99.4	0	0	0	112.1	L1035 F1058 H1059 W1060 L1065 K1066 L1072	L1035-Y1062 HydrophobicContact CD2-CD2 4.11Å; F1058-Y1062 VanDerWaalsContact O-CB 3.29Å; F1058-Y1062 WeakPolarHBondContact O-CB 3.35Å; F1058-Y1062 PolarHBondContact O-N 3.23Å; H1059-Y1062 PolarHBondContact O-N 3.47Å; W1060-Y1062 VanDerWaalsContact C-N 3.34Å; W1060-Y1062 PolarHBondContact O-N 2.84Å; Y1062-L1065 CarbonylContact O-C 3.53Å; Y1062-L1065 PolarHBondContact O-N 2.86Å; Y1062-K1066 PolarHBondContact O-N 2.87Å; Y1062-L1072 HydrophobicContact CD2-CD1 4.36Å; Y1062-L1072 HydrophobicContact CE2-CD1 4.36Å
1063	N	84.9	Confident	81.5	Confident	44 Å²	44	43.4 Å²	43.4	24%	0.235	22%	0.215	C	C	.	.	H	α-helix	trans	-69.1	-40.2	175.9	-77.9	-19.3	0	0	0	112.7	W1019 H1059 W1060 I1061 L1065 K1066	W1019-N1063 HydrophobicContact CE3-CB 4.24Å; W1019-N1063 HydrophobicContact CZ3-CB 4.38Å; H1059-N1063 PolarHBondContact CD2-ND2 2.9Å; H1059-N1063 PolarHBondContact NE2-ND2 2.8Å; H1059-N1063 WeakPolarHBondContact O-CB 3.44Å; H1059-N1063 PolarHBondContact O-N 2.87Å; W1060-N1063 PolarHBondContact O-N 3.27Å; I1061-N1063 VanDerWaalsContact C-N 3.32Å; I1061-N1063 PolarHBondContact O-N 2.85Å; N1063-L1065 PolarHBondContact O-N 2.8Å; N1063-K1066 VanDerWaalsContact O-CB 3.26Å; N1063-K1066 WeakPolarHBondContact O-CB 3.49Å; N1063-K1066 PolarHBondContact O-N 3.5Å
1064	K	85.4	Confident	81.6	Confident	4 Å²	4	46.8 Å²	46.8	2%	0.017	23%	0.234	C	C	.	.	H	α-helix	trans	-60.7	-35.8	176	-82.3	-77.7	164.5	-178.3	0	112	L1017 T1018 S1020 P1021 M1022 W1060 I1061 S1175 L1178	L1017-K1064 PolarHBondContact O-NZ 3.21Å; T1018-K1064 WeakPolarHBondContact O-CE 3.28Å; T1018-K1064 PolarHBondContact O-NZ 3.07Å; T1018-K1064 VanDerWaalsContact O-NZ 3.1Å; S1020-K1064 VanDerWaalsContact O-CD 3.31Å; S1020-K1064 WeakPolarHBondContact O-CD 3.48Å; S1020-K1064 VanDerWaalsContact O-CE 3.22Å; S1020-K1064 WeakPolarHBondContact O-CE 3.42Å; S1020-K1064 PolarHBondContact O-NZ 3.35Å; P1021-K1064 WeakPolarHBondContact CA-O 3.36Å; M1022-K1064 HydrophobicContact CG-CB 4.49Å; M1022-K1064 HydrophobicContact CG-CD 3.74Å; M1022-K1064 PolarHBondContact N-O 3.47Å; M1022-K1064 HydrophobicContact SD-CB 4.15Å; M1022-K1064 HydrophobicContact SD-CD 3.83Å; M1022-K1064 HydrophobicContact SD-CG 4.43Å; W1060-K1064 HydrophobicContact CD2-CG 4.15Å; W1060-K1064 HydrophobicContact CH2-CG 4.26Å; W1060-K1064 HydrophobicContact CZ2-CD 4.07Å; W1060-K1064 HydrophobicContact CZ2-CG 3.72Å; W1060-K1064 WeakPolarHBondContact O-CB 3.44Å; W1060-K1064 WeakPolarHBondContact O-CG 3.4Å; W1060-K1064 PolarHBondContact O-N 2.91Å; I1061-K1064 PolarHBondContact O-N 2.94Å; K1064-S1175 VanDerWaalsContact CE-OG 3.32Å; K1064-S1175 WeakPolarHBondContact CE-OG 3.46Å; K1064-S1175 PolarHBondContact NZ-OG 3.06Å; K1064-L1178 HydrophobicContact CB-CD2 4.2Å
1065	L	83.6	Confident	81.2	Confident	1 Å²	1	54 Å²	54	1%	0.005	27%	0.268	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	8.2	-176.6	-57	-178.7	0	0	0	113.5	I1061 Y1062 N1063 H1067 L1068 I1070 I1090 L1178 L1182	I1061-L1065 HydrophobicContact CG2-CD1 3.71Å; I1061-L1065 HydrophobicContact CG2-CG 4.31Å; I1061-L1065 WeakPolarHBondContact O-CB 3.31Å; I1061-L1065 WeakPolarHBondContact O-CG 3.3Å; I1061-L1065 PolarHBondContact O-N 2.67Å; Y1062-L1065 CarbonylContact O-C 3.53Å; Y1062-L1065 PolarHBondContact O-N 2.86Å; N1063-L1065 PolarHBondContact O-N 2.8Å; L1065-H1067 PolarHBondContact O-N 3.27Å; L1065-L1068 HydrophobicContact CB-CD1 3.93Å; L1065-L1068 HydrophobicContact CD2-CD1 3.71Å; L1065-L1068 HydrophobicContact CG-CD1 4.42Å; L1065-L1068 WeakPolarHBondContact O-CB 3.43Å; L1065-L1068 WeakPolarHBondContact O-CD1 3.45Å; L1065-L1068 PolarHBondContact O-N 3.4Å; L1065-I1070 HydrophobicContact CB-CD1 3.25Å; L1065-I1070 HydrophobicContact CB-CG1 4.2Å; L1065-I1070 HydrophobicContact CD1-CD1 4.21Å; L1065-I1070 HydrophobicContact CG-CD1 4.37Å; L1065-I1070 WeakPolarHBondContact O-CD1 3.39Å; L1065-I1090 HydrophobicContact CD1-CD1 3.62Å; L1065-L1178 HydrophobicContact CD2-CD2 4.39Å; L1065-L1182 HydrophobicContact CD2-CD1 3.64Å
1066	K	80.4	Confident	80.8	Confident	140 Å²	140	51.6 Å²	51.6	61%	0.609	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47	-30.9	-179.5	162.4	179.9	170.2	-179.8	0	114.9	Y1062 N1063	Y1062-K1066 PolarHBondContact O-N 2.87Å; N1063-K1066 VanDerWaalsContact O-CB 3.26Å; N1063-K1066 WeakPolarHBondContact O-CB 3.49Å; N1063-K1066 PolarHBondContact O-N 3.5Å
1067	H	79.3	Confident	80	Confident	94 Å²	94	49.4 Å²	49.4	44%	0.435	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-2.2	-177.9	-65.6	-39.2	0	0	0	114.4	P1021 Y1029 L1065	P1021-H1067 WeakPolarHBondContact CB-CD2 3.26Å; P1021-H1067 WeakPolarHBondContact CG-CD2 3.42Å; P1021-H1067 VanDerWaalsContact CG-NE2 3.26Å; P1021-H1067 WeakPolarHBondContact CG-NE2 3.27Å; Y1029-H1067 VanDerWaalsContact CE1-O 3.3Å; Y1029-H1067 WeakPolarHBondContact CE1-O 3.35Å; Y1029-H1067 PolarHBondContact OH-O 3Å; L1065-H1067 PolarHBondContact O-N 3.27Å
1068	L	78.1	Confident	78.9	Confident	13 Å²	13	53 Å²	53	7%	0.068	26%	0.261	C	S	.	.	S	Bend	trans	-92.1	146.7	169	-67.4	92.8	0	0	0	109.6	P1024 F1028 L1033 L1065 I1070	P1024-L1068 HydrophobicContact CB-CD1 3.72Å; P1024-L1068 HydrophobicContact CB-CD2 3.49Å; P1024-L1068 VanDerWaalsContact CB-CD2 3.49Å; P1024-L1068 HydrophobicContact CB-CG 3.37Å; P1024-L1068 HydrophobicContact CG-CD1 4.02Å; P1024-L1068 HydrophobicContact CG-CD2 4.37Å; P1024-L1068 HydrophobicContact CG-CG 3.72Å; F1028-L1068 HydrophobicContact CB-CD2 3.75Å; F1028-L1068 HydrophobicContact CD2-CD2 3.74Å; F1028-L1068 HydrophobicContact CG-CD2 3.93Å; L1033-L1068 HydrophobicContact CD1-CD2 3.78Å; L1065-L1068 HydrophobicContact CB-CD1 3.93Å; L1065-L1068 HydrophobicContact CD2-CD1 3.71Å; L1065-L1068 HydrophobicContact CG-CD1 4.42Å; L1065-L1068 WeakPolarHBondContact O-CB 3.43Å; L1065-L1068 WeakPolarHBondContact O-CD1 3.45Å; L1065-L1068 PolarHBondContact O-N 3.4Å; L1068-I1070 HydrophobicContact CB-CG1 4.18Å; L1068-I1070 PolarHBondContact O-N 2.93Å
1069	P	75.4	Confident	77.6	Confident	49 Å²	49	54.3 Å²	54.3	32%	0.318	27%	0.272	S	S	.	.			trans	-71.3	99.4	166.8	32.2	-32.9	0	0	0	108.3	F1028 Y1029 P1032 L1033	F1028-P1069 WeakPolarHBondContact O-CD 3.46Å; F1028-P1069 WeakPolarHBondContact O-CG 3.41Å; Y1029-P1069 HydrophobicContact CD1-CG 4.49Å; P1032-P1069 VanDerWaalsContact CA-O 3.27Å; P1032-P1069 WeakPolarHBondContact CA-O 3.13Å; P1032-P1069 HydrophobicContact CB-CB 4.16Å; P1032-P1069 HydrophobicContact CB-CG 4.2Å; P1032-P1069 WeakPolarHBondContact CB-O 3.3Å; L1033-P1069 PolarHBondContact N-O 3.27Å
1070	I	81.1	Confident	76.3	Confident	35 Å²	35	53.6 Å²	53.6	18%	0.179	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	127.4	175	-54.9	172.5	0	0	0	108.6	L1033 L1035 L1065 L1068	L1033-I1070 CarbonylContact O-C 3.49Å; L1033-I1070 VanDerWaalsContact O-CA 3.28Å; L1033-I1070 WeakPolarHBondContact O-CA 3.35Å; L1033-I1070 WeakPolarHBondContact O-CG2 3.27Å; L1035-I1070 HydrophobicContact CB-CG2 3.3Å; L1035-I1070 HydrophobicContact CD2-CG2 4.48Å; L1065-I1070 HydrophobicContact CB-CD1 3.25Å; L1065-I1070 HydrophobicContact CB-CG1 4.2Å; L1065-I1070 HydrophobicContact CD1-CD1 4.21Å; L1065-I1070 HydrophobicContact CG-CD1 4.37Å; L1065-I1070 WeakPolarHBondContact O-CD1 3.39Å; L1068-I1070 HydrophobicContact CB-CG1 4.18Å; L1068-I1070 PolarHBondContact O-N 2.93Å
1071	V	80.6	Confident	74.9	Confident	50 Å²	50	56 Å²	56	30%	0.303	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	115	168	178.5	0	0	0	0	108	P1032 L1033 G1034 L1035 L1073 L1086	P1032-V1071 HydrophobicContact CB-CG2 4.05Å; P1032-V1071 HydrophobicContact CG-CG2 4.16Å; L1033-V1071 PolarHBondContact O-N 3.07Å; G1034-V1071 CarbonylContact C-O 3.53Å; G1034-V1071 WeakPolarHBondContact CA-O 3.44Å; L1035-V1071 PolarHBondContact N-O 3.47Å; V1071-L1073 HydrophobicContact CG1-CD2 3.97Å; V1071-L1073 HydrophobicContact CG1-CG 4.49Å; V1071-L1073 PolarHBondContact O-N 2.86Å; V1071-L1086 HydrophobicContact CB-CD2 3.89Å; V1071-L1086 HydrophobicContact CG2-CD2 3.81Å
1072	L	80.1	Confident	73.5	Confident	67 Å²	67	56.8 Å²	56.8	35%	0.351	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	117.4	176.7	-154.4	82	0	0	0	110	L1035 K1037 F1058 Y1062	L1035-L1072 HydrophobicContact CB-CD1 4.29Å; L1035-L1072 HydrophobicContact CD2-CD1 4.1Å; L1035-L1072 HydrophobicContact CG-CD1 4.34Å; K1037-L1072 HydrophobicContact CB-CD2 4.34Å; K1037-L1072 HydrophobicContact CB-CG 4.33Å; K1037-L1072 HydrophobicContact CD-CD2 3.76Å; K1037-L1072 HydrophobicContact CG-CD2 4.17Å; F1058-L1072 HydrophobicContact CE2-CD1 4.13Å; F1058-L1072 HydrophobicContact CZ-CD1 3.63Å; Y1062-L1072 HydrophobicContact CD2-CD1 4.36Å; Y1062-L1072 HydrophobicContact CE2-CD1 4.36Å
1073	L	78.9	Confident	72.1	Confident	14 Å²	14	55 Å²	55	7%	0.073	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	109.5	-176.8	-62.1	168.5	0	0	0	109.3	L1035 Y1036 K1037 V1071 P1077 L1086 I1089	L1035-L1073 PolarHBondContact O-N 2.95Å; Y1036-L1073 HydrophobicContact CD2-CB 3.9Å; K1037-L1073 WeakPolarHBondContact CB-O 3.49Å; K1037-L1073 PolarHBondContact N-O 2.88Å; V1071-L1073 HydrophobicContact CG1-CD2 3.97Å; V1071-L1073 HydrophobicContact CG1-CG 4.49Å; V1071-L1073 PolarHBondContact O-N 2.86Å; L1073-P1077 HydrophobicContact CD1-CB 4.36Å; L1073-P1077 HydrophobicContact CD1-CG 3.77Å; L1073-P1077 HydrophobicContact CD2-CB 4Å; L1073-P1077 HydrophobicContact CD2-CG 4.32Å; L1073-L1086 HydrophobicContact CD1-CD1 4.2Å; L1073-I1089 HydrophobicContact CD1-CD1 4.22Å; L1073-I1089 HydrophobicContact CD1-CG1 4.33Å; L1073-I1089 HydrophobicContact CD1-CG2 4.23Å
1074	N	72.7	Confident	70.8	Confident	106 Å²	106	59.3 Å²	59.3	57%	0.567	32%	0.323	S	S	*	.	S	Bend	trans	-78.6	-34.4	175.2	-67	-31.7	0	0	0	111.8	K1037	K1037-N1074 WeakPolarHBondContact CD-OD1 3.36Å
1075	E	69.1	Low	69.7	Low	161 Å²	161	64.9 Å²	64.9	75%	0.752	35%	0.349	S	S	*	.	S	Bend	trans	-122.8	161.2	177.2	-66.8	-179.4	-178.2	0	0	108.9
1076	W	70.6	Confident	69.4	Low	16 Å²	16	65.4 Å²	65.4	6%	0.061	35%	0.352	C	S	.	.	P	Polyproline II helix	trans	-65.2	127.7	-179.6	-165.1	-93.8	0	0	0	109.8	Y1036 V1091 L1104 M1105 H1108 L1112 L1124 I1126	Y1036-W1076 HydrophobicContact CD2-CE3 4.17Å; Y1036-W1076 HydrophobicContact CE2-CE3 4.15Å; W1076-V1091 HydrophobicContact CH2-CG2 4.25Å; W1076-V1091 HydrophobicContact CZ3-CG2 4.07Å; W1076-L1104 HydrophobicContact CH2-CD2 3.62Å; W1076-L1104 HydrophobicContact CZ3-CD2 3.82Å; W1076-M1105 VanDerWaalsContact CE2-SD 3.53Å; W1076-M1105 HydrophobicContact CH2-CG 4.27Å; W1076-M1105 HydrophobicContact CZ2-CG 3.52Å; W1076-M1105 HydrophobicContact CZ2-SD 3.74Å; W1076-M1105 PolarHBondContact NE1-SD 3.39Å; W1076-H1108 AromaticContact CE3-CD2 3.34Å; W1076-H1108 AromaticContact CE3-NE2 3.8Å; W1076-H1108 AromaticContact CZ3-CD2 3.82Å; W1076-L1112 HydrophobicContact CB-CD1 4.11Å; W1076-L1124 HydrophobicContact CZ2-CD2 3.84Å; W1076-I1126 HydrophobicContact CH2-CD1 4.19Å; W1076-I1126 HydrophobicContact CZ2-CD1 4.41Å
1077	P	65.9	Low	69.3	Low	6 Å²	6	58.9 Å²	58.9	4%	0.039	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-67.9	134.3	-169.4	22.8	-31.6	0	0	0	112.5	L1073 V1081 I1082 I1089 Y1116	L1073-P1077 HydrophobicContact CD1-CB 4.36Å; L1073-P1077 HydrophobicContact CD1-CG 3.77Å; L1073-P1077 HydrophobicContact CD2-CB 4Å; L1073-P1077 HydrophobicContact CD2-CG 4.32Å; P1077-V1081 HydrophobicContact CB-CB 4.25Å; P1077-V1081 HydrophobicContact CB-CG1 4.27Å; P1077-I1082 HydrophobicContact CB-CD1 4.04Å; P1077-I1082 HydrophobicContact CB-CG1 3.69Å; P1077-I1082 HydrophobicContact CG-CD1 3.56Å; P1077-I1082 HydrophobicContact CG-CG1 3.7Å; P1077-I1089 HydrophobicContact CG-CD1 3.52Å; P1077-Y1116 PolarHBondContact O-OH 3.29Å
1078	T	59.5	Low	69.5	Low	76 Å²	76	54.5 Å²	54.5	47%	0.466	30%	0.304	S	S	.	.	P	Polyproline II helix	trans	-64.8	153.5	172.7	49.1	0	0	0	0	112	S1080 V1081 I1082 Y1116	T1078-S1080 PolarHBondContact O-N 3.19Å; T1078-S1080 PolarHBondContact OG1-OG 3.37Å; T1078-V1081 PolarHBondContact O-N 2.94Å; T1078-I1082 PolarHBondContact O-N 3.38Å; T1078-Y1116 VanDerWaalsContact CA-OH 3.27Å; T1078-Y1116 WeakPolarHBondContact CA-OH 3.23Å
1079	T	58.4	Low	69.8	Low	59 Å²	59	53.9 Å²	53.9	36%	0.362	30%	0.301	S	S	.	.	H	α-helix	trans	-48.4	-36.2	-177.7	22.5	0	0	0	0	113.2	V1081 S1083 Y1116 F1120	T1079-V1081 PolarHBondContact O-N 3.45Å; T1079-S1083 WeakPolarHBondContact O-CB 3.36Å; T1079-S1083 PolarHBondContact O-N 3.46Å; T1079-S1083 PolarHBondContact O-OG 3.28Å; T1079-Y1116 HydrophobicContact CG2-CD1 3.39Å; T1079-Y1116 HydrophobicContact CG2-CE1 3.85Å; T1079-Y1116 HydrophobicContact CG2-CG 4.32Å; T1079-F1120 HydrophobicContact CG2-CD1 3.9Å; T1079-F1120 HydrophobicContact CG2-CD2 3.98Å; T1079-F1120 HydrophobicContact CG2-CE1 3.9Å; T1079-F1120 HydrophobicContact CG2-CE2 3.96Å; T1079-F1120 HydrophobicContact CG2-CG 3.9Å; T1079-F1120 HydrophobicContact CG2-CZ 3.86Å
1080	S	57.1	Low	70.4	Confident	83 Å²	83	51.6 Å²	51.6	58%	0.58	29%	0.286	S	S	*	.	H	α-helix	trans	-67.5	-30.1	178.7	55	0	0	0	0	114.1	T1078	T1078-S1080 PolarHBondContact O-N 3.19Å; T1078-S1080 PolarHBondContact OG1-OG 3.37Å
1081	V	58.9	Low	70.6	Confident	52 Å²	52	50 Å²	50	32%	0.315	28%	0.278	S	S	.	.	H	α-helix	trans	-78.7	-40.6	-178.6	178.9	0	0	0	0	111.1	P1077 T1078 T1079 L1086	P1077-V1081 HydrophobicContact CB-CB 4.25Å; P1077-V1081 HydrophobicContact CB-CG1 4.27Å; T1078-V1081 PolarHBondContact O-N 2.94Å; T1079-V1081 PolarHBondContact O-N 3.45Å; V1081-L1086 HydrophobicContact CG1-CD1 4.44Å
1082	I	58.1	Low	70.8	Confident	15 Å²	15	47.6 Å²	47.6	8%	0.077	26%	0.263	C	S	.	.	H	α-helix	trans	-79.6	-44.6	-175.7	-42.4	-179.3	0	0	0	111.4	P1077 T1078 N1084 Q1085 L1086 I1089 F1120 L1124	P1077-I1082 HydrophobicContact CB-CD1 4.04Å; P1077-I1082 HydrophobicContact CB-CG1 3.69Å; P1077-I1082 HydrophobicContact CG-CD1 3.56Å; P1077-I1082 HydrophobicContact CG-CG1 3.7Å; T1078-I1082 PolarHBondContact O-N 3.38Å; I1082-N1084 PolarHBondContact O-N 3.48Å; I1082-Q1085 PolarHBondContact O-N 3.08Å; I1082-L1086 HydrophobicContact CG2-CB 4.3Å; I1082-L1086 PolarHBondContact O-N 2.97Å; I1082-I1089 HydrophobicContact CD1-CD1 4.06Å; I1082-F1120 HydrophobicContact CB-CE2 4.01Å; I1082-F1120 HydrophobicContact CB-CZ 3.56Å; I1082-F1120 HydrophobicContact CD1-CE1 3.76Å; I1082-F1120 HydrophobicContact CD1-CZ 3.48Å; I1082-F1120 VanDerWaalsContact CD1-CZ 3.48Å; I1082-F1120 HydrophobicContact CG1-CZ 3.81Å; I1082-F1120 HydrophobicContact CG2-CZ 4.19Å; I1082-L1124 HydrophobicContact CD1-CD1 3.65Å; I1082-L1124 HydrophobicContact CG2-CD1 3.64Å
1083	S	56.2	Low	70.8	Confident	69 Å²	69	44.4 Å²	44.4	48%	0.483	25%	0.247	S	C	.	.	H	α-helix	trans	-56.4	-27.2	-169.5	48.8	0	0	0	0	113.9	T1079	T1079-S1083 WeakPolarHBondContact O-CB 3.36Å; T1079-S1083 PolarHBondContact O-N 3.46Å; T1079-S1083 PolarHBondContact O-OG 3.28Å
1084	N	56.7	Low	70.5	Confident	136 Å²	136	48.3 Å²	48.3	73%	0.727	26%	0.261	S	S	*	.	H	α-helix	trans	-121.4	-7.7	-174.8	-70.4	-26.1	0	0	0	115.6	I1082	I1082-N1084 PolarHBondContact O-N 3.48Å
1085	Q	63.7	Low	70.6	Confident	121 Å²	121	43.6 Å²	43.6	57%	0.565	24%	0.235	S	C	*	.	H	α-helix	trans	-130	-26.6	-172.8	-62	-163.9	-11	0	0	115.8	P1032 I1082	P1032-Q1085 WeakPolarHBondContact CD-O 3.47Å; P1032-Q1085 VanDerWaalsContact CG-O 3.24Å; P1032-Q1085 WeakPolarHBondContact CG-O 3.37Å; I1082-Q1085 PolarHBondContact O-N 3.08Å
1086	L	77.1	Confident	70.4	Confident	12 Å²	12	40.7 Å²	40.7	6%	0.063	23%	0.225	C	C	.	.			trans	-106.2	136.3	-171.2	-61.5	176.2	0	0	0	113.1	P1032 V1071 L1073 V1081 I1082	P1032-L1086 HydrophobicContact CB-CD2 4.36Å; P1032-L1086 HydrophobicContact CG-CD2 4.22Å; P1032-L1086 CarbonylContact O-C 3.54Å; P1032-L1086 VanDerWaalsContact O-CA 3.24Å; P1032-L1086 WeakPolarHBondContact O-CA 3.47Å; P1032-L1086 WeakPolarHBondContact O-CD2 3.31Å; V1071-L1086 HydrophobicContact CB-CD2 3.89Å; V1071-L1086 HydrophobicContact CG2-CD2 3.81Å; L1073-L1086 HydrophobicContact CD1-CD1 4.2Å; V1081-L1086 HydrophobicContact CG1-CD1 4.44Å; I1082-L1086 HydrophobicContact CG2-CB 4.3Å; I1082-L1086 PolarHBondContact O-N 2.97Å
1087	S	77.4	Confident	70.1	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.021	25%	0.253	C	S	.	.	S	Bend	trans	-80.4	-24.7	174.1	64	0	0	0	0	113.4	F1028 Y1031 P1032 F1189	F1028-S1087 WeakPolarHBondContact CD1-OG 3.31Å; F1028-S1087 WeakPolarHBondContact CE1-OG 3.49Å; Y1031-S1087 PolarHBondContact O-OG 3.29Å; P1032-S1087 PolarHBondContact O-N 3.16Å; P1032-S1087 PolarHBondContact O-OG 3.02Å; S1087-F1189 WeakPolarHBondContact O-CD2 3.46Å
1088	G	84.3	Confident	70	Confident	2 Å²	2	50.6 Å²	50.6	2%	0.021	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	175.2	169.8	-179.4	0	0	0	0	0	111.5	G1034 L1125	G1034-G1088 PolarHBondContact N-O 3.21Å; G1088-L1125 WeakPolarHBondContact CA-O 3.42Å
1089	I	84.9	Confident	70.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	128.7	-179.8	-56.2	179.7	0	0	0	110.4	G1034 L1073 P1077 I1082 V1091 L1124 L1125 I1126 L1127	G1034-I1089 CarbonylContact O-C 3.42Å; G1034-I1089 VanDerWaalsContact O-CA 3.31Å; G1034-I1089 WeakPolarHBondContact O-CA 3.45Å; L1073-I1089 HydrophobicContact CD1-CD1 4.22Å; L1073-I1089 HydrophobicContact CD1-CG1 4.33Å; L1073-I1089 HydrophobicContact CD1-CG2 4.23Å; P1077-I1089 HydrophobicContact CG-CD1 3.52Å; I1082-I1089 HydrophobicContact CD1-CD1 4.06Å; I1089-V1091 HydrophobicContact CG2-CG2 3.77Å; I1089-L1124 HydrophobicContact CD1-CD1 3.92Å; I1089-L1124 HydrophobicContact CD1-CD2 4.5Å; I1089-L1124 HydrophobicContact CG1-CD1 4.32Å; I1089-L1125 PolarHBondContact N-O 3.2Å; I1089-I1126 WeakPolarHBondContact O-CA 3.43Å; I1089-L1127 PolarHBondContact O-N 3.11Å
1090	I	87.4	Confident	71.1	Confident	1 Å²	1	48.4 Å²	48.4	1%	0.005	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	121.5	171.3	-53.7	177.9	0	0	0	108.4	G1034 L1035 Y1036 L1065 L1127 V1129 L1182	G1034-I1090 PolarHBondContact O-N 3.25Å; L1035-I1090 HydrophobicContact CD1-CB 3.78Å; L1035-I1090 HydrophobicContact CD1-CG2 3.78Å; Y1036-I1090 WeakPolarHBondContact CB-O 3.49Å; Y1036-I1090 PolarHBondContact N-O 3.44Å; L1065-I1090 HydrophobicContact CD1-CD1 3.62Å; I1090-L1127 WeakPolarHBondContact CA-O 3.15Å; I1090-L1127 HydrophobicContact CD1-CD2 4.3Å; I1090-L1127 HydrophobicContact CG1-CB 4.29Å; I1090-L1127 HydrophobicContact CG1-CD2 4.07Å; I1090-L1127 HydrophobicContact CG2-CD2 4.37Å; I1090-V1129 HydrophobicContact CG2-CG2 4.07Å; I1090-L1182 HydrophobicContact CD1-CD2 4.21Å
1091	V	86	Confident	71.8	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	133	-179.3	-168.7	0	0	0	0	109.5	Y1036 L1040 W1076 I1089 F1095 L1104 I1126 L1127 A1128 V1129	Y1036-V1091 HydrophobicContact CD1-CG1 4.14Å; L1040-V1091 HydrophobicContact CD1-CG1 3.56Å; L1040-V1091 HydrophobicContact CG-CG1 4.31Å; W1076-V1091 HydrophobicContact CH2-CG2 4.25Å; W1076-V1091 HydrophobicContact CZ3-CG2 4.07Å; I1089-V1091 HydrophobicContact CG2-CG2 3.77Å; V1091-F1095 HydrophobicContact CG1-CZ 3.95Å; V1091-L1104 HydrophobicContact CG1-CD2 4.25Å; V1091-L1104 HydrophobicContact CG2-CD2 4.26Å; V1091-I1126 HydrophobicContact CG2-CG2 3.96Å; V1091-L1127 PolarHBondContact N-O 3.15Å; V1091-A1128 WeakPolarHBondContact O-CA 3.31Å; V1091-V1129 PolarHBondContact O-N 2.82Å
1092	I	84	Confident	72.3	Confident	1 Å²	1	46.6 Å²	46.6	1%	0.005	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.7	-178.3	-55.3	176.4	0	0	0	108.9	L1035 I1039 L1040 F1054 I1057 F1058 I1061 V1129	L1035-I1092 HydrophobicContact CD1-CD1 4.43Å; I1039-I1092 WeakPolarHBondContact CA-O 3.46Å; L1040-I1092 PolarHBondContact N-O 2.78Å; F1054-I1092 HydrophobicContact CD1-CG2 3.71Å; F1054-I1092 HydrophobicContact CE1-CG2 4.39Å; I1057-I1092 HydrophobicContact CG2-CG2 4.49Å; F1058-I1092 HydrophobicContact CB-CD1 3.76Å; F1058-I1092 HydrophobicContact CD2-CD1 3.85Å; F1058-I1092 HydrophobicContact CG-CD1 4.28Å; I1061-I1092 HydrophobicContact CD1-CD1 3.76Å; I1061-I1092 HydrophobicContact CD1-CG1 4.18Å; I1092-V1129 HydrophobicContact CG1-CB 4.41Å
1093	G	80.5	Confident	72.9	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-179.5	-170.2	-178.6	0	0	0	0	0	114.3	L1040 M1041 F1054 V1129 T1130	L1040-G1093 VanDerWaalsContact O-CA 3.31Å; L1040-G1093 WeakPolarHBondContact O-CA 3.47Å; M1041-G1093 VanDerWaalsContact CE-C 3.45Å; F1054-G1093 WeakPolarHBondContact CE1-O 3.34Å; G1093-V1129 PolarHBondContact N-O 3.47Å; G1093-V1129 VanDerWaalsContact N-O 3.1Å; G1093-T1130 WeakPolarHBondContact O-CA 3.42Å; G1093-T1130 VanDerWaalsContact O-CB 3.3Å; G1093-T1130 WeakPolarHBondContact O-CB 3.37Å; G1093-T1130 PolarHBondContact O-OG1 3.03Å
1094	Y	73.2	Confident	73.7	Confident	96 Å²	96	47.2 Å²	47.2	38%	0.376	24%	0.241	S	C	.	.			trans	-99.6	113	174.5	-169.4	-89.6	0	0	0	108.6	L1040	L1040-Y1094 PolarHBondContact O-N 3.17Å; L1040-Y1094 VanDerWaalsContact O-N 3.16Å
1095	F	73.3	Confident	74.3	Confident	6 Å²	6	40.8 Å²	40.8	3%	0.026	21%	0.206	C	C	.	.			trans	-132.8	129.8	-171.2	-49.9	-58.1	0	0	0	110.3	L1040 V1091 I1099 L1104 A1128 T1130	L1040-F1095 HydrophobicContact CB-CE1 3.9Å; L1040-F1095 HydrophobicContact CB-CZ 4.13Å; L1040-F1095 HydrophobicContact CD1-CE1 3.93Å; L1040-F1095 HydrophobicContact CD1-CZ 4.17Å; V1091-F1095 HydrophobicContact CG1-CZ 3.95Å; F1095-I1099 HydrophobicContact CB-CD1 4.44Å; F1095-I1099 HydrophobicContact CB-CG2 4.14Å; F1095-I1099 HydrophobicContact CD1-CD1 3.54Å; F1095-I1099 HydrophobicContact CE1-CD1 4.24Å; F1095-I1099 HydrophobicContact CG-CD1 4.35Å; F1095-L1104 HydrophobicContact CE1-CD1 4.29Å; F1095-L1104 HydrophobicContact CE1-CG 4.48Å; F1095-A1128 HydrophobicContact CD2-CB 3.76Å; F1095-A1128 HydrophobicContact CE2-CB 3.94Å; F1095-A1128 HydrophobicContact CG-CB 4.46Å; F1095-T1130 PolarHBondContact N-OG1 3.3Å
1096	D	64.8	Low	74.6	Confident	101 Å²	101	37.3 Å²	37.3	54%	0.54	20%	0.195	S	C	.	.			trans	-79.7	155.1	166.9	-70.9	-19.1	0	0	0	109.7	S1098 I1099	D1096-S1098 PolarHBondContact O-N 3.29Å; D1096-I1099 PolarHBondContact O-N 2.97Å; D1096-I1099 VanDerWaalsContact O-N 3.07Å
1097	H	65.8	Low	74.1	Confident	137 Å²	137	40.5 Å²	40.5	63%	0.634	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-14.8	179.7	-76.7	-75.8	0	0	0	114.4	H1157	H1097-H1157 AromaticContact CD2-NE2 3.93Å; H1097-H1157 AromaticContact CE1-CD2 3.5Å; H1097-H1157 PolarHBondContact CE1-CD2 3.33Å; H1097-H1157 VanDerWaalsContact CE1-CD2 3.5Å; H1097-H1157 AromaticContact CE1-NE2 2.94Å; H1097-H1157 PolarHBondContact CE1-NE2 3.15Å; H1097-H1157 AromaticContact ND1-NE2 3.72Å; H1097-H1157 AromaticContact NE2-CD2 3.81Å; H1097-H1157 AromaticContact NE2-CE1 3.83Å; H1097-H1157 AromaticContact NE2-NE2 3.03Å; H1097-H1157 PolarHBondContact NE2-NE2 3.21Å
1098	S	62.8	Low	73.3	Confident	93 Å²	93	42.7 Å²	42.7	65%	0.65	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95	6.2	179.9	60.4	0	0	0	0	114.5	D1096 T1100	D1096-S1098 PolarHBondContact O-N 3.29Å; S1098-T1100 PolarHBondContact O-N 3.16Å
1099	I	67.4	Low	72.1	Confident	26 Å²	26	45 Å²	45	13%	0.133	24%	0.237	C	C	.	.			trans	-66.5	128.2	-176.5	-162.6	165.8	0	0	0	111.3	F1095 D1096 Q1103 L1104 M1107 L1155	F1095-I1099 HydrophobicContact CB-CD1 4.44Å; F1095-I1099 HydrophobicContact CB-CG2 4.14Å; F1095-I1099 HydrophobicContact CD1-CD1 3.54Å; F1095-I1099 HydrophobicContact CE1-CD1 4.24Å; F1095-I1099 HydrophobicContact CG-CD1 4.35Å; D1096-I1099 PolarHBondContact O-N 2.97Å; D1096-I1099 VanDerWaalsContact O-N 3.07Å; I1099-Q1103 HydrophobicContact CG1-CB 4.16Å; I1099-L1104 HydrophobicContact CD1-CB 4.07Å; I1099-L1104 HydrophobicContact CD1-CD1 4.3Å; I1099-L1104 HydrophobicContact CD1-CG 4.28Å; I1099-L1104 HydrophobicContact CG1-CB 4.28Å; I1099-M1107 HydrophobicContact CD1-SD 4.28Å; I1099-L1155 HydrophobicContact CG2-CD1 4.27Å
1100	T	73.7	Confident	70.8	Confident	62 Å²	62	50.2 Å²	50.2	38%	0.38	27%	0.268	S	S	.	.			trans	-92.4	159.6	174.9	69.8	0	0	0	0	111.5	S1098 E1102 Q1103 L1104	S1098-T1100 PolarHBondContact O-N 3.16Å; T1100-E1102 VanDerWaalsContact C-N 3.26Å; T1100-E1102 PolarHBondContact O-N 2.77Å; T1100-Q1103 PolarHBondContact O-N 2.88Å; T1100-Q1103 WeakPolarHBondContact OG1-CB 3.44Å; T1100-Q1103 VanDerWaalsContact OG1-CG 3.23Å; T1100-Q1103 WeakPolarHBondContact OG1-CG 3.28Å; T1100-Q1103 PolarHBondContact OG1-N 3.02Å; T1100-L1104 WeakPolarHBondContact O-CB 3.47Å; T1100-L1104 PolarHBondContact O-N 3.43Å
1101	K	72.7	Confident	69.3	Low	8 Å²	8	55.6 Å²	55.6	4%	0.035	30%	0.297	C	S	.	.	H	α-helix	trans	-55.8	-42.9	176.5	-74.5	179.6	172.8	168.1	0	111.9	L1104 M1105 I1121 K1122 L1124 I1126 D1152 I1153	K1101-L1104 PolarHBondContact O-N 2.71Å; K1101-M1105 WeakPolarHBondContact O-CG 3.38Å; K1101-M1105 PolarHBondContact O-N 2.78Å; K1101-I1121 HydrophobicContact CB-CG2 4.27Å; K1101-I1121 HydrophobicContact CD-CG2 4.39Å; K1101-I1121 VanDerWaalsContact CD-O 3.32Å; K1101-I1121 WeakPolarHBondContact CD-O 3.42Å; K1101-I1121 PolarHBondContact NZ-O 2.79Å; K1101-K1122 PolarHBondContact NZ-O 3.08Å; K1101-L1124 WeakPolarHBondContact CE-O 3.29Å; K1101-L1124 PolarHBondContact NZ-O 2.87Å; K1101-I1126 HydrophobicContact CG-CD1 4.08Å; K1101-D1152 HydrophobicContact CD-CB 4.08Å; K1101-D1152 VanDerWaalsContact CE-C 3.44Å; K1101-D1152 VanDerWaalsContact CE-CB 3.43Å; K1101-D1152 WeakPolarHBondContact CE-O 3.34Å; K1101-D1152 WeakPolarHBondContact CE-OD1 3.41Å; K1101-D1152 HydrophobicContact CG-CB 4.34Å; K1101-D1152 VanDerWaalsContact NZ-CG 3.35Å; K1101-D1152 IonicContact NZ-OD1 2.69Å; K1101-D1152 PolarHBondContact NZ-OD1 3.32Å; K1101-I1153 HydrophobicContact CB-CD1 4.41Å; K1101-I1153 HydrophobicContact CG-CD1 3.78Å; K1101-I1153 HydrophobicContact CG-CG1 3.72Å
1102	E	69.5	Low	68.1	Low	89 Å²	89	57.3 Å²	57.3	42%	0.416	31%	0.306	S	S	.	.	H	α-helix	trans	-65.3	-43.1	179.3	-62.5	177.1	163.6	0	0	111.6	T1100 L1104 M1105 S1106 V1113	T1100-E1102 VanDerWaalsContact C-N 3.26Å; T1100-E1102 PolarHBondContact O-N 2.77Å; E1102-L1104 VanDerWaalsContact C-N 3.35Å; E1102-M1105 PolarHBondContact O-N 2.82Å; E1102-S1106 VanDerWaalsContact O-CB 3.3Å; E1102-S1106 WeakPolarHBondContact O-CB 3.36Å; E1102-S1106 PolarHBondContact O-N 3.13Å; E1102-S1106 PolarHBondContact O-OG 3.09Å; E1102-V1113 HydrophobicContact CG-CG1 4.44Å
1103	Q	70.5	Confident	66.9	Low	98 Å²	98	58.6 Å²	58.6	46%	0.458	31%	0.314	S	S	.	.	H	α-helix	trans	-60.8	-46.7	174.7	-76.4	172.3	-5.4	0	0	110.6	I1099 T1100 M1105 S1106 M1107	I1099-Q1103 HydrophobicContact CG1-CB 4.16Å; T1100-Q1103 PolarHBondContact O-N 2.88Å; T1100-Q1103 WeakPolarHBondContact OG1-CB 3.44Å; T1100-Q1103 VanDerWaalsContact OG1-CG 3.23Å; T1100-Q1103 WeakPolarHBondContact OG1-CG 3.28Å; T1100-Q1103 PolarHBondContact OG1-N 3.02Å; Q1103-M1105 VanDerWaalsContact C-N 3.35Å; Q1103-M1105 PolarHBondContact O-N 3.47Å; Q1103-S1106 WeakPolarHBondContact CA-OG 3.3Å; Q1103-S1106 PolarHBondContact O-N 3.26Å; Q1103-S1106 VanDerWaalsContact O-N 3.16Å; Q1103-S1106 PolarHBondContact O-OG 3.49Å; Q1103-M1107 WeakPolarHBondContact O-CG 3.25Å; Q1103-M1107 PolarHBondContact O-N 2.9Å
1104	L	72.6	Confident	66	Low	0 Å²	0	67 Å²	67	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-60.7	-42.3	178.2	-163.1	155.6	0	0	0	111.7	L1040 W1076 V1091 F1095 I1099 T1100 K1101 E1102 M1107 I1126 I1153	L1040-L1104 HydrophobicContact CD1-CD2 3.82Å; L1040-L1104 HydrophobicContact CD1-CG 4.01Å; W1076-L1104 HydrophobicContact CH2-CD2 3.62Å; W1076-L1104 HydrophobicContact CZ3-CD2 3.82Å; V1091-L1104 HydrophobicContact CG1-CD2 4.25Å; V1091-L1104 HydrophobicContact CG2-CD2 4.26Å; F1095-L1104 HydrophobicContact CE1-CD1 4.29Å; F1095-L1104 HydrophobicContact CE1-CG 4.48Å; I1099-L1104 HydrophobicContact CD1-CB 4.07Å; I1099-L1104 HydrophobicContact CD1-CD1 4.3Å; I1099-L1104 HydrophobicContact CD1-CG 4.28Å; I1099-L1104 HydrophobicContact CG1-CB 4.28Å; T1100-L1104 WeakPolarHBondContact O-CB 3.47Å; T1100-L1104 PolarHBondContact O-N 3.43Å; K1101-L1104 PolarHBondContact O-N 2.71Å; E1102-L1104 VanDerWaalsContact C-N 3.35Å; L1104-M1107 PolarHBondContact O-N 2.92Å; L1104-I1126 HydrophobicContact CD1-CG2 4.2Å; L1104-I1126 HydrophobicContact CD2-CD1 4.47Å; L1104-I1153 HydrophobicContact CD1-CD1 4.5Å
1105	M	69.2	Low	65.3	Low	1 Å²	1	66.3 Å²	66.3	1%	0.005	36%	0.363	C	S	.	.	H	α-helix	trans	-67.8	-37.4	173.9	-71.9	-144.1	-86	0	0	113.1	W1076 K1101 E1102 Q1103 M1107 H1108 S1109 V1113 I1121	W1076-M1105 VanDerWaalsContact CE2-SD 3.53Å; W1076-M1105 HydrophobicContact CH2-CG 4.27Å; W1076-M1105 HydrophobicContact CZ2-CG 3.52Å; W1076-M1105 HydrophobicContact CZ2-SD 3.74Å; W1076-M1105 PolarHBondContact NE1-SD 3.39Å; K1101-M1105 WeakPolarHBondContact O-CG 3.38Å; K1101-M1105 PolarHBondContact O-N 2.78Å; E1102-M1105 PolarHBondContact O-N 2.82Å; Q1103-M1105 VanDerWaalsContact C-N 3.35Å; Q1103-M1105 PolarHBondContact O-N 3.47Å; M1105-M1107 VanDerWaalsContact C-N 3.27Å; M1105-M1107 PolarHBondContact O-N 3.34Å; M1105-H1108 WeakPolarHBondContact O-CB 3.49Å; M1105-H1108 PolarHBondContact O-N 3.39Å; M1105-H1108 VanDerWaalsContact O-N 3.11Å; M1105-S1109 PolarHBondContact O-N 2.9Å; M1105-V1113 HydrophobicContact CB-CG2 4.16Å; M1105-I1121 HydrophobicContact CE-CB 4.29Å; M1105-I1121 HydrophobicContact CE-CD1 3.66Å; M1105-I1121 HydrophobicContact CE-CG1 3.62Å; M1105-I1121 HydrophobicContact CE-CG2 3.91Å
