A0A5K4FA75_SCHMA Loading...

BTB domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FA75, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 796 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.9	Very low	24.3	Very low	231 Å²	231	158.2 Å²	158.2	100%	1.138	81%	0.81	S	S	*	*				0	105.8	0	-69.3	-177.8	164.7	0	0	105.6
2	Q	22.8	Very low	24.5	Very low	169 Å²	169	159.7 Å²	159.7	79%	0.79	82%	0.82	S	S	*	*				48.2	117.1	89.8	-84	179	-41.5	0	0	109.2
3	D	23.2	Very low	24.4	Very low	118 Å²	118	155.8 Å²	155.8	63%	0.631	82%	0.815	S	S	*	*			cis	-178.6	154	46.4	-105.3	-20	0	0	0	111.1
4	N	23.5	Very low	24.4	Very low	119 Å²	119	158.9 Å²	158.9	64%	0.636	82%	0.819	S	S	*	*				81.9	137.7	130	-71.7	-20.7	0	0	0	125.9
5	H	24.3	Very low	24.5	Very low	157 Å²	157	155.9 Å²	155.9	73%	0.727	82%	0.818	S	S	*	*			trans	74.6	107.3	150.2	-63.8	-48.7	0	0	0	118.5
6	C	20.7	Very low	24.6	Very low	109 Å²	109	156.8 Å²	156.8	74%	0.736	82%	0.821	S	S	*	*				53.3	111.8	78.6	-75.1	0	0	0	0	113.9
7	T	25.4	Very low	24.5	Very low	132 Å²	132	159.2 Å²	159.2	81%	0.81	83%	0.827	S	S	*	*				-177.1	130.1	121.2	26.4	0	0	0	0	112.4
8	N	24.8	Very low	24.4	Very low	157 Å²	157	154.1 Å²	154.1	84%	0.84	82%	0.82	S	S	*	*			trans	55.8	98.9	144.2	-63.2	-4.1	0	0	0	121.3
9	K	21.3	Very low	24.3	Very low	206 Å²	206	154.8 Å²	154.8	90%	0.896	82%	0.822	S	S	*	*			trans	-79.6	119.6	144.7	-76.1	173.2	170	177.1	0	108.7
10	E	24.4	Very low	24.3	Very low	177 Å²	177	156.3 Å²	156.3	83%	0.827	82%	0.824	S	S	*	*			trans	-159.9	-4	149	-116.6	169.2	-163.2	0	0	116.6
11	D	26.7	Very low	24.3	Very low	165 Å²	165	154.8 Å²	154.8	88%	0.882	82%	0.823	S	S	*	*	S	Bend	trans	-108.7	30	-172.3	-78.6	-31.3	0	0	0	117.5
12	L	26.6	Very low	24	Very low	176 Å²	176	150.9 Å²	150.9	92%	0.921	81%	0.807	S	S	*	*			trans	-128.9	25.9	176.9	-136.4	85.4	0	0	0	115.7
13	S	24.3	Very low	24.1	Very low	109 Å²	109	151.7 Å²	151.7	76%	0.762	81%	0.81	S	S	*	*	S	Bend	trans	-107.7	24	178.7	65.8	0	0	0	0	114.9
14	K	23.8	Very low	24.3	Very low	199 Å²	199	153.6 Å²	153.6	87%	0.865	82%	0.819	S	S	*	*	S	Bend	trans	-133.1	23.6	-177.5	-84.4	-168.3	178	178.4	0	117.5
15	S	25.6	Very low	24.4	Very low	115 Å²	115	155.5 Å²	155.5	80%	0.804	83%	0.83	S	S	*	*	S	Bend	trans	-138.6	21	-174.9	-49.3	0	0	0	0	117.9
16	I	26.3	Very low	24.5	Very low	170 Å²	170	157.6 Å²	157.6	87%	0.872	84%	0.837	S	S	*	*			trans	-138.2	59.1	174.8	-44.9	178.2	0	0	0	110.5
17	E	22.5	Very low	24.6	Very low	198 Å²	198	157.1 Å²	157.1	93%	0.925	83%	0.833	S	S	*	*			trans	-104.4	118.6	151.7	-81.7	-175	166.3	0	0	107.3
18	G	22.8	Very low	24.8	Very low	67 Å²	67	158.2 Å²	158.2	69%	0.691	83%	0.834	S	S	*	*			trans	108.8	95.8	170.4	0	0	0	0	0	114.2
19	I	23.5	Very low	24.9	Very low	168 Å²	168	158.7 Å²	158.7	86%	0.862	83%	0.831	S	S	*	*			trans	-155	115.6	137.5	-87.9	136.1	0	0	0	106.8
20	Q	23	Very low	25.2	Very low	184 Å²	184	155.9 Å²	155.9	86%	0.86	82%	0.824	S	S	*	*			trans	-75.2	139.8	169.7	-72.7	178.6	-36.3	0	0	110.1	N22	Q20-N22 PolarHBondContact O-N 3.38Å
21	P	25.8	Very low	25.4	Very low	124 Å²	124	154 Å²	154	81%	0.805	82%	0.819	S	S	*	*			trans	-96.4	94.4	178.7	34.1	-28.2	0	0	0	111.2
22	N	22.9	Very low	25.4	Very low	150 Å²	150	153.5 Å²	153.5	80%	0.802	81%	0.811	S	S	*	*			trans	-133.6	111.5	161	-94.2	-15.8	0	0	0	108.6	Q20	Q20-N22 PolarHBondContact O-N 3.38Å
23	H	24.9	Very low	25.5	Very low	186 Å²	186	152.1 Å²	152.1	86%	0.861	80%	0.804	S	S	*	*			trans	125.6	90	169.3	-81.3	-76.6	0	0	0	113.8
24	L	28.4	Very low	25.7	Very low	157 Å²	157	153.1 Å²	153.1	82%	0.822	80%	0.8	S	S	*	*			trans	-141.7	48.6	156	-149.5	79.1	0	0	0	111.8
25	N	25.3	Very low	25.9	Very low	160 Å²	160	150.5 Å²	150.5	86%	0.856	80%	0.796	S	S	*	*			trans	-103.1	71.1	165.6	-87.7	-7.7	0	0	0	109.4
26	K	25.3	Very low	25.9	Very low	201 Å²	201	153.5 Å²	153.5	87%	0.874	80%	0.796	S	S	*	*			trans	-162.9	17.9	167.2	-117.9	169.9	-172.5	-177.5	0	118
27	C	23.8	Very low	26	Very low	98 Å²	98	151 Å²	151	66%	0.662	79%	0.789	S	S	*	*			trans	-110.2	23.2	178.3	-71.7	0	0	0	0	115.1
28	N	29.7	Very low	26.2	Very low	155 Å²	155	149.1 Å²	149.1	83%	0.829	79%	0.786	S	S	*	*	S	Bend	trans	-96.2	9.6	177.6	-84.8	2.3	0	0	0	115.2
29	H	26.7	Very low	26.3	Very low	168 Å²	168	153.5 Å²	153.5	78%	0.778	79%	0.793	S	S	*	*	S	Bend	trans	-113.7	14.9	-174.2	-112.8	-63.2	0	0	0	116.4
30	I	27.2	Very low	26.3	Very low	146 Å²	146	153 Å²	153	75%	0.749	79%	0.792	S	S	*	*	S	Bend	trans	-116.7	-7.9	-180	-62.5	177.1	0	0	0	113.1
31	I	27.5	Very low	26.4	Very low	138 Å²	138	156 Å²	156	71%	0.708	80%	0.796	S	S	*	*	S	Bend	trans	-96.1	-10.4	-173.4	-62.6	178.1	0	0	0	113.5
32	E	28	Very low	26.3	Very low	155 Å²	155	157.9 Å²	157.9	72%	0.724	80%	0.799	S	S	*	*	G	3₁₀ helix	trans	-80.8	-20.5	179.6	-74.6	-174.3	156.8	0	0	114.6	I34	E32-I34 PolarHBondContact O-N 3.15Å
33	D	28.5	Very low	26.4	Very low	146 Å²	146	159.3 Å²	159.3	78%	0.781	80%	0.801	S	S	*	*	G	3₁₀ helix	trans	-86.4	1.3	-173.6	-78.7	-22.8	0	0	0	115.8
34	I	29.3	Very low	26.3	Very low	130 Å²	130	159.7 Å²	159.7	67%	0.667	80%	0.8	S	S	*	*	G	3₁₀ helix	trans	-98.6	-12.1	-178.8	-62.5	178	0	0	0	112.9	E32 H36	E32-I34 PolarHBondContact O-N 3.15Å; I34-H36 PolarHBondContact O-N 3.42Å
35	N	27.3	Very low	26.2	Very low	145 Å²	145	160 Å²	160	78%	0.775	80%	0.803	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.1	5.2	-175.2	-81.8	-19.4	0	0	0	115.6
36	H	25.5	Very low	26.2	Very low	177 Å²	177	160.6 Å²	160.6	82%	0.819	80%	0.804	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	2.9	-176.3	-110.7	-69.5	0	0	0	116.7	I34	I34-H36 PolarHBondContact O-N 3.42Å
37	T	28.2	Very low	26	Very low	117 Å²	117	159.6 Å²	159.6	72%	0.718	81%	0.805	S	S	*	*	S	Bend	trans	-118.4	10.2	-170	46.5	0	0	0	0	117.7
38	N	27.3	Very low	26	Very low	160 Å²	160	164.7 Å²	164.7	86%	0.856	82%	0.816	S	S	*	*			trans	-122.8	24.8	179.5	-88.3	-21	0	0	0	116.5	N40	N38-N40 PolarHBondContact O-N 3.45Å
39	N	24.1	Very low	25.6	Very low	158 Å²	158	167.9 Å²	167.9	85%	0.845	82%	0.816	S	S	*	*			trans	-87.1	78.5	161.1	-84.6	-14.9	0	0	0	109.6
40	N	24.6	Very low	25.6	Very low	158 Å²	158	165 Å²	165	85%	0.845	82%	0.815	S	S	*	*			trans	-175.2	83	158	-93.5	-19.6	0	0	0	110.3	N38	N38-N40 PolarHBondContact O-N 3.45Å
41	R	24.2	Very low	25.4	Very low	247 Å²	247	165.5 Å²	165.5	93%	0.932	82%	0.819	S	S	*	*			trans	-170.4	74.6	151.7	-104.8	166.1	-168.2	-179.2	4.5	109
42	N	23.2	Very low	25.3	Very low	163 Å²	163	162.4 Å²	162.4	87%	0.872	81%	0.81	S	S	*	*			trans	-90.9	113.3	155.2	-78.4	-22.9	0	0	0	106.7
43	E	24.8	Very low	25	Very low	180 Å²	180	160.8 Å²	160.8	84%	0.841	81%	0.814	S	S	*	*			trans	161.8	132.2	143.5	-94.3	-178.7	157.1	0	0	108.7
44	F	24.5	Very low	24.7	Very low	194 Å²	194	160.8 Å²	160.8	85%	0.851	81%	0.812	S	S	*	*	S	Bend	trans	77.7	73.8	-175.9	-68.5	-88.4	0	0	0	117.3
45	D	26	Very low	24.4	Very low	164 Å²	164	165.3 Å²	165.3	88%	0.877	82%	0.823	S	S	*	*				-177.8	71	127.9	-92.1	-19.8	0	0	0	110.1
46	I	23.9	Very low	24.2	Very low	173 Å²	173	165.4 Å²	165.4	89%	0.887	82%	0.823	S	S	*	*			trans	-98.6	80.1	168.8	-58.5	174.7	0	0	0	107.3
47	M	21.8	Very low	23.9	Very low	180 Å²	180	161.4 Å²	161.4	89%	0.887	82%	0.816	S	S	*	*	S	Bend	trans	-172.1	119.1	152.7	-106.2	177.5	-172.2	0	0	109.3
48	K	23.2	Very low	23.6	Very low	205 Å²	205	163.9 Å²	163.9	89%	0.891	82%	0.816	S	S	*	*	S	Bend	trans	91.2	67.7	179.6	-56.4	177.9	176.4	174.5	0	117.1
49	R	23	Very low	23.5	Very low	222 Å²	222	166.7 Å²	166.7	84%	0.838	82%	0.817	S	S	*	*			trans	-164.8	108.8	134.7	-126.7	167.8	167.9	162.9	-4.1	111.4
50	S	25.1	Very low	23.3	Very low	108 Å²	108	164.9 Å²	164.9	76%	0.755	81%	0.807	S	S	*	*	S	Bend	trans	-131.4	125.8	151	53.5	0	0	0	0	108
51	N	24.2	Very low	23.3	Very low	155 Å²	155	163.2 Å²	163.2	83%	0.829	81%	0.807	S	S	*	*			trans	84.8	68.9	168.9	-52.3	-16.2	0	0	0	117.4
52	S	24.2	Very low	23.3	Very low	74 Å²	74	162.4 Å²	162.4	52%	0.517	81%	0.805	S	S	.	*			trans	-120.5	96.2	143.9	61.9	0	0	0	0	108.1	I54	S52-I54 PolarHBondContact O-N 3.17Å
53	C	22.4	Very low	23.4	Very low	120 Å²	120	163 Å²	163	81%	0.811	81%	0.807	S	S	*	*			trans	-73	113.4	172.1	-72.3	0	0	0	0	109.5	Y55	C53-Y55 PolarHBondContact O-N 2.96Å
54	I	22.3	Very low	23.4	Very low	146 Å²	146	159.2 Å²	159.2	75%	0.749	80%	0.8	S	S	*	*			trans	-11.9	111.6	156.4	-57.8	169.4	0	0	0	113.8	S52	S52-I54 PolarHBondContact O-N 3.17Å
55	Y	23.3	Very low	23.4	Very low	225 Å²	225	156.1 Å²	156.1	88%	0.882	80%	0.8	S	S	*	*			trans	-85.6	111.6	159	-126.4	-94.7	0	0	0	106.9	C53 S57	C53-Y55 PolarHBondContact O-N 2.96Å; Y55-S57 PolarHBondContact O-N 3.45Å
56	N	22.3	Very low	23.3	Very low	147 Å²	147	156.1 Å²	156.1	79%	0.786	80%	0.799	S	S	*	*			trans	-76.9	109.3	169.9	-91.5	-16.1	0	0	0	108.9
57	S	19.9	Very low	23.2	Very low	94 Å²	94	157.8 Å²	157.8	66%	0.657	80%	0.799	S	S	*	*			trans	-82.6	128.2	151.2	61.7	0	0	0	0	108.3	Y55	Y55-S57 PolarHBondContact O-N 3.45Å
58	F	21.3	Very low	23.2	Very low	168 Å²	168	159.4 Å²	159.4	74%	0.737	80%	0.796	S	S	*	*			trans	178	110.9	143.1	-102.4	-72.4	0	0	0	108.2
59	Y	25.3	Very low	23.1	Very low	220 Å²	220	155.1 Å²	155.1	86%	0.863	79%	0.792	S	S	*	*				-166.8	140.7	103.1	-108.2	-80.7	0	0	0	111.6
60	N	20.7	Very low	23.2	Very low	120 Å²	120	152.3 Å²	152.3	64%	0.642	79%	0.786	S	S	*	*			trans	-64.7	148.5	-176.7	-67.2	-61.3	0	0	0	113.9
61	S	25	Very low	23.1	Very low	122 Å²	122	152.3 Å²	152.3	85%	0.853	78%	0.783	S	S	*	*				-138.2	123	129.9	58.7	0	0	0	0	109.5
62	R	22.6	Very low	23	Very low	231 Å²	231	151 Å²	151	87%	0.872	79%	0.785	S	S	*	*			trans	-76	129.3	172.1	-64.5	173.9	-177.1	-175.2	0.1	107.3
63	L	25.9	Very low	23	Very low	175 Å²	175	154.8 Å²	154.8	92%	0.916	80%	0.799	S	S	*	*			trans	-147.5	116.4	148.8	-128.9	84.5	0	0	0	108.5
64	S	24.7	Very low	22.9	Very low	101 Å²	101	159 Å²	159	71%	0.706	80%	0.804	S	S	*	*			trans	-70.5	143.4	178.1	35.7	0	0	0	0	111.1	L66	S64-L66 PolarHBondContact O-N 2.91Å
65	P	24.6	Very low	23.1	Very low	129 Å²	129	156.5 Å²	156.5	84%	0.838	80%	0.799	S	S	*	*			trans	-76.3	108	-176.3	28.9	-32.2	0	0	0	110.9	K67	P65-K67 PolarHBondContact O-N 3.08Å
66	L	23.7	Very low	23.1	Very low	164 Å²	164	150.7 Å²	150.7	86%	0.859	79%	0.792	S	S	*	*			trans	-75.4	105.3	165.8	-84.1	159.4	0	0	0	108.9	S64 R68	S64-L66 PolarHBondContact O-N 2.91Å; L66-R68 PolarHBondContact O-N 2.93Å
67	K	21.2	Very low	23.4	Very low	207 Å²	207	153.4 Å²	153.4	90%	0.9	79%	0.792	S	S	*	*			trans	-54.7	106.2	165.3	-78	177.9	174	178.5	0	109.4	P65	P65-K67 PolarHBondContact O-N 3.08Å
68	R	23.1	Very low	23.6	Very low	214 Å²	214	157.4 Å²	157.4	81%	0.808	80%	0.8	S	S	*	*			trans	-93.4	104.2	159.3	-83.6	-172.2	-175.8	-178.4	1.2	108.8	L66 F70	L66-R68 PolarHBondContact O-N 2.93Å; R68-F70 HydrophobicContact CB-CD2 4.46Å; R68-F70 HydrophobicContact CB-CE2 4.42Å
69	S	20.4	Very low	24.1	Very low	116 Å²	116	155.4 Å²	155.4	81%	0.811	80%	0.802	S	S	*	*			trans	-73	119	157.6	48.2	0	0	0	0	108.6
70	F	24.8	Very low	24.1	Very low	162 Å²	162	156.9 Å²	156.9	71%	0.711	81%	0.806	S	S	*	*			trans	-106.9	137.9	158.5	-86	-81.1	0	0	0	108.8	R68	R68-F70 HydrophobicContact CB-CD2 4.46Å; R68-F70 HydrophobicContact CB-CE2 4.42Å
71	P	23	Very low	24.8	Very low	108 Å²	108	160.6 Å²	160.6	70%	0.701	82%	0.816	S	S	*	*			trans	-75.2	127.5	-172.5	29.9	-30.5	0	0	0	110.5	D73	P71-D73 PolarHBondContact O-N 3.26Å
72	C	22.6	Very low	25.5	Very low	127 Å²	127	159.3 Å²	159.3	86%	0.858	81%	0.805	S	S	*	*			trans	-77.6	95.1	168.2	-73.1	0	0	0	0	108.8	K74	C72-K74 PolarHBondContact O-N 3.49Å
73	D	23.5	Very low	26.4	Very low	155 Å²	155	153.6 Å²	153.6	83%	0.829	80%	0.796	S	S	*	*			trans	-75.9	122.3	165.7	-93.1	-29.3	0	0	0	110.4	P71 S75	P71-D73 PolarHBondContact O-N 3.26Å; D73-S75 PolarHBondContact O-N 3.42Å
74	K	21.6	Very low	27.1	Very low	207 Å²	207	149.4 Å²	149.4	90%	0.9	78%	0.781	S	S	*	*			trans	-66.4	120.5	175	-66.4	168	176.5	173.6	0	108.9	C72	C72-K74 PolarHBondContact O-N 3.49Å
75	S	26	Very low	28	Very low	94 Å²	94	149.1 Å²	149.1	66%	0.657	78%	0.775	S	S	*	*			trans	-136	110.6	154.1	58.2	0	0	0	0	111.1	D73	D73-S75 PolarHBondContact O-N 3.42Å
76	S	22.3	Very low	28.8	Very low	104 Å²	104	149.9 Å²	149.9	73%	0.727	77%	0.766	S	S	*	*			trans	-62.9	123.9	166.7	-76.7	0	0	0	0	110.1
77	Y	29.4	Very low	30	Very low	203 Å²	203	145.9 Å²	145.9	80%	0.796	75%	0.748	S	S	*	*			trans	-118.7	107.5	155.8	-78.2	-79.2	0	0	0	109.5	V79	Y77-V79 PolarHBondContact O-N 2.85Å
78	H	24.7	Very low	31.2	Very low	178 Å²	178	140 Å²	140	82%	0.824	73%	0.729	S	S	*	*			trans	-64	112.3	169.9	-77.7	-97	0	0	0	109.8
79	V	30.4	Very low	32.2	Very low	126 Å²	126	134.9 Å²	134.9	76%	0.764	72%	0.718	S	S	*	*			trans	-107.1	82.9	172.5	-176.5	0	0	0	0	108.9	Y77	Y77-V79 PolarHBondContact O-N 2.85Å
80	W	26	Very low	33.3	Very low	251 Å²	251	133.4 Å²	133.4	95%	0.951	70%	0.7	S	S	*	*			trans	-135.9	97.3	156.6	-71.2	93.4	0	0	0	107.4
81	K	34.7	Very low	34.2	Very low	198 Å²	198	132.1 Å²	132.1	86%	0.861	70%	0.697	S	S	*	*			trans	-115.8	146.6	160.3	-83.5	-168.8	177.5	-178.6	0	109.4
82	P	39.7	Very low	35.1	Very low	95 Å²	95	129.8 Å²	129.8	62%	0.617	68%	0.683	S	S	*	*			trans	-83.8	151.4	-152.8	-8.2	26.9	0	0	0	113.1	S84	P82-S84 PolarHBondContact O-N 3.45Å
83	V	42.7	Very low	35.8	Very low	112 Å²	112	131.3 Å²	131.3	68%	0.679	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.9	-4.8	-172.8	175.3	0	0	0	0	115.6	T85 F86	V83-T85 PolarHBondContact O-N 2.66Å; V83-F86 PolarHBondContact O-N 3.28Å
84	S	40.1	Very low	36.6	Very low	86 Å²	86	129.6 Å²	129.6	60%	0.601	67%	0.665	S	S	*	*	H	α-helix	trans	-65.9	-32.9	-177.5	57	0	0	0	0	113.9	P82 F86	P82-S84 PolarHBondContact O-N 3.45Å; S84-F86 VanDerWaalsContact C-N 3.3Å; S84-F86 PolarHBondContact O-N 3.12Å
85	T	42.9	Very low	37.4	Very low	95 Å²	95	125.6 Å²	125.6	58%	0.583	65%	0.653	S	S	*	*	H	α-helix	trans	-74.1	-18.1	176	28.4	0	0	0	0	113.8	V83 T88	V83-T85 PolarHBondContact O-N 2.66Å; T85-T88 PolarHBondContact O-OG1 3.44Å
86	F	41.5	Very low	38	Very low	146 Å²	146	127.1 Å²	127.1	64%	0.64	65%	0.653	S	S	*	*	H	α-helix	trans	-78.4	-37.6	178.5	-164.7	-99.7	0	0	0	111.6	V83 S84 L90	V83-F86 PolarHBondContact O-N 3.28Å; S84-F86 VanDerWaalsContact C-N 3.3Å; S84-F86 PolarHBondContact O-N 3.12Å; F86-L90 HydrophobicContact CD1-CD1 4.2Å; F86-L90 HydrophobicContact CE1-CD1 3.65Å; F86-L90 HydrophobicContact CZ-CD1 4.24Å; F86-L90 PolarHBondContact O-N 3.03Å
87	V	49.3	Very low	38.6	Very low	80 Å²	80	129.7 Å²	129.7	49%	0.485	65%	0.654	S	S	.	*	H	α-helix	trans	-71.4	-40.2	-178.1	179.8	0	0	0	0	111.8	N89 L90 Q91	V87-N89 PolarHBondContact O-N 3.35Å; V87-L90 PolarHBondContact O-N 3.35Å; V87-Q91 PolarHBondContact O-N 3.04Å; V87-Q91 VanDerWaalsContact O-N 3.13Å
88	T	47.1	Very low	38.9	Very low	82 Å²	82	124.3 Å²	124.3	50%	0.503	65%	0.646	S	S	.	*	H	α-helix	trans	-67.2	-35.2	179.4	58	0	0	0	0	112.9	T85 L90 S92	T85-T88 PolarHBondContact O-OG1 3.44Å; T88-L90 VanDerWaalsContact C-N 3.31Å; T88-L90 PolarHBondContact O-N 3.06Å; T88-S92 PolarHBondContact O-N 3.05Å; T88-S92 PolarHBondContact O-OG 2.91Å
89	N	43	Very low	39.1	Very low	108 Å²	108	124.9 Å²	124.9	58%	0.578	65%	0.646	S	S	*	*	H	α-helix	trans	-70.2	-27.1	175	-84.3	-19.5	0	0	0	113.1	V87 S92 K93	V87-N89 PolarHBondContact O-N 3.35Å; N89-S92 PolarHBondContact O-OG 3.02Å; N89-S92 VanDerWaalsContact O-OG 3.09Å; N89-K93 PolarHBondContact O-N 3.48Å
90	L	44.3	Very low	39	Very low	85 Å²	85	123.3 Å²	123.3	45%	0.445	64%	0.64	S	S	.	*	H	α-helix	trans	-79.6	-38.7	179.2	-135	141.1	0	0	0	111.5	F86 V87 T88 K93 L94	F86-L90 HydrophobicContact CD1-CD1 4.2Å; F86-L90 HydrophobicContact CE1-CD1 3.65Å; F86-L90 HydrophobicContact CZ-CD1 4.24Å; F86-L90 PolarHBondContact O-N 3.03Å; V87-L90 PolarHBondContact O-N 3.35Å; T88-L90 VanDerWaalsContact C-N 3.31Å; T88-L90 PolarHBondContact O-N 3.06Å; L90-K93 PolarHBondContact O-N 3.3Å; L90-L94 HydrophobicContact CD2-CD1 3.93Å; L90-L94 HydrophobicContact CD2-CG 4.49Å; L90-L94 WeakPolarHBondContact O-CG 3.33Å; L90-L94 PolarHBondContact O-N 2.92Å; L90-L94 VanDerWaalsContact O-N 3.1Å
91	Q	43.8	Very low	39.1	Very low	135 Å²	135	119.8 Å²	119.8	63%	0.631	63%	0.634	S	S	*	*	H	α-helix	trans	-64.7	-39.8	173.9	-94	175.2	-52.3	0	0	112.9	V87 L94 L95	V87-Q91 PolarHBondContact O-N 3.04Å; V87-Q91 VanDerWaalsContact O-N 3.13Å; Q91-L94 PolarHBondContact O-N 3.39Å; Q91-L95 PolarHBondContact O-N 3.44Å; Q91-L95 VanDerWaalsContact O-N 3.14Å
92	S	42.1	Very low	38.5	Very low	58 Å²	58	119 Å²	119	41%	0.406	63%	0.634	S	S	.	*	H	α-helix	trans	-68	-35.6	177.1	55.4	0	0	0	0	112.8	T88 N89 N96	T88-S92 PolarHBondContact O-N 3.05Å; T88-S92 PolarHBondContact O-OG 2.91Å; N89-S92 PolarHBondContact O-OG 3.02Å; N89-S92 VanDerWaalsContact O-OG 3.09Å; S92-N96 PolarHBondContact O-N 2.97Å
93	K	37.6	Very low	37.6	Very low	160 Å²	160	120.2 Å²	120.2	70%	0.696	64%	0.64	S	S	*	*	H	α-helix	trans	-68.2	-37.8	174.6	-96	-178.8	174.9	179.5	0	113.5	N89 L90 H97	N89-K93 PolarHBondContact O-N 3.48Å; L90-K93 PolarHBondContact O-N 3.3Å; K93-H97 PolarHBondContact O-N 3.13Å
94	L	40.3	Very low	36.9	Very low	118 Å²	118	121.2 Å²	121.2	62%	0.618	64%	0.641	S	S	*	*	H	α-helix	trans	-71.7	-34.4	178.2	-73.6	169.9	0	0	0	112.2	L90 Q91 N96 H97	L90-L94 HydrophobicContact CD2-CD1 3.93Å; L90-L94 HydrophobicContact CD2-CG 4.49Å; L90-L94 WeakPolarHBondContact O-CG 3.33Å; L90-L94 PolarHBondContact O-N 2.92Å; L90-L94 VanDerWaalsContact O-N 3.1Å; Q91-L94 PolarHBondContact O-N 3.39Å; L94-N96 VanDerWaalsContact C-N 3.34Å; L94-N96 PolarHBondContact O-N 3.47Å; L94-H97 PolarHBondContact O-N 3.2Å
95	L	37.7	Very low	36.1	Very low	124 Å²	124	125.1 Å²	125.1	65%	0.649	65%	0.65	S	S	*	*	H	α-helix	trans	-66.8	-37.4	177.1	-142.5	87	0	0	0	111.9	Q91 H97 S98	Q91-L95 PolarHBondContact O-N 3.44Å; Q91-L95 VanDerWaalsContact O-N 3.14Å; L95-H97 VanDerWaalsContact C-N 3.35Å; L95-H97 PolarHBondContact O-N 3.2Å; L95-S98 PolarHBondContact O-N 2.87Å; L95-S98 PolarHBondContact O-OG 2.89Å
96	N	37.7	Very low	35.1	Very low	125 Å²	125	128 Å²	128	67%	0.668	66%	0.661	S	S	*	*	H	α-helix	trans	-71.9	-25.8	-179.3	-72.7	-8.7	0	0	0	113.6	S92 L94 S98	S92-N96 PolarHBondContact O-N 2.97Å; L94-N96 VanDerWaalsContact C-N 3.34Å; L94-N96 PolarHBondContact O-N 3.47Å; N96-S98 VanDerWaalsContact C-N 3.32Å; N96-S98 PolarHBondContact O-N 3.29Å
97	H	36.6	Very low	34.4	Very low	159 Å²	159	127.2 Å²	127.2	74%	0.736	67%	0.668	S	S	*	*	H	α-helix	trans	-76	-17.3	177.4	-108.1	-78.1	0	0	0	113.9	K93 L94 L95	K93-H97 PolarHBondContact O-N 3.13Å; L94-H97 PolarHBondContact O-N 3.2Å; L95-H97 VanDerWaalsContact C-N 3.35Å; L95-H97 PolarHBondContact O-N 3.2Å
98	S	34.2	Very low	33.1	Very low	89 Å²	89	129.9 Å²	129.9	62%	0.622	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	-5.3	-176.7	68.7	0	0	0	0	115.3	L95 N96	L95-S98 PolarHBondContact O-N 2.87Å; L95-S98 PolarHBondContact O-OG 2.89Å; N96-S98 VanDerWaalsContact C-N 3.32Å; N96-S98 PolarHBondContact O-N 3.29Å
99	K	29	Very low	32.1	Very low	190 Å²	190	134.5 Å²	134.5	83%	0.826	70%	0.695	S	S	*	*	S	Bend	trans	-116.3	7.2	-172.9	-83	-172.9	176.9	-179.9	0	116.2
100	S	28.9	Very low	31.2	Very low	93 Å²	93	139 Å²	139	65%	0.65	71%	0.709	S	S	*	*			trans	-122.9	54.6	177.2	68.3	0	0	0	0	112.4
101	E	27.2	Very low	30.3	Very low	177 Å²	177	140 Å²	140	83%	0.827	72%	0.721	S	S	*	*			trans	-131.6	77.2	164.9	-79.2	-170	163.4	0	0	108.9
102	Q	22.4	Very low	29.5	Very low	182 Å²	182	141.5 Å²	141.5	85%	0.85	73%	0.733	S	S	*	*			trans	-168.4	133.9	155.4	-107.5	162.2	48.2	0	0	110.7
103	T	22.1	Very low	28.7	Very low	120 Å²	120	145 Å²	145	74%	0.736	75%	0.746	S	S	*	*			trans	77.8	96.7	165	63.7	0	0	0	0	118.8
104	N	26.2	Very low	28.2	Very low	133 Å²	133	143.9 Å²	143.9	71%	0.711	75%	0.748	S	S	*	*				172.5	118.1	93.6	-88.2	-29.6	0	0	0	114
105	Q	24.2	Very low	27.7	Very low	168 Å²	168	147.4 Å²	147.4	79%	0.785	76%	0.761	S	S	*	*			trans	59.3	93.3	131.7	-60.1	-178.2	-1.9	0	0	120.7
106	L	21.1	Very low	27.1	Very low	156 Å²	156	149.9 Å²	149.9	82%	0.817	77%	0.774	S	S	*	*				28.3	94.6	118.1	-143.2	93.4	0	0	0	118.1
107	V	27.5	Very low	26.5	Very low	130 Å²	130	147 Å²	147	79%	0.788	77%	0.774	S	S	*	*			trans	-118.9	112.7	154.2	177.8	0	0	0	0	108.8	H109	V107-H109 PolarHBondContact O-N 2.99Å
108	N	21.4	Very low	26	Very low	135 Å²	135	150.3 Å²	150.3	72%	0.722	78%	0.78	S	S	*	*			trans	-69.5	113.3	175.8	-81.4	-37.3	0	0	0	111
109	H	26.6	Very low	25.8	Very low	180 Å²	180	154.6 Å²	154.6	83%	0.833	79%	0.788	S	S	*	*			trans	-134.2	119.2	148.7	-90.7	-71.7	0	0	0	110.1	V107	V107-H109 PolarHBondContact O-N 2.99Å
110	K	23.6	Very low	25.6	Very low	201 Å²	201	152.9 Å²	152.9	87%	0.874	79%	0.788	S	S	*	*			trans	-54.1	148.8	175.1	-91.6	174.7	173.7	173.6	0	111.5	N112	K110-N112 PolarHBondContact O-N 3.49Å
111	P	26.7	Very low	25.7	Very low	108 Å²	108	155.2 Å²	155.2	70%	0.701	80%	0.797	S	S	*	*			trans	-79.7	119.8	-165.4	31.1	-32.2	0	0	0	111.5	I113	P111-I113 VanDerWaalsContact C-N 3.33Å; P111-I113 PolarHBondContact O-N 3.14Å
112	N	25.7	Very low	25.8	Very low	165 Å²	165	150.3 Å²	150.3	88%	0.882	79%	0.794	S	S	*	*			trans	-73.6	94.4	159.4	-105.6	-16.1	0	0	0	108.1	K110 N114	K110-N112 PolarHBondContact O-N 3.49Å; N112-N114 PolarHBondContact O-N 3.47Å
113	I	26.3	Very low	26.2	Very low	132 Å²	132	147.1 Å²	147.1	68%	0.677	79%	0.791	S	S	*	*			trans	-61	99.7	165.7	-62.3	165	0	0	0	106.6	P111	P111-I113 VanDerWaalsContact C-N 3.33Å; P111-I113 PolarHBondContact O-N 3.14Å
114	N	26.9	Very low	27	Very low	136 Å²	136	147.2 Å²	147.2	73%	0.727	79%	0.794	S	S	*	*			trans	-166.1	30	163.4	-98.4	-12.9	0	0	0	116.6	N112	N112-N114 PolarHBondContact O-N 3.47Å
115	H	29.1	Very low	27.5	Very low	192 Å²	192	147.2 Å²	147.2	89%	0.889	80%	0.799	S	S	*	*			trans	-144.6	72.2	164.8	-63.1	-69.2	0	0	0	111.7
116	L	25	Very low	28.1	Very low	176 Å²	176	141.4 Å²	141.4	92%	0.921	78%	0.784	S	S	*	*			trans	-91.6	104.8	167.5	-89.2	152.5	0	0	0	108.7
117	G	26.1	Very low	28.7	Very low	66 Å²	66	136.6 Å²	136.6	68%	0.68	76%	0.763	S	S	*	*			trans	149.3	39.7	167.8	0	0	0	0	0	117.2
118	R	25.7	Very low	29.3	Very low	227 Å²	227	137 Å²	137	86%	0.857	76%	0.761	S	S	*	*			trans	-109.7	109.9	161	-99.6	-175.7	177.7	175.5	-2.2	108.9	N120	R118-N120 PolarHBondContact O-N 2.89Å
119	F	30	Very low	29.8	Very low	180 Å²	180	133.5 Å²	133.5	79%	0.789	75%	0.747	S	S	*	*			trans	-77.3	101.7	167.8	-72.4	-85.2	0	0	0	107.9	V121	F119-V121 PolarHBondContact O-N 3.26Å
120	N	25.3	Very low	29.9	Very low	154 Å²	154	129.6 Å²	129.6	82%	0.824	74%	0.74	S	S	*	*			trans	-77.1	101.8	166.3	-82.3	-7.9	0	0	0	108.2	R118	R118-N120 PolarHBondContact O-N 2.89Å
121	V	30.2	Very low	30.1	Very low	141 Å²	141	125.8 Å²	125.8	86%	0.855	73%	0.727	S	S	*	*			trans	-116.3	101.4	161.5	-175.2	0	0	0	0	106.1	F119	F119-V121 PolarHBondContact O-N 3.26Å
122	G	29.7	Very low	30.1	Very low	74 Å²	74	124.4 Å²	124.4	76%	0.763	73%	0.726	S	S	*	*			trans	-151.2	124.7	-180	0	0	0	0	0	110.9
123	C	29.9	Very low	30	Very low	115 Å²	115	123.7 Å²	123.7	78%	0.777	72%	0.721	S	S	*	*			trans	-75.9	153.1	176.5	-143.7	0	0	0	0	110.4	T125	C123-T125 PolarHBondContact O-N 2.99Å
124	P	40.7	Very low	29.9	Very low	123 Å²	123	123.7 Å²	123.7	80%	0.799	73%	0.728	S	S	*	*	S	Bend	trans	-87.3	3.9	-160.1	30.8	-29.4	0	0	0	116.9	G126	P124-G126 PolarHBondContact O-N 3.44Å
125	T	35.9	Very low	29.8	Very low	132 Å²	132	121.7 Å²	121.7	81%	0.81	72%	0.724	S	S	*	*			trans	-97.2	75	175.8	56	0	0	0	0	110.1	C123	C123-T125 PolarHBondContact O-N 2.99Å
126	G	37.4	Very low	29.6	Very low	46 Å²	46	120.9 Å²	120.9	47%	0.474	72%	0.723	S	S	.	*			trans	-79.2	136.2	-172.1	0	0	0	0	0	114.3	P124 N128	P124-G126 PolarHBondContact O-N 3.44Å; G126-N128 PolarHBondContact O-N 3.21Å
127	C	34	Very low	29.6	Very low	56 Å²	56	119.1 Å²	119.1	38%	0.378	71%	0.714	S	S	.	*			trans	-74.6	68.7	156.5	-47.4	0	0	0	0	108.1	S129	C127-S129 VanDerWaalsContact C-N 3.3Å; C127-S129 PolarHBondContact O-N 2.95Å
128	N	38.2	Very low	29.6	Very low	138 Å²	138	122.9 Å²	122.9	74%	0.738	72%	0.719	S	S	*	*			trans	-73.7	90.4	169.6	-97	-0.6	0	0	0	107.9	G126 S130	G126-N128 PolarHBondContact O-N 3.21Å; N128-S130 PolarHBondContact O-N 2.96Å
129	S	32.3	Very low	29.5	Very low	62 Å²	62	119.1 Å²	119.1	43%	0.434	72%	0.716	S	S	.	*			trans	-75.7	66	157.4	54.1	0	0	0	0	108.9	C127 I131	C127-S129 VanDerWaalsContact C-N 3.3Å; C127-S129 PolarHBondContact O-N 2.95Å; S129-I131 PolarHBondContact O-N 3.33Å
130	S	30.1	Very low	29.5	Very low	98 Å²	98	121.8 Å²	121.8	69%	0.685	72%	0.722	S	S	*	*			trans	-67.1	114	155.1	54.5	0	0	0	0	106	N128 A132	N128-S130 PolarHBondContact O-N 2.96Å; S130-A132 VanDerWaalsContact C-N 3.33Å; S130-A132 PolarHBondContact O-N 3.39Å
131	I	27.2	Very low	29.5	Very low	120 Å²	120	123.4 Å²	123.4	62%	0.615	73%	0.725	S	S	*	*			trans	-61.1	102.8	166.6	-69.3	167.8	0	0	0	105.3	S129 D133	S129-I131 PolarHBondContact O-N 3.33Å; I131-D133 PolarHBondContact O-N 3.14Å
132	A	25.5	Very low	29.3	Very low	80 Å²	80	124 Å²	124	66%	0.661	72%	0.722	S	S	*	*			trans	-63.7	125.2	145.6	0	0	0	0	0	104.5	S130 V134	S130-A132 VanDerWaalsContact C-N 3.33Å; S130-A132 PolarHBondContact O-N 3.39Å; A132-V134 PolarHBondContact O-N 3.19Å
133	D	24.6	Very low	29.1	Very low	149 Å²	149	130.9 Å²	130.9	80%	0.797	73%	0.727	S	S	*	*			trans	-47.4	110.1	169.9	-70.5	-40.6	0	0	0	107.2	I131 S135	I131-D133 PolarHBondContact O-N 3.14Å; D133-S135 PolarHBondContact O-N 2.76Å
134	V	23.6	Very low	28.9	Very low	133 Å²	133	129.8 Å²	129.8	81%	0.806	72%	0.717	S	S	*	*			trans	-67.3	98.7	167.8	175.6	0	0	0	0	103.5	A132 M136	A132-V134 PolarHBondContact O-N 3.19Å; V134-M136 PolarHBondContact O-N 3.44Å; V134-M136 VanDerWaalsContact O-N 3.12Å
135	S	24.4	Very low	28.4	Very low	94 Å²	94	130.5 Å²	130.5	66%	0.657	71%	0.714	S	S	*	*			trans	-49.9	120	166.8	50.4	0	0	0	0	106.9	D133 N137	D133-S135 PolarHBondContact O-N 2.76Å; S135-N137 VanDerWaalsContact C-N 3.28Å; S135-N137 PolarHBondContact O-N 3.44Å
136	M	26.8	Very low	28.1	Very low	175 Å²	175	131.5 Å²	131.5	86%	0.862	71%	0.713	S	S	*	*	S	Bend	trans	-56.7	97.2	165.2	-65.3	-78.5	-173.2	0	0	106.8	V134	V134-M136 PolarHBondContact O-N 3.44Å; V134-M136 VanDerWaalsContact O-N 3.12Å
137	N	25	Very low	27.6	Very low	138 Å²	138	136.5 Å²	136.5	74%	0.738	73%	0.727	S	S	*	*			trans	-179.9	142.3	147	-86.7	-13.3	0	0	0	108.8	S135	S135-N137 VanDerWaalsContact C-N 3.28Å; S135-N137 PolarHBondContact O-N 3.44Å
138	D	25.2	Very low	27.3	Very low	145 Å²	145	142.2 Å²	142.2	78%	0.775	75%	0.748	S	S	*	*	S	Bend	trans	94.4	115.8	170.5	-48.4	-23.7	0	0	0	115.8
139	D	23.6	Very low	27	Very low	149 Å²	149	140.7 Å²	140.7	80%	0.797	75%	0.748	S	S	*	*			trans	81.9	92.4	161.9	-50	-22.7	0	0	0	118.4
140	Y	30.2	Very low	27	Very low	236 Å²	236	143.2 Å²	143.2	93%	0.925	76%	0.761	S	S	*	*			trans	-162.8	81.3	132.5	-104.9	-73.3	0	0	0	110.1
141	E	25.1	Very low	26.9	Very low	187 Å²	187	147.6 Å²	147.6	87%	0.874	77%	0.771	S	S	*	*			trans	-72.2	152.3	150.9	-76.6	-175.6	152.3	0	0	109.5
142	L	26.2	Very low	26.9	Very low	153 Å²	153	150.4 Å²	150.4	80%	0.801	79%	0.786	S	S	*	*			trans	80.8	86.1	160.9	-148.2	77	0	0	0	117.8
143	Y	25.9	Very low	26.9	Very low	220 Å²	220	154.3 Å²	154.3	86%	0.863	80%	0.795	S	S	*	*			trans	-167.9	69.4	137.5	-103.3	-73.4	0	0	0	108.3
144	T	26	Very low	27.1	Very low	92 Å²	92	152.9 Å²	152.9	56%	0.564	80%	0.797	S	S	*	*			trans	-128.9	60.2	169.3	56.6	0	0	0	0	110.8	K192	T144-K192 HydrophobicContact CG2-CD 3.99Å
145	D	29.3	Very low	26.9	Very low	137 Å²	137	153.9 Å²	153.9	73%	0.733	80%	0.797	S	S	*	*			trans	-139.9	107.7	158.2	-81.3	-35.9	0	0	0	105.7
146	I	30.1	Very low	27	Very low	153 Å²	153	157.2 Å²	157.2	79%	0.785	80%	0.802	S	S	*	*	S	Bend	trans	172.8	-15.6	154.7	-87.9	153.4	0	0	0	112.3
147	I	27.5	Very low	26.8	Very low	151 Å²	151	156.1 Å²	156.1	77%	0.774	80%	0.795	S	S	*	*	S	Bend	trans	-116.6	40.3	-176.2	-43	177	0	0	0	112.8
148	Q	27.7	Very low	26.7	Very low	176 Å²	176	158.3 Å²	158.3	82%	0.822	80%	0.8	S	S	*	*	S	Bend	trans	-103.6	9.3	174.3	-119.5	179.3	3.6	0	0	114.4
149	S	30.9	Very low	26.5	Very low	106 Å²	106	160.5 Å²	160.5	74%	0.741	81%	0.806	S	S	*	*	S	Bend	trans	-116	9.6	-173.4	57.9	0	0	0	0	116.9
150	T	32.3	Very low	26.3	Very low	115 Å²	115	158.3 Å²	158.3	71%	0.706	80%	0.802	S	S	*	*	S	Bend	trans	-132.5	0.8	-170.6	2.5	0	0	0	0	119.7
151	E	28.8	Very low	26	Very low	191 Å²	191	155.4 Å²	155.4	89%	0.893	80%	0.801	S	S	*	*			trans	-120.5	17.6	-177.3	-83.3	-179.8	161	0	0	116.2	L153	E151-L153 PolarHBondContact O-N 3.04Å
152	L	26.1	Very low	25.9	Very low	178 Å²	178	154.8 Å²	154.8	93%	0.932	80%	0.798	S	S	*	*	S	Bend	trans	-77.5	11.5	171.1	-93.7	167.5	0	0	0	115
153	L	25.7	Very low	26	Very low	163 Å²	163	153 Å²	153	85%	0.853	80%	0.796	S	S	*	*	S	Bend	trans	-135.6	87.5	179.7	-88.7	123	0	0	0	112	E151	E151-L153 PolarHBondContact O-N 3.04Å
154	S	28	Very low	26	Very low	118 Å²	118	151.1 Å²	151.1	83%	0.825	80%	0.795	S	S	*	*			trans	171.7	66.3	139	45.2	0	0	0	0	111
155	N	21	Very low	25.9	Very low	154 Å²	154	154.9 Å²	154.9	82%	0.824	81%	0.811	S	S	*	*			trans	-91.3	116.9	153.7	-74.7	-26.8	0	0	0	106.6
156	H	25.7	Very low	25.8	Very low	164 Å²	164	155.6 Å²	155.6	76%	0.759	82%	0.815	S	S	*	*			trans	-171.4	116.6	144.5	-96.2	-66.7	0	0	0	110.5
157	E	22.8	Very low	25.7	Very low	152 Å²	152	152.2 Å²	152.2	71%	0.71	81%	0.809	S	S	*	*			trans	60.5	108.6	136.4	-67.2	163.9	-159.3	0	0	119.5
158	H	22.4	Very low	25.6	Very low	184 Å²	184	153.7 Å²	153.7	85%	0.852	81%	0.813	S	S	*	*				53.3	103	85.5	-79.6	-64.1	0	0	0	114.8
159	Q	20.9	Very low	25.6	Very low	191 Å²	191	153.9 Å²	153.9	89%	0.893	81%	0.811	S	S	*	*				-179	146.3	114.1	-97.3	170.3	7.2	0	0	113.2
160	S	19.6	Very low	25.4	Very low	103 Å²	103	154.8 Å²	154.8	72%	0.72	82%	0.817	S	S	*	*			trans	-40.4	147.3	172.8	49	0	0	0	0	117.9
161	I	25	Very low	25.3	Very low	175 Å²	175	156.6 Å²	156.6	90%	0.897	82%	0.817	S	S	*	*			trans	-159.5	143.7	132.9	-87.2	137.8	0	0	0	109.2
162	Q	22.1	Very low	25.2	Very low	174 Å²	174	156.8 Å²	156.8	81%	0.813	82%	0.82	S	S	*	*			trans	-62.4	164	-171.4	-74.3	-98.8	-28.8	0	0	116
163	P	27.4	Very low	25.3	Very low	116 Å²	116	158.6 Å²	158.6	75%	0.753	82%	0.815	S	S	*	*			trans	-93.4	112.5	-167.8	34.1	-27	0	0	0	112.4
164	E	25.7	Very low	25.6	Very low	181 Å²	181	155.3 Å²	155.3	85%	0.846	81%	0.806	S	S	*	*			trans	-90.4	113.8	165.1	-81.8	-174.4	169.4	0	0	111	N166	E164-N166 PolarHBondContact O-N 3.43Å
165	L	24.7	Very low	26.3	Very low	171 Å²	171	153.4 Å²	153.4	90%	0.895	79%	0.79	S	S	*	*			trans	-57.2	101.9	165.9	-176.7	75.5	0	0	0	109.8
166	N	27.8	Very low	27	Very low	152 Å²	152	152 Å²	152	81%	0.813	78%	0.779	S	S	*	*			trans	-129	117.8	163.6	-92.4	-39.5	0	0	0	111.3	E164	E164-N166 PolarHBondContact O-N 3.43Å
167	A	26.7	Very low	28	Very low	81 Å²	81	149.4 Å²	149.4	67%	0.669	77%	0.765	S	S	*	*			trans	-64.5	145.5	-173.9	0	0	0	0	0	114.1
168	H	26.9	Very low	29.3	Very low	183 Å²	183	142.2 Å²	142.2	85%	0.847	73%	0.732	S	S	*	*			trans	47.1	80	139	-67.9	-66.7	0	0	0	118
169	K	26.3	Very low	30.5	Very low	180 Å²	180	139.5 Å²	139.5	78%	0.783	72%	0.719	S	S	*	*			trans	-132.5	101.5	137.1	-76.6	-172.3	-180	173	0	109.4	H171	K169-H171 PolarHBondContact O-N 3.5Å
170	S	28.2	Very low	31.7	Very low	124 Å²	124	134.9 Å²	134.9	87%	0.867	70%	0.701	S	S	*	*			trans	-64	72.2	165.7	53	0	0	0	0	109.7	M172	S170-M172 PolarHBondContact O-N 3.03Å
171	H	29.6	Very low	33	Very low	154 Å²	154	131 Å²	131	71%	0.713	67%	0.672	S	S	*	*			trans	-81.8	111.4	161.5	-90	-71.9	0	0	0	107.4	K169 R173	K169-H171 PolarHBondContact O-N 3.5Å; H171-R173 PolarHBondContact O-N 2.91Å
172	M	27.4	Very low	33.9	Very low	195 Å²	195	126.9 Å²	126.9	96%	0.961	65%	0.649	S	S	*	*			trans	-29	95.6	160.6	-71.3	-83.3	164.8	0	0	110.6	S170	S170-M172 PolarHBondContact O-N 3.03Å
173	R	26.9	Very low	35	Very low	215 Å²	215	120.9 Å²	120.9	81%	0.811	62%	0.622	S	S	*	*			trans	-99.9	113.4	-177.7	-134.7	-178.6	-167.8	-174.8	3.3	107.8	H171	H171-R173 PolarHBondContact O-N 2.91Å
174	S	32.6	Very low	35.5	Very low	95 Å²	95	116.7 Å²	116.7	66%	0.664	60%	0.596	S	S	*	*			trans	-74.4	-176.8	178.2	63.4	0	0	0	0	112.3	Q176	S174-Q176 VanDerWaalsContact C-N 3.34Å; S174-Q176 PolarHBondContact O-N 3.45Å
175	P	42.6	Very low	36.1	Very low	77 Å²	77	115.4 Å²	115.4	50%	0.5	59%	0.587	S	S	.	*	S	Bend		-86.8	46.4	-120.3	36.5	-18.9	0	0	0	114.4	F177 L224	P175-F177 VanDerWaalsContact C-N 3.26Å; P175-F177 PolarHBondContact O-N 3.45Å; P175-L224 HydrophobicContact CB-CB 4.39Å; P175-L224 HydrophobicContact CB-CD1 4.12Å; P175-L224 HydrophobicContact CB-CD2 4.05Å; P175-L224 HydrophobicContact CB-CG 4.46Å
176	Q	35.6	Very low	36.8	Very low	126 Å²	126	111.6 Å²	111.6	59%	0.589	57%	0.571	S	S	*	*			trans	-73.9	-11.1	179	-78.2	-177.5	-19.8	0	0	114.4	S174 N180	S174-Q176 VanDerWaalsContact C-N 3.34Å; S174-Q176 PolarHBondContact O-N 3.45Å; Q176-N180 WeakPolarHBondContact O-CB 3.41Å; Q176-N180 PolarHBondContact O-ND2 3.35Å
177	F	46.6	Very low	37.5	Very low	108 Å²	108	114.4 Å²	114.4	47%	0.474	57%	0.572	S	S	.	*	H	α-helix	trans	-80.8	-46.8	-171	-82.8	-83.6	0	0	0	114.1	P175 E179 N180 D181 Y236	P175-F177 VanDerWaalsContact C-N 3.26Å; P175-F177 PolarHBondContact O-N 3.45Å; F177-E179 VanDerWaalsContact C-N 3.33Å; F177-E179 PolarHBondContact O-N 3.25Å; F177-N180 CarbonylContact O-C 3.59Å; F177-N180 PolarHBondContact O-N 2.87Å; F177-N180 VanDerWaalsContact O-N 3.07Å; F177-D181 WeakPolarHBondContact O-CB 3.44Å; F177-D181 PolarHBondContact O-N 3.44Å; F177-Y236 HydrophobicContact CB-CE1 4.29Å; F177-Y236 VanDerWaalsContact CB-OH 3.28Å; F177-Y236 WeakPolarHBondContact CB-OH 3.42Å; F177-Y236 PolarHBondContact O-OH 3.49Å
178	M	50.7	Low	38.1	Very low	2 Å²	2	113.8 Å²	113.8	1%	0.01	56%	0.56	C	S	.	*	H	α-helix	trans	-69.6	-27.8	-172.3	-73.8	-177.3	78	0	0	113.8	N180 V197 H210 L213 Y220 L224 Y236	M178-N180 VanDerWaalsContact C-N 3.33Å; M178-V197 HydrophobicContact CE-CG1 4.44Å; M178-H210 PolarHBondContact O-CD2 3.33Å; M178-H210 VanDerWaalsContact O-CD2 3.31Å; M178-H210 PolarHBondContact O-NE2 2.92Å; M178-L213 HydrophobicContact CE-CD1 3.39Å; M178-Y220 WeakPolarHBondContact CB-OH 3.19Å; M178-Y220 HydrophobicContact CE-CD2 4.39Å; M178-Y220 HydrophobicContact CE-CE2 3.58Å; M178-Y220 HydrophobicContact SD-CE2 3.95Å; M178-L224 HydrophobicContact CB-CD2 3.84Å; M178-L224 HydrophobicContact CG-CD2 3.62Å; M178-L224 HydrophobicContact SD-CD2 3.29Å; M178-L224 WeakPolarHBondContact SD-CD2 3.34Å; M178-L224 HydrophobicContact SD-CG 3.89Å; M178-Y236 VanDerWaalsContact CA-OH 3.27Å; M178-Y236 WeakPolarHBondContact CA-OH 3.46Å; M178-Y236 HydrophobicContact CG-CD2 4.45Å; M178-Y236 HydrophobicContact CG-CE1 3.84Å; M178-Y236 HydrophobicContact CG-CE2 3.72Å; M178-Y236 WeakPolarHBondContact CG-OH 3.41Å; M178-Y236 PolarHBondContact N-OH 3.37Å; M178-Y236 VanDerWaalsContact N-OH 3.09Å
179	E	48.1	Very low	38.8	Very low	126 Å²	126	109.7 Å²	109.7	59%	0.589	57%	0.567	S	S	*	*	H	α-helix	trans	-74.6	-26.3	173.5	-67.4	-160.4	134.6	0	0	112.8	F177 K214	F177-E179 VanDerWaalsContact C-N 3.33Å; F177-E179 PolarHBondContact O-N 3.25Å; E179-K214 IonicContact OE1-NZ 3.02Å; E179-K214 PolarHBondContact OE1-NZ 3.41Å
180	N	44.7	Very low	39.6	Very low	95 Å²	95	105.4 Å²	105.4	51%	0.508	56%	0.556	S	S	.	*	H	α-helix	trans	-102	2.9	-178.8	-64.7	-38	0	0	0	113.5	Q176 F177 M178 H182	Q176-N180 WeakPolarHBondContact O-CB 3.41Å; Q176-N180 PolarHBondContact O-ND2 3.35Å; F177-N180 CarbonylContact O-C 3.59Å; F177-N180 PolarHBondContact O-N 2.87Å; F177-N180 VanDerWaalsContact O-N 3.07Å; M178-N180 VanDerWaalsContact C-N 3.33Å; N180-H182 PolarHBondContact O-CD2 3.21Å; N180-H182 VanDerWaalsContact O-CD2 3.22Å; N180-H182 PolarHBondContact O-N 3.06Å
181	D	47.3	Very low	40.7	Very low	20 Å²	20	106.7 Å²	106.7	11%	0.107	56%	0.559	C	S	.	*			trans	-75.8	79.7	-179.5	-152.8	16.7	0	0	0	109.4	F177 L183 V195 W229 Y236	F177-D181 WeakPolarHBondContact O-CB 3.44Å; F177-D181 PolarHBondContact O-N 3.44Å; D181-L183 PolarHBondContact O-N 3.08Å; D181-V195 VanDerWaalsContact O-CG1 3.26Å; D181-V195 WeakPolarHBondContact O-CG1 3.33Å; D181-W229 WeakPolarHBondContact OD1-CH2 3.3Å; D181-W229 WeakPolarHBondContact OD2-CZ3 3.47Å; D181-Y236 WeakPolarHBondContact OD2-CE2 3.33Å
182	H	43.4	Very low	42	Very low	89 Å²	89	105.8 Å²	105.8	41%	0.412	55%	0.553	S	S	.	*			trans	-74.5	48.5	-175.5	-65.3	-55	0	0	0	113.2	N180 S184 K185	N180-H182 PolarHBondContact O-CD2 3.21Å; N180-H182 VanDerWaalsContact O-CD2 3.22Å; N180-H182 PolarHBondContact O-N 3.06Å; H182-S184 PolarHBondContact O-N 3.29Å; H182-S184 VanDerWaalsContact O-N 3.15Å; H182-K185 HydrophobicContact CB-CB 4.16Å; H182-K185 HydrophobicContact CB-CD 4.03Å; H182-K185 HydrophobicContact CB-CG 4.1Å; H182-K185 PolarHBondContact O-N 2.9Å
183	L	46.2	Very low	43.9	Very low	49 Å²	49	98 Å²	98	26%	0.257	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-15.4	171.7	-102.2	148.5	0	0	0	112.9	D181 T186 I196	D181-L183 PolarHBondContact O-N 3.08Å; L183-T186 PolarHBondContact O-OG1 3.4Å; L183-I196 WeakPolarHBondContact CB-O 3.49Å
184	S	38.1	Very low	46.2	Very low	28 Å²	28	91.6 Å²	91.6	20%	0.196	51%	0.506	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-11.1	170.9	59.3	0	0	0	0	115.2	H182 T186 V195	H182-S184 PolarHBondContact O-N 3.29Å; H182-S184 VanDerWaalsContact O-N 3.15Å; S184-T186 PolarHBondContact O-N 3.5Å; S184-V195 WeakPolarHBondContact OG-CG2 3.36Å
185	K	37.1	Very low	48.6	Very low	154 Å²	154	89.4 Å²	89.4	67%	0.67	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-11.3	174.9	-78.9	-175.3	178.6	168.7	0	112.9	H182	H182-K185 HydrophobicContact CB-CB 4.16Å; H182-K185 HydrophobicContact CB-CD 4.03Å; H182-K185 HydrophobicContact CB-CG 4.1Å; H182-K185 PolarHBondContact O-N 2.9Å
186	T	40.4	Very low	50.8	Low	91 Å²	91	89.3 Å²	89.3	56%	0.558	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-8.7	-171.1	46.7	0	0	0	0	116.4	L183 S184	L183-T186 PolarHBondContact O-OG1 3.4Å; S184-T186 PolarHBondContact O-N 3.5Å
187	Y	43	Very low	53.3	Low	211 Å²	211	83.3 Å²	83.3	83%	0.827	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.5	-6.7	-177.8	-83.7	-77.6	0	0	0	119
188	T	37.9	Very low	55.5	Low	67 Å²	67	82 Å²	82	41%	0.411	45%	0.447	S	S	.	.			trans	-144.2	116.3	169.6	57.4	0	0	0	0	109.2	T190 A193	T188-T190 WeakPolarHBondContact CB-OG1 3.43Å; T188-T190 PolarHBondContact O-N 2.87Å; T188-T190 PolarHBondContact OG1-OG1 2.89Å; T188-A193 WeakPolarHBondContact OG1-CB 3.38Å
189	G	43.1	Very low	57.6	Low	97 Å²	97	81.9 Å²	81.9	100%	1	45%	0.446	S	S	*	.	S	Bend	trans	-63.6	25.2	171.1	0	0	0	0	0	114.6
190	T	42	Very low	59.8	Low	90 Å²	90	76.7 Å²	76.7	55%	0.552	42%	0.423	S	S	*	.	S	Bend	trans	-105.3	121.2	172.4	56.2	0	0	0	0	107.9	T188 K192 A193	T188-T190 WeakPolarHBondContact CB-OG1 3.43Å; T188-T190 PolarHBondContact O-N 2.87Å; T188-T190 PolarHBondContact OG1-OG1 2.89Å; T190-K192 PolarHBondContact O-N 3.42Å; T190-A193 PolarHBondContact O-N 3.4Å
191	T	52.1	Low	62.2	Low	152 Å²	152	72.2 Å²	72.2	93%	0.933	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	9.8	-178.4	47.6	0	0	0	0	115.5
192	K	57.2	Low	64.4	Low	134 Å²	134	73.8 Å²	73.8	58%	0.583	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124	12.1	-174.1	-67.5	-175.8	176.2	176.4	0	114.9	T144 T190	T144-K192 HydrophobicContact CG2-CD 3.99Å; T190-K192 PolarHBondContact O-N 3.42Å
193	A	65.5	Low	66.8	Low	32 Å²	32	72.2 Å²	72.2	26%	0.264	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-74.7	137.5	176.7	0	0	0	0	0	112.3	T188 T190 V195	T188-A193 WeakPolarHBondContact OG1-CB 3.38Å; T190-A193 PolarHBondContact O-N 3.4Å; A193-V195 PolarHBondContact O-N 2.99Å
194	P	76.6	Confident	69.1	Low	80 Å²	80	72.9 Å²	72.9	52%	0.519	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-64.8	132.1	-179.9	26.3	-33.4	0	0	0	111.1	I196 R209	P194-I196 PolarHBondContact O-N 3.4Å; P194-R209 HydrophobicContact CB-CG 4.49Å
195	V	83.3	Confident	71.8	Confident	49 Å²	49	75.8 Å²	75.8	30%	0.297	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-69.4	119.4	173.6	-167.3	0	0	0	0	109.2	D181 S184 A193 R209 H210	D181-V195 VanDerWaalsContact O-CG1 3.26Å; D181-V195 WeakPolarHBondContact O-CG1 3.33Å; S184-V195 WeakPolarHBondContact OG-CG2 3.36Å; A193-V195 PolarHBondContact O-N 2.99Å; V195-R209 CarbonylContact O-C 3.6Å; V195-R209 WeakPolarHBondContact O-CA 3.44Å; V195-H210 HydrophobicContact CB-CB 3.91Å; V195-H210 HydrophobicContact CG1-CB 4.18Å; V195-H210 PolarHBondContact O-N 3.36Å
196	I	87.6	Confident	74.5	Confident	76 Å²	76	70 Å²	70	39%	0.39	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	125.2	176.6	-59.1	175	0	0	0	108.8	L183 P194 H207 V208	L183-I196 WeakPolarHBondContact CB-O 3.49Å; P194-I196 PolarHBondContact O-N 3.4Å; I196-H207 HydrophobicContact CG2-CB 4.01Å; I196-V208 CarbonylContact C-O 3.19Å; I196-V208 WeakPolarHBondContact CA-O 3.39Å
197	V	89.3	Confident	77	Confident	0 Å²	0	71.1 Å²	71.1	0%	0	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	141.9	177.6	-175.8	0	0	0	0	109.5	M178 L199 V208 H210 L213 Y236	M178-V197 HydrophobicContact CE-CG1 4.44Å; V197-L199 HydrophobicContact CG1-CD2 3.7Å; V197-L199 HydrophobicContact CG1-CG 4.39Å; V197-V208 PolarHBondContact N-O 2.9Å; V197-V208 PolarHBondContact O-N 3.4Å; V197-H210 HydrophobicContact CG2-CB 4.06Å; V197-L213 HydrophobicContact CB-CD1 4.37Å; V197-Y236 HydrophobicContact CG1-CD2 3.5Å; V197-Y236 HydrophobicContact CG1-CE2 3.6Å
198	R	91.9	Very high	79.3	Confident	79 Å²	79	61.2 Å²	61.2	30%	0.298	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	115.9	172.8	-73.4	-171.7	-77.9	-156	-7.4	110.4	T233 K234 E235 Y236	R198-T233 PolarHBondContact NH2-O 2.97Å; R198-K234 PolarHBondContact NE-O 3.37Å; R198-K234 VanDerWaalsContact NE-O 3.12Å; R198-K234 PolarHBondContact NH2-O 3.23Å; R198-E235 HydrophobicContact CB-CB 3.87Å; R198-E235 WeakPolarHBondContact O-CA 3.43Å; R198-Y236 PolarHBondContact O-N 3.49Å
199	L	94.2	Very high	81.9	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	112.6	177.4	-50.9	176.2	0	0	0	109.1	V197 I205 F206 V208 L213 M223 Y236 F238 F245	V197-L199 HydrophobicContact CG1-CD2 3.7Å; V197-L199 HydrophobicContact CG1-CG 4.39Å; L199-I205 CarbonylContact O-C 3.59Å; L199-I205 WeakPolarHBondContact O-CA 3.45Å; L199-F206 HydrophobicContact CB-CB 4.43Å; L199-F206 PolarHBondContact N-O 2.81Å; L199-F206 PolarHBondContact O-N 3.2Å; L199-V208 HydrophobicContact CD1-CB 4.36Å; L199-V208 HydrophobicContact CD1-CG2 3.97Å; L199-L213 HydrophobicContact CD1-CD1 4.05Å; L199-L213 HydrophobicContact CD1-CD2 3.97Å; L199-L213 HydrophobicContact CD2-CD1 4.39Å; L199-M223 HydrophobicContact CD1-CE 3.79Å; L199-Y236 CarbonylContact C-O 3.48Å; L199-Y236 WeakPolarHBondContact CA-O 3.5Å; L199-Y236 HydrophobicContact CD2-CD2 4.14Å; L199-Y236 HydrophobicContact CD2-CG 4.43Å; L199-F238 HydrophobicContact CB-CE2 4.28Å; L199-F238 HydrophobicContact CD2-CE2 3.88Å; L199-F238 HydrophobicContact CD2-CZ 4.49Å; L199-F245 HydrophobicContact CD1-CE1 4.33Å; L199-F245 HydrophobicContact CD1-CZ 3.7Å
200	N	94.5	Very high	84	Confident	18 Å²	18	61.1 Å²	61.1	10%	0.096	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	102	175.5	-177.2	-8.5	0	0	0	109.6	G203 I205 E235 Y236 Y237 F238	N200-G203 WeakPolarHBondContact OD1-CA 3.37Å; N200-G203 PolarHBondContact OD1-N 3.44Å; N200-I205 HydrophobicContact CB-CG1 4.37Å; N200-E235 HydrophobicContact CB-CG 4.09Å; N200-E235 PolarHBondContact ND2-OE1 2.86Å; N200-Y236 PolarHBondContact N-O 3.5Å; N200-Y237 HydrophobicContact CB-CD2 4.29Å; N200-Y237 CarbonylContact O-C 3.57Å; N200-Y237 VanDerWaalsContact O-CA 3.28Å; N200-Y237 WeakPolarHBondContact O-CA 3.43Å; N200-F238 PolarHBondContact O-N 3.2Å
201	V	95.4	Very high	86.1	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	100.6	178.8	-175.3	0	0	0	0	108.6	G203 T204 F206 F238 R240 P242 F245	V201-G203 PolarHBondContact O-N 3.46Å; V201-G203 VanDerWaalsContact O-N 3.08Å; V201-T204 PolarHBondContact N-O 2.88Å; V201-T204 PolarHBondContact O-N 3.23Å; V201-F206 HydrophobicContact CB-CD2 4.25Å; V201-F206 HydrophobicContact CB-CE2 3.99Å; V201-F206 HydrophobicContact CG2-CD2 3.92Å; V201-F206 HydrophobicContact CG2-CE2 4.07Å; V201-F238 HydrophobicContact CG2-CB 4.33Å; V201-F238 HydrophobicContact CG2-CD2 4.31Å; V201-R240 HydrophobicContact CG1-CB 4.01Å; V201-R240 WeakPolarHBondContact CG1-O 3.36Å; V201-P242 HydrophobicContact CB-CB 4.34Å; V201-P242 HydrophobicContact CG1-CB 4.15Å; V201-F245 HydrophobicContact CG1-CB 4.16Å; V201-F245 HydrophobicContact CG2-CB 4.34Å; V201-F245 HydrophobicContact CG2-CD1 3.7Å; V201-F245 HydrophobicContact CG2-CD2 4.32Å; V201-F245 HydrophobicContact CG2-CE1 4.03Å; V201-F245 HydrophobicContact CG2-CG 3.84Å; V201-F245 HydrophobicContact CG2-CZ 4.48Å
202	S	94.5	Very high	88	Confident	54 Å²	54	54.1 Å²	54.1	38%	0.378	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.5	40.4	-179.2	-70.4	0	0	0	0	114.2	F238 R240	S202-F238 PolarHBondContact N-O 2.67Å; S202-F238 PolarHBondContact OG-O 3.29Å; S202-R240 WeakPolarHBondContact CB-O 3.33Å; S202-R240 PolarHBondContact OG-N 3.16Å; S202-R240 VanDerWaalsContact OG-N 3.14Å; S202-R240 PolarHBondContact OG-O 3Å
203	G	92.2	Very high	89.6	Confident	56 Å²	56	47.7 Å²	47.7	58%	0.577	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.2	-11.4	179.4	0	0	0	0	0	114.9	N200 V201	N200-G203 WeakPolarHBondContact OD1-CA 3.37Å; N200-G203 PolarHBondContact OD1-N 3.44Å; V201-G203 PolarHBondContact O-N 3.46Å; V201-G203 VanDerWaalsContact O-N 3.08Å
204	T	95.4	Very high	90.7	Very high	63 Å²	63	50.5 Å²	50.5	39%	0.387	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	116.8	174.8	-52.8	0	0	0	0	109.9	V201 F206 P242	V201-T204 PolarHBondContact N-O 2.88Å; V201-T204 PolarHBondContact O-N 3.23Å; T204-F206 HydrophobicContact CG2-CD2 4.28Å; T204-F206 HydrophobicContact CG2-CE2 3.54Å; T204-F206 HydrophobicContact CG2-CZ 3.71Å; T204-F206 VanDerWaalsContact O-CD2 3.31Å; T204-F206 WeakPolarHBondContact O-CD2 3.39Å; T204-P242 HydrophobicContact CG2-CB 4.24Å; T204-P242 WeakPolarHBondContact OG1-CB 3.34Å
205	I	94.3	Very high	91.2	Very high	89 Å²	89	52 Å²	52	46%	0.456	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	123.6	-176.3	-55.9	172.2	0	0	0	110	L199 N200	L199-I205 CarbonylContact O-C 3.59Å; L199-I205 WeakPolarHBondContact O-CA 3.45Å; N200-I205 HydrophobicContact CB-CG1 4.37Å
206	F	95	Very high	91.5	Very high	32 Å²	32	50.7 Å²	50.7	14%	0.14	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	128.6	174.8	-64	-93.8	0	0	0	110	L199 V201 T204 V208 P242 F245 L249	L199-F206 HydrophobicContact CB-CB 4.43Å; L199-F206 PolarHBondContact N-O 2.81Å; L199-F206 PolarHBondContact O-N 3.2Å; V201-F206 HydrophobicContact CB-CD2 4.25Å; V201-F206 HydrophobicContact CB-CE2 3.99Å; V201-F206 HydrophobicContact CG2-CD2 3.92Å; V201-F206 HydrophobicContact CG2-CE2 4.07Å; T204-F206 HydrophobicContact CG2-CD2 4.28Å; T204-F206 HydrophobicContact CG2-CE2 3.54Å; T204-F206 HydrophobicContact CG2-CZ 3.71Å; T204-F206 VanDerWaalsContact O-CD2 3.31Å; T204-F206 WeakPolarHBondContact O-CD2 3.39Å; F206-V208 HydrophobicContact CB-CG2 4.13Å; F206-P242 HydrophobicContact CE2-CB 4.22Å; F206-P242 HydrophobicContact CZ-CB 4.41Å; F206-F245 HydrophobicContact CB-CE1 3.92Å; F206-F245 HydrophobicContact CD1-CD1 4.01Å; F206-F245 HydrophobicContact CD1-CE1 4.05Å; F206-F245 AromaticContact CD2-CD1 3.55Å; F206-F245 HydrophobicContact CD2-CD1 3.55Å; F206-F245 AromaticContact CD2-CE1 3.72Å; F206-F245 HydrophobicContact CD2-CE1 3.72Å; F206-F245 HydrophobicContact CE1-CD1 4.03Å; F206-F245 AromaticContact CE2-CD1 3.57Å; F206-F245 HydrophobicContact CE2-CD1 3.57Å; F206-F245 HydrophobicContact CE2-CE1 4.23Å; F206-F245 AromaticContact CG-CD1 3.78Å; F206-F245 HydrophobicContact CG-CD1 3.78Å; F206-F245 AromaticContact CG-CE1 3.62Å; F206-F245 HydrophobicContact CG-CE1 3.62Å; F206-F245 AromaticContact CZ-CD1 3.82Å; F206-F245 HydrophobicContact CZ-CD1 3.82Å; F206-L249 HydrophobicContact CD1-CD2 3.92Å
