A0A087YN52_POEFO Loading...

DISC1 scaffold protein

AlphaFold DB , UniProt , Accession A0A087YN52, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 814 aa.

						>A0A087YN52_POEFO|A0A087YN52
MFAGLMGLDCHLNSLHHRCESTESGKVSGTAGSSGRKRLHRRPGYMRGEQARLQCTAHAQDEEEDEEEEESIACIRNGRSGCHADLTKATRVQQLSQAPTVKVSLTNELHHKPSTCSSSESKNLAGPLNGVQTTSNELSPSLQSSSEVVFSSSFSFIQQSLNSNQRTDPARLPQEPEPTNQPANLEKKREEIITKSSQVHKEERSYGGRCWRDCLWTGKEEMSHLPNSESQSLDIEVTSSLSVDSDTASASSVTSGYESATPASEQGWDSLVKTYDGVLQDCLQNNRTYTKIESMMLKLQRLQQKAILDDDYDAAERFGKKLEELCGERGALKLGLPSMQPSVAHFLERLSKVVHSALQREDCGHRREGSEPDSVEQSDPTQRRDRLIQEKHQVEEEIEKLQTRLAQLKDRSRYLEQLIQQEEQRAEAAELEGSVVRSCTVAQLRDMSRTLQDLISSENRTQISVSPPPSTLRLQEQEQALNLSMKEATAKVVMSQRLGSSLRRKVSETETQLLALHEAKLAAISGNDFGCAKELKAEMKAVYLERDRLEALARRLHSLSSGSSQELARMKEQRQQLRLELEHREALHESRLKENATKYVELLEDRLQSCGCPGLERIWEADLEACHLFLRGLQLRTSSCGGPDVDDAPDPVVYTSTHPSTKEEEDCAMLTALGGRWCPEANLQNSEFTKKLEEFLFCMEENHPEDACSEADAADLTERCELISDRLIALEDKLQTAILNRDQALTHCLEKEVQEVKSTLQRMLTQLQVEEQQEDDTDVSDELVKDETRVKVKAEEEDDEEEEEDQYFSDSWDI
					

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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	Very low	30.5	Very low	229 Å²	229	149.8 Å²	149.8	100%	1.128	87%	0.869	S	S	*	*				0	113	0	-67.7	176.3	-75.8	0	0	107.2
2	F	31.9	Very low	30.3	Very low	224 Å²	224	151.4 Å²	151.4	98%	0.982	87%	0.87	S	S	*	*			trans	-149.6	69.7	179.5	-96.7	-74.8	0	0	0	110
3	A	32.4	Very low	29.8	Very low	108 Å²	108	150.5 Å²	150.5	89%	0.893	86%	0.86	S	S	*	*			trans	-163.4	111.8	168.7	0	0	0	0	0	107.4
4	G	29.8	Very low	29.5	Very low	81 Å²	81	146.9 Å²	146.9	84%	0.835	85%	0.849	S	S	*	*			trans	162.2	19	-174.6	0	0	0	0	0	117.6
5	L	31.9	Very low	29.3	Very low	174 Å²	174	147.7 Å²	147.7	91%	0.911	85%	0.848	S	S	*	*			trans	-135.8	57.9	179.7	-99.4	170.8	0	0	0	111.9
6	M	33.5	Very low	29	Very low	174 Å²	174	148.1 Å²	148.1	86%	0.857	84%	0.84	S	S	*	*			trans	-140.9	108.2	163.6	-78.3	-62.1	-69.7	0	0	108.4
7	G	29.6	Very low	28.8	Very low	73 Å²	73	149.1 Å²	149.1	75%	0.753	84%	0.835	S	S	*	*			trans	-83.5	140.8	175.3	0	0	0	0	0	111.7
8	L	28.2	Very low	28.5	Very low	166 Å²	166	151.3 Å²	151.3	87%	0.869	83%	0.828	S	S	*	*			trans	-139.4	124.6	170.1	-71.9	176.1	0	0	0	110
9	D	34.1	Very low	28.3	Very low	159 Å²	159	147.8 Å²	147.8	85%	0.85	82%	0.815	S	S	*	*			trans	-67.5	138.3	173.8	-89	-61.2	0	0	0	112.2
10	C	27	Very low	28	Very low	129 Å²	129	148 Å²	148	87%	0.872	81%	0.809	S	S	*	*			trans	-146.8	126.2	159.8	-93	0	0	0	0	111.9
11	H	26.6	Very low	27.8	Very low	131 Å²	131	145.6 Å²	145.6	61%	0.606	80%	0.803	S	S	*	*			trans	-81.7	147.1	167.9	-86.1	-110.6	0	0	0	110.6	R79	H11-R79 PolarHBondContact NE2-NH2 2.92Å
12	L	27.4	Very low	27.5	Very low	169 Å²	169	141 Å²	141	89%	0.885	79%	0.789	S	S	*	*			trans	-168.6	177.4	131.8	-105.4	164.5	0	0	0	112.5
13	N	24.1	Very low	27.2	Very low	139 Å²	139	138.5 Å²	138.5	74%	0.743	78%	0.78	S	S	*	*			trans	-119.4	145.2	-161.7	-69.1	-68.1	0	0	0	114.7
14	S	25.6	Very low	26.9	Very low	100 Å²	100	138 Å²	138	70%	0.699	77%	0.77	S	S	*	*			trans	53.9	130.6	132.5	-164.8	0	0	0	0	121.5
15	L	26.2	Very low	26.7	Very low	159 Å²	159	137.6 Å²	137.6	83%	0.832	77%	0.765	S	S	*	*				-170.9	164.4	107	-102.7	169.2	0	0	0	115.4
16	H	24.5	Very low	26.7	Very low	155 Å²	155	138.5 Å²	138.5	72%	0.718	76%	0.762	S	S	*	*			trans	-77.9	155.4	179.3	-77.8	-79.3	0	0	0	114.4
17	H	25.8	Very low	26.4	Very low	164 Å²	164	136.3 Å²	136.3	76%	0.759	76%	0.758	S	S	*	*				155.5	163.1	115.3	-83	-48.8	0	0	0	112.1
18	R	23.5	Very low	26.4	Very low	190 Å²	190	138.4 Å²	138.4	72%	0.717	76%	0.762	S	S	*	*			cis	176.3	138.9	-31.5	163	178.1	171.7	-168.3	-3.7	109.1
19	C	23.6	Very low	26.4	Very low	85 Å²	85	133.3 Å²	133.3	57%	0.574	75%	0.749	S	S	*	*			trans	64.3	166.1	164.5	-71.2	0	0	0	0	116
20	E	22.4	Very low	26.2	Very low	150 Å²	150	132.9 Å²	132.9	70%	0.701	75%	0.752	S	S	*	*			cis	-154.3	129.5	-11.2	-116.8	151.2	-145.9	0	0	106.9
21	S	24.1	Very low	26.5	Very low	98 Å²	98	131.4 Å²	131.4	69%	0.685	75%	0.749	S	S	*	*				77.1	143.8	105.1	-63.9	0	0	0	0	118.9
22	T	25.4	Very low	26.6	Very low	134 Å²	134	129.2 Å²	129.2	82%	0.822	76%	0.762	S	S	*	*			trans	67.1	152.9	161.6	50.1	0	0	0	0	117.5
23	E	26.1	Very low	26.8	Very low	170 Å²	170	127.4 Å²	127.4	79%	0.794	76%	0.763	S	S	*	*			cis	-151.3	-170.7	2.4	-136.2	-169.1	129.3	0	0	112.9
24	S	25.8	Very low	27.3	Very low	99 Å²	99	125.9 Å²	125.9	69%	0.692	76%	0.763	S	S	*	*			trans	-22.3	145.2	166.2	-58.2	0	0	0	0	118.1
25	G	26	Very low	27.7	Very low	71 Å²	71	124.7 Å²	124.7	73%	0.732	77%	0.767	S	S	*	*			cis	131.6	172.3	2.5	0	0	0	0	0	113.9
26	K	30.4	Very low	28.4	Very low	193 Å²	193	127.3 Å²	127.3	84%	0.839	77%	0.766	S	S	*	*			trans	85.3	113.2	163.1	-62.5	178.1	179.4	167.5	0	122.3
27	V	27.9	Very low	29.3	Very low	128 Å²	128	128 Å²	128	78%	0.776	77%	0.767	S	S	*	*				86.4	137.9	118.4	171.7	0	0	0	0	121.3
28	S	29.9	Very low	29.8	Very low	118 Å²	118	131.7 Å²	131.7	83%	0.825	77%	0.774	S	S	*	*			trans	76.1	138.9	167.1	-72.1	0	0	0	0	118
29	G	27.1	Very low	30.7	Very low	58 Å²	58	130.3 Å²	130.3	60%	0.598	78%	0.78	S	S	*	*			cis	161.4	170.1	-7.9	0	0	0	0	0	114.8
30	T	31.1	Very low	31.4	Very low	151 Å²	151	135.7 Å²	135.7	93%	0.926	80%	0.796	S	S	*	*			trans	72.5	161.9	178.2	78	0	0	0	0	117.1
31	A	32.9	Very low	32.3	Very low	98 Å²	98	140.2 Å²	140.2	81%	0.81	81%	0.807	S	S	*	*				-169.5	135.5	-53.8	0	0	0	0	0	111.8
32	G	29.4	Very low	33.3	Very low	84 Å²	84	147.2 Å²	147.2	87%	0.866	82%	0.818	S	S	*	*			trans	90.3	156.2	166.4	0	0	0	0	0	115.5
33	S	30.1	Very low	34.7	Very low	131 Å²	131	147.2 Å²	147.2	92%	0.916	82%	0.821	S	S	*	*			cis	-142.9	-174.5	1	75.2	0	0	0	0	112.2
34	S	36.1	Very low	35.2	Very low	107 Å²	107	142.6 Å²	142.6	75%	0.748	82%	0.819	S	S	*	*			trans	-115.7	138.1	-165.2	-170.4	0	0	0	0	114.6
35	G	32.6	Very low	35.7	Very low	75 Å²	75	148.3 Å²	148.3	77%	0.773	83%	0.827	S	S	*	*			trans	-127.6	143.8	163.3	0	0	0	0	0	110.8
36	R	42.4	Very low	36.7	Very low	214 Å²	214	153.6 Å²	153.6	81%	0.808	83%	0.834	S	S	*	*			trans	-151.9	141.1	-168.6	-126.3	-173.2	-166.6	-97.3	15.8	114.3
37	K	43.1	Very low	36.9	Very low	169 Å²	169	153.3 Å²	153.3	74%	0.735	83%	0.828	S	S	*	*			trans	71.8	133.6	159.9	-54.4	170.3	177.4	176.6	0	118.2
38	R	36	Very low	37.3	Very low	243 Å²	243	150.7 Å²	150.7	92%	0.917	83%	0.827	S	S	*	*				-161.3	168.6	98.1	-97.7	164.1	-151.8	-98.9	3.7	111.6
39	L	42.8	Very low	37.6	Very low	161 Å²	161	150.7 Å²	150.7	84%	0.843	81%	0.814	S	S	*	*			trans	-133.3	153.4	-172.5	-67.6	161.4	0	0	0	109.2
40	H	38.2	Very low	37.9	Very low	198 Å²	198	156.4 Å²	156.4	92%	0.917	83%	0.825	S	S	*	*			trans	-144.1	168.2	156.3	-90.6	-76.9	0	0	0	111.7
41	R	41.9	Very low	38	Very low	244 Å²	244	153.5 Å²	153.5	92%	0.921	82%	0.816	S	S	*	*			trans	-120.6	159.3	-163.6	-83.8	-179	164.6	-175.3	-4.9	114.2
42	R	44.6	Very low	37.8	Very low	245 Å²	245	160.8 Å²	160.8	93%	0.925	82%	0.823	S	S	*	*			trans	-45.6	152.3	156	-72	-175.7	172.2	-168.1	-1.2	113
43	P	54.2	Low	38	Very low	134 Å²	134	164.1 Å²	164.1	87%	0.87	82%	0.82	S	S	*	*				-141.7	-178.4	80.6	36.3	-17	0	0	0	113.8
44	G	35.6	Very low	38	Very low	73 Å²	73	167.3 Å²	167.3	75%	0.753	82%	0.821	S	S	*	*			cis	-174.5	-166.6	6.6	0	0	0	0	0	114.4