1106	S	69.2	Low	64.9	Low	47 Å²	47	66.9 Å²	66.9	33%	0.329	37%	0.365	S	S	.	.	H	α-helix	trans	-66.8	-28.4	179.1	76.8	0	0	0	0	112.9	E1102 Q1103 H1108 S1109	E1102-S1106 VanDerWaalsContact O-CB 3.3Å; E1102-S1106 WeakPolarHBondContact O-CB 3.36Å; E1102-S1106 PolarHBondContact O-N 3.13Å; E1102-S1106 PolarHBondContact O-OG 3.09Å; Q1103-S1106 WeakPolarHBondContact CA-OG 3.3Å; Q1103-S1106 PolarHBondContact O-N 3.26Å; Q1103-S1106 VanDerWaalsContact O-N 3.16Å; Q1103-S1106 PolarHBondContact O-OG 3.49Å; S1106-H1108 PolarHBondContact O-N 3.49Å; S1106-S1109 PolarHBondContact O-N 2.75Å
1107	M	65.9	Low	64.8	Low	79 Å²	79	67.1 Å²	67.1	39%	0.389	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-19.6	173.9	-69.1	-174.9	76.4	0	0	112.6	L1040 I1099 Q1103 L1104 M1105	L1040-M1107 HydrophobicContact CD2-CB 3.72Å; I1099-M1107 HydrophobicContact CD1-SD 4.28Å; Q1103-M1107 WeakPolarHBondContact O-CG 3.25Å; Q1103-M1107 PolarHBondContact O-N 2.9Å; L1104-M1107 PolarHBondContact O-N 2.92Å; M1105-M1107 VanDerWaalsContact C-N 3.27Å; M1105-M1107 PolarHBondContact O-N 3.34Å
1108	H	60.5	Low	64.8	Low	49 Å²	49	64.9 Å²	64.9	23%	0.227	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-51.1	173.6	-82.9	-49.5	0	0	0	113.8	Y1036 L1040 W1076 M1105 S1106 L1112	Y1036-H1108 AromaticContact CD1-NE2 3.77Å; Y1036-H1108 AromaticContact CE1-CE1 2.96Å; Y1036-H1108 WeakPolarHBondContact CE1-CE1 3.41Å; Y1036-H1108 AromaticContact CE1-ND1 4Å; Y1036-H1108 AromaticContact CE1-NE2 3.03Å; Y1036-H1108 WeakPolarHBondContact CE1-NE2 3.13Å; Y1036-H1108 AromaticContact CZ-CE1 3.08Å; Y1036-H1108 AromaticContact CZ-ND1 3.7Å; Y1036-H1108 AromaticContact CZ-NE2 3.24Å; Y1036-H1108 PolarHBondContact OH-CE1 2.91Å; Y1036-H1108 PolarHBondContact OH-ND1 3.31Å; Y1036-H1108 PolarHBondContact OH-NE2 2.76Å; L1040-H1108 WeakPolarHBondContact CD2-CE1 3.24Å; L1040-H1108 VanDerWaalsContact CD2-NE2 3.31Å; L1040-H1108 WeakPolarHBondContact CD2-NE2 3.38Å; L1040-H1108 WeakPolarHBondContact CG-NE2 3.14Å; W1076-H1108 AromaticContact CE3-CD2 3.34Å; W1076-H1108 AromaticContact CE3-NE2 3.8Å; W1076-H1108 AromaticContact CZ3-CD2 3.82Å; M1105-H1108 WeakPolarHBondContact O-CB 3.49Å; M1105-H1108 PolarHBondContact O-N 3.39Å; M1105-H1108 VanDerWaalsContact O-N 3.11Å; S1106-H1108 PolarHBondContact O-N 3.49Å; H1108-L1112 HydrophobicContact CB-CD1 4.09Å
1109	S	59.1	Low	64.8	Low	52 Å²	52	65.6 Å²	65.6	36%	0.364	35%	0.352	S	S	.	.			trans	-161.3	126.1	174.6	177.6	0	0	0	0	108.9	M1105 S1106 N1111 L1112	M1105-S1109 PolarHBondContact O-N 2.9Å; S1106-S1109 PolarHBondContact O-N 2.75Å; S1109-N1111 PolarHBondContact O-N 3.35Å; S1109-L1112 WeakPolarHBondContact O-CB 3.18Å; S1109-L1112 PolarHBondContact O-N 3.09Å; S1109-L1112 VanDerWaalsContact O-N 3.07Å
1110	T	59.2	Low	64.7	Low	108 Å²	108	65.8 Å²	65.8	66%	0.663	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-24.3	-178	52.3	0	0	0	0	113.1
1111	N	55.9	Low	64.1	Low	115 Å²	115	63.1 Å²	63.1	62%	0.615	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.1	-12.1	-177.9	-65.7	-2.9	0	0	0	113.5	S1109	S1109-N1111 PolarHBondContact O-N 3.35Å
1112	L	61.1	Low	63.8	Low	35 Å²	35	68.9 Å²	68.9	18%	0.183	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-46.4	-176.3	-81.1	160.3	0	0	0	111.5	W1076 H1108 S1109 Q1114 S1115 Y1116	W1076-L1112 HydrophobicContact CB-CD1 4.11Å; H1108-L1112 HydrophobicContact CB-CD1 4.09Å; S1109-L1112 WeakPolarHBondContact O-CB 3.18Å; S1109-L1112 PolarHBondContact O-N 3.09Å; S1109-L1112 VanDerWaalsContact O-N 3.07Å; L1112-Q1114 PolarHBondContact O-N 3.4Å; L1112-S1115 PolarHBondContact O-N 3.31Å; L1112-S1115 PolarHBondContact O-OG 3.44Å; L1112-Y1116 HydrophobicContact CB-CE2 4.33Å; L1112-Y1116 HydrophobicContact CD2-CE2 3.67Å; L1112-Y1116 VanDerWaalsContact O-CD2 3.25Å; L1112-Y1116 WeakPolarHBondContact O-CD2 3.04Å
1113	V	58.7	Low	63.8	Low	28 Å²	28	68.7 Å²	68.7	17%	0.17	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-57	-32.1	-172.8	-178	0	0	0	0	112.6	E1102 M1105 S1115 I1121	E1102-V1113 HydrophobicContact CG-CG1 4.44Å; M1105-V1113 HydrophobicContact CB-CG2 4.16Å; V1113-S1115 VanDerWaalsContact C-N 3.31Å; V1113-S1115 PolarHBondContact O-N 3.04Å; V1113-I1121 HydrophobicContact CG1-CD1 4.33Å
1114	Q	61.3	Low	63.9	Low	176 Å²	176	64.2 Å²	64.2	82%	0.822	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-75.2	-18.3	178.2	-65.5	-179.8	-7.2	0	0	113.8	L1112	L1112-Q1114 PolarHBondContact O-N 3.4Å
1115	S	58.5	Low	64.3	Low	82 Å²	82	65 Å²	65	57%	0.573	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	-93.1	-14	-176.3	68.1	0	0	0	0	114.5	L1112 V1113	L1112-S1115 PolarHBondContact O-N 3.31Å; L1112-S1115 PolarHBondContact O-OG 3.44Å; V1113-S1115 VanDerWaalsContact C-N 3.31Å; V1113-S1115 PolarHBondContact O-N 3.04Å
1116	Y	63.9	Low	65	Low	18 Å²	18	64.9 Å²	64.9	7%	0.071	35%	0.345	C	S	.	.	S	Bend	trans	-98.3	144.9	179.8	-71.4	-100.5	0	0	0	111.1	P1077 T1078 T1079 L1112 F1120	P1077-Y1116 PolarHBondContact O-OH 3.29Å; T1078-Y1116 VanDerWaalsContact CA-OH 3.27Å; T1078-Y1116 WeakPolarHBondContact CA-OH 3.23Å; T1079-Y1116 HydrophobicContact CG2-CD1 3.39Å; T1079-Y1116 HydrophobicContact CG2-CE1 3.85Å; T1079-Y1116 HydrophobicContact CG2-CG 4.32Å; L1112-Y1116 HydrophobicContact CB-CE2 4.33Å; L1112-Y1116 HydrophobicContact CD2-CE2 3.67Å; L1112-Y1116 VanDerWaalsContact O-CD2 3.25Å; L1112-Y1116 WeakPolarHBondContact O-CD2 3.04Å; Y1116-F1120 AromaticContact CD1-CD1 3.71Å; Y1116-F1120 HydrophobicContact CD1-CD1 3.71Å; Y1116-F1120 AromaticContact CD1-CE1 3.49Å; Y1116-F1120 HydrophobicContact CD1-CE1 3.49Å; Y1116-F1120 VanDerWaalsContact CD1-CE1 3.49Å; Y1116-F1120 HydrophobicContact CD1-CZ 4.37Å; Y1116-F1120 AromaticContact CE1-CE1 3.89Å; Y1116-F1120 HydrophobicContact CE1-CE1 3.89Å; Y1116-F1120 HydrophobicContact CE1-CZ 4.5Å
1117	D	63.7	Low	65.8	Low	106 Å²	106	62.7 Å²	62.7	57%	0.567	33%	0.33	S	S	*	.			trans	-64.9	135.3	172.8	-158.7	-15.2	0	0	0	110.2	D1119 F1120 I1121	D1117-D1119 VanDerWaalsContact C-N 3.27Å; D1117-D1119 PolarHBondContact O-N 3Å; D1117-F1120 HydrophobicContact CB-CB 4.11Å; D1117-F1120 WeakPolarHBondContact O-CA 3.37Å; D1117-F1120 VanDerWaalsContact O-CB 3.27Å; D1117-F1120 WeakPolarHBondContact O-CB 3.42Å; D1117-F1120 PolarHBondContact O-N 3.19Å; D1117-I1121 PolarHBondContact O-N 3Å; D1117-I1121 VanDerWaalsContact O-N 3.16Å
1118	Q	65.3	Low	66.7	Low	91 Å²	91	58.9 Å²	58.9	43%	0.425	31%	0.311	S	S	.	.	H	α-helix	trans	-64.4	-34.6	-175.1	-79.9	-70.6	-31.8	0	0	112	F1120 I1121 K1122	Q1118-F1120 PolarHBondContact O-N 3.34Å; Q1118-I1121 PolarHBondContact O-N 3.23Å; Q1118-K1122 PolarHBondContact O-N 3.09Å
1119	D	63.1	Low	67.8	Low	107 Å²	107	56.7 Å²	56.7	57%	0.572	30%	0.301	S	S	*	.	H	α-helix	trans	-65.6	-32.3	174.4	-70.7	-21.3	0	0	0	111.2	D1117 D1123	D1117-D1119 VanDerWaalsContact C-N 3.27Å; D1117-D1119 PolarHBondContact O-N 3Å; D1119-D1123 WeakPolarHBondContact O-CB 3.47Å; D1119-D1123 PolarHBondContact O-N 3.1Å
1120	F	64	Low	68.8	Low	30 Å²	30	54.3 Å²	54.3	13%	0.132	28%	0.284	C	S	.	.	H	α-helix	trans	-71.1	-36.1	175.9	178.1	-87.1	0	0	0	112.9	T1079 I1082 Y1116 D1117 Q1118 D1123 L1124	T1079-F1120 HydrophobicContact CG2-CD1 3.9Å; T1079-F1120 HydrophobicContact CG2-CD2 3.98Å; T1079-F1120 HydrophobicContact CG2-CE1 3.9Å; T1079-F1120 HydrophobicContact CG2-CE2 3.96Å; T1079-F1120 HydrophobicContact CG2-CG 3.9Å; T1079-F1120 HydrophobicContact CG2-CZ 3.86Å; I1082-F1120 HydrophobicContact CB-CE2 4.01Å; I1082-F1120 HydrophobicContact CB-CZ 3.56Å; I1082-F1120 HydrophobicContact CD1-CE1 3.76Å; I1082-F1120 HydrophobicContact CD1-CZ 3.48Å; I1082-F1120 VanDerWaalsContact CD1-CZ 3.48Å; I1082-F1120 HydrophobicContact CG1-CZ 3.81Å; I1082-F1120 HydrophobicContact CG2-CZ 4.19Å; Y1116-F1120 AromaticContact CD1-CD1 3.71Å; Y1116-F1120 HydrophobicContact CD1-CD1 3.71Å; Y1116-F1120 AromaticContact CD1-CE1 3.49Å; Y1116-F1120 HydrophobicContact CD1-CE1 3.49Å; Y1116-F1120 VanDerWaalsContact CD1-CE1 3.49Å; Y1116-F1120 HydrophobicContact CD1-CZ 4.37Å; Y1116-F1120 AromaticContact CE1-CE1 3.89Å; Y1116-F1120 HydrophobicContact CE1-CE1 3.89Å; Y1116-F1120 HydrophobicContact CE1-CZ 4.5Å; D1117-F1120 HydrophobicContact CB-CB 4.11Å; D1117-F1120 WeakPolarHBondContact O-CA 3.37Å; D1117-F1120 VanDerWaalsContact O-CB 3.27Å; D1117-F1120 WeakPolarHBondContact O-CB 3.42Å; D1117-F1120 PolarHBondContact O-N 3.19Å; Q1118-F1120 PolarHBondContact O-N 3.34Å; F1120-D1123 PolarHBondContact O-N 3.06Å; F1120-L1124 PolarHBondContact O-N 3.31Å
1121	I	62.9	Low	69.2	Low	6 Å²	6	49.8 Å²	49.8	3%	0.031	26%	0.257	C	S	.	.	H	α-helix	trans	-64	-43.8	176.5	-59.4	-175.1	0	0	0	110.6	K1101 M1105 V1113 D1117 Q1118 D1123 L1124	K1101-I1121 HydrophobicContact CB-CG2 4.27Å; K1101-I1121 HydrophobicContact CD-CG2 4.39Å; K1101-I1121 VanDerWaalsContact CD-O 3.32Å; K1101-I1121 WeakPolarHBondContact CD-O 3.42Å; K1101-I1121 PolarHBondContact NZ-O 2.79Å; M1105-I1121 HydrophobicContact CE-CB 4.29Å; M1105-I1121 HydrophobicContact CE-CD1 3.66Å; M1105-I1121 HydrophobicContact CE-CG1 3.62Å; M1105-I1121 HydrophobicContact CE-CG2 3.91Å; V1113-I1121 HydrophobicContact CG1-CD1 4.33Å; D1117-I1121 PolarHBondContact O-N 3Å; D1117-I1121 VanDerWaalsContact O-N 3.16Å; Q1118-I1121 PolarHBondContact O-N 3.23Å; I1121-D1123 PolarHBondContact O-N 3.31Å; I1121-L1124 PolarHBondContact O-N 3.42Å
1122	K	66.4	Low	69.4	Low	129 Å²	129	46.7 Å²	46.7	56%	0.561	24%	0.244	S	C	*	.	H	α-helix	trans	-57.7	-36.9	174.7	-72.4	176.8	-179.7	170.2	0	111.7	K1101 Q1118 L1124	K1101-K1122 PolarHBondContact NZ-O 3.08Å; Q1118-K1122 PolarHBondContact O-N 3.09Å; K1122-L1124 PolarHBondContact O-N 3.23Å
1123	D	67.7	Low	68.8	Low	86 Å²	86	49.4 Å²	49.4	46%	0.46	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-8.9	-173.1	-102.7	15.5	0	0	0	116	D1119 F1120 I1121 K1192	D1119-D1123 WeakPolarHBondContact O-CB 3.47Å; D1119-D1123 PolarHBondContact O-N 3.1Å; F1120-D1123 PolarHBondContact O-N 3.06Å; I1121-D1123 PolarHBondContact O-N 3.31Å; D1123-K1192 VanDerWaalsContact CG-CE 3.41Å; D1123-K1192 PolarHBondContact O-NZ 3.4Å; D1123-K1192 IonicContact OD1-NZ 3.78Å; D1123-K1192 WeakPolarHBondContact OD2-CE 3.4Å; D1123-K1192 IonicContact OD2-NZ 2.82Å; D1123-K1192 PolarHBondContact OD2-NZ 3.4Å
1124	L	73.9	Confident	67.9	Low	4 Å²	4	55.5 Å²	55.5	2%	0.021	29%	0.285	C	S	.	.			trans	-82.8	123.7	-176.3	-175.5	69.5	0	0	0	111.8	W1076 I1082 I1089 K1101 F1120 I1121 K1122 I1126	W1076-L1124 HydrophobicContact CZ2-CD2 3.84Å; I1082-L1124 HydrophobicContact CD1-CD1 3.65Å; I1082-L1124 HydrophobicContact CG2-CD1 3.64Å; I1089-L1124 HydrophobicContact CD1-CD1 3.92Å; I1089-L1124 HydrophobicContact CD1-CD2 4.5Å; I1089-L1124 HydrophobicContact CG1-CD1 4.32Å; K1101-L1124 WeakPolarHBondContact CE-O 3.29Å; K1101-L1124 PolarHBondContact NZ-O 2.87Å; F1120-L1124 PolarHBondContact O-N 3.31Å; I1121-L1124 PolarHBondContact O-N 3.42Å; K1122-L1124 PolarHBondContact O-N 3.23Å; L1124-I1126 HydrophobicContact CD2-CD1 3.96Å; L1124-I1126 HydrophobicContact CD2-CG1 4.06Å; L1124-I1126 HydrophobicContact CG-CD1 4.49Å; L1124-I1126 HydrophobicContact CG-CG1 4.09Å
1125	L	81.7	Confident	66.4	Low	15 Å²	15	55.8 Å²	55.8	8%	0.079	29%	0.287	C	S	.	.			trans	-92.2	123	176	-62.3	173.5	0	0	0	111	G1088 I1089 D1151 W1184 I1185 C1188 F1189	G1088-L1125 WeakPolarHBondContact CA-O 3.42Å; I1089-L1125 PolarHBondContact N-O 3.2Å; L1125-D1151 WeakPolarHBondContact CD2-O 3.43Å; L1125-W1184 HydrophobicContact CD2-CH2 4.23Å; L1125-I1185 HydrophobicContact CD1-CG2 4.41Å; L1125-C1188 HydrophobicContact CD1-CB 3.78Å; L1125-C1188 HydrophobicContact CD2-CB 3.75Å; L1125-C1188 HydrophobicContact CG-CB 4.44Å; L1125-F1189 HydrophobicContact CD1-CB 4.01Å
1126	I	82.6	Confident	64.9	Low	0 Å²	0	58.6 Å²	58.6	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	127.7	-178.8	-54.8	-179.2	0	0	0	111.1	W1076 I1089 V1091 K1101 L1104 L1124 I1153 Y1154	W1076-I1126 HydrophobicContact CH2-CD1 4.19Å; W1076-I1126 HydrophobicContact CZ2-CD1 4.41Å; I1089-I1126 WeakPolarHBondContact O-CA 3.43Å; V1091-I1126 HydrophobicContact CG2-CG2 3.96Å; K1101-I1126 HydrophobicContact CG-CD1 4.08Å; L1104-I1126 HydrophobicContact CD1-CG2 4.2Å; L1104-I1126 HydrophobicContact CD2-CD1 4.47Å; L1124-I1126 HydrophobicContact CD2-CD1 3.96Å; L1124-I1126 HydrophobicContact CD2-CG1 4.06Å; L1124-I1126 HydrophobicContact CG-CD1 4.49Å; L1124-I1126 HydrophobicContact CG-CG1 4.09Å; I1126-I1153 HydrophobicContact CB-CG1 4.27Å; I1126-I1153 HydrophobicContact CB-CG2 4.45Å; I1126-I1153 HydrophobicContact CG2-CG2 4.41Å; I1126-I1153 WeakPolarHBondContact O-CA 3.45Å; I1126-Y1154 PolarHBondContact O-N 3.33Å
1127	L	86.9	Confident	63.2	Low	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	105.4	168.5	-173.7	75.7	0	0	0	109.4	I1089 I1090 V1091 Y1154 V1156 L1178 I1185	I1089-L1127 PolarHBondContact O-N 3.11Å; I1090-L1127 WeakPolarHBondContact CA-O 3.15Å; I1090-L1127 HydrophobicContact CD1-CD2 4.3Å; I1090-L1127 HydrophobicContact CG1-CB 4.29Å; I1090-L1127 HydrophobicContact CG1-CD2 4.07Å; I1090-L1127 HydrophobicContact CG2-CD2 4.37Å; V1091-L1127 PolarHBondContact N-O 3.15Å; L1127-Y1154 CarbonylContact C-O 3.59Å; L1127-Y1154 WeakPolarHBondContact CA-O 3.44Å; L1127-Y1154 HydrophobicContact CD1-CD1 3.56Å; L1127-Y1154 HydrophobicContact CD1-CG 4.13Å; L1127-V1156 HydrophobicContact CD1-CG2 3.62Å; L1127-V1156 HydrophobicContact CD2-CG2 4.46Å; L1127-V1156 HydrophobicContact CG-CG2 4.1Å; L1127-L1178 HydrophobicContact CD2-CD1 4.29Å; L1127-I1185 HydrophobicContact CB-CD1 3.88Å; L1127-I1185 HydrophobicContact CB-CG1 4.49Å; L1127-I1185 HydrophobicContact CD2-CD1 4.28Å
1128	A	83.8	Confident	61.4	Low	0 Å²	0	64.2 Å²	64.2	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	111.6	-177.2	0	0	0	0	0	110.4	V1091 F1095 I1153 Y1154 L1155 V1156	V1091-A1128 WeakPolarHBondContact O-CA 3.31Å; F1095-A1128 HydrophobicContact CD2-CB 3.76Å; F1095-A1128 HydrophobicContact CE2-CB 3.94Å; F1095-A1128 HydrophobicContact CG-CB 4.46Å; A1128-I1153 HydrophobicContact CB-CG2 3.86Å; A1128-Y1154 PolarHBondContact N-O 3.49Å; A1128-L1155 HydrophobicContact CB-CG 4.21Å; A1128-L1155 CarbonylContact O-C 3.51Å; A1128-L1155 WeakPolarHBondContact O-CA 3.49Å; A1128-V1156 PolarHBondContact O-N 3.09Å
1129	V	83.2	Confident	59.5	Low	2 Å²	2	64.7 Å²	64.7	1%	0.012	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	122.9	179.3	-173.8	0	0	0	0	109.9	I1061 I1090 V1091 I1092 G1093 V1156 L1158	I1061-V1129 HydrophobicContact CD1-CB 4.34Å; I1061-V1129 HydrophobicContact CD1-CG1 4.08Å; I1061-V1129 HydrophobicContact CD1-CG2 4.06Å; I1090-V1129 HydrophobicContact CG2-CG2 4.07Å; V1091-V1129 PolarHBondContact O-N 2.82Å; I1092-V1129 HydrophobicContact CG1-CB 4.41Å; G1093-V1129 PolarHBondContact N-O 3.47Å; G1093-V1129 VanDerWaalsContact N-O 3.1Å; V1129-V1156 WeakPolarHBondContact CA-O 3.37Å; V1129-V1156 HydrophobicContact CG2-CB 4.24Å; V1129-L1158 HydrophobicContact CG1-CD1 3.56Å; V1129-L1158 HydrophobicContact CG1-CG 3.86Å
1130	T	80.7	Confident	57.8	Low	3 Å²	3	63.6 Å²	63.6	2%	0.018	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	165.2	180	-157.6	0	0	0	0	113.2	G1093 F1095 L1155 V1156 H1157 L1158	G1093-T1130 WeakPolarHBondContact O-CA 3.42Å; G1093-T1130 VanDerWaalsContact O-CB 3.3Å; G1093-T1130 WeakPolarHBondContact O-CB 3.37Å; G1093-T1130 PolarHBondContact O-OG1 3.03Å; F1095-T1130 PolarHBondContact N-OG1 3.3Å; T1130-L1155 HydrophobicContact CG2-CD2 3.51Å; T1130-V1156 PolarHBondContact N-O 2.87Å; T1130-H1157 WeakPolarHBondContact CG2-CE1 3.34Å; T1130-H1157 WeakPolarHBondContact CG2-ND1 3.48Å; T1130-L1158 PolarHBondContact O-N 3.1Å
1131	C	68.4	Low	56.3	Low	12 Å²	12	68.8 Å²	68.8	8%	0.081	38%	0.382	C	S	.	.			trans	-132.2	123.5	-176	-176.8	0	0	0	0	110.2	F1054 I1057 L1158	F1054-C1131 HydrophobicContact CE1-CB 4.16Å; F1054-C1131 HydrophobicContact CZ-CB 4.08Å; I1057-C1131 HydrophobicContact CD1-CB 4.3Å; C1131-L1158 WeakPolarHBondContact CA-O 3.48Å; C1131-L1158 PolarHBondContact SG-O 3.31Å
1132	S	59	Low	54.8	Low	50 Å²	50	76.2 Å²	76.2	35%	0.35	42%	0.417	S	S	.	.			trans	-89	123.8	-179.7	68.9	0	0	0	0	111.6
1133	L	49.8	Very low	53	Low	92 Å²	92	76.4 Å²	76.4	48%	0.482	42%	0.424	S	S	.	.	S	Bend	trans	-86.3	-10.2	176.5	-71.9	169.3	0	0	0	114.2	I1050 I1162	I1050-L1133 HydrophobicContact CD1-CD1 4Å; I1050-L1133 HydrophobicContact CG1-CD1 4.41Å; L1133-I1162 HydrophobicContact CD2-CD1 3.82Å
1134	Q	39.9	Very low	51.4	Low	156 Å²	156	78 Å²	78	73%	0.729	43%	0.431	S	S	*	.	S	Bend	trans	-119.1	129.4	-179.5	-84.5	176.8	-24.2	0	0	111	I1136	Q1134-I1136 PolarHBondContact O-N 3.32Å
1135	E	27.9	Very low	49.2	Very low	183 Å²	183	84.2 Å²	84.2	86%	0.855	46%	0.46	S	S	*	.			trans	-64.8	91.7	171.6	-69.6	-178.2	168.9	0	0	109.4
1136	I	28.4	Very low	46.6	Very low	140 Å²	140	91.1 Å²	91.1	72%	0.718	49%	0.492	S	S	*	.			trans	-82.7	123.9	167.5	-57.7	173.7	0	0	0	107.2	Q1134 C1138	Q1134-I1136 PolarHBondContact O-N 3.32Å; I1136-C1138 PolarHBondContact O-N 3.28Å
1137	P	27.2	Very low	44.1	Very low	113 Å²	113	98.6 Å²	98.6	73%	0.734	53%	0.531	S	S	*	.			trans	-66.4	122.2	-177.2	25.4	-31.4	0	0	0	110.2	S1139	P1137-S1139 PolarHBondContact O-N 2.79Å
1138	C	25.5	Very low	41.5	Very low	129 Å²	129	105 Å²	105	87%	0.872	57%	0.566	S	S	*	*			trans	-62.2	96.4	-176.4	-66.7	0	0	0	0	112.5	I1136	I1136-C1138 PolarHBondContact O-N 3.28Å
1139	S	25.6	Very low	39.3	Very low	102 Å²	102	112 Å²	112	71%	0.713	60%	0.603	S	S	*	*			trans	-87.9	126.2	152.1	54.8	0	0	0	0	108.4	P1137	P1137-S1139 PolarHBondContact O-N 2.79Å
1140	S	28.4	Very low	37.5	Very low	83 Å²	83	118.4 Å²	118.4	58%	0.58	64%	0.637	S	S	*	*			trans	52.6	84.9	157.9	56.5	0	0	0	0	116.9	E1142	S1140-E1142 VanDerWaalsContact C-N 3.29Å; S1140-E1142 PolarHBondContact O-N 3.18Å
1141	L	32.2	Very low	36.2	Very low	140 Å²	140	122 Å²	122	73%	0.733	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	15.9	170.7	-151.1	83.8	0	0	0	113.6
1142	E	30.5	Very low	36.1	Very low	161 Å²	161	124.1 Å²	124.1	75%	0.752	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-12.6	177.8	-73.3	-171.2	169.3	0	0	114.1	S1140 I1144	S1140-E1142 VanDerWaalsContact C-N 3.29Å; S1140-E1142 PolarHBondContact O-N 3.18Å; E1142-I1144 VanDerWaalsContact C-N 3.3Å; E1142-I1144 PolarHBondContact O-N 3.22Å
1143	D	30.2	Very low	36.8	Very low	134 Å²	134	123.5 Å²	123.5	72%	0.717	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-1.1	178.3	-71.6	-24.7	0	0	0	113.9
1144	I	32.8	Very low	38.3	Very low	119 Å²	119	122 Å²	122	61%	0.61	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.8	-14.3	-179	-61.3	179.3	0	0	0	112.7	E1142	E1142-I1144 VanDerWaalsContact C-N 3.3Å; E1142-I1144 PolarHBondContact O-N 3.22Å
1145	H	29	Very low	40.1	Very low	134 Å²	134	116.4 Å²	116.4	62%	0.62	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	-1.3	-176.1	-86.4	-59.7	0	0	0	116.5
1146	H	27.1	Very low	42.6	Very low	161 Å²	161	108 Å²	108	75%	0.745	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.3	57.7	177.4	-82	-22.1	0	0	0	113.6
1147	N	29.2	Very low	44.9	Very low	156 Å²	156	104.1 Å²	104.1	83%	0.834	56%	0.562	S	S	*	*			trans	-100.1	89.4	147.3	-94.1	-1.9	0	0	0	108.7	N1149	N1147-N1149 PolarHBondContact O-N 3.05Å; N1147-N1149 VanDerWaalsContact O-N 3.09Å
1148	N	32.4	Very low	47.2	Very low	135 Å²	135	98.8 Å²	98.8	72%	0.722	53%	0.528	S	S	*	.			trans	-57.7	103.9	153.1	-73.6	-34.7	0	0	0	107.2
1149	N	37.5	Very low	48.9	Very low	146 Å²	146	95 Å²	95	78%	0.781	50%	0.503	S	S	*	.	S	Bend		174	-11.4	127.7	-88.8	-11.3	0	0	0	116.9	N1147	N1147-N1149 PolarHBondContact O-N 3.05Å; N1147-N1149 VanDerWaalsContact O-N 3.09Å
1150	D	45.1	Very low	50.4	Low	138 Å²	138	95.7 Å²	95.7	74%	0.738	50%	0.498	S	S	*	.			trans	-107.6	92	-178.1	-65.8	-27.5	0	0	0	110.5	D1152	D1150-D1152 PolarHBondContact O-N 3.16Å
1151	D	54.7	Low	51.3	Low	78 Å²	78	92.7 Å²	92.7	42%	0.417	48%	0.477	S	S	.	.			trans	-61.4	24.3	173.4	-84	-31.1	0	0	0	113.2	L1125	L1125-D1151 WeakPolarHBondContact CD2-O 3.43Å
1152	D	65.4	Low	51.7	Low	57 Å²	57	89.9 Å²	89.9	31%	0.305	46%	0.462	S	S	.	.	S	Bend	trans	-104.2	-55.3	-155.6	-80.6	-7.2	0	0	0	114.6	K1101 D1150	K1101-D1152 HydrophobicContact CD-CB 4.08Å; K1101-D1152 VanDerWaalsContact CE-C 3.44Å; K1101-D1152 VanDerWaalsContact CE-CB 3.43Å; K1101-D1152 WeakPolarHBondContact CE-O 3.34Å; K1101-D1152 WeakPolarHBondContact CE-OD1 3.41Å; K1101-D1152 HydrophobicContact CG-CB 4.34Å; K1101-D1152 VanDerWaalsContact NZ-CG 3.35Å; K1101-D1152 IonicContact NZ-OD1 2.69Å; K1101-D1152 PolarHBondContact NZ-OD1 3.32Å; D1150-D1152 PolarHBondContact O-N 3.16Å
1153	I	74.6	Confident	52.3	Low	37 Å²	37	85.3 Å²	85.3	19%	0.19	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	129.9	-175.8	-53.6	-177.7	0	0	0	110.8	K1101 L1104 I1126 A1128	K1101-I1153 HydrophobicContact CB-CD1 4.41Å; K1101-I1153 HydrophobicContact CG-CD1 3.78Å; K1101-I1153 HydrophobicContact CG-CG1 3.72Å; L1104-I1153 HydrophobicContact CD1-CD1 4.5Å; I1126-I1153 HydrophobicContact CB-CG1 4.27Å; I1126-I1153 HydrophobicContact CB-CG2 4.45Å; I1126-I1153 HydrophobicContact CG2-CG2 4.41Å; I1126-I1153 WeakPolarHBondContact O-CA 3.45Å; A1128-I1153 HydrophobicContact CB-CG2 3.86Å
1154	Y	81.4	Confident	52.8	Low	60 Å²	60	87 Å²	87	24%	0.235	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	126.1	171.1	-168.4	-83.6	0	0	0	111.1	I1126 L1127 A1128 V1156 W1184	I1126-Y1154 PolarHBondContact O-N 3.33Å; L1127-Y1154 CarbonylContact C-O 3.59Å; L1127-Y1154 WeakPolarHBondContact CA-O 3.44Å; L1127-Y1154 HydrophobicContact CD1-CD1 3.56Å; L1127-Y1154 HydrophobicContact CD1-CG 4.13Å; A1128-Y1154 PolarHBondContact N-O 3.49Å; Y1154-V1156 HydrophobicContact CD1-CG2 3.87Å; Y1154-V1156 HydrophobicContact CE1-CG2 3.95Å; Y1154-W1184 HydrophobicContact CD2-CB 4.05Å; Y1154-W1184 AromaticContact CD2-CD1 3.78Å; Y1154-W1184 AromaticContact CD2-CD2 3.77Å; Y1154-W1184 HydrophobicContact CD2-CD2 3.77Å; Y1154-W1184 HydrophobicContact CD2-CE3 4.37Å; Y1154-W1184 AromaticContact CD2-CG 3.58Å; Y1154-W1184 HydrophobicContact CD2-CG 3.58Å; Y1154-W1184 HydrophobicContact CE2-CB 4.29Å; Y1154-W1184 HydrophobicContact CE2-CG 4.17Å; Y1154-W1184 HydrophobicContact CG-CB 4.41Å; Y1154-W1184 AromaticContact CG-CD2 3.93Å; Y1154-W1184 HydrophobicContact CG-CD2 3.93Å; Y1154-W1184 HydrophobicContact CG-CE3 4.05Å; Y1154-W1184 HydrophobicContact CG-CG 4.08Å
1155	L	77.5	Confident	53.6	Low	39 Å²	39	91.1 Å²	91.1	20%	0.204	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	115	-171.7	-129.6	144	0	0	0	110.9	I1099 A1128 T1130 H1157	I1099-L1155 HydrophobicContact CG2-CD1 4.27Å; A1128-L1155 HydrophobicContact CB-CG 4.21Å; A1128-L1155 CarbonylContact O-C 3.51Å; A1128-L1155 WeakPolarHBondContact O-CA 3.49Å; T1130-L1155 HydrophobicContact CG2-CD2 3.51Å; L1155-H1157 WeakPolarHBondContact CD2-NE2 3.38Å
1156	V	80.5	Confident	54.6	Low	5 Å²	5	91.7 Å²	91.7	3%	0.03	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	110.8	179.5	-178.8	0	0	0	0	109.3	L1127 A1128 V1129 T1130 Y1154 L1158 N1177	L1127-V1156 HydrophobicContact CD1-CG2 3.62Å; L1127-V1156 HydrophobicContact CD2-CG2 4.46Å; L1127-V1156 HydrophobicContact CG-CG2 4.1Å; A1128-V1156 PolarHBondContact O-N 3.09Å; V1129-V1156 WeakPolarHBondContact CA-O 3.37Å; V1129-V1156 HydrophobicContact CG2-CB 4.24Å; T1130-V1156 PolarHBondContact N-O 2.87Å; Y1154-V1156 HydrophobicContact CD1-CG2 3.87Å; Y1154-V1156 HydrophobicContact CE1-CG2 3.95Å; V1156-L1158 HydrophobicContact CG1-CD2 4.04Å; V1156-N1177 HydrophobicContact CG1-CB 4Å
1157	H	76.7	Confident	56.1	Low	59 Å²	59	93.7 Å²	93.7	27%	0.273	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	121	175.3	-79	-75	0	0	0	111.6	H1097 T1130 L1155 N1177	H1097-H1157 AromaticContact CD2-NE2 3.93Å; H1097-H1157 AromaticContact CE1-CD2 3.5Å; H1097-H1157 PolarHBondContact CE1-CD2 3.33Å; H1097-H1157 VanDerWaalsContact CE1-CD2 3.5Å; H1097-H1157 AromaticContact CE1-NE2 2.94Å; H1097-H1157 PolarHBondContact CE1-NE2 3.15Å; H1097-H1157 AromaticContact ND1-NE2 3.72Å; H1097-H1157 AromaticContact NE2-CD2 3.81Å; H1097-H1157 AromaticContact NE2-CE1 3.83Å; H1097-H1157 AromaticContact NE2-NE2 3.03Å; H1097-H1157 PolarHBondContact NE2-NE2 3.21Å; T1130-H1157 WeakPolarHBondContact CG2-CE1 3.34Å; T1130-H1157 WeakPolarHBondContact CG2-ND1 3.48Å; L1155-H1157 WeakPolarHBondContact CD2-NE2 3.38Å; H1157-N1177 PolarHBondContact O-ND2 3.03Å
1158	L	75.7	Confident	57.9	Low	2 Å²	2	88.7 Å²	88.7	1%	0.01	45%	0.446	C	S	.	.			trans	-104.2	98	172.5	-57.2	-176.8	0	0	0	108.8	I1057 W1060 V1129 T1130 C1131 V1156 W1174	I1057-L1158 HydrophobicContact CG2-CD1 3.79Å; W1060-L1158 HydrophobicContact CZ3-CD1 4.49Å; V1129-L1158 HydrophobicContact CG1-CD1 3.56Å; V1129-L1158 HydrophobicContact CG1-CG 3.86Å; T1130-L1158 PolarHBondContact O-N 3.1Å; C1131-L1158 WeakPolarHBondContact CA-O 3.48Å; C1131-L1158 PolarHBondContact SG-O 3.31Å; V1156-L1158 HydrophobicContact CG1-CD2 4.04Å; L1158-W1174 HydrophobicContact CB-CD2 4.25Å; L1158-W1174 HydrophobicContact CB-CZ2 4.06Å; L1158-W1174 HydrophobicContact CD1-CD2 4.32Å; L1158-W1174 HydrophobicContact CD1-CE3 4.24Å; L1158-W1174 HydrophobicContact CD1-CZ3 4.5Å; L1158-W1174 HydrophobicContact CD2-CB 3.91Å; L1158-W1174 HydrophobicContact CD2-CD2 4.12Å; L1158-W1174 HydrophobicContact CD2-CG 3.74Å; L1158-W1174 HydrophobicContact CG-CD2 4.46Å
1159	S	61.6	Low	59.6	Low	49 Å²	49	87.5 Å²	87.5	34%	0.343	44%	0.437	S	S	.	.			trans	-93.6	155.9	177.2	54.9	0	0	0	0	112.3	W1174	S1159-W1174 PolarHBondContact O-NE1 3.08Å; S1159-W1174 VanDerWaalsContact O-NE1 3.11Å
1160	N	56.3	Low	61.2	Low	116 Å²	116	80.8 Å²	80.8	62%	0.62	40%	0.401	S	S	*	.			trans	74	41.1	161.9	-59	-17.5	0	0	0	119.6
1161	S	46.5	Very low	62.5	Low	20 Å²	20	76.4 Å²	76.4	14%	0.14	38%	0.377	C	S	.	.			trans	-107.8	63.8	171.2	65.7	0	0	0	0	114	W1174	S1161-W1174 VanDerWaalsContact CB-CH2 3.4Å; S1161-W1174 VanDerWaalsContact CB-CZ2 3.43Å; S1161-W1174 WeakPolarHBondContact OG-CH2 3.35Å
1162	I	41.9	Very low	63.1	Low	81 Å²	81	75.6 Å²	75.6	42%	0.415	38%	0.376	S	S	.	.			trans	-142.5	106	174.2	-47.4	175.8	0	0	0	112.8	L1133 F1164	L1133-I1162 HydrophobicContact CD2-CD1 3.82Å; I1162-F1164 HydrophobicContact CG2-CD1 4.49Å; I1162-F1164 HydrophobicContact CG2-CD2 3.38Å; I1162-F1164 HydrophobicContact CG2-CE2 3.42Å; I1162-F1164 VanDerWaalsContact CG2-CE2 3.42Å; I1162-F1164 HydrophobicContact CG2-CG 3.96Å; I1162-F1164 HydrophobicContact CG2-CZ 4.02Å
1163	S	42.5	Very low	63.3	Low	65 Å²	65	79.9 Å²	79.9	46%	0.455	39%	0.392	S	S	.	.			trans	-109	104	145.1	50.5	0	0	0	0	107.3	E1165 Q1166	S1163-E1165 PolarHBondContact O-N 3.27Å; S1163-Q1166 PolarHBondContact O-N 3.49Å
1164	F	40.6	Very low	63.6	Low	171 Å²	171	78.3 Å²	78.3	75%	0.75	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.2	127.7	175.8	-78	-91.5	0	0	0	108.8	I1162	I1162-F1164 HydrophobicContact CG2-CD1 4.49Å; I1162-F1164 HydrophobicContact CG2-CD2 3.38Å; I1162-F1164 HydrophobicContact CG2-CE2 3.42Å; I1162-F1164 VanDerWaalsContact CG2-CE2 3.42Å; I1162-F1164 HydrophobicContact CG2-CG 3.96Å; I1162-F1164 HydrophobicContact CG2-CZ 4.02Å
1165	E	49.1	Very low	63.6	Low	204 Å²	204	76.4 Å²	76.4	95%	0.953	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.9	0.1	-179.4	-50.7	-173.8	164.9	0	0	118.3	S1163	S1163-E1165 PolarHBondContact O-N 3.27Å
1166	Q	50.1	Low	63.5	Low	147 Å²	147	79.2 Å²	79.2	69%	0.687	39%	0.393	S	S	*	.	S	Bend	trans	-115.1	156	178.3	-64.2	-176.6	-3.1	0	0	113.3	S1163	S1163-Q1166 PolarHBondContact O-N 3.49Å
1167	K	58.9	Low	63.4	Low	203 Å²	203	82 Å²	82	88%	0.883	41%	0.408	S	S	*	.			trans	-48.5	141.9	178.2	-71.6	178.3	177.3	177.4	0	110.5	Q1169	K1167-Q1169 PolarHBondContact O-N 3.16Å; K1167-Q1169 VanDerWaalsContact O-N 3.11Å
1168	F	67.5	Low	63.8	Low	50 Å²	50	79.3 Å²	79.3	22%	0.219	40%	0.395	C	S	.	.			trans	-54.8	116.2	175.7	173.1	-99.9	0	0	0	110.9	W1019 N1056 I1057 W1060 P1170 W1174	W1019-F1168 HydrophobicContact CH2-CD1 4.18Å; W1019-F1168 AromaticContact CH2-CE1 3.96Å; W1019-F1168 HydrophobicContact CH2-CE1 3.96Å; W1019-F1168 HydrophobicContact CZ2-CD1 4.09Å; W1019-F1168 HydrophobicContact CZ2-CE1 4.12Å; N1056-F1168 HydrophobicContact CB-CB 4.21Å; N1056-F1168 HydrophobicContact CB-CD1 3.75Å; N1056-F1168 HydrophobicContact CB-CD2 3.53Å; N1056-F1168 HydrophobicContact CB-CE1 3.86Å; N1056-F1168 HydrophobicContact CB-CE2 3.66Å; N1056-F1168 HydrophobicContact CB-CG 3.56Å; N1056-F1168 HydrophobicContact CB-CZ 3.8Å; I1057-F1168 HydrophobicContact CG1-CE2 4.08Å; I1057-F1168 HydrophobicContact CG1-CZ 4.11Å; W1060-F1168 HydrophobicContact CB-CE1 4.11Å; W1060-F1168 HydrophobicContact CB-CZ 4.36Å; F1168-P1170 HydrophobicContact CD1-CG 4.37Å; F1168-P1170 HydrophobicContact CE1-CB 4.41Å; F1168-P1170 HydrophobicContact CE1-CG 3.79Å; F1168-P1170 HydrophobicContact CZ-CG 4.38Å; F1168-W1174 HydrophobicContact CE2-CH2 4.3Å; F1168-W1174 HydrophobicContact CE2-CZ3 4.23Å; F1168-W1174 HydrophobicContact CZ-CH2 4.42Å; F1168-W1174 AromaticContact CZ-CZ3 3.89Å; F1168-W1174 HydrophobicContact CZ-CZ3 3.89Å
1169	Q	67.7	Low	64.1	Low	111 Å²	111	82.5 Å²	82.5	52%	0.519	41%	0.41	S	S	.	.			trans	-120.6	108.3	176.7	-164.4	171.9	10.2	0	0	108.9	D1015 K1167	D1015-Q1169 PolarHBondContact OD1-NE2 3.21Å; K1167-Q1169 PolarHBondContact O-N 3.16Å; K1167-Q1169 VanDerWaalsContact O-N 3.11Å