207	H	92.4	Very high	91.6	Very high	115 Å²	115	51.7 Å²	51.7	53%	0.532	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	118.5	170.1	-66.2	-86.6	0	0	0	109.2	I196	I196-H207 HydrophobicContact CG2-CB 4.01Å
208	V	92	Very high	91.6	Very high	2 Å²	2	59.8 Å²	59.8	1%	0.012	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	138.7	-173.4	-171.5	0	0	0	0	110.4	I196 V197 L199 F206 H210 T212 L213 L249	I196-V208 CarbonylContact C-O 3.19Å; I196-V208 WeakPolarHBondContact CA-O 3.39Å; V197-V208 PolarHBondContact N-O 2.9Å; V197-V208 PolarHBondContact O-N 3.4Å; L199-V208 HydrophobicContact CD1-CB 4.36Å; L199-V208 HydrophobicContact CD1-CG2 3.97Å; F206-V208 HydrophobicContact CB-CG2 4.13Å; V208-H210 PolarHBondContact O-N 2.91Å; V208-T212 HydrophobicContact CG1-CG2 4.13Å; V208-L213 HydrophobicContact CB-CD2 4.34Å; V208-L213 HydrophobicContact CB-CG 4.44Å; V208-L213 HydrophobicContact CG1-CD1 4.46Å; V208-L213 HydrophobicContact CG1-CD2 3.7Å; V208-L213 HydrophobicContact CG1-CG 3.83Å; V208-L249 HydrophobicContact CB-CD1 4.22Å; V208-L249 HydrophobicContact CG1-CD1 3.52Å; V208-L249 HydrophobicContact CG2-CD1 3.57Å; V208-L249 HydrophobicContact CG2-CD2 3.85Å; V208-L249 HydrophobicContact CG2-CG 4.38Å
209	R	91	Very high	91.6	Very high	142 Å²	142	56 Å²	56	54%	0.536	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	134.5	171.6	-66.9	-173.3	-68.2	-148.1	0.3	109.6	P194 V195 S211 T212 L213	P194-R209 HydrophobicContact CB-CG 4.49Å; V195-R209 CarbonylContact O-C 3.6Å; V195-R209 WeakPolarHBondContact O-CA 3.44Å; R209-S211 PolarHBondContact O-N 3.06Å; R209-T212 WeakPolarHBondContact O-CB 3.48Å; R209-T212 PolarHBondContact O-N 3.06Å; R209-L213 PolarHBondContact O-N 3.35Å
210	H	87.1	Confident	91.4	Very high	21 Å²	21	57.1 Å²	57.1	10%	0.097	30%	0.302	C	S	.	.	H	α-helix	trans	-55.4	-37.8	175.5	-174.9	-109.4	0	0	0	112.1	M178 V195 V197 V208 T212 L213 K214 Y220	M178-H210 PolarHBondContact O-CD2 3.33Å; M178-H210 VanDerWaalsContact O-CD2 3.31Å; M178-H210 PolarHBondContact O-NE2 2.92Å; V195-H210 HydrophobicContact CB-CB 3.91Å; V195-H210 HydrophobicContact CG1-CB 4.18Å; V195-H210 PolarHBondContact O-N 3.36Å; V197-H210 HydrophobicContact CG2-CB 4.06Å; V208-H210 PolarHBondContact O-N 2.91Å; H210-T212 VanDerWaalsContact C-N 3.28Å; H210-T212 PolarHBondContact O-N 2.88Å; H210-L213 PolarHBondContact O-N 3.2Å; H210-L213 VanDerWaalsContact O-N 3.17Å; H210-K214 WeakPolarHBondContact CE1-CE 3.44Å; H210-K214 PolarHBondContact O-N 3.46Å; H210-Y220 PolarHBondContact NE2-OH 3.41Å
211	S	87.3	Confident	91.2	Very high	80 Å²	80	57.6 Å²	57.6	56%	0.559	31%	0.311	S	S	*	.	H	α-helix	trans	-62.4	-30.9	175.4	56.9	0	0	0	0	114	R209	R209-S211 PolarHBondContact O-N 3.06Å
212	T	91.4	Very high	91	Very high	14 Å²	14	60.4 Å²	60.4	9%	0.086	32%	0.323	C	S	.	.	H	α-helix	trans	-70.9	-37.6	175.5	-61.8	0	0	0	0	111.2	V208 R209 H210 K214 H215 L249 L252 R253	V208-T212 HydrophobicContact CG1-CG2 4.13Å; R209-T212 WeakPolarHBondContact O-CB 3.48Å; R209-T212 PolarHBondContact O-N 3.06Å; H210-T212 VanDerWaalsContact C-N 3.28Å; H210-T212 PolarHBondContact O-N 2.88Å; T212-K214 VanDerWaalsContact C-N 3.27Å; T212-K214 PolarHBondContact O-N 3.32Å; T212-H215 VanDerWaalsContact O-CB 3.22Å; T212-H215 WeakPolarHBondContact O-CB 3.4Å; T212-H215 PolarHBondContact O-N 2.88Å; T212-L249 HydrophobicContact CG2-CD1 4.49Å; T212-L252 HydrophobicContact CG2-CB 4.13Å; T212-R253 HydrophobicContact CG2-CB 4.45Å; T212-R253 HydrophobicContact CG2-CG 3.58Å
213	L	90.2	Very high	90.8	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-67.2	-32.1	177.7	-60	175.9	0	0	0	111.6	M178 V197 L199 V208 R209 H210 H215 Y220 M223 L252	M178-L213 HydrophobicContact CE-CD1 3.39Å; V197-L213 HydrophobicContact CB-CD1 4.37Å; L199-L213 HydrophobicContact CD1-CD1 4.05Å; L199-L213 HydrophobicContact CD1-CD2 3.97Å; L199-L213 HydrophobicContact CD2-CD1 4.39Å; V208-L213 HydrophobicContact CB-CD2 4.34Å; V208-L213 HydrophobicContact CB-CG 4.44Å; V208-L213 HydrophobicContact CG1-CD1 4.46Å; V208-L213 HydrophobicContact CG1-CD2 3.7Å; V208-L213 HydrophobicContact CG1-CG 3.83Å; R209-L213 PolarHBondContact O-N 3.35Å; H210-L213 PolarHBondContact O-N 3.2Å; H210-L213 VanDerWaalsContact O-N 3.17Å; L213-H215 PolarHBondContact O-N 3.33Å; L213-Y220 HydrophobicContact CB-CD2 3.8Å; L213-Y220 HydrophobicContact CB-CE2 4.04Å; L213-Y220 WeakPolarHBondContact O-CB 3.48Å; L213-M223 HydrophobicContact CD2-CE 4.1Å; L213-M223 HydrophobicContact CD2-SD 4.27Å; L213-L252 HydrophobicContact CD2-CD1 4Å
214	K	88.7	Confident	90.7	Very high	91 Å²	91	57.1 Å²	57.1	40%	0.396	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-3.6	175	-72.9	-174.6	162.2	-176.7	0	114.7	E179 H210 T212 D216 Y220	E179-K214 IonicContact OE1-NZ 3.02Å; E179-K214 PolarHBondContact OE1-NZ 3.41Å; H210-K214 WeakPolarHBondContact CE1-CE 3.44Å; H210-K214 PolarHBondContact O-N 3.46Å; T212-K214 VanDerWaalsContact C-N 3.27Å; T212-K214 PolarHBondContact O-N 3.32Å; K214-D216 VanDerWaalsContact C-N 3.3Å; K214-D216 PolarHBondContact O-N 2.8Å; K214-Y220 HydrophobicContact CG-CE1 4.48Å; K214-Y220 HydrophobicContact CG-CE2 4.48Å
215	H	88.2	Confident	90.3	Very high	112 Å²	112	61.1 Å²	61.1	52%	0.519	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-39.3	-176.8	-169.2	72.6	0	0	0	112.3	T212 L213 L252	T212-H215 VanDerWaalsContact O-CB 3.22Å; T212-H215 WeakPolarHBondContact O-CB 3.4Å; T212-H215 PolarHBondContact O-N 2.88Å; L213-H215 PolarHBondContact O-N 3.33Å; H215-L252 WeakPolarHBondContact CB-O 3.39Å
216	D	90	Very high	90.1	Very high	21 Å²	21	59.1 Å²	59.1	11%	0.112	29%	0.292	C	S	.	.	S	Bend	trans	-117.7	108.6	173.7	-171.9	-34.6	0	0	0	109.7	K214 F218 V219 Y220 Y251 L252	K214-D216 VanDerWaalsContact C-N 3.3Å; K214-D216 PolarHBondContact O-N 2.8Å; D216-F218 VanDerWaalsContact C-N 3.26Å; D216-F218 PolarHBondContact O-N 3.41Å; D216-F218 WeakPolarHBondContact OD1-CB 3.47Å; D216-F218 PolarHBondContact OD1-N 2.82Å; D216-V219 HydrophobicContact CB-CB 4.09Å; D216-V219 HydrophobicContact CB-CG2 4.09Å; D216-V219 PolarHBondContact OD1-N 3.31Å; D216-Y220 VanDerWaalsContact O-CB 3.22Å; D216-Y220 WeakPolarHBondContact O-CB 3.41Å; D216-Y220 PolarHBondContact O-N 3.46Å; D216-Y251 HydrophobicContact CB-CE1 4.27Å; D216-Y251 WeakPolarHBondContact OD2-CE1 3.45Å; D216-Y251 PolarHBondContact OD2-OH 2.93Å; D216-L252 HydrophobicContact CB-CD2 3.76Å
217	P	88.6	Confident	89.8	Confident	96 Å²	96	58.7 Å²	58.7	62%	0.623	30%	0.295	S	S	*	.	H	α-helix	trans	-62.6	-28.8	-179.1	-24.2	34.4	0	0	0	114.3	G221	P217-G221 PolarHBondContact O-N 3.08Å
218	F	89.4	Confident	89.7	Confident	171 Å²	171	57.9 Å²	57.9	75%	0.75	29%	0.294	S	S	*	.	H	α-helix	trans	-74.8	-49	-179	-67.2	-77.5	0	0	0	110.5	D216 Y220 G221 K222	D216-F218 VanDerWaalsContact C-N 3.26Å; D216-F218 PolarHBondContact O-N 3.41Å; D216-F218 WeakPolarHBondContact OD1-CB 3.47Å; D216-F218 PolarHBondContact OD1-N 2.82Å; F218-Y220 VanDerWaalsContact C-N 3.32Å; F218-Y220 PolarHBondContact O-N 3.4Å; F218-G221 PolarHBondContact O-N 3.31Å; F218-K222 WeakPolarHBondContact O-CB 3.37Å; F218-K222 PolarHBondContact O-N 3.2Å
219	V	91.5	Very high	89.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61	-44.8	174.6	178.5	0	0	0	0	110	D216 G221 K222 M223 I248 Y251 L252 I277	D216-V219 HydrophobicContact CB-CB 4.09Å; D216-V219 HydrophobicContact CB-CG2 4.09Å; D216-V219 PolarHBondContact OD1-N 3.31Å; V219-G221 PolarHBondContact O-N 2.93Å; V219-K222 PolarHBondContact O-N 3.48Å; V219-M223 HydrophobicContact CG1-CG 4.29Å; V219-M223 HydrophobicContact CG1-SD 4.14Å; V219-M223 WeakPolarHBondContact O-CB 3.36Å; V219-M223 VanDerWaalsContact O-CG 3.24Å; V219-M223 WeakPolarHBondContact O-CG 3.45Å; V219-M223 PolarHBondContact O-N 2.91Å; V219-I248 HydrophobicContact CG1-CG2 4.43Å; V219-Y251 HydrophobicContact CG2-CE1 4.23Å; V219-L252 HydrophobicContact CB-CD2 4.31Å; V219-L252 HydrophobicContact CG1-CD1 4.36Å; V219-L252 HydrophobicContact CG1-CD2 4.2Å; V219-I277 HydrophobicContact CG2-CD1 3.99Å; V219-I277 HydrophobicContact CG2-CG1 3.46Å; V219-I277 VanDerWaalsContact CG2-CG1 3.46Å
220	Y	91.5	Very high	89.5	Confident	23 Å²	23	56.3 Å²	56.3	9%	0.09	29%	0.291	C	S	.	.	H	α-helix	trans	-59.7	-46.1	176.9	-176.2	-111	0	0	0	112.9	M178 H210 L213 K214 D216 F218 K222 M223 L224	M178-Y220 WeakPolarHBondContact CB-OH 3.19Å; M178-Y220 HydrophobicContact CE-CD2 4.39Å; M178-Y220 HydrophobicContact CE-CE2 3.58Å; M178-Y220 HydrophobicContact SD-CE2 3.95Å; H210-Y220 PolarHBondContact NE2-OH 3.41Å; L213-Y220 HydrophobicContact CB-CD2 3.8Å; L213-Y220 HydrophobicContact CB-CE2 4.04Å; L213-Y220 WeakPolarHBondContact O-CB 3.48Å; K214-Y220 HydrophobicContact CG-CE1 4.48Å; K214-Y220 HydrophobicContact CG-CE2 4.48Å; D216-Y220 VanDerWaalsContact O-CB 3.22Å; D216-Y220 WeakPolarHBondContact O-CB 3.41Å; D216-Y220 PolarHBondContact O-N 3.46Å; F218-Y220 VanDerWaalsContact C-N 3.32Å; F218-Y220 PolarHBondContact O-N 3.4Å; Y220-K222 VanDerWaalsContact C-N 3.3Å; Y220-K222 PolarHBondContact O-N 2.88Å; Y220-M223 PolarHBondContact O-N 2.7Å; Y220-L224 HydrophobicContact CD1-CD1 3.83Å; Y220-L224 HydrophobicContact CE1-CD1 3.37Å; Y220-L224 HydrophobicContact CE1-CG 4.24Å; Y220-L224 WeakPolarHBondContact O-CG 3.32Å; Y220-L224 PolarHBondContact O-N 3.4Å
221	G	89.5	Confident	89.5	Confident	27 Å²	27	59.8 Å²	59.8	28%	0.278	31%	0.31	S	S	.	.	H	α-helix	trans	-58.8	-43.9	175.5	0	0	0	0	0	111.5	P217 F218 V219 L224 E225	P217-G221 PolarHBondContact O-N 3.08Å; F218-G221 PolarHBondContact O-N 3.31Å; V219-G221 PolarHBondContact O-N 2.93Å; G221-L224 WeakPolarHBondContact O-CB 3.28Å; G221-L224 PolarHBondContact O-N 3.13Å; G221-E225 PolarHBondContact O-N 3.3Å
222	K	90.5	Very high	89.5	Confident	59 Å²	59	65.7 Å²	65.7	26%	0.257	33%	0.326	S	S	.	.	H	α-helix	trans	-66.1	-41.1	177.7	-173.1	54.7	178.9	150	0	112.8	F218 V219 Y220 L224 E225 D226 D274	F218-K222 WeakPolarHBondContact O-CB 3.37Å; F218-K222 PolarHBondContact O-N 3.2Å; V219-K222 PolarHBondContact O-N 3.48Å; Y220-K222 VanDerWaalsContact C-N 3.3Å; Y220-K222 PolarHBondContact O-N 2.88Å; K222-L224 VanDerWaalsContact C-N 3.28Å; K222-L224 PolarHBondContact O-N 3.21Å; K222-E225 IonicContact NZ-OE2 3.68Å; K222-E225 PolarHBondContact O-N 3.41Å; K222-D226 IonicContact NZ-OD1 3.47Å; K222-D226 PolarHBondContact NZ-OD1 2.93Å; K222-D226 IonicContact NZ-OD2 3.46Å; K222-D226 PolarHBondContact O-N 3.41Å; K222-D226 VanDerWaalsContact O-N 3.13Å; K222-D274 WeakPolarHBondContact CE-O 3.42Å; K222-D274 WeakPolarHBondContact CG-O 3.33Å
223	M	91.6	Very high	89.3	Confident	1 Å²	1	68 Å²	68	1%	0.005	34%	0.341	C	S	.	.	H	α-helix	trans	-59.7	-40.3	174	-72	-177	73.4	0	0	111.5	L199 L213 V219 Y220 E225 D226 A227 F238 F245 L252 W275	L199-M223 HydrophobicContact CD1-CE 3.79Å; L213-M223 HydrophobicContact CD2-CE 4.1Å; L213-M223 HydrophobicContact CD2-SD 4.27Å; V219-M223 HydrophobicContact CG1-CG 4.29Å; V219-M223 HydrophobicContact CG1-SD 4.14Å; V219-M223 WeakPolarHBondContact O-CB 3.36Å; V219-M223 VanDerWaalsContact O-CG 3.24Å; V219-M223 WeakPolarHBondContact O-CG 3.45Å; V219-M223 PolarHBondContact O-N 2.91Å; Y220-M223 PolarHBondContact O-N 2.7Å; M223-E225 VanDerWaalsContact C-N 3.33Å; M223-E225 PolarHBondContact O-N 3.33Å; M223-D226 PolarHBondContact O-N 3.39Å; M223-A227 WeakPolarHBondContact O-CB 3.48Å; M223-A227 PolarHBondContact O-N 2.97Å; M223-F238 HydrophobicContact CB-CE1 4.26Å; M223-F238 HydrophobicContact CB-CZ 4.36Å; M223-F238 HydrophobicContact CE-CE2 4.41Å; M223-F238 HydrophobicContact CE-CZ 3.99Å; M223-F238 WeakPolarHBondContact O-CE1 3.49Å; M223-F245 HydrophobicContact CE-CE2 3.93Å; M223-F245 HydrophobicContact CE-CZ 4.2Å; M223-L252 HydrophobicContact SD-CD1 4.41Å; M223-W275 HydrophobicContact CE-CZ3 3.98Å; M223-W275 HydrophobicContact CG-CE3 3.81Å; M223-W275 HydrophobicContact CG-CZ3 3.77Å; M223-W275 HydrophobicContact SD-CE3 4.45Å; M223-W275 HydrophobicContact SD-CZ3 4.26Å
224	L	88.5	Confident	89.2	Confident	41 Å²	41	72.3 Å²	72.3	22%	0.215	36%	0.359	C	S	.	.	H	α-helix	trans	-65.5	-34.8	177.6	-80.9	170.4	0	0	0	113.4	P175 M178 Y220 G221 K222	P175-L224 HydrophobicContact CB-CB 4.39Å; P175-L224 HydrophobicContact CB-CD1 4.12Å; P175-L224 HydrophobicContact CB-CD2 4.05Å; P175-L224 HydrophobicContact CB-CG 4.46Å; M178-L224 HydrophobicContact CB-CD2 3.84Å; M178-L224 HydrophobicContact CG-CD2 3.62Å; M178-L224 HydrophobicContact SD-CD2 3.29Å; M178-L224 WeakPolarHBondContact SD-CD2 3.34Å; M178-L224 HydrophobicContact SD-CG 3.89Å; Y220-L224 HydrophobicContact CD1-CD1 3.83Å; Y220-L224 HydrophobicContact CE1-CD1 3.37Å; Y220-L224 HydrophobicContact CE1-CG 4.24Å; Y220-L224 WeakPolarHBondContact O-CG 3.32Å; Y220-L224 PolarHBondContact O-N 3.4Å; G221-L224 WeakPolarHBondContact O-CB 3.28Å; G221-L224 PolarHBondContact O-N 3.13Å; K222-L224 VanDerWaalsContact C-N 3.28Å; K222-L224 PolarHBondContact O-N 3.21Å
225	E	87.4	Confident	89.3	Confident	147 Å²	147	68.8 Å²	68.8	69%	0.687	34%	0.344	S	S	*	.	H	α-helix	trans	-68.1	-42.3	175.8	-70	176.3	177.8	0	0	112.1	G221 K222 M223	G221-E225 PolarHBondContact O-N 3.3Å; K222-E225 IonicContact NZ-OE2 3.68Å; K222-E225 PolarHBondContact O-N 3.41Å; M223-E225 VanDerWaalsContact C-N 3.33Å; M223-E225 PolarHBondContact O-N 3.33Å
226	D	89.7	Confident	89.4	Confident	46 Å²	46	63.8 Å²	63.8	25%	0.246	32%	0.321	C	S	.	.	H	α-helix	trans	-87.9	-12.5	-173.6	-74.5	16.3	0	0	0	113.2	K222 M223 R240	K222-D226 IonicContact NZ-OD1 3.47Å; K222-D226 PolarHBondContact NZ-OD1 2.93Å; K222-D226 IonicContact NZ-OD2 3.46Å; K222-D226 PolarHBondContact O-N 3.41Å; K222-D226 VanDerWaalsContact O-N 3.13Å; M223-D226 PolarHBondContact O-N 3.39Å; D226-R240 IonicContact OD2-CZ 2.77Å; D226-R240 IonicContact OD2-NE 2.81Å; D226-R240 IonicContact OD2-NH2 3.77Å; D226-R240 PolarHBondContact OD2-NH2 3.07Å
227	A	89.3	Confident	89.6	Confident	24 Å²	24	65.9 Å²	65.9	20%	0.198	33%	0.328	C	S	.	.			trans	-73.1	131.7	-174.6	0	0	0	0	0	113.6	M223 Y236 F238	M223-A227 WeakPolarHBondContact O-CB 3.48Å; M223-A227 PolarHBondContact O-N 2.97Å; A227-Y236 HydrophobicContact CB-CD1 3.9Å; A227-F238 HydrophobicContact CB-CE1 3.78Å; A227-F238 HydrophobicContact CB-CE2 4.46Å; A227-F238 HydrophobicContact CB-CZ 3.63Å
228	I	91.2	Very high	89.9	Confident	98 Å²	98	61.5 Å²	61.5	50%	0.503	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	114.7	171.4	-60.8	170.6	0	0	0	109	I230 Y236 Y237	I228-I230 PolarHBondContact O-N 3.04Å; I228-Y236 CarbonylContact O-C 3.59Å; I228-Y236 WeakPolarHBondContact O-CA 3.42Å; I228-Y237 HydrophobicContact CD1-CD1 4.29Å; I228-Y237 PolarHBondContact N-O 3.22Å; I228-Y237 PolarHBondContact O-N 3.03Å
229	W	89.1	Confident	90.1	Very high	54 Å²	54	60.3 Å²	60.3	21%	0.205	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	124.2	175.7	176.8	-112.2	0	0	0	111.7	D181 D231 K234 E235 Y236	D181-W229 WeakPolarHBondContact OD1-CH2 3.3Å; D181-W229 WeakPolarHBondContact OD2-CZ3 3.47Å; W229-D231 PolarHBondContact NE1-OD1 3.44Å; W229-K234 HydrophobicContact CH2-CB 3.96Å; W229-K234 HydrophobicContact CH2-CD 4.13Å; W229-K234 HydrophobicContact CZ2-CB 4.25Å; W229-K234 HydrophobicContact CZ2-CD 3.61Å; W229-E235 VanDerWaalsContact CE3-O 3.3Å; W229-Y236 HydrophobicContact CB-CD1 4.43Å; W229-Y236 HydrophobicContact CB-CE1 4.31Å; W229-Y236 HydrophobicContact CD2-CE1 4.34Å; W229-Y236 AromaticContact CE3-CD1 3.81Å; W229-Y236 HydrophobicContact CE3-CD1 3.81Å; W229-Y236 HydrophobicContact CE3-CD2 4.05Å; W229-Y236 AromaticContact CE3-CE1 3.57Å; W229-Y236 HydrophobicContact CE3-CE1 3.57Å; W229-Y236 AromaticContact CE3-CE2 3.82Å; W229-Y236 HydrophobicContact CE3-CE2 3.82Å; W229-Y236 HydrophobicContact CE3-CG 4.05Å; W229-Y236 AromaticContact CE3-CZ 3.57Å; W229-Y236 AromaticContact CZ3-CD2 4Å; W229-Y236 HydrophobicContact CZ3-CD2 4Å; W229-Y236 HydrophobicContact CZ3-CE1 4.24Å; W229-Y236 AromaticContact CZ3-CE2 3.64Å; W229-Y236 HydrophobicContact CZ3-CE2 3.64Å; W229-Y236 HydrophobicContact CZ3-CG 4.44Å; W229-Y236 AromaticContact CZ3-CZ 3.76Å
230	I	89.5	Confident	90.2	Very high	56 Å²	56	63.3 Å²	63.3	29%	0.287	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	103.6	173.3	-55.5	179.3	0	0	0	108.9	I228 K232 T233 K234 E235 Y237	I228-I230 PolarHBondContact O-N 3.04Å; I230-K232 VanDerWaalsContact C-N 3.31Å; I230-K232 PolarHBondContact O-N 3.32Å; I230-T233 VanDerWaalsContact CG2-OG1 3.26Å; I230-T233 WeakPolarHBondContact CG2-OG1 3.44Å; I230-T233 PolarHBondContact O-N 3.17Å; I230-K234 WeakPolarHBondContact O-CA 3.39Å; I230-K234 PolarHBondContact O-N 2.86Å; I230-E235 HydrophobicContact CB-CG 4.37Å; I230-E235 PolarHBondContact N-O 3.3Å; I230-E235 PolarHBondContact O-N 3.18Å; I230-Y237 HydrophobicContact CD1-CG 4.26Å
231	D	86.8	Confident	90.3	Very high	94 Å²	94	64.7 Å²	64.7	50%	0.503	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-31.5	-173.8	-167	54.1	0	0	0	113.9	W229 K234	W229-D231 PolarHBondContact NE1-OD1 3.44Å; D231-K234 VanDerWaalsContact O-CD 3.29Å; D231-K234 WeakPolarHBondContact O-CD 3.07Å; D231-K234 VanDerWaalsContact O-CE 3.24Å; D231-K234 WeakPolarHBondContact O-CE 3.39Å; D231-K234 IonicContact OD1-NZ 2.67Å; D231-K234 PolarHBondContact OD1-NZ 3.46Å; D231-K234 IonicContact OD2-NZ 2.68Å
232	K	86.5	Confident	90.5	Very high	204 Å²	204	65.1 Å²	65.1	89%	0.887	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-42.4	-179.2	-65.9	-175.9	-178.9	-179.1	0	112.6	I230	I230-K232 VanDerWaalsContact C-N 3.31Å; I230-K232 PolarHBondContact O-N 3.32Å
233	T	88	Confident	90.5	Very high	64 Å²	64	67.1 Å²	67.1	39%	0.393	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	-10.2	-177.9	47	0	0	0	0	112.7	R198 I230 E235	R198-T233 PolarHBondContact NH2-O 2.97Å; I230-T233 VanDerWaalsContact CG2-OG1 3.26Å; I230-T233 WeakPolarHBondContact CG2-OG1 3.44Å; I230-T233 PolarHBondContact O-N 3.17Å; T233-E235 VanDerWaalsContact OG1-CD 3.24Å; T233-E235 VanDerWaalsContact OG1-CG 3.3Å; T233-E235 WeakPolarHBondContact OG1-CG 3.47Å; T233-E235 PolarHBondContact OG1-OE1 2.85Å; T233-E235 VanDerWaalsContact OG1-OE1 3.04Å
234	K	87.6	Confident	90.5	Very high	90 Å²	90	67 Å²	67	39%	0.391	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.4	57	-176.6	-56.9	-68.3	-179.5	-174.8	0	110.7	R198 W229 I230 D231	R198-K234 PolarHBondContact NE-O 3.37Å; R198-K234 VanDerWaalsContact NE-O 3.12Å; R198-K234 PolarHBondContact NH2-O 3.23Å; W229-K234 HydrophobicContact CH2-CB 3.96Å; W229-K234 HydrophobicContact CH2-CD 4.13Å; W229-K234 HydrophobicContact CZ2-CB 4.25Å; W229-K234 HydrophobicContact CZ2-CD 3.61Å; I230-K234 WeakPolarHBondContact O-CA 3.39Å; I230-K234 PolarHBondContact O-N 2.86Å; D231-K234 VanDerWaalsContact O-CD 3.29Å; D231-K234 WeakPolarHBondContact O-CD 3.07Å; D231-K234 VanDerWaalsContact O-CE 3.24Å; D231-K234 WeakPolarHBondContact O-CE 3.39Å; D231-K234 IonicContact OD1-NZ 2.67Å; D231-K234 PolarHBondContact OD1-NZ 3.46Å; D231-K234 IonicContact OD2-NZ 2.68Å
235	E	90.1	Very high	90.7	Very high	17 Å²	17	65.1 Å²	65.1	8%	0.079	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	157.3	180	77	-166.7	173.6	0	0	111.7	R198 N200 W229 I230 T233	R198-E235 HydrophobicContact CB-CB 3.87Å; R198-E235 WeakPolarHBondContact O-CA 3.43Å; N200-E235 HydrophobicContact CB-CG 4.09Å; N200-E235 PolarHBondContact ND2-OE1 2.86Å; W229-E235 VanDerWaalsContact CE3-O 3.3Å; I230-E235 HydrophobicContact CB-CG 4.37Å; I230-E235 PolarHBondContact N-O 3.3Å; I230-E235 PolarHBondContact O-N 3.18Å; T233-E235 VanDerWaalsContact OG1-CD 3.24Å; T233-E235 VanDerWaalsContact OG1-CG 3.3Å; T233-E235 WeakPolarHBondContact OG1-CG 3.47Å; T233-E235 PolarHBondContact OG1-OE1 2.85Å; T233-E235 VanDerWaalsContact OG1-OE1 3.04Å
236	Y	91.9	Very high	91	Very high	7 Å²	7	61.8 Å²	61.8	3%	0.027	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	123.4	170.8	-64.3	-82.9	0	0	0	110.2	F177 M178 D181 V197 R198 L199 N200 A227 I228 W229	F177-Y236 HydrophobicContact CB-CE1 4.29Å; F177-Y236 VanDerWaalsContact CB-OH 3.28Å; F177-Y236 WeakPolarHBondContact CB-OH 3.42Å; F177-Y236 PolarHBondContact O-OH 3.49Å; M178-Y236 VanDerWaalsContact CA-OH 3.27Å; M178-Y236 WeakPolarHBondContact CA-OH 3.46Å; M178-Y236 HydrophobicContact CG-CD2 4.45Å; M178-Y236 HydrophobicContact CG-CE1 3.84Å; M178-Y236 HydrophobicContact CG-CE2 3.72Å; M178-Y236 WeakPolarHBondContact CG-OH 3.41Å; M178-Y236 PolarHBondContact N-OH 3.37Å; M178-Y236 VanDerWaalsContact N-OH 3.09Å; D181-Y236 WeakPolarHBondContact OD2-CE2 3.33Å; V197-Y236 HydrophobicContact CG1-CD2 3.5Å; V197-Y236 HydrophobicContact CG1-CE2 3.6Å; R198-Y236 PolarHBondContact O-N 3.49Å; L199-Y236 CarbonylContact C-O 3.48Å; L199-Y236 WeakPolarHBondContact CA-O 3.5Å; L199-Y236 HydrophobicContact CD2-CD2 4.14Å; L199-Y236 HydrophobicContact CD2-CG 4.43Å; N200-Y236 PolarHBondContact N-O 3.5Å; A227-Y236 HydrophobicContact CB-CD1 3.9Å; I228-Y236 CarbonylContact O-C 3.59Å; I228-Y236 WeakPolarHBondContact O-CA 3.42Å; W229-Y236 HydrophobicContact CB-CD1 4.43Å; W229-Y236 HydrophobicContact CB-CE1 4.31Å; W229-Y236 HydrophobicContact CD2-CE1 4.34Å; W229-Y236 AromaticContact CE3-CD1 3.81Å; W229-Y236 HydrophobicContact CE3-CD1 3.81Å; W229-Y236 HydrophobicContact CE3-CD2 4.05Å; W229-Y236 AromaticContact CE3-CE1 3.57Å; W229-Y236 HydrophobicContact CE3-CE1 3.57Å; W229-Y236 AromaticContact CE3-CE2 3.82Å; W229-Y236 HydrophobicContact CE3-CE2 3.82Å; W229-Y236 HydrophobicContact CE3-CG 4.05Å; W229-Y236 AromaticContact CE3-CZ 3.57Å; W229-Y236 AromaticContact CZ3-CD2 4Å; W229-Y236 HydrophobicContact CZ3-CD2 4Å; W229-Y236 HydrophobicContact CZ3-CE1 4.24Å; W229-Y236 AromaticContact CZ3-CE2 3.64Å; W229-Y236 HydrophobicContact CZ3-CE2 3.64Å; W229-Y236 HydrophobicContact CZ3-CG 4.44Å; W229-Y236 AromaticContact CZ3-CZ 3.76Å
237	Y	93.7	Very high	91.1	Very high	65 Å²	65	60.1 Å²	60.1	26%	0.255	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	135.9	178.1	179	-96.5	0	0	0	111.8	N200 I228 I230 E239	N200-Y237 HydrophobicContact CB-CD2 4.29Å; N200-Y237 CarbonylContact O-C 3.57Å; N200-Y237 VanDerWaalsContact O-CA 3.28Å; N200-Y237 WeakPolarHBondContact O-CA 3.43Å; I228-Y237 HydrophobicContact CD1-CD1 4.29Å; I228-Y237 PolarHBondContact N-O 3.22Å; I228-Y237 PolarHBondContact O-N 3.03Å; I230-Y237 HydrophobicContact CD1-CG 4.26Å; Y237-E239 HydrophobicContact CE1-CB 4.21Å
238	F	94.9	Very high	91.3	Very high	4 Å²	4	59 Å²	59	2%	0.018	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	133.2	174.6	-62.2	-90.5	0	0	0	110	L199 N200 V201 S202 M223 A227 R240 W275	L199-F238 HydrophobicContact CB-CE2 4.28Å; L199-F238 HydrophobicContact CD2-CE2 3.88Å; L199-F238 HydrophobicContact CD2-CZ 4.49Å; N200-F238 PolarHBondContact O-N 3.2Å; V201-F238 HydrophobicContact CG2-CB 4.33Å; V201-F238 HydrophobicContact CG2-CD2 4.31Å; S202-F238 PolarHBondContact N-O 2.67Å; S202-F238 PolarHBondContact OG-O 3.29Å; M223-F238 HydrophobicContact CB-CE1 4.26Å; M223-F238 HydrophobicContact CB-CZ 4.36Å; M223-F238 HydrophobicContact CE-CE2 4.41Å; M223-F238 HydrophobicContact CE-CZ 3.99Å; M223-F238 WeakPolarHBondContact O-CE1 3.49Å; A227-F238 HydrophobicContact CB-CE1 3.78Å; A227-F238 HydrophobicContact CB-CE2 4.46Å; A227-F238 HydrophobicContact CB-CZ 3.63Å; F238-R240 HydrophobicContact CB-CG 4.3Å; F238-R240 PolarHBondContact O-N 3.17Å; F238-W275 HydrophobicContact CB-CH2 4.25Å; F238-W275 AromaticContact CD1-CH2 4Å; F238-W275 HydrophobicContact CD1-CH2 4Å; F238-W275 HydrophobicContact CD1-CZ3 4.05Å; F238-W275 HydrophobicContact CE1-CZ3 4.21Å; F238-W275 HydrophobicContact CG-CH2 4.04Å; F238-W275 HydrophobicContact CG-CZ3 4.49Å
239	E	94	Very high	91.4	Very high	145 Å²	145	54.6 Å²	54.6	68%	0.678	25%	0.253	S	S	*	.			trans	-93.1	77.7	172.2	-167.2	177	179.7	0	0	110	Y237	Y237-E239 HydrophobicContact CE1-CB 4.21Å
240	R	93.3	Very high	91.5	Very high	64 Å²	64	53.8 Å²	53.8	24%	0.242	25%	0.253	C	S	.	.	S	Bend	trans	-147.1	167.3	-171.9	-63.3	-67.5	178.9	-117.3	6.2	111.1	V201 S202 D226 F238 P242 W275	V201-R240 HydrophobicContact CG1-CB 4.01Å; V201-R240 WeakPolarHBondContact CG1-O 3.36Å; S202-R240 WeakPolarHBondContact CB-O 3.33Å; S202-R240 PolarHBondContact OG-N 3.16Å; S202-R240 VanDerWaalsContact OG-N 3.14Å; S202-R240 PolarHBondContact OG-O 3Å; D226-R240 IonicContact OD2-CZ 2.77Å; D226-R240 IonicContact OD2-NE 2.81Å; D226-R240 IonicContact OD2-NH2 3.77Å; D226-R240 PolarHBondContact OD2-NH2 3.07Å; F238-R240 HydrophobicContact CB-CG 4.3Å; F238-R240 PolarHBondContact O-N 3.17Å; R240-P242 VanDerWaalsContact O-CD 3.32Å; R240-P242 WeakPolarHBondContact O-CD 3.09Å; R240-W275 HydrophobicContact CB-CH2 4.32Å; R240-W275 HydrophobicContact CB-CZ2 3.51Å; R240-W275 HydrophobicContact CG-CH2 4.16Å; R240-W275 HydrophobicContact CG-CZ2 3.61Å
241	D	92.3	Very high	91.7	Very high	51 Å²	51	52 Å²	52	27%	0.273	24%	0.242	S	C	.	.			trans	-73.4	117	179	-170.2	-59.8	0	0	0	111.6	E243 V244 F245 E271	D241-E243 VanDerWaalsContact C-N 3.29Å; D241-E243 PolarHBondContact O-N 3.2Å; D241-E243 VanDerWaalsContact OD1-CA 3.31Å; D241-E243 WeakPolarHBondContact OD1-CA 3.24Å; D241-E243 WeakPolarHBondContact OD1-CB 3.29Å; D241-E243 PolarHBondContact OD1-N 3.21Å; D241-V244 HydrophobicContact CB-CB 4.21Å; D241-V244 HydrophobicContact CB-CG2 3.89Å; D241-V244 PolarHBondContact O-N 3.49Å; D241-V244 PolarHBondContact OD1-N 2.87Å; D241-V244 VanDerWaalsContact OD1-N 3.07Å; D241-F245 PolarHBondContact O-N 2.67Å; D241-E271 HydrophobicContact CB-CG 4.45Å; D241-E271 PolarHBondContact N-OE2 3.35Å
242	P	93.9	Very high	91.9	Very high	37 Å²	37	47.6 Å²	47.6	24%	0.24	22%	0.219	C	C	.	.	H	α-helix	trans	-70.2	-24.4	-178.7	28.4	-34.6	0	0	0	113.4	V201 T204 F206 R240 R246	V201-P242 HydrophobicContact CB-CB 4.34Å; V201-P242 HydrophobicContact CG1-CB 4.15Å; T204-P242 HydrophobicContact CG2-CB 4.24Å; T204-P242 WeakPolarHBondContact OG1-CB 3.34Å; F206-P242 HydrophobicContact CE2-CB 4.22Å; F206-P242 HydrophobicContact CZ-CB 4.41Å; R240-P242 VanDerWaalsContact O-CD 3.32Å; R240-P242 WeakPolarHBondContact O-CD 3.09Å; P242-R246 PolarHBondContact O-N 3.23Å
243	E	91	Very high	92.2	Very high	100 Å²	100	44 Å²	44	47%	0.467	20%	0.2	S	C	.	.	H	α-helix	trans	-69.5	-44.7	176.5	-170.9	175.5	176.6	0	0	110.1	D241 R246 F247	D241-E243 VanDerWaalsContact C-N 3.29Å; D241-E243 PolarHBondContact O-N 3.2Å; D241-E243 VanDerWaalsContact OD1-CA 3.31Å; D241-E243 WeakPolarHBondContact OD1-CA 3.24Å; D241-E243 WeakPolarHBondContact OD1-CB 3.29Å; D241-E243 PolarHBondContact OD1-N 3.21Å; E243-R246 WeakPolarHBondContact O-CB 3.3Å; E243-R246 PolarHBondContact O-N 3.36Å; E243-F247 WeakPolarHBondContact O-CD2 3.11Å; E243-F247 WeakPolarHBondContact O-CE2 3.26Å
244	V	91.5	Very high	92.3	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.6	-44.5	173.9	-177.9	0	0	0	0	110.9	D241 R246 F247 I248 M263 E271	D241-V244 HydrophobicContact CB-CB 4.21Å; D241-V244 HydrophobicContact CB-CG2 3.89Å; D241-V244 PolarHBondContact O-N 3.49Å; D241-V244 PolarHBondContact OD1-N 2.87Å; D241-V244 VanDerWaalsContact OD1-N 3.07Å; V244-R246 PolarHBondContact O-N 3.12Å; V244-R246 VanDerWaalsContact O-N 3.16Å; V244-F247 WeakPolarHBondContact O-CB 3.36Å; V244-F247 PolarHBondContact O-N 3.38Å; V244-I248 HydrophobicContact CG1-CD1 3.81Å; V244-I248 HydrophobicContact CG1-CG1 4.45Å; V244-I248 PolarHBondContact O-N 2.68Å; V244-M263 HydrophobicContact CB-CE 4.43Å; V244-M263 HydrophobicContact CG2-CE 3.24Å; V244-M263 HydrophobicContact CG2-SD 4.39Å; V244-E271 HydrophobicContact CB-CB 4.42Å; V244-E271 HydrophobicContact CG1-CB 3.88Å; V244-E271 HydrophobicContact CG2-CB 4.23Å; V244-E271 HydrophobicContact CG2-CG 4.11Å
245	F	93.6	Very high	92.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-57.5	-33.2	-178.8	-176.9	-104.4	0	0	0	113	L199 V201 F206 M223 D241 F247 I248 L249 W275	L199-F245 HydrophobicContact CD1-CE1 4.33Å; L199-F245 HydrophobicContact CD1-CZ 3.7Å; V201-F245 HydrophobicContact CG1-CB 4.16Å; V201-F245 HydrophobicContact CG2-CB 4.34Å; V201-F245 HydrophobicContact CG2-CD1 3.7Å; V201-F245 HydrophobicContact CG2-CD2 4.32Å; V201-F245 HydrophobicContact CG2-CE1 4.03Å; V201-F245 HydrophobicContact CG2-CG 3.84Å; V201-F245 HydrophobicContact CG2-CZ 4.48Å; F206-F245 HydrophobicContact CB-CE1 3.92Å; F206-F245 HydrophobicContact CD1-CD1 4.01Å; F206-F245 HydrophobicContact CD1-CE1 4.05Å; F206-F245 AromaticContact CD2-CD1 3.55Å; F206-F245 HydrophobicContact CD2-CD1 3.55Å; F206-F245 AromaticContact CD2-CE1 3.72Å; F206-F245 HydrophobicContact CD2-CE1 3.72Å; F206-F245 HydrophobicContact CE1-CD1 4.03Å; F206-F245 AromaticContact CE2-CD1 3.57Å; F206-F245 HydrophobicContact CE2-CD1 3.57Å; F206-F245 HydrophobicContact CE2-CE1 4.23Å; F206-F245 AromaticContact CG-CD1 3.78Å; F206-F245 HydrophobicContact CG-CD1 3.78Å; F206-F245 AromaticContact CG-CE1 3.62Å; F206-F245 HydrophobicContact CG-CE1 3.62Å; F206-F245 AromaticContact CZ-CD1 3.82Å; F206-F245 HydrophobicContact CZ-CD1 3.82Å; M223-F245 HydrophobicContact CE-CE2 3.93Å; M223-F245 HydrophobicContact CE-CZ 4.2Å; D241-F245 PolarHBondContact O-N 2.67Å; F245-F247 PolarHBondContact O-N 2.75Å; F245-F247 VanDerWaalsContact O-N 3.17Å; F245-I248 HydrophobicContact CD2-CB 4.4Å; F245-I248 HydrophobicContact CD2-CG2 4.49Å; F245-I248 PolarHBondContact O-N 2.91Å; F245-I248 VanDerWaalsContact O-N 3.15Å; F245-L249 HydrophobicContact CE1-CB 4.33Å; F245-L249 HydrophobicContact CE1-CD2 4.41Å; F245-L249 WeakPolarHBondContact O-CB 3.19Å; F245-L249 PolarHBondContact O-N 3.08Å; F245-W275 HydrophobicContact CB-CZ2 4.15Å; F245-W275 HydrophobicContact CD2-CD2 4.48Å; F245-W275 HydrophobicContact CD2-CE3 4.4Å; F245-W275 AromaticContact CD2-CH2 3.35Å; F245-W275 HydrophobicContact CD2-CH2 3.35Å; F245-W275 AromaticContact CD2-CZ2 3.41Å; F245-W275 HydrophobicContact CD2-CZ2 3.41Å; F245-W275 VanDerWaalsContact CD2-CZ2 3.41Å; F245-W275 AromaticContact CD2-CZ3 3.88Å; F245-W275 HydrophobicContact CD2-CZ3 3.88Å; F245-W275 HydrophobicContact CE2-CE3 4.49Å; F245-W275 AromaticContact CE2-CH2 3.67Å; F245-W275 HydrophobicContact CE2-CH2 3.67Å; F245-W275 HydrophobicContact CE2-CZ2 4.2Å; F245-W275 AromaticContact CE2-CZ3 3.84Å; F245-W275 HydrophobicContact CE2-CZ3 3.84Å; F245-W275 HydrophobicContact CG-CH2 4.27Å; F245-W275 HydrophobicContact CG-CZ2 4.12Å
246	R	93.1	Very high	92.3	Very high	77 Å²	77	51.7 Å²	51.7	29%	0.291	23%	0.234	S	C	.	.	H	α-helix	trans	-54	-37.2	173.9	-167.3	-171.3	75.9	108.6	1	112.4	P242 E243 V244 N250	P242-R246 PolarHBondContact O-N 3.23Å; E243-R246 WeakPolarHBondContact O-CB 3.3Å; E243-R246 PolarHBondContact O-N 3.36Å; V244-R246 PolarHBondContact O-N 3.12Å; V244-R246 VanDerWaalsContact O-N 3.16Å; R246-N250 VanDerWaalsContact O-CG 3.3Å; R246-N250 PolarHBondContact O-N 3.47Å; R246-N250 VanDerWaalsContact O-N 3.16Å; R246-N250 PolarHBondContact O-ND2 2.72Å
247	F	91.9	Very high	92.2	Very high	12 Å²	12	51.3 Å²	51.3	5%	0.053	23%	0.232	C	C	.	.	H	α-helix	trans	-80.9	-35.2	-179.8	-64.6	-86.6	0	0	0	112.6	E243 V244 F245 L249 N250 Y251 H258 P260	E243-F247 WeakPolarHBondContact O-CD2 3.11Å; E243-F247 WeakPolarHBondContact O-CE2 3.26Å; V244-F247 WeakPolarHBondContact O-CB 3.36Å; V244-F247 PolarHBondContact O-N 3.38Å; F245-F247 PolarHBondContact O-N 2.75Å; F245-F247 VanDerWaalsContact O-N 3.17Å; F247-L249 VanDerWaalsContact C-N 3.29Å; F247-L249 PolarHBondContact O-N 2.84Å; F247-N250 CarbonylContact O-C 3.45Å; F247-N250 WeakPolarHBondContact O-CB 3.45Å; F247-N250 PolarHBondContact O-N 2.89Å; F247-N250 VanDerWaalsContact O-N 3.15Å; F247-Y251 PolarHBondContact O-N 3.45Å; F247-H258 VanDerWaalsContact CB-O 3.28Å; F247-H258 WeakPolarHBondContact CB-O 3.34Å; F247-H258 WeakPolarHBondContact CD1-O 3.49Å; F247-H258 WeakPolarHBondContact CG-O 3.24Å; F247-P260 HydrophobicContact CD2-CB 4.35Å; F247-P260 HydrophobicContact CD2-CG 3.92Å; F247-P260 HydrophobicContact CE1-CB 4.27Å; F247-P260 HydrophobicContact CE2-CB 3.42Å; F247-P260 VanDerWaalsContact CE2-CB 3.42Å; F247-P260 HydrophobicContact CE2-CG 3.44Å; F247-P260 VanDerWaalsContact CE2-CG 3.44Å; F247-P260 HydrophobicContact CZ-CB 3.33Å; F247-P260 HydrophobicContact CZ-CG 3.81Å
248	I	92.8	Very high	92	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.2	-41.2	171.8	-65.8	159	0	0	0	110.2	V219 V244 F245 N250 Y251 L252 L272 W275 I277	V219-I248 HydrophobicContact CG1-CG2 4.43Å; V244-I248 HydrophobicContact CG1-CD1 3.81Å; V244-I248 HydrophobicContact CG1-CG1 4.45Å; V244-I248 PolarHBondContact O-N 2.68Å; F245-I248 HydrophobicContact CD2-CB 4.4Å; F245-I248 HydrophobicContact CD2-CG2 4.49Å; F245-I248 PolarHBondContact O-N 2.91Å; F245-I248 VanDerWaalsContact O-N 3.15Å; I248-N250 VanDerWaalsContact C-N 3.3Å; I248-N250 PolarHBondContact O-N 2.83Å; I248-Y251 WeakPolarHBondContact O-CB 3.4Å; I248-Y251 PolarHBondContact O-N 2.78Å; I248-Y251 VanDerWaalsContact O-N 3.16Å; I248-L252 HydrophobicContact CG2-CD1 4.39Å; I248-L252 WeakPolarHBondContact O-CG 3.31Å; I248-L252 PolarHBondContact O-N 3.5Å; I248-L272 HydrophobicContact CG1-CD2 4.25Å; I248-W275 HydrophobicContact CD1-CB 3.95Å; I248-W275 HydrophobicContact CD1-CD2 3.81Å; I248-W275 HydrophobicContact CD1-CG 3.32Å; I248-W275 VanDerWaalsContact CD1-NE1 3.29Å; I248-W275 HydrophobicContact CG1-CG 4.48Å; I248-I277 HydrophobicContact CG1-CD1 4.24Å; I248-I277 HydrophobicContact CG2-CD1 4.19Å
249	L	93.4	Very high	91.6	Very high	6 Å²	6	51.4 Å²	51.4	3%	0.031	24%	0.235	C	C	.	.	H	α-helix	trans	-63.1	-38.1	173.7	-179.4	56.9	0	0	0	111.8	F206 V208 T212 F245 F247 L252 R253	F206-L249 HydrophobicContact CD1-CD2 3.92Å; V208-L249 HydrophobicContact CB-CD1 4.22Å; V208-L249 HydrophobicContact CG1-CD1 3.52Å; V208-L249 HydrophobicContact CG2-CD1 3.57Å; V208-L249 HydrophobicContact CG2-CD2 3.85Å; V208-L249 HydrophobicContact CG2-CG 4.38Å; T212-L249 HydrophobicContact CG2-CD1 4.49Å; F245-L249 HydrophobicContact CE1-CB 4.33Å; F245-L249 HydrophobicContact CE1-CD2 4.41Å; F245-L249 WeakPolarHBondContact O-CB 3.19Å; F245-L249 PolarHBondContact O-N 3.08Å; F247-L249 VanDerWaalsContact C-N 3.29Å; F247-L249 PolarHBondContact O-N 2.84Å; L249-L252 PolarHBondContact O-N 3.31Å; L249-R253 WeakPolarHBondContact O-CB 3.33Å; L249-R253 WeakPolarHBondContact O-CD 3.43Å; L249-R253 WeakPolarHBondContact O-CG 3.41Å; L249-R253 PolarHBondContact O-N 3.31Å
250	N	91.9	Very high	90.8	Very high	36 Å²	36	45.3 Å²	45.3	19%	0.193	21%	0.208	C	C	.	.	H	α-helix	trans	-67	-37.4	173.3	-73.5	-28.4	0	0	0	112.2	R246 F247 I248 R253 R254	R246-N250 VanDerWaalsContact O-CG 3.3Å; R246-N250 PolarHBondContact O-N 3.47Å; R246-N250 VanDerWaalsContact O-N 3.16Å; R246-N250 PolarHBondContact O-ND2 2.72Å; F247-N250 CarbonylContact O-C 3.45Å; F247-N250 WeakPolarHBondContact O-CB 3.45Å; F247-N250 PolarHBondContact O-N 2.89Å; F247-N250 VanDerWaalsContact O-N 3.15Å; I248-N250 VanDerWaalsContact C-N 3.3Å; I248-N250 PolarHBondContact O-N 2.83Å; N250-R253 PolarHBondContact O-N 3.03Å; N250-R254 WeakPolarHBondContact O-CB 3.11Å; N250-R254 PolarHBondContact O-N 3.41Å
251	Y	92.9	Very high	90	Very high	18 Å²	18	47.9 Å²	47.9	7%	0.071	22%	0.223	C	C	.	.	H	α-helix	trans	-59.6	-50.6	171.6	164.4	-105.6	0	0	0	111	D216 V219 F247 I248 R253 R254 G255 L257 I277 D282	D216-Y251 HydrophobicContact CB-CE1 4.27Å; D216-Y251 WeakPolarHBondContact OD2-CE1 3.45Å; D216-Y251 PolarHBondContact OD2-OH 2.93Å; V219-Y251 HydrophobicContact CG2-CE1 4.23Å; F247-Y251 PolarHBondContact O-N 3.45Å; I248-Y251 WeakPolarHBondContact O-CB 3.4Å; I248-Y251 PolarHBondContact O-N 2.78Å; I248-Y251 VanDerWaalsContact O-N 3.16Å; Y251-R253 PolarHBondContact O-N 3.14Å; Y251-R253 VanDerWaalsContact O-N 3.15Å; Y251-R254 PolarHBondContact O-N 2.82Å; Y251-G255 VanDerWaalsContact O-CA 3.3Å; Y251-G255 WeakPolarHBondContact O-CA 3.37Å; Y251-G255 PolarHBondContact O-N 2.85Å; Y251-L257 HydrophobicContact CD2-CB 3.78Å; Y251-L257 HydrophobicContact CG-CB 4.17Å; Y251-L257 HydrophobicContact CG-CD1 4.46Å; Y251-I277 HydrophobicContact CD1-CD1 3.78Å; Y251-I277 HydrophobicContact CE1-CD1 3.93Å; Y251-I277 HydrophobicContact CE1-CG1 4.41Å; Y251-D282 HydrophobicContact CE2-CB 4.05Å
252	L	92	Very high	89.5	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	25%	0.25	C	S	.	.	H	α-helix	trans	-62.2	-24	176	-66.7	174.1	0	0	0	113.4	T212 L213 H215 D216 V219 M223 I248 L249	T212-L252 HydrophobicContact CG2-CB 4.13Å; L213-L252 HydrophobicContact CD2-CD1 4Å; H215-L252 WeakPolarHBondContact CB-O 3.39Å; D216-L252 HydrophobicContact CB-CD2 3.76Å; V219-L252 HydrophobicContact CB-CD2 4.31Å; V219-L252 HydrophobicContact CG1-CD1 4.36Å; V219-L252 HydrophobicContact CG1-CD2 4.2Å; M223-L252 HydrophobicContact SD-CD1 4.41Å; I248-L252 HydrophobicContact CG2-CD1 4.39Å; I248-L252 WeakPolarHBondContact O-CG 3.31Å; I248-L252 PolarHBondContact O-N 3.5Å; L249-L252 PolarHBondContact O-N 3.31Å
253	R	92.9	Very high	89	Confident	130 Å²	130	49.6 Å²	49.6	49%	0.491	25%	0.248	S	C	.	.	H	α-helix	trans	-84.7	-37.8	177.5	-75.3	170.3	-179.8	-176.5	-1.9	113.7	T212 L249 N250 Y251	T212-R253 HydrophobicContact CG2-CB 4.45Å; T212-R253 HydrophobicContact CG2-CG 3.58Å; L249-R253 WeakPolarHBondContact O-CB 3.33Å; L249-R253 WeakPolarHBondContact O-CD 3.43Å; L249-R253 WeakPolarHBondContact O-CG 3.41Å; L249-R253 PolarHBondContact O-N 3.31Å; N250-R253 PolarHBondContact O-N 3.03Å; Y251-R253 PolarHBondContact O-N 3.14Å; Y251-R253 VanDerWaalsContact O-N 3.15Å
254	R	89.7	Confident	88.7	Confident	199 Å²	199	47.6 Å²	47.6	75%	0.751	25%	0.245	S	C	*	.	H	α-helix	trans	-114.8	-14.9	-168.7	-63.1	-173.8	179.5	-83.1	0.3	113.9	N250 Y251 E256	N250-R254 WeakPolarHBondContact O-CB 3.11Å; N250-R254 PolarHBondContact O-N 3.41Å; Y251-R254 PolarHBondContact O-N 2.82Å; R254-E256 PolarHBondContact O-N 3.35Å
255	G	87.9	Confident	88.5	Confident	36 Å²	36	47.6 Å²	47.6	37%	0.371	25%	0.245	S	C	.	.	S	Bend	trans	76.6	3.8	-171.9	0	0	0	0	0	114.4	Y251	Y251-G255 VanDerWaalsContact O-CA 3.3Å; Y251-G255 WeakPolarHBondContact O-CA 3.37Å; Y251-G255 PolarHBondContact O-N 2.85Å
256	E	89.1	Confident	88.2	Confident	96 Å²	96	49.3 Å²	49.3	45%	0.449	26%	0.256	S	S	.	.			trans	-124.1	123.4	-177.2	-62.7	-176	165.3	0	0	110.9	R254 H258 Q284	R254-E256 PolarHBondContact O-N 3.35Å; E256-H258 IonicContact OE2-NE2 2.92Å; E256-Q284 HydrophobicContact CB-CG 3.99Å
257	L	90.3	Very high	88	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-91.9	111.9	179.7	-178.6	62.4	0	0	0	111.1	Y251 L259 L272 I277 D282 I283 Q284	Y251-L257 HydrophobicContact CD2-CB 3.78Å; Y251-L257 HydrophobicContact CG-CB 4.17Å; Y251-L257 HydrophobicContact CG-CD1 4.46Å; L257-L259 HydrophobicContact CD1-CD2 4.26Å; L257-L259 HydrophobicContact CG-CD2 4.41Å; L257-L272 HydrophobicContact CD1-CD2 4.34Å; L257-L272 HydrophobicContact CD2-CD1 4.08Å; L257-L272 HydrophobicContact CD2-CD2 3.67Å; L257-I277 HydrophobicContact CD2-CG2 3.91Å; L257-D282 WeakPolarHBondContact CB-O 3.48Å; L257-I283 HydrophobicContact CD2-CG1 3.66Å; L257-I283 HydrophobicContact CG-CG1 4.27Å; L257-Q284 PolarHBondContact O-N 3.46Å
258	H	89.6	Confident	87.8	Confident	62 Å²	62	49.6 Å²	49.6	29%	0.287	26%	0.263	S	S	.	.			trans	-107.8	148.6	167.3	-68.4	-82.5	0	0	0	109.8	F247 E256 C286	F247-H258 VanDerWaalsContact CB-O 3.28Å; F247-H258 WeakPolarHBondContact CB-O 3.34Å; F247-H258 WeakPolarHBondContact CD1-O 3.49Å; F247-H258 WeakPolarHBondContact CG-O 3.24Å; E256-H258 IonicContact OE2-NE2 2.92Å; H258-C286 PolarHBondContact CE1-SG 3.12Å; H258-C286 PolarHBondContact ND1-SG 3.11Å
259	L	86.1	Confident	87.6	Confident	8 Å²	8	51.8 Å²	51.8	4%	0.042	27%	0.273	C	S	.	.			trans	-116	154.4	-176.5	-66.7	172.1	0	0	0	111.8	L257 V268 L272 I283 C287 V291	L257-L259 HydrophobicContact CD1-CD2 4.26Å; L257-L259 HydrophobicContact CG-CD2 4.41Å; L259-V268 HydrophobicContact CD1-CG1 3.56Å; L259-V268 HydrophobicContact CD2-CG1 3.63Å; L259-V268 HydrophobicContact CG-CG1 4.16Å; L259-L272 HydrophobicContact CD1-CD1 4.43Å; L259-L272 HydrophobicContact CD2-CD1 4.27Å; L259-I283 HydrophobicContact CD1-CD1 3.72Å; L259-I283 HydrophobicContact CD1-CG1 4.28Å; L259-I283 HydrophobicContact CD1-CG2 4.13Å; L259-C287 HydrophobicContact CB-CB 4.12Å; L259-C287 HydrophobicContact CG-CB 4.5Å; L259-C287 PolarHBondContact N-SG 3.49Å; L259-V291 HydrophobicContact CD1-CG2 3.72Å
260	P	78	Confident	87.5	Confident	18 Å²	18	57.9 Å²	57.9	12%	0.117	30%	0.299	C	S	.	.			trans	-64	147.9	176.8	20	-25.1	0	0	0	111.6	F247 M263	F247-P260 HydrophobicContact CD2-CB 4.35Å; F247-P260 HydrophobicContact CD2-CG 3.92Å; F247-P260 HydrophobicContact CE1-CB 4.27Å; F247-P260 HydrophobicContact CE2-CB 3.42Å; F247-P260 VanDerWaalsContact CE2-CB 3.42Å; F247-P260 HydrophobicContact CE2-CG 3.44Å; F247-P260 VanDerWaalsContact CE2-CG 3.44Å; F247-P260 HydrophobicContact CZ-CB 3.33Å; F247-P260 HydrophobicContact CZ-CG 3.81Å; P260-M263 HydrophobicContact CB-CG 4.16Å; P260-M263 HydrophobicContact CG-CB 4.32Å; P260-M263 HydrophobicContact CG-CE 3.27Å; P260-M263 HydrophobicContact CG-CG 3.73Å; P260-M263 HydrophobicContact CG-SD 3.94Å
261	H	76.4	Confident	87.5	Confident	118 Å²	118	57.5 Å²	57.5	55%	0.546	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.2	133	172.3	-59.1	84.2	0	0	0	109.7
262	G	80.6	Confident	87.5	Confident	82 Å²	82	56.6 Å²	56.6	85%	0.845	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	91	4.9	171.6	0	0	0	0	0	116.2
263	M	83.5	Confident	87.5	Confident	41 Å²	41	60.5 Å²	60.5	20%	0.202	31%	0.314	C	S	.	.			trans	-84.7	150	170	-65	-140.2	-54.4	0	0	112	V244 P260 G265 V268	V244-M263 HydrophobicContact CB-CE 4.43Å; V244-M263 HydrophobicContact CG2-CE 3.24Å; V244-M263 HydrophobicContact CG2-SD 4.39Å; P260-M263 HydrophobicContact CB-CG 4.16Å; P260-M263 HydrophobicContact CG-CB 4.32Å; P260-M263 HydrophobicContact CG-CE 3.27Å; P260-M263 HydrophobicContact CG-CG 3.73Å; P260-M263 HydrophobicContact CG-SD 3.94Å; M263-G265 PolarHBondContact O-N 3.41Å; M263-V268 HydrophobicContact CB-CG2 3.8Å; M263-V268 HydrophobicContact CE-CG2 3.68Å
264	C	85.6	Confident	87.4	Confident	58 Å²	58	56.5 Å²	56.5	39%	0.392	30%	0.302	S	S	.	.			trans	-72.4	125.5	178.7	-170	0	0	0	0	109.7	I267 V268	C264-I267 HydrophobicContact CB-CB 4.33Å; C264-I267 HydrophobicContact CB-CD1 3.8Å; C264-I267 HydrophobicContact CB-CG1 3.96Å; C264-I267 WeakPolarHBondContact O-CB 3.49Å; C264-I267 PolarHBondContact O-N 3.41Å; C264-V268 PolarHBondContact O-N 3.4Å; C264-V268 VanDerWaalsContact O-N 3.11Å
265	G	86.9	Confident	87.5	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-53.2	-45	-176.9	0	0	0	0	0	114.8	M263 I267 V268 E269 S294	M263-G265 PolarHBondContact O-N 3.41Å; G265-I267 VanDerWaalsContact C-N 3.3Å; G265-I267 PolarHBondContact O-N 3.38Å; G265-V268 CarbonylContact O-C 3.58Å; G265-V268 WeakPolarHBondContact O-CB 3.46Å; G265-V268 PolarHBondContact O-N 3.28Å; G265-V268 VanDerWaalsContact O-N 3.13Å; G265-E269 WeakPolarHBondContact O-CB 3.46Å; G265-E269 PolarHBondContact O-N 2.96Å; G265-S294 WeakPolarHBondContact CA-OG 3.12Å; G265-S294 PolarHBondContact N-OG 3.13Å
266	P	87.1	Confident	87.6	Confident	37 Å²	37	47.3 Å²	47.3	24%	0.24	27%	0.268	C	S	.	.	H	α-helix	trans	-59.8	-31.8	173.9	-29.4	34.4	0	0	0	115.6	K270 L298	P266-K270 WeakPolarHBondContact O-CB 3.32Å; P266-K270 PolarHBondContact O-N 2.98Å; P266-K270 VanDerWaalsContact O-N 3.13Å; P266-L298 HydrophobicContact CB-CD2 4.42Å; P266-L298 HydrophobicContact CG-CD2 3.68Å
267	I	88.5	Confident	87.6	Confident	92 Å²	92	42.9 Å²	42.9	47%	0.472	25%	0.247	S	C	.	.	H	α-helix	trans	-70.4	-44.2	174.8	-63.3	176.9	0	0	0	108.8	C264 G265 K270 E271	C264-I267 HydrophobicContact CB-CB 4.33Å; C264-I267 HydrophobicContact CB-CD1 3.8Å; C264-I267 HydrophobicContact CB-CG1 3.96Å; C264-I267 WeakPolarHBondContact O-CB 3.49Å; C264-I267 PolarHBondContact O-N 3.41Å; G265-I267 VanDerWaalsContact C-N 3.3Å; G265-I267 PolarHBondContact O-N 3.38Å; I267-K270 PolarHBondContact O-N 2.97Å; I267-E271 WeakPolarHBondContact O-CG 3.34Å; I267-E271 PolarHBondContact O-N 3.29Å
268	V	89.5	Confident	87.3	Confident	2 Å²	2	45.1 Å²	45.1	1%	0.012	27%	0.266	C	S	.	.	H	α-helix	trans	-63.6	-42.5	178.1	177.2	0	0	0	0	111.6	L259 M263 C264 G265 E271 L272	L259-V268 HydrophobicContact CD1-CG1 3.56Å; L259-V268 HydrophobicContact CD2-CG1 3.63Å; L259-V268 HydrophobicContact CG-CG1 4.16Å; M263-V268 HydrophobicContact CB-CG2 3.8Å; M263-V268 HydrophobicContact CE-CG2 3.68Å; C264-V268 PolarHBondContact O-N 3.4Å; C264-V268 VanDerWaalsContact O-N 3.11Å; G265-V268 CarbonylContact O-C 3.58Å; G265-V268 WeakPolarHBondContact O-CB 3.46Å; G265-V268 PolarHBondContact O-N 3.28Å; G265-V268 VanDerWaalsContact O-N 3.13Å; V268-E271 PolarHBondContact O-N 3.25Å; V268-L272 HydrophobicContact CG1-CD1 3.72Å; V268-L272 HydrophobicContact CG1-CG 4.13Å; V268-L272 WeakPolarHBondContact O-CB 3.46Å; V268-L272 VanDerWaalsContact O-CG 3.23Å; V268-L272 WeakPolarHBondContact O-CG 3.43Å; V268-L272 PolarHBondContact O-N 3.32Å
269	E	88.2	Confident	86.7	Confident	47 Å²	47	42.9 Å²	42.9	22%	0.22	26%	0.256	C	S	.	.	H	α-helix	trans	-57.6	-50.1	174.8	178.9	173.7	-158.5	0	0	111	G265 E271 L272 D273 L279 K295	G265-E269 WeakPolarHBondContact O-CB 3.46Å; G265-E269 PolarHBondContact O-N 2.96Å; E269-E271 PolarHBondContact O-N 2.86Å; E269-L272 PolarHBondContact O-N 3Å; E269-D273 WeakPolarHBondContact O-CB 3.36Å; E269-D273 VanDerWaalsContact O-CG 3.25Å; E269-D273 PolarHBondContact O-N 3.02Å; E269-L279 HydrophobicContact CB-CD1 4.18Å; E269-L279 HydrophobicContact CB-CD2 4.34Å; E269-L279 HydrophobicContact CG-CD2 4.31Å; E269-K295 IonicContact OE1-NZ 3.95Å; E269-K295 PolarHBondContact OE1-NZ 2.92Å; E269-K295 VanDerWaalsContact OE2-CD 3.32Å; E269-K295 WeakPolarHBondContact OE2-CD 3.38Å; E269-K295 WeakPolarHBondContact OE2-CE 3.28Å; E269-K295 IonicContact OE2-NZ 3.72Å; E269-K295 PolarHBondContact OE2-NZ 3.1Å
270	K	91	Very high	86	Confident	133 Å²	133	45.8 Å²	45.8	58%	0.578	29%	0.288	S	S	*	.	H	α-helix	trans	-60.5	-45.7	179.1	-171.9	-173.8	174.4	-164.6	0	112.2	P266 I267 D273 D274	P266-K270 WeakPolarHBondContact O-CB 3.32Å; P266-K270 PolarHBondContact O-N 2.98Å; P266-K270 VanDerWaalsContact O-N 3.13Å; I267-K270 PolarHBondContact O-N 2.97Å; K270-D273 PolarHBondContact O-N 2.94Å; K270-D274 WeakPolarHBondContact O-CB 3.29Å; K270-D274 VanDerWaalsContact O-CG 3.31Å; K270-D274 PolarHBondContact O-N 3.26Å
