G4LY82_SCHMA Loading...

Mucolipin, putative

AlphaFold DB , UniProt , Accession G4LY82, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 925 aa.

						>G4LY82_SCHMA|G4LY82
MSKRFKKEKIVENTGHIGPYRSSDPLSASRYRNQSSPYQSYFERNDNNVDETHLFVPPCLHLPPSYIPQVNHPDSSISNNDNTTTNKHGSQGVVEKVMLHLVKYFNKPLNNASHERTNCNYVHTDTAHEERPLISDHDEYSGDHVYSTAATAGASTSSPTTEDGADSTASTFINPNEVESWMRRRLYYHFMTPVGKFHAKRRIPFKLFVQILKVLLVTIQLIEFGFYRAAHVSFGDVSHKAFCHLYLRQWDSQYETLDYPPATGDYAVYTVNDFYEHVGYTITQFNKTKELAIGGYMFDSLNRTMKLCMRYVSPTTDENKHSMLSVSYIRESEKCTSIEVNQINSEQLTDENSIKTFLQDHKLDINFNYLLGFDIHFNLLSPPIYQLDWTQSTECYRFMIKISLENPSQSGQMKIMLRAPYASTPCIDISKQLHHYQSIMDSSFQQNSSGSSSSSSSTSMITQHYNDDDEKKYQLLVHFWNLLNSTLNQSIETKYIFSRRLLVILIDSCTLILGIISCLLCIRSIIQGFRIWLETVGFFKNWFGIQLNGVFWEFVRPWILFIIVNDLVIITTSIYALSTLNHIQVKYEPLTYLMGIGALLVWIGILYYVGFSYDNSLLIRTISRSIPGLLRFCVCALILFFAFSLCGWVVLGPYNLKFRTFMSTVECLYSLINGDDMFVTFTIINNNAPIGIYLFSRLFLYLFITLFIYVVLNLFVTIIFEAYEEVKDMQNTHGRSNNSPLWHFVCQQYYNPKSTIFKEDDTRPDRHLLYEQALGYTMTTTTTTSVTNKSSTDECKHSFINRSQFPRQQQRRRLQHQEEEGKGRCCCCYRHRQQIQSHQNQQYTSQNHNDNNTIQNSSNLLNNSINVDNLSNQTEQLQQGIEQINNNDGDDNHVNNVRNRMIEGVNEMTTTDESIISLNSRSVNV
					

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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	31.8	Very low	32.4	Very low	250 Å²	250	175.1 Å²	175.1	100%	1.232	82%	0.819	S	S	*	*				0	135.7	0	-72.8	168.9	166.4	0	0	107.2
2	S	30.4	Very low	32.3	Very low	87 Å²	87	175 Å²	175	61%	0.608	82%	0.818	S	S	*	*			cis	-152.9	124.1	-4.2	-177.7	0	0	0	0	110.7	R4	S2-R4 VanDerWaalsContact C-N 3.32Å; S2-R4 PolarHBondContact O-N 3.03Å
3	K	30.1	Very low	31.9	Very low	207 Å²	207	173.5 Å²	173.5	90%	0.9	82%	0.819	S	S	*	*			trans	-73.4	87.8	159.5	-74.5	-178.6	175.8	178.3	0	108.3
4	R	34.7	Very low	32	Very low	209 Å²	209	170.1 Å²	170.1	79%	0.789	82%	0.816	S	S	*	*			trans	-178.3	114.5	169.5	-92.7	162.3	-169	-165.1	2.8	103.5	S2	S2-R4 VanDerWaalsContact C-N 3.32Å; S2-R4 PolarHBondContact O-N 3.03Å
5	F	38.3	Very low	31.8	Very low	204 Å²	204	163 Å²	163	90%	0.895	81%	0.805	S	S	*	*				-143.1	130.9	53.1	-88.3	-104.9	0	0	0	112.2
6	K	32.7	Very low	31.8	Very low	162 Å²	162	163.4 Å²	163.4	70%	0.704	80%	0.804	S	S	*	*			trans	-157.5	82.3	161.7	-159.2	175.4	-175.8	-178.2	0	109	N899	K6-N899 PolarHBondContact NZ-OD1 3.2Å
7	K	33	Very low	31.9	Very low	202 Å²	202	163.2 Å²	163.2	88%	0.878	81%	0.805	S	S	*	*			trans	-169.6	158.2	167.9	-118.5	177.7	-178	-176.8	0	111.4
8	E	32.9	Very low	31.8	Very low	154 Å²	154	157.7 Å²	157.7	72%	0.72	80%	0.797	S	S	*	*			trans	76.1	131.5	-172.7	-53.3	-159.5	116.9	0	0	114.7
9	K	32.4	Very low	31.8	Very low	177 Å²	177	155.8 Å²	155.8	77%	0.77	80%	0.797	S	S	*	*			cis	-154.8	141.8	-10.2	-125.7	162.5	-179.4	154.8	0	110.1
10	I	28.5	Very low	31.7	Very low	159 Å²	159	159.7 Å²	159.7	82%	0.815	80%	0.803	S	S	*	*			trans	-92.9	170.4	159.6	-68.4	169.3	0	0	0	106.9
11	V	31.8	Very low	31.5	Very low	115 Å²	115	163.5 Å²	163.5	70%	0.697	81%	0.808	S	S	*	*			trans	94.7	124.5	-174.7	-176.1	0	0	0	0	110
12	E	30.9	Very low	31.5	Very low	174 Å²	174	156.6 Å²	156.6	81%	0.813	78%	0.784	S	S	*	*			cis	-146.5	157.7	22.4	-141.7	139.1	-135.3	0	0	111.6
13	N	27.4	Very low	31.6	Very low	155 Å²	155	157.3 Å²	157.3	83%	0.829	79%	0.789	S	S	*	*			trans	-138.5	112.5	176.2	-172.6	16	0	0	0	110.5
14	T	32.8	Very low	31.5	Very low	126 Å²	126	155.1 Å²	155.1	77%	0.773	79%	0.787	S	S	*	*			trans	-152	117.2	176.2	49.8	0	0	0	0	113.3
15	G	29.9	Very low	31.6	Very low	64 Å²	64	150.3 Å²	150.3	66%	0.66	78%	0.782	S	S	*	*			trans	76.4	144.8	161.7	0	0	0	0	0	116
16	H	31.5	Very low	31.1	Very low	170 Å²	170	148.8 Å²	148.8	79%	0.787	78%	0.783	S	S	*	*			cis	-160.4	148.7	-0.6	-108.4	-77.8	0	0	0	108.9
17	I	33.1	Very low	30.9	Very low	160 Å²	160	146.6 Å²	146.6	82%	0.821	79%	0.788	S	S	*	*			trans	46.2	127.2	144.2	-53.8	160.8	0	0	0	117.7
18	G	30	Very low	30.8	Very low	64 Å²	64	141.6 Å²	141.6	66%	0.66	78%	0.784	S	S	*	*			cis	-179.7	-176.9	12	0	0	0	0	0	111.1
19	P	32	Very low	30.4	Very low	121 Å²	121	139 Å²	139	79%	0.786	78%	0.783	S	S	*	*			trans	-98.5	149.8	-157.4	36.2	-34.9	0	0	0	115.2
20	Y	30.8	Very low	30.2	Very low	234 Å²	234	141 Å²	141	92%	0.918	79%	0.786	S	S	*	*			trans	-128.8	109.5	155.5	-100.2	-84.1	0	0	0	111.6
21	R	27.1	Very low	30.3	Very low	240 Å²	240	143.5 Å²	143.5	91%	0.906	79%	0.787	S	S	*	*			trans	-77.3	141.1	155.9	-79.4	174.1	164.3	169.2	-5.1	108.4
22	S	31.6	Very low	30.1	Very low	104 Å²	104	148.9 Å²	148.9	73%	0.727	79%	0.794	S	S	*	*				177.6	133.1	120.1	55.9	0	0	0	0	114.6
23	S	33	Very low	29.9	Very low	102 Å²	102	147.8 Å²	147.8	71%	0.713	79%	0.794	S	S	*	*			trans	57	98.3	142.1	59.7	0	0	0	0	120.8
24	D	28.1	Very low	29.9	Very low	162 Å²	162	150.4 Å²	150.4	87%	0.866	80%	0.801	S	S	*	*				30.1	154.3	105.5	-86.9	-23.3	0	0	0	122.5
25	P	35.4	Very low	29.6	Very low	107 Å²	107	149.9 Å²	149.9	70%	0.695	80%	0.803	S	S	*	*			trans	-104	161.1	-147	40.1	-37.1	0	0	0	115.2
26	L	27.4	Very low	29.5	Very low	172 Å²	172	152.3 Å²	152.3	90%	0.901	81%	0.81	S	S	*	*			trans	179.5	158.1	144	-101	153.6	0	0	0	111.6
27	S	29.1	Very low	29.5	Very low	117 Å²	117	148.5 Å²	148.5	82%	0.818	80%	0.8	S	S	*	*			trans	75.1	143.8	177.7	88.6	0	0	0	0	115.8
28	A	30.6	Very low	29.3	Very low	96 Å²	96	150.6 Å²	150.6	79%	0.793	80%	0.799	S	S	*	*			cis	-145	146.2	-4	0	0	0	0	0	112.6
29	S	26	Very low	29	Very low	101 Å²	101	154.9 Å²	154.9	71%	0.706	80%	0.802	S	S	*	*			trans	-65.9	142.1	166.7	57.8	0	0	0	0	113.1
30	R	26.9	Very low	28.6	Very low	218 Å²	218	153.3 Å²	153.3	82%	0.823	79%	0.794	S	S	*	*				168.5	167.2	123.2	-92.8	166.1	-168.3	-173.9	5.5	113
31	Y	31	Very low	28.4	Very low	212 Å²	212	151.8 Å²	151.8	83%	0.831	79%	0.788	S	S	*	*			trans	73.9	86.5	-179.9	-58.5	-80.8	0	0	0	113.8
32	R	27.8	Very low	28.6	Very low	227 Å²	227	148.6 Å²	148.6	86%	0.857	78%	0.781	S	S	*	*			cis	82.9	96.4	44.2	-161	-169.2	-136.8	-179.6	5.4	113.3
33	N	26.5	Very low	28.2	Very low	152 Å²	152	152.3 Å²	152.3	81%	0.813	79%	0.787	S	S	*	*			trans	21.3	119.2	150	-56	3	0	0	0	118.9
34	Q	28.3	Very low	28	Very low	209 Å²	209	158.2 Å²	158.2	98%	0.977	79%	0.794	S	S	*	*				-147.7	125.7	126.7	-116.7	169.8	9.7	0	0	111.3
35	S	26	Very low	27.9	Very low	115 Å²	115	156.5 Å²	156.5	80%	0.804	79%	0.785	S	S	*	*			trans	-114.4	129.1	-179.8	52.7	0	0	0	0	109.8
36	S	27.6	Very low	27.7	Very low	116 Å²	116	157.9 Å²	157.9	81%	0.811	79%	0.786	S	S	*	*			trans	-158.8	144.8	155.7	-169.6	0	0	0	0	110.6
37	P	30.6	Very low	27.6	Very low	90 Å²	90	156.7 Å²	156.7	58%	0.584	78%	0.781	S	S	*	*			trans	-97.8	-172.6	179.1	16.7	4.5	0	0	0	112.4
38	Y	29	Very low	27.4	Very low	203 Å²	203	158.8 Å²	158.8	80%	0.796	78%	0.783	S	S	*	*			trans	78.3	154.8	168.5	-54.8	-76.1	0	0	0	116.5
39	Q	24.5	Very low	27.3	Very low	154 Å²	154	160.5 Å²	160.5	72%	0.72	78%	0.783	S	S	*	*			cis	-175.2	147.1	-25	178.8	169.9	8.6	0	0	108.1
40	S	24.2	Very low	27.5	Very low	88 Å²	88	162.4 Å²	162.4	62%	0.615	79%	0.785	S	S	*	*			trans	67.1	160	161.4	55.3	0	0	0	0	120.7
41	Y	26.7	Very low	27.4	Very low	203 Å²	203	160.2 Å²	160.2	80%	0.796	78%	0.784	S	S	*	*			trans	78.3	97.9	172	-53.8	-77.8	0	0	0	118.1
42	F	30	Very low	27.3	Very low	173 Å²	173	155.5 Å²	155.5	76%	0.759	78%	0.778	S	S	*	*				-171.9	128.6	87.1	-116.2	-89.7	0	0	0	112.3	Y328	F42-Y328 HydrophobicContact CE2-CD1 4.42Å; F42-Y328 HydrophobicContact CE2-CE1 4.29Å; F42-Y328 HydrophobicContact CZ-CD1 4.3Å; F42-Y328 HydrophobicContact CZ-CE1 4.08Å
43	E	24.4	Very low	27.4	Very low	182 Å²	182	150.9 Å²	150.9	85%	0.85	77%	0.766	S	S	*	*			trans	-100.9	130	158.9	-72.9	178	120.8	0	0	108.7
44	R	27.2	Very low	27.5	Very low	225 Å²	225	147.7 Å²	147.7	85%	0.849	75%	0.748	S	S	*	*			trans	173.8	139	132.8	-104.4	178	-169.3	159.3	7.7	113
45	N	27.3	Very low	27.5	Very low	127 Å²	127	140.4 Å²	140.4	68%	0.679	71%	0.713	S	S	*	*			trans	64.5	124.2	162.7	-55.4	11	0	0	0	113.8
46	D	30.6	Very low	27.6	Very low	136 Å²	136	138 Å²	138	73%	0.727	69%	0.693	S	S	*	*				-148	163.4	51.8	-90.2	-50.3	0	0	0	114
47	N	24.8	Very low	27.6	Very low	147 Å²	147	134.2 Å²	134.2	79%	0.786	67%	0.666	S	S	*	*			trans	-83	157.5	172.1	-58.9	-68.3	0	0	0	111
48	N	26	Very low	27.4	Very low	161 Å²	161	135.7 Å²	135.7	86%	0.861	68%	0.676	S	S	*	*			trans	84.2	80.4	179.3	-52.8	-26.4	0	0	0	117.2
49	V	29	Very low	27.2	Very low	132 Å²	132	131.5 Å²	131.5	80%	0.8	68%	0.675	S	S	*	*			trans	-142.9	141.3	147.9	-175	0	0	0	0	109.7
50	D	28.4	Very low	27.5	Very low	140 Å²	140	129.3 Å²	129.3	75%	0.749	67%	0.668	S	S	*	*			trans	-61	143.1	-176.1	-57.7	-76.6	0	0	0	115.1	T52	D50-T52 HydrophobicContact CB-CG2 4.5Å; D50-T52 PolarHBondContact O-N 3.46Å
51	E	25.2	Very low	27.7	Very low	173 Å²	173	132 Å²	132	81%	0.808	67%	0.67	S	S	*	*			trans	-72	65.4	174.8	-71.5	-167	152.7	0	0	113.6	H53	E51-H53 VanDerWaalsContact C-N 3.27Å; E51-H53 PolarHBondContact O-N 2.98Å
52	T	28.4	Very low	27.8	Very low	113 Å²	113	127 Å²	127	69%	0.693	66%	0.657	S	S	*	*			trans	-84.2	64.8	172	51.9	0	0	0	0	112	D50 L54	D50-T52 HydrophobicContact CB-CG2 4.5Å; D50-T52 PolarHBondContact O-N 3.46Å; T52-L54 PolarHBondContact O-N 3.48Å
53	H	30	Very low	27.8	Very low	130 Å²	130	121.7 Å²	121.7	60%	0.602	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-61.2	119.2	167.9	-82.9	-77	0	0	0	110.6	E51 K586	E51-H53 VanDerWaalsContact C-N 3.27Å; E51-H53 PolarHBondContact O-N 2.98Å; H53-K586 PolarHBondContact O-NZ 3.46Å
54	L	29.5	Very low	27.9	Very low	85 Å²	85	116.2 Å²	116.2	45%	0.445	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-77.3	129	-161.7	-160.7	76.4	0	0	0	112.7	T52 V56	T52-L54 PolarHBondContact O-N 3.48Å; L54-V56 HydrophobicContact CD2-CG2 4.18Å; L54-V56 PolarHBondContact O-N 3.16Å
55	F	28.2	Very low	28	Very low	55 Å²	55	110.3 Å²	110.3	24%	0.241	61%	0.613	C	S	.	*	P	Polyproline II helix	trans	-61.8	126.9	163.8	-101.6	-111	0	0	0	109.5
56	V	28.7	Very low	28	Very low	64 Å²	64	115.2 Å²	115.2	39%	0.388	62%	0.624	S	S	.	*			trans	-133.4	115.8	165.2	-178.2	0	0	0	0	107.7	L54	L54-V56 HydrophobicContact CD2-CG2 4.18Å; L54-V56 PolarHBondContact O-N 3.16Å
57	P	27.5	Very low	27.9	Very low	37 Å²	37	116 Å²	116	24%	0.24	63%	0.626	C	S	.	*			trans	-62.5	144.8	169.4	-13.1	26.8	0	0	0	109.4	C59 V232	P57-C59 PolarHBondContact O-N 3.32Å; P57-V232 HydrophobicContact CB-CG1 4.37Å; P57-V232 HydrophobicContact CG-CG1 4.44Å
58	P	25.3	Very low	28.2	Very low	122 Å²	122	114 Å²	114	79%	0.792	62%	0.621	S	S	*	*	S	Bend	trans	-58.8	138.9	168.8	27.3	-33	0	0	0	109
59	C	26.3	Very low	28.4	Very low	115 Å²	115	114.4 Å²	114.4	78%	0.777	62%	0.618	S	S	*	*	S	Bend	trans	87.9	39.8	-175.3	-52.6	0	0	0	0	117.9	P57	P57-C59 PolarHBondContact O-N 3.32Å
60	L	28.8	Very low	28.4	Very low	108 Å²	108	114.5 Å²	114.5	57%	0.565	62%	0.618	S	S	*	*			trans	-132.4	116.6	157.7	-102	161.9	0	0	0	111.4	L62	L60-L62 PolarHBondContact O-N 3.37Å
61	H	28.8	Very low	28.6	Very low	145 Å²	145	114.8 Å²	114.8	67%	0.671	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-68.3	118.5	174.5	-86.5	-81.7	0	0	0	110.6
62	L	29.1	Very low	29	Very low	97 Å²	97	114.8 Å²	114.8	51%	0.508	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-86.6	142.2	155.1	-82.2	95.4	0	0	0	110.1	L60	L60-L62 PolarHBondContact O-N 3.37Å
63	P	29.7	Very low	29.3	Very low	62 Å²	62	115.1 Å²	115.1	40%	0.403	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-62.7	149.2	161.7	29.7	-33.9	0	0	0	109.5	S65	P63-S65 PolarHBondContact O-N 3.09Å; P63-S65 VanDerWaalsContact O-N 3.11Å
64	P	26.7	Very low	29.3	Very low	66 Å²	66	117.1 Å²	117.1	43%	0.429	64%	0.639	S	S	.	*	S	Bend	trans	-79.7	105	-164.5	29.3	-32.2	0	0	0	112.3	T660	P64-T660 HydrophobicContact CB-CG2 3.58Å; P64-T660 HydrophobicContact CG-CG2 3.34Å
65	S	29.4	Very low	29.5	Very low	101 Å²	101	118.7 Å²	118.7	71%	0.706	66%	0.657	S	S	*	*			trans	-140.6	121.3	170.5	-49.3	0	0	0	0	110	P63	P63-S65 PolarHBondContact O-N 3.09Å; P63-S65 VanDerWaalsContact O-N 3.11Å
66	Y	28.4	Very low	29.6	Very low	230 Å²	230	121 Å²	121	90%	0.902	68%	0.68	S	S	*	*			trans	68.3	118.3	169.2	-87.9	-99.5	0	0	0	120.6
67	I	28.4	Very low	29.9	Very low	152 Å²	152	125.1 Å²	125.1	78%	0.779	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-102	125.1	159.1	-62.4	166.6	0	0	0	106.9
68	P	30.7	Very low	30.1	Very low	105 Å²	105	127.6 Å²	127.6	68%	0.682	72%	0.717	S	S	*	*	P	Polyproline II helix	trans	-81.1	127.1	168.6	30.5	-29.1	0	0	0	110.4
69	Q	30.5	Very low	30.4	Very low	171 Å²	171	128.6 Å²	128.6	80%	0.799	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-84.6	138.8	172.4	-77.9	-169.3	-29.1	0	0	111.5
70	V	29.2	Very low	30.7	Very low	133 Å²	133	129.3 Å²	129.3	81%	0.806	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-83.7	124.8	172	176.5	0	0	0	0	109.1
71	N	31.8	Very low	30.8	Very low	146 Å²	146	130.2 Å²	130.2	78%	0.781	72%	0.717	S	S	*	*			trans	-125.1	132.9	168	-86	-22.8	0	0	0	111.1
72	H	33.5	Very low	30.8	Very low	173 Å²	173	129.9 Å²	129.9	80%	0.801	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-79.2	157.8	167.7	-94.2	-77.6	0	0	0	110.6
73	P	35.5	Very low	30.8	Very low	120 Å²	120	131 Å²	131	78%	0.779	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-82.6	140.1	-171.4	32.4	-35	0	0	0	113.6
74	D	29.4	Very low	30.7	Very low	172 Å²	172	134 Å²	134	92%	0.92	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-80.4	149.5	171.1	-81.6	-42.5	0	0	0	112.9
75	S	34	Very low	30.8	Very low	118 Å²	118	136.7 Å²	136.7	83%	0.825	76%	0.764	S	S	*	*			trans	-118.7	120.7	158.5	64.1	0	0	0	0	110.1
76	S	30.4	Very low	31	Very low	103 Å²	103	140.2 Å²	140.2	72%	0.72	78%	0.775	S	S	*	*			trans	-67.8	158.2	-177.2	52.5	0	0	0	0	115.1
77	I	33.9	Very low	31	Very low	151 Å²	151	138 Å²	138	77%	0.774	77%	0.77	S	S	*	*				175.5	124.3	115.2	-88.7	155.5	0	0	0	113.3
78	S	33.3	Very low	31.2	Very low	90 Å²	90	139 Å²	139	63%	0.629	77%	0.771	S	S	*	*			trans	46.3	124.9	151.2	77.5	0	0	0	0	124.3
79	N	31	Very low	31.2	Very low	142 Å²	142	137.7 Å²	137.7	76%	0.759	78%	0.776	S	S	*	*				44	121.2	120.3	-59.6	8.8	0	0	0	118.4
80	N	32.1	Very low	31.5	Very low	130 Å²	130	134.9 Å²	134.9	70%	0.695	78%	0.775	S	S	*	*				-173	157.1	52.4	-112.4	5.6	0	0	0	111.9
81	D	30.9	Very low	31.9	Very low	128 Å²	128	136.8 Å²	136.8	68%	0.684	78%	0.775	S	S	*	*			trans	58	132.7	146.3	-59.7	-30.4	0	0	0	123.8
82	N	29.3	Very low	32.2	Very low	137 Å²	137	131.3 Å²	131.3	73%	0.733	75%	0.753	S	S	*	*			trans	83.1	106.6	146.5	-66.9	-31.5	0	0	0	121.4
83	T	28.2	Very low	32.7	Very low	121 Å²	121	127.8 Å²	127.8	74%	0.742	74%	0.744	S	S	*	*			trans	80.9	150.3	131.4	61.5	0	0	0	0	121.2
84	T	28.9	Very low	33	Very low	124 Å²	124	127.6 Å²	127.6	76%	0.761	74%	0.74	S	S	*	*			trans	70.7	89	171.4	58.5	0	0	0	0	118.5
85	T	28.6	Very low	33.7	Very low	123 Å²	123	125.5 Å²	125.5	76%	0.755	73%	0.725	S	S	*	*				36	108.6	122.1	55.7	0	0	0	0	118.3
86	N	32.5	Very low	34.3	Very low	176 Å²	176	127.3 Å²	127.3	94%	0.941	72%	0.718	S	S	*	*				-156.5	144	127.8	-104	-38.5	0	0	0	113.5
87	K	29.6	Very low	35.4	Very low	183 Å²	183	126.2 Å²	126.2	80%	0.796	71%	0.706	S	S	*	*			trans	-105.3	144.3	-176.2	-102.7	-178.6	177.8	-178.9	0	110.4
88	H	31.6	Very low	36.1	Very low	174 Å²	174	122.8 Å²	122.8	81%	0.806	69%	0.688	S	S	*	*			trans	55.6	128.4	158.4	-71.4	-85.4	0	0	0	119.7
89	G	31.6	Very low	36.8	Very low	77 Å²	77	123 Å²	123	79%	0.794	68%	0.682	S	S	*	*			trans	-155.4	17	177.8	0	0	0	0	0	117.6
90	S	36.6	Very low	37.9	Very low	111 Å²	111	122.3 Å²	122.3	78%	0.776	67%	0.674	S	S	*	*	S	Bend	trans	-98	-24.2	-177.2	-172.8	0	0	0	0	114.7	G92	S90-G92 VanDerWaalsContact C-N 3.31Å; S90-G92 PolarHBondContact O-N 3.39Å
91	Q	37.3	Very low	38.5	Very low	174 Å²	174	120.4 Å²	120.4	81%	0.813	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-8.1	-177.9	-79.3	172.7	-54.3	0	0	115
92	G	37.6	Very low	39.3	Very low	30 Å²	30	117.7 Å²	117.7	31%	0.309	65%	0.651	S	S	.	*	H	α-helix	trans	-84.1	-6.3	-171.1	0	0	0	0	0	116.9	S90 K96	S90-G92 VanDerWaalsContact C-N 3.31Å; S90-G92 PolarHBondContact O-N 3.39Å; G92-K96 VanDerWaalsContact O-CB 3.29Å; G92-K96 WeakPolarHBondContact O-CB 3.42Å; G92-K96 WeakPolarHBondContact O-CD 3.47Å; G92-K96 WeakPolarHBondContact O-CG 3.41Å; G92-K96 PolarHBondContact O-N 3.29Å
93	V	43.7	Very low	40.1	Very low	100 Å²	100	118.9 Å²	118.9	61%	0.606	65%	0.65	S	S	*	*	H	α-helix	trans	-84.5	-49.1	-174.3	-176.1	0	0	0	0	111.6	E95 K96 V97	V93-E95 PolarHBondContact O-N 2.97Å; V93-K96 PolarHBondContact O-N 3.48Å; V93-V97 HydrophobicContact CG1-CG2 4.45Å; V93-V97 WeakPolarHBondContact O-CG2 3.29Å; V93-V97 PolarHBondContact O-N 3.02Å
94	V	43.5	Very low	40.8	Very low	116 Å²	116	121.7 Å²	121.7	70%	0.703	65%	0.648	S	S	*	*	H	α-helix	trans	-62.1	-45.3	178.8	-178.2	0	0	0	0	110.3	K96 V97 M98	V94-K96 PolarHBondContact O-N 3.2Å; V94-V97 PolarHBondContact O-N 3.14Å; V94-M98 WeakPolarHBondContact O-CB 3.46Å; V94-M98 PolarHBondContact O-N 3.25Å
95	E	44	Very low	41.3	Very low	128 Å²	128	120 Å²	120	60%	0.598	63%	0.63	S	S	*	*	H	α-helix	trans	-63.2	-39.9	178.2	-164.5	-178.1	-171.1	0	0	112.2	V93 M98 L99	V93-E95 PolarHBondContact O-N 2.97Å; E95-M98 PolarHBondContact O-N 2.9Å; E95-L99 HydrophobicContact CG-CD1 4.24Å; E95-L99 VanDerWaalsContact O-CB 3.28Å; E95-L99 WeakPolarHBondContact O-CB 3.43Å; E95-L99 PolarHBondContact O-N 3.13Å
96	K	45.8	Very low	41.6	Very low	155 Å²	155	119.3 Å²	119.3	67%	0.674	62%	0.622	S	S	*	*	H	α-helix	trans	-66.8	-43.2	174.3	-79.1	177	-176.2	177	0	112.7	G92 V93 V94 M98 L99 H100	G92-K96 VanDerWaalsContact O-CB 3.29Å; G92-K96 WeakPolarHBondContact O-CB 3.42Å; G92-K96 WeakPolarHBondContact O-CD 3.47Å; G92-K96 WeakPolarHBondContact O-CG 3.41Å; G92-K96 PolarHBondContact O-N 3.29Å; V93-K96 PolarHBondContact O-N 3.48Å; V94-K96 PolarHBondContact O-N 3.2Å; K96-M98 VanDerWaalsContact C-N 3.34Å; K96-L99 PolarHBondContact O-N 3.1Å; K96-H100 VanDerWaalsContact O-CB 3.3Å; K96-H100 WeakPolarHBondContact O-CB 3.45Å; K96-H100 PolarHBondContact O-N 3.18Å
97	V	53.8	Low	41.5	Very low	80 Å²	80	119.1 Å²	119.1	49%	0.485	61%	0.613	S	S	.	*	H	α-helix	trans	-63.5	-43.3	176.5	170.8	0	0	0	0	110.2	V93 V94 H100 L101	V93-V97 HydrophobicContact CG1-CG2 4.45Å; V93-V97 WeakPolarHBondContact O-CG2 3.29Å; V93-V97 PolarHBondContact O-N 3.02Å; V94-V97 PolarHBondContact O-N 3.14Å; V97-H100 PolarHBondContact O-N 3.44Å; V97-L101 HydrophobicContact CG1-CD1 3.93Å; V97-L101 HydrophobicContact CG1-CG 4.47Å; V97-L101 WeakPolarHBondContact O-CB 3.33Å; V97-L101 VanDerWaalsContact O-CG 3.31Å; V97-L101 WeakPolarHBondContact O-CG 3.41Å; V97-L101 PolarHBondContact O-N 3.05Å
98	M	47.8	Very low	41.5	Very low	79 Å²	79	114.7 Å²	114.7	39%	0.389	60%	0.603	S	S	.	*	H	α-helix	trans	-64.4	-45.7	177.1	-162.4	-175.9	-157.3	0	0	111.8	V94 E95 K96 H100 L101 V102 V634	V94-M98 WeakPolarHBondContact O-CB 3.46Å; V94-M98 PolarHBondContact O-N 3.25Å; E95-M98 PolarHBondContact O-N 2.9Å; K96-M98 VanDerWaalsContact C-N 3.34Å; M98-H100 VanDerWaalsContact C-N 3.31Å; M98-H100 PolarHBondContact O-N 3.27Å; M98-L101 PolarHBondContact O-N 3.35Å; M98-V102 WeakPolarHBondContact O-CB 3.39Å; M98-V102 VanDerWaalsContact O-CG2 3.24Å; M98-V102 WeakPolarHBondContact O-CG2 3.49Å; M98-V102 PolarHBondContact O-N 3.08Å; M98-V634 HydrophobicContact CE-CG1 3.23Å
99	L	47.9	Very low	41.5	Very low	96 Å²	96	114.6 Å²	114.6	50%	0.503	61%	0.607	S	S	.	*	H	α-helix	trans	-62.4	-34.8	172.9	-90.2	162.3	0	0	0	112.8	E95 K96 K103	E95-L99 HydrophobicContact CG-CD1 4.24Å; E95-L99 VanDerWaalsContact O-CB 3.28Å; E95-L99 WeakPolarHBondContact O-CB 3.43Å; E95-L99 PolarHBondContact O-N 3.13Å; K96-L99 PolarHBondContact O-N 3.1Å; L99-K103 WeakPolarHBondContact O-CB 3.43Å; L99-K103 WeakPolarHBondContact O-CG 3.38Å; L99-K103 PolarHBondContact O-N 2.76Å
100	H	53.9	Low	41.5	Very low	127 Å²	127	117.5 Å²	117.5	59%	0.588	60%	0.604	S	S	*	*	H	α-helix	trans	-73.1	-39.6	178.2	-146.4	-79.1	0	0	0	111.7	K96 V97 M98 K103 Y104	K96-H100 VanDerWaalsContact O-CB 3.3Å; K96-H100 WeakPolarHBondContact O-CB 3.45Å; K96-H100 PolarHBondContact O-N 3.18Å; V97-H100 PolarHBondContact O-N 3.44Å; M98-H100 VanDerWaalsContact C-N 3.31Å; M98-H100 PolarHBondContact O-N 3.27Å; H100-K103 PolarHBondContact O-N 3.4Å; H100-Y104 WeakPolarHBondContact O-CB 3.5Å; H100-Y104 PolarHBondContact O-N 3.27Å
101	L	45	Very low	41	Very low	90 Å²	90	119.5 Å²	119.5	47%	0.471	61%	0.606	S	S	.	*	H	α-helix	trans	-65.5	-45.9	172	-71	168.9	0	0	0	111.1	V97 M98 K103 Y104 F105	V97-L101 HydrophobicContact CG1-CD1 3.93Å; V97-L101 HydrophobicContact CG1-CG 4.47Å; V97-L101 WeakPolarHBondContact O-CB 3.33Å; V97-L101 VanDerWaalsContact O-CG 3.31Å; V97-L101 WeakPolarHBondContact O-CG 3.41Å; V97-L101 PolarHBondContact O-N 3.05Å; M98-L101 PolarHBondContact O-N 3.35Å; L101-K103 VanDerWaalsContact C-N 3.34Å; L101-K103 PolarHBondContact O-N 3.31Å; L101-Y104 PolarHBondContact O-N 2.69Å; L101-Y104 VanDerWaalsContact O-N 3.08Å; L101-F105 HydrophobicContact CB-CD2 4.49Å; L101-F105 HydrophobicContact CD2-CE2 4.21Å; L101-F105 WeakPolarHBondContact O-CD2 3.17Å; L101-F105 PolarHBondContact O-N 3.01Å
102	V	48.8	Very low	40.4	Very low	70 Å²	70	115.8 Å²	115.8	42%	0.424	61%	0.605	S	S	.	*	H	α-helix	trans	-60.7	-41.7	174.8	170.2	0	0	0	0	110.9	M98 Y104 F105 N106	M98-V102 WeakPolarHBondContact O-CB 3.39Å; M98-V102 VanDerWaalsContact O-CG2 3.24Å; M98-V102 WeakPolarHBondContact O-CG2 3.49Å; M98-V102 PolarHBondContact O-N 3.08Å; V102-Y104 VanDerWaalsContact C-N 3.35Å; V102-Y104 PolarHBondContact O-N 2.68Å; V102-F105 PolarHBondContact O-N 2.92Å; V102-N106 WeakPolarHBondContact O-CB 3.25Å; V102-N106 PolarHBondContact O-N 2.93Å
103	K	46.1	Very low	39.9	Very low	163 Å²	163	119.1 Å²	119.1	71%	0.709	62%	0.624	S	S	*	*	H	α-helix	trans	-64.9	-33.5	172.2	-84.8	-177.3	173.3	178.1	0	113.6	L99 H100 L101	L99-K103 WeakPolarHBondContact O-CB 3.43Å; L99-K103 WeakPolarHBondContact O-CG 3.38Å; L99-K103 PolarHBondContact O-N 2.76Å; H100-K103 PolarHBondContact O-N 3.4Å; L101-K103 VanDerWaalsContact C-N 3.34Å; L101-K103 PolarHBondContact O-N 3.31Å
104	Y	42	Very low	39	Very low	179 Å²	179	123.7 Å²	123.7	70%	0.702	64%	0.638	S	S	*	*	H	α-helix	trans	-72.3	-36.8	176.7	-125.5	-91.7	0	0	0	112.4	H100 L101 V102	H100-Y104 WeakPolarHBondContact O-CB 3.5Å; H100-Y104 PolarHBondContact O-N 3.27Å; L101-Y104 PolarHBondContact O-N 2.69Å; L101-Y104 VanDerWaalsContact O-N 3.08Å; V102-Y104 VanDerWaalsContact C-N 3.35Å; V102-Y104 PolarHBondContact O-N 2.68Å
105	F	38.9	Very low	38.2	Very low	90 Å²	90	126.1 Å²	126.1	40%	0.395	64%	0.642	S	S	.	*	H	α-helix	trans	-90.6	-15	179.6	-69.8	-64.7	0	0	0	114.3	L101 V102 K107 R631	L101-F105 HydrophobicContact CB-CD2 4.49Å; L101-F105 HydrophobicContact CD2-CE2 4.21Å; L101-F105 WeakPolarHBondContact O-CD2 3.17Å; L101-F105 PolarHBondContact O-N 3.01Å; V102-F105 PolarHBondContact O-N 2.92Å; F105-K107 VanDerWaalsContact C-N 3.33Å; F105-K107 PolarHBondContact O-N 3.06Å; F105-R631 PolarHBondContact O-NH2 2.61Å
106	N	35.1	Very low	37.2	Very low	107 Å²	107	130.7 Å²	130.7	57%	0.572	65%	0.654	S	S	*	*			trans	-95.2	51.3	169.4	-76.5	-10.9	0	0	0	111.7	V102 P108	V102-N106 WeakPolarHBondContact O-CB 3.25Å; V102-N106 PolarHBondContact O-N 2.93Å; N106-P108 WeakPolarHBondContact O-CD 3.34Å
107	K	31.4	Very low	36.4	Very low	173 Å²	173	129.3 Å²	129.3	75%	0.752	66%	0.658	S	S	*	*			trans	-80.1	111.4	153.7	-135.5	177.6	-171.6	178.9	0	106.5	F105 L109	F105-K107 VanDerWaalsContact C-N 3.33Å; F105-K107 PolarHBondContact O-N 3.06Å; K107-L109 PolarHBondContact O-N 3.25Å
108	P	30.2	Very low	34.9	Very low	90 Å²	90	131.5 Å²	131.5	58%	0.584	67%	0.667	S	S	*	*			trans	-63.6	139.8	-177	26.5	-34.2	0	0	0	109.6	N106 N110	N106-P108 WeakPolarHBondContact O-CD 3.34Å; P108-N110 WeakPolarHBondContact CB-OD1 3.41Å; P108-N110 VanDerWaalsContact CG-OD1 3.24Å; P108-N110 WeakPolarHBondContact CG-OD1 3.41Å; P108-N110 PolarHBondContact O-N 3.36Å
109	L	31.5	Very low	33.9	Very low	172 Å²	172	133 Å²	133	90%	0.901	68%	0.684	S	S	*	*			trans	-66.6	83.7	154.3	-128.7	82.9	0	0	0	105.7	K107 N111	K107-L109 PolarHBondContact O-N 3.25Å; L109-N111 PolarHBondContact O-N 3.46Å
110	N	30.4	Very low	32.7	Very low	137 Å²	137	134.9 Å²	134.9	73%	0.733	70%	0.695	S	S	*	*			trans	-66.3	108	178.6	-95.1	3.3	0	0	0	107.9	P108 A112	P108-N110 WeakPolarHBondContact CB-OD1 3.41Å; P108-N110 VanDerWaalsContact CG-OD1 3.24Å; P108-N110 WeakPolarHBondContact CG-OD1 3.41Å; P108-N110 PolarHBondContact O-N 3.36Å; N110-A112 PolarHBondContact O-N 2.61Å
111	N	25.7	Very low	31.5	Very low	154 Å²	154	139.1 Å²	139.1	82%	0.824	71%	0.707	S	S	*	*			trans	-31.4	109.1	174.5	-65	-26.9	0	0	0	111.9	L109 S113	L109-N111 PolarHBondContact O-N 3.46Å; N111-S113 PolarHBondContact O-N 3.5Å; N111-S113 VanDerWaalsContact O-N 3.16Å
112	A	25.6	Very low	30.7	Very low	95 Å²	95	140.6 Å²	140.6	79%	0.785	72%	0.72	S	S	*	*			trans	-62.7	114.3	151.5	0	0	0	0	0	105.8	N110 H114	N110-A112 PolarHBondContact O-N 2.61Å; A112-H114 PolarHBondContact O-N 3.07Å
113	S	26.1	Very low	29.6	Very low	100 Å²	100	145.3 Å²	145.3	70%	0.699	74%	0.737	S	S	*	*			trans	-53.3	126.8	179.4	44	0	0	0	0	110.4	N111 E115	N111-S113 PolarHBondContact O-N 3.5Å; N111-S113 VanDerWaalsContact O-N 3.16Å; S113-E115 PolarHBondContact O-N 3.18Å
114	H	26.1	Very low	28.8	Very low	197 Å²	197	143.5 Å²	143.5	91%	0.912	74%	0.739	S	S	*	*			trans	-64.6	73.8	163.8	-102.7	-82.9	0	0	0	109.4	A112 R116	A112-H114 PolarHBondContact O-N 3.07Å; H114-R116 PolarHBondContact O-N 3.3Å
115	E	25.9	Very low	28.1	Very low	166 Å²	166	141.7 Å²	141.7	78%	0.776	74%	0.742	S	S	*	*			trans	-83.8	105.8	168.2	-155	166.4	-144.5	0	0	107.9	S113 T117	S113-E115 PolarHBondContact O-N 3.18Å; E115-T117 PolarHBondContact O-N 2.66Å
116	R	24.4	Very low	27.7	Very low	225 Å²	225	144.4 Å²	144.4	85%	0.849	77%	0.766	S	S	*	*			trans	-78.8	75	-163.8	-164.9	-173.1	-150.7	168.1	5.6	111.1	H114 N118	H114-R116 PolarHBondContact O-N 3.3Å; R116-N118 PolarHBondContact O-N 2.93Å; R116-N118 VanDerWaalsContact O-N 3.1Å
117	T	27.1	Very low	27.3	Very low	125 Å²	125	143.4 Å²	143.4	77%	0.767	77%	0.773	S	S	*	*			trans	-73.6	97.9	169.7	35.1	0	0	0	0	110.7	E115 C119	E115-T117 PolarHBondContact O-N 2.66Å; T117-C119 PolarHBondContact O-N 3.28Å
118	N	23.5	Very low	27.3	Very low	127 Å²	127	143.5 Å²	143.5	68%	0.679	78%	0.775	S	S	*	*			trans	-55.6	108.8	168.4	-96	-0.9	0	0	0	110.6	R116	R116-N118 PolarHBondContact O-N 2.93Å; R116-N118 VanDerWaalsContact O-N 3.1Å
119	C	26.1	Very low	27.3	Very low	110 Å²	110	147.4 Å²	147.4	74%	0.743	79%	0.786	S	S	*	*			trans	-111.6	82.7	157.1	-76.4	0	0	0	0	108.1	T117 Y121	T117-C119 PolarHBondContact O-N 3.28Å; C119-Y121 PolarHBondContact O-N 3.14Å; C119-Y121 VanDerWaalsContact O-N 3.14Å
120	N	24.3	Very low	27	Very low	136 Å²	136	147.2 Å²	147.2	73%	0.727	78%	0.78	S	S	*	*			trans	-63.2	111.2	166.1	-72.3	-9.7	0	0	0	108
121	Y	28.4	Very low	26.9	Very low	216 Å²	216	152.1 Å²	152.1	85%	0.847	79%	0.789	S	S	*	*			trans	-111	119.1	160.2	-102.4	-85.5	0	0	0	109.2	C119 H123	C119-Y121 PolarHBondContact O-N 3.14Å; C119-Y121 VanDerWaalsContact O-N 3.14Å; Y121-H123 PolarHBondContact O-N 2.78Å
122	V	26.9	Very low	26.9	Very low	121 Å²	121	149.5 Å²	149.5	73%	0.733	78%	0.78	S	S	*	*			trans	-70.6	122.2	179.9	176.8	0	0	0	0	108.3	T124	V122-T124 HydrophobicContact CG1-CG2 4.24Å
123	H	27.2	Very low	27	Very low	168 Å²	168	152.2 Å²	152.2	78%	0.778	78%	0.78	S	S	*	*			trans	-76.5	125.9	163.5	-100.6	-96.4	0	0	0	108.9	Y121	Y121-H123 PolarHBondContact O-N 2.78Å
124	T	29.1	Very low	27.1	Very low	125 Å²	125	154.2 Å²	154.2	77%	0.767	78%	0.782	S	S	*	*			trans	-121.7	113.7	163.5	38.4	0	0	0	0	106.7	V122	V122-T124 HydrophobicContact CG1-CG2 4.24Å
125	D	26.1	Very low	27.2	Very low	142 Å²	142	149.6 Å²	149.6	76%	0.759	77%	0.772	S	S	*	*			trans	-79.7	135.9	-178.4	-62.6	-55.2	0	0	0	111.1
126	T	31.2	Very low	27.2	Very low	146 Å²	146	149 Å²	149	90%	0.896	77%	0.774	S	S	*	*			trans	-140.3	126.6	152.8	32.8	0	0	0	0	108.7
127	A	26.4	Very low	27.5	Very low	87 Å²	87	147.2 Å²	147.2	72%	0.719	78%	0.775	S	S	*	*			trans	-82.3	152.5	-175	0	0	0	0	0	112.2
128	H	30.7	Very low	27.5	Very low	174 Å²	174	147.5 Å²	147.5	81%	0.806	77%	0.772	S	S	*	*			trans	-164.2	111.6	138.3	-100.3	-63.8	0	0	0	111.9
129	E	30.1	Very low	27.7	Very low	173 Å²	173	150.9 Å²	150.9	81%	0.808	78%	0.784	S	S	*	*			trans	54.3	134.3	134.9	-106.7	158.5	131.9	0	0	124.6
130	E	26.1	Very low	27.6	Very low	167 Å²	167	156.2 Å²	156.2	78%	0.78	79%	0.79	S	S	*	*			trans	-66.9	151.2	-174.2	-53.2	167.1	136.6	0	0	116.3
131	R	27.7	Very low	27.8	Very low	240 Å²	240	155.8 Å²	155.8	91%	0.906	80%	0.797	S	S	*	*				-173.4	150.8	108	-97.6	172.7	-164.7	-171.2	6.3	112.8
132	P	26.2	Very low	27.7	Very low	99 Å²	99	148.7 Å²	148.7	64%	0.643	79%	0.789	S	S	*	*			trans	-111.6	-161.4	-169.4	40.8	-29.6	0	0	0	114.4
133	L	27.1	Very low	27.6	Very low	152 Å²	152	150.3 Å²	150.3	80%	0.796	79%	0.794	S	S	*	*			trans	88.3	149.1	174.9	-47.6	176.3	0	0	0	114.6
134	I	27.8	Very low	27.7	Very low	143 Å²	143	151.1 Å²	151.1	73%	0.733	80%	0.798	S	S	*	*			cis	-155.7	178.5	-8.4	-119.8	168.7	0	0	0	110.8
135	S	29.2	Very low	27.5	Very low	99 Å²	99	150.9 Å²	150.9	69%	0.692	80%	0.796	S	S	*	*			trans	-37	163.2	-176.8	60.5	0	0	0	0	121.8
136	D	25.9	Very low	27.7	Very low	155 Å²	155	154.1 Å²	154.1	83%	0.829	80%	0.799	S	S	*	*			trans	-46.1	131.6	161.5	-64.4	-71.6	0	0	0	113.9
137	H	30.6	Very low	27.5	Very low	187 Å²	187	151.3 Å²	151.3	87%	0.866	79%	0.786	S	S	*	*			trans	-163.5	150	136.7	-109.4	-72	0	0	0	110.4
138	D	26.4	Very low	27.7	Very low	130 Å²	130	153.7 Å²	153.7	70%	0.695	79%	0.791	S	S	*	*			trans	-69.7	132.3	175.9	-63.4	-87.1	0	0	0	111.1	K753	D138-K753 IonicContact OD1-NZ 2.92Å; D138-K753 PolarHBondContact OD1-NZ 2.85Å
139	E	27.5	Very low	27.7	Very low	199 Å²	199	150 Å²	150	93%	0.93	79%	0.791	S	S	*	*			trans	-142.5	154.1	155.7	-160.5	158.5	-146	0	0	112.4
140	Y	24.6	Very low	27.9	Very low	222 Å²	222	146.6 Å²	146.6	87%	0.871	79%	0.792	S	S	*	*			trans	-117.6	92.2	-162.7	-168.7	-84.3	0	0	0	110.5
141	S	27.8	Very low	28	Very low	126 Å²	126	145.6 Å²	145.6	88%	0.881	80%	0.798	S	S	*	*			trans	-172.1	153.8	166.4	-80.9	0	0	0	0	106.6
142	G	26.9	Very low	28.4	Very low	67 Å²	67	138.7 Å²	138.7	69%	0.691	79%	0.792	S	S	*	*			cis	175.1	163.3	6.7	0	0	0	0	0	105.9	H144	G142-H144 PolarHBondContact O-N 3.19Å
143	D	24.2	Very low	28.7	Very low	155 Å²	155	137.7 Å²	137.7	83%	0.829	80%	0.799	S	S	*	*			trans	-51.6	132.1	-167.4	-57.6	-63.7	0	0	0	115.7
144	H	29.8	Very low	28.9	Very low	186 Å²	186	134.9 Å²	134.9	86%	0.861	80%	0.798	S	S	*	*			trans	-145.1	113.1	149.6	-91.7	-57.4	0	0	0	112.6	G142	G142-H144 PolarHBondContact O-N 3.19Å
145	V	25.3	Very low	29.2	Very low	120 Å²	120	133.7 Å²	133.7	73%	0.727	80%	0.803	S	S	*	*			trans	-102.3	129.4	171.8	170.3	0	0	0	0	109.5
146	Y	29.4	Very low	29.2	Very low	209 Å²	209	135.8 Å²	135.8	82%	0.82	81%	0.811	S	S	*	*			trans	-151	114.9	151	-85	-78	0	0	0	106.3
147	S	28.4	Very low	29.6	Very low	88 Å²	88	134.3 Å²	134.3	62%	0.615	81%	0.813	S	S	*	*				67.4	136.1	80.3	-63.2	0	0	0	0	112.6
148	T	29.8	Very low	29.7	Very low	136 Å²	136	130.6 Å²	130.6	83%	0.834	81%	0.808	S	S	*	*			cis	-161.9	148	5.9	2.2	0	0	0	0	106.8
149	A	31.9	Very low	30.2	Very low	98 Å²	98	129.6 Å²	129.6	81%	0.81	81%	0.809	S	S	*	*				174.7	166.2	81.4	0	0	0	0	0	107.5
150	A	32.8	Very low	30.6	Very low	100 Å²	100	126.5 Å²	126.5	83%	0.826	80%	0.804	S	S	*	*			cis	-145.5	-179.5	16	0	0	0	0	0	112.3
151	T	29.3	Very low	31	Very low	146 Å²	146	121.6 Å²	121.6	90%	0.896	80%	0.797	S	S	*	*			trans	-114.7	137.9	-151.3	-32.9	0	0	0	0	115.6
152	A	35.3	Very low	31.4	Very low	96 Å²	96	123.9 Å²	123.9	79%	0.793	79%	0.794	S	S	*	*			trans	165	131.5	147.3	0	0	0	0	0	107.7
153	G	31.7	Very low	31.8	Very low	77 Å²	77	127.9 Å²	127.9	79%	0.794	80%	0.8	S	S	*	*			cis	97.1	116.5	25.9	0	0	0	0	0	109.6
154	A	32.7	Very low	32.1	Very low	93 Å²	93	124.5 Å²	124.5	77%	0.769	80%	0.801	S	S	*	*			cis	-161.5	177.6	1.6	0	0	0	0	0	112.3
155	S	33.1	Very low	32.2	Very low	118 Å²	118	120.3 Å²	120.3	83%	0.825	80%	0.799	S	S	*	*			trans	64.9	113.1	156.4	51.2	0	0	0	0	121.9
156	T	29.7	Very low	32.6	Very low	143 Å²	143	121.7 Å²	121.7	88%	0.877	80%	0.802	S	S	*	*			trans	-51.4	138.7	162.9	-7.4	0	0	0	0	116.5
157	S	34.6	Very low	32.6	Very low	124 Å²	124	117.7 Å²	117.7	87%	0.867	80%	0.804	S	S	*	*			trans	-161.2	126.4	141	60.1	0	0	0	0	111.5
158	S	32.1	Very low	32.9	Very low	109 Å²	109	119.6 Å²	119.6	76%	0.762	81%	0.813	S	S	*	*			trans	-116.8	175.7	170.4	55.8	0	0	0	0	109.2
159	P	38	Very low	33	Very low	109 Å²	109	118.2 Å²	118.2	71%	0.708	82%	0.815	S	S	*	*			cis	-123.7	177	-28.3	37	-22.1	0	0	0	111.9
160	T	35	Very low	33.5	Very low	135 Å²	135	118.2 Å²	118.2	83%	0.828	81%	0.809	S	S	*	*				171.2	143.8	125.8	38.7	0	0	0	0	112.6
161	T	33.2	Very low	34.8	Very low	118 Å²	118	118 Å²	118	72%	0.724	80%	0.798	S	S	*	*			trans	-31	137	165.4	44.3	0	0	0	0	118.2
162	E	36	Very low	36.7	Very low	174 Å²	174	118 Å²	118	81%	0.813	79%	0.785	S	S	*	*				-174.9	148.5	104.7	-96.9	166.7	-171.6	0	0	112.9
163	D	36.1	Very low	38.7	Very low	152 Å²	152	114 Å²	114	81%	0.813	75%	0.75	S	S	*	*			trans	54.6	99.4	156.7	-59.3	-12.5	0	0	0	124.2
164	G	30.4	Very low	41.2	Very low	83 Å²	83	114.4 Å²	114.4	86%	0.856	74%	0.735	S	S	*	*				74.8	98	105.8	0	0	0	0	0	122.1
165	A	31.1	Very low	43.7	Very low	99 Å²	99	112.6 Å²	112.6	82%	0.818	72%	0.715	S	S	*	*			trans	-173	148.4	135.1	0	0	0	0	0	113.1
166	D	34.1	Very low	46.2	Very low	149 Å²	149	111.7 Å²	111.7	80%	0.797	70%	0.701	S	S	*	*			trans	55.8	84.9	160.5	-68.7	-4.2	0	0	0	121.8	T168	D166-T168 PolarHBondContact O-N 3.38Å
167	S	29.8	Very low	48.9	Very low	124 Å²	124	108.1 Å²	108.1	87%	0.867	67%	0.674	S	S	*	*			trans	-73.3	86.1	157.6	55.3	0	0	0	0	113.6
168	T	33.9	Very low	51.5	Low	128 Å²	128	102.2 Å²	102.2	79%	0.785	63%	0.633	S	S	*	*			trans	-146.8	29.5	164.3	39.6	0	0	0	0	114.4	D166	D166-T168 PolarHBondContact O-N 3.38Å
169	A	32.7	Very low	54.2	Low	107 Å²	107	99 Å²	99	88%	0.884	61%	0.606	S	S	*	*			trans	-102.9	69.8	-177.7	0	0	0	0	0	114
170	S	41.1	Very low	56.5	Low	99 Å²	99	95.3 Å²	95.3	69%	0.692	58%	0.583	S	S	*	*			trans	-151.6	153.6	167.8	67.8	0	0	0	0	112.3
171	T	61.9	Low	59.1	Low	95 Å²	95	89.3 Å²	89.3	58%	0.583	55%	0.545	S	S	*	.			trans	90.6	35.7	173	72.9	0	0	0	0	121	L768	T171-L768 HydrophobicContact CG2-CD1 4.16Å
172	F	68.2	Low	61.8	Low	145 Å²	145	83.9 Å²	83.9	64%	0.636	51%	0.512	S	S	*	.			trans	-139.6	114.7	155.2	-158.3	-97.2	0	0	0	114.9	M778	F172-M778 HydrophobicContact CE2-CE 4.13Å
173	I	77.9	Confident	64.4	Low	12 Å²	12	76.5 Å²	76.5	6%	0.062	48%	0.476	C	S	.	.			trans	-91.7	151.1	173.1	-53.4	171.9	0	0	0	110	E177 V178 D765 L768 L769 Q772	I173-E177 HydrophobicContact CG2-CB 4.11Å; I173-E177 HydrophobicContact CG2-CG 4.13Å; I173-E177 WeakPolarHBondContact CG2-OE2 3.49Å; I173-V178 HydrophobicContact CB-CG2 4.46Å; I173-V178 HydrophobicContact CG2-CG2 4.49Å; I173-D765 HydrophobicContact CD1-CB 4.21Å; I173-D765 VanDerWaalsContact CD1-OD2 3.31Å; I173-D765 WeakPolarHBondContact CD1-OD2 3.42Å; I173-L768 HydrophobicContact CD1-CB 3.92Å; I173-L768 HydrophobicContact CD1-CD2 3.77Å; I173-L768 HydrophobicContact CD1-CG 3.72Å; I173-L768 HydrophobicContact CG1-CD2 3.63Å; I173-L768 HydrophobicContact CG1-CG 3.96Å; I173-L769 HydrophobicContact CB-CD2 4.42Å; I173-L769 HydrophobicContact CD1-CB 4.4Å; I173-L769 HydrophobicContact CD1-CD2 3.59Å; I173-L769 HydrophobicContact CD1-CG 3.59Å; I173-L769 HydrophobicContact CG2-CD2 3.87Å; I173-Q772 PolarHBondContact O-OE1 2.93Å
174	N	84	Confident	67	Low	86 Å²	86	70.4 Å²	70.4	46%	0.46	44%	0.442	S	S	.	.			trans	-60	129.5	178.4	-176.8	-27.4	0	0	0	110.9	N176 E177 V178	N174-N176 VanDerWaalsContact C-N 3.26Å; N174-N176 PolarHBondContact O-N 3.16Å; N174-N176 PolarHBondContact OD1-N 3.05Å; N174-N176 VanDerWaalsContact OD1-N 3.1Å; N174-E177 HydrophobicContact CB-CB 4.26Å; N174-E177 VanDerWaalsContact O-CB 3.27Å; N174-E177 WeakPolarHBondContact O-CB 3.2Å; N174-E177 PolarHBondContact O-N 3Å; N174-V178 PolarHBondContact O-N 3.4Å
175	P	84.2	Confident	69.8	Low	55 Å²	55	69.3 Å²	69.3	36%	0.357	41%	0.412	S	S	.	.	H	α-helix	trans	-59.9	-32.8	-176	21.4	-33.5	0	0	0	114.3	E177 V178 E179 W542	P175-E177 PolarHBondContact O-N 3.32Å; P175-V178 PolarHBondContact O-N 3.34Å; P175-E179 PolarHBondContact O-N 3.42Å; P175-W542 HydrophobicContact CB-CH2 3.61Å; P175-W542 HydrophobicContact CB-CZ3 3.73Å; P175-W542 WeakPolarHBondContact O-CH2 3.32Å; P175-W542 VanDerWaalsContact O-CZ3 3.3Å; P175-W542 WeakPolarHBondContact O-CZ3 3.43Å
176	N	86.1	Confident	72.6	Confident	100 Å²	100	64.6 Å²	64.6	54%	0.535	37%	0.373	S	S	.	.	H	α-helix	trans	-63.9	-27.6	176.3	-63.2	-7.3	0	0	0	112.3	N174 S180	N174-N176 VanDerWaalsContact C-N 3.26Å; N174-N176 PolarHBondContact O-N 3.16Å; N174-N176 PolarHBondContact OD1-N 3.05Å; N174-N176 VanDerWaalsContact OD1-N 3.1Å; N176-S180 WeakPolarHBondContact O-CB 3.21Å; N176-S180 PolarHBondContact O-N 3.38Å; N176-S180 PolarHBondContact O-OG 2.86Å
177	E	87.5	Confident	75.2	Confident	67 Å²	67	59.4 Å²	59.4	31%	0.313	34%	0.343	S	S	.	.	H	α-helix	trans	-79.4	-39.8	-179.6	-174.7	169.6	-156.6	0	0	111.6	I173 N174 P175 E179 S180 W181 R763	I173-E177 HydrophobicContact CG2-CB 4.11Å; I173-E177 HydrophobicContact CG2-CG 4.13Å; I173-E177 WeakPolarHBondContact CG2-OE2 3.49Å; N174-E177 HydrophobicContact CB-CB 4.26Å; N174-E177 VanDerWaalsContact O-CB 3.27Å; N174-E177 WeakPolarHBondContact O-CB 3.2Å; N174-E177 PolarHBondContact O-N 3Å; P175-E177 PolarHBondContact O-N 3.32Å; E177-E179 VanDerWaalsContact C-N 3.33Å; E177-S180 PolarHBondContact O-N 2.9Å; E177-W181 VanDerWaalsContact O-CB 3.3Å; E177-W181 WeakPolarHBondContact O-CB 3.4Å; E177-W181 PolarHBondContact O-N 3.48Å; E177-R763 VanDerWaalsContact CD-NH2 3.31Å; E177-R763 IonicContact OE1-CZ 3.26Å; E177-R763 IonicContact OE1-NH1 2.81Å; E177-R763 PolarHBondContact OE1-NH1 2.95Å; E177-R763 IonicContact OE1-NH2 2.81Å; E177-R763 PolarHBondContact OE1-NH2 2.98Å; E177-R763 IonicContact OE2-NH2 2.76Å
178	V	87.6	Confident	78	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-59.8	-44.8	169.8	-176.5	0	0	0	0	110.5	I173 N174 P175 W181 M182 W542 L769 Q772 A773	I173-V178 HydrophobicContact CB-CG2 4.46Å; I173-V178 HydrophobicContact CG2-CG2 4.49Å; N174-V178 PolarHBondContact O-N 3.4Å; P175-V178 PolarHBondContact O-N 3.34Å; V178-W181 PolarHBondContact O-N 3.3Å; V178-M182 WeakPolarHBondContact O-CB 3.32Å; V178-M182 PolarHBondContact O-N 3.36Å; V178-W542 HydrophobicContact CB-CH2 3.67Å; V178-W542 HydrophobicContact CB-CZ2 3.87Å; V178-W542 HydrophobicContact CG1-CH2 3.91Å; V178-W542 HydrophobicContact CG1-CZ2 3.58Å; V178-W542 HydrophobicContact CG2-CH2 4.27Å; V178-W542 HydrophobicContact CG2-CZ2 4.4Å; V178-L769 HydrophobicContact CG2-CD2 4Å; V178-Q772 HydrophobicContact CG1-CB 4.5Å; V178-Q772 HydrophobicContact CG2-CB 4.11Å; V178-A773 HydrophobicContact CG1-CB 3.72Å
179	E	88.6	Confident	80.6	Confident	42 Å²	42	51.5 Å²	51.5	20%	0.196	28%	0.281	C	S	.	.	H	α-helix	trans	-60	-48.8	175.6	-166.5	-165.5	148.1	0	0	111.6	P175 E177 W181 M182 R183 F538 F744	P175-E179 PolarHBondContact O-N 3.42Å; E177-E179 VanDerWaalsContact C-N 3.33Å; E179-W181 PolarHBondContact O-N 2.61Å; E179-M182 PolarHBondContact O-N 3.35Å; E179-R183 WeakPolarHBondContact O-CB 3.35Å; E179-R183 PolarHBondContact O-N 2.95Å; E179-R183 IonicContact OE1-CZ 3.09Å; E179-R183 IonicContact OE1-NH2 3.38Å; E179-R183 PolarHBondContact OE1-NH2 2.86Å; E179-F538 HydrophobicContact CG-CZ 4.32Å; E179-F744 HydrophobicContact CG-CE2 3.49Å; E179-F744 VanDerWaalsContact CG-CE2 3.49Å; E179-F744 HydrophobicContact CG-CZ 3.78Å; E179-F744 WeakPolarHBondContact OE1-CE2 3.32Å
180	S	88.2	Confident	83.2	Confident	32 Å²	32	47 Å²	47	22%	0.224	24%	0.241	C	C	.	.	H	α-helix	trans	-63.4	-40.3	179.6	-61.3	0	0	0	0	112.3	N176 E177 R183 R184	N176-S180 WeakPolarHBondContact O-CB 3.21Å; N176-S180 PolarHBondContact O-N 3.38Å; N176-S180 PolarHBondContact O-OG 2.86Å; E177-S180 PolarHBondContact O-N 2.9Å; S180-R183 PolarHBondContact O-N 3.5Å; S180-R184 WeakPolarHBondContact O-CG 3.47Å; S180-R184 PolarHBondContact O-N 3.29Å
181	W	89.4	Confident	85.2	Confident	9 Å²	9	43.2 Å²	43.2	3%	0.034	21%	0.213	C	C	.	.	H	α-helix	trans	-62.6	-46.5	174.9	173.4	84.5	0	0	0	111.6	E177 V178 E179 R183 R184 R185 L769 Y770 A773	E177-W181 VanDerWaalsContact O-CB 3.3Å; E177-W181 WeakPolarHBondContact O-CB 3.4Å; E177-W181 PolarHBondContact O-N 3.48Å; V178-W181 PolarHBondContact O-N 3.3Å; E179-W181 PolarHBondContact O-N 2.61Å; W181-R183 VanDerWaalsContact C-N 3.3Å; W181-R183 PolarHBondContact O-N 3.16Å; W181-R184 PolarHBondContact O-N 3.41Å; W181-R185 WeakPolarHBondContact O-CB 3.33Å; W181-R185 PolarHBondContact O-N 2.93Å; W181-L769 HydrophobicContact CB-CD1 4.34Å; W181-L769 HydrophobicContact CD2-CB 4.19Å; W181-L769 HydrophobicContact CD2-CD1 4.31Å; W181-L769 HydrophobicContact CE3-CB 4.4Å; W181-L769 HydrophobicContact CG-CD1 3.86Å; W181-Y770 HydrophobicContact CH2-CD2 4.21Å; W181-A773 HydrophobicContact CZ3-CB 4.13Å
182	M	89.6	Confident	86.3	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.02	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-38	177.2	-173.1	54.9	174.3	0	0	111.5	V178 E179 R185 L186 T535 F538	V178-M182 WeakPolarHBondContact O-CB 3.32Å; V178-M182 PolarHBondContact O-N 3.36Å; E179-M182 PolarHBondContact O-N 3.35Å; M182-R185 WeakPolarHBondContact O-CB 3.42Å; M182-R185 PolarHBondContact O-N 3.49Å; M182-L186 HydrophobicContact CE-CD1 4.47Å; M182-L186 HydrophobicContact CE-CG 4.39Å; M182-L186 WeakPolarHBondContact O-CG 3.34Å; M182-L186 PolarHBondContact O-N 2.96Å; M182-T535 HydrophobicContact CE-CG2 4.17Å; M182-T535 WeakPolarHBondContact CE-OG1 3.15Å; M182-F538 HydrophobicContact CB-CE1 4.22Å; M182-F538 HydrophobicContact CB-CE2 4.2Å; M182-F538 HydrophobicContact CB-CZ 4.05Å; M182-F538 HydrophobicContact CE-CB 4.05Å; M182-F538 HydrophobicContact CE-CD1 4.38Å; M182-F538 HydrophobicContact CE-CG 4.32Å; M182-F538 HydrophobicContact CG-CD1 3.68Å; M182-F538 HydrophobicContact CG-CD2 4.14Å; M182-F538 HydrophobicContact CG-CE1 3.77Å; M182-F538 HydrophobicContact CG-CE2 4.23Å; M182-F538 HydrophobicContact CG-CG 3.88Å; M182-F538 HydrophobicContact CG-CZ 4.06Å
183	R	90.6	Very high	87	Confident	19 Å²	19	36 Å²	36	7%	0.072	18%	0.181	C	C	.	.	H	α-helix	trans	-62	-46.3	174.1	-162.4	-176.2	-61.7	-160.7	-9.9	112.4	E179 S180 W181 L186 Y187 F744 Y750	E179-R183 WeakPolarHBondContact O-CB 3.35Å; E179-R183 PolarHBondContact O-N 2.95Å; E179-R183 IonicContact OE1-CZ 3.09Å; E179-R183 IonicContact OE1-NH2 3.38Å; E179-R183 PolarHBondContact OE1-NH2 2.86Å; S180-R183 PolarHBondContact O-N 3.5Å; W181-R183 VanDerWaalsContact C-N 3.3Å; W181-R183 PolarHBondContact O-N 3.16Å; R183-L186 PolarHBondContact O-N 3.18Å; R183-Y187 WeakPolarHBondContact O-CB 3.48Å; R183-Y187 PolarHBondContact O-N 3.46Å; R183-F744 HydrophobicContact CB-CE1 3.76Å; R183-F744 HydrophobicContact CB-CZ 3.9Å; R183-F744 WeakPolarHBondContact CD-O 3.22Å; R183-F744 HydrophobicContact CG-CD1 4.33Å; R183-F744 HydrophobicContact CG-CE1 4.04Å; R183-F744 HydrophobicContact CG-CZ 4.37Å; R183-F744 PolarHBondContact NE-O 3.08Å; R183-Y750 HydrophobicContact CG-CE2 4.15Å
184	R	89.9	Confident	87.2	Confident	24 Å²	24	39.3 Å²	39.3	9%	0.091	20%	0.202	C	C	.	.	H	α-helix	trans	-64	-39.7	175.4	-70.2	-173.9	-54.3	-102.7	9.8	112.3	S180 W181 Y187 Y188 Y750 F757 D760	S180-R184 WeakPolarHBondContact O-CG 3.47Å; S180-R184 PolarHBondContact O-N 3.29Å; W181-R184 PolarHBondContact O-N 3.41Å; R184-Y187 PolarHBondContact O-N 3.42Å; R184-Y188 WeakPolarHBondContact O-CB 3.44Å; R184-Y188 PolarHBondContact O-N 3.23Å; R184-Y750 HydrophobicContact CG-CD1 3.97Å; R184-Y750 HydrophobicContact CG-CD2 4.2Å; R184-Y750 HydrophobicContact CG-CE1 3.55Å; R184-Y750 HydrophobicContact CG-CE2 3.76Å; R184-Y750 HydrophobicContact CG-CG 4.29Å; R184-Y750 VanDerWaalsContact CG-CZ 3.42Å; R184-F757 HydrophobicContact CB-CE1 4.22Å; R184-D760 IonicContact CZ-OD1 2.73Å; R184-D760 IonicContact CZ-OD2 3.43Å; R184-D760 IonicContact NE-OD1 3.27Å; R184-D760 IonicContact NE-OD2 3.41Å; R184-D760 PolarHBondContact NE-OD2 2.83Å; R184-D760 IonicContact NH2-OD1 3.21Å; R184-D760 PolarHBondContact NH2-OD1 2.95Å; R184-D760 IonicContact NH2-OD2 2.68Å; R184-D760 PolarHBondContact NH2-OD2 3.38Å
185	R	89.9	Confident	87.2	Confident	60 Å²	60	35.6 Å²	35.6	23%	0.226	18%	0.184	C	C	.	.	H	α-helix	trans	-59.1	-46.3	174.3	-175.8	-179.2	-177.7	79.4	-4.5	111.7	W181 M182 H189 E534	W181-R185 WeakPolarHBondContact O-CB 3.33Å; W181-R185 PolarHBondContact O-N 2.93Å; M182-R185 WeakPolarHBondContact O-CB 3.42Å; M182-R185 PolarHBondContact O-N 3.49Å; R185-H189 PolarHBondContact O-N 3.06Å; R185-E534 IonicContact CZ-OE2 3.7Å; R185-E534 IonicContact NE-OE2 3.27Å; R185-E534 PolarHBondContact NE-OE2 3.38Å; R185-E534 VanDerWaalsContact NH2-CD 3.33Å; R185-E534 IonicContact NH2-OE1 2.73Å; R185-E534 PolarHBondContact NH2-OE1 2.95Å; R185-E534 VanDerWaalsContact NH2-OE1 3.13Å; R185-E534 IonicContact NH2-OE2 2.71Å; R185-E534 PolarHBondContact NH2-OE2 3.18Å
186	L	89.8	Confident	87.3	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-66.6	-46.4	175.6	-73.8	176.2	0	0	0	112.7	M182 R183 Y188 H189 F190 I531 T535 F554 L741 F744 V745	M182-L186 HydrophobicContact CE-CD1 4.47Å; M182-L186 HydrophobicContact CE-CG 4.39Å; M182-L186 WeakPolarHBondContact O-CG 3.34Å; M182-L186 PolarHBondContact O-N 2.96Å; R183-L186 PolarHBondContact O-N 3.18Å; L186-Y188 VanDerWaalsContact C-N 3.32Å; L186-Y188 PolarHBondContact O-N 3.32Å; L186-H189 WeakPolarHBondContact O-CB 3.13Å; L186-H189 PolarHBondContact O-N 3.07Å; L186-F190 HydrophobicContact CD2-CE2 4.22Å; L186-F190 WeakPolarHBondContact O-CD2 3.41Å; L186-F190 PolarHBondContact O-N 3.08Å; L186-I531 HydrophobicContact CD2-CG2 4.27Å; L186-T535 HydrophobicContact CD1-CG2 4.07Å; L186-T535 HydrophobicContact CD2-CG2 4.1Å; L186-T535 WeakPolarHBondContact CD2-OG1 3.48Å; L186-F554 HydrophobicContact CD2-CE1 3.64Å; L186-F554 HydrophobicContact CD2-CZ 4.05Å; L186-L741 HydrophobicContact CD1-CD1 3.95Å; L186-F744 HydrophobicContact CD1-CD1 3.84Å; L186-F744 HydrophobicContact CD1-CE1 3.86Å; L186-V745 HydrophobicContact CB-CG2 3.76Å; L186-V745 HydrophobicContact CD1-CG2 4.06Å
187	Y	88	Confident	87.4	Confident	40 Å²	40	34 Å²	34	16%	0.157	17%	0.167	C	C	.	.	H	α-helix	trans	-57	-46.6	177.4	-171.2	-89.4	0	0	0	111.1	R183 R184 H189 F190 M191 V745 Y750 F757	R183-Y187 WeakPolarHBondContact O-CB 3.48Å; R183-Y187 PolarHBondContact O-N 3.46Å; R184-Y187 PolarHBondContact O-N 3.42Å; Y187-H189 PolarHBondContact O-N 3.19Å; Y187-F190 PolarHBondContact O-N 3.23Å; Y187-M191 PolarHBondContact O-N 3.17Å; Y187-M191 VanDerWaalsContact O-N 3.17Å; Y187-V745 HydrophobicContact CD2-CG1 4.05Å; Y187-Y750 HydrophobicContact CD1-CD2 4.29Å; Y187-Y750 HydrophobicContact CD2-CD2 4.14Å; Y187-Y750 WeakPolarHBondContact CE1-O 3.4Å; Y187-Y750 AromaticContact CG-CD2 3.99Å; Y187-Y750 HydrophobicContact CG-CD2 3.99Å; Y187-Y750 PolarHBondContact OH-O 2.94Å; Y187-F757 HydrophobicContact CD1-CE1 4.21Å; Y187-F757 AromaticContact CD1-CZ 3.77Å; Y187-F757 HydrophobicContact CD1-CZ 3.77Å; Y187-F757 HydrophobicContact CE1-CZ 4.15Å
188	Y	89	Confident	87.3	Confident	52 Å²	52	34.1 Å²	34.1	20%	0.204	17%	0.167	C	C	.	.	H	α-helix	trans	-61.5	-39.6	173.4	-178.7	-92.2	0	0	0	112.2	R184 L186 F190 M191 K196 A199 K200 F757	R184-Y188 WeakPolarHBondContact O-CB 3.44Å; R184-Y188 PolarHBondContact O-N 3.23Å; L186-Y188 VanDerWaalsContact C-N 3.32Å; L186-Y188 PolarHBondContact O-N 3.32Å; Y188-F190 PolarHBondContact O-N 3.21Å; Y188-M191 WeakPolarHBondContact O-CB 3.39Å; Y188-M191 PolarHBondContact O-N 3.25Å; Y188-K196 HydrophobicContact CD2-CG 4.33Å; Y188-K196 HydrophobicContact CE1-CG 4.43Å; Y188-K196 HydrophobicContact CE2-CB 4.05Å; Y188-K196 HydrophobicContact CE2-CG 3.83Å; Y188-K196 WeakPolarHBondContact O-CE 3.26Å; Y188-A199 HydrophobicContact CD2-CB 4.31Å; Y188-A199 HydrophobicContact CE2-CB 4.24Å; Y188-K200 HydrophobicContact CE2-CD 3.78Å; Y188-K200 HydrophobicContact CE2-CG 3.88Å; Y188-F757 HydrophobicContact CD2-CD1 4.32Å
189	H	88.5	Confident	87.2	Confident	33 Å²	33	34.4 Å²	34.4	15%	0.153	17%	0.17	C	C	.	.	H	α-helix	trans	-60	-46.4	176.8	-178.7	64.7	0	0	0	112.4	R185 L186 Y187 M191 K196 I531 F554	R185-H189 PolarHBondContact O-N 3.06Å; L186-H189 WeakPolarHBondContact O-CB 3.13Å; L186-H189 PolarHBondContact O-N 3.07Å; Y187-H189 PolarHBondContact O-N 3.19Å; H189-M191 VanDerWaalsContact C-N 3.33Å; H189-M191 PolarHBondContact O-N 3.17Å; H189-K196 WeakPolarHBondContact O-CE 3.46Å; H189-K196 PolarHBondContact O-NZ 2.98Å; H189-I531 HydrophobicContact CB-CD1 4.35Å; H189-I531 WeakPolarHBondContact ND1-CD1 3.27Å; H189-F554 AromaticContact CD2-CD1 3.8Å; H189-F554 AromaticContact NE2-CD1 3.84Å; H189-F554 PolarHBondContact NE2-O 3.14Å
190	F	86.9	Confident	87.1	Confident	13 Å²	13	34 Å²	34	6%	0.057	17%	0.167	C	C	.	.	H	α-helix	trans	-79.4	-11.2	-175.9	-70.2	-62.6	0	0	0	115.3	L186 Y187 Y188 E553 F554 L741 W742	L186-F190 HydrophobicContact CD2-CE2 4.22Å; L186-F190 WeakPolarHBondContact O-CD2 3.41Å; L186-F190 PolarHBondContact O-N 3.08Å; Y187-F190 PolarHBondContact O-N 3.23Å; Y188-F190 PolarHBondContact O-N 3.21Å; F190-E553 HydrophobicContact CE1-CB 4.22Å; F190-E553 WeakPolarHBondContact CE1-O 3.41Å; F190-F554 HydrophobicContact CE2-CE1 4.09Å; F190-F554 HydrophobicContact CE2-CZ 4.3Å; F190-F554 AromaticContact CZ-CD1 3.98Å; F190-F554 HydrophobicContact CZ-CD1 3.98Å; F190-F554 AromaticContact CZ-CE1 3.72Å; F190-F554 HydrophobicContact CZ-CE1 3.72Å; F190-F554 HydrophobicContact CZ-CE2 4.32Å; F190-F554 HydrophobicContact CZ-CG 4.38Å; F190-F554 AromaticContact CZ-CZ 3.89Å; F190-F554 HydrophobicContact CZ-CZ 3.89Å; F190-L741 HydrophobicContact CE2-CD2 4.3Å; F190-L741 HydrophobicContact CZ-CD2 4.04Å; F190-W742 HydrophobicContact CB-CH2 3.78Å; F190-W742 HydrophobicContact CB-CZ3 4.27Å; F190-W742 AromaticContact CD1-CH2 3.78Å; F190-W742 HydrophobicContact CD1-CH2 3.78Å; F190-W742 HydrophobicContact CD1-CZ2 4.09Å; F190-W742 AromaticContact CD2-CH2 3.93Å; F190-W742 HydrophobicContact CD2-CH2 3.93Å; F190-W742 HydrophobicContact CD2-CZ3 4.26Å; F190-W742 HydrophobicContact CE1-CH2 4.37Å; F190-W742 HydrophobicContact CE1-CZ2 4.29Å; F190-W742 HydrophobicContact CE2-CH2 4.5Å; F190-W742 AromaticContact CG-CH2 3.55Å; F190-W742 HydrophobicContact CG-CH2 3.55Å; F190-W742 HydrophobicContact CG-CZ2 4.27Å; F190-W742 HydrophobicContact CG-CZ3 4.21Å
191	M	83.1	Confident	86.9	Confident	19 Å²	19	40.7 Å²	40.7	9%	0.094	19%	0.188	C	C	.	.	S	Bend	trans	-63	148.7	178.7	-164.5	178.3	-144.7	0	0	113.6	Y187 Y188 H189 G195 K196 A199 P752	Y187-M191 PolarHBondContact O-N 3.17Å; Y187-M191 VanDerWaalsContact O-N 3.17Å; Y188-M191 WeakPolarHBondContact O-CB 3.39Å; Y188-M191 PolarHBondContact O-N 3.25Å; H189-M191 VanDerWaalsContact C-N 3.33Å; H189-M191 PolarHBondContact O-N 3.17Å; M191-G195 WeakPolarHBondContact CE-O 3.41Å; M191-K196 HydrophobicContact CB-CG 4.05Å; M191-K196 HydrophobicContact CG-CG 4.3Å; M191-K196 VanDerWaalsContact O-CE 3.23Å; M191-K196 WeakPolarHBondContact O-CE 3.4Å; M191-K196 PolarHBondContact O-NZ 3.18Å; M191-K196 HydrophobicContact SD-CG 4.24Å; M191-A199 HydrophobicContact SD-CB 4.34Å; M191-P752 HydrophobicContact CE-CB 3.41Å; M191-P752 VanDerWaalsContact CE-CB 3.41Å; M191-P752 HydrophobicContact CE-CG 3.52Å
192	T	84.4	Confident	86.6	Confident	57 Å²	57	47.4 Å²	47.4	35%	0.35	21%	0.213	S	C	.	.			trans	-63.5	156.4	172.6	61	0	0	0	0	111.2	V194 G195 K196	T192-V194 VanDerWaalsContact C-N 3.28Å; T192-V194 PolarHBondContact O-N 2.82Å; T192-G195 PolarHBondContact O-N 2.97Å; T192-G195 VanDerWaalsContact O-N 3.14Å; T192-G195 PolarHBondContact OG1-N 2.97Å; T192-K196 WeakPolarHBondContact O-CG 3.33Å; T192-K196 PolarHBondContact O-N 3.25Å
193	P	83.7	Confident	86.3	Confident	31 Å²	31	52.2 Å²	52.2	20%	0.201	24%	0.238	C	C	.	.	H	α-helix	trans	-60	-35.2	178.8	-28.5	39.4	0	0	0	113.9	K196 F197 F611	P193-K196 PolarHBondContact O-N 3.06Å; P193-F197 PolarHBondContact O-N 2.93Å; P193-F611 HydrophobicContact CB-CE2 4.34Å; P193-F611 HydrophobicContact CG-CD2 4.2Å; P193-F611 HydrophobicContact CG-CE1 4.14Å; P193-F611 HydrophobicContact CG-CE2 3.52Å; P193-F611 HydrophobicContact CG-CZ 3.48Å; P193-F611 VanDerWaalsContact CG-CZ 3.48Å
194	V	81.8	Confident	86.1	Confident	83 Å²	83	53.6 Å²	53.6	50%	0.503	25%	0.249	S	C	.	.	H	α-helix	trans	-62.9	-46.8	173.6	-179.1	0	0	0	0	110.5	T192 K196 F197 H198	T192-V194 VanDerWaalsContact C-N 3.28Å; T192-V194 PolarHBondContact O-N 2.82Å; V194-K196 VanDerWaalsContact C-N 3.34Å; V194-K196 PolarHBondContact O-N 3.34Å; V194-F197 WeakPolarHBondContact O-CB 3.45Å; V194-F197 PolarHBondContact O-N 3.41Å; V194-F197 VanDerWaalsContact O-N 3.15Å; V194-H198 PolarHBondContact O-CD2 2.8Å; V194-H198 PolarHBondContact O-N 3.36Å
195	G	83.9	Confident	86	Confident	8 Å²	8	58.6 Å²	58.6	8%	0.082	27%	0.272	C	S	.	.	H	α-helix	trans	-59.2	-42.3	174.2	0	0	0	0	0	113.1	M191 T192 F197 H198 A199	M191-G195 WeakPolarHBondContact CE-O 3.41Å; T192-G195 PolarHBondContact O-N 2.97Å; T192-G195 VanDerWaalsContact O-N 3.14Å; T192-G195 PolarHBondContact OG1-N 2.97Å; G195-F197 VanDerWaalsContact C-N 3.32Å; G195-F197 PolarHBondContact O-N 3.41Å; G195-H198 PolarHBondContact O-N 3.14Å; G195-A199 WeakPolarHBondContact O-CB 3.45Å; G195-A199 PolarHBondContact O-N 3.06Å
196	K	87.1	Confident	85.9	Confident	53 Å²	53	58.1 Å²	58.1	23%	0.23	27%	0.271	C	S	.	.	H	α-helix	trans	-63	-37.4	175.7	-72	169.8	172	150.5	0	112.3	Y188 H189 M191 T192 P193 V194 A199 K200	Y188-K196 HydrophobicContact CD2-CG 4.33Å; Y188-K196 HydrophobicContact CE1-CG 4.43Å; Y188-K196 HydrophobicContact CE2-CB 4.05Å; Y188-K196 HydrophobicContact CE2-CG 3.83Å; Y188-K196 WeakPolarHBondContact O-CE 3.26Å; H189-K196 WeakPolarHBondContact O-CE 3.46Å; H189-K196 PolarHBondContact O-NZ 2.98Å; M191-K196 HydrophobicContact CB-CG 4.05Å; M191-K196 HydrophobicContact CG-CG 4.3Å; M191-K196 VanDerWaalsContact O-CE 3.23Å; M191-K196 WeakPolarHBondContact O-CE 3.4Å; M191-K196 PolarHBondContact O-NZ 3.18Å; M191-K196 HydrophobicContact SD-CG 4.24Å; T192-K196 WeakPolarHBondContact O-CG 3.33Å; T192-K196 PolarHBondContact O-N 3.25Å; P193-K196 PolarHBondContact O-N 3.06Å; V194-K196 VanDerWaalsContact C-N 3.34Å; V194-K196 PolarHBondContact O-N 3.34Å; K196-A199 PolarHBondContact O-N 3.47Å; K196-K200 PolarHBondContact O-N 3Å; K196-K200 VanDerWaalsContact O-N 3.14Å
197	F	87.1	Confident	85.9	Confident	69 Å²	69	60 Å²	60	30%	0.303	28%	0.281	S	S	.	.	H	α-helix	trans	-63	-44.8	173	175.5	-102.4	0	0	0	111.2	P193 V194 G195 A199 R201 R202	P193-F197 PolarHBondContact O-N 2.93Å; V194-F197 WeakPolarHBondContact O-CB 3.45Å; V194-F197 PolarHBondContact O-N 3.41Å; V194-F197 VanDerWaalsContact O-N 3.15Å; G195-F197 VanDerWaalsContact C-N 3.32Å; G195-F197 PolarHBondContact O-N 3.41Å; F197-A199 PolarHBondContact O-N 2.92Å; F197-R201 WeakPolarHBondContact O-CA 3.26Å; F197-R201 PolarHBondContact O-N 3.1Å; F197-R202 WeakPolarHBondContact CD2-O 3.31Å
198	H	86.4	Confident	86	Confident	68 Å²	68	64.3 Å²	64.3	32%	0.315	30%	0.301	S	S	.	.	H	α-helix	trans	-62.8	-41.9	174.5	-70.3	-70	0	0	0	112.7	V194 G195 K200 P752	V194-H198 PolarHBondContact O-CD2 2.8Å; V194-H198 PolarHBondContact O-N 3.36Å; G195-H198 PolarHBondContact O-N 3.14Å; H198-K200 PolarHBondContact O-N 3.3Å; H198-P752 CarbonylContact C-O 3.58Å; H198-P752 HydrophobicContact CB-CB 4.43Å
199	A	85.2	Confident	86.1	Confident	6 Å²	6	62.6 Å²	62.6	5%	0.05	30%	0.296	C	S	.	.	H	α-helix	trans	-70	-29.2	-175.8	0	0	0	0	0	115.1	Y188 M191 G195 K196 F197 P752 F757	Y188-A199 HydrophobicContact CD2-CB 4.31Å; Y188-A199 HydrophobicContact CE2-CB 4.24Å; M191-A199 HydrophobicContact SD-CB 4.34Å; G195-A199 WeakPolarHBondContact O-CB 3.45Å; G195-A199 PolarHBondContact O-N 3.06Å; K196-A199 PolarHBondContact O-N 3.47Å; F197-A199 PolarHBondContact O-N 2.92Å; A199-P752 WeakPolarHBondContact CA-O 3.48Å; A199-P752 PolarHBondContact N-O 3.49Å; A199-F757 HydrophobicContact CB-CB 4.25Å; A199-F757 HydrophobicContact CB-CD2 3.86Å; A199-F757 HydrophobicContact CB-CE2 4.48Å; A199-F757 HydrophobicContact CB-CG 4.17Å
200	K	86	Confident	86.3	Confident	34 Å²	34	61.2 Å²	61.2	15%	0.148	29%	0.289	C	S	.	.	H	α-helix	trans	-129.4	-3.2	-177.4	-64.4	-165.7	179.9	-165	0	115.5	Y188 K196 H198 R202 F757 D761	Y188-K200 HydrophobicContact CE2-CD 3.78Å; Y188-K200 HydrophobicContact CE2-CG 3.88Å; K196-K200 PolarHBondContact O-N 3Å; K196-K200 VanDerWaalsContact O-N 3.14Å; H198-K200 PolarHBondContact O-N 3.3Å; K200-R202 HydrophobicContact CB-CG 4.25Å; K200-R202 PolarHBondContact O-N 2.75Å; K200-R202 VanDerWaalsContact O-N 3.12Å; K200-F757 WeakPolarHBondContact CE-O 3.37Å; K200-F757 PolarHBondContact NZ-O 3.29Å; K200-D761 IonicContact NZ-OD1 3.78Å; K200-D761 PolarHBondContact NZ-OD1 2.88Å; K200-D761 IonicContact NZ-OD2 2.81Å; K200-D761 PolarHBondContact NZ-OD2 3.08Å
201	R	84	Confident	86.5	Confident	172 Å²	172	65.5 Å²	65.5	65%	0.649	31%	0.312	S	S	*	.			trans	51.1	28.2	-174.4	-59	-63.2	-171.7	154.5	5.5	114.3	F197	F197-R201 WeakPolarHBondContact O-CA 3.26Å; F197-R201 PolarHBondContact O-N 3.1Å
202	R	83.7	Confident	87	Confident	151 Å²	151	67.5 Å²	67.5	57%	0.57	32%	0.322	S	S	*	.			trans	-96.6	122.4	175.7	-64.1	-172.3	-171.3	148.6	13.3	110.2	F197 K200 D761	F197-R202 WeakPolarHBondContact CD2-O 3.31Å; K200-R202 HydrophobicContact CB-CG 4.25Å; K200-R202 PolarHBondContact O-N 2.75Å; K200-R202 VanDerWaalsContact O-N 3.12Å; R202-D761 IonicContact CZ-OD2 3.84Å; R202-D761 IonicContact NH1-OD2 3.63Å; R202-D761 PolarHBondContact NH1-OD2 3.41Å; R202-D761 IonicContact NH2-OD2 2.67Å; R202-D761 PolarHBondContact NH2-OD2 2.68Å
203	I	84.2	Confident	87.4	Confident	105 Å²	105	65 Å²	65	54%	0.538	31%	0.307	S	S	.	.			trans	-54.9	131.6	-178.9	-60.8	171.8	0	0	0	110.4	F205	I203-F205 HydrophobicContact CB-CD2 4.22Å; I203-F205 HydrophobicContact CB-CE2 3.94Å; I203-F205 HydrophobicContact CB-CZ 4.32Å; I203-F205 HydrophobicContact CG2-CD2 4.37Å; I203-F205 HydrophobicContact CG2-CE2 4.32Å; I203-F205 HydrophobicContact CG2-CZ 4.42Å; I203-F205 WeakPolarHBondContact O-CD2 3.49Å; I203-F205 PolarHBondContact O-N 2.94Å
204	P	86.1	Confident	87.9	Confident	48 Å²	48	64.5 Å²	64.5	31%	0.312	30%	0.303	S	S	.	.			trans	-78.7	66.9	-179.7	33.8	-36.6	0	0	0	111.4	K206 L207 F208	P204-K206 PolarHBondContact O-N 3.17Å; P204-L207 HydrophobicContact CB-CB 4.29Å; P204-L207 WeakPolarHBondContact O-CB 3.27Å; P204-L207 PolarHBondContact O-N 3.27Å; P204-F208 PolarHBondContact O-N 3.39Å