1170	P	70	Confident	65	Low	5 Å²	5	86.7 Å²	86.7	3%	0.032	42%	0.42	C	S	.	.			trans	-67.5	151.3	177	1	9.6	0	0	0	110.8	T1018 W1019 W1060 F1168 W1174	T1018-P1170 HydrophobicContact CG2-CB 3.62Å; T1018-P1170 HydrophobicContact CG2-CG 3.72Å; T1018-P1170 WeakPolarHBondContact CG2-O 3.42Å; W1019-P1170 HydrophobicContact CH2-CG 4.21Å; W1019-P1170 HydrophobicContact CZ2-CG 3.55Å; W1060-P1170 HydrophobicContact CD2-CB 4.43Å; W1060-P1170 HydrophobicContact CG-CB 4.21Å; W1060-P1170 HydrophobicContact CG-CG 4.09Å; F1168-P1170 HydrophobicContact CD1-CG 4.37Å; F1168-P1170 HydrophobicContact CE1-CB 4.41Å; F1168-P1170 HydrophobicContact CE1-CG 3.79Å; F1168-P1170 HydrophobicContact CZ-CG 4.38Å; P1170-W1174 HydrophobicContact CB-CD2 4.48Å; P1170-W1174 HydrophobicContact CB-CE3 3.62Å; P1170-W1174 HydrophobicContact CB-CZ3 3.76Å
1171	N	73.1	Confident	66.3	Low	45 Å²	45	81.2 Å²	81.2	24%	0.241	39%	0.39	C	S	.	.			trans	-81.2	133.7	174.4	-175.1	-31.7	0	0	0	109.9	F1173 W1174	N1171-F1173 PolarHBondContact O-N 3.34Å; N1171-F1173 VanDerWaalsContact O-N 3.08Å; N1171-F1173 WeakPolarHBondContact OD1-CD2 3.34Å; N1171-F1173 PolarHBondContact OD1-N 2.94Å; N1171-W1174 HydrophobicContact CB-CD2 4.25Å; N1171-W1174 HydrophobicContact CB-CG 4.1Å; N1171-W1174 VanDerWaalsContact O-CB 3.26Å; N1171-W1174 WeakPolarHBondContact O-CB 3.43Å; N1171-W1174 PolarHBondContact O-N 2.92Å
1172	P	67.6	Low	68.2	Low	61 Å²	61	80.6 Å²	80.6	40%	0.396	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50	-36.3	177.2	-26.9	30.5	0	0	0	114.2	W1174 S1175	P1172-W1174 PolarHBondContact O-N 3.35Å; P1172-S1175 PolarHBondContact O-N 3.17Å
1173	F	69.1	Low	70.1	Confident	147 Å²	147	79 Å²	79	65%	0.645	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-20.1	-179.1	-63.4	-66.4	0	0	0	113.7	N1171 S1175 M1176 N1177	N1171-F1173 PolarHBondContact O-N 3.34Å; N1171-F1173 VanDerWaalsContact O-N 3.08Å; N1171-F1173 WeakPolarHBondContact OD1-CD2 3.34Å; N1171-F1173 PolarHBondContact OD1-N 2.94Å; F1173-S1175 PolarHBondContact O-N 3.01Å; F1173-M1176 WeakPolarHBondContact O-CB 3.42Å; F1173-M1176 PolarHBondContact O-N 3.27Å; F1173-N1177 PolarHBondContact O-N 3.35Å
1174	W	81.8	Confident	72.2	Confident	4 Å²	4	78.3 Å²	78.3	2%	0.015	37%	0.368	C	S	.	.	H	α-helix	trans	-59.5	-33	176.2	-67.5	-1.5	0	0	0	112.2	I1057 W1060 L1158 S1159 S1161 F1168 P1170 N1171 P1172 M1176 N1177 L1178	I1057-W1174 HydrophobicContact CG1-CH2 4.37Å; I1057-W1174 HydrophobicContact CG1-CZ3 4.28Å; W1060-W1174 HydrophobicContact CD2-CE3 4.28Å; W1060-W1174 HydrophobicContact CE3-CE3 4.16Å; W1060-W1174 HydrophobicContact CH2-CB 3.45Å; W1060-W1174 VanDerWaalsContact CH2-CB 3.45Å; W1060-W1174 HydrophobicContact CZ2-CB 3.74Å; W1060-W1174 HydrophobicContact CZ3-CB 4.06Å; W1060-W1174 HydrophobicContact CZ3-CE3 4.32Å; L1158-W1174 HydrophobicContact CB-CD2 4.25Å; L1158-W1174 HydrophobicContact CB-CZ2 4.06Å; L1158-W1174 HydrophobicContact CD1-CD2 4.32Å; L1158-W1174 HydrophobicContact CD1-CE3 4.24Å; L1158-W1174 HydrophobicContact CD1-CZ3 4.5Å; L1158-W1174 HydrophobicContact CD2-CB 3.91Å; L1158-W1174 HydrophobicContact CD2-CD2 4.12Å; L1158-W1174 HydrophobicContact CD2-CG 3.74Å; L1158-W1174 HydrophobicContact CG-CD2 4.46Å; S1159-W1174 PolarHBondContact O-NE1 3.08Å; S1159-W1174 VanDerWaalsContact O-NE1 3.11Å; S1161-W1174 VanDerWaalsContact CB-CH2 3.4Å; S1161-W1174 VanDerWaalsContact CB-CZ2 3.43Å; S1161-W1174 WeakPolarHBondContact OG-CH2 3.35Å; F1168-W1174 HydrophobicContact CE2-CH2 4.3Å; F1168-W1174 HydrophobicContact CE2-CZ3 4.23Å; F1168-W1174 HydrophobicContact CZ-CH2 4.42Å; F1168-W1174 AromaticContact CZ-CZ3 3.89Å; F1168-W1174 HydrophobicContact CZ-CZ3 3.89Å; P1170-W1174 HydrophobicContact CB-CD2 4.48Å; P1170-W1174 HydrophobicContact CB-CE3 3.62Å; P1170-W1174 HydrophobicContact CB-CZ3 3.76Å; N1171-W1174 HydrophobicContact CB-CD2 4.25Å; N1171-W1174 HydrophobicContact CB-CG 4.1Å; N1171-W1174 VanDerWaalsContact O-CB 3.26Å; N1171-W1174 WeakPolarHBondContact O-CB 3.43Å; N1171-W1174 PolarHBondContact O-N 2.92Å; P1172-W1174 PolarHBondContact O-N 3.35Å; W1174-M1176 VanDerWaalsContact C-N 3.26Å; W1174-M1176 PolarHBondContact O-N 2.99Å; W1174-N1177 PolarHBondContact O-N 3.23Å; W1174-L1178 WeakPolarHBondContact O-CB 3.42Å; W1174-L1178 PolarHBondContact O-N 3.39Å
1175	S	80.2	Confident	74.2	Confident	20 Å²	20	70.1 Å²	70.1	14%	0.14	33%	0.333	C	S	.	.	H	α-helix	trans	-62.4	-36	177	-55.1	0	0	0	0	111.8	M1022 K1064 P1172 F1173 Q1179	M1022-S1175 WeakPolarHBondContact CE-O 3.41Å; K1064-S1175 VanDerWaalsContact CE-OG 3.32Å; K1064-S1175 WeakPolarHBondContact CE-OG 3.46Å; K1064-S1175 PolarHBondContact NZ-OG 3.06Å; P1172-S1175 PolarHBondContact O-N 3.17Å; F1173-S1175 PolarHBondContact O-N 3.01Å; S1175-Q1179 WeakPolarHBondContact O-CB 3.08Å; S1175-Q1179 PolarHBondContact O-N 3.21Å
1176	M	76.6	Confident	75.7	Confident	99 Å²	99	62.7 Å²	62.7	49%	0.488	30%	0.298	S	S	.	.	H	α-helix	trans	-71.1	-44.4	177.9	-71.7	-97.1	66.8	0	0	111.2	F1173 W1174 L1178 Q1179 Y1180	F1173-M1176 WeakPolarHBondContact O-CB 3.42Å; F1173-M1176 PolarHBondContact O-N 3.27Å; W1174-M1176 VanDerWaalsContact C-N 3.26Å; W1174-M1176 PolarHBondContact O-N 2.99Å; M1176-L1178 VanDerWaalsContact C-N 3.3Å; M1176-L1178 PolarHBondContact O-N 3Å; M1176-Q1179 HydrophobicContact CE-CB 4.36Å; M1176-Q1179 WeakPolarHBondContact O-CB 3.21Å; M1176-Q1179 PolarHBondContact O-N 3.48Å; M1176-Q1179 VanDerWaalsContact O-N 3.11Å; M1176-Y1180 HydrophobicContact CB-CE2 4.44Å; M1176-Y1180 WeakPolarHBondContact O-CD2 3.36Å; M1176-Y1180 PolarHBondContact O-N 3.47Å
1177	N	78.2	Confident	77.2	Confident	64 Å²	64	59.9 Å²	59.9	34%	0.342	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-40.2	177.9	-68.2	-3.3	0	0	0	111.6	V1156 H1157 F1173 W1174 Y1180 G1181	V1156-N1177 HydrophobicContact CG1-CB 4Å; H1157-N1177 PolarHBondContact O-ND2 3.03Å; F1173-N1177 PolarHBondContact O-N 3.35Å; W1174-N1177 PolarHBondContact O-N 3.23Å; N1177-Y1180 PolarHBondContact O-N 2.96Å; N1177-G1181 PolarHBondContact O-N 2.98Å
1178	L	84.4	Confident	78.2	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.01	25%	0.25	C	C	.	.	H	α-helix	trans	-64.8	-39.4	174.2	-172.1	63.4	0	0	0	111.6	M1022 W1060 I1061 K1064 L1065 L1127 W1174 M1176 Y1180 G1181 L1182	M1022-L1178 HydrophobicContact SD-CB 4.47Å; M1022-L1178 HydrophobicContact SD-CD2 3.85Å; M1022-L1178 HydrophobicContact SD-CG 4.31Å; W1060-L1178 HydrophobicContact CH2-CB 4.4Å; W1060-L1178 HydrophobicContact CH2-CD2 4.11Å; W1060-L1178 HydrophobicContact CZ3-CD2 4.1Å; I1061-L1178 HydrophobicContact CG1-CD2 4.48Å; K1064-L1178 HydrophobicContact CB-CD2 4.2Å; L1065-L1178 HydrophobicContact CD2-CD2 4.39Å; L1127-L1178 HydrophobicContact CD2-CD1 4.29Å; W1174-L1178 WeakPolarHBondContact O-CB 3.42Å; W1174-L1178 PolarHBondContact O-N 3.39Å; M1176-L1178 VanDerWaalsContact C-N 3.3Å; M1176-L1178 PolarHBondContact O-N 3Å; L1178-Y1180 PolarHBondContact O-N 2.92Å; L1178-G1181 PolarHBondContact O-N 3.48Å; L1178-L1182 HydrophobicContact CG-CD1 4.23Å; L1178-L1182 WeakPolarHBondContact O-CG 3.21Å; L1178-L1182 PolarHBondContact O-N 3.37Å
1179	Q	82.6	Confident	78.8	Confident	69 Å²	69	49.4 Å²	49.4	32%	0.322	24%	0.243	S	C	.	.	H	α-helix	trans	-62.3	-42.9	177.2	-174.4	66.6	34	0	0	111.9	M1022 S1175 M1176 G1181 L1182 S1183	M1022-Q1179 HydrophobicContact CE-CB 3.63Å; M1022-Q1179 HydrophobicContact CE-CG 4.31Å; S1175-Q1179 WeakPolarHBondContact O-CB 3.08Å; S1175-Q1179 PolarHBondContact O-N 3.21Å; M1176-Q1179 HydrophobicContact CE-CB 4.36Å; M1176-Q1179 WeakPolarHBondContact O-CB 3.21Å; M1176-Q1179 PolarHBondContact O-N 3.48Å; M1176-Q1179 VanDerWaalsContact O-N 3.11Å; Q1179-G1181 VanDerWaalsContact C-N 3.34Å; Q1179-G1181 PolarHBondContact O-N 3.25Å; Q1179-L1182 PolarHBondContact O-N 2.6Å; Q1179-S1183 WeakPolarHBondContact O-CB 3.41Å; Q1179-S1183 PolarHBondContact O-N 2.95Å
1180	Y	80.6	Confident	79.3	Confident	137 Å²	137	47.7 Å²	47.7	54%	0.537	24%	0.236	S	C	.	.	H	α-helix	trans	-62.3	-42.7	176.8	-72.2	-61.8	0	0	0	111.8	M1176 N1177 L1178 L1182 S1183 W1184	M1176-Y1180 HydrophobicContact CB-CE2 4.44Å; M1176-Y1180 WeakPolarHBondContact O-CD2 3.36Å; M1176-Y1180 PolarHBondContact O-N 3.47Å; N1177-Y1180 PolarHBondContact O-N 2.96Å; L1178-Y1180 PolarHBondContact O-N 2.92Å; Y1180-L1182 PolarHBondContact O-N 3.46Å; Y1180-S1183 PolarHBondContact O-N 2.83Å; Y1180-W1184 PolarHBondContact O-N 2.77Å
1181	G	82.9	Confident	79.6	Confident	0 Å²	0	53 Å²	53	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-61	-40.8	174.8	0	0	0	0	0	113.5	N1177 L1178 Q1179 W1184 I1185	N1177-G1181 PolarHBondContact O-N 2.98Å; L1178-G1181 PolarHBondContact O-N 3.48Å; Q1179-G1181 VanDerWaalsContact C-N 3.34Å; Q1179-G1181 PolarHBondContact O-N 3.25Å; G1181-W1184 WeakPolarHBondContact O-CB 3.37Å; G1181-W1184 PolarHBondContact O-N 3.24Å; G1181-I1185 PolarHBondContact O-N 3.3Å
1182	L	85.9	Confident	79.5	Confident	8 Å²	8	53.8 Å²	53.8	4%	0.042	26%	0.26	C	S	.	.	H	α-helix	trans	-69.8	-39.6	176.9	-68.9	168.5	0	0	0	112.6	M1022 L1033 L1065 I1090 L1178 Q1179 Y1180 W1184 I1185 E1186	M1022-L1182 HydrophobicContact CE-CD1 4.14Å; L1033-L1182 HydrophobicContact CD1-CD2 3.85Å; L1065-L1182 HydrophobicContact CD2-CD1 3.64Å; I1090-L1182 HydrophobicContact CD1-CD2 4.21Å; L1178-L1182 HydrophobicContact CG-CD1 4.23Å; L1178-L1182 WeakPolarHBondContact O-CG 3.21Å; L1178-L1182 PolarHBondContact O-N 3.37Å; Q1179-L1182 PolarHBondContact O-N 2.6Å; Y1180-L1182 PolarHBondContact O-N 3.46Å; L1182-W1184 PolarHBondContact O-N 3.16Å; L1182-I1185 HydrophobicContact CD2-CD1 4.45Å; L1182-I1185 PolarHBondContact O-N 3.2Å; L1182-E1186 PolarHBondContact O-N 3.42Å
1183	S	83.1	Confident	79.6	Confident	46 Å²	46	52.8 Å²	52.8	32%	0.322	25%	0.251	S	S	.	.	H	α-helix	trans	-60.7	-38.5	174.4	-165.9	0	0	0	0	111	Q1179 Y1180 E1186 D1187	Q1179-S1183 WeakPolarHBondContact O-CB 3.41Å; Q1179-S1183 PolarHBondContact O-N 2.95Å; Y1180-S1183 PolarHBondContact O-N 2.83Å; S1183-E1186 PolarHBondContact O-N 3.23Å; S1183-D1187 PolarHBondContact O-N 3.29Å
1184	W	86	Confident	79.7	Confident	51 Å²	51	49.3 Å²	49.3	19%	0.193	24%	0.239	C	C	.	.	H	α-helix	trans	-63.4	-43.9	174.9	176.1	85.1	0	0	0	112.4	L1125 Y1154 Y1180 G1181 L1182 E1186 D1187 C1188	L1125-W1184 HydrophobicContact CD2-CH2 4.23Å; Y1154-W1184 HydrophobicContact CD2-CB 4.05Å; Y1154-W1184 AromaticContact CD2-CD1 3.78Å; Y1154-W1184 AromaticContact CD2-CD2 3.77Å; Y1154-W1184 HydrophobicContact CD2-CD2 3.77Å; Y1154-W1184 HydrophobicContact CD2-CE3 4.37Å; Y1154-W1184 AromaticContact CD2-CG 3.58Å; Y1154-W1184 HydrophobicContact CD2-CG 3.58Å; Y1154-W1184 HydrophobicContact CE2-CB 4.29Å; Y1154-W1184 HydrophobicContact CE2-CG 4.17Å; Y1154-W1184 HydrophobicContact CG-CB 4.41Å; Y1154-W1184 AromaticContact CG-CD2 3.93Å; Y1154-W1184 HydrophobicContact CG-CD2 3.93Å; Y1154-W1184 HydrophobicContact CG-CE3 4.05Å; Y1154-W1184 HydrophobicContact CG-CG 4.08Å; Y1180-W1184 PolarHBondContact O-N 2.77Å; G1181-W1184 WeakPolarHBondContact O-CB 3.37Å; G1181-W1184 PolarHBondContact O-N 3.24Å; L1182-W1184 PolarHBondContact O-N 3.16Å; W1184-E1186 VanDerWaalsContact C-N 3.3Å; W1184-E1186 PolarHBondContact O-N 2.92Å; W1184-D1187 PolarHBondContact O-N 2.83Å; W1184-C1188 WeakPolarHBondContact O-CB 3.37Å; W1184-C1188 PolarHBondContact O-N 2.71Å; W1184-C1188 PolarHBondContact O-SG 3.11Å
1185	I	83.4	Confident	78.8	Confident	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-59.5	-44.4	174.5	-62.7	175.1	0	0	0	110.4	F1028 L1033 L1125 L1127 G1181 L1182 C1188 F1189	F1028-I1185 HydrophobicContact CE1-CG2 4.05Å; F1028-I1185 HydrophobicContact CZ-CB 4.45Å; F1028-I1185 HydrophobicContact CZ-CG2 4.36Å; L1033-I1185 HydrophobicContact CD2-CD1 3.74Å; L1033-I1185 HydrophobicContact CD2-CG2 4.19Å; L1125-I1185 HydrophobicContact CD1-CG2 4.41Å; L1127-I1185 HydrophobicContact CB-CD1 3.88Å; L1127-I1185 HydrophobicContact CB-CG1 4.49Å; L1127-I1185 HydrophobicContact CD2-CD1 4.28Å; G1181-I1185 PolarHBondContact O-N 3.3Å; L1182-I1185 HydrophobicContact CD2-CD1 4.45Å; L1182-I1185 PolarHBondContact O-N 3.2Å; I1185-C1188 PolarHBondContact O-N 2.99Å; I1185-F1189 WeakPolarHBondContact O-CB 3.29Å; I1185-F1189 PolarHBondContact O-N 3.35Å
1186	E	80.5	Confident	77.5	Confident	47 Å²	47	61 Å²	61	22%	0.22	29%	0.288	C	S	.	.	H	α-helix	trans	-60.2	-48	179	172.9	167.4	-160.1	0	0	111.7	S1025 I1027 F1028 L1182 S1183 W1184 F1189 M1190	S1025-E1186 WeakPolarHBondContact CB-OE1 3.36Å; S1025-E1186 WeakPolarHBondContact CB-OE2 3.46Å; S1025-E1186 PolarHBondContact OG-OE1 3.45Å; S1025-E1186 PolarHBondContact OG-OE2 3.3Å; I1027-E1186 HydrophobicContact CG2-CB 4.44Å; I1027-E1186 HydrophobicContact CG2-CG 4.01Å; F1028-E1186 HydrophobicContact CE2-CB 4.46Å; F1028-E1186 HydrophobicContact CZ-CB 4.02Å; L1182-E1186 PolarHBondContact O-N 3.42Å; S1183-E1186 PolarHBondContact O-N 3.23Å; W1184-E1186 VanDerWaalsContact C-N 3.3Å; W1184-E1186 PolarHBondContact O-N 2.92Å; E1186-F1189 PolarHBondContact O-N 3.44Å; E1186-M1190 HydrophobicContact CG-CG 4.5Å; E1186-M1190 VanDerWaalsContact O-CB 3.29Å; E1186-M1190 WeakPolarHBondContact O-CB 3.47Å; E1186-M1190 WeakPolarHBondContact O-CG 3.45Å; E1186-M1190 PolarHBondContact O-N 2.92Å
1187	D	80.3	Confident	76.2	Confident	89 Å²	89	60.8 Å²	60.8	48%	0.476	29%	0.288	S	S	.	.	H	α-helix	trans	-62.9	-45.7	179.9	-73.9	-20.9	0	0	0	111.7	S1183 W1184 K1191	S1183-D1187 PolarHBondContact O-N 3.29Å; W1184-D1187 PolarHBondContact O-N 2.83Å; D1187-K1191 WeakPolarHBondContact O-CB 3.28Å; D1187-K1191 VanDerWaalsContact O-CG 3.26Å; D1187-K1191 WeakPolarHBondContact O-CG 3.43Å; D1187-K1191 PolarHBondContact O-N 3.21Å
1188	C	80.4	Confident	74.4	Confident	12 Å²	12	65.3 Å²	65.3	8%	0.081	31%	0.307	C	S	.	.	H	α-helix	trans	-66.5	-42.3	178.3	-71.8	0	0	0	0	111.8	L1125 W1184 I1185 K1191 K1192	L1125-C1188 HydrophobicContact CD1-CB 3.78Å; L1125-C1188 HydrophobicContact CD2-CB 3.75Å; L1125-C1188 HydrophobicContact CG-CB 4.44Å; W1184-C1188 WeakPolarHBondContact O-CB 3.37Å; W1184-C1188 PolarHBondContact O-N 2.71Å; W1184-C1188 PolarHBondContact O-SG 3.11Å; I1185-C1188 PolarHBondContact O-N 2.99Å; C1188-K1191 PolarHBondContact O-N 2.96Å; C1188-K1192 PolarHBondContact O-N 3.48Å
1189	F	80.8	Confident	72	Confident	21 Å²	21	73.2 Å²	73.2	9%	0.092	34%	0.344	C	S	.	.	H	α-helix	trans	-67	-38.7	177.8	-173.2	-99.5	0	0	0	112.1	I1027 Y1031 S1087 L1125 I1185 E1186 K1192 M1193	I1027-F1189 HydrophobicContact CD1-CD1 3.87Å; I1027-F1189 HydrophobicContact CD1-CE1 4.39Å; I1027-F1189 HydrophobicContact CG1-CD1 4.44Å; Y1031-F1189 HydrophobicContact CD1-CE1 4.38Å; Y1031-F1189 AromaticContact CD1-CZ 3.94Å; Y1031-F1189 HydrophobicContact CD1-CZ 3.94Å; Y1031-F1189 AromaticContact CD2-CE1 3.54Å; Y1031-F1189 HydrophobicContact CD2-CE1 3.54Å; Y1031-F1189 AromaticContact CD2-CZ 3.96Å; Y1031-F1189 HydrophobicContact CD2-CZ 3.96Å; Y1031-F1189 HydrophobicContact CE2-CE1 4.16Å; Y1031-F1189 AromaticContact CG-CE1 3.68Å; Y1031-F1189 HydrophobicContact CG-CE1 3.68Å; Y1031-F1189 AromaticContact CG-CZ 3.61Å; Y1031-F1189 HydrophobicContact CG-CZ 3.61Å; S1087-F1189 WeakPolarHBondContact O-CD2 3.46Å; L1125-F1189 HydrophobicContact CD1-CB 4.01Å; I1185-F1189 WeakPolarHBondContact O-CB 3.29Å; I1185-F1189 PolarHBondContact O-N 3.35Å; E1186-F1189 PolarHBondContact O-N 3.44Å; F1189-K1192 WeakPolarHBondContact O-CB 2.98Å; F1189-K1192 PolarHBondContact O-N 3.3Å; F1189-M1193 HydrophobicContact CD1-CG 4.17Å; F1189-M1193 HydrophobicContact CE1-CE 3.59Å; F1189-M1193 HydrophobicContact CE1-CG 3.81Å; F1189-M1193 HydrophobicContact CE1-SD 4.23Å; F1189-M1193 HydrophobicContact CZ-CE 3.51Å; F1189-M1193 HydrophobicContact CZ-CG 4.25Å; F1189-M1193 PolarHBondContact O-N 3.04Å
1190	M	77.5	Confident	69.6	Low	74 Å²	74	74.9 Å²	74.9	37%	0.365	36%	0.359	S	S	.	.	H	α-helix	trans	-66.9	-40.8	175.2	-80.2	-61.6	-71.8	0	0	112.4	I1027 E1186 K1192 M1193 N1194	I1027-M1190 HydrophobicContact CD1-CG 3.42Å; I1027-M1190 VanDerWaalsContact CD1-CG 3.42Å; I1027-M1190 HydrophobicContact CD1-SD 3.23Å; I1027-M1190 WeakPolarHBondContact CD1-SD 3.22Å; I1027-M1190 HydrophobicContact CG1-SD 4.44Å; E1186-M1190 HydrophobicContact CG-CG 4.5Å; E1186-M1190 VanDerWaalsContact O-CB 3.29Å; E1186-M1190 WeakPolarHBondContact O-CB 3.47Å; E1186-M1190 WeakPolarHBondContact O-CG 3.45Å; E1186-M1190 PolarHBondContact O-N 2.92Å; M1190-K1192 PolarHBondContact O-N 3.33Å; M1190-M1193 PolarHBondContact O-N 2.83Å; M1190-N1194 WeakPolarHBondContact O-CB 3.48Å; M1190-N1194 PolarHBondContact O-N 3.11Å; M1190-N1194 PolarHBondContact O-ND2 3.06Å
1191	K	76	Confident	67.1	Low	116 Å²	116	77.5 Å²	77.5	50%	0.504	37%	0.373	S	S	.	.	H	α-helix	trans	-57.6	-41.1	171.6	-74.5	169.8	-175.6	174.1	0	110.9	D1187 C1188 R1195	D1187-K1191 WeakPolarHBondContact O-CB 3.28Å; D1187-K1191 VanDerWaalsContact O-CG 3.26Å; D1187-K1191 WeakPolarHBondContact O-CG 3.43Å; D1187-K1191 PolarHBondContact O-N 3.21Å; C1188-K1191 PolarHBondContact O-N 2.96Å; K1191-R1195 VanDerWaalsContact O-CG 3.32Å; K1191-R1195 WeakPolarHBondContact O-CG 3.34Å; K1191-R1195 PolarHBondContact O-N 3.2Å; K1191-R1195 VanDerWaalsContact O-N 3.1Å
1192	K	72.3	Confident	64.4	Low	62 Å²	62	85.6 Å²	85.6	27%	0.27	41%	0.411	S	S	.	.	H	α-helix	trans	-65.7	-46.7	176.7	-166.1	178.8	-175.5	-179.1	0	112.6	D1123 C1188 F1189 M1190 N1194 R1195 L1196	D1123-K1192 VanDerWaalsContact CG-CE 3.41Å; D1123-K1192 PolarHBondContact O-NZ 3.4Å; D1123-K1192 IonicContact OD1-NZ 3.78Å; D1123-K1192 WeakPolarHBondContact OD2-CE 3.4Å; D1123-K1192 IonicContact OD2-NZ 2.82Å; D1123-K1192 PolarHBondContact OD2-NZ 3.4Å; C1188-K1192 PolarHBondContact O-N 3.48Å; F1189-K1192 WeakPolarHBondContact O-CB 2.98Å; F1189-K1192 PolarHBondContact O-N 3.3Å; M1190-K1192 PolarHBondContact O-N 3.33Å; K1192-N1194 PolarHBondContact O-N 3.43Å; K1192-R1195 PolarHBondContact O-N 2.78Å; K1192-L1196 PolarHBondContact O-N 3.02Å; K1192-L1196 VanDerWaalsContact O-N 3.16Å
1193	M	68.8	Low	61.6	Low	41 Å²	41	92.6 Å²	92.6	20%	0.202	45%	0.448	C	S	.	.	H	α-helix	trans	-59.9	-43.1	174.9	-81.2	-117.1	158.8	0	0	112.6	Y1031 F1189 M1190 R1195 L1196 N1197	Y1031-M1193 HydrophobicContact CD1-CE 4.04Å; Y1031-M1193 HydrophobicContact CD2-CE 3.99Å; Y1031-M1193 HydrophobicContact CE1-CE 3.44Å; Y1031-M1193 VanDerWaalsContact CE1-CE 3.44Å; Y1031-M1193 HydrophobicContact CE2-CE 3.36Å; Y1031-M1193 HydrophobicContact CE2-SD 3.95Å; Y1031-M1193 HydrophobicContact CG-CE 4.29Å; Y1031-M1193 VanDerWaalsContact OH-CE 3.29Å; Y1031-M1193 WeakPolarHBondContact OH-CE 3.31Å; F1189-M1193 HydrophobicContact CD1-CG 4.17Å; F1189-M1193 HydrophobicContact CE1-CE 3.59Å; F1189-M1193 HydrophobicContact CE1-CG 3.81Å; F1189-M1193 HydrophobicContact CE1-SD 4.23Å; F1189-M1193 HydrophobicContact CZ-CE 3.51Å; F1189-M1193 HydrophobicContact CZ-CG 4.25Å; F1189-M1193 PolarHBondContact O-N 3.04Å; M1190-M1193 PolarHBondContact O-N 2.83Å; M1193-R1195 VanDerWaalsContact C-N 3.34Å; M1193-R1195 PolarHBondContact O-N 3.01Å; M1193-L1196 PolarHBondContact O-N 3.45Å; M1193-N1197 PolarHBondContact O-N 3.21Å
1194	N	70.2	Confident	58.8	Low	73 Å²	73	93.6 Å²	93.6	39%	0.39	47%	0.466	S	S	.	.	H	α-helix	trans	-66.7	-36.7	-179.9	-71.7	-19.2	0	0	0	111.6	M1190 K1192 L1196 N1197 H1198	M1190-N1194 WeakPolarHBondContact O-CB 3.48Å; M1190-N1194 PolarHBondContact O-N 3.11Å; M1190-N1194 PolarHBondContact O-ND2 3.06Å; K1192-N1194 PolarHBondContact O-N 3.43Å; N1194-L1196 VanDerWaalsContact C-N 3.34Å; N1194-L1196 PolarHBondContact O-N 3.27Å; N1194-N1197 PolarHBondContact O-N 3.23Å; N1194-H1198 WeakPolarHBondContact O-CB 3.36Å; N1194-H1198 PolarHBondContact O-CD2 3.47Å; N1194-H1198 PolarHBondContact O-N 2.94Å
1195	R	63.6	Low	55.8	Low	159 Å²	159	96.5 Å²	96.5	60%	0.6	49%	0.494	S	S	*	.	H	α-helix	trans	-60.9	-42.4	171.9	-72.5	173.3	-176.1	168.8	3.7	111.5	K1191 K1192 M1193 H1199	K1191-R1195 VanDerWaalsContact O-CG 3.32Å; K1191-R1195 WeakPolarHBondContact O-CG 3.34Å; K1191-R1195 PolarHBondContact O-N 3.2Å; K1191-R1195 VanDerWaalsContact O-N 3.1Å; K1192-R1195 PolarHBondContact O-N 2.78Å; M1193-R1195 VanDerWaalsContact C-N 3.34Å; M1193-R1195 PolarHBondContact O-N 3.01Å; R1195-H1199 PolarHBondContact O-CD2 3.49Å; R1195-H1199 VanDerWaalsContact O-CD2 3.24Å; R1195-H1199 PolarHBondContact O-N 3.4Å
1196	L	53.3	Low	53.1	Low	112 Å²	112	104.2 Å²	104.2	59%	0.586	54%	0.535	S	S	*	.	H	α-helix	trans	-67.7	-39.8	176.4	-78.1	155	0	0	0	112.9	K1192 M1193 N1194 H1199	K1192-L1196 PolarHBondContact O-N 3.02Å; K1192-L1196 VanDerWaalsContact O-N 3.16Å; M1193-L1196 PolarHBondContact O-N 3.45Å; N1194-L1196 VanDerWaalsContact C-N 3.34Å; N1194-L1196 PolarHBondContact O-N 3.27Å; L1196-H1199 PolarHBondContact O-N 3.19Å
1197	N	49.8	Very low	50.6	Low	93 Å²	93	106.5 Å²	106.5	50%	0.497	56%	0.562	S	S	.	*	H	α-helix	trans	-72.8	-34	179	-73	-22.9	0	0	0	112.7	M1193 N1194 H1199 T1200	M1193-N1197 PolarHBondContact O-N 3.21Å; N1194-N1197 PolarHBondContact O-N 3.23Å; N1197-H1199 PolarHBondContact O-N 3Å; N1197-T1200 PolarHBondContact O-N 3.36Å; N1197-T1200 VanDerWaalsContact O-N 3.13Å; N1197-T1200 PolarHBondContact O-OG1 3.19Å; N1197-T1200 VanDerWaalsContact O-OG1 3.13Å
1198	H	39.2	Very low	48	Very low	160 Å²	160	109.9 Å²	109.9	74%	0.741	58%	0.58	S	S	*	*	H	α-helix	trans	-67	-17.8	173.8	-83.8	-61.7	0	0	0	113.2	N1194	N1194-H1198 WeakPolarHBondContact O-CB 3.36Å; N1194-H1198 PolarHBondContact O-CD2 3.47Å; N1194-H1198 PolarHBondContact O-N 2.94Å
1199	H	35.3	Very low	45.3	Very low	168 Å²	168	115 Å²	115	78%	0.778	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-3.9	172.5	-81	-59.8	0	0	0	114.9	R1195 L1196 N1197	R1195-H1199 PolarHBondContact O-CD2 3.49Å; R1195-H1199 VanDerWaalsContact O-CD2 3.24Å; R1195-H1199 PolarHBondContact O-N 3.4Å; L1196-H1199 PolarHBondContact O-N 3.19Å; N1197-H1199 PolarHBondContact O-N 3Å
1200	T	32.3	Very low	42.5	Very low	104 Å²	104	123.1 Å²	123.1	64%	0.638	65%	0.649	S	S	*	*	S	Bend	trans	-109.5	2.5	-178.5	41.5	0	0	0	0	115.8	N1197	N1197-T1200 PolarHBondContact O-N 3.36Å; N1197-T1200 VanDerWaalsContact O-N 3.13Å; N1197-T1200 PolarHBondContact O-OG1 3.19Å; N1197-T1200 VanDerWaalsContact O-OG1 3.13Å
1201	F	27.9	Very low	40	Very low	191 Å²	191	129.7 Å²	129.7	84%	0.838	67%	0.671	S	S	*	*	S	Bend	trans	-123.1	65.4	172.2	-93.6	-85.4	0	0	0	112.1
1202	Q	25.7	Very low	37.4	Very low	171 Å²	171	128.8 Å²	128.8	80%	0.799	69%	0.685	S	S	*	*	S	Bend	trans	-166	106.8	144.7	-107.2	171.3	32.6	0	0	109
1203	N	27.2	Very low	35	Very low	154 Å²	154	133.8 Å²	133.8	82%	0.824	71%	0.714	S	S	*	*			trans	60.2	108.8	152.5	-54	-21.5	0	0	0	115.9
1204	G	23.6	Very low	32.7	Very low	68 Å²	68	136.5 Å²	136.5	70%	0.701	74%	0.737	S	S	*	*				84.9	100.7	57.8	0	0	0	0	0	109.4
1205	S	24.4	Very low	30.5	Very low	111 Å²	111	137.7 Å²	137.7	78%	0.776	75%	0.751	S	S	*	*			trans	81.3	113.1	165.5	74.9	0	0	0	0	119.3
1206	N	26.6	Very low	28.5	Very low	162 Å²	162	136.7 Å²	136.7	87%	0.866	76%	0.762	S	S	*	*			trans	53.3	103.9	140.3	-63.9	-10.1	0	0	0	118.8
1207	A	26.5	Very low	27.2	Very low	95 Å²	95	137.9 Å²	137.9	79%	0.785	78%	0.775	S	S	*	*				170.3	136.9	108	0	0	0	0	0	110.3
1208	N	25.6	Very low	26.1	Very low	160 Å²	160	137.8 Å²	137.8	86%	0.856	78%	0.782	S	S	*	*			trans	-40.3	121.4	180	-74.8	-40.8	0	0	0	115.1	K1210	N1208-K1210 PolarHBondContact O-N 2.9Å
1209	P	24.4	Very low	25.5	Very low	119 Å²	119	136.2 Å²	136.2	77%	0.773	79%	0.788	S	S	*	*			trans	-88.2	93.4	163.9	33.6	-25.7	0	0	0	108.4
1210	K	22.2	Very low	25.1	Very low	192 Å²	192	133.2 Å²	133.2	84%	0.835	79%	0.786	S	S	*	*			trans	-111.8	98.6	152.4	-91.5	-173.5	176.3	-179.3	0	107.8	N1208 A1212	N1208-K1210 PolarHBondContact O-N 2.9Å; K1210-A1212 PolarHBondContact O-N 3.26Å
1211	Y	25	Very low	25	Very low	213 Å²	213	133.8 Å²	133.8	84%	0.835	80%	0.795	S	S	*	*			trans	24.4	89.5	143.2	-65	-86.1	0	0	0	115.7
1212	A	21.9	Very low	25.3	Very low	96 Å²	96	128.6 Å²	128.6	79%	0.793	78%	0.78	S	S	*	*			trans	-111.3	78.2	153.3	0	0	0	0	0	107.7	K1210	K1210-A1212 PolarHBondContact O-N 3.26Å
1213	L	20.6	Very low	25.7	Very low	168 Å²	168	123.1 Å²	123.1	88%	0.88	76%	0.761	S	S	*	*			trans	-87.4	86.6	156.6	-98.7	159.3	0	0	0	106.4
1214	S	21.4	Very low	26.5	Very low	98 Å²	98	122.5 Å²	122.5	69%	0.685	76%	0.757	S	S	*	*			trans	-153.8	131.3	157.6	54.4	0	0	0	0	110.9
1215	S	23	Very low	27.4	Very low	98 Å²	98	123.8 Å²	123.8	69%	0.685	75%	0.752	S	S	*	*			trans	62.5	92.6	157.9	60.2	0	0	0	0	117.9
1216	T	23.3	Very low	28.4	Very low	137 Å²	137	123.4 Å²	123.4	84%	0.84	74%	0.738	S	S	*	*			trans	-130.5	76.3	133.8	51.4	0	0	0	0	109.1	S1218	T1216-S1218 PolarHBondContact O-N 2.79Å
1217	T	24.8	Very low	29	Very low	137 Å²	137	119 Å²	119	84%	0.84	71%	0.712	S	S	*	*			trans	-69.1	105.5	149.3	45.4	0	0	0	0	107.6
1218	S	26.5	Very low	30.1	Very low	92 Å²	92	118 Å²	118	64%	0.643	70%	0.697	S	S	*	*			trans	-152	83.6	161.6	57.1	0	0	0	0	109	T1216 S1220	T1216-S1218 PolarHBondContact O-N 2.79Å; S1218-S1220 PolarHBondContact O-N 3.13Å
1219	S	27.1	Very low	31.5	Very low	126 Å²	126	113.4 Å²	113.4	88%	0.881	68%	0.675	S	S	*	*			trans	11.5	88.3	142.4	59.5	0	0	0	0	116.8
1220	S	27.8	Very low	32.8	Very low	105 Å²	105	113 Å²	113	73%	0.734	67%	0.665	S	S	*	*			trans	-125.9	109.5	143.8	58.5	0	0	0	0	106.5	S1218 P1222	S1218-S1220 PolarHBondContact O-N 3.13Å; S1220-P1222 VanDerWaalsContact O-N 3.16Å
1221	S	28.8	Very low	34.1	Very low	117 Å²	117	107.4 Å²	107.4	82%	0.818	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-50.9	117.8	179.6	-24.1	0	0	0	0	109.1	S1223	S1221-S1223 PolarHBondContact O-N 3.37Å
1222	P	35.6	Very low	35.6	Very low	81 Å²	81	105.3 Å²	105.3	53%	0.526	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-64.3	136.8	-178.4	26.1	-31.4	0	0	0	108.5	S1220 E1226	S1220-P1222 VanDerWaalsContact O-N 3.16Å; P1222-E1226 HydrophobicContact CB-CB 4.41Å
1223	S	34.4	Very low	37.4	Very low	57 Å²	57	107.8 Å²	107.8	40%	0.399	62%	0.623	S	S	.	*	P	Polyproline II helix	trans	-57.2	144.2	-177.9	62.1	0	0	0	0	110.3	S1221 T1225 E1226 M1227	S1221-S1223 PolarHBondContact O-N 3.37Å; S1223-T1225 PolarHBondContact O-N 3.44Å; S1223-T1225 PolarHBondContact OG-OG1 2.73Å; S1223-E1226 PolarHBondContact N-OE2 2.94Å; S1223-E1226 PolarHBondContact O-N 3.35Å; S1223-E1226 PolarHBondContact OG-OE2 2.68Å; S1223-M1227 PolarHBondContact O-N 3.25Å
1224	N	43.9	Very low	39.1	Very low	140 Å²	140	102.2 Å²	102.2	75%	0.749	59%	0.594	S	S	*	*	H	α-helix	trans	-48.8	-30.9	-178.7	-97.2	-13.5	0	0	0	113.2	T1228	N1224-T1228 PolarHBondContact O-N 3.49Å; N1224-T1228 PolarHBondContact O-OG1 3.16Å
1225	T	42.5	Very low	41	Very low	95 Å²	95	100.9 Å²	100.9	58%	0.583	58%	0.577	S	S	*	*	H	α-helix	trans	-60.1	-49.1	173.4	28	0	0	0	0	113.1	S1223 M1227 T1228 T1229	S1223-T1225 PolarHBondContact O-N 3.44Å; S1223-T1225 PolarHBondContact OG-OG1 2.73Å; T1225-M1227 VanDerWaalsContact C-N 3.34Å; T1225-M1227 PolarHBondContact O-N 3.35Å; T1225-T1228 WeakPolarHBondContact CA-OG1 3.47Å; T1225-T1228 PolarHBondContact O-N 3.01Å; T1225-T1228 PolarHBondContact O-OG1 3.5Å; T1225-T1229 WeakPolarHBondContact O-CG2 3.46Å; T1225-T1229 PolarHBondContact O-N 2.9Å; T1225-T1229 PolarHBondContact O-OG1 3.42Å
1226	E	44.3	Very low	42.9	Very low	103 Å²	103	99.7 Å²	99.7	48%	0.481	57%	0.568	S	S	.	*	H	α-helix	trans	-64.6	-41.9	178.7	-70.6	171.1	151	0	0	111.1	P1222 S1223 T1228 T1229 L1230	P1222-E1226 HydrophobicContact CB-CB 4.41Å; S1223-E1226 PolarHBondContact N-OE2 2.94Å; S1223-E1226 PolarHBondContact O-N 3.35Å; S1223-E1226 PolarHBondContact OG-OE2 2.68Å; E1226-T1228 PolarHBondContact O-N 3.42Å; E1226-T1229 WeakPolarHBondContact CA-OG1 3.46Å; E1226-T1229 PolarHBondContact O-N 2.88Å; E1226-T1229 VanDerWaalsContact O-N 3.13Å; E1226-T1229 PolarHBondContact O-OG1 3.38Å; E1226-L1230 PolarHBondContact O-N 3.29Å
1227	M	39.7	Very low	44.8	Very low	69 Å²	69	98.3 Å²	98.3	34%	0.34	56%	0.555	S	S	.	*	H	α-helix	trans	-60.7	-44.4	176.2	-123.6	-78.6	-97.3	0	0	111.6	S1223 T1225 T1229 L1230 Y1231 F1292	S1223-M1227 PolarHBondContact O-N 3.25Å; T1225-M1227 VanDerWaalsContact C-N 3.34Å; T1225-M1227 PolarHBondContact O-N 3.35Å; M1227-T1229 VanDerWaalsContact C-N 3.35Å; M1227-T1229 PolarHBondContact O-N 2.89Å; M1227-L1230 PolarHBondContact O-N 3.47Å; M1227-Y1231 WeakPolarHBondContact O-CB 3.46Å; M1227-Y1231 PolarHBondContact O-N 3.34Å; M1227-F1292 HydrophobicContact CE-CZ 4.4Å; M1227-F1292 HydrophobicContact SD-CE1 3.98Å; M1227-F1292 HydrophobicContact SD-CE2 4.47Å; M1227-F1292 HydrophobicContact SD-CZ 3.46Å; M1227-F1292 WeakPolarHBondContact SD-CZ 3.49Å
1228	T	49.4	Very low	46.6	Very low	74 Å²	74	92.2 Å²	92.2	45%	0.454	52%	0.517	S	S	.	.	H	α-helix	trans	-65.3	-34.7	173.8	47.5	0	0	0	0	113.4	N1224 T1225 E1226 R1232	N1224-T1228 PolarHBondContact O-N 3.49Å; N1224-T1228 PolarHBondContact O-OG1 3.16Å; T1225-T1228 WeakPolarHBondContact CA-OG1 3.47Å; T1225-T1228 PolarHBondContact O-N 3.01Å; T1225-T1228 PolarHBondContact O-OG1 3.5Å; E1226-T1228 PolarHBondContact O-N 3.42Å; T1228-R1232 WeakPolarHBondContact O-CB 3.27Å; T1228-R1232 PolarHBondContact O-N 2.93Å