271	E	92.5	Very high	85.9	Confident	28 Å²	28	51.9 Å²	51.9	13%	0.131	32%	0.319	C	S	.	.	H	α-helix	trans	-64	-47	178.7	-73.1	-74.2	141.4	0	0	110.7	D241 V244 I267 V268 E269 D273 D274 W275	D241-E271 HydrophobicContact CB-CG 4.45Å; D241-E271 PolarHBondContact N-OE2 3.35Å; V244-E271 HydrophobicContact CB-CB 4.42Å; V244-E271 HydrophobicContact CG1-CB 3.88Å; V244-E271 HydrophobicContact CG2-CB 4.23Å; V244-E271 HydrophobicContact CG2-CG 4.11Å; I267-E271 WeakPolarHBondContact O-CG 3.34Å; I267-E271 PolarHBondContact O-N 3.29Å; V268-E271 PolarHBondContact O-N 3.25Å; E269-E271 PolarHBondContact O-N 2.86Å; E271-D273 VanDerWaalsContact C-N 3.33Å; E271-D273 PolarHBondContact O-N 3.41Å; E271-D274 WeakPolarHBondContact O-CB 3.34Å; E271-D274 PolarHBondContact O-N 3.02Å; E271-D274 VanDerWaalsContact O-N 3.12Å; E271-W275 PolarHBondContact O-N 3.2Å
272	L	92	Very high	86.1	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-58.9	-43.5	177.7	-72	173.6	0	0	0	112.2	I248 L257 L259 V268 E269 D274 W275 G276 I277 L279 I283	I248-L272 HydrophobicContact CG1-CD2 4.25Å; L257-L272 HydrophobicContact CD1-CD2 4.34Å; L257-L272 HydrophobicContact CD2-CD1 4.08Å; L257-L272 HydrophobicContact CD2-CD2 3.67Å; L259-L272 HydrophobicContact CD1-CD1 4.43Å; L259-L272 HydrophobicContact CD2-CD1 4.27Å; V268-L272 HydrophobicContact CG1-CD1 3.72Å; V268-L272 HydrophobicContact CG1-CG 4.13Å; V268-L272 WeakPolarHBondContact O-CB 3.46Å; V268-L272 VanDerWaalsContact O-CG 3.23Å; V268-L272 WeakPolarHBondContact O-CG 3.43Å; V268-L272 PolarHBondContact O-N 3.32Å; E269-L272 PolarHBondContact O-N 3Å; L272-D274 VanDerWaalsContact C-N 3.32Å; L272-D274 PolarHBondContact O-N 2.87Å; L272-W275 CarbonylContact O-C 3.52Å; L272-W275 PolarHBondContact O-N 3.01Å; L272-W275 VanDerWaalsContact O-N 3.14Å; L272-G276 PolarHBondContact O-N 3.49Å; L272-G276 VanDerWaalsContact O-N 3.07Å; L272-I277 CarbonylContact C-O 3.5Å; L272-I277 HydrophobicContact CB-CB 4.3Å; L272-I277 WeakPolarHBondContact CB-O 3.45Å; L272-I277 HydrophobicContact CD2-CB 4.21Å; L272-I277 HydrophobicContact CD2-CD1 4.15Å; L272-I277 HydrophobicContact CD2-CG2 4.35Å; L272-I277 PolarHBondContact O-N 3.19Å; L272-L279 HydrophobicContact CD1-CD1 3.82Å; L272-I283 HydrophobicContact CD1-CD1 3.84Å; L272-I283 HydrophobicContact CD1-CG1 4.39Å
273	D	91.5	Very high	86.4	Confident	84 Å²	84	45.6 Å²	45.6	45%	0.449	27%	0.27	S	S	.	.	H	α-helix	trans	-60.4	-41.9	175.2	-72.3	-18.9	0	0	0	111.4	E269 K270 E271 W275 G276	E269-D273 WeakPolarHBondContact O-CB 3.36Å; E269-D273 VanDerWaalsContact O-CG 3.25Å; E269-D273 PolarHBondContact O-N 3.02Å; K270-D273 PolarHBondContact O-N 2.94Å; E271-D273 VanDerWaalsContact C-N 3.33Å; E271-D273 PolarHBondContact O-N 3.41Å; D273-W275 VanDerWaalsContact C-N 3.26Å; D273-W275 PolarHBondContact O-N 3.35Å; D273-G276 PolarHBondContact O-N 3.45Å
274	D	91.9	Very high	86.7	Confident	45 Å²	45	46.6 Å²	46.6	24%	0.241	27%	0.274	C	S	.	.	H	α-helix	trans	-64.6	-30.2	176.9	-75.3	-24.1	0	0	0	112.1	K222 K270 E271 L272 G276	K222-D274 WeakPolarHBondContact CE-O 3.42Å; K222-D274 WeakPolarHBondContact CG-O 3.33Å; K270-D274 WeakPolarHBondContact O-CB 3.29Å; K270-D274 VanDerWaalsContact O-CG 3.31Å; K270-D274 PolarHBondContact O-N 3.26Å; E271-D274 WeakPolarHBondContact O-CB 3.34Å; E271-D274 PolarHBondContact O-N 3.02Å; E271-D274 VanDerWaalsContact O-N 3.12Å; L272-D274 VanDerWaalsContact C-N 3.32Å; L272-D274 PolarHBondContact O-N 2.87Å; D274-G276 VanDerWaalsContact C-N 3.31Å
275	W	91.8	Very high	86.7	Confident	5 Å²	5	54.8 Å²	54.8	2%	0.019	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-1.6	171.8	-67	105.6	0	0	0	113.8	M223 F238 R240 F245 I248 E271 L272 D273	M223-W275 HydrophobicContact CE-CZ3 3.98Å; M223-W275 HydrophobicContact CG-CE3 3.81Å; M223-W275 HydrophobicContact CG-CZ3 3.77Å; M223-W275 HydrophobicContact SD-CE3 4.45Å; M223-W275 HydrophobicContact SD-CZ3 4.26Å; F238-W275 HydrophobicContact CB-CH2 4.25Å; F238-W275 AromaticContact CD1-CH2 4Å; F238-W275 HydrophobicContact CD1-CH2 4Å; F238-W275 HydrophobicContact CD1-CZ3 4.05Å; F238-W275 HydrophobicContact CE1-CZ3 4.21Å; F238-W275 HydrophobicContact CG-CH2 4.04Å; F238-W275 HydrophobicContact CG-CZ3 4.49Å; R240-W275 HydrophobicContact CB-CH2 4.32Å; R240-W275 HydrophobicContact CB-CZ2 3.51Å; R240-W275 HydrophobicContact CG-CH2 4.16Å; R240-W275 HydrophobicContact CG-CZ2 3.61Å; F245-W275 HydrophobicContact CB-CZ2 4.15Å; F245-W275 HydrophobicContact CD2-CD2 4.48Å; F245-W275 HydrophobicContact CD2-CE3 4.4Å; F245-W275 AromaticContact CD2-CH2 3.35Å; F245-W275 HydrophobicContact CD2-CH2 3.35Å; F245-W275 AromaticContact CD2-CZ2 3.41Å; F245-W275 HydrophobicContact CD2-CZ2 3.41Å; F245-W275 VanDerWaalsContact CD2-CZ2 3.41Å; F245-W275 AromaticContact CD2-CZ3 3.88Å; F245-W275 HydrophobicContact CD2-CZ3 3.88Å; F245-W275 HydrophobicContact CE2-CE3 4.49Å; F245-W275 AromaticContact CE2-CH2 3.67Å; F245-W275 HydrophobicContact CE2-CH2 3.67Å; F245-W275 HydrophobicContact CE2-CZ2 4.2Å; F245-W275 AromaticContact CE2-CZ3 3.84Å; F245-W275 HydrophobicContact CE2-CZ3 3.84Å; F245-W275 HydrophobicContact CG-CH2 4.27Å; F245-W275 HydrophobicContact CG-CZ2 4.12Å; I248-W275 HydrophobicContact CD1-CB 3.95Å; I248-W275 HydrophobicContact CD1-CD2 3.81Å; I248-W275 HydrophobicContact CD1-CG 3.32Å; I248-W275 VanDerWaalsContact CD1-NE1 3.29Å; I248-W275 HydrophobicContact CG1-CG 4.48Å; E271-W275 PolarHBondContact O-N 3.2Å; L272-W275 CarbonylContact O-C 3.52Å; L272-W275 PolarHBondContact O-N 3.01Å; L272-W275 VanDerWaalsContact O-N 3.14Å; D273-W275 VanDerWaalsContact C-N 3.26Å; D273-W275 PolarHBondContact O-N 3.35Å
276	G	89.3	Confident	86.6	Confident	38 Å²	38	58 Å²	58	39%	0.392	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	18.8	179.5	0	0	0	0	0	114.7	L272 D273 D274	L272-G276 PolarHBondContact O-N 3.49Å; L272-G276 VanDerWaalsContact O-N 3.07Å; D273-G276 PolarHBondContact O-N 3.45Å; D274-G276 VanDerWaalsContact C-N 3.31Å
277	I	90.1	Very high	86.6	Confident	2 Å²	2	56.8 Å²	56.8	1%	0.01	31%	0.311	C	S	.	.			trans	-106.3	118.8	178.5	-55.6	174.5	0	0	0	109.5	V219 I248 Y251 L257 L272 D282	V219-I277 HydrophobicContact CG2-CD1 3.99Å; V219-I277 HydrophobicContact CG2-CG1 3.46Å; V219-I277 VanDerWaalsContact CG2-CG1 3.46Å; I248-I277 HydrophobicContact CG1-CD1 4.24Å; I248-I277 HydrophobicContact CG2-CD1 4.19Å; Y251-I277 HydrophobicContact CD1-CD1 3.78Å; Y251-I277 HydrophobicContact CE1-CD1 3.93Å; Y251-I277 HydrophobicContact CE1-CG1 4.41Å; L257-I277 HydrophobicContact CD2-CG2 3.91Å; L272-I277 CarbonylContact C-O 3.5Å; L272-I277 HydrophobicContact CB-CB 4.3Å; L272-I277 WeakPolarHBondContact CB-O 3.45Å; L272-I277 HydrophobicContact CD2-CB 4.21Å; L272-I277 HydrophobicContact CD2-CD1 4.15Å; L272-I277 HydrophobicContact CD2-CG2 4.35Å; L272-I277 PolarHBondContact O-N 3.19Å; I277-D282 HydrophobicContact CG2-CB 4.03Å
278	A	83.8	Confident	86.6	Confident	48 Å²	48	54.9 Å²	54.9	40%	0.397	30%	0.301	S	S	.	.			trans	-79.3	127.2	177.2	0	0	0	0	0	111.2	G280 L281	A278-G280 PolarHBondContact O-N 3.36Å; A278-L281 HydrophobicContact CB-CD1 4.36Å; A278-L281 PolarHBondContact O-N 2.97Å
279	L	76.2	Confident	86.4	Confident	14 Å²	14	56.8 Å²	56.8	7%	0.073	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.7	-30.6	-177.6	-165	81.3	0	0	0	114.5	E269 L272 I283 V291 M292	E269-L279 HydrophobicContact CB-CD1 4.18Å; E269-L279 HydrophobicContact CB-CD2 4.34Å; E269-L279 HydrophobicContact CG-CD2 4.31Å; L272-L279 HydrophobicContact CD1-CD1 3.82Å; L279-I283 HydrophobicContact CB-CD1 4.36Å; L279-I283 HydrophobicContact CD1-CD1 3.29Å; L279-I283 HydrophobicContact CG-CD1 3.69Å; L279-I283 VanDerWaalsContact O-CD1 3.23Å; L279-I283 WeakPolarHBondContact O-CD1 3.38Å; L279-V291 HydrophobicContact CD1-CG1 4Å; L279-V291 HydrophobicContact CD2-CG1 4.45Å; L279-M292 HydrophobicContact CD2-SD 3.87Å
280	G	72.6	Confident	86.3	Confident	69 Å²	69	58.4 Å²	58.4	71%	0.711	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-20.1	-170	0	0	0	0	0	117.1	A278	A278-G280 PolarHBondContact O-N 3.36Å
281	L	74.5	Confident	86.1	Confident	146 Å²	146	52.7 Å²	52.7	76%	0.764	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-41.8	-169.9	-75.5	117.2	0	0	0	113.7	A278	A278-L281 HydrophobicContact CB-CD1 4.36Å; A278-L281 PolarHBondContact O-N 2.97Å
282	D	81.1	Confident	85.9	Confident	56 Å²	56	55.4 Å²	55.4	30%	0.299	33%	0.326	S	S	.	.	S	Bend	trans	-100.7	-14.2	-165.1	-55.9	-51.4	0	0	0	114	Y251 L257 I277	Y251-D282 HydrophobicContact CE2-CB 4.05Å; L257-D282 WeakPolarHBondContact CB-O 3.48Å; I277-D282 HydrophobicContact CG2-CB 4.03Å
283	I	86.5	Confident	85.6	Confident	13 Å²	13	61.6 Å²	61.6	7%	0.067	35%	0.354	C	S	.	.	B	Isolated β-bridge	trans	-75.1	129.6	-178	-59.7	177.2	0	0	0	111.4	L257 L259 L272 L279 C287 L288	L257-I283 HydrophobicContact CD2-CG1 3.66Å; L257-I283 HydrophobicContact CG-CG1 4.27Å; L259-I283 HydrophobicContact CD1-CD1 3.72Å; L259-I283 HydrophobicContact CD1-CG1 4.28Å; L259-I283 HydrophobicContact CD1-CG2 4.13Å; L272-I283 HydrophobicContact CD1-CD1 3.84Å; L272-I283 HydrophobicContact CD1-CG1 4.39Å; L279-I283 HydrophobicContact CB-CD1 4.36Å; L279-I283 HydrophobicContact CD1-CD1 3.29Å; L279-I283 HydrophobicContact CG-CD1 3.69Å; L279-I283 VanDerWaalsContact O-CD1 3.23Å; L279-I283 WeakPolarHBondContact O-CD1 3.38Å; I283-C287 HydrophobicContact CG2-CB 3.98Å; I283-L288 HydrophobicContact CB-CD1 4.44Å; I283-L288 HydrophobicContact CG2-CB 4Å; I283-L288 HydrophobicContact CG2-CD1 4.44Å
284	Q	89.3	Confident	85.4	Confident	62 Å²	62	59.2 Å²	59.2	29%	0.29	35%	0.345	S	S	.	.			trans	-67.2	145.2	175.1	-68.6	-61.3	-25.8	0	0	113	E256 L257 C286 C287 L288	E256-Q284 HydrophobicContact CB-CG 3.99Å; L257-Q284 PolarHBondContact O-N 3.46Å; Q284-C286 PolarHBondContact O-N 2.86Å; Q284-C287 PolarHBondContact O-N 3.31Å; Q284-L288 PolarHBondContact O-N 3.41Å
285	R	86.3	Confident	85.2	Confident	229 Å²	229	59 Å²	59	86%	0.864	34%	0.341	S	S	*	.	H	α-helix	trans	-56.1	-31.5	-173.4	-64.2	-178.1	-178.3	-161	0.1	114.4	C287	R285-C287 VanDerWaalsContact C-N 3.28Å; R285-C287 PolarHBondContact O-N 2.76Å
286	C	85.2	Confident	85.1	Confident	69 Å²	69	61.4 Å²	61.4	47%	0.466	36%	0.359	S	S	.	.	H	α-helix	trans	-65.8	-29.1	177.4	58.2	0	0	0	0	113.1	H258 Q284	H258-C286 PolarHBondContact CE1-SG 3.12Å; H258-C286 PolarHBondContact ND1-SG 3.11Å; Q284-C286 PolarHBondContact O-N 2.86Å
287	C	87.4	Confident	85	Confident	10 Å²	10	64.4 Å²	64.4	7%	0.068	36%	0.361	C	S	.	.	H	α-helix	trans	-99.6	-26.5	-179.8	-62.7	0	0	0	0	112.4	L259 I283 Q284 R285 G289 P290 V291	L259-C287 HydrophobicContact CB-CB 4.12Å; L259-C287 HydrophobicContact CG-CB 4.5Å; L259-C287 PolarHBondContact N-SG 3.49Å; I283-C287 HydrophobicContact CG2-CB 3.98Å; Q284-C287 PolarHBondContact O-N 3.31Å; R285-C287 VanDerWaalsContact C-N 3.28Å; R285-C287 PolarHBondContact O-N 2.76Å; C287-G289 PolarHBondContact O-N 2.88Å; C287-P290 WeakPolarHBondContact O-CD 3.49Å; C287-V291 VanDerWaalsContact O-CG2 3.3Å; C287-V291 WeakPolarHBondContact O-CG2 3.21Å; C287-V291 PolarHBondContact O-N 3.35Å
288	L	87.2	Confident	84.9	Confident	53 Å²	53	68.5 Å²	68.5	28%	0.277	38%	0.383	S	S	.	.	H	α-helix	trans	-61.8	-45.3	-176.5	-177.3	62.2	0	0	0	112.8	I283 Q284 V291 M292	I283-L288 HydrophobicContact CB-CD1 4.44Å; I283-L288 HydrophobicContact CG2-CB 4Å; I283-L288 HydrophobicContact CG2-CD1 4.44Å; Q284-L288 PolarHBondContact O-N 3.41Å; L288-V291 PolarHBondContact O-N 3.5Å; L288-M292 HydrophobicContact CD1-CG 3.69Å; L288-M292 HydrophobicContact CD1-SD 4.39Å; L288-M292 HydrophobicContact CG-CG 4.1Å; L288-M292 WeakPolarHBondContact O-CB 3.1Å; L288-M292 VanDerWaalsContact O-CG 3.25Å; L288-M292 WeakPolarHBondContact O-CG 3.45Å; L288-M292 PolarHBondContact O-N 3.48Å
289	G	87	Confident	85.2	Confident	41 Å²	41	70.2 Å²	70.2	42%	0.423	38%	0.383	S	S	.	.	H	α-helix	trans	-55.8	-58.8	-177.5	0	0	0	0	0	113.6	C287 V291 M292 E293	C287-G289 PolarHBondContact O-N 2.88Å; G289-V291 VanDerWaalsContact C-N 3.31Å; G289-V291 PolarHBondContact O-N 2.87Å; G289-M292 PolarHBondContact O-N 3.46Å; G289-E293 WeakPolarHBondContact O-CB 3.45Å; G289-E293 PolarHBondContact O-N 3.43Å
290	P	86.2	Confident	85.8	Confident	81 Å²	81	71.3 Å²	71.3	53%	0.526	39%	0.391	S	S	.	.	H	α-helix	trans	-58.8	-38.3	179.9	-27.3	35.2	0	0	0	114.2	C287 S294	C287-P290 WeakPolarHBondContact O-CD 3.49Å; P290-S294 PolarHBondContact O-N 3.49Å
291	V	86.5	Confident	86.6	Confident	13 Å²	13	69 Å²	69	8%	0.079	36%	0.363	C	S	.	.	H	α-helix	trans	-66.3	-48.3	179.1	171.1	0	0	0	0	110.2	L259 L279 C287 L288 G289 E293 S294 K295	L259-V291 HydrophobicContact CD1-CG2 3.72Å; L279-V291 HydrophobicContact CD1-CG1 4Å; L279-V291 HydrophobicContact CD2-CG1 4.45Å; C287-V291 VanDerWaalsContact O-CG2 3.3Å; C287-V291 WeakPolarHBondContact O-CG2 3.21Å; C287-V291 PolarHBondContact O-N 3.35Å; L288-V291 PolarHBondContact O-N 3.5Å; G289-V291 VanDerWaalsContact C-N 3.31Å; G289-V291 PolarHBondContact O-N 2.87Å; V291-E293 PolarHBondContact O-N 2.88Å; V291-S294 PolarHBondContact O-N 3.06Å; V291-S294 PolarHBondContact O-OG 2.8Å; V291-K295 PolarHBondContact O-N 2.9Å
292	M	86.8	Confident	87.3	Confident	86 Å²	86	67.8 Å²	67.8	42%	0.424	35%	0.353	S	S	.	.	H	α-helix	trans	-65.2	-36.3	177.4	-69.8	-60.4	-66.8	0	0	112.7	L279 L288 G289 K295 S296	L279-M292 HydrophobicContact CD2-SD 3.87Å; L288-M292 HydrophobicContact CD1-CG 3.69Å; L288-M292 HydrophobicContact CD1-SD 4.39Å; L288-M292 HydrophobicContact CG-CG 4.1Å; L288-M292 WeakPolarHBondContact O-CB 3.1Å; L288-M292 VanDerWaalsContact O-CG 3.25Å; L288-M292 WeakPolarHBondContact O-CG 3.45Å; L288-M292 PolarHBondContact O-N 3.48Å; G289-M292 PolarHBondContact O-N 3.46Å; M292-K295 PolarHBondContact O-N 2.8Å; M292-S296 WeakPolarHBondContact O-CB 3.49Å; M292-S296 PolarHBondContact O-N 2.94Å; M292-S296 PolarHBondContact O-OG 3.15Å
293	E	87.4	Confident	87.6	Confident	129 Å²	129	71.9 Å²	71.9	60%	0.603	36%	0.364	S	S	*	.	H	α-helix	trans	-62.6	-46.9	173	-172.9	-177.9	169.5	0	0	111	G289 V291 K295 S296 K297	G289-E293 WeakPolarHBondContact O-CB 3.45Å; G289-E293 PolarHBondContact O-N 3.43Å; V291-E293 PolarHBondContact O-N 2.88Å; E293-K295 VanDerWaalsContact C-N 3.31Å; E293-K295 PolarHBondContact O-N 3.03Å; E293-S296 WeakPolarHBondContact CA-OG 3.25Å; E293-S296 PolarHBondContact O-OG 2.97Å; E293-S296 VanDerWaalsContact O-OG 3.06Å; E293-K297 WeakPolarHBondContact O-CB 3.45Å; E293-K297 PolarHBondContact O-N 3.29Å
294	S	87.5	Confident	87.7	Confident	35 Å²	35	71.3 Å²	71.3	25%	0.245	36%	0.361	C	S	.	.	H	α-helix	trans	-63.4	-38.3	179	74.5	0	0	0	0	112.4	G265 P290 V291 L298	G265-S294 WeakPolarHBondContact CA-OG 3.12Å; G265-S294 PolarHBondContact N-OG 3.13Å; P290-S294 PolarHBondContact O-N 3.49Å; V291-S294 PolarHBondContact O-N 3.06Å; V291-S294 PolarHBondContact O-OG 2.8Å; S294-L298 WeakPolarHBondContact O-CB 3.31Å; S294-L298 PolarHBondContact O-N 2.77Å; S294-L298 VanDerWaalsContact O-N 3.09Å
295	K	86.6	Confident	87.5	Confident	39 Å²	39	71.1 Å²	71.1	17%	0.17	36%	0.36	C	S	.	.	H	α-helix	trans	-65.7	-56.3	175.9	-179.7	179.8	175.1	169.1	0	111.6	E269 V291 M292 E293 K297 L298 E299	E269-K295 IonicContact OE1-NZ 3.95Å; E269-K295 PolarHBondContact OE1-NZ 2.92Å; E269-K295 VanDerWaalsContact OE2-CD 3.32Å; E269-K295 WeakPolarHBondContact OE2-CD 3.38Å; E269-K295 WeakPolarHBondContact OE2-CE 3.28Å; E269-K295 IonicContact OE2-NZ 3.72Å; E269-K295 PolarHBondContact OE2-NZ 3.1Å; V291-K295 PolarHBondContact O-N 2.9Å; M292-K295 PolarHBondContact O-N 2.8Å; E293-K295 VanDerWaalsContact C-N 3.31Å; E293-K295 PolarHBondContact O-N 3.03Å; K295-K297 VanDerWaalsContact C-N 3.29Å; K295-K297 PolarHBondContact O-N 3.16Å; K295-L298 PolarHBondContact O-N 3.4Å; K295-L298 VanDerWaalsContact O-N 3.09Å; K295-E299 WeakPolarHBondContact CE-OE1 3.35Å; K295-E299 WeakPolarHBondContact O-CG 3.16Å; K295-E299 PolarHBondContact O-N 3.22Å
296	S	88.8	Confident	87.3	Confident	56 Å²	56	65.9 Å²	65.9	39%	0.392	35%	0.346	S	S	.	.	H	α-helix	trans	-60.4	-37.1	179.9	57.1	0	0	0	0	112.8	M292 E293 E299 S300	M292-S296 WeakPolarHBondContact O-CB 3.49Å; M292-S296 PolarHBondContact O-N 2.94Å; M292-S296 PolarHBondContact O-OG 3.15Å; E293-S296 WeakPolarHBondContact CA-OG 3.25Å; E293-S296 PolarHBondContact O-OG 2.97Å; E293-S296 VanDerWaalsContact O-OG 3.06Å; S296-E299 PolarHBondContact O-N 2.94Å; S296-S300 WeakPolarHBondContact O-CB 3.44Å; S296-S300 PolarHBondContact O-N 3.44Å; S296-S300 PolarHBondContact O-OG 3.28Å
297	K	89	Confident	87.1	Confident	101 Å²	101	67.4 Å²	67.4	44%	0.439	34%	0.344	S	S	.	.	H	α-helix	trans	-61.8	-47.8	173.2	-176.1	177.5	-176.1	175.3	0	111	E293 K295 S300 L301	E293-K297 WeakPolarHBondContact O-CB 3.45Å; E293-K297 PolarHBondContact O-N 3.29Å; K295-K297 VanDerWaalsContact C-N 3.29Å; K295-K297 PolarHBondContact O-N 3.16Å; K297-S300 PolarHBondContact O-N 3.07Å; K297-L301 HydrophobicContact CG-CD1 4.34Å; K297-L301 WeakPolarHBondContact O-CB 3.26Å; K297-L301 VanDerWaalsContact O-CG 3.26Å; K297-L301 WeakPolarHBondContact O-CG 3.38Å; K297-L301 PolarHBondContact O-N 3.42Å
298	L	87.9	Confident	86.5	Confident	89 Å²	89	68.2 Å²	68.2	47%	0.466	35%	0.348	S	S	.	.	H	α-helix	trans	-62.5	-43.8	178.1	-174.1	67.2	0	0	0	111.8	P266 S294 K295 S300 L301 H302	P266-L298 HydrophobicContact CB-CD2 4.42Å; P266-L298 HydrophobicContact CG-CD2 3.68Å; S294-L298 WeakPolarHBondContact O-CB 3.31Å; S294-L298 PolarHBondContact O-N 2.77Å; S294-L298 VanDerWaalsContact O-N 3.09Å; K295-L298 PolarHBondContact O-N 3.4Å; K295-L298 VanDerWaalsContact O-N 3.09Å; L298-S300 VanDerWaalsContact C-N 3.33Å; L298-S300 PolarHBondContact O-N 3.27Å; L298-L301 PolarHBondContact O-N 3.49Å; L298-H302 WeakPolarHBondContact O-CB 3.43Å; L298-H302 PolarHBondContact O-N 2.86Å
299	E	89	Confident	85.7	Confident	83 Å²	83	67.9 Å²	67.9	39%	0.388	35%	0.345	S	S	.	.	H	α-helix	trans	-59.5	-43.5	175.9	-71.2	176.1	-171.7	0	0	112.1	K295 S296 H302 R303	K295-E299 WeakPolarHBondContact CE-OE1 3.35Å; K295-E299 WeakPolarHBondContact O-CG 3.16Å; K295-E299 PolarHBondContact O-N 3.22Å; S296-E299 PolarHBondContact O-N 2.94Å; E299-H302 PolarHBondContact O-N 2.81Å; E299-R303 WeakPolarHBondContact O-CG 3.48Å; E299-R303 PolarHBondContact O-N 3.09Å
300	S	88.9	Confident	84.5	Confident	37 Å²	37	68 Å²	68	26%	0.259	34%	0.338	S	S	.	.	H	α-helix	trans	-64.3	-41.2	177.2	-58.5	0	0	0	0	111.5	S296 K297 L298 R303 F304	S296-S300 WeakPolarHBondContact O-CB 3.44Å; S296-S300 PolarHBondContact O-N 3.44Å; S296-S300 PolarHBondContact O-OG 3.28Å; K297-S300 PolarHBondContact O-N 3.07Å; L298-S300 VanDerWaalsContact C-N 3.33Å; L298-S300 PolarHBondContact O-N 3.27Å; S300-R303 PolarHBondContact O-N 3.29Å; S300-F304 WeakPolarHBondContact O-CB 3.45Å; S300-F304 PolarHBondContact O-N 3.03Å
301	L	90.1	Very high	83.4	Confident	21 Å²	21	69.8 Å²	69.8	11%	0.11	34%	0.343	C	S	.	.	H	α-helix	trans	-65	-41.4	174.7	-69.7	-179.5	0	0	0	111.8	K297 L298 F304 E305 Y738 H741	K297-L301 HydrophobicContact CG-CD1 4.34Å; K297-L301 WeakPolarHBondContact O-CB 3.26Å; K297-L301 VanDerWaalsContact O-CG 3.26Å; K297-L301 WeakPolarHBondContact O-CG 3.38Å; K297-L301 PolarHBondContact O-N 3.42Å; L298-L301 PolarHBondContact O-N 3.49Å; L301-F304 WeakPolarHBondContact O-CA 3.17Å; L301-F304 WeakPolarHBondContact O-CB 3.4Å; L301-F304 PolarHBondContact O-N 3.27Å; L301-F304 VanDerWaalsContact O-N 3.12Å; L301-E305 WeakPolarHBondContact O-CG 3.35Å; L301-E305 PolarHBondContact O-N 3.1Å; L301-Y738 HydrophobicContact CD2-CD1 4.34Å; L301-Y738 HydrophobicContact CD2-CE1 4.47Å; L301-H741 HydrophobicContact CD2-CB 3.64Å; L301-H741 VanDerWaalsContact CD2-CG 3.44Å
302	H	88.1	Confident	82.3	Confident	121 Å²	121	71.9 Å²	71.9	56%	0.56	36%	0.362	S	S	*	.	H	α-helix	trans	-62.2	-46.4	176.4	-173.3	-89.1	0	0	0	111.7	L298 E299 F304 E305 E306	L298-H302 WeakPolarHBondContact O-CB 3.43Å; L298-H302 PolarHBondContact O-N 2.86Å; E299-H302 PolarHBondContact O-N 2.81Å; H302-F304 PolarHBondContact O-N 3.25Å; H302-E305 PolarHBondContact O-N 3.26Å; H302-E306 WeakPolarHBondContact O-CB 3.12Å; H302-E306 PolarHBondContact O-N 3.26Å
303	R	87.8	Confident	81.4	Confident	142 Å²	142	68.6 Å²	68.6	54%	0.536	35%	0.347	S	S	.	.	H	α-helix	trans	-61.8	-29.1	173.7	-70.2	176.5	-173.7	170.8	6.2	112.7	E299 S300 K307 Y646	E299-R303 WeakPolarHBondContact O-CG 3.48Å; E299-R303 PolarHBondContact O-N 3.09Å; S300-R303 PolarHBondContact O-N 3.29Å; R303-K307 WeakPolarHBondContact O-CG 3.38Å; R303-K307 PolarHBondContact O-N 3.02Å; R303-Y646 PolarHBondContact O-OH 2.91Å
304	F	88.3	Confident	80.5	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	35%	0.353	C	S	.	.	H	α-helix	trans	-72.4	-47.2	174.5	170.8	-97.4	0	0	0	111.4	S300 L301 H302 E306 K307 L308 V643 Y646 Y738 H741 A742	S300-F304 WeakPolarHBondContact O-CB 3.45Å; S300-F304 PolarHBondContact O-N 3.03Å; L301-F304 WeakPolarHBondContact O-CA 3.17Å; L301-F304 WeakPolarHBondContact O-CB 3.4Å; L301-F304 PolarHBondContact O-N 3.27Å; L301-F304 VanDerWaalsContact O-N 3.12Å; H302-F304 PolarHBondContact O-N 3.25Å; F304-E306 VanDerWaalsContact C-N 3.33Å; F304-E306 PolarHBondContact O-N 2.82Å; F304-K307 PolarHBondContact O-N 2.72Å; F304-L308 HydrophobicContact CD1-CD1 3.99Å; F304-L308 HydrophobicContact CD2-CD1 3.42Å; F304-L308 VanDerWaalsContact CD2-CD1 3.42Å; F304-L308 HydrophobicContact CE1-CD1 3.69Å; F304-L308 HydrophobicContact CE1-CD2 3.86Å; F304-L308 HydrophobicContact CE1-CG 4.33Å; F304-L308 HydrophobicContact CE2-CD1 3.09Å; F304-L308 HydrophobicContact CE2-CD2 4.31Å; F304-L308 HydrophobicContact CE2-CG 4.3Å; F304-L308 HydrophobicContact CG-CD1 3.88Å; F304-L308 HydrophobicContact CZ-CD1 3.23Å; F304-L308 HydrophobicContact CZ-CD2 3.61Å; F304-L308 HydrophobicContact CZ-CG 4.04Å; F304-L308 VanDerWaalsContact O-CD1 3.27Å; F304-L308 WeakPolarHBondContact O-CD1 3.5Å; F304-L308 PolarHBondContact O-N 3.07Å; F304-V643 HydrophobicContact CE2-CG1 4.2Å; F304-V643 HydrophobicContact CE2-CG2 4.43Å; F304-V643 HydrophobicContact CZ-CG1 4.28Å; F304-V643 HydrophobicContact CZ-CG2 4.08Å; F304-Y646 WeakPolarHBondContact CA-OH 3.31Å; F304-Y646 HydrophobicContact CB-CE1 4.08Å; F304-Y646 HydrophobicContact CB-CE2 4.39Å; F304-Y646 AromaticContact CD2-CD1 3.5Å; F304-Y646 HydrophobicContact CD2-CD1 3.5Å; F304-Y646 VanDerWaalsContact CD2-CD1 3.5Å; F304-Y646 HydrophobicContact CD2-CD2 4.21Å; F304-Y646 AromaticContact CD2-CE1 3.54Å; F304-Y646 HydrophobicContact CD2-CE1 3.54Å; F304-Y646 HydrophobicContact CD2-CE2 4.16Å; F304-Y646 AromaticContact CD2-CG 3.88Å; F304-Y646 HydrophobicContact CD2-CG 3.88Å; F304-Y646 AromaticContact CD2-CZ 3.88Å; F304-Y646 HydrophobicContact CE2-CD1 4.02Å; F304-Y646 HydrophobicContact CE2-CE1 4.47Å; F304-Y646 HydrophobicContact CE2-CG 4.25Å; F304-Y646 HydrophobicContact CG-CE1 4.31Å; F304-Y646 PolarHBondContact N-OH 2.93Å; F304-Y738 HydrophobicContact CB-CD1 3.82Å; F304-Y738 HydrophobicContact CB-CE1 3.8Å; F304-Y738 HydrophobicContact CD1-CD1 4.27Å; F304-Y738 AromaticContact CD2-CD1 3.49Å; F304-Y738 HydrophobicContact CD2-CD1 3.49Å; F304-Y738 VanDerWaalsContact CD2-CD1 3.49Å; F304-Y738 HydrophobicContact CD2-CE1 4.15Å; F304-Y738 AromaticContact CD2-CG 3.93Å; F304-Y738 HydrophobicContact CD2-CG 3.93Å; F304-Y738 HydrophobicContact CE2-CD1 4.02Å; F304-Y738 HydrophobicContact CE2-CG 4.07Å; F304-Y738 AromaticContact CG-CD1 3.6Å; F304-Y738 HydrophobicContact CG-CD1 3.6Å; F304-Y738 HydrophobicContact CG-CE1 4.13Å; F304-Y738 HydrophobicContact CG-CG 4.45Å; F304-Y738 WeakPolarHBondContact CZ-O 3.47Å; F304-H741 AromaticContact CD1-ND1 3.62Å; F304-H741 AromaticContact CE1-ND1 3.91Å; F304-A742 HydrophobicContact CE1-CB 3.98Å; F304-A742 HydrophobicContact CZ-CB 3.86Å
305	E	84.7	Confident	79.7	Confident	59 Å²	59	70.3 Å²	70.3	28%	0.276	34%	0.343	S	S	.	.	H	α-helix	trans	-57.8	-47.7	175.6	-66.7	-168.7	157.1	0	0	111.4	L301 H302 K307 L308 E309 H741 L745	L301-E305 WeakPolarHBondContact O-CG 3.35Å; L301-E305 PolarHBondContact O-N 3.1Å; H302-E305 PolarHBondContact O-N 3.26Å; E305-K307 VanDerWaalsContact C-N 3.31Å; E305-K307 PolarHBondContact O-N 3.36Å; E305-L308 PolarHBondContact O-N 2.77Å; E305-L308 VanDerWaalsContact O-N 3.11Å; E305-E309 WeakPolarHBondContact O-CG 3.28Å; E305-E309 PolarHBondContact O-N 2.81Å; E305-H741 IonicContact OE1-CE1 2.78Å; E305-H741 PolarHBondContact OE1-CE1 3.5Å; E305-H741 IonicContact OE1-NE2 3.77Å; E305-L745 HydrophobicContact CG-CD2 4.16Å
306	E	82.9	Confident	79.1	Confident	119 Å²	119	72.2 Å²	72.2	56%	0.556	36%	0.355	S	S	*	.	H	α-helix	trans	-54.3	-45.4	178.8	-173.2	179.3	-174.1	0	0	111.9	H302 F304 E309	H302-E306 WeakPolarHBondContact O-CB 3.12Å; H302-E306 PolarHBondContact O-N 3.26Å; F304-E306 VanDerWaalsContact C-N 3.33Å; F304-E306 PolarHBondContact O-N 2.82Å; E306-E309 VanDerWaalsContact O-O 3.04Å
307	K	81.5	Confident	78.3	Confident	100 Å²	100	73.9 Å²	73.9	44%	0.435	35%	0.353	S	S	.	.	H	α-helix	trans	-79.1	-22.1	178.9	-64.7	-170.3	-134.7	158.3	0	114.3	R303 F304 E305 Y646	R303-K307 WeakPolarHBondContact O-CG 3.38Å; R303-K307 PolarHBondContact O-N 3.02Å; F304-K307 PolarHBondContact O-N 2.72Å; E305-K307 VanDerWaalsContact C-N 3.31Å; E305-K307 PolarHBondContact O-N 3.36Å; K307-Y646 HydrophobicContact CB-CD2 3.91Å; K307-Y646 HydrophobicContact CB-CE2 3.7Å; K307-Y646 HydrophobicContact CD-CD2 3.95Å; K307-Y646 HydrophobicContact CD-CE2 3.45Å; K307-Y646 VanDerWaalsContact CD-CE2 3.45Å; K307-Y646 HydrophobicContact CG-CD2 4.49Å; K307-Y646 HydrophobicContact CG-CE2 3.95Å
308	L	75	Confident	77.6	Confident	27 Å²	27	77.1 Å²	77.1	14%	0.141	36%	0.363	C	S	.	.	H	α-helix	trans	-78.6	-35.5	175.5	-103.1	83.3	0	0	0	112.1	F304 E305 R642 V643 A742	F304-L308 HydrophobicContact CD1-CD1 3.99Å; F304-L308 HydrophobicContact CD2-CD1 3.42Å; F304-L308 VanDerWaalsContact CD2-CD1 3.42Å; F304-L308 HydrophobicContact CE1-CD1 3.69Å; F304-L308 HydrophobicContact CE1-CD2 3.86Å; F304-L308 HydrophobicContact CE1-CG 4.33Å; F304-L308 HydrophobicContact CE2-CD1 3.09Å; F304-L308 HydrophobicContact CE2-CD2 4.31Å; F304-L308 HydrophobicContact CE2-CG 4.3Å; F304-L308 HydrophobicContact CG-CD1 3.88Å; F304-L308 HydrophobicContact CZ-CD1 3.23Å; F304-L308 HydrophobicContact CZ-CD2 3.61Å; F304-L308 HydrophobicContact CZ-CG 4.04Å; F304-L308 VanDerWaalsContact O-CD1 3.27Å; F304-L308 WeakPolarHBondContact O-CD1 3.5Å; F304-L308 PolarHBondContact O-N 3.07Å; E305-L308 PolarHBondContact O-N 2.77Å; E305-L308 VanDerWaalsContact O-N 3.11Å; L308-R642 PolarHBondContact O-NH2 2.82Å; L308-V643 HydrophobicContact CD2-CG2 4.46Å; L308-A742 HydrophobicContact CD2-CB 4.4Å
309	E	68.8	Low	77.1	Confident	47 Å²	47	75.9 Å²	75.9	22%	0.22	36%	0.356	C	S	.	.	S	Bend	trans	-69.4	127.8	170.6	-60.8	-156.5	137.9	0	0	108.2	E305 E306 D311 R340 K749	E305-E309 WeakPolarHBondContact O-CG 3.28Å; E305-E309 PolarHBondContact O-N 2.81Å; E306-E309 VanDerWaalsContact O-O 3.04Å; E309-D311 PolarHBondContact O-N 2.87Å; E309-R340 IonicContact OE1-CZ 3.19Å; E309-R340 IonicContact OE1-NH2 2.97Å; E309-R340 PolarHBondContact OE1-NH2 2.84Å; E309-R340 IonicContact OE2-CZ 2.96Å; E309-R340 IonicContact OE2-NH1 3.37Å; E309-R340 PolarHBondContact OE2-NH1 3.45Å; E309-R340 IonicContact OE2-NH2 3.15Å; E309-R340 PolarHBondContact OE2-NH2 3.27Å; E309-K749 IonicContact OE1-NZ 3.77Å; E309-K749 PolarHBondContact OE1-NZ 3.2Å
310	P	63	Low	76.5	Confident	44 Å²	44	80.2 Å²	80.2	29%	0.286	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-65.6	133.2	179.6	26.1	-31.9	0	0	0	109.1	P339 R340	P310-P339 HydrophobicContact CB-CB 3.9Å; P310-R340 HydrophobicContact CG-CG 4.32Å
311	D	63.1	Low	76.3	Confident	118 Å²	118	81.2 Å²	81.2	63%	0.631	38%	0.384	S	S	*	.	P	Polyproline II helix	trans	-49	143.5	176.3	-69.1	-40.2	0	0	0	110.6	E309 V313	E309-D311 PolarHBondContact O-N 2.87Å; D311-V313 PolarHBondContact O-N 3.23Å
312	A	62.7	Low	75.9	Confident	56 Å²	56	88.1 Å²	88.1	46%	0.463	41%	0.409	S	S	.	.			trans	-72.5	98.3	176	0	0	0	0	0	108.3	R340 I342	A312-R340 CarbonylContact C-O 3.53Å; A312-R340 WeakPolarHBondContact CA-O 3.45Å; A312-R340 HydrophobicContact CB-CB 4.35Å; A312-I342 HydrophobicContact CB-CD1 3.83Å; A312-I342 HydrophobicContact CB-CG1 3.37Å; A312-I342 VanDerWaalsContact O-CD1 3.27Å; A312-I342 WeakPolarHBondContact O-CD1 3.14Å
313	V	67.3	Low	75.8	Confident	17 Å²	17	92.4 Å²	92.4	10%	0.103	42%	0.42	C	S	.	.	B	Isolated β-bridge	trans	-85.1	132.2	-176.3	180	0	0	0	0	109.4	D311 P315 P339 R340 I342 P566 S567 L570	D311-V313 PolarHBondContact O-N 3.23Å; V313-P315 VanDerWaalsContact O-CD 3.29Å; V313-P315 WeakPolarHBondContact O-CD 3.37Å; V313-P339 HydrophobicContact CG2-CB 4.3Å; V313-R340 PolarHBondContact N-O 2.99Å; V313-I342 PolarHBondContact O-N 2.97Å; V313-I342 VanDerWaalsContact O-N 3.14Å; V313-P566 HydrophobicContact CG1-CB 4.33Å; V313-P566 HydrophobicContact CG1-CG 4.31Å; V313-S567 VanDerWaalsContact CG1-OG 3.3Å; V313-S567 WeakPolarHBondContact CG1-OG 3.49Å; V313-L570 HydrophobicContact CG1-CD2 4.06Å; V313-L570 HydrophobicContact CG2-CD2 3.78Å
314	R	69.3	Low	75.6	Confident	195 Å²	195	88.5 Å²	88.5	74%	0.736	41%	0.406	S	S	*	.			trans	-77	115	163.5	-176.6	179.7	-179.8	178.6	-0.1	107.7
315	P	70.6	Confident	75.3	Confident	6 Å²	6	89.2 Å²	89.2	4%	0.039	41%	0.409	C	S	.	.			trans	-68.7	140	179	27	-35.4	0	0	0	111.5	V313 Y317 L341 P566	V313-P315 VanDerWaalsContact O-CD 3.29Å; V313-P315 WeakPolarHBondContact O-CD 3.37Å; P315-Y317 HydrophobicContact CB-CE1 4.05Å; P315-Y317 HydrophobicContact CG-CD1 4.49Å; P315-Y317 HydrophobicContact CG-CE1 3.68Å; P315-Y317 HydrophobicContact CG-CE2 3.73Å; P315-Y317 WeakPolarHBondContact CG-OH 3.41Å; P315-Y317 PolarHBondContact O-N 3.37Å; P315-L341 HydrophobicContact CB-CD2 4.24Å; P315-L341 HydrophobicContact CG-CD2 4.29Å; P315-P566 CarbonylContact C-O 3.57Å; P315-P566 WeakPolarHBondContact CA-O 3.39Å; P315-P566 HydrophobicContact CB-CB 4.35Å
316	D	74.4	Confident	75.1	Confident	79 Å²	79	88 Å²	88	42%	0.422	41%	0.407	S	S	.	.			trans	-77.9	117.1	166.7	-65.5	-32.3	0	0	0	108.1	R328 P566 S567	D316-R328 PolarHBondContact O-NH1 2.94Å; D316-R328 VanDerWaalsContact O-NH1 3.1Å; D316-R328 PolarHBondContact O-NH2 3.36Å; D316-P566 PolarHBondContact N-O 3.1Å; D316-S567 VanDerWaalsContact OD2-CA 3.31Å; D316-S567 WeakPolarHBondContact OD2-CA 3.27Å; D316-S567 WeakPolarHBondContact OD2-CB 3.32Å
317	Y	71.1	Confident	75.2	Confident	90 Å²	90	87.3 Å²	87.3	35%	0.353	40%	0.402	S	S	.	.			trans	-101	84.2	-179.3	-60.8	-67.1	0	0	0	110.5	P315 Q325	P315-Y317 HydrophobicContact CB-CE1 4.05Å; P315-Y317 HydrophobicContact CG-CD1 4.49Å; P315-Y317 HydrophobicContact CG-CE1 3.68Å; P315-Y317 HydrophobicContact CG-CE2 3.73Å; P315-Y317 WeakPolarHBondContact CG-OH 3.41Å; P315-Y317 PolarHBondContact O-N 3.37Å; Y317-Q325 HydrophobicContact CD1-CG 3.99Å; Y317-Q325 HydrophobicContact CE1-CG 3.95Å
318	W	75.5	Confident	75.4	Confident	170 Å²	170	83 Å²	83	64%	0.644	38%	0.384	S	S	*	.	S	Bend	trans	-76.6	-30.8	168	62.2	-58.8	0	0	0	112.3	I563	W318-I563 HydrophobicContact CZ2-CG2 4.4Å
319	I	77.1	Confident	75.8	Confident	62 Å²	62	85.2 Å²	85.2	32%	0.318	39%	0.393	S	S	.	.	S	Bend	trans	-117.7	114.4	173.6	-62.7	163.2	0	0	0	109	S321 W324 Q325	I319-S321 VanDerWaalsContact C-N 3.31Å; I319-S321 PolarHBondContact O-N 2.99Å; I319-W324 HydrophobicContact CB-CG 4.27Å; I319-W324 HydrophobicContact CD1-CZ2 4.42Å; I319-W324 HydrophobicContact CG2-CB 4Å; I319-W324 HydrophobicContact CG2-CG 3.81Å; I319-Q325 PolarHBondContact O-NE2 3.1Å
320	Q	76.2	Confident	76.5	Confident	174 Å²	174	86.2 Å²	86.2	81%	0.813	40%	0.397	S	S	*	.			trans	-84	3	-172.7	-63.8	-179.2	6	0	0	114.7	Y322	Q320-Y322 PolarHBondContact O-N 2.91Å
321	S	84	Confident	77.6	Confident	59 Å²	59	86 Å²	86	41%	0.413	39%	0.393	S	S	.	.			trans	-66.9	126.9	-179.2	174	0	0	0	0	112.1	I319 R323 W324 Q325	I319-S321 VanDerWaalsContact C-N 3.31Å; I319-S321 PolarHBondContact O-N 2.99Å; S321-R323 VanDerWaalsContact C-N 3.29Å; S321-R323 PolarHBondContact O-N 2.96Å; S321-R323 PolarHBondContact OG-N 3.44Å; S321-W324 WeakPolarHBondContact O-CB 3.25Å; S321-W324 PolarHBondContact O-N 3.26Å; S321-W324 VanDerWaalsContact O-N 3.17Å; S321-Q325 PolarHBondContact O-N 2.99Å
322	Y	82	Confident	78.8	Confident	165 Å²	165	81.2 Å²	81.2	65%	0.647	37%	0.366	S	S	*	.	H	α-helix	trans	-58	-40.8	175.4	174.8	-106.7	0	0	0	112.4	Q320 W324 Q325 S326	Q320-Y322 PolarHBondContact O-N 2.91Å; Y322-W324 VanDerWaalsContact C-N 3.32Å; Y322-W324 PolarHBondContact O-N 3.29Å; Y322-Q325 PolarHBondContact O-N 3.09Å; Y322-S326 WeakPolarHBondContact O-CB 3.3Å; Y322-S326 PolarHBondContact O-N 3.23Å
323	R	85.9	Confident	79.7	Confident	211 Å²	211	80.3 Å²	80.3	80%	0.796	36%	0.356	S	S	*	.	H	α-helix	trans	-63.3	-41.2	178.4	-66.4	-174.6	71.1	156.3	0.8	111.1	S321 F327	S321-R323 VanDerWaalsContact C-N 3.29Å; S321-R323 PolarHBondContact O-N 2.96Å; S321-R323 PolarHBondContact OG-N 3.44Å; R323-F327 VanDerWaalsContact O-CB 3.25Å; R323-F327 WeakPolarHBondContact O-CB 3.34Å; R323-F327 PolarHBondContact O-N 2.66Å
324	W	84.3	Confident	80.5	Confident	60 Å²	60	80.5 Å²	80.5	23%	0.227	36%	0.358	C	S	.	.	H	α-helix	trans	-65.2	-46.2	176.6	176.9	-109.5	0	0	0	111.9	I319 S321 Y322 S326 F327 R328 I563 F564	I319-W324 HydrophobicContact CB-CG 4.27Å; I319-W324 HydrophobicContact CD1-CZ2 4.42Å; I319-W324 HydrophobicContact CG2-CB 4Å; I319-W324 HydrophobicContact CG2-CG 3.81Å; S321-W324 WeakPolarHBondContact O-CB 3.25Å; S321-W324 PolarHBondContact O-N 3.26Å; S321-W324 VanDerWaalsContact O-N 3.17Å; Y322-W324 VanDerWaalsContact C-N 3.32Å; Y322-W324 PolarHBondContact O-N 3.29Å; W324-S326 PolarHBondContact O-N 3.32Å; W324-F327 HydrophobicContact CE3-CD1 4.01Å; W324-F327 AromaticContact CZ3-CD1 3.85Å; W324-F327 HydrophobicContact CZ3-CD1 3.85Å; W324-F327 HydrophobicContact CZ3-CE1 4.08Å; W324-F327 PolarHBondContact O-N 2.84Å; W324-R328 VanDerWaalsContact O-CB 3.28Å; W324-R328 WeakPolarHBondContact O-CB 3.41Å; W324-R328 PolarHBondContact O-N 3.4Å; W324-I563 HydrophobicContact CH2-CG2 4.36Å; W324-I563 HydrophobicContact CZ2-CG2 4.27Å; W324-F564 HydrophobicContact CH2-CD1 4.34Å; W324-F564 AromaticContact CH2-CE1 3.61Å; W324-F564 HydrophobicContact CH2-CE1 3.61Å; W324-F564 HydrophobicContact CH2-CZ 4.22Å; W324-F564 HydrophobicContact CZ2-CD1 4.48Å; W324-F564 HydrophobicContact CZ2-CE1 4.18Å; W324-F564 HydrophobicContact CZ3-CE1 4.18Å
325	Q	81.7	Confident	81.2	Confident	16 Å²	16	72 Å²	72	8%	0.075	33%	0.326	C	S	.	.	H	α-helix	trans	-64.7	-42.5	180	-65.1	-56.1	-27.9	0	0	111.9	Y317 I319 S321 Y322 F327 R328 E329	Y317-Q325 HydrophobicContact CD1-CG 3.99Å; Y317-Q325 HydrophobicContact CE1-CG 3.95Å; I319-Q325 PolarHBondContact O-NE2 3.1Å; S321-Q325 PolarHBondContact O-N 2.99Å; Y322-Q325 PolarHBondContact O-N 3.09Å; Q325-F327 VanDerWaalsContact C-N 3.3Å; Q325-F327 PolarHBondContact O-N 2.99Å; Q325-R328 PolarHBondContact O-N 2.92Å; Q325-E329 WeakPolarHBondContact O-CB 3.47Å; Q325-E329 VanDerWaalsContact O-CG 3.27Å; Q325-E329 WeakPolarHBondContact O-CG 3.29Å; Q325-E329 PolarHBondContact O-N 2.78Å
326	S	80.6	Confident	81.5	Confident	34 Å²	34	73.4 Å²	73.4	24%	0.238	33%	0.334	C	S	.	.	H	α-helix	trans	-62.1	-38.6	174.3	-174.3	0	0	0	0	112.3	Y322 W324 K330	Y322-S326 WeakPolarHBondContact O-CB 3.3Å; Y322-S326 PolarHBondContact O-N 3.23Å; W324-S326 PolarHBondContact O-N 3.32Å; S326-K330 WeakPolarHBondContact O-CD 3.37Å; S326-K330 WeakPolarHBondContact O-CG 3.38Å; S326-K330 PolarHBondContact O-N 2.93Å
327	F	85.5	Confident	81.3	Confident	103 Å²	103	73.5 Å²	73.5	45%	0.452	33%	0.333	S	S	.	.	H	α-helix	trans	-68.7	-45.2	176.7	179	-110.9	0	0	0	112.5	R323 W324 Q325 E329 K330 I331 F564	R323-F327 VanDerWaalsContact O-CB 3.25Å; R323-F327 WeakPolarHBondContact O-CB 3.34Å; R323-F327 PolarHBondContact O-N 2.66Å; W324-F327 HydrophobicContact CE3-CD1 4.01Å; W324-F327 AromaticContact CZ3-CD1 3.85Å; W324-F327 HydrophobicContact CZ3-CD1 3.85Å; W324-F327 HydrophobicContact CZ3-CE1 4.08Å; W324-F327 PolarHBondContact O-N 2.84Å; Q325-F327 VanDerWaalsContact C-N 3.3Å; Q325-F327 PolarHBondContact O-N 2.99Å; F327-E329 PolarHBondContact O-N 3.31Å; F327-K330 WeakPolarHBondContact O-CB 3.4Å; F327-K330 PolarHBondContact O-N 2.93Å; F327-I331 HydrophobicContact CD1-CD1 3.99Å; F327-I331 HydrophobicContact CD2-CD1 4.31Å; F327-I331 HydrophobicContact CE1-CD1 3.32Å; F327-I331 HydrophobicContact CE1-CG1 4.4Å; F327-I331 HydrophobicContact CE2-CD1 3.68Å; F327-I331 HydrophobicContact CE2-CG1 4.2Å; F327-I331 HydrophobicContact CG-CD1 4.46Å; F327-I331 HydrophobicContact CZ-CD1 3.17Å; F327-I331 HydrophobicContact CZ-CG1 4.16Å; F327-I331 PolarHBondContact O-N 3.2Å; F327-F564 HydrophobicContact CD1-CE1 4.18Å; F327-F564 AromaticContact CE1-CE1 3.96Å; F327-F564 HydrophobicContact CE1-CE1 3.96Å; F327-F564 HydrophobicContact CE1-CZ 4.21Å
328	R	86.1	Confident	80.7	Confident	10 Å²	10	71.9 Å²	71.9	4%	0.038	34%	0.335	C	S	.	.	H	α-helix	trans	-57	-49	175.8	178.4	-167.7	-175.1	-172.3	13.8	111.2	D316 W324 Q325 K330 I331 W332 F564 C565 P566	D316-R328 PolarHBondContact O-NH1 2.94Å; D316-R328 VanDerWaalsContact O-NH1 3.1Å; D316-R328 PolarHBondContact O-NH2 3.36Å; W324-R328 VanDerWaalsContact O-CB 3.28Å; W324-R328 WeakPolarHBondContact O-CB 3.41Å; W324-R328 PolarHBondContact O-N 3.4Å; Q325-R328 PolarHBondContact O-N 2.92Å; R328-K330 VanDerWaalsContact C-N 3.31Å; R328-K330 PolarHBondContact O-N 3.21Å; R328-I331 PolarHBondContact O-N 3.48Å; R328-W332 VanDerWaalsContact O-CB 3.3Å; R328-W332 WeakPolarHBondContact O-CB 3.34Å; R328-W332 PolarHBondContact O-N 2.98Å; R328-F564 HydrophobicContact CB-CD1 4.29Å; R328-F564 HydrophobicContact CG-CB 4.45Å; R328-F564 HydrophobicContact CG-CD1 4.18Å; R328-F564 VanDerWaalsContact CG-O 3.24Å; R328-F564 WeakPolarHBondContact CG-O 3.36Å; R328-F564 PolarHBondContact NE-O 3.48Å; R328-C565 VanDerWaalsContact CZ-O 3.25Å; R328-C565 PolarHBondContact NE-O 3.49Å; R328-C565 PolarHBondContact NH2-O 2.52Å; R328-P566 VanDerWaalsContact NH2-C 3.25Å; R328-P566 VanDerWaalsContact NH2-CA 3.3Å; R328-P566 PolarHBondContact NH2-O 3.38Å
329	E	82	Confident	79.7	Confident	74 Å²	74	64.8 Å²	64.8	35%	0.346	31%	0.311	S	S	.	.	H	α-helix	trans	-58.8	-42.4	177.2	-73.8	174.9	-170.2	0	0	111.9	Q325 F327 S333 L341	Q325-E329 WeakPolarHBondContact O-CB 3.47Å; Q325-E329 VanDerWaalsContact O-CG 3.27Å; Q325-E329 WeakPolarHBondContact O-CG 3.29Å; Q325-E329 PolarHBondContact O-N 2.78Å; F327-E329 PolarHBondContact O-N 3.31Å; E329-S333 WeakPolarHBondContact O-CB 3.48Å; E329-S333 PolarHBondContact O-N 3.17Å; E329-L341 HydrophobicContact CG-CD1 3.6Å; E329-L341 WeakPolarHBondContact OE1-CD1 3.28Å
330	K	84	Confident	78.4	Confident	67 Å²	67	68 Å²	68	29%	0.291	32%	0.319	S	S	.	.	H	α-helix	trans	-63.3	-48.8	176.9	-74.6	172	179.9	-162	0	111.8	S326 F327 R328 S333 V334 E460	S326-K330 WeakPolarHBondContact O-CD 3.37Å; S326-K330 WeakPolarHBondContact O-CG 3.38Å; S326-K330 PolarHBondContact O-N 2.93Å; F327-K330 WeakPolarHBondContact O-CB 3.4Å; F327-K330 PolarHBondContact O-N 2.93Å; R328-K330 VanDerWaalsContact C-N 3.31Å; R328-K330 PolarHBondContact O-N 3.21Å; K330-S333 PolarHBondContact O-N 3.38Å; K330-S333 PolarHBondContact O-OG 3.46Å; K330-V334 PolarHBondContact O-N 3.1Å; K330-E460 WeakPolarHBondContact CE-OE1 3.06Å; K330-E460 IonicContact NZ-OE1 2.86Å; K330-E460 PolarHBondContact NZ-OE1 2.99Å
331	I	86.7	Confident	77.3	Confident	41 Å²	41	62.1 Å²	62.1	21%	0.21	29%	0.293	C	S	.	.	H	α-helix	trans	-63.9	-46.2	178.6	-73.3	-175.3	0	0	0	111.1	F327 R328 S333 V334 I335 F564	F327-I331 HydrophobicContact CD1-CD1 3.99Å; F327-I331 HydrophobicContact CD2-CD1 4.31Å; F327-I331 HydrophobicContact CE1-CD1 3.32Å; F327-I331 HydrophobicContact CE1-CG1 4.4Å; F327-I331 HydrophobicContact CE2-CD1 3.68Å; F327-I331 HydrophobicContact CE2-CG1 4.2Å; F327-I331 HydrophobicContact CG-CD1 4.46Å; F327-I331 HydrophobicContact CZ-CD1 3.17Å; F327-I331 HydrophobicContact CZ-CG1 4.16Å; F327-I331 PolarHBondContact O-N 3.2Å; R328-I331 PolarHBondContact O-N 3.48Å; I331-S333 PolarHBondContact O-N 3.14Å; I331-V334 WeakPolarHBondContact O-CB 3.3Å; I331-V334 PolarHBondContact O-N 3.33Å; I331-I335 HydrophobicContact CG2-CD1 3.46Å; I331-I335 VanDerWaalsContact CG2-CD1 3.46Å; I331-I335 HydrophobicContact CG2-CG1 4.17Å; I331-I335 WeakPolarHBondContact O-CG1 3.43Å; I331-I335 PolarHBondContact O-N 3.46Å; I331-I335 VanDerWaalsContact O-N 3.09Å; I331-F564 HydrophobicContact CB-CD1 4.16Å; I331-F564 HydrophobicContact CB-CE1 4.36Å; I331-F564 HydrophobicContact CB-CG 4.31Å; I331-F564 HydrophobicContact CD1-CD1 4.33Å; I331-F564 HydrophobicContact CD1-CE1 3.66Å; I331-F564 HydrophobicContact CD1-CE2 4.15Å; I331-F564 HydrophobicContact CD1-CZ 3.57Å; I331-F564 HydrophobicContact CG2-CB 4.23Å; I331-F564 HydrophobicContact CG2-CD1 4.02Å; I331-F564 HydrophobicContact CG2-CD2 3.64Å; I331-F564 HydrophobicContact CG2-CE1 4.29Å; I331-F564 HydrophobicContact CG2-CE2 3.96Å; I331-F564 HydrophobicContact CG2-CG 3.69Å; I331-F564 HydrophobicContact CG2-CZ 4.27Å
332	W	86.8	Confident	75.9	Confident	16 Å²	16	63.4 Å²	63.4	6%	0.061	30%	0.295	C	S	.	.	H	α-helix	trans	-59	-37	178.3	-171.2	-102.5	0	0	0	111.8	R328 V334 I335 D336 P339 R561 F564 C565 W571	R328-W332 VanDerWaalsContact O-CB 3.3Å; R328-W332 WeakPolarHBondContact O-CB 3.34Å; R328-W332 PolarHBondContact O-N 2.98Å; W332-V334 PolarHBondContact O-N 3.42Å; W332-I335 PolarHBondContact O-N 2.79Å; W332-D336 HydrophobicContact CH2-CB 4.35Å; W332-D336 HydrophobicContact CZ2-CB 3.92Å; W332-D336 PolarHBondContact O-N 3.35Å; W332-P339 VanDerWaalsContact NE1-CD 3.26Å; W332-R561 HydrophobicContact CZ3-CB 4.17Å; W332-R561 HydrophobicContact CZ3-CG 4.4Å; W332-R561 WeakPolarHBondContact CZ3-O 3.39Å; W332-F564 HydrophobicContact CE3-CB 4.16Å; W332-C565 HydrophobicContact CE3-CB 4.26Å; W332-C565 HydrophobicContact CH2-CB 3.65Å; W332-C565 HydrophobicContact CZ2-CB 4.29Å; W332-C565 VanDerWaalsContact CZ3-CA 3.47Å; W332-C565 HydrophobicContact CZ3-CB 3.63Å; W332-W571 AromaticContact CH2-CD1 3.58Å; W332-W571 HydrophobicContact CH2-CG 4.39Å; W332-W571 AromaticContact CH2-NE1 3.64Å
333	S	81.7	Confident	74.3	Confident	37 Å²	37	60.2 Å²	60.2	26%	0.259	29%	0.288	S	S	.	.	H	α-helix	trans	-65.7	-17.5	175.8	81	0	0	0	0	115.1	E329 K330 I331	E329-S333 WeakPolarHBondContact O-CB 3.48Å; E329-S333 PolarHBondContact O-N 3.17Å; K330-S333 PolarHBondContact O-N 3.38Å; K330-S333 PolarHBondContact O-OG 3.46Å; I331-S333 PolarHBondContact O-N 3.14Å
334	V	84.8	Confident	72.1	Confident	22 Å²	22	53.2 Å²	53.2	13%	0.133	27%	0.272	C	S	.	.	H	α-helix	trans	-88.7	-43.9	174.5	173	0	0	0	0	110.6	K330 I331 W332 L464 L467	K330-V334 PolarHBondContact O-N 3.1Å; I331-V334 WeakPolarHBondContact O-CB 3.3Å; I331-V334 PolarHBondContact O-N 3.33Å; W332-V334 PolarHBondContact O-N 3.42Å; V334-L464 HydrophobicContact CG2-CD2 3.83Å; V334-L467 HydrophobicContact CG1-CB 4.02Å; V334-L467 HydrophobicContact CG2-CB 4.16Å
335	I	84.7	Confident	70.1	Confident	15 Å²	15	59 Å²	59	8%	0.077	29%	0.294	C	S	.	.	H	α-helix	trans	-74.8	-46.6	-173.5	-65.5	176.3	0	0	0	111.8	I331 W332 Y471 I560 R561	I331-I335 HydrophobicContact CG2-CD1 3.46Å; I331-I335 VanDerWaalsContact CG2-CD1 3.46Å; I331-I335 HydrophobicContact CG2-CG1 4.17Å; I331-I335 WeakPolarHBondContact O-CG1 3.43Å; I331-I335 PolarHBondContact O-N 3.46Å; I331-I335 VanDerWaalsContact O-N 3.09Å; W332-I335 PolarHBondContact O-N 2.79Å; I335-Y471 HydrophobicContact CB-CE1 4.44Å; I335-Y471 HydrophobicContact CG2-CE1 4.26Å; I335-Y471 WeakPolarHBondContact O-CE1 3.39Å; I335-I560 HydrophobicContact CD1-CG2 3.51Å; I335-R561 HydrophobicContact CG2-CG 3.57Å
336	D	76.7	Confident	68	Low	36 Å²	36	67.8 Å²	67.8	19%	0.193	33%	0.332	C	S	.	.	S	Bend	trans	-134.9	173.3	-178	-152.6	-7.7	0	0	0	111.2	W332 S338 R636	W332-D336 HydrophobicContact CH2-CB 4.35Å; W332-D336 HydrophobicContact CZ2-CB 3.92Å; W332-D336 PolarHBondContact O-N 3.35Å; D336-S338 PolarHBondContact O-N 3.43Å; D336-R636 IonicContact OD1-NE 3.83Å; D336-R636 IonicContact OD1-NH2 3.83Å; D336-R636 IonicContact OD2-CZ 2.76Å; D336-R636 IonicContact OD2-NH2 3.89Å; D336-R636 PolarHBondContact OD2-NH2 3.31Å
337	I	70.5	Confident	65.6	Low	81 Å²	81	71.6 Å²	71.6	42%	0.415	35%	0.354	S	S	.	.			trans	-65	109.6	172	-60.7	168.5	0	0	0	107.5	P339	I337-P339 VanDerWaalsContact O-CD 3.32Å; I337-P339 WeakPolarHBondContact O-CD 3.27Å; I337-P339 VanDerWaalsContact O-N 3.15Å
338	S	57.3	Low	63	Low	57 Å²	57	72.8 Å²	72.8	40%	0.399	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-54.8	119.1	176.8	175.1	0	0	0	0	110.4	D336	D336-S338 PolarHBondContact O-N 3.43Å
339	P	55	Low	60.5	Low	21 Å²	21	80.3 Å²	80.3	14%	0.136	41%	0.411	C	S	.	.	P	Polyproline II helix	trans	-70.6	162.5	174.9	28.8	-32.8	0	0	0	111	P310 V313 W332 I337 L341 P566	P310-P339 HydrophobicContact CB-CB 3.9Å; V313-P339 HydrophobicContact CG2-CB 4.3Å; W332-P339 VanDerWaalsContact NE1-CD 3.26Å; I337-P339 VanDerWaalsContact O-CD 3.32Å; I337-P339 WeakPolarHBondContact O-CD 3.27Å; I337-P339 VanDerWaalsContact O-N 3.15Å; P339-L341 PolarHBondContact O-N 3Å; P339-P566 HydrophobicContact CG-CG 4.05Å
340	R	50.2	Low	58.2	Low	130 Å²	130	85.7 Å²	85.7	49%	0.491	43%	0.433	S	S	.	.	P	Polyproline II helix	trans	-67	125.7	167.5	-73.6	178.7	174.4	172.1	4.2	107.2	E309 P310 A312 V313	E309-R340 IonicContact OE1-CZ 3.19Å; E309-R340 IonicContact OE1-NH2 2.97Å; E309-R340 PolarHBondContact OE1-NH2 2.84Å; E309-R340 IonicContact OE2-CZ 2.96Å; E309-R340 IonicContact OE2-NH1 3.37Å; E309-R340 PolarHBondContact OE2-NH1 3.45Å; E309-R340 IonicContact OE2-NH2 3.15Å; E309-R340 PolarHBondContact OE2-NH2 3.27Å; P310-R340 HydrophobicContact CG-CG 4.32Å; A312-R340 CarbonylContact C-O 3.53Å; A312-R340 WeakPolarHBondContact CA-O 3.45Å; A312-R340 HydrophobicContact CB-CB 4.35Å; V313-R340 PolarHBondContact N-O 2.99Å
341	L	52.8	Low	55.4	Low	49 Å²	49	89.9 Å²	89.9	26%	0.257	45%	0.453	S	S	.	.	B	Isolated β-bridge	trans	-94.1	129	174	-68.9	164.4	0	0	0	108.7	P315 E329 P339 N343 P566	P315-L341 HydrophobicContact CB-CD2 4.24Å; P315-L341 HydrophobicContact CG-CD2 4.29Å; E329-L341 HydrophobicContact CG-CD1 3.6Å; E329-L341 WeakPolarHBondContact OE1-CD1 3.28Å; P339-L341 PolarHBondContact O-N 3Å; L341-N343 PolarHBondContact O-N 3.49Å; L341-N343 VanDerWaalsContact O-N 3.08Å; L341-P566 HydrophobicContact CD2-CB 4.03Å
342	I	54.5	Low	52.6	Low	87 Å²	87	98.6 Å²	98.6	45%	0.446	48%	0.484	S	S	.	.			trans	-72.5	101.5	166.7	-58.8	176.1	0	0	0	106.7	A312 V313 S344	A312-I342 HydrophobicContact CB-CD1 3.83Å; A312-I342 HydrophobicContact CB-CG1 3.37Å; A312-I342 VanDerWaalsContact O-CD1 3.27Å; A312-I342 WeakPolarHBondContact O-CD1 3.14Å; V313-I342 PolarHBondContact O-N 2.97Å; V313-I342 VanDerWaalsContact O-N 3.14Å; I342-S344 PolarHBondContact O-N 2.83Å
343	N	48	Very low	49.8	Very low	97 Å²	97	107.1 Å²	107.1	52%	0.519	52%	0.516	S	S	.	.			trans	-65.9	106.1	166.4	-86	-18.7	0	0	0	108.3	L341 R345	L341-N343 PolarHBondContact O-N 3.49Å; L341-N343 VanDerWaalsContact O-N 3.08Å; N343-R345 PolarHBondContact O-N 3.21Å