45	Y	37.5	Very low	37.6	Very low	220 Å²	220	167.9 Å²	167.9	86%	0.863	82%	0.824	S	S	*	*			trans	-73.9	159.2	-170.2	-79.3	-101.2	0	0	0	116.9
46	M	45.9	Very low	37.4	Very low	181 Å²	181	170.4 Å²	170.4	89%	0.892	82%	0.824	S	S	*	*			trans	-135.9	154.9	135.9	-95.9	-63.6	-76.4	0	0	110.4
47	R	35.8	Very low	36.8	Very low	187 Å²	187	163.6 Å²	163.6	71%	0.706	81%	0.813	S	S	*	*			trans	-145.6	141.1	-174.8	-178.8	177.5	-176	-92.4	-5.8	110.2	E49	R47-E49 IonicContact CZ-OE1 3.43Å; R47-E49 IonicContact NH1-OE1 3.85Å; R47-E49 PolarHBondContact NH1-OE1 3.49Å; R47-E49 IonicContact NH2-OE1 2.71Å; R47-E49 PolarHBondContact NH2-OE1 3.39Å
48	G	35.3	Very low	36	Very low	74 Å²	74	164.4 Å²	164.4	76%	0.763	82%	0.819	S	S	*	*			trans	-143.5	139.8	174.1	0	0	0	0	0	111.3
49	E	37.2	Very low	35.7	Very low	117 Å²	117	156.5 Å²	156.5	55%	0.547	81%	0.806	S	S	.	*			trans	-105.4	179	177.2	-56.4	-173.8	160.6	0	0	108.9	R47	R47-E49 IonicContact CZ-OE1 3.43Å; R47-E49 IonicContact NH1-OE1 3.85Å; R47-E49 PolarHBondContact NH1-OE1 3.49Å; R47-E49 IonicContact NH2-OE1 2.71Å; R47-E49 PolarHBondContact NH2-OE1 3.39Å
50	Q	33.5	Very low	35	Very low	178 Å²	178	156.5 Å²	156.5	83%	0.832	80%	0.802	S	S	*	*			cis	-159.1	164.9	22.6	-153.7	166.6	78.6	0	0	112.1
51	A	33.2	Very low	34.6	Very low	90 Å²	90	154.1 Å²	154.1	74%	0.744	80%	0.796	S	S	*	*			trans	-81.6	168.9	-162.4	0	0	0	0	0	117.1
52	R	28.7	Very low	34.1	Very low	252 Å²	252	150.9 Å²	150.9	95%	0.951	79%	0.791	S	S	*	*			trans	-136.6	146.3	140.6	-155.7	171.2	-170.4	175.1	3.1	110.6
53	L	32.8	Very low	33.4	Very low	154 Å²	154	148.2 Å²	148.2	81%	0.806	79%	0.789	S	S	*	*			trans	-100.9	148.1	-166.8	-64.4	158.7	0	0	0	113.2
54	Q	30.6	Very low	32.1	Very low	197 Å²	197	150.2 Å²	150.2	92%	0.921	79%	0.787	S	S	*	*				-162.2	155.1	125.9	-106.6	166.7	21.7	0	0	111.5
55	C	27.7	Very low	31.7	Very low	120 Å²	120	153.5 Å²	153.5	81%	0.811	79%	0.787	S	S	*	*			trans	-85.4	169.8	-180	-54.7	0	0	0	0	110.5
56	T	28.4	Very low	31.3	Very low	128 Å²	128	150.3 Å²	150.3	79%	0.785	78%	0.78	S	S	*	*			cis	-142.3	148.4	35.5	51	0	0	0	0	110.9
57	A	29.2	Very low	30.5	Very low	70 Å²	70	149.7 Å²	149.7	58%	0.579	78%	0.775	S	S	*	*				51.3	129.4	71.5	0	0	0	0	0	113
58	H	27.9	Very low	30.3	Very low	187 Å²	187	149.7 Å²	149.7	87%	0.866	78%	0.783	S	S	*	*			cis	-157	165.7	9.5	-96.3	-48	0	0	0	108.8
59	A	28.4	Very low	29.9	Very low	77 Å²	77	154.9 Å²	154.9	64%	0.636	79%	0.787	S	S	*	*			cis	-169	178.3	-9.4	0	0	0	0	0	110.6
60	Q	28.8	Very low	29.5	Very low	160 Å²	160	157.6 Å²	157.6	75%	0.748	80%	0.8	S	S	*	*			trans	74.9	106.3	157.6	-78.3	174.3	-96.2	0	0	120.8
61	D	29.1	Very low	29.1	Very low	148 Å²	148	153 Å²	153	79%	0.791	79%	0.788	S	S	*	*			trans	-63.1	156.9	136.7	-16.5	-106.5	0	0	0	110.9
62	E	31	Very low	28.7	Very low	176 Å²	176	156.5 Å²	156.5	82%	0.822	79%	0.792	S	S	*	*			trans	-144.2	151.5	137.4	-68.4	-161.3	156.9	0	0	108.3
63	E	30	Very low	28.6	Very low	189 Å²	189	148.4 Å²	148.4	88%	0.883	78%	0.779	S	S	*	*			trans	-104.1	-137.9	179.8	-62.9	-179.9	119.5	0	0	109.8
64	E	27.1	Very low	28.2	Very low	176 Å²	176	147.5 Å²	147.5	82%	0.822	78%	0.784	S	S	*	*			trans	74.5	112.2	177.3	-55.4	-176.6	-172.3	0	0	114
65	D	26.8	Very low	28.2	Very low	142 Å²	142	146.4 Å²	146.4	76%	0.759	78%	0.783	S	S	*	*				82.1	146.4	62.3	-64	-28.2	0	0	0	111.4
66	E	30	Very low	28.3	Very low	154 Å²	154	151.1 Å²	151.1	72%	0.72	78%	0.783	S	S	*	*			cis	-153.9	-175.2	-0.3	-124.7	170.5	-179.4	0	0	108.8
67	E	29.2	Very low	28.3	Very low	167 Å²	167	152.4 Å²	152.4	78%	0.78	79%	0.785	S	S	*	*			trans	20.2	148.6	150.4	-59.2	-177.5	168.5	0	0	121.8
68	E	30.5	Very low	28.2	Very low	188 Å²	188	152.8 Å²	152.8	88%	0.879	80%	0.797	S	S	*	*			cis	-149.6	171.6	48.6	-72.1	-177.2	134.4	0	0	114.2
69	E	27.1	Very low	28.4	Very low	182 Å²	182	153.9 Å²	153.9	85%	0.85	79%	0.793	S	S	*	*			trans	-100	-165	178.5	-57.2	-169.6	108.8	0	0	114
70	E	29.5	Very low	28.5	Very low	175 Å²	175	156.3 Å²	156.3	82%	0.818	81%	0.805	S	S	*	*			trans	74.4	153.3	157.2	-71.6	-128.4	98.8	0	0	120
71	S	25.6	Very low	28.4	Very low	81 Å²	81	151.8 Å²	151.8	57%	0.566	80%	0.801	S	S	*	*			cis	-172.5	165.2	-28.5	-163.1	0	0	0	0	110
72	I	23.8	Very low	28.3	Very low	164 Å²	164	150.3 Å²	150.3	84%	0.841	80%	0.802	S	S	*	*			trans	56	154.4	167.8	14.5	179.2	0	0	0	117.5
73	A	26.3	Very low	28	Very low	81 Å²	81	150.7 Å²	150.7	67%	0.669	80%	0.803	S	S	*	*			cis	-146.5	146.9	-1.4	0	0	0	0	0	112
74	C	25.7	Very low	27.9	Very low	136 Å²	136	146.5 Å²	146.5	92%	0.919	80%	0.801	S	S	*	*			trans	-83.7	136.2	174.3	-59.3	0	0	0	0	112.2
75	I	30.7	Very low	27.9	Very low	173 Å²	173	145.4 Å²	145.4	89%	0.887	80%	0.801	S	S	*	*			trans	-110	140.7	170.8	-63	-179.2	0	0	0	109.9
76	R	28.9	Very low	28.1	Very low	219 Å²	219	146.1 Å²	146.1	83%	0.826	80%	0.803	S	S	*	*			trans	-109.2	164.6	-171.3	-170.7	-179.5	179.3	169.3	1.7	111.6
77	N	28.4	Very low	28.1	Very low	155 Å²	155	144.3 Å²	144.3	83%	0.829	80%	0.803	S	S	*	*			trans	99.7	142.9	171	-49.6	-35.3	0	0	0	114.2
78	G	27.3	Very low	28.1	Very low	79 Å²	79	145 Å²	145	81%	0.814	80%	0.803	S	S	*	*			cis	-165.3	174.7	1.3	0	0	0	0	0	113.8
79	R	32.6	Very low	27.9	Very low	210 Å²	210	140.9 Å²	140.9	79%	0.792	80%	0.802	S	S	*	*			trans	-84.4	141.6	-172.7	-77.8	174.5	152.4	-177.4	-7.7	114.8	H11	H11-R79 PolarHBondContact NE2-NH2 2.92Å
80	S	29.7	Very low	27.9	Very low	127 Å²	127	138.9 Å²	138.9	89%	0.888	80%	0.802	S	S	*	*			trans	176	157.8	134.7	53.1	0	0	0	0	111.1
81	G	27.1	Very low	27.7	Very low	65 Å²	65	142.1 Å²	142.1	67%	0.67	81%	0.807	S	S	*	*			cis	164.4	64.5	-4.1	0	0	0	0	0	116.5
82	C	28.2	Very low	27.8	Very low	118 Å²	118	144.4 Å²	144.4	80%	0.797	82%	0.817	S	S	*	*			trans	67.9	160.1	154.9	-54.3	0	0	0	0	122.2
83	H	24.4	Very low	28.1	Very low	184 Å²	184	144.9 Å²	144.9	85%	0.852	82%	0.816	S	S	*	*			trans	68.4	121.5	164.3	-65.5	-72.7	0	0	0	121.6
84	A	26.6	Very low	28.1	Very low	101 Å²	101	150.5 Å²	150.5	84%	0.835	83%	0.828	S	S	*	*			trans	-131.1	149.5	143.7	0	0	0	0	0	107.4
85	D	26.6	Very low	28.2	Very low	153 Å²	153	151.2 Å²	151.2	82%	0.818	82%	0.822	S	S	*	*			trans	-139.1	157.6	-179.1	-154.8	-11.4	0	0	0	110.9
86	L	32.9	Very low	28.1	Very low	156 Å²	156	147.9 Å²	147.9	82%	0.817	81%	0.814	S	S	*	*			trans	-94.3	140.7	-165.6	-80	72.8	0	0	0	113.5
87	T	29.2	Very low	28.2	Very low	117 Å²	117	146.4 Å²	146.4	72%	0.718	82%	0.817	S	S	*	*			trans	-135	130.4	153.4	50.7	0	0	0	0	112.6
88	K	29.2	Very low	28.1	Very low	180 Å²	180	143.5 Å²	143.5	78%	0.783	81%	0.814	S	S	*	*			trans	-71	154	175.8	-63	173.9	175	178.7	0	111.9
89	A	26.5	Very low	28.5	Very low	103 Å²	103	145.9 Å²	145.9	85%	0.851	82%	0.815	S	S	*	*			trans	-143.1	123.6	157.4	0	0	0	0	0	112.8
90	T	26.6	Very low	28.2	Very low	139 Å²	139	142.3 Å²	142.3	85%	0.853	82%	0.817	S	S	*	*			trans	-68	150.7	176.8	-50.5	0	0	0	0	112.5
91	R	26.4	Very low	28	Very low	243 Å²	243	143.2 Å²	143.2	92%	0.917	82%	0.817	S	S	*	*			trans	-122	139.2	163.4	-167.3	169.2	-175.9	159.8	3.3	112.4
92	V	27.7	Very low	28	Very low	130 Å²	130	148.8 Å²	148.8	79%	0.788	82%	0.823	S	S	*	*			trans	-88.8	152.8	-177.9	176.9	0	0	0	0	111.4
93	Q	28.7	Very low	27.9	Very low	173 Å²	173	148.7 Å²	148.7	81%	0.808	82%	0.818	S	S	*	*			trans	-67	153.8	-179.8	-62.8	173.3	-16.4	0	0	113.8