1229	T	55.9	Low	48.4	Very low	64 Å²	64	91.2 Å²	91.2	39%	0.393	51%	0.505	S	S	.	.	H	α-helix	trans	-70.1	-40.3	176.5	57.1	0	0	0	0	112.5	T1225 E1226 M1227 R1232 K1233	T1225-T1229 WeakPolarHBondContact O-CG2 3.46Å; T1225-T1229 PolarHBondContact O-N 2.9Å; T1225-T1229 PolarHBondContact O-OG1 3.42Å; E1226-T1229 WeakPolarHBondContact CA-OG1 3.46Å; E1226-T1229 PolarHBondContact O-N 2.88Å; E1226-T1229 VanDerWaalsContact O-N 3.13Å; E1226-T1229 PolarHBondContact O-OG1 3.38Å; M1227-T1229 VanDerWaalsContact C-N 3.35Å; M1227-T1229 PolarHBondContact O-N 2.89Å; T1229-R1232 PolarHBondContact O-N 3.16Å; T1229-K1233 WeakPolarHBondContact O-CG 3.46Å; T1229-K1233 PolarHBondContact O-N 2.86Å
1230	L	50.1	Low	50.5	Low	110 Å²	110	90.1 Å²	90.1	58%	0.576	49%	0.486	S	S	*	.	H	α-helix	trans	-63.8	-43.6	173.5	-84.1	167.2	0	0	0	110.9	E1226 M1227 R1232 K1233 L1234	E1226-L1230 PolarHBondContact O-N 3.29Å; M1227-L1230 PolarHBondContact O-N 3.47Å; L1230-R1232 VanDerWaalsContact C-N 3.32Å; L1230-R1232 PolarHBondContact O-N 3.43Å; L1230-K1233 PolarHBondContact O-N 3.1Å; L1230-L1234 WeakPolarHBondContact O-CB 3.25Å; L1230-L1234 PolarHBondContact O-N 3.49Å
1231	Y	51	Low	52.6	Low	76 Å²	76	89 Å²	89	30%	0.298	47%	0.466	S	S	.	.	H	α-helix	trans	-59.9	-42.7	176.4	-163.1	-92.4	0	0	0	111.8	M1227 L1234 H1235 F1292 L1295	M1227-Y1231 WeakPolarHBondContact O-CB 3.46Å; M1227-Y1231 PolarHBondContact O-N 3.34Å; Y1231-L1234 PolarHBondContact O-N 2.96Å; Y1231-H1235 WeakPolarHBondContact O-CB 3.32Å; Y1231-H1235 PolarHBondContact O-N 3.39Å; Y1231-F1292 HydrophobicContact CD2-CE1 4.49Å; Y1231-L1295 HydrophobicContact CE2-CD2 3.89Å; Y1231-L1295 WeakPolarHBondContact OH-CD2 3.28Å
1232	R	56.5	Low	54.6	Low	169 Å²	169	83.9 Å²	83.9	64%	0.638	43%	0.429	S	S	*	.	H	α-helix	trans	-66.5	-41.5	178.3	-159.7	-177.7	-60.3	135	3	112.2	T1228 T1229 L1230 S1236	T1228-R1232 WeakPolarHBondContact O-CB 3.27Å; T1228-R1232 PolarHBondContact O-N 2.93Å; T1229-R1232 PolarHBondContact O-N 3.16Å; L1230-R1232 VanDerWaalsContact C-N 3.32Å; L1230-R1232 PolarHBondContact O-N 3.43Å; R1232-S1236 WeakPolarHBondContact O-CB 3.45Å; R1232-S1236 PolarHBondContact O-N 3.23Å
1233	K	59.9	Low	56.3	Low	148 Å²	148	81.6 Å²	81.6	64%	0.643	41%	0.413	S	S	*	.	H	α-helix	trans	-65	-42.9	175	-76.8	-177.7	176.9	-177	0	111.8	T1229 L1230 S1236 L1237	T1229-K1233 WeakPolarHBondContact O-CG 3.46Å; T1229-K1233 PolarHBondContact O-N 2.86Å; L1230-K1233 PolarHBondContact O-N 3.1Å; K1233-S1236 PolarHBondContact O-N 3.23Å; K1233-L1237 WeakPolarHBondContact O-CG 3.39Å; K1233-L1237 PolarHBondContact O-N 3.13Å
1234	L	55.7	Low	58	Low	50 Å²	50	82.8 Å²	82.8	26%	0.262	41%	0.414	S	S	.	.	H	α-helix	trans	-65.1	-43.9	178	-167.4	76	0	0	0	111.2	L1230 Y1231 S1236 L1237 I1238 L1296	L1230-L1234 WeakPolarHBondContact O-CB 3.25Å; L1230-L1234 PolarHBondContact O-N 3.49Å; Y1231-L1234 PolarHBondContact O-N 2.96Å; L1234-S1236 VanDerWaalsContact C-N 3.33Å; L1234-S1236 PolarHBondContact O-N 3.07Å; L1234-L1237 PolarHBondContact O-N 3.01Å; L1234-I1238 HydrophobicContact CG-CD1 4.19Å; L1234-I1238 VanDerWaalsContact O-CG1 3.31Å; L1234-I1238 WeakPolarHBondContact O-CG1 3.28Å; L1234-I1238 PolarHBondContact O-N 3.08Å; L1234-L1296 HydrophobicContact CD2-CD1 3.94Å
1235	H	60.5	Low	59.5	Low	70 Å²	70	78.5 Å²	78.5	32%	0.324	39%	0.393	S	S	.	.	H	α-helix	trans	-60.3	-44.1	175.9	-161.9	-63.8	0	0	0	111.4	Y1231 L1237 I1238 D1239	Y1231-H1235 WeakPolarHBondContact O-CB 3.32Å; Y1231-H1235 PolarHBondContact O-N 3.39Å; H1235-L1237 VanDerWaalsContact C-N 3.33Å; H1235-L1237 PolarHBondContact O-N 3.26Å; H1235-I1238 PolarHBondContact O-N 3.04Å; H1235-D1239 IonicContact CE1-OD1 3.12Å; H1235-D1239 IonicContact CE1-OD2 3.37Å; H1235-D1239 PolarHBondContact CE1-OD2 3.17Å; H1235-D1239 IonicContact ND1-OD1 3.67Å; H1235-D1239 IonicContact ND1-OD2 2.77Å; H1235-D1239 PolarHBondContact ND1-OD2 3.25Å; H1235-D1239 PolarHBondContact O-N 3.37Å
1236	S	62.6	Low	61.1	Low	73 Å²	73	74.4 Å²	74.4	51%	0.51	37%	0.367	S	S	.	.	H	α-helix	trans	-59.8	-41.4	175.8	-172.5	0	0	0	0	112.5	R1232 K1233 L1234 D1239 E1240	R1232-S1236 WeakPolarHBondContact O-CB 3.45Å; R1232-S1236 PolarHBondContact O-N 3.23Å; K1233-S1236 PolarHBondContact O-N 3.23Å; L1234-S1236 VanDerWaalsContact C-N 3.33Å; L1234-S1236 PolarHBondContact O-N 3.07Å; S1236-D1239 PolarHBondContact O-N 3.03Å; S1236-E1240 WeakPolarHBondContact O-CB 3.32Å; S1236-E1240 PolarHBondContact O-N 2.98Å
1237	L	63.3	Low	62.5	Low	109 Å²	109	69.9 Å²	69.9	57%	0.571	35%	0.346	S	S	*	.	H	α-helix	trans	-67.9	-37.2	177.1	-76.4	167.5	0	0	0	112.1	K1233 L1234 H1235 Y1241	K1233-L1237 WeakPolarHBondContact O-CG 3.39Å; K1233-L1237 PolarHBondContact O-N 3.13Å; L1234-L1237 PolarHBondContact O-N 3.01Å; H1235-L1237 VanDerWaalsContact C-N 3.33Å; H1235-L1237 PolarHBondContact O-N 3.26Å; L1237-Y1241 WeakPolarHBondContact O-CB 3.43Å; L1237-Y1241 PolarHBondContact O-N 3.1Å
1238	I	63.6	Low	64.2	Low	8 Å²	8	73.3 Å²	73.3	4%	0.041	36%	0.356	C	S	.	.	H	α-helix	trans	-67.1	-43.2	175.8	-68.2	169.9	0	0	0	110.4	L1234 H1235 Y1241 I1242 L1281 L1296 L1300	L1234-I1238 HydrophobicContact CG-CD1 4.19Å; L1234-I1238 VanDerWaalsContact O-CG1 3.31Å; L1234-I1238 WeakPolarHBondContact O-CG1 3.28Å; L1234-I1238 PolarHBondContact O-N 3.08Å; H1235-I1238 PolarHBondContact O-N 3.04Å; I1238-Y1241 PolarHBondContact O-N 3.13Å; I1238-I1242 HydrophobicContact CG2-CD1 3.8Å; I1238-I1242 HydrophobicContact CG2-CG1 4.45Å; I1238-I1242 VanDerWaalsContact O-CG1 3.3Å; I1238-I1242 WeakPolarHBondContact O-CG1 3.33Å; I1238-I1242 PolarHBondContact O-N 3.31Å; I1238-L1281 HydrophobicContact CD1-CD2 4.42Å; I1238-L1281 HydrophobicContact CG1-CD2 4.18Å; I1238-L1296 HydrophobicContact CD1-CD1 4.11Å; I1238-L1296 HydrophobicContact CD1-CD2 3.59Å; I1238-L1300 HydrophobicContact CD1-CD1 4.3Å; I1238-L1300 HydrophobicContact CG2-CD1 3.97Å
1239	D	64.5	Low	65.3	Low	72 Å²	72	72.4 Å²	72.4	39%	0.385	35%	0.351	S	S	.	.	H	α-helix	trans	-63	-42.6	176.9	-71.5	-30.3	0	0	0	111.5	H1235 S1236 Y1241 I1242 D1243	H1235-D1239 IonicContact CE1-OD1 3.12Å; H1235-D1239 IonicContact CE1-OD2 3.37Å; H1235-D1239 PolarHBondContact CE1-OD2 3.17Å; H1235-D1239 IonicContact ND1-OD1 3.67Å; H1235-D1239 IonicContact ND1-OD2 2.77Å; H1235-D1239 PolarHBondContact ND1-OD2 3.25Å; H1235-D1239 PolarHBondContact O-N 3.37Å; S1236-D1239 PolarHBondContact O-N 3.03Å; D1239-Y1241 VanDerWaalsContact C-N 3.35Å; D1239-I1242 PolarHBondContact O-N 3.22Å; D1239-D1243 WeakPolarHBondContact O-CB 3.26Å; D1239-D1243 PolarHBondContact O-N 2.88Å
1240	E	70.5	Confident	65.9	Low	103 Å²	103	70.1 Å²	70.1	48%	0.481	34%	0.336	S	S	.	.	H	α-helix	trans	-63	-42	175.2	-172.4	173.9	-168.5	0	0	111.5	S1236 D1243 I1244	S1236-E1240 WeakPolarHBondContact O-CB 3.32Å; S1236-E1240 PolarHBondContact O-N 2.98Å; E1240-D1243 PolarHBondContact O-N 3.11Å; E1240-I1244 HydrophobicContact CG-CD1 3.85Å; E1240-I1244 WeakPolarHBondContact O-CB 3.37Å; E1240-I1244 VanDerWaalsContact O-CG1 3.28Å; E1240-I1244 WeakPolarHBondContact O-CG1 3.42Å; E1240-I1244 PolarHBondContact O-N 3.41Å
1241	Y	73	Confident	66.7	Low	82 Å²	82	66.6 Å²	66.6	32%	0.322	32%	0.323	S	S	.	.	H	α-helix	trans	-62.4	-44	175.2	-175.3	-94.3	0	0	0	112	L1237 I1238 D1239 I1244 T1245 I1277 L1281	L1237-Y1241 WeakPolarHBondContact O-CB 3.43Å; L1237-Y1241 PolarHBondContact O-N 3.1Å; I1238-Y1241 PolarHBondContact O-N 3.13Å; D1239-Y1241 VanDerWaalsContact C-N 3.35Å; Y1241-I1244 PolarHBondContact O-N 3.32Å; Y1241-T1245 HydrophobicContact CD1-CG2 4.28Å; Y1241-T1245 HydrophobicContact CD2-CG2 4.15Å; Y1241-T1245 HydrophobicContact CE1-CG2 3.97Å; Y1241-T1245 HydrophobicContact CE2-CG2 3.8Å; Y1241-T1245 HydrophobicContact CG-CG2 4.4Å; Y1241-T1245 WeakPolarHBondContact O-CB 3.29Å; Y1241-T1245 WeakPolarHBondContact O-CG2 3.39Å; Y1241-T1245 PolarHBondContact O-N 3.37Å; Y1241-T1245 PolarHBondContact O-OG1 2.87Å; Y1241-I1277 HydrophobicContact CD1-CG2 4.42Å; Y1241-I1277 HydrophobicContact CE1-CG2 3.84Å; Y1241-L1281 HydrophobicContact CD1-CD1 3.22Å; Y1241-L1281 HydrophobicContact CD2-CD1 4.39Å; Y1241-L1281 HydrophobicContact CE1-CB 4.24Å; Y1241-L1281 HydrophobicContact CE1-CD1 3.57Å; Y1241-L1281 HydrophobicContact CG-CD1 3.66Å
1242	I	69.5	Low	67.6	Low	8 Å²	8	67.8 Å²	67.8	4%	0.041	33%	0.334	C	S	.	.	H	α-helix	trans	-65.7	-39.1	176.7	-66.4	165.4	0	0	0	110.8	I1238 D1239 L1246 L1247 Y1274 I1278 I1442	I1238-I1242 HydrophobicContact CG2-CD1 3.8Å; I1238-I1242 HydrophobicContact CG2-CG1 4.45Å; I1238-I1242 VanDerWaalsContact O-CG1 3.3Å; I1238-I1242 WeakPolarHBondContact O-CG1 3.33Å; I1238-I1242 PolarHBondContact O-N 3.31Å; D1239-I1242 PolarHBondContact O-N 3.22Å; I1242-L1246 WeakPolarHBondContact O-CA 3.39Å; I1242-L1246 WeakPolarHBondContact O-CB 3.35Å; I1242-L1246 PolarHBondContact O-N 3.32Å; I1242-L1247 HydrophobicContact CG2-CG 4.37Å; I1242-L1247 PolarHBondContact O-N 3.11Å; I1242-L1247 VanDerWaalsContact O-N 3.1Å; I1242-Y1274 HydrophobicContact CD1-CE2 4.43Å; I1242-Y1274 HydrophobicContact CG2-CE2 4.41Å; I1242-I1278 HydrophobicContact CD1-CD1 3.62Å; I1242-I1278 HydrophobicContact CG1-CD1 3.96Å; I1242-I1442 HydrophobicContact CG2-CG2 4.24Å
1243	D	70.7	Confident	68	Low	33 Å²	33	63.7 Å²	63.7	18%	0.176	33%	0.325	C	S	.	.	I	π-helix	trans	-62.4	-46.8	177.4	-172.6	58.9	0	0	0	111.3	D1239 E1240 L1247 R1248	D1239-D1243 WeakPolarHBondContact O-CB 3.26Å; D1239-D1243 PolarHBondContact O-N 2.88Å; E1240-D1243 PolarHBondContact O-N 3.11Å; D1243-L1247 PolarHBondContact O-N 2.96Å; D1243-R1248 PolarHBondContact O-N 3.36Å; D1243-R1248 IonicContact OD2-CZ 2.71Å; D1243-R1248 IonicContact OD2-NE 3.02Å; D1243-R1248 PolarHBondContact OD2-NE 3.48Å; D1243-R1248 IonicContact OD2-NH2 2.71Å; D1243-R1248 PolarHBondContact OD2-NH2 3.08Å; D1243-R1248 VanDerWaalsContact OD2-NH2 3.13Å
1244	I	71.9	Confident	68.2	Low	83 Å²	83	57 Å²	57	43%	0.426	30%	0.296	S	S	.	.	I	π-helix	trans	-71.3	-45.6	-178.5	-65.6	169.2	0	0	0	111.6	E1240 Y1241 P1249	E1240-I1244 HydrophobicContact CG-CD1 3.85Å; E1240-I1244 WeakPolarHBondContact O-CB 3.37Å; E1240-I1244 VanDerWaalsContact O-CG1 3.28Å; E1240-I1244 WeakPolarHBondContact O-CG1 3.42Å; E1240-I1244 PolarHBondContact O-N 3.41Å; Y1241-I1244 PolarHBondContact O-N 3.32Å; I1244-P1249 VanDerWaalsContact O-CD 3.22Å; I1244-P1249 WeakPolarHBondContact O-CD 3.09Å
1245	T	74.4	Confident	68.4	Low	49 Å²	49	60.5 Å²	60.5	30%	0.301	31%	0.312	S	S	.	.	I	π-helix	trans	-84.7	-25.2	-172.7	56.3	0	0	0	0	114.4	Y1241	Y1241-T1245 HydrophobicContact CD1-CG2 4.28Å; Y1241-T1245 HydrophobicContact CD2-CG2 4.15Å; Y1241-T1245 HydrophobicContact CE1-CG2 3.97Å; Y1241-T1245 HydrophobicContact CE2-CG2 3.8Å; Y1241-T1245 HydrophobicContact CG-CG2 4.4Å; Y1241-T1245 WeakPolarHBondContact O-CB 3.29Å; Y1241-T1245 WeakPolarHBondContact O-CG2 3.39Å; Y1241-T1245 PolarHBondContact O-N 3.37Å; Y1241-T1245 PolarHBondContact O-OG1 2.87Å
1246	L	75.9	Confident	68.6	Low	9 Å²	9	61 Å²	61	5%	0.047	32%	0.316	C	S	.	.	I	π-helix	trans	-121.5	-58.1	-178.3	-173.9	68.5	0	0	0	112.8	I1242 P1249 L1250 K1273 Y1274 I1277 F1438 I1442	I1242-L1246 WeakPolarHBondContact O-CA 3.39Å; I1242-L1246 WeakPolarHBondContact O-CB 3.35Å; I1242-L1246 PolarHBondContact O-N 3.32Å; L1246-P1249 WeakPolarHBondContact O-CD 3.36Å; L1246-L1250 WeakPolarHBondContact O-CB 3.45Å; L1246-L1250 PolarHBondContact O-N 2.95Å; L1246-K1273 HydrophobicContact CD1-CG 4.19Å; L1246-Y1274 HydrophobicContact CD2-CD2 3.6Å; L1246-Y1274 HydrophobicContact CD2-CG 4.27Å; L1246-I1277 HydrophobicContact CB-CD1 3.86Å; L1246-I1277 HydrophobicContact CD1-CD1 3.8Å; L1246-I1277 HydrophobicContact CG-CD1 4.3Å; L1246-F1438 HydrophobicContact CD2-CE1 4.4Å; L1246-I1442 HydrophobicContact CD2-CD1 4.14Å
1247	L	74.3	Confident	68.5	Low	9 Å²	9	61 Å²	61	5%	0.047	31%	0.305	C	S	.	.	I	π-helix	trans	-70.4	-43.4	-165.4	-60.9	177.8	0	0	0	113.6	I1242 D1243 L1250 A1251 Y1439 I1442	I1242-L1247 HydrophobicContact CG2-CG 4.37Å; I1242-L1247 PolarHBondContact O-N 3.11Å; I1242-L1247 VanDerWaalsContact O-N 3.1Å; D1243-L1247 PolarHBondContact O-N 2.96Å; L1247-L1250 PolarHBondContact O-N 3.24Å; L1247-A1251 WeakPolarHBondContact O-CB 3.34Å; L1247-A1251 PolarHBondContact O-N 2.89Å; L1247-Y1439 HydrophobicContact CB-CD2 4.47Å; L1247-Y1439 HydrophobicContact CB-CE2 3.87Å; L1247-Y1439 HydrophobicContact CD2-CD2 3.95Å; L1247-Y1439 HydrophobicContact CD2-CE2 4.12Å; L1247-Y1439 HydrophobicContact CG-CE2 4.48Å; L1247-I1442 HydrophobicContact CD1-CG2 4.18Å; L1247-I1442 HydrophobicContact CD2-CB 4.24Å; L1247-I1442 HydrophobicContact CD2-CD1 4.43Å; L1247-I1442 HydrophobicContact CD2-CG2 4.07Å
1248	R	74.3	Confident	68.1	Low	141 Å²	141	60.6 Å²	60.6	53%	0.532	30%	0.298	S	S	.	.	H	α-helix	trans	-64.7	-48	176.1	-71.4	-178.2	-160.9	-172.5	6.9	112.1	D1243 L1250 A1251 N1252	D1243-R1248 PolarHBondContact O-N 3.36Å; D1243-R1248 IonicContact OD2-CZ 2.71Å; D1243-R1248 IonicContact OD2-NE 3.02Å; D1243-R1248 PolarHBondContact OD2-NE 3.48Å; D1243-R1248 IonicContact OD2-NH2 2.71Å; D1243-R1248 PolarHBondContact OD2-NH2 3.08Å; D1243-R1248 VanDerWaalsContact OD2-NH2 3.13Å; R1248-L1250 VanDerWaalsContact C-N 3.29Å; R1248-L1250 PolarHBondContact O-N 2.88Å; R1248-A1251 PolarHBondContact O-N 3.01Å; R1248-N1252 PolarHBondContact O-N 3.25Å
1249	P	73	Confident	67.9	Low	55 Å²	55	66.7 Å²	66.7	36%	0.357	33%	0.33	S	S	.	.	H	α-helix	trans	-57.7	-40.6	171.9	-26.6	34.2	0	0	0	113	I1244 L1246 N1252 L1253	I1244-P1249 VanDerWaalsContact O-CD 3.22Å; I1244-P1249 WeakPolarHBondContact O-CD 3.09Å; L1246-P1249 WeakPolarHBondContact O-CD 3.36Å; P1249-N1252 PolarHBondContact O-N 3.37Å; P1249-L1253 WeakPolarHBondContact O-CB 3.36Å; P1249-L1253 WeakPolarHBondContact O-CG 3.49Å; P1249-L1253 PolarHBondContact O-N 3.34Å
1250	L	68.8	Low	67.3	Low	15 Å²	15	69.8 Å²	69.8	8%	0.079	34%	0.342	C	S	.	.	H	α-helix	trans	-66.9	-39.1	179.2	-157.8	84.5	0	0	0	112	L1246 L1247 R1248 L1253 S1254 L1270 L1435 F1438	L1246-L1250 WeakPolarHBondContact O-CB 3.45Å; L1246-L1250 PolarHBondContact O-N 2.95Å; L1247-L1250 PolarHBondContact O-N 3.24Å; R1248-L1250 VanDerWaalsContact C-N 3.29Å; R1248-L1250 PolarHBondContact O-N 2.88Å; L1250-L1253 PolarHBondContact O-N 3.25Å; L1250-S1254 WeakPolarHBondContact O-CB 3.42Å; L1250-S1254 PolarHBondContact O-N 3.36Å; L1250-L1270 HydrophobicContact CD1-CD2 3.65Å; L1250-L1270 HydrophobicContact CD2-CD2 4.46Å; L1250-L1435 HydrophobicContact CD1-CD1 3.8Å; L1250-L1435 HydrophobicContact CD2-CD1 4.04Å; L1250-L1435 HydrophobicContact CD2-CG 3.94Å; L1250-L1435 HydrophobicContact CG-CD1 3.79Å; L1250-L1435 HydrophobicContact CG-CD2 4.29Å; L1250-L1435 HydrophobicContact CG-CG 4.02Å; L1250-F1438 HydrophobicContact CD2-CD1 4.28Å
1251	A	66.5	Low	66.5	Low	37 Å²	37	67.3 Å²	67.3	31%	0.306	35%	0.345	S	S	.	.	H	α-helix	trans	-64.6	-45.6	175.7	0	0	0	0	0	111.3	L1247 R1248 S1254 E1255 Y1439	L1247-A1251 WeakPolarHBondContact O-CB 3.34Å; L1247-A1251 PolarHBondContact O-N 2.89Å; R1248-A1251 PolarHBondContact O-N 3.01Å; A1251-S1254 VanDerWaalsContact O-CB 3.22Å; A1251-S1254 WeakPolarHBondContact O-CB 3.4Å; A1251-S1254 PolarHBondContact O-N 2.82Å; A1251-E1255 PolarHBondContact O-N 2.8Å; A1251-Y1439 HydrophobicContact CB-CE2 4.32Å
1252	N	71.2	Confident	65.6	Low	100 Å²	100	68.1 Å²	68.1	54%	0.535	35%	0.354	S	S	.	.	H	α-helix	trans	-62.9	-43.1	175.2	-72.6	-5.7	0	0	0	111.5	R1248 P1249 S1254 E1255 I1256	R1248-N1252 PolarHBondContact O-N 3.25Å; P1249-N1252 PolarHBondContact O-N 3.37Å; N1252-S1254 VanDerWaalsContact C-N 3.33Å; N1252-S1254 PolarHBondContact O-N 3.17Å; N1252-E1255 PolarHBondContact O-N 2.8Å; N1252-I1256 VanDerWaalsContact O-CG1 3.25Å; N1252-I1256 WeakPolarHBondContact O-CG1 3.41Å; N1252-I1256 PolarHBondContact O-N 2.93Å
1253	L	63.5	Low	64.9	Low	83 Å²	83	71.3 Å²	71.3	44%	0.435	37%	0.373	S	S	.	.	H	α-helix	trans	-62.3	-39.5	173.8	-85	163.1	0	0	0	111.9	P1249 L1250 E1255 I1256 W1257	P1249-L1253 WeakPolarHBondContact O-CB 3.36Å; P1249-L1253 WeakPolarHBondContact O-CG 3.49Å; P1249-L1253 PolarHBondContact O-N 3.34Å; L1250-L1253 PolarHBondContact O-N 3.25Å; L1253-E1255 VanDerWaalsContact C-N 3.3Å; L1253-E1255 PolarHBondContact O-N 3.43Å; L1253-I1256 PolarHBondContact O-N 2.87Å; L1253-W1257 VanDerWaalsContact O-CB 3.31Å; L1253-W1257 WeakPolarHBondContact O-CB 3.32Å; L1253-W1257 VanDerWaalsContact O-CD1 3.24Å; L1253-W1257 PolarHBondContact O-N 2.93Å
1254	S	63.7	Low	64.6	Low	7 Å²	7	71 Å²	71	5%	0.049	37%	0.372	C	S	.	.	H	α-helix	trans	-56.8	-47.1	174.3	-163.4	0	0	0	0	111.1	L1250 A1251 N1252 W1257 K1258 L1435	L1250-S1254 WeakPolarHBondContact O-CB 3.42Å; L1250-S1254 PolarHBondContact O-N 3.36Å; A1251-S1254 VanDerWaalsContact O-CB 3.22Å; A1251-S1254 WeakPolarHBondContact O-CB 3.4Å; A1251-S1254 PolarHBondContact O-N 2.82Å; N1252-S1254 VanDerWaalsContact C-N 3.33Å; N1252-S1254 PolarHBondContact O-N 3.17Å; S1254-W1257 PolarHBondContact O-N 2.93Å; S1254-K1258 VanDerWaalsContact O-CB 3.23Å; S1254-K1258 WeakPolarHBondContact O-CB 3.25Å; S1254-K1258 WeakPolarHBondContact O-CD 3.46Å; S1254-K1258 WeakPolarHBondContact O-CG 3.49Å; S1254-K1258 PolarHBondContact O-N 2.99Å; S1254-K1258 VanDerWaalsContact OG-CE 3.3Å; S1254-K1258 WeakPolarHBondContact OG-CE 3.05Å; S1254-K1258 PolarHBondContact OG-NZ 3.34Å; S1254-L1435 WeakPolarHBondContact OG-CD2 3.42Å
1255	E	61.1	Low	64.3	Low	125 Å²	125	68.4 Å²	68.4	58%	0.584	36%	0.36	S	S	*	.	H	α-helix	trans	-66.6	-44.4	-178.4	-166	170.2	-167	0	0	111	A1251 N1252 L1253 W1257 K1258 L1259	A1251-E1255 PolarHBondContact O-N 2.8Å; N1252-E1255 PolarHBondContact O-N 2.8Å; L1253-E1255 VanDerWaalsContact C-N 3.3Å; L1253-E1255 PolarHBondContact O-N 3.43Å; E1255-W1257 PolarHBondContact O-N 3.44Å; E1255-K1258 PolarHBondContact O-N 2.96Å; E1255-L1259 HydrophobicContact CG-CD1 4.32Å; E1255-L1259 WeakPolarHBondContact O-CB 3.37Å; E1255-L1259 VanDerWaalsContact O-CG 3.26Å; E1255-L1259 WeakPolarHBondContact O-CG 3.39Å; E1255-L1259 PolarHBondContact O-N 2.96Å
1256	I	64.7	Low	63.9	Low	81 Å²	81	69 Å²	69	42%	0.415	37%	0.366	S	S	.	.	H	α-helix	trans	-61.5	-44.9	175.2	-66.6	165.8	0	0	0	111	N1252 L1253 L1259 H1260	N1252-I1256 VanDerWaalsContact O-CG1 3.25Å; N1252-I1256 WeakPolarHBondContact O-CG1 3.41Å; N1252-I1256 PolarHBondContact O-N 2.93Å; L1253-I1256 PolarHBondContact O-N 2.87Å; I1256-L1259 WeakPolarHBondContact O-CB 3.41Å; I1256-L1259 PolarHBondContact O-N 3.04Å; I1256-H1260 PolarHBondContact O-CD2 3.01Å; I1256-H1260 PolarHBondContact O-N 3Å
1257	W	59.7	Low	63.4	Low	73 Å²	73	69.4 Å²	69.4	28%	0.277	37%	0.369	S	S	.	.	H	α-helix	trans	-67.5	-40.2	179.7	-77.2	27.6	0	0	0	111.5	L1253 S1254 E1255 L1259 H1260 G1261 L1262 V1263 P1265	L1253-W1257 VanDerWaalsContact O-CB 3.31Å; L1253-W1257 WeakPolarHBondContact O-CB 3.32Å; L1253-W1257 VanDerWaalsContact O-CD1 3.24Å; L1253-W1257 PolarHBondContact O-N 2.93Å; S1254-W1257 PolarHBondContact O-N 2.93Å; E1255-W1257 PolarHBondContact O-N 3.44Å; W1257-L1259 VanDerWaalsContact C-N 3.34Å; W1257-L1259 PolarHBondContact O-N 3.15Å; W1257-H1260 CarbonylContact O-C 3.39Å; W1257-H1260 PolarHBondContact O-N 2.84Å; W1257-G1261 PolarHBondContact O-N 3.12Å; W1257-L1262 HydrophobicContact CB-CB 4.06Å; W1257-L1262 HydrophobicContact CD2-CB 4.21Å; W1257-L1262 HydrophobicContact CE3-CB 4.38Å; W1257-L1262 HydrophobicContact CG-CB 4.08Å; W1257-L1262 HydrophobicContact CG-CD1 4.24Å; W1257-L1262 PolarHBondContact O-N 2.96Å; W1257-V1263 WeakPolarHBondContact CZ3-O 3.39Å; W1257-P1265 HydrophobicContact CE3-CG 4.27Å; W1257-P1265 HydrophobicContact CH2-CB 4.3Å; W1257-P1265 HydrophobicContact CH2-CG 3.65Å; W1257-P1265 HydrophobicContact CZ3-CB 4.24Å; W1257-P1265 HydrophobicContact CZ3-CG 3.45Å; W1257-P1265 VanDerWaalsContact CZ3-CG 3.45Å
1258	K	56	Low	62.9	Low	99 Å²	99	72.8 Å²	72.8	43%	0.43	38%	0.383	S	S	.	.	H	α-helix	trans	-62.7	-39.5	172.9	-75.9	166.3	-179.5	158.1	0	111.8	S1254 E1255 H1260 G1261 N1436	S1254-K1258 VanDerWaalsContact O-CB 3.23Å; S1254-K1258 WeakPolarHBondContact O-CB 3.25Å; S1254-K1258 WeakPolarHBondContact O-CD 3.46Å; S1254-K1258 WeakPolarHBondContact O-CG 3.49Å; S1254-K1258 PolarHBondContact O-N 2.99Å; S1254-K1258 VanDerWaalsContact OG-CE 3.3Å; S1254-K1258 WeakPolarHBondContact OG-CE 3.05Å; S1254-K1258 PolarHBondContact OG-NZ 3.34Å; E1255-K1258 PolarHBondContact O-N 2.96Å; K1258-H1260 VanDerWaalsContact C-N 3.34Å; K1258-G1261 PolarHBondContact O-N 3.25Å; K1258-N1436 PolarHBondContact NZ-OD1 2.88Å
1259	L	58.8	Low	62.6	Low	136 Å²	136	69.1 Å²	69.1	71%	0.712	38%	0.379	S	S	*	.	H	α-helix	trans	-64.5	-37.4	175	-79.2	165.6	0	0	0	112	E1255 I1256 W1257	E1255-L1259 HydrophobicContact CG-CD1 4.32Å; E1255-L1259 WeakPolarHBondContact O-CB 3.37Å; E1255-L1259 VanDerWaalsContact O-CG 3.26Å; E1255-L1259 WeakPolarHBondContact O-CG 3.39Å; E1255-L1259 PolarHBondContact O-N 2.96Å; I1256-L1259 WeakPolarHBondContact O-CB 3.41Å; I1256-L1259 PolarHBondContact O-N 3.04Å; W1257-L1259 VanDerWaalsContact C-N 3.34Å; W1257-L1259 PolarHBondContact O-N 3.15Å
1260	H	52.6	Low	62.6	Low	138 Å²	138	67 Å²	67	64%	0.639	36%	0.364	S	S	*	.	H	α-helix	trans	-91.1	-1	179	-69.5	-63.5	0	0	0	114.5	I1256 W1257 K1258 L1262	I1256-H1260 PolarHBondContact O-CD2 3.01Å; I1256-H1260 PolarHBondContact O-N 3Å; W1257-H1260 CarbonylContact O-C 3.39Å; W1257-H1260 PolarHBondContact O-N 2.84Å; K1258-H1260 VanDerWaalsContact C-N 3.34Å; H1260-L1262 VanDerWaalsContact C-N 3.26Å; H1260-L1262 HydrophobicContact CB-CD1 4.06Å; H1260-L1262 HydrophobicContact CB-CG 3.97Å; H1260-L1262 PolarHBondContact O-N 2.83Å
1261	G	52.8	Low	62.7	Low	51 Å²	51	66.6 Å²	66.6	53%	0.526	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.2	25.5	-177.6	0	0	0	0	0	114.2	W1257 K1258	W1257-G1261 PolarHBondContact O-N 3.12Å; K1258-G1261 PolarHBondContact O-N 3.25Å
1262	L	53.4	Low	63	Low	99 Å²	99	68 Å²	68	52%	0.518	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-78.8	149.6	178.4	-63.3	172.1	0	0	0	110.8	W1257 H1260	W1257-L1262 HydrophobicContact CB-CB 4.06Å; W1257-L1262 HydrophobicContact CD2-CB 4.21Å; W1257-L1262 HydrophobicContact CE3-CB 4.38Å; W1257-L1262 HydrophobicContact CG-CB 4.08Å; W1257-L1262 HydrophobicContact CG-CD1 4.24Å; W1257-L1262 PolarHBondContact O-N 2.96Å; H1260-L1262 VanDerWaalsContact C-N 3.26Å; H1260-L1262 HydrophobicContact CB-CD1 4.06Å; H1260-L1262 HydrophobicContact CB-CG 3.97Å; H1260-L1262 PolarHBondContact O-N 2.83Å
1263	V	56.6	Low	63.3	Low	74 Å²	74	69 Å²	69	45%	0.448	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-79.4	138.9	-179.1	-176.1	0	0	0	0	110.1	W1257 N1430 L1431	W1257-V1263 WeakPolarHBondContact CZ3-O 3.39Å; V1263-N1430 WeakPolarHBondContact CG1-O 3.33Å; V1263-L1431 HydrophobicContact CG1-CD2 4.27Å; V1263-L1431 HydrophobicContact CG2-CD2 3.9Å
1264	D	64.2	Low	64.1	Low	28 Å²	28	66.2 Å²	66.2	15%	0.15	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-55.2	149.2	179.9	-80.4	1.7	0	0	0	112.8	P1433 N1434 L1435	D1264-P1433 VanDerWaalsContact OD2-C 3.27Å; D1264-P1433 WeakPolarHBondContact OD2-CA 3.48Å; D1264-N1434 HydrophobicContact CB-CB 4.48Å; D1264-N1434 PolarHBondContact OD2-N 3.43Å; D1264-L1435 HydrophobicContact CB-CB 4.24Å; D1264-L1435 VanDerWaalsContact OD2-CB 3.31Å; D1264-L1435 WeakPolarHBondContact OD2-CB 3.37Å; D1264-L1435 PolarHBondContact OD2-N 3.46Å; D1264-L1435 VanDerWaalsContact OD2-N 3.16Å
1265	P	64.8	Low	64.7	Low	28 Å²	28	66.8 Å²	66.8	18%	0.182	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-62.1	154.5	178.4	-13.1	25	0	0	0	111.2	W1257 L1270 N1434 L1435	W1257-P1265 HydrophobicContact CE3-CG 4.27Å; W1257-P1265 HydrophobicContact CH2-CB 4.3Å; W1257-P1265 HydrophobicContact CH2-CG 3.65Å; W1257-P1265 HydrophobicContact CZ3-CB 4.24Å; W1257-P1265 HydrophobicContact CZ3-CG 3.45Å; W1257-P1265 VanDerWaalsContact CZ3-CG 3.45Å; P1265-L1270 HydrophobicContact CB-CD2 4.27Å; P1265-L1270 HydrophobicContact CB-CG 4.23Å; P1265-L1270 HydrophobicContact CG-CD2 4.15Å; P1265-N1434 PolarHBondContact O-ND2 2.86Å; P1265-L1435 VanDerWaalsContact CD-CD1 3.47Å; P1265-L1435 HydrophobicContact CG-CD1 3.71Å
1266	S	66.2	Low	65.5	Low	60 Å²	60	63.3 Å²	63.3	42%	0.42	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-59.7	144.3	172.8	79	0	0	0	0	110.7	K1268 S1269 L1270	S1266-K1268 PolarHBondContact O-N 2.98Å; S1266-K1268 VanDerWaalsContact O-N 3.17Å; S1266-S1269 PolarHBondContact O-N 2.68Å; S1266-S1269 PolarHBondContact OG-N 3.02Å; S1266-S1269 PolarHBondContact OG-OG 2.89Å; S1266-S1269 VanDerWaalsContact OG-OG 3.09Å; S1266-L1270 PolarHBondContact O-N 3.26Å
1267	L	64.8	Low	66.2	Low	19 Å²	19	60.2 Å²	60.2	10%	0.099	32%	0.324	C	S	.	.	H	α-helix	trans	-53.9	-37.5	178	179.3	57.9	0	0	0	111.8	L1270 I1271 I1310 W1379 F1438	L1267-L1270 PolarHBondContact O-N 2.9Å; L1267-I1271 HydrophobicContact CD1-CD1 3.99Å; L1267-I1271 HydrophobicContact CD1-CG1 4.27Å; L1267-I1271 HydrophobicContact CD2-CD1 4.47Å; L1267-I1271 HydrophobicContact CG-CD1 3.83Å; L1267-I1271 WeakPolarHBondContact O-CG1 3.43Å; L1267-I1271 PolarHBondContact O-N 3.13Å; L1267-I1310 HydrophobicContact CD2-CD1 4.36Å; L1267-W1379 HydrophobicContact CD1-CH2 3.32Å; L1267-W1379 HydrophobicContact CD1-CZ2 3.57Å; L1267-W1379 HydrophobicContact CD1-CZ3 4.12Å; L1267-W1379 HydrophobicContact CD2-CH2 4.09Å; L1267-W1379 HydrophobicContact CD2-CZ2 3.79Å; L1267-W1379 HydrophobicContact CG-CH2 4.33Å; L1267-W1379 HydrophobicContact CG-CZ2 4.21Å; L1267-F1438 HydrophobicContact CD1-CD2 4.19Å
1268	K	63.4	Low	66.9	Low	79 Å²	79	56.8 Å²	56.8	34%	0.343	31%	0.311	S	S	.	.	H	α-helix	trans	-59.3	-48.9	176.6	-176.4	175.6	178	-174.7	0	112.2	S1266 L1270 I1271 D1272 L1311	S1266-K1268 PolarHBondContact O-N 2.98Å; S1266-K1268 VanDerWaalsContact O-N 3.17Å; K1268-L1270 PolarHBondContact O-N 2.9Å; K1268-I1271 PolarHBondContact O-N 2.77Å; K1268-D1272 WeakPolarHBondContact CG-OD2 3.49Å; K1268-D1272 WeakPolarHBondContact O-CB 3.24Å; K1268-D1272 PolarHBondContact O-N 2.72Å; K1268-L1311 HydrophobicContact CD-CD2 4.45Å
1269	S	69.4	Low	68	Low	65 Å²	65	55.5 Å²	55.5	46%	0.455	31%	0.308	S	S	.	.	H	α-helix	trans	-60.7	-34.3	179.1	-60.7	0	0	0	0	112.9	S1266 K1273	S1266-S1269 PolarHBondContact O-N 2.68Å; S1266-S1269 PolarHBondContact OG-N 3.02Å; S1266-S1269 PolarHBondContact OG-OG 2.89Å; S1266-S1269 VanDerWaalsContact OG-OG 3.09Å; S1269-K1273 WeakPolarHBondContact O-CB 3.36Å; S1269-K1273 PolarHBondContact O-N 3.33Å; S1269-K1273 VanDerWaalsContact O-N 3.12Å
1270	L	72.1	Confident	68.9	Low	9 Å²	9	53.1 Å²	53.1	5%	0.047	30%	0.296	C	S	.	.	H	α-helix	trans	-69.6	-44.9	177	-66.5	173.9	0	0	0	111.9	L1250 P1265 S1266 L1267 K1268 K1273 Y1274 N1434 L1435 F1438	L1250-L1270 HydrophobicContact CD1-CD2 3.65Å; L1250-L1270 HydrophobicContact CD2-CD2 4.46Å; P1265-L1270 HydrophobicContact CB-CD2 4.27Å; P1265-L1270 HydrophobicContact CB-CG 4.23Å; P1265-L1270 HydrophobicContact CG-CD2 4.15Å; S1266-L1270 PolarHBondContact O-N 3.26Å; L1267-L1270 PolarHBondContact O-N 2.9Å; K1268-L1270 PolarHBondContact O-N 2.9Å; L1270-K1273 PolarHBondContact O-N 2.95Å; L1270-Y1274 PolarHBondContact O-N 2.76Å; L1270-N1434 HydrophobicContact CD1-CB 4.44Å; L1270-L1435 HydrophobicContact CD1-CD1 4.26Å; L1270-L1435 HydrophobicContact CD2-CD1 3.87Å; L1270-F1438 HydrophobicContact CB-CD1 3.95Å; L1270-F1438 HydrophobicContact CB-CD2 4.19Å; L1270-F1438 HydrophobicContact CB-CE1 3.96Å; L1270-F1438 HydrophobicContact CB-CE2 4.22Å; L1270-F1438 HydrophobicContact CB-CG 4.05Å; L1270-F1438 HydrophobicContact CB-CZ 4.09Å; L1270-F1438 HydrophobicContact CD1-CB 3.96Å; L1270-F1438 HydrophobicContact CD1-CD1 4.31Å; L1270-F1438 HydrophobicContact CD1-CG 4.13Å; L1270-F1438 WeakPolarHBondContact O-CZ 3.43Å
1271	I	70.7	Confident	69.9	Low	8 Å²	8	47.2 Å²	47.2	4%	0.041	27%	0.269	C	S	.	.	H	α-helix	trans	-65.1	-46	177.1	-67.3	169.2	0	0	0	110.7	L1267 K1268 K1273 Y1274 H1275 L1302 I1310 F1438	L1267-I1271 HydrophobicContact CD1-CD1 3.99Å; L1267-I1271 HydrophobicContact CD1-CG1 4.27Å; L1267-I1271 HydrophobicContact CD2-CD1 4.47Å; L1267-I1271 HydrophobicContact CG-CD1 3.83Å; L1267-I1271 WeakPolarHBondContact O-CG1 3.43Å; L1267-I1271 PolarHBondContact O-N 3.13Å; K1268-I1271 PolarHBondContact O-N 2.77Å; I1271-K1273 VanDerWaalsContact C-N 3.27Å; I1271-K1273 PolarHBondContact O-N 2.79Å; I1271-Y1274 PolarHBondContact O-N 3.43Å; I1271-H1275 PolarHBondContact O-N 2.7Å; I1271-L1302 HydrophobicContact CG2-CD1 4.13Å; I1271-I1310 HydrophobicContact CD1-CD1 3.63Å; I1271-F1438 HydrophobicContact CG1-CD2 4.48Å; I1271-F1438 HydrophobicContact CG1-CE2 3.8Å
1272	D	73.6	Confident	70.8	Confident	66 Å²	66	45 Å²	45	35%	0.353	25%	0.245	S	C	.	.	H	α-helix	trans	-59.6	-40.3	179	-70	-16.3	0	0	0	110.9	K1268 S1276	K1268-D1272 WeakPolarHBondContact CG-OD2 3.49Å; K1268-D1272 WeakPolarHBondContact O-CB 3.24Å; K1268-D1272 PolarHBondContact O-N 2.72Å; D1272-S1276 WeakPolarHBondContact O-CB 3.3Å; D1272-S1276 PolarHBondContact O-N 2.77Å
1273	K	77.9	Confident	71.7	Confident	121 Å²	121	45 Å²	45	53%	0.526	25%	0.246	S	C	.	.	H	α-helix	trans	-69.6	-40.8	177.9	-169.4	58.6	175.8	174.5	0	112.4	L1246 S1269 L1270 I1271 S1276 I1277	L1246-K1273 HydrophobicContact CD1-CG 4.19Å; S1269-K1273 WeakPolarHBondContact O-CB 3.36Å; S1269-K1273 PolarHBondContact O-N 3.33Å; S1269-K1273 VanDerWaalsContact O-N 3.12Å; L1270-K1273 PolarHBondContact O-N 2.95Å; I1271-K1273 VanDerWaalsContact C-N 3.27Å; I1271-K1273 PolarHBondContact O-N 2.79Å; K1273-S1276 PolarHBondContact O-N 3.17Å; K1273-I1277 HydrophobicContact CG-CD1 4.44Å; K1273-I1277 WeakPolarHBondContact O-CG1 3.21Å; K1273-I1277 PolarHBondContact O-N 3.34Å