344	S	41.1	Very low	47.3	Very low	64 Å²	64	112.5 Å²	112.5	45%	0.448	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-65.6	9.4	170.3	59.5	0	0	0	0	113.6	I342 F346 T347	I342-S344 PolarHBondContact O-N 2.83Å; S344-F346 PolarHBondContact O-N 3.35Å; S344-T347 PolarHBondContact O-N 3.31Å; S344-T347 VanDerWaalsContact O-N 3.1Å; S344-T347 PolarHBondContact O-OG1 2.94Å
345	R	41.1	Very low	44.6	Very low	182 Å²	182	122.1 Å²	122.1	69%	0.687	57%	0.572	S	S	*	*	G	3₁₀ helix	trans	-72.2	10.3	178.5	-130.8	-175.9	-70.1	-172.6	-1.3	114.4	N343	N343-R345 PolarHBondContact O-N 3.21Å
346	F	37.9	Very low	41.9	Very low	200 Å²	200	128.2 Å²	128.2	88%	0.877	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-103.9	31.9	162.4	-79.5	-78	0	0	0	112.8	S344	S344-F346 PolarHBondContact O-N 3.35Å
347	T	30.5	Very low	39.5	Very low	115 Å²	115	131.8 Å²	131.8	71%	0.706	63%	0.629	S	S	*	*			trans	-138.1	57	163.3	65.8	0	0	0	0	111.5	S344	S344-T347 PolarHBondContact O-N 3.31Å; S344-T347 VanDerWaalsContact O-N 3.1Å; S344-T347 PolarHBondContact O-OG1 2.94Å
348	T	30.5	Very low	37.4	Very low	127 Å²	127	135 Å²	135	78%	0.779	65%	0.647	S	S	*	*	S	Bend	trans	-115.2	108.3	144.6	55.6	0	0	0	0	106.4	K350	T348-K350 PolarHBondContact O-N 3.38Å
349	N	33.7	Very low	36	Very low	169 Å²	169	141 Å²	141	90%	0.904	67%	0.669	S	S	*	*			trans	-52.9	97.8	-179.9	-74.2	-31.4	0	0	0	112.2
350	K	32.9	Very low	34.7	Very low	186 Å²	186	147.9 Å²	147.9	81%	0.809	70%	0.704	S	S	*	*			trans	-166.4	126	148	-125.4	170.9	178	174	0	109.7	T348	T348-K350 PolarHBondContact O-N 3.38Å
351	H	26.9	Very low	33.5	Very low	155 Å²	155	150.2 Å²	150.2	72%	0.718	72%	0.718	S	S	*	*			trans	84.4	47.7	-175.3	-51.1	-63	0	0	0	117.2	R353	H351-R353 PolarHBondContact O-N 3.25Å; H351-R353 VanDerWaalsContact O-N 3.1Å
352	R	27.5	Very low	32.2	Very low	224 Å²	224	153.5 Å²	153.5	85%	0.845	74%	0.742	S	S	*	*			trans	-71.2	77.6	138.3	-173.9	-173.7	-83.4	-165.1	-4.4	107.3
353	R	26.8	Very low	30.7	Very low	196 Å²	196	156.6 Å²	156.6	74%	0.74	76%	0.76	S	S	*	*			trans	-81	113.3	155.7	-87.7	-172.1	-179.2	161.5	1.1	105.4	H351 Y355	H351-R353 PolarHBondContact O-N 3.25Å; H351-R353 VanDerWaalsContact O-N 3.1Å; R353-Y355 PolarHBondContact O-N 2.91Å
354	H	29.6	Very low	29.6	Very low	150 Å²	150	160.5 Å²	160.5	69%	0.694	77%	0.774	S	S	*	*			trans	-50.7	107.2	168.6	-77.4	-102.4	0	0	0	108.5	L356	H354-L356 VanDerWaalsContact C-N 3.27Å; H354-L356 PolarHBondContact O-N 3.17Å
355	Y	27.7	Very low	28.6	Very low	223 Å²	223	168.4 Å²	168.4	88%	0.875	80%	0.796	S	S	*	*			trans	-80.5	90.4	155.8	-73.7	-83.7	0	0	0	105.4	R353	R353-Y355 PolarHBondContact O-N 2.91Å
356	L	28.9	Very low	27.7	Very low	143 Å²	143	165.6 Å²	165.6	75%	0.749	80%	0.804	S	S	*	*			trans	-69.2	122.7	157.6	-145.1	83	0	0	0	105.6	H354 N358	H354-L356 VanDerWaalsContact C-N 3.27Å; H354-L356 PolarHBondContact O-N 3.17Å; L356-N358 PolarHBondContact O-N 3.16Å
357	P	26.7	Very low	26.8	Very low	111 Å²	111	161.3 Å²	161.3	72%	0.721	80%	0.8	S	S	*	*			trans	-78.8	108.7	179.7	28.7	-27.7	0	0	0	108.3
358	N	25.7	Very low	26.3	Very low	149 Å²	149	161.9 Å²	161.9	80%	0.797	80%	0.803	S	S	*	*			trans	-159.5	143.9	156.3	-96.6	-13.6	0	0	0	109.5	L356	L356-N358 PolarHBondContact O-N 3.16Å
359	E	28	Very low	25.8	Very low	184 Å²	184	160.3 Å²	160.3	86%	0.86	80%	0.797	S	S	*	*			trans	82.8	70.2	170.7	-53.1	-169.9	-177.5	0	0	116.7	F361	E359-F361 VanDerWaalsContact C-N 3.32Å
360	L	27.9	Very low	25.3	Very low	164 Å²	164	158.6 Å²	158.6	86%	0.859	79%	0.788	S	S	*	*			trans	-91.3	58.7	157.5	-159.5	96.2	0	0	0	110.1
361	F	24.9	Very low	24.7	Very low	180 Å²	180	157.7 Å²	157.7	79%	0.789	79%	0.787	S	S	*	*			trans	-147.4	101.4	165.4	-74.9	-72.9	0	0	0	110.4	E359 N363	E359-F361 VanDerWaalsContact C-N 3.32Å; F361-N363 PolarHBondContact O-N 3.42Å
362	P	25.6	Very low	24.3	Very low	117 Å²	117	154.9 Å²	154.9	76%	0.76	79%	0.785	S	S	*	*			trans	-82.7	100.2	165.4	14.1	1.7	0	0	0	108.7	E364	P362-E364 PolarHBondContact O-N 3.15Å
363	N	23.1	Very low	24.1	Very low	153 Å²	153	151.7 Å²	151.7	82%	0.818	78%	0.784	S	S	*	*			trans	-85.2	85.6	163.7	-79.9	-14	0	0	0	108.6	F361	F361-N363 PolarHBondContact O-N 3.42Å
364	E	23.7	Very low	24.5	Very low	178 Å²	178	146.8 Å²	146.8	83%	0.832	78%	0.778	S	S	*	*			trans	-109.3	88.6	164.7	-84.3	-179.2	164.4	0	0	108.8	P362	P362-E364 PolarHBondContact O-N 3.15Å
365	Y	22	Very low	24.1	Very low	230 Å²	230	146.3 Å²	146.3	90%	0.902	78%	0.78	S	S	*	*			trans	-138.8	96.4	156.1	-88.4	-78.8	0	0	0	107.6
366	S	21	Very low	23.9	Very low	123 Å²	123	143.3 Å²	143.3	86%	0.86	78%	0.779	S	S	*	*			trans	176.7	100.4	138.3	50.3	0	0	0	0	109.4
367	S	18.3	Very low	23.6	Very low	111 Å²	111	142.1 Å²	142.1	78%	0.776	78%	0.778	S	S	*	*			trans	-74.4	134.4	159.3	47.1	0	0	0	0	111.3
368	T	21	Very low	23.5	Very low	126 Å²	126	141.5 Å²	141.5	77%	0.773	78%	0.777	S	S	*	*			trans	179.9	108.1	143.2	43.9	0	0	0	0	105.9
369	S	20.9	Very low	23.4	Very low	95 Å²	95	142.4 Å²	142.4	66%	0.664	78%	0.78	S	S	*	*				62.7	140	72.3	71.6	0	0	0	0	114.9
370	D	21.4	Very low	23.1	Very low	133 Å²	133	140.8 Å²	140.8	71%	0.711	78%	0.778	S	S	*	*			trans	86.3	145	166.6	-52.4	-34.1	0	0	0	119.2
371	Q	20.2	Very low	22.9	Very low	166 Å²	166	138 Å²	138	78%	0.776	77%	0.772	S	S	*	*			cis	-171.8	144.1	-33.3	-116.3	-179.3	18.3	0	0	105.4
372	S	20.3	Very low	22.7	Very low	97 Å²	97	135.3 Å²	135.3	68%	0.678	77%	0.77	S	S	*	*			trans	58	121	143.4	65.9	0	0	0	0	124
373	N	22.7	Very low	22.5	Very low	157 Å²	157	136.5 Å²	136.5	84%	0.84	77%	0.771	S	S	*	*				74.4	165.1	127.9	-93	4	0	0	0	121.7
374	P	34.9	Very low	22.5	Very low	92 Å²	92	136.1 Å²	136.1	60%	0.597	77%	0.768	S	S	*	*				-133.6	-175.4	-57.3	36.6	-16.7	0	0	0	111.9
375	N	22.1	Very low	22.3	Very low	140 Å²	140	136.1 Å²	136.1	75%	0.749	77%	0.768	S	S	*	*			trans	72.6	101.9	164.6	-56.1	-13.9	0	0	0	117.4
376	D	23.7	Very low	22.3	Very low	160 Å²	160	133 Å²	133	86%	0.856	77%	0.766	S	S	*	*				-165.3	137.4	99.3	-95.6	-22.8	0	0	0	113.1
377	T	22.4	Very low	22.2	Very low	119 Å²	119	132.5 Å²	132.5	73%	0.73	76%	0.757	S	S	*	*			trans	-63.3	147.9	172.3	32.1	0	0	0	0	113.1
378	S	22.9	Very low	22.3	Very low	98 Å²	98	134.5 Å²	134.5	69%	0.685	76%	0.759	S	S	*	*			trans	60.4	108.2	146.5	66.2	0	0	0	0	118.7
379	L	24.4	Very low	22.7	Very low	167 Å²	167	133.5 Å²	133.5	87%	0.874	76%	0.755	S	S	*	*				175.1	141.6	99.5	-99.4	144.2	0	0	0	111.8
380	N	21.7	Very low	22.6	Very low	151 Å²	151	134.5 Å²	134.5	81%	0.807	76%	0.757	S	S	*	*			trans	-55.4	135.2	171.2	-64.9	-40.9	0	0	0	112.5
381	S	23.7	Very low	22.7	Very low	106 Å²	106	134.6 Å²	134.6	74%	0.741	76%	0.757	S	S	*	*				173.3	114.3	121.6	56.4	0	0	0	0	111.6
382	T	21.3	Very low	22.7	Very low	122 Å²	122	133.6 Å²	133.6	75%	0.748	75%	0.753	S	S	*	*			trans	18.1	126.2	139.3	51.3	0	0	0	0	120.7
383	N	20.5	Very low	22.8	Very low	143 Å²	143	137.3 Å²	137.3	77%	0.765	76%	0.757	S	S	*	*			trans	78.1	134.7	139.6	-70.6	-8.1	0	0	0	120.9
384	N	23.1	Very low	22.6	Very low	144 Å²	144	136.2 Å²	136.2	77%	0.77	75%	0.751	S	S	*	*			trans	99.7	106.3	154.6	-61.5	-17.1	0	0	0	117.8
385	H	19.9	Very low	22.1	Very low	178 Å²	178	139.4 Å²	139.4	82%	0.824	76%	0.758	S	S	*	*				10.3	122.5	127.9	-82.2	-78.7	0	0	0	116.3
386	I	21.9	Very low	21.9	Very low	166 Å²	166	138.6 Å²	138.6	85%	0.851	75%	0.753	S	S	*	*				-178.6	154.4	117.8	-86.7	152.1	0	0	0	109
387	T	19.6	Very low	21.9	Very low	111 Å²	111	140.9 Å²	140.9	68%	0.681	75%	0.751	S	S	*	*			trans	-78.3	153.9	-160.2	48.6	0	0	0	0	118.4
388	N	20.9	Very low	21.7	Very low	153 Å²	153	140.2 Å²	140.2	82%	0.818	75%	0.751	S	S	*	*			trans	65.7	163.9	145.5	-74.5	5.2	0	0	0	119.3
389	P	27.9	Very low	21.7	Very low	106 Å²	106	142.9 Å²	142.9	69%	0.688	76%	0.756	S	S	*	*			cis	-137	169.8	-12	34.6	-13.1	0	0	0	116.3
390	T	19.7	Very low	21.5	Very low	115 Å²	115	141.2 Å²	141.2	71%	0.706	75%	0.748	S	S	*	*			trans	22.5	158.2	142.4	64.3	0	0	0	0	125.7
391	D	22.4	Very low	21.5	Very low	135 Å²	135	140.6 Å²	140.6	72%	0.722	75%	0.745	S	S	*	*			trans	99.7	142.2	155	-62.2	-9.8	0	0	0	116.6
392	H	21	Very low	21.5	Very low	145 Å²	145	143.4 Å²	143.4	67%	0.671	75%	0.747	S	S	*	*			cis	-172.6	167.5	-23.6	-123.6	-68.5	0	0	0	104.2
393	F	22.2	Very low	21.5	Very low	175 Å²	175	146.3 Å²	146.3	77%	0.768	75%	0.752	S	S	*	*			trans	90.4	109.6	167.3	-64.3	-85.1	0	0	0	117.5
394	N	19.2	Very low	21.6	Very low	134 Å²	134	146.8 Å²	146.8	72%	0.717	75%	0.754	S	S	*	*				69.6	110.2	56	-73.9	-4.7	0	0	0	115.5
395	H	23.1	Very low	21.6	Very low	159 Å²	159	145.7 Å²	145.7	74%	0.736	75%	0.747	S	S	*	*				171.1	117.4	112.2	-98.8	-67.6	0	0	0	112.9
396	D	19.2	Very low	21.6	Very low	123 Å²	123	143 Å²	143	66%	0.658	74%	0.739	S	S	*	*				47.1	150	124.7	-60.2	-30.1	0	0	0	126.1
397	Y	23.4	Very low	21.7	Very low	208 Å²	208	141.9 Å²	141.9	82%	0.816	74%	0.735	S	S	*	*			trans	88.2	108.9	167.1	-69	-86.1	0	0	0	116.2
398	S	18.3	Very low	21.8	Very low	105 Å²	105	143 Å²	143	73%	0.734	74%	0.737	S	S	*	*			cis	61.1	110.3	49.8	-60.8	0	0	0	0	115.5
399	I	22.9	Very low	22	Very low	154 Å²	154	143.7 Å²	143.7	79%	0.79	74%	0.74	S	S	*	*				168.9	140.5	122.9	-83.1	158.8	0	0	0	110.8
400	D	19.6	Very low	21.7	Very low	132 Å²	132	145.8 Å²	145.8	71%	0.706	75%	0.746	S	S	*	*			trans	-59.7	153.9	-178.5	-50.2	-71.7	0	0	0	116.5
401	N	22.4	Very low	22	Very low	138 Å²	138	148.2 Å²	148.2	74%	0.738	76%	0.755	S	S	*	*				165.8	137.6	117.5	-86.5	-32.8	0	0	0	114.7
402	E	23.4	Very low	21.9	Very low	166 Å²	166	148.1 Å²	148.1	78%	0.776	76%	0.759	S	S	*	*			trans	63.9	110.8	139	-65.5	-179.3	154.3	0	0	122.8
403	Q	21.5	Very low	22	Very low	182 Å²	182	146.6 Å²	146.6	85%	0.85	76%	0.762	S	S	*	*				18.8	119.1	124.2	-60	-177.8	-10.6	0	0	118.6
404	L	22.9	Very low	22	Very low	154 Å²	154	143.8 Å²	143.8	81%	0.806	76%	0.764	S	S	*	*				179.5	134.5	116.9	-144.6	72.8	0	0	0	113.4
405	N	22.1	Very low	22	Very low	120 Å²	120	140.8 Å²	140.8	64%	0.642	77%	0.765	S	S	*	*			trans	50	128.2	142.4	-88.4	-18.7	0	0	0	125
406	N	20.6	Very low	21.8	Very low	122 Å²	122	139.6 Å²	139.6	65%	0.652	77%	0.773	S	S	*	*				45.2	114.3	125.6	-63.5	-16	0	0	0	119.4
407	N	23.2	Very low	21.7	Very low	142 Å²	142	139.3 Å²	139.3	76%	0.759	78%	0.781	S	S	*	*				174.7	137.6	100.1	-94.4	-30.9	0	0	0	112.1
408	N	21.4	Very low	21.7	Very low	136 Å²	136	134.9 Å²	134.9	73%	0.727	78%	0.78	S	S	*	*			trans	22	123.9	139.5	-63.9	-20.5	0	0	0	118.4
409	N	25.4	Very low	21.7	Very low	166 Å²	166	138.8 Å²	138.8	89%	0.888	79%	0.787	S	S	*	*				-159.5	126.1	116.3	-94.1	-25.8	0	0	0	112.3
410	N	21.1	Very low	22.1	Very low	150 Å²	150	136.9 Å²	136.9	80%	0.802	79%	0.785	S	S	*	*			trans	-60.3	140.7	164.8	-66.6	-39.3	0	0	0	110
411	N	26.3	Very low	22.2	Very low	166 Å²	166	140.9 Å²	140.9	89%	0.888	80%	0.796	S	S	*	*			trans	-165.1	94.8	143.6	-91.9	-20.3	0	0	0	109.8
412	T	20	Very low	21.9	Very low	134 Å²	134	139.3 Å²	139.3	82%	0.822	80%	0.796	S	S	*	*			trans	-71	147.6	148.5	42.2	0	0	0	0	109.4
413	P	22.9	Very low	21.8	Very low	113 Å²	113	140.1 Å²	140.1	73%	0.734	80%	0.797	S	S	*	*				-145	155.7	108.4	34	-17.8	0	0	0	115.6
414	S	22.8	Very low	21.7	Very low	116 Å²	116	139.1 Å²	139.1	81%	0.811	79%	0.792	S	S	*	*			trans	62.4	124.8	155.2	58	0	0	0	0	118
415	G	18.6	Very low	21.5	Very low	71 Å²	71	139 Å²	139	73%	0.732	79%	0.791	S	S	*	*			cis	100.4	96.1	25.8	0	0	0	0	0	110.2
416	C	19	Very low	21.5	Very low	133 Å²	133	139 Å²	139	90%	0.899	80%	0.798	S	S	*	*			trans	-177.8	112.5	142.9	-108.6	0	0	0	0	112
417	S	17.5	Very low	21.4	Very low	118 Å²	118	138.6 Å²	138.6	83%	0.825	80%	0.8	S	S	*	*			trans	-84.3	131.3	159.2	48	0	0	0	0	110
418	S	23.8	Very low	21.3	Very low	115 Å²	115	139.5 Å²	139.5	80%	0.804	80%	0.802	S	S	*	*			trans	-161.7	111.3	156.5	44.8	0	0	0	0	111.9
419	E	19	Very low	21.3	Very low	186 Å²	186	138.6 Å²	138.6	87%	0.869	80%	0.802	S	S	*	*			trans	-79	-179.6	148.4	-64.5	-179.5	149.7	0	0	108.9
420	P	31.5	Very low	21.3	Very low	115 Å²	115	136.3 Å²	136.3	75%	0.747	80%	0.798	S	S	*	*			cis	-129.4	160.2	-17.1	34	-17.8	0	0	0	113
421	K	20.3	Very low	21.4	Very low	215 Å²	215	137.8 Å²	137.8	94%	0.935	80%	0.803	S	S	*	*			trans	-148.2	139	150.6	-74.5	-164.2	-179.5	173.4	0	112.4
422	S	17.1	Very low	21.4	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	80%	0.8	S	S	*	*			trans	-84.8	174	-172.6	49.3	0	0	0	0	115.6
423	F	19.9	Very low	21.7	Very low	182 Å²	182	138.8 Å²	138.8	80%	0.798	80%	0.802	S	S	*	*			trans	76.5	136.7	161.2	-103.9	-127.8	0	0	0	115.1
424	E	20.2	Very low	21.8	Very low	161 Å²	161	139.1 Å²	139.1	75%	0.752	81%	0.806	S	S	*	*			cis	-167	163.2	20.2	-146.8	171.2	-165.1	0	0	110.1
425	L	17.8	Very low	21.8	Very low	151 Å²	151	139.2 Å²	139.2	79%	0.791	81%	0.805	S	S	*	*			trans	-84.6	135.4	-177.6	-174.6	83.7	0	0	0	111.8	T427	L425-T427 HydrophobicContact CD2-CG2 4.41Å
426	P	22.9	Very low	22.1	Very low	120 Å²	120	144 Å²	144	78%	0.779	81%	0.808	S	S	*	*			trans	-108.7	140.4	152.1	29.4	-17.2	0	0	0	111.6
427	T	18.8	Very low	22.4	Very low	114 Å²	114	143.7 Å²	143.7	70%	0.699	80%	0.797	S	S	*	*			trans	-86.5	171.8	-173.7	44.2	0	0	0	0	112.9	L425	L425-T427 HydrophobicContact CD2-CG2 4.41Å
428	M	20.5	Very low	22.8	Very low	161 Å²	161	147.6 Å²	147.6	79%	0.793	80%	0.799	S	S	*	*			trans	84.4	101	155.6	-71.2	-79.6	170.6	0	0	119.3
429	T	22.7	Very low	22.9	Very low	118 Å²	118	151.7 Å²	151.7	72%	0.724	80%	0.803	S	S	*	*				40.2	108.2	122.6	58.6	0	0	0	0	118.8
430	S	24.9	Very low	23.2	Very low	117 Å²	117	149.7 Å²	149.7	82%	0.818	80%	0.799	S	S	*	*				177.5	134.1	107	46.9	0	0	0	0	110.5	N432	S430-N432 PolarHBondContact O-N 2.81Å
431	M	22.5	Very low	23.3	Very low	181 Å²	181	150.3 Å²	150.3	89%	0.892	80%	0.802	S	S	*	*			trans	-51.8	125.2	167.7	-72.4	156.2	157.1	0	0	110.2
432	N	26.8	Very low	23.6	Very low	157 Å²	157	144 Å²	144	84%	0.84	79%	0.79	S	S	*	*			trans	-161.1	117.7	139.6	-95.3	-33.6	0	0	0	112	S430 C434	S430-N432 PolarHBondContact O-N 2.81Å; N432-C434 PolarHBondContact O-N 3.5Å
433	L	26.6	Very low	24.1	Very low	165 Å²	165	146.9 Å²	146.9	86%	0.864	80%	0.797	S	S	*	*			trans	-7.2	114.7	142.5	-110.7	70.1	0	0	0	114.4
434	C	23.9	Very low	24.5	Very low	119 Å²	119	145.5 Å²	145.5	80%	0.804	80%	0.799	S	S	*	*				176.4	131.6	102.4	-117.5	0	0	0	0	110.2	N432 H436	N432-C434 PolarHBondContact O-N 3.5Å; C434-H436 PolarHBondContact O-N 2.92Å
435	C	23.5	Very low	24.7	Very low	119 Å²	119	147.6 Å²	147.6	80%	0.804	81%	0.805	S	S	*	*			trans	-53.7	123.2	168	-59.8	0	0	0	0	110.5
436	H	24.7	Very low	25	Very low	171 Å²	171	146.4 Å²	146.4	79%	0.792	81%	0.808	S	S	*	*			trans	-160.8	135.2	139	-114.9	-82.5	0	0	0	109.8	C434	C434-H436 PolarHBondContact O-N 2.92Å
437	N	25.4	Very low	25.2	Very low	126 Å²	126	146 Å²	146	67%	0.674	81%	0.805	S	S	*	*	S	Bend	trans	92.7	104.9	160.2	-56.5	-15.2	0	0	0	117.9
438	K	25	Very low	25.5	Very low	200 Å²	200	144.9 Å²	144.9	87%	0.87	81%	0.808	S	S	*	*			trans	42.3	90.9	135.6	-68.4	-178.9	174.7	-179.3	0	115.6
439	F	26.4	Very low	25.7	Very low	201 Å²	201	145.1 Å²	145.1	88%	0.882	81%	0.81	S	S	*	*			trans	-137.1	109.8	158.8	-99.9	-82.9	0	0	0	113.8
440	N	25.8	Very low	25.8	Very low	145 Å²	145	148.4 Å²	148.4	78%	0.775	82%	0.815	S	S	*	*			trans	17.1	138.9	151.6	-99.8	-13.9	0	0	0	123.4	A442	N440-A442 PolarHBondContact O-N 3.21Å
441	P	34.7	Very low	25.8	Very low	127 Å²	127	148 Å²	148	83%	0.825	81%	0.812	S	S	*	*	S	Bend	trans	-89.6	77.5	178.7	38.3	-30.7	0	0	0	111.1
442	A	26	Very low	26	Very low	82 Å²	82	144.6 Å²	144.6	68%	0.678	81%	0.806	S	S	*	*			trans	-158.7	67	169.5	0	0	0	0	0	111.1	N440	N440-A442 PolarHBondContact O-N 3.21Å
443	N	27.2	Very low	25.9	Very low	167 Å²	167	147.1 Å²	147.1	89%	0.893	81%	0.806	S	S	*	*			trans	-170.1	122.2	138.3	-100.5	-23.3	0	0	0	111.6
444	N	27.5	Very low	25.9	Very low	154 Å²	154	144.3 Å²	144.3	82%	0.824	80%	0.799	S	S	*	*			trans	-55.4	145.5	170	-75.1	-41.3	0	0	0	111
445	K	24.6	Very low	26.2	Very low	204 Å²	204	143.7 Å²	143.7	89%	0.887	80%	0.797	S	S	*	*			trans	92.7	73	172	-52.9	175.4	-177.8	178.6	0	115.8
446	C	24.6	Very low	26.7	Very low	126 Å²	126	140.4 Å²	140.4	85%	0.851	78%	0.775	S	S	*	*			trans	-93.6	125.4	134.5	-66.3	0	0	0	0	107	A448	C446-A448 PolarHBondContact O-N 3.31Å
447	P	26.2	Very low	27.8	Very low	112 Å²	112	136.6 Å²	136.6	73%	0.727	76%	0.764	S	S	*	*			trans	-65	137.5	-179.3	27.4	-30.4	0	0	0	108.7	I449	P447-I449 VanDerWaalsContact C-N 3.31Å; P447-I449 PolarHBondContact O-N 2.87Å
448	A	25.7	Very low	28.9	Very low	90 Å²	90	135.9 Å²	135.9	74%	0.744	76%	0.76	S	S	*	*			trans	-57.3	93.1	170.3	0	0	0	0	0	109.8	C446 F450	C446-A448 PolarHBondContact O-N 3.31Å; A448-F450 PolarHBondContact O-N 3.07Å
449	I	26	Very low	30	Very low	166 Å²	166	133.6 Å²	133.6	85%	0.851	75%	0.752	S	S	*	*			trans	-84.9	64.6	150.4	-51.8	178	0	0	0	105.9	P447	P447-I449 VanDerWaalsContact C-N 3.31Å; P447-I449 PolarHBondContact O-N 2.87Å
450	F	24.9	Very low	31.4	Very low	187 Å²	187	126.5 Å²	126.5	82%	0.82	72%	0.722	S	S	*	*			trans	-127	136.6	164.1	-113.5	-83.6	0	0	0	106.7	A448	A448-F450 PolarHBondContact O-N 3.07Å
451	S	24.7	Very low	33.7	Very low	109 Å²	109	122.5 Å²	122.5	76%	0.762	71%	0.705	S	S	*	*			trans	85.2	71.5	164.6	77.2	0	0	0	0	118.7
452	S	25.1	Very low	36	Very low	109 Å²	109	120 Å²	120	76%	0.762	69%	0.688	S	S	*	*	S	Bend	trans	-149.3	45.7	144.5	72.1	0	0	0	0	113.1
453	Y	25.2	Very low	38.9	Very low	211 Å²	211	120.8 Å²	120.8	83%	0.827	67%	0.674	S	S	*	*	S	Bend	trans	-165.5	68.8	162.1	-119.8	-83.3	0	0	0	111.1
454	S	27.4	Very low	41.6	Very low	105 Å²	105	114.6 Å²	114.6	73%	0.734	64%	0.64	S	S	*	*	S	Bend	trans	-143.3	1.1	168.5	68.4	0	0	0	0	115.8
455	S	28.8	Very low	44.3	Very low	107 Å²	107	109.6 Å²	109.6	75%	0.748	62%	0.615	S	S	*	*	S	Bend	trans	-100.6	-10.1	175.6	51.8	0	0	0	0	114.9	T457	S455-T457 PolarHBondContact O-N 3.3Å
456	S	35	Very low	47.4	Very low	50 Å²	50	106 Å²	106	35%	0.35	60%	0.596	S	S	.	*	H	α-helix	trans	-81.8	-4.2	-174.8	-169.2	0	0	0	0	115.6	N458 E460	S456-N458 PolarHBondContact O-N 3.36Å; S456-E460 WeakPolarHBondContact O-CB 3.48Å; S456-E460 PolarHBondContact O-N 2.89Å; S456-E460 VanDerWaalsContact O-N 3.08Å
457	T	47.4	Very low	50.5	Low	91 Å²	91	104 Å²	104	56%	0.558	58%	0.577	S	S	*	*	H	α-helix	trans	-73.4	-24	-175.6	56.7	0	0	0	0	114.1	S455	S455-T457 PolarHBondContact O-N 3.3Å
458	N	49.5	Very low	53.4	Low	111 Å²	111	105.3 Å²	105.3	59%	0.594	57%	0.567	S	S	*	*	H	α-helix	trans	-81	-49.9	177.6	-74.3	-15.8	0	0	0	111.8	S456 E460 S461 V462	S456-N458 PolarHBondContact O-N 3.36Å; N458-E460 VanDerWaalsContact C-N 3.28Å; N458-E460 PolarHBondContact O-N 3.48Å; N458-S461 PolarHBondContact O-N 2.83Å; N458-S461 PolarHBondContact O-OG 3.12Å; N458-V462 WeakPolarHBondContact O-CG2 3.46Å; N458-V462 PolarHBondContact O-N 3.24Å
459	H	46.4	Very low	56.4	Low	151 Å²	151	107.5 Å²	107.5	70%	0.699	56%	0.556	S	S	*	*	H	α-helix	trans	-63	-36.4	176.9	-81.7	-87.5	0	0	0	111.9	S461 V462 Y463	H459-S461 PolarHBondContact O-N 3.15Å; H459-V462 PolarHBondContact O-N 3.06Å; H459-V462 VanDerWaalsContact O-N 3.13Å; H459-Y463 WeakPolarHBondContact O-CD1 3.46Å; H459-Y463 PolarHBondContact O-N 3.36Å
460	E	57.1	Low	59.6	Low	53 Å²	53	105.4 Å²	105.4	25%	0.248	54%	0.541	C	S	.	.	H	α-helix	trans	-60.1	-36.1	177	-172.9	166.7	-159.8	0	0	112.6	K330 S456 N458 Y463 L464	K330-E460 WeakPolarHBondContact CE-OE1 3.06Å; K330-E460 IonicContact NZ-OE1 2.86Å; K330-E460 PolarHBondContact NZ-OE1 2.99Å; S456-E460 WeakPolarHBondContact O-CB 3.48Å; S456-E460 PolarHBondContact O-N 2.89Å; S456-E460 VanDerWaalsContact O-N 3.08Å; N458-E460 VanDerWaalsContact C-N 3.28Å; N458-E460 PolarHBondContact O-N 3.48Å; E460-Y463 HydrophobicContact CB-CE1 4Å; E460-Y463 HydrophobicContact CG-CE1 3.8Å; E460-Y463 WeakPolarHBondContact O-CD1 3.48Å; E460-Y463 WeakPolarHBondContact O-CE1 3.49Å; E460-L464 HydrophobicContact CG-CD1 4.3Å; E460-L464 WeakPolarHBondContact O-CD1 3.38Å; E460-L464 WeakPolarHBondContact O-CG 3.33Å
461	S	72.9	Confident	62.7	Low	61 Å²	61	98.1 Å²	98.1	43%	0.427	51%	0.508	S	S	.	.	H	α-helix	trans	-73.1	-32.2	176.2	74.1	0	0	0	0	113.9	N458 H459 T465	N458-S461 PolarHBondContact O-N 2.83Å; N458-S461 PolarHBondContact O-OG 3.12Å; H459-S461 PolarHBondContact O-N 3.15Å; S461-T465 WeakPolarHBondContact O-CB 3.38Å; S461-T465 PolarHBondContact O-N 3.41Å; S461-T465 PolarHBondContact O-OG1 3.22Å
462	V	84	Confident	65.8	Low	75 Å²	75	97.4 Å²	97.4	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-75.3	-47.6	-175.8	177.2	0	0	0	0	111	N458 H459 L464 T465 W466	N458-V462 WeakPolarHBondContact O-CG2 3.46Å; N458-V462 PolarHBondContact O-N 3.24Å; H459-V462 PolarHBondContact O-N 3.06Å; H459-V462 VanDerWaalsContact O-N 3.13Å; V462-L464 PolarHBondContact O-N 2.97Å; V462-T465 WeakPolarHBondContact O-CB 3.27Å; V462-T465 PolarHBondContact O-N 3.13Å; V462-W466 PolarHBondContact O-N 3.18Å; V462-W466 VanDerWaalsContact O-N 3.07Å
463	Y	86.5	Confident	68.9	Low	98 Å²	98	96.4 Å²	96.4	38%	0.384	48%	0.477	S	S	.	.	H	α-helix	trans	-65.5	-41.5	-178.5	84.1	-105.1	0	0	0	111.6	H459 E460 T465 W466 L467	H459-Y463 WeakPolarHBondContact O-CD1 3.46Å; H459-Y463 PolarHBondContact O-N 3.36Å; E460-Y463 HydrophobicContact CB-CE1 4Å; E460-Y463 HydrophobicContact CG-CE1 3.8Å; E460-Y463 WeakPolarHBondContact O-CD1 3.48Å; E460-Y463 WeakPolarHBondContact O-CE1 3.49Å; Y463-T465 PolarHBondContact O-N 3.49Å; Y463-W466 PolarHBondContact O-N 3.4Å; Y463-L467 HydrophobicContact CD2-CD1 3.69Å; Y463-L467 HydrophobicContact CD2-CG 4.47Å; Y463-L467 HydrophobicContact CE2-CD1 3.96Å; Y463-L467 WeakPolarHBondContact O-CG 3.37Å; Y463-L467 PolarHBondContact O-N 3.38Å
464	L	84.9	Confident	72.1	Confident	36 Å²	36	91.7 Å²	91.7	19%	0.188	46%	0.458	C	S	.	.	H	α-helix	trans	-61.5	-36.8	175.9	-73	172.2	0	0	0	111.3	V334 E460 V462 L467 R468	V334-L464 HydrophobicContact CG2-CD2 3.83Å; E460-L464 HydrophobicContact CG-CD1 4.3Å; E460-L464 WeakPolarHBondContact O-CD1 3.38Å; E460-L464 WeakPolarHBondContact O-CG 3.33Å; V462-L464 PolarHBondContact O-N 2.97Å; L464-L467 PolarHBondContact O-N 3.27Å; L464-R468 WeakPolarHBondContact O-CB 3.42Å; L464-R468 PolarHBondContact O-N 3.11Å
465	T	83.7	Confident	75.1	Confident	50 Å²	50	87 Å²	87	31%	0.307	43%	0.425	S	S	.	.	H	α-helix	trans	-63.9	-42.9	176.1	-61.9	0	0	0	0	111.6	S461 V462 Y463 R469	S461-T465 WeakPolarHBondContact O-CB 3.38Å; S461-T465 PolarHBondContact O-N 3.41Å; S461-T465 PolarHBondContact O-OG1 3.22Å; V462-T465 WeakPolarHBondContact O-CB 3.27Å; V462-T465 PolarHBondContact O-N 3.13Å; Y463-T465 PolarHBondContact O-N 3.49Å; T465-R469 WeakPolarHBondContact O-CG 3.29Å; T465-R469 PolarHBondContact O-N 2.98Å
466	W	88.8	Confident	78.1	Confident	129 Å²	129	83.6 Å²	83.6	49%	0.489	40%	0.4	S	S	.	.	H	α-helix	trans	-68.3	-44.1	175.9	-81.1	105.7	0	0	0	112.5	V462 Y463 R468 R469 F470	V462-W466 PolarHBondContact O-N 3.18Å; V462-W466 VanDerWaalsContact O-N 3.07Å; Y463-W466 PolarHBondContact O-N 3.4Å; W466-R468 VanDerWaalsContact C-N 3.28Å; W466-R468 PolarHBondContact O-N 3.13Å; W466-R469 WeakPolarHBondContact O-CA 3.28Å; W466-R469 WeakPolarHBondContact O-CB 3.24Å; W466-R469 PolarHBondContact O-N 3.34Å; W466-F470 HydrophobicContact CB-CD2 4.32Å; W466-F470 HydrophobicContact CB-CE2 4.05Å; W466-F470 AromaticContact CE3-CE2 3.93Å; W466-F470 HydrophobicContact CE3-CE2 3.93Å; W466-F470 AromaticContact CE3-CZ 3.95Å; W466-F470 HydrophobicContact CE3-CZ 3.95Å; W466-F470 HydrophobicContact CZ3-CZ 4.41Å; W466-F470 WeakPolarHBondContact O-CD2 3.42Å; W466-F470 PolarHBondContact O-N 3.13Å
467	L	90.1	Very high	80.9	Confident	84 Å²	84	86.5 Å²	86.5	44%	0.44	41%	0.411	S	S	.	.	H	α-helix	trans	-55.7	-43.7	175	-75.3	174.9	0	0	0	111.9	V334 Y463 L464 R469 F470 Y471	V334-L467 HydrophobicContact CG1-CB 4.02Å; V334-L467 HydrophobicContact CG2-CB 4.16Å; Y463-L467 HydrophobicContact CD2-CD1 3.69Å; Y463-L467 HydrophobicContact CD2-CG 4.47Å; Y463-L467 HydrophobicContact CE2-CD1 3.96Å; Y463-L467 WeakPolarHBondContact O-CG 3.37Å; Y463-L467 PolarHBondContact O-N 3.38Å; L464-L467 PolarHBondContact O-N 3.27Å; L467-R469 VanDerWaalsContact C-N 3.31Å; L467-R469 PolarHBondContact O-N 2.96Å; L467-F470 PolarHBondContact O-N 2.97Å; L467-Y471 WeakPolarHBondContact O-CB 3.46Å; L467-Y471 PolarHBondContact O-N 2.91Å
468	R	88	Confident	83.1	Confident	139 Å²	139	83 Å²	83	53%	0.525	39%	0.388	S	S	.	.	H	α-helix	trans	-62.1	-38.1	175.6	-174	177.2	64.7	-174.2	-1.2	112.5	L464 W466 F472	L464-R468 WeakPolarHBondContact O-CB 3.42Å; L464-R468 PolarHBondContact O-N 3.11Å; W466-R468 VanDerWaalsContact C-N 3.28Å; W466-R468 PolarHBondContact O-N 3.13Å; R468-F472 VanDerWaalsContact O-CB 3.3Å; R468-F472 WeakPolarHBondContact O-CB 3.45Å; R468-F472 PolarHBondContact O-N 2.99Å
469	R	89.1	Confident	85.1	Confident	136 Å²	136	77.7 Å²	77.7	51%	0.513	36%	0.36	S	S	.	.	H	α-helix	trans	-68	-43.2	175.6	-72.8	177.1	173.4	-176.1	-3	111.8	T465 W466 L467 F472 I473	T465-R469 WeakPolarHBondContact O-CG 3.29Å; T465-R469 PolarHBondContact O-N 2.98Å; W466-R469 WeakPolarHBondContact O-CA 3.28Å; W466-R469 WeakPolarHBondContact O-CB 3.24Å; W466-R469 PolarHBondContact O-N 3.34Å; L467-R469 VanDerWaalsContact C-N 3.31Å; L467-R469 PolarHBondContact O-N 2.96Å; R469-F472 WeakPolarHBondContact O-CB 3.45Å; R469-F472 PolarHBondContact O-N 3.44Å; R469-I473 VanDerWaalsContact O-CG1 3.29Å; R469-I473 WeakPolarHBondContact O-CG1 3.48Å; R469-I473 PolarHBondContact O-N 3.34Å
470	F	92.5	Very high	87.3	Confident	121 Å²	121	73.8 Å²	73.8	53%	0.531	35%	0.347	S	S	.	.	H	α-helix	trans	-64.9	-45.5	177.7	-72.2	-57.7	0	0	0	111.9	W466 L467 F472 I473 Y474	W466-F470 HydrophobicContact CB-CD2 4.32Å; W466-F470 HydrophobicContact CB-CE2 4.05Å; W466-F470 AromaticContact CE3-CE2 3.93Å; W466-F470 HydrophobicContact CE3-CE2 3.93Å; W466-F470 AromaticContact CE3-CZ 3.95Å; W466-F470 HydrophobicContact CE3-CZ 3.95Å; W466-F470 HydrophobicContact CZ3-CZ 4.41Å; W466-F470 WeakPolarHBondContact O-CD2 3.42Å; W466-F470 PolarHBondContact O-N 3.13Å; L467-F470 PolarHBondContact O-N 2.97Å; F470-F472 VanDerWaalsContact C-N 3.26Å; F470-F472 PolarHBondContact O-N 3.45Å; F470-I473 PolarHBondContact O-N 3.44Å; F470-Y474 VanDerWaalsContact O-CB 3.29Å; F470-Y474 WeakPolarHBondContact O-CB 3.48Å; F470-Y474 PolarHBondContact O-N 3.14Å
471	Y	90.5	Very high	89	Confident	35 Å²	35	73.8 Å²	73.8	14%	0.137	35%	0.352	C	S	.	.	H	α-helix	trans	-59.1	-40	173.7	-179.6	-101.8	0	0	0	111.5	I335 L467 Y474 E475 D557 R561	I335-Y471 HydrophobicContact CB-CE1 4.44Å; I335-Y471 HydrophobicContact CG2-CE1 4.26Å; I335-Y471 WeakPolarHBondContact O-CE1 3.39Å; L467-Y471 WeakPolarHBondContact O-CB 3.46Å; L467-Y471 PolarHBondContact O-N 2.91Å; Y471-Y474 PolarHBondContact O-N 3.05Å; Y471-E475 WeakPolarHBondContact CE1-OE2 3.13Å; Y471-E475 WeakPolarHBondContact O-CB 3.48Å; Y471-E475 PolarHBondContact O-N 2.78Å; Y471-E475 PolarHBondContact OH-OE2 3.1Å; Y471-D557 WeakPolarHBondContact CE2-OD1 3.49Å; Y471-D557 PolarHBondContact OH-OD1 2.83Å; Y471-R561 PolarHBondContact OH-NE 2.91Å; Y471-R561 PolarHBondContact OH-NH2 3.2Å
472	F	88.2	Confident	90	Very high	94 Å²	94	70.9 Å²	70.9	41%	0.412	33%	0.332	S	S	.	.	H	α-helix	trans	-60	-49.1	174.1	177	-96.3	0	0	0	113.4	R468 R469 F470 T476 R637	R468-F472 VanDerWaalsContact O-CB 3.3Å; R468-F472 WeakPolarHBondContact O-CB 3.45Å; R468-F472 PolarHBondContact O-N 2.99Å; R469-F472 WeakPolarHBondContact O-CB 3.45Å; R469-F472 PolarHBondContact O-N 3.44Å; F470-F472 VanDerWaalsContact C-N 3.26Å; F470-F472 PolarHBondContact O-N 3.45Å; F472-T476 WeakPolarHBondContact O-CB 3.5Å; F472-T476 PolarHBondContact O-N 3.41Å; F472-T476 PolarHBondContact O-OG1 3.33Å; F472-R637 VanDerWaalsContact CD2-NE 3.33Å; F472-R637 HydrophobicContact CE2-CB 4.34Å
473	I	91.9	Very high	90.4	Very high	88 Å²	88	68.2 Å²	68.2	45%	0.451	32%	0.316	S	S	.	.	H	α-helix	trans	-63	-46.6	178.6	-67.3	163.3	0	0	0	110	R469 F470 T476 L477	R469-I473 VanDerWaalsContact O-CG1 3.29Å; R469-I473 WeakPolarHBondContact O-CG1 3.48Å; R469-I473 PolarHBondContact O-N 3.34Å; F470-I473 PolarHBondContact O-N 3.44Å; I473-T476 PolarHBondContact O-N 2.81Å; I473-L477 HydrophobicContact CG2-CD1 3.86Å; I473-L477 HydrophobicContact CG2-CG 4.34Å; I473-L477 WeakPolarHBondContact O-CB 3.47Å; I473-L477 WeakPolarHBondContact O-CG 3.38Å; I473-L477 PolarHBondContact O-N 3.49Å
474	Y	92.6	Very high	90.6	Very high	112 Å²	112	64.9 Å²	64.9	44%	0.439	31%	0.312	S	S	.	.	H	α-helix	trans	-55.8	-53.9	177.1	167.4	-97.9	0	0	0	112.3	F470 Y471 T476 L477 I478	F470-Y474 VanDerWaalsContact O-CB 3.29Å; F470-Y474 WeakPolarHBondContact O-CB 3.48Å; F470-Y474 PolarHBondContact O-N 3.14Å; Y471-Y474 PolarHBondContact O-N 3.05Å; Y474-T476 VanDerWaalsContact C-N 3.29Å; Y474-T476 PolarHBondContact O-N 3.5Å; Y474-L477 PolarHBondContact O-N 3.4Å; Y474-I478 HydrophobicContact CD1-CD1 4.27Å; Y474-I478 HydrophobicContact CD2-CD1 3.98Å; Y474-I478 HydrophobicContact CE1-CD1 3.63Å; Y474-I478 HydrophobicContact CE2-CD1 3.3Å; Y474-I478 HydrophobicContact CE2-CG1 4.21Å; Y474-I478 HydrophobicContact CG-CD1 4.43Å; Y474-I478 PolarHBondContact O-N 3.11Å; Y474-I478 WeakPolarHBondContact OH-CD1 3.43Å
475	E	89.9	Confident	91	Very high	6 Å²	6	63.9 Å²	63.9	3%	0.028	31%	0.307	C	S	.	.	H	α-helix	trans	-65.9	-34.6	-179	177.1	179.7	179.5	0	0	111	Y471 I479 R561 R637	Y471-E475 WeakPolarHBondContact CE1-OE2 3.13Å; Y471-E475 WeakPolarHBondContact O-CB 3.48Å; Y471-E475 PolarHBondContact O-N 2.78Å; Y471-E475 PolarHBondContact OH-OE2 3.1Å; E475-I479 HydrophobicContact CG-CD1 3.53Å; E475-I479 HydrophobicContact CG-CG1 4.39Å; E475-I479 WeakPolarHBondContact O-CB 3.47Å; E475-I479 WeakPolarHBondContact O-CD1 3.47Å; E475-I479 WeakPolarHBondContact O-CG1 3.3Å; E475-I479 PolarHBondContact O-N 2.92Å; E475-R561 IonicContact OE1-NH2 3.64Å; E475-R561 PolarHBondContact OE1-NH2 2.95Å; E475-R561 IonicContact OE2-NH2 2.62Å; E475-R561 PolarHBondContact OE2-NH2 3.31Å; E475-R637 VanDerWaalsContact CB-NH2 3.32Å; E475-R637 VanDerWaalsContact CD-CZ 3.42Å; E475-R637 IonicContact OE1-CZ 2.83Å; E475-R637 IonicContact OE1-NH2 3.97Å; E475-R637 IonicContact OE2-CZ 3.52Å; E475-R637 IonicContact OE2-NE 3.05Å; E475-R637 IonicContact OE2-NH1 2.64Å; E475-R637 PolarHBondContact OE2-NH1 3.43Å; E475-R637 IonicContact OE2-NH2 3.69Å; E475-R637 PolarHBondContact OE2-NH2 3.43Å
476	T	91.4	Very high	91.3	Very high	36 Å²	36	62.8 Å²	62.8	22%	0.221	30%	0.298	C	S	.	.	H	α-helix	trans	-65.3	-45.6	174.8	-54.6	0	0	0	0	112.3	F472 I473 Y474 T480 L634	F472-T476 WeakPolarHBondContact O-CB 3.5Å; F472-T476 PolarHBondContact O-N 3.41Å; F472-T476 PolarHBondContact O-OG1 3.33Å; I473-T476 PolarHBondContact O-N 2.81Å; Y474-T476 VanDerWaalsContact C-N 3.29Å; Y474-T476 PolarHBondContact O-N 3.5Å; T476-T480 HydrophobicContact CG2-CG2 4.34Å; T476-T480 WeakPolarHBondContact O-CB 3.27Å; T476-T480 VanDerWaalsContact O-CG2 3.27Å; T476-T480 WeakPolarHBondContact O-CG2 3.33Å; T476-T480 PolarHBondContact O-N 3.24Å; T476-T480 PolarHBondContact O-OG1 2.76Å; T476-L634 HydrophobicContact CG2-CD2 4.27Å
477	L	93.4	Very high	91.3	Very high	111 Å²	111	61.9 Å²	61.9	58%	0.581	30%	0.3	S	S	*	.	H	α-helix	trans	-63.9	-44	177.2	-72.9	174.3	0	0	0	111.8	I473 Y474 T480 S481	I473-L477 HydrophobicContact CG2-CD1 3.86Å; I473-L477 HydrophobicContact CG2-CG 4.34Å; I473-L477 WeakPolarHBondContact O-CB 3.47Å; I473-L477 WeakPolarHBondContact O-CG 3.38Å; I473-L477 PolarHBondContact O-N 3.49Å; Y474-L477 PolarHBondContact O-N 3.4Å; L477-T480 PolarHBondContact O-OG1 2.72Å; L477-S481 WeakPolarHBondContact O-CB 3.32Å; L477-S481 PolarHBondContact O-N 2.92Å
478	I	93.3	Very high	91.4	Very high	17 Å²	17	60.9 Å²	60.9	9%	0.087	30%	0.295	C	S	.	.	H	α-helix	trans	-62.3	-48.7	177.6	-75.9	-174.6	0	0	0	111.4	Y474 S481 A482 F550 A553 I554	Y474-I478 HydrophobicContact CD1-CD1 4.27Å; Y474-I478 HydrophobicContact CD2-CD1 3.98Å; Y474-I478 HydrophobicContact CE1-CD1 3.63Å; Y474-I478 HydrophobicContact CE2-CD1 3.3Å; Y474-I478 HydrophobicContact CE2-CG1 4.21Å; Y474-I478 HydrophobicContact CG-CD1 4.43Å; Y474-I478 PolarHBondContact O-N 3.11Å; Y474-I478 WeakPolarHBondContact OH-CD1 3.43Å; I478-S481 PolarHBondContact O-N 3.23Å; I478-A482 WeakPolarHBondContact O-CB 3.42Å; I478-A482 PolarHBondContact O-N 3.33Å; I478-F550 HydrophobicContact CG2-CD1 4.17Å; I478-A553 HydrophobicContact CD1-CB 3.95Å; I478-I554 HydrophobicContact CG2-CD1 4.4Å; I478-I554 HydrophobicContact CG2-CG1 4.01Å
479	I	92.4	Very high	91.3	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-66.2	-45.6	-176.3	-69.7	163.3	0	0	0	110.9	E475 A482 V483 R630 L631 R633 L634	E475-I479 HydrophobicContact CG-CD1 3.53Å; E475-I479 HydrophobicContact CG-CG1 4.39Å; E475-I479 WeakPolarHBondContact O-CB 3.47Å; E475-I479 WeakPolarHBondContact O-CD1 3.47Å; E475-I479 WeakPolarHBondContact O-CG1 3.3Å; E475-I479 PolarHBondContact O-N 2.92Å; I479-A482 PolarHBondContact O-N 3Å; I479-V483 WeakPolarHBondContact O-CG2 3.35Å; I479-V483 PolarHBondContact O-N 3.32Å; I479-R630 HydrophobicContact CG2-CB 4.23Å; I479-R630 WeakPolarHBondContact CG2-O 3.37Å; I479-L631 HydrophobicContact CG2-CD2 4.02Å; I479-R633 HydrophobicContact CD1-CB 3.65Å; I479-R633 HydrophobicContact CD1-CG 4.35Å; I479-L634 HydrophobicContact CB-CD1 4.43Å; I479-L634 HydrophobicContact CB-CD2 4.36Å; I479-L634 HydrophobicContact CB-CG 4.41Å; I479-L634 HydrophobicContact CD1-CD2 3.61Å; I479-L634 HydrophobicContact CD1-CG 3.95Å; I479-L634 HydrophobicContact CG2-CD1 3.94Å; I479-L634 HydrophobicContact CG2-CG 4.06Å
480	T	91.9	Very high	91.2	Very high	69 Å²	69	51.8 Å²	51.8	42%	0.423	27%	0.271	S	S	.	.	H	α-helix	trans	-64.9	-41.7	179.8	52.2	0	0	0	0	111.5	T476 L477 G484 L634	T476-T480 HydrophobicContact CG2-CG2 4.34Å; T476-T480 WeakPolarHBondContact O-CB 3.27Å; T476-T480 VanDerWaalsContact O-CG2 3.27Å; T476-T480 WeakPolarHBondContact O-CG2 3.33Å; T476-T480 PolarHBondContact O-N 3.24Å; T476-T480 PolarHBondContact O-OG1 2.76Å; L477-T480 PolarHBondContact O-OG1 2.72Å; T480-G484 PolarHBondContact O-N 2.64Å; T480-L634 HydrophobicContact CG2-CD1 4.36Å
481	S	93.7	Very high	91	Very high	52 Å²	52	48.8 Å²	48.8	36%	0.364	26%	0.263	S	S	.	.	H	α-helix	trans	-65.9	-41	174.9	-170.4	0	0	0	0	112.4	L477 I478 G484 V485 F550	L477-S481 WeakPolarHBondContact O-CB 3.32Å; L477-S481 PolarHBondContact O-N 2.92Å; I478-S481 PolarHBondContact O-N 3.23Å; S481-G484 PolarHBondContact O-N 3.35Å; S481-V485 WeakPolarHBondContact O-CG2 3.32Å; S481-V485 PolarHBondContact O-N 3.03Å; S481-F550 WeakPolarHBondContact OG-CE2 3.11Å; S481-F550 WeakPolarHBondContact OG-CZ 3.17Å
482	A	92.8	Very high	90.7	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-64.2	-43.5	178.6	0	0	0	0	0	112.1	I478 I479 G484 V485 F486 F550	I478-A482 WeakPolarHBondContact O-CB 3.42Å; I478-A482 PolarHBondContact O-N 3.33Å; I479-A482 PolarHBondContact O-N 3Å; A482-G484 VanDerWaalsContact C-N 3.32Å; A482-V485 PolarHBondContact O-N 3.03Å; A482-F486 PolarHBondContact O-N 3.08Å; A482-F550 HydrophobicContact CB-CB 3.78Å; A482-F550 HydrophobicContact CB-CD2 4.13Å; A482-F550 HydrophobicContact CB-CG 3.91Å
483	V	92.2	Very high	90.6	Very high	20 Å²	20	58.5 Å²	58.5	12%	0.121	31%	0.312	C	S	.	.	H	α-helix	trans	-66.3	-38	174.1	175.1	0	0	0	0	110.6	I479 F486 M487 L631	I479-V483 WeakPolarHBondContact O-CG2 3.35Å; I479-V483 PolarHBondContact O-N 3.32Å; V483-F486 WeakPolarHBondContact O-CB 3.14Å; V483-F486 PolarHBondContact O-N 2.89Å; V483-M487 VanDerWaalsContact O-CG 3.29Å; V483-M487 WeakPolarHBondContact O-CG 3.21Å; V483-M487 PolarHBondContact O-N 2.93Å; V483-L631 HydrophobicContact CG2-CD2 4.01Å; V483-L631 HydrophobicContact CG2-CG 3.98Å
484	G	92.7	Very high	90.5	Very high	28 Å²	28	58 Å²	58	29%	0.289	31%	0.307	S	S	.	.	H	α-helix	trans	-59.8	-47.4	173.5	0	0	0	0	0	112.8	T480 S481 A482 F486 M487 L488	T480-G484 PolarHBondContact O-N 2.64Å; S481-G484 PolarHBondContact O-N 3.35Å; A482-G484 VanDerWaalsContact C-N 3.32Å; G484-F486 VanDerWaalsContact C-N 3.32Å; G484-F486 PolarHBondContact O-N 3.25Å; G484-M487 PolarHBondContact O-N 2.72Å; G484-L488 VanDerWaalsContact O-CD1 3.23Å; G484-L488 WeakPolarHBondContact O-CD1 3.38Å; G484-L488 PolarHBondContact O-N 3.28Å
485	V	91.9	Very high	90.1	Very high	15 Å²	15	56 Å²	56	9%	0.091	30%	0.299	C	S	.	.	H	α-helix	trans	-61.3	-41.5	175.8	167.7	0	0	0	0	111.4	S481 A482 L488 S489 L543 M546 D547 F550	S481-V485 WeakPolarHBondContact O-CG2 3.32Å; S481-V485 PolarHBondContact O-N 3.03Å; A482-V485 PolarHBondContact O-N 3.03Å; V485-L488 PolarHBondContact O-N 3.01Å; V485-S489 WeakPolarHBondContact O-CB 3.21Å; V485-S489 PolarHBondContact O-N 3.32Å; V485-L543 HydrophobicContact CG1-CD2 4Å; V485-L543 HydrophobicContact CG2-CD2 4.45Å; V485-M546 HydrophobicContact CG1-CB 4.19Å; V485-M546 HydrophobicContact CG2-CB 4.07Å; V485-D547 HydrophobicContact CG1-CB 4.15Å; V485-F550 HydrophobicContact CG2-CD2 4.32Å; V485-F550 HydrophobicContact CG2-CE2 3.82Å
486	F	89.7	Confident	89.7	Confident	27 Å²	27	59.5 Å²	59.5	12%	0.118	32%	0.32	C	S	.	.	H	α-helix	trans	-58.7	-48.3	173.1	167.5	-107.5	0	0	0	111.5	A482 V483 G484 L488 S489 T490 K624 V627 V628	A482-F486 PolarHBondContact O-N 3.08Å; V483-F486 WeakPolarHBondContact O-CB 3.14Å; V483-F486 PolarHBondContact O-N 2.89Å; G484-F486 VanDerWaalsContact C-N 3.32Å; G484-F486 PolarHBondContact O-N 3.25Å; F486-L488 PolarHBondContact O-N 3.37Å; F486-S489 WeakPolarHBondContact O-CB 3.33Å; F486-S489 PolarHBondContact O-N 3.18Å; F486-S489 VanDerWaalsContact O-N 3.17Å; F486-S489 PolarHBondContact O-OG 2.7Å; F486-T490 HydrophobicContact CE2-CG2 4.4Å; F486-T490 HydrophobicContact CZ-CG2 4.43Å; F486-T490 PolarHBondContact O-N 3.48Å; F486-K624 HydrophobicContact CD2-CB 4.19Å; F486-K624 HydrophobicContact CE2-CB 3.62Å; F486-V627 HydrophobicContact CB-CG1 3.97Å; F486-V627 HydrophobicContact CD2-CB 4.49Å; F486-V627 HydrophobicContact CG-CB 4.43Å; F486-V627 HydrophobicContact CG-CG1 4.12Å; F486-V628 HydrophobicContact CD1-CG2 4.34Å; F486-V628 HydrophobicContact CE1-CG2 3.91Å
487	M	89.9	Confident	89	Confident	109 Å²	109	61 Å²	61	54%	0.537	33%	0.33	S	S	.	.	H	α-helix	trans	-59.5	-46.9	177	-67.7	-68.3	-74.8	0	0	111.1	V483 G484 S489 T490	V483-M487 VanDerWaalsContact O-CG 3.29Å; V483-M487 WeakPolarHBondContact O-CG 3.21Å; V483-M487 PolarHBondContact O-N 2.93Å; G484-M487 PolarHBondContact O-N 2.72Å; M487-S489 VanDerWaalsContact C-N 3.26Å; M487-S489 PolarHBondContact O-N 2.94Å; M487-T490 PolarHBondContact O-N 3.24Å; M487-T490 PolarHBondContact O-OG1 2.51Å
488	L	91.3	Very high	87.8	Confident	64 Å²	64	59.6 Å²	59.6	34%	0.335	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-34.6	177.5	-93.4	71.9	0	0	0	112.5	G484 V485 F486 T490 V491 F494 W542 L543	G484-L488 VanDerWaalsContact O-CD1 3.23Å; G484-L488 WeakPolarHBondContact O-CD1 3.38Å; G484-L488 PolarHBondContact O-N 3.28Å; V485-L488 PolarHBondContact O-N 3.01Å; F486-L488 PolarHBondContact O-N 3.37Å; L488-T490 PolarHBondContact O-N 2.88Å; L488-V491 PolarHBondContact O-N 3.38Å; L488-F494 HydrophobicContact CB-CD2 4.37Å; L488-F494 HydrophobicContact CD2-CE2 4.12Å; L488-F494 HydrophobicContact CD2-CZ 4.29Å; L488-F494 HydrophobicContact CG-CD2 4.22Å; L488-F494 HydrophobicContact CG-CE2 4.04Å; L488-W542 HydrophobicContact CD2-CH2 4.03Å; L488-L543 HydrophobicContact CB-CD1 4.21Å; L488-L543 HydrophobicContact CB-CD2 3.87Å; L488-L543 HydrophobicContact CD2-CD2 4.28Å
489	S	86.9	Confident	86.1	Confident	17 Å²	17	65 Å²	65	12%	0.119	34%	0.344	C	S	.	.	H	α-helix	trans	-65.4	-17.3	176.4	82	0	0	0	0	113.6	V485 F486 M487 R495	V485-S489 WeakPolarHBondContact O-CB 3.21Å; V485-S489 PolarHBondContact O-N 3.32Å; F486-S489 WeakPolarHBondContact O-CB 3.33Å; F486-S489 PolarHBondContact O-N 3.18Å; F486-S489 VanDerWaalsContact O-N 3.17Å; F486-S489 PolarHBondContact O-OG 2.7Å; M487-S489 VanDerWaalsContact C-N 3.26Å; M487-S489 PolarHBondContact O-N 2.94Å; S489-R495 PolarHBondContact O-NE 2.99Å; S489-R495 PolarHBondContact O-NH2 2.58Å
490	T	86	Confident	84.3	Confident	66 Å²	66	68 Å²	68	41%	0.405	36%	0.36	S	S	.	.	H	α-helix	trans	-90	-17.3	176.4	68.5	0	0	0	0	113.7	F486 M487 L488	F486-T490 HydrophobicContact CE2-CG2 4.4Å; F486-T490 HydrophobicContact CZ-CG2 4.43Å; F486-T490 PolarHBondContact O-N 3.48Å; M487-T490 PolarHBondContact O-N 3.24Å; M487-T490 PolarHBondContact O-OG1 2.51Å; L488-T490 PolarHBondContact O-N 2.88Å
491	V	89.2	Confident	82.5	Confident	59 Å²	59	71 Å²	71	36%	0.358	37%	0.373	S	S	.	.	S	Bend	trans	-76.2	130.6	-178.4	175.2	0	0	0	0	109.8	L488 D493 F494	L488-V491 PolarHBondContact O-N 3.38Å; V491-D493 VanDerWaalsContact C-N 3.26Å; V491-D493 HydrophobicContact CG1-CB 4.19Å; V491-D493 PolarHBondContact O-N 3.4Å; V491-F494 HydrophobicContact CB-CD2 3.98Å; V491-F494 HydrophobicContact CG1-CD2 4.03Å; V491-F494 HydrophobicContact CG1-CE2 4.46Å; V491-F494 PolarHBondContact O-N 2.94Å; V491-F494 VanDerWaalsContact O-N 3.15Å
492	K	84.3	Confident	80.5	Confident	185 Å²	185	73.3 Å²	73.3	80%	0.804	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-55.7	-38.8	-176.9	-65.8	-176.4	-179.3	-179.4	0	112.9	F494 R495	K492-F494 PolarHBondContact O-N 3.14Å; K492-R495 PolarHBondContact O-N 3.04Å
493	D	86.5	Confident	78.4	Confident	147 Å²	147	77.7 Å²	77.7	79%	0.786	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-64	-25.8	-177.7	-56.6	-26.1	0	0	0	113.6	V491	V491-D493 VanDerWaalsContact C-N 3.26Å; V491-D493 HydrophobicContact CG1-CB 4.19Å; V491-D493 PolarHBondContact O-N 3.4Å
494	F	88.1	Confident	76.4	Confident	77 Å²	77	84.1 Å²	84.1	34%	0.338	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-96.1	8.1	177.4	-64.8	-68	0	0	0	113.2	L488 V491 K492 S540 W542 L543	L488-F494 HydrophobicContact CB-CD2 4.37Å; L488-F494 HydrophobicContact CD2-CE2 4.12Å; L488-F494 HydrophobicContact CD2-CZ 4.29Å; L488-F494 HydrophobicContact CG-CD2 4.22Å; L488-F494 HydrophobicContact CG-CE2 4.04Å; V491-F494 HydrophobicContact CB-CD2 3.98Å; V491-F494 HydrophobicContact CG1-CD2 4.03Å; V491-F494 HydrophobicContact CG1-CE2 4.46Å; V491-F494 PolarHBondContact O-N 2.94Å; V491-F494 VanDerWaalsContact O-N 3.15Å; K492-F494 PolarHBondContact O-N 3.14Å; F494-S540 WeakPolarHBondContact O-CB 3.18Å; F494-S540 PolarHBondContact O-N 3.28Å; F494-W542 AromaticContact CD1-CZ2 3.84Å; F494-W542 HydrophobicContact CD1-CZ2 3.84Å; F494-W542 AromaticContact CE1-CZ2 3.94Å; F494-W542 HydrophobicContact CE1-CZ2 3.94Å; F494-L543 HydrophobicContact CB-CD1 3.67Å; F494-L543 HydrophobicContact CG-CD1 4.2Å
495	R	84.1	Confident	74.2	Confident	72 Å²	72	87.1 Å²	87.1	27%	0.272	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	127.3	175.9	-64.7	-176.2	170.2	-153	-6.3	110.3	S489 K492 L538	S489-R495 PolarHBondContact O-NE 2.99Å; S489-R495 PolarHBondContact O-NH2 2.58Å; K492-R495 PolarHBondContact O-N 3.04Å; R495-L538 CarbonylContact C-O 3.55Å; R495-L538 WeakPolarHBondContact CA-O 3.43Å
496	V	81.7	Confident	72.1	Confident	79 Å²	79	88.8 Å²	88.8	48%	0.479	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	137.3	177.9	-68	0	0	0	0	110	T537 L538	V496-T537 WeakPolarHBondContact O-CA 3.41Å; V496-L538 PolarHBondContact N-O 3.23Å; V496-L538 PolarHBondContact O-N 2.82Å
497	P	76.8	Confident	70.1	Confident	66 Å²	66	92.4 Å²	92.4	43%	0.429	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	134.9	173.6	28.3	-33.2	0	0	0	110
498	F	68	Low	68.1	Low	83 Å²	83	92.5 Å²	92.5	36%	0.364	47%	0.473	S	S	.	.			trans	-95.4	115.4	175.2	-174.3	-105.2	0	0	0	109.8	L500 F536 L538 L614	F498-L500 HydrophobicContact CD1-CD2 4.34Å; F498-L500 HydrophobicContact CD1-CG 3.97Å; F498-L500 HydrophobicContact CE1-CD2 3.58Å; F498-L500 HydrophobicContact CE1-CG 3.72Å; F498-L500 HydrophobicContact CZ-CD2 4.47Å; F498-L500 PolarHBondContact O-N 2.76Å; F498-F536 WeakPolarHBondContact CB-O 3.34Å; F498-F536 PolarHBondContact N-O 3.1Å; F498-L538 HydrophobicContact CB-CD1 3.52Å; F498-L538 HydrophobicContact CD2-CD1 4.1Å; F498-L538 HydrophobicContact CG-CD1 3.84Å; F498-L614 HydrophobicContact CD1-CD1 4.22Å; F498-L614 HydrophobicContact CE1-CD1 4.07Å
499	H	58.5	Low	65.8	Low	130 Å²	130	96.8 Å²	96.8	60%	0.602	49%	0.486	S	S	*	.			trans	-86.5	104.5	176.5	-61.8	-76.6	0	0	0	109.3	N501	H499-N501 PolarHBondContact O-N 3.05Å
500	L	54.6	Low	64	Low	63 Å²	63	100.1 Å²	100.1	33%	0.33	50%	0.502	S	S	.	.			trans	-75.1	114.7	161.8	-76.5	164.5	0	0	0	107.6	F498 I502 L610 I611 L614	F498-L500 HydrophobicContact CD1-CD2 4.34Å; F498-L500 HydrophobicContact CD1-CG 3.97Å; F498-L500 HydrophobicContact CE1-CD2 3.58Å; F498-L500 HydrophobicContact CE1-CG 3.72Å; F498-L500 HydrophobicContact CZ-CD2 4.47Å; F498-L500 PolarHBondContact O-N 2.76Å; L500-I502 HydrophobicContact CB-CD1 4.39Å; L500-I502 HydrophobicContact CB-CG1 3.95Å; L500-I502 PolarHBondContact O-N 3.36Å; L500-L610 HydrophobicContact CD2-CD2 4.11Å; L500-I611 HydrophobicContact CD1-CG1 4.2Å; L500-L614 HydrophobicContact CD1-CD1 3.95Å; L500-L614 HydrophobicContact CD2-CD1 4.32Å; L500-L614 HydrophobicContact CG-CD1 4.4Å
501	N	54.1	Low	62.4	Low	131 Å²	131	104.4 Å²	104.4	70%	0.701	52%	0.517	S	S	*	.			trans	-70.4	79.1	166.8	-81.3	3.1	0	0	0	108.7	H499 T503	H499-N501 PolarHBondContact O-N 3.05Å; N501-T503 PolarHBondContact O-N 3.48Å
502	I	52.6	Low	60.6	Low	102 Å²	102	106.7 Å²	106.7	52%	0.523	53%	0.532	S	S	.	.			trans	-67.6	-22.5	177.5	-66.4	171.8	0	0	0	110.9	L500 E504 Y505 T506	L500-I502 HydrophobicContact CB-CD1 4.39Å; L500-I502 HydrophobicContact CB-CG1 3.95Å; L500-I502 PolarHBondContact O-N 3.36Å; I502-E504 PolarHBondContact O-N 3.25Å; I502-Y505 PolarHBondContact O-N 3.13Å; I502-T506 PolarHBondContact O-N 3.21Å; I502-T506 PolarHBondContact O-OG1 3.28Å
503	T	47.6	Very low	58.9	Low	92 Å²	92	100.4 Å²	100.4	56%	0.564	51%	0.506	S	S	*	.	H	α-helix	trans	-60.6	-43.6	-171	52.6	0	0	0	0	113.6	N501 Y505 T506 D507	N501-T503 PolarHBondContact O-N 3.48Å; T503-Y505 VanDerWaalsContact C-N 3.25Å; T503-Y505 PolarHBondContact O-N 3.09Å; T503-T506 WeakPolarHBondContact CA-OG1 3.48Å; T503-T506 PolarHBondContact O-N 3.21Å; T503-T506 VanDerWaalsContact O-N 3.17Å; T503-T506 PolarHBondContact O-OG1 2.89Å; T503-D507 VanDerWaalsContact O-CG 3.26Å; T503-D507 PolarHBondContact O-N 3.15Å
504	E	49.3	Very low	57.2	Low	154 Å²	154	97.6 Å²	97.6	72%	0.72	50%	0.498	S	S	*	.	H	α-helix	trans	-67.8	-22.7	-176.6	-165.3	169.8	-172.8	0	0	113.4	I502	I502-E504 PolarHBondContact O-N 3.25Å
505	Y	47.2	Very low	55.5	Low	91 Å²	91	101.5 Å²	101.5	36%	0.357	52%	0.522	S	S	.	.	H	α-helix	trans	-95.5	-24.9	173.7	-112.1	-93.8	0	0	0	113.6	I502 T503 D507 Y509 S604 I607	I502-Y505 PolarHBondContact O-N 3.13Å; T503-Y505 VanDerWaalsContact C-N 3.25Å; T503-Y505 PolarHBondContact O-N 3.09Å; Y505-D507 VanDerWaalsContact C-N 3.26Å; Y505-Y509 PolarHBondContact O-N 3.32Å; Y505-S604 WeakPolarHBondContact OH-CA 3.29Å; Y505-S604 WeakPolarHBondContact OH-CB 3.16Å; Y505-I607 HydrophobicContact CD2-CD1 3.46Å; Y505-I607 VanDerWaalsContact CD2-CD1 3.46Å; Y505-I607 HydrophobicContact CE2-CD1 3.18Å; Y505-I607 HydrophobicContact CG-CD1 4.29Å