205	F	86.9	Confident	88.5	Confident	129 Å²	129	65.1 Å²	65.1	57%	0.566	30%	0.303	S	S	*	.	H	α-helix	trans	-48	-37.1	-177.7	-75.7	-80.3	0	0	0	114.1	I203 L207 F208 V209	I203-F205 HydrophobicContact CB-CD2 4.22Å; I203-F205 HydrophobicContact CB-CE2 3.94Å; I203-F205 HydrophobicContact CB-CZ 4.32Å; I203-F205 HydrophobicContact CG2-CD2 4.37Å; I203-F205 HydrophobicContact CG2-CE2 4.32Å; I203-F205 HydrophobicContact CG2-CZ 4.42Å; I203-F205 WeakPolarHBondContact O-CD2 3.49Å; I203-F205 PolarHBondContact O-N 2.94Å; F205-L207 VanDerWaalsContact C-N 3.31Å; F205-L207 PolarHBondContact O-N 3.12Å; F205-F208 PolarHBondContact O-N 3.37Å; F205-V209 WeakPolarHBondContact O-CG2 3.46Å; F205-V209 PolarHBondContact O-N 2.73Å
206	K	89	Confident	88.9	Confident	49 Å²	49	66.3 Å²	66.3	21%	0.213	31%	0.307	C	S	.	.	H	α-helix	trans	-57.7	-40.5	175.4	-171.2	-176.7	-176.2	-173.8	0	112.4	P204 Q210 C521 S524	P204-K206 PolarHBondContact O-N 3.17Å; K206-Q210 WeakPolarHBondContact O-CG 3.38Å; K206-Q210 PolarHBondContact O-N 2.99Å; K206-C521 WeakPolarHBondContact CE-SG 3.24Å; K206-S524 PolarHBondContact NZ-OG 3.39Å
207	L	88.3	Confident	89.2	Confident	39 Å²	39	64 Å²	64	20%	0.204	30%	0.298	C	S	.	.	H	α-helix	trans	-70.3	-43.4	178.8	-178.4	61.7	0	0	0	111	P204 F205 Q210 I211 Y608 F611	P204-L207 HydrophobicContact CB-CB 4.29Å; P204-L207 WeakPolarHBondContact O-CB 3.27Å; P204-L207 PolarHBondContact O-N 3.27Å; F205-L207 VanDerWaalsContact C-N 3.31Å; F205-L207 PolarHBondContact O-N 3.12Å; L207-Q210 PolarHBondContact O-N 3.22Å; L207-I211 HydrophobicContact CD1-CD1 4.27Å; L207-I211 HydrophobicContact CG-CD1 4.06Å; L207-I211 WeakPolarHBondContact O-CG1 3.4Å; L207-I211 PolarHBondContact O-N 3.3Å; L207-Y608 HydrophobicContact CD1-CD1 3.43Å; L207-Y608 VanDerWaalsContact CD1-CD1 3.43Å; L207-Y608 HydrophobicContact CD1-CE1 3.71Å; L207-Y608 HydrophobicContact CD1-CG 3.92Å; L207-F611 HydrophobicContact CD1-CE2 4.32Å
208	F	89.9	Confident	89.6	Confident	132 Å²	132	62 Å²	62	58%	0.579	29%	0.291	S	S	*	.	H	α-helix	trans	-60	-48.6	178	179.3	-98	0	0	0	112.3	P204 F205 Q210 I211 L212	P204-F208 PolarHBondContact O-N 3.39Å; F205-F208 PolarHBondContact O-N 3.37Å; F208-Q210 PolarHBondContact O-N 3.11Å; F208-I211 PolarHBondContact O-N 3.37Å; F208-L212 HydrophobicContact CE1-CD2 4.26Å; F208-L212 WeakPolarHBondContact O-CB 3.36Å; F208-L212 PolarHBondContact O-N 3.22Å
209	V	92.3	Very high	89.9	Confident	16 Å²	16	62.2 Å²	62.2	10%	0.097	29%	0.294	C	S	.	.	H	α-helix	trans	-57.4	-37.7	176	169.2	0	0	0	0	111.4	F205 K213 L513 I516 L520	F205-V209 WeakPolarHBondContact O-CG2 3.46Å; F205-V209 PolarHBondContact O-N 2.73Å; V209-K213 VanDerWaalsContact O-CB 3.23Å; V209-K213 WeakPolarHBondContact O-CB 3.35Å; V209-K213 PolarHBondContact O-N 3.1Å; V209-L513 HydrophobicContact CG1-CD2 4.3Å; V209-I516 HydrophobicContact CG1-CG2 4.16Å; V209-I516 HydrophobicContact CG2-CG2 4.16Å; V209-L520 HydrophobicContact CB-CD1 4.47Å; V209-L520 HydrophobicContact CG2-CD1 4.17Å
210	Q	92.2	Very high	90.2	Very high	4 Å²	4	62 Å²	62	2%	0.019	29%	0.292	C	S	.	.	H	α-helix	trans	-73.7	-39.4	-177.8	-64.9	-83.4	-6.8	0	0	112.3	K206 L207 F208 K213 V214 S517 Y608	K206-Q210 WeakPolarHBondContact O-CG 3.38Å; K206-Q210 PolarHBondContact O-N 2.99Å; L207-Q210 PolarHBondContact O-N 3.22Å; F208-Q210 PolarHBondContact O-N 3.11Å; Q210-K213 PolarHBondContact O-N 2.71Å; Q210-V214 VanDerWaalsContact O-CG2 3.28Å; Q210-V214 WeakPolarHBondContact O-CG2 3.46Å; Q210-V214 PolarHBondContact O-N 3.16Å; Q210-S517 PolarHBondContact NE2-OG 3.09Å; Q210-Y608 HydrophobicContact CB-CE2 4.04Å; Q210-Y608 VanDerWaalsContact CB-OH 3.3Å; Q210-Y608 WeakPolarHBondContact CB-OH 3.23Å; Q210-Y608 VanDerWaalsContact CD-OH 3.3Å; Q210-Y608 WeakPolarHBondContact CG-OH 3.28Å; Q210-Y608 PolarHBondContact OE1-OH 2.97Å
211	I	91.4	Very high	90.5	Very high	102 Å²	102	63 Å²	63	52%	0.523	30%	0.299	S	S	.	.	H	α-helix	trans	-63.5	-45.4	173.1	-66.2	167.3	0	0	0	110.2	L207 F208 K213 V214 L215	L207-I211 HydrophobicContact CD1-CD1 4.27Å; L207-I211 HydrophobicContact CG-CD1 4.06Å; L207-I211 WeakPolarHBondContact O-CG1 3.4Å; L207-I211 PolarHBondContact O-N 3.3Å; F208-I211 PolarHBondContact O-N 3.37Å; I211-K213 VanDerWaalsContact C-N 3.33Å; I211-K213 PolarHBondContact O-N 2.76Å; I211-V214 PolarHBondContact O-N 3.4Å; I211-L215 PolarHBondContact O-N 3.4Å; I211-L215 VanDerWaalsContact O-N 3.12Å
212	L	93	Very high	90.9	Very high	61 Å²	61	59 Å²	59	32%	0.319	29%	0.289	S	S	.	.	H	α-helix	trans	-64	-38	177.5	-175.8	60.4	0	0	0	112.1	F208 L215 L216 L513	F208-L212 HydrophobicContact CE1-CD2 4.26Å; F208-L212 WeakPolarHBondContact O-CB 3.36Å; F208-L212 PolarHBondContact O-N 3.22Å; L212-L215 PolarHBondContact O-N 2.96Å; L212-L216 HydrophobicContact CD1-CD1 3.92Å; L212-L216 HydrophobicContact CD1-CG 4.42Å; L212-L216 HydrophobicContact CG-CD1 4.02Å; L212-L216 PolarHBondContact O-N 3.42Å; L212-L513 HydrophobicContact CD2-CD1 3.99Å; L212-L513 HydrophobicContact CD2-CD2 4.04Å; L212-L513 HydrophobicContact CG-CD1 3.82Å
213	K	93.6	Very high	91	Very high	4 Å²	4	53 Å²	53	2%	0.017	27%	0.268	C	S	.	.	H	α-helix	trans	-62.4	-45.1	173.6	-169.8	-167.3	82.1	-174.3	0	111.9	V209 Q210 I211 L215 L216 V217 D566 I569	V209-K213 VanDerWaalsContact O-CB 3.23Å; V209-K213 WeakPolarHBondContact O-CB 3.35Å; V209-K213 PolarHBondContact O-N 3.1Å; Q210-K213 PolarHBondContact O-N 2.71Å; I211-K213 VanDerWaalsContact C-N 3.33Å; I211-K213 PolarHBondContact O-N 2.76Å; K213-L215 VanDerWaalsContact C-N 3.33Å; K213-L215 PolarHBondContact O-N 3.39Å; K213-L216 PolarHBondContact O-N 2.93Å; K213-V217 HydrophobicContact CG-CG2 4.23Å; K213-V217 WeakPolarHBondContact O-CB 3.43Å; K213-V217 VanDerWaalsContact O-CG2 3.3Å; K213-V217 WeakPolarHBondContact O-CG2 3.4Å; K213-V217 PolarHBondContact O-N 2.96Å; K213-D566 WeakPolarHBondContact CD-OD1 3.49Å; K213-D566 IonicContact NZ-OD1 3.55Å; K213-D566 PolarHBondContact NZ-OD1 3.37Å; K213-I569 HydrophobicContact CD-CD1 3.82Å; K213-I569 HydrophobicContact CG-CD1 4.28Å
214	V	93.8	Very high	91.1	Very high	22 Å²	22	49 Å²	49	13%	0.133	25%	0.246	C	C	.	.	H	α-helix	trans	-56	-49.4	175.8	168	0	0	0	0	110.7	Q210 I211 T218 V601 W602 I605	Q210-V214 VanDerWaalsContact O-CG2 3.28Å; Q210-V214 WeakPolarHBondContact O-CG2 3.46Å; Q210-V214 PolarHBondContact O-N 3.16Å; I211-V214 PolarHBondContact O-N 3.4Å; V214-T218 WeakPolarHBondContact O-CB 3.35Å; V214-T218 PolarHBondContact O-N 3.15Å; V214-T218 VanDerWaalsContact O-N 3.09Å; V214-T218 PolarHBondContact O-OG1 3.36Å; V214-V601 HydrophobicContact CB-CG1 3.98Å; V214-V601 HydrophobicContact CG1-CG1 4.21Å; V214-V601 HydrophobicContact CG2-CG1 3.6Å; V214-W602 HydrophobicContact CG1-CZ2 4.45Å; V214-I605 HydrophobicContact CG1-CD1 3.69Å; V214-I605 HydrophobicContact CG1-CG1 4.4Å; V214-I605 HydrophobicContact CG2-CD1 4.17Å; V214-I605 HydrophobicContact CG2-CG1 3.95Å
215	L	93.7	Very high	91.3	Very high	96 Å²	96	48.3 Å²	48.3	50%	0.503	25%	0.248	S	C	.	.	H	α-helix	trans	-62.1	-50.3	-179.2	-178.5	147.1	0	0	0	111.6	I211 L212 K213 T218 I219	I211-L215 PolarHBondContact O-N 3.4Å; I211-L215 VanDerWaalsContact O-N 3.12Å; L212-L215 PolarHBondContact O-N 2.96Å; K213-L215 VanDerWaalsContact C-N 3.33Å; K213-L215 PolarHBondContact O-N 3.39Å; L215-T218 PolarHBondContact O-N 3.45Å; L215-I219 HydrophobicContact CD2-CD1 3.55Å; L215-I219 HydrophobicContact CG-CD1 4.23Å; L215-I219 WeakPolarHBondContact O-CG1 3.27Å; L215-I219 PolarHBondContact O-N 3.06Å
216	L	92.8	Very high	91.2	Very high	32 Å²	32	47.8 Å²	47.8	17%	0.168	25%	0.246	C	C	.	.	H	α-helix	trans	-72.1	-37.6	-175.4	-76.7	166.2	0	0	0	113.6	L212 K213 T218 I219 Q220 C509 T510 L513	L212-L216 HydrophobicContact CD1-CD1 3.92Å; L212-L216 HydrophobicContact CD1-CG 4.42Å; L212-L216 HydrophobicContact CG-CD1 4.02Å; L212-L216 PolarHBondContact O-N 3.42Å; K213-L216 PolarHBondContact O-N 2.93Å; L216-T218 VanDerWaalsContact C-N 3.27Å; L216-T218 PolarHBondContact O-N 3.01Å; L216-I219 PolarHBondContact O-N 3.25Å; L216-Q220 WeakPolarHBondContact O-CB 3.26Å; L216-Q220 PolarHBondContact O-N 3.43Å; L216-C509 HydrophobicContact CD1-CB 4.41Å; L216-T510 HydrophobicContact CB-CG2 3.76Å; L216-L513 HydrophobicContact CD1-CD1 3.35Å
217	V	94.6	Very high	90.8	Very high	4 Å²	4	46.7 Å²	46.7	2%	0.024	24%	0.24	C	C	.	.	H	α-helix	trans	-65.1	-33.9	172.8	173.6	0	0	0	0	111.1	K213 L221 T510 I569 V601	K213-V217 HydrophobicContact CG-CG2 4.23Å; K213-V217 WeakPolarHBondContact O-CB 3.43Å; K213-V217 VanDerWaalsContact O-CG2 3.3Å; K213-V217 WeakPolarHBondContact O-CG2 3.4Å; K213-V217 PolarHBondContact O-N 2.96Å; V217-L221 WeakPolarHBondContact O-CB 3.33Å; V217-L221 PolarHBondContact O-N 2.81Å; V217-T510 HydrophobicContact CG2-CG2 4.13Å; V217-I569 HydrophobicContact CG2-CD1 4.14Å; V217-I569 HydrophobicContact CG2-CG1 4.29Å; V217-I569 HydrophobicContact CG2-CG2 3.96Å; V217-V601 HydrophobicContact CG1-CG2 4.2Å
218	T	94.8	Very high	90.6	Very high	28 Å²	28	46.1 Å²	46.1	17%	0.172	24%	0.235	C	C	.	.	H	α-helix	trans	-69.2	-41.1	174.9	-56.1	0	0	0	0	111.5	V214 L215 L216 L221 I222 W602	V214-T218 WeakPolarHBondContact O-CB 3.35Å; V214-T218 PolarHBondContact O-N 3.15Å; V214-T218 VanDerWaalsContact O-N 3.09Å; V214-T218 PolarHBondContact O-OG1 3.36Å; L215-T218 PolarHBondContact O-N 3.45Å; L216-T218 VanDerWaalsContact C-N 3.27Å; L216-T218 PolarHBondContact O-N 3.01Å; T218-L221 PolarHBondContact O-N 3.37Å; T218-I222 HydrophobicContact CG2-CD1 3.91Å; T218-I222 VanDerWaalsContact O-CG1 3.25Å; T218-I222 WeakPolarHBondContact O-CG1 3.49Å; T218-I222 PolarHBondContact O-N 2.93Å; T218-W602 HydrophobicContact CG2-CZ2 4.24Å; T218-W602 PolarHBondContact OG1-NE1 2.81Å; T218-W602 VanDerWaalsContact OG1-NE1 3.16Å
219	I	92.2	Very high	90.5	Very high	72 Å²	72	42.7 Å²	42.7	37%	0.369	23%	0.232	S	C	.	.	H	α-helix	trans	-63	-44	174.3	-68.3	172.3	0	0	0	111.1	L215 L216 L221 I222 E223 I506	L215-I219 HydrophobicContact CD2-CD1 3.55Å; L215-I219 HydrophobicContact CG-CD1 4.23Å; L215-I219 WeakPolarHBondContact O-CG1 3.27Å; L215-I219 PolarHBondContact O-N 3.06Å; L216-I219 PolarHBondContact O-N 3.25Å; I219-L221 PolarHBondContact O-N 2.99Å; I219-I222 PolarHBondContact O-N 2.79Å; I219-E223 PolarHBondContact O-N 3.3Å; I219-I506 HydrophobicContact CG2-CD1 4.03Å
220	Q	92.5	Very high	90	Very high	3 Å²	3	42.8 Å²	42.8	1%	0.014	23%	0.234	C	C	.	.	H	α-helix	trans	-57.1	-47	175.3	-171	-174.9	17.4	0	0	111.6	L216 F224 I506 D507 T510 M594	L216-Q220 WeakPolarHBondContact O-CB 3.26Å; L216-Q220 PolarHBondContact O-N 3.43Å; Q220-F224 WeakPolarHBondContact O-CB 3.33Å; Q220-F224 PolarHBondContact O-N 3.34Å; Q220-I506 HydrophobicContact CB-CG2 3.79Å; Q220-I506 HydrophobicContact CG-CG2 4.15Å; Q220-D507 WeakPolarHBondContact CG-OD1 3.3Å; Q220-D507 PolarHBondContact NE2-OD1 3.01Å; Q220-T510 HydrophobicContact CB-CG2 4.3Å; Q220-T510 PolarHBondContact NE2-OG1 3Å; Q220-T510 PolarHBondContact OE1-OG1 3.12Å; Q220-T510 VanDerWaalsContact OE1-OG1 3.1Å; Q220-M594 HydrophobicContact CG-SD 3.81Å
221	L	92.7	Very high	89.5	Confident	54 Å²	54	42.8 Å²	42.8	28%	0.283	23%	0.234	S	C	.	.	H	α-helix	trans	-62.2	-42.9	175.6	179.8	73.9	0	0	0	112.2	V217 T218 I219 G225 M594 A598	V217-L221 WeakPolarHBondContact O-CB 3.33Å; V217-L221 PolarHBondContact O-N 2.81Å; T218-L221 PolarHBondContact O-N 3.37Å; I219-L221 PolarHBondContact O-N 2.99Å; L221-G225 WeakPolarHBondContact O-CA 3.45Å; L221-G225 PolarHBondContact O-N 3.19Å; L221-M594 HydrophobicContact CB-CG 4.45Å; L221-M594 HydrophobicContact CD1-CB 4.41Å; L221-M594 HydrophobicContact CD1-CG 3.77Å; L221-A598 HydrophobicContact CD2-CB 3.63Å; L221-A598 HydrophobicContact CG-CB 4.47Å
222	I	91.2	Very high	89.2	Confident	89 Å²	89	39.6 Å²	39.6	46%	0.456	22%	0.219	S	C	.	.	H	α-helix	trans	-64.8	-45.2	-177.7	-72	166.3	0	0	0	110.9	T218 I219 G225 F226	T218-I222 HydrophobicContact CG2-CD1 3.91Å; T218-I222 VanDerWaalsContact O-CG1 3.25Å; T218-I222 WeakPolarHBondContact O-CG1 3.49Å; T218-I222 PolarHBondContact O-N 2.93Å; I219-I222 PolarHBondContact O-N 2.79Å; I222-G225 PolarHBondContact O-N 2.85Å; I222-F226 HydrophobicContact CG2-CD2 3.83Å; I222-F226 HydrophobicContact CG2-CE2 3.57Å; I222-F226 VanDerWaalsContact O-CD2 3.22Å; I222-F226 WeakPolarHBondContact O-CD2 3.28Å; I222-F226 PolarHBondContact O-N 2.9Å
223	E	85.5	Confident	89	Confident	24 Å²	24	40 Å²	40	11%	0.112	23%	0.227	C	C	.	.	H	α-helix	trans	-63.5	-49.6	-179.5	-170.6	-86.1	154.1	0	0	111.6	I219 G225 F226 Y227 R499 V503	I219-E223 PolarHBondContact O-N 3.3Å; E223-G225 VanDerWaalsContact C-N 3.31Å; E223-G225 PolarHBondContact O-N 3.23Å; E223-F226 PolarHBondContact O-N 3.33Å; E223-Y227 PolarHBondContact O-N 3.36Å; E223-R499 IonicContact OE1-NE 3.14Å; E223-V503 VanDerWaalsContact OE1-CG2 3.23Å; E223-V503 WeakPolarHBondContact OE1-CG2 3.46Å; E223-V503 WeakPolarHBondContact OE2-CG2 3.4Å
224	F	87.2	Confident	88.7	Confident	21 Å²	21	42 Å²	42	9%	0.092	24%	0.235	C	C	.	.	H	α-helix	trans	-62.6	-36.7	173	176.1	-98.3	0	0	0	112.8	Q220 Y227 R228 Y587 L590 T591 M594	Q220-F224 WeakPolarHBondContact O-CB 3.33Å; Q220-F224 PolarHBondContact O-N 3.34Å; F224-Y227 PolarHBondContact O-N 3.37Å; F224-R228 HydrophobicContact CD1-CG 3.86Å; F224-R228 HydrophobicContact CD2-CG 4.07Å; F224-R228 HydrophobicContact CE1-CG 3.48Å; F224-R228 VanDerWaalsContact CE1-CG 3.48Å; F224-R228 HydrophobicContact CE2-CG 3.69Å; F224-R228 HydrophobicContact CG-CG 4.16Å; F224-R228 HydrophobicContact CZ-CG 3.39Å; F224-R228 WeakPolarHBondContact O-CB 3.39Å; F224-R228 WeakPolarHBondContact O-CG 3.4Å; F224-R228 PolarHBondContact O-N 3Å; F224-Y587 HydrophobicContact CE2-CD1 4.42Å; F224-L590 HydrophobicContact CD2-CD2 4.45Å; F224-L590 HydrophobicContact CE2-CD2 3.65Å; F224-L590 HydrophobicContact CE2-CG 3.97Å; F224-L590 HydrophobicContact CZ-CB 4.49Å; F224-L590 HydrophobicContact CZ-CD2 4.11Å; F224-L590 HydrophobicContact CZ-CG 3.93Å; F224-T591 HydrophobicContact CE1-CG2 4.36Å; F224-M594 HydrophobicContact CB-CE 3.37Å; F224-M594 HydrophobicContact CD1-CE 3.36Å; F224-M594 HydrophobicContact CD2-CE 3.72Å; F224-M594 HydrophobicContact CE1-CE 3.95Å; F224-M594 HydrophobicContact CE2-CE 4.28Å; F224-M594 HydrophobicContact CG-CE 3.2Å; F224-M594 HydrophobicContact CZ-CE 4.37Å
225	G	88.9	Confident	88.4	Confident	33 Å²	33	41 Å²	41	34%	0.34	23%	0.23	S	C	.	.	H	α-helix	trans	-62.6	-44.1	-179.6	0	0	0	0	0	112.3	L221 I222 E223 A229	L221-G225 WeakPolarHBondContact O-CA 3.45Å; L221-G225 PolarHBondContact O-N 3.19Å; I222-G225 PolarHBondContact O-N 2.85Å; E223-G225 VanDerWaalsContact C-N 3.31Å; E223-G225 PolarHBondContact O-N 3.23Å; G225-A229 WeakPolarHBondContact O-CB 3.41Å; G225-A229 PolarHBondContact O-N 2.98Å
226	F	85.9	Confident	88.2	Confident	119 Å²	119	39.4 Å²	39.4	52%	0.522	22%	0.222	S	C	.	.	H	α-helix	trans	-60.6	-52.2	172.3	-79.6	-63.6	0	0	0	111.6	I222 E223 R228 A229 A230	I222-F226 HydrophobicContact CG2-CD2 3.83Å; I222-F226 HydrophobicContact CG2-CE2 3.57Å; I222-F226 VanDerWaalsContact O-CD2 3.22Å; I222-F226 WeakPolarHBondContact O-CD2 3.28Å; I222-F226 PolarHBondContact O-N 2.9Å; E223-F226 PolarHBondContact O-N 3.33Å; F226-R228 PolarHBondContact O-N 3.4Å; F226-A229 PolarHBondContact O-N 3.13Å; F226-A229 VanDerWaalsContact O-N 3.16Å; F226-A230 WeakPolarHBondContact O-CB 3.31Å; F226-A230 PolarHBondContact O-N 3.13Å
227	Y	80.7	Confident	88.1	Confident	25 Å²	25	42.4 Å²	42.4	10%	0.098	24%	0.241	C	C	.	.	H	α-helix	trans	-57.2	-44.4	179.8	169.3	-112.3	0	0	0	112.9	E223 F224 H231 D388 E394 Y587	E223-Y227 PolarHBondContact O-N 3.36Å; F224-Y227 PolarHBondContact O-N 3.37Å; Y227-H231 WeakPolarHBondContact O-CB 3.28Å; Y227-H231 PolarHBondContact O-N 3.03Å; Y227-D388 WeakPolarHBondContact CD2-OD2 3.12Å; Y227-E394 WeakPolarHBondContact CE2-OE1 3.29Å; Y227-Y587 HydrophobicContact CE1-CE1 4.25Å; Y227-Y587 PolarHBondContact OH-OH 3.15Å
228	R	84.4	Confident	88	Confident	27 Å²	27	42.3 Å²	42.3	10%	0.102	24%	0.241	C	C	.	.	H	α-helix	trans	-68.7	-39.8	176.6	-70.4	-61.2	-63.8	145.1	5.1	112.5	F224 F226 H231 V232	F224-R228 HydrophobicContact CD1-CG 3.86Å; F224-R228 HydrophobicContact CD2-CG 4.07Å; F224-R228 HydrophobicContact CE1-CG 3.48Å; F224-R228 VanDerWaalsContact CE1-CG 3.48Å; F224-R228 HydrophobicContact CE2-CG 3.69Å; F224-R228 HydrophobicContact CG-CG 4.16Å; F224-R228 HydrophobicContact CZ-CG 3.39Å; F224-R228 WeakPolarHBondContact O-CB 3.39Å; F224-R228 WeakPolarHBondContact O-CG 3.4Å; F224-R228 PolarHBondContact O-N 3Å; F226-R228 PolarHBondContact O-N 3.4Å; R228-H231 PolarHBondContact O-N 2.78Å; R228-V232 WeakPolarHBondContact O-CB 3.06Å; R228-V232 VanDerWaalsContact O-CG2 3.31Å; R228-V232 WeakPolarHBondContact O-CG2 3.01Å; R228-V232 PolarHBondContact O-N 2.62Å
229	A	86.2	Confident	87.9	Confident	61 Å²	61	43.7 Å²	43.7	50%	0.504	25%	0.245	S	C	.	.	H	α-helix	trans	-63.7	-42.6	177.6	0	0	0	0	0	111.5	G225 F226 S233	G225-A229 WeakPolarHBondContact O-CB 3.41Å; G225-A229 PolarHBondContact O-N 2.98Å; F226-A229 PolarHBondContact O-N 3.13Å; F226-A229 VanDerWaalsContact O-N 3.16Å; A229-S233 WeakPolarHBondContact O-CB 3.49Å; A229-S233 PolarHBondContact O-N 3Å
230	A	83.1	Confident	87.9	Confident	17 Å²	17	44.4 Å²	44.4	14%	0.14	25%	0.246	C	C	.	.	H	α-helix	trans	-60.9	-49.8	174.6	0	0	0	0	0	112.3	F226 V232 S233 F234 L387 D388	F226-A230 WeakPolarHBondContact O-CB 3.31Å; F226-A230 PolarHBondContact O-N 3.13Å; A230-V232 PolarHBondContact O-N 3.35Å; A230-S233 PolarHBondContact O-N 3.28Å; A230-F234 PolarHBondContact O-N 3.43Å; A230-L387 HydrophobicContact CB-CB 4.36Å; A230-L387 HydrophobicContact CB-CD2 4.3Å; A230-L387 HydrophobicContact CB-CG 4.04Å; A230-L387 WeakPolarHBondContact CB-O 3.36Å; A230-D388 WeakPolarHBondContact CB-OD1 3.4Å
231	H	81	Confident	87.9	Confident	5 Å²	5	46 Å²	46	2%	0.023	26%	0.259	C	S	.	.	H	α-helix	trans	-60.5	-42.9	178	-178.7	-60.5	0	0	0	112.8	Y227 R228 G235 L387 Y396 Y421	Y227-H231 WeakPolarHBondContact O-CB 3.28Å; Y227-H231 PolarHBondContact O-N 3.03Å; R228-H231 PolarHBondContact O-N 2.78Å; H231-G235 PolarHBondContact O-N 3.47Å; H231-L387 HydrophobicContact CB-CD2 4.33Å; H231-Y396 AromaticContact CD2-CE1 3.75Å; H231-Y396 AromaticContact CD2-CZ 3.93Å; H231-Y396 PolarHBondContact CD2-OH 3.33Å; H231-Y396 AromaticContact NE2-CE1 3.58Å; H231-Y421 AromaticContact CE1-CE2 3.22Å; H231-Y421 WeakPolarHBondContact CE1-CE2 3.37Å; H231-Y421 AromaticContact CE1-CZ 3.9Å; H231-Y421 AromaticContact ND1-CE2 3.43Å; H231-Y421 WeakPolarHBondContact ND1-CE2 3.14Å; H231-Y421 AromaticContact ND1-CZ 3.87Å; H231-Y421 PolarHBondContact ND1-OH 3.3Å; H231-Y421 PolarHBondContact O-OH 3.18Å
232	V	85.3	Confident	88.1	Confident	35 Å²	35	43.4 Å²	43.4	21%	0.212	25%	0.246	C	C	.	.	H	α-helix	trans	-70.1	-47.1	178.1	172.5	0	0	0	0	111.1	P57 R228 A230 F234 G235 D236	P57-V232 HydrophobicContact CB-CG1 4.37Å; P57-V232 HydrophobicContact CG-CG1 4.44Å; R228-V232 WeakPolarHBondContact O-CB 3.06Å; R228-V232 VanDerWaalsContact O-CG2 3.31Å; R228-V232 WeakPolarHBondContact O-CG2 3.01Å; R228-V232 PolarHBondContact O-N 2.62Å; A230-V232 PolarHBondContact O-N 3.35Å; V232-F234 VanDerWaalsContact C-N 3.3Å; V232-F234 PolarHBondContact O-N 3.36Å; V232-G235 WeakPolarHBondContact O-CA 3.32Å; V232-G235 PolarHBondContact O-N 3.08Å; V232-D236 WeakPolarHBondContact CG1-OD2 2.97Å; V232-D236 PolarHBondContact O-N 3.47Å
233	S	88.2	Confident	88.2	Confident	68 Å²	68	39.4 Å²	39.4	48%	0.476	23%	0.226	S	C	.	.	H	α-helix	trans	-56.5	-41.3	178	-178.3	0	0	0	0	112.6	A229 A230 D236 V237	A229-S233 WeakPolarHBondContact O-CB 3.49Å; A229-S233 PolarHBondContact O-N 3Å; A230-S233 PolarHBondContact O-N 3.28Å; S233-D236 PolarHBondContact O-N 3.23Å; S233-V237 WeakPolarHBondContact O-CB 3.24Å; S233-V237 VanDerWaalsContact O-CG2 3.32Å; S233-V237 WeakPolarHBondContact O-CG2 3.32Å; S233-V237 PolarHBondContact O-N 3.49Å
234	F	87.6	Confident	88.7	Confident	46 Å²	46	42.2 Å²	42.2	20%	0.202	24%	0.239	C	C	.	.	H	α-helix	trans	-63.4	-42.3	174.7	179.9	-99.5	0	0	0	112.4	A230 V232 S238 I384 L387 Y396 F398	A230-F234 PolarHBondContact O-N 3.43Å; V232-F234 VanDerWaalsContact C-N 3.3Å; V232-F234 PolarHBondContact O-N 3.36Å; F234-S238 WeakPolarHBondContact CZ-OG 3.08Å; F234-S238 VanDerWaalsContact O-CB 3.24Å; F234-S238 WeakPolarHBondContact O-CB 3.44Å; F234-S238 PolarHBondContact O-N 3.39Å; F234-S238 PolarHBondContact O-OG 2.97Å; F234-I384 HydrophobicContact CD1-CD1 3.89Å; F234-I384 HydrophobicContact CD2-CD1 4Å; F234-I384 HydrophobicContact CE1-CD1 3.48Å; F234-I384 VanDerWaalsContact CE1-CD1 3.48Å; F234-I384 HydrophobicContact CE2-CD1 3.61Å; F234-I384 HydrophobicContact CE2-CG1 4.25Å; F234-I384 HydrophobicContact CG-CD1 4.15Å; F234-I384 HydrophobicContact CZ-CD1 3.35Å; F234-I384 HydrophobicContact CZ-CG1 4.24Å; F234-L387 HydrophobicContact CB-CD1 3.82Å; F234-L387 HydrophobicContact CD2-CD1 4.16Å; F234-L387 HydrophobicContact CG-CD1 3.92Å; F234-Y396 AromaticContact CD1-CD2 3.57Å; F234-Y396 HydrophobicContact CD1-CD2 3.57Å; F234-Y396 AromaticContact CD1-CE2 3.69Å; F234-Y396 HydrophobicContact CD1-CE2 3.69Å; F234-Y396 AromaticContact CE1-CD2 3.45Å; F234-Y396 HydrophobicContact CE1-CD2 3.45Å; F234-Y396 VanDerWaalsContact CE1-CD2 3.45Å; F234-Y396 HydrophobicContact CE1-CE2 4.02Å; F234-Y396 HydrophobicContact CE1-CG 4.35Å; F234-F398 HydrophobicContact CD1-CZ 4.27Å; F234-F398 AromaticContact CE1-CE2 3.93Å; F234-F398 HydrophobicContact CE1-CE2 3.93Å; F234-F398 AromaticContact CE1-CZ 3.6Å; F234-F398 HydrophobicContact CE1-CZ 3.6Å; F234-F398 HydrophobicContact CZ-CE2 4.44Å; F234-F398 HydrophobicContact CZ-CZ 4.34Å
235	G	88.5	Confident	89	Confident	2 Å²	2	42.5 Å²	42.5	2%	0.021	24%	0.241	C	C	.	.	H	α-helix	trans	-60.6	-47.2	175	0	0	0	0	0	112.9	H231 V232 S238 H239	H231-G235 PolarHBondContact O-N 3.47Å; V232-G235 WeakPolarHBondContact O-CA 3.32Å; V232-G235 PolarHBondContact O-N 3.08Å; G235-S238 PolarHBondContact O-N 3.45Å; G235-H239 WeakPolarHBondContact O-CB 3.26Å; G235-H239 PolarHBondContact O-N 2.97Å
236	D	89.2	Confident	89.3	Confident	63 Å²	63	41 Å²	41	34%	0.337	23%	0.225	S	C	.	.	H	α-helix	trans	-68.3	-42	-177.2	-65.2	-19	0	0	0	112.1	V232 S233 H239 K240	V232-D236 WeakPolarHBondContact CG1-OD2 2.97Å; V232-D236 PolarHBondContact O-N 3.47Å; S233-D236 PolarHBondContact O-N 3.23Å; D236-H239 PolarHBondContact O-N 3.23Å; D236-K240 WeakPolarHBondContact O-CG 3.21Å; D236-K240 PolarHBondContact O-N 3.21Å
237	V	90.8	Very high	89.8	Confident	94 Å²	94	35.5 Å²	35.5	57%	0.57	20%	0.201	S	C	*	.	H	α-helix	trans	-66.7	-39.2	174.7	173.5	0	0	0	0	111.2	S233 K240 A241	S233-V237 WeakPolarHBondContact O-CB 3.24Å; S233-V237 VanDerWaalsContact O-CG2 3.32Å; S233-V237 WeakPolarHBondContact O-CG2 3.32Å; S233-V237 PolarHBondContact O-N 3.49Å; V237-K240 PolarHBondContact O-N 3.47Å; V237-A241 PolarHBondContact O-N 2.98Å
238	S	92	Very high	90.4	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-64.2	-42.1	174.4	-58.2	0	0	0	0	111.3	F234 G235 K240 A241 F242 Y296 F398	F234-S238 WeakPolarHBondContact CZ-OG 3.08Å; F234-S238 VanDerWaalsContact O-CB 3.24Å; F234-S238 WeakPolarHBondContact O-CB 3.44Å; F234-S238 PolarHBondContact O-N 3.39Å; F234-S238 PolarHBondContact O-OG 2.97Å; G235-S238 PolarHBondContact O-N 3.45Å; S238-K240 PolarHBondContact O-N 3.42Å; S238-A241 WeakPolarHBondContact O-CB 3.38Å; S238-A241 PolarHBondContact O-N 3.44Å; S238-F242 WeakPolarHBondContact O-CD2 3.41Å; S238-F242 WeakPolarHBondContact O-CG 3.47Å; S238-F242 PolarHBondContact O-N 3.35Å; S238-Y296 PolarHBondContact OG-OH 3.38Å; S238-F398 VanDerWaalsContact CB-CZ 3.45Å; S238-F398 WeakPolarHBondContact OG-CZ 3.38Å
239	H	92.8	Very high	90.7	Very high	56 Å²	56	43.4 Å²	43.4	26%	0.259	24%	0.238	S	C	.	.	H	α-helix	trans	-59.1	-46.6	175.9	174.6	42.5	0	0	0	112.1	G235 D236 A241 F242 C243 L417 A419	G235-H239 WeakPolarHBondContact O-CB 3.26Å; G235-H239 PolarHBondContact O-N 2.97Å; D236-H239 PolarHBondContact O-N 3.23Å; H239-A241 VanDerWaalsContact C-N 3.35Å; H239-A241 PolarHBondContact O-N 2.74Å; H239-F242 PolarHBondContact O-N 3.38Å; H239-F242 VanDerWaalsContact O-N 3.16Å; H239-C243 VanDerWaalsContact CE1-SG 3.55Å; H239-C243 PolarHBondContact O-N 3.15Å; H239-C243 PolarHBondContact O-SG 3.41Å; H239-L417 PolarHBondContact CE1-O 2.84Å; H239-L417 VanDerWaalsContact ND1-CD2 3.34Å; H239-L417 WeakPolarHBondContact ND1-CD2 3.47Å; H239-A419 HydrophobicContact CB-CB 4.46Å
240	K	92.1	Very high	90.9	Very high	87 Å²	87	42.9 Å²	42.9	38%	0.378	22%	0.223	S	C	.	.	H	α-helix	trans	-57.5	-45.5	173.1	-73.4	175.1	166.9	-133.1	0	112.1	D236 V237 S238 F242 C243 H244 E255	D236-K240 WeakPolarHBondContact O-CG 3.21Å; D236-K240 PolarHBondContact O-N 3.21Å; V237-K240 PolarHBondContact O-N 3.47Å; S238-K240 PolarHBondContact O-N 3.42Å; K240-F242 VanDerWaalsContact C-N 3.31Å; K240-F242 PolarHBondContact O-N 2.88Å; K240-C243 WeakPolarHBondContact O-CB 3.08Å; K240-C243 PolarHBondContact O-N 3.47Å; K240-C243 VanDerWaalsContact O-N 3.16Å; K240-H244 PolarHBondContact O-CD2 2.98Å; K240-H244 PolarHBondContact O-N 3.14Å; K240-H244 VanDerWaalsContact O-N 3.15Å; K240-E255 WeakPolarHBondContact CD-OE2 3.38Å; K240-E255 WeakPolarHBondContact CE-OE2 3.02Å; K240-E255 IonicContact NZ-OE2 2.68Å; K240-E255 PolarHBondContact NZ-OE2 2.96Å
241	A	93.6	Very high	91.2	Very high	36 Å²	36	45.3 Å²	45.3	30%	0.298	23%	0.233	S	C	.	.	H	α-helix	trans	-60.7	-38.7	176.1	0	0	0	0	0	112.3	V237 S238 H239 H244 L245	V237-A241 PolarHBondContact O-N 2.98Å; S238-A241 WeakPolarHBondContact O-CB 3.38Å; S238-A241 PolarHBondContact O-N 3.44Å; H239-A241 VanDerWaalsContact C-N 3.35Å; H239-A241 PolarHBondContact O-N 2.74Å; A241-H244 PolarHBondContact O-N 3.13Å; A241-L245 WeakPolarHBondContact O-CB 3.38Å; A241-L245 VanDerWaalsContact O-CG 3.27Å; A241-L245 WeakPolarHBondContact O-CG 3.46Å; A241-L245 PolarHBondContact O-N 3.36Å
242	F	95.2	Very high	91.4	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-67.3	-34.1	174.9	-58.6	-39.7	0	0	0	113	S238 H239 K240 L245 Y246 Y296 L379 F398 I400 L417 A419	S238-F242 WeakPolarHBondContact O-CD2 3.41Å; S238-F242 WeakPolarHBondContact O-CG 3.47Å; S238-F242 PolarHBondContact O-N 3.35Å; H239-F242 PolarHBondContact O-N 3.38Å; H239-F242 VanDerWaalsContact O-N 3.16Å; K240-F242 VanDerWaalsContact C-N 3.31Å; K240-F242 PolarHBondContact O-N 2.88Å; F242-L245 HydrophobicContact CD1-CD1 4.5Å; F242-L245 PolarHBondContact O-N 3.35Å; F242-Y246 HydrophobicContact CB-CD2 3.96Å; F242-Y246 HydrophobicContact CB-CE2 4.13Å; F242-Y246 HydrophobicContact CD1-CD2 4.48Å; F242-Y246 AromaticContact CD1-CE2 3.8Å; F242-Y246 HydrophobicContact CD1-CE2 3.8Å; F242-Y246 HydrophobicContact CG-CE2 4.27Å; F242-Y246 WeakPolarHBondContact O-CB 3.34Å; F242-Y246 VanDerWaalsContact O-CD2 3.26Å; F242-Y246 WeakPolarHBondContact O-CD2 3.49Å; F242-Y246 PolarHBondContact O-N 3.02Å; F242-Y296 HydrophobicContact CE1-CD1 4.28Å; F242-Y296 HydrophobicContact CE1-CD2 4.04Å; F242-Y296 AromaticContact CE1-CE1 3.95Å; F242-Y296 HydrophobicContact CE1-CE1 3.95Å; F242-Y296 AromaticContact CE1-CE2 3.68Å; F242-Y296 HydrophobicContact CE1-CE2 3.68Å; F242-Y296 HydrophobicContact CE1-CG 4.33Å; F242-Y296 AromaticContact CE1-CZ 3.63Å; F242-Y296 HydrophobicContact CZ-CD1 4.21Å; F242-Y296 AromaticContact CZ-CE1 3.69Å; F242-Y296 HydrophobicContact CZ-CE1 3.69Å; F242-Y296 HydrophobicContact CZ-CE2 4.24Å; F242-Y296 AromaticContact CZ-CZ 3.7Å; F242-L379 HydrophobicContact CE1-CD1 3.92Å; F242-L379 HydrophobicContact CZ-CD1 4.47Å; F242-F398 HydrophobicContact CE2-CB 4.19Å; F242-F398 AromaticContact CE2-CD1 3.53Å; F242-F398 HydrophobicContact CE2-CD1 3.53Å; F242-F398 HydrophobicContact CE2-CD2 4.17Å; F242-F398 AromaticContact CE2-CE1 3.85Å; F242-F398 HydrophobicContact CE2-CE1 3.85Å; F242-F398 HydrophobicContact CE2-CE2 4.43Å; F242-F398 AromaticContact CE2-CG 3.71Å; F242-F398 HydrophobicContact CE2-CG 3.71Å; F242-F398 HydrophobicContact CE2-CZ 4.28Å; F242-F398 HydrophobicContact CZ-CB 4.35Å; F242-F398 HydrophobicContact CZ-CD1 4.13Å; F242-F398 AromaticContact CZ-CD2 3.91Å; F242-F398 HydrophobicContact CZ-CD2 3.91Å; F242-F398 HydrophobicContact CZ-CE1 4.4Å; F242-F398 HydrophobicContact CZ-CE2 4.18Å; F242-F398 AromaticContact CZ-CG 3.87Å; F242-F398 HydrophobicContact CZ-CG 3.87Å; F242-F398 HydrophobicContact CZ-CZ 4.42Å; F242-I400 HydrophobicContact CB-CD1 4.46Å; F242-I400 HydrophobicContact CD1-CD1 3.9Å; F242-I400 HydrophobicContact CD2-CD1 3.78Å; F242-I400 HydrophobicContact CD2-CG1 4.2Å; F242-I400 HydrophobicContact CE1-CD1 4.02Å; F242-I400 HydrophobicContact CE2-CD1 3.94Å; F242-I400 HydrophobicContact CE2-CG1 4.4Å; F242-I400 HydrophobicContact CG-CD1 3.79Å; F242-I400 HydrophobicContact CZ-CD1 4.05Å; F242-L417 HydrophobicContact CB-CD1 4.05Å; F242-L417 HydrophobicContact CB-CD2 3.98Å; F242-L417 WeakPolarHBondContact O-CD1 3.5Å; F242-A419 HydrophobicContact CD2-CB 3.69Å; F242-A419 HydrophobicContact CE2-CB 4.12Å
243	C	94.6	Very high	91.3	Very high	5 Å²	5	51.7 Å²	51.7	3%	0.034	27%	0.268	C	S	.	.	H	α-helix	trans	-61.3	-49.9	172.3	-66.2	0	0	0	0	111.2	H239 K240 L245 L247 W250	H239-C243 VanDerWaalsContact CE1-SG 3.55Å; H239-C243 PolarHBondContact O-N 3.15Å; H239-C243 PolarHBondContact O-SG 3.41Å; K240-C243 WeakPolarHBondContact O-CB 3.08Å; K240-C243 PolarHBondContact O-N 3.47Å; K240-C243 VanDerWaalsContact O-N 3.16Å; C243-L245 VanDerWaalsContact C-N 3.32Å; C243-L245 PolarHBondContact O-N 2.87Å; C243-L247 HydrophobicContact CB-CD1 4.08Å; C243-L247 VanDerWaalsContact O-CB 3.26Å; C243-L247 WeakPolarHBondContact O-CB 3.37Å; C243-L247 PolarHBondContact O-N 3.04Å; C243-W250 HydrophobicContact CB-CD2 3.88Å; C243-W250 HydrophobicContact CB-CE3 4.49Å; C243-W250 HydrophobicContact CB-CG 4.13Å; C243-W250 HydrophobicContact CB-CZ2 4.04Å
244	H	94.6	Very high	91.1	Very high	83 Å²	83	52 Å²	52	38%	0.384	26%	0.259	S	S	.	.	H	α-helix	trans	-62.6	-34.2	175.8	-78.2	-82.2	0	0	0	113.8	K240 A241 W250 E255	K240-H244 PolarHBondContact O-CD2 2.98Å; K240-H244 PolarHBondContact O-N 3.14Å; K240-H244 VanDerWaalsContact O-N 3.15Å; A241-H244 PolarHBondContact O-N 3.13Å; H244-W250 AromaticContact CD2-CD1 3.76Å; H244-W250 AromaticContact CE1-CD1 3.64Å; H244-W250 AromaticContact CG-CD1 3.84Å; H244-W250 AromaticContact ND1-CD1 3.78Å; H244-W250 AromaticContact NE2-CD1 3.63Å; H244-W250 AromaticContact NE2-NE1 3.91Å; H244-E255 IonicContact CD2-OE1 2.76Å; H244-E255 IonicContact CE1-OE1 3.77Å; H244-E255 IonicContact NE2-OE1 3.6Å; H244-E255 PolarHBondContact NE2-OE1 2.91Å
245	L	94.5	Very high	90.9	Very high	28 Å²	28	52.9 Å²	52.9	15%	0.147	26%	0.264	C	S	.	.	H	α-helix	trans	-76.2	-41	179.8	-75.2	167.7	0	0	0	113.2	A241 F242 C243 Q284 L291 A292	A241-L245 WeakPolarHBondContact O-CB 3.38Å; A241-L245 VanDerWaalsContact O-CG 3.27Å; A241-L245 WeakPolarHBondContact O-CG 3.46Å; A241-L245 PolarHBondContact O-N 3.36Å; F242-L245 HydrophobicContact CD1-CD1 4.5Å; F242-L245 PolarHBondContact O-N 3.35Å; C243-L245 VanDerWaalsContact C-N 3.32Å; C243-L245 PolarHBondContact O-N 2.87Å; L245-Q284 VanDerWaalsContact O-CB 3.31Å; L245-Q284 WeakPolarHBondContact O-CB 3.48Å; L245-Q284 WeakPolarHBondContact O-CG 3.31Å; L245-L291 HydrophobicContact CD2-CB 4.41Å; L245-A292 HydrophobicContact CD1-CB 3.87Å; L245-A292 HydrophobicContact CD2-CB 4.5Å
246	Y	96	Very high	90.1	Very high	2 Å²	2	56.5 Å²	56.5	1%	0.008	29%	0.285	C	S	.	.	H	α-helix	trans	-109.8	-22.7	-168	-57.3	-55.8	0	0	0	114.9	F242 Y280 T281 Q284 F285 T288 F377 L379 I400 I402 L417	F242-Y246 HydrophobicContact CB-CD2 3.96Å; F242-Y246 HydrophobicContact CB-CE2 4.13Å; F242-Y246 HydrophobicContact CD1-CD2 4.48Å; F242-Y246 AromaticContact CD1-CE2 3.8Å; F242-Y246 HydrophobicContact CD1-CE2 3.8Å; F242-Y246 HydrophobicContact CG-CE2 4.27Å; F242-Y246 WeakPolarHBondContact O-CB 3.34Å; F242-Y246 VanDerWaalsContact O-CD2 3.26Å; F242-Y246 WeakPolarHBondContact O-CD2 3.49Å; F242-Y246 PolarHBondContact O-N 3.02Å; Y246-Y280 WeakPolarHBondContact O-CD1 3.12Å; Y246-T281 PolarHBondContact O-OG1 2.86Å; Y246-Q284 HydrophobicContact CD1-CB 3.84Å; Y246-Q284 HydrophobicContact CE1-CB 4.22Å; Y246-F285 HydrophobicContact CE1-CB 4.32Å; Y246-T288 VanDerWaalsContact OH-CG2 3.26Å; Y246-T288 WeakPolarHBondContact OH-CG2 3.37Å; Y246-T288 PolarHBondContact OH-OG1 2.87Å; Y246-F377 HydrophobicContact CD1-CZ 4.11Å; Y246-F377 HydrophobicContact CD2-CE2 4.21Å; Y246-F377 AromaticContact CD2-CZ 3.7Å; Y246-F377 HydrophobicContact CD2-CZ 3.7Å; Y246-F377 HydrophobicContact CE1-CE2 4.31Å; Y246-F377 HydrophobicContact CE1-CZ 4.12Å; Y246-F377 AromaticContact CE2-CE2 3.69Å; Y246-F377 HydrophobicContact CE2-CE2 3.69Å; Y246-F377 AromaticContact CE2-CZ 3.67Å; Y246-F377 HydrophobicContact CE2-CZ 3.67Å; Y246-F377 AromaticContact CG-CZ 3.93Å; Y246-F377 HydrophobicContact CG-CZ 3.93Å; Y246-F377 AromaticContact CZ-CE2 3.77Å; Y246-F377 AromaticContact CZ-CZ 3.91Å; Y246-L379 HydrophobicContact CE2-CD1 4.46Å; Y246-L379 WeakPolarHBondContact OH-CD1 3.35Å; Y246-I400 HydrophobicContact CE2-CD1 4.06Å; Y246-I402 HydrophobicContact CG-CD1 4.41Å; Y246-L417 HydrophobicContact CD2-CD1 4.24Å
247	L	95.5	Very high	88.9	Confident	2 Å²	2	59.4 Å²	59.4	1%	0.01	30%	0.301	C	S	.	.	S	Bend	trans	-93.1	122.4	178.3	-55.2	-179.6	0	0	0	110.3	C243 Q249 W250 Y266 I402 I415 L417	C243-L247 HydrophobicContact CB-CD1 4.08Å; C243-L247 VanDerWaalsContact O-CB 3.26Å; C243-L247 WeakPolarHBondContact O-CB 3.37Å; C243-L247 PolarHBondContact O-N 3.04Å; L247-Q249 PolarHBondContact O-N 3.36Å; L247-W250 HydrophobicContact CB-CB 4.11Å; L247-W250 HydrophobicContact CB-CE3 4.17Å; L247-W250 HydrophobicContact CD1-CD2 4.18Å; L247-W250 HydrophobicContact CD1-CE3 3.45Å; L247-W250 VanDerWaalsContact CD1-CE3 3.45Å; L247-W250 HydrophobicContact CD1-CH2 4.49Å; L247-W250 HydrophobicContact CD1-CZ3 3.64Å; L247-W250 HydrophobicContact CG-CE3 4.46Å; L247-W250 PolarHBondContact O-N 3.46Å; L247-Y266 HydrophobicContact CB-CE1 4.07Å; L247-Y266 HydrophobicContact CD1-CD1 4.45Å; L247-Y266 HydrophobicContact CD1-CE1 4.12Å; L247-Y266 HydrophobicContact CD2-CE1 4.4Å; L247-Y266 HydrophobicContact CG-CE1 4.43Å; L247-I402 HydrophobicContact CD2-CG2 3.94Å; L247-I415 HydrophobicContact CD2-CG2 3.77Å; L247-L417 HydrophobicContact CD1-CB 4.03Å; L247-L417 HydrophobicContact CD2-CB 4.35Å; L247-L417 HydrophobicContact CD2-CD1 4.46Å; L247-L417 HydrophobicContact CG-CB 4.39Å; L247-L417 HydrophobicContact CG-CD1 4.29Å
248	R	93.8	Very high	87.4	Confident	60 Å²	60	60 Å²	60	23%	0.226	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	127.9	-177.3	-174.8	179	177.2	-144.4	14.3	111	W250 Y266 E276 Y280	R248-W250 VanDerWaalsContact C-N 3.25Å; R248-W250 PolarHBondContact O-N 3.2Å; R248-Y266 PolarHBondContact N-OH 3.13Å; R248-Y266 PolarHBondContact O-OH 2.81Å; R248-E276 IonicContact CZ-OE2 3.1Å; R248-E276 VanDerWaalsContact NH1-CB 3.3Å; R248-E276 IonicContact NH1-OE2 2.68Å; R248-E276 PolarHBondContact NH1-OE2 2.76Å; R248-E276 IonicContact NH2-OE1 3.86Å; R248-E276 IonicContact NH2-OE2 2.69Å; R248-E276 PolarHBondContact NH2-OE2 3.03Å; R248-Y280 HydrophobicContact CB-CD1 3.71Å; R248-Y280 HydrophobicContact CB-CD2 4.41Å; R248-Y280 HydrophobicContact CB-CE1 4.06Å; R248-Y280 HydrophobicContact CB-CG 3.9Å; R248-Y280 HydrophobicContact CG-CD1 4.42Å; R248-Y280 HydrophobicContact CG-CD2 4.25Å; R248-Y280 HydrophobicContact CG-CG 4.17Å
249	Q	90.6	Very high	85.8	Confident	159 Å²	159	64.2 Å²	64.2	74%	0.743	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.1	33	-179.2	-61	166.8	-28.1	0	0	113.8	L247	L247-Q249 PolarHBondContact O-N 3.36Å
250	W	90.9	Very high	84.5	Confident	50 Å²	50	64.1 Å²	64.1	19%	0.189	32%	0.321	C	S	.	.			trans	-65.9	134.9	168.2	-172.8	-92	0	0	0	110.7	C243 H244 L247 R248 Y254 Y266	C243-W250 HydrophobicContact CB-CD2 3.88Å; C243-W250 HydrophobicContact CB-CE3 4.49Å; C243-W250 HydrophobicContact CB-CG 4.13Å; C243-W250 HydrophobicContact CB-CZ2 4.04Å; H244-W250 AromaticContact CD2-CD1 3.76Å; H244-W250 AromaticContact CE1-CD1 3.64Å; H244-W250 AromaticContact CG-CD1 3.84Å; H244-W250 AromaticContact ND1-CD1 3.78Å; H244-W250 AromaticContact NE2-CD1 3.63Å; H244-W250 AromaticContact NE2-NE1 3.91Å; L247-W250 HydrophobicContact CB-CB 4.11Å; L247-W250 HydrophobicContact CB-CE3 4.17Å; L247-W250 HydrophobicContact CD1-CD2 4.18Å; L247-W250 HydrophobicContact CD1-CE3 3.45Å; L247-W250 VanDerWaalsContact CD1-CE3 3.45Å; L247-W250 HydrophobicContact CD1-CH2 4.49Å; L247-W250 HydrophobicContact CD1-CZ3 3.64Å; L247-W250 HydrophobicContact CG-CE3 4.46Å; L247-W250 PolarHBondContact O-N 3.46Å; R248-W250 VanDerWaalsContact C-N 3.25Å; R248-W250 PolarHBondContact O-N 3.2Å; W250-Y254 HydrophobicContact CD2-CD2 4.5Å; W250-Y254 HydrophobicContact CE3-CD2 4.37Å; W250-Y254 HydrophobicContact CH2-CG 4.33Å; W250-Y254 VanDerWaalsContact CZ2-CB 3.45Å; W250-Y254 HydrophobicContact CZ3-CG 4.33Å; W250-Y266 HydrophobicContact CE3-CD1 4.11Å; W250-Y266 HydrophobicContact CE3-CD2 4.19Å; W250-Y266 HydrophobicContact CE3-CE1 4.28Å; W250-Y266 HydrophobicContact CE3-CE2 4.34Å; W250-Y266 HydrophobicContact CE3-CG 4.08Å; W250-Y266 AromaticContact CZ3-CD1 3.93Å; W250-Y266 HydrophobicContact CZ3-CD1 3.93Å; W250-Y266 HydrophobicContact CZ3-CD2 4.41Å; W250-Y266 AromaticContact CZ3-CG 3.9Å; W250-Y266 HydrophobicContact CZ3-CG 3.9Å
251	D	87.6	Confident	83.2	Confident	68 Å²	68	62.5 Å²	62.5	36%	0.364	32%	0.319	S	S	.	.			trans	-126.9	153.1	176.9	-177.7	24.6	0	0	0	110.8	Q253 Y254	D251-Q253 PolarHBondContact O-N 3.43Å; D251-Q253 WeakPolarHBondContact OD2-CG 3.29Å; D251-Y254 PolarHBondContact O-N 3.03Å
252	S	86.3	Confident	82	Confident	63 Å²	63	66 Å²	66	44%	0.441	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-46	-27.4	173.1	59.5	0	0	0	0	115.2	Y254 E255	S252-Y254 PolarHBondContact O-N 3.49Å; S252-E255 WeakPolarHBondContact O-CB 3.45Å; S252-E255 PolarHBondContact O-N 3.43Å
253	Q	83.8	Confident	81	Confident	110 Å²	110	68.2 Å²	68.2	51%	0.514	36%	0.362	S	S	.	.	G	3₁₀ helix	trans	-61.2	-31.1	175.1	-64.3	-177.6	-7.5	0	0	112.8	D251 E255 T256 T263	D251-Q253 PolarHBondContact O-N 3.43Å; D251-Q253 WeakPolarHBondContact OD2-CG 3.29Å; Q253-E255 PolarHBondContact O-N 2.84Å; Q253-T256 PolarHBondContact O-N 3.01Å; Q253-T256 PolarHBondContact O-OG1 3.16Å; Q253-T263 HydrophobicContact CB-CG2 3.72Å; Q253-T263 HydrophobicContact CG-CG2 4.43Å
254	Y	83.3	Confident	80.2	Confident	74 Å²	74	69.7 Å²	69.7	29%	0.29	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-78.9	-1.6	175.1	-61.2	-69.6	0	0	0	113.6	W250 D251 S252 Y266	W250-Y254 HydrophobicContact CD2-CD2 4.5Å; W250-Y254 HydrophobicContact CE3-CD2 4.37Å; W250-Y254 HydrophobicContact CH2-CG 4.33Å; W250-Y254 VanDerWaalsContact CZ2-CB 3.45Å; W250-Y254 HydrophobicContact CZ3-CG 4.33Å; D251-Y254 PolarHBondContact O-N 3.03Å; S252-Y254 PolarHBondContact O-N 3.49Å; Y254-Y266 HydrophobicContact CD2-CD2 4.32Å; Y254-Y266 HydrophobicContact CE1-CD2 4.49Å; Y254-Y266 AromaticContact CE2-CD2 3.84Å; Y254-Y266 HydrophobicContact CE2-CD2 3.84Å; Y254-Y266 AromaticContact CZ-CD2 3.94Å
255	E	82.7	Confident	79.7	Confident	65 Å²	65	69.6 Å²	69.6	30%	0.304	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-92	-6.4	173	-58.5	-175.1	-140.9	0	0	113.6	K240 H244 S252 Q253	K240-E255 WeakPolarHBondContact CD-OE2 3.38Å; K240-E255 WeakPolarHBondContact CE-OE2 3.02Å; K240-E255 IonicContact NZ-OE2 2.68Å; K240-E255 PolarHBondContact NZ-OE2 2.96Å; H244-E255 IonicContact CD2-OE1 2.76Å; H244-E255 IonicContact CE1-OE1 3.77Å; H244-E255 IonicContact NE2-OE1 3.6Å; H244-E255 PolarHBondContact NE2-OE1 2.91Å; S252-E255 WeakPolarHBondContact O-CB 3.45Å; S252-E255 PolarHBondContact O-N 3.43Å; Q253-E255 PolarHBondContact O-N 2.84Å
256	T	72.7	Confident	79.5	Confident	78 Å²	78	69.8 Å²	69.8	48%	0.479	38%	0.379	S	S	.	.	S	Bend	trans	-88.6	157.3	-179.9	76.8	0	0	0	0	112	Q253 D258	Q253-T256 PolarHBondContact O-N 3.01Å; Q253-T256 PolarHBondContact O-OG1 3.16Å; T256-D258 PolarHBondContact OG1-OD2 3.19Å
257	L	63.4	Low	79.3	Confident	125 Å²	125	70.6 Å²	70.6	65%	0.654	39%	0.386	S	S	*	.			trans	-99	16.9	-176	-86.8	150.5	0	0	0	112.7	Y259	L257-Y259 PolarHBondContact O-N 2.84Å
258	D	59.7	Low	79.3	Confident	106 Å²	106	71.3 Å²	71.3	57%	0.567	39%	0.39	S	S	*	.			trans	-63.5	129	-175.6	-62	-38.9	0	0	0	110.7	T256 P260 P261	T256-D258 PolarHBondContact OG1-OD2 3.19Å; D258-P260 CarbonylContact O-C 3.57Å; D258-P260 VanDerWaalsContact O-C 3.3Å; D258-P261 VanDerWaalsContact O-CA 3.26Å; D258-P261 WeakPolarHBondContact O-CA 3.44Å; D258-P261 WeakPolarHBondContact O-CD 3.42Å
259	Y	59	Low	79.3	Confident	92 Å²	92	75.4 Å²	75.4	36%	0.361	41%	0.407	S	S	.	.	S	Bend	trans	-124.3	117.7	-177.7	-172.9	-85.8	0	0	0	112	L257 L656 K657	L257-Y259 PolarHBondContact O-N 2.84Å; Y259-L656 PolarHBondContact OH-O 2.83Å; Y259-K657 HydrophobicContact CE1-CG 3.83Å
260	P	63.8	Low	79.4	Confident	53 Å²	53	71.1 Å²	71.1	34%	0.344	39%	0.391	S	S	.	.	S	Bend	cis	-70.4	148.9	-7.7	31.3	-35.5	0	0	0	112.2	D258 A262 L656	D258-P260 CarbonylContact O-C 3.57Å; D258-P260 VanDerWaalsContact O-C 3.3Å; P260-A262 PolarHBondContact O-N 2.86Å; P260-L656 HydrophobicContact CB-CD1 3.78Å; P260-L656 HydrophobicContact CG-CD1 4.32Å
261	P	65.6	Low	79.5	Confident	54 Å²	54	71.4 Å²	71.4	35%	0.351	40%	0.399	S	S	.	.			trans	-68.8	131.7	179.6	27.2	-34.4	0	0	0	110.4	D258 T263 G264	D258-P261 VanDerWaalsContact O-CA 3.26Å; D258-P261 WeakPolarHBondContact O-CA 3.44Å; D258-P261 WeakPolarHBondContact O-CD 3.42Å; P261-T263 PolarHBondContact O-N 2.83Å; P261-G264 PolarHBondContact O-N 2.8Å
262	A	67.5	Low	79.8	Confident	110 Å²	110	71.8 Å²	71.8	91%	0.909	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-25.3	-178.3	0	0	0	0	0	113.4	P260	P260-A262 PolarHBondContact O-N 2.86Å
263	T	74.4	Confident	80.1	Confident	46 Å²	46	71.3 Å²	71.3	28%	0.282	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-13.4	179.2	48	0	0	0	0	114.5	Q253 P261	Q253-T263 HydrophobicContact CB-CG2 3.72Å; Q253-T263 HydrophobicContact CG-CG2 4.43Å; P261-T263 PolarHBondContact O-N 2.83Å
264	G	79	Confident	80.6	Confident	35 Å²	35	66.1 Å²	66.1	36%	0.361	37%	0.369	S	S	.	.			trans	70.7	-171.7	-169.6	0	0	0	0	0	113.9	P261	P261-G264 PolarHBondContact O-N 2.8Å
265	D	82.9	Confident	81.1	Confident	82 Å²	82	62.8 Å²	62.8	44%	0.439	36%	0.356	S	S	.	.			trans	-75.9	134.2	178.5	-62	-44.5	0	0	0	111.2	A267 K414	D265-A267 PolarHBondContact O-N 3.4Å; D265-A267 VanDerWaalsContact O-N 3.15Å; D265-K414 HydrophobicContact CB-CD 4.24Å; D265-K414 WeakPolarHBondContact OD2-CE 3.11Å; D265-K414 IonicContact OD2-NZ 3.6Å; D265-K414 PolarHBondContact OD2-NZ 3.23Å
266	Y	90.9	Very high	81.6	Confident	32 Å²	32	63.1 Å²	63.1	13%	0.125	36%	0.357	C	S	.	.			trans	-64.7	112.7	172.3	-177.6	-103	0	0	0	110.8	L247 R248 W250 Y254 H277 I415	L247-Y266 HydrophobicContact CB-CE1 4.07Å; L247-Y266 HydrophobicContact CD1-CD1 4.45Å; L247-Y266 HydrophobicContact CD1-CE1 4.12Å; L247-Y266 HydrophobicContact CD2-CE1 4.4Å; L247-Y266 HydrophobicContact CG-CE1 4.43Å; R248-Y266 PolarHBondContact N-OH 3.13Å; R248-Y266 PolarHBondContact O-OH 2.81Å; W250-Y266 HydrophobicContact CE3-CD1 4.11Å; W250-Y266 HydrophobicContact CE3-CD2 4.19Å; W250-Y266 HydrophobicContact CE3-CE1 4.28Å; W250-Y266 HydrophobicContact CE3-CE2 4.34Å; W250-Y266 HydrophobicContact CE3-CG 4.08Å; W250-Y266 AromaticContact CZ3-CD1 3.93Å; W250-Y266 HydrophobicContact CZ3-CD1 3.93Å; W250-Y266 HydrophobicContact CZ3-CD2 4.41Å; W250-Y266 AromaticContact CZ3-CG 3.9Å; W250-Y266 HydrophobicContact CZ3-CG 3.9Å; Y254-Y266 HydrophobicContact CD2-CD2 4.32Å; Y254-Y266 HydrophobicContact CE1-CD2 4.49Å; Y254-Y266 AromaticContact CE2-CD2 3.84Å; Y254-Y266 HydrophobicContact CE2-CD2 3.84Å; Y254-Y266 AromaticContact CZ-CD2 3.94Å; Y266-H277 AromaticContact CE1-CE1 3.96Å; Y266-H277 PolarHBondContact OH-CE1 2.81Å; Y266-H277 PolarHBondContact OH-ND1 2.88Å; Y266-I415 HydrophobicContact CD1-CB 3.78Å; Y266-I415 HydrophobicContact CD1-CG2 4.31Å; Y266-I415 HydrophobicContact CE1-CB 3.75Å; Y266-I415 HydrophobicContact CE1-CD1 4.27Å; Y266-I415 HydrophobicContact CE1-CG1 4.47Å; Y266-I415 HydrophobicContact CE1-CG2 3.94Å; Y266-I415 PolarHBondContact O-N 3.21Å
267	A	92.9	Very high	82.6	Confident	18 Å²	18	59.5 Å²	59.5	15%	0.149	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	158.4	-169.1	0	0	0	0	0	111.4	D265 Y269 Q412 M413 K414	D265-A267 PolarHBondContact O-N 3.4Å; D265-A267 VanDerWaalsContact O-N 3.15Å; A267-Y269 HydrophobicContact CB-CE2 4.19Å; A267-Q412 HydrophobicContact CB-CG 3.62Å; A267-M413 CarbonylContact C-O 3.56Å; A267-M413 VanDerWaalsContact CA-O 3.27Å; A267-M413 WeakPolarHBondContact CA-O 3.48Å; A267-M413 WeakPolarHBondContact CB-O 3.5Å; A267-K414 HydrophobicContact CB-CG 4.38Å
268	V	93.8	Very high	84.1	Confident	17 Å²	17	53.6 Å²	53.6	10%	0.103	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	149.7	169.9	-66.6	0	0	0	0	111	D273 M413 I415	V268-D273 HydrophobicContact CB-CB 3.84Å; V268-D273 HydrophobicContact CG1-CB 3.81Å; V268-M413 HydrophobicContact CG2-CB 4.25Å; V268-M413 HydrophobicContact CG2-CE 3.21Å; V268-M413 PolarHBondContact N-O 2.86Å; V268-M413 PolarHBondContact O-N 2.69Å; V268-I415 HydrophobicContact CB-CD1 4.5Å; V268-I415 HydrophobicContact CG1-CD1 3.73Å; V268-I415 HydrophobicContact CG2-CD1 4.1Å
269	Y	93.5	Very high	85.7	Confident	147 Å²	147	48.6 Å²	48.6	58%	0.576	28%	0.278	S	S	*	.			trans	-124.6	-15.1	-171.2	-63.2	-90	0	0	0	113.5	A267 Q412	A267-Y269 HydrophobicContact CB-CE2 4.19Å; Y269-Q412 HydrophobicContact CD1-CB 4.23Å; Y269-Q412 HydrophobicContact CD1-CG 4.38Å; Y269-Q412 HydrophobicContact CE1-CB 3.76Å; Y269-Q412 HydrophobicContact CE1-CG 3.62Å; Y269-Q412 PolarHBondContact OH-NE2 3.01Å
270	T	94.2	Very high	87.3	Confident	68 Å²	68	47.4 Å²	47.4	42%	0.417	27%	0.273	S	S	.	.	S	Bend	trans	-117.7	159.7	176	79	0	0	0	0	112.2	N272 D273 F274	T270-N272 VanDerWaalsContact C-N 3.31Å; T270-D273 WeakPolarHBondContact CB-OD2 3.37Å; T270-D273 WeakPolarHBondContact CG2-OD2 3.37Å; T270-D273 PolarHBondContact N-OD2 3.49Å; T270-D273 PolarHBondContact O-N 2.61Å; T270-D273 PolarHBondContact OG1-N 3.3Å; T270-D273 VanDerWaalsContact OG1-N 3.07Å; T270-D273 PolarHBondContact OG1-OD2 3.39Å; T270-F274 PolarHBondContact O-N 2.86Å
271	V	92.8	Very high	88.8	Confident	56 Å²	56	44.9 Å²	44.9	34%	0.339	26%	0.257	S	S	.	.	H	α-helix	trans	-67.7	-35	175.5	170.4	0	0	0	0	111	F274 Y275 F367	V271-F274 WeakPolarHBondContact O-CB 3.19Å; V271-F274 PolarHBondContact O-N 3.16Å; V271-Y275 HydrophobicContact CG1-CD2 3.83Å; V271-Y275 HydrophobicContact CG1-CE2 3.48Å; V271-Y275 VanDerWaalsContact CG1-CE2 3.48Å; V271-Y275 VanDerWaalsContact O-CD2 3.22Å; V271-Y275 WeakPolarHBondContact O-CD2 3.29Å; V271-Y275 PolarHBondContact O-N 3.43Å; V271-F367 HydrophobicContact CB-CE2 4.28Å; V271-F367 HydrophobicContact CB-CZ 4.43Å; V271-F367 HydrophobicContact CG1-CD2 4.28Å; V271-F367 HydrophobicContact CG1-CE2 3.54Å; V271-F367 HydrophobicContact CG1-CZ 3.9Å; V271-F367 HydrophobicContact CG2-CD2 3.89Å; V271-F367 HydrophobicContact CG2-CE2 3.89Å; V271-F367 HydrophobicContact CG2-CG 4.23Å; V271-F367 HydrophobicContact CG2-CZ 4.21Å
272	N	93	Very high	90.1	Very high	77 Å²	77	42.3 Å²	42.3	41%	0.412	24%	0.24	S	C	.	.	H	α-helix	trans	-62.6	-49	176.3	-46.9	58.2	0	0	0	109.9	T270 F274 Y275 E276 E351	T270-N272 VanDerWaalsContact C-N 3.31Å; N272-F274 VanDerWaalsContact C-N 3.28Å; N272-F274 PolarHBondContact O-N 2.99Å; N272-Y275 PolarHBondContact O-N 2.95Å; N272-E276 WeakPolarHBondContact O-CB 3.38Å; N272-E276 WeakPolarHBondContact O-CG 3.41Å; N272-E276 PolarHBondContact O-N 3.31Å; N272-E351 WeakPolarHBondContact CB-OE2 3.38Å; N272-E351 PolarHBondContact ND2-OE2 3.03Å
273	D	93.1	Very high	91.2	Very high	53 Å²	53	39 Å²	39	28%	0.283	21%	0.208	S	C	.	.	H	α-helix	trans	-58.9	-37.4	176.7	-61.8	-44.7	0	0	0	112.6	V268 T270 H277	V268-D273 HydrophobicContact CB-CB 3.84Å; V268-D273 HydrophobicContact CG1-CB 3.81Å; T270-D273 WeakPolarHBondContact CB-OD2 3.37Å; T270-D273 WeakPolarHBondContact CG2-OD2 3.37Å; T270-D273 PolarHBondContact N-OD2 3.49Å; T270-D273 PolarHBondContact O-N 2.61Å; T270-D273 PolarHBondContact OG1-N 3.3Å; T270-D273 VanDerWaalsContact OG1-N 3.07Å; T270-D273 PolarHBondContact OG1-OD2 3.39Å; D273-H277 WeakPolarHBondContact O-CB 3.14Å; D273-H277 PolarHBondContact O-N 2.98Å
274	F	94.6	Very high	92.1	Very high	1 Å²	1	38.4 Å²	38.4	0%	0.004	20%	0.202	C	C	.	.	H	α-helix	trans	-55.9	-56.9	174.1	173.2	-76.1	0	0	0	110.6	T270 V271 N272 H277 V278 I365 F367 L370 F373 M413	T270-F274 PolarHBondContact O-N 2.86Å; V271-F274 WeakPolarHBondContact O-CB 3.19Å; V271-F274 PolarHBondContact O-N 3.16Å; N272-F274 VanDerWaalsContact C-N 3.28Å; N272-F274 PolarHBondContact O-N 2.99Å; F274-H277 PolarHBondContact O-N 3.04Å; F274-V278 HydrophobicContact CD1-CG2 4.33Å; F274-V278 HydrophobicContact CE1-CG2 3.89Å; F274-V278 HydrophobicContact CZ-CG2 4.1Å; F274-V278 WeakPolarHBondContact O-CG2 3.34Å; F274-V278 PolarHBondContact O-N 2.84Å; F274-V278 VanDerWaalsContact O-N 3.08Å; F274-I365 HydrophobicContact CE1-CD1 3.58Å; F274-I365 HydrophobicContact CZ-CD1 3.63Å; F274-F367 HydrophobicContact CB-CE1 4.11Å; F274-F367 HydrophobicContact CB-CZ 4.14Å; F274-F367 HydrophobicContact CD1-CE1 4.19Å; F274-F367 AromaticContact CD1-CZ 3.82Å; F274-F367 HydrophobicContact CD1-CZ 3.82Å; F274-F367 AromaticContact CD2-CE1 3.6Å; F274-F367 HydrophobicContact CD2-CE1 3.6Å; F274-F367 HydrophobicContact CD2-CZ 4.09Å; F274-F367 HydrophobicContact CE1-CZ 4.36Å; F274-F367 HydrophobicContact CE2-CE1 4.15Å; F274-F367 AromaticContact CG-CE1 3.71Å; F274-F367 HydrophobicContact CG-CE1 3.71Å; F274-F367 AromaticContact CG-CZ 3.75Å; F274-F367 HydrophobicContact CG-CZ 3.75Å; F274-L370 HydrophobicContact CE2-CD2 3.99Å; F274-F373 HydrophobicContact CE2-CB 3.93Å; F274-F373 HydrophobicContact CE2-CG 4.32Å; F274-F373 HydrophobicContact CZ-CB 3.91Å; F274-F373 HydrophobicContact CZ-CD1 4.19Å; F274-F373 HydrophobicContact CZ-CD2 4.01Å; F274-F373 AromaticContact CZ-CG 3.79Å; F274-F373 HydrophobicContact CZ-CG 3.79Å; F274-M413 HydrophobicContact CB-CE 4.48Å; F274-M413 HydrophobicContact CD2-CE 3.3Å; F274-M413 HydrophobicContact CD2-SD 3.88Å; F274-M413 HydrophobicContact CE2-CE 3.88Å; F274-M413 HydrophobicContact CE2-SD 4.02Å; F274-M413 HydrophobicContact CG-CE 4.31Å
275	Y	94.4	Very high	92.8	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.016	19%	0.185	C	C	.	.	H	α-helix	trans	-68.5	-43.5	-173.6	-72.3	-63.4	0	0	0	110.8	V271 N272 H277 V278 G279 E351 I354 K355 L358 I365 F367	V271-Y275 HydrophobicContact CG1-CD2 3.83Å; V271-Y275 HydrophobicContact CG1-CE2 3.48Å; V271-Y275 VanDerWaalsContact CG1-CE2 3.48Å; V271-Y275 VanDerWaalsContact O-CD2 3.22Å; V271-Y275 WeakPolarHBondContact O-CD2 3.29Å; V271-Y275 PolarHBondContact O-N 3.43Å; N272-Y275 PolarHBondContact O-N 2.95Å; Y275-H277 VanDerWaalsContact C-N 3.3Å; Y275-H277 PolarHBondContact O-N 3.23Å; Y275-V278 PolarHBondContact O-N 2.79Å; Y275-G279 PolarHBondContact O-N 3.3Å; Y275-E351 HydrophobicContact CD2-CG 3.73Å; Y275-E351 HydrophobicContact CG-CG 4.18Å; Y275-I354 HydrophobicContact CD1-CG2 4.15Å; Y275-K355 HydrophobicContact CD1-CB 4.31Å; Y275-K355 HydrophobicContact CE1-CB 3.99Å; Y275-K355 HydrophobicContact CE1-CG 4.17Å; Y275-K355 HydrophobicContact CE2-CB 4.28Å; Y275-K355 HydrophobicContact CE2-CD 4.12Å; Y275-K355 HydrophobicContact CE2-CG 4.27Å; Y275-L358 HydrophobicContact CD1-CD1 3.87Å; Y275-L358 HydrophobicContact CE1-CD1 3.8Å; Y275-I365 HydrophobicContact CE1-CD1 4.4Å; Y275-F367 HydrophobicContact CE2-CE2 4.03Å; Y275-F367 HydrophobicContact CE2-CZ 4.14Å
276	E	92.7	Very high	93.1	Very high	71 Å²	71	34.7 Å²	34.7	33%	0.332	17%	0.174	S	C	.	.	H	α-helix	trans	-60.8	-36.9	176.6	-68.7	-173.5	147.8	0	0	112.4	R248 N272 Y280	R248-E276 IonicContact CZ-OE2 3.1Å; R248-E276 VanDerWaalsContact NH1-CB 3.3Å; R248-E276 IonicContact NH1-OE2 2.68Å; R248-E276 PolarHBondContact NH1-OE2 2.76Å; R248-E276 IonicContact NH2-OE1 3.86Å; R248-E276 IonicContact NH2-OE2 2.69Å; R248-E276 PolarHBondContact NH2-OE2 3.03Å; N272-E276 WeakPolarHBondContact O-CB 3.38Å; N272-E276 WeakPolarHBondContact O-CG 3.41Å; N272-E276 PolarHBondContact O-N 3.31Å; E276-Y280 WeakPolarHBondContact O-CB 3.28Å; E276-Y280 PolarHBondContact O-N 3.19Å
277	H	93.9	Very high	93.1	Very high	3 Å²	3	37.4 Å²	37.4	1%	0.014	19%	0.186	C	C	.	.	H	α-helix	trans	-67.7	-40.8	174.7	-170.6	107.5	0	0	0	112.2	Y266 D273 F274 Y275 T281	Y266-H277 AromaticContact CE1-CE1 3.96Å; Y266-H277 PolarHBondContact OH-CE1 2.81Å; Y266-H277 PolarHBondContact OH-ND1 2.88Å; D273-H277 WeakPolarHBondContact O-CB 3.14Å; D273-H277 PolarHBondContact O-N 2.98Å; F274-H277 PolarHBondContact O-N 3.04Å; Y275-H277 VanDerWaalsContact C-N 3.3Å; Y275-H277 PolarHBondContact O-N 3.23Å; H277-T281 WeakPolarHBondContact O-CB 3.13Å; H277-T281 PolarHBondContact O-N 3.31Å; H277-T281 PolarHBondContact O-OG1 3.05Å
278	V	94	Very high	93	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-65.2	-46.1	175.7	173.9	0	0	0	0	110.8	F274 Y275 T281 I282 L358 F373 I375	F274-V278 HydrophobicContact CD1-CG2 4.33Å; F274-V278 HydrophobicContact CE1-CG2 3.89Å; F274-V278 HydrophobicContact CZ-CG2 4.1Å; F274-V278 WeakPolarHBondContact O-CG2 3.34Å; F274-V278 PolarHBondContact O-N 2.84Å; F274-V278 VanDerWaalsContact O-N 3.08Å; Y275-V278 PolarHBondContact O-N 2.79Å; V278-T281 WeakPolarHBondContact O-CB 3.24Å; V278-T281 PolarHBondContact O-N 3.45Å; V278-I282 HydrophobicContact CG1-CD1 3.93Å; V278-I282 WeakPolarHBondContact O-CG1 3.29Å; V278-I282 PolarHBondContact O-N 2.88Å; V278-L358 HydrophobicContact CG1-CD1 4.46Å; V278-F373 HydrophobicContact CG1-CE1 4.09Å; V278-F373 HydrophobicContact CG1-CZ 4.5Å; V278-F373 HydrophobicContact CG2-CD1 4.15Å; V278-F373 HydrophobicContact CG2-CE1 3.97Å; V278-I375 HydrophobicContact CG1-CD1 4.33Å; V278-I375 HydrophobicContact CG2-CD1 4.36Å
279	G	92.8	Very high	92.7	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.01	21%	0.21	C	C	.	.	H	α-helix	trans	-63.8	-39.9	177.3	0	0	0	0	0	113.3	Y275 I282 T283	Y275-G279 PolarHBondContact O-N 3.3Å; G279-I282 PolarHBondContact O-N 3.06Å; G279-T283 WeakPolarHBondContact O-CB 3.45Å; G279-T283 PolarHBondContact O-N 3.43Å; G279-T283 PolarHBondContact O-OG1 3.28Å
280	Y	93.8	Very high	92.5	Very high	68 Å²	68	44.2 Å²	44.2	27%	0.267	22%	0.217	S	C	.	.	H	α-helix	trans	-57.8	-50.9	170.8	179.3	-94.6	0	0	0	111.1	Y246 R248 E276 I282 T283 Q284	Y246-Y280 WeakPolarHBondContact O-CD1 3.12Å; R248-Y280 HydrophobicContact CB-CD1 3.71Å; R248-Y280 HydrophobicContact CB-CD2 4.41Å; R248-Y280 HydrophobicContact CB-CE1 4.06Å; R248-Y280 HydrophobicContact CB-CG 3.9Å; R248-Y280 HydrophobicContact CG-CD1 4.42Å; R248-Y280 HydrophobicContact CG-CD2 4.25Å; R248-Y280 HydrophobicContact CG-CG 4.17Å; E276-Y280 WeakPolarHBondContact O-CB 3.28Å; E276-Y280 PolarHBondContact O-N 3.19Å; Y280-I282 PolarHBondContact O-N 2.94Å; Y280-T283 PolarHBondContact O-N 2.85Å; Y280-Q284 HydrophobicContact CD1-CG 3.93Å; Y280-Q284 HydrophobicContact CD2-CG 4.25Å; Y280-Q284 HydrophobicContact CE1-CG 3.64Å; Y280-Q284 HydrophobicContact CE2-CG 3.99Å; Y280-Q284 VanDerWaalsContact CE2-NE2 3.27Å; Y280-Q284 HydrophobicContact CG-CG 4.23Å; Y280-Q284 VanDerWaalsContact CZ-NE2 3.26Å; Y280-Q284 WeakPolarHBondContact O-CB 3.35Å; Y280-Q284 VanDerWaalsContact O-CG 3.25Å; Y280-Q284 WeakPolarHBondContact O-CG 3.35Å; Y280-Q284 PolarHBondContact O-N 2.88Å; Y280-Q284 PolarHBondContact OH-NE2 3.48Å; Y280-Q284 VanDerWaalsContact OH-NE2 3.14Å
281	T	94.5	Very high	92.3	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-55.8	-48	179.6	-58.1	0	0	0	0	112.2	Y246 H277 V278 Q284 F285 I375 I402	Y246-T281 PolarHBondContact O-OG1 2.86Å; H277-T281 WeakPolarHBondContact O-CB 3.13Å; H277-T281 PolarHBondContact O-N 3.31Å; H277-T281 PolarHBondContact O-OG1 3.05Å; V278-T281 WeakPolarHBondContact O-CB 3.24Å; V278-T281 PolarHBondContact O-N 3.45Å; T281-Q284 PolarHBondContact O-N 2.67Å; T281-F285 WeakPolarHBondContact O-CB 3.41Å; T281-F285 PolarHBondContact O-N 2.9Å; T281-I375 HydrophobicContact CG2-CD1 3.89Å; T281-I375 HydrophobicContact CG2-CG2 4.16Å; T281-I402 HydrophobicContact CG2-CD1 3.57Å
282	I	93.2	Very high	92.3	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.1	-43.3	179.5	-63.7	165.2	0	0	0	110.7	V278 G279 Y280 F285 N286 M305 L307 I338 V340 I343 L348 F357	V278-I282 HydrophobicContact CG1-CD1 3.93Å; V278-I282 WeakPolarHBondContact O-CG1 3.29Å; V278-I282 PolarHBondContact O-N 2.88Å; G279-I282 PolarHBondContact O-N 3.06Å; Y280-I282 PolarHBondContact O-N 2.94Å; I282-F285 PolarHBondContact O-N 2.88Å; I282-N286 PolarHBondContact O-N 2.77Å; I282-N286 VanDerWaalsContact O-N 3.11Å; I282-M305 HydrophobicContact CG1-SD 3.84Å; I282-L307 HydrophobicContact CD1-CD1 4.36Å; I282-I338 HydrophobicContact CD1-CD1 4.37Å; I282-I338 HydrophobicContact CG2-CD1 4.5Å; I282-V340 HydrophobicContact CG2-CG1 3.98Å; I282-V340 HydrophobicContact CG2-CG2 4.42Å; I282-I343 HydrophobicContact CG2-CD1 4.1Å; I282-L348 HydrophobicContact CB-CD1 4.24Å; I282-L348 HydrophobicContact CD1-CD2 4.47Å; I282-L348 HydrophobicContact CG2-CD1 3.7Å; I282-F357 HydrophobicContact CD1-CE1 4.16Å
283	T	91.5	Very high	92.3	Very high	40 Å²	40	48.1 Å²	48.1	25%	0.245	23%	0.233	C	C	.	.	H	α-helix	trans	-63.8	-43.7	178.9	-58.8	0	0	0	0	112	G279 Y280 N286 K287	G279-T283 WeakPolarHBondContact O-CB 3.45Å; G279-T283 PolarHBondContact O-N 3.43Å; G279-T283 PolarHBondContact O-OG1 3.28Å; Y280-T283 PolarHBondContact O-N 2.85Å; T283-N286 PolarHBondContact O-N 2.84Å; T283-K287 HydrophobicContact CG2-CD 4.38Å; T283-K287 PolarHBondContact O-N 2.94Å
284	Q	92.6	Very high	91.8	Very high	33 Å²	33	47 Å²	47	15%	0.154	24%	0.235	C	C	.	.	H	α-helix	trans	-66.1	-42.2	177.9	-70.5	-68.7	1.7	0	0	111.7	L245 Y246 Y280 T281 N286 K287 T288	L245-Q284 VanDerWaalsContact O-CB 3.31Å; L245-Q284 WeakPolarHBondContact O-CB 3.48Å; L245-Q284 WeakPolarHBondContact O-CG 3.31Å; Y246-Q284 HydrophobicContact CD1-CB 3.84Å; Y246-Q284 HydrophobicContact CE1-CB 4.22Å; Y280-Q284 HydrophobicContact CD1-CG 3.93Å; Y280-Q284 HydrophobicContact CD2-CG 4.25Å; Y280-Q284 HydrophobicContact CE1-CG 3.64Å; Y280-Q284 HydrophobicContact CE2-CG 3.99Å; Y280-Q284 VanDerWaalsContact CE2-NE2 3.27Å; Y280-Q284 HydrophobicContact CG-CG 4.23Å; Y280-Q284 VanDerWaalsContact CZ-NE2 3.26Å; Y280-Q284 WeakPolarHBondContact O-CB 3.35Å; Y280-Q284 VanDerWaalsContact O-CG 3.25Å; Y280-Q284 WeakPolarHBondContact O-CG 3.35Å; Y280-Q284 PolarHBondContact O-N 2.88Å; Y280-Q284 PolarHBondContact OH-NE2 3.48Å; Y280-Q284 VanDerWaalsContact OH-NE2 3.14Å; T281-Q284 PolarHBondContact O-N 2.67Å; Q284-N286 VanDerWaalsContact C-N 3.32Å; Q284-N286 PolarHBondContact O-N 3.03Å; Q284-K287 CarbonylContact O-C 3.56Å; Q284-K287 PolarHBondContact O-N 3.35Å; Q284-K287 VanDerWaalsContact O-N 3.12Å; Q284-T288 PolarHBondContact O-N 3.42Å; Q284-T288 PolarHBondContact O-OG1 2.87Å