1274	Y	79.3	Confident	72.4	Confident	24 Å²	24	48 Å²	48	9%	0.094	26%	0.255	C	S	.	.	H	α-helix	trans	-60.7	-49.1	173.6	172.5	-99.5	0	0	0	111.3	I1242 L1246 L1270 I1271 S1276 I1277 I1278 L1300 L1302 F1438 I1442	I1242-Y1274 HydrophobicContact CD1-CE2 4.43Å; I1242-Y1274 HydrophobicContact CG2-CE2 4.41Å; L1246-Y1274 HydrophobicContact CD2-CD2 3.6Å; L1246-Y1274 HydrophobicContact CD2-CG 4.27Å; L1270-Y1274 PolarHBondContact O-N 2.76Å; I1271-Y1274 PolarHBondContact O-N 3.43Å; Y1274-S1276 PolarHBondContact O-N 3.17Å; Y1274-I1277 PolarHBondContact O-N 2.87Å; Y1274-I1277 VanDerWaalsContact O-N 3.13Å; Y1274-I1278 HydrophobicContact CD1-CG1 4.32Å; Y1274-I1278 HydrophobicContact CD2-CG1 4.33Å; Y1274-I1278 HydrophobicContact CE1-CG1 3.9Å; Y1274-I1278 HydrophobicContact CE2-CD1 4.04Å; Y1274-I1278 HydrophobicContact CE2-CG1 3.93Å; Y1274-I1278 WeakPolarHBondContact O-CG1 3.48Å; Y1274-I1278 PolarHBondContact O-N 3.08Å; Y1274-L1300 PolarHBondContact OH-O 3.04Å; Y1274-L1302 HydrophobicContact CD1-CD1 4.41Å; Y1274-L1302 HydrophobicContact CE1-CD1 4.5Å; Y1274-F1438 HydrophobicContact CG-CZ 4.32Å; Y1274-I1442 HydrophobicContact CD2-CD1 3.73Å; Y1274-I1442 HydrophobicContact CE2-CD1 4.04Å; Y1274-I1442 HydrophobicContact CG-CD1 4.33Å
1275	H	76.4	Confident	72.4	Confident	20 Å²	20	48.9 Å²	48.9	9%	0.093	26%	0.259	C	S	.	.	H	α-helix	trans	-60.1	-42	177.5	-75.4	175.8	0	0	0	113	I1271 I1277 I1278 L1279 L1302	I1271-H1275 PolarHBondContact O-N 2.7Å; H1275-I1277 VanDerWaalsContact C-N 3.28Å; H1275-I1277 PolarHBondContact O-N 2.87Å; H1275-I1278 PolarHBondContact O-N 2.82Å; H1275-L1279 WeakPolarHBondContact O-CB 3.12Å; H1275-L1279 WeakPolarHBondContact O-CG 3.48Å; H1275-L1279 PolarHBondContact O-N 3.5Å; H1275-L1302 VanDerWaalsContact NE2-CB 3.26Å; H1275-L1302 WeakPolarHBondContact NE2-CB 3.39Å; H1275-L1302 WeakPolarHBondContact NE2-CD1 3.4Å; H1275-L1302 WeakPolarHBondContact NE2-CG 3.49Å; H1275-L1302 PolarHBondContact NE2-N 3.1Å
1276	S	78.5	Confident	72	Confident	52 Å²	52	52 Å²	52	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-60.1	-38	176.1	174.8	0	0	0	0	112.4	D1272 K1273 Y1274 N1280	D1272-S1276 WeakPolarHBondContact O-CB 3.3Å; D1272-S1276 PolarHBondContact O-N 2.77Å; K1273-S1276 PolarHBondContact O-N 3.17Å; Y1274-S1276 PolarHBondContact O-N 3.17Å; S1276-N1280 WeakPolarHBondContact O-CB 3.45Å; S1276-N1280 PolarHBondContact O-N 3.41Å; S1276-N1280 VanDerWaalsContact O-N 3.14Å; S1276-N1280 PolarHBondContact O-ND2 2.79Å
1277	I	78.5	Confident	71.4	Confident	16 Å²	16	54.4 Å²	54.4	8%	0.082	29%	0.288	C	S	.	.	H	α-helix	trans	-70.4	-43.5	178	-67.6	170.2	0	0	0	110.9	Y1241 L1246 K1273 Y1274 H1275 N1280 L1281	Y1241-I1277 HydrophobicContact CD1-CG2 4.42Å; Y1241-I1277 HydrophobicContact CE1-CG2 3.84Å; L1246-I1277 HydrophobicContact CB-CD1 3.86Å; L1246-I1277 HydrophobicContact CD1-CD1 3.8Å; L1246-I1277 HydrophobicContact CG-CD1 4.3Å; K1273-I1277 HydrophobicContact CG-CD1 4.44Å; K1273-I1277 WeakPolarHBondContact O-CG1 3.21Å; K1273-I1277 PolarHBondContact O-N 3.34Å; Y1274-I1277 PolarHBondContact O-N 2.87Å; Y1274-I1277 VanDerWaalsContact O-N 3.13Å; H1275-I1277 VanDerWaalsContact C-N 3.28Å; H1275-I1277 PolarHBondContact O-N 2.87Å; I1277-N1280 PolarHBondContact O-N 3.07Å; I1277-L1281 PolarHBondContact O-N 3.22Å; I1277-L1281 VanDerWaalsContact O-N 3.07Å
1278	I	76	Confident	70.9	Confident	1 Å²	1	61 Å²	61	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-65.8	-43.6	178.6	-63.6	-61.7	0	0	0	111.6	I1242 Y1274 H1275 L1281 I1282 L1300 I1301	I1242-I1278 HydrophobicContact CD1-CD1 3.62Å; I1242-I1278 HydrophobicContact CG1-CD1 3.96Å; Y1274-I1278 HydrophobicContact CD1-CG1 4.32Å; Y1274-I1278 HydrophobicContact CD2-CG1 4.33Å; Y1274-I1278 HydrophobicContact CE1-CG1 3.9Å; Y1274-I1278 HydrophobicContact CE2-CD1 4.04Å; Y1274-I1278 HydrophobicContact CE2-CG1 3.93Å; Y1274-I1278 WeakPolarHBondContact O-CG1 3.48Å; Y1274-I1278 PolarHBondContact O-N 3.08Å; H1275-I1278 PolarHBondContact O-N 2.82Å; I1278-L1281 PolarHBondContact O-N 3.25Å; I1278-I1282 HydrophobicContact CG2-CD1 3.74Å; I1278-I1282 HydrophobicContact CG2-CG1 4.4Å; I1278-I1282 WeakPolarHBondContact O-CG1 3.15Å; I1278-I1282 PolarHBondContact O-N 3.47Å; I1278-L1300 HydrophobicContact CG2-CB 3.86Å; I1278-I1301 HydrophobicContact CG2-CG1 3.91Å
1279	L	78	Confident	70.7	Confident	72 Å²	72	60.7 Å²	60.7	38%	0.377	32%	0.322	S	S	.	.	H	α-helix	trans	-62.1	-44.4	177	-75.3	170.2	0	0	0	111.5	H1275 L1281 I1282 D1283 I1301	H1275-L1279 WeakPolarHBondContact O-CB 3.12Å; H1275-L1279 WeakPolarHBondContact O-CG 3.48Å; H1275-L1279 PolarHBondContact O-N 3.5Å; L1279-L1281 VanDerWaalsContact C-N 3.27Å; L1279-L1281 PolarHBondContact O-N 3.05Å; L1279-I1282 PolarHBondContact O-N 3.33Å; L1279-D1283 WeakPolarHBondContact O-CB 3.28Å; L1279-D1283 PolarHBondContact O-N 3.24Å; L1279-I1301 HydrophobicContact CD2-CD1 3.69Å; L1279-I1301 HydrophobicContact CG-CD1 4.47Å
1280	N	77.9	Confident	70.3	Confident	85 Å²	85	65.5 Å²	65.5	46%	0.455	34%	0.335	S	S	.	.	H	α-helix	trans	-59.6	-38.4	174.9	-76.5	-7.8	0	0	0	112.3	S1276 I1277 Q1284	S1276-N1280 WeakPolarHBondContact O-CB 3.45Å; S1276-N1280 PolarHBondContact O-N 3.41Å; S1276-N1280 VanDerWaalsContact O-N 3.14Å; S1276-N1280 PolarHBondContact O-ND2 2.79Å; I1277-N1280 PolarHBondContact O-N 3.07Å; N1280-Q1284 VanDerWaalsContact O-CG 3.31Å; N1280-Q1284 WeakPolarHBondContact O-CG 3.32Å; N1280-Q1284 PolarHBondContact O-N 2.94Å
1281	L	73.5	Confident	69.9	Low	14 Å²	14	71.1 Å²	71.1	7%	0.073	36%	0.359	C	S	.	.	H	α-helix	trans	-69.7	-40.2	176.9	-177.6	139.1	0	0	0	111.6	I1238 Y1241 I1277 I1278 L1279 Q1284 L1285	I1238-L1281 HydrophobicContact CD1-CD2 4.42Å; I1238-L1281 HydrophobicContact CG1-CD2 4.18Å; Y1241-L1281 HydrophobicContact CD1-CD1 3.22Å; Y1241-L1281 HydrophobicContact CD2-CD1 4.39Å; Y1241-L1281 HydrophobicContact CE1-CB 4.24Å; Y1241-L1281 HydrophobicContact CE1-CD1 3.57Å; Y1241-L1281 HydrophobicContact CG-CD1 3.66Å; I1277-L1281 PolarHBondContact O-N 3.22Å; I1277-L1281 VanDerWaalsContact O-N 3.07Å; I1278-L1281 PolarHBondContact O-N 3.25Å; L1279-L1281 VanDerWaalsContact C-N 3.27Å; L1279-L1281 PolarHBondContact O-N 3.05Å; L1281-Q1284 PolarHBondContact O-N 3.31Å; L1281-L1285 HydrophobicContact CD2-CD1 3.56Å; L1281-L1285 HydrophobicContact CG-CD1 4.26Å; L1281-L1285 VanDerWaalsContact O-CG 3.32Å; L1281-L1285 WeakPolarHBondContact O-CG 3.3Å; L1281-L1285 PolarHBondContact O-N 3.43Å
1282	I	71.2	Confident	69.3	Low	5 Å²	5	73.7 Å²	73.7	3%	0.026	37%	0.37	C	S	.	.	H	α-helix	trans	-65.2	-44.5	175.8	-69.8	166.5	0	0	0	110.6	I1278 L1279 Q1284 L1285 I1286 T1293 H1297 I1301	I1278-I1282 HydrophobicContact CG2-CD1 3.74Å; I1278-I1282 HydrophobicContact CG2-CG1 4.4Å; I1278-I1282 WeakPolarHBondContact O-CG1 3.15Å; I1278-I1282 PolarHBondContact O-N 3.47Å; L1279-I1282 PolarHBondContact O-N 3.33Å; I1282-Q1284 PolarHBondContact O-N 3.03Å; I1282-L1285 CarbonylContact O-C 3.57Å; I1282-L1285 WeakPolarHBondContact O-CA 3.42Å; I1282-L1285 PolarHBondContact O-N 3.33Å; I1282-I1286 HydrophobicContact CG2-CG1 4.43Å; I1282-I1286 WeakPolarHBondContact O-CG1 3.4Å; I1282-I1286 PolarHBondContact O-N 3.38Å; I1282-T1293 HydrophobicContact CG2-CG2 4.29Å; I1282-H1297 HydrophobicContact CD1-CB 4.17Å; I1282-I1301 HydrophobicContact CD1-CD1 3.73Å; I1282-I1301 HydrophobicContact CD1-CG1 4.07Å
1283	D	73.6	Confident	68.6	Low	98 Å²	98	71 Å²	71	52%	0.524	36%	0.356	S	S	.	.	H	α-helix	trans	-58.9	-36.3	178.6	-75.7	-19.1	0	0	0	112.1	L1279 L1285	L1279-D1283 WeakPolarHBondContact O-CB 3.28Å; L1279-D1283 PolarHBondContact O-N 3.24Å; D1283-L1285 VanDerWaalsContact C-N 3.31Å; D1283-L1285 PolarHBondContact O-N 3.43Å
1284	Q	69.7	Low	67.8	Low	139 Å²	139	69.5 Å²	69.5	65%	0.65	35%	0.354	S	S	*	.	H	α-helix	trans	-70	-25.7	173.3	-71.7	178.3	2.1	0	0	113.2	N1280 L1281 I1282 P1287	N1280-Q1284 VanDerWaalsContact O-CG 3.31Å; N1280-Q1284 WeakPolarHBondContact O-CG 3.32Å; N1280-Q1284 PolarHBondContact O-N 2.94Å; L1281-Q1284 PolarHBondContact O-N 3.31Å; I1282-Q1284 PolarHBondContact O-N 3.03Å; Q1284-P1287 WeakPolarHBondContact O-CD 3.43Å
1285	L	64.4	Low	66.9	Low	46 Å²	46	71.7 Å²	71.7	24%	0.241	37%	0.367	C	S	.	.	H	α-helix	trans	-92.7	-16.8	-178.5	-70.6	171.5	0	0	0	114.3	L1281 I1282 D1283 P1287 M1288 T1293 L1296	L1281-L1285 HydrophobicContact CD2-CD1 3.56Å; L1281-L1285 HydrophobicContact CG-CD1 4.26Å; L1281-L1285 VanDerWaalsContact O-CG 3.32Å; L1281-L1285 WeakPolarHBondContact O-CG 3.3Å; L1281-L1285 PolarHBondContact O-N 3.43Å; I1282-L1285 CarbonylContact O-C 3.57Å; I1282-L1285 WeakPolarHBondContact O-CA 3.42Å; I1282-L1285 PolarHBondContact O-N 3.33Å; D1283-L1285 VanDerWaalsContact C-N 3.31Å; D1283-L1285 PolarHBondContact O-N 3.43Å; L1285-P1287 VanDerWaalsContact C-N 3.29Å; L1285-M1288 WeakPolarHBondContact O-CB 3.4Å; L1285-M1288 PolarHBondContact O-N 3.14Å; L1285-T1293 HydrophobicContact CB-CG2 3.91Å; L1285-L1296 HydrophobicContact CD1-CD1 4.14Å
1286	I	57.9	Low	66.1	Low	92 Å²	92	71.1 Å²	71.1	47%	0.472	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.4	-38.2	179.2	-72.6	169.7	0	0	0	114.3	I1282 M1288 T1293	I1282-I1286 HydrophobicContact CG2-CG1 4.43Å; I1282-I1286 WeakPolarHBondContact O-CG1 3.4Å; I1282-I1286 PolarHBondContact O-N 3.38Å; I1286-M1288 PolarHBondContact O-N 3.42Å; I1286-M1288 VanDerWaalsContact O-N 3.14Å; I1286-T1293 HydrophobicContact CG1-CG2 4.09Å
1287	P	52.8	Low	65.3	Low	111 Å²	111	72.5 Å²	72.5	72%	0.721	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-18.4	179.6	-21	32.3	0	0	0	114.3	Q1284 L1285	Q1284-P1287 WeakPolarHBondContact O-CD 3.43Å; L1285-P1287 VanDerWaalsContact C-N 3.29Å
1288	M	55.1	Low	64.3	Low	157 Å²	157	78 Å²	78	77%	0.773	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.9	-41.3	-166.7	-74.1	-66.8	-65.5	0	0	114.3	L1285 I1286	L1285-M1288 WeakPolarHBondContact O-CB 3.4Å; L1285-M1288 PolarHBondContact O-N 3.14Å; I1286-M1288 PolarHBondContact O-N 3.42Å; I1286-M1288 VanDerWaalsContact O-N 3.14Å
1289	D	58.7	Low	63.4	Low	74 Å²	74	81.2 Å²	81.2	40%	0.396	42%	0.417	S	S	.	.			trans	-175.4	128.2	173.2	-168.9	-14.4	0	0	0	109.7	F1291 F1292 T1293	D1289-F1291 VanDerWaalsContact C-N 3.26Å; D1289-F1291 PolarHBondContact O-N 3.38Å; D1289-F1291 PolarHBondContact OD1-N 2.98Å; D1289-F1292 HydrophobicContact CB-CB 4.33Å; D1289-F1292 HydrophobicContact CB-CD2 3.97Å; D1289-F1292 PolarHBondContact O-N 2.95Å; D1289-F1292 WeakPolarHBondContact OD2-CD2 3.1Å; D1289-T1293 PolarHBondContact O-N 3.31Å; D1289-T1293 VanDerWaalsContact O-N 3.12Å; D1289-T1293 PolarHBondContact O-OG1 3.26Å
1290	K	61.9	Low	62.6	Low	165 Å²	165	78.9 Å²	78.9	72%	0.717	41%	0.405	S	S	*	.	H	α-helix	trans	-66.5	-28.3	-178.9	-157.5	173.9	-173.5	176.6	0	112.3	T1293 N1294	K1290-T1293 WeakPolarHBondContact CA-OG1 3.36Å; K1290-T1293 PolarHBondContact O-OG1 3.26Å; K1290-N1294 WeakPolarHBondContact O-CB 3.47Å; K1290-N1294 PolarHBondContact O-N 3.32Å; K1290-N1294 PolarHBondContact O-ND2 3.44Å
1291	F	61.9	Low	61.8	Low	128 Å²	128	76.8 Å²	76.8	56%	0.561	39%	0.393	S	S	*	.	H	α-helix	trans	-71.2	-48.3	178.3	-176.9	-96.2	0	0	0	111.6	D1289 N1294 L1295	D1289-F1291 VanDerWaalsContact C-N 3.26Å; D1289-F1291 PolarHBondContact O-N 3.38Å; D1289-F1291 PolarHBondContact OD1-N 2.98Å; F1291-N1294 PolarHBondContact O-N 3.38Å; F1291-L1295 HydrophobicContact CE1-CD1 3.96Å; F1291-L1295 HydrophobicContact CZ-CD1 4.15Å; F1291-L1295 PolarHBondContact O-N 3.21Å; F1291-L1295 VanDerWaalsContact O-N 3.08Å
1292	F	59.8	Low	61.1	Low	61 Å²	61	77.6 Å²	77.6	27%	0.268	40%	0.398	S	S	.	.	H	α-helix	trans	-64.7	-42.3	177.8	-83.9	-83.8	0	0	0	112.5	M1227 Y1231 D1289 N1294 L1295 L1296	M1227-F1292 HydrophobicContact CE-CZ 4.4Å; M1227-F1292 HydrophobicContact SD-CE1 3.98Å; M1227-F1292 HydrophobicContact SD-CE2 4.47Å; M1227-F1292 HydrophobicContact SD-CZ 3.46Å; M1227-F1292 WeakPolarHBondContact SD-CZ 3.49Å; Y1231-F1292 HydrophobicContact CD2-CE1 4.49Å; D1289-F1292 HydrophobicContact CB-CB 4.33Å; D1289-F1292 HydrophobicContact CB-CD2 3.97Å; D1289-F1292 PolarHBondContact O-N 2.95Å; D1289-F1292 WeakPolarHBondContact OD2-CD2 3.1Å; F1292-N1294 PolarHBondContact O-N 3.18Å; F1292-L1295 PolarHBondContact O-N 2.92Å; F1292-L1296 WeakPolarHBondContact O-CB 3.39Å; F1292-L1296 WeakPolarHBondContact O-CG 3.35Å; F1292-L1296 PolarHBondContact O-N 2.97Å
1293	T	58.1	Low	60.3	Low	10 Å²	10	80.1 Å²	80.1	6%	0.061	42%	0.416	C	S	.	.	H	α-helix	trans	-63.6	-40.3	177.1	29.2	0	0	0	0	112.2	I1282 L1285 I1286 D1289 K1290 L1295 L1296 H1297	I1282-T1293 HydrophobicContact CG2-CG2 4.29Å; L1285-T1293 HydrophobicContact CB-CG2 3.91Å; I1286-T1293 HydrophobicContact CG1-CG2 4.09Å; D1289-T1293 PolarHBondContact O-N 3.31Å; D1289-T1293 VanDerWaalsContact O-N 3.12Å; D1289-T1293 PolarHBondContact O-OG1 3.26Å; K1290-T1293 WeakPolarHBondContact CA-OG1 3.36Å; K1290-T1293 PolarHBondContact O-OG1 3.26Å; T1293-L1295 VanDerWaalsContact C-N 3.33Å; T1293-L1295 PolarHBondContact O-N 2.54Å; T1293-L1296 PolarHBondContact O-N 3.28Å; T1293-H1297 WeakPolarHBondContact O-CB 3.28Å; T1293-H1297 PolarHBondContact O-N 3.22Å
1294	N	61.7	Low	59.2	Low	90 Å²	90	81.8 Å²	81.8	48%	0.481	42%	0.42	S	S	.	.	H	α-helix	trans	-63.1	-38.5	174	-77.7	-17.9	0	0	0	112.5	K1290 F1291 F1292 N1298	K1290-N1294 WeakPolarHBondContact O-CB 3.47Å; K1290-N1294 PolarHBondContact O-N 3.32Å; K1290-N1294 PolarHBondContact O-ND2 3.44Å; F1291-N1294 PolarHBondContact O-N 3.38Å; F1292-N1294 PolarHBondContact O-N 3.18Å; N1294-N1298 WeakPolarHBondContact O-CB 3.29Å; N1294-N1298 PolarHBondContact O-N 3.49Å; N1294-N1298 PolarHBondContact O-ND2 3.14Å; N1294-N1298 VanDerWaalsContact O-ND2 3.13Å
1295	L	58.8	Low	58.2	Low	69 Å²	69	80.6 Å²	80.6	36%	0.361	42%	0.419	S	S	.	.	H	α-helix	trans	-69	-42.9	-179.8	-151.9	147.6	0	0	0	111.1	Y1231 F1291 F1292 T1293 N1298 S1299	Y1231-L1295 HydrophobicContact CE2-CD2 3.89Å; Y1231-L1295 WeakPolarHBondContact OH-CD2 3.28Å; F1291-L1295 HydrophobicContact CE1-CD1 3.96Å; F1291-L1295 HydrophobicContact CZ-CD1 4.15Å; F1291-L1295 PolarHBondContact O-N 3.21Å; F1291-L1295 VanDerWaalsContact O-N 3.08Å; F1292-L1295 PolarHBondContact O-N 2.92Å; T1293-L1295 VanDerWaalsContact C-N 3.33Å; T1293-L1295 PolarHBondContact O-N 2.54Å; L1295-N1298 PolarHBondContact O-N 2.72Å; L1295-S1299 PolarHBondContact O-N 3.18Å; L1295-S1299 VanDerWaalsContact O-N 3.11Å; L1295-S1299 PolarHBondContact O-OG 3.16Å
1296	L	61.1	Low	57.5	Low	8 Å²	8	78.9 Å²	78.9	4%	0.042	41%	0.41	C	S	.	.	H	α-helix	trans	-65.8	-42.6	173.7	-74.4	170.5	0	0	0	112.8	L1234 I1238 L1285 F1292 T1293 N1298 S1299 L1300	L1234-L1296 HydrophobicContact CD2-CD1 3.94Å; I1238-L1296 HydrophobicContact CD1-CD1 4.11Å; I1238-L1296 HydrophobicContact CD1-CD2 3.59Å; L1285-L1296 HydrophobicContact CD1-CD1 4.14Å; F1292-L1296 WeakPolarHBondContact O-CB 3.39Å; F1292-L1296 WeakPolarHBondContact O-CG 3.35Å; F1292-L1296 PolarHBondContact O-N 2.97Å; T1293-L1296 PolarHBondContact O-N 3.28Å; L1296-N1298 VanDerWaalsContact C-N 3.25Å; L1296-N1298 PolarHBondContact O-N 3.13Å; L1296-S1299 WeakPolarHBondContact CA-OG 3.48Å; L1296-S1299 PolarHBondContact O-N 3.06Å; L1296-S1299 VanDerWaalsContact O-N 3.16Å; L1296-S1299 PolarHBondContact O-OG 3.24Å; L1296-S1299 VanDerWaalsContact O-OG 3.11Å; L1296-L1300 HydrophobicContact CB-CD1 4.48Å; L1296-L1300 HydrophobicContact CD2-CD1 4.03Å; L1296-L1300 WeakPolarHBondContact O-CB 3.14Å; L1296-L1300 PolarHBondContact O-N 2.99Å
1297	H	61.5	Low	57.2	Low	81 Å²	81	76.4 Å²	76.4	38%	0.375	40%	0.397	S	S	.	.	H	α-helix	trans	-59.1	-39.7	176.4	-173	-70.7	0	0	0	110.9	I1282 T1293 I1301	I1282-H1297 HydrophobicContact CD1-CB 4.17Å; T1293-H1297 WeakPolarHBondContact O-CB 3.28Å; T1293-H1297 PolarHBondContact O-N 3.22Å; H1297-I1301 WeakPolarHBondContact CD2-CD1 3.41Å; H1297-I1301 VanDerWaalsContact NE2-CD1 3.29Å; H1297-I1301 WeakPolarHBondContact NE2-CD1 3.14Å; H1297-I1301 WeakPolarHBondContact O-CB 3.26Å; H1297-I1301 PolarHBondContact O-N 3.37Å
1298	N	56.7	Low	57.1	Low	131 Å²	131	75.5 Å²	75.5	70%	0.701	39%	0.386	S	S	*	.	H	α-helix	trans	-74.6	-26.2	177.3	-70.8	-25.3	0	0	0	113.9	N1294 L1295 L1296	N1294-N1298 WeakPolarHBondContact O-CB 3.29Å; N1294-N1298 PolarHBondContact O-N 3.49Å; N1294-N1298 PolarHBondContact O-ND2 3.14Å; N1294-N1298 VanDerWaalsContact O-ND2 3.13Å; L1295-N1298 PolarHBondContact O-N 2.72Å; L1296-N1298 VanDerWaalsContact C-N 3.25Å; L1296-N1298 PolarHBondContact O-N 3.13Å
1299	S	56.5	Low	56.7	Low	70 Å²	70	71.1 Å²	71.1	49%	0.49	37%	0.366	S	S	.	.	H	α-helix	trans	-89.2	-32.5	-179.4	62.3	0	0	0	0	114	L1295 L1296	L1295-S1299 PolarHBondContact O-N 3.18Å; L1295-S1299 VanDerWaalsContact O-N 3.11Å; L1295-S1299 PolarHBondContact O-OG 3.16Å; L1296-S1299 WeakPolarHBondContact CA-OG 3.48Å; L1296-S1299 PolarHBondContact O-N 3.06Å; L1296-S1299 VanDerWaalsContact O-N 3.16Å; L1296-S1299 PolarHBondContact O-OG 3.24Å; L1296-S1299 VanDerWaalsContact O-OG 3.11Å
1300	L	61.7	Low	56.2	Low	22 Å²	22	68.9 Å²	68.9	12%	0.115	35%	0.353	C	S	.	.	H	α-helix	trans	-102.8	-26.3	-169.1	-65	171.6	0	0	0	114.7	I1238 Y1274 I1278 L1296	I1238-L1300 HydrophobicContact CD1-CD1 4.3Å; I1238-L1300 HydrophobicContact CG2-CD1 3.97Å; Y1274-L1300 PolarHBondContact OH-O 3.04Å; I1278-L1300 HydrophobicContact CG2-CB 3.86Å; L1296-L1300 HydrophobicContact CB-CD1 4.48Å; L1296-L1300 HydrophobicContact CD2-CD1 4.03Å; L1296-L1300 WeakPolarHBondContact O-CB 3.14Å; L1296-L1300 PolarHBondContact O-N 2.99Å
1301	I	61.2	Low	55.2	Low	42 Å²	42	63.4 Å²	63.4	22%	0.215	33%	0.332	C	S	.	.	S	Bend	trans	-88.1	124.4	-179.4	-62.4	175	0	0	0	109.9	I1278 L1279 I1282 H1297	I1278-I1301 HydrophobicContact CG2-CG1 3.91Å; L1279-I1301 HydrophobicContact CD2-CD1 3.69Å; L1279-I1301 HydrophobicContact CG-CD1 4.47Å; I1282-I1301 HydrophobicContact CD1-CD1 3.73Å; I1282-I1301 HydrophobicContact CD1-CG1 4.07Å; H1297-I1301 WeakPolarHBondContact CD2-CD1 3.41Å; H1297-I1301 VanDerWaalsContact NE2-CD1 3.29Å; H1297-I1301 WeakPolarHBondContact NE2-CD1 3.14Å; H1297-I1301 WeakPolarHBondContact O-CB 3.26Å; H1297-I1301 PolarHBondContact O-N 3.37Å
1302	L	58.7	Low	54.3	Low	31 Å²	31	61.5 Å²	61.5	16%	0.162	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-70.1	131.6	177.8	-54.2	160.5	0	0	0	108.9	I1271 Y1274 H1275 I1306 L1386	I1271-L1302 HydrophobicContact CG2-CD1 4.13Å; Y1274-L1302 HydrophobicContact CD1-CD1 4.41Å; Y1274-L1302 HydrophobicContact CE1-CD1 4.5Å; H1275-L1302 VanDerWaalsContact NE2-CB 3.26Å; H1275-L1302 WeakPolarHBondContact NE2-CB 3.39Å; H1275-L1302 WeakPolarHBondContact NE2-CD1 3.4Å; H1275-L1302 WeakPolarHBondContact NE2-CG 3.49Å; H1275-L1302 PolarHBondContact NE2-N 3.1Å; L1302-I1306 HydrophobicContact CB-CD1 4.29Å; L1302-L1386 HydrophobicContact CD2-CD1 3.98Å; L1302-L1386 HydrophobicContact CD2-CD2 3.37Å; L1302-L1386 HydrophobicContact CD2-CG 4.28Å
1303	S	54.1	Low	53.5	Low	58 Å²	58	62.2 Å²	62.2	41%	0.406	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-57.3	142.5	-173.7	80.5	0	0	0	0	112.8	N1305 I1306	S1303-N1305 PolarHBondContact O-N 3.3Å; S1303-I1306 WeakPolarHBondContact O-CB 3.36Å; S1303-I1306 PolarHBondContact O-N 2.93Å
1304	E	50.4	Low	52.3	Low	132 Å²	132	68.4 Å²	68.4	62%	0.617	36%	0.356	S	S	*	.	H	α-helix	trans	-57.2	-24.7	-179.4	-154.4	175.6	-169.5	0	0	113.2	I1306 L1307 N1308	E1304-I1306 VanDerWaalsContact C-N 3.25Å; E1304-I1306 PolarHBondContact O-N 2.81Å; E1304-L1307 WeakPolarHBondContact O-CB 3.47Å; E1304-L1307 PolarHBondContact O-N 3.26Å; E1304-N1308 PolarHBondContact O-N 2.97Å
1305	N	50.3	Low	50.9	Low	115 Å²	115	69.1 Å²	69.1	62%	0.615	36%	0.36	S	S	*	.	H	α-helix	trans	-59.2	-33.2	172.2	-70.8	-18.8	0	0	0	113	S1303 L1309	S1303-N1305 PolarHBondContact O-N 3.3Å; N1305-L1309 PolarHBondContact O-N 2.89Å
1306	I	49.8	Very low	50	Low	10 Å²	10	71.1 Å²	71.1	5%	0.051	37%	0.371	C	S	.	.	H	α-helix	trans	-71.2	-42.4	177	-63.7	168	0	0	0	110.2	L1302 S1303 E1304 N1308 L1309 I1310 L1382	L1302-I1306 HydrophobicContact CB-CD1 4.29Å; S1303-I1306 WeakPolarHBondContact O-CB 3.36Å; S1303-I1306 PolarHBondContact O-N 2.93Å; E1304-I1306 VanDerWaalsContact C-N 3.25Å; E1304-I1306 PolarHBondContact O-N 2.81Å; I1306-N1308 VanDerWaalsContact C-N 3.33Å; I1306-N1308 PolarHBondContact O-N 3.24Å; I1306-L1309 PolarHBondContact O-N 2.65Å; I1306-I1310 HydrophobicContact CG2-CD1 4.09Å; I1306-I1310 WeakPolarHBondContact O-CG1 3.35Å; I1306-I1310 PolarHBondContact O-N 3.48Å; I1306-I1310 VanDerWaalsContact O-N 3.17Å; I1306-L1382 HydrophobicContact CG2-CD1 3.61Å; I1306-L1382 HydrophobicContact CG2-CG 4.27Å
1307	L	51.7	Low	48.6	Very low	40 Å²	40	73.4 Å²	73.4	21%	0.209	39%	0.387	C	S	.	.	H	α-helix	trans	-61.8	-41.4	176.1	-104.7	147.4	0	0	0	111.2	E1304 L1309 I1310 L1311	E1304-L1307 WeakPolarHBondContact O-CB 3.47Å; E1304-L1307 PolarHBondContact O-N 3.26Å; L1307-L1309 PolarHBondContact O-N 3.44Å; L1307-I1310 PolarHBondContact O-N 3.48Å; L1307-L1311 HydrophobicContact CD2-CD1 4.45Å; L1307-L1311 WeakPolarHBondContact O-CB 3.3Å; L1307-L1311 WeakPolarHBondContact O-CD1 3.39Å; L1307-L1311 VanDerWaalsContact O-CG 3.22Å; L1307-L1311 WeakPolarHBondContact O-CG 3.43Å; L1307-L1311 PolarHBondContact O-N 2.93Å
1308	N	49.2	Very low	47.2	Very low	92 Å²	92	73.6 Å²	73.6	49%	0.492	39%	0.391	S	S	.	.	H	α-helix	trans	-66.4	-34.8	176.8	-79	-29.7	0	0	0	113.3	E1304 I1306 I1310 L1311	E1304-N1308 PolarHBondContact O-N 2.97Å; I1306-N1308 VanDerWaalsContact C-N 3.33Å; I1306-N1308 PolarHBondContact O-N 3.24Å; N1308-I1310 VanDerWaalsContact C-N 3.33Å; N1308-L1311 PolarHBondContact O-N 2.87Å
1309	L	48	Very low	46.1	Very low	65 Å²	65	73.7 Å²	73.7	34%	0.34	39%	0.392	S	S	.	.	H	α-helix	trans	-65.3	-36.4	173.6	-80.1	161.5	0	0	0	112.1	N1305 I1306 L1307 I1381	N1305-L1309 PolarHBondContact O-N 2.89Å; I1306-L1309 PolarHBondContact O-N 2.65Å; L1307-L1309 PolarHBondContact O-N 3.44Å; L1309-I1381 HydrophobicContact CD1-CG2 4.23Å
1310	I	47.7	Very low	45.1	Very low	26 Å²	26	76.6 Å²	76.6	13%	0.133	40%	0.402	C	S	.	.	H	α-helix	trans	-78.8	-30.1	177.8	-62	169.8	0	0	0	111.4	L1267 I1271 I1306 L1307 N1308 I1312 D1313 L1382	L1267-I1310 HydrophobicContact CD2-CD1 4.36Å; I1271-I1310 HydrophobicContact CD1-CD1 3.63Å; I1306-I1310 HydrophobicContact CG2-CD1 4.09Å; I1306-I1310 WeakPolarHBondContact O-CG1 3.35Å; I1306-I1310 PolarHBondContact O-N 3.48Å; I1306-I1310 VanDerWaalsContact O-N 3.17Å; L1307-I1310 PolarHBondContact O-N 3.48Å; N1308-I1310 VanDerWaalsContact C-N 3.33Å; I1310-I1312 VanDerWaalsContact C-N 3.27Å; I1310-I1312 PolarHBondContact O-N 3.14Å; I1310-D1313 PolarHBondContact O-N 2.96Å; I1310-L1382 HydrophobicContact CD1-CD1 4.1Å
1311	L	41.6	Very low	43.6	Very low	51 Å²	51	82.2 Å²	82.2	27%	0.267	43%	0.432	S	S	.	.	H	α-helix	trans	-72.7	-10.6	-179.6	-81	166.1	0	0	0	115	K1268 L1307 N1308 D1313 Y1314	K1268-L1311 HydrophobicContact CD-CD2 4.45Å; L1307-L1311 HydrophobicContact CD2-CD1 4.45Å; L1307-L1311 WeakPolarHBondContact O-CB 3.3Å; L1307-L1311 WeakPolarHBondContact O-CD1 3.39Å; L1307-L1311 VanDerWaalsContact O-CG 3.22Å; L1307-L1311 WeakPolarHBondContact O-CG 3.43Å; L1307-L1311 PolarHBondContact O-N 2.93Å; N1308-L1311 PolarHBondContact O-N 2.87Å; L1311-D1313 PolarHBondContact O-N 3.04Å; L1311-Y1314 PolarHBondContact O-N 3.37Å
1312	I	41.9	Very low	42	Very low	88 Å²	88	87.2 Å²	87.2	45%	0.451	46%	0.459	S	S	.	.	H	α-helix	trans	-56.6	-24.4	172.5	-62.7	177	0	0	0	110.6	I1310 Y1314	I1310-I1312 VanDerWaalsContact C-N 3.27Å; I1310-I1312 PolarHBondContact O-N 3.14Å; I1312-Y1314 VanDerWaalsContact C-N 3.31Å; I1312-Y1314 PolarHBondContact O-N 3.39Å
1313	D	43.7	Very low	40.6	Very low	76 Å²	76	92.7 Å²	92.7	41%	0.406	49%	0.489	S	S	.	.	H	α-helix	trans	-65.7	-23.3	176.1	-73.6	-9.2	0	0	0	114.5	I1310 L1311 I1370	I1310-D1313 PolarHBondContact O-N 2.96Å; L1311-D1313 PolarHBondContact O-N 3.04Å; D1313-I1370 WeakPolarHBondContact OD1-CD1 3.35Å
1314	Y	31.8	Very low	39.3	Very low	139 Å²	139	97.4 Å²	97.4	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-102.2	-36.7	-177.2	-147.4	-95.3	0	0	0	114	L1311 I1312 N1316 S1317 N1318	L1311-Y1314 PolarHBondContact O-N 3.37Å; I1312-Y1314 VanDerWaalsContact C-N 3.31Å; I1312-Y1314 PolarHBondContact O-N 3.39Å; Y1314-N1316 VanDerWaalsContact C-N 3.3Å; Y1314-N1316 PolarHBondContact O-N 3.39Å; Y1314-S1317 PolarHBondContact O-N 3.05Å; Y1314-S1317 VanDerWaalsContact O-N 3.16Å; Y1314-N1318 WeakPolarHBondContact CE1-ND2 3.33Å; Y1314-N1318 PolarHBondContact O-N 2.76Å
1315	N	33.8	Very low	38.2	Very low	105 Å²	105	96.8 Å²	96.8	56%	0.561	52%	0.519	S	S	*	.	H	α-helix	trans	-69.5	-29.8	179.8	-80.9	-18	0	0	0	112.5	S1317 N1319	N1315-S1317 VanDerWaalsContact C-N 3.33Å; N1315-N1319 WeakPolarHBondContact O-CB 3.48Å; N1315-N1319 PolarHBondContact O-N 2.94Å
1316	N	38.8	Very low	37	Very low	112 Å²	112	99.5 Å²	99.5	60%	0.599	53%	0.534	S	S	*	.	H	α-helix	trans	-74.9	-24.7	173.7	-73.7	-18.8	0	0	0	112.8	Y1314	Y1314-N1316 VanDerWaalsContact C-N 3.3Å; Y1314-N1316 PolarHBondContact O-N 3.39Å
1317	S	32.5	Very low	35.9	Very low	55 Å²	55	104.6 Å²	104.6	39%	0.385	57%	0.571	S	S	.	*	H	α-helix	trans	-80.2	-35.6	174.9	-170	0	0	0	0	112.6	Y1314 N1315	Y1314-S1317 PolarHBondContact O-N 3.05Å; Y1314-S1317 VanDerWaalsContact O-N 3.16Å; N1315-S1317 VanDerWaalsContact C-N 3.33Å
1318	N	31	Very low	34.6	Very low	86 Å²	86	107.4 Å²	107.4	46%	0.46	60%	0.599	S	S	.	*	H	α-helix	trans	-85.3	-20.4	-178	-96	9.7	0	0	0	114.6	Y1314 N1320	Y1314-N1318 WeakPolarHBondContact CE1-ND2 3.33Å; Y1314-N1318 PolarHBondContact O-N 2.76Å; N1318-N1320 PolarHBondContact O-N 2.79Å
1319	N	34.1	Very low	33.3	Very low	133 Å²	133	109.7 Å²	109.7	71%	0.711	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-10.3	174.7	-92.3	-8.1	0	0	0	114.1	N1315	N1315-N1319 WeakPolarHBondContact O-CB 3.48Å; N1315-N1319 PolarHBondContact O-N 2.94Å
1320	N	34.8	Very low	32.1	Very low	130 Å²	130	112 Å²	112	70%	0.695	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	-1.7	-176.7	-83.8	-10.3	0	0	0	116.1	N1318	N1318-N1320 PolarHBondContact O-N 2.79Å
1321	N	30.7	Very low	31	Very low	140 Å²	140	116.1 Å²	116.1	75%	0.749	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.1	2.6	178.9	-82.3	-9	0	0	0	115.7	N1323	N1321-N1323 PolarHBondContact O-N 2.89Å
1322	N	27.1	Very low	30.4	Very low	147 Å²	147	119.7 Å²	119.7	79%	0.786	70%	0.703	S	S	*	*			trans	-85.1	69.5	167.4	-84	-6.2	0	0	0	110.8
1323	N	29.4	Very low	29.6	Very low	147 Å²	147	118.8 Å²	118.8	79%	0.786	72%	0.716	S	S	*	*	S	Bend	trans	-143.8	109.8	148.6	-87.3	-31.4	0	0	0	107.3	N1321	N1321-N1323 PolarHBondContact O-N 2.89Å
1324	N	28.1	Very low	28.9	Very low	157 Å²	157	122.8 Å²	122.8	84%	0.84	74%	0.737	S	S	*	*	S	Bend	trans	91	80.5	172	-53.3	-19.9	0	0	0	117
1325	S	26.4	Very low	28.5	Very low	118 Å²	118	125.8 Å²	125.8	83%	0.825	75%	0.749	S	S	*	*				-173.3	114.1	116.4	34.7	0	0	0	0	110.4	S1327	S1325-S1327 PolarHBondContact O-N 2.8Å
1326	N	24.8	Very low	28.2	Very low	173 Å²	173	125.7 Å²	125.7	93%	0.925	76%	0.755	S	S	*	*			trans	-66.1	117.9	168	-73.4	-29.3	0	0	0	109.5
1327	S	26	Very low	27.7	Very low	117 Å²	117	131 Å²	131	82%	0.818	77%	0.767	S	S	*	*			trans	-169.8	129.3	142.4	49.6	0	0	0	0	113.2	S1325	S1325-S1327 PolarHBondContact O-N 2.8Å
1328	A	25.8	Very low	27.4	Very low	98 Å²	98	136 Å²	136	81%	0.81	78%	0.782	S	S	*	*			trans	-23.2	130.9	174.7	0	0	0	0	0	119.8
1329	C	20.7	Very low	27.2	Very low	141 Å²	141	138.7 Å²	138.7	95%	0.953	79%	0.792	S	S	*	*				-155.7	128.4	127.6	-96.1	0	0	0	0	109.8
1330	S	23	Very low	27.2	Very low	112 Å²	112	135.5 Å²	135.5	78%	0.783	78%	0.784	S	S	*	*			trans	-109.5	158.3	-174.4	44.4	0	0	0	0	111.2
1331	S	25.3	Very low	26.9	Very low	114 Å²	114	135.9 Å²	135.9	80%	0.797	78%	0.781	S	S	*	*			trans	107.6	138.3	156.3	78.4	0	0	0	0	119.6
1332	S	27.8	Very low	26.8	Very low	125 Å²	125	135.5 Å²	135.5	87%	0.874	78%	0.778	S	S	*	*			trans	74.2	114.5	-179.6	76	0	0	0	0	115.7
1333	G	26.5	Very low	27	Very low	70 Å²	70	137.3 Å²	137.3	72%	0.722	78%	0.779	S	S	*	*			cis	115.4	100.2	17	0	0	0	0	0	109.1
1334	D	27.6	Very low	27.1	Very low	159 Å²	159	133.8 Å²	133.8	85%	0.85	77%	0.77	S	S	*	*	S	Bend	trans	95	32.2	166.3	-55.3	-28.4	0	0	0	122.1
1335	Y	23.7	Very low	27.1	Very low	203 Å²	203	133.2 Å²	133.2	80%	0.796	77%	0.767	S	S	*	*	S	Bend	trans	-118.6	-2.6	159	-150.4	-100.8	0	0	0	115.1
1336	C	27.4	Very low	27.1	Very low	103 Å²	103	134.8 Å²	134.8	70%	0.696	77%	0.766	S	S	*	*			trans	-92.5	3.5	-171.9	-85.7	0	0	0	0	116.8
1337	R	29.1	Very low	27.1	Very low	222 Å²	222	133.1 Å²	133.1	84%	0.838	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-22.3	-178.2	-103.9	-177.2	-167.2	139.6	4.1	115.2
1338	F	25.8	Very low	27.1	Very low	162 Å²	162	134.9 Å²	134.9	71%	0.711	76%	0.758	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-24.5	-179	-145.2	-102.5	0	0	0	113.6	A1340 Q1341	F1338-A1340 VanDerWaalsContact C-N 3.29Å; F1338-A1340 PolarHBondContact O-N 2.82Å; F1338-Q1341 PolarHBondContact O-N 3.49Å
1339	Q	27.2	Very low	27.3	Very low	141 Å²	141	137 Å²	137	66%	0.659	76%	0.755	S	S	*	*	H	α-helix	trans	-71.1	-20.1	173.6	-90.1	-173.6	-9.3	0	0	114	Q1341	Q1339-Q1341 PolarHBondContact O-N 2.84Å
1340	A	33.1	Very low	27.6	Very low	66 Å²	66	137 Å²	137	55%	0.545	75%	0.746	S	S	.	*	H	α-helix	trans	-69.3	-23.6	174.8	0	0	0	0	0	112.6	F1338	F1338-A1340 VanDerWaalsContact C-N 3.29Å; F1338-A1340 PolarHBondContact O-N 2.82Å