506	T	48.6	Very low	54	Low	51 Å²	51	106.8 Å²	106.8	31%	0.313	54%	0.544	S	S	.	.	H	α-helix	trans	-67.9	-34	170.9	0.6	0	0	0	0	109.9	I502 T503 L508 Y509 N510	I502-T506 PolarHBondContact O-N 3.21Å; I502-T506 PolarHBondContact O-OG1 3.28Å; T503-T506 WeakPolarHBondContact CA-OG1 3.48Å; T503-T506 PolarHBondContact O-N 3.21Å; T503-T506 VanDerWaalsContact O-N 3.17Å; T503-T506 PolarHBondContact O-OG1 2.89Å; T506-L508 PolarHBondContact O-N 3.46Å; T506-Y509 PolarHBondContact O-N 3.23Å; T506-N510 WeakPolarHBondContact O-CB 3.24Å; T506-N510 PolarHBondContact O-N 3.28Å; T506-N510 PolarHBondContact O-ND2 2.87Å; T506-N510 VanDerWaalsContact O-ND2 3.15Å; T506-N510 PolarHBondContact O-OD1 3.16Å
507	D	47.2	Very low	52.7	Low	103 Å²	103	106.4 Å²	106.4	55%	0.551	54%	0.539	S	S	*	.	H	α-helix	trans	-65.7	-39.2	178.3	-66	-23.4	0	0	0	112.5	T503 Y505 Y509 N510 E511	T503-D507 VanDerWaalsContact O-CG 3.26Å; T503-D507 PolarHBondContact O-N 3.15Å; Y505-D507 VanDerWaalsContact C-N 3.26Å; D507-Y509 VanDerWaalsContact C-N 3.31Å; D507-Y509 PolarHBondContact O-N 3.03Å; D507-N510 PolarHBondContact O-N 2.84Å; D507-E511 PolarHBondContact O-N 3.21Å; D507-E511 VanDerWaalsContact O-N 3.16Å
508	L	48.3	Very low	51.6	Low	111 Å²	111	110.5 Å²	110.5	58%	0.581	56%	0.557	S	S	*	*	H	α-helix	trans	-68.2	-28.9	173.8	-160.4	80.2	0	0	0	112.8	T506	T506-L508 PolarHBondContact O-N 3.46Å
509	Y	41.7	Very low	50.8	Low	154 Å²	154	114.9 Å²	114.9	60%	0.604	58%	0.579	S	S	*	*	H	α-helix	trans	-83.9	-35.1	177.8	-160.6	-105.5	0	0	0	112	Y505 T506 D507 E511 T512 I513	Y505-Y509 PolarHBondContact O-N 3.32Å; T506-Y509 PolarHBondContact O-N 3.23Å; D507-Y509 VanDerWaalsContact C-N 3.31Å; D507-Y509 PolarHBondContact O-N 3.03Å; Y509-E511 VanDerWaalsContact C-N 3.32Å; Y509-E511 PolarHBondContact O-N 3.33Å; Y509-T512 PolarHBondContact O-N 3.24Å; Y509-T512 PolarHBondContact O-OG1 3.17Å; Y509-I513 HydrophobicContact CD1-CD1 3.75Å; Y509-I513 HydrophobicContact CE1-CD1 3.39Å
510	N	49.9	Very low	50.6	Low	87 Å²	87	111.8 Å²	111.8	47%	0.465	57%	0.566	S	S	.	*	H	α-helix	trans	-69.4	-30	178.2	-70.1	-19.9	0	0	0	111.8	T506 D507 T512 I513	T506-N510 WeakPolarHBondContact O-CB 3.24Å; T506-N510 PolarHBondContact O-N 3.28Å; T506-N510 PolarHBondContact O-ND2 2.87Å; T506-N510 VanDerWaalsContact O-ND2 3.15Å; T506-N510 PolarHBondContact O-OD1 3.16Å; D507-N510 PolarHBondContact O-N 2.84Å; N510-T512 PolarHBondContact O-N 3.46Å; N510-I513 CarbonylContact O-C 3.47Å; N510-I513 PolarHBondContact O-N 3.19Å; N510-I513 VanDerWaalsContact O-N 3.11Å
511	E	51.9	Low	50.5	Low	155 Å²	155	115.1 Å²	115.1	72%	0.724	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-24.5	174.1	-148.8	173.8	-155.6	0	0	112.2	D507 Y509	D507-E511 PolarHBondContact O-N 3.21Å; D507-E511 VanDerWaalsContact O-N 3.16Å; Y509-E511 VanDerWaalsContact C-N 3.32Å; Y509-E511 PolarHBondContact O-N 3.33Å
512	T	51.7	Low	50.3	Low	107 Å²	107	113 Å²	113	66%	0.656	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-9.8	174.3	61.2	0	0	0	0	114.7	Y509 N510	Y509-T512 PolarHBondContact O-N 3.24Å; Y509-T512 PolarHBondContact O-OG1 3.17Å; N510-T512 PolarHBondContact O-N 3.46Å
513	I	48.7	Very low	50.2	Low	54 Å²	54	111.7 Å²	111.7	28%	0.277	58%	0.577	S	S	.	*			trans	-120.1	41.8	-178.2	-48.1	176.2	0	0	0	109.6	Y509 N510 D515 N517	Y509-I513 HydrophobicContact CD1-CD1 3.75Å; Y509-I513 HydrophobicContact CE1-CD1 3.39Å; N510-I513 CarbonylContact O-C 3.47Å; N510-I513 PolarHBondContact O-N 3.19Å; N510-I513 VanDerWaalsContact O-N 3.11Å; I513-D515 PolarHBondContact O-N 3.42Å; I513-N517 PolarHBondContact O-ND2 3.05Å
514	S	50	Low	50.4	Low	88 Å²	88	111.3 Å²	111.3	62%	0.615	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-7.8	167.3	64.7	0	0	0	0	113
515	D	53.2	Low	50.3	Low	158 Å²	158	109.3 Å²	109.3	85%	0.845	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.5	1.2	-172.3	-102.7	6.2	0	0	0	115.8	I513	I513-D515 PolarHBondContact O-N 3.42Å
516	Y	52.4	Low	50.4	Low	184 Å²	184	108.5 Å²	108.5	72%	0.722	57%	0.573	S	S	*	*	S	Bend	trans	-129.8	25.4	-176.2	-138.3	-93.9	0	0	0	115.4	I520	Y516-I520 HydrophobicContact CD1-CD1 4.42Å; Y516-I520 WeakPolarHBondContact O-CD1 3.15Å
517	N	55.6	Low	50.3	Low	70 Å²	70	109.9 Å²	109.9	37%	0.374	58%	0.578	S	S	.	*			trans	-90.5	-6.5	-162	-78.7	-30.7	0	0	0	119	I513 H519	I513-N517 PolarHBondContact O-ND2 3.05Å; N517-H519 PolarHBondContact O-N 3.26Å
518	N	52.8	Low	50.1	Low	152 Å²	152	106.8 Å²	106.8	81%	0.813	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.8	-23.9	-172.1	-69.2	-12.3	0	0	0	115.4
519	H	51.2	Low	49.8	Very low	176 Å²	176	110.6 Å²	110.6	82%	0.815	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-9.1	177.8	-90.4	-64.8	0	0	0	114.1	N517	N517-H519 PolarHBondContact O-N 3.26Å
520	I	53.2	Low	49.8	Very low	65 Å²	65	113.5 Å²	113.5	33%	0.333	58%	0.583	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.1	-26.7	-170.5	-49.9	-175.8	0	0	0	111.6	Y516 A522 T523 I524	Y516-I520 HydrophobicContact CD1-CD1 4.42Å; Y516-I520 WeakPolarHBondContact O-CD1 3.15Å; I520-A522 VanDerWaalsContact C-N 3.3Å; I520-A522 PolarHBondContact O-N 3.28Å; I520-A522 VanDerWaalsContact O-N 3.15Å; I520-T523 PolarHBondContact O-N 2.82Å; I520-I524 HydrophobicContact CB-CD1 4.07Å; I520-I524 HydrophobicContact CG2-CD1 3.36Å; I520-I524 HydrophobicContact CG2-CG1 3.69Å; I520-I524 PolarHBondContact O-N 3.21Å
521	E	53.1	Low	49.7	Very low	132 Å²	132	114 Å²	114	62%	0.617	59%	0.589	S	S	*	*	H	α-helix	trans	-55.4	-36	-177	-77.6	-173.9	158.1	0	0	114.6	N525	E521-N525 PolarHBondContact O-N 3.46Å
522	A	49.6	Very low	49.3	Very low	86 Å²	86	111.8 Å²	111.8	71%	0.711	58%	0.582	S	S	*	*	H	α-helix	trans	-73.1	-29.5	178.1	0	0	0	0	0	113.2	I520	I520-A522 VanDerWaalsContact C-N 3.3Å; I520-A522 PolarHBondContact O-N 3.28Å; I520-A522 VanDerWaalsContact O-N 3.15Å
523	T	51.2	Low	49	Very low	76 Å²	76	111.9 Å²	111.9	47%	0.466	58%	0.578	S	S	.	*	H	α-helix	trans	-87.7	-28.1	-179.1	-50.3	0	0	0	0	111.6	I520 S526 N527	I520-T523 PolarHBondContact O-N 2.82Å; T523-S526 PolarHBondContact O-OG 3.32Å; T523-N527 WeakPolarHBondContact O-CB 3.22Å; T523-N527 PolarHBondContact O-N 3.45Å
524	I	50.9	Low	49.1	Very low	84 Å²	84	114.3 Å²	114.3	43%	0.431	60%	0.6	S	S	.	*	H	α-helix	trans	-64.7	-42.9	174.8	-76.1	160	0	0	0	111.1	I520 S526 N527 S528	I520-I524 HydrophobicContact CB-CD1 4.07Å; I520-I524 HydrophobicContact CG2-CD1 3.36Å; I520-I524 HydrophobicContact CG2-CG1 3.69Å; I520-I524 PolarHBondContact O-N 3.21Å; I524-S526 VanDerWaalsContact C-N 3.32Å; I524-S526 PolarHBondContact O-N 3.31Å; I524-N527 PolarHBondContact O-N 2.98Å; I524-S528 WeakPolarHBondContact O-CB 3.18Å; I524-S528 PolarHBondContact O-N 3.47Å; I524-S528 PolarHBondContact O-OG 3.49Å
525	N	48.5	Very low	49.4	Very low	111 Å²	111	115.8 Å²	115.8	59%	0.594	59%	0.593	S	S	*	*	H	α-helix	trans	-68.7	-26	-175.2	-76.7	-18.7	0	0	0	114.2	E521 S528 Y529	E521-N525 PolarHBondContact O-N 3.46Å; N525-S528 PolarHBondContact O-OG 2.91Å; N525-Y529 VanDerWaalsContact O-CD2 3.28Å; N525-Y529 WeakPolarHBondContact O-CD2 3.47Å
526	S	49.1	Very low	50.1	Low	75 Å²	75	110.5 Å²	110.5	52%	0.524	56%	0.563	S	S	.	*	H	α-helix	trans	-88	-30.4	173.6	61.3	0	0	0	0	113.4	T523 I524	T523-S526 PolarHBondContact O-OG 3.32Å; I524-S526 VanDerWaalsContact C-N 3.32Å; I524-S526 PolarHBondContact O-N 3.31Å
527	N	45.6	Very low	51.4	Low	79 Å²	79	104.3 Å²	104.3	42%	0.422	54%	0.544	S	S	.	.	H	α-helix	trans	-84	-28.1	-179.7	-74	-15.4	0	0	0	113	T523 I524 Y529 R530 T531	T523-N527 WeakPolarHBondContact O-CB 3.22Å; T523-N527 PolarHBondContact O-N 3.45Å; I524-N527 PolarHBondContact O-N 2.98Å; N527-Y529 VanDerWaalsContact C-N 3.32Å; N527-Y529 PolarHBondContact O-N 3.33Å; N527-R530 PolarHBondContact O-N 3.42Å; N527-T531 WeakPolarHBondContact O-CG2 3.42Å; N527-T531 PolarHBondContact O-N 2.98Å; N527-T531 PolarHBondContact O-OG1 3.49Å; N527-T531 VanDerWaalsContact O-OG1 3.13Å
528	S	44.4	Very low	52.5	Low	38 Å²	38	103.5 Å²	103.5	27%	0.266	54%	0.539	S	S	.	.	H	α-helix	trans	-61.9	-35.2	179.2	60.9	0	0	0	0	113.2	I524 N525 R530 N532	I524-S528 WeakPolarHBondContact O-CB 3.18Å; I524-S528 PolarHBondContact O-N 3.47Å; I524-S528 PolarHBondContact O-OG 3.49Å; N525-S528 PolarHBondContact O-OG 2.91Å; S528-R530 VanDerWaalsContact C-N 3.33Å; S528-N532 PolarHBondContact O-ND2 2.92Å
529	Y	40	Very low	54	Low	191 Å²	191	97.3 Å²	97.3	75%	0.749	51%	0.508	S	S	*	.	H	α-helix	trans	-74.3	-21.9	172.3	-69	-77.4	0	0	0	113.4	N525 N527	N525-Y529 VanDerWaalsContact O-CD2 3.28Å; N525-Y529 WeakPolarHBondContact O-CD2 3.47Å; N527-Y529 VanDerWaalsContact C-N 3.32Å; N527-Y529 PolarHBondContact O-N 3.33Å
530	R	43.6	Very low	55.8	Low	216 Å²	216	89.6 Å²	89.6	82%	0.815	47%	0.473	S	S	*	.	H	α-helix	trans	-89.9	-32.1	-179.3	-134.5	-179.4	-149.8	-172.1	6.8	112.8	N527 S528	N527-R530 PolarHBondContact O-N 3.42Å; S528-R530 VanDerWaalsContact C-N 3.33Å
531	T	45.9	Very low	57.5	Low	96 Å²	96	95.6 Å²	95.6	59%	0.589	50%	0.497	S	S	*	.	H	α-helix	trans	-79.2	-21.6	-179.7	53.3	0	0	0	0	113.7	N527 N533	N527-T531 WeakPolarHBondContact O-CG2 3.42Å; N527-T531 PolarHBondContact O-N 2.98Å; N527-T531 PolarHBondContact O-OG1 3.49Å; N527-T531 VanDerWaalsContact O-OG1 3.13Å; T531-N533 PolarHBondContact O-N 2.87Å
532	N	43.9	Very low	59.4	Low	109 Å²	109	95.6 Å²	95.6	58%	0.583	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-6.7	-178.4	-75.7	-7.1	0	0	0	115.3	S528 Y535	S528-N532 PolarHBondContact O-ND2 2.92Å; N532-Y535 WeakPolarHBondContact O-CE1 3.18Å; N532-Y535 PolarHBondContact O-OH 3.4Å
533	N	45.6	Very low	61.4	Low	109 Å²	109	91.6 Å²	91.6	58%	0.583	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	1.5	-169.9	-86.5	-3	0	0	0	116.7	T531 Y535	T531-N533 PolarHBondContact O-N 2.87Å; N533-Y535 HydrophobicContact CB-CE2 4.47Å; N533-Y535 PolarHBondContact O-N 3.32Å; N533-Y535 WeakPolarHBondContact OD1-CE2 3.43Å; N533-Y535 PolarHBondContact OD1-OH 3.14Å
534	S	51.2	Low	63.1	Low	106 Å²	106	90.6 Å²	90.6	74%	0.741	45%	0.452	S	S	*	.			trans	-84.3	66.7	166.6	61.8	0	0	0	0	109.7	F536	S534-F536 PolarHBondContact O-N 3.38Å; S534-F536 VanDerWaalsContact O-N 3.08Å
535	Y	57	Low	65.1	Low	119 Å²	119	92.4 Å²	92.4	47%	0.467	46%	0.458	S	S	.	.			trans	-64	111	175	-60.9	-75	0	0	0	109	N532 N533	N532-Y535 WeakPolarHBondContact O-CE1 3.18Å; N532-Y535 PolarHBondContact O-OH 3.4Å; N533-Y535 HydrophobicContact CB-CE2 4.47Å; N533-Y535 PolarHBondContact O-N 3.32Å; N533-Y535 WeakPolarHBondContact OD1-CE2 3.43Å; N533-Y535 PolarHBondContact OD1-OH 3.14Å
536	F	67	Low	67.2	Low	47 Å²	47	91.2 Å²	91.2	21%	0.206	45%	0.45	C	S	.	.			trans	-66.9	130.8	170.5	-171.1	-95	0	0	0	109	F498 S534 L538 L614 E617	F498-F536 WeakPolarHBondContact CB-O 3.34Å; F498-F536 PolarHBondContact N-O 3.1Å; S534-F536 PolarHBondContact O-N 3.38Å; S534-F536 VanDerWaalsContact O-N 3.08Å; F536-L538 HydrophobicContact CD1-CD1 3.46Å; F536-L538 VanDerWaalsContact CD1-CD1 3.46Å; F536-L538 HydrophobicContact CD1-CG 4.45Å; F536-L538 HydrophobicContact CE1-CD1 3.48Å; F536-L538 VanDerWaalsContact CE1-CD1 3.48Å; F536-L538 HydrophobicContact CE1-CG 4.03Å; F536-L614 HydrophobicContact CD1-CB 4.42Å; F536-L614 HydrophobicContact CD1-CD2 3.6Å; F536-L614 HydrophobicContact CD1-CG 4.47Å; F536-L614 HydrophobicContact CD2-CB 4.4Å; F536-L614 HydrophobicContact CE1-CB 4.38Å; F536-L614 HydrophobicContact CE1-CD2 3.46Å; F536-L614 VanDerWaalsContact CE1-CD2 3.46Å; F536-L614 HydrophobicContact CE1-CG 4.5Å; F536-L614 HydrophobicContact CE2-CB 4.36Å; F536-L614 WeakPolarHBondContact CE2-O 3.3Å; F536-L614 HydrophobicContact CG-CB 4.44Å; F536-L614 HydrophobicContact CG-CD2 4.39Å; F536-L614 HydrophobicContact CZ-CB 4.36Å; F536-L614 HydrophobicContact CZ-CD2 4.16Å; F536-L614 WeakPolarHBondContact CZ-O 3.33Å; F536-E617 WeakPolarHBondContact CE1-OE2 3.33Å; F536-E617 HydrophobicContact CE2-CB 4.36Å; F536-E617 HydrophobicContact CZ-CB 3.74Å; F536-E617 HydrophobicContact CZ-CG 3.94Å; F536-E617 WeakPolarHBondContact CZ-OE2 3.24Å
537	T	79	Confident	69.2	Low	54 Å²	54	88.8 Å²	88.8	33%	0.331	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	122.7	-173.8	65.6	0	0	0	0	111.3	V496	V496-T537 WeakPolarHBondContact O-CA 3.41Å
538	L	79.5	Confident	71.3	Confident	52 Å²	52	87.8 Å²	87.8	27%	0.272	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	148.3	175	-82.4	89.5	0	0	0	111.1	R495 V496 F498 F536 L614	R495-L538 CarbonylContact C-O 3.55Å; R495-L538 WeakPolarHBondContact CA-O 3.43Å; V496-L538 PolarHBondContact N-O 3.23Å; V496-L538 PolarHBondContact O-N 2.82Å; F498-L538 HydrophobicContact CB-CD1 3.52Å; F498-L538 HydrophobicContact CD2-CD1 4.1Å; F498-L538 HydrophobicContact CG-CD1 3.84Å; F536-L538 HydrophobicContact CD1-CD1 3.46Å; F536-L538 VanDerWaalsContact CD1-CD1 3.46Å; F536-L538 HydrophobicContact CD1-CG 4.45Å; F536-L538 HydrophobicContact CE1-CD1 3.48Å; F536-L538 VanDerWaalsContact CE1-CD1 3.48Å; F536-L538 HydrophobicContact CE1-CG 4.03Å; L538-L614 HydrophobicContact CD1-CD2 4.48Å
539	P	85.4	Confident	73.7	Confident	22 Å²	22	91.5 Å²	91.5	14%	0.143	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	148.3	168	26.1	-33.6	0	0	0	111.2	V544	P539-V544 HydrophobicContact CB-CG2 4.18Å; P539-V544 HydrophobicContact CG-CG2 3.63Å
540	S	88.4	Confident	76.3	Confident	14 Å²	14	83.1 Å²	83.1	10%	0.098	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-54.8	144.5	176.4	63	0	0	0	0	112.2	F494 W542 L543 V544	F494-S540 WeakPolarHBondContact O-CB 3.18Å; F494-S540 PolarHBondContact O-N 3.28Å; S540-W542 PolarHBondContact O-N 3.45Å; S540-W542 VanDerWaalsContact O-N 3.1Å; S540-W542 PolarHBondContact OG-NE1 2.97Å; S540-L543 WeakPolarHBondContact O-CB 3.22Å; S540-L543 PolarHBondContact O-N 2.92Å; S540-L543 WeakPolarHBondContact OG-CD1 3.26Å; S540-L543 WeakPolarHBondContact OG-CG 3.41Å; S540-V544 PolarHBondContact O-N 3.06Å
541	K	88.3	Confident	78.6	Confident	191 Å²	191	72.9 Å²	72.9	83%	0.83	37%	0.366	S	S	*	.	H	α-helix	trans	-53.1	-38.1	-173.7	-64.3	-176.7	179.8	-179.5	0	113.5	V544 Q545	K541-V544 PolarHBondContact O-N 2.89Å; K541-Q545 PolarHBondContact O-N 3.01Å
542	W	92.8	Very high	80.9	Confident	132 Å²	132	72.2 Å²	72.2	50%	0.5	36%	0.358	S	S	.	.	H	α-helix	trans	-70.8	-32.6	-179.3	66.7	-91.9	0	0	0	112.6	L488 F494 S540 M546	L488-W542 HydrophobicContact CD2-CH2 4.03Å; F494-W542 AromaticContact CD1-CZ2 3.84Å; F494-W542 HydrophobicContact CD1-CZ2 3.84Å; F494-W542 AromaticContact CE1-CZ2 3.94Å; F494-W542 HydrophobicContact CE1-CZ2 3.94Å; S540-W542 PolarHBondContact O-N 3.45Å; S540-W542 VanDerWaalsContact O-N 3.1Å; S540-W542 PolarHBondContact OG-NE1 2.97Å; W542-M546 WeakPolarHBondContact O-CB 3.22Å; W542-M546 VanDerWaalsContact O-CG 3.25Å; W542-M546 WeakPolarHBondContact O-CG 3.49Å; W542-M546 PolarHBondContact O-N 3.07Å
543	L	91.7	Very high	83.2	Confident	3 Å²	3	67.5 Å²	67.5	2%	0.016	33%	0.334	C	S	.	.	H	α-helix	trans	-67.5	-42	173.4	-75.6	172.9	0	0	0	111.3	V485 L488 F494 S540 M546 D547	V485-L543 HydrophobicContact CG1-CD2 4Å; V485-L543 HydrophobicContact CG2-CD2 4.45Å; L488-L543 HydrophobicContact CB-CD1 4.21Å; L488-L543 HydrophobicContact CB-CD2 3.87Å; L488-L543 HydrophobicContact CD2-CD2 4.28Å; F494-L543 HydrophobicContact CB-CD1 3.67Å; F494-L543 HydrophobicContact CG-CD1 4.2Å; S540-L543 WeakPolarHBondContact O-CB 3.22Å; S540-L543 PolarHBondContact O-N 2.92Å; S540-L543 WeakPolarHBondContact OG-CD1 3.26Å; S540-L543 WeakPolarHBondContact OG-CG 3.41Å; L543-M546 PolarHBondContact O-N 2.76Å; L543-D547 PolarHBondContact O-N 3Å
544	V	87.8	Confident	85.4	Confident	54 Å²	54	62.4 Å²	62.4	33%	0.327	31%	0.307	S	S	.	.	H	α-helix	trans	-60.1	-47.4	175.7	178.9	0	0	0	0	110.5	P539 S540 K541 M546 D547 I548	P539-V544 HydrophobicContact CB-CG2 4.18Å; P539-V544 HydrophobicContact CG-CG2 3.63Å; S540-V544 PolarHBondContact O-N 3.06Å; K541-V544 PolarHBondContact O-N 2.89Å; V544-M546 VanDerWaalsContact C-N 3.3Å; V544-M546 PolarHBondContact O-N 3.26Å; V544-D547 PolarHBondContact O-N 3.48Å; V544-I548 HydrophobicContact CG1-CD1 3.96Å; V544-I548 VanDerWaalsContact O-CG1 3.3Å; V544-I548 WeakPolarHBondContact O-CG1 3.48Å; V544-I548 PolarHBondContact O-N 3.39Å
545	Q	91.6	Very high	87.4	Confident	122 Å²	122	58.1 Å²	58.1	57%	0.57	28%	0.276	S	S	*	.	H	α-helix	trans	-60.7	-39.5	178	-174.1	61.1	31.2	0	0	112.5	K541 F549	K541-Q545 PolarHBondContact O-N 3.01Å; Q545-F549 WeakPolarHBondContact O-CB 3.36Å; Q545-F549 PolarHBondContact O-N 3.46Å
546	M	92.7	Very high	89.2	Confident	86 Å²	86	56.6 Å²	56.6	42%	0.424	28%	0.275	S	S	.	.	H	α-helix	trans	-67	-41.9	176.6	-74.5	-70.5	179.2	0	0	112	V485 W542 L543 V544 I548 F549 F550	V485-M546 HydrophobicContact CG1-CB 4.19Å; V485-M546 HydrophobicContact CG2-CB 4.07Å; W542-M546 WeakPolarHBondContact O-CB 3.22Å; W542-M546 VanDerWaalsContact O-CG 3.25Å; W542-M546 WeakPolarHBondContact O-CG 3.49Å; W542-M546 PolarHBondContact O-N 3.07Å; L543-M546 PolarHBondContact O-N 2.76Å; V544-M546 VanDerWaalsContact C-N 3.3Å; V544-M546 PolarHBondContact O-N 3.26Å; M546-I548 VanDerWaalsContact C-N 3.33Å; M546-I548 PolarHBondContact O-N 3.47Å; M546-F549 WeakPolarHBondContact O-CB 3.3Å; M546-F549 PolarHBondContact O-N 2.8Å; M546-F550 HydrophobicContact CB-CD2 4.47Å; M546-F550 HydrophobicContact CB-CE2 4.14Å; M546-F550 WeakPolarHBondContact O-CD2 3.45Å; M546-F550 PolarHBondContact O-N 2.89Å; M546-F550 HydrophobicContact SD-CE2 4.4Å
547	D	90.8	Very high	90.4	Very high	25 Å²	25	54.7 Å²	54.7	13%	0.134	27%	0.267	C	S	.	.	H	α-helix	trans	-64	-39.9	177.2	-169.4	29	0	0	0	111.7	V485 L543 V544 F550 S551 R630	V485-D547 HydrophobicContact CG1-CB 4.15Å; L543-D547 PolarHBondContact O-N 3Å; V544-D547 PolarHBondContact O-N 3.48Å; D547-F550 PolarHBondContact O-N 3.09Å; D547-S551 VanDerWaalsContact O-CB 3.23Å; D547-S551 WeakPolarHBondContact O-CB 3.23Å; D547-S551 PolarHBondContact O-N 2.84Å; D547-S551 PolarHBondContact O-OG 3.37Å; D547-R630 IonicContact OD1-NH1 2.72Å
548	I	91.6	Very high	91	Very high	58 Å²	58	53 Å²	53	30%	0.297	26%	0.257	S	S	.	.	H	α-helix	trans	-59.7	-48.7	171.7	-65.5	166.5	0	0	0	110.2	V544 M546 F550 S551 I552 F587	V544-I548 HydrophobicContact CG1-CD1 3.96Å; V544-I548 VanDerWaalsContact O-CG1 3.3Å; V544-I548 WeakPolarHBondContact O-CG1 3.48Å; V544-I548 PolarHBondContact O-N 3.39Å; M546-I548 VanDerWaalsContact C-N 3.33Å; M546-I548 PolarHBondContact O-N 3.47Å; I548-F550 PolarHBondContact O-N 3.09Å; I548-S551 PolarHBondContact O-N 2.88Å; I548-I552 HydrophobicContact CG2-CD1 3.69Å; I548-I552 HydrophobicContact CG2-CG1 4.39Å; I548-I552 WeakPolarHBondContact O-CB 3.35Å; I548-I552 VanDerWaalsContact O-CG1 3.28Å; I548-I552 WeakPolarHBondContact O-CG1 3.41Å; I548-I552 PolarHBondContact O-N 2.93Å; I548-F587 HydrophobicContact CB-CE2 4.4Å; I548-F587 HydrophobicContact CG1-CE2 4.17Å; I548-F587 HydrophobicContact CG2-CE2 4.3Å
549	F	94.7	Very high	91.6	Very high	116 Å²	116	54.1 Å²	54.1	51%	0.509	26%	0.262	S	S	.	.	H	α-helix	trans	-57.4	-48.9	178.7	170	-97.8	0	0	0	112.3	Q545 M546 I552 A553	Q545-F549 WeakPolarHBondContact O-CB 3.36Å; Q545-F549 PolarHBondContact O-N 3.46Å; M546-F549 WeakPolarHBondContact O-CB 3.3Å; M546-F549 PolarHBondContact O-N 2.8Å; F549-I552 PolarHBondContact O-N 3.31Å; F549-A553 WeakPolarHBondContact O-CB 3.46Å; F549-A553 PolarHBondContact O-N 3.33Å
550	F	93.8	Very high	92	Very high	15 Å²	15	56 Å²	56	7%	0.066	27%	0.27	C	S	.	.	H	α-helix	trans	-67.4	-38.2	179.5	-67.7	-53	0	0	0	112.4	I478 S481 A482 V485 M546 D547 I548 A553 I554	I478-F550 HydrophobicContact CG2-CD1 4.17Å; S481-F550 WeakPolarHBondContact OG-CE2 3.11Å; S481-F550 WeakPolarHBondContact OG-CZ 3.17Å; A482-F550 HydrophobicContact CB-CB 3.78Å; A482-F550 HydrophobicContact CB-CD2 4.13Å; A482-F550 HydrophobicContact CB-CG 3.91Å; V485-F550 HydrophobicContact CG2-CD2 4.32Å; V485-F550 HydrophobicContact CG2-CE2 3.82Å; M546-F550 HydrophobicContact CB-CD2 4.47Å; M546-F550 HydrophobicContact CB-CE2 4.14Å; M546-F550 WeakPolarHBondContact O-CD2 3.45Å; M546-F550 PolarHBondContact O-N 2.89Å; M546-F550 HydrophobicContact SD-CE2 4.4Å; D547-F550 PolarHBondContact O-N 3.09Å; I548-F550 PolarHBondContact O-N 3.09Å; F550-A553 PolarHBondContact O-N 2.94Å; F550-I554 VanDerWaalsContact O-CG1 3.25Å; F550-I554 WeakPolarHBondContact O-CG1 3.5Å; F550-I554 PolarHBondContact O-N 3.25Å
551	S	91.8	Very high	92.1	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.9	-42.7	176.8	-62.6	0	0	0	0	111.1	D547 I548 I554 T555 R630	D547-S551 VanDerWaalsContact O-CB 3.23Å; D547-S551 WeakPolarHBondContact O-CB 3.23Å; D547-S551 PolarHBondContact O-N 2.84Å; D547-S551 PolarHBondContact O-OG 3.37Å; I548-S551 PolarHBondContact O-N 2.88Å; S551-I554 PolarHBondContact O-N 2.98Å; S551-T555 WeakPolarHBondContact O-CB 3.49Å; S551-T555 PolarHBondContact O-N 3.21Å; S551-T555 PolarHBondContact O-OG1 3.47Å; S551-T555 VanDerWaalsContact O-OG1 3.09Å; S551-R630 PolarHBondContact OG-NH2 3.18Å; S551-R630 VanDerWaalsContact OG-NH2 3.17Å
552	I	93.4	Very high	92.2	Very high	83 Å²	83	50.1 Å²	50.1	43%	0.426	25%	0.245	S	C	.	.	H	α-helix	trans	-62	-45.4	172.7	-68.5	168.5	0	0	0	111.2	I548 F549 I554 T555 I556 F587	I548-I552 HydrophobicContact CG2-CD1 3.69Å; I548-I552 HydrophobicContact CG2-CG1 4.39Å; I548-I552 WeakPolarHBondContact O-CB 3.35Å; I548-I552 VanDerWaalsContact O-CG1 3.28Å; I548-I552 WeakPolarHBondContact O-CG1 3.41Å; I548-I552 PolarHBondContact O-N 2.93Å; F549-I552 PolarHBondContact O-N 3.31Å; I552-I554 VanDerWaalsContact C-N 3.3Å; I552-I554 PolarHBondContact O-N 3.48Å; I552-T555 WeakPolarHBondContact O-CB 3.42Å; I552-T555 PolarHBondContact O-N 3.4Å; I552-I556 HydrophobicContact CG2-CD1 3.79Å; I552-I556 HydrophobicContact CG2-CG1 4.36Å; I552-I556 VanDerWaalsContact O-CG1 3.31Å; I552-I556 WeakPolarHBondContact O-CG1 3.33Å; I552-I556 PolarHBondContact O-N 2.98Å; I552-F587 HydrophobicContact CG1-CZ 4.47Å
553	A	93.7	Very high	92	Very high	9 Å²	9	46.7 Å²	46.7	7%	0.074	24%	0.236	C	C	.	.	H	α-helix	trans	-61.7	-38.5	179.8	0	0	0	0	0	112.4	I478 F549 F550 D557	I478-A553 HydrophobicContact CD1-CB 3.95Å; F549-A553 WeakPolarHBondContact O-CB 3.46Å; F549-A553 PolarHBondContact O-N 3.33Å; F550-A553 PolarHBondContact O-N 2.94Å; A553-D557 PolarHBondContact O-N 2.98Å; A553-D557 VanDerWaalsContact O-N 3.11Å
554	I	92.1	Very high	91.9	Very high	3 Å²	3	47.8 Å²	47.8	2%	0.015	24%	0.241	C	C	.	.	H	α-helix	trans	-71.2	-41.9	175.7	-66.6	167.3	0	0	0	110.8	I478 F550 S551 I552 I556 D557 V558 L584 R630	I478-I554 HydrophobicContact CG2-CD1 4.4Å; I478-I554 HydrophobicContact CG2-CG1 4.01Å; F550-I554 VanDerWaalsContact O-CG1 3.25Å; F550-I554 WeakPolarHBondContact O-CG1 3.5Å; F550-I554 PolarHBondContact O-N 3.25Å; S551-I554 PolarHBondContact O-N 2.98Å; I552-I554 VanDerWaalsContact C-N 3.3Å; I552-I554 PolarHBondContact O-N 3.48Å; I554-I556 VanDerWaalsContact C-N 3.32Å; I554-I556 PolarHBondContact O-N 3.44Å; I554-D557 WeakPolarHBondContact O-CB 3.26Å; I554-D557 PolarHBondContact O-N 3.31Å; I554-D557 VanDerWaalsContact O-N 3.16Å; I554-V558 WeakPolarHBondContact O-CG2 3.33Å; I554-V558 PolarHBondContact O-N 2.86Å; I554-L584 HydrophobicContact CB-CD2 4.09Å; I554-L584 HydrophobicContact CG2-CD1 4.41Å; I554-L584 HydrophobicContact CG2-CD2 3.68Å; I554-L584 HydrophobicContact CG2-CG 4.12Å; I554-R630 HydrophobicContact CD1-CG 4.26Å
555	T	93.4	Very high	91.8	Very high	15 Å²	15	45.3 Å²	45.3	9%	0.092	23%	0.226	C	C	.	.	H	α-helix	trans	-55.9	-48.8	173	-71.2	0	0	0	0	111	S551 I552 D557 V558 I559 Y588	S551-T555 WeakPolarHBondContact O-CB 3.49Å; S551-T555 PolarHBondContact O-N 3.21Å; S551-T555 PolarHBondContact O-OG1 3.47Å; S551-T555 VanDerWaalsContact O-OG1 3.09Å; I552-T555 WeakPolarHBondContact O-CB 3.42Å; I552-T555 PolarHBondContact O-N 3.4Å; T555-D557 VanDerWaalsContact C-N 3.25Å; T555-D557 PolarHBondContact O-N 3.18Å; T555-V558 PolarHBondContact O-N 3.4Å; T555-V558 VanDerWaalsContact O-N 3.15Å; T555-I559 HydrophobicContact CG2-CD1 3.67Å; T555-I559 HydrophobicContact CG2-CG1 4.31Å; T555-I559 VanDerWaalsContact O-CG1 3.31Å; T555-I559 WeakPolarHBondContact O-CG1 3.36Å; T555-I559 PolarHBondContact O-N 2.84Å; T555-Y588 WeakPolarHBondContact CB-OH 3.03Å; T555-Y588 WeakPolarHBondContact CG2-OH 3.25Å; T555-Y588 PolarHBondContact OG1-OH 3.42Å
556	I	93.9	Very high	91.4	Very high	87 Å²	87	40.2 Å²	40.2	45%	0.446	20%	0.203	S	C	.	.	H	α-helix	trans	-58.1	-42.8	178.1	-70.7	168	0	0	0	110	I552 I554 V558 I559 I560	I552-I556 HydrophobicContact CG2-CD1 3.79Å; I552-I556 HydrophobicContact CG2-CG1 4.36Å; I552-I556 VanDerWaalsContact O-CG1 3.31Å; I552-I556 WeakPolarHBondContact O-CG1 3.33Å; I552-I556 PolarHBondContact O-N 2.98Å; I554-I556 VanDerWaalsContact C-N 3.32Å; I554-I556 PolarHBondContact O-N 3.44Å; I556-V558 PolarHBondContact O-N 2.88Å; I556-I559 PolarHBondContact O-N 2.97Å; I556-I560 HydrophobicContact CG2-CD1 3.68Å; I556-I560 HydrophobicContact CG2-CG1 4.23Å; I556-I560 WeakPolarHBondContact O-CB 3.32Å; I556-I560 VanDerWaalsContact O-CG1 3.22Å; I556-I560 WeakPolarHBondContact O-CG1 3.39Å; I556-I560 PolarHBondContact O-N 2.7Å
557	D	92.5	Very high	90.9	Very high	8 Å²	8	36.5 Å²	36.5	4%	0.043	19%	0.186	C	C	.	.	H	α-helix	trans	-61.5	-42.9	176.5	179.9	72.4	0	0	0	113	Y471 A553 I554 T555 I560 R561 R633	Y471-D557 WeakPolarHBondContact CE2-OD1 3.49Å; Y471-D557 PolarHBondContact OH-OD1 2.83Å; A553-D557 PolarHBondContact O-N 2.98Å; A553-D557 VanDerWaalsContact O-N 3.11Å; I554-D557 WeakPolarHBondContact O-CB 3.26Å; I554-D557 PolarHBondContact O-N 3.31Å; I554-D557 VanDerWaalsContact O-N 3.16Å; T555-D557 VanDerWaalsContact C-N 3.25Å; T555-D557 PolarHBondContact O-N 3.18Å; D557-I560 PolarHBondContact O-N 2.89Å; D557-R561 WeakPolarHBondContact O-CG 3.46Å; D557-R561 PolarHBondContact O-N 3.3Å; D557-R561 IonicContact OD1-NE 3.43Å; D557-R561 IonicContact OD2-CZ 2.71Å; D557-R561 IonicContact OD2-NE 3.22Å; D557-R561 PolarHBondContact OD2-NE 3.39Å; D557-R561 VanDerWaalsContact OD2-NE 3.15Å; D557-R561 IonicContact OD2-NH2 2.84Å; D557-R561 PolarHBondContact OD2-NH2 3.33Å; D557-R633 IonicContact OD2-CZ 4Å; D557-R633 VanDerWaalsContact OD2-CZ 3.22Å; D557-R633 IonicContact OD2-NH1 2.58Å; D557-R633 PolarHBondContact OD2-NH1 3.15Å; D557-R633 IonicContact OD2-NH2 3.73Å; D557-R633 PolarHBondContact OD2-NH2 3.19Å
558	V	91.4	Very high	90.7	Very high	18 Å²	18	39 Å²	39	11%	0.109	20%	0.199	C	C	.	.	H	α-helix	trans	-64.1	-40.7	174.8	173.4	0	0	0	0	111.2	I554 T555 I556 R561 M562 W571 D580 L584	I554-V558 WeakPolarHBondContact O-CG2 3.33Å; I554-V558 PolarHBondContact O-N 2.86Å; T555-V558 PolarHBondContact O-N 3.4Å; T555-V558 VanDerWaalsContact O-N 3.15Å; I556-V558 PolarHBondContact O-N 2.88Å; V558-R561 WeakPolarHBondContact O-CB 3.06Å; V558-R561 PolarHBondContact O-N 3.46Å; V558-M562 WeakPolarHBondContact O-CB 3.49Å; V558-M562 PolarHBondContact O-N 3.21Å; V558-W571 HydrophobicContact CG1-CH2 4.01Å; V558-D580 HydrophobicContact CG2-CB 4.22Å; V558-L584 HydrophobicContact CB-CD1 4.3Å; V558-L584 HydrophobicContact CG2-CD1 3.9Å
559	I	92.8	Very high	90.5	Very high	75 Å²	75	42.3 Å²	42.3	39%	0.385	21%	0.214	S	C	.	.	H	α-helix	trans	-65.9	-44.3	176.5	-67.6	170.1	0	0	0	111.1	T555 I556 R561 M562 I563	T555-I559 HydrophobicContact CG2-CD1 3.67Å; T555-I559 HydrophobicContact CG2-CG1 4.31Å; T555-I559 VanDerWaalsContact O-CG1 3.31Å; T555-I559 WeakPolarHBondContact O-CG1 3.36Å; T555-I559 PolarHBondContact O-N 2.84Å; I556-I559 PolarHBondContact O-N 2.97Å; I559-R561 VanDerWaalsContact C-N 3.29Å; I559-R561 PolarHBondContact O-N 3.12Å; I559-M562 WeakPolarHBondContact O-CB 3.47Å; I559-M562 PolarHBondContact O-N 3.43Å; I559-M562 VanDerWaalsContact O-N 3.13Å; I559-I563 HydrophobicContact CG2-CD1 3.88Å; I559-I563 HydrophobicContact CG2-CG1 4.48Å; I559-I563 WeakPolarHBondContact O-CG1 3.17Å; I559-I563 PolarHBondContact O-N 2.95Å
560	I	91.9	Very high	90.1	Very high	62 Å²	62	41.7 Å²	41.7	32%	0.318	22%	0.215	S	C	.	.	H	α-helix	trans	-58.1	-46.4	175	-72.2	170.7	0	0	0	109.3	I335 I556 D557 M562 I563 F564	I335-I560 HydrophobicContact CD1-CG2 3.51Å; I556-I560 HydrophobicContact CG2-CD1 3.68Å; I556-I560 HydrophobicContact CG2-CG1 4.23Å; I556-I560 WeakPolarHBondContact O-CB 3.32Å; I556-I560 VanDerWaalsContact O-CG1 3.22Å; I556-I560 WeakPolarHBondContact O-CG1 3.39Å; I556-I560 PolarHBondContact O-N 2.7Å; D557-I560 PolarHBondContact O-N 2.89Å; I560-M562 VanDerWaalsContact C-N 3.32Å; I560-M562 PolarHBondContact O-N 3.47Å; I560-I563 PolarHBondContact O-N 3.03Å; I560-F564 HydrophobicContact CG2-CD2 3.67Å; I560-F564 HydrophobicContact CG2-CE2 3.9Å; I560-F564 WeakPolarHBondContact O-CD2 3.41Å; I560-F564 PolarHBondContact O-N 3.49Å
561	R	90.5	Very high	89.7	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.008	22%	0.216	C	C	.	.	H	α-helix	trans	-58.8	-43.8	175.4	-74.1	171.5	-174.9	-160.7	2	111.4	W332 I335 Y471 E475 D557 V558 I559 I563 F564 C565 W571 D580 R633 R636	W332-R561 HydrophobicContact CZ3-CB 4.17Å; W332-R561 HydrophobicContact CZ3-CG 4.4Å; W332-R561 WeakPolarHBondContact CZ3-O 3.39Å; I335-R561 HydrophobicContact CG2-CG 3.57Å; Y471-R561 PolarHBondContact OH-NE 2.91Å; Y471-R561 PolarHBondContact OH-NH2 3.2Å; E475-R561 IonicContact OE1-NH2 3.64Å; E475-R561 PolarHBondContact OE1-NH2 2.95Å; E475-R561 IonicContact OE2-NH2 2.62Å; E475-R561 PolarHBondContact OE2-NH2 3.31Å; D557-R561 WeakPolarHBondContact O-CG 3.46Å; D557-R561 PolarHBondContact O-N 3.3Å; D557-R561 IonicContact OD1-NE 3.43Å; D557-R561 IonicContact OD2-CZ 2.71Å; D557-R561 IonicContact OD2-NE 3.22Å; D557-R561 PolarHBondContact OD2-NE 3.39Å; D557-R561 VanDerWaalsContact OD2-NE 3.15Å; D557-R561 IonicContact OD2-NH2 2.84Å; D557-R561 PolarHBondContact OD2-NH2 3.33Å; V558-R561 WeakPolarHBondContact O-CB 3.06Å; V558-R561 PolarHBondContact O-N 3.46Å; I559-R561 VanDerWaalsContact C-N 3.29Å; I559-R561 PolarHBondContact O-N 3.12Å; R561-I563 PolarHBondContact O-N 3.26Å; R561-F564 PolarHBondContact O-N 3.27Å; R561-C565 WeakPolarHBondContact O-CB 3.43Å; R561-C565 PolarHBondContact O-N 2.8Å; R561-W571 HydrophobicContact CB-CH2 4.03Å; R561-W571 HydrophobicContact CB-CZ2 3.38Å; R561-W571 HydrophobicContact CG-CZ2 4.42Å; R561-D580 IonicContact NH1-OD2 3.84Å; R561-D580 PolarHBondContact NH1-OD2 3.4Å; R561-R633 VanDerWaalsContact NH1-NH2 3.16Å; R561-R636 VanDerWaalsContact NH1-NH1 3.16Å
562	M	90.2	Very high	89.6	Confident	79 Å²	79	46.4 Å²	46.4	39%	0.389	24%	0.236	S	C	.	.	H	α-helix	trans	-60.6	-40.7	177.3	-173.6	176.6	64.5	0	0	112.8	V558 I559 I560 C565 I568 W571	V558-M562 WeakPolarHBondContact O-CB 3.49Å; V558-M562 PolarHBondContact O-N 3.21Å; I559-M562 WeakPolarHBondContact O-CB 3.47Å; I559-M562 PolarHBondContact O-N 3.43Å; I559-M562 VanDerWaalsContact O-N 3.13Å; I560-M562 VanDerWaalsContact C-N 3.32Å; I560-M562 PolarHBondContact O-N 3.47Å; M562-C565 PolarHBondContact O-SG 3.21Å; M562-I568 HydrophobicContact CG-CD1 3.62Å; M562-I568 HydrophobicContact CG-CG1 4.08Å; M562-I568 HydrophobicContact SD-CD1 4.11Å; M562-W571 HydrophobicContact CB-CE3 4.49Å; M562-W571 HydrophobicContact CB-CH2 4.04Å; M562-W571 HydrophobicContact CB-CZ3 3.71Å; M562-W571 HydrophobicContact CG-CZ3 4.08Å
563	I	89.9	Confident	89.3	Confident	60 Å²	60	50 Å²	50	31%	0.308	25%	0.249	S	C	.	.	H	α-helix	trans	-70.2	-40.7	180	-66.8	165.9	0	0	0	111.7	W318 W324 I559 I560 R561	W318-I563 HydrophobicContact CZ2-CG2 4.4Å; W324-I563 HydrophobicContact CH2-CG2 4.36Å; W324-I563 HydrophobicContact CZ2-CG2 4.27Å; I559-I563 HydrophobicContact CG2-CD1 3.88Å; I559-I563 HydrophobicContact CG2-CG1 4.48Å; I559-I563 WeakPolarHBondContact O-CG1 3.17Å; I559-I563 PolarHBondContact O-N 2.95Å; I560-I563 PolarHBondContact O-N 3.03Å; R561-I563 PolarHBondContact O-N 3.26Å
564	F	89.1	Confident	89	Confident	27 Å²	27	51.3 Å²	51.3	12%	0.118	26%	0.257	C	S	.	.	H	α-helix	trans	-93.4	-14.1	-174	-66.6	-68.6	0	0	0	114.5	W324 F327 R328 I331 W332 I560 R561	W324-F564 HydrophobicContact CH2-CD1 4.34Å; W324-F564 AromaticContact CH2-CE1 3.61Å; W324-F564 HydrophobicContact CH2-CE1 3.61Å; W324-F564 HydrophobicContact CH2-CZ 4.22Å; W324-F564 HydrophobicContact CZ2-CD1 4.48Å; W324-F564 HydrophobicContact CZ2-CE1 4.18Å; W324-F564 HydrophobicContact CZ3-CE1 4.18Å; F327-F564 HydrophobicContact CD1-CE1 4.18Å; F327-F564 AromaticContact CE1-CE1 3.96Å; F327-F564 HydrophobicContact CE1-CE1 3.96Å; F327-F564 HydrophobicContact CE1-CZ 4.21Å; R328-F564 HydrophobicContact CB-CD1 4.29Å; R328-F564 HydrophobicContact CG-CB 4.45Å; R328-F564 HydrophobicContact CG-CD1 4.18Å; R328-F564 VanDerWaalsContact CG-O 3.24Å; R328-F564 WeakPolarHBondContact CG-O 3.36Å; R328-F564 PolarHBondContact NE-O 3.48Å; I331-F564 HydrophobicContact CB-CD1 4.16Å; I331-F564 HydrophobicContact CB-CE1 4.36Å; I331-F564 HydrophobicContact CB-CG 4.31Å; I331-F564 HydrophobicContact CD1-CD1 4.33Å; I331-F564 HydrophobicContact CD1-CE1 3.66Å; I331-F564 HydrophobicContact CD1-CE2 4.15Å; I331-F564 HydrophobicContact CD1-CZ 3.57Å; I331-F564 HydrophobicContact CG2-CB 4.23Å; I331-F564 HydrophobicContact CG2-CD1 4.02Å; I331-F564 HydrophobicContact CG2-CD2 3.64Å; I331-F564 HydrophobicContact CG2-CE1 4.29Å; I331-F564 HydrophobicContact CG2-CE2 3.96Å; I331-F564 HydrophobicContact CG2-CG 3.69Å; I331-F564 HydrophobicContact CG2-CZ 4.27Å; W332-F564 HydrophobicContact CE3-CB 4.16Å; I560-F564 HydrophobicContact CG2-CD2 3.67Å; I560-F564 HydrophobicContact CG2-CE2 3.9Å; I560-F564 WeakPolarHBondContact O-CD2 3.41Å; I560-F564 PolarHBondContact O-N 3.49Å; R561-F564 PolarHBondContact O-N 3.27Å
565	C	86.2	Confident	88.7	Confident	2 Å²	2	57 Å²	57	1%	0.014	29%	0.287	C	S	.	.	S	Bend	trans	-58.9	145.1	178.5	70.6	0	0	0	0	111.2	R328 W332 R561 M562 W571	R328-C565 VanDerWaalsContact CZ-O 3.25Å; R328-C565 PolarHBondContact NE-O 3.49Å; R328-C565 PolarHBondContact NH2-O 2.52Å; W332-C565 HydrophobicContact CE3-CB 4.26Å; W332-C565 HydrophobicContact CH2-CB 3.65Å; W332-C565 HydrophobicContact CZ2-CB 4.29Å; W332-C565 VanDerWaalsContact CZ3-CA 3.47Å; W332-C565 HydrophobicContact CZ3-CB 3.63Å; R561-C565 WeakPolarHBondContact O-CB 3.43Å; R561-C565 PolarHBondContact O-N 2.8Å; M562-C565 PolarHBondContact O-SG 3.21Å; C565-W571 HydrophobicContact CB-CB 3.87Å; C565-W571 HydrophobicContact CB-CD2 4.14Å; C565-W571 HydrophobicContact CB-CG 3.75Å
566	P	82.2	Confident	88.2	Confident	14 Å²	14	58.5 Å²	58.5	9%	0.091	30%	0.298	C	S	.	.	S	Bend	trans	-68.6	-36.1	-176.5	26	-34.2	0	0	0	113.7	V313 P315 D316 R328 P339 L341	V313-P566 HydrophobicContact CG1-CB 4.33Å; V313-P566 HydrophobicContact CG1-CG 4.31Å; P315-P566 CarbonylContact C-O 3.57Å; P315-P566 WeakPolarHBondContact CA-O 3.39Å; P315-P566 HydrophobicContact CB-CB 4.35Å; D316-P566 PolarHBondContact N-O 3.1Å; R328-P566 VanDerWaalsContact NH2-C 3.25Å; R328-P566 VanDerWaalsContact NH2-CA 3.3Å; R328-P566 PolarHBondContact NH2-O 3.38Å; P339-P566 HydrophobicContact CG-CG 4.05Å; L341-P566 HydrophobicContact CD2-CB 4.03Å
567	S	82.8	Confident	88	Confident	9 Å²	9	54.4 Å²	54.4	6%	0.063	28%	0.277	C	S	.	.			trans	-141	118.6	177.6	47.7	0	0	0	0	109.5	V313 D316 L570 W571	V313-S567 VanDerWaalsContact CG1-OG 3.3Å; V313-S567 WeakPolarHBondContact CG1-OG 3.49Å; D316-S567 VanDerWaalsContact OD2-CA 3.31Å; D316-S567 WeakPolarHBondContact OD2-CA 3.27Å; D316-S567 WeakPolarHBondContact OD2-CB 3.32Å; S567-L570 WeakPolarHBondContact OG-CB 3.32Å; S567-W571 VanDerWaalsContact O-CB 3.27Å; S567-W571 WeakPolarHBondContact O-CB 3.48Å; S567-W571 PolarHBondContact O-N 3.45Å
568	I	87.2	Confident	87.9	Confident	78 Å²	78	58.5 Å²	58.5	40%	0.4	30%	0.299	S	S	.	.	H	α-helix	trans	-66.9	-44	-168.6	-168.7	164.9	0	0	0	111.9	M562 W571 F572	M562-I568 HydrophobicContact CG-CD1 3.62Å; M562-I568 HydrophobicContact CG-CG1 4.08Å; M562-I568 HydrophobicContact SD-CD1 4.11Å; I568-W571 PolarHBondContact O-N 3.32Å; I568-F572 VanDerWaalsContact O-CB 3.22Å; I568-F572 WeakPolarHBondContact O-CB 3.46Å; I568-F572 PolarHBondContact O-N 3.2Å
569	M	87	Confident	87.8	Confident	126 Å²	126	59.3 Å²	59.3	62%	0.621	30%	0.302	S	S	*	.	H	α-helix	trans	-67.2	-45.9	-178.1	-68.7	-60.6	-168.8	0	0	111.7	W571 F572 F573	M569-W571 VanDerWaalsContact C-N 3.31Å; M569-W571 PolarHBondContact O-N 2.99Å; M569-F572 PolarHBondContact O-N 3.25Å; M569-F573 WeakPolarHBondContact O-CD2 3.42Å; M569-F573 PolarHBondContact O-N 2.71Å; M569-F573 HydrophobicContact SD-CE2 4.38Å
570	L	85.3	Confident	87.7	Confident	103 Å²	103	55.8 Å²	55.8	54%	0.539	28%	0.284	S	S	.	.	H	α-helix	trans	-63.6	-40.8	178.7	-176.6	64.9	0	0	0	111.3	V313 S567 S574	V313-L570 HydrophobicContact CG1-CD2 4.06Å; V313-L570 HydrophobicContact CG2-CD2 3.78Å; S567-L570 WeakPolarHBondContact OG-CB 3.32Å; L570-S574 PolarHBondContact O-N 3Å
571	W	86.9	Confident	87.7	Confident	18 Å²	18	55.4 Å²	55.4	7%	0.068	28%	0.282	C	S	.	.	H	α-helix	trans	-65.3	-42.9	176.1	174.3	74.6	0	0	0	111.8	W332 V558 R561 M562 C565 S567 I568 M569 S574 T577	W332-W571 AromaticContact CH2-CD1 3.58Å; W332-W571 HydrophobicContact CH2-CG 4.39Å; W332-W571 AromaticContact CH2-NE1 3.64Å; V558-W571 HydrophobicContact CG1-CH2 4.01Å; R561-W571 HydrophobicContact CB-CH2 4.03Å; R561-W571 HydrophobicContact CB-CZ2 3.38Å; R561-W571 HydrophobicContact CG-CZ2 4.42Å; M562-W571 HydrophobicContact CB-CE3 4.49Å; M562-W571 HydrophobicContact CB-CH2 4.04Å; M562-W571 HydrophobicContact CB-CZ3 3.71Å; M562-W571 HydrophobicContact CG-CZ3 4.08Å; C565-W571 HydrophobicContact CB-CB 3.87Å; C565-W571 HydrophobicContact CB-CD2 4.14Å; C565-W571 HydrophobicContact CB-CG 3.75Å; S567-W571 VanDerWaalsContact O-CB 3.27Å; S567-W571 WeakPolarHBondContact O-CB 3.48Å; S567-W571 PolarHBondContact O-N 3.45Å; I568-W571 PolarHBondContact O-N 3.32Å; M569-W571 VanDerWaalsContact C-N 3.31Å; M569-W571 PolarHBondContact O-N 2.99Å; W571-S574 WeakPolarHBondContact O-CB 3.07Å; W571-S574 PolarHBondContact O-N 2.84Å; W571-S574 PolarHBondContact O-OG 3.36Å; W571-T577 HydrophobicContact CD2-CG2 3.95Å; W571-T577 VanDerWaalsContact CE2-OG1 3.26Å; W571-T577 HydrophobicContact CE3-CG2 4.02Å; W571-T577 HydrophobicContact CH2-CG2 3.61Å; W571-T577 HydrophobicContact CZ2-CG2 3.49Å; W571-T577 VanDerWaalsContact CZ2-CG2 3.49Å; W571-T577 HydrophobicContact CZ3-CG2 3.87Å; W571-T577 PolarHBondContact NE1-OG1 3.35Å; W571-T577 WeakPolarHBondContact O-CB 3.45Å; W571-T577 PolarHBondContact O-OG1 3.19Å
572	F	88.4	Confident	87.8	Confident	97 Å²	97	57.7 Å²	57.7	43%	0.425	29%	0.294	S	S	.	.	H	α-helix	trans	-63.3	-42	-179.7	-171.4	-98.3	0	0	0	112.4	I568 M569 S574 I581	I568-F572 VanDerWaalsContact O-CB 3.22Å; I568-F572 WeakPolarHBondContact O-CB 3.46Å; I568-F572 PolarHBondContact O-N 3.2Å; M569-F572 PolarHBondContact O-N 3.25Å; F572-S574 VanDerWaalsContact C-N 3.25Å; F572-S574 PolarHBondContact O-N 3.24Å; F572-I581 HydrophobicContact CD2-CD1 3.71Å; F572-I581 HydrophobicContact CE2-CD1 3.31Å; F572-I581 HydrophobicContact CZ-CD1 3.95Å
573	F	88.9	Confident	87.8	Confident	158 Å²	158	53.9 Å²	53.9	69%	0.693	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	3.5	177.2	-69.8	-63.9	0	0	0	114.6	M569	M569-F573 WeakPolarHBondContact O-CD2 3.42Å; M569-F573 PolarHBondContact O-N 2.71Å; M569-F573 HydrophobicContact SD-CE2 4.38Å
574	S	86.5	Confident	87.9	Confident	37 Å²	37	51.6 Å²	51.6	26%	0.259	26%	0.264	S	S	.	.	S	Bend	trans	-73.2	138.1	174.9	75.8	0	0	0	0	111	L570 W571 F572 S576 T577 L578	L570-S574 PolarHBondContact O-N 3Å; W571-S574 WeakPolarHBondContact O-CB 3.07Å; W571-S574 PolarHBondContact O-N 2.84Å; W571-S574 PolarHBondContact O-OG 3.36Å; F572-S574 VanDerWaalsContact C-N 3.25Å; F572-S574 PolarHBondContact O-N 3.24Å; S574-S576 PolarHBondContact O-N 2.72Å; S574-S576 VanDerWaalsContact O-N 3.13Å; S574-T577 PolarHBondContact O-N 3.48Å; S574-T577 WeakPolarHBondContact OG-CB 3.37Å; S574-T577 PolarHBondContact OG-N 2.82Å; S574-T577 PolarHBondContact OG-OG1 2.97Å; S574-L578 PolarHBondContact O-N 2.91Å
575	L	85.7	Confident	88	Confident	121 Å²	121	53.4 Å²	53.4	63%	0.634	27%	0.274	S	S	*	.	H	α-helix	trans	-52.5	-38.7	-179.2	-179.4	66.2	0	0	0	112.3	L578 I579	L575-L578 PolarHBondContact O-N 2.83Å; L575-I579 HydrophobicContact CG-CD1 4.28Å; L575-I579 WeakPolarHBondContact O-CD1 3.27Å; L575-I579 VanDerWaalsContact O-CG1 3.3Å; L575-I579 WeakPolarHBondContact O-CG1 3.26Å; L575-I579 PolarHBondContact O-N 2.98Å
576	S	83.5	Confident	88.1	Confident	48 Å²	48	53.5 Å²	53.5	34%	0.336	27%	0.274	S	S	.	.	H	α-helix	trans	-68.7	-39.2	179.8	-53.5	0	0	0	0	112.8	S574 D580	S574-S576 PolarHBondContact O-N 2.72Å; S574-S576 VanDerWaalsContact O-N 3.13Å; S576-D580 PolarHBondContact O-N 3.46Å
577	T	89.2	Confident	88.4	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-72.5	-35.4	176.5	-59.9	0	0	0	0	111.6	W571 S574 I579 D580 I581	W571-T577 HydrophobicContact CD2-CG2 3.95Å; W571-T577 VanDerWaalsContact CE2-OG1 3.26Å; W571-T577 HydrophobicContact CE3-CG2 4.02Å; W571-T577 HydrophobicContact CH2-CG2 3.61Å; W571-T577 HydrophobicContact CZ2-CG2 3.49Å; W571-T577 VanDerWaalsContact CZ2-CG2 3.49Å; W571-T577 HydrophobicContact CZ3-CG2 3.87Å; W571-T577 PolarHBondContact NE1-OG1 3.35Å; W571-T577 WeakPolarHBondContact O-CB 3.45Å; W571-T577 PolarHBondContact O-OG1 3.19Å; S574-T577 PolarHBondContact O-N 3.48Å; S574-T577 WeakPolarHBondContact OG-CB 3.37Å; S574-T577 PolarHBondContact OG-N 2.82Å; S574-T577 PolarHBondContact OG-OG1 2.97Å; T577-I579 VanDerWaalsContact C-N 3.29Å; T577-I579 PolarHBondContact O-N 2.91Å; T577-D580 WeakPolarHBondContact O-CB 3.42Å; T577-D580 PolarHBondContact O-N 3.47Å; T577-D580 VanDerWaalsContact O-N 3.15Å; T577-I581 HydrophobicContact CG2-CD1 3.9Å; T577-I581 HydrophobicContact CG2-CG1 4.4Å; T577-I581 WeakPolarHBondContact O-CG1 3.38Å; T577-I581 PolarHBondContact O-N 2.86Å
578	L	90.3	Very high	88.8	Confident	95 Å²	95	58 Å²	58	50%	0.497	29%	0.29	S	S	.	.	H	α-helix	trans	-60.5	-41.1	175	-173.3	145.9	0	0	0	111.5	S574 L575 I581 L582	S574-L578 PolarHBondContact O-N 2.91Å; L575-L578 PolarHBondContact O-N 2.83Å; L578-I581 PolarHBondContact O-N 3.15Å; L578-L582 VanDerWaalsContact O-CB 3.32Å; L578-L582 WeakPolarHBondContact O-CB 3.33Å; L578-L582 PolarHBondContact O-N 2.94Å
579	I	90.5	Very high	88.7	Confident	34 Å²	34	56.5 Å²	56.5	17%	0.174	29%	0.285	C	S	.	.	H	α-helix	trans	-64.7	-41.7	174.2	-64.7	164.3	0	0	0	111.3	L575 T577 I581 L582 S583 L629 F632	L575-I579 HydrophobicContact CG-CD1 4.28Å; L575-I579 WeakPolarHBondContact O-CD1 3.27Å; L575-I579 VanDerWaalsContact O-CG1 3.3Å; L575-I579 WeakPolarHBondContact O-CG1 3.26Å; L575-I579 PolarHBondContact O-N 2.98Å; T577-I579 VanDerWaalsContact C-N 3.29Å; T577-I579 PolarHBondContact O-N 2.91Å; I579-I581 VanDerWaalsContact C-N 3.32Å; I579-I581 PolarHBondContact O-N 3.05Å; I579-L582 PolarHBondContact O-N 3.38Å; I579-S583 WeakPolarHBondContact O-CB 3.45Å; I579-S583 PolarHBondContact O-N 2.93Å; I579-L629 HydrophobicContact CG2-CB 4Å; I579-F632 HydrophobicContact CG2-CB 3.82Å; I579-F632 HydrophobicContact CG2-CD2 4.25Å; I579-F632 HydrophobicContact CG2-CG 4.32Å
580	D	90	Very high	88.5	Confident	2 Å²	2	53.9 Å²	53.9	1%	0.011	27%	0.272	C	S	.	.	H	α-helix	trans	-57	-46.4	175.3	-68.9	-3.5	0	0	0	110.9	V558 R561 S576 T577 S583 R633 R636	V558-D580 HydrophobicContact CG2-CB 4.22Å; R561-D580 IonicContact NH1-OD2 3.84Å; R561-D580 PolarHBondContact NH1-OD2 3.4Å; S576-D580 PolarHBondContact O-N 3.46Å; T577-D580 WeakPolarHBondContact O-CB 3.42Å; T577-D580 PolarHBondContact O-N 3.47Å; T577-D580 VanDerWaalsContact O-N 3.15Å; D580-S583 PolarHBondContact O-N 2.96Å; D580-S583 PolarHBondContact O-OG 3.15Å; D580-R633 WeakPolarHBondContact OD1-CD 3.37Å; D580-R633 WeakPolarHBondContact OD1-CG 3.27Å; D580-R633 IonicContact OD1-CZ 3.25Å; D580-R633 IonicContact OD1-NE 3.24Å; D580-R633 PolarHBondContact OD1-NE 2.7Å; D580-R633 IonicContact OD1-NH2 3.9Å; D580-R633 IonicContact OD2-CZ 3.01Å; D580-R633 IonicContact OD2-NE 3.05Å; D580-R633 PolarHBondContact OD2-NE 3.39Å; D580-R633 IonicContact OD2-NH2 3.85Å; D580-R633 PolarHBondContact OD2-NH2 2.95Å; D580-R636 IonicContact OD2-NH1 3.66Å; D580-R636 PolarHBondContact OD2-NH1 3.36Å
581	I	92	Very high	88.5	Confident	53 Å²	53	53.8 Å²	53.8	27%	0.272	27%	0.267	S	S	.	.	H	α-helix	trans	-67.7	-46.2	179.6	-65.8	164.5	0	0	0	111.1	F572 T577 L578 I579 S583 L584 I585	F572-I581 HydrophobicContact CD2-CD1 3.71Å; F572-I581 HydrophobicContact CE2-CD1 3.31Å; F572-I581 HydrophobicContact CZ-CD1 3.95Å; T577-I581 HydrophobicContact CG2-CD1 3.9Å; T577-I581 HydrophobicContact CG2-CG1 4.4Å; T577-I581 WeakPolarHBondContact O-CG1 3.38Å; T577-I581 PolarHBondContact O-N 2.86Å; L578-I581 PolarHBondContact O-N 3.15Å; I579-I581 VanDerWaalsContact C-N 3.32Å; I579-I581 PolarHBondContact O-N 3.05Å; I581-S583 PolarHBondContact O-N 3.49Å; I581-L584 WeakPolarHBondContact O-CB 3.19Å; I581-L584 PolarHBondContact O-N 3.16Å; I581-I585 PolarHBondContact O-N 3.34Å
582	L	91.6	Very high	88.4	Confident	50 Å²	50	57.5 Å²	57.5	26%	0.262	29%	0.287	S	S	.	.	H	α-helix	trans	-57.9	-33.4	177.6	-177.6	56.1	0	0	0	111.5	L578 I579 L584 I585 F626 L629	L578-L582 VanDerWaalsContact O-CB 3.32Å; L578-L582 WeakPolarHBondContact O-CB 3.33Å; L578-L582 PolarHBondContact O-N 2.94Å; I579-L582 PolarHBondContact O-N 3.38Å; L582-L584 VanDerWaalsContact C-N 3.27Å; L582-L584 PolarHBondContact O-N 3.37Å; L582-I585 HydrophobicContact CD1-CD1 3.71Å; L582-I585 WeakPolarHBondContact O-CB 3.17Å; L582-I585 PolarHBondContact O-N 3.29Å; L582-F626 HydrophobicContact CD1-CD1 3.93Å; L582-F626 HydrophobicContact CD1-CD2 4.48Å; L582-F626 HydrophobicContact CD1-CE1 4Å; L582-F626 HydrophobicContact CD1-CG 4.18Å; L582-F626 HydrophobicContact CD1-CZ 4.31Å; L582-F626 HydrophobicContact CD2-CD1 4.12Å; L582-F626 HydrophobicContact CD2-CE1 4.17Å; L582-F626 HydrophobicContact CG-CD1 3.87Å; L582-F626 HydrophobicContact CG-CE1 4.24Å; L582-F626 HydrophobicContact CG-CG 4.33Å; L582-L629 HydrophobicContact CB-CD1 4.2Å; L582-L629 HydrophobicContact CD2-CD1 3.42Å; L582-L629 VanDerWaalsContact CD2-CD1 3.42Å; L582-L629 HydrophobicContact CG-CD1 3.58Å
583	S	91.1	Very high	88	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-13.5	177	84.4	0	0	0	0	115.2	I579 D580 I581 R630	I579-S583 WeakPolarHBondContact O-CB 3.45Å; I579-S583 PolarHBondContact O-N 2.93Å; D580-S583 PolarHBondContact O-N 2.96Å; D580-S583 PolarHBondContact O-OG 3.15Å; I581-S583 PolarHBondContact O-N 3.49Å; S583-R630 PolarHBondContact O-NE 3.33Å
584	L	92	Very high	87.4	Confident	12 Å²	12	54.7 Å²	54.7	6%	0.063	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-20	175.1	-74.1	174.2	0	0	0	112.9	I554 V558 I581 L582 P586 F587 Y588	I554-L584 HydrophobicContact CB-CD2 4.09Å; I554-L584 HydrophobicContact CG2-CD1 4.41Å; I554-L584 HydrophobicContact CG2-CD2 3.68Å; I554-L584 HydrophobicContact CG2-CG 4.12Å; V558-L584 HydrophobicContact CB-CD1 4.3Å; V558-L584 HydrophobicContact CG2-CD1 3.9Å; I581-L584 WeakPolarHBondContact O-CB 3.19Å; I581-L584 PolarHBondContact O-N 3.16Å; L582-L584 VanDerWaalsContact C-N 3.27Å; L582-L584 PolarHBondContact O-N 3.37Å; L584-P586 VanDerWaalsContact C-N 3.33Å; L584-F587 PolarHBondContact O-N 2.89Å; L584-Y588 HydrophobicContact CB-CD2 4.13Å; L584-Y588 HydrophobicContact CB-CE2 4.15Å; L584-Y588 WeakPolarHBondContact O-CD2 3.34Å; L584-Y588 PolarHBondContact O-N 3.44Å