94	Q	26.6	Very low	27.9	Very low	199 Å²	199	145.3 Å²	145.3	93%	0.93	82%	0.815	S	S	*	*			trans	-142.7	156.6	152.4	-147.1	164.8	6.7	0	0	109.8
95	L	28.6	Very low	27.9	Very low	151 Å²	151	147.4 Å²	147.4	79%	0.791	81%	0.812	S	S	*	*			trans	-108.7	174.3	-164.1	-89	118.6	0	0	0	114
96	S	28.1	Very low	27.9	Very low	103 Å²	103	146.6 Å²	146.6	72%	0.72	81%	0.812	S	S	*	*			trans	82.7	149.3	164.5	83.1	0	0	0	0	116.5
97	Q	29.9	Very low	27.5	Very low	189 Å²	189	144.9 Å²	144.9	88%	0.883	80%	0.804	S	S	*	*			cis	-156.6	158.1	-15.9	-118.9	165.5	46.8	0	0	109.1
98	A	27.4	Very low	27.4	Very low	93 Å²	93	145.5 Å²	145.5	77%	0.769	80%	0.799	S	S	*	*			trans	-121.1	138.4	-179.5	0	0	0	0	0	112.4
99	P	35	Very low	27.2	Very low	130 Å²	130	144 Å²	144	84%	0.844	80%	0.799	S	S	*	*			trans	-96.9	137.7	167.8	34.8	-29.3	0	0	0	111.9
100	T	26.6	Very low	27.3	Very low	135 Å²	135	144.9 Å²	144.9	83%	0.828	79%	0.785	S	S	*	*			trans	-100	135.7	178.1	-6.1	0	0	0	0	111.8
101	V	25.4	Very low	27.3	Very low	146 Å²	146	144.8 Å²	144.8	89%	0.885	77%	0.774	S	S	*	*			trans	-132.8	155.9	162.9	-176.3	0	0	0	0	108.9
102	K	26.9	Very low	27.4	Very low	181 Å²	181	142.2 Å²	142.2	79%	0.787	77%	0.77	S	S	*	*			trans	-125.6	144.9	-159.2	-93.7	-177.6	176.2	179.5	0	114.5
103	V	27.3	Very low	28.2	Very low	116 Å²	116	142.2 Å²	142.2	70%	0.703	77%	0.772	S	S	*	*			trans	67.8	111.1	139.7	175.2	0	0	0	0	119.3
104	S	24	Very low	28	Very low	113 Å²	113	139.2 Å²	139.2	79%	0.79	77%	0.771	S	S	*	*				179.6	129.2	113.6	-70.4	0	0	0	0	108.6
105	L	27.4	Very low	27.9	Very low	145 Å²	145	135.9 Å²	135.9	76%	0.759	76%	0.764	S	S	*	*			cis	76.7	94.1	48.4	-94.6	170.5	0	0	0	116.8
106	T	25.4	Very low	27.7	Very low	136 Å²	136	134.5 Å²	134.5	83%	0.834	77%	0.766	S	S	*	*			trans	-166.1	137.8	135.8	9.7	0	0	0	0	107.7
107	N	24.2	Very low	27.6	Very low	121 Å²	121	135.2 Å²	135.2	65%	0.647	77%	0.771	S	S	*	*			cis	67.7	125.6	40.9	-92.9	40.6	0	0	0	113.4
108	E	27.1	Very low	27.5	Very low	129 Å²	129	131.5 Å²	131.5	60%	0.603	77%	0.765	S	S	*	*			cis	-151.5	179.3	2.5	-68.8	-160.5	129.4	0	0	112.4
109	L	25.9	Very low	27.5	Very low	149 Å²	149	132.5 Å²	132.5	78%	0.78	77%	0.767	S	S	*	*			trans	139.7	107.9	132.2	-79	130.6	0	0	0	110.8
110	H	29	Very low	27.1	Very low	122 Å²	122	135.1 Å²	135.1	57%	0.565	77%	0.768	S	S	*	*				80.8	140.2	72.1	-74.6	6.9	0	0	0	112.9
111	H	26	Very low	27.1	Very low	136 Å²	136	133.6 Å²	133.6	63%	0.63	76%	0.763	S	S	*	*			cis	-151	131.3	12.8	-96.6	-31.1	0	0	0	110.5
112	K	27.5	Very low	27.2	Very low	190 Å²	190	136.8 Å²	136.8	83%	0.826	77%	0.765	S	S	*	*				83.4	153.6	100.6	-78.6	-172.2	172	179.4	0	118.4
113	P	46.1	Very low	27.3	Very low	129 Å²	129	135.4 Å²	135.4	84%	0.838	77%	0.766	S	S	*	*			trans	-120	177.6	-162	43.5	-30.9	0	0	0	116.5
114	S	24.8	Very low	27.3	Very low	111 Å²	111	138 Å²	138	78%	0.776	78%	0.775	S	S	*	*			trans	-169.4	148.9	176.5	171.9	0	0	0	0	109.3
115	T	23.8	Very low	27.4	Very low	128 Å²	128	137.2 Å²	137.2	79%	0.785	78%	0.775	S	S	*	*			cis	-158.1	164	-19.3	-73.3	0	0	0	0	108.2
116	C	23.7	Very low	27.2	Very low	123 Å²	123	133.7 Å²	133.7	83%	0.831	77%	0.774	S	S	*	*			trans	-79.3	152.2	-165.7	-42.6	0	0	0	0	117.8
117	S	26.1	Very low	28.4	Very low	118 Å²	118	132.8 Å²	132.8	83%	0.825	77%	0.771	S	S	*	*			trans	-159.5	141.1	134.3	57	0	0	0	0	108.8
118	S	28.1	Very low	28.6	Very low	110 Å²	110	133.9 Å²	133.9	77%	0.769	78%	0.776	S	S	*	*			cis	122.6	94.8	1.9	176.7	0	0	0	0	111.5
119	S	28.3	Very low	28.6	Very low	115 Å²	115	135.1 Å²	135.1	80%	0.804	79%	0.787	S	S	*	*			trans	-158.8	111.5	152.9	-67	0	0	0	0	111.8
120	E	25.8	Very low	28.6	Very low	184 Å²	184	131.4 Å²	131.4	86%	0.86	78%	0.784	S	S	*	*			trans	28	123.3	143.7	-51.3	-170.6	116.5	0	0	121.1
121	S	26.8	Very low	28.5	Very low	103 Å²	103	131.7 Å²	131.7	72%	0.72	79%	0.794	S	S	*	*			cis	85.3	107.8	45.4	-65.8	0	0	0	0	116.1
122	K	28.1	Very low	28.7	Very low	213 Å²	213	133 Å²	133	93%	0.926	80%	0.801	S	S	*	*			trans	-163.6	112.4	135.9	-102.9	142.2	-168.8	164.4	0	111.8
123	N	27.7	Very low	28.5	Very low	152 Å²	152	130 Å²	130	81%	0.813	80%	0.799	S	S	*	*			trans	-92.5	162	163.4	-72.9	-85.5	0	0	0	109.4
124	L	28.2	Very low	27.6	Very low	172 Å²	172	129.7 Å²	129.7	90%	0.901	79%	0.794	S	S	*	*				-179.2	154.1	119.2	-98.9	161.6	0	0	0	114.5
125	A	25.9	Very low	27.6	Very low	95 Å²	95	128.9 Å²	128.9	79%	0.785	79%	0.789	S	S	*	*			trans	69.5	108.5	158.9	0	0	0	0	0	120.9
126	G	23	Very low	27.7	Very low	72 Å²	72	129.6 Å²	129.6	74%	0.742	79%	0.788	S	S	*	*			trans	-100.9	-147.5	134.2	0	0	0	0	0	109.1
127	P	50.7	Low	27.9	Very low	117 Å²	117	131.7 Å²	131.7	76%	0.76	79%	0.785	S	S	*	*			cis	-130.7	-169.4	-10	41.1	-24.1	0	0	0	112.7
128	L	27.5	Very low	27.9	Very low	144 Å²	144	134.2 Å²	134.2	75%	0.754	79%	0.789	S	S	*	*			trans	163.4	129.1	131.2	-87.3	161.1	0	0	0	116
129	N	27.8	Very low	27.8	Very low	155 Å²	155	134.1 Å²	134.1	83%	0.829	79%	0.788	S	S	*	*			trans	46.5	141.6	140.5	-62.2	-2.3	0	0	0	125.6
130	G	25.3	Very low	28.1	Very low	71 Å²	71	134.2 Å²	134.2	73%	0.732	79%	0.786	S	S	*	*			trans	125.6	101.6	155	0	0	0	0	0	113.8
131	V	28	Very low	28.1	Very low	128 Å²	128	130 Å²	130	78%	0.776	78%	0.777	S	S	*	*			cis	95.9	98.6	46.3	176.9	0	0	0	0	114.1
132	Q	28.9	Very low	28.3	Very low	163 Å²	163	133.2 Å²	133.2	76%	0.762	79%	0.785	S	S	*	*			trans	59.2	122	144.2	-66	-179.6	10.1	0	0	123.5
133	T	24.4	Very low	28.2	Very low	128 Å²	128	133 Å²	133	79%	0.785	79%	0.787	S	S	*	*			trans	66.5	161.7	138.8	64.2	0	0	0	0	118.3
134	T	25.8	Very low	28.5	Very low	121 Å²	121	131.6 Å²	131.6	74%	0.742	79%	0.789	S	S	*	*			cis	-137.2	178.5	13.9	53.2	0	0	0	0	113.2
135	S	26.7	Very low	28.3	Very low	95 Å²	95	128.9 Å²	128.9	66%	0.664	79%	0.785	S	S	*	*			trans	-37.8	164.3	150.3	-11.9	0	0	0	0	114.3
136	N	24.1	Very low	28.6	Very low	143 Å²	143	129.3 Å²	129.3	77%	0.765	78%	0.782	S	S	*	*			cis	-161.5	-174.1	45.2	-141	42.1	0	0	0	114.8
137	E	28.2	Very low	29	Very low	166 Å²	166	133.7 Å²	133.7	78%	0.776	78%	0.783	S	S	*	*			trans	-63.3	158.3	-177.4	-50.7	166.8	119.6	0	0	116.2
138	L	26.3	Very low	28.4	Very low	172 Å²	172	134.3 Å²	134.3	90%	0.901	78%	0.784	S	S	*	*				-171.2	129.7	127	-103.6	165.2	0	0	0	111.9
139	S	26.9	Very low	29.1	Very low	107 Å²	107	133.3 Å²	133.3	75%	0.748	78%	0.784	S	S	*	*			trans	-99.8	161.3	164.4	-48.6	0	0	0	0	109.9
140	P	35.1	Very low	30	Very low	117 Å²	117	132.1 Å²	132.1	76%	0.76	77%	0.772	S	S	*	*				-153.9	170.9	97.8	39.4	-21.5	0	0	0	117.7
141	S	24	Very low	31	Very low	96 Å²	96	134.1 Å²	134.1	67%	0.671	77%	0.774	S	S	*	*			trans	59.9	98.4	146.9	59.2	0	0	0	0	121.7
142	L	32.3	Very low	32.3	Very low	171 Å²	171	128.8 Å²	128.8	90%	0.895	74%	0.743	S	S	*	*				37.7	110.6	115.8	-65.4	168.7	0	0	0	119.2
143	Q	26.1	Very low	33.6	Very low	207 Å²	207	126.7 Å²	126.7	97%	0.967	75%	0.746	S	S	*	*			trans	-132.9	160.9	133.6	-75.7	-164	-33.4	0	0	109.9
144	S	32.4	Very low	35.3	Very low	123 Å²	123	127.1 Å²	127.1	86%	0.86	74%	0.737	S	S	*	*			trans	-106.9	134.7	-173.2	178.4	0	0	0	0	110.4
145	S	26	Very low	36.6	Very low	115 Å²	115	125.1 Å²	125.1	80%	0.804	73%	0.728	S	S	*	*			trans	-131.5	167.5	167.6	64.5	0	0	0	0	110.8