1341	Q	29.7	Very low	27.7	Very low	138 Å²	138	135.8 Å²	135.8	65%	0.645	74%	0.738	S	S	*	*	H	α-helix	trans	-83.7	-23.9	-174.3	-142.8	138	9	0	0	113.2	F1338 Q1339	F1338-Q1341 PolarHBondContact O-N 3.49Å; Q1339-Q1341 PolarHBondContact O-N 2.84Å
1342	I	27.9	Very low	27.6	Very low	132 Å²	132	137.3 Å²	137.3	68%	0.677	74%	0.737	S	S	*	*	H	α-helix	trans	-84.8	-28.6	176.6	-63.4	179.7	0	0	0	111.5
1343	K	31.5	Very low	27.7	Very low	185 Å²	185	138.3 Å²	138.3	80%	0.804	73%	0.732	S	S	*	*	H	α-helix	trans	-81.2	-10.8	175.5	-77.4	-171.7	176.6	-179.8	0	114.6	N1345	K1343-N1345 VanDerWaalsContact C-N 3.35Å
1344	A	32.3	Very low	27.6	Very low	73 Å²	73	141.6 Å²	141.6	60%	0.603	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-15.7	176.9	0	0	0	0	0	113.9
1345	N	27.2	Very low	27.5	Very low	146 Å²	146	140.7 Å²	140.7	78%	0.781	73%	0.728	S	S	*	*	S	Bend	trans	-107.9	9.7	-168.7	-110.3	10.7	0	0	0	116.3	K1343	K1343-N1345 VanDerWaalsContact C-N 3.35Å
1346	N	26.4	Very low	27.5	Very low	151 Å²	151	135.4 Å²	135.4	81%	0.807	72%	0.721	S	S	*	*	S	Bend	trans	-115.6	17.4	176.2	-96	1.3	0	0	0	115
1347	N	25.4	Very low	27.4	Very low	137 Å²	137	138.2 Å²	138.2	73%	0.733	73%	0.729	S	S	*	*			trans	-116.7	95.3	168.9	-82.7	-9.2	0	0	0	109.6
1348	N	26.4	Very low	27.1	Very low	154 Å²	154	131 Å²	131	82%	0.824	73%	0.725	S	S	*	*			trans	-174	136.6	142.9	-92.2	-19.6	0	0	0	110.4
1349	N	28.8	Very low	27.1	Very low	142 Å²	142	131.3 Å²	131.3	76%	0.759	73%	0.733	S	S	*	*			trans	104.4	80.4	176.5	-53.2	-19.8	0	0	0	113.4
1350	N	27.9	Very low	27	Very low	142 Å²	142	131.6 Å²	131.6	76%	0.759	74%	0.739	S	S	*	*				89.3	100.3	87.8	-78.5	-3.7	0	0	0	111.5
1351	S	24.2	Very low	26.6	Very low	87 Å²	87	135.6 Å²	135.6	61%	0.608	75%	0.752	S	S	*	*				63.6	104	90.5	82.5	0	0	0	0	114.6
1352	N	24.7	Very low	26.4	Very low	146 Å²	146	137.5 Å²	137.5	78%	0.781	76%	0.761	S	S	*	*				162.4	146	117.9	-81	-13.9	0	0	0	113.4
1353	N	28.3	Very low	26.2	Very low	145 Å²	145	141.4 Å²	141.4	78%	0.775	77%	0.773	S	S	*	*			trans	90.7	84.3	160.7	-67.3	0.4	0	0	0	119.9
1354	D	25.1	Very low	25.9	Very low	139 Å²	139	139.2 Å²	139.2	74%	0.743	77%	0.77	S	S	*	*				51.5	123.6	108.1	-69.6	-4.2	0	0	0	122.5
1355	N	25.7	Very low	25.7	Very low	140 Å²	140	141.1 Å²	141.1	75%	0.749	78%	0.776	S	S	*	*			trans	95	103	135.3	-69.3	-18.8	0	0	0	121.3
1356	S	24.3	Very low	25.8	Very low	93 Å²	93	140.8 Å²	140.8	65%	0.65	77%	0.774	S	S	*	*				59.6	109.7	126.6	68.9	0	0	0	0	119.3
1357	N	25.2	Very low	26	Very low	161 Å²	161	139.1 Å²	139.1	86%	0.861	77%	0.77	S	S	*	*				176.4	129.1	90.1	-101.6	-21.9	0	0	0	109.9
1358	G	22.9	Very low	26.2	Very low	72 Å²	72	140 Å²	140	74%	0.742	77%	0.774	S	S	*	*			trans	-69	142.9	175.7	0	0	0	0	0	111.9
1359	N	25.7	Very low	26.8	Very low	167 Å²	167	138 Å²	138	89%	0.893	77%	0.772	S	S	*	*			trans	-144	107	143.9	-110.3	-14.2	0	0	0	108.5
1360	N	24.4	Very low	27.6	Very low	147 Å²	147	134.9 Å²	134.9	79%	0.786	75%	0.754	S	S	*	*			trans	-55.3	134.4	160.8	-65.3	-43.5	0	0	0	108.3
1361	N	24.7	Very low	28.8	Very low	151 Å²	151	130.8 Å²	130.8	81%	0.807	74%	0.737	S	S	*	*			trans	-170.4	123.5	130.1	-89.2	-18.4	0	0	0	111.6
1362	E	24.7	Very low	30.5	Very low	178 Å²	178	128.9 Å²	128.9	83%	0.832	72%	0.716	S	S	*	*			trans	67.9	83.9	147.5	-62.5	-174.7	157.9	0	0	119.1	N1364	E1362-N1364 PolarHBondContact O-N 3.28Å; E1362-N1364 VanDerWaalsContact O-N 3.16Å
1363	K	24.1	Very low	32.2	Very low	213 Å²	213	127.5 Å²	127.5	93%	0.926	71%	0.709	S	S	*	*			trans	-20.6	99.8	144.3	-64	174.2	177	178.7	0	114.5
1364	N	25.5	Very low	33.9	Very low	139 Å²	139	123.3 Å²	123.3	74%	0.743	69%	0.689	S	S	*	*			trans	-89.7	123.9	156.6	-111.8	-21.1	0	0	0	109	E1362 N1366	E1362-N1364 PolarHBondContact O-N 3.28Å; E1362-N1364 VanDerWaalsContact O-N 3.16Å; N1364-N1366 PolarHBondContact O-N 2.96Å
1365	P	28.7	Very low	35.9	Very low	114 Å²	114	117.7 Å²	117.7	74%	0.74	66%	0.657	S	S	*	*			trans	-83	77.7	-176.5	34.9	-32.5	0	0	0	110.2
1366	N	28.5	Very low	37.8	Very low	138 Å²	138	112.1 Å²	112.1	74%	0.738	63%	0.627	S	S	*	*			trans	-113.7	24.4	177.9	-83.5	1.2	0	0	0	113.8	N1364	N1364-N1366 PolarHBondContact O-N 2.96Å
1367	T	30	Very low	39.8	Very low	117 Å²	117	111.9 Å²	111.9	72%	0.718	62%	0.618	S	S	*	*			trans	-107.7	100.3	177.5	48	0	0	0	0	110.2
1368	L	30.1	Very low	41.7	Very low	156 Å²	156	106.6 Å²	106.6	82%	0.817	59%	0.589	S	S	*	*			trans	178.2	9.7	147.7	-95.9	152.6	0	0	0	115.7	I1370	L1368-I1370 PolarHBondContact O-N 2.78Å
1369	S	38.6	Very low	43.9	Very low	112 Å²	112	103.3 Å²	103.3	78%	0.783	55%	0.554	S	S	*	*			trans	-90.1	99.6	174.9	50.3	0	0	0	0	111.7	S1371	S1369-S1371 PolarHBondContact O-N 3.04Å
1370	I	45.7	Very low	45.9	Very low	75 Å²	75	96.1 Å²	96.1	39%	0.385	52%	0.515	S	S	.	.			trans	-58.4	127.3	156.8	-64.8	162.1	0	0	0	106.5	D1313 L1368 T1374 I1429	D1313-I1370 WeakPolarHBondContact OD1-CD1 3.35Å; L1368-I1370 PolarHBondContact O-N 2.78Å; I1370-T1374 HydrophobicContact CG2-CG2 4.25Å; I1370-I1429 HydrophobicContact CB-CD1 4.26Å; I1370-I1429 HydrophobicContact CG2-CD1 4.07Å; I1370-I1429 VanDerWaalsContact O-CD1 3.23Å; I1370-I1429 WeakPolarHBondContact O-CD1 3.39Å
1371	S	52.7	Low	47.8	Very low	56 Å²	56	92.4 Å²	92.4	39%	0.392	50%	0.495	S	S	.	.			trans	-72.5	145.6	-179.5	78.9	0	0	0	0	110.5	S1369 N1373 T1374 Y1375	S1369-S1371 PolarHBondContact O-N 3.04Å; S1371-N1373 PolarHBondContact O-N 2.89Å; S1371-N1373 VanDerWaalsContact O-N 3.12Å; S1371-T1374 WeakPolarHBondContact O-CB 3.25Å; S1371-T1374 PolarHBondContact O-N 2.87Å; S1371-T1374 PolarHBondContact OG-N 3.47Å; S1371-T1374 PolarHBondContact OG-OG1 3.23Å; S1371-Y1375 PolarHBondContact O-N 3.22Å
1372	W	60.5	Low	49.5	Very low	48 Å²	48	86 Å²	86	18%	0.182	46%	0.46	C	S	.	.	H	α-helix	trans	-52.4	-32.8	173.7	-86.1	102.7	0	0	0	112.5	Y1375 I1376 F1400 P1427 I1429 A1432	W1372-Y1375 HydrophobicContact CE3-CD1 4.18Å; W1372-Y1375 HydrophobicContact CZ3-CD1 4.03Å; W1372-Y1375 HydrophobicContact CZ3-CE1 4.48Å; W1372-Y1375 WeakPolarHBondContact O-CB 3.35Å; W1372-Y1375 PolarHBondContact O-N 3.18Å; W1372-I1376 VanDerWaalsContact O-CG1 3.32Å; W1372-I1376 WeakPolarHBondContact O-CG1 3.19Å; W1372-I1376 PolarHBondContact O-N 3.14Å; W1372-F1400 HydrophobicContact CE3-CD1 4.44Å; W1372-F1400 HydrophobicContact CE3-CE1 4.22Å; W1372-F1400 HydrophobicContact CZ3-CD1 4.16Å; W1372-F1400 AromaticContact CZ3-CE1 3.64Å; W1372-F1400 HydrophobicContact CZ3-CE1 3.64Å; W1372-P1427 WeakPolarHBondContact CZ2-O 3.35Å; W1372-P1427 PolarHBondContact NE1-O 3.49Å; W1372-I1429 HydrophobicContact CD2-CG1 3.8Å; W1372-I1429 HydrophobicContact CE3-CG1 3.99Å; W1372-I1429 HydrophobicContact CG-CG1 4.25Å; W1372-I1429 HydrophobicContact CH2-CG1 4.36Å; W1372-I1429 HydrophobicContact CZ2-CG1 4.18Å; W1372-I1429 HydrophobicContact CZ3-CG1 4.23Å; W1372-A1432 HydrophobicContact CH2-CB 3.74Å; W1372-A1432 HydrophobicContact CZ3-CB 3.9Å
1373	N	61.3	Low	51.4	Low	117 Å²	117	77.7 Å²	77.7	63%	0.626	42%	0.422	S	S	*	.	H	α-helix	trans	-62.3	-42.4	174.7	-75.7	-16.2	0	0	0	112.3	S1371 Y1375 N1377	S1371-N1373 PolarHBondContact O-N 2.89Å; S1371-N1373 VanDerWaalsContact O-N 3.12Å; N1373-Y1375 VanDerWaalsContact C-N 3.3Å; N1373-Y1375 PolarHBondContact O-N 2.79Å; N1373-N1377 VanDerWaalsContact O-CB 3.29Å; N1373-N1377 WeakPolarHBondContact O-CB 3.35Å; N1373-N1377 VanDerWaalsContact O-CG 3.23Å; N1373-N1377 PolarHBondContact O-N 3.27Å; N1373-N1377 PolarHBondContact O-ND2 3.15Å
1374	T	64	Low	53.1	Low	57 Å²	57	74.5 Å²	74.5	35%	0.35	41%	0.408	S	S	.	.	H	α-helix	trans	-62.4	-41.5	175	-42.1	0	0	0	0	110.6	I1370 S1371 N1377 H1378	I1370-T1374 HydrophobicContact CG2-CG2 4.25Å; S1371-T1374 WeakPolarHBondContact O-CB 3.25Å; S1371-T1374 PolarHBondContact O-N 2.87Å; S1371-T1374 PolarHBondContact OG-N 3.47Å; S1371-T1374 PolarHBondContact OG-OG1 3.23Å; T1374-N1377 PolarHBondContact O-N 2.85Å; T1374-H1378 PolarHBondContact O-CD2 3.37Å; T1374-H1378 PolarHBondContact O-N 3.35Å
1375	Y	66	Low	54.2	Low	21 Å²	21	72.5 Å²	72.5	8%	0.082	39%	0.394	C	S	.	.	H	α-helix	trans	-64.9	-46.3	178.4	-169.3	-105.3	0	0	0	113.4	S1371 W1372 N1373 N1377 H1378 W1379 F1400 I1429 A1432 N1434	S1371-Y1375 PolarHBondContact O-N 3.22Å; W1372-Y1375 HydrophobicContact CE3-CD1 4.18Å; W1372-Y1375 HydrophobicContact CZ3-CD1 4.03Å; W1372-Y1375 HydrophobicContact CZ3-CE1 4.48Å; W1372-Y1375 WeakPolarHBondContact O-CB 3.35Å; W1372-Y1375 PolarHBondContact O-N 3.18Å; N1373-Y1375 VanDerWaalsContact C-N 3.3Å; N1373-Y1375 PolarHBondContact O-N 2.79Å; Y1375-N1377 VanDerWaalsContact C-N 3.33Å; Y1375-H1378 PolarHBondContact O-N 3.46Å; Y1375-W1379 AromaticContact CE1-CD1 3.57Å; Y1375-W1379 AromaticContact CE1-NE1 3.3Å; Y1375-W1379 VanDerWaalsContact CE1-NE1 3.3Å; Y1375-W1379 AromaticContact CZ-CD1 3.83Å; Y1375-W1379 AromaticContact CZ-NE1 3.25Å; Y1375-W1379 VanDerWaalsContact CZ-NE1 3.25Å; Y1375-W1379 PolarHBondContact O-N 3.36Å; Y1375-W1379 PolarHBondContact OH-NE1 3.47Å; Y1375-F1400 HydrophobicContact CD1-CE1 4.49Å; Y1375-F1400 HydrophobicContact CD1-CZ 4.2Å; Y1375-F1400 HydrophobicContact CE1-CZ 4.04Å; Y1375-I1429 HydrophobicContact CD2-CG2 4.04Å; Y1375-I1429 HydrophobicContact CE2-CG2 4.29Å; Y1375-I1429 HydrophobicContact CG-CD1 4.2Å; Y1375-I1429 HydrophobicContact CG-CG1 4.27Å; Y1375-I1429 HydrophobicContact CG-CG2 4.42Å; Y1375-A1432 HydrophobicContact CD1-CB 4.49Å; Y1375-A1432 HydrophobicContact CE1-CB 3.69Å; Y1375-N1434 VanDerWaalsContact OH-CG 3.29Å; Y1375-N1434 PolarHBondContact OH-OD1 2.89Å
1376	I	66	Low	55.3	Low	22 Å²	22	69.8 Å²	69.8	11%	0.113	37%	0.373	C	S	.	.	H	α-helix	trans	-61.7	-45	175	-67.7	168.3	0	0	0	109.4	W1372 H1378 W1379 L1380 M1397 F1400	W1372-I1376 VanDerWaalsContact O-CG1 3.32Å; W1372-I1376 WeakPolarHBondContact O-CG1 3.19Å; W1372-I1376 PolarHBondContact O-N 3.14Å; I1376-H1378 VanDerWaalsContact C-N 3.28Å; I1376-H1378 PolarHBondContact O-N 3.25Å; I1376-W1379 PolarHBondContact O-N 3.44Å; I1376-W1379 VanDerWaalsContact O-N 3.1Å; I1376-L1380 HydrophobicContact CG2-CD1 3.85Å; I1376-L1380 HydrophobicContact CG2-CG 4.11Å; I1376-L1380 VanDerWaalsContact O-CG 3.31Å; I1376-L1380 WeakPolarHBondContact O-CG 3.48Å; I1376-L1380 PolarHBondContact O-N 3.49Å; I1376-M1397 HydrophobicContact CG2-SD 3.58Å; I1376-M1397 VanDerWaalsContact CG2-SD 3.58Å; I1376-F1400 HydrophobicContact CD1-CB 3.96Å; I1376-F1400 HydrophobicContact CD1-CD1 4.36Å; I1376-F1400 HydrophobicContact CD1-CD2 4.41Å; I1376-F1400 HydrophobicContact CD1-CG 3.99Å; I1376-F1400 HydrophobicContact CG1-CB 4.35Å; I1376-F1400 HydrophobicContact CG1-CD1 4.19Å; I1376-F1400 HydrophobicContact CG1-CD2 3.86Å; I1376-F1400 HydrophobicContact CG1-CE2 4.19Å; I1376-F1400 HydrophobicContact CG1-CG 3.86Å
1377	N	65.9	Low	56.2	Low	88 Å²	88	72.3 Å²	72.3	47%	0.471	38%	0.378	S	S	.	.	H	α-helix	trans	-58.3	-38.3	176.7	-78.6	-25.8	0	0	0	112.5	N1373 T1374 Y1375 L1380 I1381	N1373-N1377 VanDerWaalsContact O-CB 3.29Å; N1373-N1377 WeakPolarHBondContact O-CB 3.35Å; N1373-N1377 VanDerWaalsContact O-CG 3.23Å; N1373-N1377 PolarHBondContact O-N 3.27Å; N1373-N1377 PolarHBondContact O-ND2 3.15Å; T1374-N1377 PolarHBondContact O-N 2.85Å; Y1375-N1377 VanDerWaalsContact C-N 3.33Å; N1377-L1380 PolarHBondContact O-N 3.06Å; N1377-I1381 WeakPolarHBondContact O-CB 3.46Å; N1377-I1381 WeakPolarHBondContact O-CD1 3.43Å; N1377-I1381 WeakPolarHBondContact O-CG1 3.38Å; N1377-I1381 PolarHBondContact O-N 3.11Å
1378	H	65.8	Low	57.1	Low	51 Å²	51	69.4 Å²	69.4	24%	0.236	36%	0.355	C	S	.	.	H	α-helix	trans	-61.8	-44.2	174.5	-68.8	175.7	0	0	0	112.2	T1374 Y1375 I1376 L1380 I1381 L1382	T1374-H1378 PolarHBondContact O-CD2 3.37Å; T1374-H1378 PolarHBondContact O-N 3.35Å; Y1375-H1378 PolarHBondContact O-N 3.46Å; I1376-H1378 VanDerWaalsContact C-N 3.28Å; I1376-H1378 PolarHBondContact O-N 3.25Å; H1378-L1380 PolarHBondContact O-N 3.4Å; H1378-I1381 PolarHBondContact O-N 3.05Å; H1378-L1382 WeakPolarHBondContact O-CB 3.46Å; H1378-L1382 PolarHBondContact O-N 3.36Å
1379	W	69.8	Low	58.2	Low	3 Å²	3	67.1 Å²	67.1	1%	0.011	34%	0.344	C	S	.	.	H	α-helix	trans	-63.8	-39.4	173.9	-82.9	105.6	0	0	0	112.8	L1267 Y1375 I1376 L1382 S1383 I1396 L1437 L1441	L1267-W1379 HydrophobicContact CD1-CH2 3.32Å; L1267-W1379 HydrophobicContact CD1-CZ2 3.57Å; L1267-W1379 HydrophobicContact CD1-CZ3 4.12Å; L1267-W1379 HydrophobicContact CD2-CH2 4.09Å; L1267-W1379 HydrophobicContact CD2-CZ2 3.79Å; L1267-W1379 HydrophobicContact CG-CH2 4.33Å; L1267-W1379 HydrophobicContact CG-CZ2 4.21Å; Y1375-W1379 AromaticContact CE1-CD1 3.57Å; Y1375-W1379 AromaticContact CE1-NE1 3.3Å; Y1375-W1379 VanDerWaalsContact CE1-NE1 3.3Å; Y1375-W1379 AromaticContact CZ-CD1 3.83Å; Y1375-W1379 AromaticContact CZ-NE1 3.25Å; Y1375-W1379 VanDerWaalsContact CZ-NE1 3.25Å; Y1375-W1379 PolarHBondContact O-N 3.36Å; Y1375-W1379 PolarHBondContact OH-NE1 3.47Å; I1376-W1379 PolarHBondContact O-N 3.44Å; I1376-W1379 VanDerWaalsContact O-N 3.1Å; W1379-L1382 HydrophobicContact CE3-CD2 4.46Å; W1379-L1382 HydrophobicContact CZ3-CD2 4.43Å; W1379-L1382 PolarHBondContact O-N 3.06Å; W1379-S1383 WeakPolarHBondContact O-CB 3.2Å; W1379-S1383 PolarHBondContact O-N 3.37Å; W1379-I1396 HydrophobicContact CB-CG2 4.21Å; W1379-L1437 HydrophobicContact CD2-CD1 4.38Å; W1379-L1437 HydrophobicContact CH2-CB 3.74Å; W1379-L1437 HydrophobicContact CZ2-CB 3.79Å; W1379-L1437 HydrophobicContact CZ2-CD1 3.98Å; W1379-L1437 HydrophobicContact CZ3-CB 4.29Å; W1379-L1441 HydrophobicContact CE3-CD1 3.65Å; W1379-L1441 HydrophobicContact CH2-CD1 4.22Å; W1379-L1441 HydrophobicContact CZ3-CD1 3.18Å
1380	L	66.7	Low	59	Low	16 Å²	16	65.8 Å²	65.8	8%	0.084	33%	0.334	C	S	.	.	H	α-helix	trans	-67	-41.7	177.9	-65.4	175.3	0	0	0	111.6	I1376 N1377 H1378 L1382 S1383 K1384 H1393 I1396 M1397	I1376-L1380 HydrophobicContact CG2-CD1 3.85Å; I1376-L1380 HydrophobicContact CG2-CG 4.11Å; I1376-L1380 VanDerWaalsContact O-CG 3.31Å; I1376-L1380 WeakPolarHBondContact O-CG 3.48Å; I1376-L1380 PolarHBondContact O-N 3.49Å; N1377-L1380 PolarHBondContact O-N 3.06Å; H1378-L1380 PolarHBondContact O-N 3.4Å; L1380-L1382 VanDerWaalsContact C-N 3.34Å; L1380-S1383 PolarHBondContact O-N 2.67Å; L1380-S1383 PolarHBondContact O-OG 3.39Å; L1380-K1384 WeakPolarHBondContact O-CG 3.45Å; L1380-K1384 PolarHBondContact O-N 2.92Å; L1380-H1393 WeakPolarHBondContact CD2-CE1 3.48Å; L1380-H1393 WeakPolarHBondContact CD2-ND1 3.49Å; L1380-I1396 HydrophobicContact CD2-CB 4.48Å; L1380-I1396 HydrophobicContact CD2-CG2 4.21Å; L1380-M1397 HydrophobicContact CD1-SD 3.82Å; L1380-M1397 HydrophobicContact CD2-CG 4.11Å; L1380-M1397 HydrophobicContact CD2-SD 4.05Å; L1380-M1397 HydrophobicContact CG-SD 4.35Å
1381	I	64	Low	59.4	Low	69 Å²	69	65.2 Å²	65.2	35%	0.354	34%	0.337	S	S	.	.	H	α-helix	trans	-60.6	-45.5	174	-69.6	163.3	0	0	0	109.9	L1309 N1377 H1378 S1383 K1384 Q1385	L1309-I1381 HydrophobicContact CD1-CG2 4.23Å; N1377-I1381 WeakPolarHBondContact O-CB 3.46Å; N1377-I1381 WeakPolarHBondContact O-CD1 3.43Å; N1377-I1381 WeakPolarHBondContact O-CG1 3.38Å; N1377-I1381 PolarHBondContact O-N 3.11Å; H1378-I1381 PolarHBondContact O-N 3.05Å; I1381-S1383 PolarHBondContact O-N 3.4Å; I1381-K1384 PolarHBondContact O-N 2.76Å; I1381-Q1385 HydrophobicContact CG2-CG 4.45Å; I1381-Q1385 WeakPolarHBondContact O-CG 3.47Å; I1381-Q1385 PolarHBondContact O-N 3.5Å
1382	L	61.7	Low	59.3	Low	15 Å²	15	63.7 Å²	63.7	8%	0.079	32%	0.324	C	S	.	.	H	α-helix	trans	-61.7	-43.2	178	-164.2	138.8	0	0	0	111.5	I1306 I1310 H1378 W1379 L1380 L1386 L1441	I1306-L1382 HydrophobicContact CG2-CD1 3.61Å; I1306-L1382 HydrophobicContact CG2-CG 4.27Å; I1310-L1382 HydrophobicContact CD1-CD1 4.1Å; H1378-L1382 WeakPolarHBondContact O-CB 3.46Å; H1378-L1382 PolarHBondContact O-N 3.36Å; W1379-L1382 HydrophobicContact CE3-CD2 4.46Å; W1379-L1382 HydrophobicContact CZ3-CD2 4.43Å; W1379-L1382 PolarHBondContact O-N 3.06Å; L1380-L1382 VanDerWaalsContact C-N 3.34Å; L1382-L1386 HydrophobicContact CD2-CD1 3.7Å; L1382-L1386 HydrophobicContact CG-CD1 4.33Å; L1382-L1386 WeakPolarHBondContact O-CG 3.23Å; L1382-L1386 PolarHBondContact O-N 3.06Å; L1382-L1441 HydrophobicContact CD2-CD1 4.27Å
1383	S	63.1	Low	59.1	Low	4 Å²	4	63.9 Å²	63.9	3%	0.028	33%	0.327	C	S	.	.	H	α-helix	trans	-63.4	-41.3	175.9	76.4	0	0	0	0	113	W1379 L1380 I1381 F1388	W1379-S1383 WeakPolarHBondContact O-CB 3.2Å; W1379-S1383 PolarHBondContact O-N 3.37Å; L1380-S1383 PolarHBondContact O-N 2.67Å; L1380-S1383 PolarHBondContact O-OG 3.39Å; I1381-S1383 PolarHBondContact O-N 3.4Å; S1383-F1388 PolarHBondContact O-N 3.1Å
1384	K	61.3	Low	59.2	Low	147 Å²	147	62.6 Å²	62.6	64%	0.639	32%	0.32	S	S	*	.	H	α-helix	trans	-69.4	-41.3	179.5	-78.4	-177.3	178.3	179.5	0	111.9	L1380 I1381 L1386 K1387	L1380-K1384 WeakPolarHBondContact O-CG 3.45Å; L1380-K1384 PolarHBondContact O-N 2.92Å; I1381-K1384 PolarHBondContact O-N 2.76Å; K1384-L1386 VanDerWaalsContact C-N 3.34Å; K1384-K1387 WeakPolarHBondContact O-CA 3.21Å; K1384-K1387 PolarHBondContact O-N 3.31Å
1385	Q	47.9	Very low	59	Low	96 Å²	96	63.8 Å²	63.8	45%	0.449	32%	0.318	S	S	.	.	H	α-helix	trans	-68.9	-33.2	-179.2	-76.6	-167.2	-10.7	0	0	112.8	I1381 K1387	I1381-Q1385 HydrophobicContact CG2-CG 4.45Å; I1381-Q1385 WeakPolarHBondContact O-CG 3.47Å; I1381-Q1385 PolarHBondContact O-N 3.5Å; Q1385-K1387 PolarHBondContact O-N 3.13Å; Q1385-K1387 VanDerWaalsContact O-N 3.14Å
1386	L	52.4	Low	58.7	Low	57 Å²	57	62.9 Å²	62.9	30%	0.298	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	5.5	172	-63.9	169.6	0	0	0	113.2	L1302 L1382 K1384 F1388	L1302-L1386 HydrophobicContact CD2-CD1 3.98Å; L1302-L1386 HydrophobicContact CD2-CD2 3.37Å; L1302-L1386 HydrophobicContact CD2-CG 4.28Å; L1382-L1386 HydrophobicContact CD2-CD1 3.7Å; L1382-L1386 HydrophobicContact CG-CD1 4.33Å; L1382-L1386 WeakPolarHBondContact O-CG 3.23Å; L1382-L1386 PolarHBondContact O-N 3.06Å; K1384-L1386 VanDerWaalsContact C-N 3.34Å; L1386-F1388 HydrophobicContact CB-CD2 3.35Å; L1386-F1388 HydrophobicContact CB-CE2 3.23Å; L1386-F1388 HydrophobicContact CB-CG 4.22Å; L1386-F1388 HydrophobicContact CB-CZ 4.01Å; L1386-F1388 HydrophobicContact CD1-CD2 4.14Å; L1386-F1388 HydrophobicContact CD1-CE2 3.48Å; L1386-F1388 VanDerWaalsContact CD1-CE2 3.48Å; L1386-F1388 HydrophobicContact CD1-CZ 4.4Å; L1386-F1388 HydrophobicContact CG-CD2 4.36Å; L1386-F1388 HydrophobicContact CG-CE2 3.93Å; L1386-F1388 PolarHBondContact O-N 3.36Å
1387	K	47.5	Very low	58.6	Low	192 Å²	192	65.4 Å²	65.4	84%	0.835	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	33	-179.2	-62.5	-177.8	178.8	176.2	0	113	K1384 Q1385	K1384-K1387 WeakPolarHBondContact O-CA 3.21Å; K1384-K1387 PolarHBondContact O-N 3.31Å; Q1385-K1387 PolarHBondContact O-N 3.13Å; Q1385-K1387 VanDerWaalsContact O-N 3.14Å
1388	F	48.6	Very low	58.4	Low	56 Å²	56	66.3 Å²	66.3	25%	0.246	33%	0.33	C	S	.	.			trans	-72.6	150.1	178.3	-74	-53.4	0	0	0	111.9	S1383 L1386 I1392 L1441	S1383-F1388 PolarHBondContact O-N 3.1Å; L1386-F1388 HydrophobicContact CB-CD2 3.35Å; L1386-F1388 HydrophobicContact CB-CE2 3.23Å; L1386-F1388 HydrophobicContact CB-CG 4.22Å; L1386-F1388 HydrophobicContact CB-CZ 4.01Å; L1386-F1388 HydrophobicContact CD1-CD2 4.14Å; L1386-F1388 HydrophobicContact CD1-CE2 3.48Å; L1386-F1388 VanDerWaalsContact CD1-CE2 3.48Å; L1386-F1388 HydrophobicContact CD1-CZ 4.4Å; L1386-F1388 HydrophobicContact CG-CD2 4.36Å; L1386-F1388 HydrophobicContact CG-CE2 3.93Å; L1386-F1388 PolarHBondContact O-N 3.36Å; F1388-I1392 HydrophobicContact CB-CB 4.44Å; F1388-I1392 HydrophobicContact CB-CD1 3.71Å; F1388-I1392 HydrophobicContact CD1-CD1 4.02Å; F1388-I1392 HydrophobicContact CG-CD1 3.93Å; F1388-L1441 HydrophobicContact CD2-CD2 3.71Å; F1388-L1441 HydrophobicContact CE2-CD2 3.52Å; F1388-L1441 HydrophobicContact CZ-CD2 4.45Å
1389	N	53.4	Low	58	Low	108 Å²	108	65.5 Å²	65.5	58%	0.578	33%	0.331	S	S	*	.			trans	-55.6	145.4	-177.8	-167	-15.2	0	0	0	111.3	S1391 I1392	N1389-S1391 PolarHBondContact ND2-OG 3.1Å; N1389-S1391 PolarHBondContact O-N 3.02Å; N1389-S1391 PolarHBondContact OD1-OG 3.4Å; N1389-I1392 PolarHBondContact O-N 2.99Å
1390	S	55.7	Low	57.5	Low	84 Å²	84	65.9 Å²	65.9	59%	0.587	33%	0.333	S	S	*	.	H	α-helix	trans	-54.4	-25	-179.9	60.6	0	0	0	0	113.2	I1392 H1393 N1394	S1390-I1392 VanDerWaalsContact C-N 3.3Å; S1390-I1392 PolarHBondContact O-N 3.36Å; S1390-H1393 WeakPolarHBondContact O-CB 3.4Å; S1390-H1393 PolarHBondContact O-N 3.32Å; S1390-N1394 PolarHBondContact O-N 3.41Å; S1390-N1394 VanDerWaalsContact O-N 3.13Å
1391	S	52.8	Low	57.2	Low	62 Å²	62	72.7 Å²	72.7	43%	0.434	36%	0.358	S	S	.	.	H	α-helix	trans	-61.2	-30.6	173.6	37.7	0	0	0	0	114	N1389 W1395	N1389-S1391 PolarHBondContact ND2-OG 3.1Å; N1389-S1391 PolarHBondContact O-N 3.02Å; N1389-S1391 PolarHBondContact OD1-OG 3.4Å; S1391-W1395 WeakPolarHBondContact O-CB 3.31Å; S1391-W1395 PolarHBondContact O-N 2.78Å
1392	I	51.6	Low	56.9	Low	25 Å²	25	74 Å²	74	13%	0.128	36%	0.361	C	S	.	.	H	α-helix	trans	-73.7	-38.4	175.3	-70.6	164.8	0	0	0	110.9	F1388 N1389 S1390 N1394 W1395 I1396	F1388-I1392 HydrophobicContact CB-CB 4.44Å; F1388-I1392 HydrophobicContact CB-CD1 3.71Å; F1388-I1392 HydrophobicContact CD1-CD1 4.02Å; F1388-I1392 HydrophobicContact CG-CD1 3.93Å; N1389-I1392 PolarHBondContact O-N 2.99Å; S1390-I1392 VanDerWaalsContact C-N 3.3Å; S1390-I1392 PolarHBondContact O-N 3.36Å; I1392-N1394 VanDerWaalsContact C-N 3.32Å; I1392-N1394 PolarHBondContact O-N 2.98Å; I1392-W1395 PolarHBondContact O-N 3.41Å; I1392-W1395 VanDerWaalsContact O-N 3.14Å; I1392-I1396 HydrophobicContact CG2-CD1 4Å; I1392-I1396 HydrophobicContact CG2-CG1 4.37Å; I1392-I1396 WeakPolarHBondContact O-CG1 3.4Å; I1392-I1396 PolarHBondContact O-N 3Å
1393	H	56.4	Low	56.4	Low	51 Å²	51	76.8 Å²	76.8	24%	0.236	38%	0.376	C	S	.	.	H	α-helix	trans	-56.9	-48.9	172.2	178.7	96.8	0	0	0	110.3	L1380 S1390 W1395 I1396 M1397	L1380-H1393 WeakPolarHBondContact CD2-CE1 3.48Å; L1380-H1393 WeakPolarHBondContact CD2-ND1 3.49Å; S1390-H1393 WeakPolarHBondContact O-CB 3.4Å; S1390-H1393 PolarHBondContact O-N 3.32Å; H1393-W1395 VanDerWaalsContact C-N 3.31Å; H1393-W1395 PolarHBondContact O-N 2.98Å; H1393-I1396 PolarHBondContact O-N 2.66Å; H1393-M1397 WeakPolarHBondContact O-CB 3.4Å; H1393-M1397 VanDerWaalsContact O-CG 3.32Å; H1393-M1397 WeakPolarHBondContact O-CG 3.13Å; H1393-M1397 PolarHBondContact O-N 3.1Å
1394	N	62.2	Low	55.8	Low	90 Å²	90	80.5 Å²	80.5	48%	0.481	39%	0.392	S	S	.	.	H	α-helix	trans	-61.6	-40.1	175.6	-73.7	-9.3	0	0	0	111.7	S1390 I1392 M1397 I1398	S1390-N1394 PolarHBondContact O-N 3.41Å; S1390-N1394 VanDerWaalsContact O-N 3.13Å; I1392-N1394 VanDerWaalsContact C-N 3.32Å; I1392-N1394 PolarHBondContact O-N 2.98Å; N1394-M1397 PolarHBondContact O-N 2.91Å; N1394-I1398 HydrophobicContact CB-CD1 4.47Å; N1394-I1398 VanDerWaalsContact O-CB 3.29Å; N1394-I1398 WeakPolarHBondContact O-CB 3.45Å; N1394-I1398 WeakPolarHBondContact O-CD1 3.34Å; N1394-I1398 WeakPolarHBondContact O-CG1 3.44Å; N1394-I1398 PolarHBondContact O-N 3.26Å
1395	W	60.9	Low	55.7	Low	83 Å²	83	78.8 Å²	78.8	31%	0.314	39%	0.385	S	S	.	.	H	α-helix	trans	-63.5	-46.5	177.4	-177.3	75.2	0	0	0	112.6	S1391 I1392 H1393 M1397 I1398 S1399 L1437	S1391-W1395 WeakPolarHBondContact O-CB 3.31Å; S1391-W1395 PolarHBondContact O-N 2.78Å; I1392-W1395 PolarHBondContact O-N 3.41Å; I1392-W1395 VanDerWaalsContact O-N 3.14Å; H1393-W1395 VanDerWaalsContact C-N 3.31Å; H1393-W1395 PolarHBondContact O-N 2.98Å; W1395-M1397 VanDerWaalsContact C-N 3.33Å; W1395-M1397 PolarHBondContact O-N 3.21Å; W1395-I1398 PolarHBondContact O-N 3.44Å; W1395-S1399 WeakPolarHBondContact O-CB 3.12Å; W1395-S1399 PolarHBondContact O-N 3.39Å; W1395-S1399 PolarHBondContact O-OG 3.45Å; W1395-L1437 HydrophobicContact CH2-CD2 4.03Å; W1395-L1437 HydrophobicContact CZ3-CD2 3.68Å
1396	I	59.3	Low	55.9	Low	1 Å²	1	77.1 Å²	77.1	1%	0.005	38%	0.379	C	S	.	.	H	α-helix	trans	-58	-48	175.1	-67.5	170	0	0	0	109.8	W1379 L1380 I1392 H1393 S1399 F1400	W1379-I1396 HydrophobicContact CB-CG2 4.21Å; L1380-I1396 HydrophobicContact CD2-CB 4.48Å; L1380-I1396 HydrophobicContact CD2-CG2 4.21Å; I1392-I1396 HydrophobicContact CG2-CD1 4Å; I1392-I1396 HydrophobicContact CG2-CG1 4.37Å; I1392-I1396 WeakPolarHBondContact O-CG1 3.4Å; I1392-I1396 PolarHBondContact O-N 3Å; H1393-I1396 PolarHBondContact O-N 2.66Å; I1396-S1399 PolarHBondContact O-N 2.92Å; I1396-F1400 HydrophobicContact CG2-CD2 3.8Å; I1396-F1400 HydrophobicContact CG2-CE2 3.82Å; I1396-F1400 VanDerWaalsContact O-CD2 3.24Å; I1396-F1400 WeakPolarHBondContact O-CD2 3.49Å; I1396-F1400 PolarHBondContact O-N 3.01Å
1397	M	64.9	Low	55.5	Low	76 Å²	76	76.8 Å²	76.8	37%	0.374	38%	0.376	S	S	.	.	H	α-helix	trans	-63.1	-43	178.9	-70	-56.6	-69.6	0	0	112.6	I1376 L1380 H1393 N1394 W1395 F1400 Y1401	I1376-M1397 HydrophobicContact CG2-SD 3.58Å; I1376-M1397 VanDerWaalsContact CG2-SD 3.58Å; L1380-M1397 HydrophobicContact CD1-SD 3.82Å; L1380-M1397 HydrophobicContact CD2-CG 4.11Å; L1380-M1397 HydrophobicContact CD2-SD 4.05Å; L1380-M1397 HydrophobicContact CG-SD 4.35Å; H1393-M1397 WeakPolarHBondContact O-CB 3.4Å; H1393-M1397 VanDerWaalsContact O-CG 3.32Å; H1393-M1397 WeakPolarHBondContact O-CG 3.13Å; H1393-M1397 PolarHBondContact O-N 3.1Å; N1394-M1397 PolarHBondContact O-N 2.91Å; W1395-M1397 VanDerWaalsContact C-N 3.33Å; W1395-M1397 PolarHBondContact O-N 3.21Å; M1397-F1400 PolarHBondContact O-N 3.45Å; M1397-Y1401 WeakPolarHBondContact O-CB 3.28Å; M1397-Y1401 PolarHBondContact O-N 3.38Å
1398	I	61.7	Low	55.6	Low	106 Å²	106	70 Å²	70	54%	0.544	35%	0.348	S	S	.	.	H	α-helix	trans	-64.4	-42.7	177.6	-71.3	162.8	0	0	0	110.5	N1394 W1395 F1400 Y1401 K1402	N1394-I1398 HydrophobicContact CB-CD1 4.47Å; N1394-I1398 VanDerWaalsContact O-CB 3.29Å; N1394-I1398 WeakPolarHBondContact O-CB 3.45Å; N1394-I1398 WeakPolarHBondContact O-CD1 3.34Å; N1394-I1398 WeakPolarHBondContact O-CG1 3.44Å; N1394-I1398 PolarHBondContact O-N 3.26Å; W1395-I1398 PolarHBondContact O-N 3.44Å; I1398-F1400 VanDerWaalsContact C-N 3.35Å; I1398-F1400 PolarHBondContact O-N 2.82Å; I1398-Y1401 PolarHBondContact O-N 2.71Å; I1398-K1402 VanDerWaalsContact O-CB 3.24Å; I1398-K1402 WeakPolarHBondContact O-CB 3.16Å; I1398-K1402 PolarHBondContact O-N 3.05Å
1399	S	56.3	Low	55.9	Low	35 Å²	35	71 Å²	71	25%	0.245	36%	0.356	C	S	.	.	H	α-helix	trans	-61	-43.5	177.7	-74.3	0	0	0	0	111.7	W1395 I1396 I1403	W1395-S1399 WeakPolarHBondContact O-CB 3.12Å; W1395-S1399 PolarHBondContact O-N 3.39Å; W1395-S1399 PolarHBondContact O-OG 3.45Å; I1396-S1399 PolarHBondContact O-N 2.92Å; S1399-I1403 WeakPolarHBondContact O-CG1 3.27Å; S1399-I1403 PolarHBondContact O-N 3.18Å
1400	F	60.2	Low	55.6	Low	11 Å²	11	68.1 Å²	68.1	5%	0.048	34%	0.344	C	S	.	.	H	α-helix	trans	-71.5	-44.4	175.5	-79.4	-65.7	0	0	0	112.9	W1372 Y1375 I1376 I1396 M1397 I1398 K1402 I1403 E1404 L1437	W1372-F1400 HydrophobicContact CE3-CD1 4.44Å; W1372-F1400 HydrophobicContact CE3-CE1 4.22Å; W1372-F1400 HydrophobicContact CZ3-CD1 4.16Å; W1372-F1400 AromaticContact CZ3-CE1 3.64Å; W1372-F1400 HydrophobicContact CZ3-CE1 3.64Å; Y1375-F1400 HydrophobicContact CD1-CE1 4.49Å; Y1375-F1400 HydrophobicContact CD1-CZ 4.2Å; Y1375-F1400 HydrophobicContact CE1-CZ 4.04Å; I1376-F1400 HydrophobicContact CD1-CB 3.96Å; I1376-F1400 HydrophobicContact CD1-CD1 4.36Å; I1376-F1400 HydrophobicContact CD1-CD2 4.41Å; I1376-F1400 HydrophobicContact CD1-CG 3.99Å; I1376-F1400 HydrophobicContact CG1-CB 4.35Å; I1376-F1400 HydrophobicContact CG1-CD1 4.19Å; I1376-F1400 HydrophobicContact CG1-CD2 3.86Å; I1376-F1400 HydrophobicContact CG1-CE2 4.19Å; I1376-F1400 HydrophobicContact CG1-CG 3.86Å; I1396-F1400 HydrophobicContact CG2-CD2 3.8Å; I1396-F1400 HydrophobicContact CG2-CE2 3.82Å; I1396-F1400 VanDerWaalsContact O-CD2 3.24Å; I1396-F1400 WeakPolarHBondContact O-CD2 3.49Å; I1396-F1400 PolarHBondContact O-N 3.01Å; M1397-F1400 PolarHBondContact O-N 3.45Å; I1398-F1400 VanDerWaalsContact C-N 3.35Å; I1398-F1400 PolarHBondContact O-N 2.82Å; F1400-K1402 PolarHBondContact O-N 3.44Å; F1400-I1403 PolarHBondContact O-N 2.72Å; F1400-I1403 VanDerWaalsContact O-N 3.12Å; F1400-E1404 PolarHBondContact O-N 2.99Å; F1400-L1437 HydrophobicContact CE2-CD1 3.9Å; F1400-L1437 HydrophobicContact CZ-CD1 3.67Å
1401	Y	59.9	Low	54.9	Low	159 Å²	159	65.2 Å²	65.2	62%	0.624	32%	0.322	S	S	*	.	H	α-helix	trans	-60.6	-33.7	178	-171.1	-93.8	0	0	0	111.9	M1397 I1398 K1405	M1397-Y1401 WeakPolarHBondContact O-CB 3.28Å; M1397-Y1401 PolarHBondContact O-N 3.38Å; I1398-Y1401 PolarHBondContact O-N 2.71Å; Y1401-K1405 VanDerWaalsContact O-CB 3.22Å; Y1401-K1405 WeakPolarHBondContact O-CB 3.4Å; Y1401-K1405 PolarHBondContact O-N 2.71Å
1402	K	56.7	Low	55	Low	96 Å²	96	67.1 Å²	67.1	42%	0.417	33%	0.327	S	S	.	.	H	α-helix	trans	-70.9	-41.2	175.9	-163.8	174.3	-176.7	-178.7	0	112	I1398 F1400 E1404 K1405 D1406	I1398-K1402 VanDerWaalsContact O-CB 3.24Å; I1398-K1402 WeakPolarHBondContact O-CB 3.16Å; I1398-K1402 PolarHBondContact O-N 3.05Å; F1400-K1402 PolarHBondContact O-N 3.44Å; K1402-E1404 VanDerWaalsContact C-N 3.32Å; K1402-K1405 PolarHBondContact O-N 3.39Å; K1402-D1406 VanDerWaalsContact O-CB 3.29Å; K1402-D1406 WeakPolarHBondContact O-CB 3.37Å; K1402-D1406 PolarHBondContact O-N 2.84Å