285	F	93.1	Very high	91.4	Very high	2 Å²	2	49.1 Å²	49.1	1%	0.009	26%	0.257	C	S	.	.	H	α-helix	trans	-56.7	-46	173.7	175.9	-104.5	0	0	0	111.9	Y246 T281 I282 K287 T288 F298 R303 M305 V340 F377 L379	Y246-F285 HydrophobicContact CE1-CB 4.32Å; T281-F285 WeakPolarHBondContact O-CB 3.41Å; T281-F285 PolarHBondContact O-N 2.9Å; I282-F285 PolarHBondContact O-N 2.88Å; F285-K287 PolarHBondContact O-N 3.37Å; F285-T288 WeakPolarHBondContact CA-OG1 3.37Å; F285-T288 WeakPolarHBondContact O-CB 3.26Å; F285-T288 PolarHBondContact O-N 3.13Å; F285-T288 PolarHBondContact O-OG1 3.34Å; F285-F298 HydrophobicContact CD2-CE1 4.1Å; F285-F298 HydrophobicContact CE1-CD1 4.37Å; F285-F298 HydrophobicContact CE1-CE1 4.16Å; F285-F298 AromaticContact CE2-CD1 3.77Å; F285-F298 HydrophobicContact CE2-CD1 3.77Å; F285-F298 AromaticContact CE2-CE1 3.67Å; F285-F298 HydrophobicContact CE2-CE1 3.67Å; F285-F298 AromaticContact CZ-CD1 3.64Å; F285-F298 HydrophobicContact CZ-CD1 3.64Å; F285-F298 AromaticContact CZ-CE1 3.72Å; F285-F298 HydrophobicContact CZ-CE1 3.72Å; F285-F298 WeakPolarHBondContact O-CE1 3.41Å; F285-F298 WeakPolarHBondContact O-CZ 3.47Å; F285-R303 HydrophobicContact CE1-CB 4.05Å; F285-M305 HydrophobicContact CB-CE 3.39Å; F285-M305 HydrophobicContact CD1-CE 3.65Å; F285-M305 HydrophobicContact CD2-CE 4.17Å; F285-M305 HydrophobicContact CE1-CB 4.37Å; F285-M305 HydrophobicContact CE1-CE 4.43Å; F285-M305 HydrophobicContact CG-CE 3.46Å; F285-M305 VanDerWaalsContact CG-CE 3.46Å; F285-V340 HydrophobicContact CD1-CB 4.13Å; F285-V340 HydrophobicContact CD1-CG1 4.25Å; F285-V340 HydrophobicContact CD1-CG2 3.86Å; F285-V340 HydrophobicContact CE1-CB 4.26Å; F285-V340 HydrophobicContact CE1-CG2 3.98Å; F285-F377 HydrophobicContact CD2-CB 4.15Å; F285-F377 HydrophobicContact CD2-CD1 4.34Å; F285-F377 AromaticContact CD2-CD2 3.37Å; F285-F377 HydrophobicContact CD2-CD2 3.37Å; F285-F377 AromaticContact CD2-CE2 3.7Å; F285-F377 HydrophobicContact CD2-CE2 3.7Å; F285-F377 AromaticContact CD2-CG 3.71Å; F285-F377 HydrophobicContact CD2-CG 3.71Å; F285-F377 HydrophobicContact CD2-CZ 4.32Å; F285-F377 HydrophobicContact CE2-CB 3.67Å; F285-F377 AromaticContact CE2-CD2 3.4Å; F285-F377 HydrophobicContact CE2-CD2 3.4Å; F285-F377 HydrophobicContact CE2-CE2 4.16Å; F285-F377 AromaticContact CE2-CG 3.7Å; F285-F377 HydrophobicContact CE2-CG 3.7Å; F285-F377 HydrophobicContact CG-CD2 4.49Å; F285-F377 HydrophobicContact CZ-CB 4.04Å; F285-F377 HydrophobicContact CZ-CG 4.49Å; F285-L379 HydrophobicContact CE2-CD2 4.1Å
286	N	90.7	Very high	91.2	Very high	37 Å²	37	50 Å²	50	20%	0.198	26%	0.26	C	S	.	.	H	α-helix	trans	-58.8	-37.4	177.8	-156	11.7	0	0	0	112.5	I282 T283 Q284 R303 V340	I282-N286 PolarHBondContact O-N 2.77Å; I282-N286 VanDerWaalsContact O-N 3.11Å; T283-N286 PolarHBondContact O-N 2.84Å; Q284-N286 VanDerWaalsContact C-N 3.32Å; Q284-N286 PolarHBondContact O-N 3.03Å; N286-R303 PolarHBondContact O-NH1 3.18Å; N286-R303 PolarHBondContact OD1-NH1 2.99Å; N286-V340 HydrophobicContact CB-CG1 3.59Å
287	K	90	Very high	91	Very high	89 Å²	89	50.4 Å²	50.4	39%	0.387	26%	0.263	S	S	.	.	H	α-helix	trans	-90.8	4.9	-178.2	-64.7	179.2	-179.3	178.9	0	114.3	T283 Q284 F285 K289 E290 L291	T283-K287 HydrophobicContact CG2-CD 4.38Å; T283-K287 PolarHBondContact O-N 2.94Å; Q284-K287 CarbonylContact O-C 3.56Å; Q284-K287 PolarHBondContact O-N 3.35Å; Q284-K287 VanDerWaalsContact O-N 3.12Å; F285-K287 PolarHBondContact O-N 3.37Å; K287-K289 VanDerWaalsContact C-N 3.26Å; K287-K289 PolarHBondContact O-N 3.25Å; K287-K289 VanDerWaalsContact O-N 3.1Å; K287-E290 PolarHBondContact O-N 2.84Å; K287-L291 HydrophobicContact CB-CD1 3.5Å; K287-L291 HydrophobicContact CB-CG 3.95Å; K287-L291 HydrophobicContact CD-CD1 4.14Å; K287-L291 HydrophobicContact CG-CD1 4.47Å; K287-L291 PolarHBondContact O-N 3.06Å
288	T	91.6	Very high	90.8	Very high	2 Å²	2	52 Å²	52	1%	0.012	27%	0.27	C	S	.	.	H	α-helix	trans	-49.4	-43.7	-175.5	-58	0	0	0	0	112.8	Y246 Q284 F285 E290 L291 A292 L379	Y246-T288 VanDerWaalsContact OH-CG2 3.26Å; Y246-T288 WeakPolarHBondContact OH-CG2 3.37Å; Y246-T288 PolarHBondContact OH-OG1 2.87Å; Q284-T288 PolarHBondContact O-N 3.42Å; Q284-T288 PolarHBondContact O-OG1 2.87Å; F285-T288 WeakPolarHBondContact CA-OG1 3.37Å; F285-T288 WeakPolarHBondContact O-CB 3.26Å; F285-T288 PolarHBondContact O-N 3.13Å; F285-T288 PolarHBondContact O-OG1 3.34Å; T288-E290 VanDerWaalsContact C-N 3.25Å; T288-E290 PolarHBondContact O-N 3.3Å; T288-L291 PolarHBondContact O-N 3.33Å; T288-A292 HydrophobicContact CG2-CB 4.15Å; T288-A292 WeakPolarHBondContact O-CB 3.33Å; T288-A292 PolarHBondContact O-N 2.87Å; T288-L379 HydrophobicContact CG2-CD1 4.23Å; T288-L379 HydrophobicContact CG2-CD2 4.38Å
289	K	87.1	Confident	90.2	Very high	167 Å²	167	54.5 Å²	54.5	73%	0.726	28%	0.283	S	S	*	.	H	α-helix	trans	-66.5	-23.6	-179.3	-173	179	176.4	-172.6	0	113.9	K287 F298	K287-K289 VanDerWaalsContact C-N 3.26Å; K287-K289 PolarHBondContact O-N 3.25Å; K287-K289 VanDerWaalsContact O-N 3.1Å; K289-F298 HydrophobicContact CB-CE2 4.33Å
290	E	88.7	Confident	89.6	Confident	156 Å²	156	56.4 Å²	56.4	73%	0.729	30%	0.297	S	S	*	.	H	α-helix	trans	-96.4	-29.7	-177.8	-66.5	167.5	-164.8	0	0	112	K287 T288	K287-E290 PolarHBondContact O-N 2.84Å; T288-E290 VanDerWaalsContact C-N 3.25Å; T288-E290 PolarHBondContact O-N 3.3Å
291	L	90.8	Very high	88.8	Confident	85 Å²	85	59 Å²	59	45%	0.445	31%	0.314	S	S	.	.	H	α-helix	trans	-102.3	-29.2	-173.8	-63	175.9	0	0	0	114.1	L245 K287 T288	L245-L291 HydrophobicContact CD2-CB 4.41Å; K287-L291 HydrophobicContact CB-CD1 3.5Å; K287-L291 HydrophobicContact CB-CG 3.95Å; K287-L291 HydrophobicContact CD-CD1 4.14Å; K287-L291 HydrophobicContact CG-CD1 4.47Å; K287-L291 PolarHBondContact O-N 3.06Å; T288-L291 PolarHBondContact O-N 3.33Å
292	A	92.2	Very high	87.8	Confident	17 Å²	17	62.6 Å²	62.6	14%	0.14	33%	0.334	C	S	.	.			trans	-80.3	125.9	-177.1	0	0	0	0	0	111.8	L245 T288 G294 Y296	L245-A292 HydrophobicContact CD1-CB 3.87Å; L245-A292 HydrophobicContact CD2-CB 4.5Å; T288-A292 HydrophobicContact CG2-CB 4.15Å; T288-A292 WeakPolarHBondContact O-CB 3.33Å; T288-A292 PolarHBondContact O-N 2.87Å; A292-G294 WeakPolarHBondContact CB-O 3.4Å; A292-Y296 HydrophobicContact CB-CD2 3.93Å; A292-Y296 HydrophobicContact CB-CE2 4.49Å
293	I	92.3	Very high	87.5	Confident	181 Å²	181	65.5 Å²	65.5	93%	0.928	35%	0.345	S	S	*	.	S	Bend	trans	-68.3	-36.8	174.7	-61	173.5	0	0	0	110.9	G295	I293-G295 PolarHBondContact O-N 3.5Å
294	G	82.8	Confident	87.5	Confident	30 Å²	30	66.6 Å²	66.6	31%	0.309	35%	0.352	S	S	.	.	S	Bend	trans	-70	125.2	165.8	0	0	0	0	0	109	A292 Y296	A292-G294 WeakPolarHBondContact CB-O 3.4Å; G294-Y296 WeakPolarHBondContact O-CD2 3.45Å; G294-Y296 PolarHBondContact O-N 3.41Å
295	G	86.3	Confident	87.5	Confident	46 Å²	46	65.1 Å²	65.1	47%	0.474	35%	0.345	S	S	.	.			trans	-71.1	54.4	-177.2	0	0	0	0	0	114.1	I293	I293-G295 PolarHBondContact O-N 3.5Å
296	Y	90.6	Very high	87.5	Confident	21 Å²	21	69.1 Å²	69.1	8%	0.082	36%	0.362	C	S	.	.			trans	-66.3	140.1	-179.1	-59.1	-70.9	0	0	0	111.1	S238 F242 A292 G294 L380 F398	S238-Y296 PolarHBondContact OG-OH 3.38Å; F242-Y296 HydrophobicContact CE1-CD1 4.28Å; F242-Y296 HydrophobicContact CE1-CD2 4.04Å; F242-Y296 AromaticContact CE1-CE1 3.95Å; F242-Y296 HydrophobicContact CE1-CE1 3.95Å; F242-Y296 AromaticContact CE1-CE2 3.68Å; F242-Y296 HydrophobicContact CE1-CE2 3.68Å; F242-Y296 HydrophobicContact CE1-CG 4.33Å; F242-Y296 AromaticContact CE1-CZ 3.63Å; F242-Y296 HydrophobicContact CZ-CD1 4.21Å; F242-Y296 AromaticContact CZ-CE1 3.69Å; F242-Y296 HydrophobicContact CZ-CE1 3.69Å; F242-Y296 HydrophobicContact CZ-CE2 4.24Å; F242-Y296 AromaticContact CZ-CZ 3.7Å; A292-Y296 HydrophobicContact CB-CD2 3.93Å; A292-Y296 HydrophobicContact CB-CE2 4.49Å; G294-Y296 WeakPolarHBondContact O-CD2 3.45Å; G294-Y296 PolarHBondContact O-N 3.41Å; Y296-L380 CarbonylContact C-O 3.57Å; Y296-L380 WeakPolarHBondContact CA-O 3.42Å; Y296-F398 HydrophobicContact CE1-CD2 4.34Å; Y296-F398 AromaticContact CE1-CE2 3.95Å; Y296-F398 HydrophobicContact CE1-CE2 3.95Å
297	M	88.9	Confident	87.8	Confident	81 Å²	81	67.3 Å²	67.3	40%	0.399	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	150.8	180	-62.9	-177	62.8	0	0	110.4	L379 L380 I429	M297-L379 WeakPolarHBondContact O-CA 3.45Å; M297-L380 HydrophobicContact CB-CB 4.32Å; M297-L380 PolarHBondContact N-O 3.19Å; M297-L380 PolarHBondContact O-N 2.89Å; M297-I429 HydrophobicContact CE-CD1 3.88Å; M297-I429 HydrophobicContact CE-CG2 4.4Å; M297-I429 HydrophobicContact SD-CD1 3.62Å
298	F	89.2	Confident	88	Confident	36 Å²	36	63.1 Å²	63.1	16%	0.158	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	139.6	173.2	-58.2	-75	0	0	0	110.3	F285 K289 S300 R303 L379	F285-F298 HydrophobicContact CD2-CE1 4.1Å; F285-F298 HydrophobicContact CE1-CD1 4.37Å; F285-F298 HydrophobicContact CE1-CE1 4.16Å; F285-F298 AromaticContact CE2-CD1 3.77Å; F285-F298 HydrophobicContact CE2-CD1 3.77Å; F285-F298 AromaticContact CE2-CE1 3.67Å; F285-F298 HydrophobicContact CE2-CE1 3.67Å; F285-F298 AromaticContact CZ-CD1 3.64Å; F285-F298 HydrophobicContact CZ-CD1 3.64Å; F285-F298 AromaticContact CZ-CE1 3.72Å; F285-F298 HydrophobicContact CZ-CE1 3.72Å; F285-F298 WeakPolarHBondContact O-CE1 3.41Å; F285-F298 WeakPolarHBondContact O-CZ 3.47Å; K289-F298 HydrophobicContact CB-CE2 4.33Å; F298-S300 WeakPolarHBondContact CB-O 3.48Å; F298-S300 PolarHBondContact O-N 3.49Å; F298-R303 HydrophobicContact CB-CG 4.43Å; F298-R303 HydrophobicContact CD1-CG 4.04Å; F298-R303 HydrophobicContact CD2-CG 3.84Å; F298-R303 HydrophobicContact CE1-CG 4.23Å; F298-R303 HydrophobicContact CE2-CG 4.06Å; F298-R303 VanDerWaalsContact CE2-NE 3.34Å; F298-R303 HydrophobicContact CG-CG 3.83Å; F298-R303 HydrophobicContact CZ-CG 4.24Å; F298-L379 HydrophobicContact CD1-CD2 3.97Å; F298-L379 HydrophobicContact CE1-CD2 4.24Å
299	D	81.9	Confident	88.1	Confident	52 Å²	52	63.5 Å²	63.5	28%	0.278	34%	0.336	S	S	.	.	S	Bend	trans	-65.7	-21.4	179.6	-170.4	52.5	0	0	0	113.2	N378 R397	D299-N378 HydrophobicContact CB-CB 3.54Å; D299-N378 WeakPolarHBondContact OD2-CB 3.13Å; D299-N378 PolarHBondContact OD2-ND2 2.97Å; D299-R397 IonicContact OD1-CZ 2.7Å; D299-R397 IonicContact OD1-NE 2.61Å; D299-R397 PolarHBondContact OD1-NE 3.42Å; D299-R397 IonicContact OD1-NH2 3.13Å; D299-R397 PolarHBondContact OD1-NH2 3.3Å; D299-R397 IonicContact OD2-CZ 2.85Å; D299-R397 IonicContact OD2-NE 2.99Å; D299-R397 PolarHBondContact OD2-NE 3.03Å; D299-R397 IonicContact OD2-NH2 3.18Å; D299-R397 PolarHBondContact OD2-NH2 3.29Å
300	S	80.2	Confident	88.4	Confident	42 Å²	42	58.5 Å²	58.5	29%	0.294	31%	0.312	S	S	.	.	S	Bend	trans	-138.8	153.6	177	68.9	0	0	0	0	110.8	F298 N302 T304	F298-S300 WeakPolarHBondContact CB-O 3.48Å; F298-S300 PolarHBondContact O-N 3.49Å; S300-N302 PolarHBondContact O-N 3.35Å; S300-T304 PolarHBondContact OG-OG1 3.19Å; S300-T304 VanDerWaalsContact OG-OG1 3.12Å
301	L	75.6	Confident	88.3	Confident	121 Å²	121	54.2 Å²	54.2	63%	0.634	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-34	175.3	-83.7	93.3	0	0	0	112.3	R303 N341 Y436	L301-R303 VanDerWaalsContact C-N 3.26Å; L301-R303 PolarHBondContact O-N 3.16Å; L301-N341 PolarHBondContact O-ND2 2.83Å; L301-N341 VanDerWaalsContact O-ND2 3.13Å; L301-Y436 HydrophobicContact CD2-CE2 4.48Å
302	N	75.2	Confident	88	Confident	77 Å²	77	50.7 Å²	50.7	41%	0.412	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	9.6	-170.5	-70.6	20.3	0	0	0	114.5	S300 T304 E339	S300-N302 PolarHBondContact O-N 3.35Å; N302-T304 HydrophobicContact CB-CG2 4.22Å; N302-T304 PolarHBondContact O-N 2.81Å; N302-E339 HydrophobicContact CB-CG 4.21Å; N302-E339 WeakPolarHBondContact CB-OE1 3.38Å; N302-E339 PolarHBondContact ND2-OE1 3.49Å; N302-E339 PolarHBondContact ND2-OE2 2.86Å
303	R	87.1	Confident	87.1	Confident	61 Å²	61	51.6 Å²	51.6	23%	0.23	28%	0.278	C	S	.	.			trans	41.7	59.6	179.8	-61.4	-165.9	-159.5	161.5	3	112.4	F285 N286 F298 L301 V340 N341	F285-R303 HydrophobicContact CE1-CB 4.05Å; N286-R303 PolarHBondContact O-NH1 3.18Å; N286-R303 PolarHBondContact OD1-NH1 2.99Å; F298-R303 HydrophobicContact CB-CG 4.43Å; F298-R303 HydrophobicContact CD1-CG 4.04Å; F298-R303 HydrophobicContact CD2-CG 3.84Å; F298-R303 HydrophobicContact CE1-CG 4.23Å; F298-R303 HydrophobicContact CE2-CG 4.06Å; F298-R303 VanDerWaalsContact CE2-NE 3.34Å; F298-R303 HydrophobicContact CG-CG 3.83Å; F298-R303 HydrophobicContact CZ-CG 4.24Å; L301-R303 VanDerWaalsContact C-N 3.26Å; L301-R303 PolarHBondContact O-N 3.16Å; R303-V340 HydrophobicContact CB-CB 4.5Å; R303-V340 PolarHBondContact O-N 3.06Å; R303-N341 WeakPolarHBondContact CD-OD1 3.24Å; R303-N341 VanDerWaalsContact CG-OD1 3.24Å; R303-N341 WeakPolarHBondContact CG-OD1 3.33Å; R303-N341 PolarHBondContact NE-OD1 2.78Å
304	T	89.7	Confident	85.8	Confident	63 Å²	63	44.9 Å²	44.9	39%	0.387	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.6	127.5	-175.2	50.5	0	0	0	0	112.2	S300 N302 I338 E339	S300-T304 PolarHBondContact OG-OG1 3.19Å; S300-T304 VanDerWaalsContact OG-OG1 3.12Å; N302-T304 HydrophobicContact CB-CG2 4.22Å; N302-T304 PolarHBondContact O-N 2.81Å; T304-I338 WeakPolarHBondContact CA-O 3.12Å; T304-E339 HydrophobicContact CG2-CG 4.37Å
305	M	92.8	Very high	84.7	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.01	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	139.6	170.5	178.5	-175.8	-74.5	0	0	109.3	I282 F285 L307 S337 I338 V340 I375 F377	I282-M305 HydrophobicContact CG1-SD 3.84Å; F285-M305 HydrophobicContact CB-CE 3.39Å; F285-M305 HydrophobicContact CD1-CE 3.65Å; F285-M305 HydrophobicContact CD2-CE 4.17Å; F285-M305 HydrophobicContact CE1-CB 4.37Å; F285-M305 HydrophobicContact CE1-CE 4.43Å; F285-M305 HydrophobicContact CG-CE 3.46Å; F285-M305 VanDerWaalsContact CG-CE 3.46Å; M305-L307 HydrophobicContact CG-CD2 4.2Å; M305-L307 HydrophobicContact SD-CD2 3.88Å; M305-S337 CarbonylContact O-C 3.58Å; M305-S337 WeakPolarHBondContact O-CA 3.48Å; M305-I338 HydrophobicContact CB-CD1 4.45Å; M305-I338 HydrophobicContact CB-CG1 4.01Å; M305-I338 PolarHBondContact N-O 2.91Å; M305-I338 WeakPolarHBondContact O-CG1 3.45Å; M305-I338 PolarHBondContact O-N 2.86Å; M305-I338 HydrophobicContact SD-CD1 4.45Å; M305-V340 HydrophobicContact CB-CG2 3.97Å; M305-I375 HydrophobicContact CE-CG2 4.09Å; M305-I375 HydrophobicContact CG-CG2 3.91Å; M305-I375 HydrophobicContact SD-CG2 3.5Å; M305-I375 WeakPolarHBondContact SD-CG2 3.3Å; M305-F377 HydrophobicContact CB-CB 4.49Å; M305-F377 HydrophobicContact CE-CD1 3.71Å; M305-F377 HydrophobicContact CE-CE1 4.09Å; M305-F377 HydrophobicContact CE-CG 4.31Å; M305-F377 HydrophobicContact CG-CB 4.42Å; M305-F377 HydrophobicContact CG-CD1 4.41Å
306	K	94.1	Very high	83.1	Confident	85 Å²	85	49.1 Å²	49.1	37%	0.37	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	122.5	177.2	-177.4	-164.4	-175.2	-154.5	0	109.2	C308 C335 T336 H376	K306-C308 WeakPolarHBondContact CE-SG 3.4Å; K306-C335 VanDerWaalsContact CE-SG 3.51Å; K306-C335 HydrophobicContact CG-CB 4.41Å; K306-T336 CarbonylContact C-O 3.54Å; K306-T336 WeakPolarHBondContact CA-O 3.17Å; K306-H376 HydrophobicContact CB-CB 4.2Å; K306-H376 PolarHBondContact N-O 3.04Å; K306-H376 PolarHBondContact O-N 3.18Å
307	L	95.7	Very high	81.3	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	129.4	177.2	-57	177.6	0	0	0	108.8	I282 M305 C335 T336 I338 L358 L363 F373 I375	I282-L307 HydrophobicContact CD1-CD1 4.36Å; M305-L307 HydrophobicContact CG-CD2 4.2Å; M305-L307 HydrophobicContact SD-CD2 3.88Å; L307-C335 CarbonylContact O-C 3.57Å; L307-C335 VanDerWaalsContact O-CA 3.24Å; L307-C335 WeakPolarHBondContact O-CA 3.12Å; L307-T336 HydrophobicContact CB-CG2 4.17Å; L307-T336 PolarHBondContact N-O 2.76Å; L307-T336 PolarHBondContact O-N 2.81Å; L307-I338 HydrophobicContact CD1-CD1 3.79Å; L307-I338 HydrophobicContact CD1-CG1 4.47Å; L307-I338 HydrophobicContact CG-CD1 4.21Å; L307-L358 HydrophobicContact CD1-CD2 3.87Å; L307-L363 HydrophobicContact CB-CD1 3.74Å; L307-L363 HydrophobicContact CD1-CD1 4.34Å; L307-F373 HydrophobicContact CB-CZ 4.08Å; L307-F373 HydrophobicContact CD2-CE1 4.23Å; L307-F373 HydrophobicContact CD2-CZ 4.38Å; L307-I375 HydrophobicContact CD2-CB 4.22Å; L307-I375 HydrophobicContact CD2-CD1 4.33Å; L307-I375 HydrophobicContact CD2-CG1 3.79Å; L307-I375 HydrophobicContact CD2-CG2 3.89Å
308	C	95.5	Very high	79.6	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	131.9	-178.4	-64.6	0	0	0	0	111	K306 E333 K334 C335 F373 D374	K306-C308 WeakPolarHBondContact CE-SG 3.4Å; C308-E333 HydrophobicContact CB-CG 4.39Å; C308-E333 WeakPolarHBondContact CB-OE1 3.45Å; C308-K334 WeakPolarHBondContact CA-O 3.24Å; C308-C335 HydrophobicContact CB-CB 4.14Å; C308-C335 WeakPolarHBondContact CB-SG 3.45Å; C308-C335 WeakPolarHBondContact SG-CB 3.37Å; C308-C335 CovalentContact SG-SG 2.04Å; C308-C335 PolarHBondContact SG-SG 3.31Å; C308-F373 CarbonylContact O-C 3.54Å; C308-F373 WeakPolarHBondContact O-CA 3.14Å; C308-D374 HydrophobicContact CB-CB 4.24Å; C308-D374 PolarHBondContact N-O 3.3Å; C308-D374 PolarHBondContact O-N 3.35Å
309	M	93.7	Very high	77.9	Confident	10 Å²	10	65 Å²	65	5%	0.049	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	132.8	169.4	65.6	-176.9	-68	0	0	110	Y311 E333 K334 L363 D364 L370 F373	M309-Y311 HydrophobicContact CE-CD1 3.81Å; M309-Y311 HydrophobicContact CE-CE1 4.36Å; M309-Y311 HydrophobicContact CE-CG 4.14Å; M309-Y311 HydrophobicContact CG-CD1 4.12Å; M309-Y311 HydrophobicContact CG-CE1 4.45Å; M309-E333 WeakPolarHBondContact O-CA 3.44Å; M309-K334 HydrophobicContact CG-CB 3.89Å; M309-K334 PolarHBondContact N-O 3.12Å; M309-K334 PolarHBondContact O-N 3.28Å; M309-K334 HydrophobicContact SD-CD 4.42Å; M309-L363 HydrophobicContact CB-CD2 4.45Å; M309-L363 HydrophobicContact CG-CD2 3.79Å; M309-L363 HydrophobicContact SD-CB 4.31Å; M309-L363 HydrophobicContact SD-CD2 3.76Å; M309-D364 WeakPolarHBondContact CE-O 3.28Å; M309-L370 HydrophobicContact CB-CD1 4.24Å; M309-F373 HydrophobicContact CB-CD2 4.03Å; M309-F373 HydrophobicContact CB-CE2 4.43Å
310	R	92.2	Very high	76.4	Confident	62 Å²	62	70 Å²	70	23%	0.234	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	123.3	171.4	-68.4	-175.6	-68.5	107.4	1.6	108.8	S332 E333 L371 G372 D374	R310-S332 WeakPolarHBondContact CA-O 3.39Å; R310-E333 HydrophobicContact CG-CB 4.17Å; R310-E333 HydrophobicContact CG-CG 3.95Å; R310-L371 PolarHBondContact O-N 2.87Å; R310-G372 PolarHBondContact N-O 3.39Å; R310-G372 PolarHBondContact O-N 3.45Å; R310-G372 VanDerWaalsContact O-N 3.16Å; R310-D374 IonicContact CZ-OD2 3.41Å; R310-D374 IonicContact NE-OD2 2.73Å; R310-D374 PolarHBondContact NE-OD2 3.34Å; R310-D374 VanDerWaalsContact NE-OD2 3.09Å; R310-D374 IonicContact NH2-OD2 2.62Å
311	Y	88	Confident	75.1	Confident	66 Å²	66	76 Å²	76	26%	0.259	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	159.5	-172.7	68.8	-79.5	0	0	0	112.7	M309 S313 S332 K334 Y369	M309-Y311 HydrophobicContact CE-CD1 3.81Å; M309-Y311 HydrophobicContact CE-CE1 4.36Å; M309-Y311 HydrophobicContact CE-CG 4.14Å; M309-Y311 HydrophobicContact CG-CD1 4.12Å; M309-Y311 HydrophobicContact CG-CE1 4.45Å; Y311-S313 VanDerWaalsContact CE2-OG 3.26Å; Y311-S313 WeakPolarHBondContact CE2-OG 3.31Å; Y311-S332 VanDerWaalsContact CD1-O 3.26Å; Y311-S332 WeakPolarHBondContact CD1-O 3.44Å; Y311-S332 PolarHBondContact N-O 2.94Å; Y311-S332 PolarHBondContact O-N 3.31Å; Y311-K334 HydrophobicContact CE1-CB 4.1Å; Y311-Y369 CarbonylContact C-O 3.59Å; Y311-Y369 WeakPolarHBondContact CA-O 3.48Å; Y311-Y369 WeakPolarHBondContact CB-O 3.49Å
312	V	83.2	Confident	74	Confident	11 Å²	11	73.2 Å²	73.2	7%	0.067	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	124.3	172.9	171.5	0	0	0	0	109.6	P314 I329 Y369 L371	V312-P314 VanDerWaalsContact O-CD 3.28Å; V312-P314 WeakPolarHBondContact O-CD 3.36Å; V312-I329 HydrophobicContact CB-CG2 4.21Å; V312-I329 HydrophobicContact CG1-CB 4.21Å; V312-I329 HydrophobicContact CG1-CG1 3.91Å; V312-I329 HydrophobicContact CG1-CG2 3.74Å; V312-I329 HydrophobicContact CG2-CG2 3.59Å; V312-Y369 PolarHBondContact N-O 2.97Å; V312-Y369 WeakPolarHBondContact O-CB 3.36Å; V312-L371 HydrophobicContact CG2-CD1 3.8Å; V312-L371 HydrophobicContact CG2-CD2 3.94Å; V312-L371 HydrophobicContact CG2-CG 3.91Å
313	S	73.1	Confident	72.9	Confident	37 Å²	37	77.1 Å²	77.1	26%	0.259	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	110.4	169.1	-64.3	0	0	0	0	110.1	Y311 T315 R330	Y311-S313 VanDerWaalsContact CE2-OG 3.26Å; Y311-S313 WeakPolarHBondContact CE2-OG 3.31Å; S313-T315 PolarHBondContact O-N 3.3Å; S313-R330 PolarHBondContact N-O 3.23Å; S313-R330 VanDerWaalsContact N-O 3.09Å
314	P	65.4	Low	71.2	Confident	40 Å²	40	81.9 Å²	81.9	26%	0.26	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	119.7	174.6	30.2	-35.3	0	0	0	110.4	V312 T316 V326 Y369	V312-P314 VanDerWaalsContact O-CD 3.28Å; V312-P314 WeakPolarHBondContact O-CD 3.36Å; P314-T316 PolarHBondContact O-N 3Å; P314-V326 HydrophobicContact CB-CG2 4.48Å; P314-Y369 HydrophobicContact CB-CE1 4.16Å; P314-Y369 HydrophobicContact CG-CD1 4.39Å; P314-Y369 HydrophobicContact CG-CE1 3.86Å; P314-Y369 HydrophobicContact CG-CE2 4.16Å
315	T	59.6	Low	69.2	Low	79 Å²	79	80 Å²	80	49%	0.485	41%	0.41	S	S	.	.			trans	-79.3	95	167.9	55.5	0	0	0	0	109.3	S313 D317	S313-T315 PolarHBondContact O-N 3.3Å; T315-D317 PolarHBondContact O-N 2.99Å
316	T	54.2	Low	67.3	Low	86 Å²	86	82.7 Å²	82.7	53%	0.528	43%	0.426	S	S	.	.			trans	-78	116	177.8	49	0	0	0	0	111.6	P314	P314-T316 PolarHBondContact O-N 3Å
317	D	51.6	Low	65.5	Low	129 Å²	129	82.4 Å²	82.4	69%	0.69	44%	0.435	S	S	*	.			trans	-62.6	125.5	146.4	-106.2	-33.2	0	0	0	107.4	T315 N319	T315-D317 PolarHBondContact O-N 2.99Å; D317-N319 PolarHBondContact O-N 3.43Å
318	E	54.2	Low	63.4	Low	187 Å²	187	89.3 Å²	89.3	87%	0.874	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-2.6	-171	-63.8	-163.1	145.1	0	0	115.2
319	N	52.5	Low	61.9	Low	156 Å²	156	94.4 Å²	94.4	83%	0.834	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	15.3	-170.1	-67.3	-60.3	0	0	0	115.2	D317	D317-N319 PolarHBondContact O-N 3.43Å
320	K	51	Low	60.9	Low	157 Å²	157	101.8 Å²	101.8	68%	0.683	52%	0.515	S	S	*	.	S	Bend	trans	-139.4	155.1	176.8	-80.8	-177.4	179	170.2	0	114	S322	K320-S322 PolarHBondContact O-N 2.67Å
321	H	51.8	Low	60.5	Low	166 Å²	166	105 Å²	105	77%	0.769	53%	0.533	S	S	*	.			trans	-55.8	126.8	174	-98.4	-83.1	0	0	0	111.5	M323 L324	H321-M323 PolarHBondContact O-N 3.31Å; H321-L324 PolarHBondContact O-N 3.01Å
322	S	53.3	Low	60.4	Low	63 Å²	63	103.3 Å²	103.3	44%	0.441	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-13.9	-169.6	51	0	0	0	0	117.1	K320	K320-S322 PolarHBondContact O-N 2.67Å
323	M	51.7	Low	60.8	Low	159 Å²	159	107.7 Å²	107.7	78%	0.783	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-14.4	176.4	-70.6	-167.2	76.8	0	0	115.1	H321	H321-M323 PolarHBondContact O-N 3.31Å
324	L	51.9	Low	61.7	Low	162 Å²	162	110.1 Å²	110.1	85%	0.848	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.6	2.6	-175.2	-93.4	95.1	0	0	0	114.7	H321	H321-L324 PolarHBondContact O-N 3.01Å
325	S	47.6	Very low	63.1	Low	24 Å²	24	110.6 Å²	110.6	17%	0.168	56%	0.56	C	S	.	*			trans	-129.5	27.9	-174.9	63.3	0	0	0	0	114.5	S327	S325-S327 PolarHBondContact O-N 2.79Å
326	V	53.6	Low	64.7	Low	58 Å²	58	108.5 Å²	108.5	35%	0.352	55%	0.547	S	S	.	.			trans	-76.7	89.8	171.9	-173.3	0	0	0	0	108.7	P314 I329	P314-V326 HydrophobicContact CB-CG2 4.48Å; V326-I329 HydrophobicContact CG1-CD1 4.36Å; V326-I329 HydrophobicContact CG1-CG1 3.6Å
327	S	55	Low	66.5	Low	78 Å²	78	108.7 Å²	108.7	55%	0.545	55%	0.552	S	S	.	*			trans	-81	-26.1	-178.4	48.2	0	0	0	0	113.5	S325	S325-S327 PolarHBondContact O-N 2.79Å
328	Y	53.4	Low	68.3	Low	145 Å²	145	102.8 Å²	102.8	57%	0.569	52%	0.52	S	S	*	.			trans	-143.9	128.4	175.6	-51.6	-80.6	0	0	0	109.7	F42	F42-Y328 HydrophobicContact CE2-CD1 4.42Å; F42-Y328 HydrophobicContact CE2-CE1 4.29Å; F42-Y328 HydrophobicContact CZ-CD1 4.3Å; F42-Y328 HydrophobicContact CZ-CE1 4.08Å
329	I	63.6	Low	70	Confident	108 Å²	108	97.1 Å²	97.1	55%	0.554	49%	0.494	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.8	105.9	173	-71.2	177.1	0	0	0	107.2	V312 V326 E331	V312-I329 HydrophobicContact CB-CG2 4.21Å; V312-I329 HydrophobicContact CG1-CB 4.21Å; V312-I329 HydrophobicContact CG1-CG1 3.91Å; V312-I329 HydrophobicContact CG1-CG2 3.74Å; V312-I329 HydrophobicContact CG2-CG2 3.59Å; V326-I329 HydrophobicContact CG1-CD1 4.36Å; V326-I329 HydrophobicContact CG1-CG1 3.6Å; I329-E331 HydrophobicContact CG2-CG 4.39Å
330	R	72.5	Confident	71.4	Confident	165 Å²	165	89.7 Å²	89.7	62%	0.623	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	111.6	161.9	179.4	173.7	-73	-173.8	-3	107.7	S313	S313-R330 PolarHBondContact N-O 3.23Å; S313-R330 VanDerWaalsContact N-O 3.09Å
331	E	84.1	Confident	72.7	Confident	129 Å²	129	85.8 Å²	85.8	60%	0.603	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.8	139.9	163.6	-60	-165.7	-172.5	0	0	108.8	I329 L371	I329-E331 HydrophobicContact CG2-CG 4.39Å; E331-L371 HydrophobicContact CB-CD1 4.44Å; E331-L371 HydrophobicContact CG-CD1 3.73Å
332	S	85.8	Confident	73.8	Confident	30 Å²	30	84.7 Å²	84.7	21%	0.21	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	134.1	-179.6	-61.7	0	0	0	0	108.8	R310 Y311	R310-S332 WeakPolarHBondContact CA-O 3.39Å; Y311-S332 VanDerWaalsContact CD1-O 3.26Å; Y311-S332 WeakPolarHBondContact CD1-O 3.44Å; Y311-S332 PolarHBondContact N-O 2.94Å; Y311-S332 PolarHBondContact O-N 3.31Å
333	E	90.6	Very high	75	Confident	104 Å²	104	82.7 Å²	82.7	49%	0.486	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	133.4	175.4	-173.2	175.9	-170.8	0	0	109.7	C308 M309 R310 C335	C308-E333 HydrophobicContact CB-CG 4.39Å; C308-E333 WeakPolarHBondContact CB-OE1 3.45Å; M309-E333 WeakPolarHBondContact O-CA 3.44Å; R310-E333 HydrophobicContact CG-CB 4.17Å; R310-E333 HydrophobicContact CG-CG 3.95Å; E333-C335 PolarHBondContact OE1-SG 3.47Å; E333-C335 VanDerWaalsContact OE1-SG 3.34Å
334	K	92.2	Very high	76.1	Confident	87 Å²	87	80.2 Å²	80.2	38%	0.378	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	115.6	175.1	-172.1	-177.7	-166.5	-178.3	0	108.8	C308 M309 Y311 K362 L363	C308-K334 WeakPolarHBondContact CA-O 3.24Å; M309-K334 HydrophobicContact CG-CB 3.89Å; M309-K334 PolarHBondContact N-O 3.12Å; M309-K334 PolarHBondContact O-N 3.28Å; M309-K334 HydrophobicContact SD-CD 4.42Å; Y311-K334 HydrophobicContact CE1-CB 4.1Å; K334-K362 WeakPolarHBondContact CE-O 3.49Å; K334-K362 PolarHBondContact NZ-O 3.4Å; K334-L363 HydrophobicContact CG-CD2 4.36Å
335	C	94.6	Very high	77.1	Confident	51 Å²	51	76.5 Å²	76.5	35%	0.345	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	148.7	179.4	-61.9	0	0	0	0	112.1	K306 L307 C308 E333	K306-C335 VanDerWaalsContact CE-SG 3.51Å; K306-C335 HydrophobicContact CG-CB 4.41Å; L307-C335 CarbonylContact O-C 3.57Å; L307-C335 VanDerWaalsContact O-CA 3.24Å; L307-C335 WeakPolarHBondContact O-CA 3.12Å; C308-C335 HydrophobicContact CB-CB 4.14Å; C308-C335 WeakPolarHBondContact CB-SG 3.45Å; C308-C335 WeakPolarHBondContact SG-CB 3.37Å; C308-C335 CovalentContact SG-SG 2.04Å; C308-C335 PolarHBondContact SG-SG 3.31Å; E333-C335 PolarHBondContact OE1-SG 3.47Å; E333-C335 VanDerWaalsContact OE1-SG 3.34Å
336	T	93.3	Very high	78.3	Confident	35 Å²	35	82.8 Å²	82.8	22%	0.215	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	152	168.9	-163.5	0	0	0	0	109.3	K306 L307 I338 H361 L363	K306-T336 CarbonylContact C-O 3.54Å; K306-T336 WeakPolarHBondContact CA-O 3.17Å; L307-T336 HydrophobicContact CB-CG2 4.17Å; L307-T336 PolarHBondContact N-O 2.76Å; L307-T336 PolarHBondContact O-N 2.81Å; T336-I338 HydrophobicContact CG2-CG2 4.35Å; T336-H361 HydrophobicContact CG2-CB 4.13Å; T336-L363 HydrophobicContact CG2-CD1 3.59Å; T336-L363 HydrophobicContact CG2-CG 3.99Å
337	S	91.3	Very high	79.2	Confident	89 Å²	89	83.6 Å²	83.6	62%	0.622	42%	0.424	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.4	127.1	176.8	-61.7	0	0	0	0	108.7	M305	M305-S337 CarbonylContact O-C 3.58Å; M305-S337 WeakPolarHBondContact O-CA 3.48Å
338	I	90.6	Very high	80.3	Confident	5 Å²	5	80.8 Å²	80.8	3%	0.026	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	141.2	-176.8	59.7	170.1	0	0	0	110.9	I282 T304 M305 L307 T336 V340 I343 F357 H361	I282-I338 HydrophobicContact CD1-CD1 4.37Å; I282-I338 HydrophobicContact CG2-CD1 4.5Å; T304-I338 WeakPolarHBondContact CA-O 3.12Å; M305-I338 HydrophobicContact CB-CD1 4.45Å; M305-I338 HydrophobicContact CB-CG1 4.01Å; M305-I338 PolarHBondContact N-O 2.91Å; M305-I338 WeakPolarHBondContact O-CG1 3.45Å; M305-I338 PolarHBondContact O-N 2.86Å; M305-I338 HydrophobicContact SD-CD1 4.45Å; L307-I338 HydrophobicContact CD1-CD1 3.79Å; L307-I338 HydrophobicContact CD1-CG1 4.47Å; L307-I338 HydrophobicContact CG-CD1 4.21Å; T336-I338 HydrophobicContact CG2-CG2 4.35Å; I338-V340 HydrophobicContact CD1-CG2 4.09Å; I338-V340 HydrophobicContact CG1-CG2 4.13Å; I338-I343 HydrophobicContact CD1-CD1 4.12Å; I338-F357 HydrophobicContact CD1-CE1 4.37Å; I338-F357 HydrophobicContact CD1-CZ 4.06Å; I338-F357 HydrophobicContact CG2-CZ 4.46Å; I338-H361 VanDerWaalsContact CG2-CD2 3.46Å; I338-H361 WeakPolarHBondContact CG2-CD2 3.39Å
339	E	88.7	Confident	81.3	Confident	68 Å²	68	79.2 Å²	79.2	32%	0.318	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	101.4	171.1	-65.2	-164	166.1	0	0	109.2	N302 T304 N341 Q342	N302-E339 HydrophobicContact CB-CG 4.21Å; N302-E339 WeakPolarHBondContact CB-OE1 3.38Å; N302-E339 PolarHBondContact ND2-OE1 3.49Å; N302-E339 PolarHBondContact ND2-OE2 2.86Å; T304-E339 HydrophobicContact CG2-CG 4.37Å; E339-N341 PolarHBondContact O-N 3.03Å; E339-N341 VanDerWaalsContact O-N 3.13Å; E339-Q342 HydrophobicContact CB-CG 4.29Å; E339-Q342 PolarHBondContact O-N 2.84Å; E339-Q342 VanDerWaalsContact O-N 3.1Å; E339-Q342 PolarHBondContact OE2-NE2 2.85Å
340	V	84	Confident	82	Confident	1 Å²	1	77.3 Å²	77.3	1%	0.006	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-68.5	-19.5	-167.5	-176.4	0	0	0	0	112.6	I282 F285 N286 R303 M305 I338 Q342 I343	I282-V340 HydrophobicContact CG2-CG1 3.98Å; I282-V340 HydrophobicContact CG2-CG2 4.42Å; F285-V340 HydrophobicContact CD1-CB 4.13Å; F285-V340 HydrophobicContact CD1-CG1 4.25Å; F285-V340 HydrophobicContact CD1-CG2 3.86Å; F285-V340 HydrophobicContact CE1-CB 4.26Å; F285-V340 HydrophobicContact CE1-CG2 3.98Å; N286-V340 HydrophobicContact CB-CG1 3.59Å; R303-V340 HydrophobicContact CB-CB 4.5Å; R303-V340 PolarHBondContact O-N 3.06Å; M305-V340 HydrophobicContact CB-CG2 3.97Å; I338-V340 HydrophobicContact CD1-CG2 4.09Å; I338-V340 HydrophobicContact CG1-CG2 4.13Å; V340-Q342 PolarHBondContact O-N 2.82Å; V340-I343 HydrophobicContact CB-CD1 4.38Å; V340-I343 HydrophobicContact CG1-CD1 4.25Å; V340-I343 HydrophobicContact CG2-CD1 4.38Å; V340-I343 PolarHBondContact O-N 2.82Å
341	N	78.1	Confident	82.5	Confident	75 Å²	75	71 Å²	71	40%	0.401	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-58.3	-26.1	172.3	-73.7	-23.7	0	0	0	114.1	L301 R303 E339	L301-N341 PolarHBondContact O-ND2 2.83Å; L301-N341 VanDerWaalsContact O-ND2 3.13Å; R303-N341 WeakPolarHBondContact CD-OD1 3.24Å; R303-N341 VanDerWaalsContact CG-OD1 3.24Å; R303-N341 WeakPolarHBondContact CG-OD1 3.33Å; R303-N341 PolarHBondContact NE-OD1 2.78Å; E339-N341 PolarHBondContact O-N 3.03Å; E339-N341 VanDerWaalsContact O-N 3.13Å
342	Q	73.1	Confident	82.6	Confident	143 Å²	143	69.4 Å²	69.4	67%	0.668	37%	0.373	S	S	*	.	G	3₁₀ helix	trans	-95.7	-1.2	-172.9	-53.3	-170.6	15.2	0	0	113.3	E339 V340	E339-Q342 HydrophobicContact CB-CG 4.29Å; E339-Q342 PolarHBondContact O-N 2.84Å; E339-Q342 VanDerWaalsContact O-N 3.1Å; E339-Q342 PolarHBondContact OE2-NE2 2.85Å; V340-Q342 PolarHBondContact O-N 2.82Å
343	I	78.6	Confident	82.6	Confident	20 Å²	20	69.8 Å²	69.8	10%	0.103	38%	0.376	C	S	.	.			trans	-89.4	120.4	-173.5	-53.4	175.1	0	0	0	109.9	I282 I338 V340 Q347 L348 F357	I282-I343 HydrophobicContact CG2-CD1 4.1Å; I338-I343 HydrophobicContact CD1-CD1 4.12Å; V340-I343 HydrophobicContact CB-CD1 4.38Å; V340-I343 HydrophobicContact CG1-CD1 4.25Å; V340-I343 HydrophobicContact CG2-CD1 4.38Å; V340-I343 PolarHBondContact O-N 2.82Å; I343-Q347 HydrophobicContact CG2-CB 4.31Å; I343-L348 HydrophobicContact CG2-CD1 3.86Å; I343-L348 HydrophobicContact CG2-CG 4.03Å; I343-F357 HydrophobicContact CD1-CE2 3.74Å; I343-F357 HydrophobicContact CD1-CZ 3.57Å; I343-F357 HydrophobicContact CG1-CE2 4Å; I343-F357 HydrophobicContact CG1-CZ 4.33Å; I343-F357 HydrophobicContact CG2-CD2 4.49Å; I343-F357 HydrophobicContact CG2-CE2 4.04Å
344	N	75.6	Confident	82.6	Confident	108 Å²	108	65 Å²	65	58%	0.578	35%	0.354	S	S	*	.			trans	-67.9	134.6	172.9	-77.6	-14.8	0	0	0	109.5	E346 Q347	N344-E346 PolarHBondContact O-N 2.54Å; N344-E346 VanDerWaalsContact O-N 3.1Å; N344-Q347 HydrophobicContact CB-CG 4.29Å; N344-Q347 WeakPolarHBondContact O-CB 3.07Å; N344-Q347 PolarHBondContact O-N 2.82Å
345	S	72.7	Confident	82.5	Confident	84 Å²	84	64.8 Å²	64.8	59%	0.587	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-58.8	-28.9	-176.9	-64.6	0	0	0	0	113.2	Q347 L348	S345-Q347 PolarHBondContact O-N 3.35Å; S345-L348 PolarHBondContact O-N 3.33Å; S345-L348 VanDerWaalsContact O-N 3.13Å
346	E	72.5	Confident	82.2	Confident	155 Å²	155	65.8 Å²	65.8	72%	0.724	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-62.3	-22	174.7	-61.6	177.1	176.4	0	0	113.9	N344 L348 T349	N344-E346 PolarHBondContact O-N 2.54Å; N344-E346 VanDerWaalsContact O-N 3.1Å; E346-L348 PolarHBondContact O-N 3.14Å; E346-T349 PolarHBondContact O-OG1 2.83Å
347	Q	73.9	Confident	82.1	Confident	75 Å²	75	64.3 Å²	64.3	35%	0.35	35%	0.348	S	S	.	.	G	3₁₀ helix	trans	-76.8	-10.4	176.6	-62.4	178.9	-65.6	0	0	112.8	I343 N344 S345 S353	I343-Q347 HydrophobicContact CG2-CB 4.31Å; N344-Q347 HydrophobicContact CB-CG 4.29Å; N344-Q347 WeakPolarHBondContact O-CB 3.07Å; N344-Q347 PolarHBondContact O-N 2.82Å; S345-Q347 PolarHBondContact O-N 3.35Å; Q347-S353 CarbonylContact O-C 3.36Å; Q347-S353 WeakPolarHBondContact O-CB 3.07Å
348	L	78.1	Confident	82.1	Confident	19 Å²	19	60.1 Å²	60.1	10%	0.099	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-120.5	12.4	-173.6	-61.1	175.8	0	0	0	113.4	I282 I343 S345 E346 I354 F357	I282-L348 HydrophobicContact CB-CD1 4.24Å; I282-L348 HydrophobicContact CD1-CD2 4.47Å; I282-L348 HydrophobicContact CG2-CD1 3.7Å; I343-L348 HydrophobicContact CG2-CD1 3.86Å; I343-L348 HydrophobicContact CG2-CG 4.03Å; S345-L348 PolarHBondContact O-N 3.33Å; S345-L348 VanDerWaalsContact O-N 3.13Å; E346-L348 PolarHBondContact O-N 3.14Å; L348-I354 HydrophobicContact CD2-CG1 4.28Å; L348-F357 HydrophobicContact CD2-CD1 4.44Å
349	T	73.1	Confident	82	Confident	112 Å²	112	63.7 Å²	63.7	69%	0.687	34%	0.335	S	S	*	.	S	Bend	trans	-88.7	-32.2	-176.8	48.7	0	0	0	0	115.4	E346	E346-T349 PolarHBondContact O-OG1 2.83Å
350	D	79.5	Confident	82	Confident	69 Å²	69	66 Å²	66	37%	0.369	35%	0.349	S	S	.	.	S	Bend	trans	-119.4	143.6	-177.2	172.7	5.1	0	0	0	109	N352 S353 I354	D350-N352 PolarHBondContact O-N 2.04Å; D350-N352 PolarHBondContact OD1-N 3.09Å; D350-N352 PolarHBondContact OD1-ND2 2.89Å; D350-N352 PolarHBondContact OD2-ND2 2.9Å; D350-N352 VanDerWaalsContact OD2-ND2 3.14Å; D350-S353 WeakPolarHBondContact O-CB 3.44Å; D350-S353 PolarHBondContact O-N 2.84Å; D350-I354 WeakPolarHBondContact O-CD1 3.23Å; D350-I354 WeakPolarHBondContact O-CG1 3.39Å; D350-I354 PolarHBondContact O-N 3.4Å
351	E	81.8	Confident	82.3	Confident	33 Å²	33	68.9 Å²	68.9	15%	0.154	36%	0.363	C	S	.	.	H	α-helix	trans	-41.9	-48.3	166	176.4	-171.2	-179.1	0	0	112	N272 Y275 S353 I354 K355	N272-E351 WeakPolarHBondContact CB-OE2 3.38Å; N272-E351 PolarHBondContact ND2-OE2 3.03Å; Y275-E351 HydrophobicContact CD2-CG 3.73Å; Y275-E351 HydrophobicContact CG-CG 4.18Å; E351-S353 VanDerWaalsContact C-N 3.35Å; E351-S353 PolarHBondContact O-N 3.15Å; E351-I354 PolarHBondContact O-N 3.23Å; E351-K355 VanDerWaalsContact O-CB 3.32Å; E351-K355 WeakPolarHBondContact O-CB 3.5Å; E351-K355 PolarHBondContact O-N 3.16Å
352	N	86.4	Confident	82.8	Confident	95 Å²	95	72.7 Å²	72.7	51%	0.508	38%	0.376	S	S	.	.	H	α-helix	trans	-63.7	-42.1	-178.2	-61.4	-73.2	0	0	0	111.3	D350 K355 T356	D350-N352 PolarHBondContact O-N 2.04Å; D350-N352 PolarHBondContact OD1-N 3.09Å; D350-N352 PolarHBondContact OD1-ND2 2.89Å; D350-N352 PolarHBondContact OD2-ND2 2.9Å; D350-N352 VanDerWaalsContact OD2-ND2 3.14Å; N352-K355 PolarHBondContact O-N 2.85Å; N352-T356 PolarHBondContact O-N 3.47Å; N352-T356 PolarHBondContact O-OG1 3.34Å
353	S	87	Confident	83.5	Confident	38 Å²	38	66 Å²	66	27%	0.266	34%	0.344	S	S	.	.	H	α-helix	trans	-63.5	-43.4	175.9	-53.8	0	0	0	0	111.7	Q347 D350 E351 K355 T356 F357	Q347-S353 CarbonylContact O-C 3.36Å; Q347-S353 WeakPolarHBondContact O-CB 3.07Å; D350-S353 WeakPolarHBondContact O-CB 3.44Å; D350-S353 PolarHBondContact O-N 2.84Å; E351-S353 VanDerWaalsContact C-N 3.35Å; E351-S353 PolarHBondContact O-N 3.15Å; S353-K355 VanDerWaalsContact C-N 3.34Å; S353-K355 PolarHBondContact O-N 3.17Å; S353-T356 PolarHBondContact O-N 3.11Å; S353-F357 VanDerWaalsContact O-CB 3.27Å; S353-F357 WeakPolarHBondContact O-CB 3.47Å; S353-F357 PolarHBondContact O-N 2.96Å
354	I	89.6	Confident	84	Confident	4 Å²	4	70 Å²	70	2%	0.021	37%	0.366	C	S	.	.	H	α-helix	trans	-65.5	-39.6	178.1	-62.2	157.5	0	0	0	110.5	Y275 L348 D350 E351 F357 L358	Y275-I354 HydrophobicContact CD1-CG2 4.15Å; L348-I354 HydrophobicContact CD2-CG1 4.28Å; D350-I354 WeakPolarHBondContact O-CD1 3.23Å; D350-I354 WeakPolarHBondContact O-CG1 3.39Å; D350-I354 PolarHBondContact O-N 3.4Å; E351-I354 PolarHBondContact O-N 3.23Å; I354-F357 PolarHBondContact O-N 2.86Å; I354-L358 HydrophobicContact CG2-CD1 4.24Å; I354-L358 WeakPolarHBondContact O-CG 3.41Å; I354-L358 PolarHBondContact O-N 3.38Å
355	K	89.7	Confident	84.6	Confident	81 Å²	81	65.4 Å²	65.4	35%	0.352	34%	0.341	S	S	.	.	H	α-helix	trans	-63.4	-47.6	175.2	-178	177.6	179.9	-178.5	0	111.8	Y275 E351 N352 S353 L358 Q359	Y275-K355 HydrophobicContact CD1-CB 4.31Å; Y275-K355 HydrophobicContact CE1-CB 3.99Å; Y275-K355 HydrophobicContact CE1-CG 4.17Å; Y275-K355 HydrophobicContact CE2-CB 4.28Å; Y275-K355 HydrophobicContact CE2-CD 4.12Å; Y275-K355 HydrophobicContact CE2-CG 4.27Å; E351-K355 VanDerWaalsContact O-CB 3.32Å; E351-K355 WeakPolarHBondContact O-CB 3.5Å; E351-K355 PolarHBondContact O-N 3.16Å; N352-K355 PolarHBondContact O-N 2.85Å; S353-K355 VanDerWaalsContact C-N 3.34Å; S353-K355 PolarHBondContact O-N 3.17Å; K355-L358 PolarHBondContact O-N 3.44Å; K355-Q359 WeakPolarHBondContact O-CG 3.38Å; K355-Q359 PolarHBondContact O-N 2.89Å
356	T	89.4	Confident	85.4	Confident	72 Å²	72	65.2 Å²	65.2	44%	0.442	33%	0.334	S	S	.	.	H	α-helix	trans	-61.8	-44	174.4	-61.4	0	0	0	0	111.3	N352 S353 L358 Q359 D360	N352-T356 PolarHBondContact O-N 3.47Å; N352-T356 PolarHBondContact O-OG1 3.34Å; S353-T356 PolarHBondContact O-N 3.11Å; T356-L358 VanDerWaalsContact C-N 3.33Å; T356-L358 PolarHBondContact O-N 3.25Å; T356-Q359 WeakPolarHBondContact O-CB 3.26Å; T356-Q359 PolarHBondContact O-N 3.44Å; T356-Q359 VanDerWaalsContact O-N 3.12Å; T356-D360 PolarHBondContact O-N 3.36Å
357	F	90.3	Very high	86.2	Confident	5 Å²	5	60.5 Å²	60.5	2%	0.022	31%	0.311	C	S	.	.	H	α-helix	trans	-56.2	-43.7	175.5	169.6	-90.7	0	0	0	112.4	I282 I338 I343 L348 S353 I354 H361	I282-F357 HydrophobicContact CD1-CE1 4.16Å; I338-F357 HydrophobicContact CD1-CE1 4.37Å; I338-F357 HydrophobicContact CD1-CZ 4.06Å; I338-F357 HydrophobicContact CG2-CZ 4.46Å; I343-F357 HydrophobicContact CD1-CE2 3.74Å; I343-F357 HydrophobicContact CD1-CZ 3.57Å; I343-F357 HydrophobicContact CG1-CE2 4Å; I343-F357 HydrophobicContact CG1-CZ 4.33Å; I343-F357 HydrophobicContact CG2-CD2 4.49Å; I343-F357 HydrophobicContact CG2-CE2 4.04Å; L348-F357 HydrophobicContact CD2-CD1 4.44Å; S353-F357 VanDerWaalsContact O-CB 3.27Å; S353-F357 WeakPolarHBondContact O-CB 3.47Å; S353-F357 PolarHBondContact O-N 2.96Å; I354-F357 PolarHBondContact O-N 2.86Å; F357-H361 AromaticContact CD2-CE1 3.73Å; F357-H361 AromaticContact CD2-ND1 3.86Å; F357-H361 AromaticContact CE2-CE1 3.24Å; F357-H361 WeakPolarHBondContact CE2-CE1 3.32Å; F357-H361 AromaticContact CE2-ND1 3.65Å; F357-H361 AromaticContact CZ-CE1 3.61Å; F357-H361 AromaticContact CZ-ND1 3.74Å; F357-H361 PolarHBondContact O-N 3.4Å; F357-H361 PolarHBondContact O-ND1 3.31Å
358	L	91	Very high	86.7	Confident	1 Å²	1	62.4 Å²	62.4	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-67.7	-40.4	176.3	-71.1	169.9	0	0	0	111.7	Y275 V278 L307 I354 K355 T356 H361 K362 L363 I365 F373	Y275-L358 HydrophobicContact CD1-CD1 3.87Å; Y275-L358 HydrophobicContact CE1-CD1 3.8Å; V278-L358 HydrophobicContact CG1-CD1 4.46Å; L307-L358 HydrophobicContact CD1-CD2 3.87Å; I354-L358 HydrophobicContact CG2-CD1 4.24Å; I354-L358 WeakPolarHBondContact O-CG 3.41Å; I354-L358 PolarHBondContact O-N 3.38Å; K355-L358 PolarHBondContact O-N 3.44Å; T356-L358 VanDerWaalsContact C-N 3.33Å; T356-L358 PolarHBondContact O-N 3.25Å; L358-H361 CarbonylContact O-C 3.45Å; L358-H361 PolarHBondContact O-N 3.16Å; L358-K362 PolarHBondContact O-N 3.48Å; L358-L363 CarbonylContact C-O 3.6Å; L358-L363 HydrophobicContact CB-CB 4.29Å; L358-L363 HydrophobicContact CD2-CD1 4.07Å; L358-L363 CarbonylContact O-C 3.59Å; L358-L363 WeakPolarHBondContact O-CA 3.38Å; L358-L363 WeakPolarHBondContact O-CB 3.18Å; L358-L363 PolarHBondContact O-N 2.98Å; L358-I365 HydrophobicContact CD1-CD1 4.05Å; L358-F373 HydrophobicContact CD2-CZ 4.12Å
359	Q	89.4	Confident	87	Confident	80 Å²	80	64 Å²	64	37%	0.374	33%	0.329	S	S	.	.	H	α-helix	trans	-62.1	-43	175.4	-73.5	177.8	-30.9	0	0	112.4	K355 T356 H361 K362 D364	K355-Q359 WeakPolarHBondContact O-CG 3.38Å; K355-Q359 PolarHBondContact O-N 2.89Å; T356-Q359 WeakPolarHBondContact O-CB 3.26Å; T356-Q359 PolarHBondContact O-N 3.44Å; T356-Q359 VanDerWaalsContact O-N 3.12Å; Q359-H361 VanDerWaalsContact C-N 3.26Å; Q359-H361 PolarHBondContact O-N 3.48Å; Q359-K362 WeakPolarHBondContact O-CA 3.26Å; Q359-K362 PolarHBondContact O-N 2.84Å; Q359-D364 HydrophobicContact CG-CB 4.3Å; Q359-D364 PolarHBondContact NE2-OD1 2.84Å
360	D	89.3	Confident	87.8	Confident	115 Å²	115	58.7 Å²	58.7	62%	0.615	30%	0.296	S	S	*	.	H	α-helix	trans	-59.9	-37.3	174.9	-70.9	-21.2	0	0	0	111.7	T356 K362	T356-D360 PolarHBondContact O-N 3.36Å; D360-K362 PolarHBondContact O-N 3.13Å
361	H	88.9	Confident	88.3	Confident	63 Å²	63	56.3 Å²	56.3	29%	0.292	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81	15.1	173.2	-68.4	85.6	0	0	0	113.9	T336 I338 F357 L358 Q359 L363	T336-H361 HydrophobicContact CG2-CB 4.13Å; I338-H361 VanDerWaalsContact CG2-CD2 3.46Å; I338-H361 WeakPolarHBondContact CG2-CD2 3.39Å; F357-H361 AromaticContact CD2-CE1 3.73Å; F357-H361 AromaticContact CD2-ND1 3.86Å; F357-H361 AromaticContact CE2-CE1 3.24Å; F357-H361 WeakPolarHBondContact CE2-CE1 3.32Å; F357-H361 AromaticContact CE2-ND1 3.65Å; F357-H361 AromaticContact CZ-CE1 3.61Å; F357-H361 AromaticContact CZ-ND1 3.74Å; F357-H361 PolarHBondContact O-N 3.4Å; F357-H361 PolarHBondContact O-ND1 3.31Å; L358-H361 CarbonylContact O-C 3.45Å; L358-H361 PolarHBondContact O-N 3.16Å; Q359-H361 VanDerWaalsContact C-N 3.26Å; Q359-H361 PolarHBondContact O-N 3.48Å; H361-L363 VanDerWaalsContact C-N 3.28Å; H361-L363 PolarHBondContact O-N 3.3Å
362	K	88.5	Confident	88.9	Confident	155 Å²	155	54.7 Å²	54.7	67%	0.674	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.4	18.4	178.4	-52	176.4	-177.5	173.6	0	114.8	K334 L358 Q359 D360	K334-K362 WeakPolarHBondContact CE-O 3.49Å; K334-K362 PolarHBondContact NZ-O 3.4Å; L358-K362 PolarHBondContact O-N 3.48Å; Q359-K362 WeakPolarHBondContact O-CA 3.26Å; Q359-K362 PolarHBondContact O-N 2.84Å; D360-K362 PolarHBondContact O-N 3.13Å
363	L	89	Confident	89.3	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.01	25%	0.251	C	S	.	.			trans	-101.1	73.2	173.8	-62.8	178.1	0	0	0	110.2	L307 M309 K334 T336 L358 H361 I365 F373	L307-L363 HydrophobicContact CB-CD1 3.74Å; L307-L363 HydrophobicContact CD1-CD1 4.34Å; M309-L363 HydrophobicContact CB-CD2 4.45Å; M309-L363 HydrophobicContact CG-CD2 3.79Å; M309-L363 HydrophobicContact SD-CB 4.31Å; M309-L363 HydrophobicContact SD-CD2 3.76Å; K334-L363 HydrophobicContact CG-CD2 4.36Å; T336-L363 HydrophobicContact CG2-CD1 3.59Å; T336-L363 HydrophobicContact CG2-CG 3.99Å; L358-L363 CarbonylContact C-O 3.6Å; L358-L363 HydrophobicContact CB-CB 4.29Å; L358-L363 HydrophobicContact CD2-CD1 4.07Å; L358-L363 CarbonylContact O-C 3.59Å; L358-L363 WeakPolarHBondContact O-CA 3.38Å; L358-L363 WeakPolarHBondContact O-CB 3.18Å; L358-L363 PolarHBondContact O-N 2.98Å; H361-L363 VanDerWaalsContact C-N 3.28Å; H361-L363 PolarHBondContact O-N 3.3Å; L363-I365 PolarHBondContact O-N 3.44Å; L363-F373 HydrophobicContact CD1-CE2 4.1Å; L363-F373 HydrophobicContact CD1-CZ 4.27Å
364	D	87.9	Confident	89.7	Confident	103 Å²	103	48.5 Å²	48.5	55%	0.551	24%	0.239	S	C	*	.			trans	-80.7	109.2	172.8	-172.7	35.9	0	0	0	110.2	M309 Q359	M309-D364 WeakPolarHBondContact CE-O 3.28Å; Q359-D364 HydrophobicContact CG-CB 4.3Å; Q359-D364 PolarHBondContact NE2-OD1 2.84Å
365	I	89.8	Confident	90.1	Very high	13 Å²	13	48.3 Å²	48.3	7%	0.067	24%	0.238	C	C	.	.			trans	-94.2	110.9	-168.7	-60.9	178.8	0	0	0	110.8	F274 Y275 L358 L363 F367 L370 F373	F274-I365 HydrophobicContact CE1-CD1 3.58Å; F274-I365 HydrophobicContact CZ-CD1 3.63Å; Y275-I365 HydrophobicContact CE1-CD1 4.4Å; L358-I365 HydrophobicContact CD1-CD1 4.05Å; L363-I365 PolarHBondContact O-N 3.44Å; I365-F367 HydrophobicContact CG2-CD1 4.4Å; I365-F367 HydrophobicContact CG2-CD2 4.22Å; I365-F367 HydrophobicContact CG2-CE1 4.14Å; I365-F367 HydrophobicContact CG2-CE2 3.93Å; I365-F367 HydrophobicContact CG2-CG 4.44Å; I365-F367 HydrophobicContact CG2-CZ 3.9Å; I365-L370 HydrophobicContact CG2-CD1 4.32Å; I365-L370 HydrophobicContact CG2-CD2 3.89Å; I365-F373 HydrophobicContact CD1-CD2 3.96Å; I365-F373 HydrophobicContact CD1-CE2 3.82Å
366	N	87.9	Confident	90.3	Very high	80 Å²	80	47.1 Å²	47.1	43%	0.428	23%	0.234	S	C	.	.			trans	-101.1	103.2	168.8	-170.6	-24	0	0	0	110.5	N368 Y369 L370	N366-N368 PolarHBondContact O-N 2.77Å; N366-N368 VanDerWaalsContact O-N 3.13Å; N366-N368 WeakPolarHBondContact OD1-CB 3.39Å; N366-N368 PolarHBondContact OD1-N 3.28Å; N366-Y369 HydrophobicContact CB-CD2 4.23Å; N366-Y369 PolarHBondContact O-N 3.28Å; N366-L370 PolarHBondContact O-N 3.09Å; N366-L370 VanDerWaalsContact O-N 3.13Å
367	F	89.3	Confident	90.6	Very high	55 Å²	55	44 Å²	44	24%	0.241	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.7	-176.5	-69.4	-85	0	0	0	114.5	V271 F274 Y275 I365 Y369 L370	V271-F367 HydrophobicContact CB-CE2 4.28Å; V271-F367 HydrophobicContact CB-CZ 4.43Å; V271-F367 HydrophobicContact CG1-CD2 4.28Å; V271-F367 HydrophobicContact CG1-CE2 3.54Å; V271-F367 HydrophobicContact CG1-CZ 3.9Å; V271-F367 HydrophobicContact CG2-CD2 3.89Å; V271-F367 HydrophobicContact CG2-CE2 3.89Å; V271-F367 HydrophobicContact CG2-CG 4.23Å; V271-F367 HydrophobicContact CG2-CZ 4.21Å; F274-F367 HydrophobicContact CB-CE1 4.11Å; F274-F367 HydrophobicContact CB-CZ 4.14Å; F274-F367 HydrophobicContact CD1-CE1 4.19Å; F274-F367 AromaticContact CD1-CZ 3.82Å; F274-F367 HydrophobicContact CD1-CZ 3.82Å; F274-F367 AromaticContact CD2-CE1 3.6Å; F274-F367 HydrophobicContact CD2-CE1 3.6Å; F274-F367 HydrophobicContact CD2-CZ 4.09Å; F274-F367 HydrophobicContact CE1-CZ 4.36Å; F274-F367 HydrophobicContact CE2-CE1 4.15Å; F274-F367 AromaticContact CG-CE1 3.71Å; F274-F367 HydrophobicContact CG-CE1 3.71Å; F274-F367 AromaticContact CG-CZ 3.75Å; F274-F367 HydrophobicContact CG-CZ 3.75Å; Y275-F367 HydrophobicContact CE2-CE2 4.03Å; Y275-F367 HydrophobicContact CE2-CZ 4.14Å; I365-F367 HydrophobicContact CG2-CD1 4.4Å; I365-F367 HydrophobicContact CG2-CD2 4.22Å; I365-F367 HydrophobicContact CG2-CE1 4.14Å; I365-F367 HydrophobicContact CG2-CE2 3.93Å; I365-F367 HydrophobicContact CG2-CG 4.44Å; I365-F367 HydrophobicContact CG2-CZ 3.9Å; F367-Y369 PolarHBondContact O-N 2.81Å; F367-L370 HydrophobicContact CD1-CD2 4.05Å; F367-L370 HydrophobicContact CE1-CD2 4.15Å
368	N	84.1	Confident	90.7	Very high	115 Å²	115	46.1 Å²	46.1	62%	0.615	23%	0.226	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-21.8	175.5	-61.8	-20.7	0	0	0	112.7	N366 Q409	N366-N368 PolarHBondContact O-N 2.77Å; N366-N368 VanDerWaalsContact O-N 3.13Å; N366-N368 WeakPolarHBondContact OD1-CB 3.39Å; N366-N368 PolarHBondContact OD1-N 3.28Å; N368-Q409 PolarHBondContact O-NE2 2.86Å
369	Y	85.3	Confident	90.8	Very high	53 Å²	53	46 Å²	46	21%	0.208	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.7	-5.3	-176.6	-58	-60	0	0	0	113.3	Y311 V312 P314 N366 F367 L371	Y311-Y369 CarbonylContact C-O 3.59Å; Y311-Y369 WeakPolarHBondContact CA-O 3.48Å; Y311-Y369 WeakPolarHBondContact CB-O 3.49Å; V312-Y369 PolarHBondContact N-O 2.97Å; V312-Y369 WeakPolarHBondContact O-CB 3.36Å; P314-Y369 HydrophobicContact CB-CE1 4.16Å; P314-Y369 HydrophobicContact CG-CD1 4.39Å; P314-Y369 HydrophobicContact CG-CE1 3.86Å; P314-Y369 HydrophobicContact CG-CE2 4.16Å; N366-Y369 HydrophobicContact CB-CD2 4.23Å; N366-Y369 PolarHBondContact O-N 3.28Å; F367-Y369 PolarHBondContact O-N 2.81Å; Y369-L371 PolarHBondContact O-N 3Å
370	L	89.7	Confident	90.9	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.005	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	121.8	-179.2	-171.2	72.5	0	0	0	110.8	F274 M309 I365 N366 F367 G372	F274-L370 HydrophobicContact CE2-CD2 3.99Å; M309-L370 HydrophobicContact CB-CD1 4.24Å; I365-L370 HydrophobicContact CG2-CD1 4.32Å; I365-L370 HydrophobicContact CG2-CD2 3.89Å; N366-L370 PolarHBondContact O-N 3.09Å; N366-L370 VanDerWaalsContact O-N 3.13Å; F367-L370 HydrophobicContact CD1-CD2 4.05Å; F367-L370 HydrophobicContact CE1-CD2 4.15Å; L370-G372 WeakPolarHBondContact CD1-O 3.34Å
371	L	90.4	Very high	90.9	Very high	18 Å²	18	39.5 Å²	39.5	9%	0.094	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	-27.9	172.4	-62.5	176.6	0	0	0	111.8	R310 V312 E331 Y369 N406	R310-L371 PolarHBondContact O-N 2.87Å; V312-L371 HydrophobicContact CG2-CD1 3.8Å; V312-L371 HydrophobicContact CG2-CD2 3.94Å; V312-L371 HydrophobicContact CG2-CG 3.91Å; E331-L371 HydrophobicContact CB-CD1 4.44Å; E331-L371 HydrophobicContact CG-CD1 3.73Å; Y369-L371 PolarHBondContact O-N 3Å; L371-N406 CarbonylContact O-C 3.5Å; L371-N406 WeakPolarHBondContact O-CA 3.48Å; L371-N406 PolarHBondContact O-N 2.83Å
372	G	93.2	Very high	90.7	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177	169	169.4	0	0	0	0	0	113.9	R310 L370 L404	R310-G372 PolarHBondContact N-O 3.39Å; R310-G372 PolarHBondContact O-N 3.45Å; R310-G372 VanDerWaalsContact O-N 3.16Å; L370-G372 WeakPolarHBondContact CD1-O 3.34Å; G372-L404 CarbonylContact C-O 3.3Å; G372-L404 WeakPolarHBondContact CA-O 3.21Å
373	F	95.6	Very high	90.4	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	127.4	177.1	-167.6	-94.7	0	0	0	109.2	F274 V278 L307 C308 M309 L358 L363 I365 I375 L404	F274-F373 HydrophobicContact CE2-CB 3.93Å; F274-F373 HydrophobicContact CE2-CG 4.32Å; F274-F373 HydrophobicContact CZ-CB 3.91Å; F274-F373 HydrophobicContact CZ-CD1 4.19Å; F274-F373 HydrophobicContact CZ-CD2 4.01Å; F274-F373 AromaticContact CZ-CG 3.79Å; F274-F373 HydrophobicContact CZ-CG 3.79Å; V278-F373 HydrophobicContact CG1-CE1 4.09Å; V278-F373 HydrophobicContact CG1-CZ 4.5Å; V278-F373 HydrophobicContact CG2-CD1 4.15Å; V278-F373 HydrophobicContact CG2-CE1 3.97Å; L307-F373 HydrophobicContact CB-CZ 4.08Å; L307-F373 HydrophobicContact CD2-CE1 4.23Å; L307-F373 HydrophobicContact CD2-CZ 4.38Å; C308-F373 CarbonylContact O-C 3.54Å; C308-F373 WeakPolarHBondContact O-CA 3.14Å; M309-F373 HydrophobicContact CB-CD2 4.03Å; M309-F373 HydrophobicContact CB-CE2 4.43Å; L358-F373 HydrophobicContact CD2-CZ 4.12Å; L363-F373 HydrophobicContact CD1-CE2 4.1Å; L363-F373 HydrophobicContact CD1-CZ 4.27Å; I365-F373 HydrophobicContact CD1-CD2 3.96Å; I365-F373 HydrophobicContact CD1-CE2 3.82Å; F373-I375 HydrophobicContact CD1-CD1 4.4Å; F373-I375 HydrophobicContact CD1-CG1 3.94Å; F373-I375 HydrophobicContact CE1-CD1 4.09Å; F373-I375 HydrophobicContact CE1-CG1 3.72Å; F373-L404 HydrophobicContact CB-CB 4.42Å; F373-L404 HydrophobicContact CB-CD1 4.45Å; F373-L404 HydrophobicContact CD1-CD1 4.19Å; F373-L404 PolarHBondContact N-O 2.96Å; F373-L404 WeakPolarHBondContact O-CD1 3.43Å; F373-L404 PolarHBondContact O-N 3.45Å
374	D	95.9	Very high	89.9	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.011	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	124	-172.9	-74	-40.2	0	0	0	109.9	C308 R310 K401 I402 S403	C308-D374 HydrophobicContact CB-CB 4.24Å; C308-D374 PolarHBondContact N-O 3.3Å; C308-D374 PolarHBondContact O-N 3.35Å; R310-D374 IonicContact CZ-OD2 3.41Å; R310-D374 IonicContact NE-OD2 2.73Å; R310-D374 PolarHBondContact NE-OD2 3.34Å; R310-D374 VanDerWaalsContact NE-OD2 3.09Å; R310-D374 IonicContact NH2-OD2 2.62Å; D374-K401 WeakPolarHBondContact OD1-CE 3.31Å; D374-K401 IonicContact OD1-NZ 2.71Å; D374-K401 PolarHBondContact OD1-NZ 3.48Å; D374-K401 VanDerWaalsContact OD1-NZ 3.14Å; D374-K401 WeakPolarHBondContact OD2-CE 3.45Å; D374-K401 IonicContact OD2-NZ 2.76Å; D374-K401 PolarHBondContact OD2-NZ 3.21Å; D374-I402 WeakPolarHBondContact CA-O 3.35Å; D374-S403 VanDerWaalsContact OD1-CA 3.29Å; D374-S403 WeakPolarHBondContact OD1-CA 3.42Å; D374-S403 WeakPolarHBondContact OD1-CB 3.05Å; D374-S403 PolarHBondContact OD1-OG 2.79Å
375	I	96.7	Very high	88.8	Confident	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	125.3	177.7	-56	179.6	0	0	0	108.4	V278 T281 M305 L307 F373 F377 K401 I402	V278-I375 HydrophobicContact CG1-CD1 4.33Å; V278-I375 HydrophobicContact CG2-CD1 4.36Å; T281-I375 HydrophobicContact CG2-CD1 3.89Å; T281-I375 HydrophobicContact CG2-CG2 4.16Å; M305-I375 HydrophobicContact CE-CG2 4.09Å; M305-I375 HydrophobicContact CG-CG2 3.91Å; M305-I375 HydrophobicContact SD-CG2 3.5Å; M305-I375 WeakPolarHBondContact SD-CG2 3.3Å; L307-I375 HydrophobicContact CD2-CB 4.22Å; L307-I375 HydrophobicContact CD2-CD1 4.33Å; L307-I375 HydrophobicContact CD2-CG1 3.79Å; L307-I375 HydrophobicContact CD2-CG2 3.89Å; F373-I375 HydrophobicContact CD1-CD1 4.4Å; F373-I375 HydrophobicContact CD1-CG1 3.94Å; F373-I375 HydrophobicContact CE1-CD1 4.09Å; F373-I375 HydrophobicContact CE1-CG1 3.72Å; I375-F377 HydrophobicContact CG2-CD1 4.16Å; I375-F377 HydrophobicContact CG2-CE1 4.3Å; I375-K401 CarbonylContact O-C 3.59Å; I375-K401 VanDerWaalsContact O-CA 3.31Å; I375-K401 WeakPolarHBondContact O-CA 3.42Å; I375-I402 HydrophobicContact CB-CB 4.27Å; I375-I402 PolarHBondContact N-O 3.24Å; I375-I402 PolarHBondContact O-N 3.18Å
376	H	95.6	Very high	87.4	Confident	57 Å²	57	41.9 Å²	41.9	26%	0.264	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	132.8	-176.5	-66	-107.4	0	0	0	112	K306 I400 K401	K306-H376 HydrophobicContact CB-CB 4.2Å; K306-H376 PolarHBondContact N-O 3.04Å; K306-H376 PolarHBondContact O-N 3.18Å; H376-I400 WeakPolarHBondContact CA-O 3.28Å; H376-K401 VanDerWaalsContact CE1-CE 3.45Å; H376-K401 WeakPolarHBondContact CE1-CE 3.26Å; H376-K401 VanDerWaalsContact NE2-CE 3.33Å; H376-K401 WeakPolarHBondContact NE2-CE 3.3Å
377	F	94.7	Very high	86.1	Confident	5 Å²	5	39.3 Å²	39.3	2%	0.022	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	156.3	171.3	55	-87.3	0	0	0	111.6	Y246 F285 M305 I375 L379 I400 I402	Y246-F377 HydrophobicContact CD1-CZ 4.11Å; Y246-F377 HydrophobicContact CD2-CE2 4.21Å; Y246-F377 AromaticContact CD2-CZ 3.7Å; Y246-F377 HydrophobicContact CD2-CZ 3.7Å; Y246-F377 HydrophobicContact CE1-CE2 4.31Å; Y246-F377 HydrophobicContact CE1-CZ 4.12Å; Y246-F377 AromaticContact CE2-CE2 3.69Å; Y246-F377 HydrophobicContact CE2-CE2 3.69Å; Y246-F377 AromaticContact CE2-CZ 3.67Å; Y246-F377 HydrophobicContact CE2-CZ 3.67Å; Y246-F377 AromaticContact CG-CZ 3.93Å; Y246-F377 HydrophobicContact CG-CZ 3.93Å; Y246-F377 AromaticContact CZ-CE2 3.77Å; Y246-F377 AromaticContact CZ-CZ 3.91Å; F285-F377 HydrophobicContact CD2-CB 4.15Å; F285-F377 HydrophobicContact CD2-CD1 4.34Å; F285-F377 AromaticContact CD2-CD2 3.37Å; F285-F377 HydrophobicContact CD2-CD2 3.37Å; F285-F377 AromaticContact CD2-CE2 3.7Å; F285-F377 HydrophobicContact CD2-CE2 3.7Å; F285-F377 AromaticContact CD2-CG 3.71Å; F285-F377 HydrophobicContact CD2-CG 3.71Å; F285-F377 HydrophobicContact CD2-CZ 4.32Å; F285-F377 HydrophobicContact CE2-CB 3.67Å; F285-F377 AromaticContact CE2-CD2 3.4Å; F285-F377 HydrophobicContact CE2-CD2 3.4Å; F285-F377 HydrophobicContact CE2-CE2 4.16Å; F285-F377 AromaticContact CE2-CG 3.7Å; F285-F377 HydrophobicContact CE2-CG 3.7Å; F285-F377 HydrophobicContact CG-CD2 4.49Å; F285-F377 HydrophobicContact CZ-CB 4.04Å; F285-F377 HydrophobicContact CZ-CG 4.49Å; M305-F377 HydrophobicContact CB-CB 4.49Å; M305-F377 HydrophobicContact CE-CD1 3.71Å; M305-F377 HydrophobicContact CE-CE1 4.09Å; M305-F377 HydrophobicContact CE-CG 4.31Å; M305-F377 HydrophobicContact CG-CB 4.42Å; M305-F377 HydrophobicContact CG-CD1 4.41Å; I375-F377 HydrophobicContact CG2-CD1 4.16Å; I375-F377 HydrophobicContact CG2-CE1 4.3Å; F377-L379 HydrophobicContact CD2-CG 4.29Å; F377-L379 HydrophobicContact CE2-CD1 4.29Å; F377-L379 HydrophobicContact CE2-CG 4.43Å; F377-I400 HydrophobicContact CD2-CB 4.13Å; F377-I400 HydrophobicContact CD2-CD1 4.21Å; F377-I400 HydrophobicContact CE1-CB 4.39Å; F377-I400 HydrophobicContact CE1-CG2 3.96Å; F377-I400 HydrophobicContact CE2-CB 3.83Å; F377-I400 HydrophobicContact CE2-CD1 3.54Å; F377-I400 HydrophobicContact CE2-CG1 4.26Å; F377-I400 HydrophobicContact CE2-CG2 3.95Å; F377-I400 HydrophobicContact CZ-CB 3.98Å; F377-I400 HydrophobicContact CZ-CD1 4.19Å; F377-I400 HydrophobicContact CZ-CG2 3.57Å; F377-I400 PolarHBondContact N-O 2.81Å; F377-I400 PolarHBondContact O-N 3.38Å; F377-I402 HydrophobicContact CE1-CD1 4.09Å; F377-I402 HydrophobicContact CZ-CD1 4.4Å