585	I	90.3	Very high	87.1	Confident	64 Å²	64	56.1 Å²	56.1	33%	0.328	27%	0.274	S	S	.	.	H	α-helix	trans	-48.9	-45.4	-179.3	-70.6	-174.2	0	0	0	113	I581 L582 F587 Y588 C589	I581-I585 PolarHBondContact O-N 3.34Å; L582-I585 HydrophobicContact CD1-CD1 3.71Å; L582-I585 WeakPolarHBondContact O-CB 3.17Å; L582-I585 PolarHBondContact O-N 3.29Å; I585-F587 VanDerWaalsContact C-N 3.33Å; I585-F587 PolarHBondContact O-N 3.42Å; I585-Y588 PolarHBondContact O-N 2.93Å; I585-C589 VanDerWaalsContact CG2-SG 3.6Å; I585-C589 VanDerWaalsContact O-CB 3.29Å; I585-C589 WeakPolarHBondContact O-CB 3.3Å; I585-C589 PolarHBondContact O-N 3.42Å; I585-C589 PolarHBondContact O-SG 2.59Å
586	P	88.6	Confident	86.6	Confident	4 Å²	4	55.9 Å²	55.9	3%	0.026	27%	0.273	C	S	.	.	H	α-helix	trans	-59.4	-42.4	-175.9	-25.9	37.3	0	0	0	113.1	L584 E590 L623 K624 F626 V627	L584-P586 VanDerWaalsContact C-N 3.33Å; P586-E590 WeakPolarHBondContact O-CB 3.46Å; P586-E590 PolarHBondContact O-N 3.26Å; P586-L623 HydrophobicContact CB-CB 4.36Å; P586-L623 HydrophobicContact CG-CB 4.43Å; P586-L623 WeakPolarHBondContact CG-O 3.11Å; P586-K624 HydrophobicContact CB-CG 4.37Å; P586-F626 HydrophobicContact CG-CB 3.88Å; P586-V627 HydrophobicContact CB-CG2 4.37Å; P586-V627 HydrophobicContact CG-CG2 4.27Å
587	F	88.7	Confident	86	Confident	32 Å²	32	54.6 Å²	54.6	14%	0.14	26%	0.263	C	S	.	.	H	α-helix	trans	-66.4	-46.1	-180	172	-100.7	0	0	0	112	I548 I552 L584 I585 E590 F591	I548-F587 HydrophobicContact CB-CE2 4.4Å; I548-F587 HydrophobicContact CG1-CE2 4.17Å; I548-F587 HydrophobicContact CG2-CE2 4.3Å; I552-F587 HydrophobicContact CG1-CZ 4.47Å; L584-F587 PolarHBondContact O-N 2.89Å; I585-F587 VanDerWaalsContact C-N 3.33Å; I585-F587 PolarHBondContact O-N 3.42Å; F587-E590 PolarHBondContact O-N 3.11Å; F587-F591 WeakPolarHBondContact O-CB 3.34Å; F587-F591 PolarHBondContact O-N 2.83Å
588	Y	90.6	Very high	85.1	Confident	87 Å²	87	61.2 Å²	61.2	34%	0.341	29%	0.289	S	S	.	.	H	α-helix	trans	-71.4	-35.2	-179.4	-76.9	-71.1	0	0	0	112.9	T555 L584 I585 F591 I592	T555-Y588 WeakPolarHBondContact CB-OH 3.03Å; T555-Y588 WeakPolarHBondContact CG2-OH 3.25Å; T555-Y588 PolarHBondContact OG1-OH 3.42Å; L584-Y588 HydrophobicContact CB-CD2 4.13Å; L584-Y588 HydrophobicContact CB-CE2 4.15Å; L584-Y588 WeakPolarHBondContact O-CD2 3.34Å; L584-Y588 PolarHBondContact O-N 3.44Å; I585-Y588 PolarHBondContact O-N 2.93Å; Y588-F591 PolarHBondContact O-N 3.41Å; Y588-I592 WeakPolarHBondContact O-CB 2.99Å; Y588-I592 VanDerWaalsContact O-CG1 3.23Å; Y588-I592 WeakPolarHBondContact O-CG1 3.41Å; Y588-I592 PolarHBondContact O-N 3.13Å
589	C	85.8	Confident	84.1	Confident	45 Å²	45	62.2 Å²	62.2	30%	0.304	30%	0.295	S	S	.	.	H	α-helix	trans	-63.2	-42.6	172.6	-72.1	0	0	0	0	111.1	I585 F593 F620 L623	I585-C589 VanDerWaalsContact CG2-SG 3.6Å; I585-C589 VanDerWaalsContact O-CB 3.29Å; I585-C589 WeakPolarHBondContact O-CB 3.3Å; I585-C589 PolarHBondContact O-N 3.42Å; I585-C589 PolarHBondContact O-SG 2.59Å; C589-F593 WeakPolarHBondContact O-CB 3.39Å; C589-F593 PolarHBondContact O-N 3.4Å; C589-F593 VanDerWaalsContact O-N 3.11Å; C589-F620 HydrophobicContact CB-CD1 4.35Å; C589-F620 HydrophobicContact CB-CE1 3.92Å; C589-L623 HydrophobicContact CB-CD1 4.23Å
590	E	83.6	Confident	83	Confident	72 Å²	72	65.8 Å²	65.8	34%	0.336	32%	0.315	S	S	.	.	H	α-helix	trans	-62.9	-44.8	174.3	-171.3	172.5	162.8	0	0	111.5	P586 F587 F593 Y594 K624	P586-E590 WeakPolarHBondContact O-CB 3.46Å; P586-E590 PolarHBondContact O-N 3.26Å; F587-E590 PolarHBondContact O-N 3.11Å; E590-F593 PolarHBondContact O-N 2.87Å; E590-Y594 WeakPolarHBondContact O-CB 3.48Å; E590-Y594 PolarHBondContact O-N 2.81Å; E590-K624 IonicContact OE1-NZ 2.82Å; E590-K624 WeakPolarHBondContact OE2-CE 3.29Å; E590-K624 IonicContact OE2-NZ 2.91Å; E590-K624 PolarHBondContact OE2-NZ 3.47Å
591	F	85.5	Confident	81.5	Confident	101 Å²	101	69.3 Å²	69.3	44%	0.443	33%	0.334	S	S	.	.	H	α-helix	trans	-65.3	-49.3	178.9	179.1	-100.8	0	0	0	113.5	F587 Y588 F593 Y594 E595	F587-F591 WeakPolarHBondContact O-CB 3.34Å; F587-F591 PolarHBondContact O-N 2.83Å; Y588-F591 PolarHBondContact O-N 3.41Å; F591-F593 VanDerWaalsContact C-N 3.25Å; F591-F593 PolarHBondContact O-N 3.49Å; F591-Y594 WeakPolarHBondContact O-CB 3.17Å; F591-Y594 PolarHBondContact O-N 3.22Å; F591-E595 HydrophobicContact CD1-CG 4.48Å; F591-E595 HydrophobicContact CE1-CG 3.97Å; F591-E595 HydrophobicContact CE2-CG 4.13Å; F591-E595 HydrophobicContact CZ-CG 3.77Å; F591-E595 PolarHBondContact O-N 3.49Å
592	I	84.7	Confident	79.9	Confident	96 Å²	96	74.2 Å²	74.2	49%	0.492	36%	0.36	S	S	.	.	H	α-helix	trans	-60.9	-40.6	178.7	-70.4	166.7	0	0	0	110	Y588 E595 L596	Y588-I592 WeakPolarHBondContact O-CB 2.99Å; Y588-I592 VanDerWaalsContact O-CG1 3.23Å; Y588-I592 WeakPolarHBondContact O-CG1 3.41Å; Y588-I592 PolarHBondContact O-N 3.13Å; I592-E595 PolarHBondContact O-N 2.92Å; I592-L596 HydrophobicContact CG2-CD1 3.87Å; I592-L596 HydrophobicContact CG2-CG 4.29Å; I592-L596 WeakPolarHBondContact O-CB 3.32Å; I592-L596 VanDerWaalsContact O-CG 3.27Å; I592-L596 WeakPolarHBondContact O-CG 3.31Å; I592-L596 PolarHBondContact O-N 3.45Å
593	F	78.8	Confident	78.2	Confident	50 Å²	50	77.8 Å²	77.8	22%	0.219	38%	0.38	C	S	.	.	H	α-helix	trans	-66.2	-41.7	178.3	-170.8	-108.4	0	0	0	112	C589 E590 F591 E595 L596 V597 V613 V616 F620	C589-F593 WeakPolarHBondContact O-CB 3.39Å; C589-F593 PolarHBondContact O-N 3.4Å; C589-F593 VanDerWaalsContact O-N 3.11Å; E590-F593 PolarHBondContact O-N 2.87Å; F591-F593 VanDerWaalsContact C-N 3.25Å; F591-F593 PolarHBondContact O-N 3.49Å; F593-E595 PolarHBondContact O-N 3.46Å; F593-L596 PolarHBondContact O-N 3.41Å; F593-V597 HydrophobicContact CD1-CG2 4.45Å; F593-V597 HydrophobicContact CE1-CG2 4.31Å; F593-V597 HydrophobicContact CZ-CG2 4.33Å; F593-V597 WeakPolarHBondContact O-CB 3.49Å; F593-V597 WeakPolarHBondContact O-CG2 3.43Å; F593-V597 PolarHBondContact O-N 2.94Å; F593-V597 VanDerWaalsContact O-N 3.09Å; F593-V613 HydrophobicContact CD1-CG1 4.31Å; F593-V613 HydrophobicContact CD1-CG2 4.29Å; F593-V613 HydrophobicContact CE1-CB 3.8Å; F593-V613 HydrophobicContact CE1-CG1 3.73Å; F593-V613 HydrophobicContact CE1-CG2 3.4Å; F593-V613 HydrophobicContact CZ-CB 4.4Å; F593-V613 HydrophobicContact CZ-CG2 3.77Å; F593-V616 HydrophobicContact CE1-CB 4.43Å; F593-V616 HydrophobicContact CE1-CG1 4.47Å; F593-V616 HydrophobicContact CZ-CB 4.16Å; F593-V616 HydrophobicContact CZ-CG1 4.15Å; F593-V616 HydrophobicContact CZ-CG2 4.42Å; F593-F620 HydrophobicContact CB-CE1 4.39Å; F593-F620 HydrophobicContact CB-CE2 4.22Å; F593-F620 HydrophobicContact CB-CZ 3.62Å; F593-F620 AromaticContact CD1-CE2 3.47Å; F593-F620 HydrophobicContact CD1-CE2 3.47Å; F593-F620 VanDerWaalsContact CD1-CE2 3.47Å; F593-F620 AromaticContact CD1-CZ 3.77Å; F593-F620 HydrophobicContact CD1-CZ 3.77Å; F593-F620 HydrophobicContact CD2-CE2 4.24Å; F593-F620 AromaticContact CD2-CZ 3.95Å; F593-F620 HydrophobicContact CD2-CZ 3.95Å; F593-F620 AromaticContact CE1-CE2 3.72Å; F593-F620 HydrophobicContact CE1-CE2 3.72Å; F593-F620 HydrophobicContact CE1-CZ 4.35Å; F593-F620 HydrophobicContact CE2-CE2 4.49Å; F593-F620 AromaticContact CG-CE2 3.73Å; F593-F620 HydrophobicContact CG-CE2 3.73Å; F593-F620 AromaticContact CG-CZ 3.52Å; F593-F620 HydrophobicContact CG-CZ 3.52Å; F593-F620 HydrophobicContact CZ-CE2 4.25Å
594	Y	76.5	Confident	76.7	Confident	145 Å²	145	81 Å²	81	57%	0.569	40%	0.402	S	S	*	.	H	α-helix	trans	-58.3	-46.8	173.5	179.2	-93.4	0	0	0	112.1	E590 F591 V597 Y598	E590-Y594 WeakPolarHBondContact O-CB 3.48Å; E590-Y594 PolarHBondContact O-N 2.81Å; F591-Y594 WeakPolarHBondContact O-CB 3.17Å; F591-Y594 PolarHBondContact O-N 3.22Å; Y594-V597 PolarHBondContact O-N 2.87Å; Y594-Y598 WeakPolarHBondContact O-CB 3.25Å; Y594-Y598 PolarHBondContact O-N 2.88Å
595	E	80.2	Confident	75.4	Confident	67 Å²	67	85.8 Å²	85.8	31%	0.313	42%	0.424	S	S	.	.	H	α-helix	trans	-66.1	-42	179.1	-75.7	-64.5	150.3	0	0	113.2	F591 I592 F593 V597 Y598 N599	F591-E595 HydrophobicContact CD1-CG 4.48Å; F591-E595 HydrophobicContact CE1-CG 3.97Å; F591-E595 HydrophobicContact CE2-CG 4.13Å; F591-E595 HydrophobicContact CZ-CG 3.77Å; F591-E595 PolarHBondContact O-N 3.49Å; I592-E595 PolarHBondContact O-N 2.92Å; F593-E595 PolarHBondContact O-N 3.46Å; E595-V597 PolarHBondContact O-N 3.35Å; E595-Y598 PolarHBondContact O-N 2.95Å; E595-N599 WeakPolarHBondContact O-CB 3.36Å; E595-N599 PolarHBondContact O-N 3.11Å; E595-N599 PolarHBondContact O-ND2 3.24Å
596	L	76.1	Confident	74	Confident	116 Å²	116	83.8 Å²	83.8	61%	0.607	42%	0.417	S	S	*	.	H	α-helix	trans	-61.2	-36.7	176.2	-75.5	172.8	0	0	0	111.7	I592 F593	I592-L596 HydrophobicContact CG2-CD1 3.87Å; I592-L596 HydrophobicContact CG2-CG 4.29Å; I592-L596 WeakPolarHBondContact O-CB 3.32Å; I592-L596 VanDerWaalsContact O-CG 3.27Å; I592-L596 WeakPolarHBondContact O-CG 3.31Å; I592-L596 PolarHBondContact O-N 3.45Å; F593-L596 PolarHBondContact O-N 3.41Å
597	V	69.6	Low	72.6	Confident	22 Å²	22	86.7 Å²	86.7	13%	0.133	43%	0.432	C	S	.	.	H	α-helix	trans	-76.5	-44	178.9	174	0	0	0	0	110.6	F593 Y594 E595 N599 N600 V613	F593-V597 HydrophobicContact CD1-CG2 4.45Å; F593-V597 HydrophobicContact CE1-CG2 4.31Å; F593-V597 HydrophobicContact CZ-CG2 4.33Å; F593-V597 WeakPolarHBondContact O-CB 3.49Å; F593-V597 WeakPolarHBondContact O-CG2 3.43Å; F593-V597 PolarHBondContact O-N 2.94Å; F593-V597 VanDerWaalsContact O-N 3.09Å; Y594-V597 PolarHBondContact O-N 2.87Å; E595-V597 PolarHBondContact O-N 3.35Å; V597-N599 PolarHBondContact O-N 2.82Å; V597-N600 PolarHBondContact O-N 3.27Å; V597-V613 HydrophobicContact CB-CG2 4.15Å; V597-V613 HydrophobicContact CG1-CG2 3.78Å; V597-V613 HydrophobicContact CG2-CG2 3.43Å; V597-V613 VanDerWaalsContact CG2-CG2 3.43Å
598	Y	70.8	Confident	71.2	Confident	138 Å²	138	93.1 Å²	93.1	54%	0.541	46%	0.455	S	S	.	.	H	α-helix	trans	-61.5	-42	-179.6	-178.5	-99.1	0	0	0	112.5	Y594 E595 N600 N601	Y594-Y598 WeakPolarHBondContact O-CB 3.25Å; Y594-Y598 PolarHBondContact O-N 2.88Å; E595-Y598 PolarHBondContact O-N 2.95Å; Y598-N600 PolarHBondContact O-N 3.24Å; Y598-N601 WeakPolarHBondContact O-CB 3.47Å; Y598-N601 PolarHBondContact O-N 3.4Å
599	N	69.4	Low	69.7	Low	117 Å²	117	93.6 Å²	93.6	63%	0.626	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-17.6	-178.6	-73	-50.5	0	0	0	113.9	E595 V597 N601	E595-N599 WeakPolarHBondContact O-CB 3.36Å; E595-N599 PolarHBondContact O-N 3.11Å; E595-N599 PolarHBondContact O-ND2 3.24Å; V597-N599 PolarHBondContact O-N 2.82Å; N599-N601 VanDerWaalsContact C-N 3.31Å; N599-N601 PolarHBondContact O-N 3.46Å
600	N	66.9	Low	68.5	Low	109 Å²	109	94.7 Å²	94.7	58%	0.583	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	3.1	179.5	-122.5	3.6	0	0	0	113.7	V597 Y598 N602	V597-N600 PolarHBondContact O-N 3.27Å; Y598-N600 PolarHBondContact O-N 3.24Å; N600-N602 PolarHBondContact O-N 3.18Å; N600-N602 VanDerWaalsContact O-N 3.11Å
601	N	58.7	Low	67.6	Low	76 Å²	76	94.1 Å²	94.1	41%	0.406	46%	0.458	S	S	.	.			trans	-85.1	43.9	-169.4	-89.4	2	0	0	0	116.6	Y598 N599 A606	Y598-N601 WeakPolarHBondContact O-CB 3.47Å; Y598-N601 PolarHBondContact O-N 3.4Å; N599-N601 VanDerWaalsContact C-N 3.31Å; N599-N601 PolarHBondContact O-N 3.46Å; N601-A606 HydrophobicContact CB-CB 4.39Å; N601-A606 VanDerWaalsContact OD1-CA 3.31Å; N601-A606 WeakPolarHBondContact OD1-CA 3.5Å; N601-A606 WeakPolarHBondContact OD1-CB 3.45Å
602	N	57.6	Low	66.6	Low	155 Å²	155	96.6 Å²	96.6	83%	0.829	46%	0.464	S	S	*	.	S	Bend	trans	-94.2	5.3	170.2	-83.6	-4.6	0	0	0	115	N600	N600-N602 PolarHBondContact O-N 3.18Å; N600-N602 VanDerWaalsContact O-N 3.11Å
603	N	56.9	Low	65.7	Low	126 Å²	126	93.5 Å²	93.5	67%	0.674	45%	0.449	S	S	*	.	S	Bend	trans	-150.9	163.7	177	-85.3	-33.1	0	0	0	112.6	E605 A606	N603-E605 PolarHBondContact O-N 3.47Å; N603-A606 WeakPolarHBondContact O-CB 3.47Å; N603-A606 PolarHBondContact O-N 2.76Å
604	S	60.3	Low	64.9	Low	67 Å²	67	91.9 Å²	91.9	47%	0.469	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-40.6	-17	172.9	45.3	0	0	0	0	117.1	Y505 A606	Y505-S604 WeakPolarHBondContact OH-CA 3.29Å; Y505-S604 WeakPolarHBondContact OH-CB 3.16Å; S604-A606 PolarHBondContact O-N 3.42Å
605	E	63.4	Low	64.3	Low	112 Å²	112	94 Å²	94	52%	0.523	45%	0.45	S	S	.	.	H	α-helix	trans	-64.7	-19.6	170.5	-68.5	-61.6	146.2	0	0	113.9	N603 I607 W608 W609	N603-E605 PolarHBondContact O-N 3.47Å; E605-I607 PolarHBondContact O-N 3.39Å; E605-I607 VanDerWaalsContact O-N 3.14Å; E605-W608 PolarHBondContact O-N 2.92Å; E605-W608 VanDerWaalsContact O-N 3.17Å; E605-W609 PolarHBondContact O-N 3.07Å
606	A	61.3	Low	63.7	Low	22 Å²	22	92.9 Å²	92.9	18%	0.182	45%	0.447	C	S	.	.	H	α-helix	trans	-48.8	-40.1	177.5	0	0	0	0	0	113.5	N601 N603 S604 L610	N601-A606 HydrophobicContact CB-CB 4.39Å; N601-A606 VanDerWaalsContact OD1-CA 3.31Å; N601-A606 WeakPolarHBondContact OD1-CA 3.5Å; N601-A606 WeakPolarHBondContact OD1-CB 3.45Å; N603-A606 WeakPolarHBondContact O-CB 3.47Å; N603-A606 PolarHBondContact O-N 2.76Å; S604-A606 PolarHBondContact O-N 3.42Å; A606-L610 WeakPolarHBondContact O-CB 3.31Å; A606-L610 PolarHBondContact O-N 2.97Å
607	I	60	Low	63.4	Low	65 Å²	65	89.3 Å²	89.3	33%	0.333	43%	0.428	S	S	.	.	H	α-helix	trans	-74.7	-41.6	-176.5	-65.2	164.4	0	0	0	111.1	Y505 E605 W609 L610 I611	Y505-I607 HydrophobicContact CD2-CD1 3.46Å; Y505-I607 VanDerWaalsContact CD2-CD1 3.46Å; Y505-I607 HydrophobicContact CE2-CD1 3.18Å; Y505-I607 HydrophobicContact CG-CD1 4.29Å; E605-I607 PolarHBondContact O-N 3.39Å; E605-I607 VanDerWaalsContact O-N 3.14Å; I607-W609 VanDerWaalsContact C-N 3.3Å; I607-W609 PolarHBondContact O-N 3Å; I607-L610 WeakPolarHBondContact O-CB 3.31Å; I607-L610 PolarHBondContact O-N 3.43Å; I607-I611 HydrophobicContact CG2-CD1 4.26Å; I607-I611 WeakPolarHBondContact O-CG1 3.38Å; I607-I611 PolarHBondContact O-N 2.68Å
608	W	57.5	Low	63.4	Low	168 Å²	168	94.4 Å²	94.4	64%	0.636	45%	0.45	S	S	*	.	H	α-helix	trans	-64.2	-36.7	174.6	-76	108.7	0	0	0	111.8	E605 R612	E605-W608 PolarHBondContact O-N 2.92Å; E605-W608 VanDerWaalsContact O-N 3.17Å; W608-R612 PolarHBondContact O-N 3.32Å; W608-R612 VanDerWaalsContact O-N 3.12Å
609	W	60.3	Low	63.6	Low	96 Å²	96	96 Å²	96	36%	0.364	46%	0.456	S	S	.	.	H	α-helix	trans	-67.7	-42.7	171.4	-83.4	93.8	0	0	0	112.6	E605 I607 I611 R612 V613	E605-W609 PolarHBondContact O-N 3.07Å; I607-W609 VanDerWaalsContact C-N 3.3Å; I607-W609 PolarHBondContact O-N 3Å; W609-I611 VanDerWaalsContact C-N 3.32Å; W609-I611 PolarHBondContact O-N 3.26Å; W609-R612 CarbonylContact O-C 3.58Å; W609-R612 WeakPolarHBondContact O-CA 3.38Å; W609-R612 WeakPolarHBondContact O-CB 3.45Å; W609-R612 PolarHBondContact O-N 2.88Å; W609-V613 WeakPolarHBondContact O-CG2 3.44Å; W609-V613 PolarHBondContact O-N 2.97Å
610	L	61.1	Low	63.9	Low	69 Å²	69	91.9 Å²	91.9	36%	0.361	43%	0.433	S	S	.	.	H	α-helix	trans	-56.6	-44.7	174	-177.7	72.8	0	0	0	111.6	L500 A606 I607 R612 V613 L614	L500-L610 HydrophobicContact CD2-CD2 4.11Å; A606-L610 WeakPolarHBondContact O-CB 3.31Å; A606-L610 PolarHBondContact O-N 2.97Å; I607-L610 WeakPolarHBondContact O-CB 3.31Å; I607-L610 PolarHBondContact O-N 3.43Å; L610-R612 VanDerWaalsContact C-N 3.31Å; L610-R612 PolarHBondContact O-N 3.28Å; L610-V613 WeakPolarHBondContact O-CB 3.5Å; L610-V613 PolarHBondContact O-N 2.92Å; L610-L614 HydrophobicContact CG-CD1 4.37Å; L610-L614 VanDerWaalsContact O-CG 3.31Å; L610-L614 WeakPolarHBondContact O-CG 3.25Å; L610-L614 PolarHBondContact O-N 2.81Å
611	I	63.1	Low	64.3	Low	60 Å²	60	89.4 Å²	89.4	31%	0.308	42%	0.421	S	S	.	.	H	α-helix	trans	-62.1	-39.8	175.8	-67	165.6	0	0	0	110.9	L500 I607 W609 L614 R615	L500-I611 HydrophobicContact CD1-CG1 4.2Å; I607-I611 HydrophobicContact CG2-CD1 4.26Å; I607-I611 WeakPolarHBondContact O-CG1 3.38Å; I607-I611 PolarHBondContact O-N 2.68Å; W609-I611 VanDerWaalsContact C-N 3.32Å; W609-I611 PolarHBondContact O-N 3.26Å; I611-L614 PolarHBondContact O-N 2.9Å; I611-R615 PolarHBondContact O-N 2.83Å; I611-R615 VanDerWaalsContact O-N 3.16Å
612	R	64.7	Low	65.3	Low	153 Å²	153	90.5 Å²	90.5	58%	0.577	43%	0.431	S	S	*	.	H	α-helix	trans	-65.6	-39.8	175.1	-173.7	174	-82.4	153.1	-3.8	111.5	W608 W609 L610 R615 V616	W608-R612 PolarHBondContact O-N 3.32Å; W608-R612 VanDerWaalsContact O-N 3.12Å; W609-R612 CarbonylContact O-C 3.58Å; W609-R612 WeakPolarHBondContact O-CA 3.38Å; W609-R612 WeakPolarHBondContact O-CB 3.45Å; W609-R612 PolarHBondContact O-N 2.88Å; L610-R612 VanDerWaalsContact C-N 3.31Å; L610-R612 PolarHBondContact O-N 3.28Å; R612-R615 PolarHBondContact O-N 3.37Å; R612-V616 VanDerWaalsContact O-CG2 3.25Å; R612-V616 WeakPolarHBondContact O-CG2 3.36Å; R612-V616 PolarHBondContact O-N 3.37Å
613	V	66.3	Low	66.6	Low	30 Å²	30	85.6 Å²	85.6	18%	0.182	40%	0.404	C	S	.	.	H	α-helix	trans	-58.8	-49.1	173.2	164.9	0	0	0	0	111.6	F593 V597 W609 L610 R615 V616 E617	F593-V613 HydrophobicContact CD1-CG1 4.31Å; F593-V613 HydrophobicContact CD1-CG2 4.29Å; F593-V613 HydrophobicContact CE1-CB 3.8Å; F593-V613 HydrophobicContact CE1-CG1 3.73Å; F593-V613 HydrophobicContact CE1-CG2 3.4Å; F593-V613 HydrophobicContact CZ-CB 4.4Å; F593-V613 HydrophobicContact CZ-CG2 3.77Å; V597-V613 HydrophobicContact CB-CG2 4.15Å; V597-V613 HydrophobicContact CG1-CG2 3.78Å; V597-V613 HydrophobicContact CG2-CG2 3.43Å; V597-V613 VanDerWaalsContact CG2-CG2 3.43Å; W609-V613 WeakPolarHBondContact O-CG2 3.44Å; W609-V613 PolarHBondContact O-N 2.97Å; L610-V613 WeakPolarHBondContact O-CB 3.5Å; L610-V613 PolarHBondContact O-N 2.92Å; V613-R615 VanDerWaalsContact C-N 3.25Å; V613-R615 PolarHBondContact O-N 3.35Å; V613-V616 CarbonylContact O-C 3.43Å; V613-V616 WeakPolarHBondContact O-CA 3.45Å; V613-V616 PolarHBondContact O-N 2.88Å; V613-E617 PolarHBondContact O-N 3.22Å
614	L	62.5	Low	67.9	Low	16 Å²	16	81 Å²	81	8%	0.084	38%	0.378	C	S	.	.	H	α-helix	trans	-60.3	-36.2	-180	-66.2	167.2	0	0	0	111.5	F498 L500 F536 L538 L610 I611 E617	F498-L614 HydrophobicContact CD1-CD1 4.22Å; F498-L614 HydrophobicContact CE1-CD1 4.07Å; L500-L614 HydrophobicContact CD1-CD1 3.95Å; L500-L614 HydrophobicContact CD2-CD1 4.32Å; L500-L614 HydrophobicContact CG-CD1 4.4Å; F536-L614 HydrophobicContact CD1-CB 4.42Å; F536-L614 HydrophobicContact CD1-CD2 3.6Å; F536-L614 HydrophobicContact CD1-CG 4.47Å; F536-L614 HydrophobicContact CD2-CB 4.4Å; F536-L614 HydrophobicContact CE1-CB 4.38Å; F536-L614 HydrophobicContact CE1-CD2 3.46Å; F536-L614 VanDerWaalsContact CE1-CD2 3.46Å; F536-L614 HydrophobicContact CE1-CG 4.5Å; F536-L614 HydrophobicContact CE2-CB 4.36Å; F536-L614 WeakPolarHBondContact CE2-O 3.3Å; F536-L614 HydrophobicContact CG-CB 4.44Å; F536-L614 HydrophobicContact CG-CD2 4.39Å; F536-L614 HydrophobicContact CZ-CB 4.36Å; F536-L614 HydrophobicContact CZ-CD2 4.16Å; F536-L614 WeakPolarHBondContact CZ-O 3.33Å; L538-L614 HydrophobicContact CD1-CD2 4.48Å; L610-L614 HydrophobicContact CG-CD1 4.37Å; L610-L614 VanDerWaalsContact O-CG 3.31Å; L610-L614 WeakPolarHBondContact O-CG 3.25Å; L610-L614 PolarHBondContact O-N 2.81Å; I611-L614 PolarHBondContact O-N 2.9Å; L614-E617 VanDerWaalsContact O-CB 3.3Å; L614-E617 WeakPolarHBondContact O-CB 3.46Å; L614-E617 PolarHBondContact O-N 2.79Å
615	R	63.3	Low	69.2	Low	190 Å²	190	82 Å²	82	72%	0.717	38%	0.382	S	S	*	.	H	α-helix	trans	-72.2	-32.8	173.1	-174.2	175.2	-99.6	155.9	-6.5	112.9	I611 R612 V613 E617	I611-R615 PolarHBondContact O-N 2.83Å; I611-R615 VanDerWaalsContact O-N 3.16Å; R612-R615 PolarHBondContact O-N 3.37Å; V613-R615 VanDerWaalsContact C-N 3.25Å; V613-R615 PolarHBondContact O-N 3.35Å; R615-E617 VanDerWaalsContact C-N 3.3Å
616	V	67.8	Low	70.4	Confident	43 Å²	43	80.3 Å²	80.3	26%	0.261	37%	0.372	S	S	.	.	H	α-helix	trans	-74.2	-22.8	175.1	-178.8	0	0	0	0	111.5	F593 R612 V613 E618 Y619 F620	F593-V616 HydrophobicContact CE1-CB 4.43Å; F593-V616 HydrophobicContact CE1-CG1 4.47Å; F593-V616 HydrophobicContact CZ-CB 4.16Å; F593-V616 HydrophobicContact CZ-CG1 4.15Å; F593-V616 HydrophobicContact CZ-CG2 4.42Å; R612-V616 VanDerWaalsContact O-CG2 3.25Å; R612-V616 WeakPolarHBondContact O-CG2 3.36Å; R612-V616 PolarHBondContact O-N 3.37Å; V613-V616 CarbonylContact O-C 3.43Å; V613-V616 WeakPolarHBondContact O-CA 3.45Å; V613-V616 PolarHBondContact O-N 2.88Å; V616-E618 PolarHBondContact O-N 3.45Å; V616-E618 VanDerWaalsContact O-N 3.13Å; V616-Y619 WeakPolarHBondContact O-CB 3.38Å; V616-Y619 PolarHBondContact O-N 2.8Å; V616-F620 HydrophobicContact CB-CE2 4.33Å; V616-F620 HydrophobicContact CG1-CD2 3.81Å; V616-F620 HydrophobicContact CG1-CE2 3.42Å; V616-F620 VanDerWaalsContact CG1-CE2 3.42Å; V616-F620 HydrophobicContact CG1-CZ 4.29Å; V616-F620 WeakPolarHBondContact O-CD2 3.23Å; V616-F620 PolarHBondContact O-N 3Å
617	E	69.6	Low	71.7	Confident	42 Å²	42	79.4 Å²	79.4	20%	0.196	37%	0.365	C	S	.	.	H	α-helix	trans	-52.5	-36.1	176	-167.2	176.8	148.1	0	0	112.1	F536 V613 L614 R615 Y619 F620 V621	F536-E617 WeakPolarHBondContact CE1-OE2 3.33Å; F536-E617 HydrophobicContact CE2-CB 4.36Å; F536-E617 HydrophobicContact CZ-CB 3.74Å; F536-E617 HydrophobicContact CZ-CG 3.94Å; F536-E617 WeakPolarHBondContact CZ-OE2 3.24Å; V613-E617 PolarHBondContact O-N 3.22Å; L614-E617 VanDerWaalsContact O-CB 3.3Å; L614-E617 WeakPolarHBondContact O-CB 3.46Å; L614-E617 PolarHBondContact O-N 2.79Å; R615-E617 VanDerWaalsContact C-N 3.3Å; E617-Y619 VanDerWaalsContact C-N 3.28Å; E617-Y619 PolarHBondContact O-N 2.94Å; E617-F620 PolarHBondContact O-N 3.29Å; E617-F620 VanDerWaalsContact O-N 3.1Å; E617-V621 WeakPolarHBondContact O-CG2 3.12Å; E617-V621 PolarHBondContact O-N 3.47Å
618	E	69	Low	73.1	Confident	129 Å²	129	79 Å²	79	60%	0.603	37%	0.366	S	S	*	.	H	α-helix	trans	-58.3	-36.5	175.2	-65.3	-174.9	168.7	0	0	113.1	V616 V621	V616-E618 PolarHBondContact O-N 3.45Å; V616-E618 VanDerWaalsContact O-N 3.13Å; E618-V621 WeakPolarHBondContact O-CB 3.35Å; E618-V621 PolarHBondContact O-N 2.62Å
619	Y	75.3	Confident	74.6	Confident	171 Å²	171	72.9 Å²	72.9	67%	0.671	35%	0.345	S	S	*	.	H	α-helix	trans	-75.4	-36.4	175.3	-66.3	-82.2	0	0	0	111.9	V616 E617 V621 V622 L623	V616-Y619 WeakPolarHBondContact O-CB 3.38Å; V616-Y619 PolarHBondContact O-N 2.8Å; E617-Y619 VanDerWaalsContact C-N 3.28Å; E617-Y619 PolarHBondContact O-N 2.94Å; Y619-V621 VanDerWaalsContact C-N 3.25Å; Y619-V621 PolarHBondContact O-N 2.83Å; Y619-V622 WeakPolarHBondContact O-CB 3.35Å; Y619-V622 PolarHBondContact O-N 2.82Å; Y619-V622 VanDerWaalsContact O-N 3.1Å; Y619-L623 PolarHBondContact O-N 3.07Å
620	F	75.8	Confident	75.9	Confident	31 Å²	31	68.4 Å²	68.4	14%	0.136	33%	0.328	C	S	.	.	H	α-helix	trans	-62.7	-34	172	-73.4	-71.3	0	0	0	111.6	C589 F593 V616 E617 V622 L623 K624	C589-F620 HydrophobicContact CB-CD1 4.35Å; C589-F620 HydrophobicContact CB-CE1 3.92Å; F593-F620 HydrophobicContact CB-CE1 4.39Å; F593-F620 HydrophobicContact CB-CE2 4.22Å; F593-F620 HydrophobicContact CB-CZ 3.62Å; F593-F620 AromaticContact CD1-CE2 3.47Å; F593-F620 HydrophobicContact CD1-CE2 3.47Å; F593-F620 VanDerWaalsContact CD1-CE2 3.47Å; F593-F620 AromaticContact CD1-CZ 3.77Å; F593-F620 HydrophobicContact CD1-CZ 3.77Å; F593-F620 HydrophobicContact CD2-CE2 4.24Å; F593-F620 AromaticContact CD2-CZ 3.95Å; F593-F620 HydrophobicContact CD2-CZ 3.95Å; F593-F620 AromaticContact CE1-CE2 3.72Å; F593-F620 HydrophobicContact CE1-CE2 3.72Å; F593-F620 HydrophobicContact CE1-CZ 4.35Å; F593-F620 HydrophobicContact CE2-CE2 4.49Å; F593-F620 AromaticContact CG-CE2 3.73Å; F593-F620 HydrophobicContact CG-CE2 3.73Å; F593-F620 AromaticContact CG-CZ 3.52Å; F593-F620 HydrophobicContact CG-CZ 3.52Å; F593-F620 HydrophobicContact CZ-CE2 4.25Å; V616-F620 HydrophobicContact CB-CE2 4.33Å; V616-F620 HydrophobicContact CG1-CD2 3.81Å; V616-F620 HydrophobicContact CG1-CE2 3.42Å; V616-F620 VanDerWaalsContact CG1-CE2 3.42Å; V616-F620 HydrophobicContact CG1-CZ 4.29Å; V616-F620 WeakPolarHBondContact O-CD2 3.23Å; V616-F620 PolarHBondContact O-N 3Å; E617-F620 PolarHBondContact O-N 3.29Å; E617-F620 VanDerWaalsContact O-N 3.1Å; F620-V622 PolarHBondContact O-N 3.03Å; F620-L623 HydrophobicContact CD1-CD1 3.92Å; F620-L623 HydrophobicContact CE1-CD1 4.35Å; F620-L623 WeakPolarHBondContact O-CA 3.38Å; F620-L623 WeakPolarHBondContact O-CB 3.49Å; F620-L623 PolarHBondContact O-N 3.42Å; F620-K624 WeakPolarHBondContact O-CG 3.36Å; F620-K624 PolarHBondContact O-N 2.81Å
621	V	75.1	Confident	77.3	Confident	56 Å²	56	68.3 Å²	68.3	34%	0.339	33%	0.327	S	S	.	.	H	α-helix	trans	-58.8	-36.3	172.9	172.4	0	0	0	0	111.4	E617 E618 Y619 K624	E617-V621 WeakPolarHBondContact O-CG2 3.12Å; E617-V621 PolarHBondContact O-N 3.47Å; E618-V621 WeakPolarHBondContact O-CB 3.35Å; E618-V621 PolarHBondContact O-N 2.62Å; Y619-V621 VanDerWaalsContact C-N 3.25Å; Y619-V621 PolarHBondContact O-N 2.83Å; V621-K624 WeakPolarHBondContact O-CB 3.38Å; V621-K624 PolarHBondContact O-N 3.36Å
622	V	81.3	Confident	78.5	Confident	100 Å²	100	69.4 Å²	69.4	61%	0.606	33%	0.33	S	S	*	.	H	α-helix	trans	-66.3	-41.9	173.3	-177.6	0	0	0	0	111.1	Y619 F620 K624 V625	Y619-V622 WeakPolarHBondContact O-CB 3.35Å; Y619-V622 PolarHBondContact O-N 2.82Å; Y619-V622 VanDerWaalsContact O-N 3.1Å; F620-V622 PolarHBondContact O-N 3.03Å; V622-K624 PolarHBondContact O-N 2.91Å; V622-V625 VanDerWaalsContact O-CB 3.31Å; V622-V625 WeakPolarHBondContact O-CB 3.39Å; V622-V625 WeakPolarHBondContact O-CG2 3.36Å; V622-V625 PolarHBondContact O-N 3.31Å
623	L	84.7	Confident	79.5	Confident	52 Å²	52	62.3 Å²	62.3	27%	0.272	30%	0.303	S	S	.	.	H	α-helix	trans	-58.8	-34.1	173.4	-68.7	176.3	0	0	0	111.5	P586 C589 Y619 F620 V625 F626	P586-L623 HydrophobicContact CB-CB 4.36Å; P586-L623 HydrophobicContact CG-CB 4.43Å; P586-L623 WeakPolarHBondContact CG-O 3.11Å; C589-L623 HydrophobicContact CB-CD1 4.23Å; Y619-L623 PolarHBondContact O-N 3.07Å; F620-L623 HydrophobicContact CD1-CD1 3.92Å; F620-L623 HydrophobicContact CE1-CD1 4.35Å; F620-L623 WeakPolarHBondContact O-CA 3.38Å; F620-L623 WeakPolarHBondContact O-CB 3.49Å; F620-L623 PolarHBondContact O-N 3.42Å; L623-V625 PolarHBondContact O-N 3.44Å; L623-F626 HydrophobicContact CD2-CD2 4.11Å; L623-F626 HydrophobicContact CD2-CE2 3.82Å; L623-F626 WeakPolarHBondContact O-CB 3.49Å; L623-F626 VanDerWaalsContact O-CD2 3.29Å; L623-F626 WeakPolarHBondContact O-CD2 3.39Å; L623-F626 PolarHBondContact O-N 3Å
624	K	84.5	Confident	80.4	Confident	28 Å²	28	62.8 Å²	62.8	12%	0.122	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-59.4	-15.5	176.7	-65.1	-173.1	178.1	-169.1	0	113.5	F486 P586 E590 F620 V621 V622 F626 V627	F486-K624 HydrophobicContact CD2-CB 4.19Å; F486-K624 HydrophobicContact CE2-CB 3.62Å; P586-K624 HydrophobicContact CB-CG 4.37Å; E590-K624 IonicContact OE1-NZ 2.82Å; E590-K624 WeakPolarHBondContact OE2-CE 3.29Å; E590-K624 IonicContact OE2-NZ 2.91Å; E590-K624 PolarHBondContact OE2-NZ 3.47Å; F620-K624 WeakPolarHBondContact O-CG 3.36Å; F620-K624 PolarHBondContact O-N 2.81Å; V621-K624 WeakPolarHBondContact O-CB 3.38Å; V621-K624 PolarHBondContact O-N 3.36Å; V622-K624 PolarHBondContact O-N 2.91Å; K624-F626 PolarHBondContact O-N 3.31Å; K624-V627 HydrophobicContact CB-CG2 4.39Å; K624-V627 WeakPolarHBondContact O-CB 3.24Å; K624-V627 WeakPolarHBondContact O-CG2 3.23Å; K624-V627 PolarHBondContact O-N 3.07Å
625	V	86	Confident	81.5	Confident	89 Å²	89	65.3 Å²	65.3	54%	0.539	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-58.7	-32.9	169.4	177	0	0	0	0	112	V622 L623 V627 V628	V622-V625 VanDerWaalsContact O-CB 3.31Å; V622-V625 WeakPolarHBondContact O-CB 3.39Å; V622-V625 WeakPolarHBondContact O-CG2 3.36Å; V622-V625 PolarHBondContact O-N 3.31Å; L623-V625 PolarHBondContact O-N 3.44Å; V625-V627 PolarHBondContact O-N 2.95Å; V625-V627 VanDerWaalsContact O-N 3.12Å; V625-V628 WeakPolarHBondContact O-CB 3.47Å; V625-V628 PolarHBondContact O-N 3.1Å
626	F	89.7	Confident	82.4	Confident	76 Å²	76	57.7 Å²	57.7	33%	0.333	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-63.6	-16.5	175.4	-64.7	-61	0	0	0	113.2	L582 P586 L623 K624 V628 L629	L582-F626 HydrophobicContact CD1-CD1 3.93Å; L582-F626 HydrophobicContact CD1-CD2 4.48Å; L582-F626 HydrophobicContact CD1-CE1 4Å; L582-F626 HydrophobicContact CD1-CG 4.18Å; L582-F626 HydrophobicContact CD1-CZ 4.31Å; L582-F626 HydrophobicContact CD2-CD1 4.12Å; L582-F626 HydrophobicContact CD2-CE1 4.17Å; L582-F626 HydrophobicContact CG-CD1 3.87Å; L582-F626 HydrophobicContact CG-CE1 4.24Å; L582-F626 HydrophobicContact CG-CG 4.33Å; P586-F626 HydrophobicContact CG-CB 3.88Å; L623-F626 HydrophobicContact CD2-CD2 4.11Å; L623-F626 HydrophobicContact CD2-CE2 3.82Å; L623-F626 WeakPolarHBondContact O-CB 3.49Å; L623-F626 VanDerWaalsContact O-CD2 3.29Å; L623-F626 WeakPolarHBondContact O-CD2 3.39Å; L623-F626 PolarHBondContact O-N 3Å; K624-F626 PolarHBondContact O-N 3.31Å; F626-V628 PolarHBondContact O-N 2.95Å; F626-L629 HydrophobicContact CB-CD1 4.35Å; F626-L629 HydrophobicContact CD1-CD1 3.72Å; F626-L629 HydrophobicContact CD1-CG 4.44Å; F626-L629 WeakPolarHBondContact O-CB 3.37Å; F626-L629 WeakPolarHBondContact O-CG 3.2Å; F626-L629 PolarHBondContact O-N 2.88Å
627	V	87.4	Confident	82.8	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.018	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-59.6	-33.7	171.5	174.8	0	0	0	0	111.2	F486 P586 K624 V625 L629 R630	F486-V627 HydrophobicContact CB-CG1 3.97Å; F486-V627 HydrophobicContact CD2-CB 4.49Å; F486-V627 HydrophobicContact CG-CB 4.43Å; F486-V627 HydrophobicContact CG-CG1 4.12Å; P586-V627 HydrophobicContact CB-CG2 4.37Å; P586-V627 HydrophobicContact CG-CG2 4.27Å; K624-V627 HydrophobicContact CB-CG2 4.39Å; K624-V627 WeakPolarHBondContact O-CB 3.24Å; K624-V627 WeakPolarHBondContact O-CG2 3.23Å; K624-V627 PolarHBondContact O-N 3.07Å; V625-V627 PolarHBondContact O-N 2.95Å; V625-V627 VanDerWaalsContact O-N 3.12Å; V627-L629 PolarHBondContact O-N 3.44Å; V627-R630 WeakPolarHBondContact O-CB 3.34Å; V627-R630 WeakPolarHBondContact O-CD 3.36Å; V627-R630 WeakPolarHBondContact O-CG 3.38Å; V627-R630 PolarHBondContact O-N 3.13Å
628	V	89.3	Confident	83.4	Confident	58 Å²	58	62.3 Å²	62.3	35%	0.352	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-63.9	-25.4	177.9	-177.2	0	0	0	0	111.3	F486 V625 F626 R630 L631	F486-V628 HydrophobicContact CD1-CG2 4.34Å; F486-V628 HydrophobicContact CE1-CG2 3.91Å; V625-V628 WeakPolarHBondContact O-CB 3.47Å; V625-V628 PolarHBondContact O-N 3.1Å; F626-V628 PolarHBondContact O-N 2.95Å; V628-R630 PolarHBondContact O-N 3.03Å; V628-R630 VanDerWaalsContact O-N 3.07Å; V628-L631 HydrophobicContact CG1-CD1 4.04Å; V628-L631 WeakPolarHBondContact O-CB 3.14Å; V628-L631 PolarHBondContact O-N 3.45Å
629	L	90.4	Very high	84	Confident	39 Å²	39	60.3 Å²	60.3	20%	0.204	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-61.7	-19.2	176	-60.3	-177.8	0	0	0	113.1	I579 L582 F626 V627 L631 F632	I579-L629 HydrophobicContact CG2-CB 4Å; L582-L629 HydrophobicContact CB-CD1 4.2Å; L582-L629 HydrophobicContact CD2-CD1 3.42Å; L582-L629 VanDerWaalsContact CD2-CD1 3.42Å; L582-L629 HydrophobicContact CG-CD1 3.58Å; F626-L629 HydrophobicContact CB-CD1 4.35Å; F626-L629 HydrophobicContact CD1-CD1 3.72Å; F626-L629 HydrophobicContact CD1-CG 4.44Å; F626-L629 WeakPolarHBondContact O-CB 3.37Å; F626-L629 WeakPolarHBondContact O-CG 3.2Å; F626-L629 PolarHBondContact O-N 2.88Å; V627-L629 PolarHBondContact O-N 3.44Å; L629-L631 PolarHBondContact O-N 2.92Å; L629-L631 VanDerWaalsContact O-N 3.1Å; L629-F632 HydrophobicContact CB-CD2 4.26Å; L629-F632 HydrophobicContact CD2-CD2 3.75Å; L629-F632 HydrophobicContact CD2-CE2 3.53Å; L629-F632 WeakPolarHBondContact O-CB 3.09Å; L629-F632 PolarHBondContact O-N 3.01Å
630	R	87.9	Confident	84.5	Confident	2 Å²	2	52.5 Å²	52.5	1%	0.008	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-55	-26.1	171.5	-62.4	170.9	-175.3	180	-3.1	111.9	I479 D547 S551 I554 S583 V627 V628 F632 R633	I479-R630 HydrophobicContact CG2-CB 4.23Å; I479-R630 WeakPolarHBondContact CG2-O 3.37Å; D547-R630 IonicContact OD1-NH1 2.72Å; S551-R630 PolarHBondContact OG-NH2 3.18Å; S551-R630 VanDerWaalsContact OG-NH2 3.17Å; I554-R630 HydrophobicContact CD1-CG 4.26Å; S583-R630 PolarHBondContact O-NE 3.33Å; V627-R630 WeakPolarHBondContact O-CB 3.34Å; V627-R630 WeakPolarHBondContact O-CD 3.36Å; V627-R630 WeakPolarHBondContact O-CG 3.38Å; V627-R630 PolarHBondContact O-N 3.13Å; V628-R630 PolarHBondContact O-N 3.03Å; V628-R630 VanDerWaalsContact O-N 3.07Å; R630-F632 VanDerWaalsContact C-N 3.32Å; R630-F632 PolarHBondContact O-N 3.42Å; R630-R633 WeakPolarHBondContact O-CB 3.36Å; R630-R633 VanDerWaalsContact O-CG 3.24Å; R630-R633 WeakPolarHBondContact O-CG 3.37Å; R630-R633 PolarHBondContact O-N 3.05Å
631	L	89.7	Confident	85	Confident	66 Å²	66	51.9 Å²	51.9	35%	0.346	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-66.4	-29.3	175	-67.9	174.3	0	0	0	113.3	I479 V483 V628 L629 R633 L634 L635	I479-L631 HydrophobicContact CG2-CD2 4.02Å; V483-L631 HydrophobicContact CG2-CD2 4.01Å; V483-L631 HydrophobicContact CG2-CG 3.98Å; V628-L631 HydrophobicContact CG1-CD1 4.04Å; V628-L631 WeakPolarHBondContact O-CB 3.14Å; V628-L631 PolarHBondContact O-N 3.45Å; L629-L631 PolarHBondContact O-N 2.92Å; L629-L631 VanDerWaalsContact O-N 3.1Å; L631-R633 PolarHBondContact O-N 3.33Å; L631-L634 HydrophobicContact CD2-CD1 4.24Å; L631-L634 WeakPolarHBondContact O-CB 3.42Å; L631-L634 PolarHBondContact O-N 2.97Å; L631-L635 PolarHBondContact O-N 3.41Å
632	F	88.7	Confident	85.5	Confident	84 Å²	84	53.2 Å²	53.2	37%	0.368	26%	0.264	S	S	.	.	H	α-helix	trans	-63.2	-23.9	176.2	-74.7	-77.4	0	0	0	112.3	I579 L629 R630 L634 L635 R636 F645	I579-F632 HydrophobicContact CG2-CB 3.82Å; I579-F632 HydrophobicContact CG2-CD2 4.25Å; I579-F632 HydrophobicContact CG2-CG 4.32Å; L629-F632 HydrophobicContact CB-CD2 4.26Å; L629-F632 HydrophobicContact CD2-CD2 3.75Å; L629-F632 HydrophobicContact CD2-CE2 3.53Å; L629-F632 WeakPolarHBondContact O-CB 3.09Å; L629-F632 PolarHBondContact O-N 3.01Å; R630-F632 VanDerWaalsContact C-N 3.32Å; R630-F632 PolarHBondContact O-N 3.42Å; F632-L634 PolarHBondContact O-N 3.41Å; F632-L635 HydrophobicContact CD1-CD1 3.55Å; F632-L635 HydrophobicContact CE1-CD1 3.9Å; F632-L635 HydrophobicContact CG-CD1 4.36Å; F632-L635 WeakPolarHBondContact O-CB 3.46Å; F632-L635 PolarHBondContact O-N 2.73Å; F632-L635 VanDerWaalsContact O-N 3.1Å; F632-R636 PolarHBondContact O-N 3.2Å; F632-F645 HydrophobicContact CD1-CZ 4.35Å
633	R	85.9	Confident	85.9	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.015	24%	0.235	C	C	.	.	H	α-helix	trans	-62.3	-31.9	172.7	-47.4	-169.6	88.5	-156.6	6.8	111.9	I479 D557 R561 D580 R630 L631 R636	I479-R633 HydrophobicContact CD1-CB 3.65Å; I479-R633 HydrophobicContact CD1-CG 4.35Å; D557-R633 IonicContact OD2-CZ 4Å; D557-R633 VanDerWaalsContact OD2-CZ 3.22Å; D557-R633 IonicContact OD2-NH1 2.58Å; D557-R633 PolarHBondContact OD2-NH1 3.15Å; D557-R633 IonicContact OD2-NH2 3.73Å; D557-R633 PolarHBondContact OD2-NH2 3.19Å; R561-R633 VanDerWaalsContact NH1-NH2 3.16Å; D580-R633 WeakPolarHBondContact OD1-CD 3.37Å; D580-R633 WeakPolarHBondContact OD1-CG 3.27Å; D580-R633 IonicContact OD1-CZ 3.25Å; D580-R633 IonicContact OD1-NE 3.24Å; D580-R633 PolarHBondContact OD1-NE 2.7Å; D580-R633 IonicContact OD1-NH2 3.9Å; D580-R633 IonicContact OD2-CZ 3.01Å; D580-R633 IonicContact OD2-NE 3.05Å; D580-R633 PolarHBondContact OD2-NE 3.39Å; D580-R633 IonicContact OD2-NH2 3.85Å; D580-R633 PolarHBondContact OD2-NH2 2.95Å; R630-R633 WeakPolarHBondContact O-CB 3.36Å; R630-R633 VanDerWaalsContact O-CG 3.24Å; R630-R633 WeakPolarHBondContact O-CG 3.37Å; R630-R633 PolarHBondContact O-N 3.05Å; L631-R633 PolarHBondContact O-N 3.33Å; R633-R636 VanDerWaalsContact O-CG 3.26Å; R633-R636 WeakPolarHBondContact O-CG 3.22Å
634	L	85.3	Confident	86.2	Confident	39 Å²	39	49.1 Å²	49.1	20%	0.204	24%	0.238	C	C	.	.	H	α-helix	trans	-71.9	-38.6	173.9	-58.3	179	0	0	0	111.3	T476 I479 T480 L631 F632 R636 R637	T476-L634 HydrophobicContact CG2-CD2 4.27Å; I479-L634 HydrophobicContact CB-CD1 4.43Å; I479-L634 HydrophobicContact CB-CD2 4.36Å; I479-L634 HydrophobicContact CB-CG 4.41Å; I479-L634 HydrophobicContact CD1-CD2 3.61Å; I479-L634 HydrophobicContact CD1-CG 3.95Å; I479-L634 HydrophobicContact CG2-CD1 3.94Å; I479-L634 HydrophobicContact CG2-CG 4.06Å; T480-L634 HydrophobicContact CG2-CD1 4.36Å; L631-L634 HydrophobicContact CD2-CD1 4.24Å; L631-L634 WeakPolarHBondContact O-CB 3.42Å; L631-L634 PolarHBondContact O-N 2.97Å; F632-L634 PolarHBondContact O-N 3.41Å; L634-R636 VanDerWaalsContact C-N 3.29Å; L634-R636 PolarHBondContact O-N 2.94Å; L634-R637 PolarHBondContact O-N 3.27Å
635	L	84.8	Confident	86.4	Confident	69 Å²	69	52.2 Å²	52.2	36%	0.361	25%	0.252	S	S	.	.	H	α-helix	trans	-61.8	-35.4	-179.7	-62.9	177.8	0	0	0	111.8	L631 F632 R637 H638 T641	L631-L635 PolarHBondContact O-N 3.41Å; F632-L635 HydrophobicContact CD1-CD1 3.55Å; F632-L635 HydrophobicContact CE1-CD1 3.9Å; F632-L635 HydrophobicContact CG-CD1 4.36Å; F632-L635 WeakPolarHBondContact O-CB 3.46Å; F632-L635 PolarHBondContact O-N 2.73Å; F632-L635 VanDerWaalsContact O-N 3.1Å; L635-R637 PolarHBondContact O-N 2.87Å; L635-H638 PolarHBondContact O-N 3.04Å; L635-T641 HydrophobicContact CB-CG2 4.18Å; L635-T641 HydrophobicContact CD2-CG2 3.88Å; L635-T641 WeakPolarHBondContact O-CB 3.3Å; L635-T641 PolarHBondContact O-OG1 3.28Å
636	R	81.5	Confident	86.6	Confident	30 Å²	30	49 Å²	49	11%	0.113	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-24.9	-177.6	85.3	-168.4	-74.8	152.3	-1	114.6	D336 R561 D580 F632 R633 L634	D336-R636 IonicContact OD1-NE 3.83Å; D336-R636 IonicContact OD1-NH2 3.83Å; D336-R636 IonicContact OD2-CZ 2.76Å; D336-R636 IonicContact OD2-NH2 3.89Å; D336-R636 PolarHBondContact OD2-NH2 3.31Å; R561-R636 VanDerWaalsContact NH1-NH1 3.16Å; D580-R636 IonicContact OD2-NH1 3.66Å; D580-R636 PolarHBondContact OD2-NH1 3.36Å; F632-R636 PolarHBondContact O-N 3.2Å; R633-R636 VanDerWaalsContact O-CG 3.26Å; R633-R636 WeakPolarHBondContact O-CG 3.22Å; L634-R636 VanDerWaalsContact C-N 3.29Å; L634-R636 PolarHBondContact O-N 2.94Å
637	R	76.6	Confident	86.7	Confident	64 Å²	64	45.4 Å²	45.4	24%	0.242	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-18.5	-173.6	-66.7	-168.8	-78.7	-159.6	-1	113.7	F472 E475 L634 L635	F472-R637 VanDerWaalsContact CD2-NE 3.33Å; F472-R637 HydrophobicContact CE2-CB 4.34Å; E475-R637 VanDerWaalsContact CB-NH2 3.32Å; E475-R637 VanDerWaalsContact CD-CZ 3.42Å; E475-R637 IonicContact OE1-CZ 2.83Å; E475-R637 IonicContact OE1-NH2 3.97Å; E475-R637 IonicContact OE2-CZ 3.52Å; E475-R637 IonicContact OE2-NE 3.05Å; E475-R637 IonicContact OE2-NH1 2.64Å; E475-R637 PolarHBondContact OE2-NH1 3.43Å; E475-R637 IonicContact OE2-NH2 3.69Å; E475-R637 PolarHBondContact OE2-NH2 3.43Å; L634-R637 PolarHBondContact O-N 3.27Å; L635-R637 PolarHBondContact O-N 2.87Å
638	H	83.3	Confident	86.9	Confident	118 Å²	118	48.6 Å²	48.6	55%	0.546	23%	0.231	S	C	.	.			trans	-79.1	128.2	178.4	-167.6	-95.4	0	0	0	110.3	L635 G640 T641 R642	L635-H638 PolarHBondContact O-N 3.04Å; H638-G640 VanDerWaalsContact C-N 3.25Å; H638-G640 WeakPolarHBondContact ND1-CA 3.46Å; H638-G640 PolarHBondContact ND1-N 3.1Å; H638-G640 VanDerWaalsContact ND1-N 3.1Å; H638-G640 PolarHBondContact O-N 3.05Å; H638-T641 HydrophobicContact CB-CG2 3.88Å; H638-T641 PolarHBondContact ND1-N 3.17Å; H638-T641 PolarHBondContact O-N 2.93Å; H638-T641 PolarHBondContact O-OG1 2.9Å; H638-R642 PolarHBondContact O-N 2.97Å
639	K	80.8	Confident	87	Confident	87 Å²	87	54.5 Å²	54.5	38%	0.378	25%	0.247	S	C	.	.	H	α-helix	trans	-57.8	-42.4	177.8	-178.7	-172.9	175.8	-168.2	0	110.9	T641 R642 V643 A742 S746	K639-T641 VanDerWaalsContact C-N 3.34Å; K639-T641 PolarHBondContact O-N 3.42Å; K639-R642 PolarHBondContact O-N 2.96Å; K639-V643 WeakPolarHBondContact O-CG2 3.23Å; K639-V643 PolarHBondContact O-N 3.22Å; K639-A742 VanDerWaalsContact NZ-C 3.34Å; K639-A742 PolarHBondContact NZ-O 3.42Å; K639-S746 PolarHBondContact NZ-OG 2.97Å
640	G	85.9	Confident	86.9	Confident	8 Å²	8	54.3 Å²	54.3	8%	0.082	25%	0.247	C	C	.	.	H	α-helix	trans	-64.7	-32.2	-177.2	0	0	0	0	0	114.2	H638 V643 L644	H638-G640 VanDerWaalsContact C-N 3.25Å; H638-G640 WeakPolarHBondContact ND1-CA 3.46Å; H638-G640 PolarHBondContact ND1-N 3.1Å; H638-G640 VanDerWaalsContact ND1-N 3.1Å; H638-G640 PolarHBondContact O-N 3.05Å; G640-V643 PolarHBondContact O-N 3.22Å; G640-L644 WeakPolarHBondContact O-CB 3.44Å; G640-L644 PolarHBondContact O-N 3.09Å
641	T	86.5	Confident	87	Confident	18 Å²	18	54.2 Å²	54.2	11%	0.11	25%	0.247	C	C	.	.	H	α-helix	trans	-73.7	-35.9	178.5	54.5	0	0	0	0	111	L635 H638 K639 V643 L644 F645	L635-T641 HydrophobicContact CB-CG2 4.18Å; L635-T641 HydrophobicContact CD2-CG2 3.88Å; L635-T641 WeakPolarHBondContact O-CB 3.3Å; L635-T641 PolarHBondContact O-OG1 3.28Å; H638-T641 HydrophobicContact CB-CG2 3.88Å; H638-T641 PolarHBondContact ND1-N 3.17Å; H638-T641 PolarHBondContact O-N 2.93Å; H638-T641 PolarHBondContact O-OG1 2.9Å; K639-T641 VanDerWaalsContact C-N 3.34Å; K639-T641 PolarHBondContact O-N 3.42Å; T641-V643 VanDerWaalsContact C-N 3.31Å; T641-V643 PolarHBondContact O-N 3.31Å; T641-L644 CarbonylContact O-C 3.6Å; T641-L644 WeakPolarHBondContact O-CB 2.91Å; T641-L644 PolarHBondContact O-N 2.88Å; T641-F645 WeakPolarHBondContact O-CD2 3.28Å; T641-F645 PolarHBondContact O-N 3.36Å
642	R	84.7	Confident	87.1	Confident	84 Å²	84	55 Å²	55	32%	0.317	25%	0.25	S	S	.	.	H	α-helix	trans	-60.4	-43.6	172.7	-68.2	-178.5	61.5	-149.4	-4.9	111.3	L308 H638 K639 L644 F645 Y646	L308-R642 PolarHBondContact O-NH2 2.82Å; H638-R642 PolarHBondContact O-N 2.97Å; K639-R642 PolarHBondContact O-N 2.96Å; R642-L644 VanDerWaalsContact C-N 3.34Å; R642-F645 PolarHBondContact O-N 3.05Å; R642-Y646 PolarHBondContact O-N 2.99Å
643	V	90	Very high	87.2	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-63.4	-42.4	174.3	177.9	0	0	0	0	110.6	F304 L308 K639 G640 T641 Y646 T647 F735 A742	F304-V643 HydrophobicContact CE2-CG1 4.2Å; F304-V643 HydrophobicContact CE2-CG2 4.43Å; F304-V643 HydrophobicContact CZ-CG1 4.28Å; F304-V643 HydrophobicContact CZ-CG2 4.08Å; L308-V643 HydrophobicContact CD2-CG2 4.46Å; K639-V643 WeakPolarHBondContact O-CG2 3.23Å; K639-V643 PolarHBondContact O-N 3.22Å; G640-V643 PolarHBondContact O-N 3.22Å; T641-V643 VanDerWaalsContact C-N 3.31Å; T641-V643 PolarHBondContact O-N 3.31Å; V643-Y646 PolarHBondContact O-N 2.89Å; V643-T647 WeakPolarHBondContact O-CB 3.49Å; V643-T647 PolarHBondContact O-N 2.91Å; V643-T647 PolarHBondContact O-OG1 3.06Å; V643-F735 HydrophobicContact CB-CE2 4.4Å; V643-F735 HydrophobicContact CG1-CD2 4.27Å; V643-F735 HydrophobicContact CG1-CE2 4.11Å; V643-A742 HydrophobicContact CG2-CB 4.05Å
644	L	91.5	Very high	87.3	Confident	65 Å²	65	59.5 Å²	59.5	34%	0.34	28%	0.282	S	S	.	.	H	α-helix	trans	-61.3	-48.5	176.2	-178.6	64.9	0	0	0	112.1	G640 T641 R642 Y646 T647 I648 F735	G640-L644 WeakPolarHBondContact O-CB 3.44Å; G640-L644 PolarHBondContact O-N 3.09Å; T641-L644 CarbonylContact O-C 3.6Å; T641-L644 WeakPolarHBondContact O-CB 2.91Å; T641-L644 PolarHBondContact O-N 2.88Å; R642-L644 VanDerWaalsContact C-N 3.34Å; L644-Y646 VanDerWaalsContact C-N 3.33Å; L644-Y646 PolarHBondContact O-N 2.87Å; L644-T647 WeakPolarHBondContact O-CA 2.86Å; L644-T647 WeakPolarHBondContact O-CB 3.22Å; L644-T647 PolarHBondContact O-N 3.43Å; L644-I648 HydrophobicContact CD1-CD1 4.14Å; L644-I648 HydrophobicContact CD1-CG1 4.32Å; L644-I648 HydrophobicContact CG-CD1 3.88Å; L644-I648 HydrophobicContact CG-CG1 4.45Å; L644-I648 WeakPolarHBondContact O-CG1 3.33Å; L644-I648 PolarHBondContact O-N 2.77Å; L644-F735 HydrophobicContact CB-CD2 4.24Å; L644-F735 HydrophobicContact CB-CE2 3.93Å; L644-F735 HydrophobicContact CD1-CD2 3.97Å; L644-F735 HydrophobicContact CD1-CE2 4.29Å
645	F	89.6	Confident	87.6	Confident	93 Å²	93	58.4 Å²	58.4	41%	0.408	28%	0.276	S	S	.	.	H	α-helix	trans	-61.1	-41.4	177.7	-78.6	-63.2	0	0	0	112.1	F632 T641 R642 T647 R649	F632-F645 HydrophobicContact CD1-CZ 4.35Å; T641-F645 WeakPolarHBondContact O-CD2 3.28Å; T641-F645 PolarHBondContact O-N 3.36Å; R642-F645 PolarHBondContact O-N 3.05Å; F645-T647 VanDerWaalsContact C-N 3.32Å; F645-R649 WeakPolarHBondContact O-CB 3.46Å; F645-R649 PolarHBondContact O-N 3.22Å
646	Y	88.8	Confident	88.1	Confident	21 Å²	21	58.3 Å²	58.3	8%	0.082	28%	0.282	C	S	.	.	H	α-helix	trans	-60.7	-44.8	172.2	177.4	-79	0	0	0	111.2	R303 F304 K307 R642 V643 L644 R649 T650 Y738	R303-Y646 PolarHBondContact O-OH 2.91Å; F304-Y646 WeakPolarHBondContact CA-OH 3.31Å; F304-Y646 HydrophobicContact CB-CE1 4.08Å; F304-Y646 HydrophobicContact CB-CE2 4.39Å; F304-Y646 AromaticContact CD2-CD1 3.5Å; F304-Y646 HydrophobicContact CD2-CD1 3.5Å; F304-Y646 VanDerWaalsContact CD2-CD1 3.5Å; F304-Y646 HydrophobicContact CD2-CD2 4.21Å; F304-Y646 AromaticContact CD2-CE1 3.54Å; F304-Y646 HydrophobicContact CD2-CE1 3.54Å; F304-Y646 HydrophobicContact CD2-CE2 4.16Å; F304-Y646 AromaticContact CD2-CG 3.88Å; F304-Y646 HydrophobicContact CD2-CG 3.88Å; F304-Y646 AromaticContact CD2-CZ 3.88Å; F304-Y646 HydrophobicContact CE2-CD1 4.02Å; F304-Y646 HydrophobicContact CE2-CE1 4.47Å; F304-Y646 HydrophobicContact CE2-CG 4.25Å; F304-Y646 HydrophobicContact CG-CE1 4.31Å; F304-Y646 PolarHBondContact N-OH 2.93Å; K307-Y646 HydrophobicContact CB-CD2 3.91Å; K307-Y646 HydrophobicContact CB-CE2 3.7Å; K307-Y646 HydrophobicContact CD-CD2 3.95Å; K307-Y646 HydrophobicContact CD-CE2 3.45Å; K307-Y646 VanDerWaalsContact CD-CE2 3.45Å; K307-Y646 HydrophobicContact CG-CD2 4.49Å; K307-Y646 HydrophobicContact CG-CE2 3.95Å; R642-Y646 PolarHBondContact O-N 2.99Å; V643-Y646 PolarHBondContact O-N 2.89Å; L644-Y646 VanDerWaalsContact C-N 3.33Å; L644-Y646 PolarHBondContact O-N 2.87Å; Y646-R649 PolarHBondContact O-N 3.37Å; Y646-T650 WeakPolarHBondContact CD1-OG1 3.31Å; Y646-T650 HydrophobicContact CE1-CG2 4.43Å; Y646-T650 WeakPolarHBondContact CE1-OG1 3.34Å; Y646-T650 WeakPolarHBondContact O-CB 3.46Å; Y646-T650 PolarHBondContact O-N 2.87Å; Y646-T650 PolarHBondContact O-OG1 2.98Å; Y646-Y738 HydrophobicContact CD1-CD2 4.41Å; Y646-Y738 HydrophobicContact CD1-CE2 4.49Å; Y646-Y738 HydrophobicContact CE1-CD1 4.28Å; Y646-Y738 HydrophobicContact CE1-CD2 4.38Å; Y646-Y738 AromaticContact CE1-CE1 3.96Å; Y646-Y738 HydrophobicContact CE1-CE1 3.96Å; Y646-Y738 HydrophobicContact CE1-CE2 4.09Å; Y646-Y738 HydrophobicContact CE1-CG 4.49Å; Y646-Y738 AromaticContact CE1-CZ 3.88Å