146	S	31.7	Very low	38.2	Very low	104 Å²	104	127 Å²	127	73%	0.727	73%	0.725	S	S	*	*			trans	-67.1	130.9	-169.3	-171.2	0	0	0	0	113.1	V148	S146-V148 PolarHBondContact O-N 3.47Å
147	E	31.9	Very low	39.8	Very low	165 Å²	165	122.7 Å²	122.7	77%	0.771	70%	0.701	S	S	*	*			trans	-76.9	82.8	175.2	-170.1	171.4	-148.5	0	0	110.6	V149	E147-V149 PolarHBondContact O-N 3.35Å
148	V	36.8	Very low	41.4	Very low	129 Å²	129	119.3 Å²	119.3	78%	0.782	69%	0.685	S	S	*	*			trans	-72.2	105.9	174	-177.9	0	0	0	0	109.1	S146 F150	S146-V148 PolarHBondContact O-N 3.47Å; V148-F150 PolarHBondContact O-N 2.6Å
149	V	42.3	Very low	42.8	Very low	123 Å²	123	116.4 Å²	116.4	75%	0.745	67%	0.667	S	S	*	*			trans	-71.5	101.2	-176.4	-179.2	0	0	0	0	110.7	E147 S151	E147-V149 PolarHBondContact O-N 3.35Å; V149-S151 PolarHBondContact O-N 3.23Å
150	F	47.5	Very low	44.2	Very low	131 Å²	131	114.4 Å²	114.4	58%	0.575	65%	0.653	S	S	*	*			trans	-65.9	109.6	178	-175.4	-97.3	0	0	0	112	V148 L161	V148-F150 PolarHBondContact O-N 2.6Å; F150-L161 WeakPolarHBondContact O-CD1 3.24Å
151	S	46.1	Very low	45	Very low	112 Å²	112	113.2 Å²	113.2	78%	0.783	64%	0.64	S	S	*	*			trans	-95.2	116.7	174.7	60.2	0	0	0	0	111.4	V149	V149-S151 PolarHBondContact O-N 3.23Å
152	S	55.1	Low	46.1	Very low	17 Å²	17	115.2 Å²	115.2	12%	0.119	64%	0.643	C	S	.	*			trans	-105.4	142	175.2	-175.9	0	0	0	0	111.8	F154 Q158	S152-F154 PolarHBondContact O-N 3.07Å; S152-F154 PolarHBondContact OG-N 3.38Å; S152-Q158 WeakPolarHBondContact O-CG 3.05Å; S152-Q158 PolarHBondContact O-NE2 2.85Å
153	S	57	Low	46.5	Very low	118 Å²	118	111.4 Å²	111.4	83%	0.825	63%	0.63	S	S	*	*	S	Bend	trans	-65.1	-20.7	172.9	-41.4	0	0	0	0	113.5
154	F	59	Low	47.1	Very low	138 Å²	138	108.3 Å²	108.3	61%	0.605	62%	0.621	S	S	*	*			trans	-88.3	118.8	-175.7	-69.2	-85.2	0	0	0	112	S152 F156 I157 Q158	S152-F154 PolarHBondContact O-N 3.07Å; S152-F154 PolarHBondContact OG-N 3.38Å; F154-F156 HydrophobicContact CB-CD1 4.17Å; F154-F156 HydrophobicContact CB-CE1 4.2Å; F154-F156 PolarHBondContact O-N 2.68Å; F154-F156 VanDerWaalsContact O-N 3.15Å; F154-I157 HydrophobicContact CB-CD1 4.11Å; F154-I157 HydrophobicContact CB-CG1 4.18Å; F154-I157 PolarHBondContact O-N 2.8Å; F154-Q158 PolarHBondContact O-N 3.06Å
155	S	52.9	Low	47.6	Very low	78 Å²	78	110.9 Å²	110.9	55%	0.545	62%	0.619	S	S	.	*	H	α-helix	trans	-62.7	-23.2	-172.9	62.7	0	0	0	0	114.7	Q159	S155-Q159 WeakPolarHBondContact O-CG 3.48Å; S155-Q159 PolarHBondContact O-N 3.43Å; S155-Q159 PolarHBondContact O-NE2 2.81Å
156	F	61	Low	47.8	Very low	136 Å²	136	116.2 Å²	116.2	60%	0.596	62%	0.622	S	S	*	*	H	α-helix	trans	-74.5	-35.3	174	87.9	-94.3	0	0	0	112.3	F154 Q159 S160	F154-F156 HydrophobicContact CB-CD1 4.17Å; F154-F156 HydrophobicContact CB-CE1 4.2Å; F154-F156 PolarHBondContact O-N 2.68Å; F154-F156 VanDerWaalsContact O-N 3.15Å; F156-Q159 PolarHBondContact O-N 3.22Å; F156-S160 PolarHBondContact O-N 2.63Å
157	I	57.2	Low	47.7	Very low	51 Å²	51	116.9 Å²	116.9	26%	0.262	62%	0.622	S	S	.	*	H	α-helix	trans	-68.3	-44.8	177.6	-59.2	-177.7	0	0	0	109.5	F154 Q159 S160 L161	F154-I157 HydrophobicContact CB-CD1 4.11Å; F154-I157 HydrophobicContact CB-CG1 4.18Å; F154-I157 PolarHBondContact O-N 2.8Å; I157-Q159 VanDerWaalsContact C-N 3.29Å; I157-Q159 PolarHBondContact O-N 3.19Å; I157-S160 PolarHBondContact O-N 3.2Å; I157-S160 VanDerWaalsContact O-N 3.08Å; I157-L161 HydrophobicContact CG2-CD1 4.25Å; I157-L161 WeakPolarHBondContact O-CG 3.45Å; I157-L161 PolarHBondContact O-N 2.96Å
158	Q	63	Low	47.4	Very low	95 Å²	95	116.3 Å²	116.3	44%	0.444	62%	0.624	S	S	.	*	H	α-helix	trans	-55.2	-42.8	172.4	-63.5	-179.9	-2.9	0	0	112.4	S152 F154 L161 N162	S152-Q158 WeakPolarHBondContact O-CG 3.05Å; S152-Q158 PolarHBondContact O-NE2 2.85Å; F154-Q158 PolarHBondContact O-N 3.06Å; Q158-L161 PolarHBondContact O-N 3.29Å; Q158-N162 PolarHBondContact O-N 2.75Å; Q158-N162 PolarHBondContact O-ND2 2.74Å
159	Q	55	Low	47.7	Very low	112 Å²	112	115.4 Å²	115.4	52%	0.523	62%	0.621	S	S	.	*	H	α-helix	trans	-69	-32.6	177.4	-75.8	169.4	112.1	0	0	112.5	S155 F156 I157	S155-Q159 WeakPolarHBondContact O-CG 3.48Å; S155-Q159 PolarHBondContact O-N 3.43Å; S155-Q159 PolarHBondContact O-NE2 2.81Å; F156-Q159 PolarHBondContact O-N 3.22Å; I157-Q159 VanDerWaalsContact C-N 3.29Å; I157-Q159 PolarHBondContact O-N 3.19Å
160	S	56.3	Low	47.1	Very low	64 Å²	64	114.4 Å²	114.4	45%	0.448	63%	0.625	S	S	.	*	H	α-helix	trans	-70.9	-34.9	174.9	-172.1	0	0	0	0	113.5	F156 I157	F156-S160 PolarHBondContact O-N 2.63Å; I157-S160 PolarHBondContact O-N 3.2Å; I157-S160 VanDerWaalsContact O-N 3.08Å
161	L	52.3	Low	46	Very low	92 Å²	92	119.9 Å²	119.9	48%	0.482	64%	0.642	S	S	.	*	H	α-helix	trans	-68.6	-42.4	-179.7	-70.3	167.7	0	0	0	111.7	F150 I157 Q158 S163	F150-L161 WeakPolarHBondContact O-CD1 3.24Å; I157-L161 HydrophobicContact CG2-CD1 4.25Å; I157-L161 WeakPolarHBondContact O-CG 3.45Å; I157-L161 PolarHBondContact O-N 2.96Å; Q158-L161 PolarHBondContact O-N 3.29Å; L161-S163 PolarHBondContact O-N 3.46Å
162	N	45.8	Very low	45.2	Very low	138 Å²	138	122.3 Å²	122.3	74%	0.738	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-7.6	-179.2	-75	-77.6	0	0	0	114.4	Q158	Q158-N162 PolarHBondContact O-N 2.75Å; Q158-N162 PolarHBondContact O-ND2 2.74Å
163	S	41.8	Very low	44.1	Very low	91 Å²	91	127.3 Å²	127.3	64%	0.636	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-10.8	-173.3	-167	0	0	0	0	115	L161	L161-S163 PolarHBondContact O-N 3.46Å
164	N	39.1	Very low	42.5	Very low	143 Å²	143	131.1 Å²	131.1	77%	0.765	68%	0.682	S	S	*	*	S	Bend	trans	-93.6	-13.9	-169.2	-74.6	-13.8	0	0	0	115.2	R166	N164-R166 PolarHBondContact O-N 2.64Å
165	Q	41.3	Very low	41.2	Very low	177 Å²	177	132.3 Å²	132.3	83%	0.827	69%	0.689	S	S	*	*			trans	-92.5	57.5	-179	-67.8	-164.4	8.1	0	0	113.5
166	R	30.2	Very low	40.3	Very low	227 Å²	227	134.2 Å²	134.2	86%	0.857	70%	0.7	S	S	*	*			trans	-157.1	103.9	164.4	-144.9	175.6	-169.1	-177.7	3.7	115.7	N164	N164-R166 PolarHBondContact O-N 2.64Å
167	T	29.9	Very low	38.7	Very low	118 Å²	118	135.2 Å²	135.2	72%	0.724	71%	0.706	S	S	*	*				151.2	118.4	124.2	-63.6	0	0	0	0	110.9
168	D	26.6	Very low	38.4	Very low	153 Å²	153	137.1 Å²	137.1	82%	0.818	72%	0.722	S	S	*	*			trans	-166.8	163.7	131.5	-107.7	-5.2	0	0	0	110.8
169	P	43	Very low	36.5	Very low	110 Å²	110	138.5 Å²	138.5	71%	0.714	74%	0.737	S	S	*	*			trans	-121.4	156	-138.4	41.5	-33	0	0	0	118.5
170	A	29.6	Very low	35.2	Very low	101 Å²	101	140 Å²	140	84%	0.835	75%	0.749	S	S	*	*			trans	63.6	103.4	143.6	0	0	0	0	0	121.2
171	R	24.9	Very low	33.9	Very low	247 Å²	247	145.7 Å²	145.7	93%	0.932	77%	0.768	S	S	*	*				-152.4	159.6	123.9	-145.9	163.9	-179.2	150.8	-0.4	112.4
172	L	27.8	Very low	33.9	Very low	163 Å²	163	146.6 Å²	146.6	85%	0.853	78%	0.779	S	S	*	*			trans	-67.4	142.1	179.5	-73.4	143.3	0	0	0	112.7
173	P	32.3	Very low	33	Very low	121 Å²	121	144.7 Å²	144.7	79%	0.786	78%	0.783	S	S	*	*			trans	-84.4	156.7	166.2	34.9	-33.4	0	0	0	112.3
174	Q	23.7	Very low	32.4	Very low	198 Å²	198	146.8 Å²	146.8	93%	0.925	79%	0.787	S	S	*	*			trans	-113.5	141.6	156.4	-69.9	-173.8	-84.3	0	0	108.5
175	E	31.2	Very low	32	Very low	164 Å²	164	146.1 Å²	146.1	77%	0.766	78%	0.783	S	S	*	*			trans	-83.6	160.2	166	-134.8	-179.3	-166.9	0	0	110