378	N	93.1	Very high	84.6	Confident	50 Å²	50	37.6 Å²	37.6	27%	0.267	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	139.9	-179.5	-64.5	-17.8	0	0	0	111.2	D299 R397 F398	D299-N378 HydrophobicContact CB-CB 3.54Å; D299-N378 WeakPolarHBondContact OD2-CB 3.13Å; D299-N378 PolarHBondContact OD2-ND2 2.97Å; N378-R397 PolarHBondContact ND2-NH2 3.36Å; N378-F398 CarbonylContact C-O 3.58Å; N378-F398 VanDerWaalsContact CA-O 3.28Å; N378-F398 WeakPolarHBondContact CA-O 3.37Å
379	L	92.9	Very high	83.3	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	148.2	170.2	-63.7	177	0	0	0	110.5	F242 Y246 F285 T288 M297 F298 F377 R397 F398 I400	F242-L379 HydrophobicContact CE1-CD1 3.92Å; F242-L379 HydrophobicContact CZ-CD1 4.47Å; Y246-L379 HydrophobicContact CE2-CD1 4.46Å; Y246-L379 WeakPolarHBondContact OH-CD1 3.35Å; F285-L379 HydrophobicContact CE2-CD2 4.1Å; T288-L379 HydrophobicContact CG2-CD1 4.23Å; T288-L379 HydrophobicContact CG2-CD2 4.38Å; M297-L379 WeakPolarHBondContact O-CA 3.45Å; F298-L379 HydrophobicContact CD1-CD2 3.97Å; F298-L379 HydrophobicContact CE1-CD2 4.24Å; F377-L379 HydrophobicContact CD2-CG 4.29Å; F377-L379 HydrophobicContact CE2-CD1 4.29Å; F377-L379 HydrophobicContact CE2-CG 4.43Å; L379-R397 CarbonylContact O-C 3.53Å; L379-R397 WeakPolarHBondContact O-CA 3.41Å; L379-F398 PolarHBondContact N-O 3.05Å; L379-F398 PolarHBondContact O-N 3.48Å; L379-I400 HydrophobicContact CD1-CD1 3.69Å; L379-I400 HydrophobicContact CG-CD1 4.22Å
380	L	90.6	Very high	81.7	Confident	51 Å²	51	39.5 Å²	39.5	27%	0.267	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	135.6	171	-64.1	169.3	0	0	0	108.9	Y296 M297 Y396 R397 T424	Y296-L380 CarbonylContact C-O 3.57Å; Y296-L380 WeakPolarHBondContact CA-O 3.42Å; M297-L380 HydrophobicContact CB-CB 4.32Å; M297-L380 PolarHBondContact N-O 3.19Å; M297-L380 PolarHBondContact O-N 2.89Å; L380-Y396 CarbonylContact C-O 3.17Å; L380-Y396 WeakPolarHBondContact CA-O 3.28Å; L380-R397 HydrophobicContact CD2-CB 3.87Å; L380-R397 HydrophobicContact CD2-CG 3.83Å; L380-T424 HydrophobicContact CD2-CG2 4.27Å
381	S	89.4	Confident	80.1	Confident	6 Å²	6	45.4 Å²	45.4	4%	0.042	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-70	155.9	170.4	80.8	0	0	0	0	110.7	Y396	S381-Y396 PolarHBondContact N-O 3.03Å; S381-Y396 PolarHBondContact OG-N 2.91Å
382	P	85.1	Confident	78.6	Confident	40 Å²	40	45.2 Å²	45.2	26%	0.26	22%	0.216	S	C	.	.	P	Polyproline II helix	trans	-60.6	162.8	159	29.7	-35	0	0	0	110.2	I384	P382-I384 PolarHBondContact O-N 3.45Å
383	P	82.4	Confident	77.4	Confident	46 Å²	46	47.1 Å²	47.1	30%	0.299	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-63.5	126.1	168.5	25.9	-33.1	0	0	0	110.5	Y385 T393	P383-Y385 HydrophobicContact CB-CE2 4Å; P383-Y385 HydrophobicContact CG-CE2 3.9Å; P383-Y385 WeakPolarHBondContact O-CD2 3.46Å; P383-Y385 WeakPolarHBondContact O-CE2 3.28Å; P383-T393 HydrophobicContact CB-CG2 3.6Å
384	I	77.5	Confident	76.4	Confident	27 Å²	27	48.5 Å²	48.5	14%	0.138	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-105	109.5	-174.9	-53.2	151.1	0	0	0	109.8	F234 P382 L387 S392 T393 E394 Y396	F234-I384 HydrophobicContact CD1-CD1 3.89Å; F234-I384 HydrophobicContact CD2-CD1 4Å; F234-I384 HydrophobicContact CE1-CD1 3.48Å; F234-I384 VanDerWaalsContact CE1-CD1 3.48Å; F234-I384 HydrophobicContact CE2-CD1 3.61Å; F234-I384 HydrophobicContact CE2-CG1 4.25Å; F234-I384 HydrophobicContact CG-CD1 4.15Å; F234-I384 HydrophobicContact CZ-CD1 3.35Å; F234-I384 HydrophobicContact CZ-CG1 4.24Å; P382-I384 PolarHBondContact O-N 3.45Å; I384-L387 HydrophobicContact CB-CD1 4.18Å; I384-L387 HydrophobicContact CD1-CD1 4.04Å; I384-L387 HydrophobicContact CG2-CB 4.49Å; I384-L387 HydrophobicContact CG2-CD1 3.49Å; I384-L387 VanDerWaalsContact CG2-CD1 3.49Å; I384-S392 VanDerWaalsContact O-O 3.12Å; I384-T393 WeakPolarHBondContact O-CA 3.35Å; I384-E394 PolarHBondContact N-O 2.85Å; I384-E394 PolarHBondContact O-N 2.9Å; I384-Y396 HydrophobicContact CD1-CD2 3.63Å; I384-Y396 HydrophobicContact CD1-CE2 3.63Å
385	Y	65.2	Low	75.8	Confident	119 Å²	119	49.1 Å²	49.1	47%	0.467	24%	0.238	S	C	.	.	S	Bend	trans	-88.3	-4.6	-174.1	-58.1	-87.7	0	0	0	114.6	P383 Q391 T393	P383-Y385 HydrophobicContact CB-CE2 4Å; P383-Y385 HydrophobicContact CG-CE2 3.9Å; P383-Y385 WeakPolarHBondContact O-CD2 3.46Å; P383-Y385 WeakPolarHBondContact O-CE2 3.28Å; Y385-Q391 VanDerWaalsContact O-CA 3.26Å; Y385-Q391 WeakPolarHBondContact O-CA 3.39Å; Y385-Q391 WeakPolarHBondContact O-CB 3.45Å; Y385-T393 HydrophobicContact CD1-CG2 4.02Å; Y385-T393 VanDerWaalsContact CD1-OG1 3.3Å; Y385-T393 WeakPolarHBondContact CD1-OG1 3.31Å; Y385-T393 HydrophobicContact CE1-CG2 3.75Å
386	Q	61.5	Low	75.4	Confident	154 Å²	154	49.1 Å²	49.1	72%	0.72	24%	0.238	S	C	*	.			trans	-143.5	39.1	-169.8	-62.9	-172.9	0.4	0	0	113.1	D388	Q386-D388 VanDerWaalsContact C-N 3.31Å
387	L	60.2	Low	75.1	Confident	27 Å²	27	51 Å²	51	14%	0.141	24%	0.243	C	C	.	.	S	Bend	trans	-63.4	-43.7	170.3	-133.1	75.9	0	0	0	110.6	A230 H231 F234 I384 Y396	A230-L387 HydrophobicContact CB-CB 4.36Å; A230-L387 HydrophobicContact CB-CD2 4.3Å; A230-L387 HydrophobicContact CB-CG 4.04Å; A230-L387 WeakPolarHBondContact CB-O 3.36Å; H231-L387 HydrophobicContact CB-CD2 4.33Å; F234-L387 HydrophobicContact CB-CD1 3.82Å; F234-L387 HydrophobicContact CD2-CD1 4.16Å; F234-L387 HydrophobicContact CG-CD1 3.92Å; I384-L387 HydrophobicContact CB-CD1 4.18Å; I384-L387 HydrophobicContact CD1-CD1 4.04Å; I384-L387 HydrophobicContact CG2-CB 4.49Å; I384-L387 HydrophobicContact CG2-CD1 3.49Å; I384-L387 VanDerWaalsContact CG2-CD1 3.49Å; L387-Y396 HydrophobicContact CD2-CE2 4.31Å; L387-Y396 WeakPolarHBondContact CD2-OH 3.39Å
388	D	58	Low	75	Confident	18 Å²	18	50.8 Å²	50.8	10%	0.096	24%	0.242	C	C	.	.	S	Bend	trans	-122.4	165.8	-177	-80.3	-55.2	0	0	0	112.4	Y227 A230 Q386 T390 Q391	Y227-D388 WeakPolarHBondContact CD2-OD2 3.12Å; A230-D388 WeakPolarHBondContact CB-OD1 3.4Å; Q386-D388 VanDerWaalsContact C-N 3.31Å; D388-T390 PolarHBondContact O-N 2.82Å; D388-Q391 PolarHBondContact O-N 2.84Å
389	W	56.3	Low	75	Confident	178 Å²	178	52 Å²	52	67%	0.674	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	-50.2	-10	161.6	64	-67.2	0	0	0	115.3
390	T	52.5	Low	75.1	Confident	30 Å²	30	52.1 Å²	52.1	18%	0.184	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.3	3.3	-174.8	66.5	0	0	0	0	114.9	D388 S392 R499	D388-T390 PolarHBondContact O-N 2.82Å; T390-S392 VanDerWaalsContact C-N 3.29Å; T390-S392 PolarHBondContact O-N 3.26Å; T390-S392 VanDerWaalsContact O-N 3.16Å; T390-R499 VanDerWaalsContact OG1-CD 3.3Å; T390-R499 WeakPolarHBondContact OG1-CD 3.34Å; T390-R499 PolarHBondContact OG1-NH1 3.48Å
391	Q	54.3	Low	75.4	Confident	125 Å²	125	52.1 Å²	52.1	58%	0.584	25%	0.246	S	C	*	.			trans	51.1	36.7	171.9	-62.2	-176	-17.4	0	0	115.8	Y385 D388 T393	Y385-Q391 VanDerWaalsContact O-CA 3.26Å; Y385-Q391 WeakPolarHBondContact O-CA 3.39Å; Y385-Q391 WeakPolarHBondContact O-CB 3.45Å; D388-Q391 PolarHBondContact O-N 2.84Å; Q391-T393 PolarHBondContact O-N 3.38Å
392	S	59.2	Low	75.7	Confident	15 Å²	15	51.8 Å²	51.8	11%	0.105	24%	0.244	C	C	.	.			trans	-76.2	119.7	174.7	51.7	0	0	0	0	111.5	I384 T390 E394 R499	I384-S392 VanDerWaalsContact O-O 3.12Å; T390-S392 VanDerWaalsContact C-N 3.29Å; T390-S392 PolarHBondContact O-N 3.26Å; T390-S392 VanDerWaalsContact O-N 3.16Å; S392-E394 PolarHBondContact O-N 2.99Å; S392-R499 PolarHBondContact OG-NH1 2.85Å
393	T	68.4	Low	76.2	Confident	40 Å²	40	49.9 Å²	49.9	25%	0.245	23%	0.231	C	C	.	.			trans	-70	110	174.2	-47.5	0	0	0	0	111.1	P383 I384 Y385 Q391	P383-T393 HydrophobicContact CB-CG2 3.6Å; I384-T393 WeakPolarHBondContact O-CA 3.35Å; Y385-T393 HydrophobicContact CD1-CG2 4.02Å; Y385-T393 VanDerWaalsContact CD1-OG1 3.3Å; Y385-T393 WeakPolarHBondContact CD1-OG1 3.31Å; Y385-T393 HydrophobicContact CE1-CG2 3.75Å; Q391-T393 PolarHBondContact O-N 3.38Å
394	E	74.7	Confident	76.8	Confident	29 Å²	29	47.7 Å²	47.7	14%	0.136	22%	0.217	C	C	.	.	B	Isolated β-bridge	trans	-120.1	154.2	174.1	-67.1	-169.7	-169.1	0	0	111.7	Y227 I384 S392 Y396	Y227-E394 WeakPolarHBondContact CE2-OE1 3.29Å; I384-E394 PolarHBondContact N-O 2.85Å; I384-E394 PolarHBondContact O-N 2.9Å; S392-E394 PolarHBondContact O-N 2.99Å; E394-Y396 HydrophobicContact CB-CE2 4.42Å; E394-Y396 PolarHBondContact OE2-OH 2.86Å
395	C	84	Confident	77.6	Confident	14 Å²	14	48.8 Å²	48.8	10%	0.095	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	142.7	174.8	-66.8	0	0	0	0	108.6	T424 C426	C395-T424 HydrophobicContact CB-CG2 3.98Å; C395-T424 WeakPolarHBondContact O-CG2 3.27Å; C395-T424 PolarHBondContact O-N 2.65Å; C395-T424 VanDerWaalsContact O-O 3.06Å; C395-C426 HydrophobicContact CB-CB 4.12Å; C395-C426 WeakPolarHBondContact CB-SG 3.48Å; C395-C426 PolarHBondContact N-SG 2.92Å; C395-C426 WeakPolarHBondContact SG-CA 3.39Å; C395-C426 WeakPolarHBondContact SG-CB 3.36Å; C395-C426 CovalentContact SG-SG 2.04Å; C395-C426 PolarHBondContact SG-SG 2.8Å
396	Y	86.9	Confident	78.7	Confident	0 Å²	0	44 Å²	44	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	140	-179.4	-61.4	-69.7	0	0	0	111.1	H231 F234 L380 S381 I384 L387 E394 Y421 A422	H231-Y396 AromaticContact CD2-CE1 3.75Å; H231-Y396 AromaticContact CD2-CZ 3.93Å; H231-Y396 PolarHBondContact CD2-OH 3.33Å; H231-Y396 AromaticContact NE2-CE1 3.58Å; F234-Y396 AromaticContact CD1-CD2 3.57Å; F234-Y396 HydrophobicContact CD1-CD2 3.57Å; F234-Y396 AromaticContact CD1-CE2 3.69Å; F234-Y396 HydrophobicContact CD1-CE2 3.69Å; F234-Y396 AromaticContact CE1-CD2 3.45Å; F234-Y396 HydrophobicContact CE1-CD2 3.45Å; F234-Y396 VanDerWaalsContact CE1-CD2 3.45Å; F234-Y396 HydrophobicContact CE1-CE2 4.02Å; F234-Y396 HydrophobicContact CE1-CG 4.35Å; L380-Y396 CarbonylContact C-O 3.17Å; L380-Y396 WeakPolarHBondContact CA-O 3.28Å; S381-Y396 PolarHBondContact N-O 3.03Å; S381-Y396 PolarHBondContact OG-N 2.91Å; I384-Y396 HydrophobicContact CD1-CD2 3.63Å; I384-Y396 HydrophobicContact CD1-CE2 3.63Å; L387-Y396 HydrophobicContact CD2-CE2 4.31Å; L387-Y396 WeakPolarHBondContact CD2-OH 3.39Å; E394-Y396 HydrophobicContact CB-CE2 4.42Å; E394-Y396 PolarHBondContact OE2-OH 2.86Å; Y396-Y421 HydrophobicContact CD1-CD2 4.01Å; Y396-Y421 HydrophobicContact CG-CD2 4.32Å; Y396-A422 WeakPolarHBondContact CA-O 3.19Å
397	R	89.8	Confident	79.8	Confident	97 Å²	97	41 Å²	41	37%	0.366	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	109.6	168.6	-169.7	178.6	-170.8	-150.8	5.6	108.2	D299 N378 L379 L380 Y421 A422 T424	D299-R397 IonicContact OD1-CZ 2.7Å; D299-R397 IonicContact OD1-NE 2.61Å; D299-R397 PolarHBondContact OD1-NE 3.42Å; D299-R397 IonicContact OD1-NH2 3.13Å; D299-R397 PolarHBondContact OD1-NH2 3.3Å; D299-R397 IonicContact OD2-CZ 2.85Å; D299-R397 IonicContact OD2-NE 2.99Å; D299-R397 PolarHBondContact OD2-NE 3.03Å; D299-R397 IonicContact OD2-NH2 3.18Å; D299-R397 PolarHBondContact OD2-NH2 3.29Å; N378-R397 PolarHBondContact ND2-NH2 3.36Å; L379-R397 CarbonylContact O-C 3.53Å; L379-R397 WeakPolarHBondContact O-CA 3.41Å; L380-R397 HydrophobicContact CD2-CB 3.87Å; L380-R397 HydrophobicContact CD2-CG 3.83Å; R397-Y421 VanDerWaalsContact O-CA 3.3Å; R397-Y421 WeakPolarHBondContact O-CA 3.18Å; R397-A422 PolarHBondContact N-O 3.46Å; R397-A422 PolarHBondContact O-N 2.58Å; R397-T424 HydrophobicContact CB-CG2 4.27Å
398	F	92.8	Very high	80.7	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	127	173.7	-68.1	-83.4	0	0	0	109.4	F234 S238 F242 Y296 N378 L379 I400 A419 Y421	F234-F398 HydrophobicContact CD1-CZ 4.27Å; F234-F398 AromaticContact CE1-CE2 3.93Å; F234-F398 HydrophobicContact CE1-CE2 3.93Å; F234-F398 AromaticContact CE1-CZ 3.6Å; F234-F398 HydrophobicContact CE1-CZ 3.6Å; F234-F398 HydrophobicContact CZ-CE2 4.44Å; F234-F398 HydrophobicContact CZ-CZ 4.34Å; S238-F398 VanDerWaalsContact CB-CZ 3.45Å; S238-F398 WeakPolarHBondContact OG-CZ 3.38Å; F242-F398 HydrophobicContact CE2-CB 4.19Å; F242-F398 AromaticContact CE2-CD1 3.53Å; F242-F398 HydrophobicContact CE2-CD1 3.53Å; F242-F398 HydrophobicContact CE2-CD2 4.17Å; F242-F398 AromaticContact CE2-CE1 3.85Å; F242-F398 HydrophobicContact CE2-CE1 3.85Å; F242-F398 HydrophobicContact CE2-CE2 4.43Å; F242-F398 AromaticContact CE2-CG 3.71Å; F242-F398 HydrophobicContact CE2-CG 3.71Å; F242-F398 HydrophobicContact CE2-CZ 4.28Å; F242-F398 HydrophobicContact CZ-CB 4.35Å; F242-F398 HydrophobicContact CZ-CD1 4.13Å; F242-F398 AromaticContact CZ-CD2 3.91Å; F242-F398 HydrophobicContact CZ-CD2 3.91Å; F242-F398 HydrophobicContact CZ-CE1 4.4Å; F242-F398 HydrophobicContact CZ-CE2 4.18Å; F242-F398 AromaticContact CZ-CG 3.87Å; F242-F398 HydrophobicContact CZ-CG 3.87Å; F242-F398 HydrophobicContact CZ-CZ 4.42Å; Y296-F398 HydrophobicContact CE1-CD2 4.34Å; Y296-F398 AromaticContact CE1-CE2 3.95Å; Y296-F398 HydrophobicContact CE1-CE2 3.95Å; N378-F398 CarbonylContact C-O 3.58Å; N378-F398 VanDerWaalsContact CA-O 3.28Å; N378-F398 WeakPolarHBondContact CA-O 3.37Å; L379-F398 PolarHBondContact N-O 3.05Å; L379-F398 PolarHBondContact O-N 3.48Å; F398-I400 HydrophobicContact CB-CD1 4.48Å; F398-I400 HydrophobicContact CB-CG1 4.22Å; F398-A419 HydrophobicContact CD1-CB 4.45Å; F398-Y421 VanDerWaalsContact CD1-CB 3.49Å; F398-Y421 HydrophobicContact CD1-CG 4.19Å; F398-Y421 HydrophobicContact CE1-CD1 4.19Å; F398-Y421 HydrophobicContact CE1-CD2 4.5Å; F398-Y421 AromaticContact CE1-CG 3.9Å; F398-Y421 HydrophobicContact CE1-CG 3.9Å
399	M	92.9	Very high	82	Confident	77 Å²	77	48 Å²	48	38%	0.379	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	83.3	176.2	-62.9	173.3	-69.4	0	0	107.8	P420	M399-P420 HydrophobicContact CB-CG 4.39Å; M399-P420 PolarHBondContact N-O 2.04Å; M399-P420 VanDerWaalsContact O-CD 3.26Å; M399-P420 WeakPolarHBondContact O-CD 3.34Å; M399-P420 WeakPolarHBondContact O-CG 3.47Å
400	I	95.2	Very high	83.4	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	128.1	-171.2	-62.4	166.6	0	0	0	109.3	F242 Y246 H376 F377 L379 F398 I402 L417 R418 A419	F242-I400 HydrophobicContact CB-CD1 4.46Å; F242-I400 HydrophobicContact CD1-CD1 3.9Å; F242-I400 HydrophobicContact CD2-CD1 3.78Å; F242-I400 HydrophobicContact CD2-CG1 4.2Å; F242-I400 HydrophobicContact CE1-CD1 4.02Å; F242-I400 HydrophobicContact CE2-CD1 3.94Å; F242-I400 HydrophobicContact CE2-CG1 4.4Å; F242-I400 HydrophobicContact CG-CD1 3.79Å; F242-I400 HydrophobicContact CZ-CD1 4.05Å; Y246-I400 HydrophobicContact CE2-CD1 4.06Å; H376-I400 WeakPolarHBondContact CA-O 3.28Å; F377-I400 HydrophobicContact CD2-CB 4.13Å; F377-I400 HydrophobicContact CD2-CD1 4.21Å; F377-I400 HydrophobicContact CE1-CB 4.39Å; F377-I400 HydrophobicContact CE1-CG2 3.96Å; F377-I400 HydrophobicContact CE2-CB 3.83Å; F377-I400 HydrophobicContact CE2-CD1 3.54Å; F377-I400 HydrophobicContact CE2-CG1 4.26Å; F377-I400 HydrophobicContact CE2-CG2 3.95Å; F377-I400 HydrophobicContact CZ-CB 3.98Å; F377-I400 HydrophobicContact CZ-CD1 4.19Å; F377-I400 HydrophobicContact CZ-CG2 3.57Å; F377-I400 PolarHBondContact N-O 2.81Å; F377-I400 PolarHBondContact O-N 3.38Å; L379-I400 HydrophobicContact CD1-CD1 3.69Å; L379-I400 HydrophobicContact CG-CD1 4.22Å; F398-I400 HydrophobicContact CB-CD1 4.48Å; F398-I400 HydrophobicContact CB-CG1 4.22Å; I400-I402 HydrophobicContact CG2-CG1 4.35Å; I400-L417 HydrophobicContact CG2-CD1 4.3Å; I400-L417 HydrophobicContact CG2-CD2 4.26Å; I400-L417 HydrophobicContact CG2-CG 4.15Å; I400-R418 WeakPolarHBondContact CA-O 3.38Å; I400-A419 HydrophobicContact CG1-CB 4.05Å
401	K	96.2	Very high	85.1	Confident	51 Å²	51	44.3 Å²	44.3	22%	0.222	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	121.9	171.6	-172.7	-175.8	-170.5	-163.4	0	109.2	D374 I375 H376 S403 L417 R418	D374-K401 WeakPolarHBondContact OD1-CE 3.31Å; D374-K401 IonicContact OD1-NZ 2.71Å; D374-K401 PolarHBondContact OD1-NZ 3.48Å; D374-K401 VanDerWaalsContact OD1-NZ 3.14Å; D374-K401 WeakPolarHBondContact OD2-CE 3.45Å; D374-K401 IonicContact OD2-NZ 2.76Å; D374-K401 PolarHBondContact OD2-NZ 3.21Å; I375-K401 CarbonylContact O-C 3.59Å; I375-K401 VanDerWaalsContact O-CA 3.31Å; I375-K401 WeakPolarHBondContact O-CA 3.42Å; H376-K401 VanDerWaalsContact CE1-CE 3.45Å; H376-K401 WeakPolarHBondContact CE1-CE 3.26Å; H376-K401 VanDerWaalsContact NE2-CE 3.33Å; H376-K401 WeakPolarHBondContact NE2-CE 3.3Å; K401-S403 WeakPolarHBondContact CE-OG 3.48Å; K401-S403 PolarHBondContact NZ-OG 3.46Å; K401-L417 CarbonylContact O-C 3.59Å; K401-L417 WeakPolarHBondContact O-CA 3.26Å; K401-R418 PolarHBondContact N-O 3.42Å; K401-R418 PolarHBondContact O-N 2.88Å
402	I	96.9	Very high	86.9	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	114.8	168.8	-61.1	164.2	0	0	0	107.2	Y246 L247 T281 D374 I375 F377 I400 L404 I415 L417	Y246-I402 HydrophobicContact CG-CD1 4.41Å; L247-I402 HydrophobicContact CD2-CG2 3.94Å; T281-I402 HydrophobicContact CG2-CD1 3.57Å; D374-I402 WeakPolarHBondContact CA-O 3.35Å; I375-I402 HydrophobicContact CB-CB 4.27Å; I375-I402 PolarHBondContact N-O 3.24Å; I375-I402 PolarHBondContact O-N 3.18Å; F377-I402 HydrophobicContact CE1-CD1 4.09Å; F377-I402 HydrophobicContact CZ-CD1 4.4Å; I400-I402 HydrophobicContact CG2-CG1 4.35Å; I402-L404 HydrophobicContact CG2-CD1 4.22Å; I402-I415 HydrophobicContact CG2-CG2 4.03Å; I402-L417 HydrophobicContact CD1-CD1 3.96Å; I402-L417 HydrophobicContact CG1-CB 4.19Å; I402-L417 HydrophobicContact CG1-CD1 3.74Å; I402-L417 HydrophobicContact CG1-CG 3.8Å
403	S	95.5	Very high	88.5	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	120.2	-177	-75	0	0	0	0	110.2	D374 K401 I415 M416	D374-S403 VanDerWaalsContact OD1-CA 3.29Å; D374-S403 WeakPolarHBondContact OD1-CA 3.42Å; D374-S403 WeakPolarHBondContact OD1-CB 3.05Å; D374-S403 PolarHBondContact OD1-OG 2.79Å; K401-S403 WeakPolarHBondContact CE-OG 3.48Å; K401-S403 PolarHBondContact NZ-OG 3.46Å; S403-I415 CarbonylContact O-C 3.51Å; S403-I415 WeakPolarHBondContact O-CA 3.3Å; S403-M416 PolarHBondContact N-O 3.18Å; S403-M416 PolarHBondContact O-N 3.18Å
404	L	95.5	Very high	89.6	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	99.6	170.7	-57.2	91.5	0	0	0	107.5	G372 F373 I402 M413 K414 I415	G372-L404 CarbonylContact C-O 3.3Å; G372-L404 WeakPolarHBondContact CA-O 3.21Å; F373-L404 HydrophobicContact CB-CB 4.42Å; F373-L404 HydrophobicContact CB-CD1 4.45Å; F373-L404 HydrophobicContact CD1-CD1 4.19Å; F373-L404 PolarHBondContact N-O 2.96Å; F373-L404 WeakPolarHBondContact O-CD1 3.43Å; F373-L404 PolarHBondContact O-N 3.45Å; I402-L404 HydrophobicContact CG2-CD1 4.22Å; L404-M413 HydrophobicContact CB-CE 3.57Å; L404-M413 HydrophobicContact CB-CG 4.11Å; L404-M413 HydrophobicContact CB-SD 3.64Å; L404-M413 HydrophobicContact CD2-CE 3.5Å; L404-M413 HydrophobicContact CG-CE 4.15Å; L404-K414 CarbonylContact C-O 3.5Å; L404-K414 WeakPolarHBondContact CA-O 3.43Å; L404-I415 HydrophobicContact CB-CG1 4.41Å; L404-I415 HydrophobicContact CD2-CD1 3.6Å; L404-I415 HydrophobicContact CD2-CG1 3.89Å; L404-I415 HydrophobicContact CG-CD1 4.12Å; L404-I415 HydrophobicContact CG-CG1 3.9Å; L404-I415 HydrophobicContact CG-CG2 4.26Å
405	E	92.6	Very high	90.5	Very high	50 Å²	50	40.9 Å²	40.9	23%	0.234	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	125.9	-168	-64.8	-178.1	-169.6	0	0	111.7	P407 M413 K414 M416 R418	E405-P407 VanDerWaalsContact C-CD 3.41Å; E405-M413 WeakPolarHBondContact O-CA 3.21Å; E405-M413 WeakPolarHBondContact O-CG 3.31Å; E405-K414 PolarHBondContact N-O 2.99Å; E405-K414 PolarHBondContact O-N 3.02Å; E405-M416 VanDerWaalsContact CD-CE 3.41Å; E405-M416 HydrophobicContact CG-CE 4.47Å; E405-M416 VanDerWaalsContact OE1-CE 3.23Å; E405-M416 WeakPolarHBondContact OE1-CE 3.39Å; E405-M416 WeakPolarHBondContact OE2-CE 3.34Å; E405-R418 IonicContact OE1-NH1 3.67Å; E405-R418 PolarHBondContact OE1-NH1 2.93Å
406	N	89.9	Confident	91	Very high	17 Å²	17	43 Å²	43	9%	0.091	24%	0.239	C	C	.	.			trans	-128.9	45.4	176	-169.5	28.1	0	0	0	112.8	L371 S408 Q409 S410 M413	L371-N406 CarbonylContact O-C 3.5Å; L371-N406 WeakPolarHBondContact O-CA 3.48Å; L371-N406 PolarHBondContact O-N 2.83Å; N406-S408 PolarHBondContact O-N 3.42Å; N406-Q409 PolarHBondContact O-N 3.12Å; N406-Q409 VanDerWaalsContact OD1-CA 3.29Å; N406-Q409 WeakPolarHBondContact OD1-CA 3.19Å; N406-Q409 PolarHBondContact OD1-N 3.29Å; N406-S410 PolarHBondContact OD1-N 2.84Å; N406-M413 HydrophobicContact CB-CB 4.22Å; N406-M413 HydrophobicContact CB-CG 3.95Å
407	P	83.9	Confident	91.4	Very high	93 Å²	93	43.6 Å²	43.6	60%	0.604	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-26.1	-171.6	28.1	-36.9	0	0	0	113.6	E405	E405-P407 VanDerWaalsContact C-CD 3.41Å
408	S	80	Confident	91.6	Very high	99 Å²	99	42.1 Å²	42.1	69%	0.692	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-2.9	177.9	-53.5	0	0	0	0	113.8	N406 S410	N406-S408 PolarHBondContact O-N 3.42Å; S408-S410 PolarHBondContact O-N 3.09Å; S408-S410 VanDerWaalsContact O-N 3.08Å
409	Q	83.8	Confident	91.6	Very high	92 Å²	92	42.7 Å²	42.7	43%	0.43	24%	0.241	S	C	.	.			trans	47.4	35.8	-175.4	-57.9	-166.8	-48.2	0	0	113.9	N368 N406 G411	N368-Q409 PolarHBondContact O-NE2 2.86Å; N406-Q409 PolarHBondContact O-N 3.12Å; N406-Q409 VanDerWaalsContact OD1-CA 3.29Å; N406-Q409 WeakPolarHBondContact OD1-CA 3.19Å; N406-Q409 PolarHBondContact OD1-N 3.29Å; Q409-G411 VanDerWaalsContact C-N 3.31Å; Q409-G411 PolarHBondContact O-N 3.17Å
410	S	86.9	Confident	91.5	Very high	81 Å²	81	41 Å²	41	57%	0.566	24%	0.236	S	C	*	.	S	Bend	trans	-84	0.4	-169.1	56.1	0	0	0	0	114.6	N406 S408 Q412	N406-S410 PolarHBondContact OD1-N 2.84Å; S408-S410 PolarHBondContact O-N 3.09Å; S408-S410 VanDerWaalsContact O-N 3.08Å; S410-Q412 PolarHBondContact O-N 2.88Å
411	G	88.5	Confident	91.2	Very high	50 Å²	50	42 Å²	42	52%	0.515	24%	0.24	S	C	.	.	S	Bend	trans	79.9	-4	-170.8	0	0	0	0	0	114.5	Q409	Q409-G411 VanDerWaalsContact C-N 3.31Å; Q409-G411 PolarHBondContact O-N 3.17Å
412	Q	90.9	Very high	90.5	Very high	48 Å²	48	41.4 Å²	41.4	22%	0.224	25%	0.245	C	C	.	.			trans	-107.5	111.9	168	-179.3	-171.4	28.5	0	0	108.6	A267 Y269 S410 K414	A267-Q412 HydrophobicContact CB-CG 3.62Å; Y269-Q412 HydrophobicContact CD1-CB 4.23Å; Y269-Q412 HydrophobicContact CD1-CG 4.38Å; Y269-Q412 HydrophobicContact CE1-CB 3.76Å; Y269-Q412 HydrophobicContact CE1-CG 3.62Å; Y269-Q412 PolarHBondContact OH-NE2 3.01Å; S410-Q412 PolarHBondContact O-N 2.88Å; Q412-K414 HydrophobicContact CG-CG 4.43Å
413	M	92.4	Very high	89.6	Confident	13 Å²	13	42.2 Å²	42.2	6%	0.064	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	112.9	174.5	-174.6	-177.8	66.4	0	0	109.7	A267 V268 F274 L404 E405 N406	A267-M413 CarbonylContact C-O 3.56Å; A267-M413 VanDerWaalsContact CA-O 3.27Å; A267-M413 WeakPolarHBondContact CA-O 3.48Å; A267-M413 WeakPolarHBondContact CB-O 3.5Å; V268-M413 HydrophobicContact CG2-CB 4.25Å; V268-M413 HydrophobicContact CG2-CE 3.21Å; V268-M413 PolarHBondContact N-O 2.86Å; V268-M413 PolarHBondContact O-N 2.69Å; F274-M413 HydrophobicContact CB-CE 4.48Å; F274-M413 HydrophobicContact CD2-CE 3.3Å; F274-M413 HydrophobicContact CD2-SD 3.88Å; F274-M413 HydrophobicContact CE2-CE 3.88Å; F274-M413 HydrophobicContact CE2-SD 4.02Å; F274-M413 HydrophobicContact CG-CE 4.31Å; L404-M413 HydrophobicContact CB-CE 3.57Å; L404-M413 HydrophobicContact CB-CG 4.11Å; L404-M413 HydrophobicContact CB-SD 3.64Å; L404-M413 HydrophobicContact CD2-CE 3.5Å; L404-M413 HydrophobicContact CG-CE 4.15Å; E405-M413 WeakPolarHBondContact O-CA 3.21Å; E405-M413 WeakPolarHBondContact O-CG 3.31Å; N406-M413 HydrophobicContact CB-CB 4.22Å; N406-M413 HydrophobicContact CB-CG 3.95Å
414	K	93	Very high	88.7	Confident	69 Å²	69	43.8 Å²	43.8	30%	0.3	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	139.3	-174.5	-57.5	-169.2	-174.9	-168.1	0	110.4	D265 A267 L404 E405 Q412	D265-K414 HydrophobicContact CB-CD 4.24Å; D265-K414 WeakPolarHBondContact OD2-CE 3.11Å; D265-K414 IonicContact OD2-NZ 3.6Å; D265-K414 PolarHBondContact OD2-NZ 3.23Å; A267-K414 HydrophobicContact CB-CG 4.38Å; L404-K414 CarbonylContact C-O 3.5Å; L404-K414 WeakPolarHBondContact CA-O 3.43Å; E405-K414 PolarHBondContact N-O 2.99Å; E405-K414 PolarHBondContact O-N 3.02Å; Q412-K414 HydrophobicContact CG-CG 4.43Å
415	I	93.7	Very high	87.7	Confident	7 Å²	7	47.5 Å²	47.5	4%	0.036	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124.6	-179.2	-53.9	-174.5	0	0	0	109.1	L247 Y266 V268 I402 S403 L404	L247-I415 HydrophobicContact CD2-CG2 3.77Å; Y266-I415 HydrophobicContact CD1-CB 3.78Å; Y266-I415 HydrophobicContact CD1-CG2 4.31Å; Y266-I415 HydrophobicContact CE1-CB 3.75Å; Y266-I415 HydrophobicContact CE1-CD1 4.27Å; Y266-I415 HydrophobicContact CE1-CG1 4.47Å; Y266-I415 HydrophobicContact CE1-CG2 3.94Å; Y266-I415 PolarHBondContact O-N 3.21Å; V268-I415 HydrophobicContact CB-CD1 4.5Å; V268-I415 HydrophobicContact CG1-CD1 3.73Å; V268-I415 HydrophobicContact CG2-CD1 4.1Å; I402-I415 HydrophobicContact CG2-CG2 4.03Å; S403-I415 CarbonylContact O-C 3.51Å; S403-I415 WeakPolarHBondContact O-CA 3.3Å; L404-I415 HydrophobicContact CB-CG1 4.41Å; L404-I415 HydrophobicContact CD2-CD1 3.6Å; L404-I415 HydrophobicContact CD2-CG1 3.89Å; L404-I415 HydrophobicContact CG-CD1 4.12Å; L404-I415 HydrophobicContact CG-CG1 3.9Å; L404-I415 HydrophobicContact CG-CG2 4.26Å
416	M	93.3	Very high	86.8	Confident	59 Å²	59	47.6 Å²	47.6	29%	0.291	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	123.5	177.2	-66.3	-170.2	-65.8	0	0	110.5	S403 E405	S403-M416 PolarHBondContact N-O 3.18Å; S403-M416 PolarHBondContact O-N 3.18Å; E405-M416 VanDerWaalsContact CD-CE 3.41Å; E405-M416 HydrophobicContact CG-CE 4.47Å; E405-M416 VanDerWaalsContact OE1-CE 3.23Å; E405-M416 WeakPolarHBondContact OE1-CE 3.39Å; E405-M416 WeakPolarHBondContact OE2-CE 3.34Å
417	L	95.1	Very high	85.7	Confident	12 Å²	12	52.1 Å²	52.1	6%	0.063	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	134.5	165.7	-168.9	152.1	0	0	0	108.9	H239 F242 Y246 L247 I400 K401 I402 A419	H239-L417 PolarHBondContact CE1-O 2.84Å; H239-L417 VanDerWaalsContact ND1-CD2 3.34Å; H239-L417 WeakPolarHBondContact ND1-CD2 3.47Å; F242-L417 HydrophobicContact CB-CD1 4.05Å; F242-L417 HydrophobicContact CB-CD2 3.98Å; F242-L417 WeakPolarHBondContact O-CD1 3.5Å; Y246-L417 HydrophobicContact CD2-CD1 4.24Å; L247-L417 HydrophobicContact CD1-CB 4.03Å; L247-L417 HydrophobicContact CD2-CB 4.35Å; L247-L417 HydrophobicContact CD2-CD1 4.46Å; L247-L417 HydrophobicContact CG-CB 4.39Å; L247-L417 HydrophobicContact CG-CD1 4.29Å; I400-L417 HydrophobicContact CG2-CD1 4.3Å; I400-L417 HydrophobicContact CG2-CD2 4.26Å; I400-L417 HydrophobicContact CG2-CG 4.15Å; K401-L417 CarbonylContact O-C 3.59Å; K401-L417 WeakPolarHBondContact O-CA 3.26Å; I402-L417 HydrophobicContact CD1-CD1 3.96Å; I402-L417 HydrophobicContact CG1-CB 4.19Å; I402-L417 HydrophobicContact CG1-CD1 3.74Å; I402-L417 HydrophobicContact CG1-CG 3.8Å; L417-A419 HydrophobicContact CD2-CB 4.06Å
418	R	94.1	Very high	84.3	Confident	65 Å²	65	51.6 Å²	51.6	25%	0.245	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	131.6	169.4	-64.9	-179.1	175.5	112.4	-7.4	107.8	I400 K401 E405 P420	I400-R418 WeakPolarHBondContact CA-O 3.38Å; K401-R418 PolarHBondContact N-O 3.42Å; K401-R418 PolarHBondContact O-N 2.88Å; E405-R418 IonicContact OE1-NH1 3.67Å; E405-R418 PolarHBondContact OE1-NH1 2.93Å; R418-P420 WeakPolarHBondContact O-CD 3.35Å
419	A	93.1	Very high	82.9	Confident	13 Å²	13	50.4 Å²	50.4	11%	0.107	29%	0.29	C	S	.	.			trans	-124.8	59.2	-179.6	0	0	0	0	0	112.2	H239 F242 F398 I400 L417 Y421	H239-A419 HydrophobicContact CB-CB 4.46Å; F242-A419 HydrophobicContact CD2-CB 3.69Å; F242-A419 HydrophobicContact CE2-CB 4.12Å; F398-A419 HydrophobicContact CD1-CB 4.45Å; I400-A419 HydrophobicContact CG1-CB 4.05Å; L417-A419 HydrophobicContact CD2-CB 4.06Å; A419-Y421 PolarHBondContact O-N 3.41Å
420	P	90.9	Very high	80.8	Confident	41 Å²	41	48.7 Å²	48.7	27%	0.266	29%	0.288	S	S	.	.			trans	-56.1	140.8	172.7	26	-35.2	0	0	0	110.7	M399 R418	M399-P420 HydrophobicContact CB-CG 4.39Å; M399-P420 PolarHBondContact N-O 2.04Å; M399-P420 VanDerWaalsContact O-CD 3.26Å; M399-P420 WeakPolarHBondContact O-CD 3.34Å; M399-P420 WeakPolarHBondContact O-CG 3.47Å; R418-P420 WeakPolarHBondContact O-CD 3.35Å
421	Y	88	Confident	78.7	Confident	21 Å²	21	52 Å²	52	8%	0.082	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	148.2	-171.9	60.4	-75.7	0	0	0	111.3	H231 Y396 R397 F398 A419	H231-Y421 AromaticContact CE1-CE2 3.22Å; H231-Y421 WeakPolarHBondContact CE1-CE2 3.37Å; H231-Y421 AromaticContact CE1-CZ 3.9Å; H231-Y421 AromaticContact ND1-CE2 3.43Å; H231-Y421 WeakPolarHBondContact ND1-CE2 3.14Å; H231-Y421 AromaticContact ND1-CZ 3.87Å; H231-Y421 PolarHBondContact ND1-OH 3.3Å; H231-Y421 PolarHBondContact O-OH 3.18Å; Y396-Y421 HydrophobicContact CD1-CD2 4.01Å; Y396-Y421 HydrophobicContact CG-CD2 4.32Å; R397-Y421 VanDerWaalsContact O-CA 3.3Å; R397-Y421 WeakPolarHBondContact O-CA 3.18Å; F398-Y421 VanDerWaalsContact CD1-CB 3.49Å; F398-Y421 HydrophobicContact CD1-CG 4.19Å; F398-Y421 HydrophobicContact CE1-CD1 4.19Å; F398-Y421 HydrophobicContact CE1-CD2 4.5Å; F398-Y421 AromaticContact CE1-CG 3.9Å; F398-Y421 HydrophobicContact CE1-CG 3.9Å; A419-Y421 PolarHBondContact O-N 3.41Å
422	A	83.3	Confident	76.7	Confident	40 Å²	40	55.6 Å²	55.6	33%	0.331	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	139.7	177	0	0	0	0	0	110.2	Y396 R397 T424	Y396-A422 WeakPolarHBondContact CA-O 3.19Å; R397-A422 PolarHBondContact N-O 3.46Å; R397-A422 PolarHBondContact O-N 2.58Å; A422-T424 PolarHBondContact O-N 3.43Å
423	S	77.6	Confident	74.3	Confident	16 Å²	16	58.7 Å²	58.7	11%	0.112	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	130.8	168.8	-172.8	0	0	0	0	109.2
424	T	77.1	Confident	71.8	Confident	34 Å²	34	65 Å²	65	21%	0.209	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	143.3	177.9	-177.8	0	0	0	0	108.4	L380 C395 R397 A422 C426	L380-T424 HydrophobicContact CD2-CG2 4.27Å; C395-T424 HydrophobicContact CB-CG2 3.98Å; C395-T424 WeakPolarHBondContact O-CG2 3.27Å; C395-T424 PolarHBondContact O-N 2.65Å; C395-T424 VanDerWaalsContact O-O 3.06Å; R397-T424 HydrophobicContact CB-CG2 4.27Å; A422-T424 PolarHBondContact O-N 3.43Å; T424-C426 PolarHBondContact O-N 2.89Å
425	P	73.3	Confident	69.3	Low	78 Å²	78	67.6 Å²	67.6	51%	0.506	36%	0.355	S	S	.	.			trans	-55.4	130	170.9	24.1	-34.6	0	0	0	109.7	I427	P425-I427 VanDerWaalsContact C-N 3.29Å; P425-I427 PolarHBondContact O-N 2.89Å
426	C	74.6	Confident	67	Low	52 Å²	52	73.5 Å²	73.5	35%	0.351	38%	0.378	S	S	.	.			trans	-64.8	92.6	167	-63.8	0	0	0	0	108.4	C395 T424 D428	C395-C426 HydrophobicContact CB-CB 4.12Å; C395-C426 WeakPolarHBondContact CB-SG 3.48Å; C395-C426 PolarHBondContact N-SG 2.92Å; C395-C426 WeakPolarHBondContact SG-CA 3.39Å; C395-C426 WeakPolarHBondContact SG-CB 3.36Å; C395-C426 CovalentContact SG-SG 2.04Å; C395-C426 PolarHBondContact SG-SG 2.8Å; T424-C426 PolarHBondContact O-N 2.89Å; C426-D428 PolarHBondContact O-N 2.93Å
427	I	66.2	Low	64.6	Low	112 Å²	112	76.2 Å²	76.2	57%	0.574	39%	0.39	S	S	*	.			trans	-65.1	130.2	169.4	-62.7	176.3	0	0	0	106.7	P425 I429	P425-I427 VanDerWaalsContact C-N 3.29Å; P425-I427 PolarHBondContact O-N 2.89Å; I427-I429 VanDerWaalsContact C-N 3.34Å; I427-I429 PolarHBondContact O-N 3.45Å
428	D	54.2	Low	62.1	Low	82 Å²	82	78.6 Å²	78.6	44%	0.439	41%	0.407	S	S	.	.			trans	-65.3	91.9	179	-163.6	-8.4	0	0	0	109.2	C426 S430 K431	C426-D428 PolarHBondContact O-N 2.93Å; D428-S430 PolarHBondContact O-N 3.47Å; D428-S430 WeakPolarHBondContact OD1-CB 3.47Å; D428-S430 PolarHBondContact OD1-OG 3.07Å; D428-S430 PolarHBondContact OD2-OG 3.06Å; D428-K431 HydrophobicContact CB-CD 4.49Å; D428-K431 WeakPolarHBondContact O-CB 3.24Å; D428-K431 PolarHBondContact O-N 2.9Å
429	I	50.7	Low	59.9	Low	74 Å²	74	79.2 Å²	79.2	38%	0.379	42%	0.415	S	S	.	.	H	α-helix	trans	-55.7	-25	-174	-70.4	153.7	0	0	0	111.3	M297 I427 K431 Q432 L433	M297-I429 HydrophobicContact CE-CD1 3.88Å; M297-I429 HydrophobicContact CE-CG2 4.4Å; M297-I429 HydrophobicContact SD-CD1 3.62Å; I427-I429 VanDerWaalsContact C-N 3.34Å; I427-I429 PolarHBondContact O-N 3.45Å; I429-K431 PolarHBondContact O-N 3.38Å; I429-Q432 PolarHBondContact O-N 2.79Å; I429-Q432 VanDerWaalsContact O-N 3.09Å; I429-L433 HydrophobicContact CG2-CD1 4.47Å; I429-L433 PolarHBondContact O-N 3.45Å
430	S	40	Very low	57.5	Low	55 Å²	55	83.9 Å²	83.9	39%	0.385	44%	0.436	S	S	.	.	H	α-helix	trans	-49.3	-37.5	170.1	69.6	0	0	0	0	113.2	D428 H434	D428-S430 PolarHBondContact O-N 3.47Å; D428-S430 WeakPolarHBondContact OD1-CB 3.47Å; D428-S430 PolarHBondContact OD1-OG 3.07Å; D428-S430 PolarHBondContact OD2-OG 3.06Å; S430-H434 PolarHBondContact O-CD2 2.85Å; S430-H434 PolarHBondContact O-N 3.16Å
431	K	42.5	Very low	55.4	Low	150 Å²	150	86.9 Å²	86.9	65%	0.652	45%	0.449	S	S	*	.	H	α-helix	trans	-75.3	-32.4	-179.6	-67	-178.3	-179.5	174.1	0	113.2	D428 I429 H435	D428-K431 HydrophobicContact CB-CD 4.49Å; D428-K431 WeakPolarHBondContact O-CB 3.24Å; D428-K431 PolarHBondContact O-N 2.9Å; I429-K431 PolarHBondContact O-N 3.38Å; K431-H435 PolarHBondContact O-N 3.43Å
432	Q	45.6	Very low	53.3	Low	127 Å²	127	89.6 Å²	89.6	59%	0.593	47%	0.472	S	S	*	.	H	α-helix	trans	-74.2	-39	172.8	-76.4	-167.7	-16.9	0	0	111.4	I429 H435 Y436	I429-Q432 PolarHBondContact O-N 2.79Å; I429-Q432 VanDerWaalsContact O-N 3.09Å; Q432-H435 PolarHBondContact O-N 3.41Å; Q432-Y436 PolarHBondContact O-N 2.68Å
433	L	40.9	Very low	51.5	Low	112 Å²	112	90.9 Å²	90.9	59%	0.586	48%	0.478	S	S	*	.	H	α-helix	trans	-62.6	-48.4	176.4	-125.7	80.3	0	0	0	111.9	I429 H435 Y436 Q437	I429-L433 HydrophobicContact CG2-CD1 4.47Å; I429-L433 PolarHBondContact O-N 3.45Å; L433-H435 VanDerWaalsContact C-N 3.33Å; L433-H435 PolarHBondContact O-N 3.34Å; L433-Y436 PolarHBondContact O-N 2.88Å; L433-Q437 PolarHBondContact O-N 2.94Å
434	H	40.2	Very low	49.6	Very low	146 Å²	146	98.5 Å²	98.5	68%	0.676	51%	0.51	S	S	*	.	H	α-helix	trans	-62.9	-36.3	-180	-92.1	-66	0	0	0	113.6	S430 S438	S430-H434 PolarHBondContact O-CD2 2.85Å; S430-H434 PolarHBondContact O-N 3.16Å; H434-S438 PolarHBondContact O-N 3.27Å
435	H	40	Very low	47.8	Very low	124 Å²	124	105.1 Å²	105.1	57%	0.574	54%	0.538	S	S	*	.	H	α-helix	trans	-68.7	-37.5	177.3	-163.4	11	0	0	0	111.6	K431 Q432 L433 S438 I439	K431-H435 PolarHBondContact O-N 3.43Å; Q432-H435 PolarHBondContact O-N 3.41Å; L433-H435 VanDerWaalsContact C-N 3.33Å; L433-H435 PolarHBondContact O-N 3.34Å; H435-S438 PolarHBondContact O-N 2.9Å; H435-S438 PolarHBondContact O-OG 3.06Å; H435-I439 WeakPolarHBondContact O-CG1 3.42Å; H435-I439 PolarHBondContact O-N 2.93Å
436	Y	46.2	Very low	46.1	Very low	130 Å²	130	109.7 Å²	109.7	51%	0.51	55%	0.553	S	S	.	*	H	α-helix	trans	-69.8	-38.6	177.2	-136.8	-89.9	0	0	0	112.5	L301 Q432 L433 S438 I439 M440	L301-Y436 HydrophobicContact CD2-CE2 4.48Å; Q432-Y436 PolarHBondContact O-N 2.68Å; L433-Y436 PolarHBondContact O-N 2.88Å; Y436-S438 VanDerWaalsContact C-N 3.35Å; Y436-S438 PolarHBondContact O-N 2.85Å; Y436-I439 PolarHBondContact O-N 3.05Å; Y436-M440 HydrophobicContact CD1-CG 4.33Å; Y436-M440 HydrophobicContact CE1-CE 4.35Å; Y436-M440 PolarHBondContact O-N 2.91Å
437	Q	43.2	Very low	44.2	Very low	116 Å²	116	114.6 Å²	114.6	54%	0.542	58%	0.576	S	S	.	*	H	α-helix	trans	-57.2	-47.4	173.7	-151.1	93.4	17.4	0	0	110.8	L433 I439 M440 D441	L433-Q437 PolarHBondContact O-N 2.94Å; Q437-I439 VanDerWaalsContact C-N 3.28Å; Q437-I439 PolarHBondContact O-N 2.98Å; Q437-M440 PolarHBondContact O-N 3.1Å; Q437-D441 PolarHBondContact O-N 3.42Å
438	S	41.2	Very low	42.6	Very low	62 Å²	62	114.3 Å²	114.3	43%	0.434	58%	0.583	S	S	.	*	H	α-helix	trans	-64.5	-29.3	178.2	70.9	0	0	0	0	114	H434 H435 Y436 S442	H434-S438 PolarHBondContact O-N 3.27Å; H435-S438 PolarHBondContact O-N 2.9Å; H435-S438 PolarHBondContact O-OG 3.06Å; Y436-S438 VanDerWaalsContact C-N 3.35Å; Y436-S438 PolarHBondContact O-N 2.85Å; S438-S442 VanDerWaalsContact O-CB 3.31Å; S438-S442 WeakPolarHBondContact O-CB 3.48Å; S438-S442 PolarHBondContact O-N 2.73Å; S438-S442 VanDerWaalsContact O-N 3.12Å; S438-S442 PolarHBondContact O-OG 2.96Å
439	I	48.9	Very low	41.6	Very low	79 Å²	79	116.5 Å²	116.5	41%	0.405	61%	0.605	S	S	.	*	H	α-helix	trans	-76.1	-41	178.4	-69.7	165.6	0	0	0	110.1	H435 Y436 Q437 S442 S443	H435-I439 WeakPolarHBondContact O-CG1 3.42Å; H435-I439 PolarHBondContact O-N 2.93Å; Y436-I439 PolarHBondContact O-N 3.05Å; Q437-I439 VanDerWaalsContact C-N 3.28Å; Q437-I439 PolarHBondContact O-N 2.98Å; I439-S442 PolarHBondContact O-N 2.93Å; I439-S442 PolarHBondContact O-OG 3.1Å; I439-S443 PolarHBondContact O-N 3.34Å; I439-S443 VanDerWaalsContact O-N 3.16Å; I439-S443 PolarHBondContact O-OG 3.14Å
440	M	43.6	Very low	40.8	Very low	111 Å²	111	116.2 Å²	116.2	55%	0.547	62%	0.621	S	S	.	*	H	α-helix	trans	-61.9	-47.5	172.9	-75.2	-67.6	-148.5	0	0	112.1	Y436 Q437 S442 S443 F444	Y436-M440 HydrophobicContact CD1-CG 4.33Å; Y436-M440 HydrophobicContact CE1-CE 4.35Å; Y436-M440 PolarHBondContact O-N 2.91Å; Q437-M440 PolarHBondContact O-N 3.1Å; M440-S442 VanDerWaalsContact C-N 3.3Å; M440-S442 PolarHBondContact O-N 3.42Å; M440-S443 PolarHBondContact O-N 3.14Å; M440-S443 PolarHBondContact O-OG 3.03Å; M440-S443 VanDerWaalsContact O-OG 3.06Å; M440-F444 PolarHBondContact O-N 3.43Å
441	D	45.5	Very low	40.5	Very low	103 Å²	103	118.9 Å²	118.9	55%	0.551	64%	0.639	S	S	*	*	H	α-helix	trans	-63.9	-35.4	179.2	-68.8	-27.8	0	0	0	112	Q437 S443	Q437-D441 PolarHBondContact O-N 3.42Å; D441-S443 PolarHBondContact O-N 2.83Å
442	S	44.7	Very low	40	Very low	78 Å²	78	116.7 Å²	116.7	55%	0.545	64%	0.643	S	S	.	*	H	α-helix	trans	-71.2	-25.2	177	74.1	0	0	0	0	114.5	S438 I439 M440	S438-S442 VanDerWaalsContact O-CB 3.31Å; S438-S442 WeakPolarHBondContact O-CB 3.48Å; S438-S442 PolarHBondContact O-N 2.73Å; S438-S442 VanDerWaalsContact O-N 3.12Å; S438-S442 PolarHBondContact O-OG 2.96Å; I439-S442 PolarHBondContact O-N 2.93Å; I439-S442 PolarHBondContact O-OG 3.1Å; M440-S442 VanDerWaalsContact C-N 3.3Å; M440-S442 PolarHBondContact O-N 3.42Å
443	S	44.3	Very low	39.5	Very low	68 Å²	68	116 Å²	116	48%	0.476	65%	0.652	S	S	.	*	H	α-helix	trans	-92.3	-19.3	-178.3	48.1	0	0	0	0	113.3	I439 M440 D441	I439-S443 PolarHBondContact O-N 3.34Å; I439-S443 VanDerWaalsContact O-N 3.16Å; I439-S443 PolarHBondContact O-OG 3.14Å; M440-S443 PolarHBondContact O-N 3.14Å; M440-S443 PolarHBondContact O-OG 3.03Å; M440-S443 VanDerWaalsContact O-OG 3.06Å; D441-S443 PolarHBondContact O-N 2.83Å
444	F	39.4	Very low	39.3	Very low	175 Å²	175	115.9 Å²	115.9	77%	0.768	66%	0.661	S	S	*	*	H	α-helix	trans	-82.1	-19.7	176.2	-126.8	-92.5	0	0	0	114.4	M440	M440-F444 PolarHBondContact O-N 3.43Å
445	Q	39.2	Very low	39.1	Very low	173 Å²	173	113.6 Å²	113.6	81%	0.808	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-1.4	-177	-76.9	-164.7	-26.5	0	0	116.1
446	Q	36.6	Very low	38.9	Very low	174 Å²	174	112.9 Å²	112.9	81%	0.813	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	-5.2	178.9	-80.2	-171.7	-18.5	0	0	115.7
447	N	34.5	Very low	38.5	Very low	155 Å²	155	111.1 Å²	111.1	83%	0.829	68%	0.677	S	S	*	*	S	Bend	trans	-126.4	54.1	-174.8	-82	-29.9	0	0	0	113.9
448	S	34	Very low	38.1	Very low	106 Å²	106	112 Å²	112	74%	0.741	69%	0.691	S	S	*	*			trans	-159.1	75.2	168.2	43.8	0	0	0	0	114.2
449	S	32.7	Very low	37.9	Very low	128 Å²	128	114 Å²	114	90%	0.895	71%	0.705	S	S	*	*			trans	-115.5	100.3	165	57.3	0	0	0	0	110.3
450	G	33.1	Very low	37.1	Very low	68 Å²	68	118.9 Å²	118.9	70%	0.701	73%	0.728	S	S	*	*			trans	179.4	95.9	-178.6	0	0	0	0	0	116
451	S	33.6	Very low	36.7	Very low	111 Å²	111	121.9 Å²	121.9	78%	0.776	74%	0.744	S	S	*	*			trans	50.6	87.7	149.2	57.5	0	0	0	0	121.7
452	S	31.8	Very low	36	Very low	104 Å²	104	123 Å²	123	73%	0.727	76%	0.755	S	S	*	*				35.8	137.7	116.7	60.6	0	0	0	0	124.2
453	S	35.8	Very low	35.5	Very low	114 Å²	114	128.9 Å²	128.9	80%	0.797	77%	0.774	S	S	*	*			trans	69.5	147.6	153.7	68.1	0	0	0	0	118
454	S	36.5	Very low	34.9	Very low	109 Å²	109	134.1 Å²	134.1	76%	0.762	79%	0.79	S	S	*	*			cis	-173.9	163.3	0.7	31.6	0	0	0	0	109.2
455	S	36.4	Very low	34.6	Very low	97 Å²	97	136.5 Å²	136.5	68%	0.678	80%	0.796	S	S	*	*			cis	-179.3	145.4	-16.1	53.1	0	0	0	0	111.6
456	S	36.7	Very low	34.5	Very low	109 Å²	109	134.2 Å²	134.2	76%	0.762	79%	0.789	S	S	*	*			trans	67.9	157.1	159	81.3	0	0	0	0	118.2
457	S	36.4	Very low	34.8	Very low	93 Å²	93	131.3 Å²	131.3	65%	0.65	78%	0.779	S	S	*	*			cis	-154.5	171.7	14.3	-60	0	0	0	0	114.1
458	T	36.2	Very low	35.5	Very low	136 Å²	136	130.7 Å²	130.7	83%	0.834	78%	0.776	S	S	*	*			trans	80.2	139.1	148.2	39.7	0	0	0	0	120.6
459	S	36.5	Very low	36.2	Very low	104 Å²	104	131 Å²	131	73%	0.727	77%	0.769	S	S	*	*			cis	-163.3	142.1	-3.6	49.8	0	0	0	0	114.2
460	M	30.9	Very low	37	Very low	181 Å²	181	130.7 Å²	130.7	89%	0.892	75%	0.754	S	S	*	*			trans	19.6	133	151.4	-65.7	-178.8	172.5	0	0	122.6
461	I	36	Very low	37.9	Very low	173 Å²	173	134.2 Å²	134.2	89%	0.887	75%	0.75	S	S	*	*				-158.3	144.2	97.1	-92.9	158.7	0	0	0	109.4
462	T	30.5	Very low	38.9	Very low	128 Å²	128	135.8 Å²	135.8	79%	0.785	74%	0.742	S	S	*	*			trans	-105.5	144.4	-171.5	36.2	0	0	0	0	113.6
463	Q	33.7	Very low	40	Very low	200 Å²	200	138.8 Å²	138.8	94%	0.935	74%	0.739	S	S	*	*			trans	-138	135.4	143.4	-85.2	-163.1	-24.6	0	0	110.6
464	H	32.4	Very low	41.3	Very low	179 Å²	179	139.4 Å²	139.4	83%	0.829	73%	0.729	S	S	*	*			trans	-81.5	132.3	-177.4	-122.3	-88.2	0	0	0	110.3
465	Y	32.2	Very low	43	Very low	224 Å²	224	140.4 Å²	140.4	88%	0.878	73%	0.725	S	S	*	*			trans	-144.3	150.2	158.6	-136	-100.1	0	0	0	109.5
466	N	37.2	Very low	44.5	Very low	126 Å²	126	140.5 Å²	140.5	67%	0.674	72%	0.718	S	S	*	*			trans	-76.1	134.3	-158	-65.7	-29.4	0	0	0	114.6	D468	N466-D468 PolarHBondContact O-N 2.9Å
467	D	43.6	Very low	46.1	Very low	113 Å²	113	138.9 Å²	138.9	60%	0.604	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.9	8.2	-168.2	-165.8	18	0	0	0	114.7
468	D	49.9	Very low	47.8	Very low	142 Å²	142	140.5 Å²	140.5	76%	0.759	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	-25.3	-178.9	-82.5	-44	0	0	0	114.3	N466	N466-D468 PolarHBondContact O-N 2.9Å
469	D	49.1	Very low	49.8	Very low	112 Å²	112	139.7 Å²	139.7	60%	0.599	69%	0.685	S	S	*	*	H	α-helix	trans	-79.4	-26.6	178.6	-83.7	-47	0	0	0	112.8	K471 K472 Y473	D469-K471 PolarHBondContact O-N 3.29Å; D469-K472 WeakPolarHBondContact O-CB 3.4Å; D469-K472 PolarHBondContact O-N 2.81Å; D469-K472 VanDerWaalsContact O-N 3.14Å; D469-Y473 PolarHBondContact O-N 3.49Å
470	E	49.5	Very low	51.3	Low	122 Å²	122	142.5 Å²	142.5	57%	0.57	68%	0.68	S	S	*	*	H	α-helix	trans	-65.9	-39.3	-175.4	-169.5	169.6	170.8	0	0	112.4	K472 Y473 Q474	E470-K472 VanDerWaalsContact C-N 3.28Å; E470-K472 PolarHBondContact O-N 3.13Å; E470-Y473 PolarHBondContact O-N 2.97Å; E470-Q474 HydrophobicContact CG-CG 4.47Å; E470-Q474 WeakPolarHBondContact O-CB 3.29Å; E470-Q474 VanDerWaalsContact O-CG 3.26Å; E470-Q474 WeakPolarHBondContact O-CG 3.46Å; E470-Q474 PolarHBondContact O-N 3.15Å
471	K	51.4	Low	53.1	Low	141 Å²	141	138.6 Å²	138.6	61%	0.613	66%	0.663	S	S	*	*	H	α-helix	trans	-63.4	-34.4	174.6	-72.8	171.7	-173.5	145.7	0	112.2	D469 L475	D469-K471 PolarHBondContact O-N 3.29Å; K471-L475 WeakPolarHBondContact O-CB 3.45Å; K471-L475 PolarHBondContact O-N 3.48Å; K471-L475 VanDerWaalsContact O-N 3.13Å
472	K	55.5	Low	54.9	Low	144 Å²	144	135.2 Å²	135.2	63%	0.626	65%	0.646	S	S	*	*	H	α-helix	trans	-74.1	-37.7	178.7	-159.4	175.4	-176.6	-179	0	111.3	D469 E470 L476	D469-K472 WeakPolarHBondContact O-CB 3.4Å; D469-K472 PolarHBondContact O-N 2.81Å; D469-K472 VanDerWaalsContact O-N 3.14Å; E470-K472 VanDerWaalsContact C-N 3.28Å; E470-K472 PolarHBondContact O-N 3.13Å; K472-L476 WeakPolarHBondContact O-CB 3.43Å; K472-L476 WeakPolarHBondContact O-CG 3.47Å; K472-L476 PolarHBondContact O-N 2.78Å
473	Y	54.6	Low	56.8	Low	168 Å²	168	132.5 Å²	132.5	66%	0.659	63%	0.627	S	S	*	*	H	α-helix	trans	-67.4	-44.7	172.8	-114	-88	0	0	0	112.4	D469 E470 L475 L476 V477	D469-Y473 PolarHBondContact O-N 3.49Å; E470-Y473 PolarHBondContact O-N 2.97Å; Y473-L475 VanDerWaalsContact C-N 3.35Å; Y473-L475 PolarHBondContact O-N 2.95Å; Y473-L476 PolarHBondContact O-N 3.5Å; Y473-V477 HydrophobicContact CD1-CG2 4.49Å; Y473-V477 WeakPolarHBondContact O-CB 3.23Å; Y473-V477 VanDerWaalsContact O-CG2 3.31Å; Y473-V477 WeakPolarHBondContact O-CG2 3.37Å; Y473-V477 PolarHBondContact O-N 3.42Å
474	Q	62.9	Low	58.2	Low	126 Å²	126	126 Å²	126	59%	0.589	60%	0.598	S	S	*	*	H	α-helix	trans	-55.6	-47.1	174.1	-75.7	-95.2	-2.7	0	0	111.7	E470 V477 H478	E470-Q474 HydrophobicContact CG-CG 4.47Å; E470-Q474 WeakPolarHBondContact O-CB 3.29Å; E470-Q474 VanDerWaalsContact O-CG 3.26Å; E470-Q474 WeakPolarHBondContact O-CG 3.46Å; E470-Q474 PolarHBondContact O-N 3.15Å; Q474-V477 PolarHBondContact O-N 2.92Å; Q474-H478 WeakPolarHBondContact O-CB 3.29Å; Q474-H478 PolarHBondContact O-N 2.88Å
475	L	71.3	Confident	59.5	Low	130 Å²	130	120.5 Å²	120.5	68%	0.681	58%	0.58	S	S	*	*	H	α-helix	trans	-66.4	-38.4	179.3	-130.4	161.4	0	0	0	112.2	K471 Y473 F479	K471-L475 WeakPolarHBondContact O-CB 3.45Å; K471-L475 PolarHBondContact O-N 3.48Å; K471-L475 VanDerWaalsContact O-N 3.13Å; Y473-L475 VanDerWaalsContact C-N 3.35Å; Y473-L475 PolarHBondContact O-N 2.95Å; L475-F479 VanDerWaalsContact O-CB 3.27Å; L475-F479 WeakPolarHBondContact O-CB 3.39Å; L475-F479 PolarHBondContact O-N 2.7Å
476	L	68.6	Low	60.7	Low	100 Å²	100	113.6 Å²	113.6	52%	0.524	56%	0.561	S	S	.	*	H	α-helix	trans	-67.6	-41.5	174.3	-77.4	170.1	0	0	0	112.6	K472 Y473 F479 W480	K472-L476 WeakPolarHBondContact O-CB 3.43Å; K472-L476 WeakPolarHBondContact O-CG 3.47Å; K472-L476 PolarHBondContact O-N 2.78Å; Y473-L476 PolarHBondContact O-N 3.5Å; L476-F479 PolarHBondContact O-N 3.08Å; L476-W480 WeakPolarHBondContact O-CB 3.42Å; L476-W480 PolarHBondContact O-N 2.92Å
477	V	70.7	Confident	61.6	Low	75 Å²	75	111.5 Å²	111.5	46%	0.455	55%	0.55	S	S	.	.	H	α-helix	trans	-65.1	-43.2	175.7	170.7	0	0	0	0	110.7	Y473 Q474 F479 W480 N481	Y473-V477 HydrophobicContact CD1-CG2 4.49Å; Y473-V477 WeakPolarHBondContact O-CB 3.23Å; Y473-V477 VanDerWaalsContact O-CG2 3.31Å; Y473-V477 WeakPolarHBondContact O-CG2 3.37Å; Y473-V477 PolarHBondContact O-N 3.42Å; Q474-V477 PolarHBondContact O-N 2.92Å; V477-F479 PolarHBondContact O-N 2.89Å; V477-W480 PolarHBondContact O-N 3.09Å; V477-N481 WeakPolarHBondContact O-CB 3.48Å; V477-N481 VanDerWaalsContact O-CG 3.25Å; V477-N481 PolarHBondContact O-N 3.23Å; V477-N481 PolarHBondContact O-ND2 3.5Å
478	H	71.4	Confident	62	Low	127 Å²	127	110.1 Å²	110.1	59%	0.588	54%	0.542	S	S	*	.	H	α-helix	trans	-64.5	-40.1	175.8	-164.6	-69	0	0	0	111.8	Q474 L482	Q474-H478 WeakPolarHBondContact O-CB 3.29Å; Q474-H478 PolarHBondContact O-N 2.88Å; H478-L482 PolarHBondContact O-N 3.43Å
479	F	77.6	Confident	62	Low	119 Å²	119	109 Å²	109	52%	0.522	53%	0.532	S	S	.	.	H	α-helix	trans	-64.5	-44.7	173.3	-179.9	-100	0	0	0	112	L475 L476 V477 N481 L482 L483	L475-F479 VanDerWaalsContact O-CB 3.27Å; L475-F479 WeakPolarHBondContact O-CB 3.39Å; L475-F479 PolarHBondContact O-N 2.7Å; L476-F479 PolarHBondContact O-N 3.08Å; V477-F479 PolarHBondContact O-N 2.89Å; F479-N481 PolarHBondContact O-N 3.16Å; F479-L482 PolarHBondContact O-N 3.39Å; F479-L483 HydrophobicContact CE1-CD1 4.15Å; F479-L483 HydrophobicContact CE2-CD1 4.5Å; F479-L483 HydrophobicContact CZ-CD1 3.87Å; F479-L483 WeakPolarHBondContact O-CB 3.39Å; F479-L483 PolarHBondContact O-N 2.93Å
480	W	68.3	Low	62.1	Low	162 Å²	162	106.3 Å²	106.3	61%	0.614	52%	0.522	S	S	*	.	H	α-helix	trans	-64	-40.3	178	-135.6	101.3	0	0	0	111.5	L476 V477 L483 N484	L476-W480 WeakPolarHBondContact O-CB 3.42Å; L476-W480 PolarHBondContact O-N 2.92Å; V477-W480 PolarHBondContact O-N 3.09Å; W480-L483 PolarHBondContact O-N 3.24Å; W480-N484 HydrophobicContact CE3-CB 3.81Å; W480-N484 HydrophobicContact CZ3-CB 3.78Å; W480-N484 WeakPolarHBondContact O-CB 3.42Å; W480-N484 PolarHBondContact O-N 2.86Å
481	N	69.9	Low	62.2	Low	100 Å²	100	104.1 Å²	104.1	54%	0.535	51%	0.514	S	S	.	.	H	α-helix	trans	-65	-40.3	174.8	-72.9	-18.8	0	0	0	112	V477 F479 S485	V477-N481 WeakPolarHBondContact O-CB 3.48Å; V477-N481 VanDerWaalsContact O-CG 3.25Å; V477-N481 PolarHBondContact O-N 3.23Å; V477-N481 PolarHBondContact O-ND2 3.5Å; F479-N481 PolarHBondContact O-N 3.16Å; N481-S485 WeakPolarHBondContact O-CB 3.24Å; N481-S485 PolarHBondContact O-N 3.31Å
482	L	73.6	Confident	62.1	Low	102 Å²	102	101.8 Å²	101.8	53%	0.534	51%	0.505	S	S	.	.	H	α-helix	trans	-64.8	-41.9	173.2	-123.5	93	0	0	0	112.1	H478 F479 S485 T486	H478-L482 PolarHBondContact O-N 3.43Å; F479-L482 PolarHBondContact O-N 3.39Å; L482-S485 PolarHBondContact O-N 3.22Å; L482-T486 PolarHBondContact O-N 2.87Å; L482-T486 PolarHBondContact O-OG1 3.27Å
483	L	68.9	Low	61.8	Low	71 Å²	71	99.1 Å²	99.1	37%	0.372	50%	0.501	S	S	.	.	H	α-helix	trans	-69	-39	-179.6	-155.7	96.3	0	0	0	111.3	F479 W480 T486 L487	F479-L483 HydrophobicContact CE1-CD1 4.15Å; F479-L483 HydrophobicContact CE2-CD1 4.5Å; F479-L483 HydrophobicContact CZ-CD1 3.87Å; F479-L483 WeakPolarHBondContact O-CB 3.39Å; F479-L483 PolarHBondContact O-N 2.93Å; W480-L483 PolarHBondContact O-N 3.24Å; L483-T486 WeakPolarHBondContact CA-OG1 3.49Å; L483-T486 PolarHBondContact O-N 3.29Å; L483-T486 PolarHBondContact O-OG1 3.36Å; L483-T486 VanDerWaalsContact O-OG1 3.13Å; L483-L487 HydrophobicContact CD2-CD1 3.94Å; L483-L487 HydrophobicContact CG-CD1 4.2Å; L483-L487 VanDerWaalsContact O-CB 3.24Å; L483-L487 WeakPolarHBondContact O-CB 3.5Å; L483-L487 WeakPolarHBondContact O-CG 3.2Å; L483-L487 PolarHBondContact O-N 2.78Å
484	N	64	Low	61.5	Low	62 Å²	62	98.7 Å²	98.7	33%	0.332	50%	0.502	S	S	.	.	H	α-helix	trans	-73.1	-35.1	177.4	-158.7	31.9	0	0	0	111.6	W480 N488	W480-N484 HydrophobicContact CE3-CB 3.81Å; W480-N484 HydrophobicContact CZ3-CB 3.78Å; W480-N484 WeakPolarHBondContact O-CB 3.42Å; W480-N484 PolarHBondContact O-N 2.86Å; N484-N488 VanDerWaalsContact O-CB 3.28Å; N484-N488 WeakPolarHBondContact O-CB 3.46Å; N484-N488 PolarHBondContact O-N 3.42Å
485	S	60.1	Low	61	Low	65 Å²	65	100.4 Å²	100.4	46%	0.455	51%	0.505	S	S	.	.	H	α-helix	trans	-59.4	-50.4	169.3	168.6	0	0	0	0	111.5	N481 L482 Q489	N481-S485 WeakPolarHBondContact O-CB 3.24Å; N481-S485 PolarHBondContact O-N 3.31Å; L482-S485 PolarHBondContact O-N 3.22Å; S485-Q489 WeakPolarHBondContact O-CB 3.3Å; S485-Q489 PolarHBondContact O-N 3.35Å
486	T	57.2	Low	60.2	Low	79 Å²	79	97.1 Å²	97.1	49%	0.485	49%	0.487	S	S	.	.	H	α-helix	trans	-70.6	-35.3	179	43.4	0	0	0	0	113.2	L482 L483 S490	L482-T486 PolarHBondContact O-N 2.87Å; L482-T486 PolarHBondContact O-OG1 3.27Å; L483-T486 WeakPolarHBondContact CA-OG1 3.49Å; L483-T486 PolarHBondContact O-N 3.29Å; L483-T486 PolarHBondContact O-OG1 3.36Å; L483-T486 VanDerWaalsContact O-OG1 3.13Å; T486-S490 WeakPolarHBondContact O-CB 3.25Å; T486-S490 PolarHBondContact O-N 3.03Å
487	L	54.9	Low	59.7	Low	82 Å²	82	99.3 Å²	99.3	43%	0.429	49%	0.493	S	S	.	.	H	α-helix	trans	-66.4	-48	172.6	-85.6	161.5	0	0	0	111.8	L483 Q489 S490 I491	L483-L487 HydrophobicContact CD2-CD1 3.94Å; L483-L487 HydrophobicContact CG-CD1 4.2Å; L483-L487 VanDerWaalsContact O-CB 3.24Å; L483-L487 WeakPolarHBondContact O-CB 3.5Å; L483-L487 WeakPolarHBondContact O-CG 3.2Å; L483-L487 PolarHBondContact O-N 2.78Å; L487-Q489 PolarHBondContact O-N 2.86Å; L487-S490 CarbonylContact O-C 3.6Å; L487-S490 WeakPolarHBondContact O-CA 3.37Å; L487-S490 WeakPolarHBondContact O-CB 3.45Å; L487-S490 PolarHBondContact O-N 3.16Å; L487-S490 VanDerWaalsContact O-N 3.08Å; L487-S490 PolarHBondContact O-OG 2.94Å; L487-I491 VanDerWaalsContact O-CG1 3.25Å; L487-I491 WeakPolarHBondContact O-CG1 3.22Å; L487-I491 PolarHBondContact O-N 3.19Å
488	N	53.4	Low	59.5	Low	84 Å²	84	99 Å²	99	45%	0.449	49%	0.494	S	S	.	.	H	α-helix	trans	-62.6	-42.4	176.8	-78.7	-11.8	0	0	0	111.8	N484 S490 I491 E492	N484-N488 VanDerWaalsContact O-CB 3.28Å; N484-N488 WeakPolarHBondContact O-CB 3.46Å; N484-N488 PolarHBondContact O-N 3.42Å; N488-S490 VanDerWaalsContact C-N 3.31Å; N488-S490 PolarHBondContact O-N 3.44Å; N488-I491 PolarHBondContact O-N 3.05Å; N488-I491 VanDerWaalsContact O-N 3.15Å; N488-E492 PolarHBondContact O-N 3.23Å
489	Q	49	Very low	59.4	Low	118 Å²	118	95.3 Å²	95.3	55%	0.551	48%	0.475	S	S	*	.	H	α-helix	trans	-59.3	-41	171	-85.2	-173.4	-22	0	0	112	S485 L487 I491 T493	S485-Q489 WeakPolarHBondContact O-CB 3.3Å; S485-Q489 PolarHBondContact O-N 3.35Å; L487-Q489 PolarHBondContact O-N 2.86Å; Q489-I491 VanDerWaalsContact C-N 3.3Å; Q489-I491 PolarHBondContact O-N 2.82Å; Q489-T493 VanDerWaalsContact O-CB 3.29Å; Q489-T493 WeakPolarHBondContact O-CB 3.42Å; Q489-T493 WeakPolarHBondContact O-CG2 3.37Å; Q489-T493 PolarHBondContact O-N 3.36Å; Q489-T493 PolarHBondContact O-OG1 3.1Å
490	S	51.2	Low	59.2	Low	56 Å²	56	96 Å²	96	39%	0.392	47%	0.474	S	S	.	.	H	α-helix	trans	-66.1	-30.7	176.4	81.7	0	0	0	0	113.4	T486 L487 N488 T493 K494	T486-S490 WeakPolarHBondContact O-CB 3.25Å; T486-S490 PolarHBondContact O-N 3.03Å; L487-S490 CarbonylContact O-C 3.6Å; L487-S490 WeakPolarHBondContact O-CA 3.37Å; L487-S490 WeakPolarHBondContact O-CB 3.45Å; L487-S490 PolarHBondContact O-N 3.16Å; L487-S490 VanDerWaalsContact O-N 3.08Å; L487-S490 PolarHBondContact O-OG 2.94Å; N488-S490 VanDerWaalsContact C-N 3.31Å; N488-S490 PolarHBondContact O-N 3.44Å; S490-T493 PolarHBondContact O-OG1 3.42Å; S490-K494 WeakPolarHBondContact O-CB 3.06Å; S490-K494 PolarHBondContact O-N 3.03Å
491	I	51.1	Low	59.7	Low	75 Å²	75	92.7 Å²	92.7	39%	0.385	47%	0.468	S	S	.	.	H	α-helix	trans	-78.7	-50.8	-179.3	-69.3	165.1	0	0	0	110	L487 N488 Q489 T493 K494 Y495	L487-I491 VanDerWaalsContact O-CG1 3.25Å; L487-I491 WeakPolarHBondContact O-CG1 3.22Å; L487-I491 PolarHBondContact O-N 3.19Å; N488-I491 PolarHBondContact O-N 3.05Å; N488-I491 VanDerWaalsContact O-N 3.15Å; Q489-I491 VanDerWaalsContact C-N 3.3Å; Q489-I491 PolarHBondContact O-N 2.82Å; I491-T493 PolarHBondContact O-N 3.36Å; I491-K494 PolarHBondContact O-N 3.08Å; I491-Y495 HydrophobicContact CG2-CD2 3.86Å; I491-Y495 HydrophobicContact CG2-CE2 3.6Å; I491-Y495 WeakPolarHBondContact O-CD2 3.36Å; I491-Y495 PolarHBondContact O-N 3.1Å; I491-Y495 VanDerWaalsContact O-N 3.09Å
492	E	49.6	Very low	60.4	Low	93 Å²	93	91.7 Å²	91.7	44%	0.435	46%	0.462	S	S	.	.	H	α-helix	trans	-61.4	-45.5	176.8	-72	-166.7	173.7	0	0	111.9	N488 K494 Y495 I496	N488-E492 PolarHBondContact O-N 3.23Å; E492-K494 VanDerWaalsContact C-N 3.27Å; E492-K494 PolarHBondContact O-N 3.37Å; E492-Y495 PolarHBondContact O-N 3.32Å; E492-I496 WeakPolarHBondContact O-CB 3.45Å; E492-I496 VanDerWaalsContact O-CG1 3.31Å; E492-I496 WeakPolarHBondContact O-CG1 3.48Å; E492-I496 PolarHBondContact O-N 2.97Å
493	T	49.3	Very low	60.9	Low	87 Å²	87	87.5 Å²	87.5	53%	0.534	44%	0.441	S	S	.	.	H	α-helix	trans	-62.1	-34.7	177.2	53.6	0	0	0	0	112.4	Q489 S490 I491 F497	Q489-T493 VanDerWaalsContact O-CB 3.29Å; Q489-T493 WeakPolarHBondContact O-CB 3.42Å; Q489-T493 WeakPolarHBondContact O-CG2 3.37Å; Q489-T493 PolarHBondContact O-N 3.36Å; Q489-T493 PolarHBondContact O-OG1 3.1Å; S490-T493 PolarHBondContact O-OG1 3.42Å; I491-T493 PolarHBondContact O-N 3.36Å; T493-F497 WeakPolarHBondContact O-CB 3.37Å; T493-F497 PolarHBondContact O-N 3Å
494	K	48.5	Very low	61.8	Low	160 Å²	160	87.2 Å²	87.2	70%	0.696	44%	0.439	S	S	*	.	H	α-helix	trans	-68	-40	176.5	-171.9	174.7	-176.1	179.8	0	112.4	S490 I491 E492 S498	S490-K494 WeakPolarHBondContact O-CB 3.06Å; S490-K494 PolarHBondContact O-N 3.03Å; I491-K494 PolarHBondContact O-N 3.08Å; E492-K494 VanDerWaalsContact C-N 3.27Å; E492-K494 PolarHBondContact O-N 3.37Å; K494-S498 WeakPolarHBondContact O-CB 3.43Å; K494-S498 PolarHBondContact O-N 3.34Å
495	Y	51.7	Low	63.1	Low	161 Å²	161	89.2 Å²	89.2	63%	0.631	45%	0.449	S	S	*	.	H	α-helix	trans	-69.9	-44.7	175.5	-75.2	-64.4	0	0	0	112.4	I491 E492 F497 S498 R499	I491-Y495 HydrophobicContact CG2-CD2 3.86Å; I491-Y495 HydrophobicContact CG2-CE2 3.6Å; I491-Y495 WeakPolarHBondContact O-CD2 3.36Å; I491-Y495 PolarHBondContact O-N 3.1Å; I491-Y495 VanDerWaalsContact O-N 3.09Å; E492-Y495 PolarHBondContact O-N 3.32Å; Y495-F497 VanDerWaalsContact C-N 3.34Å; Y495-F497 PolarHBondContact O-N 3.05Å; Y495-S498 PolarHBondContact O-N 3.48Å; Y495-S498 VanDerWaalsContact O-N 3.16Å; Y495-R499 PolarHBondContact O-N 3.48Å
496	I	55.6	Low	64.6	Low	62 Å²	62	87 Å²	87	32%	0.318	43%	0.432	S	S	.	.	H	α-helix	trans	-61.7	-42.7	177.2	-66.7	166.3	0	0	0	111	E492 R500	E492-I496 WeakPolarHBondContact O-CB 3.45Å; E492-I496 VanDerWaalsContact O-CG1 3.31Å; E492-I496 WeakPolarHBondContact O-CG1 3.48Å; E492-I496 PolarHBondContact O-N 2.97Å; I496-R500 PolarHBondContact O-N 3.48Å; I496-R500 VanDerWaalsContact O-N 3.11Å
497	F	58.4	Low	66.2	Low	145 Å²	145	83.6 Å²	83.6	64%	0.636	41%	0.411	S	S	*	.	H	α-helix	trans	-64.2	-41.1	174.7	-171.2	-98.8	0	0	0	111.7	T493 Y495 R500 L501	T493-F497 WeakPolarHBondContact O-CB 3.37Å; T493-F497 PolarHBondContact O-N 3Å; Y495-F497 VanDerWaalsContact C-N 3.34Å; Y495-F497 PolarHBondContact O-N 3.05Å; F497-R500 PolarHBondContact O-N 3.08Å; F497-L501 HydrophobicContact CE1-CD2 4.27Å; F497-L501 VanDerWaalsContact O-CB 3.22Å; F497-L501 WeakPolarHBondContact O-CB 3.46Å; F497-L501 PolarHBondContact O-N 3.41Å
498	S	66.8	Low	68	Low	70 Å²	70	81.6 Å²	81.6	49%	0.49	40%	0.404	S	S	.	.	H	α-helix	trans	-63.9	-40.8	178.5	-167.3	0	0	0	0	113	K494 Y495 L502	K494-S498 WeakPolarHBondContact O-CB 3.43Å; K494-S498 PolarHBondContact O-N 3.34Å; Y495-S498 PolarHBondContact O-N 3.48Å; Y495-S498 VanDerWaalsContact O-N 3.16Å; S498-L502 VanDerWaalsContact O-CB 3.27Å; S498-L502 WeakPolarHBondContact O-CB 3.43Å; S498-L502 PolarHBondContact O-N 2.8Å
499	R	67.9	Low	70	Confident	49 Å²	49	79.9 Å²	79.9	19%	0.185	40%	0.398	C	S	.	.	H	α-helix	trans	-66.4	-51.4	174.7	173.4	175.3	159.2	-148.7	-13.3	110.9	E223 T390 S392 Y495 L501 L502 V503	E223-R499 IonicContact OE1-NE 3.14Å; T390-R499 VanDerWaalsContact OG1-CD 3.3Å; T390-R499 WeakPolarHBondContact OG1-CD 3.34Å; T390-R499 PolarHBondContact OG1-NH1 3.48Å; S392-R499 PolarHBondContact OG-NH1 2.85Å; Y495-R499 PolarHBondContact O-N 3.48Å; R499-L501 VanDerWaalsContact C-N 3.25Å; R499-L501 PolarHBondContact O-N 3.31Å; R499-L502 WeakPolarHBondContact O-CA 3.49Å; R499-L502 WeakPolarHBondContact O-CB 3.38Å; R499-L502 PolarHBondContact O-N 2.87Å; R499-V503 HydrophobicContact CG-CG2 4.18Å; R499-V503 WeakPolarHBondContact O-CG2 3.22Å; R499-V503 PolarHBondContact O-N 3.49Å