647	T	92.2	Very high	88.7	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-60.4	-52.1	-178.9	-56.7	0	0	0	0	109.8	V643 L644 F645 R649 T650 T651 L731 H734 F735 Y738	V643-T647 WeakPolarHBondContact O-CB 3.49Å; V643-T647 PolarHBondContact O-N 2.91Å; V643-T647 PolarHBondContact O-OG1 3.06Å; L644-T647 WeakPolarHBondContact O-CA 2.86Å; L644-T647 WeakPolarHBondContact O-CB 3.22Å; L644-T647 PolarHBondContact O-N 3.43Å; F645-T647 VanDerWaalsContact C-N 3.32Å; T647-R649 VanDerWaalsContact C-N 3.33Å; T647-R649 PolarHBondContact O-N 3.31Å; T647-T650 PolarHBondContact O-N 3.26Å; T647-T651 HydrophobicContact CG2-CG2 4.2Å; T647-T651 WeakPolarHBondContact O-CG2 3.43Å; T647-T651 PolarHBondContact O-N 3.43Å; T647-T651 PolarHBondContact O-OG1 3.04Å; T647-T651 VanDerWaalsContact O-OG1 3.06Å; T647-L731 HydrophobicContact CG2-CD1 4.21Å; T647-H734 HydrophobicContact CG2-CB 3.74Å; T647-F735 HydrophobicContact CG2-CB 4.09Å; T647-Y738 HydrophobicContact CG2-CD2 4.38Å
648	I	91.9	Very high	89.5	Confident	70 Å²	70	60.9 Å²	60.9	36%	0.359	30%	0.301	S	S	.	.	H	α-helix	trans	-55.7	-48.1	176.9	-67	166.5	0	0	0	110.5	L644 T650 T651 I652 L731	L644-I648 HydrophobicContact CD1-CD1 4.14Å; L644-I648 HydrophobicContact CD1-CG1 4.32Å; L644-I648 HydrophobicContact CG-CD1 3.88Å; L644-I648 HydrophobicContact CG-CG1 4.45Å; L644-I648 WeakPolarHBondContact O-CG1 3.33Å; L644-I648 PolarHBondContact O-N 2.77Å; I648-T650 PolarHBondContact O-N 3.09Å; I648-T651 PolarHBondContact O-N 3.26Å; I648-T651 PolarHBondContact O-OG1 3.12Å; I648-I652 WeakPolarHBondContact O-CB 3.16Å; I648-I652 PolarHBondContact O-N 3.04Å; I648-L731 HydrophobicContact CG1-CD1 4.16Å
649	R	91.2	Very high	90	Very high	183 Å²	183	58.9 Å²	58.9	69%	0.691	29%	0.293	S	S	*	.	H	α-helix	trans	-62	-32.1	179	-179.2	176.7	177.3	-176.5	1.1	112.6	F645 Y646 T647 I652	F645-R649 WeakPolarHBondContact O-CB 3.46Å; F645-R649 PolarHBondContact O-N 3.22Å; Y646-R649 PolarHBondContact O-N 3.37Å; T647-R649 VanDerWaalsContact C-N 3.33Å; T647-R649 PolarHBondContact O-N 3.31Å; R649-I652 VanDerWaalsContact O-CG2 3.29Å; R649-I652 WeakPolarHBondContact O-CG2 3.29Å
650	T	87.9	Confident	90.7	Very high	34 Å²	34	59.8 Å²	59.8	21%	0.209	30%	0.302	C	S	.	.	H	α-helix	trans	-81.2	-41.8	-179	-56	0	0	0	0	110.8	Y646 T647 I648 I652 T653	Y646-T650 WeakPolarHBondContact CD1-OG1 3.31Å; Y646-T650 HydrophobicContact CE1-CG2 4.43Å; Y646-T650 WeakPolarHBondContact CE1-OG1 3.34Å; Y646-T650 WeakPolarHBondContact O-CB 3.46Å; Y646-T650 PolarHBondContact O-N 2.87Å; Y646-T650 PolarHBondContact O-OG1 2.98Å; T647-T650 PolarHBondContact O-N 3.26Å; I648-T650 PolarHBondContact O-N 3.09Å; T650-I652 VanDerWaalsContact C-N 3.33Å; T650-I652 PolarHBondContact O-N 3.5Å; T650-T653 PolarHBondContact O-OG1 2.88Å
651	T	90.9	Very high	91.2	Very high	1 Å²	1	63.6 Å²	63.6	1%	0.006	32%	0.32	C	S	.	.	H	α-helix	trans	-80.6	-12	-180	60.6	0	0	0	0	112.9	T647 I648 T653 D654 L655 H734	T647-T651 HydrophobicContact CG2-CG2 4.2Å; T647-T651 WeakPolarHBondContact O-CG2 3.43Å; T647-T651 PolarHBondContact O-N 3.43Å; T647-T651 PolarHBondContact O-OG1 3.04Å; T647-T651 VanDerWaalsContact O-OG1 3.06Å; I648-T651 PolarHBondContact O-N 3.26Å; I648-T651 PolarHBondContact O-OG1 3.12Å; T651-T653 PolarHBondContact O-N 3.4Å; T651-D654 PolarHBondContact O-N 3.29Å; T651-D654 VanDerWaalsContact O-N 3.09Å; T651-L655 VanDerWaalsContact O-CB 3.31Å; T651-L655 WeakPolarHBondContact O-CB 3.29Å; T651-L655 VanDerWaalsContact O-CG 3.29Å; T651-L655 WeakPolarHBondContact O-CG 3.47Å; T651-L655 PolarHBondContact O-N 3.34Å; T651-H734 HydrophobicContact CG2-CB 3.73Å
652	I	91.6	Very high	91.6	Very high	81 Å²	81	63.8 Å²	63.8	42%	0.415	32%	0.32	S	S	.	.	H	α-helix	trans	-60.9	-33.3	-178	-162.3	62.3	0	0	0	111.9	I648 R649 T650 D654 S656 I659	I648-I652 WeakPolarHBondContact O-CB 3.16Å; I648-I652 PolarHBondContact O-N 3.04Å; R649-I652 VanDerWaalsContact O-CG2 3.29Å; R649-I652 WeakPolarHBondContact O-CG2 3.29Å; T650-I652 VanDerWaalsContact C-N 3.33Å; T650-I652 PolarHBondContact O-N 3.5Å; I652-D654 VanDerWaalsContact C-N 3.32Å; I652-S656 WeakPolarHBondContact O-CA 3.2Å; I652-S656 WeakPolarHBondContact O-CB 3.5Å; I652-S656 PolarHBondContact O-N 3.25Å; I652-I659 HydrophobicContact CD1-CD1 4.33Å
653	T	89.7	Confident	92.2	Very high	97 Å²	97	63.3 Å²	63.3	60%	0.595	32%	0.323	S	S	*	.	H	α-helix	trans	-64.7	-41	176.2	51.1	0	0	0	0	111.1	T650 T651	T650-T653 PolarHBondContact O-OG1 2.88Å; T651-T653 PolarHBondContact O-N 3.4Å
654	D	88.6	Confident	92.5	Very high	86 Å²	86	67.1 Å²	67.1	46%	0.46	35%	0.346	S	S	.	.	H	α-helix	trans	-77.6	-37.5	-177.6	-53.6	-14.6	0	0	0	110.7	T651 I652 I658	T651-D654 PolarHBondContact O-N 3.29Å; T651-D654 VanDerWaalsContact O-N 3.09Å; I652-D654 VanDerWaalsContact C-N 3.32Å; D654-I658 WeakPolarHBondContact O-CD1 3.45Å
655	L	92.7	Very high	92.8	Very high	16 Å²	16	64.4 Å²	64.4	8%	0.084	33%	0.333	C	S	.	.	H	α-helix	trans	-78.2	-24.1	178.5	-67.6	178.4	0	0	0	113	T651 I657 I658 I659 T727 V730 L731	T651-L655 VanDerWaalsContact O-CB 3.31Å; T651-L655 WeakPolarHBondContact O-CB 3.29Å; T651-L655 VanDerWaalsContact O-CG 3.29Å; T651-L655 WeakPolarHBondContact O-CG 3.47Å; T651-L655 PolarHBondContact O-N 3.34Å; L655-I657 PolarHBondContact O-N 3.21Å; L655-I658 HydrophobicContact CD2-CD1 4.35Å; L655-I658 PolarHBondContact O-N 3.17Å; L655-I659 HydrophobicContact CB-CD1 4.27Å; L655-I659 WeakPolarHBondContact O-CG1 3.08Å; L655-I659 PolarHBondContact O-N 3.5Å; L655-T727 HydrophobicContact CD2-CG2 4.49Å; L655-V730 HydrophobicContact CD2-CB 4.26Å; L655-V730 HydrophobicContact CD2-CG1 3.98Å; L655-L731 HydrophobicContact CD1-CD1 4.5Å
656	S	94.1	Very high	93.1	Very high	68 Å²	68	60 Å²	60	48%	0.476	31%	0.313	S	S	.	.	H	α-helix	trans	-57	-38.4	-176.5	-177.2	0	0	0	0	112.2	I652 L660	I652-S656 WeakPolarHBondContact O-CA 3.2Å; I652-S656 WeakPolarHBondContact O-CB 3.5Å; I652-S656 PolarHBondContact O-N 3.25Å; S656-L660 WeakPolarHBondContact O-CB 3.3Å; S656-L660 PolarHBondContact O-N 3.03Å
657	I	94.5	Very high	93.5	Very high	126 Å²	126	63.5 Å²	63.5	65%	0.646	33%	0.333	S	S	*	.	H	α-helix	trans	-65.4	-41.9	178.6	-61.8	174.7	0	0	0	110.3	L655 L660 L661	L655-I657 PolarHBondContact O-N 3.21Å; I657-L660 PolarHBondContact O-N 3.44Å; I657-L661 WeakPolarHBondContact O-CB 3.48Å; I657-L661 PolarHBondContact O-N 3.15Å
658	I	93.2	Very high	93.8	Very high	21 Å²	21	70 Å²	70	11%	0.108	36%	0.362	C	S	.	.	H	α-helix	trans	-73.3	-39.1	-179.5	-60	124.7	0	0	0	111.3	D654 L655 L660 L661 I662 Y726 T727	D654-I658 WeakPolarHBondContact O-CD1 3.45Å; L655-I658 HydrophobicContact CD2-CD1 4.35Å; L655-I658 PolarHBondContact O-N 3.17Å; I658-L660 VanDerWaalsContact C-N 3.29Å; I658-L660 PolarHBondContact O-N 3.31Å; I658-L661 WeakPolarHBondContact O-CB 3.32Å; I658-L661 PolarHBondContact O-N 3.18Å; I658-L661 VanDerWaalsContact O-N 3.15Å; I658-I662 HydrophobicContact CG2-CD1 4.12Å; I658-I662 WeakPolarHBondContact O-CG1 3.15Å; I658-I662 PolarHBondContact O-N 2.63Å; I658-Y726 HydrophobicContact CD1-CD1 3.5Å; I658-Y726 VanDerWaalsContact CD1-CD1 3.5Å; I658-Y726 HydrophobicContact CD1-CE1 3.24Å; I658-Y726 HydrophobicContact CG1-CD1 3.93Å; I658-Y726 HydrophobicContact CG1-CE1 4.05Å; I658-T727 HydrophobicContact CB-CG2 4.18Å; I658-T727 HydrophobicContact CG2-CG2 3.38Å
659	I	94.1	Very high	94.1	Very high	76 Å²	76	67.5 Å²	67.5	39%	0.39	35%	0.348	S	S	.	.	H	α-helix	trans	-60	-43.7	174	-66.8	167.2	0	0	0	109.9	I652 L655 L661 I662 L663	I652-I659 HydrophobicContact CD1-CD1 4.33Å; L655-I659 HydrophobicContact CB-CD1 4.27Å; L655-I659 WeakPolarHBondContact O-CG1 3.08Å; L655-I659 PolarHBondContact O-N 3.5Å; I659-L661 VanDerWaalsContact C-N 3.34Å; I659-L661 PolarHBondContact O-N 2.67Å; I659-I662 PolarHBondContact O-N 3.17Å; I659-L663 HydrophobicContact CG2-CD1 4.37Å; I659-L663 WeakPolarHBondContact O-CG 3.19Å; I659-L663 PolarHBondContact O-N 3.21Å
660	L	95.7	Very high	94.4	Very high	106 Å²	106	58.8 Å²	58.8	56%	0.555	32%	0.316	S	S	*	.	H	α-helix	trans	-61.2	-43.4	174.1	-179.2	66.2	0	0	0	111.5	S656 I657 I658 I662 L663 V664	S656-L660 WeakPolarHBondContact O-CB 3.3Å; S656-L660 PolarHBondContact O-N 3.03Å; I657-L660 PolarHBondContact O-N 3.44Å; I658-L660 VanDerWaalsContact C-N 3.29Å; I658-L660 PolarHBondContact O-N 3.31Å; L660-I662 VanDerWaalsContact C-N 3.32Å; L660-I662 PolarHBondContact O-N 3.32Å; L660-L663 PolarHBondContact O-N 2.97Å; L660-V664 HydrophobicContact CD1-CG2 4.31Å; L660-V664 HydrophobicContact CG-CG2 4.42Å; L660-V664 WeakPolarHBondContact O-CG2 3.41Å; L660-V664 PolarHBondContact O-N 3.4Å
661	L	95.6	Very high	94.8	Very high	88 Å²	88	58.5 Å²	58.5	46%	0.461	32%	0.317	S	S	.	.	H	α-helix	trans	-62.6	-37.9	177.3	-174.4	57.9	0	0	0	112.1	I657 I658 I659 S665 L723	I657-L661 WeakPolarHBondContact O-CB 3.48Å; I657-L661 PolarHBondContact O-N 3.15Å; I658-L661 WeakPolarHBondContact O-CB 3.32Å; I658-L661 PolarHBondContact O-N 3.18Å; I658-L661 VanDerWaalsContact O-N 3.15Å; I659-L661 VanDerWaalsContact C-N 3.34Å; I659-L661 PolarHBondContact O-N 2.67Å; L661-S665 WeakPolarHBondContact O-CB 3.47Å; L661-S665 PolarHBondContact O-N 3.21Å; L661-S665 PolarHBondContact O-OG 3.38Å; L661-L723 HydrophobicContact CD2-CD2 3.42Å; L661-L723 VanDerWaalsContact CD2-CD2 3.42Å; L661-L723 HydrophobicContact CG-CD1 4.09Å; L661-L723 HydrophobicContact CG-CD2 3.87Å
662	I	95.5	Very high	95.1	Very high	23 Å²	23	59.8 Å²	59.8	12%	0.118	33%	0.327	C	S	.	.	H	α-helix	trans	-63.7	-44.4	173.2	-70	164.1	0	0	0	110.7	I658 I659 L660 S665 A666 M694 L723 M724 T727	I658-I662 HydrophobicContact CG2-CD1 4.12Å; I658-I662 WeakPolarHBondContact O-CG1 3.15Å; I658-I662 PolarHBondContact O-N 2.63Å; I659-I662 PolarHBondContact O-N 3.17Å; L660-I662 VanDerWaalsContact C-N 3.32Å; L660-I662 PolarHBondContact O-N 3.32Å; I662-S665 WeakPolarHBondContact CA-OG 3.43Å; I662-S665 PolarHBondContact O-OG 3Å; I662-S665 VanDerWaalsContact O-OG 3.04Å; I662-A666 VanDerWaalsContact O-CB 3.25Å; I662-A666 WeakPolarHBondContact O-CB 3.44Å; I662-A666 PolarHBondContact O-N 3.03Å; I662-M694 HydrophobicContact CB-CE 4.44Å; I662-M694 HydrophobicContact CG1-CE 4.48Å; I662-M694 HydrophobicContact CG2-CE 4.09Å; I662-L723 HydrophobicContact CD1-CB 4.4Å; I662-L723 HydrophobicContact CG1-CB 3.84Å; I662-L723 HydrophobicContact CG1-CD1 4.18Å; I662-M724 HydrophobicContact CD1-SD 3.73Å; I662-T727 HydrophobicContact CD1-CG2 4.08Å
663	L	96.5	Very high	95.4	Very high	73 Å²	73	55.9 Å²	55.9	38%	0.382	31%	0.307	S	S	.	.	H	α-helix	trans	-66.3	-42.9	178.8	-69.9	172.9	0	0	0	112.4	I659 L660 A666 L667 F687	I659-L663 HydrophobicContact CG2-CD1 4.37Å; I659-L663 WeakPolarHBondContact O-CG 3.19Å; I659-L663 PolarHBondContact O-N 3.21Å; L660-L663 PolarHBondContact O-N 2.97Å; L663-A666 PolarHBondContact O-N 3.24Å; L663-L667 WeakPolarHBondContact O-CG 3.2Å; L663-L667 PolarHBondContact O-N 3.26Å; L663-F687 HydrophobicContact CD2-CZ 4.05Å
664	V	97.4	Very high	95.7	Very high	81 Å²	81	55.4 Å²	55.4	49%	0.491	30%	0.295	S	S	.	.	H	α-helix	trans	-65	-43.2	177.9	171.2	0	0	0	0	111	L660 L667 F668	L660-V664 HydrophobicContact CD1-CG2 4.31Å; L660-V664 HydrophobicContact CG-CG2 4.42Å; L660-V664 WeakPolarHBondContact O-CG2 3.41Å; L660-V664 PolarHBondContact O-N 3.4Å; V664-L667 PolarHBondContact O-N 3.38Å; V664-F668 WeakPolarHBondContact O-CB 3.2Å; V664-F668 PolarHBondContact O-N 3.01Å
665	S	96.4	Very high	96.1	Very high	8 Å²	8	58.9 Å²	58.9	6%	0.056	31%	0.306	C	S	.	.	H	α-helix	trans	-68.1	-38.6	176.6	49.6	0	0	0	0	112.4	L661 I662 L667 F668 F669 M694	L661-S665 WeakPolarHBondContact O-CB 3.47Å; L661-S665 PolarHBondContact O-N 3.21Å; L661-S665 PolarHBondContact O-OG 3.38Å; I662-S665 WeakPolarHBondContact CA-OG 3.43Å; I662-S665 PolarHBondContact O-OG 3Å; I662-S665 VanDerWaalsContact O-OG 3.04Å; S665-L667 VanDerWaalsContact C-N 3.34Å; S665-L667 PolarHBondContact O-N 3.4Å; S665-F668 PolarHBondContact O-N 2.9Å; S665-F669 WeakPolarHBondContact O-CD2 3.48Å; S665-F669 PolarHBondContact O-N 3.43Å; S665-M694 WeakPolarHBondContact OG-CE 3.48Å
666	A	97.2	Very high	96.2	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.1	-40.4	172.7	0	0	0	0	0	112	I662 L663 G670 F687 A690 M694	I662-A666 VanDerWaalsContact O-CB 3.25Å; I662-A666 WeakPolarHBondContact O-CB 3.44Å; I662-A666 PolarHBondContact O-N 3.03Å; L663-A666 PolarHBondContact O-N 3.24Å; A666-G670 WeakPolarHBondContact O-CA 3.2Å; A666-G670 PolarHBondContact O-N 3.34Å; A666-F687 HydrophobicContact CB-CD2 3.9Å; A666-F687 HydrophobicContact CB-CE2 3.59Å; A666-A690 HydrophobicContact CB-CB 4.18Å; A666-A690 WeakPolarHBondContact O-CB 3.29Å; A666-M694 HydrophobicContact CB-SD 3.87Å
667	L	97.4	Very high	96.2	Very high	95 Å²	95	57.3 Å²	57.3	50%	0.497	29%	0.294	S	S	.	.	H	α-helix	trans	-64.5	-44.1	173.6	-75.5	170.3	0	0	0	111.8	L663 V664 S665 G670 A671 F687	L663-L667 WeakPolarHBondContact O-CG 3.2Å; L663-L667 PolarHBondContact O-N 3.26Å; V664-L667 PolarHBondContact O-N 3.38Å; S665-L667 VanDerWaalsContact C-N 3.34Å; S665-L667 PolarHBondContact O-N 3.4Å; L667-G670 PolarHBondContact O-N 2.96Å; L667-A671 WeakPolarHBondContact O-CB 3.41Å; L667-A671 PolarHBondContact O-N 2.86Å; L667-F687 HydrophobicContact CB-CD2 4.3Å; L667-F687 HydrophobicContact CB-CE2 4.47Å; L667-F687 HydrophobicContact CD2-CD2 3.44Å; L667-F687 VanDerWaalsContact CD2-CD2 3.44Å; L667-F687 HydrophobicContact CD2-CE2 3.74Å; L667-F687 HydrophobicContact CD2-CG 4.03Å; L667-F687 HydrophobicContact CG-CD2 3.69Å; L667-F687 HydrophobicContact CG-CE2 3.61Å
668	F	97.8	Very high	96.1	Very high	137 Å²	137	57.1 Å²	57.1	60%	0.601	30%	0.304	S	S	*	.	H	α-helix	trans	-61	-53.5	178.4	174	-97.1	0	0	0	111.9	V664 S665 G670 A671 A672	V664-F668 WeakPolarHBondContact O-CB 3.2Å; V664-F668 PolarHBondContact O-N 3.01Å; S665-F668 PolarHBondContact O-N 2.9Å; F668-G670 VanDerWaalsContact C-N 3.34Å; F668-G670 PolarHBondContact O-N 3.04Å; F668-A671 PolarHBondContact O-N 2.79Å; F668-A672 WeakPolarHBondContact O-CB 3.32Å; F668-A672 PolarHBondContact O-N 3.22Å
669	F	97.6	Very high	96.1	Very high	18 Å²	18	58.4 Å²	58.4	8%	0.079	31%	0.313	C	S	.	.	H	α-helix	trans	-69.2	-33.5	179.5	-72.8	-64.5	0	0	0	112.4	S665 A672 I673 A690 V712 A715 C716 L719	S665-F669 WeakPolarHBondContact O-CD2 3.48Å; S665-F669 PolarHBondContact O-N 3.43Å; F669-A672 PolarHBondContact O-N 3.29Å; F669-I673 WeakPolarHBondContact O-CB 3.27Å; F669-I673 PolarHBondContact O-N 3.3Å; F669-A690 HydrophobicContact CB-CB 4.2Å; F669-V712 HydrophobicContact CD1-CG1 4.08Å; F669-A715 HydrophobicContact CE1-CB 4.03Å; F669-A715 HydrophobicContact CZ-CB 4.36Å; F669-C716 HydrophobicContact CB-CB 4.14Å; F669-C716 HydrophobicContact CD1-CB 3.83Å; F669-C716 HydrophobicContact CD2-CB 3.92Å; F669-C716 HydrophobicContact CE1-CB 4.17Å; F669-C716 HydrophobicContact CE2-CB 4.24Å; F669-C716 HydrophobicContact CG-CB 3.7Å; F669-C716 HydrophobicContact CZ-CB 4.37Å; F669-L719 HydrophobicContact CE2-CB 4.17Å; F669-L719 HydrophobicContact CE2-CD2 3.64Å; F669-L719 HydrophobicContact CZ-CB 4.45Å; F669-L719 HydrophobicContact CZ-CD2 4.16Å
670	G	97.4	Very high	96.2	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.2	-37.7	174.2	0	0	0	0	0	113.2	A666 L667 F668 I673 Y674 G686	A666-G670 WeakPolarHBondContact O-CA 3.2Å; A666-G670 PolarHBondContact O-N 3.34Å; L667-G670 PolarHBondContact O-N 2.96Å; F668-G670 VanDerWaalsContact C-N 3.34Å; F668-G670 PolarHBondContact O-N 3.04Å; G670-I673 WeakPolarHBondContact O-CG2 3.39Å; G670-Y674 PolarHBondContact O-N 2.72Å; G670-G686 VanDerWaalsContact CA-O 3.29Å; G670-G686 WeakPolarHBondContact CA-O 3.49Å
671	A	97.8	Very high	96.1	Very high	28 Å²	28	52.5 Å²	52.5	23%	0.231	29%	0.287	C	S	.	.	H	α-helix	trans	-72.7	-42	171.4	0	0	0	0	0	111.9	L667 F668 I673 Y674 F675 I683	L667-A671 WeakPolarHBondContact O-CB 3.41Å; L667-A671 PolarHBondContact O-N 2.86Å; F668-A671 PolarHBondContact O-N 2.79Å; A671-I673 PolarHBondContact O-N 2.9Å; A671-Y674 WeakPolarHBondContact O-CB 3.46Å; A671-Y674 PolarHBondContact O-N 2.79Å; A671-F675 WeakPolarHBondContact O-CD2 3.47Å; A671-F675 PolarHBondContact O-N 3.03Å; A671-I683 HydrophobicContact CB-CG2 4.38Å
672	A	97.4	Very high	96	Very high	27 Å²	27	52.4 Å²	52.4	22%	0.223	29%	0.287	C	S	.	.	H	α-helix	trans	-60.7	-43.4	179.6	0	0	0	0	0	112.2	F668 F669 Y674 F675 V676 V712	F668-A672 WeakPolarHBondContact O-CB 3.32Å; F668-A672 PolarHBondContact O-N 3.22Å; F669-A672 PolarHBondContact O-N 3.29Å; A672-Y674 VanDerWaalsContact C-N 3.33Å; A672-Y674 PolarHBondContact O-N 3.37Å; A672-F675 PolarHBondContact O-N 2.75Å; A672-V676 WeakPolarHBondContact O-CB 3.31Å; A672-V676 VanDerWaalsContact O-CG2 3.26Å; A672-V676 WeakPolarHBondContact O-CG2 3.38Å; A672-V676 PolarHBondContact O-N 3Å; A672-V712 HydrophobicContact CB-CG1 4.06Å
673	I	97	Very high	96.1	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-68.1	-35	-179.4	-158.3	68.7	0	0	0	112.1	F669 G670 A671 F675 V676 D677 F680 W689 P704 V712	F669-I673 WeakPolarHBondContact O-CB 3.27Å; F669-I673 PolarHBondContact O-N 3.3Å; G670-I673 WeakPolarHBondContact O-CG2 3.39Å; A671-I673 PolarHBondContact O-N 2.9Å; I673-F675 VanDerWaalsContact C-N 3.35Å; I673-F675 PolarHBondContact O-N 3.27Å; I673-V676 PolarHBondContact O-N 3.3Å; I673-D677 HydrophobicContact CD1-CB 4.5Å; I673-D677 PolarHBondContact O-N 3.44Å; I673-F680 HydrophobicContact CB-CD2 4.4Å; I673-F680 HydrophobicContact CB-CE2 4.34Å; I673-F680 HydrophobicContact CD1-CE2 4.22Å; I673-F680 HydrophobicContact CG1-CD2 3.64Å; I673-F680 HydrophobicContact CG1-CE1 4.39Å; I673-F680 HydrophobicContact CG1-CE2 3.24Å; I673-F680 HydrophobicContact CG1-CG 4.37Å; I673-F680 HydrophobicContact CG1-CZ 3.67Å; I673-F680 HydrophobicContact CG2-CD1 3.93Å; I673-F680 HydrophobicContact CG2-CD2 4.07Å; I673-F680 HydrophobicContact CG2-CE1 4.02Å; I673-F680 HydrophobicContact CG2-CE2 4.18Å; I673-F680 HydrophobicContact CG2-CG 3.96Å; I673-F680 HydrophobicContact CG2-CZ 4.15Å; I673-W689 HydrophobicContact CB-CE3 4.17Å; I673-W689 HydrophobicContact CB-CH2 4.34Å; I673-W689 HydrophobicContact CB-CZ3 3.74Å; I673-W689 HydrophobicContact CD1-CH2 4.07Å; I673-W689 HydrophobicContact CD1-CZ3 4.34Å; I673-W689 HydrophobicContact CG1-CE3 4.31Å; I673-W689 HydrophobicContact CG1-CH2 4.08Å; I673-W689 HydrophobicContact CG1-CZ3 3.91Å; I673-W689 HydrophobicContact CG2-CE3 3.7Å; I673-W689 HydrophobicContact CG2-CZ3 3.79Å; I673-P704 HydrophobicContact CD1-CB 4.26Å; I673-V712 HydrophobicContact CB-CG1 4.36Å; I673-V712 HydrophobicContact CD1-CB 4.02Å; I673-V712 HydrophobicContact CD1-CG1 4Å
674	Y	96.6	Very high	96.1	Very high	86 Å²	86	55.8 Å²	55.8	34%	0.337	31%	0.31	S	S	.	.	H	α-helix	trans	-59.9	-42	174.5	167.2	-101.4	0	0	0	112.6	G670 A671 A672 V676 F680 S681 I683	G670-Y674 PolarHBondContact O-N 2.72Å; A671-Y674 WeakPolarHBondContact O-CB 3.46Å; A671-Y674 PolarHBondContact O-N 2.79Å; A672-Y674 VanDerWaalsContact C-N 3.33Å; A672-Y674 PolarHBondContact O-N 3.37Å; Y674-V676 VanDerWaalsContact C-N 3.33Å; Y674-F680 VanDerWaalsContact CD2-O 3.29Å; Y674-F680 WeakPolarHBondContact CD2-O 3.29Å; Y674-S681 WeakPolarHBondContact CE2-O 3.32Å; Y674-I683 HydrophobicContact CD1-CD1 4.37Å; Y674-I683 HydrophobicContact CD1-CG1 3.68Å; Y674-I683 HydrophobicContact CE1-CG1 4.12Å; Y674-I683 HydrophobicContact CG-CG1 3.92Å
675	F	95.9	Very high	96.1	Very high	160 Å²	160	56.7 Å²	56.7	70%	0.702	31%	0.307	S	S	*	.	H	α-helix	trans	-76.4	-19.3	178.8	-73.3	-64.9	0	0	0	114	A671 A672 I673	A671-F675 WeakPolarHBondContact O-CD2 3.47Å; A671-F675 PolarHBondContact O-N 3.03Å; A672-F675 PolarHBondContact O-N 2.75Å; I673-F675 VanDerWaalsContact C-N 3.35Å; I673-F675 PolarHBondContact O-N 3.27Å
676	V	96.1	Very high	96.1	Very high	47 Å²	47	56.3 Å²	56.3	29%	0.285	31%	0.305	S	S	.	.	H	α-helix	trans	-100.6	-30	-173.5	170.7	0	0	0	0	112.6	A672 I673 Y674 N706 W708 V712	A672-V676 WeakPolarHBondContact O-CB 3.31Å; A672-V676 VanDerWaalsContact O-CG2 3.26Å; A672-V676 WeakPolarHBondContact O-CG2 3.38Å; A672-V676 PolarHBondContact O-N 3Å; I673-V676 PolarHBondContact O-N 3.3Å; Y674-V676 VanDerWaalsContact C-N 3.33Å; V676-N706 PolarHBondContact O-ND2 2.79Å; V676-W708 VanDerWaalsContact CG1-C 3.47Å; V676-W708 HydrophobicContact CG1-CB 3.29Å; V676-V712 HydrophobicContact CG1-CG2 4.47Å; V676-V712 HydrophobicContact CG2-CG2 4.29Å
677	D	93.9	Very high	96.1	Very high	4 Å²	4	58.8 Å²	58.8	2%	0.021	32%	0.315	C	S	.	.			trans	-132.3	122.9	-173.7	-160.4	-27	0	0	0	112.1	I673 T679 F680 P704 N705 N706	I673-D677 HydrophobicContact CD1-CB 4.5Å; I673-D677 PolarHBondContact O-N 3.44Å; D677-T679 VanDerWaalsContact CG-OG1 3.3Å; D677-T679 PolarHBondContact O-N 3.23Å; D677-T679 WeakPolarHBondContact OD1-CG2 3.06Å; D677-T679 PolarHBondContact OD1-N 3.37Å; D677-T679 VanDerWaalsContact OD1-N 3.11Å; D677-T679 PolarHBondContact OD1-OG1 3.36Å; D677-T679 VanDerWaalsContact OD1-OG1 3.14Å; D677-F680 HydrophobicContact CB-CD2 4.02Å; D677-F680 HydrophobicContact CB-CE2 4.26Å; D677-F680 PolarHBondContact O-N 3.48Å; D677-P704 WeakPolarHBondContact OD2-CA 3.34Å; D677-N705 PolarHBondContact OD2-N 2.93Å; D677-N706 HydrophobicContact CB-CB 4.32Å; D677-N706 PolarHBondContact OD2-N 3.47Å
678	S	92.1	Very high	96.1	Very high	122 Å²	122	59.5 Å²	59.5	85%	0.853	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-8.2	-179.4	54.8	0	0	0	0	114.1	F680	S678-F680 PolarHBondContact O-N 2.86Å
679	T	93.7	Very high	96.1	Very high	47 Å²	47	53.4 Å²	53.4	29%	0.288	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-23.4	173	55.1	0	0	0	0	112.7	D677 V703 N705	D677-T679 VanDerWaalsContact CG-OG1 3.3Å; D677-T679 PolarHBondContact O-N 3.23Å; D677-T679 WeakPolarHBondContact OD1-CG2 3.06Å; D677-T679 PolarHBondContact OD1-N 3.37Å; D677-T679 VanDerWaalsContact OD1-N 3.11Å; D677-T679 PolarHBondContact OD1-OG1 3.36Å; D677-T679 VanDerWaalsContact OD1-OG1 3.14Å; T679-V703 PolarHBondContact OG1-O 3.49Å; T679-N705 HydrophobicContact CG2-CB 3.8Å; T679-N705 VanDerWaalsContact CG2-ND2 3.26Å; T679-N705 WeakPolarHBondContact CG2-ND2 3.23Å
680	F	94.9	Very high	96.1	Very high	4 Å²	4	52.6 Å²	52.6	2%	0.018	28%	0.281	C	S	.	.			trans	-95.4	107.7	-179.7	-62.5	-91.4	0	0	0	110.1	I673 Y674 D677 S678 W689 L702	I673-F680 HydrophobicContact CB-CD2 4.4Å; I673-F680 HydrophobicContact CB-CE2 4.34Å; I673-F680 HydrophobicContact CD1-CE2 4.22Å; I673-F680 HydrophobicContact CG1-CD2 3.64Å; I673-F680 HydrophobicContact CG1-CE1 4.39Å; I673-F680 HydrophobicContact CG1-CE2 3.24Å; I673-F680 HydrophobicContact CG1-CG 4.37Å; I673-F680 HydrophobicContact CG1-CZ 3.67Å; I673-F680 HydrophobicContact CG2-CD1 3.93Å; I673-F680 HydrophobicContact CG2-CD2 4.07Å; I673-F680 HydrophobicContact CG2-CE1 4.02Å; I673-F680 HydrophobicContact CG2-CE2 4.18Å; I673-F680 HydrophobicContact CG2-CG 3.96Å; I673-F680 HydrophobicContact CG2-CZ 4.15Å; Y674-F680 VanDerWaalsContact CD2-O 3.29Å; Y674-F680 WeakPolarHBondContact CD2-O 3.29Å; D677-F680 HydrophobicContact CB-CD2 4.02Å; D677-F680 HydrophobicContact CB-CE2 4.26Å; D677-F680 PolarHBondContact O-N 3.48Å; S678-F680 PolarHBondContact O-N 2.86Å; F680-W689 HydrophobicContact CE1-CB 3.62Å; F680-W689 AromaticContact CE1-CD2 3.91Å; F680-W689 HydrophobicContact CE1-CD2 3.91Å; F680-W689 HydrophobicContact CE1-CE3 4.35Å; F680-W689 AromaticContact CE1-CG 3.57Å; F680-W689 HydrophobicContact CE1-CG 3.57Å; F680-W689 HydrophobicContact CZ-CB 4.42Å; F680-W689 AromaticContact CZ-CD2 3.9Å; F680-W689 HydrophobicContact CZ-CD2 3.9Å; F680-W689 HydrophobicContact CZ-CE3 4.41Å; F680-W689 AromaticContact CZ-CG 3.88Å; F680-W689 HydrophobicContact CZ-CG 3.88Å; F680-L702 HydrophobicContact CD1-CD1 4.26Å; F680-L702 HydrophobicContact CE1-CB 3.84Å; F680-L702 HydrophobicContact CE1-CD1 4.17Å; F680-L702 HydrophobicContact CZ-CB 4.31Å
681	S	93.1	Very high	96.1	Very high	55 Å²	55	55.5 Å²	55.5	39%	0.385	30%	0.296	S	S	.	.			trans	-71.8	-32.3	-176.2	66.4	0	0	0	0	114.2	Y674 K685	Y674-S681 WeakPolarHBondContact CE2-O 3.32Å; S681-K685 WeakPolarHBondContact OG-CD 3.06Å; S681-K685 VanDerWaalsContact OG-CE 3.28Å; S681-K685 WeakPolarHBondContact OG-CE 3.4Å; S681-K685 PolarHBondContact OG-NZ 3.29Å
682	D	95.5	Very high	96	Very high	85 Å²	85	54.4 Å²	54.4	46%	0.455	29%	0.287	S	S	.	.	S	Bend	trans	-146.9	150.8	-173.9	-49.4	-81	0	0	0	110.7	P684 K685 G686	D682-P684 VanDerWaalsContact C-CD 3.49Å; D682-P684 VanDerWaalsContact C-N 3.35Å; D682-K685 WeakPolarHBondContact O-CB 3.46Å; D682-K685 PolarHBondContact O-N 2.99Å; D682-G686 PolarHBondContact O-N 2.99Å
683	I	96.3	Very high	95.9	Very high	73 Å²	73	54.2 Å²	54.2	37%	0.374	28%	0.283	S	S	.	.	H	α-helix	trans	-54	-41.2	179	-61.1	166.2	0	0	0	112.8	A671 Y674 K685 G686 F687	A671-I683 HydrophobicContact CB-CG2 4.38Å; Y674-I683 HydrophobicContact CD1-CD1 4.37Å; Y674-I683 HydrophobicContact CD1-CG1 3.68Å; Y674-I683 HydrophobicContact CE1-CG1 4.12Å; Y674-I683 HydrophobicContact CG-CG1 3.92Å; I683-K685 VanDerWaalsContact C-N 3.27Å; I683-K685 PolarHBondContact O-N 3.37Å; I683-G686 CarbonylContact O-C 3.52Å; I683-G686 WeakPolarHBondContact O-CA 3.32Å; I683-G686 PolarHBondContact O-N 3.23Å; I683-G686 VanDerWaalsContact O-N 3.11Å; I683-F687 PolarHBondContact O-N 2.9Å
684	P	97.7	Very high	95.9	Very high	95 Å²	95	54.3 Å²	54.3	62%	0.617	28%	0.283	S	S	*	.	H	α-helix	trans	-59.9	-31.5	176.2	-26.9	36.9	0	0	0	114.5	D682 F687 W688	D682-P684 VanDerWaalsContact C-CD 3.49Å; D682-P684 VanDerWaalsContact C-N 3.35Å; P684-F687 PolarHBondContact O-N 3.36Å; P684-W688 PolarHBondContact O-N 2.99Å
685	K	96.7	Very high	95.7	Very high	99 Å²	99	51.7 Å²	51.7	43%	0.43	28%	0.278	S	S	.	.	H	α-helix	trans	-72	-39.3	174.2	-67.4	-172.1	-172.7	171	0	111.4	S681 D682 I683 F687 W688 W689 L702	S681-K685 WeakPolarHBondContact OG-CD 3.06Å; S681-K685 VanDerWaalsContact OG-CE 3.28Å; S681-K685 WeakPolarHBondContact OG-CE 3.4Å; S681-K685 PolarHBondContact OG-NZ 3.29Å; D682-K685 WeakPolarHBondContact O-CB 3.46Å; D682-K685 PolarHBondContact O-N 2.99Å; I683-K685 VanDerWaalsContact C-N 3.27Å; I683-K685 PolarHBondContact O-N 3.37Å; K685-F687 VanDerWaalsContact C-N 3.33Å; K685-W688 PolarHBondContact O-N 3.15Å; K685-W689 WeakPolarHBondContact O-CB 3.37Å; K685-W689 PolarHBondContact O-N 2.81Å; K685-L702 HydrophobicContact CB-CD1 3.96Å
686	G	97.1	Very high	95.6	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.3	-42.5	170.1	0	0	0	0	0	112	G670 D682 I683 W689 A690	G670-G686 VanDerWaalsContact CA-O 3.29Å; G670-G686 WeakPolarHBondContact CA-O 3.49Å; D682-G686 PolarHBondContact O-N 2.99Å; I683-G686 CarbonylContact O-C 3.52Å; I683-G686 WeakPolarHBondContact O-CA 3.32Å; I683-G686 PolarHBondContact O-N 3.23Å; I683-G686 VanDerWaalsContact O-N 3.11Å; G686-W689 PolarHBondContact O-N 3.04Å; G686-A690 WeakPolarHBondContact O-CB 3.4Å; G686-A690 PolarHBondContact O-N 3.21Å
687	F	97	Very high	95.6	Very high	52 Å²	52	50.5 Å²	50.5	23%	0.228	28%	0.283	C	S	.	.	H	α-helix	trans	-62.3	-45.6	175.3	175.9	-104.7	0	0	0	112.3	L663 A666 L667 I683 P684 K685 W689 A690 L691	L663-F687 HydrophobicContact CD2-CZ 4.05Å; A666-F687 HydrophobicContact CB-CD2 3.9Å; A666-F687 HydrophobicContact CB-CE2 3.59Å; L667-F687 HydrophobicContact CB-CD2 4.3Å; L667-F687 HydrophobicContact CB-CE2 4.47Å; L667-F687 HydrophobicContact CD2-CD2 3.44Å; L667-F687 VanDerWaalsContact CD2-CD2 3.44Å; L667-F687 HydrophobicContact CD2-CE2 3.74Å; L667-F687 HydrophobicContact CD2-CG 4.03Å; L667-F687 HydrophobicContact CG-CD2 3.69Å; L667-F687 HydrophobicContact CG-CE2 3.61Å; I683-F687 PolarHBondContact O-N 2.9Å; P684-F687 PolarHBondContact O-N 3.36Å; K685-F687 VanDerWaalsContact C-N 3.33Å; F687-W689 PolarHBondContact O-N 3.22Å; F687-A690 PolarHBondContact O-N 2.92Å; F687-L691 HydrophobicContact CE1-CD1 4.06Å; F687-L691 HydrophobicContact CZ-CD1 3.99Å; F687-L691 WeakPolarHBondContact O-CB 3.37Å; F687-L691 PolarHBondContact O-N 3.05Å
688	W	97.5	Very high	95.6	Very high	110 Å²	110	52.5 Å²	52.5	42%	0.417	31%	0.305	S	S	.	.	H	α-helix	trans	-54.8	-51.6	172.8	164.5	-107.1	0	0	0	111.3	P684 K685 A690 L691 I692 Y699 D701	P684-W688 PolarHBondContact O-N 2.99Å; K685-W688 PolarHBondContact O-N 3.15Å; W688-A690 PolarHBondContact O-N 3Å; W688-L691 PolarHBondContact O-N 3.27Å; W688-I692 HydrophobicContact CD2-CG2 3.97Å; W688-I692 HydrophobicContact CE3-CG2 4.04Å; W688-I692 HydrophobicContact CH2-CG2 3.83Å; W688-I692 HydrophobicContact CZ2-CG2 3.73Å; W688-I692 HydrophobicContact CZ3-CG2 3.97Å; W688-I692 WeakPolarHBondContact O-CG1 3.36Å; W688-I692 PolarHBondContact O-N 2.97Å; W688-Y699 HydrophobicContact CH2-CD2 4.25Å; W688-Y699 AromaticContact CH2-CE2 3.72Å; W688-Y699 HydrophobicContact CH2-CE2 3.72Å; W688-Y699 AromaticContact CZ2-CD2 3.65Å; W688-Y699 HydrophobicContact CZ2-CD2 3.65Å; W688-Y699 AromaticContact CZ2-CE2 3.61Å; W688-Y699 HydrophobicContact CZ2-CE2 3.61Å; W688-D701 PolarHBondContact NE1-OD2 3.2Å
689	W	97.6	Very high	95.7	Very high	10 Å²	10	54.1 Å²	54.1	4%	0.038	29%	0.293	C	S	.	.	H	α-helix	trans	-57.7	-44.6	177.3	167.4	80.2	0	0	0	112.8	I673 F680 K685 G686 F687 I692 T693 L702 A713 C716	I673-W689 HydrophobicContact CB-CE3 4.17Å; I673-W689 HydrophobicContact CB-CH2 4.34Å; I673-W689 HydrophobicContact CB-CZ3 3.74Å; I673-W689 HydrophobicContact CD1-CH2 4.07Å; I673-W689 HydrophobicContact CD1-CZ3 4.34Å; I673-W689 HydrophobicContact CG1-CE3 4.31Å; I673-W689 HydrophobicContact CG1-CH2 4.08Å; I673-W689 HydrophobicContact CG1-CZ3 3.91Å; I673-W689 HydrophobicContact CG2-CE3 3.7Å; I673-W689 HydrophobicContact CG2-CZ3 3.79Å; F680-W689 HydrophobicContact CE1-CB 3.62Å; F680-W689 AromaticContact CE1-CD2 3.91Å; F680-W689 HydrophobicContact CE1-CD2 3.91Å; F680-W689 HydrophobicContact CE1-CE3 4.35Å; F680-W689 AromaticContact CE1-CG 3.57Å; F680-W689 HydrophobicContact CE1-CG 3.57Å; F680-W689 HydrophobicContact CZ-CB 4.42Å; F680-W689 AromaticContact CZ-CD2 3.9Å; F680-W689 HydrophobicContact CZ-CD2 3.9Å; F680-W689 HydrophobicContact CZ-CE3 4.41Å; F680-W689 AromaticContact CZ-CG 3.88Å; F680-W689 HydrophobicContact CZ-CG 3.88Å; K685-W689 WeakPolarHBondContact O-CB 3.37Å; K685-W689 PolarHBondContact O-N 2.81Å; G686-W689 PolarHBondContact O-N 3.04Å; F687-W689 PolarHBondContact O-N 3.22Å; W689-I692 WeakPolarHBondContact O-CG1 3.23Å; W689-T693 PolarHBondContact NE1-OG1 3.03Å; W689-T693 VanDerWaalsContact O-CB 3.23Å; W689-T693 WeakPolarHBondContact O-CB 3.48Å; W689-T693 PolarHBondContact O-N 3.27Å; W689-T693 PolarHBondContact O-OG1 2.82Å; W689-L702 HydrophobicContact CB-CB 4.33Å; W689-L702 HydrophobicContact CB-CD1 4.35Å; W689-L702 HydrophobicContact CG-CB 4.5Å; W689-L702 PolarHBondContact NE1-O 2.88Å; W689-A713 HydrophobicContact CH2-CB 3.84Å; W689-A713 HydrophobicContact CZ2-CB 3.65Å; W689-C716 HydrophobicContact CH2-CB 4.48Å
690	A	97.4	Very high	95.7	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-63.6	-43.5	178.1	0	0	0	0	0	110.9	A666 F669 G686 F687 W688 T693 M694	A666-A690 HydrophobicContact CB-CB 4.18Å; A666-A690 WeakPolarHBondContact O-CB 3.29Å; F669-A690 HydrophobicContact CB-CB 4.2Å; G686-A690 WeakPolarHBondContact O-CB 3.4Å; G686-A690 PolarHBondContact O-N 3.21Å; F687-A690 PolarHBondContact O-N 2.92Å; W688-A690 PolarHBondContact O-N 3Å; A690-T693 PolarHBondContact O-N 2.89Å; A690-M694 VanDerWaalsContact O-CB 3.29Å; A690-M694 WeakPolarHBondContact O-CB 3.35Å; A690-M694 WeakPolarHBondContact O-CG 3.27Å; A690-M694 PolarHBondContact O-N 3.11Å
691	L	96.5	Very high	95.8	Very high	61 Å²	61	58.2 Å²	58.2	32%	0.319	33%	0.326	S	S	.	.	H	α-helix	trans	-63.8	-45.5	179.3	-165.3	158.2	0	0	0	112	F687 W688 T693 S695	F687-L691 HydrophobicContact CE1-CD1 4.06Å; F687-L691 HydrophobicContact CZ-CD1 3.99Å; F687-L691 WeakPolarHBondContact O-CB 3.37Å; F687-L691 PolarHBondContact O-N 3.05Å; W688-L691 PolarHBondContact O-N 3.27Å; L691-T693 VanDerWaalsContact C-N 3.32Å; L691-T693 PolarHBondContact O-N 3.3Å; L691-S695 VanDerWaalsContact O-CB 3.27Å; L691-S695 WeakPolarHBondContact O-CB 3.22Å; L691-S695 PolarHBondContact O-N 2.87Å; L691-S695 PolarHBondContact O-OG 3.41Å
692	I	96.6	Very high	95.8	Very high	6 Å²	6	57.3 Å²	57.3	3%	0.031	32%	0.317	C	S	.	.	H	α-helix	trans	-67.4	-32.4	177.3	64.7	177.9	0	0	0	112.4	W688 W689 S695 T696 V697 G698 Y699 D701	W688-I692 HydrophobicContact CD2-CG2 3.97Å; W688-I692 HydrophobicContact CE3-CG2 4.04Å; W688-I692 HydrophobicContact CH2-CG2 3.83Å; W688-I692 HydrophobicContact CZ2-CG2 3.73Å; W688-I692 HydrophobicContact CZ3-CG2 3.97Å; W688-I692 WeakPolarHBondContact O-CG1 3.36Å; W688-I692 PolarHBondContact O-N 2.97Å; W689-I692 WeakPolarHBondContact O-CG1 3.23Å; I692-S695 VanDerWaalsContact CA-OG 3.3Å; I692-S695 WeakPolarHBondContact CA-OG 3.21Å; I692-S695 PolarHBondContact O-OG 2.92Å; I692-S695 VanDerWaalsContact O-OG 3.1Å; I692-T696 PolarHBondContact O-N 2.96Å; I692-V697 PolarHBondContact O-N 3.23Å; I692-G698 PolarHBondContact O-N 3.32Å; I692-G698 VanDerWaalsContact O-N 3.12Å; I692-Y699 HydrophobicContact CB-CD2 4.4Å; I692-Y699 HydrophobicContact CD1-CD2 4.14Å; I692-Y699 HydrophobicContact CG2-CD2 3.96Å; I692-Y699 HydrophobicContact CG2-CE2 3.96Å; I692-D701 WeakPolarHBondContact CD1-OD1 3.44Å
693	T	95.9	Very high	95.8	Very high	23 Å²	23	56.7 Å²	56.7	14%	0.141	32%	0.316	C	S	.	.	H	α-helix	trans	-73.5	-47.9	178.2	-59.9	0	0	0	0	110.7	W689 A690 L691 S695 T696 I717	W689-T693 PolarHBondContact NE1-OG1 3.03Å; W689-T693 VanDerWaalsContact O-CB 3.23Å; W689-T693 WeakPolarHBondContact O-CB 3.48Å; W689-T693 PolarHBondContact O-N 3.27Å; W689-T693 PolarHBondContact O-OG1 2.82Å; A690-T693 PolarHBondContact O-N 2.89Å; L691-T693 VanDerWaalsContact C-N 3.32Å; L691-T693 PolarHBondContact O-N 3.3Å; T693-S695 VanDerWaalsContact C-N 3.3Å; T693-S695 PolarHBondContact O-N 2.93Å; T693-T696 WeakPolarHBondContact O-CA 3.44Å; T693-T696 PolarHBondContact O-N 3.48Å; T693-I717 HydrophobicContact CG2-CD1 4.38Å; T693-I717 HydrophobicContact CG2-CG1 3.54Å
694	M	95.3	Very high	95.8	Very high	2 Å²	2	53.8 Å²	53.8	1%	0.01	30%	0.302	C	S	.	.	H	α-helix	trans	-62.9	-37	177	-70.4	179.6	71.5	0	0	112.2	I662 S665 A666 A690 T696 L723 M724	I662-M694 HydrophobicContact CB-CE 4.44Å; I662-M694 HydrophobicContact CG1-CE 4.48Å; I662-M694 HydrophobicContact CG2-CE 4.09Å; S665-M694 WeakPolarHBondContact OG-CE 3.48Å; A666-M694 HydrophobicContact CB-SD 3.87Å; A690-M694 VanDerWaalsContact O-CB 3.29Å; A690-M694 WeakPolarHBondContact O-CB 3.35Å; A690-M694 WeakPolarHBondContact O-CG 3.27Å; A690-M694 PolarHBondContact O-N 3.11Å; M694-T696 PolarHBondContact O-N 3.37Å; M694-L723 HydrophobicContact CE-CD1 3.87Å; M694-M724 WeakPolarHBondContact O-CG 3.37Å
695	S	93.4	Very high	95.6	Very high	31 Å²	31	54.3 Å²	54.3	22%	0.217	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	2.2	173.9	60	0	0	0	0	114	L691 I692 T693 V697	L691-S695 VanDerWaalsContact O-CB 3.27Å; L691-S695 WeakPolarHBondContact O-CB 3.22Å; L691-S695 PolarHBondContact O-N 2.87Å; L691-S695 PolarHBondContact O-OG 3.41Å; I692-S695 VanDerWaalsContact CA-OG 3.3Å; I692-S695 WeakPolarHBondContact CA-OG 3.21Å; I692-S695 PolarHBondContact O-OG 2.92Å; I692-S695 VanDerWaalsContact O-OG 3.1Å; T693-S695 VanDerWaalsContact C-N 3.3Å; T693-S695 PolarHBondContact O-N 2.93Å; S695-V697 PolarHBondContact O-N 2.99Å; S695-V697 VanDerWaalsContact O-N 3.15Å
696	T	93.9	Very high	95.4	Very high	103 Å²	103	52.3 Å²	52.3	63%	0.632	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	15.3	179.6	66.2	0	0	0	0	114.8	I692 T693 M694 T721	I692-T696 PolarHBondContact O-N 2.96Å; T693-T696 WeakPolarHBondContact O-CA 3.44Å; T693-T696 PolarHBondContact O-N 3.48Å; M694-T696 PolarHBondContact O-N 3.37Å; T696-T721 HydrophobicContact CG2-CG2 3.98Å
697	V	95.2	Very high	95.3	Very high	78 Å²	78	56.9 Å²	56.9	47%	0.473	32%	0.321	S	S	.	.			trans	-76.4	-51.7	177.8	177.2	0	0	0	0	110.6	I692 S695 Y699	I692-V697 PolarHBondContact O-N 3.23Å; S695-V697 PolarHBondContact O-N 2.99Å; S695-V697 VanDerWaalsContact O-N 3.15Å; V697-Y699 HydrophobicContact CG1-CD1 4.13Å; V697-Y699 HydrophobicContact CG1-CD2 4.27Å; V697-Y699 HydrophobicContact CG1-CE1 3.76Å; V697-Y699 HydrophobicContact CG1-CE2 3.91Å; V697-Y699 HydrophobicContact CG1-CG 4.37Å
698	G	94.1	Very high	95.2	Very high	46 Å²	46	62.4 Å²	62.4	47%	0.474	34%	0.341	S	S	.	.			trans	51	67.8	174.1	0	0	0	0	0	115.5	I692 G700	I692-G698 PolarHBondContact O-N 3.32Å; I692-G698 VanDerWaalsContact O-N 3.12Å; G698-G700 PolarHBondContact O-N 3.06Å; G698-G700 VanDerWaalsContact O-N 3.14Å
699	Y	95.4	Very high	95.2	Very high	156 Å²	156	57.2 Å²	57.2	61%	0.612	32%	0.321	S	S	*	.			trans	-58.5	-26.6	179.2	-67.2	-63	0	0	0	114.4	W688 I692 V697 D701	W688-Y699 HydrophobicContact CH2-CD2 4.25Å; W688-Y699 AromaticContact CH2-CE2 3.72Å; W688-Y699 HydrophobicContact CH2-CE2 3.72Å; W688-Y699 AromaticContact CZ2-CD2 3.65Å; W688-Y699 HydrophobicContact CZ2-CD2 3.65Å; W688-Y699 AromaticContact CZ2-CE2 3.61Å; W688-Y699 HydrophobicContact CZ2-CE2 3.61Å; I692-Y699 HydrophobicContact CB-CD2 4.4Å; I692-Y699 HydrophobicContact CD1-CD2 4.14Å; I692-Y699 HydrophobicContact CG2-CD2 3.96Å; I692-Y699 HydrophobicContact CG2-CE2 3.96Å; V697-Y699 HydrophobicContact CG1-CD1 4.13Å; V697-Y699 HydrophobicContact CG1-CD2 4.27Å; V697-Y699 HydrophobicContact CG1-CE1 3.76Å; V697-Y699 HydrophobicContact CG1-CE2 3.91Å; V697-Y699 HydrophobicContact CG1-CG 4.37Å; Y699-D701 VanDerWaalsContact C-N 3.29Å
700	G	93.4	Very high	95.1	Very high	51 Å²	51	62.7 Å²	62.7	53%	0.526	34%	0.342	S	S	.	.	S	Bend	trans	77.5	12.2	-178.2	0	0	0	0	0	114.3	G698 L702	G698-G700 PolarHBondContact O-N 3.06Å; G698-G700 VanDerWaalsContact O-N 3.14Å; G700-L702 VanDerWaalsContact C-N 3.33Å
701	D	95.8	Very high	95.1	Very high	87 Å²	87	67.5 Å²	67.5	47%	0.465	37%	0.367	S	S	.	.	S	Bend	trans	-66.9	-33.5	171.9	59.8	-39.1	0	0	0	112.4	W688 I692 Y699	W688-D701 PolarHBondContact NE1-OD2 3.2Å; I692-D701 WeakPolarHBondContact CD1-OD1 3.44Å; Y699-D701 VanDerWaalsContact C-N 3.29Å
702	L	94.5	Very high	95.2	Very high	36 Å²	36	65.9 Å²	65.9	19%	0.188	36%	0.359	C	S	.	.	S	Bend	trans	-128.8	129.7	172.6	-63.6	172.3	0	0	0	109.5	F680 K685 W689 G700	F680-L702 HydrophobicContact CD1-CD1 4.26Å; F680-L702 HydrophobicContact CE1-CB 3.84Å; F680-L702 HydrophobicContact CE1-CD1 4.17Å; F680-L702 HydrophobicContact CZ-CB 4.31Å; K685-L702 HydrophobicContact CB-CD1 3.96Å; W689-L702 HydrophobicContact CB-CB 4.33Å; W689-L702 HydrophobicContact CB-CD1 4.35Å; W689-L702 HydrophobicContact CG-CB 4.5Å; W689-L702 PolarHBondContact NE1-O 2.88Å; G700-L702 VanDerWaalsContact C-N 3.33Å
703	V	95.1	Very high	95.2	Very high	72 Å²	72	66 Å²	66	44%	0.436	36%	0.361	S	S	.	.			trans	-140.1	146.2	176	-65.8	0	0	0	0	109.7	T679 N705	T679-V703 PolarHBondContact OG1-O 3.49Å; V703-N705 PolarHBondContact O-N 3.02Å
704	P	95.3	Very high	95.2	Very high	12 Å²	12	68.6 Å²	68.6	8%	0.078	38%	0.377	C	S	.	.			trans	-64.1	135	171.2	28	-34.9	0	0	0	110.1	I673 D677 Y710 A713	I673-P704 HydrophobicContact CD1-CB 4.26Å; D677-P704 WeakPolarHBondContact OD2-CA 3.34Å; P704-Y710 HydrophobicContact CB-CD1 4.2Å; P704-Y710 HydrophobicContact CB-CE1 4.37Å; P704-Y710 HydrophobicContact CG-CD1 3.7Å; P704-Y710 HydrophobicContact CG-CE1 3.94Å; P704-Y710 WeakPolarHBondContact O-CE1 3.02Å; P704-Y710 PolarHBondContact O-OH 3.46Å; P704-A713 HydrophobicContact CG-CB 3.92Å
705	N	93.6	Very high	95.3	Very high	105 Å²	105	70.7 Å²	70.7	56%	0.561	40%	0.395	S	S	*	.			trans	-105.4	-19.7	171.7	-71.9	-8.8	0	0	0	111.5	D677 T679 V703	D677-N705 PolarHBondContact OD2-N 2.93Å; T679-N705 HydrophobicContact CG2-CB 3.8Å; T679-N705 VanDerWaalsContact CG2-ND2 3.26Å; T679-N705 WeakPolarHBondContact CG2-ND2 3.23Å; V703-N705 PolarHBondContact O-N 3.02Å
706	N	93	Very high	95.4	Very high	58 Å²	58	69.2 Å²	69.2	31%	0.31	39%	0.385	S	S	.	.	S	Bend	trans	-87.6	148.6	-178.9	-167.6	10.2	0	0	0	112.6	V676 D677 W708 G709 Y710	V676-N706 PolarHBondContact O-ND2 2.79Å; D677-N706 HydrophobicContact CB-CB 4.32Å; D677-N706 PolarHBondContact OD2-N 3.47Å; N706-W708 VanDerWaalsContact C-N 3.34Å; N706-W708 PolarHBondContact O-N 3.07Å; N706-G709 WeakPolarHBondContact O-CA 3.16Å; N706-G709 PolarHBondContact O-N 3.49Å; N706-Y710 WeakPolarHBondContact O-CD2 3.29Å; N706-Y710 PolarHBondContact O-N 3.12Å
707	T	95	Very high	95.6	Very high	95 Å²	95	68.1 Å²	68.1	58%	0.583	37%	0.374	S	S	*	.	H	α-helix	trans	-55.3	-45.6	176.2	53.7	0	0	0	0	112.7	G709 Y710 I711	T707-G709 VanDerWaalsContact C-N 3.31Å; T707-G709 PolarHBondContact O-N 2.83Å; T707-Y710 PolarHBondContact O-N 3.41Å; T707-I711 PolarHBondContact O-N 3.14Å
708	W	95.3	Very high	95.6	Very high	169 Å²	169	69.1 Å²	69.1	64%	0.64	38%	0.376	S	S	*	.	H	α-helix	trans	-66.7	-32.9	174.3	-66.4	108.9	0	0	0	112.6	V676 N706 Y710 I711 V712	V676-W708 VanDerWaalsContact CG1-C 3.47Å; V676-W708 HydrophobicContact CG1-CB 3.29Å; N706-W708 VanDerWaalsContact C-N 3.34Å; N706-W708 PolarHBondContact O-N 3.07Å; W708-Y710 VanDerWaalsContact C-N 3.33Å; W708-Y710 PolarHBondContact O-N 2.97Å; W708-I711 HydrophobicContact CE3-CD1 3.73Å; W708-I711 HydrophobicContact CZ3-CD1 3.96Å; W708-I711 WeakPolarHBondContact O-CB 3.36Å; W708-I711 PolarHBondContact O-N 3.1Å; W708-V712 WeakPolarHBondContact O-CG2 3.43Å; W708-V712 PolarHBondContact O-N 2.96Å; W708-V712 VanDerWaalsContact O-N 3.08Å
709	G	96.6	Very high	95.7	Very high	0 Å²	0	70.3 Å²	70.3	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-62.5	-39.7	174.9	0	0	0	0	0	111.9	N706 T707 I711 V712 A713	N706-G709 WeakPolarHBondContact O-CA 3.16Å; N706-G709 PolarHBondContact O-N 3.49Å; T707-G709 VanDerWaalsContact C-N 3.31Å; T707-G709 PolarHBondContact O-N 2.83Å; G709-I711 VanDerWaalsContact C-N 3.31Å; G709-I711 PolarHBondContact O-N 2.72Å; G709-V712 PolarHBondContact O-N 2.98Å; G709-A713 VanDerWaalsContact O-CB 3.29Å; G709-A713 WeakPolarHBondContact O-CB 3.42Å; G709-A713 PolarHBondContact O-N 3.29Å
710	Y	96.7	Very high	95.7	Very high	126 Å²	126	62.9 Å²	62.9	49%	0.494	34%	0.342	S	S	.	.	H	α-helix	trans	-62.7	-35.4	173.2	-62.9	-52.3	0	0	0	113	P704 N706 T707 W708 A713 T714	P704-Y710 HydrophobicContact CB-CD1 4.2Å; P704-Y710 HydrophobicContact CB-CE1 4.37Å; P704-Y710 HydrophobicContact CG-CD1 3.7Å; P704-Y710 HydrophobicContact CG-CE1 3.94Å; P704-Y710 WeakPolarHBondContact O-CE1 3.02Å; P704-Y710 PolarHBondContact O-OH 3.46Å; N706-Y710 WeakPolarHBondContact O-CD2 3.29Å; N706-Y710 PolarHBondContact O-N 3.12Å; T707-Y710 PolarHBondContact O-N 3.41Å; W708-Y710 VanDerWaalsContact C-N 3.33Å; W708-Y710 PolarHBondContact O-N 2.97Å; Y710-A713 PolarHBondContact O-N 3.32Å; Y710-T714 WeakPolarHBondContact O-CB 3.42Å; Y710-T714 PolarHBondContact O-N 2.99Å; Y710-T714 PolarHBondContact O-OG1 3.49Å
711	I	97.3	Very high	95.8	Very high	101 Å²	101	63.1 Å²	63.1	52%	0.518	33%	0.333	S	S	.	.	H	α-helix	trans	-66.5	-48.2	176.3	-63.2	171	0	0	0	110.1	T707 W708 G709 A713 T714 A715	T707-I711 PolarHBondContact O-N 3.14Å; W708-I711 HydrophobicContact CE3-CD1 3.73Å; W708-I711 HydrophobicContact CZ3-CD1 3.96Å; W708-I711 WeakPolarHBondContact O-CB 3.36Å; W708-I711 PolarHBondContact O-N 3.1Å; G709-I711 VanDerWaalsContact C-N 3.31Å; G709-I711 PolarHBondContact O-N 2.72Å; I711-A713 VanDerWaalsContact C-N 3.32Å; I711-A713 PolarHBondContact O-N 2.85Å; I711-T714 PolarHBondContact O-N 2.99Å; I711-A715 PolarHBondContact O-N 3.15Å
712	V	97.1	Very high	95.7	Very high	26 Å²	26	64.1 Å²	64.1	16%	0.158	34%	0.338	C	S	.	.	H	α-helix	trans	-59.3	-44.1	176.1	175.3	0	0	0	0	110.8	F669 A672 I673 V676 W708 G709 A715 C716	F669-V712 HydrophobicContact CD1-CG1 4.08Å; A672-V712 HydrophobicContact CB-CG1 4.06Å; I673-V712 HydrophobicContact CB-CG1 4.36Å; I673-V712 HydrophobicContact CD1-CB 4.02Å; I673-V712 HydrophobicContact CD1-CG1 4Å; V676-V712 HydrophobicContact CG1-CG2 4.47Å; V676-V712 HydrophobicContact CG2-CG2 4.29Å; W708-V712 WeakPolarHBondContact O-CG2 3.43Å; W708-V712 PolarHBondContact O-N 2.96Å; W708-V712 VanDerWaalsContact O-N 3.08Å; G709-V712 PolarHBondContact O-N 2.98Å; V712-A715 PolarHBondContact O-N 2.93Å; V712-C716 WeakPolarHBondContact O-CB 3.47Å; V712-C716 PolarHBondContact O-N 3.41Å
713	A	96.7	Very high	95.6	Very high	8 Å²	8	63.4 Å²	63.4	7%	0.066	33%	0.334	C	S	.	.	H	α-helix	trans	-63.2	-43	177.1	0	0	0	0	0	112.7	W689 P704 G709 Y710 I711 A715 C716 I717	W689-A713 HydrophobicContact CH2-CB 3.84Å; W689-A713 HydrophobicContact CZ2-CB 3.65Å; P704-A713 HydrophobicContact CG-CB 3.92Å; G709-A713 VanDerWaalsContact O-CB 3.29Å; G709-A713 WeakPolarHBondContact O-CB 3.42Å; G709-A713 PolarHBondContact O-N 3.29Å; Y710-A713 PolarHBondContact O-N 3.32Å; I711-A713 VanDerWaalsContact C-N 3.32Å; I711-A713 PolarHBondContact O-N 2.85Å; A713-A715 VanDerWaalsContact C-N 3.34Å; A713-A715 PolarHBondContact O-N 3.43Å; A713-C716 WeakPolarHBondContact O-CB 3.14Å; A713-C716 PolarHBondContact O-N 3.44Å; A713-I717 WeakPolarHBondContact O-CD1 3.35Å; A713-I717 VanDerWaalsContact O-CG1 3.22Å; A713-I717 WeakPolarHBondContact O-CG1 3.42Å; A713-I717 PolarHBondContact O-N 3.45Å
714	T	96.3	Very high	95.5	Very high	79 Å²	79	62.3 Å²	62.3	49%	0.485	33%	0.325	S	S	.	.	H	α-helix	trans	-62.1	-43.9	177.7	-56.4	0	0	0	0	111	Y710 I711 I717 I718	Y710-T714 WeakPolarHBondContact O-CB 3.42Å; Y710-T714 PolarHBondContact O-N 2.99Å; Y710-T714 PolarHBondContact O-OG1 3.49Å; I711-T714 PolarHBondContact O-N 2.99Å; T714-I717 PolarHBondContact O-N 3.23Å; T714-I718 HydrophobicContact CG2-CD1 4.12Å; T714-I718 WeakPolarHBondContact O-CG1 3.13Å; T714-I718 PolarHBondContact O-N 3.1Å; T714-I718 VanDerWaalsContact O-N 3.07Å
715	A	97	Very high	95.3	Very high	46 Å²	46	65.1 Å²	65.1	38%	0.38	34%	0.344	S	S	.	.	H	α-helix	trans	-63	-41.3	174.9	0	0	0	0	0	112.2	F669 I711 V712 A713 I718 L719	F669-A715 HydrophobicContact CE1-CB 4.03Å; F669-A715 HydrophobicContact CZ-CB 4.36Å; I711-A715 PolarHBondContact O-N 3.15Å; V712-A715 PolarHBondContact O-N 2.93Å; A713-A715 VanDerWaalsContact C-N 3.34Å; A713-A715 PolarHBondContact O-N 3.43Å; A715-I718 PolarHBondContact O-N 3.32Å; A715-L719 PolarHBondContact O-N 3.31Å
716	C	97.1	Very high	95.2	Very high	0 Å²	0	66.5 Å²	66.5	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-62.5	-44.1	176.3	-176	0	0	0	0	112.1	F669 W689 V712 A713 G720	F669-C716 HydrophobicContact CB-CB 4.14Å; F669-C716 HydrophobicContact CD1-CB 3.83Å; F669-C716 HydrophobicContact CD2-CB 3.92Å; F669-C716 HydrophobicContact CE1-CB 4.17Å; F669-C716 HydrophobicContact CE2-CB 4.24Å; F669-C716 HydrophobicContact CG-CB 3.7Å; F669-C716 HydrophobicContact CZ-CB 4.37Å; W689-C716 HydrophobicContact CH2-CB 4.48Å; V712-C716 WeakPolarHBondContact O-CB 3.47Å; V712-C716 PolarHBondContact O-N 3.41Å; A713-C716 WeakPolarHBondContact O-CB 3.14Å; A713-C716 PolarHBondContact O-N 3.44Å; C716-G720 WeakPolarHBondContact O-CA 3.3Å; C716-G720 PolarHBondContact O-N 3.39Å
717	I	96.7	Very high	95	Very high	80 Å²	80	64.8 Å²	64.8	41%	0.41	34%	0.335	S	S	.	.	H	α-helix	trans	-61.9	-47.8	177.9	-69.2	162.1	0	0	0	110.5	T693 A713 T714 G720 T721	T693-I717 HydrophobicContact CG2-CD1 4.38Å; T693-I717 HydrophobicContact CG2-CG1 3.54Å; A713-I717 WeakPolarHBondContact O-CD1 3.35Å; A713-I717 VanDerWaalsContact O-CG1 3.22Å; A713-I717 WeakPolarHBondContact O-CG1 3.42Å; A713-I717 PolarHBondContact O-N 3.45Å; T714-I717 PolarHBondContact O-N 3.23Å; I717-G720 PolarHBondContact O-N 3.04Å; I717-T721 HydrophobicContact CG2-CG2 4.27Å; I717-T721 WeakPolarHBondContact O-CB 3.4Å; I717-T721 WeakPolarHBondContact O-CG2 3.45Å; I717-T721 PolarHBondContact O-N 3.47Å; I717-T721 PolarHBondContact O-OG1 3.41Å