176	P	35.5	Very low	31.5	Very low	117 Å²	117	144.1 Å²	144.1	76%	0.76	77%	0.774	S	S	*	*				-147.6	138.9	80.6	36.4	-18	0	0	0	117.2
177	E	27.3	Very low	31.7	Very low	157 Å²	157	141.3 Å²	141.3	73%	0.734	77%	0.768	S	S	*	*				50.9	163	107.4	-111.4	-137.6	149.6	0	0	122
178	P	50.9	Low	31.5	Very low	92 Å²	92	143.1 Å²	143.1	60%	0.597	77%	0.765	S	S	*	*				-136.7	-159.9	-99.2	44.8	-26.1	0	0	0	114
179	T	22.9	Very low	31.6	Very low	124 Å²	124	146.6 Å²	146.6	76%	0.761	77%	0.767	S	S	*	*			trans	-151.1	110.1	164.2	-62.8	0	0	0	0	114.2
180	N	26.4	Very low	31.1	Very low	143 Å²	143	148 Å²	148	77%	0.765	76%	0.764	S	S	*	*			trans	49.5	103.6	146.4	-55	-23.1	0	0	0	123.7
181	Q	29.4	Very low	31.1	Very low	183 Å²	183	150.9 Å²	150.9	86%	0.855	76%	0.76	S	S	*	*				20.2	165.3	110.6	-67.7	-167.5	25.4	0	0	122.4
182	P	53.3	Low	31.4	Very low	111 Å²	111	145 Å²	145	72%	0.721	75%	0.746	S	S	*	*			cis	-146.2	-175.8	-40.1	42.8	-25.4	0	0	0	114.6
183	A	25.7	Very low	31.4	Very low	99 Å²	99	143.8 Å²	143.8	82%	0.818	74%	0.739	S	S	*	*			trans	149.2	161.8	137.6	0	0	0	0	0	114.9
184	N	30.8	Very low	31.1	Very low	134 Å²	134	143.2 Å²	143.2	72%	0.717	73%	0.734	S	S	*	*			cis	-173.1	163.8	-40.6	-160.7	1.7	0	0	0	110.3
185	L	30.2	Very low	31.2	Very low	130 Å²	130	143.2 Å²	143.2	68%	0.681	73%	0.73	S	S	*	*			trans	66.4	150.9	160.8	-63.9	166.1	0	0	0	119.2
186	E	30.6	Very low	30.9	Very low	135 Å²	135	140.5 Å²	140.5	63%	0.631	73%	0.73	S	S	*	*			cis	-162.5	167.7	-28.1	-134.5	-173.3	-168.6	0	0	112.7
187	K	33.5	Very low	30.4	Very low	167 Å²	167	140.8 Å²	140.8	73%	0.726	74%	0.735	S	S	*	*			trans	7.9	160	154.1	-68.1	159.6	-166.1	157.5	0	121.5
188	K	27	Very low	30.3	Very low	156 Å²	156	140.5 Å²	140.5	68%	0.678	73%	0.733	S	S	*	*			cis	-156.9	179.8	28	-149.7	-151.5	164.7	-163.8	0	113.3	E190	K188-E190 VanDerWaalsContact CE-OE1 3.24Å; K188-E190 WeakPolarHBondContact CE-OE1 2.99Å; K188-E190 IonicContact NZ-OE1 2.98Å; K188-E190 PolarHBondContact NZ-OE1 2.89Å; K188-E190 IonicContact NZ-OE2 3.58Å; K188-E190 PolarHBondContact NZ-OE2 2.82Å
189	R	28.4	Very low	29.1	Very low	226 Å²	226	143.1 Å²	143.1	85%	0.853	75%	0.747	S	S	*	*			trans	-133.6	166.6	177.8	-167.3	-173.1	-169	-159.2	5.9	109.9
190	E	31.7	Very low	29.1	Very low	141 Å²	141	144.1 Å²	144.1	66%	0.659	74%	0.743	S	S	*	*			trans	126.5	149	167.5	-74.4	150	-136.7	0	0	113	K188	K188-E190 VanDerWaalsContact CE-OE1 3.24Å; K188-E190 WeakPolarHBondContact CE-OE1 2.99Å; K188-E190 IonicContact NZ-OE1 2.98Å; K188-E190 PolarHBondContact NZ-OE1 2.89Å; K188-E190 IonicContact NZ-OE2 3.58Å; K188-E190 PolarHBondContact NZ-OE2 2.82Å
191	E	30.4	Very low	29	Very low	161 Å²	161	146.1 Å²	146.1	75%	0.752	75%	0.745	S	S	*	*			cis	-171	169.8	-32.2	-130	-171.7	163.6	0	0	112.6
192	I	31.2	Very low	28.8	Very low	124 Å²	124	144.6 Å²	144.6	64%	0.636	74%	0.737	S	S	*	*			trans	81.8	106.8	142.8	-76.5	168.6	0	0	0	124.3
193	I	27.7	Very low	27.4	Very low	137 Å²	137	146.7 Å²	146.7	70%	0.703	74%	0.738	S	S	*	*				69.5	109.5	122	-58.6	177.1	0	0	0	124.3
194	T	25.4	Very low	27.4	Very low	109 Å²	109	151.4 Å²	151.4	67%	0.669	73%	0.734	S	S	*	*			trans	24.4	139.1	135	79.7	0	0	0	0	124.2
195	K	25.9	Very low	27	Very low	197 Å²	197	149.2 Å²	149.2	86%	0.857	73%	0.73	S	S	*	*				179.6	140.7	96.6	-108	167.4	-171.6	175.3	0	117.8
196	S	24.4	Very low	26.8	Very low	108 Å²	108	153.8 Å²	153.8	76%	0.755	74%	0.74	S	S	*	*			trans	-4.7	140.9	148	-177.3	0	0	0	0	121.5
197	S	26.1	Very low	26.5	Very low	123 Å²	123	151.2 Å²	151.2	86%	0.86	75%	0.749	S	S	*	*				-168.8	174	116.2	39.5	0	0	0	0	113.7
198	Q	25.3	Very low	26	Very low	151 Å²	151	147.3 Å²	147.3	71%	0.706	76%	0.756	S	S	*	*			trans	-133.3	147.2	-155.4	167.9	-171.4	0.9	0	0	111.1	H200	Q198-H200 PolarHBondContact NE2-CD2 3.28Å; Q198-H200 PolarHBondContact NE2-NE2 3Å
199	V	25.2	Very low	26	Very low	146 Å²	146	151.6 Å²	151.6	89%	0.885	77%	0.768	S	S	*	*			trans	-136.2	140.8	170	180	0	0	0	0	110.3
200	H	23.5	Very low	25.7	Very low	146 Å²	146	145.4 Å²	145.4	68%	0.676	76%	0.759	S	S	*	*			trans	-115.4	148.9	176.2	-87	-103.9	0	0	0	111.4	Q198	Q198-H200 PolarHBondContact NE2-CD2 3.28Å; Q198-H200 PolarHBondContact NE2-NE2 3Å
201	K	24.3	Very low	25.4	Very low	185 Å²	185	150.7 Å²	150.7	80%	0.804	77%	0.773	S	S	*	*			trans	143.4	161.9	136.7	-82.8	-165.4	164.3	-155.3	0	112.8
202	E	24.8	Very low	25.2	Very low	150 Å²	150	152.3 Å²	152.3	70%	0.701	77%	0.772	S	S	*	*			cis	-179.8	162.8	-34.9	-173.7	161	-156.7	0	0	107.7
203	E	23.6	Very low	24.8	Very low	155 Å²	155	151.6 Å²	151.6	72%	0.724	77%	0.769	S	S	*	*			trans	79.9	136.8	161	-149.6	159.2	-147.7	0	0	117.9
204	R	24.7	Very low	24.6	Very low	198 Å²	198	150.6 Å²	150.6	75%	0.747	77%	0.774	S	S	*	*			cis	-178.9	144.1	-22.5	164.3	-170.1	-131	149.4	-3	112.3
205	S	23.5	Very low	24.5	Very low	89 Å²	89	152.2 Å²	152.2	62%	0.622	78%	0.777	S	S	*	*			trans	60.6	156.9	168	-63.2	0	0	0	0	116.8
206	Y	26.7	Very low	24.6	Very low	226 Å²	226	154.7 Å²	154.7	89%	0.886	78%	0.781	S	S	*	*			cis	-121.6	168.2	-2.5	-61.7	-103.9	0	0	0	107
207	G	23.2	Very low	24.5	Very low	81 Å²	81	156.5 Å²	156.5	84%	0.835	79%	0.788	S	S	*	*			cis	113	113.8	20.8	0	0	0	0	0	110.2
208	G	23.6	Very low	24.4	Very low	85 Å²	85	153.9 Å²	153.9	88%	0.876	78%	0.781	S	S	*	*			trans	146.4	143.1	177	0	0	0	0	0	114.4
209	R	26.1	Very low	24.6	Very low	245 Å²	245	154.9 Å²	154.9	93%	0.925	78%	0.783	S	S	*	*			trans	-111.3	162.5	-179.6	-83.9	-173	-71.7	-105.6	-1.9	111.9
210	C	22.8	Very low	24.6	Very low	97 Å²	97	154.8 Å²	154.8	66%	0.655	77%	0.772	S	S	*	*			trans	75.5	126.2	147.9	-157.1	0	0	0	0	118.2
211	W	26	Very low	24.6	Very low	251 Å²	251	156.1 Å²	156.1	95%	0.951	78%	0.779	S	S	*	*				-135	129.8	120.8	-80.8	105.5	0	0	0	109.5
212	R	24.3	Very low	24.6	Very low	195 Å²	195	155.3 Å²	155.3	74%	0.736	78%	0.78	S	S	*	*			trans	-139.1	149.9	160.4	-155	-146.6	-117.3	-145.7	-1.6	106.4
213	D	23.5	Very low	24.7	Very low	109 Å²	109	152.3 Å²	152.3	58%	0.583	78%	0.776	S	S	*	*			trans	60.9	117.4	167.6	-49.5	-35.5	0	0	0	118.6
214	C	24.6	Very low	24.7	Very low	117 Å²	117	153.1 Å²	153.1	79%	0.791	78%	0.779	S	S	*	*				-155.8	131.5	107.7	-88.9	0	0	0	0	106.8
215	L	23.3	Very low	25.1	Very low	143 Å²	143	151 Å²	151	75%	0.749	78%	0.782	S	S	*	*				67.9	116.6	56.1	-69.9	166.1	0	0	0	113.8
216	W	26.5	Very low	26.3	Very low	249 Å²	249	151.5 Å²	151.5	94%	0.943	78%	0.783	S	S	*	*			trans	-125.1	118.1	168.5	-75.6	104.7	0	0	0	109.4
217	T	23.6	Very low	26.1	Very low	145 Å²	145	147.8 Å²	147.8	89%	0.89	78%	0.779	S	S	*	*			trans	-167.9	149.5	165.6	-8.3	0	0	0	0	113.5
218	G	24.5	Very low	26.3	Very low	69 Å²	69	148.1 Å²	148.1	71%	0.711	77%	0.768	S	S	*	*			trans	101.3	148.1	172.5	0	0	0	0	0	114.7
219	K	28.3	Very low	26.5	Very low	171 Å²	171	152.7 Å²	152.7	74%	0.743	77%	0.767	S	S	*	*			cis	-163.3	165.8	3.9	-103	172.4	169.4	-72.6	0	108.7
220	E	26.1	Very low	26.9	Very low	144 Å²	144	145.3 Å²	145.3	67%	0.673	75%	0.753	S	S	*	*			cis	-119.4	-114.8	-3.4	-162.3	86.4	-106.6	0	0	109.8
221	E	23.4	Very low	27.3	Very low	174 Å²	174	149.2 Å²	149.2	81%	0.813	76%	0.761	S	S	*	*			cis	-149.8	-176.3	-8.1	-162.9	151.8	-168.1	0	0	110.9
222	M	23.6	Very low	27.5	Very low	168 Å²	168	141.7 Å²	141.7	83%	0.828	75%	0.747	S	S	*	*			trans	-37.9	148.2	177.6	-102.7	56	160.3	0	0	117.5