500	R	73.4	Confident	72.2	Confident	134 Å²	134	74.3 Å²	74.3	51%	0.506	37%	0.372	S	S	.	.	H	α-helix	trans	-56.5	-42.2	179.6	-74	-175	175.5	-159.2	-2.1	111.7	I496 F497 V503 I504	I496-R500 PolarHBondContact O-N 3.48Å; I496-R500 VanDerWaalsContact O-N 3.11Å; F497-R500 PolarHBondContact O-N 3.08Å; R500-V503 PolarHBondContact O-N 3.33Å; R500-I504 WeakPolarHBondContact O-CB 3.4Å; R500-I504 WeakPolarHBondContact O-CD1 3.33Å; R500-I504 WeakPolarHBondContact O-CG1 3.5Å; R500-I504 PolarHBondContact O-N 3.25Å
501	L	79.9	Confident	74.3	Confident	91 Å²	91	73.2 Å²	73.2	48%	0.476	36%	0.361	S	S	.	.	H	α-helix	trans	-63.6	-40.5	174.9	-175.2	63.7	0	0	0	112.5	F497 R499 L505	F497-L501 HydrophobicContact CE1-CD2 4.27Å; F497-L501 VanDerWaalsContact O-CB 3.22Å; F497-L501 WeakPolarHBondContact O-CB 3.46Å; F497-L501 PolarHBondContact O-N 3.41Å; R499-L501 VanDerWaalsContact C-N 3.25Å; R499-L501 PolarHBondContact O-N 3.31Å; L501-L505 WeakPolarHBondContact O-CB 3.34Å; L501-L505 PolarHBondContact O-N 3.4Å
502	L	83.8	Confident	76.5	Confident	79 Å²	79	74.1 Å²	74.1	41%	0.414	37%	0.366	S	S	.	.	H	α-helix	trans	-65.1	-44	176.9	177.7	147.6	0	0	0	112.2	S498 R499 L505 I506	S498-L502 VanDerWaalsContact O-CB 3.27Å; S498-L502 WeakPolarHBondContact O-CB 3.43Å; S498-L502 PolarHBondContact O-N 2.8Å; R499-L502 WeakPolarHBondContact O-CA 3.49Å; R499-L502 WeakPolarHBondContact O-CB 3.38Å; R499-L502 PolarHBondContact O-N 2.87Å; L502-L505 PolarHBondContact O-N 3.37Å; L502-I506 HydrophobicContact CD2-CD1 3.52Å; L502-I506 HydrophobicContact CG-CD1 4.05Å; L502-I506 WeakPolarHBondContact O-CG1 3.49Å; L502-I506 PolarHBondContact O-N 3.27Å
503	V	84.4	Confident	78.6	Confident	15 Å²	15	70.6 Å²	70.6	9%	0.091	35%	0.35	C	S	.	.	H	α-helix	trans	-63.3	-50.9	176	179.6	0	0	0	0	110.5	E223 R499 R500 L505 I506 D507 L580	E223-V503 VanDerWaalsContact OE1-CG2 3.23Å; E223-V503 WeakPolarHBondContact OE1-CG2 3.46Å; E223-V503 WeakPolarHBondContact OE2-CG2 3.4Å; R499-V503 HydrophobicContact CG-CG2 4.18Å; R499-V503 WeakPolarHBondContact O-CG2 3.22Å; R499-V503 PolarHBondContact O-N 3.49Å; R500-V503 PolarHBondContact O-N 3.33Å; V503-L505 PolarHBondContact O-N 3.23Å; V503-I506 PolarHBondContact O-N 3.35Å; V503-I506 VanDerWaalsContact O-N 3.15Å; V503-D507 WeakPolarHBondContact O-CB 3.14Å; V503-D507 PolarHBondContact O-N 3.09Å; V503-L580 HydrophobicContact CB-CD1 4.29Å; V503-L580 HydrophobicContact CG1-CD1 3.73Å
504	I	87.5	Confident	80.8	Confident	65 Å²	65	66.5 Å²	66.5	33%	0.333	33%	0.325	S	S	.	.	H	α-helix	trans	-55.1	-40.8	175.6	-68.9	164.2	0	0	0	111.1	R500 S508 L577 L580	R500-I504 WeakPolarHBondContact O-CB 3.4Å; R500-I504 WeakPolarHBondContact O-CD1 3.33Å; R500-I504 WeakPolarHBondContact O-CG1 3.5Å; R500-I504 PolarHBondContact O-N 3.25Å; I504-S508 WeakPolarHBondContact O-CB 3.48Å; I504-S508 PolarHBondContact O-N 2.94Å; I504-S508 PolarHBondContact O-OG 3.33Å; I504-L577 HydrophobicContact CG2-CD2 4.35Å; I504-L580 HydrophobicContact CD1-CD2 3.66Å; I504-L580 HydrophobicContact CG1-CD1 4.38Å; I504-L580 HydrophobicContact CG1-CD2 3.64Å
505	L	91.2	Very high	83.1	Confident	104 Å²	104	62.4 Å²	62.4	55%	0.545	31%	0.31	S	S	.	.	H	α-helix	trans	-67.6	-45.4	179	-176.9	149.8	0	0	0	111.7	L501 L502 V503 S508 C509	L501-L505 WeakPolarHBondContact O-CB 3.34Å; L501-L505 PolarHBondContact O-N 3.4Å; L502-L505 PolarHBondContact O-N 3.37Å; V503-L505 PolarHBondContact O-N 3.23Å; L505-S508 PolarHBondContact O-N 2.64Å; L505-C509 WeakPolarHBondContact O-CB 3.17Å; L505-C509 PolarHBondContact O-N 3.44Å; L505-C509 PolarHBondContact O-SG 3.02Å
506	I	91.8	Very high	85.2	Confident	18 Å²	18	58 Å²	58	9%	0.092	30%	0.297	C	S	.	.	H	α-helix	trans	-63	-51.1	177.4	-69.9	168.7	0	0	0	110.3	I219 Q220 L502 V503 S508 C509 T510	I219-I506 HydrophobicContact CG2-CD1 4.03Å; Q220-I506 HydrophobicContact CB-CG2 3.79Å; Q220-I506 HydrophobicContact CG-CG2 4.15Å; L502-I506 HydrophobicContact CD2-CD1 3.52Å; L502-I506 HydrophobicContact CG-CD1 4.05Å; L502-I506 WeakPolarHBondContact O-CG1 3.49Å; L502-I506 PolarHBondContact O-N 3.27Å; V503-I506 PolarHBondContact O-N 3.35Å; V503-I506 VanDerWaalsContact O-N 3.15Å; I506-S508 VanDerWaalsContact C-N 3.32Å; I506-S508 PolarHBondContact O-N 3.01Å; I506-C509 PolarHBondContact O-N 3.11Å; I506-C509 VanDerWaalsContact O-N 3.12Å; I506-T510 PolarHBondContact O-N 3.22Å; I506-T510 PolarHBondContact O-OG1 3Å
507	D	91.9	Very high	87.1	Confident	8 Å²	8	55.1 Å²	55.1	4%	0.043	28%	0.282	C	S	.	.	H	α-helix	trans	-60.3	-38.9	178.5	-73.3	-14.8	0	0	0	112.4	Q220 V503 T510 L511 L577	Q220-D507 WeakPolarHBondContact CG-OD1 3.3Å; Q220-D507 PolarHBondContact NE2-OD1 3.01Å; V503-D507 WeakPolarHBondContact O-CB 3.14Å; V503-D507 PolarHBondContact O-N 3.09Å; D507-T510 WeakPolarHBondContact CA-OG1 3.18Å; D507-T510 PolarHBondContact O-OG1 3.31Å; D507-T510 VanDerWaalsContact O-OG1 3.08Å; D507-L511 VanDerWaalsContact O-CB 3.25Å; D507-L511 WeakPolarHBondContact O-CB 3.33Å; D507-L511 PolarHBondContact O-N 2.92Å; D507-L577 HydrophobicContact CB-CD1 4.43Å; D507-L577 HydrophobicContact CB-CD2 3.71Å; D507-L577 HydrophobicContact CB-CG 3.86Å
508	S	92.7	Very high	88.8	Confident	40 Å²	40	48.8 Å²	48.8	28%	0.28	26%	0.255	S	S	.	.	H	α-helix	trans	-67.9	-40.4	175.1	-62.3	0	0	0	0	111.4	I504 L505 I506 I512	I504-S508 WeakPolarHBondContact O-CB 3.48Å; I504-S508 PolarHBondContact O-N 2.94Å; I504-S508 PolarHBondContact O-OG 3.33Å; L505-S508 PolarHBondContact O-N 2.64Å; I506-S508 VanDerWaalsContact C-N 3.32Å; I506-S508 PolarHBondContact O-N 3.01Å; S508-I512 WeakPolarHBondContact O-CB 3.21Å; S508-I512 WeakPolarHBondContact O-CD1 3.49Å; S508-I512 WeakPolarHBondContact O-CG1 3.29Å; S508-I512 PolarHBondContact O-N 2.99Å
509	C	94.7	Very high	90.2	Very high	48 Å²	48	50.8 Å²	50.8	32%	0.324	26%	0.26	S	S	.	.	H	α-helix	trans	-66.6	-41.2	176.4	-77	0	0	0	0	112.4	L216 L505 I506 L513	L216-C509 HydrophobicContact CD1-CB 4.41Å; L505-C509 WeakPolarHBondContact O-CB 3.17Å; L505-C509 PolarHBondContact O-N 3.44Å; L505-C509 PolarHBondContact O-SG 3.02Å; I506-C509 PolarHBondContact O-N 3.11Å; I506-C509 VanDerWaalsContact O-N 3.12Å; C509-L513 WeakPolarHBondContact O-CB 3.31Å; C509-L513 WeakPolarHBondContact O-CG 3.25Å; C509-L513 PolarHBondContact O-N 3.16Å
510	T	94.9	Very high	91.5	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.006	27%	0.265	C	S	.	.	H	α-helix	trans	-68.4	-39.6	176.3	53.7	0	0	0	0	111.7	L216 V217 Q220 I506 D507 L513 G514 S573	L216-T510 HydrophobicContact CB-CG2 3.76Å; V217-T510 HydrophobicContact CG2-CG2 4.13Å; Q220-T510 HydrophobicContact CB-CG2 4.3Å; Q220-T510 PolarHBondContact NE2-OG1 3Å; Q220-T510 PolarHBondContact OE1-OG1 3.12Å; Q220-T510 VanDerWaalsContact OE1-OG1 3.1Å; I506-T510 PolarHBondContact O-N 3.22Å; I506-T510 PolarHBondContact O-OG1 3Å; D507-T510 WeakPolarHBondContact CA-OG1 3.18Å; D507-T510 PolarHBondContact O-OG1 3.31Å; D507-T510 VanDerWaalsContact O-OG1 3.08Å; T510-L513 PolarHBondContact O-N 3.47Å; T510-G514 PolarHBondContact O-N 3.39Å; T510-S573 PolarHBondContact OG1-OG 3.46Å
511	L	95.8	Very high	92.5	Very high	32 Å²	32	44.7 Å²	44.7	17%	0.168	24%	0.241	C	C	.	.	H	α-helix	trans	-57.7	-51.8	171.7	178.6	57.3	0	0	0	112	D507 L513 G514 I515 I570 I574 L577	D507-L511 VanDerWaalsContact O-CB 3.25Å; D507-L511 WeakPolarHBondContact O-CB 3.33Å; D507-L511 PolarHBondContact O-N 2.92Å; L511-L513 PolarHBondContact O-N 3.42Å; L511-G514 PolarHBondContact O-N 3.21Å; L511-I515 HydrophobicContact CD1-CD1 3.99Å; L511-I515 HydrophobicContact CD1-CG1 4.42Å; L511-I515 HydrophobicContact CG-CD1 4.14Å; L511-I515 WeakPolarHBondContact O-CG1 3.49Å; L511-I515 PolarHBondContact O-N 3.48Å; L511-I570 HydrophobicContact CD1-CB 4.32Å; L511-I570 HydrophobicContact CD1-CG1 4.33Å; L511-I570 HydrophobicContact CD1-CG2 3.92Å; L511-I574 HydrophobicContact CD1-CD1 4.36Å; L511-I574 HydrophobicContact CD1-CG1 3.98Å; L511-I574 HydrophobicContact CD2-CG1 4.3Å; L511-L577 HydrophobicContact CD2-CD1 4.14Å
512	I	96	Very high	93.2	Very high	94 Å²	94	43.7 Å²	43.7	48%	0.482	24%	0.235	S	C	.	.	H	α-helix	trans	-61	-44.1	-179.9	-70.7	165	0	0	0	110.8	S508 I515 I516	S508-I512 WeakPolarHBondContact O-CB 3.21Å; S508-I512 WeakPolarHBondContact O-CD1 3.49Å; S508-I512 WeakPolarHBondContact O-CG1 3.29Å; S508-I512 PolarHBondContact O-N 2.99Å; I512-I515 PolarHBondContact O-N 2.95Å; I512-I516 HydrophobicContact CG2-CD1 3.72Å; I512-I516 HydrophobicContact CG2-CG1 4.48Å; I512-I516 VanDerWaalsContact O-CG1 3.29Å; I512-I516 WeakPolarHBondContact O-CG1 3.38Å; I512-I516 PolarHBondContact O-N 2.76Å
513	L	94.9	Very high	93.7	Very high	20 Å²	20	48.6 Å²	48.6	11%	0.105	25%	0.248	C	C	.	.	H	α-helix	trans	-69	-35.1	178.1	-73.3	169.5	0	0	0	113	V209 L212 L216 C509 T510 L511 I516 S517	V209-L513 HydrophobicContact CG1-CD2 4.3Å; L212-L513 HydrophobicContact CD2-CD1 3.99Å; L212-L513 HydrophobicContact CD2-CD2 4.04Å; L212-L513 HydrophobicContact CG-CD1 3.82Å; L216-L513 HydrophobicContact CD1-CD1 3.35Å; C509-L513 WeakPolarHBondContact O-CB 3.31Å; C509-L513 WeakPolarHBondContact O-CG 3.25Å; C509-L513 PolarHBondContact O-N 3.16Å; T510-L513 PolarHBondContact O-N 3.47Å; L511-L513 PolarHBondContact O-N 3.42Å; L513-I516 PolarHBondContact O-N 3.21Å; L513-S517 WeakPolarHBondContact O-CB 3.23Å; L513-S517 PolarHBondContact O-N 2.98Å
514	G	94.8	Very high	94.1	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.8	-46.1	171.6	0	0	0	0	0	111.6	T510 L511 S517 C518	T510-G514 PolarHBondContact O-N 3.39Å; L511-G514 PolarHBondContact O-N 3.21Å; G514-S517 PolarHBondContact O-N 3.41Å; G514-C518 VanDerWaalsContact O-CB 3.27Å; G514-C518 WeakPolarHBondContact O-CB 3.33Å; G514-C518 PolarHBondContact O-N 2.98Å
515	I	96.3	Very high	94.3	Very high	74 Å²	74	48.1 Å²	48.1	38%	0.379	25%	0.248	S	C	.	.	H	α-helix	trans	-63.3	-49.2	176.4	-65.5	165.7	0	0	0	111.1	L511 I512 S517 C518 L519 I570	L511-I515 HydrophobicContact CD1-CD1 3.99Å; L511-I515 HydrophobicContact CD1-CG1 4.42Å; L511-I515 HydrophobicContact CG-CD1 4.14Å; L511-I515 WeakPolarHBondContact O-CG1 3.49Å; L511-I515 PolarHBondContact O-N 3.48Å; I512-I515 PolarHBondContact O-N 2.95Å; I515-S517 VanDerWaalsContact C-N 3.34Å; I515-S517 PolarHBondContact O-N 3.26Å; I515-C518 PolarHBondContact O-N 3.28Å; I515-L519 HydrophobicContact CG2-CD1 3.98Å; I515-L519 HydrophobicContact CG2-CG 4.45Å; I515-L519 WeakPolarHBondContact O-CG 3.48Å; I515-L519 PolarHBondContact O-N 2.89Å; I515-I570 HydrophobicContact CG1-CD1 3.92Å; I515-I570 HydrophobicContact CG1-CG1 4.08Å
516	I	96.3	Very high	94.5	Very high	70 Å²	70	48.2 Å²	48.2	36%	0.359	25%	0.248	S	C	.	.	H	α-helix	trans	-60.6	-44.4	178.4	-67.3	167.3	0	0	0	110.7	V209 I512 L513 L519 L520	V209-I516 HydrophobicContact CG1-CG2 4.16Å; V209-I516 HydrophobicContact CG2-CG2 4.16Å; I512-I516 HydrophobicContact CG2-CD1 3.72Å; I512-I516 HydrophobicContact CG2-CG1 4.48Å; I512-I516 VanDerWaalsContact O-CG1 3.29Å; I512-I516 WeakPolarHBondContact O-CG1 3.38Å; I512-I516 PolarHBondContact O-N 2.76Å; L513-I516 PolarHBondContact O-N 3.21Å; I516-L519 PolarHBondContact O-N 3.04Å; I516-L520 HydrophobicContact CG2-CD1 3.89Å; I516-L520 HydrophobicContact CG2-CG 4.41Å; I516-L520 WeakPolarHBondContact O-CB 3.49Å; I516-L520 VanDerWaalsContact O-CG 3.25Å; I516-L520 WeakPolarHBondContact O-CG 3.41Å; I516-L520 PolarHBondContact O-N 3.01Å
517	S	95.3	Very high	94.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-57.3	-50.6	175.6	177.8	0	0	0	0	111.4	Q210 L513 G514 I515 L519 L520 C521 D566	Q210-S517 PolarHBondContact NE2-OG 3.09Å; L513-S517 WeakPolarHBondContact O-CB 3.23Å; L513-S517 PolarHBondContact O-N 2.98Å; G514-S517 PolarHBondContact O-N 3.41Å; I515-S517 VanDerWaalsContact C-N 3.34Å; I515-S517 PolarHBondContact O-N 3.26Å; S517-L519 PolarHBondContact O-N 3.3Å; S517-L520 PolarHBondContact O-N 3.03Å; S517-C521 WeakPolarHBondContact O-CB 3.47Å; S517-C521 PolarHBondContact O-N 3.24Å; S517-C521 PolarHBondContact O-SG 3.47Å; S517-C521 VanDerWaalsContact O-SG 3.34Å; S517-D566 VanDerWaalsContact C-OD2 3.31Å; S517-D566 VanDerWaalsContact CB-OD2 3.31Å; S517-D566 WeakPolarHBondContact CB-OD2 3.4Å; S517-D566 PolarHBondContact OG-OD1 3.47Å; S517-D566 PolarHBondContact OG-OD2 3.08Å
518	C	95.3	Very high	94.5	Very high	13 Å²	13	52 Å²	52	9%	0.088	27%	0.266	C	S	.	.	H	α-helix	trans	-59.8	-48.8	-179.5	-172.5	0	0	0	0	111.3	G514 I515 L520 C521 I522 D566 I570	G514-C518 VanDerWaalsContact O-CB 3.27Å; G514-C518 WeakPolarHBondContact O-CB 3.33Å; G514-C518 PolarHBondContact O-N 2.98Å; I515-C518 PolarHBondContact O-N 3.28Å; C518-L520 PolarHBondContact O-N 3.43Å; C518-C521 PolarHBondContact O-N 3.33Å; C518-C521 VanDerWaalsContact O-N 3.14Å; C518-I522 WeakPolarHBondContact O-CG1 3.45Å; C518-I522 PolarHBondContact O-N 3.45Å; C518-D566 WeakPolarHBondContact CA-OD2 3.35Å; C518-D566 HydrophobicContact CB-CB 3.93Å; C518-D566 PolarHBondContact N-OD2 2.92Å; C518-I570 HydrophobicContact CB-CD1 4.41Å
519	L	96.1	Very high	94.6	Very high	111 Å²	111	54.7 Å²	54.7	58%	0.581	27%	0.273	S	S	*	.	H	α-helix	trans	-60.9	-42.4	177.8	-68.4	173.4	0	0	0	112.5	I515 I516 S517 C521 R523	I515-L519 HydrophobicContact CG2-CD1 3.98Å; I515-L519 HydrophobicContact CG2-CG 4.45Å; I515-L519 WeakPolarHBondContact O-CG 3.48Å; I515-L519 PolarHBondContact O-N 2.89Å; I516-L519 PolarHBondContact O-N 3.04Å; S517-L519 PolarHBondContact O-N 3.3Å; L519-C521 VanDerWaalsContact C-N 3.33Å; L519-R523 WeakPolarHBondContact O-CB 3.35Å; L519-R523 PolarHBondContact O-N 2.77Å
520	L	94.5	Very high	94.5	Very high	56 Å²	56	58.6 Å²	58.6	29%	0.293	28%	0.281	S	S	.	.	H	α-helix	trans	-66	-35.2	175.2	-70.6	174.4	0	0	0	112.2	V209 I516 S517 C518 S524	V209-L520 HydrophobicContact CB-CD1 4.47Å; V209-L520 HydrophobicContact CG2-CD1 4.17Å; I516-L520 HydrophobicContact CG2-CD1 3.89Å; I516-L520 HydrophobicContact CG2-CG 4.41Å; I516-L520 WeakPolarHBondContact O-CB 3.49Å; I516-L520 VanDerWaalsContact O-CG 3.25Å; I516-L520 WeakPolarHBondContact O-CG 3.41Å; I516-L520 PolarHBondContact O-N 3.01Å; S517-L520 PolarHBondContact O-N 3.03Å; C518-L520 PolarHBondContact O-N 3.43Å; L520-S524 VanDerWaalsContact O-CB 3.31Å; L520-S524 WeakPolarHBondContact O-CB 3.11Å; L520-S524 PolarHBondContact O-N 3.06Å
521	C	93.6	Very high	94.3	Very high	0 Å²	0	59 Å²	59	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-71.2	-44.9	175.4	-74.3	0	0	0	0	112.4	K206 S517 C518 L519 R523 S524 I525 I559 I562 I563	K206-C521 WeakPolarHBondContact CE-SG 3.24Å; S517-C521 WeakPolarHBondContact O-CB 3.47Å; S517-C521 PolarHBondContact O-N 3.24Å; S517-C521 PolarHBondContact O-SG 3.47Å; S517-C521 VanDerWaalsContact O-SG 3.34Å; C518-C521 PolarHBondContact O-N 3.33Å; C518-C521 VanDerWaalsContact O-N 3.14Å; L519-C521 VanDerWaalsContact C-N 3.33Å; C521-R523 PolarHBondContact O-N 2.71Å; C521-S524 CarbonylContact O-C 3.59Å; C521-S524 WeakPolarHBondContact O-CA 3.47Å; C521-S524 VanDerWaalsContact O-CB 3.26Å; C521-S524 WeakPolarHBondContact O-CB 3.46Å; C521-S524 PolarHBondContact O-N 3.41Å; C521-S524 VanDerWaalsContact O-N 3.08Å; C521-I525 PolarHBondContact O-N 3.14Å; C521-I559 HydrophobicContact CB-CG2 4.07Å; C521-I562 VanDerWaalsContact SG-CG2 3.58Å; C521-I563 HydrophobicContact CB-CD1 3.94Å; C521-I563 HydrophobicContact CB-CG1 3.51Å
522	I	95	Very high	94.2	Very high	70 Å²	70	60.2 Å²	60.2	36%	0.359	29%	0.285	S	S	.	.	H	α-helix	trans	-58.1	-48.7	174.2	-69.4	165.6	0	0	0	110.3	C518 S524 I525 I526 I563	C518-I522 WeakPolarHBondContact O-CG1 3.45Å; C518-I522 PolarHBondContact O-N 3.45Å; I522-S524 VanDerWaalsContact C-N 3.25Å; I522-S524 PolarHBondContact O-N 3.05Å; I522-I525 PolarHBondContact O-N 2.93Å; I522-I526 HydrophobicContact CG2-CD1 3.84Å; I522-I526 WeakPolarHBondContact O-CG1 3.34Å; I522-I526 PolarHBondContact O-N 2.92Å; I522-I563 HydrophobicContact CG1-CD1 3.97Å
523	R	94.8	Very high	94	Very high	181 Å²	181	60 Å²	60	68%	0.683	28%	0.284	S	S	*	.	H	α-helix	trans	-56.5	-40.3	174.2	-178.1	-178.9	173	95.9	-0.6	112.1	L519 C521 I526 Q527	L519-R523 WeakPolarHBondContact O-CB 3.35Å; L519-R523 PolarHBondContact O-N 2.77Å; C521-R523 PolarHBondContact O-N 2.71Å; R523-I526 PolarHBondContact O-N 2.73Å; R523-Q527 WeakPolarHBondContact O-CB 3.41Å; R523-Q527 PolarHBondContact O-N 3.03Å
524	S	91.8	Very high	93.8	Very high	36 Å²	36	59.4 Å²	59.4	25%	0.252	28%	0.281	S	S	.	.	H	α-helix	trans	-65.7	-34.3	177.2	-171.4	0	0	0	0	112.8	K206 L520 C521 I522 G528	K206-S524 PolarHBondContact NZ-OG 3.39Å; L520-S524 VanDerWaalsContact O-CB 3.31Å; L520-S524 WeakPolarHBondContact O-CB 3.11Å; L520-S524 PolarHBondContact O-N 3.06Å; C521-S524 CarbonylContact O-C 3.59Å; C521-S524 WeakPolarHBondContact O-CA 3.47Å; C521-S524 VanDerWaalsContact O-CB 3.26Å; C521-S524 WeakPolarHBondContact O-CB 3.46Å; C521-S524 PolarHBondContact O-N 3.41Å; C521-S524 VanDerWaalsContact O-N 3.08Å; I522-S524 VanDerWaalsContact C-N 3.25Å; I522-S524 PolarHBondContact O-N 3.05Å; S524-G528 PolarHBondContact O-N 2.93Å; S524-G528 VanDerWaalsContact O-N 3.14Å
525	I	93.7	Very high	93.6	Very high	34 Å²	34	59.4 Å²	59.4	17%	0.174	28%	0.281	C	S	.	.	H	α-helix	trans	-71.5	-47.6	174.1	-68.2	-174.8	0	0	0	110.6	C521 I522 Q527 G528 F529 V555 I559 L560 I563	C521-I525 PolarHBondContact O-N 3.14Å; I522-I525 PolarHBondContact O-N 2.93Å; I525-Q527 PolarHBondContact O-N 3.31Å; I525-G528 PolarHBondContact O-N 2.89Å; I525-F529 WeakPolarHBondContact O-CB 3.04Å; I525-F529 PolarHBondContact O-N 3.36Å; I525-V555 HydrophobicContact CG1-CG1 4.38Å; I525-V555 HydrophobicContact CG2-CG1 4.14Å; I525-I559 HydrophobicContact CD1-CB 4.47Å; I525-I559 HydrophobicContact CD1-CG2 4Å; I525-I559 HydrophobicContact CG1-CB 4.25Å; I525-I559 HydrophobicContact CG1-CG2 3.65Å; I525-L560 HydrophobicContact CD1-CD2 3.52Å; I525-L560 HydrophobicContact CD1-CG 4Å; I525-I563 HydrophobicContact CD1-CD1 3.44Å; I525-I563 VanDerWaalsContact CD1-CD1 3.44Å; I525-I563 HydrophobicContact CG1-CD1 4.34Å
526	I	94.3	Very high	93.3	Very high	107 Å²	107	58 Å²	58	55%	0.549	28%	0.275	S	S	.	.	H	α-helix	trans	-57	-41.4	177.6	-65.3	166.4	0	0	0	110.6	I522 R523 R530	I522-I526 HydrophobicContact CG2-CD1 3.84Å; I522-I526 WeakPolarHBondContact O-CG1 3.34Å; I522-I526 PolarHBondContact O-N 2.92Å; R523-I526 PolarHBondContact O-N 2.73Å; I526-R530 WeakPolarHBondContact O-CB 3.27Å; I526-R530 PolarHBondContact O-N 3.1Å
527	Q	92.1	Very high	92.9	Very high	104 Å²	104	55.7 Å²	55.7	49%	0.486	27%	0.269	S	S	.	.	H	α-helix	trans	-64.9	-42.5	175.1	-175.4	172.8	-1.5	0	0	112.6	R523 I525 R530 I531	R523-Q527 WeakPolarHBondContact O-CB 3.41Å; R523-Q527 PolarHBondContact O-N 3.03Å; I525-Q527 PolarHBondContact O-N 3.31Å; Q527-R530 PolarHBondContact O-N 3.49Å; Q527-I531 HydrophobicContact CG-CD1 3.96Å; Q527-I531 VanDerWaalsContact O-CG1 3.32Å; Q527-I531 WeakPolarHBondContact O-CG1 3.35Å; Q527-I531 PolarHBondContact O-N 3.22Å
528	G	92	Very high	92.7	Very high	2 Å²	2	55.7 Å²	55.7	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-63.8	-43.5	175.7	0	0	0	0	0	112.8	S524 I525 I531 W532	S524-G528 PolarHBondContact O-N 2.93Å; S524-G528 VanDerWaalsContact O-N 3.14Å; I525-G528 PolarHBondContact O-N 2.89Å; G528-I531 PolarHBondContact O-N 3.14Å; G528-W532 WeakPolarHBondContact O-CB 3.46Å; G528-W532 PolarHBondContact O-N 3.34Å
529	F	93.8	Very high	92.5	Very high	95 Å²	95	55.2 Å²	55.2	42%	0.417	27%	0.266	S	S	.	.	H	α-helix	trans	-61	-44.8	175.6	-179.2	-102.1	0	0	0	112.1	I525 W532 L533 F551	I525-F529 WeakPolarHBondContact O-CB 3.04Å; I525-F529 PolarHBondContact O-N 3.36Å; F529-W532 AromaticContact CD2-CE3 3.93Å; F529-W532 HydrophobicContact CD2-CE3 3.93Å; F529-W532 HydrophobicContact CD2-CZ3 4.14Å; F529-W532 AromaticContact CE2-CE3 3.91Å; F529-W532 HydrophobicContact CE2-CE3 3.91Å; F529-W532 AromaticContact CE2-CZ3 3.64Å; F529-W532 HydrophobicContact CE2-CZ3 3.64Å; F529-W532 HydrophobicContact CZ-CZ3 4.27Å; F529-W532 WeakPolarHBondContact O-CB 3.39Å; F529-W532 PolarHBondContact O-N 2.99Å; F529-L533 HydrophobicContact CD1-CD1 4.02Å; F529-L533 HydrophobicContact CE1-CD1 3.46Å; F529-L533 VanDerWaalsContact CE1-CD1 3.46Å; F529-L533 HydrophobicContact CE1-CG 4.25Å; F529-L533 HydrophobicContact CZ-CD1 3.85Å; F529-L533 HydrophobicContact CZ-CG 4.3Å; F529-L533 PolarHBondContact O-N 3.31Å; F529-F551 HydrophobicContact CD2-CE2 4.14Å
530	R	92.8	Very high	92.1	Very high	131 Å²	131	56 Å²	56	49%	0.494	26%	0.264	S	S	.	.	H	α-helix	trans	-61	-48.1	175.6	178.5	178.4	169.3	158.9	8.9	111.9	I526 Q527 W532 L533 E534 Y770	I526-R530 WeakPolarHBondContact O-CB 3.27Å; I526-R530 PolarHBondContact O-N 3.1Å; Q527-R530 PolarHBondContact O-N 3.49Å; R530-W532 VanDerWaalsContact C-N 3.29Å; R530-W532 PolarHBondContact O-N 2.77Å; R530-L533 PolarHBondContact O-N 3.37Å; R530-E534 HydrophobicContact CG-CG 4.45Å; R530-E534 WeakPolarHBondContact CG-OE1 3.46Å; R530-E534 IonicContact CZ-OE1 3.05Å; R530-E534 IonicContact NE-OE1 3.98Å; R530-E534 PolarHBondContact NE-OE1 2.96Å; R530-E534 IonicContact NH2-OE1 2.65Å; R530-E534 PolarHBondContact NH2-OE1 3.33Å; R530-E534 VanDerWaalsContact O-CG 3.31Å; R530-E534 WeakPolarHBondContact O-CG 3.33Å; R530-E534 PolarHBondContact O-N 3.03Å; R530-Y770 PolarHBondContact NH2-OH 3.05Å
531	I	91.4	Very high	91.8	Very high	9 Å²	9	57.6 Å²	57.6	5%	0.046	27%	0.273	C	S	.	.	H	α-helix	trans	-64.7	-36.3	179.4	-67.1	167.7	0	0	0	110.8	L186 H189 Q527 G528 E534 T535 F554	L186-I531 HydrophobicContact CD2-CG2 4.27Å; H189-I531 HydrophobicContact CB-CD1 4.35Å; H189-I531 WeakPolarHBondContact ND1-CD1 3.27Å; Q527-I531 HydrophobicContact CG-CD1 3.96Å; Q527-I531 VanDerWaalsContact O-CG1 3.32Å; Q527-I531 WeakPolarHBondContact O-CG1 3.35Å; Q527-I531 PolarHBondContact O-N 3.22Å; G528-I531 PolarHBondContact O-N 3.14Å; I531-E534 PolarHBondContact O-N 3.37Å; I531-T535 WeakPolarHBondContact O-CB 3.38Å; I531-T535 PolarHBondContact O-N 3.35Å; I531-T535 PolarHBondContact O-OG1 3.27Å; I531-F554 HydrophobicContact CB-CD1 4.47Å; I531-F554 HydrophobicContact CG2-CD1 3.85Å; I531-F554 HydrophobicContact CG2-CE1 3.82Å
532	W	93.4	Very high	91.5	Very high	58 Å²	58	61.4 Å²	61.4	22%	0.22	29%	0.288	C	S	.	.	H	α-helix	trans	-60.1	-50.5	172.9	169.5	68.8	0	0	0	112	G528 F529 R530 E534 T535 V536 F551 F554	G528-W532 WeakPolarHBondContact O-CB 3.46Å; G528-W532 PolarHBondContact O-N 3.34Å; F529-W532 AromaticContact CD2-CE3 3.93Å; F529-W532 HydrophobicContact CD2-CE3 3.93Å; F529-W532 HydrophobicContact CD2-CZ3 4.14Å; F529-W532 AromaticContact CE2-CE3 3.91Å; F529-W532 HydrophobicContact CE2-CE3 3.91Å; F529-W532 AromaticContact CE2-CZ3 3.64Å; F529-W532 HydrophobicContact CE2-CZ3 3.64Å; F529-W532 HydrophobicContact CZ-CZ3 4.27Å; F529-W532 WeakPolarHBondContact O-CB 3.39Å; F529-W532 PolarHBondContact O-N 2.99Å; R530-W532 VanDerWaalsContact C-N 3.29Å; R530-W532 PolarHBondContact O-N 2.77Å; W532-E534 PolarHBondContact O-N 3.47Å; W532-T535 PolarHBondContact O-N 2.92Å; W532-T535 VanDerWaalsContact O-N 3.14Å; W532-V536 HydrophobicContact CZ2-CG2 4.4Å; W532-V536 WeakPolarHBondContact O-CG2 3.22Å; W532-V536 PolarHBondContact O-N 2.91Å; W532-F551 AromaticContact CD2-CD2 3.91Å; W532-F551 HydrophobicContact CD2-CD2 3.91Å; W532-F551 HydrophobicContact CE3-CD2 4.13Å; W532-F551 HydrophobicContact CG-CD2 4.27Å; W532-F554 HydrophobicContact CB-CB 3.84Å; W532-F554 HydrophobicContact CB-CD1 4.31Å; W532-F554 HydrophobicContact CB-CD2 3.99Å; W532-F554 HydrophobicContact CB-CG 3.78Å; W532-F554 AromaticContact CD1-CD2 3.66Å; W532-F554 HydrophobicContact CG-CD2 4.21Å; W532-F554 HydrophobicContact CG-CG 4.47Å
533	L	91.8	Very high	91.1	Very high	88 Å²	88	62.3 Å²	62.3	46%	0.461	29%	0.289	S	S	.	.	H	α-helix	trans	-58.4	-46.8	175.9	-75.3	176.5	0	0	0	112.2	F529 R530 T535 V536 G537	F529-L533 HydrophobicContact CD1-CD1 4.02Å; F529-L533 HydrophobicContact CE1-CD1 3.46Å; F529-L533 VanDerWaalsContact CE1-CD1 3.46Å; F529-L533 HydrophobicContact CE1-CG 4.25Å; F529-L533 HydrophobicContact CZ-CD1 3.85Å; F529-L533 HydrophobicContact CZ-CG 4.3Å; F529-L533 PolarHBondContact O-N 3.31Å; R530-L533 PolarHBondContact O-N 3.37Å; L533-T535 PolarHBondContact O-N 3.48Å; L533-V536 PolarHBondContact O-N 2.86Å; L533-G537 PolarHBondContact O-N 2.98Å
534	E	90.8	Very high	90.6	Very high	9 Å²	9	56.7 Å²	56.7	4%	0.042	29%	0.287	C	S	.	.	H	α-helix	trans	-56.4	-40.3	175.8	-71.7	169.5	-173.8	0	0	111.5	R185 R530 I531 W532 F538 Y770 L774	R185-E534 IonicContact CZ-OE2 3.7Å; R185-E534 IonicContact NE-OE2 3.27Å; R185-E534 PolarHBondContact NE-OE2 3.38Å; R185-E534 VanDerWaalsContact NH2-CD 3.33Å; R185-E534 IonicContact NH2-OE1 2.73Å; R185-E534 PolarHBondContact NH2-OE1 2.95Å; R185-E534 VanDerWaalsContact NH2-OE1 3.13Å; R185-E534 IonicContact NH2-OE2 2.71Å; R185-E534 PolarHBondContact NH2-OE2 3.18Å; R530-E534 HydrophobicContact CG-CG 4.45Å; R530-E534 WeakPolarHBondContact CG-OE1 3.46Å; R530-E534 IonicContact CZ-OE1 3.05Å; R530-E534 IonicContact NE-OE1 3.98Å; R530-E534 PolarHBondContact NE-OE1 2.96Å; R530-E534 IonicContact NH2-OE1 2.65Å; R530-E534 PolarHBondContact NH2-OE1 3.33Å; R530-E534 VanDerWaalsContact O-CG 3.31Å; R530-E534 WeakPolarHBondContact O-CG 3.33Å; R530-E534 PolarHBondContact O-N 3.03Å; I531-E534 PolarHBondContact O-N 3.37Å; W532-E534 PolarHBondContact O-N 3.47Å; E534-F538 WeakPolarHBondContact O-CB 3.41Å; E534-F538 PolarHBondContact O-N 3.15Å; E534-Y770 HydrophobicContact CG-CE2 4.03Å; E534-Y770 WeakPolarHBondContact OE1-CE2 3.49Å; E534-L774 HydrophobicContact CB-CD2 4.34Å; E534-L774 WeakPolarHBondContact O-CD2 3.27Å
535	T	90.6	Very high	90.3	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-74.8	-41.3	-178.1	-49.5	0	0	0	0	112.7	M182 L186 I531 W532 L533 G537 F538 F539 L547 F554 L741	M182-T535 HydrophobicContact CE-CG2 4.17Å; M182-T535 WeakPolarHBondContact CE-OG1 3.15Å; L186-T535 HydrophobicContact CD1-CG2 4.07Å; L186-T535 HydrophobicContact CD2-CG2 4.1Å; L186-T535 WeakPolarHBondContact CD2-OG1 3.48Å; I531-T535 WeakPolarHBondContact O-CB 3.38Å; I531-T535 PolarHBondContact O-N 3.35Å; I531-T535 PolarHBondContact O-OG1 3.27Å; W532-T535 PolarHBondContact O-N 2.92Å; W532-T535 VanDerWaalsContact O-N 3.14Å; L533-T535 PolarHBondContact O-N 3.48Å; T535-G537 VanDerWaalsContact C-N 3.3Å; T535-G537 PolarHBondContact O-N 2.88Å; T535-F538 PolarHBondContact O-N 3.06Å; T535-F539 HydrophobicContact CG2-CD2 3.7Å; T535-F539 HydrophobicContact CG2-CE2 3.76Å; T535-F539 WeakPolarHBondContact O-CD2 3.34Å; T535-F539 PolarHBondContact O-N 3Å; T535-L547 HydrophobicContact CG2-CD1 4.07Å; T535-F554 HydrophobicContact CG2-CZ 3.9Å; T535-L741 HydrophobicContact CG2-CD1 4.06Å
536	V	90.3	Very high	89.9	Confident	43 Å²	43	63 Å²	63	26%	0.261	31%	0.314	S	S	.	.	H	α-helix	trans	-63.2	-40.2	175	173.9	0	0	0	0	110.4	W532 L533 K540	W532-V536 HydrophobicContact CZ2-CG2 4.4Å; W532-V536 WeakPolarHBondContact O-CG2 3.22Å; W532-V536 PolarHBondContact O-N 2.91Å; L533-V536 PolarHBondContact O-N 2.86Å; V536-K540 VanDerWaalsContact O-CB 3.25Å; V536-K540 WeakPolarHBondContact O-CB 3.41Å; V536-K540 PolarHBondContact O-N 3.46Å; V536-K540 VanDerWaalsContact O-N 3.1Å
537	G	88.6	Confident	89.5	Confident	22 Å²	22	58.6 Å²	58.6	23%	0.227	29%	0.291	C	S	.	.	H	α-helix	trans	-61.7	-50.7	173.2	0	0	0	0	0	112.8	L533 T535 K540 N541	L533-G537 PolarHBondContact O-N 2.98Å; T535-G537 VanDerWaalsContact C-N 3.3Å; T535-G537 PolarHBondContact O-N 2.88Å; G537-K540 PolarHBondContact O-N 3.09Å; G537-N541 WeakPolarHBondContact O-CB 3.38Å; G537-N541 PolarHBondContact O-N 3.44Å
538	F	90.5	Very high	88.9	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-56.8	-52.5	177.6	175.8	-105.8	0	0	0	112.2	E179 M182 E534 T535 K540 N541 W542 F543 F744 A773	E179-F538 HydrophobicContact CG-CZ 4.32Å; M182-F538 HydrophobicContact CB-CE1 4.22Å; M182-F538 HydrophobicContact CB-CE2 4.2Å; M182-F538 HydrophobicContact CB-CZ 4.05Å; M182-F538 HydrophobicContact CE-CB 4.05Å; M182-F538 HydrophobicContact CE-CD1 4.38Å; M182-F538 HydrophobicContact CE-CG 4.32Å; M182-F538 HydrophobicContact CG-CD1 3.68Å; M182-F538 HydrophobicContact CG-CD2 4.14Å; M182-F538 HydrophobicContact CG-CE1 3.77Å; M182-F538 HydrophobicContact CG-CE2 4.23Å; M182-F538 HydrophobicContact CG-CG 3.88Å; M182-F538 HydrophobicContact CG-CZ 4.06Å; E534-F538 WeakPolarHBondContact O-CB 3.41Å; E534-F538 PolarHBondContact O-N 3.15Å; T535-F538 PolarHBondContact O-N 3.06Å; F538-K540 VanDerWaalsContact C-N 3.33Å; F538-K540 PolarHBondContact O-N 3.3Å; F538-N541 PolarHBondContact O-N 2.72Å; F538-W542 HydrophobicContact CD2-CB 4.44Å; F538-W542 AromaticContact CD2-CD1 3.5Å; F538-W542 HydrophobicContact CD2-CD2 4.23Å; F538-W542 AromaticContact CD2-CG 3.81Å; F538-W542 HydrophobicContact CD2-CG 3.81Å; F538-W542 AromaticContact CD2-NE1 3.81Å; F538-W542 HydrophobicContact CE2-CB 4.19Å; F538-W542 AromaticContact CE2-CD1 3.66Å; F538-W542 AromaticContact CE2-CD2 3.57Å; F538-W542 HydrophobicContact CE2-CD2 3.57Å; F538-W542 AromaticContact CE2-CE2 3.8Å; F538-W542 HydrophobicContact CE2-CE3 4.14Å; F538-W542 AromaticContact CE2-CG 3.54Å; F538-W542 HydrophobicContact CE2-CG 3.54Å; F538-W542 AromaticContact CE2-NE1 3.82Å; F538-W542 HydrophobicContact CZ-CB 4.39Å; F538-W542 HydrophobicContact CZ-CD2 4.21Å; F538-W542 HydrophobicContact CZ-CE3 4.43Å; F538-W542 HydrophobicContact CZ-CG 4.16Å; F538-W542 WeakPolarHBondContact O-CB 3.39Å; F538-W542 PolarHBondContact O-N 3.16Å; F538-F543 AromaticContact CE1-CE2 3.81Å; F538-F543 HydrophobicContact CE1-CE2 3.81Å; F538-F543 HydrophobicContact CZ-CE2 4.27Å; F538-F744 HydrophobicContact CE1-CE1 4.16Å; F538-F744 HydrophobicContact CE1-CE2 4.12Å; F538-F744 AromaticContact CE1-CZ 3.67Å; F538-F744 HydrophobicContact CE1-CZ 3.67Å; F538-F744 HydrophobicContact CZ-CE2 4.49Å; F538-F744 HydrophobicContact CZ-CZ 4.07Å; F538-A773 HydrophobicContact CD2-CB 4.1Å
539	F	90	Very high	88.4	Confident	4 Å²	4	62.7 Å²	62.7	2%	0.018	33%	0.331	C	S	.	.	H	α-helix	trans	-63.8	-36.1	-179.2	-89.2	-104.8	0	0	0	113.3	T535 F543 G544 I545 L547 P740 L741 F744	T535-F539 HydrophobicContact CG2-CD2 3.7Å; T535-F539 HydrophobicContact CG2-CE2 3.76Å; T535-F539 WeakPolarHBondContact O-CD2 3.34Å; T535-F539 PolarHBondContact O-N 3Å; F539-F543 AromaticContact CD1-CD2 3.82Å; F539-F543 HydrophobicContact CD1-CD2 3.82Å; F539-F543 HydrophobicContact CD1-CE2 4.5Å; F539-F543 HydrophobicContact CE1-CD2 4.11Å; F539-F543 HydrophobicContact CE1-CE2 4.41Å; F539-F543 HydrophobicContact CG-CD2 4.17Å; F539-F543 CarbonylContact O-C 3.37Å; F539-F543 PolarHBondContact O-N 2.9Å; F539-F543 VanDerWaalsContact O-N 3.1Å; F539-G544 PolarHBondContact O-N 3.43Å; F539-G544 VanDerWaalsContact O-N 3.11Å; F539-I545 CarbonylContact C-O 3.42Å; F539-I545 PolarHBondContact O-N 3.12Å; F539-L547 HydrophobicContact CB-CD1 3.87Å; F539-L547 HydrophobicContact CB-CG 3.97Å; F539-L547 HydrophobicContact CD1-CD1 3.9Å; F539-L547 HydrophobicContact CD1-CD2 3.99Å; F539-L547 HydrophobicContact CD1-CG 3.99Å; F539-L547 HydrophobicContact CD2-CD1 3.57Å; F539-L547 HydrophobicContact CD2-CG 4.46Å; F539-L547 HydrophobicContact CE1-CD1 4.31Å; F539-L547 HydrophobicContact CE1-CD2 4.27Å; F539-L547 HydrophobicContact CE2-CD1 4.01Å; F539-L547 HydrophobicContact CG-CD1 3.5Å; F539-L547 HydrophobicContact CG-CD2 4.4Å; F539-L547 HydrophobicContact CG-CG 3.9Å; F539-L547 HydrophobicContact CZ-CD1 4.35Å; F539-P740 HydrophobicContact CE1-CB 4.38Å; F539-L741 HydrophobicContact CE2-CD1 4.3Å; F539-L741 HydrophobicContact CZ-CD1 4.42Å; F539-F744 HydrophobicContact CE1-CB 4.41Å; F539-F744 HydrophobicContact CE2-CD1 4.24Å; F539-F744 HydrophobicContact CE2-CG 4.43Å; F539-F744 HydrophobicContact CZ-CB 3.72Å; F539-F744 HydrophobicContact CZ-CD1 4.06Å; F539-F744 HydrophobicContact CZ-CD2 4.47Å; F539-F744 AromaticContact CZ-CG 3.84Å; F539-F744 HydrophobicContact CZ-CG 3.84Å
540	K	88.8	Confident	88	Confident	126 Å²	126	58.6 Å²	58.6	55%	0.548	31%	0.314	S	S	.	.	H	α-helix	trans	-64.4	-43.3	174.9	-176.2	-177.2	177.3	-173.9	0	111.6	V536 G537 F538 G544 I545	V536-K540 VanDerWaalsContact O-CB 3.25Å; V536-K540 WeakPolarHBondContact O-CB 3.41Å; V536-K540 PolarHBondContact O-N 3.46Å; V536-K540 VanDerWaalsContact O-N 3.1Å; G537-K540 PolarHBondContact O-N 3.09Å; F538-K540 VanDerWaalsContact C-N 3.33Å; F538-K540 PolarHBondContact O-N 3.3Å; K540-G544 WeakPolarHBondContact O-CA 3.37Å; K540-G544 PolarHBondContact O-N 2.99Å; K540-I545 PolarHBondContact N-O 2.98Å
541	N	87.1	Confident	87.7	Confident	90 Å²	90	55.1 Å²	55.1	48%	0.481	30%	0.303	S	S	.	.	H	α-helix	trans	-83	-35.2	-173.8	-68.5	-5	0	0	0	113.2	G537 F538 L774	G537-N541 WeakPolarHBondContact O-CB 3.38Å; G537-N541 PolarHBondContact O-N 3.44Å; F538-N541 PolarHBondContact O-N 2.72Å; N541-L774 PolarHBondContact ND2-O 3.41Å
542	W	87.7	Confident	87.4	Confident	81 Å²	81	61.7 Å²	61.7	31%	0.307	33%	0.327	S	S	.	.	H	α-helix	trans	-93.5	-37.6	-175.2	-77.6	66	0	0	0	114	P175 V178 F538 Q772 A773	P175-W542 HydrophobicContact CB-CH2 3.61Å; P175-W542 HydrophobicContact CB-CZ3 3.73Å; P175-W542 WeakPolarHBondContact O-CH2 3.32Å; P175-W542 VanDerWaalsContact O-CZ3 3.3Å; P175-W542 WeakPolarHBondContact O-CZ3 3.43Å; V178-W542 HydrophobicContact CB-CH2 3.67Å; V178-W542 HydrophobicContact CB-CZ2 3.87Å; V178-W542 HydrophobicContact CG1-CH2 3.91Å; V178-W542 HydrophobicContact CG1-CZ2 3.58Å; V178-W542 HydrophobicContact CG2-CH2 4.27Å; V178-W542 HydrophobicContact CG2-CZ2 4.4Å; F538-W542 HydrophobicContact CD2-CB 4.44Å; F538-W542 AromaticContact CD2-CD1 3.5Å; F538-W542 HydrophobicContact CD2-CD2 4.23Å; F538-W542 AromaticContact CD2-CG 3.81Å; F538-W542 HydrophobicContact CD2-CG 3.81Å; F538-W542 AromaticContact CD2-NE1 3.81Å; F538-W542 HydrophobicContact CE2-CB 4.19Å; F538-W542 AromaticContact CE2-CD1 3.66Å; F538-W542 AromaticContact CE2-CD2 3.57Å; F538-W542 HydrophobicContact CE2-CD2 3.57Å; F538-W542 AromaticContact CE2-CE2 3.8Å; F538-W542 HydrophobicContact CE2-CE3 4.14Å; F538-W542 AromaticContact CE2-CG 3.54Å; F538-W542 HydrophobicContact CE2-CG 3.54Å; F538-W542 AromaticContact CE2-NE1 3.82Å; F538-W542 HydrophobicContact CZ-CB 4.39Å; F538-W542 HydrophobicContact CZ-CD2 4.21Å; F538-W542 HydrophobicContact CZ-CE3 4.43Å; F538-W542 HydrophobicContact CZ-CG 4.16Å; F538-W542 WeakPolarHBondContact O-CB 3.39Å; F538-W542 PolarHBondContact O-N 3.16Å; W542-Q772 PolarHBondContact NE1-O 3.3Å; W542-A773 PolarHBondContact NE1-O 2.96Å
543	F	87.7	Confident	87	Confident	88 Å²	88	61.9 Å²	61.9	39%	0.386	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.1	-11.4	-176.7	-59.8	-64.5	0	0	0	113.5	F538 F539 I545 F744	F538-F543 AromaticContact CE1-CE2 3.81Å; F538-F543 HydrophobicContact CE1-CE2 3.81Å; F538-F543 HydrophobicContact CZ-CE2 4.27Å; F539-F543 AromaticContact CD1-CD2 3.82Å; F539-F543 HydrophobicContact CD1-CD2 3.82Å; F539-F543 HydrophobicContact CD1-CE2 4.5Å; F539-F543 HydrophobicContact CE1-CD2 4.11Å; F539-F543 HydrophobicContact CE1-CE2 4.41Å; F539-F543 HydrophobicContact CG-CD2 4.17Å; F539-F543 CarbonylContact O-C 3.37Å; F539-F543 PolarHBondContact O-N 2.9Å; F539-F543 VanDerWaalsContact O-N 3.1Å; F543-I545 HydrophobicContact CB-CB 4.35Å; F543-I545 HydrophobicContact CB-CD1 3.87Å; F543-I545 HydrophobicContact CB-CG1 3.92Å; F543-I545 PolarHBondContact O-N 3.45Å; F543-F744 HydrophobicContact CE2-CD2 4.06Å; F543-F744 AromaticContact CE2-CE2 3.98Å; F543-F744 HydrophobicContact CE2-CE2 3.98Å; F543-F744 HydrophobicContact CZ-CD2 4.06Å; F543-F744 AromaticContact CZ-CE2 3.9Å; F543-F744 HydrophobicContact CZ-CE2 3.9Å
544	G	83.1	Confident	86.9	Confident	63 Å²	63	58 Å²	58	65%	0.649	31%	0.31	S	S	*	.			trans	69.5	11.8	-172.1	0	0	0	0	0	113.8	F539 K540	F539-G544 PolarHBondContact O-N 3.43Å; F539-G544 VanDerWaalsContact O-N 3.11Å; K540-G544 WeakPolarHBondContact O-CA 3.37Å; K540-G544 PolarHBondContact O-N 2.99Å
545	I	86.4	Confident	86.7	Confident	67 Å²	67	57.8 Å²	57.8	34%	0.344	31%	0.309	S	S	.	.			trans	-96.5	127	-174	-61.1	173.3	0	0	0	109.7	F539 K540 F543 L547	F539-I545 CarbonylContact C-O 3.42Å; F539-I545 PolarHBondContact O-N 3.12Å; K540-I545 PolarHBondContact N-O 2.98Å; F543-I545 HydrophobicContact CB-CB 4.35Å; F543-I545 HydrophobicContact CB-CD1 3.87Å; F543-I545 HydrophobicContact CB-CG1 3.92Å; F543-I545 PolarHBondContact O-N 3.45Å; I545-L547 HydrophobicContact CG2-CD2 4.36Å
546	Q	85.3	Confident	86.5	Confident	137 Å²	137	61.8 Å²	61.8	64%	0.64	32%	0.324	S	S	*	.			trans	-88.2	109.2	171.2	-63.6	-173.9	10.5	0	0	110.3	N548	Q546-N548 PolarHBondContact O-N 3.1Å
547	L	84.8	Confident	86.3	Confident	13 Å²	13	63 Å²	63	7%	0.068	33%	0.333	C	S	.	.			trans	-76.5	83.7	177.3	-68.5	179.4	0	0	0	111.6	T535 F539 I545 V550 P740	T535-L547 HydrophobicContact CG2-CD1 4.07Å; F539-L547 HydrophobicContact CB-CD1 3.87Å; F539-L547 HydrophobicContact CB-CG 3.97Å; F539-L547 HydrophobicContact CD1-CD1 3.9Å; F539-L547 HydrophobicContact CD1-CD2 3.99Å; F539-L547 HydrophobicContact CD1-CG 3.99Å; F539-L547 HydrophobicContact CD2-CD1 3.57Å; F539-L547 HydrophobicContact CD2-CG 4.46Å; F539-L547 HydrophobicContact CE1-CD1 4.31Å; F539-L547 HydrophobicContact CE1-CD2 4.27Å; F539-L547 HydrophobicContact CE2-CD1 4.01Å; F539-L547 HydrophobicContact CG-CD1 3.5Å; F539-L547 HydrophobicContact CG-CD2 4.4Å; F539-L547 HydrophobicContact CG-CG 3.9Å; F539-L547 HydrophobicContact CZ-CD1 4.35Å; I545-L547 HydrophobicContact CG2-CD2 4.36Å; L547-V550 HydrophobicContact CB-CG1 4.28Å; L547-V550 HydrophobicContact CB-CG2 3.86Å; L547-P740 HydrophobicContact CD2-CB 4.15Å
548	N	80.6	Confident	86.3	Confident	127 Å²	127	65.2 Å²	65.2	68%	0.679	33%	0.334	S	S	*	.			trans	-80.7	130.6	177.8	-71.1	-25.3	0	0	0	111.8	Q546 V550	Q546-N548 PolarHBondContact O-N 3.1Å; N548-V550 PolarHBondContact O-N 2.71Å
549	G	80.3	Confident	86.3	Confident	65 Å²	65	65.8 Å²	65.8	67%	0.67	34%	0.337	S	S	*	.	S	Bend	trans	88	-10.1	171.4	0	0	0	0	0	116.9	F551	G549-F551 PolarHBondContact O-N 3.26Å
550	V	84.9	Confident	86.4	Confident	9 Å²	9	69.3 Å²	69.3	6%	0.055	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-4.5	-176.7	-60.7	0	0	0	0	115.4	L547 N548 W552 E553 F554 L741	L547-V550 HydrophobicContact CB-CG1 4.28Å; L547-V550 HydrophobicContact CB-CG2 3.86Å; N548-V550 PolarHBondContact O-N 2.71Å; V550-W552 VanDerWaalsContact C-N 3.33Å; V550-W552 PolarHBondContact O-N 3.13Å; V550-E553 WeakPolarHBondContact O-CB 3.45Å; V550-E553 PolarHBondContact O-N 3.27Å; V550-F554 HydrophobicContact CB-CE2 4.2Å; V550-F554 HydrophobicContact CG2-CD2 4.37Å; V550-F554 HydrophobicContact CG2-CE2 3.93Å; V550-F554 WeakPolarHBondContact O-CD2 3.42Å; V550-L741 HydrophobicContact CB-CD2 4.4Å; V550-L741 HydrophobicContact CG1-CD2 4.41Å
551	F	88.1	Confident	86.5	Confident	59 Å²	59	66.3 Å²	66.3	26%	0.259	34%	0.343	S	S	.	.	H	α-helix	trans	-51.3	-46.5	-174.6	173.1	-103.4	0	0	0	113.6	F529 W532 G549 E553 F554 V555	F529-F551 HydrophobicContact CD2-CE2 4.14Å; W532-F551 AromaticContact CD2-CD2 3.91Å; W532-F551 HydrophobicContact CD2-CD2 3.91Å; W532-F551 HydrophobicContact CE3-CD2 4.13Å; W532-F551 HydrophobicContact CG-CD2 4.27Å; G549-F551 PolarHBondContact O-N 3.26Å; F551-E553 PolarHBondContact O-N 2.77Å; F551-F554 PolarHBondContact O-N 3.16Å; F551-F554 VanDerWaalsContact O-N 3.12Å; F551-V555 HydrophobicContact CE1-CB 4.31Å; F551-V555 HydrophobicContact CE2-CB 4.18Å; F551-V555 HydrophobicContact CE2-CG2 3.81Å; F551-V555 HydrophobicContact CZ-CB 3.91Å; F551-V555 HydrophobicContact CZ-CG1 4.25Å; F551-V555 HydrophobicContact CZ-CG2 3.98Å; F551-V555 PolarHBondContact O-N 3.28Å
552	W	84.6	Confident	86.8	Confident	147 Å²	147	62.1 Å²	62.1	56%	0.557	32%	0.32	S	S	*	.	H	α-helix	trans	-69	-16.1	-177.9	-61.4	118	0	0	0	114.2	V550 V555 P557 L560	V550-W552 VanDerWaalsContact C-N 3.33Å; V550-W552 PolarHBondContact O-N 3.13Å; W552-V555 CarbonylContact O-C 3.56Å; W552-P557 HydrophobicContact CD2-CG 4.45Å; W552-P557 HydrophobicContact CE3-CG 3.79Å; W552-P557 HydrophobicContact CZ3-CG 4.27Å; W552-L560 HydrophobicContact CZ3-CD1 4.05Å
553	E	84.7	Confident	87.1	Confident	62 Å²	62	59.4 Å²	59.4	29%	0.29	31%	0.312	S	S	.	.	H	α-helix	trans	-73.5	-40.8	171.5	-56.4	-172.9	-144.6	0	0	110.7	F190 V550 F551 W742	F190-E553 HydrophobicContact CE1-CB 4.22Å; F190-E553 WeakPolarHBondContact CE1-O 3.41Å; V550-E553 WeakPolarHBondContact O-CB 3.45Å; V550-E553 PolarHBondContact O-N 3.27Å; F551-E553 PolarHBondContact O-N 2.77Å; E553-W742 PolarHBondContact OE2-NE1 2.99Å
554	F	88.9	Confident	87.5	Confident	6 Å²	6	59.3 Å²	59.3	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-76.9	-43.4	178.8	-69	-87.2	0	0	0	112.6	L186 H189 F190 I531 W532 T535 V550 F551 L741	L186-F554 HydrophobicContact CD2-CE1 3.64Å; L186-F554 HydrophobicContact CD2-CZ 4.05Å; H189-F554 AromaticContact CD2-CD1 3.8Å; H189-F554 AromaticContact NE2-CD1 3.84Å; H189-F554 PolarHBondContact NE2-O 3.14Å; F190-F554 HydrophobicContact CE2-CE1 4.09Å; F190-F554 HydrophobicContact CE2-CZ 4.3Å; F190-F554 AromaticContact CZ-CD1 3.98Å; F190-F554 HydrophobicContact CZ-CD1 3.98Å; F190-F554 AromaticContact CZ-CE1 3.72Å; F190-F554 HydrophobicContact CZ-CE1 3.72Å; F190-F554 HydrophobicContact CZ-CE2 4.32Å; F190-F554 HydrophobicContact CZ-CG 4.38Å; F190-F554 AromaticContact CZ-CZ 3.89Å; F190-F554 HydrophobicContact CZ-CZ 3.89Å; I531-F554 HydrophobicContact CB-CD1 4.47Å; I531-F554 HydrophobicContact CG2-CD1 3.85Å; I531-F554 HydrophobicContact CG2-CE1 3.82Å; W532-F554 HydrophobicContact CB-CB 3.84Å; W532-F554 HydrophobicContact CB-CD1 4.31Å; W532-F554 HydrophobicContact CB-CD2 3.99Å; W532-F554 HydrophobicContact CB-CG 3.78Å; W532-F554 AromaticContact CD1-CD2 3.66Å; W532-F554 HydrophobicContact CG-CD2 4.21Å; W532-F554 HydrophobicContact CG-CG 4.47Å; T535-F554 HydrophobicContact CG2-CZ 3.9Å; V550-F554 HydrophobicContact CB-CE2 4.2Å; V550-F554 HydrophobicContact CG2-CD2 4.37Å; V550-F554 HydrophobicContact CG2-CE2 3.93Å; V550-F554 WeakPolarHBondContact O-CD2 3.42Å; F551-F554 PolarHBondContact O-N 3.16Å; F551-F554 VanDerWaalsContact O-N 3.12Å; F554-L741 HydrophobicContact CE2-CD2 3.66Å; F554-L741 HydrophobicContact CZ-CD1 4.06Å; F554-L741 HydrophobicContact CZ-CD2 3.74Å
555	V	88.2	Confident	88	Confident	4 Å²	4	56.4 Å²	56.4	2%	0.024	29%	0.288	C	S	.	.	S	Bend	trans	-109	88.9	177.4	-176.6	0	0	0	0	108.5	I525 F551 W552	I525-V555 HydrophobicContact CG1-CG1 4.38Å; I525-V555 HydrophobicContact CG2-CG1 4.14Å; F551-V555 HydrophobicContact CE1-CB 4.31Å; F551-V555 HydrophobicContact CE2-CB 4.18Å; F551-V555 HydrophobicContact CE2-CG2 3.81Å; F551-V555 HydrophobicContact CZ-CB 3.91Å; F551-V555 HydrophobicContact CZ-CG1 4.25Å; F551-V555 HydrophobicContact CZ-CG2 3.98Å; F551-V555 PolarHBondContact O-N 3.28Å; W552-V555 CarbonylContact O-C 3.56Å
556	R	84.9	Confident	88.5	Confident	85 Å²	85	53.2 Å²	53.2	32%	0.321	27%	0.272	S	S	.	.			trans	-62.6	127.3	-179	-61.2	-173.3	-172.4	-174.9	4	110.5	W558 I559	R556-W558 PolarHBondContact O-N 3.21Å; R556-I559 PolarHBondContact O-N 3Å
557	P	86.9	Confident	89	Confident	68 Å²	68	51 Å²	51	44%	0.442	26%	0.264	S	S	.	.	H	α-helix	trans	-52.1	-32.7	-179.8	-30.1	35.1	0	0	0	114.9	W552 I559 L560 F561	W552-P557 HydrophobicContact CD2-CG 4.45Å; W552-P557 HydrophobicContact CE3-CG 3.79Å; W552-P557 HydrophobicContact CZ3-CG 4.27Å; P557-I559 PolarHBondContact O-N 3.12Å; P557-I559 VanDerWaalsContact O-N 3.09Å; P557-L560 WeakPolarHBondContact O-CB 3.45Å; P557-L560 PolarHBondContact O-N 3.38Å; P557-F561 PolarHBondContact O-N 3.44Å; P557-F561 VanDerWaalsContact O-N 3.13Å
558	W	89.1	Confident	89.5	Confident	68 Å²	68	51.7 Å²	51.7	26%	0.258	27%	0.268	S	S	.	.	H	α-helix	trans	-51.2	-30.8	173.8	-71.5	101.1	0	0	0	114.7	R556 F561 I562 I603 L606 Y607 I619	R556-W558 PolarHBondContact O-N 3.21Å; W558-F561 HydrophobicContact CE3-CD1 4.46Å; W558-F561 PolarHBondContact O-N 3.48Å; W558-I562 VanDerWaalsContact O-CG1 3.28Å; W558-I562 WeakPolarHBondContact O-CG1 3.33Å; W558-I562 PolarHBondContact O-N 2.97Å; W558-I603 HydrophobicContact CZ3-CG2 4.45Å; W558-L606 HydrophobicContact CH2-CB 4.33Å; W558-Y607 HydrophobicContact CB-CD2 3.4Å; W558-Y607 HydrophobicContact CB-CE2 3.85Å; W558-Y607 HydrophobicContact CB-CG 3.99Å; W558-Y607 AromaticContact CD1-CD2 3.89Å; W558-Y607 HydrophobicContact CD2-CD2 4.1Å; W558-Y607 HydrophobicContact CD2-CG 4.45Å; W558-Y607 AromaticContact CG-CD2 3.5Å; W558-Y607 HydrophobicContact CG-CD2 3.5Å; W558-Y607 VanDerWaalsContact CG-CD2 3.5Å; W558-Y607 HydrophobicContact CG-CE2 4.25Å; W558-Y607 HydrophobicContact CG-CG 4.2Å; W558-I619 HydrophobicContact CH2-CD1 4.16Å; W558-I619 HydrophobicContact CH2-CG1 4.5Å; W558-I619 HydrophobicContact CZ2-CD1 3.92Å; W558-I619 HydrophobicContact CZ2-CG1 3.94Å
559	I	90.1	Very high	90.2	Very high	13 Å²	13	45.9 Å²	45.9	7%	0.067	24%	0.237	C	C	.	.	H	α-helix	trans	-74.3	-33.2	178.6	-53	176	0	0	0	111	C521 I525 R556 P557 I562 I563	C521-I559 HydrophobicContact CB-CG2 4.07Å; I525-I559 HydrophobicContact CD1-CB 4.47Å; I525-I559 HydrophobicContact CD1-CG2 4Å; I525-I559 HydrophobicContact CG1-CB 4.25Å; I525-I559 HydrophobicContact CG1-CG2 3.65Å; R556-I559 PolarHBondContact O-N 3Å; P557-I559 PolarHBondContact O-N 3.12Å; P557-I559 VanDerWaalsContact O-N 3.09Å; I559-I562 PolarHBondContact O-N 3.45Å; I559-I563 WeakPolarHBondContact O-CG1 3.41Å; I559-I563 PolarHBondContact O-N 2.94Å; I559-I563 VanDerWaalsContact O-N 3.15Å
560	L	91.4	Very high	90.9	Very high	77 Å²	77	44 Å²	44	40%	0.403	21%	0.212	S	C	.	.	H	α-helix	trans	-67.7	-42.8	172.6	-68.3	165.8	0	0	0	110.7	I525 W552 P557 I562 I563 V564	I525-L560 HydrophobicContact CD1-CD2 3.52Å; I525-L560 HydrophobicContact CD1-CG 4Å; W552-L560 HydrophobicContact CZ3-CD1 4.05Å; P557-L560 WeakPolarHBondContact O-CB 3.45Å; P557-L560 PolarHBondContact O-N 3.38Å; L560-I562 VanDerWaalsContact C-N 3.32Å; L560-I562 PolarHBondContact O-N 3.48Å; L560-I563 PolarHBondContact O-N 3.4Å; L560-I563 VanDerWaalsContact O-N 3.1Å; L560-V564 PolarHBondContact O-N 3.18Å
561	F	92.6	Very high	91.3	Very high	63 Å²	63	47.1 Å²	47.1	28%	0.276	23%	0.23	S	C	.	.	H	α-helix	trans	-57	-44.1	174.2	179.6	-94.6	0	0	0	112.1	P557 W558 I563 V564 N565 L600 I603	P557-F561 PolarHBondContact O-N 3.44Å; P557-F561 VanDerWaalsContact O-N 3.13Å; W558-F561 HydrophobicContact CE3-CD1 4.46Å; W558-F561 PolarHBondContact O-N 3.48Å; F561-I563 VanDerWaalsContact C-N 3.34Å; F561-I563 PolarHBondContact O-N 3.13Å; F561-V564 PolarHBondContact O-N 3.05Å; F561-N565 WeakPolarHBondContact O-CB 3.48Å; F561-N565 PolarHBondContact O-N 3.32Å; F561-L600 WeakPolarHBondContact CE1-O 3.31Å; F561-L600 HydrophobicContact CE2-CD2 3.61Å; F561-L600 HydrophobicContact CZ-CB 4.27Å; F561-L600 HydrophobicContact CZ-CD2 3.5Å; F561-L600 VanDerWaalsContact CZ-CD2 3.5Å; F561-L600 HydrophobicContact CZ-CG 4.49Å; F561-I603 HydrophobicContact CE1-CB 4.33Å; F561-I603 HydrophobicContact CE1-CG2 3.9Å; F561-I603 HydrophobicContact CZ-CB 4.09Å; F561-I603 HydrophobicContact CZ-CG2 3.62Å
562	I	93	Very high	91.5	Very high	2 Å²	2	44.5 Å²	44.5	1%	0.01	22%	0.219	C	C	.	.	H	α-helix	trans	-62.9	-37.6	175.5	-68.4	164.3	0	0	0	111.8	C521 W558 I559 L560 N565 D566 Y607	C521-I562 VanDerWaalsContact SG-CG2 3.58Å; W558-I562 VanDerWaalsContact O-CG1 3.28Å; W558-I562 WeakPolarHBondContact O-CG1 3.33Å; W558-I562 PolarHBondContact O-N 2.97Å; I559-I562 PolarHBondContact O-N 3.45Å; L560-I562 VanDerWaalsContact C-N 3.32Å; L560-I562 PolarHBondContact O-N 3.48Å; I562-N565 PolarHBondContact O-N 2.96Å; I562-D566 WeakPolarHBondContact O-CB 3.37Å; I562-D566 PolarHBondContact O-N 3.45Å; I562-Y607 HydrophobicContact CD1-CD1 4.27Å
563	I	94.3	Very high	91.9	Very high	25 Å²	25	37.5 Å²	37.5	13%	0.128	19%	0.193	C	C	.	.	H	α-helix	trans	-66.8	-43.3	176.4	-68.9	169.1	0	0	0	111.4	C521 I522 I525 I559 L560 F561 N565 D566 L567	C521-I563 HydrophobicContact CB-CD1 3.94Å; C521-I563 HydrophobicContact CB-CG1 3.51Å; I522-I563 HydrophobicContact CG1-CD1 3.97Å; I525-I563 HydrophobicContact CD1-CD1 3.44Å; I525-I563 VanDerWaalsContact CD1-CD1 3.44Å; I525-I563 HydrophobicContact CG1-CD1 4.34Å; I559-I563 WeakPolarHBondContact O-CG1 3.41Å; I559-I563 PolarHBondContact O-N 2.94Å; I559-I563 VanDerWaalsContact O-N 3.15Å; L560-I563 PolarHBondContact O-N 3.4Å; L560-I563 VanDerWaalsContact O-N 3.1Å; F561-I563 VanDerWaalsContact C-N 3.34Å; F561-I563 PolarHBondContact O-N 3.13Å; I563-N565 VanDerWaalsContact C-N 3.29Å; I563-N565 PolarHBondContact O-N 2.95Å; I563-D566 PolarHBondContact O-N 3.12Å; I563-L567 HydrophobicContact CG2-CD1 4.41Å; I563-L567 WeakPolarHBondContact O-CG 3.4Å; I563-L567 PolarHBondContact O-N 3.47Å
564	V	94.8	Very high	92.3	Very high	86 Å²	86	39 Å²	39	52%	0.521	20%	0.202	S	C	.	.	H	α-helix	trans	-59.9	-43.2	176.3	173.8	0	0	0	0	110.5	L560 F561 L567 V568	L560-V564 PolarHBondContact O-N 3.18Å; F561-V564 PolarHBondContact O-N 3.05Å; V564-L567 PolarHBondContact O-N 3.09Å; V564-V568 WeakPolarHBondContact O-CG2 3.5Å; V564-V568 PolarHBondContact O-N 3.39Å; V564-V568 VanDerWaalsContact O-N 3.14Å
565	N	94.9	Very high	92.3	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.011	22%	0.215	C	C	.	.	H	α-helix	trans	-61.6	-47.3	173.3	-178	10.3	0	0	0	112.4	F561 I562 I563 L567 V568 I569 G597 L600 V601	F561-N565 WeakPolarHBondContact O-CB 3.48Å; F561-N565 PolarHBondContact O-N 3.32Å; I562-N565 PolarHBondContact O-N 2.96Å; I563-N565 VanDerWaalsContact C-N 3.29Å; I563-N565 PolarHBondContact O-N 2.95Å; N565-L567 PolarHBondContact O-N 3.37Å; N565-V568 WeakPolarHBondContact O-CB 3.44Å; N565-V568 PolarHBondContact O-N 2.95Å; N565-I569 WeakPolarHBondContact O-CG1 3.28Å; N565-I569 PolarHBondContact O-N 2.85Å; N565-I569 WeakPolarHBondContact OD1-CD1 3.37Å; N565-G597 PolarHBondContact OD1-O 2.89Å; N565-L600 HydrophobicContact CB-CB 3.98Å; N565-L600 HydrophobicContact CB-CD1 4.49Å; N565-L600 PolarHBondContact ND2-O 3.4Å; N565-L600 VanDerWaalsContact ND2-O 3.14Å; N565-V601 WeakPolarHBondContact ND2-CA 3.47Å; N565-V601 VanDerWaalsContact ND2-CG2 3.32Å; N565-V601 WeakPolarHBondContact ND2-CG2 3.45Å; N565-V601 PolarHBondContact ND2-N 3.37Å
566	D	95.7	Very high	92.4	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-58.4	-36.8	177.3	-69.3	-21.9	0	0	0	112	K213 S517 C518 I562 I563 I569 I570	K213-D566 WeakPolarHBondContact CD-OD1 3.49Å; K213-D566 IonicContact NZ-OD1 3.55Å; K213-D566 PolarHBondContact NZ-OD1 3.37Å; S517-D566 VanDerWaalsContact C-OD2 3.31Å; S517-D566 VanDerWaalsContact CB-OD2 3.31Å; S517-D566 WeakPolarHBondContact CB-OD2 3.4Å; S517-D566 PolarHBondContact OG-OD1 3.47Å; S517-D566 PolarHBondContact OG-OD2 3.08Å; C518-D566 WeakPolarHBondContact CA-OD2 3.35Å; C518-D566 HydrophobicContact CB-CB 3.93Å; C518-D566 PolarHBondContact N-OD2 2.92Å; I562-D566 WeakPolarHBondContact O-CB 3.37Å; I562-D566 PolarHBondContact O-N 3.45Å; I563-D566 PolarHBondContact O-N 3.12Å; D566-I569 PolarHBondContact O-N 2.96Å; D566-I570 WeakPolarHBondContact O-CB 3.25Å; D566-I570 WeakPolarHBondContact O-CD1 3.39Å; D566-I570 WeakPolarHBondContact O-CG1 3.28Å; D566-I570 PolarHBondContact O-N 3.28Å
567	L	95.2	Very high	92.4	Very high	90 Å²	90	40.6 Å²	40.6	47%	0.471	21%	0.212	S	C	.	.	H	α-helix	trans	-65.2	-41.4	173.3	-68.1	174.2	0	0	0	112.3	I563 V564 N565 I570 T571	I563-L567 HydrophobicContact CG2-CD1 4.41Å; I563-L567 WeakPolarHBondContact O-CG 3.4Å; I563-L567 PolarHBondContact O-N 3.47Å; V564-L567 PolarHBondContact O-N 3.09Å; N565-L567 PolarHBondContact O-N 3.37Å; L567-I570 PolarHBondContact O-N 3.17Å; L567-T571 WeakPolarHBondContact O-CG2 3.24Å; L567-T571 PolarHBondContact O-N 3.49Å; L567-T571 PolarHBondContact O-OG1 3.46Å
568	V	95.3	Very high	92.3	Very high	28 Å²	28	40.9 Å²	40.9	17%	0.17	22%	0.216	C	C	.	.	H	α-helix	trans	-63.2	-41.4	174.5	174.7	0	0	0	0	111.2	V564 N565 T571 T572 L593 L600	V564-V568 WeakPolarHBondContact O-CG2 3.5Å; V564-V568 PolarHBondContact O-N 3.39Å; V564-V568 VanDerWaalsContact O-N 3.14Å; N565-V568 WeakPolarHBondContact O-CB 3.44Å; N565-V568 PolarHBondContact O-N 2.95Å; V568-T571 PolarHBondContact O-N 3.33Å; V568-T571 PolarHBondContact O-OG1 2.94Å; V568-T571 VanDerWaalsContact O-OG1 3.08Å; V568-T572 VanDerWaalsContact O-CB 3.26Å; V568-T572 WeakPolarHBondContact O-CB 3.31Å; V568-T572 PolarHBondContact O-N 3.26Å; V568-T572 PolarHBondContact O-OG1 3.41Å; V568-L593 HydrophobicContact CG1-CD2 4.49Å; V568-L600 HydrophobicContact CG2-CD1 4.49Å
569	I	95.3	Very high	91.8	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.021	21%	0.207	C	C	.	.	H	α-helix	trans	-63.4	-42.8	176.2	-63.1	161.5	0	0	0	110.8	K213 V217 N565 D566 T572 S573 V601	K213-I569 HydrophobicContact CD-CD1 3.82Å; K213-I569 HydrophobicContact CG-CD1 4.28Å; V217-I569 HydrophobicContact CG2-CD1 4.14Å; V217-I569 HydrophobicContact CG2-CG1 4.29Å; V217-I569 HydrophobicContact CG2-CG2 3.96Å; N565-I569 WeakPolarHBondContact O-CG1 3.28Å; N565-I569 PolarHBondContact O-N 2.85Å; N565-I569 WeakPolarHBondContact OD1-CD1 3.37Å; D566-I569 PolarHBondContact O-N 2.96Å; I569-T572 PolarHBondContact O-N 2.99Å; I569-S573 WeakPolarHBondContact O-CB 3.45Å; I569-S573 PolarHBondContact O-N 2.89Å; I569-S573 PolarHBondContact O-OG 3.07Å; I569-V601 HydrophobicContact CD1-CG2 3.63Å; I569-V601 HydrophobicContact CG1-CG2 4.36Å
570	I	95.8	Very high	91	Very high	27 Å²	27	39.7 Å²	39.7	14%	0.138	22%	0.215	C	C	.	.	H	α-helix	trans	-63.5	-48.3	178.3	-70.5	163.3	0	0	0	110.8	L511 I515 C518 D566 L567 S573 I574	L511-I570 HydrophobicContact CD1-CB 4.32Å; L511-I570 HydrophobicContact CD1-CG1 4.33Å; L511-I570 HydrophobicContact CD1-CG2 3.92Å; I515-I570 HydrophobicContact CG1-CD1 3.92Å; I515-I570 HydrophobicContact CG1-CG1 4.08Å; C518-I570 HydrophobicContact CB-CD1 4.41Å; D566-I570 WeakPolarHBondContact O-CB 3.25Å; D566-I570 WeakPolarHBondContact O-CD1 3.39Å; D566-I570 WeakPolarHBondContact O-CG1 3.28Å; D566-I570 PolarHBondContact O-N 3.28Å; L567-I570 PolarHBondContact O-N 3.17Å; I570-S573 PolarHBondContact O-N 3.37Å; I570-I574 HydrophobicContact CG2-CD1 3.78Å; I570-I574 VanDerWaalsContact O-CG1 3.29Å; I570-I574 WeakPolarHBondContact O-CG1 3.37Å; I570-I574 PolarHBondContact O-N 2.91Å
571	T	93.7	Very high	89.7	Confident	73 Å²	73	42.2 Å²	42.2	45%	0.448	23%	0.229	S	C	.	.	H	α-helix	trans	-65.5	-39.7	178.2	55.2	0	0	0	0	112	L567 V568 Y575	L567-T571 WeakPolarHBondContact O-CG2 3.24Å; L567-T571 PolarHBondContact O-N 3.49Å; L567-T571 PolarHBondContact O-OG1 3.46Å; V568-T571 PolarHBondContact O-N 3.33Å; V568-T571 PolarHBondContact O-OG1 2.94Å; V568-T571 VanDerWaalsContact O-OG1 3.08Å; T571-Y575 WeakPolarHBondContact O-CB 3.37Å; T571-Y575 PolarHBondContact O-N 3.03Å
572	T	93	Very high	88.2	Confident	4 Å²	4	44.7 Å²	44.7	3%	0.025	24%	0.241	C	C	.	.	H	α-helix	trans	-57.8	-49.8	174.2	-56.6	0	0	0	0	111.1	V568 I569 Y575 A576 L590 M594	V568-T572 VanDerWaalsContact O-CB 3.26Å; V568-T572 WeakPolarHBondContact O-CB 3.31Å; V568-T572 PolarHBondContact O-N 3.26Å; V568-T572 PolarHBondContact O-OG1 3.41Å; I569-T572 PolarHBondContact O-N 2.99Å; T572-Y575 PolarHBondContact O-N 3.12Å; T572-A576 WeakPolarHBondContact O-CB 3.32Å; T572-A576 PolarHBondContact O-N 3.48Å; T572-L590 HydrophobicContact CG2-CD1 3.89Å; T572-M594 HydrophobicContact CG2-CB 3.79Å; T572-M594 HydrophobicContact CG2-CG 4.13Å; T572-M594 HydrophobicContact CG2-SD 3.79Å
573	S	92.9	Very high	86.5	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-69.4	-36.6	-175.5	-49.8	0	0	0	0	112.1	T510 I569 I570 L577	T510-S573 PolarHBondContact OG1-OG 3.46Å; I569-S573 WeakPolarHBondContact O-CB 3.45Å; I569-S573 PolarHBondContact O-N 2.89Å; I569-S573 PolarHBondContact O-OG 3.07Å; I570-S573 PolarHBondContact O-N 3.37Å; S573-L577 WeakPolarHBondContact O-CB 3.22Å; S573-L577 VanDerWaalsContact O-CG 3.29Å; S573-L577 WeakPolarHBondContact O-CG 3.32Å; S573-L577 PolarHBondContact O-N 3.33Å; S573-L577 VanDerWaalsContact O-N 3.11Å
574	I	92.1	Very high	84.6	Confident	95 Å²	95	55.1 Å²	55.1	49%	0.487	29%	0.291	S	S	.	.	H	α-helix	trans	-64.1	-42.1	171.7	-68	166.6	0	0	0	110.7	L511 I570 S578	L511-I574 HydrophobicContact CD1-CD1 4.36Å; L511-I574 HydrophobicContact CD1-CG1 3.98Å; L511-I574 HydrophobicContact CD2-CG1 4.3Å; I570-I574 HydrophobicContact CG2-CD1 3.78Å; I570-I574 VanDerWaalsContact O-CG1 3.29Å; I570-I574 WeakPolarHBondContact O-CG1 3.37Å; I570-I574 PolarHBondContact O-N 2.91Å; I574-S578 WeakPolarHBondContact O-CB 3.41Å; I574-S578 PolarHBondContact O-N 3.05Å
575	Y	90.1	Very high	82.9	Confident	77 Å²	77	53.2 Å²	53.2	30%	0.302	28%	0.279	S	S	.	.	H	α-helix	trans	-67.6	-43.8	179.3	-163.3	-85.8	0	0	0	111.7	T571 T572 S578 T579 P589 L590	T571-Y575 WeakPolarHBondContact O-CB 3.37Å; T571-Y575 PolarHBondContact O-N 3.03Å; T572-Y575 PolarHBondContact O-N 3.12Å; Y575-S578 WeakPolarHBondContact O-CB 3Å; Y575-S578 PolarHBondContact O-N 2.94Å; Y575-T579 HydrophobicContact CD1-CG2 3.75Å; Y575-T579 HydrophobicContact CE1-CG2 3.47Å; Y575-T579 VanDerWaalsContact CE1-CG2 3.47Å; Y575-T579 WeakPolarHBondContact O-CG2 3.31Å; Y575-T579 PolarHBondContact O-N 3.48Å; Y575-T579 PolarHBondContact O-OG1 3.06Å; Y575-P589 HydrophobicContact CE1-CG 4.26Å; Y575-P589 WeakPolarHBondContact OH-CG 3.41Å; Y575-L590 HydrophobicContact CD1-CB 3.75Å; Y575-L590 HydrophobicContact CD1-CD1 4.11Å; Y575-L590 HydrophobicContact CD1-CD2 4.38Å; Y575-L590 HydrophobicContact CD1-CG 4.29Å; Y575-L590 HydrophobicContact CE1-CB 3.87Å
576	A	88.5	Confident	81.5	Confident	6 Å²	6	57.2 Å²	57.2	5%	0.05	30%	0.297	C	S	.	.	H	α-helix	trans	-56	-53.7	175.5	0	0	0	0	0	111.8	T572 S578 T579 L580 L590	T572-A576 WeakPolarHBondContact O-CB 3.32Å; T572-A576 PolarHBondContact O-N 3.48Å; A576-S578 VanDerWaalsContact C-N 3.27Å; A576-S578 PolarHBondContact O-N 2.93Å; A576-T579 WeakPolarHBondContact CA-OG1 3.48Å; A576-T579 PolarHBondContact O-N 3.38Å; A576-T579 VanDerWaalsContact O-N 3.14Å; A576-T579 PolarHBondContact O-OG1 3.38Å; A576-L580 PolarHBondContact O-N 3.12Å; A576-L580 VanDerWaalsContact O-N 3.13Å; A576-L590 HydrophobicContact CB-CD1 4.1Å; A576-L590 HydrophobicContact CB-CD2 4.36Å
577	L	86.7	Confident	80.4	Confident	45 Å²	45	58.7 Å²	58.7	24%	0.236	30%	0.303	C	S	.	.	H	α-helix	trans	-58.7	-36.4	176.8	-70.9	170.1	0	0	0	112.8	I504 D507 L511 S573	I504-L577 HydrophobicContact CG2-CD2 4.35Å; D507-L577 HydrophobicContact CB-CD1 4.43Å; D507-L577 HydrophobicContact CB-CD2 3.71Å; D507-L577 HydrophobicContact CB-CG 3.86Å; L511-L577 HydrophobicContact CD2-CD1 4.14Å; S573-L577 WeakPolarHBondContact O-CB 3.22Å; S573-L577 VanDerWaalsContact O-CG 3.29Å; S573-L577 WeakPolarHBondContact O-CG 3.32Å; S573-L577 PolarHBondContact O-N 3.33Å; S573-L577 VanDerWaalsContact O-N 3.11Å