718	I	96.2	Very high	94.9	Very high	99 Å²	99	65.2 Å²	65.2	51%	0.508	33%	0.332	S	S	.	.	H	α-helix	trans	-62.7	-49	-179.8	-65.7	167.8	0	0	0	110.6	T714 A715 T721 L722	T714-I718 HydrophobicContact CG2-CD1 4.12Å; T714-I718 WeakPolarHBondContact O-CG1 3.13Å; T714-I718 PolarHBondContact O-N 3.1Å; T714-I718 VanDerWaalsContact O-N 3.07Å; A715-I718 PolarHBondContact O-N 3.32Å; I718-T721 PolarHBondContact O-OG1 3.28Å; I718-L722 HydrophobicContact CG2-CD1 4.22Å; I718-L722 VanDerWaalsContact O-CG 3.27Å; I718-L722 WeakPolarHBondContact O-CG 3.47Å; I718-L722 PolarHBondContact O-N 2.9Å
719	L	95.6	Very high	94.7	Very high	71 Å²	71	60.8 Å²	60.8	37%	0.372	33%	0.325	S	S	.	.	H	α-helix	trans	-66.7	-43.3	179.8	-170.8	68.2	0	0	0	111.9	F669 A715 L722 L723	F669-L719 HydrophobicContact CE2-CB 4.17Å; F669-L719 HydrophobicContact CE2-CD2 3.64Å; F669-L719 HydrophobicContact CZ-CB 4.45Å; F669-L719 HydrophobicContact CZ-CD2 4.16Å; A715-L719 PolarHBondContact O-N 3.31Å; L719-L722 PolarHBondContact O-N 3.13Å; L719-L723 HydrophobicContact CG-CD1 4.12Å; L719-L723 HydrophobicContact CG-CG 4.49Å; L719-L723 WeakPolarHBondContact O-CG 3.43Å; L719-L723 PolarHBondContact O-N 2.84Å
720	G	95.8	Very high	94.5	Very high	0 Å²	0	62 Å²	62	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-63.2	-45.7	-178.4	0	0	0	0	0	113.2	C716 I717 L722 L723 M724	C716-G720 WeakPolarHBondContact O-CA 3.3Å; C716-G720 PolarHBondContact O-N 3.39Å; I717-G720 PolarHBondContact O-N 3.04Å; G720-L722 PolarHBondContact O-N 3.1Å; G720-L723 PolarHBondContact O-N 3.42Å; G720-M724 WeakPolarHBondContact O-CB 3.42Å; G720-M724 PolarHBondContact O-N 2.98Å
721	T	94.1	Very high	94.3	Very high	55 Å²	55	58.6 Å²	58.6	34%	0.337	32%	0.323	S	S	.	.	H	α-helix	trans	-62.6	-41.5	176.3	52.4	0	0	0	0	111.7	T696 I717 I718 S725	T696-T721 HydrophobicContact CG2-CG2 3.98Å; I717-T721 HydrophobicContact CG2-CG2 4.27Å; I717-T721 WeakPolarHBondContact O-CB 3.4Å; I717-T721 WeakPolarHBondContact O-CG2 3.45Å; I717-T721 PolarHBondContact O-N 3.47Å; I717-T721 PolarHBondContact O-OG1 3.41Å; I718-T721 PolarHBondContact O-OG1 3.28Å; T721-S725 WeakPolarHBondContact O-CB 3.44Å; T721-S725 PolarHBondContact O-N 2.87Å; T721-S725 PolarHBondContact O-OG 3.09Å
722	L	94	Very high	94.1	Very high	108 Å²	108	57.2 Å²	57.2	57%	0.565	32%	0.318	S	S	*	.	H	α-helix	trans	-60.8	-46.8	174.6	-72	172.3	0	0	0	111.9	I718 L719 G720 S725 Y726	I718-L722 HydrophobicContact CG2-CD1 4.22Å; I718-L722 VanDerWaalsContact O-CG 3.27Å; I718-L722 WeakPolarHBondContact O-CG 3.47Å; I718-L722 PolarHBondContact O-N 2.9Å; L719-L722 PolarHBondContact O-N 3.13Å; G720-L722 PolarHBondContact O-N 3.1Å; L722-S725 PolarHBondContact O-N 3.2Å; L722-S725 PolarHBondContact O-OG 3.49Å; L722-Y726 PolarHBondContact O-N 3.08Å
723	L	93.7	Very high	93.9	Very high	21 Å²	21	61.1 Å²	61.1	11%	0.11	34%	0.338	C	S	.	.	H	α-helix	trans	-65.5	-44.2	179.5	-68.8	176	0	0	0	112.8	L661 I662 M694 L719 G720 Y726	L661-L723 HydrophobicContact CD2-CD2 3.42Å; L661-L723 VanDerWaalsContact CD2-CD2 3.42Å; L661-L723 HydrophobicContact CG-CD1 4.09Å; L661-L723 HydrophobicContact CG-CD2 3.87Å; I662-L723 HydrophobicContact CD1-CB 4.4Å; I662-L723 HydrophobicContact CG1-CB 3.84Å; I662-L723 HydrophobicContact CG1-CD1 4.18Å; M694-L723 HydrophobicContact CE-CD1 3.87Å; L719-L723 HydrophobicContact CG-CD1 4.12Å; L719-L723 HydrophobicContact CG-CG 4.49Å; L719-L723 WeakPolarHBondContact O-CG 3.43Å; L719-L723 PolarHBondContact O-N 2.84Å; G720-L723 PolarHBondContact O-N 3.42Å; L723-Y726 PolarHBondContact O-N 3.45Å
724	M	91.6	Very high	93.6	Very high	50 Å²	50	62.9 Å²	62.9	25%	0.246	35%	0.345	C	S	.	.	H	α-helix	trans	-68.7	-35.4	177.4	-75.1	-61.8	-68.3	0	0	112.5	I662 M694 G720 Y726 T727	I662-M724 HydrophobicContact CD1-SD 3.73Å; M694-M724 WeakPolarHBondContact O-CG 3.37Å; G720-M724 WeakPolarHBondContact O-CB 3.42Å; G720-M724 PolarHBondContact O-N 2.98Å; M724-Y726 PolarHBondContact O-N 3.3Å; M724-T727 PolarHBondContact O-N 2.95Å; M724-T727 PolarHBondContact O-OG1 3.45Å
725	S	92.1	Very high	93.5	Very high	70 Å²	70	61.8 Å²	61.8	49%	0.49	33%	0.334	S	S	.	.	H	α-helix	trans	-63.9	-23	176.9	75.2	0	0	0	0	113.2	T721 L722 P729	T721-S725 WeakPolarHBondContact O-CB 3.44Å; T721-S725 PolarHBondContact O-N 2.87Å; T721-S725 PolarHBondContact O-OG 3.09Å; L722-S725 PolarHBondContact O-N 3.2Å; L722-S725 PolarHBondContact O-OG 3.49Å; S725-P729 WeakPolarHBondContact O-CD 3.02Å; S725-P729 VanDerWaalsContact O-CG 3.22Å; S725-P729 WeakPolarHBondContact O-CG 3.5Å
726	Y	91.3	Very high	93.4	Very high	135 Å²	135	64.4 Å²	64.4	53%	0.529	34%	0.341	S	S	.	.	H	α-helix	trans	-80.1	-39.1	176	-175.1	-85.9	0	0	0	112.5	I658 L722 L723 M724 I728 V730	I658-Y726 HydrophobicContact CD1-CD1 3.5Å; I658-Y726 VanDerWaalsContact CD1-CD1 3.5Å; I658-Y726 HydrophobicContact CD1-CE1 3.24Å; I658-Y726 HydrophobicContact CG1-CD1 3.93Å; I658-Y726 HydrophobicContact CG1-CE1 4.05Å; L722-Y726 PolarHBondContact O-N 3.08Å; L723-Y726 PolarHBondContact O-N 3.45Å; M724-Y726 PolarHBondContact O-N 3.3Å; Y726-I728 PolarHBondContact O-N 3.45Å; Y726-V730 HydrophobicContact CD1-CG2 4.06Å; Y726-V730 HydrophobicContact CE1-CG2 3.58Å; Y726-V730 HydrophobicContact CE2-CG2 4.41Å; Y726-V730 WeakPolarHBondContact O-CG2 3.05Å
727	T	89.9	Confident	93.1	Very high	22 Å²	22	67 Å²	67	14%	0.135	36%	0.355	C	S	.	.	H	α-helix	trans	-66.9	-37.8	-173.4	59.3	0	0	0	0	112.8	L655 I658 I662 M724 L731	L655-T727 HydrophobicContact CD2-CG2 4.49Å; I658-T727 HydrophobicContact CB-CG2 4.18Å; I658-T727 HydrophobicContact CG2-CG2 3.38Å; I662-T727 HydrophobicContact CD1-CG2 4.08Å; M724-T727 PolarHBondContact O-N 2.95Å; M724-T727 PolarHBondContact O-OG1 3.45Å; T727-L731 PolarHBondContact O-N 3.41Å
728	I	91.4	Very high	92.9	Very high	104 Å²	104	63.5 Å²	63.5	53%	0.533	34%	0.336	S	S	.	.	H	α-helix	trans	-69.6	-53.1	-174.4	-58.5	170.3	0	0	0	112	Y726 V730 L731 V732	Y726-I728 PolarHBondContact O-N 3.45Å; I728-V730 VanDerWaalsContact C-N 3.32Å; I728-V730 PolarHBondContact O-N 2.84Å; I728-L731 PolarHBondContact O-N 3.4Å; I728-V732 HydrophobicContact CG2-CG2 4.28Å; I728-V732 WeakPolarHBondContact O-CG2 3.43Å; I728-V732 PolarHBondContact O-N 3.27Å
729	P	92.4	Very high	92.8	Very high	75 Å²	75	63.9 Å²	63.9	49%	0.487	33%	0.332	S	S	.	.	H	α-helix	trans	-63.8	-34.4	-179.4	-23.8	36	0	0	0	113.4	S725 L731 V732 N733	S725-P729 WeakPolarHBondContact O-CD 3.02Å; S725-P729 VanDerWaalsContact O-CG 3.22Å; S725-P729 WeakPolarHBondContact O-CG 3.5Å; P729-L731 VanDerWaalsContact C-N 3.35Å; P729-V732 PolarHBondContact O-N 3.44Å; P729-N733 VanDerWaalsContact O-CB 3.24Å; P729-N733 WeakPolarHBondContact O-CB 3.06Å; P729-N733 PolarHBondContact O-N 2.91Å
730	V	91.9	Very high	92.7	Very high	27 Å²	27	63 Å²	63	16%	0.164	34%	0.335	C	S	.	.	H	α-helix	trans	-60.5	-47	175.5	171	0	0	0	0	110.3	L655 Y726 I728 H734	L655-V730 HydrophobicContact CD2-CB 4.26Å; L655-V730 HydrophobicContact CD2-CG1 3.98Å; Y726-V730 HydrophobicContact CD1-CG2 4.06Å; Y726-V730 HydrophobicContact CE1-CG2 3.58Å; Y726-V730 HydrophobicContact CE2-CG2 4.41Å; Y726-V730 WeakPolarHBondContact O-CG2 3.05Å; I728-V730 VanDerWaalsContact C-N 3.32Å; I728-V730 PolarHBondContact O-N 2.84Å; V730-H734 PolarHBondContact O-N 3.28Å; V730-H734 PolarHBondContact O-ND1 3.48Å
731	L	91.4	Very high	92.4	Very high	54 Å²	54	64.1 Å²	64.1	28%	0.283	34%	0.34	S	S	.	.	H	α-helix	trans	-65	-43.7	178	-175.1	66.2	0	0	0	111.8	T647 I648 L655 T727 I728 P729 F735	T647-L731 HydrophobicContact CG2-CD1 4.21Å; I648-L731 HydrophobicContact CG1-CD1 4.16Å; L655-L731 HydrophobicContact CD1-CD1 4.5Å; T727-L731 PolarHBondContact O-N 3.41Å; I728-L731 PolarHBondContact O-N 3.4Å; P729-L731 VanDerWaalsContact C-N 3.35Å; L731-F735 WeakPolarHBondContact O-CB 3.31Å; L731-F735 PolarHBondContact O-N 3.21Å
732	V	94.1	Very high	92.2	Very high	71 Å²	71	61.7 Å²	61.7	43%	0.43	33%	0.326	S	S	.	.	H	α-helix	trans	-66.1	-45	-178.9	173.3	0	0	0	0	111.7	I728 P729 H734 F735 L736	I728-V732 HydrophobicContact CG2-CG2 4.28Å; I728-V732 WeakPolarHBondContact O-CG2 3.43Å; I728-V732 PolarHBondContact O-N 3.27Å; P729-V732 PolarHBondContact O-N 3.44Å; V732-H734 PolarHBondContact O-N 3.49Å; V732-F735 PolarHBondContact O-N 3.33Å; V732-L736 HydrophobicContact CG1-CD1 3.85Å; V732-L736 HydrophobicContact CG1-CG 4.19Å; V732-L736 WeakPolarHBondContact O-CB 3.41Å; V732-L736 WeakPolarHBondContact O-CG 3.14Å; V732-L736 PolarHBondContact O-N 3.37Å
733	N	92.5	Very high	92	Very high	108 Å²	108	61 Å²	61	58%	0.578	32%	0.323	S	S	*	.	H	α-helix	trans	-61.4	-44.8	-179.5	-174	40.2	0	0	0	111.5	P729 L736 L737	P729-N733 VanDerWaalsContact O-CB 3.24Å; P729-N733 WeakPolarHBondContact O-CB 3.06Å; P729-N733 PolarHBondContact O-N 2.91Å; N733-L736 PolarHBondContact O-N 3.04Å; N733-L737 WeakPolarHBondContact O-CB 3.3Å; N733-L737 PolarHBondContact O-N 3.36Å
734	H	91.4	Very high	91.9	Very high	46 Å²	46	64.5 Å²	64.5	21%	0.213	34%	0.338	C	S	.	.	H	α-helix	trans	-64.6	-42.2	175.1	-74.1	94	0	0	0	111.9	T647 T651 V730 V732 L737 Y738	T647-H734 HydrophobicContact CG2-CB 3.74Å; T651-H734 HydrophobicContact CG2-CB 3.73Å; V730-H734 PolarHBondContact O-N 3.28Å; V730-H734 PolarHBondContact O-ND1 3.48Å; V732-H734 PolarHBondContact O-N 3.49Å; H734-L737 PolarHBondContact O-N 2.71Å; H734-Y738 HydrophobicContact CB-CD2 4.4Å; H734-Y738 HydrophobicContact CB-CE2 4.28Å; H734-Y738 WeakPolarHBondContact O-CD2 3.47Å; H734-Y738 PolarHBondContact O-N 3.46Å
735	F	94.1	Very high	91.7	Very high	56 Å²	56	63.5 Å²	63.5	25%	0.246	33%	0.334	C	S	.	.	H	α-helix	trans	-61.1	-47.6	177.9	177.2	-102.7	0	0	0	111.6	V643 L644 T647 L731 V732 L737 Y738 Y739	V643-F735 HydrophobicContact CB-CE2 4.4Å; V643-F735 HydrophobicContact CG1-CD2 4.27Å; V643-F735 HydrophobicContact CG1-CE2 4.11Å; L644-F735 HydrophobicContact CB-CD2 4.24Å; L644-F735 HydrophobicContact CB-CE2 3.93Å; L644-F735 HydrophobicContact CD1-CD2 3.97Å; L644-F735 HydrophobicContact CD1-CE2 4.29Å; T647-F735 HydrophobicContact CG2-CB 4.09Å; L731-F735 WeakPolarHBondContact O-CB 3.31Å; L731-F735 PolarHBondContact O-N 3.21Å; V732-F735 PolarHBondContact O-N 3.33Å; F735-L737 VanDerWaalsContact C-N 3.34Å; F735-L737 PolarHBondContact O-N 2.87Å; F735-Y738 PolarHBondContact O-N 3.26Å; F735-Y739 HydrophobicContact CE1-CD2 4.34Å; F735-Y739 HydrophobicContact CE2-CD2 4.43Å; F735-Y739 AromaticContact CZ-CD2 3.84Å; F735-Y739 HydrophobicContact CZ-CD2 3.84Å; F735-Y739 HydrophobicContact CZ-CG 4.4Å; F735-Y739 WeakPolarHBondContact O-CB 3.27Å; F735-Y739 PolarHBondContact O-N 3.28Å
736	L	94.5	Very high	91.4	Very high	101 Å²	101	62.3 Å²	62.3	53%	0.529	33%	0.326	S	S	.	.	H	α-helix	trans	-62	-42.2	178.7	-69.5	176.5	0	0	0	111.7	V732 N733 Y739 A740	V732-L736 HydrophobicContact CG1-CD1 3.85Å; V732-L736 HydrophobicContact CG1-CG 4.19Å; V732-L736 WeakPolarHBondContact O-CB 3.41Å; V732-L736 WeakPolarHBondContact O-CG 3.14Å; V732-L736 PolarHBondContact O-N 3.37Å; N733-L736 PolarHBondContact O-N 3.04Å; L736-Y739 PolarHBondContact O-N 2.84Å; L736-A740 VanDerWaalsContact O-CB 3.3Å; L736-A740 WeakPolarHBondContact O-CB 3.32Å; L736-A740 PolarHBondContact O-N 2.92Å
737	L	91.3	Very high	91.3	Very high	54 Å²	54	61 Å²	61	28%	0.283	33%	0.326	S	S	.	.	H	α-helix	trans	-58.1	-53.9	175.6	174.3	63.6	0	0	0	111.5	N733 H734 F735 Y739 H741	N733-L737 WeakPolarHBondContact O-CB 3.3Å; N733-L737 PolarHBondContact O-N 3.36Å; H734-L737 PolarHBondContact O-N 2.71Å; F735-L737 VanDerWaalsContact C-N 3.34Å; F735-L737 PolarHBondContact O-N 2.87Å; L737-Y739 VanDerWaalsContact C-N 3.34Å; L737-Y739 PolarHBondContact O-N 3.2Å; L737-H741 PolarHBondContact O-N 3.03Å; L737-H741 VanDerWaalsContact O-N 3.14Å
738	Y	92.5	Very high	91.2	Very high	7 Å²	7	63.9 Å²	63.9	3%	0.027	34%	0.343	C	S	.	.	H	α-helix	trans	-69.4	-32.6	-178.7	-70.7	-56.9	0	0	0	112.6	L301 F304 Y646 T647 H734 F735 A742	L301-Y738 HydrophobicContact CD2-CD1 4.34Å; L301-Y738 HydrophobicContact CD2-CE1 4.47Å; F304-Y738 HydrophobicContact CB-CD1 3.82Å; F304-Y738 HydrophobicContact CB-CE1 3.8Å; F304-Y738 HydrophobicContact CD1-CD1 4.27Å; F304-Y738 AromaticContact CD2-CD1 3.49Å; F304-Y738 HydrophobicContact CD2-CD1 3.49Å; F304-Y738 VanDerWaalsContact CD2-CD1 3.49Å; F304-Y738 HydrophobicContact CD2-CE1 4.15Å; F304-Y738 AromaticContact CD2-CG 3.93Å; F304-Y738 HydrophobicContact CD2-CG 3.93Å; F304-Y738 HydrophobicContact CE2-CD1 4.02Å; F304-Y738 HydrophobicContact CE2-CG 4.07Å; F304-Y738 AromaticContact CG-CD1 3.6Å; F304-Y738 HydrophobicContact CG-CD1 3.6Å; F304-Y738 HydrophobicContact CG-CE1 4.13Å; F304-Y738 HydrophobicContact CG-CG 4.45Å; F304-Y738 WeakPolarHBondContact CZ-O 3.47Å; Y646-Y738 HydrophobicContact CD1-CD2 4.41Å; Y646-Y738 HydrophobicContact CD1-CE2 4.49Å; Y646-Y738 HydrophobicContact CE1-CD1 4.28Å; Y646-Y738 HydrophobicContact CE1-CD2 4.38Å; Y646-Y738 AromaticContact CE1-CE1 3.96Å; Y646-Y738 HydrophobicContact CE1-CE1 3.96Å; Y646-Y738 HydrophobicContact CE1-CE2 4.09Å; Y646-Y738 HydrophobicContact CE1-CG 4.49Å; Y646-Y738 AromaticContact CE1-CZ 3.88Å; T647-Y738 HydrophobicContact CG2-CD2 4.38Å; H734-Y738 HydrophobicContact CB-CD2 4.4Å; H734-Y738 HydrophobicContact CB-CE2 4.28Å; H734-Y738 WeakPolarHBondContact O-CD2 3.47Å; H734-Y738 PolarHBondContact O-N 3.46Å; F735-Y738 PolarHBondContact O-N 3.26Å; Y738-A742 WeakPolarHBondContact O-CB 3.48Å; Y738-A742 PolarHBondContact O-N 3.04Å
739	Y	92.9	Very high	90.9	Very high	106 Å²	106	62.4 Å²	62.4	42%	0.416	33%	0.333	S	S	.	.	H	α-helix	trans	-67.8	-46.8	176.5	-171.7	-87.8	0	0	0	111.8	F735 L736 L737 H741 A742 D743	F735-Y739 HydrophobicContact CE1-CD2 4.34Å; F735-Y739 HydrophobicContact CE2-CD2 4.43Å; F735-Y739 AromaticContact CZ-CD2 3.84Å; F735-Y739 HydrophobicContact CZ-CD2 3.84Å; F735-Y739 HydrophobicContact CZ-CG 4.4Å; F735-Y739 WeakPolarHBondContact O-CB 3.27Å; F735-Y739 PolarHBondContact O-N 3.28Å; L736-Y739 PolarHBondContact O-N 2.84Å; L737-Y739 VanDerWaalsContact C-N 3.34Å; L737-Y739 PolarHBondContact O-N 3.2Å; Y739-H741 VanDerWaalsContact C-N 3.3Å; Y739-H741 PolarHBondContact O-N 3.46Å; Y739-A742 WeakPolarHBondContact O-CB 3.44Å; Y739-A742 PolarHBondContact O-N 3.49Å; Y739-D743 PolarHBondContact O-N 3.4Å
740	A	92.9	Very high	90.7	Very high	52 Å²	52	65.1 Å²	65.1	43%	0.43	34%	0.339	S	S	.	.	H	α-helix	trans	-58.8	-43.8	176.3	0	0	0	0	0	111.2	L736 D743 Q744	L736-A740 VanDerWaalsContact O-CB 3.3Å; L736-A740 WeakPolarHBondContact O-CB 3.32Å; L736-A740 PolarHBondContact O-N 2.92Å; A740-D743 PolarHBondContact O-N 3.4Å; A740-Q744 WeakPolarHBondContact O-CG 3.37Å; A740-Q744 PolarHBondContact O-N 2.65Å
741	H	90.3	Very high	90.6	Very high	25 Å²	25	68.8 Å²	68.8	12%	0.116	36%	0.357	C	S	.	.	H	α-helix	trans	-64.7	-42.6	176.2	-171.8	-110.8	0	0	0	112.8	L301 F304 E305 L737 Y739 D743 Q744 L745	L301-H741 HydrophobicContact CD2-CB 3.64Å; L301-H741 VanDerWaalsContact CD2-CG 3.44Å; F304-H741 AromaticContact CD1-ND1 3.62Å; F304-H741 AromaticContact CE1-ND1 3.91Å; E305-H741 IonicContact OE1-CE1 2.78Å; E305-H741 PolarHBondContact OE1-CE1 3.5Å; E305-H741 IonicContact OE1-NE2 3.77Å; L737-H741 PolarHBondContact O-N 3.03Å; L737-H741 VanDerWaalsContact O-N 3.14Å; Y739-H741 VanDerWaalsContact C-N 3.3Å; Y739-H741 PolarHBondContact O-N 3.46Å; H741-D743 PolarHBondContact O-N 3.49Å; H741-Q744 PolarHBondContact O-N 2.89Å; H741-L745 PolarHBondContact O-N 2.73Å
742	A	90.1	Very high	90.5	Very high	4 Å²	4	71.2 Å²	71.2	3%	0.033	37%	0.367	C	S	.	.	H	α-helix	trans	-59.6	-34.9	175.9	0	0	0	0	0	112.1	F304 L308 K639 V643 Y738 Y739 S746	F304-A742 HydrophobicContact CE1-CB 3.98Å; F304-A742 HydrophobicContact CZ-CB 3.86Å; L308-A742 HydrophobicContact CD2-CB 4.4Å; K639-A742 VanDerWaalsContact NZ-C 3.34Å; K639-A742 PolarHBondContact NZ-O 3.42Å; V643-A742 HydrophobicContact CG2-CB 4.05Å; Y738-A742 WeakPolarHBondContact O-CB 3.48Å; Y738-A742 PolarHBondContact O-N 3.04Å; Y739-A742 WeakPolarHBondContact O-CB 3.44Å; Y739-A742 PolarHBondContact O-N 3.49Å; A742-S746 PolarHBondContact O-N 2.96Å; A742-S746 PolarHBondContact O-OG 2.94Å; A742-S746 VanDerWaalsContact O-OG 3.07Å
743	D	90.4	Very high	90	Very high	94 Å²	94	76.6 Å²	76.6	50%	0.503	38%	0.379	S	S	.	.	H	α-helix	trans	-70.8	-45.9	176.9	-165.1	45.5	0	0	0	112.2	Y739 A740 H741 L745 S746 M747	Y739-D743 PolarHBondContact O-N 3.4Å; A740-D743 PolarHBondContact O-N 3.4Å; H741-D743 PolarHBondContact O-N 3.49Å; D743-L745 VanDerWaalsContact C-N 3.32Å; D743-L745 PolarHBondContact O-N 3.48Å; D743-S746 WeakPolarHBondContact CA-OG 3.41Å; D743-S746 PolarHBondContact O-N 2.96Å; D743-S746 VanDerWaalsContact O-N 3.1Å; D743-S746 PolarHBondContact O-OG 3.21Å; D743-M747 PolarHBondContact O-N 3.31Å
744	Q	91	Very high	90	Very high	94 Å²	94	74.4 Å²	74.4	44%	0.439	37%	0.37	S	S	.	.	H	α-helix	trans	-55.6	-45.3	172.9	-72.2	176.7	-25.2	0	0	111.8	A740 H741 S746 M747 V748	A740-Q744 WeakPolarHBondContact O-CG 3.37Å; A740-Q744 PolarHBondContact O-N 2.65Å; H741-Q744 PolarHBondContact O-N 2.89Å; Q744-S746 VanDerWaalsContact C-N 3.32Å; Q744-S746 PolarHBondContact O-N 3.28Å; Q744-M747 WeakPolarHBondContact O-CB 3.29Å; Q744-M747 PolarHBondContact O-N 2.89Å; Q744-M747 VanDerWaalsContact O-N 3.13Å; Q744-V748 WeakPolarHBondContact O-CG2 3.41Å; Q744-V748 PolarHBondContact O-N 2.87Å
745	L	87	Confident	90.1	Very high	28 Å²	28	74.3 Å²	74.3	15%	0.147	38%	0.377	C	S	.	.	H	α-helix	trans	-62.6	-38.4	178.1	-173.8	63.1	0	0	0	112.1	E305 H741 D743 K749	E305-L745 HydrophobicContact CG-CD2 4.16Å; H741-L745 PolarHBondContact O-N 2.73Å; D743-L745 VanDerWaalsContact C-N 3.32Å; D743-L745 PolarHBondContact O-N 3.48Å; L745-K749 HydrophobicContact CD1-CD 4.45Å; L745-K749 HydrophobicContact CG-CD 4.14Å; L745-K749 WeakPolarHBondContact O-CB 3.07Å; L745-K749 VanDerWaalsContact O-CG 3.25Å; L745-K749 WeakPolarHBondContact O-CG 3.45Å; L745-K749 PolarHBondContact O-N 2.88Å
746	S	86.1	Confident	89.9	Confident	46 Å²	46	77.6 Å²	77.6	32%	0.322	39%	0.391	S	S	.	.	H	α-helix	trans	-64.8	-41.3	173.3	31.4	0	0	0	0	112.3	K639 A742 D743 Q744 K749 Q750	K639-S746 PolarHBondContact NZ-OG 2.97Å; A742-S746 PolarHBondContact O-N 2.96Å; A742-S746 PolarHBondContact O-OG 2.94Å; A742-S746 VanDerWaalsContact O-OG 3.07Å; D743-S746 WeakPolarHBondContact CA-OG 3.41Å; D743-S746 PolarHBondContact O-N 2.96Å; D743-S746 VanDerWaalsContact O-N 3.1Å; D743-S746 PolarHBondContact O-OG 3.21Å; Q744-S746 VanDerWaalsContact C-N 3.32Å; Q744-S746 PolarHBondContact O-N 3.28Å; S746-K749 PolarHBondContact O-N 3.35Å; S746-Q750 PolarHBondContact O-N 3.5Å
747	M	89	Confident	89.7	Confident	107 Å²	107	80.5 Å²	80.5	53%	0.527	40%	0.395	S	S	.	.	H	α-helix	trans	-62.8	-48	176.6	-174.2	-179.4	71.7	0	0	111.2	D743 Q744 K749 Q750 L751	D743-M747 PolarHBondContact O-N 3.31Å; Q744-M747 WeakPolarHBondContact O-CB 3.29Å; Q744-M747 PolarHBondContact O-N 2.89Å; Q744-M747 VanDerWaalsContact O-N 3.13Å; M747-K749 VanDerWaalsContact C-N 3.34Å; M747-K749 PolarHBondContact O-N 3.42Å; M747-Q750 WeakPolarHBondContact O-CB 3.2Å; M747-Q750 PolarHBondContact O-N 3.42Å; M747-Q750 VanDerWaalsContact O-N 3.11Å; M747-L751 HydrophobicContact CG-CD1 4.19Å; M747-L751 HydrophobicContact CG-CG 4.48Å; M747-L751 WeakPolarHBondContact O-CG 3.36Å; M747-L751 PolarHBondContact O-N 2.86Å
748	V	87.9	Confident	89.8	Confident	83 Å²	83	84.1 Å²	84.1	50%	0.503	41%	0.409	S	S	.	.	H	α-helix	trans	-60.1	-43.7	177.4	172.6	0	0	0	0	111	Q744 Q750 L751 H752	Q744-V748 WeakPolarHBondContact O-CG2 3.41Å; Q744-V748 PolarHBondContact O-N 2.87Å; V748-Q750 VanDerWaalsContact C-N 3.32Å; V748-Q750 PolarHBondContact O-N 2.93Å; V748-L751 PolarHBondContact O-N 2.94Å; V748-H752 WeakPolarHBondContact O-CB 3.48Å; V748-H752 PolarHBondContact O-N 3.45Å
749	K	85.7	Confident	89.8	Confident	73 Å²	73	88 Å²	88	32%	0.317	43%	0.429	S	S	.	.	H	α-helix	trans	-60.9	-39.2	175.3	-76.2	172.4	177.4	175.3	0	111.7	E309 L745 S746 M747 R753	E309-K749 IonicContact OE1-NZ 3.77Å; E309-K749 PolarHBondContact OE1-NZ 3.2Å; L745-K749 HydrophobicContact CD1-CD 4.45Å; L745-K749 HydrophobicContact CG-CD 4.14Å; L745-K749 WeakPolarHBondContact O-CB 3.07Å; L745-K749 VanDerWaalsContact O-CG 3.25Å; L745-K749 WeakPolarHBondContact O-CG 3.45Å; L745-K749 PolarHBondContact O-N 2.88Å; S746-K749 PolarHBondContact O-N 3.35Å; M747-K749 VanDerWaalsContact C-N 3.34Å; M747-K749 PolarHBondContact O-N 3.42Å; K749-R753 WeakPolarHBondContact O-CB 3.43Å; K749-R753 VanDerWaalsContact O-CG 3.24Å; K749-R753 WeakPolarHBondContact O-CG 3.46Å; K749-R753 PolarHBondContact O-N 3.39Å
750	Q	87.1	Confident	89.8	Confident	132 Å²	132	90.4 Å²	90.4	62%	0.617	44%	0.437	S	S	*	.	H	α-helix	trans	-68.7	-42.9	176	-179.2	174.6	-8.4	0	0	112.4	S746 M747 V748 R753 T754	S746-Q750 PolarHBondContact O-N 3.5Å; M747-Q750 WeakPolarHBondContact O-CB 3.2Å; M747-Q750 PolarHBondContact O-N 3.42Å; M747-Q750 VanDerWaalsContact O-N 3.11Å; V748-Q750 VanDerWaalsContact C-N 3.32Å; V748-Q750 PolarHBondContact O-N 2.93Å; Q750-R753 PolarHBondContact O-N 3.48Å; Q750-T754 WeakPolarHBondContact O-CB 3.34Å; Q750-T754 PolarHBondContact O-N 3.16Å; Q750-T754 PolarHBondContact O-OG1 3.4Å
751	L	91.2	Very high	89.8	Confident	104 Å²	104	92 Å²	92	55%	0.545	44%	0.439	S	S	.	.	H	α-helix	trans	-60.5	-46.9	175.3	-72.2	172.9	0	0	0	110.8	M747 V748 R753 T754 A755	M747-L751 HydrophobicContact CG-CD1 4.19Å; M747-L751 HydrophobicContact CG-CG 4.48Å; M747-L751 WeakPolarHBondContact O-CG 3.36Å; M747-L751 PolarHBondContact O-N 2.86Å; V748-L751 PolarHBondContact O-N 2.94Å; L751-R753 PolarHBondContact O-N 3.4Å; L751-T754 PolarHBondContact O-N 3.06Å; L751-A755 WeakPolarHBondContact O-CB 3.25Å; L751-A755 PolarHBondContact O-N 2.96Å
752	H	88.1	Confident	90	Very high	104 Å²	104	98.6 Å²	98.6	48%	0.481	46%	0.463	S	S	.	.	H	α-helix	trans	-63.3	-41	178	-177.4	-123.5	0	0	0	112.6	V748 T754 A755 K756	V748-H752 WeakPolarHBondContact O-CB 3.48Å; V748-H752 PolarHBondContact O-N 3.45Å; H752-T754 VanDerWaalsContact C-N 3.34Å; H752-T754 PolarHBondContact O-N 3.44Å; H752-A755 PolarHBondContact O-N 3.2Å; H752-K756 WeakPolarHBondContact CE1-CE 3.37Å; H752-K756 PolarHBondContact CE1-NZ 3.42Å; H752-K756 VanDerWaalsContact NE2-CE 3.31Å; H752-K756 WeakPolarHBondContact NE2-CE 3.38Å; H752-K756 WeakPolarHBondContact O-CB 3.38Å; H752-K756 WeakPolarHBondContact O-CG 3.25Å; H752-K756 PolarHBondContact O-N 2.83Å
753	R	84.9	Confident	90.1	Very high	185 Å²	185	104.3 Å²	104.3	70%	0.698	49%	0.487	S	S	*	.	H	α-helix	trans	-61.2	-42.5	172.7	-74.9	171.6	-175.9	179.3	1.8	111.8	K749 Q750 L751 K756 R757	K749-R753 WeakPolarHBondContact O-CB 3.43Å; K749-R753 VanDerWaalsContact O-CG 3.24Å; K749-R753 WeakPolarHBondContact O-CG 3.46Å; K749-R753 PolarHBondContact O-N 3.39Å; Q750-R753 PolarHBondContact O-N 3.48Å; L751-R753 PolarHBondContact O-N 3.4Å; R753-K756 PolarHBondContact O-N 2.98Å; R753-R757 WeakPolarHBondContact O-CB 3.46Å; R753-R757 PolarHBondContact O-N 3.34Å
754	T	92.3	Very high	90.2	Very high	62 Å²	62	106 Å²	106	38%	0.38	49%	0.493	S	S	.	.	H	α-helix	trans	-66.7	-42.9	178.5	-56.4	0	0	0	0	111.2	Q750 L751 H752 R757 K758	Q750-T754 WeakPolarHBondContact O-CB 3.34Å; Q750-T754 PolarHBondContact O-N 3.16Å; Q750-T754 PolarHBondContact O-OG1 3.4Å; L751-T754 PolarHBondContact O-N 3.06Å; H752-T754 VanDerWaalsContact C-N 3.34Å; H752-T754 PolarHBondContact O-N 3.44Å; T754-R757 PolarHBondContact O-N 2.98Å; T754-K758 WeakPolarHBondContact O-CG 3.43Å; T754-K758 PolarHBondContact O-N 2.86Å
755	A	92.4	Very high	90.3	Very high	44 Å²	44	104.7 Å²	104.7	36%	0.364	49%	0.494	S	S	.	.	H	α-helix	trans	-61	-47.8	174.5	0	0	0	0	0	111.3	L751 H752 R757 K758 I759	L751-A755 WeakPolarHBondContact O-CB 3.25Å; L751-A755 PolarHBondContact O-N 2.96Å; H752-A755 PolarHBondContact O-N 3.2Å; A755-R757 VanDerWaalsContact C-N 3.34Å; A755-R757 PolarHBondContact O-N 3.06Å; A755-K758 PolarHBondContact O-N 3.45Å; A755-I759 WeakPolarHBondContact O-CG1 3.46Å; A755-I759 PolarHBondContact O-N 2.87Å
756	K	90.8	Very high	90.7	Very high	125 Å²	125	111.4 Å²	111.4	54%	0.543	52%	0.518	S	S	.	.	H	α-helix	trans	-58.4	-43	174.2	-80.5	-176.7	168.6	177.9	0	112.4	H752 R753 I759 R760	H752-K756 WeakPolarHBondContact CE1-CE 3.37Å; H752-K756 PolarHBondContact CE1-NZ 3.42Å; H752-K756 VanDerWaalsContact NE2-CE 3.31Å; H752-K756 WeakPolarHBondContact NE2-CE 3.38Å; H752-K756 WeakPolarHBondContact O-CB 3.38Å; H752-K756 WeakPolarHBondContact O-CG 3.25Å; H752-K756 PolarHBondContact O-N 2.83Å; R753-K756 PolarHBondContact O-N 2.98Å; K756-I759 PolarHBondContact O-N 3.14Å; K756-R760 WeakPolarHBondContact O-CB 3.34Å; K756-R760 PolarHBondContact O-N 2.94Å
757	R	90.3	Very high	91.1	Very high	161 Å²	161	116.7 Å²	116.7	61%	0.608	53%	0.532	S	S	*	.	H	α-helix	trans	-62.4	-44.5	176	-174.5	178.1	179.7	178.5	-0.6	111.4	R753 T754 A755 R760 N761	R753-R757 WeakPolarHBondContact O-CB 3.46Å; R753-R757 PolarHBondContact O-N 3.34Å; T754-R757 PolarHBondContact O-N 2.98Å; A755-R757 VanDerWaalsContact C-N 3.34Å; A755-R757 PolarHBondContact O-N 3.06Å; R757-R760 PolarHBondContact O-N 3.36Å; R757-N761 WeakPolarHBondContact O-CB 3.4Å; R757-N761 VanDerWaalsContact O-CG 3.27Å; R757-N761 PolarHBondContact O-N 3.12Å; R757-N761 PolarHBondContact O-OD1 3.37Å
758	K	92.7	Very high	91.4	Very high	130 Å²	130	117.2 Å²	117.2	57%	0.565	54%	0.536	S	S	*	.	H	α-helix	trans	-62	-45.5	176.2	-74.6	178.9	178.7	-178.8	0	111.7	T754 A755 R760 N761 R762	T754-K758 WeakPolarHBondContact O-CG 3.43Å; T754-K758 PolarHBondContact O-N 2.86Å; A755-K758 PolarHBondContact O-N 3.45Å; K758-R760 VanDerWaalsContact C-N 3.34Å; K758-R760 PolarHBondContact O-N 2.82Å; K758-N761 PolarHBondContact O-N 3.25Å; K758-R762 WeakPolarHBondContact O-CB 3.45Å; K758-R762 WeakPolarHBondContact O-CG 2.95Å; K758-R762 PolarHBondContact O-N 3.49Å
759	I	93.4	Very high	91.7	Very high	90 Å²	90	119.2 Å²	119.2	46%	0.462	54%	0.54	S	S	.	.	H	α-helix	trans	-59.5	-45.5	175.8	-68.2	166.2	0	0	0	110.5	A755 K756 R762 K763	A755-I759 WeakPolarHBondContact O-CG1 3.46Å; A755-I759 PolarHBondContact O-N 2.87Å; K756-I759 PolarHBondContact O-N 3.14Å; I759-R762 PolarHBondContact O-N 3.34Å; I759-K763 WeakPolarHBondContact O-CG 3.31Å; I759-K763 PolarHBondContact O-N 3.03Å
760	R	91.8	Very high	92.1	Very high	155 Å²	155	122.4 Å²	122.4	59%	0.585	55%	0.554	S	S	*	*	H	α-helix	trans	-62.6	-44.8	177.3	-174.9	174.7	65.6	171.8	1	112.1	K756 R757 K758 R762 K763 M764	K756-R760 WeakPolarHBondContact O-CB 3.34Å; K756-R760 PolarHBondContact O-N 2.94Å; R757-R760 PolarHBondContact O-N 3.36Å; K758-R760 VanDerWaalsContact C-N 3.34Å; K758-R760 PolarHBondContact O-N 2.82Å; R760-R762 PolarHBondContact O-N 3.42Å; R760-K763 PolarHBondContact O-N 3.49Å; R760-M764 PolarHBondContact O-N 3.37Å
761	N	93.3	Very high	92.5	Very high	85 Å²	85	118.8 Å²	118.8	46%	0.455	55%	0.546	S	S	.	.	H	α-helix	trans	-63.7	-40.5	177.9	-72.6	4.5	0	0	0	111.6	R757 K758 K763 M764 S765	R757-N761 WeakPolarHBondContact O-CB 3.4Å; R757-N761 VanDerWaalsContact O-CG 3.27Å; R757-N761 PolarHBondContact O-N 3.12Å; R757-N761 PolarHBondContact O-OD1 3.37Å; K758-N761 PolarHBondContact O-N 3.25Å; N761-K763 VanDerWaalsContact C-N 3.35Å; N761-K763 PolarHBondContact O-N 2.97Å; N761-M764 PolarHBondContact O-N 3.11Å; N761-S765 PolarHBondContact O-N 3.44Å; N761-S765 PolarHBondContact O-OG 3.34Å
762	R	93.9	Very high	92.7	Very high	165 Å²	165	119.3 Å²	119.3	62%	0.623	55%	0.549	S	S	*	.	H	α-helix	trans	-62.7	-38.8	173.5	-73.9	176.3	178.1	179.6	-1.5	112.4	K758 I759 R760 S765 R766	K758-R762 WeakPolarHBondContact O-CB 3.45Å; K758-R762 WeakPolarHBondContact O-CG 2.95Å; K758-R762 PolarHBondContact O-N 3.49Å; I759-R762 PolarHBondContact O-N 3.34Å; R760-R762 PolarHBondContact O-N 3.42Å; R762-S765 PolarHBondContact O-OG 3.08Å; R762-R766 VanDerWaalsContact O-CG 3.3Å; R762-R766 WeakPolarHBondContact O-CG 3.36Å; R762-R766 PolarHBondContact O-N 3.37Å
763	K	92.9	Very high	93	Very high	124 Å²	124	119 Å²	119	54%	0.539	55%	0.551	S	S	.	*	H	α-helix	trans	-65.2	-47.4	173.4	-73.3	-175.3	179.1	-172.1	0	110.8	I759 R760 N761 S765 R766 Y767	I759-K763 WeakPolarHBondContact O-CG 3.31Å; I759-K763 PolarHBondContact O-N 3.03Å; R760-K763 PolarHBondContact O-N 3.49Å; N761-K763 VanDerWaalsContact C-N 3.35Å; N761-K763 PolarHBondContact O-N 2.97Å; K763-S765 PolarHBondContact O-N 2.85Å; K763-R766 WeakPolarHBondContact O-CB 3.48Å; K763-R766 PolarHBondContact O-N 3.42Å; K763-Y767 HydrophobicContact CB-CE2 4.43Å; K763-Y767 WeakPolarHBondContact O-CD2 3.5Å; K763-Y767 PolarHBondContact O-N 2.72Å
764	M	92.7	Very high	93.6	Very high	129 Å²	129	115 Å²	115	64%	0.635	54%	0.543	S	S	*	.	H	α-helix	trans	-61.4	-42.6	179.2	-173.1	62.6	110	0	0	112.3	R760 N761 R766 Y767 L768	R760-M764 PolarHBondContact O-N 3.37Å; N761-M764 PolarHBondContact O-N 3.11Å; M764-R766 VanDerWaalsContact C-N 3.32Å; M764-R766 PolarHBondContact O-N 3.17Å; M764-Y767 PolarHBondContact O-N 3.49Å; M764-Y767 VanDerWaalsContact O-N 3.16Å; M764-L768 PolarHBondContact O-N 3.46Å
765	S	93.7	Very high	93.6	Very high	67 Å²	67	114.6 Å²	114.6	47%	0.469	55%	0.546	S	S	.	.	H	α-helix	trans	-63	-39.1	176.8	68.1	0	0	0	0	111.8	N761 R762 K763 L768 Q769	N761-S765 PolarHBondContact O-N 3.44Å; N761-S765 PolarHBondContact O-OG 3.34Å; R762-S765 PolarHBondContact O-OG 3.08Å; K763-S765 PolarHBondContact O-N 2.85Å; S765-L768 PolarHBondContact O-N 2.89Å; S765-Q769 WeakPolarHBondContact O-CB 3.26Å; S765-Q769 PolarHBondContact O-N 3.5Å
766	R	94	Very high	93.8	Very high	168 Å²	168	118.8 Å²	118.8	63%	0.634	56%	0.556	S	S	*	*	H	α-helix	trans	-63	-39.9	172.8	-72.7	175.5	-178.6	177.4	-0.4	112.2	R762 K763 M764 K770	R762-R766 VanDerWaalsContact O-CG 3.3Å; R762-R766 WeakPolarHBondContact O-CG 3.36Å; R762-R766 PolarHBondContact O-N 3.37Å; K763-R766 WeakPolarHBondContact O-CB 3.48Å; K763-R766 PolarHBondContact O-N 3.42Å; M764-R766 VanDerWaalsContact C-N 3.32Å; M764-R766 PolarHBondContact O-N 3.17Å; R766-K770 WeakPolarHBondContact O-CG 3.34Å; R766-K770 PolarHBondContact O-N 3.45Å; R766-K770 VanDerWaalsContact O-N 3.08Å
767	Y	94.6	Very high	93.9	Very high	157 Å²	157	116.1 Å²	116.1	62%	0.616	55%	0.553	S	S	*	*	H	α-helix	trans	-66.8	-43.6	175.1	-76.3	-67.8	0	0	0	112.3	K763 M764 Q769 K770 A771	K763-Y767 HydrophobicContact CB-CE2 4.43Å; K763-Y767 WeakPolarHBondContact O-CD2 3.5Å; K763-Y767 PolarHBondContact O-N 2.72Å; M764-Y767 PolarHBondContact O-N 3.49Å; M764-Y767 VanDerWaalsContact O-N 3.16Å; Y767-Q769 VanDerWaalsContact C-N 3.35Å; Y767-Q769 PolarHBondContact O-N 2.9Å; Y767-K770 PolarHBondContact O-N 2.83Å; Y767-A771 WeakPolarHBondContact O-CB 3.48Å; Y767-A771 PolarHBondContact O-N 2.85Å
768	L	94.8	Very high	94.1	Very high	118 Å²	118	113.8 Å²	113.8	62%	0.618	55%	0.551	S	S	*	*	H	α-helix	trans	-62.8	-42.4	177.2	-177.2	63.9	0	0	0	111.4	M764 S765 K770 A771 L772	M764-L768 PolarHBondContact O-N 3.46Å; S765-L768 PolarHBondContact O-N 2.89Å; L768-K770 PolarHBondContact O-N 3.33Å; L768-A771 PolarHBondContact O-N 2.89Å; L768-L772 WeakPolarHBondContact O-CB 3.37Å; L768-L772 PolarHBondContact O-N 3.35Å
769	Q	95.1	Very high	94.1	Very high	126 Å²	126	111.2 Å²	111.2	59%	0.589	55%	0.546	S	S	*	.	H	α-helix	trans	-61.1	-44.4	175.8	-171.8	178.8	1	0	0	111.4	S765 Y767 L772 L773	S765-Q769 WeakPolarHBondContact O-CB 3.26Å; S765-Q769 PolarHBondContact O-N 3.5Å; Y767-Q769 VanDerWaalsContact C-N 3.35Å; Y767-Q769 PolarHBondContact O-N 2.9Å; Q769-L772 PolarHBondContact O-N 3.36Å; Q769-L773 HydrophobicContact CG-CD1 4.43Å; Q769-L773 VanDerWaalsContact O-CG 3.28Å; Q769-L773 WeakPolarHBondContact O-CG 3.2Å; Q769-L773 PolarHBondContact O-N 3.26Å
770	K	94.8	Very high	94.2	Very high	140 Å²	140	111 Å²	111	61%	0.609	55%	0.546	S	S	*	.	H	α-helix	trans	-61.8	-43	173.9	-73.8	-177.9	177.8	-167.1	0	112.3	R766 Y767 L768 L773 N774	R766-K770 WeakPolarHBondContact O-CG 3.34Å; R766-K770 PolarHBondContact O-N 3.45Å; R766-K770 VanDerWaalsContact O-N 3.08Å; Y767-K770 PolarHBondContact O-N 2.83Å; L768-K770 PolarHBondContact O-N 3.33Å; K770-L773 PolarHBondContact O-N 3.11Å; K770-N774 VanDerWaalsContact O-CG 3.29Å; K770-N774 PolarHBondContact O-N 3.01Å; K770-N774 PolarHBondContact O-OD1 3.28Å
771	A	94.7	Very high	94.2	Very high	55 Å²	55	106 Å²	106	46%	0.455	54%	0.537	S	S	.	.	H	α-helix	trans	-65.1	-40.7	178.7	0	0	0	0	0	112.4	Y767 L768 N774 A775	Y767-A771 WeakPolarHBondContact O-CB 3.48Å; Y767-A771 PolarHBondContact O-N 2.85Å; L768-A771 PolarHBondContact O-N 2.89Å; A771-N774 PolarHBondContact O-N 3.48Å; A771-A775 WeakPolarHBondContact O-CB 3.43Å; A771-A775 PolarHBondContact O-N 2.95Å
772	L	95.7	Very high	94.1	Very high	115 Å²	115	105.4 Å²	105.4	60%	0.602	54%	0.537	S	S	*	.	H	α-helix	trans	-68.4	-38.3	178.3	-171	138.2	0	0	0	112	L768 Q769 A775 K776	L768-L772 WeakPolarHBondContact O-CB 3.37Å; L768-L772 PolarHBondContact O-N 3.35Å; Q769-L772 PolarHBondContact O-N 3.36Å; L772-A775 PolarHBondContact O-N 2.93Å; L772-K776 WeakPolarHBondContact O-CB 3.48Å; L772-K776 PolarHBondContact O-N 3.48Å
773	L	95.2	Very high	93.9	Very high	99 Å²	99	101.6 Å²	101.6	52%	0.518	53%	0.528	S	S	.	.	H	α-helix	trans	-61.3	-45.3	172	-72.2	170.9	0	0	0	111.6	Q769 K770 A775 K776 S777	Q769-L773 HydrophobicContact CG-CD1 4.43Å; Q769-L773 VanDerWaalsContact O-CG 3.28Å; Q769-L773 WeakPolarHBondContact O-CG 3.2Å; Q769-L773 PolarHBondContact O-N 3.26Å; K770-L773 PolarHBondContact O-N 3.11Å; L773-A775 PolarHBondContact O-N 3.36Å; L773-K776 PolarHBondContact O-N 3.13Å; L773-S777 PolarHBondContact O-N 2.67Å; L773-S777 PolarHBondContact O-OG 3.29Å
774	N	95.6	Very high	93.7	Very high	101 Å²	101	99.2 Å²	99.2	54%	0.54	52%	0.524	S	S	.	.	H	α-helix	trans	-64.8	-38.2	176.7	-69	-4.7	0	0	0	112.7	K770 A771 S777 I778	K770-N774 VanDerWaalsContact O-CG 3.29Å; K770-N774 PolarHBondContact O-N 3.01Å; K770-N774 PolarHBondContact O-OD1 3.28Å; A771-N774 PolarHBondContact O-N 3.48Å; N774-S777 WeakPolarHBondContact CA-OG 3.29Å; N774-S777 PolarHBondContact O-N 3.36Å; N774-S777 PolarHBondContact O-OG 3.17Å; N774-I778 VanDerWaalsContact O-CG1 3.32Å; N774-I778 WeakPolarHBondContact O-CG1 3.38Å; N774-I778 PolarHBondContact O-N 3Å; N774-I778 VanDerWaalsContact O-N 3.14Å
775	A	94.2	Very high	93.6	Very high	52 Å²	52	97.8 Å²	97.8	43%	0.43	52%	0.519	S	S	.	.	H	α-helix	trans	-65.7	-42.9	175.8	0	0	0	0	0	111.3	A771 L772 L773 S777 I778 V779	A771-A775 WeakPolarHBondContact O-CB 3.43Å; A771-A775 PolarHBondContact O-N 2.95Å; L772-A775 PolarHBondContact O-N 2.93Å; L773-A775 PolarHBondContact O-N 3.36Å; A775-S777 VanDerWaalsContact C-N 3.32Å; A775-S777 PolarHBondContact O-N 3.01Å; A775-I778 PolarHBondContact O-N 3.01Å; A775-V779 WeakPolarHBondContact O-CG2 3.43Å; A775-V779 PolarHBondContact O-N 3.17Å
776	K	95.1	Very high	93.2	Very high	133 Å²	133	98.5 Å²	98.5	58%	0.578	52%	0.521	S	S	*	.	H	α-helix	trans	-60.8	-40.6	176	-171.6	176.6	-178.8	-179.8	0	111.8	L772 L773 V779 N780	L772-K776 WeakPolarHBondContact O-CB 3.48Å; L772-K776 PolarHBondContact O-N 3.48Å; L773-K776 PolarHBondContact O-N 3.13Å; K776-V779 PolarHBondContact O-N 2.9Å; K776-N780 WeakPolarHBondContact O-CB 3.4Å; K776-N780 VanDerWaalsContact O-CG 3.3Å; K776-N780 PolarHBondContact O-N 3.21Å
777	S	94.1	Very high	92.9	Very high	69 Å²	69	94.6 Å²	94.6	48%	0.483	51%	0.512	S	S	.	.	H	α-helix	trans	-64.9	-37.5	175.8	56.4	0	0	0	0	112.7	L773 N774 A775 A781	L773-S777 PolarHBondContact O-N 2.67Å; L773-S777 PolarHBondContact O-OG 3.29Å; N774-S777 WeakPolarHBondContact CA-OG 3.29Å; N774-S777 PolarHBondContact O-N 3.36Å; N774-S777 PolarHBondContact O-OG 3.17Å; A775-S777 VanDerWaalsContact C-N 3.32Å; A775-S777 PolarHBondContact O-N 3.01Å; S777-A781 WeakPolarHBondContact O-CB 3.44Å; S777-A781 PolarHBondContact O-N 3.4Å; S777-A781 VanDerWaalsContact O-N 3.14Å
778	I	93.8	Very high	92.4	Very high	111 Å²	111	91.7 Å²	91.7	57%	0.569	51%	0.507	S	S	*	.	H	α-helix	trans	-67.6	-45.7	176.5	-66.5	164.7	0	0	0	111	N774 A775 N780 A781 T782	N774-I778 VanDerWaalsContact O-CG1 3.32Å; N774-I778 WeakPolarHBondContact O-CG1 3.38Å; N774-I778 PolarHBondContact O-N 3Å; N774-I778 VanDerWaalsContact O-N 3.14Å; A775-I778 PolarHBondContact O-N 3.01Å; I778-N780 PolarHBondContact O-N 3.26Å; I778-A781 PolarHBondContact O-N 3.11Å; I778-T782 PolarHBondContact O-N 3.23Å
779	V	93.6	Very high	91.7	Very high	76 Å²	76	92.9 Å²	92.9	46%	0.461	51%	0.507	S	S	.	.	H	α-helix	trans	-63.5	-41.3	179.1	172.1	0	0	0	0	111.6	A775 K776 A781 T782 I783	A775-V779 WeakPolarHBondContact O-CG2 3.43Å; A775-V779 PolarHBondContact O-N 3.17Å; K776-V779 PolarHBondContact O-N 2.9Å; V779-A781 VanDerWaalsContact C-N 3.31Å; V779-A781 PolarHBondContact O-N 3.14Å; V779-T782 WeakPolarHBondContact CA-OG1 3.45Å; V779-T782 PolarHBondContact O-N 3.23Å; V779-T782 PolarHBondContact O-OG1 3.45Å; V779-I783 HydrophobicContact CG1-CD1 3.78Å; V779-I783 HydrophobicContact CG1-CG1 4.37Å; V779-I783 WeakPolarHBondContact O-CG1 3.28Å; V779-I783 PolarHBondContact O-N 3.34Å
780	N	93.9	Very high	90.9	Very high	87 Å²	87	89.7 Å²	89.7	47%	0.465	50%	0.497	S	S	.	.	H	α-helix	trans	-61.8	-41.6	175.5	-74.5	-2.2	0	0	0	111.2	K776 I778 T782 I783 T784	K776-N780 WeakPolarHBondContact O-CB 3.4Å; K776-N780 VanDerWaalsContact O-CG 3.3Å; K776-N780 PolarHBondContact O-N 3.21Å; I778-N780 PolarHBondContact O-N 3.26Å; N780-T782 VanDerWaalsContact C-N 3.34Å; N780-T782 PolarHBondContact O-N 2.93Å; N780-I783 PolarHBondContact O-N 3.25Å; N780-T784 WeakPolarHBondContact O-CG2 3.35Å; N780-T784 PolarHBondContact O-N 3.36Å; N780-T784 PolarHBondContact O-OG1 2.91Å; N780-T784 VanDerWaalsContact O-OG1 3.13Å
781	A	91.5	Very high	90	Very high	48 Å²	48	87.3 Å²	87.3	40%	0.397	49%	0.49	S	S	.	.	H	α-helix	trans	-65.6	-33.2	176.9	0	0	0	0	0	113.2	S777 I778 V779 T784 N785	S777-A781 WeakPolarHBondContact O-CB 3.44Å; S777-A781 PolarHBondContact O-N 3.4Å; S777-A781 VanDerWaalsContact O-N 3.14Å; I778-A781 PolarHBondContact O-N 3.11Å; V779-A781 VanDerWaalsContact C-N 3.31Å; V779-A781 PolarHBondContact O-N 3.14Å; A781-T784 WeakPolarHBondContact CA-OG1 3.02Å; A781-T784 PolarHBondContact O-OG1 3.19Å; A781-N785 WeakPolarHBondContact O-CB 3.34Å; A781-N785 PolarHBondContact O-N 3.48Å; A781-N785 PolarHBondContact O-ND2 2.89Å
782	T	91.4	Very high	89	Confident	73 Å²	73	88.6 Å²	88.6	45%	0.448	49%	0.492	S	S	.	.	H	α-helix	trans	-74.4	-41.6	175.6	56.6	0	0	0	0	112	I778 V779 N780 T784 N785 V786	I778-T782 PolarHBondContact O-N 3.23Å; V779-T782 WeakPolarHBondContact CA-OG1 3.45Å; V779-T782 PolarHBondContact O-N 3.23Å; V779-T782 PolarHBondContact O-OG1 3.45Å; N780-T782 VanDerWaalsContact C-N 3.34Å; N780-T782 PolarHBondContact O-N 2.93Å; T782-T784 VanDerWaalsContact C-N 3.35Å; T782-T784 PolarHBondContact O-N 3.33Å; T782-N785 PolarHBondContact O-N 2.79Å; T782-V786 WeakPolarHBondContact O-CG2 3.45Å; T782-V786 PolarHBondContact O-N 3.32Å
783	I	90.4	Very high	88.1	Confident	86 Å²	86	89.6 Å²	89.6	44%	0.441	49%	0.493	S	S	.	.	H	α-helix	trans	-60.2	-45.3	175.7	-67.9	168.2	0	0	0	110.4	V779 N780 N785 V786 N787	V779-I783 HydrophobicContact CG1-CD1 3.78Å; V779-I783 HydrophobicContact CG1-CG1 4.37Å; V779-I783 WeakPolarHBondContact O-CG1 3.28Å; V779-I783 PolarHBondContact O-N 3.34Å; N780-I783 PolarHBondContact O-N 3.25Å; I783-N785 VanDerWaalsContact C-N 3.3Å; I783-N785 PolarHBondContact O-N 3.44Å; I783-V786 PolarHBondContact O-N 3.48Å; I783-N787 WeakPolarHBondContact O-CB 3.17Å; I783-N787 PolarHBondContact O-N 3.32Å
784	T	89.8	Confident	87.1	Confident	74 Å²	74	91.6 Å²	91.6	45%	0.454	50%	0.503	S	S	.	.	H	α-helix	trans	-60.7	-40.5	176.3	51.9	0	0	0	0	111.9	N780 A781 T782 N788	N780-T784 WeakPolarHBondContact O-CG2 3.35Å; N780-T784 PolarHBondContact O-N 3.36Å; N780-T784 PolarHBondContact O-OG1 2.91Å; N780-T784 VanDerWaalsContact O-OG1 3.13Å; A781-T784 WeakPolarHBondContact CA-OG1 3.02Å; A781-T784 PolarHBondContact O-OG1 3.19Å; T782-T784 VanDerWaalsContact C-N 3.35Å; T782-T784 PolarHBondContact O-N 3.33Å; T784-N788 WeakPolarHBondContact O-CB 3.29Å; T784-N788 PolarHBondContact O-N 3.2Å; T784-N788 PolarHBondContact O-ND2 3.02Å; T784-N788 PolarHBondContact O-OD1 3.43Å
785	N	89.7	Confident	86.1	Confident	99 Å²	99	94.6 Å²	94.6	53%	0.529	51%	0.514	S	S	.	.	H	α-helix	trans	-68.8	-38.2	178	-76	-15.7	0	0	0	113.1	A781 T782 I783 K789	A781-N785 WeakPolarHBondContact O-CB 3.34Å; A781-N785 PolarHBondContact O-N 3.48Å; A781-N785 PolarHBondContact O-ND2 2.89Å; T782-N785 PolarHBondContact O-N 2.79Å; I783-N785 VanDerWaalsContact C-N 3.3Å; I783-N785 PolarHBondContact O-N 3.44Å; N785-K789 WeakPolarHBondContact O-CG 3.47Å; N785-K789 PolarHBondContact O-N 3.15Å
786	V	86.1	Confident	85	Confident	82 Å²	82	103.3 Å²	103.3	50%	0.497	54%	0.542	S	S	.	.	H	α-helix	trans	-67.6	-47.4	176.1	172.2	0	0	0	0	110.5	T782 I783 N788 K789 T790	T782-V786 WeakPolarHBondContact O-CG2 3.45Å; T782-V786 PolarHBondContact O-N 3.32Å; I783-V786 PolarHBondContact O-N 3.48Å; V786-N788 VanDerWaalsContact C-N 3.29Å; V786-N788 PolarHBondContact O-N 3.32Å; V786-K789 WeakPolarHBondContact O-CA 3.5Å; V786-K789 WeakPolarHBondContact O-CB 3.26Å; V786-K789 PolarHBondContact O-N 3.42Å; V786-T790 HydrophobicContact CG1-CG2 4.39Å; V786-T790 PolarHBondContact O-N 3.49Å; V786-T790 PolarHBondContact O-OG1 3.37Å; V786-T790 VanDerWaalsContact O-OG1 3.08Å
787	N	86.1	Confident	84.5	Confident	85 Å²	85	101.9 Å²	101.9	46%	0.455	54%	0.54	S	S	.	.	H	α-helix	trans	-57.1	-44.4	177.1	-74.3	-3.6	0	0	0	111.3	I783 K789 T790 I791	I783-N787 WeakPolarHBondContact O-CB 3.17Å; I783-N787 PolarHBondContact O-N 3.32Å; N787-K789 VanDerWaalsContact C-N 3.34Å; N787-K789 PolarHBondContact O-N 2.84Å; N787-T790 WeakPolarHBondContact CA-OG1 3.42Å; N787-T790 PolarHBondContact O-N 3.49Å; N787-T790 PolarHBondContact O-OG1 2.97Å; N787-I791 WeakPolarHBondContact O-CB 3.47Å; N787-I791 WeakPolarHBondContact O-CD1 3.19Å; N787-I791 WeakPolarHBondContact O-CG1 3.38Å; N787-I791 PolarHBondContact O-N 3.5Å
788	N	84	Confident	84	Confident	96 Å²	96	103.6 Å²	103.6	51%	0.513	54%	0.543	S	S	.	.	H	α-helix	trans	-61.2	-42	175.6	-70.8	-10.2	0	0	0	111.7	T784 V786 T792	T784-N788 WeakPolarHBondContact O-CB 3.29Å; T784-N788 PolarHBondContact O-N 3.2Å; T784-N788 PolarHBondContact O-ND2 3.02Å; T784-N788 PolarHBondContact O-OD1 3.43Å; V786-N788 VanDerWaalsContact C-N 3.29Å; V786-N788 PolarHBondContact O-N 3.32Å; N788-T792 WeakPolarHBondContact O-CG2 3.28Å; N788-T792 PolarHBondContact O-N 2.89Å; N788-T792 PolarHBondContact O-OG1 3.29Å
789	K	82	Confident	83.4	Confident	143 Å²	143	103.2 Å²	103.2	62%	0.622	54%	0.542	S	S	*	.	H	α-helix	trans	-65.5	-45.7	176.3	-78.5	-175.5	178.2	-171.9	0	113.2	N785 V786 N787 I791 T792 E793	N785-K789 WeakPolarHBondContact O-CG 3.47Å; N785-K789 PolarHBondContact O-N 3.15Å; V786-K789 WeakPolarHBondContact O-CA 3.5Å; V786-K789 WeakPolarHBondContact O-CB 3.26Å; V786-K789 PolarHBondContact O-N 3.42Å; N787-K789 VanDerWaalsContact C-N 3.34Å; N787-K789 PolarHBondContact O-N 2.84Å; K789-I791 VanDerWaalsContact C-N 3.32Å; K789-I791 PolarHBondContact O-N 2.93Å; K789-T792 WeakPolarHBondContact CA-OG1 3.2Å; K789-T792 CarbonylContact O-C 3.6Å; K789-T792 PolarHBondContact O-N 3.11Å; K789-T792 VanDerWaalsContact O-N 3.12Å; K789-T792 PolarHBondContact O-OG1 3.19Å; K789-E793 PolarHBondContact O-N 2.75Å
790	T	78.1	Confident	82.8	Confident	59 Å²	59	104.8 Å²	104.8	36%	0.362	55%	0.547	S	S	.	.	H	α-helix	trans	-63.8	-38	177.7	45.5	0	0	0	0	112	V786 N787 T792 E793 I794	V786-T790 HydrophobicContact CG1-CG2 4.39Å; V786-T790 PolarHBondContact O-N 3.49Å; V786-T790 PolarHBondContact O-OG1 3.37Å; V786-T790 VanDerWaalsContact O-OG1 3.08Å; N787-T790 WeakPolarHBondContact CA-OG1 3.42Å; N787-T790 PolarHBondContact O-N 3.49Å; N787-T790 PolarHBondContact O-OG1 2.97Å; T790-T792 VanDerWaalsContact C-N 3.32Å; T790-T792 PolarHBondContact O-N 3.18Å; T790-E793 PolarHBondContact O-N 3.43Å; T790-I794 WeakPolarHBondContact O-CG1 3.37Å; T790-I794 PolarHBondContact O-N 3.16Å
791	I	75.9	Confident	82.1	Confident	91 Å²	91	105.9 Å²	105.9	47%	0.467	55%	0.552	S	S	.	*	H	α-helix	trans	-61.2	-43.6	172.8	-70	165	0	0	0	110	N787 K789 E793 H795	N787-I791 WeakPolarHBondContact O-CB 3.47Å; N787-I791 WeakPolarHBondContact O-CD1 3.19Å; N787-I791 WeakPolarHBondContact O-CG1 3.38Å; N787-I791 PolarHBondContact O-N 3.5Å; K789-I791 VanDerWaalsContact C-N 3.32Å; K789-I791 PolarHBondContact O-N 2.93Å; I791-E793 VanDerWaalsContact C-N 3.33Å; I791-E793 PolarHBondContact O-N 3.15Å; I791-H795 WeakPolarHBondContact O-CB 3.43Å; I791-H795 PolarHBondContact O-CD2 3.49Å; I791-H795 PolarHBondContact O-N 3.48Å; I791-H795 VanDerWaalsContact O-N 3.15Å
792	T	73.4	Confident	81.5	Confident	81 Å²	81	109.7 Å²	109.7	50%	0.497	56%	0.562	S	S	.	*	H	α-helix	trans	-68.6	-27.4	177.2	55.6	0	0	0	0	114.2	N788 K789 T790	N788-T792 WeakPolarHBondContact O-CG2 3.28Å; N788-T792 PolarHBondContact O-N 2.89Å; N788-T792 PolarHBondContact O-OG1 3.29Å; K789-T792 WeakPolarHBondContact CA-OG1 3.2Å; K789-T792 CarbonylContact O-C 3.6Å; K789-T792 PolarHBondContact O-N 3.11Å; K789-T792 VanDerWaalsContact O-N 3.12Å; K789-T792 PolarHBondContact O-OG1 3.19Å; T790-T792 VanDerWaalsContact C-N 3.32Å; T790-T792 PolarHBondContact O-N 3.18Å
793	E	77	Confident	80.8	Confident	136 Å²	136	112.4 Å²	112.4	64%	0.636	57%	0.57	S	S	*	*	H	α-helix	trans	-80.4	-37.8	175.6	-78	178.9	177.8	0	0	112.7	K789 T790 I791 H795 K796	K789-E793 PolarHBondContact O-N 2.75Å; T790-E793 PolarHBondContact O-N 3.43Å; I791-E793 VanDerWaalsContact C-N 3.33Å; I791-E793 PolarHBondContact O-N 3.15Å; E793-H795 PolarHBondContact O-N 2.75Å; E793-K796 PolarHBondContact O-N 3.41Å; E793-K796 VanDerWaalsContact O-N 3.17Å
794	I	74.2	Confident	80.1	Confident	142 Å²	142	114.4 Å²	114.4	73%	0.728	58%	0.58	S	S	*	*	H	α-helix	trans	-66	-30.2	173.6	-68	167	0	0	0	111.5	T790 K796	T790-I794 WeakPolarHBondContact O-CG1 3.37Å; T790-I794 PolarHBondContact O-N 3.16Å; I794-K796 VanDerWaalsContact C-N 3.28Å
795	H	74.4	Confident	79.3	Confident	164 Å²	164	117.8 Å²	117.8	76%	0.759	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	-17.3	174.7	-97.6	-66.8	0	0	0	114	I791 E793	I791-H795 WeakPolarHBondContact O-CB 3.43Å; I791-H795 PolarHBondContact O-CD2 3.49Å; I791-H795 PolarHBondContact O-N 3.48Å; I791-H795 VanDerWaalsContact O-N 3.15Å; E793-H795 PolarHBondContact O-N 2.75Å
796	K	70.3	Confident	78.3	Confident	235 Å²	235	119.5 Å²	119.5	100%	1.022	60%	0.596	S	S	*	*			trans	-93	0	175.1	-77.4	-179	177.3	-178.1	0	110.1	E793 I794	E793-K796 PolarHBondContact O-N 3.41Å; E793-K796 VanDerWaalsContact O-N 3.17Å; I794-K796 VanDerWaalsContact C-N 3.28Å

Retrieved 796 of 796 residues in 229.2 ms (Link to these results)

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