223	S	26.4	Very low	27.7	Very low	88 Å²	88	139.4 Å²	139.4	62%	0.615	75%	0.749	S	S	*	*			cis	-168.5	166.1	19.1	51	0	0	0	0	115.4
224	H	25.2	Very low	28.1	Very low	171 Å²	171	141.1 Å²	141.1	79%	0.792	76%	0.758	S	S	*	*			trans	75.7	90	157.5	-61.8	-60.5	0	0	0	122.9
225	L	32.2	Very low	28.7	Very low	154 Å²	154	141.8 Å²	141.8	81%	0.806	75%	0.752	S	S	*	*			trans	5.6	161.2	132.2	-69.6	106.2	0	0	0	122.1
226	P	47.6	Very low	29.3	Very low	100 Å²	100	143.5 Å²	143.5	65%	0.649	76%	0.757	S	S	*	*			cis	-147.8	-170.1	-28.1	40.8	-20.9	0	0	0	116.9
227	N	22.8	Very low	29.9	Very low	147 Å²	147	138 Å²	138	79%	0.786	75%	0.75	S	S	*	*			trans	102.6	127.7	161.5	-69.5	10.1	0	0	0	116.8
228	S	27.6	Very low	30.3	Very low	88 Å²	88	136.8 Å²	136.8	62%	0.615	74%	0.743	S	S	*	*			cis	-153.7	146	-5.4	-89	0	0	0	0	112.5
229	E	28.4	Very low	30.5	Very low	181 Å²	181	138.7 Å²	138.7	85%	0.846	75%	0.745	S	S	*	*			trans	29.2	132.7	140	-68.3	165.9	-151.9	0	0	119.9
230	S	33.3	Very low	30.6	Very low	91 Å²	91	135.5 Å²	135.5	64%	0.636	74%	0.744	S	S	*	*			cis	-159.9	146.5	12.5	-95.2	0	0	0	0	110.1
231	Q	33.1	Very low	30.9	Very low	178 Å²	178	136.1 Å²	136.1	83%	0.832	75%	0.751	S	S	*	*				58.9	146.6	77.1	-81	-173	18.6	0	0	114.6
232	S	28.6	Very low	31.4	Very low	93 Å²	93	133 Å²	133	65%	0.65	75%	0.748	S	S	*	*			cis	-175.2	162.2	-2.7	51	0	0	0	0	108.5
233	L	30.3	Very low	32.2	Very low	148 Å²	148	131.1 Å²	131.1	78%	0.775	75%	0.746	S	S	*	*			cis	-156.4	-176.4	2	-149	73.2	0	0	0	108.8	I235	L233-I235 HydrophobicContact CD2-CD1 4.37Å; L233-I235 HydrophobicContact CD2-CG1 4.14Å
234	D	31.1	Very low	32.6	Very low	145 Å²	145	134.4 Å²	134.4	78%	0.775	76%	0.757	S	S	*	*			trans	-122.5	148.4	160.8	-170.8	12.7	0	0	0	110.4
235	I	37.6	Very low	33.3	Very low	130 Å²	130	131.5 Å²	131.5	67%	0.667	76%	0.756	S	S	*	*			trans	-150.2	109.4	-178.2	-56.7	-177.8	0	0	0	111.3	L233 V237	L233-I235 HydrophobicContact CD2-CD1 4.37Å; L233-I235 HydrophobicContact CD2-CG1 4.14Å; I235-V237 HydrophobicContact CG2-CG2 4.32Å
236	E	34.6	Very low	34	Very low	180 Å²	180	132.3 Å²	132.3	84%	0.841	76%	0.761	S	S	*	*			trans	-76.8	148.8	162.6	-65.7	-168.6	136.7	0	0	112.3
237	V	39.3	Very low	34.2	Very low	134 Å²	134	133.5 Å²	133.5	81%	0.812	77%	0.767	S	S	*	*			trans	-136.2	132.6	160.8	-179.1	0	0	0	0	110.7	I235	I235-V237 HydrophobicContact CG2-CG2 4.32Å
238	T	31.8	Very low	35.4	Very low	119 Å²	119	131.3 Å²	131.3	73%	0.73	77%	0.769	S	S	*	*			trans	-80.5	151.3	-176.5	53.5	0	0	0	0	113.7
239	S	28.9	Very low	36	Very low	109 Å²	109	132.8 Å²	132.8	76%	0.762	78%	0.78	S	S	*	*				171.1	107.8	123.9	-78.8	0	0	0	0	116.2
240	S	31.5	Very low	36.9	Very low	104 Å²	104	128.7 Å²	128.7	73%	0.727	78%	0.776	S	S	*	*				33.9	117.7	120.2	-58.1	0	0	0	0	123.7
241	L	32.7	Very low	37.3	Very low	157 Å²	157	129.9 Å²	129.9	82%	0.822	79%	0.785	S	S	*	*				84.8	121.7	123.8	-64.6	172.8	0	0	0	123.5
242	S	33.1	Very low	37.5	Very low	107 Å²	107	126.9 Å²	126.9	75%	0.748	78%	0.783	S	S	*	*			trans	70.4	131.8	139.1	67.6	0	0	0	0	121.4
243	V	40.3	Very low	38.4	Very low	130 Å²	130	128.6 Å²	128.6	79%	0.788	79%	0.79	S	S	*	*				-163.5	137.6	102.2	152.9	0	0	0	0	108.1
244	D	35.3	Very low	39.6	Very low	156 Å²	156	128.2 Å²	128.2	83%	0.834	79%	0.794	S	S	*	*			trans	-79.8	146.9	175.2	-55.8	-63	0	0	0	112
245	S	38.9	Very low	40.1	Very low	111 Å²	111	126.5 Å²	126.5	78%	0.776	79%	0.793	S	S	*	*			trans	-161.1	88	162.7	-79.3	0	0	0	0	111.9	T247	S245-T247 PolarHBondContact O-N 3.16Å
246	D	48.1	Very low	40.6	Very low	170 Å²	170	124.1 Å²	124.1	91%	0.909	80%	0.801	S	S	*	*			trans	-65.9	127.4	161.2	-84.7	-39	0	0	0	109.9
247	T	50.8	Low	40.8	Very low	126 Å²	126	125.5 Å²	125.5	77%	0.773	80%	0.8	S	S	*	*			trans	-149.2	97.1	162.2	-62.1	0	0	0	0	109.6	S245 S249	S245-T247 PolarHBondContact O-N 3.16Å; T247-S249 PolarHBondContact O-N 2.85Å
248	A	48.8	Very low	40.9	Very low	101 Å²	101	128 Å²	128	84%	0.835	80%	0.803	S	S	*	*			trans	-73.6	119.4	174.7	0	0	0	0	0	110.9
249	S	39.9	Very low	41.3	Very low	119 Å²	119	127.2 Å²	127.2	83%	0.832	80%	0.802	S	S	*	*			trans	-155.2	144.7	159.5	-82.8	0	0	0	0	109.9	T247	T247-S249 PolarHBondContact O-N 2.85Å
250	A	46.5	Very low	41.9	Very low	94 Å²	94	127 Å²	127	78%	0.777	81%	0.806	S	S	*	*			trans	-99.8	-178.7	-167.2	0	0	0	0	0	113.4
251	S	42.1	Very low	42.4	Very low	116 Å²	116	126.7 Å²	126.7	81%	0.811	80%	0.8	S	S	*	*			trans	90.5	167.4	168.8	83.1	0	0	0	0	117.6
252	S	37.3	Very low	43	Very low	115 Å²	115	122.4 Å²	122.4	80%	0.804	78%	0.782	S	S	*	*			trans	77.5	85.5	-176.3	-54.1	0	0	0	0	116.3
253	V	47.6	Very low	43.6	Very low	130 Å²	130	120.9 Å²	120.9	79%	0.788	78%	0.776	S	S	*	*			trans	-56.3	172.5	147.9	-77.3	0	0	0	0	111.8
254	T	55.4	Low	44.2	Very low	140 Å²	140	117 Å²	117	86%	0.859	76%	0.755	S	S	*	*			trans	72.6	80.9	176.4	78	0	0	0	0	116.5
255	S	42.3	Very low	45	Very low	109 Å²	109	114.9 Å²	114.9	76%	0.762	74%	0.74	S	S	*	*			trans	-146.9	114.3	136	-169	0	0	0	0	108.7	Y257	S255-Y257 PolarHBondContact O-N 2.95Å
256	G	47.3	Very low	46.2	Very low	80 Å²	80	116.2 Å²	116.2	83%	0.825	73%	0.733	S	S	*	*			trans	-82.9	109.3	172.4	0	0	0	0	0	109
257	Y	38.7	Very low	47.4	Very low	208 Å²	208	108.8 Å²	108.8	82%	0.816	70%	0.697	S	S	*	*			trans	-121.8	93.2	167.9	-135.2	-98.3	0	0	0	108.2	S255 S259	S255-Y257 PolarHBondContact O-N 2.95Å; Y257-S259 PolarHBondContact O-N 3.09Å; Y257-S259 VanDerWaalsContact O-N 3.07Å
258	E	42.3	Very low	48.8	Very low	188 Å²	188	103.4 Å²	103.4	88%	0.879	66%	0.663	S	S	*	*			trans	-61.6	111.2	174.1	-70.6	176.5	116.3	0	0	108.5	A260	E258-A260 PolarHBondContact O-N 3.24Å
259	S	38.8	Very low	50.3	Low	102 Å²	102	102.6 Å²	102.6	71%	0.713	64%	0.644	S	S	*	*			trans	-73.1	99.1	170	-65.3	0	0	0	0	107.4	Y257 T261	Y257-S259 PolarHBondContact O-N 3.09Å; Y257-S259 VanDerWaalsContact O-N 3.07Å; S259-T261 PolarHBondContact O-N 3Å; S259-T261 PolarHBondContact O-OG1 3Å
260	A	42.8	Very low	52.3	Low	103 Å²	103	99.8 Å²	99.8	85%	0.851	62%	0.624	S	S	*	*			trans	-73.3	56.9	-178.9	0	0	0	0	0	112.5	E258	E258-A260 PolarHBondContact O-N 3.24Å
261	T	41.2	Very low	54	Low	98 Å²	98	95.4 Å²	95.4	60%	0.601	59%	0.588	S	S	*	*			trans	-66.1	142.1	155.5	45.5	0	0	0	0	109	S259 A263	S259-T261 PolarHBondContact O-N 3Å; S259-T261 PolarHBondContact O-OG1 3Å; T261-A263 VanDerWaalsContact C-N 3.31Å; T261-A263 PolarHBondContact O-N 3.31Å
262	P	44.9	Very low	55.9	Low	68 Å²	68	90 Å²	90	44%	0.442	55%	0.55	S	S	.	.			trans	-73	79.5	-175.8	30.6	-36.2	0	0	0	112	S264 E265	P262-S264 PolarHBondContact O-N 3.09Å; P262-E265 HydrophobicContact CB-CG 4.27Å; P262-E265 WeakPolarHBondContact CG-OE2 3.15Å; P262-E265 PolarHBondContact O-N 3.35Å
263	A	47	Very low	58.3	Low	74 Å²	74	91.8 Å²	91.8	61%	0.612	54%	0.543	S	S	*	.	H	α-helix	trans	-59.2	-16.8	179.7	0	0	0	0	0	113.8	T261 G267	T261-A263 VanDerWaalsContact C-N 3.31Å; T261-A263 PolarHBondContact O-N 3.31Å; A263-G267 PolarHBondContact O-N 3.38Å
264	S	51.6	Low	60.2	Low	50 Å²	50	89.6 Å²	89.6	35%	0.35	53%	0.53	S	S	.	.	H	α-helix	trans	-64.8	-35.8	171.5	48.6	0	0	0	0	113.8	P262	P262-S264 PolarHBondContact O-N 3.09Å