578	S	84.1	Confident	79.6	Confident	73 Å²	73	57 Å²	57	51%	0.51	29%	0.292	S	S	.	.	H	α-helix	trans	-67.8	-45.3	175.3	-171.8	0	0	0	0	112.1	I574 Y575 A576 L580	I574-S578 WeakPolarHBondContact O-CB 3.41Å; I574-S578 PolarHBondContact O-N 3.05Å; Y575-S578 WeakPolarHBondContact O-CB 3Å; Y575-S578 PolarHBondContact O-N 2.94Å; A576-S578 VanDerWaalsContact C-N 3.27Å; A576-S578 PolarHBondContact O-N 2.93Å; S578-L580 PolarHBondContact O-N 2.88Å
579	T	79.3	Confident	79.1	Confident	11 Å²	11	58.2 Å²	58.2	7%	0.067	30%	0.3	C	S	.	.	H	α-helix	trans	-65.3	-24.4	179.7	49.6	0	0	0	0	113.9	Y575 A576 N581 H582 V585	Y575-T579 HydrophobicContact CD1-CG2 3.75Å; Y575-T579 HydrophobicContact CE1-CG2 3.47Å; Y575-T579 VanDerWaalsContact CE1-CG2 3.47Å; Y575-T579 WeakPolarHBondContact O-CG2 3.31Å; Y575-T579 PolarHBondContact O-N 3.48Å; Y575-T579 PolarHBondContact O-OG1 3.06Å; A576-T579 WeakPolarHBondContact CA-OG1 3.48Å; A576-T579 PolarHBondContact O-N 3.38Å; A576-T579 VanDerWaalsContact O-N 3.14Å; A576-T579 PolarHBondContact O-OG1 3.38Å; T579-N581 PolarHBondContact O-N 3.33Å; T579-H582 PolarHBondContact O-N 2.81Å; T579-V585 HydrophobicContact CG2-CB 4.16Å; T579-V585 HydrophobicContact CG2-CG1 3.81Å
580	L	72.3	Confident	78.8	Confident	46 Å²	46	58.1 Å²	58.1	24%	0.241	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-23.4	-175.8	-153.6	115.1	0	0	0	114.2	V503 I504 A576 S578	V503-L580 HydrophobicContact CB-CD1 4.29Å; V503-L580 HydrophobicContact CG1-CD1 3.73Å; I504-L580 HydrophobicContact CD1-CD2 3.66Å; I504-L580 HydrophobicContact CG1-CD1 4.38Å; I504-L580 HydrophobicContact CG1-CD2 3.64Å; A576-L580 PolarHBondContact O-N 3.12Å; A576-L580 VanDerWaalsContact O-N 3.13Å; S578-L580 PolarHBondContact O-N 2.88Å
581	N	64.2	Low	78.5	Confident	130 Å²	130	59.5 Å²	59.5	70%	0.695	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-15.6	177.5	-70.5	-36	0	0	0	114.1	T579	T579-N581 PolarHBondContact O-N 3.33Å
582	H	61.8	Low	78.4	Confident	114 Å²	114	63.2 Å²	63.2	53%	0.528	32%	0.316	S	S	.	.			trans	-114.6	92.4	-171.1	-66.9	-72.8	0	0	0	111.6	T579 Q584 V585	T579-H582 PolarHBondContact O-N 2.81Å; H582-Q584 PolarHBondContact O-N 3.48Å; H582-V585 HydrophobicContact CB-CG2 3.52Å; H582-V585 PolarHBondContact O-N 3.22Å
583	I	57.1	Low	78.4	Confident	80 Å²	80	65.7 Å²	65.7	41%	0.41	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-23.3	-177.8	-59.3	171.7	0	0	0	113.3
584	Q	53.4	Low	78.3	Confident	166 Å²	166	65.9 Å²	65.9	78%	0.776	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	8	-173.4	-63.9	-173.3	-34.3	0	0	115.5	H582	H582-Q584 PolarHBondContact O-N 3.48Å
585	V	60	Low	78.4	Confident	46 Å²	46	63 Å²	63	28%	0.279	32%	0.324	S	S	.	.			trans	-79.3	137.5	-179.5	179.4	0	0	0	0	111.7	T579 H582 Y587	T579-V585 HydrophobicContact CG2-CB 4.16Å; T579-V585 HydrophobicContact CG2-CG1 3.81Å; H582-V585 HydrophobicContact CB-CG2 3.52Å; H582-V585 PolarHBondContact O-N 3.22Å; V585-Y587 WeakPolarHBondContact O-CD2 3.35Å; V585-Y587 PolarHBondContact O-N 3.38Å
586	K	65	Low	78.5	Confident	87 Å²	87	63.4 Å²	63.4	38%	0.378	33%	0.331	S	S	.	.			trans	-65.7	116.7	173.9	-60.1	-171.3	-176.9	-170.1	0	110.1	H53 E588 P589	H53-K586 PolarHBondContact O-NZ 3.46Å; K586-E588 VanDerWaalsContact C-N 3.26Å; K586-E588 PolarHBondContact O-N 3.16Å; K586-P589 WeakPolarHBondContact O-CD 3.44Å
587	Y	72.6	Confident	78.7	Confident	31 Å²	31	63.2 Å²	63.2	12%	0.122	33%	0.329	C	S	.	.			trans	-74.9	-5.4	-177.5	-69	-84.2	0	0	0	115.1	F224 Y227 V585 L590 T591	F224-Y587 HydrophobicContact CE2-CD1 4.42Å; Y227-Y587 HydrophobicContact CE1-CE1 4.25Å; Y227-Y587 PolarHBondContact OH-OH 3.15Å; V585-Y587 WeakPolarHBondContact O-CD2 3.35Å; V585-Y587 PolarHBondContact O-N 3.38Å; Y587-L590 PolarHBondContact O-N 2.98Å; Y587-T591 PolarHBondContact O-N 2.7Å; Y587-T591 PolarHBondContact O-OG1 3.2Å
588	E	78.1	Confident	79	Confident	55 Å²	55	61.3 Å²	61.3	26%	0.257	32%	0.319	S	S	.	.	H	α-helix	trans	-56.7	-56.3	-176.6	-63.9	178.6	173.2	0	0	114.1	K586 L590 T591 Y592	K586-E588 VanDerWaalsContact C-N 3.26Å; K586-E588 PolarHBondContact O-N 3.16Å; E588-L590 VanDerWaalsContact C-N 3.29Å; E588-L590 PolarHBondContact O-N 3.48Å; E588-T591 WeakPolarHBondContact O-CB 3.48Å; E588-T591 PolarHBondContact O-N 2.85Å; E588-Y592 HydrophobicContact CB-CE2 4.16Å; E588-Y592 WeakPolarHBondContact O-CD2 3.3Å; E588-Y592 PolarHBondContact O-N 2.97Å; E588-Y592 VanDerWaalsContact O-N 3.08Å
589	P	86	Confident	79.5	Confident	52 Å²	52	63 Å²	63	34%	0.338	32%	0.322	S	S	.	.	H	α-helix	trans	-58.9	-37.3	179.2	22.6	-35.2	0	0	0	113.3	Y575 K586 T591 Y592 L593	Y575-P589 HydrophobicContact CE1-CG 4.26Å; Y575-P589 WeakPolarHBondContact OH-CG 3.41Å; K586-P589 WeakPolarHBondContact O-CD 3.44Å; P589-T591 VanDerWaalsContact C-N 3.35Å; P589-Y592 PolarHBondContact O-N 3.37Å; P589-L593 WeakPolarHBondContact O-CB 3.32Å; P589-L593 VanDerWaalsContact O-CG 3.28Å; P589-L593 WeakPolarHBondContact O-CG 3.2Å; P589-L593 PolarHBondContact O-N 3.19Å
590	L	88.1	Confident	80.2	Confident	3 Å²	3	64 Å²	64	2%	0.016	33%	0.327	C	S	.	.	H	α-helix	trans	-63.6	-41.8	174.9	180	55	0	0	0	111.6	F224 T572 Y575 A576 Y587 E588 L593 M594	F224-L590 HydrophobicContact CD2-CD2 4.45Å; F224-L590 HydrophobicContact CE2-CD2 3.65Å; F224-L590 HydrophobicContact CE2-CG 3.97Å; F224-L590 HydrophobicContact CZ-CB 4.49Å; F224-L590 HydrophobicContact CZ-CD2 4.11Å; F224-L590 HydrophobicContact CZ-CG 3.93Å; T572-L590 HydrophobicContact CG2-CD1 3.89Å; Y575-L590 HydrophobicContact CD1-CB 3.75Å; Y575-L590 HydrophobicContact CD1-CD1 4.11Å; Y575-L590 HydrophobicContact CD1-CD2 4.38Å; Y575-L590 HydrophobicContact CD1-CG 4.29Å; Y575-L590 HydrophobicContact CE1-CB 3.87Å; A576-L590 HydrophobicContact CB-CD1 4.1Å; A576-L590 HydrophobicContact CB-CD2 4.36Å; Y587-L590 PolarHBondContact O-N 2.98Å; E588-L590 VanDerWaalsContact C-N 3.29Å; E588-L590 PolarHBondContact O-N 3.48Å; L590-L593 PolarHBondContact O-N 2.98Å; L590-M594 WeakPolarHBondContact O-CB 3.46Å; L590-M594 PolarHBondContact O-N 3.4Å
591	T	90.7	Very high	81.2	Confident	55 Å²	55	62 Å²	62	34%	0.337	32%	0.317	S	S	.	.	H	α-helix	trans	-61.4	-46.3	178.8	-52.9	0	0	0	0	110.9	F224 Y587 E588 P589 G595	F224-T591 HydrophobicContact CE1-CG2 4.36Å; Y587-T591 PolarHBondContact O-N 2.7Å; Y587-T591 PolarHBondContact O-OG1 3.2Å; E588-T591 WeakPolarHBondContact O-CB 3.48Å; E588-T591 PolarHBondContact O-N 2.85Å; P589-T591 VanDerWaalsContact C-N 3.35Å; T591-G595 PolarHBondContact O-N 3.05Å; T591-G595 VanDerWaalsContact O-N 3.09Å
592	Y	90.7	Very high	82.6	Confident	151 Å²	151	62.4 Å²	62.4	59%	0.592	31%	0.309	S	S	*	.	H	α-helix	trans	-64.1	-47.2	176.3	-63.3	-58	0	0	0	112.5	E588 P589 M594 G595 I596	E588-Y592 HydrophobicContact CB-CE2 4.16Å; E588-Y592 WeakPolarHBondContact O-CD2 3.3Å; E588-Y592 PolarHBondContact O-N 2.97Å; E588-Y592 VanDerWaalsContact O-N 3.08Å; P589-Y592 PolarHBondContact O-N 3.37Å; Y592-M594 PolarHBondContact O-N 3.07Å; Y592-G595 PolarHBondContact O-N 3.15Å; Y592-I596 WeakPolarHBondContact O-CB 3.47Å; Y592-I596 VanDerWaalsContact O-CG1 3.25Å; Y592-I596 WeakPolarHBondContact O-CG1 3.24Å; Y592-I596 PolarHBondContact O-N 3.28Å
593	L	92.3	Very high	84	Confident	56 Å²	56	59.9 Å²	59.9	29%	0.293	30%	0.299	S	S	.	.	H	α-helix	trans	-62	-43.5	-178.9	-75.5	172	0	0	0	112.1	V568 P589 L590 G597	V568-L593 HydrophobicContact CG1-CD2 4.49Å; P589-L593 WeakPolarHBondContact O-CB 3.32Å; P589-L593 VanDerWaalsContact O-CG 3.28Å; P589-L593 WeakPolarHBondContact O-CG 3.2Å; P589-L593 PolarHBondContact O-N 3.19Å; L590-L593 PolarHBondContact O-N 2.98Å; L593-G597 PolarHBondContact O-N 3.35Å
594	M	92.1	Very high	85.5	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.025	28%	0.281	C	S	.	.	H	α-helix	trans	-70.6	-40.5	-179.9	-165.2	127.9	67.9	0	0	112.5	Q220 L221 F224 T572 L590 Y592 G597 A598	Q220-M594 HydrophobicContact CG-SD 3.81Å; L221-M594 HydrophobicContact CB-CG 4.45Å; L221-M594 HydrophobicContact CD1-CB 4.41Å; L221-M594 HydrophobicContact CD1-CG 3.77Å; F224-M594 HydrophobicContact CB-CE 3.37Å; F224-M594 HydrophobicContact CD1-CE 3.36Å; F224-M594 HydrophobicContact CD2-CE 3.72Å; F224-M594 HydrophobicContact CE1-CE 3.95Å; F224-M594 HydrophobicContact CE2-CE 4.28Å; F224-M594 HydrophobicContact CG-CE 3.2Å; F224-M594 HydrophobicContact CZ-CE 4.37Å; T572-M594 HydrophobicContact CG2-CB 3.79Å; T572-M594 HydrophobicContact CG2-CG 4.13Å; T572-M594 HydrophobicContact CG2-SD 3.79Å; L590-M594 WeakPolarHBondContact O-CB 3.46Å; L590-M594 PolarHBondContact O-N 3.4Å; Y592-M594 PolarHBondContact O-N 3.07Å; M594-G597 PolarHBondContact O-N 3.44Å; M594-A598 WeakPolarHBondContact O-CB 3.49Å; M594-A598 PolarHBondContact O-N 3.26Å
595	G	93	Very high	87.2	Confident	34 Å²	34	50.7 Å²	50.7	35%	0.351	26%	0.256	S	S	.	.	H	α-helix	trans	-62.8	-45.8	174.8	0	0	0	0	0	112.8	T591 Y592 A598 L599	T591-G595 PolarHBondContact O-N 3.05Å; T591-G595 VanDerWaalsContact O-N 3.09Å; Y592-G595 PolarHBondContact O-N 3.15Å; G595-A598 PolarHBondContact O-N 3.19Å; G595-L599 PolarHBondContact O-N 3.11Å
596	I	93.1	Very high	88.4	Confident	86 Å²	86	52.2 Å²	52.2	44%	0.441	26%	0.262	S	S	.	.	H	α-helix	trans	-65.5	-44	176.2	-67.9	167.8	0	0	0	110.7	Y592 A598 L599 L600	Y592-I596 WeakPolarHBondContact O-CB 3.47Å; Y592-I596 VanDerWaalsContact O-CG1 3.25Å; Y592-I596 WeakPolarHBondContact O-CG1 3.24Å; Y592-I596 PolarHBondContact O-N 3.28Å; I596-A598 PolarHBondContact O-N 2.65Å; I596-L599 PolarHBondContact O-N 3.15Å; I596-L600 HydrophobicContact CG2-CD1 3.86Å; I596-L600 HydrophobicContact CG2-CG 4.23Å; I596-L600 VanDerWaalsContact O-CG 3.28Å; I596-L600 WeakPolarHBondContact O-CG 3.27Å; I596-L600 PolarHBondContact O-N 3.37Å
597	G	93.2	Very high	89.4	Confident	2 Å²	2	49.6 Å²	49.6	2%	0.021	25%	0.25	C	S	.	.	H	α-helix	trans	-56.1	-48.8	176.4	0	0	0	0	0	111.9	N565 L593 M594 L600 V601	N565-G597 PolarHBondContact OD1-O 2.89Å; L593-G597 PolarHBondContact O-N 3.35Å; M594-G597 PolarHBondContact O-N 3.44Å; G597-L600 PolarHBondContact O-N 2.9Å; G597-V601 WeakPolarHBondContact O-CB 3.37Å; G597-V601 VanDerWaalsContact O-CG2 3.29Å; G597-V601 WeakPolarHBondContact O-CG2 3.33Å; G597-V601 PolarHBondContact O-N 3.23Å
598	A	92.5	Very high	89.9	Confident	4 Å²	4	49.9 Å²	49.9	3%	0.033	25%	0.251	C	S	.	.	H	α-helix	trans	-61.5	-45.1	176.2	0	0	0	0	0	112.8	L221 M594 G595 I596 L600 V601 W602	L221-A598 HydrophobicContact CD2-CB 3.63Å; L221-A598 HydrophobicContact CG-CB 4.47Å; M594-A598 WeakPolarHBondContact O-CB 3.49Å; M594-A598 PolarHBondContact O-N 3.26Å; G595-A598 PolarHBondContact O-N 3.19Å; I596-A598 PolarHBondContact O-N 2.65Å; A598-L600 VanDerWaalsContact C-N 3.34Å; A598-L600 PolarHBondContact O-N 2.85Å; A598-V601 WeakPolarHBondContact O-CB 3.32Å; A598-V601 PolarHBondContact O-N 3.29Å; A598-V601 VanDerWaalsContact O-N 3.12Å; A598-W602 VanDerWaalsContact O-CD1 3.29Å; A598-W602 PolarHBondContact O-N 2.87Å
599	L	93.9	Very high	90.1	Very high	108 Å²	108	50.3 Å²	50.3	57%	0.565	26%	0.258	S	S	*	.	H	α-helix	trans	-56.9	-46.4	176	179.3	64.5	0	0	0	111.7	G595 I596 V601 W602 I603	G595-L599 PolarHBondContact O-N 3.11Å; I596-L599 PolarHBondContact O-N 3.15Å; L599-V601 VanDerWaalsContact C-N 3.32Å; L599-V601 PolarHBondContact O-N 2.9Å; L599-W602 PolarHBondContact O-N 3.12Å; L599-I603 HydrophobicContact CD1-CD1 4.06Å; L599-I603 HydrophobicContact CD1-CG1 4.47Å; L599-I603 HydrophobicContact CG-CD1 3.95Å; L599-I603 WeakPolarHBondContact O-CB 3.47Å; L599-I603 VanDerWaalsContact O-CG1 3.31Å; L599-I603 WeakPolarHBondContact O-CG1 3.38Å; L599-I603 PolarHBondContact O-N 3.38Å
600	L	93.9	Very high	89.6	Confident	34 Å²	34	48.9 Å²	48.9	18%	0.178	25%	0.253	C	S	.	.	H	α-helix	trans	-66.3	-32.7	177.4	-65	174	0	0	0	112.4	F561 N565 V568 I596 G597 A598 G604	F561-L600 WeakPolarHBondContact CE1-O 3.31Å; F561-L600 HydrophobicContact CE2-CD2 3.61Å; F561-L600 HydrophobicContact CZ-CB 4.27Å; F561-L600 HydrophobicContact CZ-CD2 3.5Å; F561-L600 VanDerWaalsContact CZ-CD2 3.5Å; F561-L600 HydrophobicContact CZ-CG 4.49Å; N565-L600 HydrophobicContact CB-CB 3.98Å; N565-L600 HydrophobicContact CB-CD1 4.49Å; N565-L600 PolarHBondContact ND2-O 3.4Å; N565-L600 VanDerWaalsContact ND2-O 3.14Å; V568-L600 HydrophobicContact CG2-CD1 4.49Å; I596-L600 HydrophobicContact CG2-CD1 3.86Å; I596-L600 HydrophobicContact CG2-CG 4.23Å; I596-L600 VanDerWaalsContact O-CG 3.28Å; I596-L600 WeakPolarHBondContact O-CG 3.27Å; I596-L600 PolarHBondContact O-N 3.37Å; G597-L600 PolarHBondContact O-N 2.9Å; A598-L600 VanDerWaalsContact C-N 3.34Å; A598-L600 PolarHBondContact O-N 2.85Å; L600-G604 PolarHBondContact O-N 3.47Å
601	V	93.5	Very high	89.1	Confident	3 Å²	3	50.7 Å²	50.7	2%	0.018	26%	0.26	C	S	.	.	H	α-helix	trans	-64.4	-48.8	173.5	164.8	0	0	0	0	111.1	V214 V217 N565 I569 G597 A598 L599 G604 I605	V214-V601 HydrophobicContact CB-CG1 3.98Å; V214-V601 HydrophobicContact CG1-CG1 4.21Å; V214-V601 HydrophobicContact CG2-CG1 3.6Å; V217-V601 HydrophobicContact CG1-CG2 4.2Å; N565-V601 WeakPolarHBondContact ND2-CA 3.47Å; N565-V601 VanDerWaalsContact ND2-CG2 3.32Å; N565-V601 WeakPolarHBondContact ND2-CG2 3.45Å; N565-V601 PolarHBondContact ND2-N 3.37Å; I569-V601 HydrophobicContact CD1-CG2 3.63Å; I569-V601 HydrophobicContact CG1-CG2 4.36Å; G597-V601 WeakPolarHBondContact O-CB 3.37Å; G597-V601 VanDerWaalsContact O-CG2 3.29Å; G597-V601 WeakPolarHBondContact O-CG2 3.33Å; G597-V601 PolarHBondContact O-N 3.23Å; A598-V601 WeakPolarHBondContact O-CB 3.32Å; A598-V601 PolarHBondContact O-N 3.29Å; A598-V601 VanDerWaalsContact O-N 3.12Å; L599-V601 VanDerWaalsContact C-N 3.32Å; L599-V601 PolarHBondContact O-N 2.9Å; V601-G604 WeakPolarHBondContact O-CA 3.18Å; V601-G604 PolarHBondContact O-N 2.91Å; V601-G604 VanDerWaalsContact O-N 3.12Å; V601-I605 PolarHBondContact O-N 3.23Å
602	W	93.1	Very high	88.4	Confident	139 Å²	139	50.2 Å²	50.2	53%	0.527	26%	0.259	S	S	.	.	H	α-helix	trans	-67.7	-41.1	179.5	-79.7	93.9	0	0	0	112.5	V214 T218 A598 L599 G604 I605	V214-W602 HydrophobicContact CG1-CZ2 4.45Å; T218-W602 HydrophobicContact CG2-CZ2 4.24Å; T218-W602 PolarHBondContact OG1-NE1 2.81Å; T218-W602 VanDerWaalsContact OG1-NE1 3.16Å; A598-W602 VanDerWaalsContact O-CD1 3.29Å; A598-W602 PolarHBondContact O-N 2.87Å; L599-W602 PolarHBondContact O-N 3.12Å; W602-G604 PolarHBondContact O-N 2.92Å; W602-I605 HydrophobicContact CD2-CD1 3.89Å; W602-I605 HydrophobicContact CE3-CD1 3.38Å; W602-I605 HydrophobicContact CH2-CD1 4.42Å; W602-I605 HydrophobicContact CZ3-CD1 3.68Å; W602-I605 WeakPolarHBondContact O-CB 3.25Å; W602-I605 PolarHBondContact O-N 2.91Å
603	I	91.8	Very high	87.3	Confident	61 Å²	61	44.7 Å²	44.7	31%	0.313	24%	0.237	S	C	.	.	H	α-helix	trans	-59.6	-36.4	169.7	-68.2	168.8	0	0	0	110.9	W558 F561 L599 I605 L606	W558-I603 HydrophobicContact CZ3-CG2 4.45Å; F561-I603 HydrophobicContact CE1-CB 4.33Å; F561-I603 HydrophobicContact CE1-CG2 3.9Å; F561-I603 HydrophobicContact CZ-CB 4.09Å; F561-I603 HydrophobicContact CZ-CG2 3.62Å; L599-I603 HydrophobicContact CD1-CD1 4.06Å; L599-I603 HydrophobicContact CD1-CG1 4.47Å; L599-I603 HydrophobicContact CG-CD1 3.95Å; L599-I603 WeakPolarHBondContact O-CB 3.47Å; L599-I603 VanDerWaalsContact O-CG1 3.31Å; L599-I603 WeakPolarHBondContact O-CG1 3.38Å; L599-I603 PolarHBondContact O-N 3.38Å; I603-I605 PolarHBondContact O-N 2.98Å; I603-L606 WeakPolarHBondContact O-CB 3.46Å; I603-L606 PolarHBondContact O-N 3.08Å; I603-L606 VanDerWaalsContact O-N 3.13Å
604	G	88.8	Confident	86.2	Confident	5 Å²	5	46.3 Å²	46.3	5%	0.052	25%	0.247	C	C	.	.	H	α-helix	trans	-59.2	-23	175	0	0	0	0	0	114.5	L600 V601 W602 L606 Y607	L600-G604 PolarHBondContact O-N 3.47Å; V601-G604 WeakPolarHBondContact O-CA 3.18Å; V601-G604 PolarHBondContact O-N 2.91Å; V601-G604 VanDerWaalsContact O-N 3.12Å; W602-G604 PolarHBondContact O-N 2.92Å; G604-L606 VanDerWaalsContact C-N 3.31Å; G604-L606 PolarHBondContact O-N 3.25Å; G604-Y607 WeakPolarHBondContact O-CB 3.29Å; G604-Y607 PolarHBondContact O-N 2.67Å
605	I	88.2	Confident	85.2	Confident	47 Å²	47	51.3 Å²	51.3	24%	0.241	27%	0.273	C	S	.	.	H	α-helix	trans	-68.2	-31.4	177.2	-56	175.3	0	0	0	111.5	V214 V601 W602 I603 Y607 Y608 V609	V214-I605 HydrophobicContact CG1-CD1 3.69Å; V214-I605 HydrophobicContact CG1-CG1 4.4Å; V214-I605 HydrophobicContact CG2-CD1 4.17Å; V214-I605 HydrophobicContact CG2-CG1 3.95Å; V601-I605 PolarHBondContact O-N 3.23Å; W602-I605 HydrophobicContact CD2-CD1 3.89Å; W602-I605 HydrophobicContact CE3-CD1 3.38Å; W602-I605 HydrophobicContact CH2-CD1 4.42Å; W602-I605 HydrophobicContact CZ3-CD1 3.68Å; W602-I605 WeakPolarHBondContact O-CB 3.25Å; W602-I605 PolarHBondContact O-N 2.91Å; I603-I605 PolarHBondContact O-N 2.98Å; I605-Y607 PolarHBondContact O-N 3.3Å; I605-Y607 VanDerWaalsContact O-N 3.12Å; I605-Y608 WeakPolarHBondContact O-CB 3.14Å; I605-Y608 PolarHBondContact O-N 3.03Å; I605-V609 HydrophobicContact CG2-CG2 4.46Å; I605-V609 PolarHBondContact O-N 3.45Å; I605-V609 VanDerWaalsContact O-N 3.15Å
606	L	86.2	Confident	84.6	Confident	79 Å²	79	49.8 Å²	49.8	41%	0.414	26%	0.257	S	S	.	.	H	α-helix	trans	-58.5	-28.6	179.4	-60.8	176.1	0	0	0	112.6	W558 I603 G604 Y608 V609 G610	W558-L606 HydrophobicContact CH2-CB 4.33Å; I603-L606 WeakPolarHBondContact O-CB 3.46Å; I603-L606 PolarHBondContact O-N 3.08Å; I603-L606 VanDerWaalsContact O-N 3.13Å; G604-L606 VanDerWaalsContact C-N 3.31Å; G604-L606 PolarHBondContact O-N 3.25Å; L606-Y608 VanDerWaalsContact C-N 3.32Å; L606-Y608 PolarHBondContact O-N 3.28Å; L606-V609 PolarHBondContact O-N 3.4Å; L606-G610 PolarHBondContact O-N 2.87Å
607	Y	85.4	Confident	84.3	Confident	32 Å²	32	47.4 Å²	47.4	13%	0.125	25%	0.245	C	C	.	.	H	α-helix	trans	-62.6	-36.5	172.6	171.9	-106.4	0	0	0	113	W558 I562 G604 I605 G610 F611	W558-Y607 HydrophobicContact CB-CD2 3.4Å; W558-Y607 HydrophobicContact CB-CE2 3.85Å; W558-Y607 HydrophobicContact CB-CG 3.99Å; W558-Y607 AromaticContact CD1-CD2 3.89Å; W558-Y607 HydrophobicContact CD2-CD2 4.1Å; W558-Y607 HydrophobicContact CD2-CG 4.45Å; W558-Y607 AromaticContact CG-CD2 3.5Å; W558-Y607 HydrophobicContact CG-CD2 3.5Å; W558-Y607 VanDerWaalsContact CG-CD2 3.5Å; W558-Y607 HydrophobicContact CG-CE2 4.25Å; W558-Y607 HydrophobicContact CG-CG 4.2Å; I562-Y607 HydrophobicContact CD1-CD1 4.27Å; G604-Y607 WeakPolarHBondContact O-CB 3.29Å; G604-Y607 PolarHBondContact O-N 2.67Å; I605-Y607 PolarHBondContact O-N 3.3Å; I605-Y607 VanDerWaalsContact O-N 3.12Å; Y607-G610 PolarHBondContact O-N 2.99Å; Y607-F611 HydrophobicContact CD1-CE1 4.41Å; Y607-F611 HydrophobicContact CD1-CZ 4.38Å; Y607-F611 AromaticContact CE1-CE1 3.89Å; Y607-F611 HydrophobicContact CE1-CE1 3.89Å; Y607-F611 AromaticContact CE1-CZ 3.84Å; Y607-F611 HydrophobicContact CE1-CZ 3.84Å; Y607-F611 HydrophobicContact CE2-CE1 4.48Å; Y607-F611 AromaticContact CZ-CE1 3.93Å
608	Y	83.3	Confident	83.9	Confident	36 Å²	36	53.1 Å²	53.1	14%	0.141	28%	0.275	C	S	.	.	H	α-helix	trans	-79.3	-35.7	178.9	-55.2	-57.9	0	0	0	112	L207 Q210 I605 L606 G610 F611	L207-Y608 HydrophobicContact CD1-CD1 3.43Å; L207-Y608 VanDerWaalsContact CD1-CD1 3.43Å; L207-Y608 HydrophobicContact CD1-CE1 3.71Å; L207-Y608 HydrophobicContact CD1-CG 3.92Å; Q210-Y608 HydrophobicContact CB-CE2 4.04Å; Q210-Y608 VanDerWaalsContact CB-OH 3.3Å; Q210-Y608 WeakPolarHBondContact CB-OH 3.23Å; Q210-Y608 VanDerWaalsContact CD-OH 3.3Å; Q210-Y608 WeakPolarHBondContact CG-OH 3.28Å; Q210-Y608 PolarHBondContact OE1-OH 2.97Å; I605-Y608 WeakPolarHBondContact O-CB 3.14Å; I605-Y608 PolarHBondContact O-N 3.03Å; L606-Y608 VanDerWaalsContact C-N 3.32Å; L606-Y608 PolarHBondContact O-N 3.28Å; Y608-G610 PolarHBondContact O-N 3.38Å; Y608-F611 AromaticContact CD1-CE2 3.65Å; Y608-F611 HydrophobicContact CD1-CE2 3.65Å; Y608-F611 AromaticContact CD1-CZ 3.58Å; Y608-F611 HydrophobicContact CD1-CZ 3.58Å; Y608-F611 HydrophobicContact CE1-CZ 4.23Å; Y608-F611 HydrophobicContact CG-CE2 4.47Å; Y608-F611 WeakPolarHBondContact O-CB 3.3Å; Y608-F611 WeakPolarHBondContact O-CD2 3.46Å; Y608-F611 VanDerWaalsContact O-CG 3.32Å; Y608-F611 WeakPolarHBondContact O-CG 3.45Å; Y608-F611 PolarHBondContact O-N 2.73Å; Y608-F611 VanDerWaalsContact O-N 3.11Å
609	V	82.5	Confident	83.6	Confident	65 Å²	65	54.5 Å²	54.5	39%	0.394	28%	0.281	S	S	.	.	H	α-helix	trans	-57.2	-37.5	168.8	-178.8	0	0	0	0	110.3	I605 L606 F611 S612 N615	I605-V609 HydrophobicContact CG2-CG2 4.46Å; I605-V609 PolarHBondContact O-N 3.45Å; I605-V609 VanDerWaalsContact O-N 3.15Å; L606-V609 PolarHBondContact O-N 3.4Å; V609-F611 PolarHBondContact O-N 3.03Å; V609-S612 PolarHBondContact O-N 3.11Å; V609-N615 HydrophobicContact CG1-CB 3.98Å
610	G	76.4	Confident	83.1	Confident	22 Å²	22	53.6 Å²	53.6	23%	0.227	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	1.6	174	0	0	0	0	0	117.1	L606 Y607 Y608	L606-G610 PolarHBondContact O-N 2.87Å; Y607-G610 PolarHBondContact O-N 2.99Å; Y608-G610 PolarHBondContact O-N 3.38Å
611	F	77.3	Confident	82.9	Confident	40 Å²	40	52.3 Å²	52.3	18%	0.175	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-31	172.7	-63.9	-16.2	0	0	0	113.8	P193 L207 Y607 Y608 V609	P193-F611 HydrophobicContact CB-CE2 4.34Å; P193-F611 HydrophobicContact CG-CD2 4.2Å; P193-F611 HydrophobicContact CG-CE1 4.14Å; P193-F611 HydrophobicContact CG-CE2 3.52Å; P193-F611 HydrophobicContact CG-CZ 3.48Å; P193-F611 VanDerWaalsContact CG-CZ 3.48Å; L207-F611 HydrophobicContact CD1-CE2 4.32Å; Y607-F611 HydrophobicContact CD1-CE1 4.41Å; Y607-F611 HydrophobicContact CD1-CZ 4.38Å; Y607-F611 AromaticContact CE1-CE1 3.89Å; Y607-F611 HydrophobicContact CE1-CE1 3.89Å; Y607-F611 AromaticContact CE1-CZ 3.84Å; Y607-F611 HydrophobicContact CE1-CZ 3.84Å; Y607-F611 HydrophobicContact CE2-CE1 4.48Å; Y607-F611 AromaticContact CZ-CE1 3.93Å; Y608-F611 AromaticContact CD1-CE2 3.65Å; Y608-F611 HydrophobicContact CD1-CE2 3.65Å; Y608-F611 AromaticContact CD1-CZ 3.58Å; Y608-F611 HydrophobicContact CD1-CZ 3.58Å; Y608-F611 HydrophobicContact CE1-CZ 4.23Å; Y608-F611 HydrophobicContact CG-CE2 4.47Å; Y608-F611 WeakPolarHBondContact O-CB 3.3Å; Y608-F611 WeakPolarHBondContact O-CD2 3.46Å; Y608-F611 VanDerWaalsContact O-CG 3.32Å; Y608-F611 WeakPolarHBondContact O-CG 3.45Å; Y608-F611 PolarHBondContact O-N 2.73Å; Y608-F611 VanDerWaalsContact O-N 3.11Å; V609-F611 PolarHBondContact O-N 3.03Å
612	S	74.9	Confident	82.7	Confident	45 Å²	45	55.9 Å²	55.9	32%	0.315	28%	0.282	S	S	.	.	S	Bend	trans	-79.8	132.5	164.8	170.9	0	0	0	0	107.8	V609 S616	V609-S612 PolarHBondContact O-N 3.11Å; S612-S616 WeakPolarHBondContact O-CB 3.4Å; S612-S616 PolarHBondContact O-N 2.88Å; S612-S616 PolarHBondContact O-OG 3.2Å
613	Y	67.4	Low	82.5	Confident	35 Å²	35	52.3 Å²	52.3	14%	0.137	28%	0.278	C	S	.	.	S	Bend	trans	-71.2	-41.4	-176	-172.9	-109.7	0	0	0	111.1	S616 M729 Q730 H733 G734	Y613-S616 WeakPolarHBondContact O-CB 3.43Å; Y613-S616 PolarHBondContact O-N 3.47Å; Y613-S616 VanDerWaalsContact O-N 3.12Å; Y613-S616 PolarHBondContact O-OG 3.06Å; Y613-M729 PolarHBondContact OH-O 3.07Å; Y613-Q730 HydrophobicContact CD1-CG 4.09Å; Y613-Q730 HydrophobicContact CE1-CB 4.1Å; Y613-Q730 HydrophobicContact CE1-CG 3.48Å; Y613-Q730 VanDerWaalsContact CE1-CG 3.48Å; Y613-Q730 WeakPolarHBondContact CE1-O 3.37Å; Y613-Q730 WeakPolarHBondContact OH-CA 3.35Å; Y613-H733 AromaticContact CD1-CE1 3.79Å; Y613-H733 AromaticContact CD1-ND1 3.31Å; Y613-H733 VanDerWaalsContact CD1-ND1 3.31Å; Y613-H733 WeakPolarHBondContact CD1-ND1 3.37Å; Y613-H733 HydrophobicContact CE1-CB 4.49Å; Y613-H733 AromaticContact CE1-ND1 3.43Å; Y613-H733 WeakPolarHBondContact CE1-ND1 3.46Å; Y613-H733 AromaticContact CG-ND1 3.94Å; Y613-H733 VanDerWaalsContact CZ-C 3.48Å; Y613-G734 WeakPolarHBondContact OH-CA 3.48Å; Y613-G734 PolarHBondContact OH-N 2.84Å
614	D	69.8	Low	82.3	Confident	91 Å²	91	54.2 Å²	54.2	49%	0.487	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-71.6	-40.5	-177.9	-49.5	-64.8	0	0	0	111.6	S616 L617 Q730	D614-S616 PolarHBondContact O-N 2.68Å; D614-L617 WeakPolarHBondContact O-CB 3.48Å; D614-L617 PolarHBondContact O-N 2.93Å; D614-Q730 PolarHBondContact OD1-NE2 3.48Å
615	N	72	Confident	82.5	Confident	110 Å²	110	54.3 Å²	54.3	59%	0.588	28%	0.281	S	S	*	.	G	3₁₀ helix	trans	-69.4	-13.3	173	-56.2	-6.6	0	0	0	112.6	V609	V609-N615 HydrophobicContact CG1-CB 3.98Å
616	S	80.5	Confident	82.7	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.007	29%	0.289	C	S	.	.	G	3₁₀ helix	trans	-88.6	1.4	178.3	77	0	0	0	0	114.4	S612 Y613 D614 L618 I619 R620	S612-S616 WeakPolarHBondContact O-CB 3.4Å; S612-S616 PolarHBondContact O-N 2.88Å; S612-S616 PolarHBondContact O-OG 3.2Å; Y613-S616 WeakPolarHBondContact O-CB 3.43Å; Y613-S616 PolarHBondContact O-N 3.47Å; Y613-S616 VanDerWaalsContact O-N 3.12Å; Y613-S616 PolarHBondContact O-OG 3.06Å; D614-S616 PolarHBondContact O-N 2.68Å; S616-L618 PolarHBondContact O-N 3.48Å; S616-I619 VanDerWaalsContact O-CG2 3.31Å; S616-I619 WeakPolarHBondContact O-CG2 3.49Å; S616-I619 PolarHBondContact O-N 3.41Å; S616-R620 WeakPolarHBondContact O-CB 3.32Å; S616-R620 VanDerWaalsContact O-CG 3.22Å; S616-R620 WeakPolarHBondContact O-CG 3.29Å; S616-R620 PolarHBondContact O-N 2.92Å; S616-R620 PolarHBondContact OG-NE 3.21Å
617	L	85.6	Confident	83	Confident	36 Å²	36	54.3 Å²	54.3	19%	0.188	28%	0.284	C	S	.	.	H	α-helix	trans	-54	-55.5	179.2	-178.6	55	0	0	0	111.5	D614 I619 R620 T621 Y723 V726	D614-L617 WeakPolarHBondContact O-CB 3.48Å; D614-L617 PolarHBondContact O-N 2.93Å; L617-I619 PolarHBondContact O-N 3.08Å; L617-R620 PolarHBondContact O-N 2.9Å; L617-R620 VanDerWaalsContact O-N 3.16Å; L617-T621 PolarHBondContact O-N 3.25Å; L617-T621 PolarHBondContact O-OG1 3.11Å; L617-T621 VanDerWaalsContact O-OG1 3.12Å; L617-Y723 HydrophobicContact CD1-CD2 4.47Å; L617-Y723 HydrophobicContact CD1-CE2 4.24Å; L617-Y723 HydrophobicContact CD2-CE2 3.75Å; L617-Y723 HydrophobicContact CG-CE2 4.02Å; L617-V726 HydrophobicContact CD1-CB 4.42Å; L617-V726 HydrophobicContact CD1-CG1 3.68Å
618	L	85.6	Confident	83.3	Confident	123 Å²	123	54 Å²	54	64%	0.644	29%	0.291	S	S	*	.	H	α-helix	trans	-53.7	-52	-179.7	179.3	65.1	0	0	0	112.9	S616 R620 T621 I622	S616-L618 PolarHBondContact O-N 3.48Å; L618-R620 VanDerWaalsContact C-N 3.29Å; L618-R620 PolarHBondContact O-N 3.38Å; L618-T621 PolarHBondContact O-N 2.93Å; L618-I622 HydrophobicContact CD1-CD1 4.06Å; L618-I622 HydrophobicContact CG-CD1 4.02Å; L618-I622 WeakPolarHBondContact O-CG1 3.33Å; L618-I622 PolarHBondContact O-N 3.32Å
619	I	84.9	Confident	83.8	Confident	32 Å²	32	53.2 Å²	53.2	16%	0.164	29%	0.289	C	S	.	.	H	α-helix	trans	-69.4	-28.2	-176.9	-169.5	58.4	0	0	0	112.4	W558 S616 L617 S623	W558-I619 HydrophobicContact CH2-CD1 4.16Å; W558-I619 HydrophobicContact CH2-CG1 4.5Å; W558-I619 HydrophobicContact CZ2-CD1 3.92Å; W558-I619 HydrophobicContact CZ2-CG1 3.94Å; S616-I619 VanDerWaalsContact O-CG2 3.31Å; S616-I619 WeakPolarHBondContact O-CG2 3.49Å; S616-I619 PolarHBondContact O-N 3.41Å; L617-I619 PolarHBondContact O-N 3.08Å; I619-S623 VanDerWaalsContact O-CB 3.3Å; I619-S623 WeakPolarHBondContact O-CB 3.41Å; I619-S623 PolarHBondContact O-N 3.48Å; I619-S623 PolarHBondContact O-OG 2.63Å
620	R	83.5	Confident	84.3	Confident	89 Å²	89	54.5 Å²	54.5	34%	0.336	29%	0.293	S	S	.	.	H	α-helix	trans	-72.6	-44.7	172.9	-73.7	173.2	-171.9	-84.8	-4.1	111.7	S616 L617 L618 I622 S623 R624 V726	S616-R620 WeakPolarHBondContact O-CB 3.32Å; S616-R620 VanDerWaalsContact O-CG 3.22Å; S616-R620 WeakPolarHBondContact O-CG 3.29Å; S616-R620 PolarHBondContact O-N 2.92Å; S616-R620 PolarHBondContact OG-NE 3.21Å; L617-R620 PolarHBondContact O-N 2.9Å; L617-R620 VanDerWaalsContact O-N 3.16Å; L618-R620 VanDerWaalsContact C-N 3.29Å; L618-R620 PolarHBondContact O-N 3.38Å; R620-I622 PolarHBondContact O-N 3.19Å; R620-S623 PolarHBondContact O-N 2.96Å; R620-R624 VanDerWaalsContact O-CB 3.24Å; R620-R624 WeakPolarHBondContact O-CB 3.47Å; R620-R624 PolarHBondContact O-N 3.34Å; R620-V726 HydrophobicContact CB-CG1 3.55Å; R620-V726 HydrophobicContact CB-CG2 4.27Å
621	T	90.4	Very high	85.1	Confident	8 Å²	8	60 Å²	60	5%	0.049	31%	0.307	C	S	.	.	H	α-helix	trans	-56.3	-48.9	173.6	-61.9	0	0	0	0	110.9	L617 L618 S623 R624 S625 I719 Y723	L617-T621 PolarHBondContact O-N 3.25Å; L617-T621 PolarHBondContact O-OG1 3.11Å; L617-T621 VanDerWaalsContact O-OG1 3.12Å; L618-T621 PolarHBondContact O-N 2.93Å; T621-S623 PolarHBondContact O-N 3.04Å; T621-R624 PolarHBondContact O-N 3.48Å; T621-S625 WeakPolarHBondContact O-CB 3.21Å; T621-S625 PolarHBondContact O-N 3.46Å; T621-S625 PolarHBondContact O-OG 3.43Å; T621-I719 HydrophobicContact CG2-CG2 4.39Å; T621-Y723 HydrophobicContact CG2-CD2 4.37Å
622	I	90	Very high	85.9	Confident	77 Å²	77	60.2 Å²	60.2	40%	0.395	31%	0.308	S	S	.	.	H	α-helix	trans	-59	-49	174.9	-67	166.3	0	0	0	111	L618 R620 R624 S625 I626	L618-I622 HydrophobicContact CD1-CD1 4.06Å; L618-I622 HydrophobicContact CG-CD1 4.02Å; L618-I622 WeakPolarHBondContact O-CG1 3.33Å; L618-I622 PolarHBondContact O-N 3.32Å; R620-I622 PolarHBondContact O-N 3.19Å; I622-R624 PolarHBondContact O-N 3.15Å; I622-S625 PolarHBondContact O-N 2.87Å; I622-S625 PolarHBondContact O-OG 3.14Å; I622-S625 VanDerWaalsContact O-OG 3.11Å; I622-I626 HydrophobicContact CG2-CD1 4.08Å; I622-I626 VanDerWaalsContact O-CG1 3.27Å; I622-I626 WeakPolarHBondContact O-CG1 3.26Å; I622-I626 PolarHBondContact O-N 3.02Å; I622-I626 VanDerWaalsContact O-N 3.15Å
623	S	87.5	Confident	86.8	Confident	64 Å²	64	60.2 Å²	60.2	45%	0.448	31%	0.307	S	S	.	.	H	α-helix	trans	-62.2	-31.3	179.2	-59.2	0	0	0	0	112.8	I619 R620 T621	I619-S623 VanDerWaalsContact O-CB 3.3Å; I619-S623 WeakPolarHBondContact O-CB 3.41Å; I619-S623 PolarHBondContact O-N 3.48Å; I619-S623 PolarHBondContact O-OG 2.63Å; R620-S623 PolarHBondContact O-N 2.96Å; T621-S623 PolarHBondContact O-N 3.04Å
624	R	88.5	Confident	88.1	Confident	102 Å²	102	61.5 Å²	61.5	39%	0.385	32%	0.318	S	S	.	.	H	α-helix	trans	-82.7	-30.8	-178.9	-176.1	60.2	-170.2	78.8	1.9	113	R620 T621 I622 A722 E725 V726	R620-R624 VanDerWaalsContact O-CB 3.24Å; R620-R624 WeakPolarHBondContact O-CB 3.47Å; R620-R624 PolarHBondContact O-N 3.34Å; T621-R624 PolarHBondContact O-N 3.48Å; I622-R624 PolarHBondContact O-N 3.15Å; R624-A722 HydrophobicContact CB-CB 4.29Å; R624-A722 HydrophobicContact CG-CB 4.12Å; R624-E725 IonicContact CZ-OE1 3.22Å; R624-E725 VanDerWaalsContact CZ-OE1 3.26Å; R624-E725 IonicContact CZ-OE2 3.53Å; R624-E725 IonicContact NE-OE1 2.82Å; R624-E725 PolarHBondContact NE-OE1 2.95Å; R624-E725 IonicContact NE-OE2 3.75Å; R624-E725 PolarHBondContact NE-OE2 3.48Å; R624-E725 VanDerWaalsContact NE-OE2 3.15Å; R624-E725 IonicContact NH1-OE2 2.74Å; R624-E725 IonicContact NH2-OE1 3.17Å; R624-E725 PolarHBondContact NH2-OE1 3.2Å; R624-E725 IonicContact NH2-OE2 3.45Å; R624-E725 PolarHBondContact NH2-OE2 3.42Å; R624-V726 HydrophobicContact CB-CG2 3.82Å; R624-V726 HydrophobicContact CG-CG2 4.03Å
625	S	93.7	Very high	89.2	Confident	7 Å²	7	60.8 Å²	60.8	5%	0.049	32%	0.32	C	S	.	.	H	α-helix	trans	-78.9	-34.3	178.1	67.3	0	0	0	0	112.8	T621 I622 P627 G628 L629	T621-S625 WeakPolarHBondContact O-CB 3.21Å; T621-S625 PolarHBondContact O-N 3.46Å; T621-S625 PolarHBondContact O-OG 3.43Å; I622-S625 PolarHBondContact O-N 2.87Å; I622-S625 PolarHBondContact O-OG 3.14Å; I622-S625 VanDerWaalsContact O-OG 3.11Å; S625-P627 VanDerWaalsContact O-N 3.12Å; S625-G628 WeakPolarHBondContact O-CA 3.32Å; S625-G628 PolarHBondContact O-N 3.27Å; S625-L629 WeakPolarHBondContact O-CG 3.47Å; S625-L629 PolarHBondContact O-N 3.12Å; S625-L629 WeakPolarHBondContact OG-CD1 3.49Å
626	I	92.2	Very high	90.3	Very high	79 Å²	79	56.3 Å²	56.3	41%	0.405	30%	0.298	S	S	.	.	H	α-helix	trans	-43	-48.6	-177.6	-80.4	164.5	0	0	0	114.3	I622 G628 L629 L630	I622-I626 HydrophobicContact CG2-CD1 4.08Å; I622-I626 VanDerWaalsContact O-CG1 3.27Å; I622-I626 WeakPolarHBondContact O-CG1 3.26Å; I622-I626 PolarHBondContact O-N 3.02Å; I622-I626 VanDerWaalsContact O-N 3.15Å; I626-G628 VanDerWaalsContact C-N 3.33Å; I626-G628 PolarHBondContact O-N 3.22Å; I626-L629 PolarHBondContact O-N 3.33Å; I626-L630 HydrophobicContact CG2-CD1 3.75Å; I626-L630 HydrophobicContact CG2-CG 4.22Å; I626-L630 WeakPolarHBondContact O-CB 3.46Å; I626-L630 VanDerWaalsContact O-CG 3.31Å; I626-L630 WeakPolarHBondContact O-CG 3.36Å; I626-L630 PolarHBondContact O-N 3.21Å
627	P	91.1	Very high	91	Very high	46 Å²	46	59.8 Å²	59.8	30%	0.299	32%	0.316	S	S	.	.	H	α-helix	trans	-65.3	-31.4	-179.9	-22.8	34.9	0	0	0	114.4	S625 R631	S625-P627 VanDerWaalsContact O-N 3.12Å; P627-R631 WeakPolarHBondContact O-CD 3.48Å; P627-R631 WeakPolarHBondContact O-CG 3.48Å
628	G	92	Very high	91.5	Very high	26 Å²	26	63.1 Å²	63.1	27%	0.268	33%	0.333	S	S	.	.	H	α-helix	trans	-74.8	-48.5	173.3	0	0	0	0	0	111.2	S625 I626 L630 R631 F632	S625-G628 WeakPolarHBondContact O-CA 3.32Å; S625-G628 PolarHBondContact O-N 3.27Å; I626-G628 VanDerWaalsContact C-N 3.33Å; I626-G628 PolarHBondContact O-N 3.22Å; G628-L630 PolarHBondContact O-N 3.23Å; G628-R631 PolarHBondContact O-N 3.36Å; G628-F632 PolarHBondContact O-N 2.8Å
629	L	94.8	Very high	92	Very high	20 Å²	20	61.1 Å²	61.1	11%	0.105	32%	0.323	C	S	.	.	H	α-helix	trans	-60.4	-40.4	179.2	-65	177.7	0	0	0	112.6	S625 I626 R631 F632 C633 F715 I718 I719	S625-L629 WeakPolarHBondContact O-CG 3.47Å; S625-L629 PolarHBondContact O-N 3.12Å; S625-L629 WeakPolarHBondContact OG-CD1 3.49Å; I626-L629 PolarHBondContact O-N 3.33Å; L629-R631 PolarHBondContact O-N 2.97Å; L629-F632 PolarHBondContact O-N 3.13Å; L629-C633 WeakPolarHBondContact O-CB 3.5Å; L629-C633 PolarHBondContact O-N 2.95Å; L629-F715 HydrophobicContact CB-CE2 4.36Å; L629-F715 HydrophobicContact CD1-CE1 4.24Å; L629-F715 HydrophobicContact CD1-CZ 4Å; L629-F715 HydrophobicContact CD2-CD1 4.07Å; L629-F715 HydrophobicContact CD2-CD2 3.81Å; L629-F715 HydrophobicContact CD2-CE1 4.03Å; L629-F715 HydrophobicContact CD2-CE2 3.76Å; L629-F715 HydrophobicContact CD2-CG 3.97Å; L629-F715 HydrophobicContact CD2-CZ 3.87Å; L629-F715 HydrophobicContact CG-CE2 4.44Å; L629-F715 HydrophobicContact CG-CZ 4.36Å; L629-I718 HydrophobicContact CD2-CB 3.81Å; L629-I718 HydrophobicContact CD2-CD1 4.41Å; L629-I718 HydrophobicContact CD2-CG2 3.56Å; L629-I718 HydrophobicContact CG-CG2 3.93Å; L629-I719 HydrophobicContact CD1-CD1 4.28Å; L629-I719 HydrophobicContact CD1-CG1 3.92Å; L629-I719 HydrophobicContact CD2-CG1 4.17Å
630	L	92.6	Very high	92.5	Very high	92 Å²	92	60.4 Å²	60.4	48%	0.482	32%	0.318	S	S	.	.	H	α-helix	trans	-63.8	-41.2	177.4	-75.9	174.1	0	0	0	112.3	I626 G628 V634	I626-L630 HydrophobicContact CG2-CD1 3.75Å; I626-L630 HydrophobicContact CG2-CG 4.22Å; I626-L630 WeakPolarHBondContact O-CB 3.46Å; I626-L630 VanDerWaalsContact O-CG 3.31Å; I626-L630 WeakPolarHBondContact O-CG 3.36Å; I626-L630 PolarHBondContact O-N 3.21Å; G628-L630 PolarHBondContact O-N 3.23Å; L630-V634 VanDerWaalsContact O-CG2 3.32Å; L630-V634 WeakPolarHBondContact O-CG2 3.5Å; L630-V634 PolarHBondContact O-N 2.89Å; L630-V634 VanDerWaalsContact O-N 3.14Å
631	R	93.3	Very high	93.1	Very high	137 Å²	137	60.6 Å²	60.6	52%	0.517	32%	0.322	S	S	.	.	H	α-helix	trans	-64.7	-43.5	176.6	-69.7	170.8	178.6	168.2	-2.1	111.3	F105 P627 G628 L629	F105-R631 PolarHBondContact O-NH2 2.61Å; P627-R631 WeakPolarHBondContact O-CD 3.48Å; P627-R631 WeakPolarHBondContact O-CG 3.48Å; G628-R631 PolarHBondContact O-N 3.36Å; L629-R631 PolarHBondContact O-N 2.97Å
632	F	94.3	Very high	93.4	Very high	44 Å²	44	63 Å²	63	19%	0.193	34%	0.342	C	S	.	.	H	α-helix	trans	-68.2	-45.6	177.7	178.3	-104.9	0	0	0	112.6	G628 L629 V634 C635 A636 V711 L714 F715 I718	G628-F632 PolarHBondContact O-N 2.8Å; L629-F632 PolarHBondContact O-N 3.13Å; F632-V634 VanDerWaalsContact C-N 3.29Å; F632-V634 PolarHBondContact O-N 3.28Å; F632-C635 WeakPolarHBondContact O-CB 3.43Å; F632-C635 PolarHBondContact O-N 3.03Å; F632-A636 PolarHBondContact O-N 3.43Å; F632-V711 HydrophobicContact CE1-CG1 3.86Å; F632-V711 WeakPolarHBondContact CE1-O 3.38Å; F632-V711 HydrophobicContact CZ-CB 4.46Å; F632-V711 HydrophobicContact CZ-CG1 3.8Å; F632-V711 WeakPolarHBondContact CZ-O 3.31Å; F632-L714 HydrophobicContact CE1-CB 4.36Å; F632-L714 HydrophobicContact CE2-CB 3.85Å; F632-L714 HydrophobicContact CE2-CD1 3.87Å; F632-L714 HydrophobicContact CZ-CB 3.6Å; F632-L714 HydrophobicContact CZ-CD1 4.15Å; F632-F715 HydrophobicContact CD1-CD2 4.03Å; F632-F715 HydrophobicContact CE1-CB 4.13Å; F632-F715 HydrophobicContact CE1-CD2 4.2Å; F632-I718 HydrophobicContact CB-CD1 3.74Å; F632-I718 HydrophobicContact CD1-CD1 4.15Å; F632-I718 HydrophobicContact CD2-CD1 4.22Å; F632-I718 HydrophobicContact CG-CD1 3.77Å
633	C	93.1	Very high	93.8	Very high	45 Å²	45	60.6 Å²	60.6	30%	0.304	33%	0.329	S	S	.	.	H	α-helix	trans	-58.6	-39.5	179.4	-177.8	0	0	0	0	111.8	L629 C635 A636 L637	L629-C633 WeakPolarHBondContact O-CB 3.5Å; L629-C633 PolarHBondContact O-N 2.95Å; C633-C635 VanDerWaalsContact C-N 3.32Å; C633-C635 PolarHBondContact O-N 2.92Å; C633-A636 PolarHBondContact O-N 3.34Å; C633-L637 WeakPolarHBondContact O-CB 3.31Å; C633-L637 VanDerWaalsContact O-CG 3.27Å; C633-L637 WeakPolarHBondContact O-CG 3.36Å; C633-L637 PolarHBondContact O-N 3.14Å
634	V	94.4	Very high	94.2	Very high	62 Å²	62	57.5 Å²	57.5	38%	0.376	31%	0.308	S	S	.	.	H	α-helix	trans	-56.4	-43.5	173.2	161.7	0	0	0	0	112.3	M98 L630 F632 I638	M98-V634 HydrophobicContact CE-CG1 3.23Å; L630-V634 VanDerWaalsContact O-CG2 3.32Å; L630-V634 WeakPolarHBondContact O-CG2 3.5Å; L630-V634 PolarHBondContact O-N 2.89Å; L630-V634 VanDerWaalsContact O-N 3.14Å; F632-V634 VanDerWaalsContact C-N 3.29Å; F632-V634 PolarHBondContact O-N 3.28Å; V634-I638 WeakPolarHBondContact O-CG1 3.46Å; V634-I638 PolarHBondContact O-N 3.44Å
635	C	93.5	Very high	94.6	Very high	77 Å²	77	57 Å²	57	52%	0.52	31%	0.312	S	S	.	.	H	α-helix	trans	-69.7	-42.4	176.1	-62.9	0	0	0	0	112.1	F632 C633 L637 I638 L639	F632-C635 WeakPolarHBondContact O-CB 3.43Å; F632-C635 PolarHBondContact O-N 3.03Å; C633-C635 VanDerWaalsContact C-N 3.32Å; C633-C635 PolarHBondContact O-N 2.92Å; C635-L637 PolarHBondContact O-N 3.11Å; C635-I638 PolarHBondContact O-N 3.41Å; C635-L639 PolarHBondContact O-N 3.14Å
636	A	95	Very high	94.7	Very high	15 Å²	15	59.2 Å²	59.2	12%	0.124	33%	0.327	C	S	.	.	H	α-helix	trans	-63.2	-38.6	177.9	0	0	0	0	0	112.5	F632 C633 L639 F640 V711	F632-A636 PolarHBondContact O-N 3.43Å; C633-A636 PolarHBondContact O-N 3.34Å; A636-L639 PolarHBondContact O-N 3.14Å; A636-F640 WeakPolarHBondContact O-CB 3.49Å; A636-F640 PolarHBondContact O-N 3.2Å; A636-V711 HydrophobicContact CB-CG1 3.84Å
637	L	95	Very high	94.8	Very high	75 Å²	75	55.4 Å²	55.4	39%	0.393	31%	0.308	S	S	.	.	H	α-helix	trans	-65.8	-36.8	176.8	-76	171.8	0	0	0	112.5	C633 C635 L639 F640 F641	C633-L637 WeakPolarHBondContact O-CB 3.31Å; C633-L637 VanDerWaalsContact O-CG 3.27Å; C633-L637 WeakPolarHBondContact O-CG 3.36Å; C633-L637 PolarHBondContact O-N 3.14Å; C635-L637 PolarHBondContact O-N 3.11Å; L637-L639 VanDerWaalsContact C-N 3.33Å; L637-L639 PolarHBondContact O-N 2.94Å; L637-F640 PolarHBondContact O-N 3.03Å; L637-F641 HydrophobicContact CB-CD2 4.45Å; L637-F641 HydrophobicContact CB-CE2 4.39Å; L637-F641 HydrophobicContact CD2-CE2 4.38Å; L637-F641 WeakPolarHBondContact O-CB 3.5Å; L637-F641 WeakPolarHBondContact O-CD2 3.34Å; L637-F641 PolarHBondContact O-N 3.49Å
638	I	96.1	Very high	95.1	Very high	106 Å²	106	58 Å²	58	54%	0.544	31%	0.311	S	S	.	.	H	α-helix	trans	-60.9	-45	174.7	-68.6	164.6	0	0	0	110.3	V634 C635 A642	V634-I638 WeakPolarHBondContact O-CG1 3.46Å; V634-I638 PolarHBondContact O-N 3.44Å; C635-I638 PolarHBondContact O-N 3.41Å; I638-A642 WeakPolarHBondContact O-CB 3.46Å; I638-A642 PolarHBondContact O-N 2.96Å; I638-A642 VanDerWaalsContact O-N 3.09Å
639	L	95.6	Very high	95.2	Very high	80 Å²	80	61.8 Å²	61.8	42%	0.419	33%	0.329	S	S	.	.	H	α-helix	trans	-63.5	-47	174.1	-65.2	175	0	0	0	111	C635 A636 L637 F641 A642 F643 F707	C635-L639 PolarHBondContact O-N 3.14Å; A636-L639 PolarHBondContact O-N 3.14Å; L637-L639 VanDerWaalsContact C-N 3.33Å; L637-L639 PolarHBondContact O-N 2.94Å; L639-F641 VanDerWaalsContact C-N 3.34Å; L639-F641 PolarHBondContact O-N 2.83Å; L639-A642 WeakPolarHBondContact O-CB 3.46Å; L639-A642 PolarHBondContact O-N 2.94Å; L639-A642 VanDerWaalsContact O-N 3.1Å; L639-F643 WeakPolarHBondContact O-CD2 3.31Å; L639-F643 PolarHBondContact O-N 2.88Å; L639-F707 HydrophobicContact CB-CZ 3.92Å
640	F	96.8	Very high	95.2	Very high	18 Å²	18	63.1 Å²	63.1	8%	0.079	34%	0.338	C	S	.	.	H	α-helix	trans	-59.7	-43	-178	-178.5	-95.6	0	0	0	112.1	A636 L637 F643 S644 V665 L668 I672 F703 F707	A636-F640 WeakPolarHBondContact O-CB 3.49Å; A636-F640 PolarHBondContact O-N 3.2Å; L637-F640 PolarHBondContact O-N 3.03Å; F640-F643 PolarHBondContact O-N 2.76Å; F640-S644 WeakPolarHBondContact O-CB 3.34Å; F640-S644 PolarHBondContact O-N 2.83Å; F640-S644 PolarHBondContact O-OG 2.81Å; F640-V665 HydrophobicContact CE1-CB 4.4Å; F640-V665 HydrophobicContact CE1-CG1 3.97Å; F640-V665 HydrophobicContact CE1-CG2 4.16Å; F640-V665 HydrophobicContact CZ-CG1 4.26Å; F640-L668 HydrophobicContact CE2-CB 3.66Å; F640-L668 HydrophobicContact CZ-CB 3.88Å; F640-I672 HydrophobicContact CD2-CD1 3.8Å; F640-I672 HydrophobicContact CE2-CD1 3.71Å; F640-F703 HydrophobicContact CD2-CE2 4.16Å; F640-F703 HydrophobicContact CD2-CZ 4.21Å; F640-F703 HydrophobicContact CE2-CE2 4.43Å; F640-F703 HydrophobicContact CE2-CZ 4.11Å; F640-F707 HydrophobicContact CB-CE1 3.99Å; F640-F707 HydrophobicContact CB-CZ 3.96Å; F640-F707 HydrophobicContact CD2-CE1 4.19Å; F640-F707 HydrophobicContact CD2-CZ 4.44Å
641	F	96.2	Very high	95.2	Very high	92 Å²	92	58.7 Å²	58.7	40%	0.404	32%	0.315	S	S	.	.	H	α-helix	trans	-69.1	-34.3	174.9	-74.9	-56	0	0	0	113	L637 L639 S644 L645 F661	L637-F641 HydrophobicContact CB-CD2 4.45Å; L637-F641 HydrophobicContact CB-CE2 4.39Å; L637-F641 HydrophobicContact CD2-CE2 4.38Å; L637-F641 WeakPolarHBondContact O-CB 3.5Å; L637-F641 WeakPolarHBondContact O-CD2 3.34Å; L637-F641 PolarHBondContact O-N 3.49Å; L639-F641 VanDerWaalsContact C-N 3.34Å; L639-F641 PolarHBondContact O-N 2.83Å; F641-S644 PolarHBondContact O-N 3.25Å; F641-L645 WeakPolarHBondContact O-CB 3.24Å; F641-L645 WeakPolarHBondContact O-CG 3.2Å; F641-L645 PolarHBondContact O-N 2.91Å; F641-F661 HydrophobicContact CD1-CE2 4.5Å; F641-F661 AromaticContact CD1-CZ 3.82Å; F641-F661 HydrophobicContact CD1-CZ 3.82Å; F641-F661 AromaticContact CE1-CZ 3.91Å; F641-F661 HydrophobicContact CE1-CZ 3.91Å
642	A	96.6	Very high	95.1	Very high	58 Å²	58	52.8 Å²	52.8	48%	0.479	30%	0.297	S	S	.	.	H	α-helix	trans	-62.8	-44.7	173.3	0	0	0	0	0	111.7	I638 L639 C646	I638-A642 WeakPolarHBondContact O-CB 3.46Å; I638-A642 PolarHBondContact O-N 2.96Å; I638-A642 VanDerWaalsContact O-N 3.09Å; L639-A642 WeakPolarHBondContact O-CB 3.46Å; L639-A642 PolarHBondContact O-N 2.94Å; L639-A642 VanDerWaalsContact O-N 3.1Å; A642-C646 VanDerWaalsContact O-CB 3.31Å; A642-C646 WeakPolarHBondContact O-CB 3.35Å; A642-C646 PolarHBondContact O-N 2.83Å; A642-C646 VanDerWaalsContact O-N 3.14Å
643	F	96.9	Very high	94.9	Very high	27 Å²	27	55.5 Å²	55.5	12%	0.118	32%	0.318	C	S	.	.	H	α-helix	trans	-63.7	-42.2	171.5	-84.8	-92	0	0	0	111.9	L639 F640 C646 G647 L668 F699 L702 F703 L706 F707	L639-F643 WeakPolarHBondContact O-CD2 3.31Å; L639-F643 PolarHBondContact O-N 2.88Å; F640-F643 PolarHBondContact O-N 2.76Å; F643-C646 PolarHBondContact O-N 3.47Å; F643-G647 PolarHBondContact O-N 3.44Å; F643-L668 HydrophobicContact CB-CD1 4.38Å; F643-F699 HydrophobicContact CB-CE2 4.42Å; F643-F699 HydrophobicContact CB-CZ 4.34Å; F643-F699 HydrophobicContact CD1-CD2 4.14Å; F643-F699 AromaticContact CD1-CE2 3.59Å; F643-F699 HydrophobicContact CD1-CE2 3.59Å; F643-F699 AromaticContact CD1-CZ 3.93Å; F643-F699 HydrophobicContact CD1-CZ 3.93Å; F643-F699 HydrophobicContact CE1-CD2 4.49Å; F643-F699 HydrophobicContact CE1-CE2 4.37Å; F643-F699 HydrophobicContact CG-CE2 4.42Å; F643-F699 WeakPolarHBondContact O-CZ 3.42Å; F643-L702 HydrophobicContact CE1-CD2 3.96Å; F643-L702 HydrophobicContact CE1-CG 4.25Å; F643-L702 HydrophobicContact CZ-CD2 3.8Å; F643-L702 HydrophobicContact CZ-CG 4.05Å; F643-F703 HydrophobicContact CB-CD2 3.93Å; F643-F703 HydrophobicContact CB-CE2 4.22Å; F643-F703 HydrophobicContact CD1-CB 3.95Å; F643-F703 AromaticContact CD1-CD2 3.69Å; F643-F703 HydrophobicContact CD1-CD2 3.69Å; F643-F703 HydrophobicContact CD1-CG 4.28Å; F643-F703 HydrophobicContact CD2-CD2 4.39Å; F643-F703 HydrophobicContact CE1-CB 3.94Å; F643-F703 HydrophobicContact CE1-CD2 4.27Å; F643-F703 AromaticContact CG-CD2 3.76Å; F643-F703 HydrophobicContact CG-CD2 3.76Å; F643-F703 HydrophobicContact CG-CE2 4.44Å; F643-L706 HydrophobicContact CE2-CD2 3.77Å; F643-L706 HydrophobicContact CZ-CD2 4.04Å; F643-F707 AromaticContact CD2-CE2 3.98Å; F643-F707 HydrophobicContact CD2-CE2 3.98Å; F643-F707 HydrophobicContact CE2-CE2 4.21Å
644	S	96.5	Very high	94.7	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-60.9	-46.9	179.4	-58.7	0	0	0	0	112.7	F640 F641 W648 T664	F640-S644 WeakPolarHBondContact O-CB 3.34Å; F640-S644 PolarHBondContact O-N 2.83Å; F640-S644 PolarHBondContact O-OG 2.81Å; F641-S644 PolarHBondContact O-N 3.25Å; S644-W648 VanDerWaalsContact O-CB 3.29Å; S644-W648 WeakPolarHBondContact O-CB 3.36Å; S644-W648 PolarHBondContact O-N 3.31Å; S644-T664 WeakPolarHBondContact O-CG2 3.36Å
645	L	96.5	Very high	94.3	Very high	90 Å²	90	55.1 Å²	55.1	47%	0.471	31%	0.305	S	S	.	.	H	α-helix	trans	-66.3	-40.4	178.2	-69.4	170.7	0	0	0	111.8	F641 W648 V649 F661	F641-L645 WeakPolarHBondContact O-CB 3.24Å; F641-L645 WeakPolarHBondContact O-CG 3.2Å; F641-L645 PolarHBondContact O-N 2.91Å; L645-W648 HydrophobicContact CD2-CE3 4.34Å; L645-V649 WeakPolarHBondContact O-CG2 3.37Å; L645-V649 PolarHBondContact O-N 3.3Å; L645-F661 HydrophobicContact CD2-CD2 4.06Å; L645-F661 HydrophobicContact CD2-CE2 3.76Å; L645-F661 HydrophobicContact CG-CE2 4.23Å
646	C	96.2	Very high	93.8	Very high	54 Å²	54	55.3 Å²	55.3	37%	0.365	30%	0.3	S	S	.	.	H	α-helix	trans	-66.5	-46.7	177.6	-171.9	0	0	0	0	111.9	A642 F643 V650 F699	A642-C646 VanDerWaalsContact O-CB 3.31Å; A642-C646 WeakPolarHBondContact O-CB 3.35Å; A642-C646 PolarHBondContact O-N 2.83Å; A642-C646 VanDerWaalsContact O-N 3.14Å; F643-C646 PolarHBondContact O-N 3.47Å; C646-V650 WeakPolarHBondContact O-CB 3.21Å; C646-V650 WeakPolarHBondContact O-CG2 3.28Å; C646-V650 PolarHBondContact O-N 3.41Å; C646-F699 HydrophobicContact CB-CE2 4.22Å
647	G	94.9	Very high	93.5	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-61	-46.6	176.3	0	0	0	0	0	112.2	F643 V649 L651	F643-G647 PolarHBondContact O-N 3.44Å; G647-V649 PolarHBondContact O-N 3.35Å; G647-L651 WeakPolarHBondContact O-CA 3.15Å; G647-L651 VanDerWaalsContact O-CB 3.24Å; G647-L651 WeakPolarHBondContact O-CB 3.29Å; G647-L651 PolarHBondContact O-N 3.48Å
648	W	96.1	Very high	93.4	Very high	100 Å²	100	51.5 Å²	51.5	38%	0.379	28%	0.278	S	S	.	.	H	α-helix	trans	-57.8	-51.1	178.4	177.4	27.3	0	0	0	112	S644 L645 G652 F658 R659 F661 T664	S644-W648 VanDerWaalsContact O-CB 3.29Å; S644-W648 WeakPolarHBondContact O-CB 3.36Å; S644-W648 PolarHBondContact O-N 3.31Å; L645-W648 HydrophobicContact CD2-CE3 4.34Å; W648-G652 VanDerWaalsContact O-CA 3.29Å; W648-G652 WeakPolarHBondContact O-CA 3.33Å; W648-G652 PolarHBondContact O-N 2.81Å; W648-F658 VanDerWaalsContact CD1-O 3.23Å; W648-R659 PolarHBondContact NE1-O 3.3Å; W648-F661 HydrophobicContact CD2-CB 3.95Å; W648-F661 HydrophobicContact CD2-CD2 4.49Å; W648-F661 HydrophobicContact CE3-CB 3.8Å; W648-F661 AromaticContact CE3-CD2 3.84Å; W648-F661 HydrophobicContact CE3-CD2 3.84Å; W648-F661 HydrophobicContact CE3-CG 4.25Å; W648-F661 HydrophobicContact CH2-CB 4.25Å; W648-F661 HydrophobicContact CZ2-CB 4.39Å; W648-F661 HydrophobicContact CZ3-CB 3.96Å; W648-F661 HydrophobicContact CZ3-CD2 4.31Å; W648-F661 HydrophobicContact CZ3-CG 4.43Å; W648-T664 HydrophobicContact CB-CG2 4.3Å
649	V	95.5	Very high	93	Very high	105 Å²	105	52 Å²	52	64%	0.636	27%	0.273	S	S	*	.	H	α-helix	trans	-70.9	-38.3	-175.1	175.5	0	0	0	0	112.4	L645 G647	L645-V649 WeakPolarHBondContact O-CG2 3.37Å; L645-V649 PolarHBondContact O-N 3.3Å; G647-V649 PolarHBondContact O-N 3.35Å
650	V	93.7	Very high	92.8	Very high	48 Å²	48	50.1 Å²	50.1	29%	0.291	27%	0.265	S	S	.	.	H	α-helix	trans	-89.8	-40.5	-174.5	-175.9	0	0	0	0	112.8	C646 F695	C646-V650 WeakPolarHBondContact O-CB 3.21Å; C646-V650 WeakPolarHBondContact O-CG2 3.28Å; C646-V650 PolarHBondContact O-N 3.41Å; V650-F695 HydrophobicContact CB-CD1 4.29Å; V650-F695 HydrophobicContact CB-CE1 3.74Å; V650-F695 HydrophobicContact CB-CZ 4.25Å; V650-F695 HydrophobicContact CG1-CD1 3.48Å; V650-F695 VanDerWaalsContact CG1-CD1 3.48Å; V650-F695 HydrophobicContact CG1-CE1 3.44Å; V650-F695 VanDerWaalsContact CG1-CE1 3.44Å; V650-F695 HydrophobicContact CG1-CG 4.2Å; V650-F695 HydrophobicContact CG1-CZ 4.11Å; V650-F695 HydrophobicContact CG2-CE1 4.24Å; V650-F695 HydrophobicContact CG2-CZ 4.25Å
651	L	92.4	Very high	92.7	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-95.2	-21.5	-176.2	-54.4	179.3	0	0	0	113.1	G647 P653 Y654 N655 F658 I684 F695 F699	G647-L651 WeakPolarHBondContact O-CA 3.15Å; G647-L651 VanDerWaalsContact O-CB 3.24Å; G647-L651 WeakPolarHBondContact O-CB 3.29Å; G647-L651 PolarHBondContact O-N 3.48Å; L651-P653 VanDerWaalsContact C-CD 3.49Å; L651-Y654 CarbonylContact O-C 3.53Å; L651-Y654 PolarHBondContact O-N 3.32Å; L651-N655 PolarHBondContact O-N 2.98Å; L651-F658 HydrophobicContact CB-CB 3.94Å; L651-F658 HydrophobicContact CB-CD1 4.16Å; L651-F658 HydrophobicContact CB-CD2 4.16Å; L651-F658 HydrophobicContact CB-CG 3.81Å; L651-F658 HydrophobicContact CD1-CD1 4.25Å; L651-F658 HydrophobicContact CD1-CD2 4.32Å; L651-F658 HydrophobicContact CD1-CE1 4.05Å; L651-F658 HydrophobicContact CD1-CE2 4.13Å; L651-F658 HydrophobicContact CD1-CG 4.38Å; L651-F658 HydrophobicContact CD1-CZ 3.99Å; L651-I684 HydrophobicContact CD2-CD1 4.27Å; L651-F695 HydrophobicContact CD2-CD1 4.05Å; L651-F695 HydrophobicContact CD2-CE1 4.31Å; L651-F699 HydrophobicContact CD1-CD1 3.79Å; L651-F699 HydrophobicContact CD1-CE1 4Å
652	G	91.3	Very high	92.6	Very high	13 Å²	13	53.6 Å²	53.6	13%	0.134	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-35.6	-176.2	0	0	0	0	0	116.7	W648 Y654 F658	W648-G652 VanDerWaalsContact O-CA 3.29Å; W648-G652 WeakPolarHBondContact O-CA 3.33Å; W648-G652 PolarHBondContact O-N 2.81Å; G652-Y654 VanDerWaalsContact C-N 3.28Å; G652-Y654 PolarHBondContact O-N 2.98Å; G652-F658 WeakPolarHBondContact CA-O 3.39Å
653	P	89.7	Confident	92.3	Very high	100 Å²	100	52 Å²	52	65%	0.649	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-15.3	173.3	-20.1	33.6	0	0	0	114.8	L651	L651-P653 VanDerWaalsContact C-CD 3.49Å
654	Y	88.9	Confident	92.2	Very high	97 Å²	97	50.7 Å²	50.7	38%	0.38	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119	-13.9	-170.5	-57.1	-79.7	0	0	0	113.9	L651 G652 A688 I692	L651-Y654 CarbonylContact O-C 3.53Å; L651-Y654 PolarHBondContact O-N 3.32Å; G652-Y654 VanDerWaalsContact C-N 3.28Å; G652-Y654 PolarHBondContact O-N 2.98Å; Y654-A688 HydrophobicContact CD1-CB 4.25Å; Y654-I692 HydrophobicContact CD2-CD1 4.33Å; Y654-I692 HydrophobicContact CD2-CG2 3.76Å; Y654-I692 HydrophobicContact CE1-CD1 4.19Å; Y654-I692 HydrophobicContact CE2-CD1 3.52Å; Y654-I692 HydrophobicContact CE2-CG1 4.23Å; Y654-I692 HydrophobicContact CE2-CG2 4.11Å; Y654-I692 HydrophobicContact CG-CG2 3.99Å; Y654-I692 VanDerWaalsContact CZ-CD1 3.45Å; Y654-I692 WeakPolarHBondContact OH-CD1 3.17Å
655	N	86.5	Confident	92.1	Very high	2 Å²	2	52.3 Å²	52.3	1%	0.011	27%	0.273	C	S	.	.			trans	-137.1	124	-179.5	-170.8	-32.1	0	0	0	110.6	L651 K657 F658 T680 I683 I684	L651-N655 PolarHBondContact O-N 2.98Å; N655-K657 PolarHBondContact O-N 3.27Å; N655-K657 PolarHBondContact OD1-N 3.28Å; N655-F658 HydrophobicContact CB-CB 4.5Å; N655-F658 HydrophobicContact CB-CD2 3.94Å; N655-F658 PolarHBondContact O-N 3.36Å; N655-T680 PolarHBondContact ND2-O 2.96Å; N655-I683 HydrophobicContact CB-CG2 4.25Å; N655-I684 HydrophobicContact CB-CD1 3.99Å; N655-I684 HydrophobicContact CB-CG1 3.94Å
656	L	84.5	Confident	92	Very high	82 Å²	82	53 Å²	53	43%	0.429	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-55.8	-37.2	-177.7	-64.6	166	0	0	0	112.7	Y259 P260 F658 R659	Y259-L656 PolarHBondContact OH-O 2.83Å; P260-L656 HydrophobicContact CB-CD1 3.78Å; P260-L656 HydrophobicContact CG-CD1 4.32Å; L656-F658 PolarHBondContact O-N 2.84Å; L656-R659 WeakPolarHBondContact O-CB 3.39Å; L656-R659 PolarHBondContact O-N 2.96Å
657	K	88.5	Confident	91.8	Very high	9 Å²	9	50.9 Å²	50.9	4%	0.039	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-70	-14.2	178.2	-64.8	-173	-176.8	-171.2	0	114.3	Y259 N655 S663 T664 C667 D676 T680 I683	Y259-K657 HydrophobicContact CE1-CG 3.83Å; N655-K657 PolarHBondContact O-N 3.27Å; N655-K657 PolarHBondContact OD1-N 3.28Å; K657-S663 CarbonylContact O-C 3.57Å; K657-S663 VanDerWaalsContact O-O 3.11Å; K657-S663 PolarHBondContact O-OG 3.44Å; K657-S663 VanDerWaalsContact O-OG 3.13Å; K657-T664 PolarHBondContact O-N 3.43Å; K657-C667 HydrophobicContact CB-CB 4Å; K657-D676 PolarHBondContact NZ-O 3.35Å; K657-D676 IonicContact NZ-OD1 3.83Å; K657-D676 PolarHBondContact NZ-OD1 2.91Å; K657-D676 IonicContact NZ-OD2 3.5Å; K657-D676 PolarHBondContact NZ-OD2 2.97Å; K657-T680 PolarHBondContact NZ-OG1 3.19Å; K657-I683 HydrophobicContact CG-CD1 4.5Å
658	F	91.6	Very high	91.8	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-107.6	6.2	178.8	-71.8	-93.8	0	0	0	112.4	W648 L651 G652 N655 L656 T660 T664 L668 T680 F699 L700	W648-F658 VanDerWaalsContact CD1-O 3.23Å; L651-F658 HydrophobicContact CB-CB 3.94Å; L651-F658 HydrophobicContact CB-CD1 4.16Å; L651-F658 HydrophobicContact CB-CD2 4.16Å; L651-F658 HydrophobicContact CB-CG 3.81Å; L651-F658 HydrophobicContact CD1-CD1 4.25Å; L651-F658 HydrophobicContact CD1-CD2 4.32Å; L651-F658 HydrophobicContact CD1-CE1 4.05Å; L651-F658 HydrophobicContact CD1-CE2 4.13Å; L651-F658 HydrophobicContact CD1-CG 4.38Å; L651-F658 HydrophobicContact CD1-CZ 3.99Å; G652-F658 WeakPolarHBondContact CA-O 3.39Å; N655-F658 HydrophobicContact CB-CB 4.5Å; N655-F658 HydrophobicContact CB-CD2 3.94Å; N655-F658 PolarHBondContact O-N 3.36Å; L656-F658 PolarHBondContact O-N 2.84Å; F658-T660 VanDerWaalsContact C-N 3.31Å; F658-T660 PolarHBondContact O-N 3.28Å; F658-T664 WeakPolarHBondContact CA-OG1 3.44Å; F658-T664 HydrophobicContact CD1-CG2 3.52Å; F658-T664 HydrophobicContact CE1-CG2 3.78Å; F658-T664 PolarHBondContact O-OG1 3.48Å; F658-L668 HydrophobicContact CE1-CD2 4.21Å; F658-L668 HydrophobicContact CE1-CG 4.33Å; F658-L668 HydrophobicContact CZ-CD2 4.23Å; F658-T680 HydrophobicContact CE2-CG2 3.91Å; F658-F699 HydrophobicContact CE1-CE1 4.17Å; F658-F699 HydrophobicContact CZ-CE1 4.36Å; F658-L700 HydrophobicContact CZ-CD2 4.34Å
659	R	88.4	Confident	91.8	Very high	117 Å²	117	53.1 Å²	53.1	44%	0.442	27%	0.268	S	S	.	.	S	Bend	trans	-63.4	-32.7	-171.5	-177	165.4	58.3	138.4	-7.2	113.8	W648 L656	W648-R659 PolarHBondContact NE1-O 3.3Å; L656-R659 WeakPolarHBondContact O-CB 3.39Å; L656-R659 PolarHBondContact O-N 2.96Å
660	T	91.7	Very high	91.7	Very high	41 Å²	41	49.9 Å²	49.9	25%	0.252	25%	0.25	S	S	.	.	S	Bend	trans	-126.5	160.7	172.5	50	0	0	0	0	112.1	P64 F658 M662 S663 T664	P64-T660 HydrophobicContact CB-CG2 3.58Å; P64-T660 HydrophobicContact CG-CG2 3.34Å; F658-T660 VanDerWaalsContact C-N 3.31Å; F658-T660 PolarHBondContact O-N 3.28Å; T660-M662 PolarHBondContact O-N 2.83Å; T660-S663 PolarHBondContact O-N 2.81Å; T660-S663 WeakPolarHBondContact OG1-CB 3.43Å; T660-T664 WeakPolarHBondContact O-CB 3.19Å; T660-T664 PolarHBondContact O-N 3.01Å; T660-T664 PolarHBondContact O-OG1 3.47Å
661	F	93.9	Very high	91.7	Very high	57 Å²	57	47.8 Å²	47.8	25%	0.25	24%	0.237	C	C	.	.	H	α-helix	trans	-56.3	-45.5	175.7	-177.4	-105.4	0	0	0	113.2	F641 L645 W648 T664 V665	F641-F661 HydrophobicContact CD1-CE2 4.5Å; F641-F661 AromaticContact CD1-CZ 3.82Å; F641-F661 HydrophobicContact CD1-CZ 3.82Å; F641-F661 AromaticContact CE1-CZ 3.91Å; F641-F661 HydrophobicContact CE1-CZ 3.91Å; L645-F661 HydrophobicContact CD2-CD2 4.06Å; L645-F661 HydrophobicContact CD2-CE2 3.76Å; L645-F661 HydrophobicContact CG-CE2 4.23Å; W648-F661 HydrophobicContact CD2-CB 3.95Å; W648-F661 HydrophobicContact CD2-CD2 4.49Å; W648-F661 HydrophobicContact CE3-CB 3.8Å; W648-F661 AromaticContact CE3-CD2 3.84Å; W648-F661 HydrophobicContact CE3-CD2 3.84Å; W648-F661 HydrophobicContact CE3-CG 4.25Å; W648-F661 HydrophobicContact CH2-CB 4.25Å; W648-F661 HydrophobicContact CZ2-CB 4.39Å; W648-F661 HydrophobicContact CZ3-CB 3.96Å; W648-F661 HydrophobicContact CZ3-CD2 4.31Å; W648-F661 HydrophobicContact CZ3-CG 4.43Å; F661-T664 WeakPolarHBondContact O-CB 3.42Å; F661-T664 PolarHBondContact O-N 3.32Å; F661-V665 HydrophobicContact CE1-CG2 4.1Å; F661-V665 HydrophobicContact CE2-CG2 4.31Å; F661-V665 HydrophobicContact CZ-CG2 4Å; F661-V665 WeakPolarHBondContact O-CG2 3.11Å; F661-V665 PolarHBondContact O-N 2.75Å
662	M	93.6	Very high	91.8	Very high	126 Å²	126	49.1 Å²	49.1	62%	0.621	24%	0.244	S	C	*	.	H	α-helix	trans	-66.3	-46.3	178.8	-67	-54.1	-161.3	0	0	112.1	T660 T664 V665 E666	T660-M662 PolarHBondContact O-N 2.83Å; M662-T664 PolarHBondContact O-N 3.29Å; M662-V665 WeakPolarHBondContact O-CB 3.3Å; M662-V665 PolarHBondContact O-N 2.58Å; M662-E666 WeakPolarHBondContact O-CG 3.31Å; M662-E666 PolarHBondContact O-N 3Å
663	S	90.7	Very high	91.9	Very high	24 Å²	24	53.2 Å²	53.2	17%	0.168	26%	0.263	C	S	.	.	H	α-helix	trans	-61.3	-34.3	175.2	-175.2	0	0	0	0	112	K657 T660 C667	K657-S663 CarbonylContact O-C 3.57Å; K657-S663 VanDerWaalsContact O-O 3.11Å; K657-S663 PolarHBondContact O-OG 3.44Å; K657-S663 VanDerWaalsContact O-OG 3.13Å; T660-S663 PolarHBondContact O-N 2.81Å; T660-S663 WeakPolarHBondContact OG1-CB 3.43Å; S663-C667 WeakPolarHBondContact O-CB 3.48Å; S663-C667 PolarHBondContact O-N 2.98Å