1403	I	51.9	Low	54.9	Low	74 Å²	74	73.8 Å²	73.8	38%	0.379	36%	0.355	S	S	.	.	H	α-helix	trans	-61.4	-44.2	173	-67.3	165.4	0	0	0	110.2	S1399 F1400 F1407 P1433	S1399-I1403 WeakPolarHBondContact O-CG1 3.27Å; S1399-I1403 PolarHBondContact O-N 3.18Å; F1400-I1403 PolarHBondContact O-N 2.72Å; F1400-I1403 VanDerWaalsContact O-N 3.12Å; I1403-F1407 WeakPolarHBondContact O-CB 3.43Å; I1403-F1407 PolarHBondContact O-N 3.18Å; I1403-P1433 HydrophobicContact CD1-CG 4Å
1404	E	51.3	Low	54.1	Low	81 Å²	81	75.6 Å²	75.6	38%	0.379	37%	0.365	S	S	.	.	H	α-helix	trans	-59.4	-58.2	175.5	-172.1	176.6	-173.4	0	0	109.7	F1400 K1402 D1406 F1407 I1408	F1400-E1404 PolarHBondContact O-N 2.99Å; K1402-E1404 VanDerWaalsContact C-N 3.32Å; E1404-D1406 VanDerWaalsContact C-N 3.33Å; E1404-D1406 PolarHBondContact O-N 3.22Å; E1404-F1407 CarbonylContact O-C 3.56Å; E1404-F1407 WeakPolarHBondContact O-CA 3.38Å; E1404-F1407 VanDerWaalsContact O-CB 3.29Å; E1404-F1407 WeakPolarHBondContact O-CB 3.3Å; E1404-F1407 PolarHBondContact O-N 3.38Å; E1404-I1408 HydrophobicContact CG-CD1 4.13Å; E1404-I1408 HydrophobicContact CG-CG1 4.3Å; E1404-I1408 VanDerWaalsContact O-CG1 3.23Å; E1404-I1408 WeakPolarHBondContact O-CG1 3.33Å; E1404-I1408 PolarHBondContact O-N 3.1Å
1405	K	57.9	Low	53.4	Low	111 Å²	111	80.6 Å²	80.6	48%	0.483	38%	0.383	S	S	.	.	H	α-helix	trans	-53.8	-45.1	179.3	-174.4	178.8	178.4	178.1	0	113.1	Y1401 K1402 F1407 I1408 D1409	Y1401-K1405 VanDerWaalsContact O-CB 3.22Å; Y1401-K1405 WeakPolarHBondContact O-CB 3.4Å; Y1401-K1405 PolarHBondContact O-N 2.71Å; K1402-K1405 PolarHBondContact O-N 3.39Å; K1405-F1407 VanDerWaalsContact C-N 3.27Å; K1405-F1407 PolarHBondContact O-N 3.42Å; K1405-I1408 PolarHBondContact O-N 3.4Å; K1405-D1409 WeakPolarHBondContact O-CB 3.36Å; K1405-D1409 PolarHBondContact O-N 3.14Å
1406	D	52	Low	52.6	Low	62 Å²	62	82.2 Å²	82.2	33%	0.332	40%	0.402	S	S	.	.	H	α-helix	trans	-65.8	-32.7	179.1	-69.8	-16.4	0	0	0	111.4	K1402 E1404 S1410	K1402-D1406 VanDerWaalsContact O-CB 3.29Å; K1402-D1406 WeakPolarHBondContact O-CB 3.37Å; K1402-D1406 PolarHBondContact O-N 2.84Å; E1404-D1406 VanDerWaalsContact C-N 3.33Å; E1404-D1406 PolarHBondContact O-N 3.22Å; D1406-S1410 WeakPolarHBondContact O-CB 3.33Å; D1406-S1410 PolarHBondContact O-N 3.1Å; D1406-S1410 PolarHBondContact O-OG 2.81Å
1407	F	45.3	Very low	51.4	Low	50 Å²	50	86 Å²	86	22%	0.219	42%	0.422	C	S	.	.	H	α-helix	trans	-70.5	-42.9	171.9	-167.3	-104.5	0	0	0	111.8	I1403 E1404 K1405 S1410 L1411 A1425 L1426	I1403-F1407 WeakPolarHBondContact O-CB 3.43Å; I1403-F1407 PolarHBondContact O-N 3.18Å; E1404-F1407 CarbonylContact O-C 3.56Å; E1404-F1407 WeakPolarHBondContact O-CA 3.38Å; E1404-F1407 VanDerWaalsContact O-CB 3.29Å; E1404-F1407 WeakPolarHBondContact O-CB 3.3Å; E1404-F1407 PolarHBondContact O-N 3.38Å; K1405-F1407 VanDerWaalsContact C-N 3.27Å; K1405-F1407 PolarHBondContact O-N 3.42Å; F1407-S1410 WeakPolarHBondContact O-CB 3.47Å; F1407-S1410 PolarHBondContact O-N 3.3Å; F1407-L1411 HydrophobicContact CD1-CD1 3.72Å; F1407-L1411 HydrophobicContact CD1-CG 4.49Å; F1407-L1411 HydrophobicContact CE1-CD1 3.24Å; F1407-L1411 HydrophobicContact CE1-CG 4.09Å; F1407-L1411 HydrophobicContact CZ-CD1 3.86Å; F1407-L1411 HydrophobicContact CZ-CG 4.31Å; F1407-L1411 PolarHBondContact O-N 3.27Å; F1407-A1425 HydrophobicContact CE1-CB 4.44Å; F1407-A1425 HydrophobicContact CZ-CB 4.43Å; F1407-A1425 WeakPolarHBondContact CZ-O 3.41Å; F1407-L1426 HydrophobicContact CD1-CD2 4.23Å; F1407-L1426 HydrophobicContact CD1-CG 4.49Å; F1407-L1426 HydrophobicContact CE1-CG 4.41Å
1408	I	48.4	Very low	50.5	Low	49 Å²	49	86.9 Å²	86.9	25%	0.251	43%	0.432	S	S	.	.	H	α-helix	trans	-60.2	-46.1	174.1	-56.5	-160.7	0	0	0	110.5	E1404 K1405 S1410 L1411 N1412 F1422	E1404-I1408 HydrophobicContact CG-CD1 4.13Å; E1404-I1408 HydrophobicContact CG-CG1 4.3Å; E1404-I1408 VanDerWaalsContact O-CG1 3.23Å; E1404-I1408 WeakPolarHBondContact O-CG1 3.33Å; E1404-I1408 PolarHBondContact O-N 3.1Å; K1405-I1408 PolarHBondContact O-N 3.4Å; I1408-S1410 VanDerWaalsContact C-N 3.26Å; I1408-S1410 PolarHBondContact O-N 3.46Å; I1408-L1411 PolarHBondContact O-N 3.45Å; I1408-N1412 WeakPolarHBondContact CG2-ND2 3.08Å; I1408-N1412 WeakPolarHBondContact O-CB 3.33Å; I1408-N1412 PolarHBondContact O-N 3.05Å; I1408-N1412 PolarHBondContact O-ND2 3.33Å; I1408-F1422 HydrophobicContact CB-CZ 4.28Å; I1408-F1422 HydrophobicContact CD1-CE1 4.35Å; I1408-F1422 HydrophobicContact CD1-CZ 3.82Å; I1408-F1422 HydrophobicContact CG1-CE1 4.41Å; I1408-F1422 HydrophobicContact CG1-CZ 3.62Å; I1408-F1422 HydrophobicContact CG2-CZ 4.24Å
1409	D	55.6	Low	49.8	Very low	77 Å²	77	88 Å²	88	41%	0.412	44%	0.439	S	S	.	.	H	α-helix	trans	-64.8	-32	178.6	-77.4	-17.7	0	0	0	111.9	K1405	K1405-D1409 WeakPolarHBondContact O-CB 3.36Å; K1405-D1409 PolarHBondContact O-N 3.14Å
1410	S	47.2	Very low	49.2	Very low	47 Å²	47	92.7 Å²	92.7	33%	0.329	46%	0.461	S	S	.	.	H	α-helix	trans	-72.8	-39.9	173.6	-62.2	0	0	0	0	112.2	D1406 F1407 I1408	D1406-S1410 WeakPolarHBondContact O-CB 3.33Å; D1406-S1410 PolarHBondContact O-N 3.1Å; D1406-S1410 PolarHBondContact O-OG 2.81Å; F1407-S1410 WeakPolarHBondContact O-CB 3.47Å; F1407-S1410 PolarHBondContact O-N 3.3Å; I1408-S1410 VanDerWaalsContact C-N 3.26Å; I1408-S1410 PolarHBondContact O-N 3.46Å
1411	L	40.9	Very low	48.5	Very low	24 Å²	24	97.1 Å²	97.1	13%	0.126	48%	0.482	C	S	.	.	H	α-helix	trans	-72.8	-37.1	177	-87.8	171.9	0	0	0	113.1	F1407 I1408 K1413 I1414 L1417 F1422 A1425	F1407-L1411 HydrophobicContact CD1-CD1 3.72Å; F1407-L1411 HydrophobicContact CD1-CG 4.49Å; F1407-L1411 HydrophobicContact CE1-CD1 3.24Å; F1407-L1411 HydrophobicContact CE1-CG 4.09Å; F1407-L1411 HydrophobicContact CZ-CD1 3.86Å; F1407-L1411 HydrophobicContact CZ-CG 4.31Å; F1407-L1411 PolarHBondContact O-N 3.27Å; I1408-L1411 PolarHBondContact O-N 3.45Å; L1411-K1413 PolarHBondContact O-N 2.84Å; L1411-K1413 VanDerWaalsContact O-N 3.12Å; L1411-I1414 CarbonylContact O-C 3.51Å; L1411-I1414 WeakPolarHBondContact O-CA 3.19Å; L1411-I1414 PolarHBondContact O-N 3.34Å; L1411-I1414 VanDerWaalsContact O-O 3.14Å; L1411-L1417 HydrophobicContact CD2-CD1 3.89Å; L1411-F1422 HydrophobicContact CB-CE2 4.29Å; L1411-F1422 HydrophobicContact CD1-CD2 3.73Å; L1411-F1422 HydrophobicContact CD1-CE2 3.72Å; L1411-A1425 HydrophobicContact CD1-CB 4.41Å
1412	N	53.7	Low	47.8	Very low	101 Å²	101	91.4 Å²	91.4	54%	0.54	46%	0.461	S	S	.	.	H	α-helix	trans	-61.5	-21.9	176.8	-80.8	-24.6	0	0	0	112.7	I1408 I1414	I1408-N1412 WeakPolarHBondContact CG2-ND2 3.08Å; I1408-N1412 WeakPolarHBondContact O-CB 3.33Å; I1408-N1412 PolarHBondContact O-N 3.05Å; I1408-N1412 PolarHBondContact O-ND2 3.33Å; N1412-I1414 PolarHBondContact O-N 2.97Å
1413	K	51.3	Low	47.1	Very low	165 Å²	165	94.7 Å²	94.7	72%	0.717	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-19.6	169.9	-72.6	174.8	-179	168	0	112.9	L1411	L1411-K1413 PolarHBondContact O-N 2.84Å; L1411-K1413 VanDerWaalsContact O-N 3.12Å
1414	I	38.9	Very low	46.6	Very low	89 Å²	89	98.2 Å²	98.2	46%	0.456	49%	0.491	S	S	.	.	S	Bend	trans	-107.9	78.9	177.7	-50.9	177.3	0	0	0	107.6	L1411 N1412 T1416	L1411-I1414 CarbonylContact O-C 3.51Å; L1411-I1414 WeakPolarHBondContact O-CA 3.19Å; L1411-I1414 PolarHBondContact O-N 3.34Å; L1411-I1414 VanDerWaalsContact O-O 3.14Å; N1412-I1414 PolarHBondContact O-N 2.97Å; I1414-T1416 PolarHBondContact O-N 2.77Å
1415	K	46.9	Very low	46.3	Very low	195 Å²	195	96.2 Å²	96.2	85%	0.848	49%	0.488	S	S	*	.			trans	-59	19.1	-167.8	-79.7	-172.3	171.7	-174.3	0	118.4
1416	T	44.7	Very low	45.8	Very low	117 Å²	117	93.1 Å²	93.1	72%	0.718	48%	0.477	S	S	*	.			trans	-142	45.7	-167.8	63	0	0	0	0	114.8	I1414	I1414-T1416 PolarHBondContact O-N 2.77Å
1417	L	34.7	Very low	45.8	Very low	82 Å²	82	92.2 Å²	92.2	43%	0.429	47%	0.474	S	S	.	.			trans	-129.8	131.6	172	-68.8	165.1	0	0	0	109.8	L1411 Q1421	L1411-L1417 HydrophobicContact CD2-CD1 3.89Å; L1417-Q1421 HydrophobicContact CB-CB 4.47Å; L1417-Q1421 HydrophobicContact CD2-CB 4.2Å
1418	T	45.9	Very low	46	Very low	94 Å²	94	93 Å²	93	58%	0.577	49%	0.486	S	S	*	.			trans	-77.4	155.8	177.5	48.4	0	0	0	0	111	D1420 Q1421 F1422	T1418-D1420 PolarHBondContact O-N 3Å; T1418-D1420 VanDerWaalsContact O-N 3.09Å; T1418-Q1421 WeakPolarHBondContact O-CA 3.28Å; T1418-Q1421 WeakPolarHBondContact O-CB 3.36Å; T1418-Q1421 PolarHBondContact O-N 2.82Å; T1418-F1422 PolarHBondContact O-N 2.66Å
1419	N	46	Very low	46.5	Very low	129 Å²	129	92.3 Å²	92.3	69%	0.69	48%	0.483	S	S	*	.	H	α-helix	trans	-54	-32.1	-173.6	-73.8	-6.6	0	0	0	114.3	Q1421 F1422	N1419-Q1421 VanDerWaalsContact C-N 3.35Å; N1419-F1422 VanDerWaalsContact O-CB 3.23Å; N1419-F1422 WeakPolarHBondContact O-CB 3.4Å; N1419-F1422 PolarHBondContact O-N 2.91Å
1420	D	43.2	Very low	46.2	Very low	134 Å²	134	94.2 Å²	94.2	72%	0.717	49%	0.493	S	S	*	.	H	α-helix	trans	-72.7	-27.9	176.5	-67.2	-20.1	0	0	0	112.9	T1418 F1422 N1424	T1418-D1420 PolarHBondContact O-N 3Å; T1418-D1420 VanDerWaalsContact O-N 3.09Å; D1420-F1422 VanDerWaalsContact C-N 3.32Å; D1420-N1424 PolarHBondContact O-ND2 3.25Å
1421	Q	46.7	Very low	46.5	Very low	103 Å²	103	97 Å²	97	48%	0.481	50%	0.503	S	S	.	.	H	α-helix	trans	-77.2	-22.7	172.1	-66.2	-173.1	-22.4	0	0	111.9	L1417 T1418 N1419 A1425	L1417-Q1421 HydrophobicContact CB-CB 4.47Å; L1417-Q1421 HydrophobicContact CD2-CB 4.2Å; T1418-Q1421 WeakPolarHBondContact O-CA 3.28Å; T1418-Q1421 WeakPolarHBondContact O-CB 3.36Å; T1418-Q1421 PolarHBondContact O-N 2.82Å; N1419-Q1421 VanDerWaalsContact C-N 3.35Å; Q1421-A1425 WeakPolarHBondContact O-CB 3.46Å; Q1421-A1425 PolarHBondContact O-N 3.1Å
1422	F	43.9	Very low	47.5	Very low	40 Å²	40	95.9 Å²	95.9	18%	0.175	50%	0.498	C	S	.	.	H	α-helix	trans	-67.3	-47.4	179.5	-171.2	-91.2	0	0	0	112.5	I1408 L1411 T1418 N1419 D1420 N1424 A1425	I1408-F1422 HydrophobicContact CB-CZ 4.28Å; I1408-F1422 HydrophobicContact CD1-CE1 4.35Å; I1408-F1422 HydrophobicContact CD1-CZ 3.82Å; I1408-F1422 HydrophobicContact CG1-CE1 4.41Å; I1408-F1422 HydrophobicContact CG1-CZ 3.62Å; I1408-F1422 HydrophobicContact CG2-CZ 4.24Å; L1411-F1422 HydrophobicContact CB-CE2 4.29Å; L1411-F1422 HydrophobicContact CD1-CD2 3.73Å; L1411-F1422 HydrophobicContact CD1-CE2 3.72Å; T1418-F1422 PolarHBondContact O-N 2.66Å; N1419-F1422 VanDerWaalsContact O-CB 3.23Å; N1419-F1422 WeakPolarHBondContact O-CB 3.4Å; N1419-F1422 PolarHBondContact O-N 2.91Å; D1420-F1422 VanDerWaalsContact C-N 3.32Å; F1422-N1424 VanDerWaalsContact C-N 3.29Å; F1422-N1424 PolarHBondContact O-N 2.6Å; F1422-A1425 WeakPolarHBondContact O-CB 3.48Å; F1422-A1425 PolarHBondContact O-N 3.4Å
1423	Y	42.4	Very low	48.1	Very low	165 Å²	165	92.7 Å²	92.7	65%	0.647	48%	0.482	S	S	*	.	H	α-helix	trans	-67.3	-31.5	178.4	-75.9	-73.6	0	0	0	112.8	A1425 L1426	Y1423-A1425 PolarHBondContact O-N 3.29Å; Y1423-L1426 HydrophobicContact CD1-CD1 4.2Å
1424	N	42.1	Very low	48.8	Very low	148 Å²	148	85.3 Å²	85.3	79%	0.791	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-9.9	173	-71.2	-34.3	0	0	0	113.5	D1420 F1422	D1420-N1424 PolarHBondContact O-ND2 3.25Å; F1422-N1424 VanDerWaalsContact C-N 3.29Å; F1422-N1424 PolarHBondContact O-N 2.6Å
1425	A	44.4	Very low	50.2	Low	38 Å²	38	81.5 Å²	81.5	31%	0.314	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-16.2	-178.7	0	0	0	0	0	113.9	F1407 L1411 Q1421 F1422 Y1423	F1407-A1425 HydrophobicContact CE1-CB 4.44Å; F1407-A1425 HydrophobicContact CZ-CB 4.43Å; F1407-A1425 WeakPolarHBondContact CZ-O 3.41Å; L1411-A1425 HydrophobicContact CD1-CB 4.41Å; Q1421-A1425 WeakPolarHBondContact O-CB 3.46Å; Q1421-A1425 PolarHBondContact O-N 3.1Å; F1422-A1425 WeakPolarHBondContact O-CB 3.48Å; F1422-A1425 PolarHBondContact O-N 3.4Å; Y1423-A1425 PolarHBondContact O-N 3.29Å
1426	L	48.7	Very low	51	Low	47 Å²	47	75.4 Å²	75.4	25%	0.246	41%	0.408	C	S	.	.	S	Bend	trans	-54.4	136.1	176.7	-85.2	147.3	0	0	0	110.3	F1407 Y1423	F1407-L1426 HydrophobicContact CD1-CD2 4.23Å; F1407-L1426 HydrophobicContact CD1-CG 4.49Å; F1407-L1426 HydrophobicContact CE1-CG 4.41Å; Y1423-L1426 HydrophobicContact CD1-CD1 4.2Å
1427	P	51.1	Low	52	Low	42 Å²	42	70.1 Å²	70.1	27%	0.273	38%	0.375	S	S	.	.	P	Polyproline II helix	trans	-57.3	147.5	179.5	20.9	-29.4	0	0	0	110.6	W1372 L1431	W1372-P1427 WeakPolarHBondContact CZ2-O 3.35Å; W1372-P1427 PolarHBondContact NE1-O 3.49Å; P1427-L1431 HydrophobicContact CB-CD1 3.85Å
1428	S	50.3	Low	53.6	Low	68 Å²	68	66.7 Å²	66.7	48%	0.476	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-59.2	143.5	179.8	75.7	0	0	0	0	110.2	N1430 L1431	S1428-N1430 PolarHBondContact O-N 2.88Å; S1428-L1431 WeakPolarHBondContact O-CB 3.35Å; S1428-L1431 PolarHBondContact O-N 3.26Å
1429	I	57.2	Low	54.5	Low	34 Å²	34	65.3 Å²	65.3	17%	0.174	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-51.5	-25.4	178.7	-94.5	164.4	0	0	0	112.8	I1370 W1372 Y1375 L1431 A1432	I1370-I1429 HydrophobicContact CB-CD1 4.26Å; I1370-I1429 HydrophobicContact CG2-CD1 4.07Å; I1370-I1429 VanDerWaalsContact O-CD1 3.23Å; I1370-I1429 WeakPolarHBondContact O-CD1 3.39Å; W1372-I1429 HydrophobicContact CD2-CG1 3.8Å; W1372-I1429 HydrophobicContact CE3-CG1 3.99Å; W1372-I1429 HydrophobicContact CG-CG1 4.25Å; W1372-I1429 HydrophobicContact CH2-CG1 4.36Å; W1372-I1429 HydrophobicContact CZ2-CG1 4.18Å; W1372-I1429 HydrophobicContact CZ3-CG1 4.23Å; Y1375-I1429 HydrophobicContact CD2-CG2 4.04Å; Y1375-I1429 HydrophobicContact CE2-CG2 4.29Å; Y1375-I1429 HydrophobicContact CG-CD1 4.2Å; Y1375-I1429 HydrophobicContact CG-CG1 4.27Å; Y1375-I1429 HydrophobicContact CG-CG2 4.42Å; I1429-L1431 PolarHBondContact O-N 3.29Å; I1429-L1431 VanDerWaalsContact O-N 3.09Å; I1429-A1432 WeakPolarHBondContact O-CB 3.13Å; I1429-A1432 PolarHBondContact O-N 3.04Å
1430	N	51.2	Low	55.2	Low	117 Å²	117	59.9 Å²	59.9	63%	0.626	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-58.3	-23.1	175.5	-64.7	-9.8	0	0	0	112.8	V1263 S1428 A1432	V1263-N1430 WeakPolarHBondContact CG1-O 3.33Å; S1428-N1430 PolarHBondContact O-N 2.88Å; N1430-A1432 VanDerWaalsContact C-N 3.32Å
1431	L	52.9	Low	56	Low	104 Å²	104	54.4 Å²	54.4	55%	0.545	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-88.2	6.4	176.8	-64.8	164.5	0	0	0	113.4	V1263 P1427 S1428 I1429	V1263-L1431 HydrophobicContact CG1-CD2 4.27Å; V1263-L1431 HydrophobicContact CG2-CD2 3.9Å; P1427-L1431 HydrophobicContact CB-CD1 3.85Å; S1428-L1431 WeakPolarHBondContact O-CB 3.35Å; S1428-L1431 PolarHBondContact O-N 3.26Å; I1429-L1431 PolarHBondContact O-N 3.29Å; I1429-L1431 VanDerWaalsContact O-N 3.09Å
1432	A	61.7	Low	56.7	Low	1 Å²	1	51.5 Å²	51.5	1%	0.008	27%	0.274	C	S	.	.	S	Bend	trans	-62.7	141.5	175.3	0	0	0	0	0	111.2	W1372 Y1375 I1429 N1430 N1434	W1372-A1432 HydrophobicContact CH2-CB 3.74Å; W1372-A1432 HydrophobicContact CZ3-CB 3.9Å; Y1375-A1432 HydrophobicContact CD1-CB 4.49Å; Y1375-A1432 HydrophobicContact CE1-CB 3.69Å; I1429-A1432 WeakPolarHBondContact O-CB 3.13Å; I1429-A1432 PolarHBondContact O-N 3.04Å; N1430-A1432 VanDerWaalsContact C-N 3.32Å; A1432-N1434 WeakPolarHBondContact CB-OD1 3.48Å; A1432-N1434 PolarHBondContact O-N 3.44Å; A1432-N1434 PolarHBondContact O-OD1 3.5Å
1433	P	65.6	Low	57.3	Low	34 Å²	34	53.8 Å²	53.8	22%	0.221	28%	0.284	C	S	.	.			trans	-78.8	56.7	-174.7	34.2	-37.7	0	0	0	112.4	D1264 I1403 L1435 N1436 L1437	D1264-P1433 VanDerWaalsContact OD2-C 3.27Å; D1264-P1433 WeakPolarHBondContact OD2-CA 3.48Å; I1403-P1433 HydrophobicContact CD1-CG 4Å; P1433-L1435 PolarHBondContact O-N 2.99Å; P1433-N1436 PolarHBondContact O-N 3.37Å; P1433-L1437 PolarHBondContact O-N 3.45Å
1434	N	66.8	Low	57.5	Low	11 Å²	11	50.2 Å²	50.2	6%	0.059	28%	0.276	C	S	.	.	H	α-helix	trans	-57.2	-36.9	-171	-63.4	-18.7	0	0	0	112.6	D1264 P1265 L1270 Y1375 A1432 F1438	D1264-N1434 HydrophobicContact CB-CB 4.48Å; D1264-N1434 PolarHBondContact OD2-N 3.43Å; P1265-N1434 PolarHBondContact O-ND2 2.86Å; L1270-N1434 HydrophobicContact CD1-CB 4.44Å; Y1375-N1434 VanDerWaalsContact OH-CG 3.29Å; Y1375-N1434 PolarHBondContact OH-OD1 2.89Å; A1432-N1434 WeakPolarHBondContact CB-OD1 3.48Å; A1432-N1434 PolarHBondContact O-N 3.44Å; A1432-N1434 PolarHBondContact O-OD1 3.5Å; N1434-F1438 VanDerWaalsContact O-CB 3.25Å; N1434-F1438 WeakPolarHBondContact O-CB 3.39Å; N1434-F1438 PolarHBondContact O-N 3.31Å
1435	L	67	Low	57.1	Low	8 Å²	8	52 Å²	52	4%	0.042	27%	0.273	C	S	.	.	H	α-helix	trans	-67.7	-42.4	-176.2	-159.2	101.4	0	0	0	111.4	L1250 S1254 D1264 P1265 L1270 P1433 F1438 Y1439	L1250-L1435 HydrophobicContact CD1-CD1 3.8Å; L1250-L1435 HydrophobicContact CD2-CD1 4.04Å; L1250-L1435 HydrophobicContact CD2-CG 3.94Å; L1250-L1435 HydrophobicContact CG-CD1 3.79Å; L1250-L1435 HydrophobicContact CG-CD2 4.29Å; L1250-L1435 HydrophobicContact CG-CG 4.02Å; S1254-L1435 WeakPolarHBondContact OG-CD2 3.42Å; D1264-L1435 HydrophobicContact CB-CB 4.24Å; D1264-L1435 VanDerWaalsContact OD2-CB 3.31Å; D1264-L1435 WeakPolarHBondContact OD2-CB 3.37Å; D1264-L1435 PolarHBondContact OD2-N 3.46Å; D1264-L1435 VanDerWaalsContact OD2-N 3.16Å; P1265-L1435 VanDerWaalsContact CD-CD1 3.47Å; P1265-L1435 HydrophobicContact CG-CD1 3.71Å; L1270-L1435 HydrophobicContact CD1-CD1 4.26Å; L1270-L1435 HydrophobicContact CD2-CD1 3.87Å; P1433-L1435 PolarHBondContact O-N 2.99Å; L1435-F1438 PolarHBondContact O-N 3.04Å; L1435-Y1439 WeakPolarHBondContact O-CB 3.22Å; L1435-Y1439 PolarHBondContact O-N 3.39Å
1436	N	64.7	Low	56.3	Low	68 Å²	68	57.7 Å²	57.7	36%	0.364	29%	0.293	S	S	.	.	H	α-helix	trans	-71.5	-38.3	-179.5	-57.8	-49.6	0	0	0	111.4	K1258 P1433 G1440	K1258-N1436 PolarHBondContact NZ-OD1 2.88Å; P1433-N1436 PolarHBondContact O-N 3.37Å; N1436-G1440 PolarHBondContact O-N 3.4Å
1437	L	64.9	Low	55.4	Low	5 Å²	5	61.6 Å²	61.6	3%	0.026	32%	0.322	C	S	.	.	H	α-helix	trans	-63.6	-44.8	174.6	-72.3	170.6	0	0	0	110.9	W1379 W1395 F1400 P1433 G1440 L1441	W1379-L1437 HydrophobicContact CD2-CD1 4.38Å; W1379-L1437 HydrophobicContact CH2-CB 3.74Å; W1379-L1437 HydrophobicContact CZ2-CB 3.79Å; W1379-L1437 HydrophobicContact CZ2-CD1 3.98Å; W1379-L1437 HydrophobicContact CZ3-CB 4.29Å; W1395-L1437 HydrophobicContact CH2-CD2 4.03Å; W1395-L1437 HydrophobicContact CZ3-CD2 3.68Å; F1400-L1437 HydrophobicContact CE2-CD1 3.9Å; F1400-L1437 HydrophobicContact CZ-CD1 3.67Å; P1433-L1437 PolarHBondContact O-N 3.45Å; L1437-G1440 PolarHBondContact O-N 3.33Å; L1437-L1441 PolarHBondContact O-N 3.3Å
1438	F	67.8	Low	54.2	Low	11 Å²	11	64.5 Å²	64.5	5%	0.048	34%	0.342	C	S	.	.	H	α-helix	trans	-64.1	-44.9	177.5	-170.5	-104.2	0	0	0	112.4	L1246 L1250 L1267 L1270 I1271 Y1274 N1434 L1435 G1440 L1441 I1442	L1246-F1438 HydrophobicContact CD2-CE1 4.4Å; L1250-F1438 HydrophobicContact CD2-CD1 4.28Å; L1267-F1438 HydrophobicContact CD1-CD2 4.19Å; L1270-F1438 HydrophobicContact CB-CD1 3.95Å; L1270-F1438 HydrophobicContact CB-CD2 4.19Å; L1270-F1438 HydrophobicContact CB-CE1 3.96Å; L1270-F1438 HydrophobicContact CB-CE2 4.22Å; L1270-F1438 HydrophobicContact CB-CG 4.05Å; L1270-F1438 HydrophobicContact CB-CZ 4.09Å; L1270-F1438 HydrophobicContact CD1-CB 3.96Å; L1270-F1438 HydrophobicContact CD1-CD1 4.31Å; L1270-F1438 HydrophobicContact CD1-CG 4.13Å; L1270-F1438 WeakPolarHBondContact O-CZ 3.43Å; I1271-F1438 HydrophobicContact CG1-CD2 4.48Å; I1271-F1438 HydrophobicContact CG1-CE2 3.8Å; Y1274-F1438 HydrophobicContact CG-CZ 4.32Å; N1434-F1438 VanDerWaalsContact O-CB 3.25Å; N1434-F1438 WeakPolarHBondContact O-CB 3.39Å; N1434-F1438 PolarHBondContact O-N 3.31Å; L1435-F1438 PolarHBondContact O-N 3.04Å; F1438-G1440 VanDerWaalsContact C-N 3.35Å; F1438-G1440 PolarHBondContact O-N 3.36Å; F1438-L1441 PolarHBondContact O-N 2.75Å; F1438-I1442 HydrophobicContact CD1-CD1 3.92Å; F1438-I1442 HydrophobicContact CE1-CD1 3.32Å; F1438-I1442 HydrophobicContact CE1-CG1 4.43Å; F1438-I1442 HydrophobicContact CE2-CD1 4.23Å; F1438-I1442 HydrophobicContact CZ-CD1 3.51Å; F1438-I1442 HydrophobicContact CZ-CG1 4.46Å; F1438-I1442 PolarHBondContact O-N 2.91Å
1439	Y	65.4	Low	53.1	Low	64 Å²	64	69.5 Å²	69.5	25%	0.251	36%	0.36	S	S	.	.	H	α-helix	trans	-59.1	-44.6	175.9	-172.5	-88.1	0	0	0	112	L1247 A1251 L1435 L1441 I1442 K1443	L1247-Y1439 HydrophobicContact CB-CD2 4.47Å; L1247-Y1439 HydrophobicContact CB-CE2 3.87Å; L1247-Y1439 HydrophobicContact CD2-CD2 3.95Å; L1247-Y1439 HydrophobicContact CD2-CE2 4.12Å; L1247-Y1439 HydrophobicContact CG-CE2 4.48Å; A1251-Y1439 HydrophobicContact CB-CE2 4.32Å; L1435-Y1439 WeakPolarHBondContact O-CB 3.22Å; L1435-Y1439 PolarHBondContact O-N 3.39Å; Y1439-L1441 VanDerWaalsContact C-N 3.32Å; Y1439-L1441 PolarHBondContact O-N 3.4Å; Y1439-I1442 PolarHBondContact O-N 3.46Å; Y1439-K1443 HydrophobicContact CE1-CD 3.65Å; Y1439-K1443 PolarHBondContact O-N 2.88Å; Y1439-K1443 PolarHBondContact OH-NZ 2.89Å
1440	G	60.8	Low	51.9	Low	15 Å²	15	72.6 Å²	72.6	16%	0.155	38%	0.38	C	S	.	.	H	α-helix	trans	-66.2	-30.8	177.7	0	0	0	0	0	113.9	N1436 L1437 F1438 N1444	N1436-G1440 PolarHBondContact O-N 3.4Å; L1437-G1440 PolarHBondContact O-N 3.33Å; F1438-G1440 VanDerWaalsContact C-N 3.35Å; F1438-G1440 PolarHBondContact O-N 3.36Å; G1440-N1444 PolarHBondContact O-ND2 3.05Å
1441	L	61.2	Low	50.8	Low	19 Å²	19	76.6 Å²	76.6	10%	0.099	39%	0.386	C	S	.	.	H	α-helix	trans	-72.3	-38.6	177.3	-95	155.7	0	0	0	113.2	W1379 L1382 F1388 L1437 F1438 Y1439	W1379-L1441 HydrophobicContact CE3-CD1 3.65Å; W1379-L1441 HydrophobicContact CH2-CD1 4.22Å; W1379-L1441 HydrophobicContact CZ3-CD1 3.18Å; L1382-L1441 HydrophobicContact CD2-CD1 4.27Å; F1388-L1441 HydrophobicContact CD2-CD2 3.71Å; F1388-L1441 HydrophobicContact CE2-CD2 3.52Å; F1388-L1441 HydrophobicContact CZ-CD2 4.45Å; L1437-L1441 PolarHBondContact O-N 3.3Å; F1438-L1441 PolarHBondContact O-N 2.75Å; Y1439-L1441 VanDerWaalsContact C-N 3.32Å; Y1439-L1441 PolarHBondContact O-N 3.4Å
1442	I	60.6	Low	49.8	Very low	43 Å²	43	75.6 Å²	75.6	22%	0.221	39%	0.388	C	S	.	.	H	α-helix	trans	-75.8	-40	-179.2	-64.6	178.1	0	0	0	111.8	I1242 L1246 L1247 Y1274 F1438 Y1439 N1444	I1242-I1442 HydrophobicContact CG2-CG2 4.24Å; L1246-I1442 HydrophobicContact CD2-CD1 4.14Å; L1247-I1442 HydrophobicContact CD1-CG2 4.18Å; L1247-I1442 HydrophobicContact CD2-CB 4.24Å; L1247-I1442 HydrophobicContact CD2-CD1 4.43Å; L1247-I1442 HydrophobicContact CD2-CG2 4.07Å; Y1274-I1442 HydrophobicContact CD2-CD1 3.73Å; Y1274-I1442 HydrophobicContact CE2-CD1 4.04Å; Y1274-I1442 HydrophobicContact CG-CD1 4.33Å; F1438-I1442 HydrophobicContact CD1-CD1 3.92Å; F1438-I1442 HydrophobicContact CE1-CD1 3.32Å; F1438-I1442 HydrophobicContact CE1-CG1 4.43Å; F1438-I1442 HydrophobicContact CE2-CD1 4.23Å; F1438-I1442 HydrophobicContact CZ-CD1 3.51Å; F1438-I1442 HydrophobicContact CZ-CG1 4.46Å; F1438-I1442 PolarHBondContact O-N 2.91Å; Y1439-I1442 PolarHBondContact O-N 3.46Å; I1442-N1444 PolarHBondContact O-N 2.9Å
1443	K	56.6	Low	48.3	Very low	87 Å²	87	80.8 Å²	80.8	38%	0.378	42%	0.416	S	S	.	.	H	α-helix	trans	-81.1	-11.7	-167.9	-158.2	174.7	-175.3	176.7	0	115.5	Y1439 Y1445	Y1439-K1443 HydrophobicContact CE1-CD 3.65Å; Y1439-K1443 PolarHBondContact O-N 2.88Å; Y1439-K1443 PolarHBondContact OH-NZ 2.89Å; K1443-Y1445 PolarHBondContact O-N 3.34Å
1444	N	46.1	Very low	46.7	Very low	91 Å²	91	82.4 Å²	82.4	49%	0.487	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	36.1	-165.3	-96.7	-24.9	0	0	0	116.6	G1440 I1442	G1440-N1444 PolarHBondContact O-ND2 3.05Å; I1442-N1444 PolarHBondContact O-N 2.9Å
1445	Y	34.4	Very low	45	Very low	185 Å²	185	85.8 Å²	85.8	73%	0.725	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-9.1	161.7	-84.5	-73.7	0	0	0	114.9	K1443	K1443-Y1445 PolarHBondContact O-N 3.34Å
1446	E	28.3	Very low	43.2	Very low	157 Å²	157	92 Å²	92	73%	0.734	48%	0.478	S	S	*	.	S	Bend	trans	-148.3	144.5	165.4	-82.1	-161.5	157.5	0	0	114.6	C1448	E1446-C1448 PolarHBondContact O-N 3.26Å
1447	P	28.1	Very low	41.6	Very low	130 Å²	130	94.8 Å²	94.8	84%	0.844	49%	0.492	S	S	*	.			trans	-85	95.6	-169.1	33.7	-31.9	0	0	0	111.8
1448	C	27	Very low	40.3	Very low	103 Å²	103	97.7 Å²	97.7	70%	0.696	51%	0.513	S	S	*	.			trans	-102.2	128.8	172.4	-83.3	0	0	0	0	113.7	E1446	E1446-C1448 PolarHBondContact O-N 3.26Å
1449	M	26.2	Very low	38.7	Very low	173 Å²	173	100.3 Å²	100.3	85%	0.852	53%	0.527	S	S	*	.	S	Bend	trans	0.9	142.4	153.3	-71.7	-73.3	-142.8	0	0	119.7
1450	T	32.1	Very low	37.3	Very low	99 Å²	99	104 Å²	104	61%	0.607	55%	0.546	S	S	*	.			trans	91.8	40.9	165.4	72.1	0	0	0	0	119	S1452	T1450-S1452 VanDerWaalsContact C-N 3.3Å; T1450-S1452 PolarHBondContact O-N 3.03Å
1451	R	29.1	Very low	36.2	Very low	200 Å²	200	107 Å²	107	76%	0.755	56%	0.558	S	S	*	*	H	α-helix	trans	-61.3	-29.7	165.5	-94.3	-179.4	174.7	174.1	-1.1	114.7	I1455	R1451-I1455 WeakPolarHBondContact O-CD1 3.42Å; R1451-I1455 VanDerWaalsContact O-CG1 3.27Å; R1451-I1455 WeakPolarHBondContact O-CG1 3.5Å
1452	S	31.8	Very low	35.2	Very low	83 Å²	83	110.1 Å²	110.1	58%	0.58	58%	0.578	S	S	*	*	H	α-helix	trans	-81.9	-44.7	-172.1	-175.1	0	0	0	0	113.6	T1450 A1454 I1455 H1456	T1450-S1452 VanDerWaalsContact C-N 3.3Å; T1450-S1452 PolarHBondContact O-N 3.03Å; S1452-A1454 PolarHBondContact O-N 2.85Å; S1452-I1455 PolarHBondContact O-N 2.73Å; S1452-H1456 PolarHBondContact O-N 3.31Å
1453	N	29.7	Very low	34.1	Very low	111 Å²	111	113 Å²	113	59%	0.594	59%	0.591	S	S	*	*	H	α-helix	trans	-72	-33.9	-173.9	-72.9	-8.6	0	0	0	113	H1456 L1457	N1453-H1456 PolarHBondContact O-N 2.93Å; N1453-L1457 PolarHBondContact O-N 3.35Å
1454	A	31.4	Very low	33.3	Very low	67 Å²	67	117.1 Å²	117.1	55%	0.554	60%	0.604	S	S	*	*	H	α-helix	trans	-67.2	-37.1	177.7	0	0	0	0	0	112.5	S1452 S1458	S1452-A1454 PolarHBondContact O-N 2.85Å; A1454-S1458 PolarHBondContact O-N 3.42Å
1455	I	31.6	Very low	33.1	Very low	83 Å²	83	116.7 Å²	116.7	43%	0.426	60%	0.602	S	S	.	*	H	α-helix	trans	-71.2	-36.8	179.2	-65.3	174.3	0	0	0	110.9	R1451 S1452 S1458 L1459	R1451-I1455 WeakPolarHBondContact O-CD1 3.42Å; R1451-I1455 VanDerWaalsContact O-CG1 3.27Å; R1451-I1455 WeakPolarHBondContact O-CG1 3.5Å; S1452-I1455 PolarHBondContact O-N 2.73Å; I1455-S1458 PolarHBondContact O-OG 3.47Å; I1455-L1459 HydrophobicContact CG2-CD1 3.97Å; I1455-L1459 WeakPolarHBondContact O-CD1 3.46Å; I1455-L1459 PolarHBondContact O-N 2.96Å
1456	H	30.4	Very low	33.3	Very low	137 Å²	137	111.4 Å²	111.4	63%	0.634	59%	0.586	S	S	*	*	H	α-helix	trans	-73.1	-31.5	-176.5	-128.1	-67.1	0	0	0	113.2	S1452 N1453	S1452-H1456 PolarHBondContact O-N 3.31Å; N1453-H1456 PolarHBondContact O-N 2.93Å
1457	L	29.8	Very low	33.8	Very low	127 Å²	127	108.6 Å²	108.6	67%	0.665	58%	0.575	S	S	*	*	H	α-helix	trans	-78.9	-32.9	178.5	-81.1	159.2	0	0	0	113	N1453	N1453-L1457 PolarHBondContact O-N 3.35Å
1458	S	37.2	Very low	34.3	Very low	66 Å²	66	107.5 Å²	107.5	46%	0.462	56%	0.559	S	S	.	*	H	α-helix	trans	-68.9	-39.2	176.9	70.5	0	0	0	0	112.3	A1454 I1455 H1460 N1461 V1462	A1454-S1458 PolarHBondContact O-N 3.42Å; I1455-S1458 PolarHBondContact O-OG 3.47Å; S1458-H1460 VanDerWaalsContact C-N 3.34Å; S1458-H1460 PolarHBondContact O-N 3.34Å; S1458-N1461 PolarHBondContact O-N 3.05Å; S1458-V1462 WeakPolarHBondContact O-CG2 3.41Å; S1458-V1462 PolarHBondContact O-N 3.38Å
1459	L	34.1	Very low	35	Very low	66 Å²	66	106.3 Å²	106.3	35%	0.346	55%	0.548	S	S	.	.	H	α-helix	trans	-65.2	-35.3	-178.7	-86.5	158.9	0	0	0	113	I1455 N1461 H1463	I1455-L1459 HydrophobicContact CG2-CD1 3.97Å; I1455-L1459 WeakPolarHBondContact O-CD1 3.46Å; I1455-L1459 PolarHBondContact O-N 2.96Å; L1459-N1461 VanDerWaalsContact C-N 3.34Å; L1459-N1461 PolarHBondContact O-N 3.1Å; L1459-H1463 PolarHBondContact O-N 3.16Å
1460	H	36.4	Very low	35.5	Very low	142 Å²	142	100.6 Å²	100.6	66%	0.657	53%	0.525	S	S	*	.	H	α-helix	trans	-70.8	-31.1	-178.1	-150.2	-79.9	0	0	0	112.4	S1458 R1464	S1458-H1460 VanDerWaalsContact C-N 3.34Å; S1458-H1460 PolarHBondContact O-N 3.34Å; H1460-R1464 PolarHBondContact O-N 3.23Å
1461	N	38.1	Very low	35.7	Very low	77 Å²	77	100 Å²	100	41%	0.412	52%	0.517	S	S	.	.	H	α-helix	trans	-83.9	-35.4	180	-77.3	-15.8	0	0	0	113.3	S1458 L1459 H1463 R1464 N1465	S1458-N1461 PolarHBondContact O-N 3.05Å; L1459-N1461 VanDerWaalsContact C-N 3.34Å; L1459-N1461 PolarHBondContact O-N 3.1Å; N1461-H1463 PolarHBondContact O-N 3.43Å; N1461-R1464 PolarHBondContact O-N 2.94Å; N1461-R1464 VanDerWaalsContact O-N 3.11Å; N1461-N1465 PolarHBondContact O-N 3.07Å
1462	V	40	Very low	36.3	Very low	85 Å²	85	95.6 Å²	95.6	52%	0.515	51%	0.505	S	S	.	.	H	α-helix	trans	-59.6	-40.9	171.8	174	0	0	0	0	110.3	S1458 R1464 N1466	S1458-V1462 WeakPolarHBondContact O-CG2 3.41Å; S1458-V1462 PolarHBondContact O-N 3.38Å; V1462-R1464 VanDerWaalsContact C-N 3.34Å; V1462-R1464 PolarHBondContact O-N 3.48Å; V1462-N1466 WeakPolarHBondContact O-CB 3.32Å; V1462-N1466 VanDerWaalsContact O-CG 3.27Å; V1462-N1466 PolarHBondContact O-N 2.91Å; V1462-N1466 VanDerWaalsContact O-N 3.09Å; V1462-N1466 PolarHBondContact O-ND2 3.29Å
1463	H	38.5	Very low	36.8	Very low	105 Å²	105	94 Å²	94	49%	0.486	49%	0.494	S	S	.	.	H	α-helix	trans	-61.8	-40	174.6	-106.8	-65.2	0	0	0	113	L1459 N1461 I1467	L1459-H1463 PolarHBondContact O-N 3.16Å; N1461-H1463 PolarHBondContact O-N 3.43Å; H1463-I1467 WeakPolarHBondContact O-CD1 3.44Å; H1463-I1467 WeakPolarHBondContact O-CG1 3.42Å; H1463-I1467 PolarHBondContact O-N 2.88Å