265	E	53.3	Low	61.8	Low	111 Å²	111	84.3 Å²	84.3	52%	0.519	50%	0.495	S	S	.	.	H	α-helix	trans	-75.2	-47	-177.3	-66.8	176.5	155.9	0	0	110.4	P262 G267 W268 D269	P262-E265 HydrophobicContact CB-CG 4.27Å; P262-E265 WeakPolarHBondContact CG-OE2 3.15Å; P262-E265 PolarHBondContact O-N 3.35Å; E265-G267 PolarHBondContact O-N 2.7Å; E265-W268 PolarHBondContact O-N 2.96Å; E265-W268 VanDerWaalsContact O-N 3.09Å; E265-D269 PolarHBondContact O-N 3.14Å
266	Q	63.2	Low	64.1	Low	138 Å²	138	81.5 Å²	81.5	65%	0.645	47%	0.471	S	S	*	.	H	α-helix	trans	-63.4	-27.2	178.1	-71.7	-178.6	-44.5	0	0	113.7	S270	Q266-S270 VanDerWaalsContact O-CB 3.3Å; Q266-S270 WeakPolarHBondContact O-CB 3.05Å; Q266-S270 PolarHBondContact O-N 3.33Å; Q266-S270 VanDerWaalsContact O-N 3.09Å
267	G	74.1	Confident	66.2	Low	14 Å²	14	79.6 Å²	79.6	14%	0.144	45%	0.452	C	S	.	.	H	α-helix	trans	-64.3	-45.2	171.8	0	0	0	0	0	112.5	A263 E265 L271	A263-G267 PolarHBondContact O-N 3.38Å; E265-G267 PolarHBondContact O-N 2.7Å; G267-L271 WeakPolarHBondContact O-CB 3.38Å; G267-L271 PolarHBondContact O-N 3.05Å
268	W	79.6	Confident	68.8	Low	13 Å²	13	72 Å²	72	5%	0.049	43%	0.427	C	S	.	.	H	α-helix	trans	-68	-47.3	175.4	-81	118	0	0	0	112.3	E265 S270 L271 V272 L350 V435 M447 L615	E265-W268 PolarHBondContact O-N 2.96Å; E265-W268 VanDerWaalsContact O-N 3.09Å; W268-S270 VanDerWaalsContact C-N 3.28Å; W268-S270 PolarHBondContact O-N 3.32Å; W268-L271 HydrophobicContact CE3-CD2 4.27Å; W268-L271 HydrophobicContact CZ3-CD2 4.35Å; W268-L271 PolarHBondContact O-N 2.88Å; W268-L271 VanDerWaalsContact O-N 3.09Å; W268-V272 WeakPolarHBondContact O-CG2 3.34Å; W268-V272 PolarHBondContact O-N 2.94Å; W268-L350 HydrophobicContact CH2-CD2 4.04Å; W268-L350 HydrophobicContact CZ3-CD2 4.06Å; W268-V435 HydrophobicContact CD2-CB 4.47Å; W268-V435 HydrophobicContact CD2-CG1 3.63Å; W268-V435 HydrophobicContact CD2-CG2 3.96Å; W268-V435 HydrophobicContact CE3-CG1 3.86Å; W268-V435 HydrophobicContact CE3-CG2 4.11Å; W268-V435 HydrophobicContact CG-CG1 4.4Å; W268-V435 HydrophobicContact CG-CG2 4.17Å; W268-V435 HydrophobicContact CH2-CG1 3.68Å; W268-V435 HydrophobicContact CZ2-CG1 3.36Å; W268-V435 HydrophobicContact CZ3-CG1 3.9Å; W268-M447 HydrophobicContact CH2-SD 3.51Å; W268-M447 VanDerWaalsContact CH2-SD 3.51Å; W268-M447 HydrophobicContact CZ2-CE 4.35Å; W268-M447 HydrophobicContact CZ2-SD 3.63Å; W268-L615 HydrophobicContact CH2-CG 4.43Å
269	D	79.8	Confident	71.3	Confident	85 Å²	85	63.4 Å²	63.4	46%	0.455	39%	0.387	S	S	.	.	H	α-helix	trans	-58.4	-40.3	179.8	-86.8	-32.7	0	0	0	112.2	E265 K273 R617	E265-D269 PolarHBondContact O-N 3.14Å; D269-K273 WeakPolarHBondContact O-CB 3.06Å; D269-K273 PolarHBondContact O-N 3.01Å; D269-K273 VanDerWaalsContact O-N 3.1Å; D269-R617 IonicContact OD1-CZ 2.83Å; D269-R617 IonicContact OD1-NH2 3.8Å; D269-R617 PolarHBondContact OD1-NH2 2.86Å
270	S	82.3	Confident	73.9	Confident	59 Å²	59	64.4 Å²	64.4	41%	0.413	38%	0.38	S	S	.	.	H	α-helix	trans	-64	-43.4	175.5	-168.2	0	0	0	0	111.9	Q266 W268	Q266-S270 VanDerWaalsContact O-CB 3.3Å; Q266-S270 WeakPolarHBondContact O-CB 3.05Å; Q266-S270 PolarHBondContact O-N 3.33Å; Q266-S270 VanDerWaalsContact O-N 3.09Å; W268-S270 VanDerWaalsContact C-N 3.28Å; W268-S270 PolarHBondContact O-N 3.32Å
271	L	82.7	Confident	76.4	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-67.6	-49.5	-178.2	-176.3	57.7	0	0	0	112.1	G267 W268 K273 T274 Y275 F346 L431 E432 V435	G267-L271 WeakPolarHBondContact O-CB 3.38Å; G267-L271 PolarHBondContact O-N 3.05Å; W268-L271 HydrophobicContact CE3-CD2 4.27Å; W268-L271 HydrophobicContact CZ3-CD2 4.35Å; W268-L271 PolarHBondContact O-N 2.88Å; W268-L271 VanDerWaalsContact O-N 3.09Å; L271-K273 VanDerWaalsContact C-N 3.28Å; L271-K273 PolarHBondContact O-N 3.29Å; L271-T274 PolarHBondContact O-N 3.16Å; L271-T274 PolarHBondContact O-OG1 2.82Å; L271-Y275 WeakPolarHBondContact O-CD2 3.31Å; L271-F346 HydrophobicContact CD1-CE2 3.77Å; L271-F346 HydrophobicContact CD1-CZ 4.28Å; L271-F346 HydrophobicContact CD2-CE2 3.79Å; L271-F346 HydrophobicContact CD2-CZ 3.83Å; L271-F346 HydrophobicContact CG-CE2 3.79Å; L271-F346 HydrophobicContact CG-CZ 3.81Å; L271-L431 HydrophobicContact CD1-CB 4.13Å; L271-E432 HydrophobicContact CD1-CG 4.33Å; L271-E432 HydrophobicContact CD2-CG 4.32Å; L271-V435 HydrophobicContact CD2-CB 4.44Å; L271-V435 HydrophobicContact CD2-CG2 3.9Å
272	V	82.5	Confident	79	Confident	1 Å²	1	60.1 Å²	60.1	1%	0.006	34%	0.34	C	S	.	.	H	α-helix	trans	-63.7	-36	177.6	-176.7	0	0	0	0	111.3	W268 T274 Y275 D276 G614 R617	W268-V272 WeakPolarHBondContact O-CG2 3.34Å; W268-V272 PolarHBondContact O-N 2.94Å; V272-T274 PolarHBondContact O-N 3.37Å; V272-T274 VanDerWaalsContact O-N 3.13Å; V272-Y275 CarbonylContact O-C 3.52Å; V272-Y275 WeakPolarHBondContact O-CA 3.47Å; V272-Y275 PolarHBondContact O-N 2.59Å; V272-D276 PolarHBondContact O-N 2.77Å; V272-G614 WeakPolarHBondContact CG2-O 3.35Å; V272-R617 HydrophobicContact CG1-CB 4.15Å; V272-R617 HydrophobicContact CG1-CG 4.4Å
273	K	86.2	Confident	81.4	Confident	153 Å²	153	57.7 Å²	57.7	67%	0.665	32%	0.323	S	S	*	.	H	α-helix	trans	-63.5	-17.7	178.6	-173.5	170.5	-177.4	174.6	0	114.9	D269 L271 Y275 D276	D269-K273 WeakPolarHBondContact O-CB 3.06Å; D269-K273 PolarHBondContact O-N 3.01Å; D269-K273 VanDerWaalsContact O-N 3.1Å; L271-K273 VanDerWaalsContact C-N 3.28Å; L271-K273 PolarHBondContact O-N 3.29Å; K273-Y275 VanDerWaalsContact C-N 3.26Å; K273-D276 VanDerWaalsContact CA-OD2 3.31Å; K273-D276 WeakPolarHBondContact CA-OD2 3.12Å
274	T	87.3	Confident	83.8	Confident	84 Å²	84	58.5 Å²	58.5	52%	0.515	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-16.8	168.8	66.1	0	0	0	0	113.5	L271 V272	L271-T274 PolarHBondContact O-N 3.16Å; L271-T274 PolarHBondContact O-OG1 2.82Å; V272-T274 PolarHBondContact O-N 3.37Å; V272-T274 VanDerWaalsContact O-N 3.13Å
275	Y	89.4	Confident	85.9	Confident	29 Å²	29	58.2 Å²	58.2	11%	0.114	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-19.4	180	-59.5	-73	0	0	0	114	L271 V272 K273 G277 V278 L279 V343 F346	L271-Y275 WeakPolarHBondContact O-CD2 3.31Å; V272-Y275 CarbonylContact O-C 3.52Å; V272-Y275 WeakPolarHBondContact O-CA 3.47Å; V272-Y275 PolarHBondContact O-N 2.59Å; K273-Y275 VanDerWaalsContact C-N 3.26Å; Y275-G277 PolarHBondContact O-N 2.9Å; Y275-G277 VanDerWaalsContact O-N 3.07Å; Y275-V278 PolarHBondContact O-N 3.01Å; Y275-L279 PolarHBondContact O-N 2.9Å; Y275-V343 HydrophobicContact CD1-CG2 4.22Å; Y275-F346 AromaticContact CD2-CD1 3.96Å; Y275-F346 HydrophobicContact CD2-CD1 3.96Å; Y275-F346 HydrophobicContact CD2-CE1 4.28Å; Y275-F346 HydrophobicContact CD2-CG 4.09Å; Y275-F346 HydrophobicContact CE1-CB 3.9Å; Y275-F346 HydrophobicContact CE1-CG 4.37Å; Y275-F346 HydrophobicContact CE2-CB 3.9Å; Y275-F346 AromaticContact CE2-CD1 3.81Å; Y275-F346 HydrophobicContact CE2-CD1 3.81Å; Y275-F346 AromaticContact CE2-CD2 3.63Å; Y275-F346 HydrophobicContact CE2-CD2 3.63Å; Y275-F346 HydrophobicContact CE2-CE1 4.26Å; Y275-F346 HydrophobicContact CE2-CE2 4.11Å; Y275-F346 AromaticContact CE2-CG 3.46Å; Y275-F346 HydrophobicContact CE2-CG 3.46Å; Y275-F346 VanDerWaalsContact CE2-CG 3.46Å; Y275-F346 HydrophobicContact CE2-CZ 4.39Å; Y275-F346 AromaticContact CZ-CD2 3.94Å; Y275-F346 AromaticContact CZ-CG 3.66Å