664	T	94.2	Very high	92	Very high	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.9	-43.8	172.5	-59	0	0	0	0	111.9	S644 W648 K657 F658 T660 F661 M662 C667 L668	S644-T664 WeakPolarHBondContact O-CG2 3.36Å; W648-T664 HydrophobicContact CB-CG2 4.3Å; K657-T664 PolarHBondContact O-N 3.43Å; F658-T664 WeakPolarHBondContact CA-OG1 3.44Å; F658-T664 HydrophobicContact CD1-CG2 3.52Å; F658-T664 HydrophobicContact CE1-CG2 3.78Å; F658-T664 PolarHBondContact O-OG1 3.48Å; T660-T664 WeakPolarHBondContact O-CB 3.19Å; T660-T664 PolarHBondContact O-N 3.01Å; T660-T664 PolarHBondContact O-OG1 3.47Å; F661-T664 WeakPolarHBondContact O-CB 3.42Å; F661-T664 PolarHBondContact O-N 3.32Å; M662-T664 PolarHBondContact O-N 3.29Å; T664-C667 PolarHBondContact O-N 3.34Å; T664-L668 HydrophobicContact CG2-CD1 4.01Å; T664-L668 HydrophobicContact CG2-CG 4.36Å; T664-L668 WeakPolarHBondContact O-CB 2.98Å; T664-L668 VanDerWaalsContact O-CG 3.3Å; T664-L668 WeakPolarHBondContact O-CG 3.08Å; T664-L668 PolarHBondContact O-N 3.49Å
665	V	95.6	Very high	92.2	Very high	34 Å²	34	50.5 Å²	50.5	21%	0.206	26%	0.26	C	S	.	.	H	α-helix	trans	-64.5	-44.2	176.7	162.3	0	0	0	0	111	F640 F661 M662 Y669	F640-V665 HydrophobicContact CE1-CB 4.4Å; F640-V665 HydrophobicContact CE1-CG1 3.97Å; F640-V665 HydrophobicContact CE1-CG2 4.16Å; F640-V665 HydrophobicContact CZ-CG1 4.26Å; F661-V665 HydrophobicContact CE1-CG2 4.1Å; F661-V665 HydrophobicContact CE2-CG2 4.31Å; F661-V665 HydrophobicContact CZ-CG2 4Å; F661-V665 WeakPolarHBondContact O-CG2 3.11Å; F661-V665 PolarHBondContact O-N 2.75Å; M662-V665 WeakPolarHBondContact O-CB 3.3Å; M662-V665 PolarHBondContact O-N 2.58Å; V665-Y669 VanDerWaalsContact O-CB 3.24Å; V665-Y669 WeakPolarHBondContact O-CB 3.18Å; V665-Y669 PolarHBondContact O-N 3.05Å
666	E	93.2	Very high	92.1	Very high	104 Å²	104	53.2 Å²	53.2	49%	0.486	28%	0.275	S	S	.	.	H	α-helix	trans	-59.9	-50.7	174.3	-70.6	159.3	-172.9	0	0	110.8	M662 L668 Y669 S670	M662-E666 WeakPolarHBondContact O-CG 3.31Å; M662-E666 PolarHBondContact O-N 3Å; E666-L668 PolarHBondContact O-N 3.19Å; E666-Y669 PolarHBondContact O-N 2.88Å; E666-S670 PolarHBondContact O-N 3.41Å; E666-S670 PolarHBondContact O-OG 3.43Å
667	C	93	Very high	92.4	Very high	10 Å²	10	53.4 Å²	53.4	7%	0.068	28%	0.275	C	S	.	.	H	α-helix	trans	-57.7	-49.5	177.3	176	0	0	0	0	112.4	K657 S663 T664 Y669 S670 L671	K657-C667 HydrophobicContact CB-CB 4Å; S663-C667 WeakPolarHBondContact O-CB 3.48Å; S663-C667 PolarHBondContact O-N 2.98Å; T664-C667 PolarHBondContact O-N 3.34Å; C667-Y669 VanDerWaalsContact C-N 3.31Å; C667-Y669 PolarHBondContact O-N 2.96Å; C667-S670 PolarHBondContact O-N 3.21Å; C667-L671 WeakPolarHBondContact O-CB 3.48Å; C667-L671 VanDerWaalsContact O-CG 3.29Å; C667-L671 WeakPolarHBondContact O-CG 3.29Å; C667-L671 PolarHBondContact O-N 3.01Å
668	L	95.3	Very high	92.4	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-66	-33.2	177.9	-70.4	178.9	0	0	0	111.9	F640 F643 F658 T664 E666 L671 I672 F699 F703	F640-L668 HydrophobicContact CE2-CB 3.66Å; F640-L668 HydrophobicContact CZ-CB 3.88Å; F643-L668 HydrophobicContact CB-CD1 4.38Å; F658-L668 HydrophobicContact CE1-CD2 4.21Å; F658-L668 HydrophobicContact CE1-CG 4.33Å; F658-L668 HydrophobicContact CZ-CD2 4.23Å; T664-L668 HydrophobicContact CG2-CD1 4.01Å; T664-L668 HydrophobicContact CG2-CG 4.36Å; T664-L668 WeakPolarHBondContact O-CB 2.98Å; T664-L668 VanDerWaalsContact O-CG 3.3Å; T664-L668 WeakPolarHBondContact O-CG 3.08Å; T664-L668 PolarHBondContact O-N 3.49Å; E666-L668 PolarHBondContact O-N 3.19Å; L668-L671 HydrophobicContact CD2-CD1 4.21Å; L668-I672 WeakPolarHBondContact O-CG1 3.45Å; L668-I672 PolarHBondContact O-N 3.44Å; L668-I672 VanDerWaalsContact O-N 3.16Å; L668-F699 HydrophobicContact CD2-CE1 4.2Å; L668-F699 HydrophobicContact CD2-CZ 4.47Å; L668-F703 HydrophobicContact CB-CE1 4.14Å; L668-F703 HydrophobicContact CB-CE2 4.27Å; L668-F703 HydrophobicContact CB-CZ 3.69Å; L668-F703 HydrophobicContact CD1-CE2 4.38Å; L668-F703 HydrophobicContact CD2-CD1 3.86Å; L668-F703 HydrophobicContact CD2-CD2 4.13Å; L668-F703 HydrophobicContact CD2-CE1 3.75Å; L668-F703 HydrophobicContact CD2-CE2 4.01Å; L668-F703 HydrophobicContact CD2-CG 4.06Å; L668-F703 HydrophobicContact CD2-CZ 3.82Å; L668-F703 HydrophobicContact CG-CE2 4.46Å; L668-F703 HydrophobicContact CG-CZ 4.22Å; L668-F703 WeakPolarHBondContact O-CE1 3.27Å; L668-F703 WeakPolarHBondContact O-CZ 3.37Å
669	Y	94.8	Very high	92.1	Very high	146 Å²	146	62.5 Å²	62.5	57%	0.573	32%	0.318	S	S	*	.	H	α-helix	trans	-70	-41.7	174.5	-177.1	-106.3	0	0	0	112.5	V665 E666 C667 L671 I672 N673	V665-Y669 VanDerWaalsContact O-CB 3.24Å; V665-Y669 WeakPolarHBondContact O-CB 3.18Å; V665-Y669 PolarHBondContact O-N 3.05Å; E666-Y669 PolarHBondContact O-N 2.88Å; C667-Y669 VanDerWaalsContact C-N 3.31Å; C667-Y669 PolarHBondContact O-N 2.96Å; Y669-L671 VanDerWaalsContact C-N 3.34Å; Y669-L671 PolarHBondContact O-N 2.94Å; Y669-I672 PolarHBondContact O-N 3.1Å; Y669-N673 PolarHBondContact O-N 3.15Å; Y669-N673 PolarHBondContact O-ND2 3.36Å
670	S	94.2	Very high	92.1	Very high	37 Å²	37	57 Å²	57	26%	0.259	30%	0.297	S	S	.	.	H	α-helix	trans	-58.7	-45.1	172.1	-63.4	0	0	0	0	111.4	E666 C667 I672 N673 G674 D675	E666-S670 PolarHBondContact O-N 3.41Å; E666-S670 PolarHBondContact O-OG 3.43Å; C667-S670 PolarHBondContact O-N 3.21Å; S670-I672 VanDerWaalsContact C-N 3.32Å; S670-I672 PolarHBondContact O-N 2.83Å; S670-N673 CarbonylContact O-C 3.48Å; S670-N673 PolarHBondContact O-N 3.42Å; S670-G674 PolarHBondContact O-N 3.08Å; S670-D675 PolarHBondContact O-N 3.18Å
671	L	94.2	Very high	91.9	Very high	4 Å²	4	55.9 Å²	55.9	2%	0.021	29%	0.289	C	S	.	.	H	α-helix	trans	-61.1	-34	176.8	-73.7	172	0	0	0	113.7	C667 L668 Y669 N673 G674 M677 T680 L700 F703	C667-L671 WeakPolarHBondContact O-CB 3.48Å; C667-L671 VanDerWaalsContact O-CG 3.29Å; C667-L671 WeakPolarHBondContact O-CG 3.29Å; C667-L671 PolarHBondContact O-N 3.01Å; L668-L671 HydrophobicContact CD2-CD1 4.21Å; Y669-L671 VanDerWaalsContact C-N 3.34Å; Y669-L671 PolarHBondContact O-N 2.94Å; L671-N673 PolarHBondContact O-N 3.14Å; L671-G674 PolarHBondContact O-N 3.4Å; L671-G674 VanDerWaalsContact O-N 3.16Å; L671-M677 HydrophobicContact CD2-CB 3.98Å; L671-M677 HydrophobicContact CD2-CG 4.16Å; L671-T680 HydrophobicContact CD1-CG2 4.31Å; L671-L700 HydrophobicContact CD1-CD2 3.85Å; L671-F703 HydrophobicContact CB-CD1 4.44Å; L671-F703 HydrophobicContact CB-CE1 3.99Å
672	I	95	Very high	91.6	Very high	28 Å²	28	56.5 Å²	56.5	14%	0.144	30%	0.298	C	S	.	.	H	α-helix	trans	-62.9	-34.4	174.4	-69.7	170.3	0	0	0	111.2	F640 L668 Y669 S670 G674 F703 F707	F640-I672 HydrophobicContact CD2-CD1 3.8Å; F640-I672 HydrophobicContact CE2-CD1 3.71Å; L668-I672 WeakPolarHBondContact O-CG1 3.45Å; L668-I672 PolarHBondContact O-N 3.44Å; L668-I672 VanDerWaalsContact O-N 3.16Å; Y669-I672 PolarHBondContact O-N 3.1Å; S670-I672 VanDerWaalsContact C-N 3.32Å; S670-I672 PolarHBondContact O-N 2.83Å; I672-G674 VanDerWaalsContact C-N 3.29Å; I672-F703 HydrophobicContact CD1-CZ 3.85Å; I672-F703 HydrophobicContact CG1-CE1 3.88Å; I672-F703 HydrophobicContact CG1-CZ 3.65Å; I672-F707 HydrophobicContact CD1-CB 4.31Å; I672-F707 HydrophobicContact CD1-CD1 3.72Å; I672-F707 HydrophobicContact CD1-CE1 4.4Å; I672-F707 HydrophobicContact CD1-CG 4.19Å; I672-F707 HydrophobicContact CG1-CB 3.89Å; I672-F707 HydrophobicContact CG1-CD1 4.25Å; I672-F707 HydrophobicContact CG1-CG 4.26Å
673	N	93.6	Very high	91.1	Very high	99 Å²	99	52.4 Å²	52.4	53%	0.529	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	3.3	178.5	-61.4	-64	0	0	0	113	Y669 S670 L671 D675	Y669-N673 PolarHBondContact O-N 3.15Å; Y669-N673 PolarHBondContact O-ND2 3.36Å; S670-N673 CarbonylContact O-C 3.48Å; S670-N673 PolarHBondContact O-N 3.42Å; L671-N673 PolarHBondContact O-N 3.14Å; N673-D675 VanDerWaalsContact C-N 3.32Å
674	G	91.5	Very high	90.5	Very high	45 Å²	45	51.5 Å²	51.5	46%	0.464	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	6.7	-179.2	0	0	0	0	0	115	S670 L671 I672	S670-G674 PolarHBondContact O-N 3.08Å; L671-G674 PolarHBondContact O-N 3.4Å; L671-G674 VanDerWaalsContact O-N 3.16Å; I672-G674 VanDerWaalsContact C-N 3.29Å
675	D	92.4	Very high	89.3	Confident	95 Å²	95	56 Å²	56	51%	0.508	30%	0.295	S	S	.	.			trans	-81.1	147.6	-179.8	-171.6	23.9	0	0	0	111.8	S670 N673 M677	S670-D675 PolarHBondContact O-N 3.18Å; N673-D675 VanDerWaalsContact C-N 3.32Å; D675-M677 PolarHBondContact O-N 3.26Å
676	D	85.2	Confident	87.9	Confident	60 Å²	60	60.3 Å²	60.3	32%	0.321	32%	0.317	S	S	.	.	S	Bend	trans	57.7	21.8	165.3	-134.5	-14.7	0	0	0	115.7	K657 V679 T680	K657-D676 PolarHBondContact NZ-O 3.35Å; K657-D676 IonicContact NZ-OD1 3.83Å; K657-D676 PolarHBondContact NZ-OD1 2.91Å; K657-D676 IonicContact NZ-OD2 3.5Å; K657-D676 PolarHBondContact NZ-OD2 2.97Å; D676-V679 VanDerWaalsContact OD1-CB 3.3Å; D676-V679 WeakPolarHBondContact OD1-CB 3.29Å; D676-V679 WeakPolarHBondContact OD1-CG2 3.39Å; D676-T680 PolarHBondContact O-N 3.06Å; D676-T680 PolarHBondContact O-OG1 3.34Å
677	M	88.9	Confident	86.9	Confident	85 Å²	85	62.3 Å²	62.3	42%	0.419	33%	0.332	S	S	.	.	H	α-helix	trans	-65.3	-49.7	-172.9	-177.5	177.4	65.8	0	0	112.9	L671 D675 V679 T680 F681 I704	L671-M677 HydrophobicContact CD2-CB 3.98Å; L671-M677 HydrophobicContact CD2-CG 4.16Å; D675-M677 PolarHBondContact O-N 3.26Å; M677-V679 PolarHBondContact O-N 3.09Å; M677-T680 PolarHBondContact O-N 3.5Å; M677-F681 HydrophobicContact CG-CD2 3.87Å; M677-F681 HydrophobicContact CG-CE2 3.74Å; M677-F681 VanDerWaalsContact O-CD2 3.28Å; M677-F681 WeakPolarHBondContact O-CD2 3.28Å; M677-F681 PolarHBondContact O-N 3Å; M677-F681 HydrophobicContact SD-CE2 4.28Å; M677-I704 HydrophobicContact CG-CD1 4.03Å; M677-I704 HydrophobicContact SD-CD1 3.84Å
678	F	88.6	Confident	86.1	Confident	154 Å²	154	62.5 Å²	62.5	68%	0.675	33%	0.334	S	S	*	.	H	α-helix	trans	-62.6	-44.8	-178.1	-180	-104.6	0	0	0	112	T680 F681 T682	F678-T680 VanDerWaalsContact C-N 3.28Å; F678-T680 PolarHBondContact O-N 3.13Å; F678-F681 CarbonylContact O-C 3.43Å; F678-F681 WeakPolarHBondContact O-CA 3.38Å; F678-F681 WeakPolarHBondContact O-CB 3.49Å; F678-F681 PolarHBondContact O-N 3.27Å; F678-T682 HydrophobicContact CD1-CG2 4.03Å; F678-T682 HydrophobicContact CD2-CG2 4.23Å; F678-T682 HydrophobicContact CE1-CG2 3.58Å; F678-T682 HydrophobicContact CE2-CG2 3.8Å; F678-T682 HydrophobicContact CG-CG2 4.35Å; F678-T682 HydrophobicContact CZ-CG2 3.45Å; F678-T682 VanDerWaalsContact CZ-CG2 3.45Å; F678-T682 PolarHBondContact O-N 3.38Å; F678-T682 PolarHBondContact O-OG1 3.31Å
679	V	85.9	Confident	85.7	Confident	46 Å²	46	66 Å²	66	28%	0.279	36%	0.356	S	S	.	.	H	α-helix	trans	-57	-43.8	177	176.3	0	0	0	0	110.9	D676 M677 F681 T682 I683	D676-V679 VanDerWaalsContact OD1-CB 3.3Å; D676-V679 WeakPolarHBondContact OD1-CB 3.29Å; D676-V679 WeakPolarHBondContact OD1-CG2 3.39Å; M677-V679 PolarHBondContact O-N 3.09Å; V679-F681 PolarHBondContact O-N 3.12Å; V679-T682 WeakPolarHBondContact CA-OG1 3.34Å; V679-T682 PolarHBondContact O-N 3.01Å; V679-T682 PolarHBondContact O-OG1 3.35Å; V679-I683 HydrophobicContact CG1-CD1 3.69Å; V679-I683 HydrophobicContact CG1-CG1 4.24Å; V679-I683 VanDerWaalsContact O-CG1 3.28Å; V679-I683 WeakPolarHBondContact O-CG1 3.38Å; V679-I683 PolarHBondContact O-N 3.36Å; V679-I683 VanDerWaalsContact O-N 3.08Å
680	T	88.5	Confident	85.3	Confident	1 Å²	1	65 Å²	65	1%	0.006	36%	0.36	C	S	.	.	H	α-helix	trans	-64.4	-30.3	178.7	-50.9	0	0	0	0	112.5	N655 K657 F658 L671 D676 M677 F678 L700	N655-T680 PolarHBondContact ND2-O 2.96Å; K657-T680 PolarHBondContact NZ-OG1 3.19Å; F658-T680 HydrophobicContact CE2-CG2 3.91Å; L671-T680 HydrophobicContact CD1-CG2 4.31Å; D676-T680 PolarHBondContact O-N 3.06Å; D676-T680 PolarHBondContact O-OG1 3.34Å; M677-T680 PolarHBondContact O-N 3.5Å; F678-T680 VanDerWaalsContact C-N 3.28Å; F678-T680 PolarHBondContact O-N 3.13Å; T680-L700 HydrophobicContact CG2-CD1 4.19Å; T680-L700 HydrophobicContact CG2-CD2 4.17Å
681	F	88.7	Confident	85.1	Confident	18 Å²	18	65.5 Å²	65.5	8%	0.079	37%	0.371	C	S	.	.	H	α-helix	trans	-82	-21.7	174.9	-85.7	-58.1	0	0	0	114.9	M677 F678 V679 R697 L700 Y701 I704	M677-F681 HydrophobicContact CG-CD2 3.87Å; M677-F681 HydrophobicContact CG-CE2 3.74Å; M677-F681 VanDerWaalsContact O-CD2 3.28Å; M677-F681 WeakPolarHBondContact O-CD2 3.28Å; M677-F681 PolarHBondContact O-N 3Å; M677-F681 HydrophobicContact SD-CE2 4.28Å; F678-F681 CarbonylContact O-C 3.43Å; F678-F681 WeakPolarHBondContact O-CA 3.38Å; F678-F681 WeakPolarHBondContact O-CB 3.49Å; F678-F681 PolarHBondContact O-N 3.27Å; V679-F681 PolarHBondContact O-N 3.12Å; F681-R697 PolarHBondContact O-NH1 3.39Å; F681-R697 PolarHBondContact O-NH2 3.15Å; F681-L700 HydrophobicContact CD1-CB 4.36Å; F681-L700 HydrophobicContact CD1-CD1 3.6Å; F681-L700 HydrophobicContact CE1-CB 3.49Å; F681-L700 VanDerWaalsContact CE1-CB 3.49Å; F681-L700 HydrophobicContact CE1-CD1 3.61Å; F681-L700 HydrophobicContact CE1-CG 4.2Å; F681-L700 HydrophobicContact CG-CD1 4.26Å; F681-L700 HydrophobicContact CZ-CB 3.59Å; F681-L700 HydrophobicContact CZ-CD1 4.24Å; F681-Y701 HydrophobicContact CE1-CD1 4.37Å; F681-Y701 HydrophobicContact CE1-CE1 4.09Å; F681-Y701 HydrophobicContact CE2-CE1 4.33Å; F681-Y701 AromaticContact CZ-CD1 3.77Å; F681-Y701 HydrophobicContact CZ-CD1 3.77Å; F681-Y701 AromaticContact CZ-CE1 3.62Å; F681-Y701 HydrophobicContact CZ-CE1 3.62Å; F681-Y701 HydrophobicContact CZ-CG 4.45Å; F681-I704 HydrophobicContact CE2-CD1 3.78Å; F681-I704 HydrophobicContact CZ-CD1 3.92Å
682	T	86.3	Confident	85	Confident	71 Å²	71	66.8 Å²	66.8	44%	0.436	38%	0.377	S	S	.	.	H	α-helix	trans	-96	-28.7	-178.6	52.3	0	0	0	0	114	F678 V679 I684	F678-T682 HydrophobicContact CD1-CG2 4.03Å; F678-T682 HydrophobicContact CD2-CG2 4.23Å; F678-T682 HydrophobicContact CE1-CG2 3.58Å; F678-T682 HydrophobicContact CE2-CG2 3.8Å; F678-T682 HydrophobicContact CG-CG2 4.35Å; F678-T682 HydrophobicContact CZ-CG2 3.45Å; F678-T682 VanDerWaalsContact CZ-CG2 3.45Å; F678-T682 PolarHBondContact O-N 3.38Å; F678-T682 PolarHBondContact O-OG1 3.31Å; V679-T682 WeakPolarHBondContact CA-OG1 3.34Å; V679-T682 PolarHBondContact O-N 3.01Å; V679-T682 PolarHBondContact O-OG1 3.35Å; T682-I684 PolarHBondContact O-N 3.46Å; T682-I684 VanDerWaalsContact O-N 3.17Å
683	I	82.6	Confident	84.7	Confident	39 Å²	39	68.3 Å²	68.3	20%	0.2	38%	0.382	C	S	.	.	S	Bend	trans	-55.2	-34.6	178.9	-75.3	165.8	0	0	0	112.4	N655 K657 V679 N685	N655-I683 HydrophobicContact CB-CG2 4.25Å; K657-I683 HydrophobicContact CG-CD1 4.5Å; V679-I683 HydrophobicContact CG1-CD1 3.69Å; V679-I683 HydrophobicContact CG1-CG1 4.24Å; V679-I683 VanDerWaalsContact O-CG1 3.28Å; V679-I683 WeakPolarHBondContact O-CG1 3.38Å; V679-I683 PolarHBondContact O-N 3.36Å; V679-I683 VanDerWaalsContact O-N 3.08Å; I683-N685 VanDerWaalsContact C-N 3.34Å; I683-N685 PolarHBondContact O-N 3.45Å
684	I	77.9	Confident	84.6	Confident	6 Å²	6	68.5 Å²	68.5	3%	0.031	38%	0.382	C	S	.	.	S	Bend	trans	-81.9	85.2	-179.7	-63	166.6	0	0	0	109.2	L651 N655 T682 A688 Y693 S696	L651-I684 HydrophobicContact CD2-CD1 4.27Å; N655-I684 HydrophobicContact CB-CD1 3.99Å; N655-I684 HydrophobicContact CB-CG1 3.94Å; T682-I684 PolarHBondContact O-N 3.46Å; T682-I684 VanDerWaalsContact O-N 3.17Å; I684-A688 HydrophobicContact CG2-CB 4.17Å; I684-Y693 HydrophobicContact CG2-CD2 4.37Å; I684-S696 WeakPolarHBondContact CD1-OG 3.47Å
685	N	70.9	Confident	84.6	Confident	94 Å²	94	69.6 Å²	69.6	50%	0.503	37%	0.374	S	S	.	.			trans	-64.9	157.6	178.1	-167.9	2.7	0	0	0	112.2	I683 N687 A688	I683-N685 VanDerWaalsContact C-N 3.34Å; I683-N685 PolarHBondContact O-N 3.45Å; N685-N687 PolarHBondContact O-N 3.46Å; N685-A688 PolarHBondContact O-N 3.45Å
686	N	65.6	Low	84.6	Confident	125 Å²	125	65.2 Å²	65.2	67%	0.668	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-8.3	179	-66.7	-27.1	0	0	0	114.7	A688	N686-A688 VanDerWaalsContact C-N 3.27Å
687	N	72.1	Confident	84.9	Confident	146 Å²	146	65.1 Å²	65.1	78%	0.781	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-18.8	173.2	-65.9	-6.3	0	0	0	112.9	N685	N685-N687 PolarHBondContact O-N 3.46Å
688	A	76.2	Confident	85.2	Confident	14 Å²	14	66.8 Å²	66.8	12%	0.116	36%	0.356	C	S	.	.	S	Bend	trans	-65.7	144.7	172.3	0	0	0	0	0	110.4	Y654 I684 N685 N686 I690 I692	Y654-A688 HydrophobicContact CD1-CB 4.25Å; I684-A688 HydrophobicContact CG2-CB 4.17Å; N685-A688 PolarHBondContact O-N 3.45Å; N686-A688 VanDerWaalsContact C-N 3.27Å; A688-I690 PolarHBondContact O-N 2.86Å; A688-I692 HydrophobicContact CB-CG2 4.34Å
689	P	85.6	Confident	85.5	Confident	72 Å²	72	60 Å²	60	47%	0.468	33%	0.326	S	S	.	.			trans	-53.5	136.7	172.9	-24.6	33.6	0	0	0	110.9	G691 I692 Y693	P689-G691 PolarHBondContact O-N 3.47Å; P689-I692 HydrophobicContact CB-CD1 4.09Å; P689-I692 HydrophobicContact CG-CD1 3.85Å; P689-I692 WeakPolarHBondContact O-CA 3.45Å; P689-I692 WeakPolarHBondContact O-CB 3.3Å; P689-I692 PolarHBondContact O-N 2.77Å; P689-Y693 PolarHBondContact O-N 3.41Å; P689-Y693 VanDerWaalsContact O-N 3.14Å
690	I	87.2	Confident	85.9	Confident	126 Å²	126	57.9 Å²	57.9	65%	0.646	31%	0.313	S	S	*	.	H	α-helix	trans	-51.8	-33.6	-172.3	-172.7	59.8	0	0	0	113.7	A688 Y693 L694	A688-I690 PolarHBondContact O-N 2.86Å; I690-Y693 HydrophobicContact CD1-CD1 4.25Å; I690-Y693 PolarHBondContact O-N 3.08Å; I690-L694 HydrophobicContact CD1-CD1 4.46Å; I690-L694 HydrophobicContact CD1-CG 4.31Å; I690-L694 HydrophobicContact CG1-CD1 4.1Å; I690-L694 HydrophobicContact CG1-CG 4.4Å; I690-L694 WeakPolarHBondContact O-CB 3.39Å; I690-L694 WeakPolarHBondContact O-CG 3.33Å; I690-L694 PolarHBondContact O-N 2.93Å
691	G	90	Very high	86.2	Confident	48 Å²	48	64 Å²	64	50%	0.495	34%	0.337	S	S	.	.	H	α-helix	trans	-63.6	-37.2	174.7	0	0	0	0	0	114	P689 F695	P689-G691 PolarHBondContact O-N 3.47Å; G691-F695 WeakPolarHBondContact O-CB 3.36Å; G691-F695 PolarHBondContact O-N 3.46Å
692	I	91.3	Very high	86.6	Confident	30 Å²	30	67.7 Å²	67.7	15%	0.154	36%	0.357	C	S	.	.	H	α-helix	trans	-75.6	-38.1	176.2	-72.5	148.5	0	0	0	110.9	Y654 A688 P689 F695 S696	Y654-I692 HydrophobicContact CD2-CD1 4.33Å; Y654-I692 HydrophobicContact CD2-CG2 3.76Å; Y654-I692 HydrophobicContact CE1-CD1 4.19Å; Y654-I692 HydrophobicContact CE2-CD1 3.52Å; Y654-I692 HydrophobicContact CE2-CG1 4.23Å; Y654-I692 HydrophobicContact CE2-CG2 4.11Å; Y654-I692 HydrophobicContact CG-CG2 3.99Å; Y654-I692 VanDerWaalsContact CZ-CD1 3.45Å; Y654-I692 WeakPolarHBondContact OH-CD1 3.17Å; A688-I692 HydrophobicContact CB-CG2 4.34Å; P689-I692 HydrophobicContact CB-CD1 4.09Å; P689-I692 HydrophobicContact CG-CD1 3.85Å; P689-I692 WeakPolarHBondContact O-CA 3.45Å; P689-I692 WeakPolarHBondContact O-CB 3.3Å; P689-I692 PolarHBondContact O-N 2.77Å; I692-F695 PolarHBondContact O-N 3.43Å; I692-S696 VanDerWaalsContact O-CB 3.31Å; I692-S696 WeakPolarHBondContact O-CB 3.46Å; I692-S696 PolarHBondContact O-N 3.36Å
693	Y	89.7	Confident	87	Confident	60 Å²	60	64.3 Å²	64.3	24%	0.235	34%	0.337	C	S	.	.	H	α-helix	trans	-59.6	-49.8	173	179	-95.5	0	0	0	111.4	I684 P689 I690 S696 R697	I684-Y693 HydrophobicContact CG2-CD2 4.37Å; P689-Y693 PolarHBondContact O-N 3.41Å; P689-Y693 VanDerWaalsContact O-N 3.14Å; I690-Y693 HydrophobicContact CD1-CD1 4.25Å; I690-Y693 PolarHBondContact O-N 3.08Å; Y693-S696 PolarHBondContact O-N 2.96Å; Y693-R697 HydrophobicContact CE1-CG 4.26Å; Y693-R697 WeakPolarHBondContact O-CG 3.39Å; Y693-R697 PolarHBondContact O-N 2.87Å; Y693-R697 VanDerWaalsContact O-N 3.15Å; Y693-R697 PolarHBondContact OH-NE 3.2Å; Y693-R697 PolarHBondContact OH-NH2 2.92Å
694	L	90.8	Very high	87.6	Confident	104 Å²	104	63.1 Å²	63.1	55%	0.545	33%	0.331	S	S	.	.	H	α-helix	trans	-64.3	-43.4	176.2	-71.4	172.5	0	0	0	112.2	I690 S696 R697 L698	I690-L694 HydrophobicContact CD1-CD1 4.46Å; I690-L694 HydrophobicContact CD1-CG 4.31Å; I690-L694 HydrophobicContact CG1-CD1 4.1Å; I690-L694 HydrophobicContact CG1-CG 4.4Å; I690-L694 WeakPolarHBondContact O-CB 3.39Å; I690-L694 WeakPolarHBondContact O-CG 3.33Å; I690-L694 PolarHBondContact O-N 2.93Å; L694-S696 PolarHBondContact O-N 2.87Å; L694-R697 PolarHBondContact O-N 3.13Å; L694-L698 WeakPolarHBondContact O-CB 3.45Å; L694-L698 PolarHBondContact O-N 3.45Å
695	F	93.1	Very high	88.4	Confident	68 Å²	68	66 Å²	66	30%	0.298	35%	0.348	S	S	.	.	H	α-helix	trans	-58.6	-46	176	176.9	-89	0	0	0	111.5	V650 L651 G691 I692 L698 F699	V650-F695 HydrophobicContact CB-CD1 4.29Å; V650-F695 HydrophobicContact CB-CE1 3.74Å; V650-F695 HydrophobicContact CB-CZ 4.25Å; V650-F695 HydrophobicContact CG1-CD1 3.48Å; V650-F695 VanDerWaalsContact CG1-CD1 3.48Å; V650-F695 HydrophobicContact CG1-CE1 3.44Å; V650-F695 VanDerWaalsContact CG1-CE1 3.44Å; V650-F695 HydrophobicContact CG1-CG 4.2Å; V650-F695 HydrophobicContact CG1-CZ 4.11Å; V650-F695 HydrophobicContact CG2-CE1 4.24Å; V650-F695 HydrophobicContact CG2-CZ 4.25Å; L651-F695 HydrophobicContact CD2-CD1 4.05Å; L651-F695 HydrophobicContact CD2-CE1 4.31Å; G691-F695 WeakPolarHBondContact O-CB 3.36Å; G691-F695 PolarHBondContact O-N 3.46Å; I692-F695 PolarHBondContact O-N 3.43Å; F695-L698 PolarHBondContact O-N 3.03Å; F695-F699 HydrophobicContact CD1-CB 4.36Å; F695-F699 HydrophobicContact CE1-CB 4Å; F695-F699 HydrophobicContact CE1-CD2 4.16Å; F695-F699 HydrophobicContact CE1-CG 4.2Å; F695-F699 HydrophobicContact CZ-CB 4.29Å; F695-F699 HydrophobicContact CZ-CD2 4.04Å; F695-F699 HydrophobicContact CZ-CG 4.46Å; F695-F699 WeakPolarHBondContact O-CB 3.29Å; F695-F699 PolarHBondContact O-N 3.44Å
696	S	91.9	Very high	89.5	Confident	2 Å²	2	64 Å²	64	1%	0.014	34%	0.337	C	S	.	.	H	α-helix	trans	-58.2	-50	177.7	171.8	0	0	0	0	112.2	I684 I692 Y693 L694 L698 F699 L700	I684-S696 WeakPolarHBondContact CD1-OG 3.47Å; I692-S696 VanDerWaalsContact O-CB 3.31Å; I692-S696 WeakPolarHBondContact O-CB 3.46Å; I692-S696 PolarHBondContact O-N 3.36Å; Y693-S696 PolarHBondContact O-N 2.96Å; L694-S696 PolarHBondContact O-N 2.87Å; S696-L698 PolarHBondContact O-N 2.88Å; S696-F699 PolarHBondContact O-N 3.44Å; S696-L700 WeakPolarHBondContact O-CB 3.44Å; S696-L700 WeakPolarHBondContact O-CG 3.49Å; S696-L700 PolarHBondContact O-N 3Å
697	R	92	Very high	91	Very high	58 Å²	58	58.4 Å²	58.4	22%	0.219	31%	0.307	C	S	.	.	H	α-helix	trans	-58.3	-49.3	177.7	-65.7	-69	179.3	-173.3	-10.7	110.8	F681 Y693 L694 Y701	F681-R697 PolarHBondContact O-NH1 3.39Å; F681-R697 PolarHBondContact O-NH2 3.15Å; Y693-R697 HydrophobicContact CE1-CG 4.26Å; Y693-R697 WeakPolarHBondContact O-CG 3.39Å; Y693-R697 PolarHBondContact O-N 2.87Å; Y693-R697 VanDerWaalsContact O-N 3.15Å; Y693-R697 PolarHBondContact OH-NE 3.2Å; Y693-R697 PolarHBondContact OH-NH2 2.92Å; L694-R697 PolarHBondContact O-N 3.13Å; R697-Y701 HydrophobicContact CB-CD2 4.38Å; R697-Y701 HydrophobicContact CB-CE2 4.19Å; R697-Y701 WeakPolarHBondContact O-CB 3.39Å; R697-Y701 WeakPolarHBondContact O-CD2 3.48Å; R697-Y701 PolarHBondContact O-N 3.01Å
698	L	93.8	Very high	92.1	Very high	121 Å²	121	53.3 Å²	53.3	63%	0.634	28%	0.279	S	S	*	.	H	α-helix	trans	-62.3	-45.6	179.1	-175.7	66.3	0	0	0	112	L694 F695 S696 L702	L694-L698 WeakPolarHBondContact O-CB 3.45Å; L694-L698 PolarHBondContact O-N 3.45Å; F695-L698 PolarHBondContact O-N 3.03Å; S696-L698 PolarHBondContact O-N 2.88Å; L698-L702 WeakPolarHBondContact O-CB 3.25Å; L698-L702 PolarHBondContact O-N 3.34Å
699	F	95.6	Very high	92.9	Very high	11 Å²	11	59.9 Å²	59.9	5%	0.048	30%	0.302	C	S	.	.	H	α-helix	trans	-60.8	-48.6	179.3	173.5	-89.4	0	0	0	111.7	F643 C646 L651 F658 L668 F695 S696 L702 F703	F643-F699 HydrophobicContact CB-CE2 4.42Å; F643-F699 HydrophobicContact CB-CZ 4.34Å; F643-F699 HydrophobicContact CD1-CD2 4.14Å; F643-F699 AromaticContact CD1-CE2 3.59Å; F643-F699 HydrophobicContact CD1-CE2 3.59Å; F643-F699 AromaticContact CD1-CZ 3.93Å; F643-F699 HydrophobicContact CD1-CZ 3.93Å; F643-F699 HydrophobicContact CE1-CD2 4.49Å; F643-F699 HydrophobicContact CE1-CE2 4.37Å; F643-F699 HydrophobicContact CG-CE2 4.42Å; F643-F699 WeakPolarHBondContact O-CZ 3.42Å; C646-F699 HydrophobicContact CB-CE2 4.22Å; L651-F699 HydrophobicContact CD1-CD1 3.79Å; L651-F699 HydrophobicContact CD1-CE1 4Å; F658-F699 HydrophobicContact CE1-CE1 4.17Å; F658-F699 HydrophobicContact CZ-CE1 4.36Å; L668-F699 HydrophobicContact CD2-CE1 4.2Å; L668-F699 HydrophobicContact CD2-CZ 4.47Å; F695-F699 HydrophobicContact CD1-CB 4.36Å; F695-F699 HydrophobicContact CE1-CB 4Å; F695-F699 HydrophobicContact CE1-CD2 4.16Å; F695-F699 HydrophobicContact CE1-CG 4.2Å; F695-F699 HydrophobicContact CZ-CB 4.29Å; F695-F699 HydrophobicContact CZ-CD2 4.04Å; F695-F699 HydrophobicContact CZ-CG 4.46Å; F695-F699 WeakPolarHBondContact O-CB 3.29Å; F695-F699 PolarHBondContact O-N 3.44Å; S696-F699 PolarHBondContact O-N 3.44Å; F699-L702 PolarHBondContact O-N 2.94Å; F699-F703 VanDerWaalsContact O-CB 3.28Å; F699-F703 WeakPolarHBondContact O-CB 3.49Å; F699-F703 PolarHBondContact O-N 3.48Å
700	L	94.3	Very high	93.4	Very high	1 Å²	1	59.9 Å²	59.9	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-67.7	-45.9	179.7	-69.5	172.6	0	0	0	111.4	F658 L671 T680 F681 S696 L702 F703 I704	F658-L700 HydrophobicContact CZ-CD2 4.34Å; L671-L700 HydrophobicContact CD1-CD2 3.85Å; T680-L700 HydrophobicContact CG2-CD1 4.19Å; T680-L700 HydrophobicContact CG2-CD2 4.17Å; F681-L700 HydrophobicContact CD1-CB 4.36Å; F681-L700 HydrophobicContact CD1-CD1 3.6Å; F681-L700 HydrophobicContact CE1-CB 3.49Å; F681-L700 VanDerWaalsContact CE1-CB 3.49Å; F681-L700 HydrophobicContact CE1-CD1 3.61Å; F681-L700 HydrophobicContact CE1-CG 4.2Å; F681-L700 HydrophobicContact CG-CD1 4.26Å; F681-L700 HydrophobicContact CZ-CB 3.59Å; F681-L700 HydrophobicContact CZ-CD1 4.24Å; S696-L700 WeakPolarHBondContact O-CB 3.44Å; S696-L700 WeakPolarHBondContact O-CG 3.49Å; S696-L700 PolarHBondContact O-N 3Å; L700-L702 PolarHBondContact O-N 2.95Å; L700-F703 PolarHBondContact O-N 3.36Å; L700-I704 HydrophobicContact CB-CD1 4.46Å; L700-I704 WeakPolarHBondContact O-CB 3.4Å; L700-I704 WeakPolarHBondContact O-CD1 3.32Å; L700-I704 WeakPolarHBondContact O-CG1 3.33Å; L700-I704 PolarHBondContact O-N 3.14Å
701	Y	94.8	Very high	93.7	Very high	131 Å²	131	54.9 Å²	54.9	51%	0.514	28%	0.276	S	S	.	.	H	α-helix	trans	-61.5	-42.1	175.6	-69.6	-47	0	0	0	112.2	F681 R697 T705	F681-Y701 HydrophobicContact CE1-CD1 4.37Å; F681-Y701 HydrophobicContact CE1-CE1 4.09Å; F681-Y701 HydrophobicContact CE2-CE1 4.33Å; F681-Y701 AromaticContact CZ-CD1 3.77Å; F681-Y701 HydrophobicContact CZ-CD1 3.77Å; F681-Y701 AromaticContact CZ-CE1 3.62Å; F681-Y701 HydrophobicContact CZ-CE1 3.62Å; F681-Y701 HydrophobicContact CZ-CG 4.45Å; R697-Y701 HydrophobicContact CB-CD2 4.38Å; R697-Y701 HydrophobicContact CB-CE2 4.19Å; R697-Y701 WeakPolarHBondContact O-CB 3.39Å; R697-Y701 WeakPolarHBondContact O-CD2 3.48Å; R697-Y701 PolarHBondContact O-N 3.01Å; Y701-T705 WeakPolarHBondContact O-CB 3.23Å; Y701-T705 VanDerWaalsContact O-CG2 3.28Å; Y701-T705 WeakPolarHBondContact O-CG2 3.42Å; Y701-T705 PolarHBondContact O-N 3.28Å; Y701-T705 PolarHBondContact O-OG1 3.34Å
702	L	96	Very high	93.9	Very high	95 Å²	95	55.7 Å²	55.7	50%	0.497	27%	0.269	S	S	.	.	H	α-helix	trans	-62.5	-45.2	176	-175	74.5	0	0	0	111.4	F643 L698 F699 L700 T705 L706	F643-L702 HydrophobicContact CE1-CD2 3.96Å; F643-L702 HydrophobicContact CE1-CG 4.25Å; F643-L702 HydrophobicContact CZ-CD2 3.8Å; F643-L702 HydrophobicContact CZ-CG 4.05Å; L698-L702 WeakPolarHBondContact O-CB 3.25Å; L698-L702 PolarHBondContact O-N 3.34Å; F699-L702 PolarHBondContact O-N 2.94Å; L700-L702 PolarHBondContact O-N 2.95Å; L702-T705 PolarHBondContact O-OG1 3.47Å; L702-L706 WeakPolarHBondContact O-CB 3.41Å; L702-L706 PolarHBondContact O-N 2.97Å
703	F	96.5	Very high	94	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-63.6	-51.1	178.5	179	-98.3	0	0	0	111.9	F640 F643 L668 L671 I672 F699 L700 L706 F707	F640-F703 HydrophobicContact CD2-CE2 4.16Å; F640-F703 HydrophobicContact CD2-CZ 4.21Å; F640-F703 HydrophobicContact CE2-CE2 4.43Å; F640-F703 HydrophobicContact CE2-CZ 4.11Å; F643-F703 HydrophobicContact CB-CD2 3.93Å; F643-F703 HydrophobicContact CB-CE2 4.22Å; F643-F703 HydrophobicContact CD1-CB 3.95Å; F643-F703 AromaticContact CD1-CD2 3.69Å; F643-F703 HydrophobicContact CD1-CD2 3.69Å; F643-F703 HydrophobicContact CD1-CG 4.28Å; F643-F703 HydrophobicContact CD2-CD2 4.39Å; F643-F703 HydrophobicContact CE1-CB 3.94Å; F643-F703 HydrophobicContact CE1-CD2 4.27Å; F643-F703 AromaticContact CG-CD2 3.76Å; F643-F703 HydrophobicContact CG-CD2 3.76Å; F643-F703 HydrophobicContact CG-CE2 4.44Å; L668-F703 HydrophobicContact CB-CE1 4.14Å; L668-F703 HydrophobicContact CB-CE2 4.27Å; L668-F703 HydrophobicContact CB-CZ 3.69Å; L668-F703 HydrophobicContact CD1-CE2 4.38Å; L668-F703 HydrophobicContact CD2-CD1 3.86Å; L668-F703 HydrophobicContact CD2-CD2 4.13Å; L668-F703 HydrophobicContact CD2-CE1 3.75Å; L668-F703 HydrophobicContact CD2-CE2 4.01Å; L668-F703 HydrophobicContact CD2-CG 4.06Å; L668-F703 HydrophobicContact CD2-CZ 3.82Å; L668-F703 HydrophobicContact CG-CE2 4.46Å; L668-F703 HydrophobicContact CG-CZ 4.22Å; L668-F703 WeakPolarHBondContact O-CE1 3.27Å; L668-F703 WeakPolarHBondContact O-CZ 3.37Å; L671-F703 HydrophobicContact CB-CD1 4.44Å; L671-F703 HydrophobicContact CB-CE1 3.99Å; I672-F703 HydrophobicContact CD1-CZ 3.85Å; I672-F703 HydrophobicContact CG1-CE1 3.88Å; I672-F703 HydrophobicContact CG1-CZ 3.65Å; F699-F703 VanDerWaalsContact O-CB 3.28Å; F699-F703 WeakPolarHBondContact O-CB 3.49Å; F699-F703 PolarHBondContact O-N 3.48Å; L700-F703 PolarHBondContact O-N 3.36Å; F703-L706 PolarHBondContact O-N 2.88Å; F703-F707 AromaticContact CD2-CD2 3.49Å; F703-F707 HydrophobicContact CD2-CD2 3.49Å; F703-F707 VanDerWaalsContact CD2-CD2 3.49Å; F703-F707 AromaticContact CD2-CE2 3.69Å; F703-F707 HydrophobicContact CD2-CE2 3.69Å; F703-F707 HydrophobicContact CD2-CG 4.35Å; F703-F707 HydrophobicContact CE2-CD1 4.48Å; F703-F707 AromaticContact CE2-CD2 3.4Å; F703-F707 HydrophobicContact CE2-CD2 3.4Å; F703-F707 VanDerWaalsContact CE2-CD2 3.4Å; F703-F707 AromaticContact CE2-CE2 3.54Å; F703-F707 HydrophobicContact CE2-CE2 3.54Å; F703-F707 AromaticContact CE2-CG 3.92Å; F703-F707 HydrophobicContact CE2-CG 3.92Å; F703-F707 HydrophobicContact CE2-CZ 4.17Å; F703-F707 HydrophobicContact CG-CD2 4.24Å; F703-F707 HydrophobicContact CZ-CD2 4.08Å; F703-F707 HydrophobicContact CZ-CG 4.16Å; F703-F707 WeakPolarHBondContact O-CB 3.35Å; F703-F707 PolarHBondContact O-N 3.42Å
704	I	95.2	Very high	94.2	Very high	14 Å²	14	59.5 Å²	59.5	7%	0.072	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-50.3	-178	-68.7	163.2	0	0	0	110.4	M677 F681 L700 L706 I708	M677-I704 HydrophobicContact CG-CD1 4.03Å; M677-I704 HydrophobicContact SD-CD1 3.84Å; F681-I704 HydrophobicContact CE2-CD1 3.78Å; F681-I704 HydrophobicContact CZ-CD1 3.92Å; L700-I704 HydrophobicContact CB-CD1 4.46Å; L700-I704 WeakPolarHBondContact O-CB 3.4Å; L700-I704 WeakPolarHBondContact O-CD1 3.32Å; L700-I704 WeakPolarHBondContact O-CG1 3.33Å; L700-I704 PolarHBondContact O-N 3.14Å; I704-L706 PolarHBondContact O-N 3.14Å; I704-I708 HydrophobicContact CG2-CD1 3.85Å; I704-I708 HydrophobicContact CG2-CG1 4.42Å; I704-I708 VanDerWaalsContact O-CB 3.32Å; I704-I708 WeakPolarHBondContact O-CB 3.36Å; I704-I708 WeakPolarHBondContact O-CG1 3.24Å; I704-I708 PolarHBondContact O-N 2.82Å
705	T	93.7	Very high	94.3	Very high	65 Å²	65	58.4 Å²	58.4	40%	0.399	28%	0.284	S	S	.	.	H	α-helix	trans	-64.1	-39.2	179.8	53.7	0	0	0	0	112.7	Y701 L702 Y709	Y701-T705 WeakPolarHBondContact O-CB 3.23Å; Y701-T705 VanDerWaalsContact O-CG2 3.28Å; Y701-T705 WeakPolarHBondContact O-CG2 3.42Å; Y701-T705 PolarHBondContact O-N 3.28Å; Y701-T705 PolarHBondContact O-OG1 3.34Å; L702-T705 PolarHBondContact O-OG1 3.47Å; T705-Y709 HydrophobicContact CG2-CD2 4.15Å; T705-Y709 HydrophobicContact CG2-CE2 4.05Å; T705-Y709 WeakPolarHBondContact O-CB 3.1Å; T705-Y709 PolarHBondContact O-N 3.29Å
706	L	94.8	Very high	94.4	Very high	52 Å²	52	58.9 Å²	58.9	27%	0.272	29%	0.292	S	S	.	.	H	α-helix	trans	-68.6	-52.5	177.4	-179.2	65.3	0	0	0	111.9	F643 L702 F703 I704 V710 V711	F643-L706 HydrophobicContact CE2-CD2 3.77Å; F643-L706 HydrophobicContact CZ-CD2 4.04Å; L702-L706 WeakPolarHBondContact O-CB 3.41Å; L702-L706 PolarHBondContact O-N 2.97Å; F703-L706 PolarHBondContact O-N 2.88Å; I704-L706 PolarHBondContact O-N 3.14Å; L706-V710 HydrophobicContact CD1-CB 4.44Å; L706-V710 HydrophobicContact CD1-CG2 4.49Å; L706-V710 WeakPolarHBondContact O-CA 3.33Å; L706-V710 VanDerWaalsContact O-CB 3.23Å; L706-V710 WeakPolarHBondContact O-CB 3.35Å; L706-V710 PolarHBondContact O-N 2.88Å; L706-V710 VanDerWaalsContact O-N 3.14Å; L706-V711 PolarHBondContact O-N 3.44Å
707	F	96.3	Very high	94.5	Very high	8 Å²	8	62 Å²	62	4%	0.035	31%	0.311	C	S	.	.	I	π-helix	trans	-77.4	-40.1	-171.5	-82.6	-95.1	0	0	0	113.3	L639 F640 F643 I672 F703 V711 L712	L639-F707 HydrophobicContact CB-CZ 3.92Å; F640-F707 HydrophobicContact CB-CE1 3.99Å; F640-F707 HydrophobicContact CB-CZ 3.96Å; F640-F707 HydrophobicContact CD2-CE1 4.19Å; F640-F707 HydrophobicContact CD2-CZ 4.44Å; F643-F707 AromaticContact CD2-CE2 3.98Å; F643-F707 HydrophobicContact CD2-CE2 3.98Å; F643-F707 HydrophobicContact CE2-CE2 4.21Å; I672-F707 HydrophobicContact CD1-CB 4.31Å; I672-F707 HydrophobicContact CD1-CD1 3.72Å; I672-F707 HydrophobicContact CD1-CE1 4.4Å; I672-F707 HydrophobicContact CD1-CG 4.19Å; I672-F707 HydrophobicContact CG1-CB 3.89Å; I672-F707 HydrophobicContact CG1-CD1 4.25Å; I672-F707 HydrophobicContact CG1-CG 4.26Å; F703-F707 AromaticContact CD2-CD2 3.49Å; F703-F707 HydrophobicContact CD2-CD2 3.49Å; F703-F707 VanDerWaalsContact CD2-CD2 3.49Å; F703-F707 AromaticContact CD2-CE2 3.69Å; F703-F707 HydrophobicContact CD2-CE2 3.69Å; F703-F707 HydrophobicContact CD2-CG 4.35Å; F703-F707 HydrophobicContact CE2-CD1 4.48Å; F703-F707 AromaticContact CE2-CD2 3.4Å; F703-F707 HydrophobicContact CE2-CD2 3.4Å; F703-F707 VanDerWaalsContact CE2-CD2 3.4Å; F703-F707 AromaticContact CE2-CE2 3.54Å; F703-F707 HydrophobicContact CE2-CE2 3.54Å; F703-F707 AromaticContact CE2-CG 3.92Å; F703-F707 HydrophobicContact CE2-CG 3.92Å; F703-F707 HydrophobicContact CE2-CZ 4.17Å; F703-F707 HydrophobicContact CG-CD2 4.24Å; F703-F707 HydrophobicContact CZ-CD2 4.08Å; F703-F707 HydrophobicContact CZ-CG 4.16Å; F703-F707 WeakPolarHBondContact O-CB 3.35Å; F703-F707 PolarHBondContact O-N 3.42Å; F707-V711 HydrophobicContact CD1-CB 4.17Å; F707-V711 HydrophobicContact CD1-CG1 4.25Å; F707-V711 HydrophobicContact CD1-CG2 4.08Å; F707-V711 HydrophobicContact CE1-CG2 4.35Å; F707-V711 HydrophobicContact CG-CG2 4.35Å; F707-V711 WeakPolarHBondContact O-CB 3.35Å; F707-V711 PolarHBondContact O-N 3.48Å; F707-L712 WeakPolarHBondContact O-CB 3.35Å; F707-L712 PolarHBondContact O-N 3.17Å
708	I	94.6	Very high	94.7	Very high	39 Å²	39	60.9 Å²	60.9	20%	0.2	31%	0.309	C	S	.	.	I	π-helix	trans	-76.5	-53.2	179.5	-53.7	-172.2	0	0	0	110.4	I704 L712	I704-I708 HydrophobicContact CG2-CD1 3.85Å; I704-I708 HydrophobicContact CG2-CG1 4.42Å; I704-I708 VanDerWaalsContact O-CB 3.32Å; I704-I708 WeakPolarHBondContact O-CB 3.36Å; I704-I708 WeakPolarHBondContact O-CG1 3.24Å; I704-I708 PolarHBondContact O-N 2.82Å; I708-L712 WeakPolarHBondContact O-CB 3.34Å
709	Y	94.5	Very high	94.8	Very high	153 Å²	153	58.1 Å²	58.1	60%	0.6	30%	0.295	S	S	*	.	I	π-helix	trans	-84.1	-20.9	-171.5	-51.7	-41.1	0	0	0	114.8	T705 N713	T705-Y709 HydrophobicContact CG2-CD2 4.15Å; T705-Y709 HydrophobicContact CG2-CE2 4.05Å; T705-Y709 WeakPolarHBondContact O-CB 3.1Å; T705-Y709 PolarHBondContact O-N 3.29Å; Y709-N713 PolarHBondContact O-ND2 3.03Å
710	V	94.4	Very high	94.7	Very high	71 Å²	71	63.5 Å²	63.5	43%	0.43	32%	0.318	S	S	.	.	I	π-helix	trans	-108.8	-58.5	177.7	-167.8	0	0	0	0	111.5	L706 L714	L706-V710 HydrophobicContact CD1-CB 4.44Å; L706-V710 HydrophobicContact CD1-CG2 4.49Å; L706-V710 WeakPolarHBondContact O-CA 3.33Å; L706-V710 VanDerWaalsContact O-CB 3.23Å; L706-V710 WeakPolarHBondContact O-CB 3.35Å; L706-V710 PolarHBondContact O-N 2.88Å; L706-V710 VanDerWaalsContact O-N 3.14Å; V710-L714 HydrophobicContact CG1-CD1 4.08Å; V710-L714 WeakPolarHBondContact O-CB 3.12Å; V710-L714 VanDerWaalsContact O-CG 3.29Å; V710-L714 WeakPolarHBondContact O-CG 3.45Å; V710-L714 PolarHBondContact O-N 2.93Å
711	V	94.9	Very high	94.7	Very high	21 Å²	21	69.2 Å²	69.2	13%	0.127	35%	0.345	C	S	.	.	I	π-helix	trans	-68.8	-47.5	-170.9	-178.7	0	0	0	0	112.3	F632 A636 L706 F707 L714 F715	F632-V711 HydrophobicContact CE1-CG1 3.86Å; F632-V711 WeakPolarHBondContact CE1-O 3.38Å; F632-V711 HydrophobicContact CZ-CB 4.46Å; F632-V711 HydrophobicContact CZ-CG1 3.8Å; F632-V711 WeakPolarHBondContact CZ-O 3.31Å; A636-V711 HydrophobicContact CB-CG1 3.84Å; L706-V711 PolarHBondContact O-N 3.44Å; F707-V711 HydrophobicContact CD1-CB 4.17Å; F707-V711 HydrophobicContact CD1-CG1 4.25Å; F707-V711 HydrophobicContact CD1-CG2 4.08Å; F707-V711 HydrophobicContact CE1-CG2 4.35Å; F707-V711 HydrophobicContact CG-CG2 4.35Å; F707-V711 WeakPolarHBondContact O-CB 3.35Å; F707-V711 PolarHBondContact O-N 3.48Å; V711-L714 PolarHBondContact O-N 3.16Å; V711-F715 PolarHBondContact O-N 2.71Å
712	L	93.4	Very high	94.6	Very high	66 Å²	66	63.2 Å²	63.2	35%	0.346	32%	0.322	S	S	.	.	I	π-helix	trans	-66.5	-43.1	179.9	-172	156	0	0	0	111.4	F707 I708 L714 F715 V716	F707-L712 WeakPolarHBondContact O-CB 3.35Å; F707-L712 PolarHBondContact O-N 3.17Å; I708-L712 WeakPolarHBondContact O-CB 3.34Å; L712-L714 PolarHBondContact O-N 2.76Å; L712-F715 WeakPolarHBondContact O-CB 3.5Å; L712-F715 PolarHBondContact O-N 3.31Å; L712-F715 VanDerWaalsContact O-N 3.1Å; L712-V716 HydrophobicContact CD2-CG2 4.07Å; L712-V716 WeakPolarHBondContact O-CG2 3.36Å; L712-V716 PolarHBondContact O-N 3.09Å
713	N	93.7	Very high	94.4	Very high	86 Å²	86	62.6 Å²	62.6	46%	0.46	31%	0.314	S	S	.	.	H	α-helix	trans	-59.9	-41.8	175.3	-79	-26.7	0	0	0	112.7	Y709 F715 V716 T717	Y709-N713 PolarHBondContact O-ND2 3.03Å; N713-F715 VanDerWaalsContact C-N 3.34Å; N713-F715 PolarHBondContact O-N 3.03Å; N713-V716 PolarHBondContact O-N 3.09Å; N713-T717 PolarHBondContact O-N 3.14Å; N713-T717 PolarHBondContact O-OG1 3.2Å; N713-T717 VanDerWaalsContact O-OG1 3.08Å
714	L	94.3	Very high	94.2	Very high	83 Å²	83	65.3 Å²	65.3	44%	0.435	33%	0.326	S	S	.	.	H	α-helix	trans	-64.2	-37.2	173.4	-73.2	173.3	0	0	0	112.6	F632 V710 V711 L712 T717 I718	F632-L714 HydrophobicContact CE1-CB 4.36Å; F632-L714 HydrophobicContact CE2-CB 3.85Å; F632-L714 HydrophobicContact CE2-CD1 3.87Å; F632-L714 HydrophobicContact CZ-CB 3.6Å; F632-L714 HydrophobicContact CZ-CD1 4.15Å; V710-L714 HydrophobicContact CG1-CD1 4.08Å; V710-L714 WeakPolarHBondContact O-CB 3.12Å; V710-L714 VanDerWaalsContact O-CG 3.29Å; V710-L714 WeakPolarHBondContact O-CG 3.45Å; V710-L714 PolarHBondContact O-N 2.93Å; V711-L714 PolarHBondContact O-N 3.16Å; L712-L714 PolarHBondContact O-N 2.76Å; L714-T717 PolarHBondContact O-N 3.06Å; L714-I718 WeakPolarHBondContact O-CG1 2.77Å; L714-I718 PolarHBondContact O-N 2.95Å; L714-I718 VanDerWaalsContact O-N 3.1Å
715	F	92.8	Very high	93.8	Very high	82 Å²	82	67.7 Å²	67.7	36%	0.36	34%	0.337	S	S	.	.	H	α-helix	trans	-62.6	-41.9	175.7	-163.9	-85.3	0	0	0	111.8	L629 F632 V711 L712 N713 I718 I719	L629-F715 HydrophobicContact CB-CE2 4.36Å; L629-F715 HydrophobicContact CD1-CE1 4.24Å; L629-F715 HydrophobicContact CD1-CZ 4Å; L629-F715 HydrophobicContact CD2-CD1 4.07Å; L629-F715 HydrophobicContact CD2-CD2 3.81Å; L629-F715 HydrophobicContact CD2-CE1 4.03Å; L629-F715 HydrophobicContact CD2-CE2 3.76Å; L629-F715 HydrophobicContact CD2-CG 3.97Å; L629-F715 HydrophobicContact CD2-CZ 3.87Å; L629-F715 HydrophobicContact CG-CE2 4.44Å; L629-F715 HydrophobicContact CG-CZ 4.36Å; F632-F715 HydrophobicContact CD1-CD2 4.03Å; F632-F715 HydrophobicContact CE1-CB 4.13Å; F632-F715 HydrophobicContact CE1-CD2 4.2Å; V711-F715 PolarHBondContact O-N 2.71Å; L712-F715 WeakPolarHBondContact O-CB 3.5Å; L712-F715 PolarHBondContact O-N 3.31Å; L712-F715 VanDerWaalsContact O-N 3.1Å; N713-F715 VanDerWaalsContact C-N 3.34Å; N713-F715 PolarHBondContact O-N 3.03Å; F715-I718 PolarHBondContact O-N 3.25Å; F715-I719 HydrophobicContact CD1-CD1 3.79Å; F715-I719 HydrophobicContact CE1-CD1 3.69Å; F715-I719 PolarHBondContact O-N 3.24Å
716	V	94.3	Very high	93.5	Very high	78 Å²	78	65 Å²	65	47%	0.473	32%	0.321	S	S	.	.	H	α-helix	trans	-64.2	-44.9	174.7	174.2	0	0	0	0	111.2	L712 N713 I718 I719 F720	L712-V716 HydrophobicContact CD2-CG2 4.07Å; L712-V716 WeakPolarHBondContact O-CG2 3.36Å; L712-V716 PolarHBondContact O-N 3.09Å; N713-V716 PolarHBondContact O-N 3.09Å; V716-I718 VanDerWaalsContact C-N 3.33Å; V716-I718 PolarHBondContact O-N 3.05Å; V716-I719 PolarHBondContact O-N 3.36Å; V716-I719 VanDerWaalsContact O-N 3.1Å; V716-F720 PolarHBondContact O-N 3.16Å
717	T	95.3	Very high	93.1	Very high	66 Å²	66	66.3 Å²	66.3	41%	0.405	32%	0.324	S	S	.	.	H	α-helix	trans	-56.9	-43.8	176.8	-59.8	0	0	0	0	112.2	N713 L714 I719 F720 E721	N713-T717 PolarHBondContact O-N 3.14Å; N713-T717 PolarHBondContact O-OG1 3.2Å; N713-T717 VanDerWaalsContact O-OG1 3.08Å; L714-T717 PolarHBondContact O-N 3.06Å; T717-I719 VanDerWaalsContact C-N 3.29Å; T717-I719 PolarHBondContact O-N 3.1Å; T717-F720 PolarHBondContact O-N 3.27Å; T717-F720 VanDerWaalsContact O-N 3.14Å; T717-E721 HydrophobicContact CG2-CG 4.45Å; T717-E721 WeakPolarHBondContact O-CG 3.26Å; T717-E721 PolarHBondContact O-N 3.35Å
718	I	95.4	Very high	92.5	Very high	35 Å²	35	71.2 Å²	71.2	18%	0.179	35%	0.351	C	S	.	.	H	α-helix	trans	-63.2	-34.2	178.1	-65.3	163.1	0	0	0	111.9	L629 F632 L714 F715 V716 A722	L629-I718 HydrophobicContact CD2-CB 3.81Å; L629-I718 HydrophobicContact CD2-CD1 4.41Å; L629-I718 HydrophobicContact CD2-CG2 3.56Å; L629-I718 HydrophobicContact CG-CG2 3.93Å; F632-I718 HydrophobicContact CB-CD1 3.74Å; F632-I718 HydrophobicContact CD1-CD1 4.15Å; F632-I718 HydrophobicContact CD2-CD1 4.22Å; F632-I718 HydrophobicContact CG-CD1 3.77Å; L714-I718 WeakPolarHBondContact O-CG1 2.77Å; L714-I718 PolarHBondContact O-N 2.95Å; L714-I718 VanDerWaalsContact O-N 3.1Å; F715-I718 PolarHBondContact O-N 3.25Å; V716-I718 VanDerWaalsContact C-N 3.33Å; V716-I718 PolarHBondContact O-N 3.05Å; I718-A722 WeakPolarHBondContact O-CB 3.45Å; I718-A722 PolarHBondContact O-N 3.46Å
719	I	95	Very high	91.7	Very high	64 Å²	64	72.8 Å²	72.8	33%	0.328	36%	0.358	S	S	.	.	H	α-helix	trans	-71	-40.8	174.4	-68.4	166	0	0	0	110.8	T621 L629 F715 V716 T717 A722 Y723	T621-I719 HydrophobicContact CG2-CG2 4.39Å; L629-I719 HydrophobicContact CD1-CD1 4.28Å; L629-I719 HydrophobicContact CD1-CG1 3.92Å; L629-I719 HydrophobicContact CD2-CG1 4.17Å; F715-I719 HydrophobicContact CD1-CD1 3.79Å; F715-I719 HydrophobicContact CE1-CD1 3.69Å; F715-I719 PolarHBondContact O-N 3.24Å; V716-I719 PolarHBondContact O-N 3.36Å; V716-I719 VanDerWaalsContact O-N 3.1Å; T717-I719 VanDerWaalsContact C-N 3.29Å; T717-I719 PolarHBondContact O-N 3.1Å; I719-A722 PolarHBondContact O-N 2.76Å; I719-Y723 PolarHBondContact O-N 3.12Å
720	F	94.3	Very high	90.6	Very high	123 Å²	123	68.4 Å²	68.4	54%	0.539	34%	0.343	S	S	.	.	H	α-helix	trans	-66.5	-43.2	179.5	-176.1	-100.9	0	0	0	112.6	V716 T717 A722 Y723 E724	V716-F720 PolarHBondContact O-N 3.16Å; T717-F720 PolarHBondContact O-N 3.27Å; T717-F720 VanDerWaalsContact O-N 3.14Å; F720-A722 VanDerWaalsContact C-N 3.32Å; F720-A722 PolarHBondContact O-N 3.07Å; F720-Y723 WeakPolarHBondContact O-CB 3.46Å; F720-Y723 PolarHBondContact O-N 2.85Å; F720-E724 HydrophobicContact CE1-CG 4Å; F720-E724 HydrophobicContact CE2-CG 4.33Å; F720-E724 HydrophobicContact CZ-CG 3.84Å; F720-E724 PolarHBondContact O-N 3.14Å
721	E	95	Very high	89.3	Confident	122 Å²	122	68.9 Å²	68.9	57%	0.57	34%	0.343	S	S	*	.	H	α-helix	trans	-57.9	-44.3	172.7	-72.8	177.5	-178.4	0	0	111.6	T717 Y723 E725	T717-E721 HydrophobicContact CG2-CG 4.45Å; T717-E721 WeakPolarHBondContact O-CG 3.26Å; T717-E721 PolarHBondContact O-N 3.35Å; E721-Y723 VanDerWaalsContact C-N 3.26Å; E721-Y723 PolarHBondContact O-N 3.04Å; E721-E725 WeakPolarHBondContact O-CB 3.43Å; E721-E725 PolarHBondContact O-N 2.85Å
722	A	92.2	Very high	88	Confident	5 Å²	5	70.9 Å²	70.9	4%	0.041	36%	0.356	C	S	.	.	H	α-helix	trans	-69.2	-22.4	176.2	0	0	0	0	0	113.5	R624 I718 I719 F720 V726	R624-A722 HydrophobicContact CB-CB 4.29Å; R624-A722 HydrophobicContact CG-CB 4.12Å; I718-A722 WeakPolarHBondContact O-CB 3.45Å; I718-A722 PolarHBondContact O-N 3.46Å; I719-A722 PolarHBondContact O-N 2.76Å; F720-A722 VanDerWaalsContact C-N 3.32Å; F720-A722 PolarHBondContact O-N 3.07Å; A722-V726 WeakPolarHBondContact O-CG2 3.19Å; A722-V726 PolarHBondContact O-N 2.78Å
723	Y	92.1	Very high	86.6	Confident	82 Å²	82	71.1 Å²	71.1	32%	0.322	36%	0.355	S	S	.	.	H	α-helix	trans	-73.4	-52.8	173.6	172.1	-98	0	0	0	110.9	L617 T621 I719 F720 E721 E725 V726 K727	L617-Y723 HydrophobicContact CD1-CD2 4.47Å; L617-Y723 HydrophobicContact CD1-CE2 4.24Å; L617-Y723 HydrophobicContact CD2-CE2 3.75Å; L617-Y723 HydrophobicContact CG-CE2 4.02Å; T621-Y723 HydrophobicContact CG2-CD2 4.37Å; I719-Y723 PolarHBondContact O-N 3.12Å; F720-Y723 WeakPolarHBondContact O-CB 3.46Å; F720-Y723 PolarHBondContact O-N 2.85Å; E721-Y723 VanDerWaalsContact C-N 3.26Å; E721-Y723 PolarHBondContact O-N 3.04Å; Y723-E725 PolarHBondContact O-N 3.47Å; Y723-V726 PolarHBondContact O-N 2.67Å; Y723-K727 HydrophobicContact CE1-CD 3.84Å; Y723-K727 WeakPolarHBondContact O-CB 3.4Å; Y723-K727 PolarHBondContact O-N 3.4Å
724	E	91.5	Very high	85	Confident	56 Å²	56	68.3 Å²	68.3	26%	0.262	35%	0.346	S	S	.	.	H	α-helix	trans	-62.9	-39.4	179.1	-68.8	-62.7	130.3	0	0	111.6	F720 V726 K727 D728	F720-E724 HydrophobicContact CE1-CG 4Å; F720-E724 HydrophobicContact CE2-CG 4.33Å; F720-E724 HydrophobicContact CZ-CG 3.84Å; F720-E724 PolarHBondContact O-N 3.14Å; E724-V726 VanDerWaalsContact C-N 3.35Å; E724-V726 PolarHBondContact O-N 3.06Å; E724-K727 WeakPolarHBondContact O-CB 3.45Å; E724-K727 PolarHBondContact O-N 3.38Å; E724-K727 IonicContact OE1-NZ 3.4Å; E724-K727 PolarHBondContact OE1-NZ 3.04Å; E724-K727 IonicContact OE2-NZ 2.82Å; E724-K727 PolarHBondContact OE2-NZ 3.49Å; E724-D728 PolarHBondContact O-N 3.14Å
725	E	87.7	Confident	83.6	Confident	64 Å²	64	68.4 Å²	68.4	30%	0.299	34%	0.341	S	S	.	.	H	α-helix	trans	-60.8	-40.7	174.6	-177.4	-176.5	158.8	0	0	112.8	R624 E721 Y723 K727 M729	R624-E725 IonicContact CZ-OE1 3.22Å; R624-E725 VanDerWaalsContact CZ-OE1 3.26Å; R624-E725 IonicContact CZ-OE2 3.53Å; R624-E725 IonicContact NE-OE1 2.82Å; R624-E725 PolarHBondContact NE-OE1 2.95Å; R624-E725 IonicContact NE-OE2 3.75Å; R624-E725 PolarHBondContact NE-OE2 3.48Å; R624-E725 VanDerWaalsContact NE-OE2 3.15Å; R624-E725 IonicContact NH1-OE2 2.74Å; R624-E725 IonicContact NH2-OE1 3.17Å; R624-E725 PolarHBondContact NH2-OE1 3.2Å; R624-E725 IonicContact NH2-OE2 3.45Å; R624-E725 PolarHBondContact NH2-OE2 3.42Å; E721-E725 WeakPolarHBondContact O-CB 3.43Å; E721-E725 PolarHBondContact O-N 2.85Å; Y723-E725 PolarHBondContact O-N 3.47Å; E725-K727 VanDerWaalsContact C-N 3.35Å; E725-M729 HydrophobicContact CG-CE 3.85Å; E725-M729 WeakPolarHBondContact O-CG 3.41Å; E725-M729 PolarHBondContact O-N 3.14Å; E725-M729 WeakPolarHBondContact OE1-CE 3.34Å
726	V	86.4	Confident	82.1	Confident	9 Å²	9	67.8 Å²	67.8	6%	0.055	35%	0.347	C	S	.	.	H	α-helix	trans	-71.4	-33.3	178.5	170.3	0	0	0	0	111.5	L617 R620 R624 A722 Y723 E724 M729 Q730	L617-V726 HydrophobicContact CD1-CB 4.42Å; L617-V726 HydrophobicContact CD1-CG1 3.68Å; R620-V726 HydrophobicContact CB-CG1 3.55Å; R620-V726 HydrophobicContact CB-CG2 4.27Å; R624-V726 HydrophobicContact CB-CG2 3.82Å; R624-V726 HydrophobicContact CG-CG2 4.03Å; A722-V726 WeakPolarHBondContact O-CG2 3.19Å; A722-V726 PolarHBondContact O-N 2.78Å; Y723-V726 PolarHBondContact O-N 2.67Å; E724-V726 VanDerWaalsContact C-N 3.35Å; E724-V726 PolarHBondContact O-N 3.06Å; V726-M729 CarbonylContact O-C 3.52Å; V726-M729 WeakPolarHBondContact O-CB 3.48Å; V726-M729 PolarHBondContact O-N 2.99Å; V726-Q730 PolarHBondContact O-N 2.89Å
727	K	85.8	Confident	80.4	Confident	79 Å²	79	68.7 Å²	68.7	34%	0.343	35%	0.349	S	S	.	.	H	α-helix	trans	-69.1	-39.7	175.1	178.5	-177.3	164.8	-150.3	0	111.8	Y723 E724 E725 M729 Q730	Y723-K727 HydrophobicContact CE1-CD 3.84Å; Y723-K727 WeakPolarHBondContact O-CB 3.4Å; Y723-K727 PolarHBondContact O-N 3.4Å; E724-K727 WeakPolarHBondContact O-CB 3.45Å; E724-K727 PolarHBondContact O-N 3.38Å; E724-K727 IonicContact OE1-NZ 3.4Å; E724-K727 PolarHBondContact OE1-NZ 3.04Å; E724-K727 IonicContact OE2-NZ 2.82Å; E724-K727 PolarHBondContact OE2-NZ 3.49Å; E725-K727 VanDerWaalsContact C-N 3.35Å; K727-M729 VanDerWaalsContact C-N 3.34Å; K727-M729 PolarHBondContact O-N 3.46Å; K727-Q730 WeakPolarHBondContact O-CA 3.2Å; K727-Q730 WeakPolarHBondContact O-CB 3.36Å; K727-Q730 PolarHBondContact O-N 3.03Å
728	D	84.1	Confident	79	Confident	112 Å²	112	72.6 Å²	72.6	60%	0.599	37%	0.367	S	S	*	.	H	α-helix	trans	-63	-41.2	170	-80.9	-15.9	0	0	0	111.7	E724 Q730 N731	E724-D728 PolarHBondContact O-N 3.14Å; D728-Q730 PolarHBondContact O-N 3.47Å; D728-N731 WeakPolarHBondContact O-CB 3.1Å; D728-N731 PolarHBondContact O-ND2 2.89Å
729	M	77.5	Confident	78.2	Confident	72 Å²	72	71.9 Å²	71.9	36%	0.355	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-10.9	170.8	-69.7	-173.8	-165.7	0	0	113.7	Y613 E725 V726 K727 N731 T732 H733 G734	Y613-M729 PolarHBondContact OH-O 3.07Å; E725-M729 HydrophobicContact CG-CE 3.85Å; E725-M729 WeakPolarHBondContact O-CG 3.41Å; E725-M729 PolarHBondContact O-N 3.14Å; E725-M729 WeakPolarHBondContact OE1-CE 3.34Å; V726-M729 CarbonylContact O-C 3.52Å; V726-M729 WeakPolarHBondContact O-CB 3.48Å; V726-M729 PolarHBondContact O-N 2.99Å; K727-M729 VanDerWaalsContact C-N 3.34Å; K727-M729 PolarHBondContact O-N 3.46Å; M729-N731 PolarHBondContact O-N 2.95Å; M729-T732 CarbonylContact O-C 3.44Å; M729-T732 PolarHBondContact O-N 3.18Å; M729-T732 VanDerWaalsContact O-N 3.14Å; M729-T732 PolarHBondContact O-OG1 2.94Å; M729-T732 VanDerWaalsContact O-OG1 3.11Å; M729-H733 PolarHBondContact O-N 3.29Å; M729-H733 VanDerWaalsContact O-N 3.14Å; M729-G734 PolarHBondContact O-N 3.08Å
730	Q	73.1	Confident	77.7	Confident	60 Å²	60	71.6 Å²	71.6	28%	0.28	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-39.1	179.9	-156.6	175.5	-14.6	0	0	110.7	Y613 D614 V726 K727 D728 T732 H733	Y613-Q730 HydrophobicContact CD1-CG 4.09Å; Y613-Q730 HydrophobicContact CE1-CB 4.1Å; Y613-Q730 HydrophobicContact CE1-CG 3.48Å; Y613-Q730 VanDerWaalsContact CE1-CG 3.48Å; Y613-Q730 WeakPolarHBondContact CE1-O 3.37Å; Y613-Q730 WeakPolarHBondContact OH-CA 3.35Å; D614-Q730 PolarHBondContact OD1-NE2 3.48Å; V726-Q730 PolarHBondContact O-N 2.89Å; K727-Q730 WeakPolarHBondContact O-CA 3.2Å; K727-Q730 WeakPolarHBondContact O-CB 3.36Å; K727-Q730 PolarHBondContact O-N 3.03Å; D728-Q730 PolarHBondContact O-N 3.47Å; Q730-T732 PolarHBondContact O-N 3.14Å; Q730-H733 PolarHBondContact O-N 2.99Å; Q730-H733 VanDerWaalsContact O-N 3.14Å; Q730-H733 PolarHBondContact O-ND1 3.33Å
731	N	67	Low	77.3	Confident	81 Å²	81	65.7 Å²	65.7	43%	0.433	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.8	-43.9	173.4	-70.2	-47.9	0	0	0	113.5	D728 M729 H733 R830 Q834	D728-N731 WeakPolarHBondContact O-CB 3.1Å; D728-N731 PolarHBondContact O-ND2 2.89Å; M729-N731 PolarHBondContact O-N 2.95Å; N731-H733 VanDerWaalsContact C-N 3.31Å; N731-R830 VanDerWaalsContact O-CD 3.29Å; N731-R830 WeakPolarHBondContact O-CD 3.33Å; N731-R830 PolarHBondContact O-NH1 3.49Å; N731-Q834 VanDerWaalsContact CB-NE2 3.31Å; N731-Q834 PolarHBondContact OD1-NE2 2.92Å
732	T	68	Low	76.8	Confident	63 Å²	63	61.5 Å²	61.5	39%	0.387	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	6.8	-179.8	60.4	0	0	0	0	113.5	M729 Q730 G734 R735	M729-T732 CarbonylContact O-C 3.44Å; M729-T732 PolarHBondContact O-N 3.18Å; M729-T732 VanDerWaalsContact O-N 3.14Å; M729-T732 PolarHBondContact O-OG1 2.94Å; M729-T732 VanDerWaalsContact O-OG1 3.11Å; Q730-T732 PolarHBondContact O-N 3.14Å; T732-G734 PolarHBondContact O-N 2.86Å; T732-R735 PolarHBondContact O-N 3.04Å
733	H	64.1	Low	76.4	Confident	72 Å²	72	66.5 Å²	66.5	33%	0.333	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	36.2	-172.5	-76.6	-21.4	0	0	0	113.9	Y613 M729 Q730 N731 R735 R830	Y613-H733 AromaticContact CD1-CE1 3.79Å; Y613-H733 AromaticContact CD1-ND1 3.31Å; Y613-H733 VanDerWaalsContact CD1-ND1 3.31Å; Y613-H733 WeakPolarHBondContact CD1-ND1 3.37Å; Y613-H733 HydrophobicContact CE1-CB 4.49Å; Y613-H733 AromaticContact CE1-ND1 3.43Å; Y613-H733 WeakPolarHBondContact CE1-ND1 3.46Å; Y613-H733 AromaticContact CG-ND1 3.94Å; Y613-H733 VanDerWaalsContact CZ-C 3.48Å; M729-H733 PolarHBondContact O-N 3.29Å; M729-H733 VanDerWaalsContact O-N 3.14Å; Q730-H733 PolarHBondContact O-N 2.99Å; Q730-H733 VanDerWaalsContact O-N 3.14Å; Q730-H733 PolarHBondContact O-ND1 3.33Å; N731-H733 VanDerWaalsContact C-N 3.31Å; H733-R735 VanDerWaalsContact C-N 3.28Å; H733-R735 PolarHBondContact O-N 3.17Å; H733-R830 PolarHBondContact CD2-NH1 3.1Å; H733-R830 VanDerWaalsContact CD2-NH1 3.26Å; H733-R830 PolarHBondContact CE1-NH1 2.82Å; H733-R830 PolarHBondContact CE1-NH2 3.11Å; H733-R830 VanDerWaalsContact CG-NH1 3.3Å; H733-R830 PolarHBondContact ND1-NH1 3.05Å; H733-R830 PolarHBondContact NE2-NH1 3.19Å; H733-R830 VanDerWaalsContact NE2-NH1 3.18Å; H733-R830 PolarHBondContact NE2-NH2 2.85Å
734	G	59.3	Low	76.2	Confident	27 Å²	27	62.9 Å²	62.9	28%	0.278	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	24.7	172.8	0	0	0	0	0	114	Y613 M729 T732	Y613-G734 WeakPolarHBondContact OH-CA 3.48Å; Y613-G734 PolarHBondContact OH-N 2.84Å; M729-G734 PolarHBondContact O-N 3.08Å; T732-G734 PolarHBondContact O-N 2.86Å
735	R	64.8	Low	75.9	Confident	84 Å²	84	60.3 Å²	60.3	32%	0.317	32%	0.318	S	S	.	.			trans	-115.7	120.6	-179.6	-71.7	170.2	173.5	145.5	-0.1	109.7	T732 H733 N737 W742	T732-R735 PolarHBondContact O-N 3.04Å; H733-R735 VanDerWaalsContact C-N 3.28Å; H733-R735 PolarHBondContact O-N 3.17Å; R735-N737 PolarHBondContact O-N 3.44Å; R735-W742 HydrophobicContact CB-CD2 4.39Å; R735-W742 HydrophobicContact CB-CG 4.39Å; R735-W742 HydrophobicContact CG-CD2 3.92Å; R735-W742 HydrophobicContact CG-CE3 3.96Å; R735-W742 HydrophobicContact CG-CG 4.42Å; R735-W742 HydrophobicContact CG-CZ3 4.31Å
736	S	62.2	Low	75.5	Confident	69 Å²	69	58.3 Å²	58.3	48%	0.483	31%	0.31	S	S	.	.			trans	-72.8	120.4	174.6	-177.3	0	0	0	0	110.1	N738 S739	S736-N738 PolarHBondContact O-N 2.85Å; S736-N738 VanDerWaalsContact O-N 3.09Å; S736-N738 PolarHBondContact OG-N 3.08Å; S736-S739 PolarHBondContact O-N 3.33Å
737	N	57.8	Low	75.3	Confident	97 Å²	97	61.7 Å²	61.7	52%	0.519	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-18.6	172.9	-71	-19.7	0	0	0	112.7	R735	R735-N737 PolarHBondContact O-N 3.44Å
738	N	66.5	Low	75.1	Confident	148 Å²	148	61.7 Å²	61.7	79%	0.791	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-9.5	-176.3	-59.6	-1.4	0	0	0	113.2	S736 P740	S736-N738 PolarHBondContact O-N 2.85Å; S736-N738 VanDerWaalsContact O-N 3.09Å; S736-N738 PolarHBondContact OG-N 3.08Å; N738-P740 WeakPolarHBondContact O-CD 3.33Å
739	S	77.1	Confident	74.8	Confident	20 Å²	20	62.4 Å²	62.4	14%	0.14	32%	0.322	C	S	.	.			trans	-81.8	121.7	175.2	176.1	0	0	0	0	110.5	S736 L741 W742 H743	S736-S739 PolarHBondContact O-N 3.33Å; S739-L741 PolarHBondContact O-N 3.47Å; S739-L741 VanDerWaalsContact O-N 3.12Å; S739-W742 PolarHBondContact O-N 3.37Å; S739-W742 VanDerWaalsContact O-N 3.07Å; S739-H743 PolarHBondContact O-N 3.12Å
740	P	84.3	Confident	75	Confident	58 Å²	58	59.5 Å²	59.5	38%	0.377	31%	0.307	S	S	.	.	H	α-helix	trans	-57.2	-29.7	177.9	-25.5	34.6	0	0	0	113.3	F539 L547 N738 F744	F539-P740 HydrophobicContact CE1-CB 4.38Å; L547-P740 HydrophobicContact CD2-CB 4.15Å; N738-P740 WeakPolarHBondContact O-CD 3.33Å; P740-F744 WeakPolarHBondContact O-CB 3.04Å; P740-F744 PolarHBondContact O-N 2.88Å; P740-F744 VanDerWaalsContact O-N 3.08Å
741	L	86.4	Confident	75.4	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-67	-50	175.1	178.1	63.3	0	0	0	111.7	L186 F190 T535 F539 V550 F554 S739 F744 V745	L186-L741 HydrophobicContact CD1-CD1 3.95Å; F190-L741 HydrophobicContact CE2-CD2 4.3Å; F190-L741 HydrophobicContact CZ-CD2 4.04Å; T535-L741 HydrophobicContact CG2-CD1 4.06Å; F539-L741 HydrophobicContact CE2-CD1 4.3Å; F539-L741 HydrophobicContact CZ-CD1 4.42Å; V550-L741 HydrophobicContact CB-CD2 4.4Å; V550-L741 HydrophobicContact CG1-CD2 4.41Å; F554-L741 HydrophobicContact CE2-CD2 3.66Å; F554-L741 HydrophobicContact CZ-CD1 4.06Å; F554-L741 HydrophobicContact CZ-CD2 3.74Å; S739-L741 PolarHBondContact O-N 3.47Å; S739-L741 VanDerWaalsContact O-N 3.12Å; L741-F744 PolarHBondContact O-N 3.37Å; L741-V745 HydrophobicContact CD1-CG2 4.4Å; L741-V745 WeakPolarHBondContact O-CG2 3.09Å; L741-V745 PolarHBondContact O-N 2.92Å
742	W	84	Confident	75.8	Confident	33 Å²	33	58.3 Å²	58.3	13%	0.125	30%	0.304	C	S	.	.	H	α-helix	trans	-70.4	-34.5	179.3	-73.1	109.5	0	0	0	112.4	F190 E553 R735 S739 V745 C746	F190-W742 HydrophobicContact CB-CH2 3.78Å; F190-W742 HydrophobicContact CB-CZ3 4.27Å; F190-W742 AromaticContact CD1-CH2 3.78Å; F190-W742 HydrophobicContact CD1-CH2 3.78Å; F190-W742 HydrophobicContact CD1-CZ2 4.09Å; F190-W742 AromaticContact CD2-CH2 3.93Å; F190-W742 HydrophobicContact CD2-CH2 3.93Å; F190-W742 HydrophobicContact CD2-CZ3 4.26Å; F190-W742 HydrophobicContact CE1-CH2 4.37Å; F190-W742 HydrophobicContact CE1-CZ2 4.29Å; F190-W742 HydrophobicContact CE2-CH2 4.5Å; F190-W742 AromaticContact CG-CH2 3.55Å; F190-W742 HydrophobicContact CG-CH2 3.55Å; F190-W742 HydrophobicContact CG-CZ2 4.27Å; F190-W742 HydrophobicContact CG-CZ3 4.21Å; E553-W742 PolarHBondContact OE2-NE1 2.99Å; R735-W742 HydrophobicContact CB-CD2 4.39Å; R735-W742 HydrophobicContact CB-CG 4.39Å; R735-W742 HydrophobicContact CG-CD2 3.92Å; R735-W742 HydrophobicContact CG-CE3 3.96Å; R735-W742 HydrophobicContact CG-CG 4.42Å; R735-W742 HydrophobicContact CG-CZ3 4.31Å; S739-W742 PolarHBondContact O-N 3.37Å; S739-W742 VanDerWaalsContact O-N 3.07Å; W742-V745 HydrophobicContact CE3-CB 4.34Å; W742-V745 HydrophobicContact CE3-CG1 4.33Å; W742-V745 HydrophobicContact CZ3-CG1 4.19Å; W742-V745 PolarHBondContact O-N 3.07Å; W742-C746 WeakPolarHBondContact O-CB 3.38Å; W742-C746 PolarHBondContact O-N 3.12Å; W742-C746 PolarHBondContact O-SG 2.58Å