1464	R	39.3	Very low	37	Very low	172 Å²	172	92.9 Å²	92.9	65%	0.649	49%	0.487	S	S	*	.	H	α-helix	trans	-67.9	-47.9	-179.3	-166.3	177.4	-175.1	163.3	2.7	112.2	H1460 N1461 V1462 I1467 E1468	H1460-R1464 PolarHBondContact O-N 3.23Å; N1461-R1464 PolarHBondContact O-N 2.94Å; N1461-R1464 VanDerWaalsContact O-N 3.11Å; V1462-R1464 VanDerWaalsContact C-N 3.34Å; V1462-R1464 PolarHBondContact O-N 3.48Å; R1464-I1467 PolarHBondContact O-N 3.38Å; R1464-E1468 PolarHBondContact O-N 3.31Å; R1464-E1468 VanDerWaalsContact O-N 3.1Å
1465	N	41.1	Very low	37.3	Very low	83 Å²	83	100 Å²	100	44%	0.444	50%	0.5	S	S	.	.	H	α-helix	trans	-69.9	-34.3	-178.1	-74.3	-7.2	0	0	0	112.5	N1461 I1467 E1468 T1469	N1461-N1465 PolarHBondContact O-N 3.07Å; N1465-I1467 VanDerWaalsContact C-N 3.35Å; N1465-E1468 PolarHBondContact O-N 3.13Å; N1465-T1469 WeakPolarHBondContact O-CB 3.39Å; N1465-T1469 WeakPolarHBondContact O-CG2 3.36Å; N1465-T1469 PolarHBondContact O-N 2.86Å; N1465-T1469 PolarHBondContact O-OG1 2.77Å
1466	N	38.4	Very low	37.8	Very low	73 Å²	73	105.7 Å²	105.7	39%	0.39	52%	0.516	S	S	.	.	H	α-helix	trans	-66.8	-36.6	174.7	-75.2	-11.6	0	0	0	111.9	V1462 T1469 C1470	V1462-N1466 WeakPolarHBondContact O-CB 3.32Å; V1462-N1466 VanDerWaalsContact O-CG 3.27Å; V1462-N1466 PolarHBondContact O-N 2.91Å; V1462-N1466 VanDerWaalsContact O-N 3.09Å; V1462-N1466 PolarHBondContact O-ND2 3.29Å; N1466-T1469 WeakPolarHBondContact CA-OG1 3.38Å; N1466-T1469 PolarHBondContact O-OG1 2.96Å; N1466-C1470 VanDerWaalsContact O-CB 3.24Å; N1466-C1470 WeakPolarHBondContact O-CB 3.38Å; N1466-C1470 PolarHBondContact O-N 3.44Å
1467	I	39.6	Very low	38.1	Very low	98 Å²	98	109.3 Å²	109.3	50%	0.503	52%	0.524	S	S	.	.	H	α-helix	trans	-66.7	-44	175	-68.8	166.1	0	0	0	110.2	H1463 R1464 N1465 L1471	H1463-I1467 WeakPolarHBondContact O-CD1 3.44Å; H1463-I1467 WeakPolarHBondContact O-CG1 3.42Å; H1463-I1467 PolarHBondContact O-N 2.88Å; R1464-I1467 PolarHBondContact O-N 3.38Å; N1465-I1467 VanDerWaalsContact C-N 3.35Å; I1467-L1471 HydrophobicContact CG2-CD1 3.81Å; I1467-L1471 HydrophobicContact CG2-CG 4.38Å; I1467-L1471 WeakPolarHBondContact O-CB 3.36Å; I1467-L1471 WeakPolarHBondContact O-CG 3.41Å; I1467-L1471 PolarHBondContact O-N 2.58Å
1468	E	39.4	Very low	38.3	Very low	108 Å²	108	108 Å²	108	51%	0.505	51%	0.513	S	S	.	.	H	α-helix	trans	-67.2	-41.7	-179.7	-116	179.8	171.8	0	0	113.2	R1464 N1465 L1471 Q1472	R1464-E1468 PolarHBondContact O-N 3.31Å; R1464-E1468 VanDerWaalsContact O-N 3.1Å; N1465-E1468 PolarHBondContact O-N 3.13Å; E1468-L1471 PolarHBondContact O-N 3.43Å; E1468-Q1472 WeakPolarHBondContact O-CG 3.38Å; E1468-Q1472 PolarHBondContact O-N 3.26Å
1469	T	41.4	Very low	38.4	Very low	77 Å²	77	110.2 Å²	110.2	47%	0.472	53%	0.529	S	S	.	.	H	α-helix	trans	-70.7	-36.4	177	49.1	0	0	0	0	112.4	N1465 N1466 Q1472 S1473	N1465-T1469 WeakPolarHBondContact O-CB 3.39Å; N1465-T1469 WeakPolarHBondContact O-CG2 3.36Å; N1465-T1469 PolarHBondContact O-N 2.86Å; N1465-T1469 PolarHBondContact O-OG1 2.77Å; N1466-T1469 WeakPolarHBondContact CA-OG1 3.38Å; N1466-T1469 PolarHBondContact O-OG1 2.96Å; T1469-Q1472 PolarHBondContact O-N 3.1Å; T1469-S1473 WeakPolarHBondContact O-CB 3.44Å; T1469-S1473 PolarHBondContact O-N 3.5Å; T1469-S1473 PolarHBondContact O-OG 2.96Å
1470	C	37.1	Very low	38.6	Very low	54 Å²	54	111.6 Å²	111.6	37%	0.365	54%	0.544	S	S	.	.	H	α-helix	trans	-62.2	-42.1	167.7	-94.2	0	0	0	0	111.6	N1466 Q1472 S1473 I1474	N1466-C1470 VanDerWaalsContact O-CB 3.24Å; N1466-C1470 WeakPolarHBondContact O-CB 3.38Å; N1466-C1470 PolarHBondContact O-N 3.44Å; C1470-Q1472 PolarHBondContact O-N 2.95Å; C1470-S1473 WeakPolarHBondContact CA-OG 3.23Å; C1470-S1473 PolarHBondContact O-N 3.31Å; C1470-S1473 PolarHBondContact O-OG 3.42Å; C1470-I1474 WeakPolarHBondContact O-CB 3.4Å; C1470-I1474 WeakPolarHBondContact O-CD1 3.03Å; C1470-I1474 WeakPolarHBondContact O-CG1 3.22Å; C1470-I1474 PolarHBondContact O-N 3.09Å
1471	L	36.2	Very low	38.5	Very low	86 Å²	86	109.3 Å²	109.3	45%	0.45	54%	0.54	S	S	.	.	H	α-helix	trans	-65	-38.6	177.9	-74.8	169.2	0	0	0	112.1	I1467 E1468 R1475	I1467-L1471 HydrophobicContact CG2-CD1 3.81Å; I1467-L1471 HydrophobicContact CG2-CG 4.38Å; I1467-L1471 WeakPolarHBondContact O-CB 3.36Å; I1467-L1471 WeakPolarHBondContact O-CG 3.41Å; I1467-L1471 PolarHBondContact O-N 2.58Å; E1468-L1471 PolarHBondContact O-N 3.43Å; L1471-R1475 WeakPolarHBondContact O-CG 3.4Å; L1471-R1475 PolarHBondContact O-N 3.41Å; L1471-R1475 VanDerWaalsContact O-N 3.08Å
1472	Q	41.8	Very low	38.6	Very low	108 Å²	108	109.4 Å²	109.4	51%	0.505	55%	0.547	S	S	.	.	H	α-helix	trans	-71.3	-40.7	176.5	-74	-175.7	4.1	0	0	112.7	E1468 T1469 C1470 R1475 R1476	E1468-Q1472 WeakPolarHBondContact O-CG 3.38Å; E1468-Q1472 PolarHBondContact O-N 3.26Å; T1469-Q1472 PolarHBondContact O-N 3.1Å; C1470-Q1472 PolarHBondContact O-N 2.95Å; Q1472-R1475 PolarHBondContact O-N 3.2Å; Q1472-R1476 WeakPolarHBondContact O-CG 3.25Å; Q1472-R1476 PolarHBondContact O-N 2.7Å
1473	S	40.5	Very low	38.9	Very low	50 Å²	50	111.3 Å²	111.3	35%	0.35	55%	0.553	S	S	.	*	H	α-helix	trans	-68.6	-35.2	177.6	57	0	0	0	0	112.5	T1469 C1470 R1476 R1477	T1469-S1473 WeakPolarHBondContact O-CB 3.44Å; T1469-S1473 PolarHBondContact O-N 3.5Å; T1469-S1473 PolarHBondContact O-OG 2.96Å; C1470-S1473 WeakPolarHBondContact CA-OG 3.23Å; C1470-S1473 PolarHBondContact O-N 3.31Å; C1470-S1473 PolarHBondContact O-OG 3.42Å; S1473-R1476 PolarHBondContact O-N 3.28Å; S1473-R1477 PolarHBondContact O-N 2.96Å; S1473-R1477 VanDerWaalsContact O-N 3.16Å
1474	I	35.5	Very low	39.1	Very low	86 Å²	86	114.5 Å²	114.5	44%	0.441	57%	0.567	S	S	.	*	H	α-helix	trans	-70.1	-36.1	174.2	-66.8	167.1	0	0	0	111.3	C1470 R1476 K1478	C1470-I1474 WeakPolarHBondContact O-CB 3.4Å; C1470-I1474 WeakPolarHBondContact O-CD1 3.03Å; C1470-I1474 WeakPolarHBondContact O-CG1 3.22Å; C1470-I1474 PolarHBondContact O-N 3.09Å; I1474-R1476 VanDerWaalsContact C-N 3.32Å; I1474-K1478 HydrophobicContact CG2-CD 4Å
1475	R	37.6	Very low	39.2	Very low	218 Å²	218	113.1 Å²	113.1	82%	0.823	57%	0.568	S	S	*	*	H	α-helix	trans	-63.4	-36.6	171.2	-82.8	-178.2	178.3	170.7	1.2	112.2	L1471 Q1472	L1471-R1475 WeakPolarHBondContact O-CG 3.4Å; L1471-R1475 PolarHBondContact O-N 3.41Å; L1471-R1475 VanDerWaalsContact O-N 3.08Å; Q1472-R1475 PolarHBondContact O-N 3.2Å
1476	R	42	Very low	39.1	Very low	202 Å²	202	114 Å²	114	76%	0.762	57%	0.568	S	S	*	*	H	α-helix	trans	-74.8	-27.8	-179.4	-73.2	-177.7	-173.8	-177.9	3.9	114.3	Q1472 S1473 I1474	Q1472-R1476 WeakPolarHBondContact O-CG 3.25Å; Q1472-R1476 PolarHBondContact O-N 2.7Å; S1473-R1476 PolarHBondContact O-N 3.28Å; I1474-R1476 VanDerWaalsContact C-N 3.32Å
1477	R	36.5	Very low	39.8	Very low	213 Å²	213	117.2 Å²	117.2	80%	0.804	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.3	4.9	-174.6	-72.1	-174.5	-178.6	164.1	1.3	115.9	S1473	S1473-R1477 PolarHBondContact O-N 2.96Å; S1473-R1477 VanDerWaalsContact O-N 3.16Å
1478	K	34.7	Very low	40.1	Very low	99 Å²	99	115.5 Å²	115.5	43%	0.43	58%	0.578	S	S	.	*			trans	-109.1	37.1	-173	-76.9	-173.3	173.3	-178.4	0	115.8	I1474 S1480	I1474-K1478 HydrophobicContact CG2-CD 4Å; K1478-S1480 VanDerWaalsContact C-N 3.29Å
1479	S	37.6	Very low	40.2	Very low	113 Å²	113	114.4 Å²	114.4	79%	0.79	58%	0.575	S	S	*	*	S	Bend	trans	-76.2	-11.3	167.4	51.5	0	0	0	0	113.9
1480	S	39.4	Very low	40.6	Very low	95 Å²	95	113.7 Å²	113.7	66%	0.664	57%	0.573	S	S	*	*	S	Bend	trans	-132	87	-179.8	59.1	0	0	0	0	111.7	K1478	K1478-S1480 VanDerWaalsContact C-N 3.29Å
1481	T	33.5	Very low	41.8	Very low	93 Å²	93	114 Å²	114	57%	0.571	58%	0.579	S	S	*	*	S	Bend	trans	-170.2	143.1	156.9	19.8	0	0	0	0	109.5	K1486	T1481-K1486 WeakPolarHBondContact O-CE 3.48Å
1482	S	40.7	Very low	42.5	Very low	80 Å²	80	114.8 Å²	114.8	56%	0.559	58%	0.579	S	S	*	*			trans	-55.2	143.5	-163.4	51.1	0	0	0	0	115.3	E1484 H1485	S1482-E1484 VanDerWaalsContact C-N 3.33Å; S1482-E1484 PolarHBondContact O-N 3.48Å; S1482-H1485 PolarHBondContact O-N 3.26Å
1483	I	46.2	Very low	42.7	Very low	125 Å²	125	114.1 Å²	114.1	64%	0.641	58%	0.579	S	S	*	*	H	α-helix	trans	-60.8	-32.8	-164.8	-68.1	166.3	0	0	0	113.3	H1485 K1486 E1487	I1483-H1485 PolarHBondContact O-N 3.38Å; I1483-K1486 WeakPolarHBondContact O-CB 3.46Å; I1483-K1486 PolarHBondContact O-N 3.34Å; I1483-K1486 VanDerWaalsContact O-N 3.14Å; I1483-E1487 PolarHBondContact O-N 3.43Å
1484	E	43.7	Very low	43.6	Very low	171 Å²	171	116.8 Å²	116.8	80%	0.799	59%	0.589	S	S	*	*	H	α-helix	trans	-68.2	-33.4	-179.2	-69.9	-177.1	162.7	0	0	113.5	S1482 K1486 S1488	S1482-E1484 VanDerWaalsContact C-N 3.33Å; S1482-E1484 PolarHBondContact O-N 3.48Å; E1484-K1486 VanDerWaalsContact C-N 3.33Å; E1484-S1488 PolarHBondContact O-N 3.04Å
1485	H	40.1	Very low	44.9	Very low	144 Å²	144	117 Å²	117	67%	0.667	59%	0.588	S	S	*	*	H	α-helix	trans	-74.2	-25.2	174	-84.3	-53.1	0	0	0	112.6	S1482 I1483 L1489	S1482-H1485 PolarHBondContact O-N 3.26Å; I1483-H1485 PolarHBondContact O-N 3.38Å; H1485-L1489 WeakPolarHBondContact O-CB 3.35Å; H1485-L1489 PolarHBondContact O-N 3.1Å; H1485-L1489 VanDerWaalsContact O-N 3.16Å
1486	K	39	Very low	45.2	Very low	100 Å²	100	111.8 Å²	111.8	44%	0.435	58%	0.576	S	S	.	*	H	α-helix	trans	-65.3	-43.1	175.7	-74.1	-178	173.7	176.3	0	111.3	T1481 I1483 E1484 S1490	T1481-K1486 WeakPolarHBondContact O-CE 3.48Å; I1483-K1486 WeakPolarHBondContact O-CB 3.46Å; I1483-K1486 PolarHBondContact O-N 3.34Å; I1483-K1486 VanDerWaalsContact O-N 3.14Å; E1484-K1486 VanDerWaalsContact C-N 3.33Å; K1486-S1490 WeakPolarHBondContact O-CB 3.34Å; K1486-S1490 PolarHBondContact O-N 2.92Å
1487	E	52.4	Low	45.6	Very low	141 Å²	141	105.3 Å²	105.3	66%	0.659	56%	0.562	S	S	*	*	H	α-helix	trans	-71.7	-43.4	-178	-68.1	-172.4	167.1	0	0	112.3	I1483 L1489 S1490 A1491	I1483-E1487 PolarHBondContact O-N 3.43Å; E1487-L1489 PolarHBondContact O-N 3.32Å; E1487-S1490 PolarHBondContact O-N 3.19Å; E1487-A1491 VanDerWaalsContact O-CB 3.3Å; E1487-A1491 WeakPolarHBondContact O-CB 3.32Å; E1487-A1491 PolarHBondContact O-N 3.2Å
1488	S	47.8	Very low	46.8	Very low	63 Å²	63	102.1 Å²	102.1	44%	0.441	55%	0.554	S	S	.	*	H	α-helix	trans	-63.5	-39.7	177.8	-172.8	0	0	0	0	112.7	E1484 K1492	E1484-S1488 PolarHBondContact O-N 3.04Å; S1488-K1492 PolarHBondContact O-N 2.73Å; S1488-K1492 VanDerWaalsContact O-N 3.16Å
1489	L	41.5	Very low	47.9	Very low	85 Å²	85	101.7 Å²	101.7	45%	0.445	55%	0.552	S	S	.	*	H	α-helix	trans	-75.9	-37.7	178.5	-155.2	83.6	0	0	0	111.9	H1485 E1487 K1492 L1493	H1485-L1489 WeakPolarHBondContact O-CB 3.35Å; H1485-L1489 PolarHBondContact O-N 3.1Å; H1485-L1489 VanDerWaalsContact O-N 3.16Å; E1487-L1489 PolarHBondContact O-N 3.32Å; L1489-K1492 PolarHBondContact O-N 3.14Å; L1489-L1493 HydrophobicContact CD2-CD1 4.48Å; L1489-L1493 HydrophobicContact CG-CD1 4.5Å; L1489-L1493 WeakPolarHBondContact O-CB 3.4Å; L1489-L1493 PolarHBondContact O-N 2.87Å
1490	S	48.7	Very low	48.4	Very low	62 Å²	62	100.9 Å²	100.9	43%	0.434	54%	0.538	S	S	.	.	H	α-helix	trans	-61.7	-43.2	173.4	-176.5	0	0	0	0	111.2	K1486 E1487 K1492 L1493 N1494	K1486-S1490 WeakPolarHBondContact O-CB 3.34Å; K1486-S1490 PolarHBondContact O-N 2.92Å; E1487-S1490 PolarHBondContact O-N 3.19Å; S1490-K1492 PolarHBondContact O-N 3.26Å; S1490-L1493 PolarHBondContact O-N 3.12Å; S1490-N1494 WeakPolarHBondContact O-CB 3.26Å; S1490-N1494 VanDerWaalsContact O-CG 3.3Å; S1490-N1494 PolarHBondContact O-N 3.02Å; S1490-N1494 PolarHBondContact O-ND2 2.78Å
1491	A	62.6	Low	49.3	Very low	60 Å²	60	101.4 Å²	101.4	50%	0.496	53%	0.53	S	S	.	.	H	α-helix	trans	-60.3	-44.8	174.9	0	0	0	0	0	111.9	E1487 N1494 E1495	E1487-A1491 VanDerWaalsContact O-CB 3.3Å; E1487-A1491 WeakPolarHBondContact O-CB 3.32Å; E1487-A1491 PolarHBondContact O-N 3.2Å; A1491-N1494 PolarHBondContact O-N 2.88Å; A1491-E1495 WeakPolarHBondContact O-CB 3.42Å; A1491-E1495 PolarHBondContact O-N 3.24Å
1492	K	51.8	Low	50.6	Low	102 Å²	102	103.8 Å²	103.8	44%	0.443	53%	0.532	S	S	.	.	H	α-helix	trans	-66.2	-37.6	175.9	-81.8	175.4	175.5	173.3	0	113.5	S1488 L1489 S1490 E1495 L1496	S1488-K1492 PolarHBondContact O-N 2.73Å; S1488-K1492 VanDerWaalsContact O-N 3.16Å; L1489-K1492 PolarHBondContact O-N 3.14Å; S1490-K1492 PolarHBondContact O-N 3.26Å; K1492-E1495 PolarHBondContact O-N 3.41Å; K1492-L1496 PolarHBondContact O-N 3.11Å
1493	L	45.5	Very low	51.1	Low	95 Å²	95	105.4 Å²	105.4	50%	0.497	53%	0.534	S	S	.	.	H	α-helix	trans	-66.9	-41.5	175.6	-104.8	146.4	0	0	0	111.6	L1489 S1490 L1496 S1497	L1489-L1493 HydrophobicContact CD2-CD1 4.48Å; L1489-L1493 HydrophobicContact CG-CD1 4.5Å; L1489-L1493 WeakPolarHBondContact O-CB 3.4Å; L1489-L1493 PolarHBondContact O-N 2.87Å; S1490-L1493 PolarHBondContact O-N 3.12Å; L1493-L1496 PolarHBondContact O-N 2.97Å; L1493-S1497 WeakPolarHBondContact O-CB 3.46Å; L1493-S1497 PolarHBondContact O-N 3.36Å
1494	N	59.5	Low	51.4	Low	106 Å²	106	104.6 Å²	104.6	57%	0.567	53%	0.527	S	S	*	.	H	α-helix	trans	-66.3	-38.1	174.4	-72.3	-21.9	0	0	0	111.4	S1490 A1491 L1496 S1497 F1498	S1490-N1494 WeakPolarHBondContact O-CB 3.26Å; S1490-N1494 VanDerWaalsContact O-CG 3.3Å; S1490-N1494 PolarHBondContact O-N 3.02Å; S1490-N1494 PolarHBondContact O-ND2 2.78Å; A1491-N1494 PolarHBondContact O-N 2.88Å; N1494-L1496 PolarHBondContact O-N 2.99Å; N1494-S1497 PolarHBondContact O-N 3.41Å; N1494-F1498 VanDerWaalsContact O-CB 3.29Å; N1494-F1498 WeakPolarHBondContact O-CB 3.31Å; N1494-F1498 PolarHBondContact O-N 2.68Å
1495	E	62.4	Low	52.7	Low	89 Å²	89	100.3 Å²	100.3	42%	0.416	51%	0.509	S	S	.	.	H	α-helix	trans	-62.9	-41	174.2	-164	-165.5	155.6	0	0	111.9	A1491 K1492 F1498 K1499	A1491-E1495 WeakPolarHBondContact O-CB 3.42Å; A1491-E1495 PolarHBondContact O-N 3.24Å; K1492-E1495 PolarHBondContact O-N 3.41Å; E1495-F1498 PolarHBondContact O-N 3.05Å; E1495-K1499 WeakPolarHBondContact O-CG 3.32Å; E1495-K1499 PolarHBondContact O-N 3.25Å; E1495-K1499 VanDerWaalsContact OE1-CE 3.26Å; E1495-K1499 WeakPolarHBondContact OE1-CE 3.46Å; E1495-K1499 IonicContact OE1-NZ 3.44Å; E1495-K1499 PolarHBondContact OE1-NZ 3.41Å
1496	L	44.2	Very low	53.3	Low	109 Å²	109	97 Å²	97	57%	0.571	50%	0.503	S	S	*	.	H	α-helix	trans	-68.8	-44	178.8	-151.2	100.8	0	0	0	111.8	K1492 L1493 N1494 F1498 K1499 I1500	K1492-L1496 PolarHBondContact O-N 3.11Å; L1493-L1496 PolarHBondContact O-N 2.97Å; N1494-L1496 PolarHBondContact O-N 2.99Å; L1496-F1498 VanDerWaalsContact C-N 3.33Å; L1496-F1498 PolarHBondContact O-N 3.17Å; L1496-K1499 PolarHBondContact O-N 3.2Å; L1496-I1500 HydrophobicContact CD2-CD1 4.39Å; L1496-I1500 WeakPolarHBondContact O-CG1 3.38Å; L1496-I1500 PolarHBondContact O-N 2.73Å
1497	S	49.6	Very low	53.6	Low	67 Å²	67	98.2 Å²	98.2	47%	0.469	51%	0.511	S	S	.	.	H	α-helix	trans	-59.1	-45	174.6	-173.8	0	0	0	0	111.2	L1493 N1494 K1499 I1500 Q1501	L1493-S1497 WeakPolarHBondContact O-CB 3.46Å; L1493-S1497 PolarHBondContact O-N 3.36Å; N1494-S1497 PolarHBondContact O-N 3.41Å; S1497-K1499 VanDerWaalsContact C-N 3.33Å; S1497-K1499 PolarHBondContact O-N 3.07Å; S1497-I1500 PolarHBondContact O-N 3.03Å; S1497-Q1501 PolarHBondContact O-N 2.89Å
1498	F	61.6	Low	54	Low	145 Å²	145	95.6 Å²	95.6	64%	0.636	50%	0.502	S	S	*	.	H	α-helix	trans	-63.7	-36	176.8	-163.7	-94.1	0	0	0	112.5	N1494 E1495 L1496 K1502	N1494-F1498 VanDerWaalsContact O-CB 3.29Å; N1494-F1498 WeakPolarHBondContact O-CB 3.31Å; N1494-F1498 PolarHBondContact O-N 2.68Å; E1495-F1498 PolarHBondContact O-N 3.05Å; L1496-F1498 VanDerWaalsContact C-N 3.33Å; L1496-F1498 PolarHBondContact O-N 3.17Å; F1498-K1502 VanDerWaalsContact O-CB 3.28Å; F1498-K1502 WeakPolarHBondContact O-CB 3.47Å; F1498-K1502 PolarHBondContact O-N 3.32Å
1499	K	57.5	Low	55	Low	90 Å²	90	97 Å²	97	39%	0.391	51%	0.505	S	S	.	.	H	α-helix	trans	-65.9	-42.2	174.1	-77.8	175.4	-173.8	168.4	0	112.4	E1495 L1496 S1497 K1502 I1503	E1495-K1499 WeakPolarHBondContact O-CG 3.32Å; E1495-K1499 PolarHBondContact O-N 3.25Å; E1495-K1499 VanDerWaalsContact OE1-CE 3.26Å; E1495-K1499 WeakPolarHBondContact OE1-CE 3.46Å; E1495-K1499 IonicContact OE1-NZ 3.44Å; E1495-K1499 PolarHBondContact OE1-NZ 3.41Å; L1496-K1499 PolarHBondContact O-N 3.2Å; S1497-K1499 VanDerWaalsContact C-N 3.33Å; S1497-K1499 PolarHBondContact O-N 3.07Å; K1499-K1502 PolarHBondContact O-N 2.8Å; K1499-I1503 WeakPolarHBondContact O-CG1 2.97Å; K1499-I1503 PolarHBondContact O-N 2.84Å
1500	I	48.7	Very low	55.5	Low	97 Å²	97	96.3 Å²	96.3	50%	0.497	50%	0.504	S	S	.	.	H	α-helix	trans	-64.3	-48	177.3	-67.3	169.9	0	0	0	110.2	L1496 S1497 K1502 I1503 E1504	L1496-I1500 HydrophobicContact CD2-CD1 4.39Å; L1496-I1500 WeakPolarHBondContact O-CG1 3.38Å; L1496-I1500 PolarHBondContact O-N 2.73Å; S1497-I1500 PolarHBondContact O-N 3.03Å; I1500-K1502 VanDerWaalsContact C-N 3.25Å; I1500-K1502 PolarHBondContact O-N 3.31Å; I1500-I1503 PolarHBondContact O-N 2.99Å; I1500-I1503 VanDerWaalsContact O-N 3.08Å; I1500-E1504 PolarHBondContact O-N 3.08Å
1501	Q	58.1	Low	55.6	Low	105 Å²	105	97.1 Å²	97.1	49%	0.491	50%	0.502	S	S	.	.	H	α-helix	trans	-58.2	-38	176.4	-162.3	92.9	36	0	0	111.9	S1497 E1504 N1505	S1497-Q1501 PolarHBondContact O-N 2.89Å; Q1501-E1504 PolarHBondContact O-N 3.12Å; Q1501-N1505 WeakPolarHBondContact O-CB 2.96Å; Q1501-N1505 VanDerWaalsContact O-CG 3.23Å; Q1501-N1505 PolarHBondContact O-N 2.95Å; Q1501-N1505 PolarHBondContact O-ND2 3.41Å
1502	K	61.3	Low	55.6	Low	144 Å²	144	101.4 Å²	101.4	63%	0.626	51%	0.51	S	S	*	.	H	α-helix	trans	-68.7	-35	177.8	-162.5	175.1	-174.6	178.3	0	112.5	F1498 K1499 I1500 S1506	F1498-K1502 VanDerWaalsContact O-CB 3.28Å; F1498-K1502 WeakPolarHBondContact O-CB 3.47Å; F1498-K1502 PolarHBondContact O-N 3.32Å; K1499-K1502 PolarHBondContact O-N 2.8Å; I1500-K1502 VanDerWaalsContact C-N 3.25Å; I1500-K1502 PolarHBondContact O-N 3.31Å; K1502-S1506 WeakPolarHBondContact O-CB 3.37Å; K1502-S1506 PolarHBondContact O-N 3.48Å
1503	I	50.6	Low	55.8	Low	114 Å²	114	101.9 Å²	101.9	59%	0.585	51%	0.514	S	S	*	.	H	α-helix	trans	-68.1	-46.6	174.1	-67.9	165.7	0	0	0	110	K1499 I1500 N1505 S1506 M1507	K1499-I1503 WeakPolarHBondContact O-CG1 2.97Å; K1499-I1503 PolarHBondContact O-N 2.84Å; I1500-I1503 PolarHBondContact O-N 2.99Å; I1500-I1503 VanDerWaalsContact O-N 3.08Å; I1503-N1505 PolarHBondContact O-N 2.9Å; I1503-S1506 PolarHBondContact O-N 2.84Å; I1503-M1507 WeakPolarHBondContact O-CB 3.26Å; I1503-M1507 PolarHBondContact O-N 3.09Å
1504	E	52.2	Low	55.9	Low	107 Å²	107	101.4 Å²	101.4	50%	0.5	52%	0.515	S	S	.	.	H	α-helix	trans	-58.3	-47.3	175.3	-87.8	-173.9	147.7	0	0	112.2	I1500 Q1501 S1506 M1507 N1508	I1500-E1504 PolarHBondContact O-N 3.08Å; Q1501-E1504 PolarHBondContact O-N 3.12Å; E1504-S1506 VanDerWaalsContact C-N 3.35Å; E1504-S1506 PolarHBondContact O-N 3.07Å; E1504-M1507 PolarHBondContact O-N 3.4Å; E1504-N1508 WeakPolarHBondContact O-CB 3.3Å; E1504-N1508 PolarHBondContact O-N 3.06Å; E1504-N1508 PolarHBondContact O-ND2 3.43Å
1505	N	71	Confident	55.3	Low	81 Å²	81	103.2 Å²	103.2	43%	0.433	52%	0.518	S	S	.	.	H	α-helix	trans	-62	-43.1	178	-71.7	-13.9	0	0	0	111.4	Q1501 I1503 M1507 N1508 D1509	Q1501-N1505 WeakPolarHBondContact O-CB 2.96Å; Q1501-N1505 VanDerWaalsContact O-CG 3.23Å; Q1501-N1505 PolarHBondContact O-N 2.95Å; Q1501-N1505 PolarHBondContact O-ND2 3.41Å; I1503-N1505 PolarHBondContact O-N 2.9Å; N1505-M1507 VanDerWaalsContact C-N 3.29Å; N1505-M1507 PolarHBondContact O-N 2.78Å; N1505-N1508 PolarHBondContact O-N 3.45Å; N1505-D1509 WeakPolarHBondContact O-CB 3.31Å; N1505-D1509 VanDerWaalsContact O-CG 3.28Å; N1505-D1509 PolarHBondContact O-N 3.09Å
1506	S	54.2	Low	54.8	Low	75 Å²	75	106.1 Å²	106.1	52%	0.524	53%	0.529	S	S	.	.	H	α-helix	trans	-61.8	-36.9	175.8	-176.4	0	0	0	0	112.6	K1502 I1503 E1504 T1510	K1502-S1506 WeakPolarHBondContact O-CB 3.37Å; K1502-S1506 PolarHBondContact O-N 3.48Å; I1503-S1506 PolarHBondContact O-N 2.84Å; E1504-S1506 VanDerWaalsContact C-N 3.35Å; E1504-S1506 PolarHBondContact O-N 3.07Å; S1506-T1510 PolarHBondContact O-N 2.92Å; S1506-T1510 PolarHBondContact O-OG1 3.39Å
1507	M	44.3	Very low	54.5	Low	126 Å²	126	109.5 Å²	109.5	62%	0.621	54%	0.535	S	S	*	.	H	α-helix	trans	-70.3	-43.3	178	-134.8	175	-178	0	0	110.7	I1503 E1504 N1505 D1509 T1510 I1511	I1503-M1507 WeakPolarHBondContact O-CB 3.26Å; I1503-M1507 PolarHBondContact O-N 3.09Å; E1504-M1507 PolarHBondContact O-N 3.4Å; N1505-M1507 VanDerWaalsContact C-N 3.29Å; N1505-M1507 PolarHBondContact O-N 2.78Å; M1507-D1509 VanDerWaalsContact C-N 3.34Å; M1507-D1509 PolarHBondContact O-N 3.37Å; M1507-T1510 WeakPolarHBondContact CA-OG1 3.41Å; M1507-T1510 PolarHBondContact O-N 3.38Å; M1507-T1510 PolarHBondContact O-OG1 3.21Å; M1507-T1510 VanDerWaalsContact O-OG1 3.07Å; M1507-I1511 VanDerWaalsContact O-CG1 3.27Å; M1507-I1511 WeakPolarHBondContact O-CG1 3.45Å; M1507-I1511 PolarHBondContact O-N 3.26Å
1508	N	61	Low	53.9	Low	85 Å²	85	114 Å²	114	46%	0.455	55%	0.546	S	S	.	.	H	α-helix	trans	-64.8	-36.8	175.8	-76.4	-31.4	0	0	0	112.4	E1504 N1505 I1511 K1512	E1504-N1508 WeakPolarHBondContact O-CB 3.3Å; E1504-N1508 PolarHBondContact O-N 3.06Å; E1504-N1508 PolarHBondContact O-ND2 3.43Å; N1505-N1508 PolarHBondContact O-N 3.45Å; N1508-I1511 PolarHBondContact O-N 3Å; N1508-K1512 WeakPolarHBondContact O-CB 3.41Å; N1508-K1512 WeakPolarHBondContact O-CG 3.44Å; N1508-K1512 PolarHBondContact O-N 3.04Å
1509	D	69.4	Low	52.7	Low	94 Å²	94	112.1 Å²	112.1	50%	0.503	54%	0.542	S	S	.	.	H	α-helix	trans	-67.8	-39.3	174.3	-72.6	-22.4	0	0	0	111.7	N1505 M1507 I1511 K1512 E1513	N1505-D1509 WeakPolarHBondContact O-CB 3.31Å; N1505-D1509 VanDerWaalsContact O-CG 3.28Å; N1505-D1509 PolarHBondContact O-N 3.09Å; M1507-D1509 VanDerWaalsContact C-N 3.34Å; M1507-D1509 PolarHBondContact O-N 3.37Å; D1509-I1511 VanDerWaalsContact C-N 3.35Å; D1509-I1511 PolarHBondContact O-N 2.79Å; D1509-K1512 PolarHBondContact O-N 2.87Å; D1509-E1513 WeakPolarHBondContact O-CB 3.19Å; D1509-E1513 PolarHBondContact O-N 3.45Å
1510	T	50.8	Low	52	Low	70 Å²	70	113 Å²	113	43%	0.429	55%	0.551	S	S	.	*	H	α-helix	trans	-66.6	-36.7	174	15.9	0	0	0	0	112.1	S1506 M1507 T1514	S1506-T1510 PolarHBondContact O-N 2.92Å; S1506-T1510 PolarHBondContact O-OG1 3.39Å; M1507-T1510 WeakPolarHBondContact CA-OG1 3.41Å; M1507-T1510 PolarHBondContact O-N 3.38Å; M1507-T1510 PolarHBondContact O-OG1 3.21Å; M1507-T1510 VanDerWaalsContact O-OG1 3.07Å; T1510-T1514 WeakPolarHBondContact O-CB 3.5Å; T1510-T1514 WeakPolarHBondContact O-CG2 3.43Å; T1510-T1514 PolarHBondContact O-N 3.15Å; T1510-T1514 PolarHBondContact O-OG1 2.8Å
1511	I	50.4	Low	51.5	Low	78 Å²	78	113.6 Å²	113.6	40%	0.4	56%	0.56	S	S	.	*	H	α-helix	trans	-66	-41	173.4	-68.1	165.2	0	0	0	110.6	M1507 N1508 D1509 T1514 K1515	M1507-I1511 VanDerWaalsContact O-CG1 3.27Å; M1507-I1511 WeakPolarHBondContact O-CG1 3.45Å; M1507-I1511 PolarHBondContact O-N 3.26Å; N1508-I1511 PolarHBondContact O-N 3Å; D1509-I1511 VanDerWaalsContact C-N 3.35Å; D1509-I1511 PolarHBondContact O-N 2.79Å; I1511-T1514 VanDerWaalsContact CA-OG1 3.31Å; I1511-T1514 WeakPolarHBondContact CA-OG1 3.4Å; I1511-T1514 PolarHBondContact O-OG1 3.49Å; I1511-K1515 HydrophobicContact CG2-CD 4.36Å; I1511-K1515 WeakPolarHBondContact O-CB 3.43Å; I1511-K1515 VanDerWaalsContact O-CG 3.31Å; I1511-K1515 WeakPolarHBondContact O-CG 3.31Å; I1511-K1515 PolarHBondContact O-N 3.43Å
1512	K	64	Low	50.5	Low	150 Å²	150	113.1 Å²	113.1	65%	0.652	57%	0.568	S	S	*	*	H	α-helix	trans	-66	-43.2	174.9	-80.9	-179.5	178.5	175.7	0	112.1	N1508 D1509 K1515 K1516	N1508-K1512 WeakPolarHBondContact O-CB 3.41Å; N1508-K1512 WeakPolarHBondContact O-CG 3.44Å; N1508-K1512 PolarHBondContact O-N 3.04Å; D1509-K1512 PolarHBondContact O-N 2.87Å; K1512-K1515 PolarHBondContact O-N 3.25Å; K1512-K1516 WeakPolarHBondContact O-CB 3.41Å; K1512-K1516 PolarHBondContact O-N 3.4Å
1513	E	56.5	Low	49.1	Very low	113 Å²	113	114.2 Å²	114.2	53%	0.528	58%	0.579	S	S	.	*	H	α-helix	trans	-63.2	-43.8	175.9	-83.2	-166.3	157.5	0	0	111.8	D1509 K1516 Y1517	D1509-E1513 WeakPolarHBondContact O-CB 3.19Å; D1509-E1513 PolarHBondContact O-N 3.45Å; E1513-K1516 PolarHBondContact O-N 2.97Å; E1513-Y1517 WeakPolarHBondContact O-CB 3.4Å; E1513-Y1517 PolarHBondContact O-N 3.1Å
1514	T	47.7	Very low	49.1	Very low	85 Å²	85	114.3 Å²	114.3	52%	0.521	58%	0.579	S	S	.	*	H	α-helix	trans	-66.6	-37.6	177	43.9	0	0	0	0	112.1	T1510 I1511 Y1517 K1518	T1510-T1514 WeakPolarHBondContact O-CB 3.5Å; T1510-T1514 WeakPolarHBondContact O-CG2 3.43Å; T1510-T1514 PolarHBondContact O-N 3.15Å; T1510-T1514 PolarHBondContact O-OG1 2.8Å; I1511-T1514 VanDerWaalsContact CA-OG1 3.31Å; I1511-T1514 WeakPolarHBondContact CA-OG1 3.4Å; I1511-T1514 PolarHBondContact O-OG1 3.49Å; T1514-Y1517 PolarHBondContact O-N 3.28Å; T1514-K1518 WeakPolarHBondContact O-CB 3.3Å; T1514-K1518 PolarHBondContact O-N 3.15Å
1515	K	45.6	Very low	48.9	Very low	143 Å²	143	114.6 Å²	114.6	62%	0.622	58%	0.583	S	S	*	*	H	α-helix	trans	-63	-41.5	170.3	-78	-176.7	178	-172.1	0	111.7	I1511 K1512 K1518 L1519	I1511-K1515 HydrophobicContact CG2-CD 4.36Å; I1511-K1515 WeakPolarHBondContact O-CB 3.43Å; I1511-K1515 VanDerWaalsContact O-CG 3.31Å; I1511-K1515 WeakPolarHBondContact O-CG 3.31Å; I1511-K1515 PolarHBondContact O-N 3.43Å; K1512-K1515 PolarHBondContact O-N 3.25Å; K1515-K1518 PolarHBondContact O-N 2.84Å; K1515-L1519 PolarHBondContact O-N 3.49Å
1516	K	51.1	Low	47.7	Very low	150 Å²	150	116.5 Å²	116.5	65%	0.652	59%	0.591	S	S	*	*	H	α-helix	trans	-67.8	-38.4	177.5	-156.3	177.6	-173.8	-178	0	112.1	K1512 E1513 L1519 N1520	K1512-K1516 WeakPolarHBondContact O-CB 3.41Å; K1512-K1516 PolarHBondContact O-N 3.4Å; E1513-K1516 PolarHBondContact O-N 2.97Å; K1516-L1519 PolarHBondContact O-N 3.16Å; K1516-N1520 WeakPolarHBondContact O-CB 3.13Å; K1516-N1520 PolarHBondContact O-N 3.04Å
1517	Y	38.5	Very low	47.3	Very low	181 Å²	181	118.9 Å²	118.9	71%	0.71	60%	0.595	S	S	*	*	H	α-helix	trans	-65.5	-41	173.4	-110.9	-84.1	0	0	0	112.1	E1513 T1514 T1521	E1513-Y1517 WeakPolarHBondContact O-CB 3.4Å; E1513-Y1517 PolarHBondContact O-N 3.1Å; T1514-Y1517 PolarHBondContact O-N 3.28Å; Y1517-T1521 PolarHBondContact O-N 3.49Å; Y1517-T1521 VanDerWaalsContact O-N 3.07Å; Y1517-T1521 PolarHBondContact O-OG1 3.16Å
1518	K	37	Very low	47.5	Very low	161 Å²	161	118.5 Å²	118.5	70%	0.7	59%	0.594	S	S	*	*	H	α-helix	trans	-64.9	-40.2	172.5	-87.9	-173	171.7	-175.7	0	112	T1514 K1515 T1521 S1522	T1514-K1518 WeakPolarHBondContact O-CB 3.3Å; T1514-K1518 PolarHBondContact O-N 3.15Å; K1515-K1518 PolarHBondContact O-N 2.84Å; K1518-T1521 WeakPolarHBondContact CA-OG1 3.36Å; K1518-T1521 PolarHBondContact O-N 3.46Å; K1518-T1521 PolarHBondContact O-OG1 3.46Å; K1518-T1521 VanDerWaalsContact O-OG1 3.07Å; K1518-S1522 WeakPolarHBondContact O-CB 3.38Å; K1518-S1522 PolarHBondContact O-N 3.42Å; K1518-S1522 PolarHBondContact O-OG 3.21Å; K1518-S1522 VanDerWaalsContact O-OG 3.13Å
1519	L	37.8	Very low	46.6	Very low	105 Å²	105	120.7 Å²	120.7	55%	0.55	60%	0.603	S	S	.	*	H	α-helix	trans	-66	-42.6	177.1	-127.9	95.4	0	0	0	111.8	K1515 K1516 T1521 S1522 I1523	K1515-L1519 PolarHBondContact O-N 3.49Å; K1516-L1519 PolarHBondContact O-N 3.16Å; L1519-T1521 PolarHBondContact O-N 2.87Å; L1519-S1522 WeakPolarHBondContact CA-OG 3.47Å; L1519-S1522 PolarHBondContact O-N 3.47Å; L1519-S1522 PolarHBondContact O-OG 3.35Å; L1519-I1523 HydrophobicContact CD2-CD1 4.24Å; L1519-I1523 WeakPolarHBondContact O-CB 3.18Å; L1519-I1523 VanDerWaalsContact O-CG1 3.31Å; L1519-I1523 WeakPolarHBondContact O-CG1 3.25Å; L1519-I1523 PolarHBondContact O-N 3.3Å
1520	N	42.3	Very low	44.9	Very low	108 Å²	108	122.6 Å²	122.6	58%	0.578	61%	0.61	S	S	*	*	H	α-helix	trans	-73.8	-10.3	177.3	-81.2	5.8	0	0	0	114.6	K1516 I1523	K1516-N1520 WeakPolarHBondContact O-CB 3.13Å; K1516-N1520 PolarHBondContact O-N 3.04Å; N1520-I1523 VanDerWaalsContact O-OXT 3.07Å
1521	T	38.5	Very low	44.5	Very low	110 Å²	110	126.7 Å²	126.7	68%	0.675	62%	0.624	S	S	*	*	H	α-helix	trans	-97.9	-15.9	169.8	39.4	0	0	0	0	111.9	Y1517 K1518 L1519	Y1517-T1521 PolarHBondContact O-N 3.49Å; Y1517-T1521 VanDerWaalsContact O-N 3.07Å; Y1517-T1521 PolarHBondContact O-OG1 3.16Å; K1518-T1521 WeakPolarHBondContact CA-OG1 3.36Å; K1518-T1521 PolarHBondContact O-N 3.46Å; K1518-T1521 PolarHBondContact O-OG1 3.46Å; K1518-T1521 VanDerWaalsContact O-OG1 3.07Å; L1519-T1521 PolarHBondContact O-N 2.87Å
1522	S	36.2	Very low	44	Very low	95 Å²	95	130.8 Å²	130.8	66%	0.664	64%	0.643	S	S	*	*	H	α-helix	trans	-92.3	-25	171.3	63	0	0	0	0	114	K1518 L1519	K1518-S1522 WeakPolarHBondContact O-CB 3.38Å; K1518-S1522 PolarHBondContact O-N 3.42Å; K1518-S1522 PolarHBondContact O-OG 3.21Å; K1518-S1522 VanDerWaalsContact O-OG 3.13Å; L1519-S1522 WeakPolarHBondContact CA-OG 3.47Å; L1519-S1522 PolarHBondContact O-N 3.47Å; L1519-S1522 PolarHBondContact O-OG 3.35Å
1523	I	32.5	Very low	42.2	Very low	168 Å²	168	129 Å²	129	86%	0.862	64%	0.642	S	S	*	*			trans	-81.8	0	161.5	-60.9	166.8	0	0	0	106.7	L1519 N1520	L1519-I1523 HydrophobicContact CD2-CD1 4.24Å; L1519-I1523 WeakPolarHBondContact O-CB 3.18Å; L1519-I1523 VanDerWaalsContact O-CG1 3.31Å; L1519-I1523 WeakPolarHBondContact O-CG1 3.25Å; L1519-I1523 PolarHBondContact O-N 3.3Å; N1520-I1523 VanDerWaalsContact O-OXT 3.07Å

Retrieved 1,523 of 1,523 residues in 1200.5 ms (Link to these results)

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