743	H	84.2	Confident	76.4	Confident	111 Å²	111	61.7 Å²	61.7	51%	0.514	31%	0.314	S	S	.	.	H	α-helix	trans	-57	-50.1	170.3	-176.1	-108.8	0	0	0	111	S739 V745 C746 Q747	S739-H743 PolarHBondContact O-N 3.12Å; H743-V745 PolarHBondContact O-N 3.24Å; H743-C746 PolarHBondContact O-N 3.5Å; H743-Q747 PolarHBondContact CE1-NE2 3.07Å; H743-Q747 PolarHBondContact ND1-NE2 2.96Å; H743-Q747 WeakPolarHBondContact O-CG 3.42Å; H743-Q747 PolarHBondContact O-N 3.03Å; H743-Q747 VanDerWaalsContact O-N 3.17Å
744	F	87.8	Confident	77.3	Confident	5 Å²	5	60 Å²	60	2%	0.022	31%	0.31	C	S	.	.	H	α-helix	trans	-59.3	-45.9	176.5	-179	-103.8	0	0	0	113.3	E179 R183 L186 F538 F539 F543 P740 L741	E179-F744 HydrophobicContact CG-CE2 3.49Å; E179-F744 VanDerWaalsContact CG-CE2 3.49Å; E179-F744 HydrophobicContact CG-CZ 3.78Å; E179-F744 WeakPolarHBondContact OE1-CE2 3.32Å; R183-F744 HydrophobicContact CB-CE1 3.76Å; R183-F744 HydrophobicContact CB-CZ 3.9Å; R183-F744 WeakPolarHBondContact CD-O 3.22Å; R183-F744 HydrophobicContact CG-CD1 4.33Å; R183-F744 HydrophobicContact CG-CE1 4.04Å; R183-F744 HydrophobicContact CG-CZ 4.37Å; R183-F744 PolarHBondContact NE-O 3.08Å; L186-F744 HydrophobicContact CD1-CD1 3.84Å; L186-F744 HydrophobicContact CD1-CE1 3.86Å; F538-F744 HydrophobicContact CE1-CE1 4.16Å; F538-F744 HydrophobicContact CE1-CE2 4.12Å; F538-F744 AromaticContact CE1-CZ 3.67Å; F538-F744 HydrophobicContact CE1-CZ 3.67Å; F538-F744 HydrophobicContact CZ-CE2 4.49Å; F538-F744 HydrophobicContact CZ-CZ 4.07Å; F539-F744 HydrophobicContact CE1-CB 4.41Å; F539-F744 HydrophobicContact CE2-CD1 4.24Å; F539-F744 HydrophobicContact CE2-CG 4.43Å; F539-F744 HydrophobicContact CZ-CB 3.72Å; F539-F744 HydrophobicContact CZ-CD1 4.06Å; F539-F744 HydrophobicContact CZ-CD2 4.47Å; F539-F744 AromaticContact CZ-CG 3.84Å; F539-F744 HydrophobicContact CZ-CG 3.84Å; F543-F744 HydrophobicContact CE2-CD2 4.06Å; F543-F744 AromaticContact CE2-CE2 3.98Å; F543-F744 HydrophobicContact CE2-CE2 3.98Å; F543-F744 HydrophobicContact CZ-CD2 4.06Å; F543-F744 AromaticContact CZ-CE2 3.9Å; F543-F744 HydrophobicContact CZ-CE2 3.9Å; P740-F744 WeakPolarHBondContact O-CB 3.04Å; P740-F744 PolarHBondContact O-N 2.88Å; P740-F744 VanDerWaalsContact O-N 3.08Å; L741-F744 PolarHBondContact O-N 3.37Å
745	V	85.5	Confident	78.5	Confident	3 Å²	3	63 Å²	63	2%	0.018	32%	0.323	C	S	.	.	H	α-helix	trans	-70.9	-34.3	-178.2	174.4	0	0	0	0	112.4	L186 Y187 L741 W742 H743	L186-V745 HydrophobicContact CB-CG2 3.76Å; L186-V745 HydrophobicContact CD1-CG2 4.06Å; Y187-V745 HydrophobicContact CD2-CG1 4.05Å; L741-V745 HydrophobicContact CD1-CG2 4.4Å; L741-V745 WeakPolarHBondContact O-CG2 3.09Å; L741-V745 PolarHBondContact O-N 2.92Å; W742-V745 HydrophobicContact CE3-CB 4.34Å; W742-V745 HydrophobicContact CE3-CG1 4.33Å; W742-V745 HydrophobicContact CZ3-CG1 4.19Å; W742-V745 PolarHBondContact O-N 3.07Å; H743-V745 PolarHBondContact O-N 3.24Å
746	C	80.6	Confident	79.4	Confident	22 Å²	22	61.3 Å²	61.3	15%	0.149	32%	0.32	C	S	.	.	H	α-helix	trans	-89.9	-11	-174.6	-60.3	0	0	0	0	114.7	W742 H743 Q748 C826	W742-C746 WeakPolarHBondContact O-CB 3.38Å; W742-C746 PolarHBondContact O-N 3.12Å; W742-C746 PolarHBondContact O-SG 2.58Å; H743-C746 PolarHBondContact O-N 3.5Å; C746-Q748 PolarHBondContact O-N 2.83Å; C746-Q748 VanDerWaalsContact O-N 3.14Å; C746-C826 WeakPolarHBondContact O-CB 3.47Å
747	Q	81.3	Confident	80.5	Confident	79 Å²	79	58.2 Å²	58.2	37%	0.369	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-28.1	176.9	-91	175.2	27.9	0	0	114	H743	H743-Q747 PolarHBondContact CE1-NE2 3.07Å; H743-Q747 PolarHBondContact ND1-NE2 2.96Å; H743-Q747 WeakPolarHBondContact O-CG 3.42Å; H743-Q747 PolarHBondContact O-N 3.03Å; H743-Q747 VanDerWaalsContact O-N 3.17Å
748	Q	81.2	Confident	81.6	Confident	80 Å²	80	60.3 Å²	60.3	37%	0.374	30%	0.302	S	S	.	.	S	Bend	trans	-135.5	125.4	177.6	-175.2	173.1	6.7	0	0	110.2	C746 Y750	C746-Q748 PolarHBondContact O-N 2.83Å; C746-Q748 VanDerWaalsContact O-N 3.14Å; Q748-Y750 HydrophobicContact CB-CE2 4.26Å; Q748-Y750 HydrophobicContact CG-CE1 4.04Å; Q748-Y750 HydrophobicContact CG-CE2 4.29Å; Q748-Y750 PolarHBondContact OE1-OH 3.4Å
749	Y	78.2	Confident	82.4	Confident	126 Å²	126	58 Å²	58	49%	0.494	29%	0.286	S	S	.	.			trans	-76.7	136.9	171.1	178.6	-94.3	0	0	0	110.6	N751	Y749-N751 HydrophobicContact CE1-CB 4.22Å
750	Y	81.6	Confident	82.8	Confident	12 Å²	12	57.8 Å²	57.8	5%	0.047	28%	0.284	C	S	.	.			trans	-120	123.4	172.6	-62.3	-76.2	0	0	0	109.8	R183 R184 Y187 Q748 P752 F757	R183-Y750 HydrophobicContact CG-CE2 4.15Å; R184-Y750 HydrophobicContact CG-CD1 3.97Å; R184-Y750 HydrophobicContact CG-CD2 4.2Å; R184-Y750 HydrophobicContact CG-CE1 3.55Å; R184-Y750 HydrophobicContact CG-CE2 3.76Å; R184-Y750 HydrophobicContact CG-CG 4.29Å; R184-Y750 VanDerWaalsContact CG-CZ 3.42Å; Y187-Y750 HydrophobicContact CD1-CD2 4.29Å; Y187-Y750 HydrophobicContact CD2-CD2 4.14Å; Y187-Y750 WeakPolarHBondContact CE1-O 3.4Å; Y187-Y750 AromaticContact CG-CD2 3.99Å; Y187-Y750 HydrophobicContact CG-CD2 3.99Å; Y187-Y750 PolarHBondContact OH-O 2.94Å; Q748-Y750 HydrophobicContact CB-CE2 4.26Å; Q748-Y750 HydrophobicContact CG-CE1 4.04Å; Q748-Y750 HydrophobicContact CG-CE2 4.29Å; Q748-Y750 PolarHBondContact OE1-OH 3.4Å; Y750-P752 WeakPolarHBondContact O-CD 3.37Å; Y750-F757 HydrophobicContact CG-CZ 4.32Å
751	N	81	Confident	82.6	Confident	84 Å²	84	57 Å²	57	45%	0.449	28%	0.276	S	S	.	.			trans	-65.6	124.4	178.9	-177.2	-25.9	0	0	0	110.2	Y749 K753 S754	Y749-N751 HydrophobicContact CE1-CB 4.22Å; N751-K753 PolarHBondContact O-N 3.48Å; N751-K753 VanDerWaalsContact O-N 3.14Å; N751-K753 PolarHBondContact OD1-N 2.76Å; N751-S754 WeakPolarHBondContact O-CB 3.48Å; N751-S754 PolarHBondContact O-N 2.88Å; N751-S754 PolarHBondContact O-OG 3.37Å
752	P	76.5	Confident	82.4	Confident	32 Å²	32	62.1 Å²	62.1	21%	0.208	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-29.7	175.8	-29.3	36.2	0	0	0	116	M191 H198 A199 Y750 S754	M191-P752 HydrophobicContact CE-CB 3.41Å; M191-P752 VanDerWaalsContact CE-CB 3.41Å; M191-P752 HydrophobicContact CE-CG 3.52Å; H198-P752 CarbonylContact C-O 3.58Å; H198-P752 HydrophobicContact CB-CB 4.43Å; A199-P752 WeakPolarHBondContact CA-O 3.48Å; A199-P752 PolarHBondContact N-O 3.49Å; Y750-P752 WeakPolarHBondContact O-CD 3.37Å; P752-S754 VanDerWaalsContact C-N 3.33Å
753	K	79.8	Confident	82.4	Confident	133 Å²	133	63.2 Å²	63.2	58%	0.578	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-2.6	-179.2	-62	179.9	178.9	177.7	0	112.8	D138 N751	D138-K753 IonicContact OD1-NZ 2.92Å; D138-K753 PolarHBondContact OD1-NZ 2.85Å; N751-K753 PolarHBondContact O-N 3.48Å; N751-K753 VanDerWaalsContact O-N 3.14Å; N751-K753 PolarHBondContact OD1-N 2.76Å
754	S	83.6	Confident	82.3	Confident	36 Å²	36	63.9 Å²	63.9	25%	0.252	33%	0.326	S	S	.	.			trans	-77.2	146.3	-175.6	63.7	0	0	0	0	114.5	N751 P752 I756	N751-S754 WeakPolarHBondContact O-CB 3.48Å; N751-S754 PolarHBondContact O-N 2.88Å; N751-S754 PolarHBondContact O-OG 3.37Å; P752-S754 VanDerWaalsContact C-N 3.33Å; S754-I756 VanDerWaalsContact C-N 3.3Å; S754-I756 PolarHBondContact O-N 3.37Å; S754-I756 WeakPolarHBondContact OG-CG2 3.41Å
755	T	83.5	Confident	82.1	Confident	92 Å²	92	65.9 Å²	65.9	56%	0.564	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-18.7	-176.7	52.7	0	0	0	0	114.2	F757 K758 E759	T755-F757 PolarHBondContact O-N 2.74Å; T755-F757 VanDerWaalsContact O-N 3.07Å; T755-K758 WeakPolarHBondContact O-CA 3.42Å; T755-K758 WeakPolarHBondContact O-CB 3.32Å; T755-K758 PolarHBondContact O-N 2.91Å; T755-E759 WeakPolarHBondContact CB-OE1 3.4Å; T755-E759 PolarHBondContact O-N 3.37Å; T755-E759 PolarHBondContact OG1-OE1 3.41Å
756	I	85.2	Confident	82	Confident	48 Å²	48	70.4 Å²	70.4	25%	0.246	35%	0.354	C	S	.	.	H	α-helix	trans	-52.9	-34.2	-175.6	-159.1	166.1	0	0	0	113.8	S754 K758 E759 D760	S754-I756 VanDerWaalsContact C-N 3.3Å; S754-I756 PolarHBondContact O-N 3.37Å; S754-I756 WeakPolarHBondContact OG-CG2 3.41Å; I756-K758 VanDerWaalsContact C-N 3.33Å; I756-K758 PolarHBondContact O-N 2.86Å; I756-E759 PolarHBondContact O-N 3.35Å; I756-D760 WeakPolarHBondContact O-CB 3.39Å; I756-D760 PolarHBondContact O-N 3.48Å
757	F	83.9	Confident	82.1	Confident	4 Å²	4	75.3 Å²	75.3	2%	0.018	37%	0.374	C	S	.	.	H	α-helix	trans	-71.7	-26.3	177.3	-62.9	-71.9	0	0	0	113.6	R184 Y187 Y188 A199 K200 Y750 T755	R184-F757 HydrophobicContact CB-CE1 4.22Å; Y187-F757 HydrophobicContact CD1-CE1 4.21Å; Y187-F757 AromaticContact CD1-CZ 3.77Å; Y187-F757 HydrophobicContact CD1-CZ 3.77Å; Y187-F757 HydrophobicContact CE1-CZ 4.15Å; Y188-F757 HydrophobicContact CD2-CD1 4.32Å; A199-F757 HydrophobicContact CB-CB 4.25Å; A199-F757 HydrophobicContact CB-CD2 3.86Å; A199-F757 HydrophobicContact CB-CE2 4.48Å; A199-F757 HydrophobicContact CB-CG 4.17Å; K200-F757 WeakPolarHBondContact CE-O 3.37Å; K200-F757 PolarHBondContact NZ-O 3.29Å; Y750-F757 HydrophobicContact CG-CZ 4.32Å; T755-F757 PolarHBondContact O-N 2.74Å; T755-F757 VanDerWaalsContact O-N 3.07Å
758	K	82.1	Confident	82.3	Confident	140 Å²	140	72.9 Å²	72.9	61%	0.609	36%	0.364	S	S	*	.	H	α-helix	trans	-81.5	-41	174.5	-172.1	-177	176.4	-171.7	0	110.1	T755 I756 D761 T762	T755-K758 WeakPolarHBondContact O-CA 3.42Å; T755-K758 WeakPolarHBondContact O-CB 3.32Å; T755-K758 PolarHBondContact O-N 2.91Å; I756-K758 VanDerWaalsContact C-N 3.33Å; I756-K758 PolarHBondContact O-N 2.86Å; K758-D761 WeakPolarHBondContact O-CB 3.41Å; K758-D761 PolarHBondContact O-N 3.39Å; K758-D761 VanDerWaalsContact O-N 3.15Å; K758-T762 PolarHBondContact O-N 2.96Å; K758-T762 PolarHBondContact O-OG1 2.66Å
759	E	83.6	Confident	82.4	Confident	99 Å²	99	69 Å²	69	46%	0.463	35%	0.346	S	S	.	.	H	α-helix	trans	-59.8	-47.1	175.4	-69.1	155.8	-153.1	0	0	111.9	T755 I756 D761 T762 R763	T755-E759 WeakPolarHBondContact CB-OE1 3.4Å; T755-E759 PolarHBondContact O-N 3.37Å; T755-E759 PolarHBondContact OG1-OE1 3.41Å; I756-E759 PolarHBondContact O-N 3.35Å; E759-D761 PolarHBondContact O-N 2.97Å; E759-D761 VanDerWaalsContact O-N 3.16Å; E759-T762 PolarHBondContact O-N 3.38Å; E759-T762 PolarHBondContact O-OG1 2.92Å; E759-T762 VanDerWaalsContact O-OG1 3.12Å; E759-R763 WeakPolarHBondContact O-CB 3.4Å; E759-R763 PolarHBondContact O-N 3.04Å
760	D	84.2	Confident	82.7	Confident	16 Å²	16	66 Å²	66	9%	0.086	33%	0.334	C	S	.	.	H	α-helix	trans	-58.1	-26.2	174.8	-82	-23.6	0	0	0	113.5	R184 I756	R184-D760 IonicContact CZ-OD1 2.73Å; R184-D760 IonicContact CZ-OD2 3.43Å; R184-D760 IonicContact NE-OD1 3.27Å; R184-D760 IonicContact NE-OD2 3.41Å; R184-D760 PolarHBondContact NE-OD2 2.83Å; R184-D760 IonicContact NH2-OD1 3.21Å; R184-D760 PolarHBondContact NH2-OD1 2.95Å; R184-D760 IonicContact NH2-OD2 2.68Å; R184-D760 PolarHBondContact NH2-OD2 3.38Å; I756-D760 WeakPolarHBondContact O-CB 3.39Å; I756-D760 PolarHBondContact O-N 3.48Å
761	D	80.3	Confident	82.8	Confident	41 Å²	41	68.1 Å²	68.1	22%	0.219	34%	0.344	C	S	.	.	H	α-helix	trans	-78	-35.8	176.4	-101.9	13.2	0	0	0	111.9	K200 R202 K758 E759 R766	K200-D761 IonicContact NZ-OD1 3.78Å; K200-D761 PolarHBondContact NZ-OD1 2.88Å; K200-D761 IonicContact NZ-OD2 2.81Å; K200-D761 PolarHBondContact NZ-OD2 3.08Å; R202-D761 IonicContact CZ-OD2 3.84Å; R202-D761 IonicContact NH1-OD2 3.63Å; R202-D761 PolarHBondContact NH1-OD2 3.41Å; R202-D761 IonicContact NH2-OD2 2.67Å; R202-D761 PolarHBondContact NH2-OD2 2.68Å; K758-D761 WeakPolarHBondContact O-CB 3.41Å; K758-D761 PolarHBondContact O-N 3.39Å; K758-D761 VanDerWaalsContact O-N 3.15Å; E759-D761 PolarHBondContact O-N 2.97Å; E759-D761 VanDerWaalsContact O-N 3.16Å; D761-R766 PolarHBondContact O-NH1 2.92Å; D761-R766 IonicContact OD1-NH1 2.79Å
762	T	82.4	Confident	82.9	Confident	108 Å²	108	64.9 Å²	64.9	66%	0.663	33%	0.327	S	S	*	.	H	α-helix	trans	-95.3	-5	-174.7	51	0	0	0	0	114.7	K758 E759	K758-T762 PolarHBondContact O-N 2.96Å; K758-T762 PolarHBondContact O-OG1 2.66Å; E759-T762 PolarHBondContact O-N 3.38Å; E759-T762 PolarHBondContact O-OG1 2.92Å; E759-T762 VanDerWaalsContact O-OG1 3.12Å
763	R	84.1	Confident	83.2	Confident	56 Å²	56	63.5 Å²	63.5	21%	0.211	32%	0.318	C	S	.	.			trans	-64	128.9	-175.9	-179.8	166.1	-178.7	159.1	0.3	112.7	E177 E759 D765 R766	E177-R763 VanDerWaalsContact CD-NH2 3.31Å; E177-R763 IonicContact OE1-CZ 3.26Å; E177-R763 IonicContact OE1-NH1 2.81Å; E177-R763 PolarHBondContact OE1-NH1 2.95Å; E177-R763 IonicContact OE1-NH2 2.81Å; E177-R763 PolarHBondContact OE1-NH2 2.98Å; E177-R763 IonicContact OE2-NH2 2.76Å; E759-R763 WeakPolarHBondContact O-CB 3.4Å; E759-R763 PolarHBondContact O-N 3.04Å; R763-D765 WeakPolarHBondContact CD-OD1 3.4Å; R763-D765 WeakPolarHBondContact CG-OD1 3.41Å; R763-D765 IonicContact CZ-OD1 3.15Å; R763-D765 IonicContact CZ-OD2 2.68Å; R763-D765 IonicContact NE-OD1 2.94Å; R763-D765 PolarHBondContact NE-OD1 3.47Å; R763-D765 IonicContact NE-OD2 2.76Å; R763-D765 PolarHBondContact NE-OD2 3.35Å; R763-D765 IonicContact NH2-OD1 3.76Å; R763-D765 IonicContact NH2-OD2 2.88Å; R763-D765 PolarHBondContact NH2-OD2 3.47Å; R763-R766 HydrophobicContact CB-CB 4.5Å; R763-R766 WeakPolarHBondContact O-CB 3.48Å; R763-R766 PolarHBondContact O-N 3.14Å
764	P	82	Confident	83.2	Confident	126 Å²	126	58.1 Å²	58.1	82%	0.818	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-38.7	-174.3	26.7	-34.7	0	0	0	113.5	R766	P764-R766 PolarHBondContact O-N 3.01Å
765	D	84.1	Confident	82.6	Confident	47 Å²	47	58.4 Å²	58.4	25%	0.251	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	14.5	179	59.4	-50.3	0	0	0	113.6	I173 R763 H767 L768 L769	I173-D765 HydrophobicContact CD1-CB 4.21Å; I173-D765 VanDerWaalsContact CD1-OD2 3.31Å; I173-D765 WeakPolarHBondContact CD1-OD2 3.42Å; R763-D765 WeakPolarHBondContact CD-OD1 3.4Å; R763-D765 WeakPolarHBondContact CG-OD1 3.41Å; R763-D765 IonicContact CZ-OD1 3.15Å; R763-D765 IonicContact CZ-OD2 2.68Å; R763-D765 IonicContact NE-OD1 2.94Å; R763-D765 PolarHBondContact NE-OD1 3.47Å; R763-D765 IonicContact NE-OD2 2.76Å; R763-D765 PolarHBondContact NE-OD2 3.35Å; R763-D765 IonicContact NH2-OD1 3.76Å; R763-D765 IonicContact NH2-OD2 2.88Å; R763-D765 PolarHBondContact NH2-OD2 3.47Å; D765-H767 PolarHBondContact O-N 3.14Å; D765-L768 WeakPolarHBondContact O-CB 3.47Å; D765-L768 PolarHBondContact O-N 3.12Å; D765-L769 PolarHBondContact O-N 3.22Å
766	R	82.9	Confident	81.8	Confident	97 Å²	97	61.4 Å²	61.4	37%	0.366	31%	0.306	S	S	.	.	H	α-helix	trans	-58.2	-29.2	177.7	174.8	178.6	163.5	-175.3	-4.4	114	D761 R763 P764 Y770	D761-R766 PolarHBondContact O-NH1 2.92Å; D761-R766 IonicContact OD1-NH1 2.79Å; R763-R766 HydrophobicContact CB-CB 4.5Å; R763-R766 WeakPolarHBondContact O-CB 3.48Å; R763-R766 PolarHBondContact O-N 3.14Å; P764-R766 PolarHBondContact O-N 3.01Å; R766-Y770 PolarHBondContact O-N 3.41Å
767	H	83.3	Confident	80.2	Confident	125 Å²	125	61.9 Å²	61.9	58%	0.579	31%	0.311	S	S	*	.	H	α-helix	trans	-65.1	-46	173.2	-169	-87.7	0	0	0	111.2	D765 Y770 E771	D765-H767 PolarHBondContact O-N 3.14Å; H767-Y770 WeakPolarHBondContact O-CB 3.35Å; H767-Y770 PolarHBondContact O-N 3.49Å; H767-Y770 VanDerWaalsContact O-N 3.13Å; H767-E771 IonicContact CE1-OE1 3.37Å; H767-E771 PolarHBondContact CE1-OE1 3.24Å; H767-E771 VanDerWaalsContact CE1-OE1 3.27Å; H767-E771 IonicContact CE1-OE2 3.46Å; H767-E771 PolarHBondContact CE1-OE2 3Å; H767-E771 IonicContact ND1-OE1 3.77Å; H767-E771 IonicContact ND1-OE2 2.74Å; H767-E771 PolarHBondContact ND1-OE2 3.49Å; H767-E771 PolarHBondContact O-N 3.21Å
768	L	84.8	Confident	78.3	Confident	28 Å²	28	67.5 Å²	67.5	15%	0.147	34%	0.339	C	S	.	.	H	α-helix	trans	-66.4	-39.8	-179.9	-177.4	63.3	0	0	0	111.5	T171 I173 D765 Y770 E771 Q772	T171-L768 HydrophobicContact CG2-CD1 4.16Å; I173-L768 HydrophobicContact CD1-CB 3.92Å; I173-L768 HydrophobicContact CD1-CD2 3.77Å; I173-L768 HydrophobicContact CD1-CG 3.72Å; I173-L768 HydrophobicContact CG1-CD2 3.63Å; I173-L768 HydrophobicContact CG1-CG 3.96Å; D765-L768 WeakPolarHBondContact O-CB 3.47Å; D765-L768 PolarHBondContact O-N 3.12Å; L768-Y770 VanDerWaalsContact C-N 3.29Å; L768-Y770 PolarHBondContact O-N 2.97Å; L768-E771 PolarHBondContact O-N 3.06Å; L768-Q772 HydrophobicContact CD1-CG 4.26Å; L768-Q772 WeakPolarHBondContact O-CB 3.4Å; L768-Q772 WeakPolarHBondContact O-CG 3.48Å; L768-Q772 PolarHBondContact O-N 3.15Å
769	L	84	Confident	75.9	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-55.6	-43.8	170.3	-74.5	173.7	0	0	0	112.1	I173 V178 W181 D765 A773	I173-L769 HydrophobicContact CB-CD2 4.42Å; I173-L769 HydrophobicContact CD1-CB 4.4Å; I173-L769 HydrophobicContact CD1-CD2 3.59Å; I173-L769 HydrophobicContact CD1-CG 3.59Å; I173-L769 HydrophobicContact CG2-CD2 3.87Å; V178-L769 HydrophobicContact CG2-CD2 4Å; W181-L769 HydrophobicContact CB-CD1 4.34Å; W181-L769 HydrophobicContact CD2-CB 4.19Å; W181-L769 HydrophobicContact CD2-CD1 4.31Å; W181-L769 HydrophobicContact CE3-CB 4.4Å; W181-L769 HydrophobicContact CG-CD1 3.86Å; D765-L769 PolarHBondContact O-N 3.22Å; L769-A773 VanDerWaalsContact O-CB 3.27Å; L769-A773 WeakPolarHBondContact O-CB 3.3Å; L769-A773 PolarHBondContact O-N 3.3Å
770	Y	83.7	Confident	73.4	Confident	63 Å²	63	68.2 Å²	68.2	25%	0.247	36%	0.362	C	S	.	.	H	α-helix	trans	-68.3	-44.4	180	178.6	-96.5	0	0	0	112.2	W181 R530 E534 R766 H767 L768 A773 L774	W181-Y770 HydrophobicContact CH2-CD2 4.21Å; R530-Y770 PolarHBondContact NH2-OH 3.05Å; E534-Y770 HydrophobicContact CG-CE2 4.03Å; E534-Y770 WeakPolarHBondContact OE1-CE2 3.49Å; R766-Y770 PolarHBondContact O-N 3.41Å; H767-Y770 WeakPolarHBondContact O-CB 3.35Å; H767-Y770 PolarHBondContact O-N 3.49Å; H767-Y770 VanDerWaalsContact O-N 3.13Å; L768-Y770 VanDerWaalsContact C-N 3.29Å; L768-Y770 PolarHBondContact O-N 2.97Å; Y770-A773 PolarHBondContact O-N 3Å; Y770-L774 HydrophobicContact CD1-CD1 4.16Å; Y770-L774 HydrophobicContact CD2-CD1 4.25Å; Y770-L774 HydrophobicContact CE1-CD1 3.59Å; Y770-L774 HydrophobicContact CE2-CD1 3.71Å; Y770-L774 HydrophobicContact CG-CD1 4.47Å; Y770-L774 WeakPolarHBondContact O-CG 3.44Å; Y770-L774 PolarHBondContact O-N 3.16Å; Y770-L774 VanDerWaalsContact O-N 3.1Å
771	E	83.4	Confident	70.8	Confident	55 Å²	55	72.9 Å²	72.9	26%	0.257	39%	0.391	S	S	.	.	H	α-helix	trans	-65.4	-40.7	177.8	-73.4	-178.1	124.7	0	0	112.7	H767 L768 L774 G775 Y776 T777	H767-E771 IonicContact CE1-OE1 3.37Å; H767-E771 PolarHBondContact CE1-OE1 3.24Å; H767-E771 VanDerWaalsContact CE1-OE1 3.27Å; H767-E771 IonicContact CE1-OE2 3.46Å; H767-E771 PolarHBondContact CE1-OE2 3Å; H767-E771 IonicContact ND1-OE1 3.77Å; H767-E771 IonicContact ND1-OE2 2.74Å; H767-E771 PolarHBondContact ND1-OE2 3.49Å; H767-E771 PolarHBondContact O-N 3.21Å; L768-E771 PolarHBondContact O-N 3.06Å; E771-L774 CarbonylContact O-C 3.6Å; E771-L774 PolarHBondContact O-N 2.76Å; E771-G775 PolarHBondContact O-N 2.73Å; E771-Y776 PolarHBondContact O-N 3.47Å; E771-T777 HydrophobicContact CB-CG2 3.97Å
772	Q	83.6	Confident	68.6	Low	17 Å²	17	78 Å²	78	8%	0.079	42%	0.424	C	S	.	.	H	α-helix	trans	-69.7	-37.1	175.5	-71.2	-165.5	-29.4	0	0	112.7	I173 V178 W542 L768 L774 G775	I173-Q772 PolarHBondContact O-OE1 2.93Å; V178-Q772 HydrophobicContact CG1-CB 4.5Å; V178-Q772 HydrophobicContact CG2-CB 4.11Å; W542-Q772 PolarHBondContact NE1-O 3.3Å; L768-Q772 HydrophobicContact CD1-CG 4.26Å; L768-Q772 WeakPolarHBondContact O-CB 3.4Å; L768-Q772 WeakPolarHBondContact O-CG 3.48Å; L768-Q772 PolarHBondContact O-N 3.15Å; Q772-L774 VanDerWaalsContact C-N 3.28Å; Q772-L774 PolarHBondContact O-N 2.98Å; Q772-G775 PolarHBondContact O-N 3.41Å
773	A	82.4	Confident	66.4	Low	2 Å²	2	78 Å²	78	2%	0.017	42%	0.424	C	S	.	.	H	α-helix	trans	-61.4	-38.4	174	0	0	0	0	0	111.8	V178 W181 F538 W542 L769 Y770	V178-A773 HydrophobicContact CG1-CB 3.72Å; W181-A773 HydrophobicContact CZ3-CB 4.13Å; F538-A773 HydrophobicContact CD2-CB 4.1Å; W542-A773 PolarHBondContact NE1-O 2.96Å; L769-A773 VanDerWaalsContact O-CB 3.27Å; L769-A773 WeakPolarHBondContact O-CB 3.3Å; L769-A773 PolarHBondContact O-N 3.3Å; Y770-A773 PolarHBondContact O-N 3Å
774	L	80.8	Confident	64	Low	21 Å²	21	81.9 Å²	81.9	11%	0.11	45%	0.454	C	S	.	.	H	α-helix	trans	-91.8	-7.5	-179.5	-61.6	179.3	0	0	0	114.1	E534 N541 Y770 E771 Q772 Y776	E534-L774 HydrophobicContact CB-CD2 4.34Å; E534-L774 WeakPolarHBondContact O-CD2 3.27Å; N541-L774 PolarHBondContact ND2-O 3.41Å; Y770-L774 HydrophobicContact CD1-CD1 4.16Å; Y770-L774 HydrophobicContact CD2-CD1 4.25Å; Y770-L774 HydrophobicContact CE1-CD1 3.59Å; Y770-L774 HydrophobicContact CE2-CD1 3.71Å; Y770-L774 HydrophobicContact CG-CD1 4.47Å; Y770-L774 WeakPolarHBondContact O-CG 3.44Å; Y770-L774 PolarHBondContact O-N 3.16Å; Y770-L774 VanDerWaalsContact O-N 3.1Å; E771-L774 CarbonylContact O-C 3.6Å; E771-L774 PolarHBondContact O-N 2.76Å; Q772-L774 VanDerWaalsContact C-N 3.28Å; Q772-L774 PolarHBondContact O-N 2.98Å; L774-Y776 HydrophobicContact CB-CD2 3.67Å; L774-Y776 HydrophobicContact CB-CE2 3.42Å; L774-Y776 VanDerWaalsContact CB-CE2 3.42Å; L774-Y776 HydrophobicContact CD1-CE2 3.77Å; L774-Y776 HydrophobicContact CG-CE2 4.26Å
775	G	70.2	Confident	61.8	Low	41 Å²	41	80.6 Å²	80.6	42%	0.423	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	24.3	172.6	0	0	0	0	0	115.5	E771 Q772	E771-G775 PolarHBondContact O-N 2.73Å; Q772-G775 PolarHBondContact O-N 3.41Å
776	Y	66.2	Low	59.5	Low	156 Å²	156	84.5 Å²	84.5	61%	0.612	47%	0.473	S	S	*	.			trans	-77.4	-18.8	-175.8	-69.4	-65.7	0	0	0	114.8	E771 L774	E771-Y776 PolarHBondContact O-N 3.47Å; L774-Y776 HydrophobicContact CB-CD2 3.67Å; L774-Y776 HydrophobicContact CB-CE2 3.42Å; L774-Y776 VanDerWaalsContact CB-CE2 3.42Å; L774-Y776 HydrophobicContact CD1-CE2 3.77Å; L774-Y776 HydrophobicContact CG-CE2 4.26Å
777	T	52.9	Low	57.2	Low	57 Å²	57	84.8 Å²	84.8	35%	0.35	49%	0.486	S	S	.	.			trans	-112.9	57.6	-170	58.3	0	0	0	0	113.6	E771	E771-T777 HydrophobicContact CB-CG2 3.97Å
778	M	42.4	Very low	54.7	Low	123 Å²	123	85.8 Å²	85.8	61%	0.606	50%	0.496	S	S	*	.			trans	-137	36.1	179.3	-89.4	-102.1	175.5	0	0	113.1	F172	F172-M778 HydrophobicContact CE2-CE 4.13Å
779	T	32	Very low	52.3	Low	117 Å²	117	93.4 Å²	93.4	72%	0.718	53%	0.527	S	S	*	.			trans	-140.4	140.3	176.4	44.4	0	0	0	0	111.4
780	T	31.3	Very low	49.7	Very low	136 Å²	136	98.6 Å²	98.6	83%	0.834	56%	0.564	S	S	*	*			trans	64.2	135.9	-170.1	15.5	0	0	0	0	113.2
781	T	30.7	Very low	47.3	Very low	114 Å²	114	100.4 Å²	100.4	70%	0.699	59%	0.586	S	S	*	*			cis	-150.2	139.7	23.5	-22.3	0	0	0	0	110.7
782	T	33.2	Very low	44.7	Very low	149 Å²	149	103.2 Å²	103.2	91%	0.914	61%	0.607	S	S	*	*			trans	-137.1	107.9	161.3	46.6	0	0	0	0	109.6
783	T	35.8	Very low	42.2	Very low	108 Å²	108	109.4 Å²	109.4	66%	0.663	64%	0.641	S	S	*	*			trans	-116.4	133.3	178.1	38.6	0	0	0	0	110.6
784	T	34	Very low	39.7	Very low	137 Å²	137	118.3 Å²	118.3	84%	0.84	68%	0.682	S	S	*	*			trans	65.1	143.1	159.7	53.5	0	0	0	0	116.9
785	S	35.7	Very low	37	Very low	100 Å²	100	123.4 Å²	123.4	70%	0.699	72%	0.718	S	S	*	*			cis	-160.5	157.1	16.7	43.3	0	0	0	0	112.8
786	V	35.6	Very low	35	Very low	128 Å²	128	131.4 Å²	131.4	78%	0.776	74%	0.741	S	S	*	*			trans	64.5	129.8	140.5	165.5	0	0	0	0	118.4
787	T	34.6	Very low	33.2	Very low	104 Å²	104	132.5 Å²	132.5	64%	0.638	75%	0.751	S	S	*	*			cis	-166	152.9	0.9	20.3	0	0	0	0	111.5
788	N	32.3	Very low	31.8	Very low	146 Å²	146	135.2 Å²	135.2	78%	0.781	77%	0.772	S	S	*	*			trans	59.2	132	148.7	-59.9	-20.2	0	0	0	118.9
789	K	34.1	Very low	31.1	Very low	187 Å²	187	138.4 Å²	138.4	81%	0.813	78%	0.783	S	S	*	*			cis	-160.9	153.9	31.9	-126.2	168.8	-175.1	179.9	0	111.4
790	S	29.6	Very low	31	Very low	109 Å²	109	140.3 Å²	140.3	76%	0.762	79%	0.788	S	S	*	*			trans	5.1	139.3	157.8	57.3	0	0	0	0	120.2
791	S	33.5	Very low	30.7	Very low	101 Å²	101	140.5 Å²	140.5	71%	0.706	78%	0.783	S	S	*	*			cis	-162.5	139.8	37.5	54.6	0	0	0	0	115.2
792	T	28.6	Very low	30.5	Very low	114 Å²	114	144.4 Å²	144.4	70%	0.699	79%	0.785	S	S	*	*			trans	26.7	121.6	139.7	54.2	0	0	0	0	118.8
793	D	30.2	Very low	30.3	Very low	148 Å²	148	141.4 Å²	141.4	79%	0.791	77%	0.771	S	S	*	*			cis	-169.5	164.9	40.8	-89.6	-31.7	0	0	0	115.1
794	E	29.2	Very low	29.9	Very low	188 Å²	188	144.8 Å²	144.8	88%	0.879	78%	0.779	S	S	*	*			trans	61.7	86.4	159.5	-64.7	-160.5	137.5	0	0	123.7
795	C	24	Very low	29.9	Very low	129 Å²	129	146.4 Å²	146.4	87%	0.872	77%	0.774	S	S	*	*			trans	17.9	109.2	133.8	-77.2	0	0	0	0	122.3
796	K	28.7	Very low	29.8	Very low	208 Å²	208	144.8 Å²	144.8	90%	0.904	76%	0.762	S	S	*	*				-159.8	130.4	124.2	-111.2	160.1	-172.5	168.5	0	112.7	S798	K796-S798 PolarHBondContact O-N 3.28Å
797	H	28.7	Very low	29.8	Very low	179 Å²	179	149.2 Å²	149.2	83%	0.829	76%	0.764	S	S	*	*			trans	-20.4	115.3	-176	-84.9	-95.8	0	0	0	118.4	F799	H797-F799 PolarHBondContact O-N 2.85Å
798	S	24.1	Very low	29.9	Very low	114 Å²	114	150.9 Å²	150.9	80%	0.797	77%	0.765	S	S	*	*			trans	-76.2	93.7	165.5	42.6	0	0	0	0	111.8	K796 I800	K796-S798 PolarHBondContact O-N 3.28Å; S798-I800 PolarHBondContact O-N 2.7Å
799	F	27.7	Very low	30.2	Very low	191 Å²	191	148.6 Å²	148.6	84%	0.838	75%	0.75	S	S	*	*			trans	-71.7	116.3	158.8	-104.5	-90.6	0	0	0	109	H797 N801	H797-F799 PolarHBondContact O-N 2.85Å; F799-N801 PolarHBondContact O-N 3.13Å
800	I	28.7	Very low	30.6	Very low	157 Å²	157	146.3 Å²	146.3	81%	0.805	74%	0.742	S	S	*	*			trans	-62.6	119.1	177.6	-67.7	174.2	0	0	0	109.2	S798 R802	S798-I800 PolarHBondContact O-N 2.7Å; I800-R802 PolarHBondContact O-N 3.26Å
801	N	25.5	Very low	31.1	Very low	139 Å²	139	150.1 Å²	150.1	74%	0.743	74%	0.739	S	S	*	*			trans	-63	89.4	176.7	-96.1	-44.5	0	0	0	111.3	F799 S803	F799-N801 PolarHBondContact O-N 3.13Å; N801-S803 PolarHBondContact O-N 3.45Å; N801-S803 PolarHBondContact OD1-OG 2.74Å; N801-S803 VanDerWaalsContact OD1-OG 3.05Å
802	R	27.1	Very low	31.3	Very low	196 Å²	196	153 Å²	153	74%	0.74	74%	0.735	S	S	*	*			trans	-90.8	41.5	164	-140.4	177.5	-165.8	-173	5.9	111.5	I800	I800-R802 PolarHBondContact O-N 3.26Å
803	S	28.1	Very low	31.7	Very low	87 Å²	87	154.9 Å²	154.9	61%	0.608	73%	0.729	S	S	*	*			trans	-103.1	16.8	-179.7	50.7	0	0	0	0	112.9	N801	N801-S803 PolarHBondContact O-N 3.45Å; N801-S803 PolarHBondContact OD1-OG 2.74Å; N801-S803 VanDerWaalsContact OD1-OG 3.05Å
804	Q	28.4	Very low	32.3	Very low	178 Å²	178	152.8 Å²	152.8	83%	0.832	72%	0.718	S	S	*	*			trans	-134.2	69.8	176.6	-70.2	-172.7	-14.9	0	0	112.2
805	F	33.8	Very low	32.7	Very low	171 Å²	171	149.8 Å²	149.8	75%	0.75	70%	0.704	S	S	*	*	S	Bend	trans	-92.4	134.1	144.3	-110.6	-87.6	0	0	0	107.5	R807	F805-R807 PolarHBondContact O-N 3.38Å
806	P	33.2	Very low	33.2	Very low	67 Å²	67	150.5 Å²	150.5	44%	0.435	69%	0.694	S	S	.	*			trans	-74.5	112.2	-161.8	-12.5	27.1	0	0	0	111.3	Q808 Q809 Q810	P806-Q808 PolarHBondContact O-N 2.73Å; P806-Q809 HydrophobicContact CB-CB 4.2Å; P806-Q809 HydrophobicContact CG-CB 4.48Å; P806-Q809 PolarHBondContact O-N 3.33Å; P806-Q810 PolarHBondContact O-N 3.01Å
807	R	35.6	Very low	33.7	Very low	220 Å²	220	147.2 Å²	147.2	83%	0.83	68%	0.681	S	S	*	*	H	α-helix	trans	-52.1	-22.9	168.6	-75.6	-178.5	171.7	178.2	-3	112.6	F805 R811	F805-R807 PolarHBondContact O-N 3.38Å; R807-R811 PolarHBondContact O-N 2.9Å
808	Q	36.7	Very low	34.2	Very low	139 Å²	139	144.5 Å²	144.5	65%	0.65	67%	0.669	S	S	*	*	H	α-helix	trans	-71.6	-34	172.5	-70.2	-176.6	-10.8	0	0	114.2	P806 Q810 R812	P806-Q808 PolarHBondContact O-N 2.73Å; Q808-Q810 VanDerWaalsContact C-N 3.34Å; Q808-R812 WeakPolarHBondContact O-CG 3.34Å; Q808-R812 PolarHBondContact O-N 3.31Å; Q808-R812 VanDerWaalsContact O-N 3.1Å
809	Q	39.2	Very low	34.8	Very low	99 Å²	99	146.6 Å²	146.6	46%	0.463	67%	0.666	S	S	.	*	H	α-helix	trans	-74.5	-29.8	-179.8	-146.4	175.4	23	0	0	111.1	P806 R813	P806-Q809 HydrophobicContact CB-CB 4.2Å; P806-Q809 HydrophobicContact CG-CB 4.48Å; P806-Q809 PolarHBondContact O-N 3.33Å; Q809-R813 VanDerWaalsContact O-CG 3.31Å; Q809-R813 WeakPolarHBondContact O-CG 3.47Å; Q809-R813 PolarHBondContact O-N 2.97Å; Q809-R813 VanDerWaalsContact O-N 3.12Å
810	Q	41.8	Very low	35.2	Very low	138 Å²	138	145.4 Å²	145.4	65%	0.645	66%	0.663	S	S	*	*	H	α-helix	trans	-74.6	-38	174.4	-151.8	161.3	4.7	0	0	112	P806 Q808 R813 L814	P806-Q810 PolarHBondContact O-N 3.01Å; Q808-Q810 VanDerWaalsContact C-N 3.34Å; Q810-R813 PolarHBondContact O-N 3.47Å; Q810-L814 WeakPolarHBondContact O-CG 3.41Å; Q810-L814 PolarHBondContact O-N 3.43Å
811	R	41.2	Very low	35.5	Very low	189 Å²	189	139.4 Å²	139.4	71%	0.713	64%	0.641	S	S	*	*	H	α-helix	trans	-62.6	-42.8	170.8	-78.9	-173.8	175.6	-175.1	-1.9	113.1	R807 L814 Q815	R807-R811 PolarHBondContact O-N 2.9Å; R811-L814 PolarHBondContact O-N 2.84Å; R811-Q815 PolarHBondContact O-N 3.43Å; R811-Q815 VanDerWaalsContact O-N 3.07Å
812	R	36.4	Very low	36	Very low	163 Å²	163	139.4 Å²	139.4	62%	0.615	63%	0.634	S	S	*	*	H	α-helix	trans	-68.4	-32.5	176.5	-66.9	-173.4	-156.2	-173.4	7.2	113.3	Q808 H816	Q808-R812 WeakPolarHBondContact O-CG 3.34Å; Q808-R812 PolarHBondContact O-N 3.31Å; Q808-R812 VanDerWaalsContact O-N 3.1Å; R812-H816 PolarHBondContact O-N 2.95Å
813	R	37.5	Very low	36.4	Very low	153 Å²	153	132.6 Å²	132.6	58%	0.577	63%	0.625	S	S	*	*	H	α-helix	trans	-69.4	-36.3	173.3	-74.7	177.9	-167.7	-176	5.9	112.5	Q809 Q810 Q817	Q809-R813 VanDerWaalsContact O-CG 3.31Å; Q809-R813 WeakPolarHBondContact O-CG 3.47Å; Q809-R813 PolarHBondContact O-N 2.97Å; Q809-R813 VanDerWaalsContact O-N 3.12Å; Q810-R813 PolarHBondContact O-N 3.47Å; R813-Q817 WeakPolarHBondContact O-CB 3.35Å; R813-Q817 WeakPolarHBondContact O-CG 3.31Å; R813-Q817 PolarHBondContact O-N 2.94Å
814	L	42.1	Very low	36.9	Very low	104 Å²	104	137.9 Å²	137.9	55%	0.545	63%	0.631	S	S	.	*	H	α-helix	trans	-62.8	-47.2	172.1	-73.7	163.1	0	0	0	111	Q810 R811 H816 Q817 E818	Q810-L814 WeakPolarHBondContact O-CG 3.41Å; Q810-L814 PolarHBondContact O-N 3.43Å; R811-L814 PolarHBondContact O-N 2.84Å; L814-H816 PolarHBondContact O-N 3.29Å; L814-Q817 PolarHBondContact O-N 2.95Å; L814-E818 WeakPolarHBondContact O-CG 3.34Å; L814-E818 PolarHBondContact O-N 3.39Å; L814-E818 VanDerWaalsContact O-N 3.14Å
815	Q	37.2	Very low	37.5	Very low	125 Å²	125	131.3 Å²	131.3	58%	0.584	61%	0.605	S	S	*	*	H	α-helix	trans	-63.8	-41.6	178.5	-71.4	176.9	-49	0	0	113.3	R811 Q817 E818	R811-Q815 PolarHBondContact O-N 3.43Å; R811-Q815 VanDerWaalsContact O-N 3.07Å; Q815-Q817 PolarHBondContact O-N 3.39Å; Q815-E818 PolarHBondContact O-N 3.32Å
816	H	36.2	Very low	37.9	Very low	144 Å²	144	125.7 Å²	125.7	67%	0.667	59%	0.586	S	S	*	*	H	α-helix	trans	-73.8	-20.3	175.2	-88	-57.8	0	0	0	114.3	R812 L814	R812-H816 PolarHBondContact O-N 2.95Å; L814-H816 PolarHBondContact O-N 3.29Å
817	Q	38.8	Very low	38.4	Very low	138 Å²	138	125.2 Å²	125.2	65%	0.645	58%	0.584	S	S	*	*	H	α-helix	trans	-84.2	-15.5	173.4	-75.7	-178.1	-31.9	0	0	113.4	R813 L814 Q815 E819 G821	R813-Q817 WeakPolarHBondContact O-CB 3.35Å; R813-Q817 WeakPolarHBondContact O-CG 3.31Å; R813-Q817 PolarHBondContact O-N 2.94Å; L814-Q817 PolarHBondContact O-N 2.95Å; Q815-Q817 PolarHBondContact O-N 3.39Å; Q817-E819 VanDerWaalsContact C-N 3.27Å; Q817-E819 PolarHBondContact O-N 3.49Å; Q817-G821 WeakPolarHBondContact O-CA 3.37Å; Q817-G821 PolarHBondContact O-N 2.98Å; Q817-G821 VanDerWaalsContact O-N 3.08Å
818	E	39.3	Very low	38.5	Very low	122 Å²	122	117.3 Å²	117.3	57%	0.57	56%	0.562	S	S	*	*	H	α-helix	trans	-73.9	-12.4	176.4	-80.4	-179.8	122.4	0	0	114.4	L814 Q815 K822	L814-E818 WeakPolarHBondContact O-CG 3.34Å; L814-E818 PolarHBondContact O-N 3.39Å; L814-E818 VanDerWaalsContact O-N 3.14Å; Q815-E818 PolarHBondContact O-N 3.32Å; E818-K822 WeakPolarHBondContact O-CD 3.35Å; E818-K822 WeakPolarHBondContact O-CE 3.39Å; E818-K822 PolarHBondContact O-NZ 3.04Å
819	E	36.3	Very low	38.9	Very low	158 Å²	158	118.5 Å²	118.5	74%	0.738	56%	0.561	S	S	*	*	H	α-helix	trans	-100.7	-34.9	178.9	-66.6	-175.6	145.2	0	0	113.3	Q817	Q817-E819 VanDerWaalsContact C-N 3.27Å; Q817-E819 PolarHBondContact O-N 3.49Å
820	E	37	Very low	38.9	Very low	166 Å²	166	117.7 Å²	117.7	78%	0.776	55%	0.554	S	S	*	*	H	α-helix	trans	-104	-5.9	178.8	-64.5	-170	144.7	0	0	115.1
821	G	35.2	Very low	38.9	Very low	32 Å²	32	116.4 Å²	116.4	33%	0.33	55%	0.548	S	S	.	.			trans	-92.7	-16.9	-173.8	0	0	0	0	0	116.6	Q817 G823 R824	Q817-G821 WeakPolarHBondContact O-CA 3.37Å; Q817-G821 PolarHBondContact O-N 2.98Å; Q817-G821 VanDerWaalsContact O-N 3.08Å; G821-G823 PolarHBondContact O-N 3.01Å; G821-R824 PolarHBondContact O-N 3.35Å
822	K	35.1	Very low	38.8	Very low	138 Å²	138	115.5 Å²	115.5	60%	0.6	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-6.4	-164	-82.6	170.8	174.5	143.7	0	117	E818	E818-K822 WeakPolarHBondContact O-CD 3.35Å; E818-K822 WeakPolarHBondContact O-CE 3.39Å; E818-K822 PolarHBondContact O-NZ 3.04Å
823	G	34.5	Very low	39.3	Very low	53 Å²	53	112.6 Å²	112.6	55%	0.546	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-6.3	177	0	0	0	0	0	116.7	G821	G821-G823 PolarHBondContact O-N 3.01Å
824	R	39.9	Very low	39.6	Very low	198 Å²	198	108 Å²	108	75%	0.747	52%	0.523	S	S	*	.	S	Bend	trans	-121.7	-0.6	-163.6	-77	179.8	-81.2	-174	-5.4	117.3	G821	G821-R824 PolarHBondContact O-N 3.35Å
825	C	39.6	Very low	40	Very low	40 Å²	40	106.9 Å²	106.9	27%	0.27	52%	0.516	S	S	.	.			trans	-84.7	139.9	175.7	-179.7	0	0	0	0	111.7	C827 C828 Y829	C825-C827 PolarHBondContact O-N 3.04Å; C825-C828 HydrophobicContact CB-CB 4.03Å; C825-C828 PolarHBondContact O-N 3.1Å; C825-Y829 PolarHBondContact O-N 3.37Å; C825-Y829 VanDerWaalsContact O-N 3.09Å
826	C	42.7	Very low	40.3	Very low	54 Å²	54	106.3 Å²	106.3	37%	0.365	51%	0.514	S	S	.	.	H	α-helix	trans	-56	-34.9	179.4	-157.8	0	0	0	0	112.4	C746	C746-C826 WeakPolarHBondContact O-CB 3.47Å
827	C	43.6	Very low	40.5	Very low	56 Å²	56	102.1 Å²	102.1	38%	0.378	50%	0.501	S	S	.	.	H	α-helix	trans	-77.8	-36.2	176	-56	0	0	0	0	112.8	C825 H831	C825-C827 PolarHBondContact O-N 3.04Å; C827-H831 WeakPolarHBondContact O-CB 3.25Å; C827-H831 PolarHBondContact O-N 3.2Å
828	C	39.1	Very low	40.8	Very low	55 Å²	55	101 Å²	101	37%	0.372	50%	0.495	S	S	.	.	H	α-helix	trans	-73.6	-36.8	-176.4	-63.3	0	0	0	0	113.2	C825 R830 H831 R832	C825-C828 HydrophobicContact CB-CB 4.03Å; C825-C828 PolarHBondContact O-N 3.1Å; C828-R830 VanDerWaalsContact C-N 3.28Å; C828-R830 PolarHBondContact O-N 3.36Å; C828-H831 PolarHBondContact O-N 3.07Å; C828-R832 PolarHBondContact O-N 3.4Å; C828-R832 VanDerWaalsContact O-N 3.12Å
829	Y	43	Very low	41	Very low	163 Å²	163	100.1 Å²	100.1	64%	0.639	49%	0.491	S	S	*	.	H	α-helix	trans	-61.1	-40.1	177.5	-167.3	-94.5	0	0	0	111.3	C825	C825-Y829 PolarHBondContact O-N 3.37Å; C825-Y829 VanDerWaalsContact O-N 3.09Å
830	R	40.6	Very low	41.2	Very low	83 Å²	83	97.3 Å²	97.3	31%	0.313	48%	0.481	S	S	.	.	H	α-helix	trans	-78	-36.2	177.2	-156.7	-179.2	-126.5	157.8	12.8	113.5	N731 H733 C828 R832 Q833 Q834	N731-R830 VanDerWaalsContact O-CD 3.29Å; N731-R830 WeakPolarHBondContact O-CD 3.33Å; N731-R830 PolarHBondContact O-NH1 3.49Å; H733-R830 PolarHBondContact CD2-NH1 3.1Å; H733-R830 VanDerWaalsContact CD2-NH1 3.26Å; H733-R830 PolarHBondContact CE1-NH1 2.82Å; H733-R830 PolarHBondContact CE1-NH2 3.11Å; H733-R830 VanDerWaalsContact CG-NH1 3.3Å; H733-R830 PolarHBondContact ND1-NH1 3.05Å; H733-R830 PolarHBondContact NE2-NH1 3.19Å; H733-R830 VanDerWaalsContact NE2-NH1 3.18Å; H733-R830 PolarHBondContact NE2-NH2 2.85Å; C828-R830 VanDerWaalsContact C-N 3.28Å; C828-R830 PolarHBondContact O-N 3.36Å; R830-R832 PolarHBondContact O-N 3.12Å; R830-Q833 WeakPolarHBondContact O-CB 3.33Å; R830-Q833 PolarHBondContact O-N 3.1Å; R830-Q833 VanDerWaalsContact O-N 3.08Å; R830-Q834 WeakPolarHBondContact O-CG 2.97Å; R830-Q834 PolarHBondContact O-N 3.33Å
831	H	41.5	Very low	41.2	Very low	111 Å²	111	95.4 Å²	95.4	51%	0.514	47%	0.473	S	S	.	.	H	α-helix	trans	-60.8	-32.3	175.2	-161.4	-29.6	0	0	0	111.8	C827 C828 Q834 I835	C827-H831 WeakPolarHBondContact O-CB 3.25Å; C827-H831 PolarHBondContact O-N 3.2Å; C828-H831 PolarHBondContact O-N 3.07Å; H831-Q834 PolarHBondContact O-N 2.82Å; H831-I835 WeakPolarHBondContact ND1-CD1 3.15Å; H831-I835 WeakPolarHBondContact O-CG1 3.38Å; H831-I835 PolarHBondContact O-N 3.4Å
832	R	38.8	Very low	41.4	Very low	170 Å²	170	99.4 Å²	99.4	64%	0.642	48%	0.483	S	S	*	.	H	α-helix	trans	-67.8	-40.6	173	-168.2	179	-78.1	-157	-4.4	112.4	C828 R830 Q834 Q836	C828-R832 PolarHBondContact O-N 3.4Å; C828-R832 VanDerWaalsContact O-N 3.12Å; R830-R832 PolarHBondContact O-N 3.12Å; R832-Q834 VanDerWaalsContact C-N 3.35Å; R832-Q836 PolarHBondContact O-N 2.67Å
833	Q	47.4	Very low	41.4	Very low	102 Å²	102	100.7 Å²	100.7	48%	0.477	49%	0.485	S	S	.	.	H	α-helix	trans	-64.4	-37.5	172.8	-68.6	-178	-16.3	0	0	112.3	R830 Q836 S837	R830-Q833 WeakPolarHBondContact O-CB 3.33Å; R830-Q833 PolarHBondContact O-N 3.1Å; R830-Q833 VanDerWaalsContact O-N 3.08Å; Q833-Q836 PolarHBondContact O-N 3.27Å; Q833-S837 PolarHBondContact O-N 3.33Å
834	Q	43.8	Very low	41.4	Very low	56 Å²	56	103.6 Å²	103.6	26%	0.262	49%	0.492	S	S	.	.	H	α-helix	trans	-73	-32.9	179.7	-73.2	176.6	-43.7	0	0	113.9	N731 R830 H831 R832 Q836 S837 H838	N731-Q834 VanDerWaalsContact CB-NE2 3.31Å; N731-Q834 PolarHBondContact OD1-NE2 2.92Å; R830-Q834 WeakPolarHBondContact O-CG 2.97Å; R830-Q834 PolarHBondContact O-N 3.33Å; H831-Q834 PolarHBondContact O-N 2.82Å; R832-Q834 VanDerWaalsContact C-N 3.35Å; Q834-Q836 VanDerWaalsContact C-N 3.31Å; Q834-S837 WeakPolarHBondContact CA-OG 3.38Å; Q834-S837 PolarHBondContact O-N 2.81Å; Q834-S837 PolarHBondContact O-OG 3.21Å; Q834-S837 VanDerWaalsContact O-OG 3.05Å; Q834-H838 WeakPolarHBondContact O-CB 3.49Å; Q834-H838 PolarHBondContact O-N 3.31Å
835	I	49.2	Very low	41.3	Very low	80 Å²	80	98.6 Å²	98.6	41%	0.41	49%	0.488	S	S	.	.	H	α-helix	trans	-64.2	-41.4	170.8	-70.4	164.5	0	0	0	109.6	H831 H838 Q839	H831-I835 WeakPolarHBondContact ND1-CD1 3.15Å; H831-I835 WeakPolarHBondContact O-CG1 3.38Å; H831-I835 PolarHBondContact O-N 3.4Å; I835-H838 PolarHBondContact O-N 3.35Å; I835-Q839 HydrophobicContact CG2-CG 4.38Å; I835-Q839 VanDerWaalsContact O-CB 3.32Å; I835-Q839 WeakPolarHBondContact O-CB 3.27Å; I835-Q839 VanDerWaalsContact O-CG 3.32Å; I835-Q839 WeakPolarHBondContact O-CG 3.27Å; I835-Q839 PolarHBondContact O-N 2.93Å
836	Q	43.7	Very low	41.2	Very low	113 Å²	113	104 Å²	104	53%	0.528	51%	0.509	S	S	.	.	H	α-helix	trans	-64.8	-37.5	175	-71	175.3	-39.2	0	0	112.7	R832 Q833 Q834 N840	R832-Q836 PolarHBondContact O-N 2.67Å; Q833-Q836 PolarHBondContact O-N 3.27Å; Q834-Q836 VanDerWaalsContact C-N 3.31Å; Q836-N840 WeakPolarHBondContact O-CB 3.48Å; Q836-N840 VanDerWaalsContact O-CG 3.25Å; Q836-N840 PolarHBondContact O-N 3.18Å; Q836-N840 VanDerWaalsContact O-N 3.07Å
837	S	40.8	Very low	40.7	Very low	57 Å²	57	107.6 Å²	107.6	40%	0.399	52%	0.524	S	S	.	.	H	α-helix	trans	-72.8	-38.3	176.4	66.4	0	0	0	0	113.5	Q833 Q834 N840 Q841	Q833-S837 PolarHBondContact O-N 3.33Å; Q834-S837 WeakPolarHBondContact CA-OG 3.38Å; Q834-S837 PolarHBondContact O-N 2.81Å; Q834-S837 PolarHBondContact O-OG 3.21Å; Q834-S837 VanDerWaalsContact O-OG 3.05Å; S837-N840 PolarHBondContact O-N 3.1Å; S837-Q841 PolarHBondContact O-N 3.03Å
838	H	46.1	Very low	40.1	Very low	114 Å²	114	113.9 Å²	113.9	53%	0.528	55%	0.548	S	S	.	.	H	α-helix	trans	-71.6	-38.2	176	-92	-70.8	0	0	0	112.7	Q834 I835 N840 Q841 Q842	Q834-H838 WeakPolarHBondContact O-CB 3.49Å; Q834-H838 PolarHBondContact O-N 3.31Å; I835-H838 PolarHBondContact O-N 3.35Å; H838-N840 VanDerWaalsContact C-N 3.33Å; H838-Q841 PolarHBondContact O-N 3.41Å; H838-Q842 PolarHBondContact O-N 3.38Å
839	Q	42	Very low	39.7	Very low	104 Å²	104	118.7 Å²	118.7	49%	0.486	57%	0.57	S	S	.	*	H	α-helix	trans	-61.7	-43.5	171.8	-75.1	177.9	-30.9	0	0	110.6	I835 Q841 Q842 Y843	I835-Q839 HydrophobicContact CG2-CG 4.38Å; I835-Q839 VanDerWaalsContact O-CB 3.32Å; I835-Q839 WeakPolarHBondContact O-CB 3.27Å; I835-Q839 VanDerWaalsContact O-CG 3.32Å; I835-Q839 WeakPolarHBondContact O-CG 3.27Å; I835-Q839 PolarHBondContact O-N 2.93Å; Q839-Q841 VanDerWaalsContact C-N 3.3Å; Q839-Q841 PolarHBondContact O-N 2.97Å; Q839-Q842 PolarHBondContact O-N 3.27Å; Q839-Y843 WeakPolarHBondContact O-CB 3.3Å; Q839-Y843 WeakPolarHBondContact O-CD2 3.36Å; Q839-Y843 PolarHBondContact O-N 3.3Å
840	N	40.2	Very low	39.3	Very low	99 Å²	99	117.9 Å²	117.9	53%	0.529	58%	0.577	S	S	.	*	H	α-helix	trans	-65.6	-27.7	176	-74.1	-3.8	0	0	0	113.9	Q836 S837 H838 T844	Q836-N840 WeakPolarHBondContact O-CB 3.48Å; Q836-N840 VanDerWaalsContact O-CG 3.25Å; Q836-N840 PolarHBondContact O-N 3.18Å; Q836-N840 VanDerWaalsContact O-N 3.07Å; S837-N840 PolarHBondContact O-N 3.1Å; H838-N840 VanDerWaalsContact C-N 3.33Å; N840-T844 WeakPolarHBondContact O-CG2 3.31Å; N840-T844 PolarHBondContact O-N 3.42Å; N840-T844 PolarHBondContact O-OG1 2.87Å; N840-T844 VanDerWaalsContact O-OG1 3.1Å
841	Q	38.8	Very low	38.9	Very low	126 Å²	126	119.8 Å²	119.8	59%	0.589	59%	0.593	S	S	*	*	H	α-helix	trans	-84	-28.1	175.1	-76.1	-177.8	-20.8	0	0	114.1	S837 H838 Q839 T844 S845	S837-Q841 PolarHBondContact O-N 3.03Å; H838-Q841 PolarHBondContact O-N 3.41Å; Q839-Q841 VanDerWaalsContact C-N 3.3Å; Q839-Q841 PolarHBondContact O-N 2.97Å; Q841-T844 PolarHBondContact O-OG1 3Å; Q841-T844 VanDerWaalsContact O-OG1 3.08Å; Q841-S845 PolarHBondContact O-OG 3.1Å
842	Q	38.5	Very low	38.4	Very low	116 Å²	116	121.7 Å²	121.7	54%	0.542	61%	0.607	S	S	.	*	H	α-helix	trans	-79.4	-36.5	172.6	-74.9	-176	-74.4	0	0	112.2	H838 Q839 T844 S845 Q846	H838-Q842 PolarHBondContact O-N 3.38Å; Q839-Q842 PolarHBondContact O-N 3.27Å; Q842-T844 VanDerWaalsContact C-N 3.33Å; Q842-T844 PolarHBondContact O-N 3.41Å; Q842-S845 CarbonylContact O-C 3.44Å; Q842-S845 WeakPolarHBondContact O-CA 3.43Å; Q842-S845 PolarHBondContact O-N 3.5Å; Q842-Q846 PolarHBondContact O-N 2.84Å
843	Y	35.1	Very low	37.9	Very low	164 Å²	164	120.2 Å²	120.2	64%	0.643	62%	0.617	S	S	*	*	H	α-helix	trans	-66.9	-30.2	174.6	-91.4	-91.9	0	0	0	113.2	Q839 S845	Q839-Y843 WeakPolarHBondContact O-CB 3.3Å; Q839-Y843 WeakPolarHBondContact O-CD2 3.36Å; Q839-Y843 PolarHBondContact O-N 3.3Å; Y843-S845 PolarHBondContact O-N 3.29Å
844	T	35.2	Very low	37.2	Very low	114 Å²	114	122.4 Å²	122.4	70%	0.699	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.7	-6	169	52.1	0	0	0	0	114.2	N840 Q841 Q842	N840-T844 WeakPolarHBondContact O-CG2 3.31Å; N840-T844 PolarHBondContact O-N 3.42Å; N840-T844 PolarHBondContact O-OG1 2.87Å; N840-T844 VanDerWaalsContact O-OG1 3.1Å; Q841-T844 PolarHBondContact O-OG1 3Å; Q841-T844 VanDerWaalsContact O-OG1 3.08Å; Q842-T844 VanDerWaalsContact C-N 3.33Å; Q842-T844 PolarHBondContact O-N 3.41Å
845	S	37	Very low	36.5	Very low	94 Å²	94	128.5 Å²	128.5	66%	0.657	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.2	-0.5	-175.7	-54.4	0	0	0	0	114.2	Q841 Q842 Y843	Q841-S845 PolarHBondContact O-OG 3.1Å; Q842-S845 CarbonylContact O-C 3.44Å; Q842-S845 WeakPolarHBondContact O-CA 3.43Å; Q842-S845 PolarHBondContact O-N 3.5Å; Y843-S845 PolarHBondContact O-N 3.29Å
846	Q	38	Very low	35.6	Very low	153 Å²	153	131.5 Å²	131.5	72%	0.715	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.3	3	-177.5	-72	-172.2	-71.2	0	0	115.6	Q842	Q842-Q846 PolarHBondContact O-N 2.84Å
847	N	31.2	Very low	34.9	Very low	129 Å²	129	131.3 Å²	131.3	69%	0.69	69%	0.687	S	S	*	*			trans	-113.6	18.6	-177.2	-100.1	-0.5	0	0	0	115.8
848	H	32.4	Very low	34.4	Very low	188 Å²	188	133.5 Å²	133.5	87%	0.87	70%	0.702	S	S	*	*			trans	-111.3	73.5	168.5	-91	-36.3	0	0	0	111.9
849	N	30.9	Very low	33.8	Very low	157 Å²	157	134.3 Å²	134.3	84%	0.84	71%	0.711	S	S	*	*			trans	-150.7	71.4	160	-99.5	-22.9	0	0	0	108.3
850	D	33.5	Very low	33.3	Very low	145 Å²	145	137.3 Å²	137.3	78%	0.775	73%	0.729	S	S	*	*	S	Bend	trans	-170.1	121.6	149.4	-101.1	-30.9	0	0	0	112.5
851	N	32.3	Very low	32.9	Very low	123 Å²	123	140.6 Å²	140.6	66%	0.658	75%	0.746	S	S	*	*			trans	48	107.6	147	-59.5	-52.4	0	0	0	122.1
852	N	30.4	Very low	32.4	Very low	152 Å²	152	141.9 Å²	141.9	81%	0.813	76%	0.757	S	S	*	*				50.9	69.8	122.7	-63	-21.4	0	0	0	119.1
853	T	29.5	Very low	32.1	Very low	139 Å²	139	143.9 Å²	143.9	85%	0.853	77%	0.771	S	S	*	*			trans	-162.8	168.4	137.1	2.4	0	0	0	0	110.7
854	I	32	Very low	32	Very low	148 Å²	148	141.2 Å²	141.2	76%	0.759	78%	0.777	S	S	*	*			trans	72.8	52.8	179.7	-39.3	174.1	0	0	0	113.9
855	Q	29.3	Very low	32	Very low	183 Å²	183	143.1 Å²	143.1	86%	0.855	78%	0.781	S	S	*	*			trans	-62.5	121.3	133.4	-67.6	166.5	-59.2	0	0	107.4
856	N	30	Very low	31.7	Very low	144 Å²	144	145.2 Å²	145.2	77%	0.77	79%	0.785	S	S	*	*			trans	169	-6.4	149	-89.8	-17.7	0	0	0	115.8
857	S	30.5	Very low	31.7	Very low	109 Å²	109	141.9 Å²	141.9	76%	0.762	78%	0.775	S	S	*	*	S	Bend	trans	-96.6	-5	-173.6	-48.9	0	0	0	0	116
858	S	29.8	Very low	32	Very low	102 Å²	102	142.2 Å²	142.2	71%	0.713	78%	0.776	S	S	*	*	S	Bend	trans	-97.3	12.5	-170.8	45.1	0	0	0	0	115.6
859	N	32.6	Very low	32.3	Very low	132 Å²	132	138.3 Å²	138.3	71%	0.706	76%	0.762	S	S	*	*	S	Bend	trans	-114.7	16.7	-171	-81.3	-17.3	0	0	0	115.7
860	L	32.4	Very low	32.6	Very low	166 Å²	166	136.5 Å²	136.5	87%	0.869	75%	0.752	S	S	*	*	S	Bend	trans	-123.1	10.6	-171.2	-94.7	165.9	0	0	0	117.4
861	L	30.7	Very low	32.9	Very low	169 Å²	169	132.9 Å²	132.9	89%	0.885	74%	0.738	S	S	*	*	S	Bend	trans	-129.1	8.8	172.3	-103.2	157.4	0	0	0	114.8
862	N	29.3	Very low	33.2	Very low	152 Å²	152	131.9 Å²	131.9	81%	0.813	73%	0.732	S	S	*	*	S	Bend	trans	-95.3	22.2	175.8	-93.2	-1.9	0	0	0	113.9
863	N	31.6	Very low	33.7	Very low	158 Å²	158	130.5 Å²	130.5	85%	0.845	72%	0.721	S	S	*	*	S	Bend	trans	-135.5	63.4	-176.5	-94.6	-23.6	0	0	0	112.9
864	S	33.1	Very low	34.6	Very low	109 Å²	109	127.5 Å²	127.5	76%	0.762	70%	0.703	S	S	*	*	S	Bend	trans	-176.9	141.5	142.9	46	0	0	0	0	111.9
865	I	35.3	Very low	35.1	Very low	153 Å²	153	126.8 Å²	126.8	79%	0.785	70%	0.696	S	S	*	*			trans	82.9	90.8	178.5	-49.4	171.2	0	0	0	114.1	V867	I865-V867 HydrophobicContact CG2-CG2 4.31Å; I865-V867 PolarHBondContact O-N 2.97Å; I865-V867 VanDerWaalsContact O-N 3.16Å
866	N	31.3	Very low	35.8	Very low	138 Å²	138	125.1 Å²	125.1	74%	0.738	69%	0.688	S	S	*	*			trans	-60.9	106.8	163.4	-83.6	-28.7	0	0	0	110.2
867	V	36.7	Very low	36.2	Very low	84 Å²	84	123.9 Å²	123.9	51%	0.509	68%	0.681	S	S	.	*	S	Bend	trans	-83.8	-22	172.4	177.6	0	0	0	0	111.6	I865 N869	I865-V867 HydrophobicContact CG2-CG2 4.31Å; I865-V867 PolarHBondContact O-N 2.97Å; I865-V867 VanDerWaalsContact O-N 3.16Å; V867-N869 VanDerWaalsContact C-N 3.34Å; V867-N869 PolarHBondContact O-N 3.06Å
868	D	37.6	Very low	37	Very low	135 Å²	135	125 Å²	125	72%	0.722	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-0.1	-173.4	-59.1	-40.4	0	0	0	115.5
869	N	40.2	Very low	37.7	Very low	107 Å²	107	126.8 Å²	126.8	57%	0.572	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	-6.1	173.7	-104.4	-4.5	0	0	0	113.9	V867	V867-N869 VanDerWaalsContact C-N 3.34Å; V867-N869 PolarHBondContact O-N 3.06Å
870	L	36.9	Very low	38	Very low	118 Å²	118	122.1 Å²	122.1	62%	0.618	66%	0.655	S	S	*	*	H	α-helix	trans	-90.1	-23.5	-176.9	-146	72.3	0	0	0	113.3	T874	L870-T874 PolarHBondContact O-N 3.22Å; L870-T874 PolarHBondContact O-OG1 2.73Å
871	S	38.6	Very low	38.7	Very low	69 Å²	69	119.5 Å²	119.5	48%	0.483	64%	0.64	S	S	.	*	H	α-helix	trans	-65.6	-51.3	174.1	45.3	0	0	0	0	111.8	Q873 T874 E875	S871-Q873 VanDerWaalsContact C-N 3.31Å; S871-Q873 PolarHBondContact O-N 3.13Å; S871-T874 PolarHBondContact O-N 3.04Å; S871-T874 VanDerWaalsContact O-N 3.08Å; S871-E875 PolarHBondContact O-N 3.03Å
872	N	40.4	Very low	39.3	Very low	102 Å²	102	118.6 Å²	118.6	55%	0.545	63%	0.631	S	S	.	*	H	α-helix	trans	-65.8	-27.5	-179.9	-77.7	-17.2	0	0	0	113.9	Q876	N872-Q876 PolarHBondContact O-N 2.91Å
873	Q	40	Very low	39.9	Very low	123 Å²	123	119 Å²	119	58%	0.575	63%	0.629	S	S	*	*	H	α-helix	trans	-76.8	-26.4	173.4	-75.7	-168.9	-30.1	0	0	112.9	S871 L877	S871-Q873 VanDerWaalsContact C-N 3.31Å; S871-Q873 PolarHBondContact O-N 3.13Å; Q873-L877 WeakPolarHBondContact O-CB 3.47Å; Q873-L877 PolarHBondContact O-N 3.27Å; Q873-L877 VanDerWaalsContact O-N 3.09Å
874	T	47.6	Very low	40.3	Very low	77 Å²	77	117.8 Å²	117.8	47%	0.472	62%	0.62	S	S	.	*	H	α-helix	trans	-72.6	-40.4	177.9	-50.1	0	0	0	0	110.8	L870 S871 L877 Q878	L870-T874 PolarHBondContact O-N 3.22Å; L870-T874 PolarHBondContact O-OG1 2.73Å; S871-T874 PolarHBondContact O-N 3.04Å; S871-T874 VanDerWaalsContact O-N 3.08Å; T874-L877 PolarHBondContact O-N 2.81Å; T874-Q878 WeakPolarHBondContact O-CB 3.16Å; T874-Q878 PolarHBondContact O-N 3.41Å
875	E	43.5	Very low	40.8	Very low	133 Å²	133	119.2 Å²	119.2	62%	0.621	62%	0.619	S	S	*	*	H	α-helix	trans	-69.3	-35.3	175.5	-69.1	-171.5	145.3	0	0	113.3	S871 Q878 Q879	S871-E875 PolarHBondContact O-N 3.03Å; E875-Q878 PolarHBondContact O-N 3.2Å; E875-Q879 PolarHBondContact O-N 3.21Å
876	Q	43.1	Very low	41	Very low	147 Å²	147	118.3 Å²	118.3	69%	0.687	62%	0.616	S	S	*	*	H	α-helix	trans	-69.5	-33	173.8	-74	-171.8	-9.5	0	0	113.1	N872 G880	N872-Q876 PolarHBondContact O-N 2.91Å; Q876-G880 PolarHBondContact O-N 3.38Å
877	L	40.2	Very low	41.2	Very low	118 Å²	118	119 Å²	119	62%	0.618	62%	0.62	S	S	*	*	H	α-helix	trans	-69.1	-34.1	170.9	-96.5	154.7	0	0	0	112.2	Q873 T874 G880 I881	Q873-L877 WeakPolarHBondContact O-CB 3.47Å; Q873-L877 PolarHBondContact O-N 3.27Å; Q873-L877 VanDerWaalsContact O-N 3.09Å; T874-L877 PolarHBondContact O-N 2.81Å; L877-G880 PolarHBondContact O-N 2.85Å; L877-I881 WeakPolarHBondContact O-CD1 3.44Å; L877-I881 VanDerWaalsContact O-CG1 3.29Å; L877-I881 WeakPolarHBondContact O-CG1 3.31Å; L877-I881 PolarHBondContact O-N 2.95Å
878	Q	46.5	Very low	41.2	Very low	133 Å²	133	123 Å²	123	62%	0.621	64%	0.639	S	S	*	*	H	α-helix	trans	-75.3	-36.5	179.9	-149.7	149.8	-13.8	0	0	112.2	T874 E875 I881	T874-Q878 WeakPolarHBondContact O-CB 3.16Å; T874-Q878 PolarHBondContact O-N 3.41Å; E875-Q878 PolarHBondContact O-N 3.2Å; Q878-I881 PolarHBondContact O-N 3.05Å
879	Q	44.1	Very low	40.9	Very low	140 Å²	140	120 Å²	120	65%	0.654	64%	0.64	S	S	*	*	H	α-helix	trans	-72.6	-29.6	169.6	-70.9	-176.3	-7.5	0	0	113.3	E875 I881 E882	E875-Q879 PolarHBondContact O-N 3.21Å; Q879-I881 VanDerWaalsContact C-N 3.3Å; Q879-I881 PolarHBondContact O-N 2.93Å; Q879-E882 PolarHBondContact O-N 3.37Å
880	G	39.6	Very low	40.6	Very low	34 Å²	34	122.6 Å²	122.6	35%	0.351	65%	0.653	S	S	.	*	H	α-helix	trans	-65.4	-30.6	173	0	0	0	0	0	113.5	Q876 L877 I884	Q876-G880 PolarHBondContact O-N 3.38Å; L877-G880 PolarHBondContact O-N 2.85Å; G880-I884 WeakPolarHBondContact O-CD1 3.38Å; G880-I884 WeakPolarHBondContact O-CG1 3.34Å
881	I	45.7	Very low	40.5	Very low	110 Å²	110	124.7 Å²	124.7	56%	0.564	67%	0.665	S	S	*	*	H	α-helix	trans	-77.2	-27.1	-179.7	-72.3	165.9	0	0	0	112.2	L877 Q878 Q879	L877-I881 WeakPolarHBondContact O-CD1 3.44Å; L877-I881 VanDerWaalsContact O-CG1 3.29Å; L877-I881 WeakPolarHBondContact O-CG1 3.31Å; L877-I881 PolarHBondContact O-N 2.95Å; Q878-I881 PolarHBondContact O-N 3.05Å; Q879-I881 VanDerWaalsContact C-N 3.3Å; Q879-I881 PolarHBondContact O-N 2.93Å
882	E	43.7	Very low	40.5	Very low	150 Å²	150	128.7 Å²	128.7	70%	0.701	68%	0.681	S	S	*	*	H	α-helix	trans	-79.4	-23.3	176	-71.3	-170	140.7	0	0	114	Q879	Q879-E882 PolarHBondContact O-N 3.37Å
883	Q	42.4	Very low	40.5	Very low	162 Å²	162	131.5 Å²	131.5	76%	0.757	69%	0.691	S	S	*	*	H	α-helix	trans	-82.2	-13	175.4	-70.6	-158.8	-19	0	0	114.6
884	I	40.6	Very low	40.5	Very low	131 Å²	131	130.7 Å²	130.7	67%	0.672	69%	0.694	S	S	*	*	G	3₁₀ helix	trans	-80.1	-18.8	-179.7	-69.8	168.8	0	0	0	112.4	G880 N886	G880-I884 WeakPolarHBondContact O-CD1 3.38Å; G880-I884 WeakPolarHBondContact O-CG1 3.34Å; I884-N886 VanDerWaalsContact C-N 3.26Å; I884-N886 PolarHBondContact O-N 3.33Å
885	N	42.3	Very low	40.1	Very low	139 Å²	139	133 Å²	133	74%	0.743	70%	0.704	S	S	*	*	G	3₁₀ helix	trans	-81	14.1	-178.2	-79.1	-17.9	0	0	0	115.5
886	N	39.7	Very low	39.9	Very low	135 Å²	135	131.8 Å²	131.8	72%	0.722	70%	0.701	S	S	*	*	G	3₁₀ helix	trans	-133.6	15.6	-170.9	-87.7	-44.6	0	0	0	116	I884	I884-N886 VanDerWaalsContact C-N 3.26Å; I884-N886 PolarHBondContact O-N 3.33Å
887	N	36.7	Very low	39.9	Very low	152 Å²	152	129.3 Å²	129.3	81%	0.813	70%	0.696	S	S	*	*			trans	-135.4	132.7	170	-81.8	-55.6	0	0	0	111.9
888	D	35.4	Very low	39.8	Very low	168 Å²	168	132.5 Å²	132.5	90%	0.898	70%	0.7	S	S	*	*			trans	-64.1	147	-180	-66.7	-66.7	0	0	0	113.6
889	G	32.3	Very low	39.6	Very low	72 Å²	72	129.7 Å²	129.7	74%	0.742	69%	0.689	S	S	*	*			trans	77	88.1	145.4	0	0	0	0	0	118.8
890	D	34.2	Very low	39.4	Very low	161 Å²	161	132.2 Å²	132.2	86%	0.861	69%	0.693	S	S	*	*				-169.2	101.6	121.3	-114.7	-19.2	0	0	0	112.6	N892	D890-N892 PolarHBondContact O-N 2.85Å
891	D	33.5	Very low	39.3	Very low	162 Å²	162	138.3 Å²	138.3	87%	0.866	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	85.5	175.7	-83.7	-47.3	0	0	0	111.7
892	N	38.5	Very low	39.1	Very low	154 Å²	154	139.5 Å²	139.5	82%	0.824	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-156.4	-19.3	160.9	-102.6	-52.8	0	0	0	117.2	D890	D890-N892 PolarHBondContact O-N 2.85Å
893	H	40.2	Very low	38.8	Very low	161 Å²	161	139.8 Å²	139.8	75%	0.745	72%	0.721	S	S	*	*	S	Bend	trans	-95.9	-17.1	-166.7	-138.1	-49	0	0	0	116.5
894	V	41.5	Very low	38.4	Very low	106 Å²	106	135.3 Å²	135.3	64%	0.642	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-29.3	-169.1	179.4	0	0	0	0	114	N896	V894-N896 PolarHBondContact O-N 3.36Å; V894-N896 VanDerWaalsContact O-N 3.16Å
895	N	39.4	Very low	38.1	Very low	126 Å²	126	135 Å²	135	67%	0.674	72%	0.723	S	S	*	*	H	α-helix	trans	-69.4	-14.3	-175.4	-79.5	-35.2	0	0	0	114.8	N899	N895-N899 PolarHBondContact O-ND2 3.18Å
896	N	39.5	Very low	37.7	Very low	106 Å²	106	135.9 Å²	135.9	57%	0.567	73%	0.727	S	S	*	*	H	α-helix	trans	-88.7	-13.8	-175.2	-121.4	-27.4	0	0	0	114.6	V894 R900	V894-N896 PolarHBondContact O-N 3.36Å; V894-N896 VanDerWaalsContact O-N 3.16Å; N896-R900 PolarHBondContact O-NE 3.48Å
897	V	42	Very low	37.3	Very low	96 Å²	96	138 Å²	138	58%	0.582	73%	0.733	S	S	*	*	H	α-helix	trans	-97.4	-43.5	177.4	-178.1	0	0	0	0	110.8	N899 R900	V897-N899 VanDerWaalsContact C-N 3.28Å; V897-N899 PolarHBondContact O-N 3.2Å; V897-R900 PolarHBondContact O-N 3.22Å
898	R	37.7	Very low	36.9	Very low	185 Å²	185	140 Å²	140	70%	0.698	74%	0.74	S	S	*	*	H	α-helix	trans	-61.8	-31.8	-178	-148.4	177.1	-154.4	121.4	3	113.6
899	N	42.4	Very low	36.7	Very low	74 Å²	74	138 Å²	138	40%	0.396	73%	0.734	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75	-17	176.6	-79.9	-76.9	0	0	0	114.1	K6 N895 V897	K6-N899 PolarHBondContact NZ-OD1 3.2Å; N895-N899 PolarHBondContact O-ND2 3.18Å; V897-N899 VanDerWaalsContact C-N 3.28Å; V897-N899 PolarHBondContact O-N 3.2Å
900	R	39.5	Very low	36.6	Very low	192 Å²	192	140.5 Å²	140.5	73%	0.725	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	-18.6	-178.9	-64.5	-169.8	-162.6	-168.3	3.1	114.5	N896 V897	N896-R900 PolarHBondContact O-NE 3.48Å; V897-R900 PolarHBondContact O-N 3.22Å
901	M	37.9	Very low	36.5	Very low	162 Å²	162	138.8 Å²	138.8	80%	0.798	73%	0.73	S	S	*	*	S	Bend	trans	-86.8	-10	177.1	-73.9	-177.6	172.5	0	0	113.8
902	I	42.8	Very low	36.4	Very low	135 Å²	135	137.6 Å²	137.6	69%	0.692	72%	0.724	S	S	*	*	S	Bend	trans	-100.1	-12.2	-175.9	-62.6	177.3	0	0	0	112.3
903	E	36.6	Very low	36.1	Very low	156 Å²	156	138.4 Å²	138.4	73%	0.729	72%	0.723	S	S	*	*	S	Bend	trans	-97.1	4.7	179.4	-68.7	-174.1	159.6	0	0	114.4
904	G	33.2	Very low	35.5	Very low	69 Å²	69	135.2 Å²	135.2	71%	0.711	72%	0.719	S	S	*	*	S	Bend	trans	-89.1	0.8	-176.3	0	0	0	0	0	117.2
905	V	35.7	Very low	35	Very low	124 Å²	124	137 Å²	137	75%	0.752	72%	0.723	S	S	*	*	S	Bend	trans	-108.4	-4.2	-162.8	-177.1	0	0	0	0	114.2
906	N	32.7	Very low	34.5	Very low	157 Å²	157	138 Å²	138	84%	0.84	73%	0.727	S	S	*	*	S	Bend	trans	-115.9	18.4	-170.4	-82.2	-22.7	0	0	0	116.5
907	E	31.1	Very low	34	Very low	179 Å²	179	138 Å²	138	84%	0.836	74%	0.735	S	S	*	*			trans	-128.9	75.6	171.5	-78.9	-174.4	157.3	0	0	111.9
908	M	29.3	Very low	33.3	Very low	194 Å²	194	141.5 Å²	141.5	96%	0.956	75%	0.75	S	S	*	*			trans	-152.4	86.4	156.9	-114.2	172.8	-161.9	0	0	111.4
909	T	31.6	Very low	32.9	Very low	128 Å²	128	140 Å²	140	79%	0.785	76%	0.756	S	S	*	*			trans	-111.8	147.8	161.8	44	0	0	0	0	109.5
910	T	29.8	Very low	32.4	Very low	123 Å²	123	141.5 Å²	141.5	76%	0.755	77%	0.772	S	S	*	*	S	Bend	trans	75.5	133.8	173	72.3	0	0	0	0	117.7
911	T	31.1	Very low	32	Very low	125 Å²	125	142.4 Å²	142.4	77%	0.767	78%	0.775	S	S	*	*			trans	62.7	143.7	170.8	66.9	0	0	0	0	116
912	D	31.4	Very low	31.7	Very low	138 Å²	138	139.3 Å²	139.3	74%	0.738	77%	0.77	S	S	*	*			cis	-159.7	178.1	-18.2	-115.1	-44.6	0	0	0	107.8
913	E	32.1	Very low	31.2	Very low	170 Å²	170	139.8 Å²	139.8	79%	0.794	78%	0.778	S	S	*	*			trans	48.1	105	156.7	-70.2	-177.9	177.8	0	0	119.4
914	S	28.8	Very low	31	Very low	94 Å²	94	139.5 Å²	139.5	66%	0.657	78%	0.782	S	S	*	*				85.3	155.3	84.4	87.9	0	0	0	0	116.2
915	I	30.9	Very low	31	Very low	143 Å²	143	146.6 Å²	146.6	73%	0.733	81%	0.811	S	S	*	*			trans	79.5	97.9	164.1	-59.8	170.8	0	0	0	118.6
916	I	28.4	Very low	30.8	Very low	149 Å²	149	147.7 Å²	147.7	76%	0.764	81%	0.814	S	S	*	*				59	144	122.6	-59.8	171	0	0	0	121.3
917	S	29.3	Very low	30.7	Very low	104 Å²	104	147.2 Å²	147.2	73%	0.727	81%	0.813	S	S	*	*			trans	76.8	117.4	169.8	70.2	0	0	0	0	115.3
918	L	26.9	Very low	30.6	Very low	170 Å²	170	145.4 Å²	145.4	89%	0.89	81%	0.811	S	S	*	*				52.6	78.3	50.9	-94.8	169	0	0	0	113
919	N	29.5	Very low	30.7	Very low	155 Å²	155	142.6 Å²	142.6	83%	0.829	80%	0.803	S	S	*	*			trans	-165.9	154.3	140.5	-112.5	-30.7	0	0	0	114
920	S	31.4	Very low	30.7	Very low	105 Å²	105	143.5 Å²	143.5	73%	0.734	80%	0.804	S	S	*	*			trans	70.8	145	166	83.3	0	0	0	0	117.3
921	R	31.8	Very low	30.7	Very low	210 Å²	210	144.9 Å²	144.9	79%	0.792	81%	0.807	S	S	*	*			cis	-152.9	144.8	-1.7	-133.1	164.3	-174.1	173.7	-2.5	111.2
922	S	31.2	Very low	30.7	Very low	97 Å²	97	146.3 Å²	146.3	68%	0.678	81%	0.81	S	S	*	*			trans	-60	150.5	165.2	51	0	0	0	0	113.4
923	V	33.2	Very low	30.7	Very low	145 Å²	145	146.9 Å²	146.9	88%	0.879	82%	0.816	S	S	*	*			trans	-138.5	134.9	137.2	-177.6	0	0	0	0	108.3
924	N	31.7	Very low	30.5	Very low	151 Å²	151	145 Å²	145	81%	0.807	82%	0.817	S	S	*	*			trans	-80.2	133.8	174.2	-62.9	-42.2	0	0	0	110.9
925	V	33.3	Very low	30.7	Very low	217 Å²	217	149.6 Å²	149.6	100%	1.315	83%	0.832	S	S	*	*			trans	-140.7	0	133.3	177.7	0	0	0	0	106.9

Retrieved 925 of 925 residues in 185.9 ms (Link to these results)

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