276	D	90.3	Very high	87.9	Confident	50 Å²	50	53 Å²	53	27%	0.267	28%	0.284	S	S	.	.	H	α-helix	trans	-42	-46.2	179.2	-83.3	-21.1	0	0	0	113.4	V272 K273 V278 L279 Q280 R617	V272-D276 PolarHBondContact O-N 2.77Å; K273-D276 VanDerWaalsContact CA-OD2 3.31Å; K273-D276 WeakPolarHBondContact CA-OD2 3.12Å; D276-V278 PolarHBondContact O-N 3.33Å; D276-L279 PolarHBondContact O-N 3.48Å; D276-Q280 VanDerWaalsContact O-CB 3.3Å; D276-Q280 WeakPolarHBondContact O-CB 3.13Å; D276-Q280 PolarHBondContact O-N 3.45Å; D276-R617 IonicContact OD1-CZ 3.98Å; D276-R617 IonicContact OD1-NH1 2.63Å; D276-R617 PolarHBondContact OD1-NH1 2.84Å; D276-R617 IonicContact OD2-NH1 2.68Å; D276-R617 PolarHBondContact OD2-NH1 3.4Å
277	G	92.1	Very high	89.5	Confident	40 Å²	40	50.6 Å²	50.6	41%	0.412	27%	0.269	S	S	.	.	H	α-helix	trans	-61.9	-42.8	179	0	0	0	0	0	113.5	Y275 Q280 D281	Y275-G277 PolarHBondContact O-N 2.9Å; Y275-G277 VanDerWaalsContact O-N 3.07Å; G277-Q280 PolarHBondContact O-N 3.22Å; G277-D281 WeakPolarHBondContact O-CB 2.95Å; G277-D281 VanDerWaalsContact O-CG 3.25Å; G277-D281 PolarHBondContact O-N 2.76Å
278	V	93.8	Very high	90.6	Very high	49 Å²	49	52 Å²	52	30%	0.297	28%	0.275	S	S	.	.	H	α-helix	trans	-71	-35.8	179	-178.2	0	0	0	0	111.4	Y275 D276 C282 Q340 V343	Y275-V278 PolarHBondContact O-N 3.01Å; D276-V278 PolarHBondContact O-N 3.33Å; V278-C282 WeakPolarHBondContact O-CB 3.03Å; V278-C282 PolarHBondContact O-N 3.46Å; V278-C282 VanDerWaalsContact O-N 3.12Å; V278-Q340 HydrophobicContact CG1-CB 3.81Å; V278-Q340 HydrophobicContact CG1-CG 4.03Å; V278-V343 HydrophobicContact CG1-CG2 4.35Å
279	L	93.6	Very high	91.4	Very high	7 Å²	7	53.2 Å²	53.2	4%	0.037	28%	0.28	C	S	.	.	H	α-helix	trans	-63.4	-46.6	172.7	-61.7	171.8	0	0	0	110.4	Y275 D276 C282 L283 P337 V343 I618	Y275-L279 PolarHBondContact O-N 2.9Å; D276-L279 PolarHBondContact O-N 3.48Å; L279-C282 PolarHBondContact O-N 2.91Å; L279-L283 WeakPolarHBondContact O-CB 3.43Å; L279-L283 WeakPolarHBondContact O-CG 3.39Å; L279-L283 PolarHBondContact O-N 2.89Å; L279-P337 HydrophobicContact CB-CB 4.48Å; L279-P337 HydrophobicContact CD2-CB 3.54Å; L279-V343 HydrophobicContact CD2-CG1 4.18Å; L279-V343 HydrophobicContact CD2-CG2 3.97Å; L279-I618 HydrophobicContact CD1-CG1 4.12Å
280	Q	94.8	Very high	92.1	Very high	124 Å²	124	49.9 Å²	49.9	58%	0.579	26%	0.263	S	S	*	.	H	α-helix	trans	-66.3	-42.4	179.8	-174.5	171.8	2.1	0	0	112.5	D276 G277 L283 Q284	D276-Q280 VanDerWaalsContact O-CB 3.3Å; D276-Q280 WeakPolarHBondContact O-CB 3.13Å; D276-Q280 PolarHBondContact O-N 3.45Å; G277-Q280 PolarHBondContact O-N 3.22Å; Q280-L283 PolarHBondContact O-N 2.76Å; Q280-Q284 VanDerWaalsContact O-CB 3.22Å; Q280-Q284 WeakPolarHBondContact O-CB 3.27Å; Q280-Q284 PolarHBondContact O-N 3.38Å
281	D	95.3	Very high	92.7	Very high	108 Å²	108	53.7 Å²	53.7	58%	0.578	27%	0.272	S	S	*	.	H	α-helix	trans	-61.8	-43.6	175.7	-74.4	-18.7	0	0	0	111.3	G277 Q284 N285	G277-D281 WeakPolarHBondContact O-CB 2.95Å; G277-D281 VanDerWaalsContact O-CG 3.25Å; G277-D281 PolarHBondContact O-N 2.76Å; D281-Q284 PolarHBondContact O-N 3.21Å; D281-N285 PolarHBondContact O-N 2.77Å
282	C	95.1	Very high	93.4	Very high	3 Å²	3	54 Å²	54	2%	0.02	27%	0.273	C	S	.	.	H	α-helix	trans	-63.9	-45.3	176.7	-171.7	0	0	0	0	112	V278 L279 Q284 N285 N286 G335 P337 Q340	V278-C282 WeakPolarHBondContact O-CB 3.03Å; V278-C282 PolarHBondContact O-N 3.46Å; V278-C282 VanDerWaalsContact O-N 3.12Å; L279-C282 PolarHBondContact O-N 2.91Å; C282-Q284 VanDerWaalsContact C-N 3.32Å; C282-Q284 PolarHBondContact O-N 2.79Å; C282-N285 PolarHBondContact O-N 2.76Å; C282-N286 VanDerWaalsContact O-CG 3.31Å; C282-N286 PolarHBondContact O-N 3.27Å; C282-N286 VanDerWaalsContact O-N 3.11Å; C282-N286 PolarHBondContact O-ND2 3.37Å; C282-G335 PolarHBondContact SG-O 2.72Å; C282-G335 VanDerWaalsContact SG-O 3.33Å; C282-P337 HydrophobicContact CB-CB 4.4Å; C282-P337 HydrophobicContact CB-CG 4.19Å; C282-Q340 HydrophobicContact CB-CG 3.9Å; C282-Q340 PolarHBondContact SG-NE2 2.76Å
283	L	95.6	Very high	93.9	Very high	16 Å²	16	54.7 Å²	54.7	8%	0.084	28%	0.277	C	S	.	.	H	α-helix	trans	-61.1	-41.9	173.5	-78.7	174.3	0	0	0	111.7	L279 Q280 N285 N286 R287 P337 A621 E624 A625	L279-L283 WeakPolarHBondContact O-CB 3.43Å; L279-L283 WeakPolarHBondContact O-CG 3.39Å; L279-L283 PolarHBondContact O-N 2.89Å; Q280-L283 PolarHBondContact O-N 2.76Å; L283-N285 PolarHBondContact O-N 2.83Å; L283-N286 PolarHBondContact O-N 3.44Å; L283-R287 WeakPolarHBondContact O-CB 3.5Å; L283-R287 VanDerWaalsContact O-CG 3.26Å; L283-R287 WeakPolarHBondContact O-CG 3.4Å; L283-R287 PolarHBondContact O-N 3.17Å; L283-P337 HydrophobicContact CD2-CG 4.11Å; L283-P337 HydrophobicContact CG-CG 4Å; L283-A621 HydrophobicContact CD1-CB 3.94Å; L283-A621 WeakPolarHBondContact CD2-O 3.48Å; L283-A621 HydrophobicContact CG-CB 4.42Å; L283-E624 HydrophobicContact CD2-CB 3.95Å; L283-E624 HydrophobicContact CD2-CG 4.33Å; L283-A625 HydrophobicContact CD2-CB 4.34Å
284	Q	96.6	Very high	94.3	Very high	91 Å²	91	49 Å²	49	43%	0.425	26%	0.256	S	S	.	.	H	α-helix	trans	-67.1	-36.4	-178.6	-170.3	57.8	27.5	0	0	111.9	Q280 D281 C282 T288	Q280-Q284 VanDerWaalsContact O-CB 3.22Å; Q280-Q284 WeakPolarHBondContact O-CB 3.27Å; Q280-Q284 PolarHBondContact O-N 3.38Å; D281-Q284 PolarHBondContact O-N 3.21Å; C282-Q284 VanDerWaalsContact C-N 3.32Å; C282-Q284 PolarHBondContact O-N 2.79Å; Q284-T288 VanDerWaalsContact O-CB 3.26Å; Q284-T288 WeakPolarHBondContact O-CB 3.49Å; Q284-T288 PolarHBondContact O-N 3.48Å; Q284-T288 PolarHBondContact O-OG1 2.74Å
285	N	96.3	Very high	94.7	Very high	45 Å²	45	48.6 Å²	48.6	24%	0.241	25%	0.249	C	C	.	.	H	α-helix	trans	-60.9	-49.9	169.3	-71.6	-15.1	0	0	0	111.5	D281 C282 L283 R287 T288 Y289 L332 K333	D281-N285 PolarHBondContact O-N 2.77Å; C282-N285 PolarHBondContact O-N 2.76Å; L283-N285 PolarHBondContact O-N 2.83Å; N285-R287 PolarHBondContact O-N 3.47Å; N285-T288 PolarHBondContact O-N 3.02Å; N285-Y289 WeakPolarHBondContact O-CB 3.46Å; N285-Y289 PolarHBondContact O-N 2.7Å; N285-L332 HydrophobicContact CB-CD2 4.44Å; N285-K333 VanDerWaalsContact CB-O 3.23Å; N285-K333 WeakPolarHBondContact CB-O 3.3Å; N285-K333 PolarHBondContact ND2-O 2.99Å
286	N	96.1	Very high	95.1	Very high	2 Å²	2	47.6 Å²	47.6	1%	0.011	25%	0.246	C	C	.	.	H	α-helix	trans	-58.8	-46.3	179.2	-67.4	-24.6	0	0	0	111.6	C282 L283 T288 Y289 T290 L334 G335 L628 F629	C282-N286 VanDerWaalsContact O-CG 3.31Å; C282-N286 PolarHBondContact O-N 3.27Å; C282-N286 VanDerWaalsContact O-N 3.11Å; C282-N286 PolarHBondContact O-ND2 3.37Å; L283-N286 PolarHBondContact O-N 3.44Å; N286-T288 PolarHBondContact O-N 2.76Å; N286-Y289 PolarHBondContact O-N 2.73Å; N286-T290 PolarHBondContact O-N 2.97Å; N286-T290 VanDerWaalsContact O-N 3.1Å; N286-T290 PolarHBondContact O-OG1 3.13Å; N286-L334 WeakPolarHBondContact OD1-CA 3.45Å; N286-G335 PolarHBondContact ND2-O 3.4Å; N286-G335 PolarHBondContact OD1-N 2.76Å; N286-L628 HydrophobicContact CB-CD1 3.86Å; N286-F629 HydrophobicContact CB-CE1 4.36Å
287	R	96.8	Very high	95.2	Very high	87 Å²	87	46.7 Å²	46.7	33%	0.328	24%	0.24	S	C	.	.	H	α-helix	trans	-59.9	-43.7	175.4	-70	169.4	-174.9	157.4	1.4	112.1	L283 N285 K291 E624 L628	L283-R287 WeakPolarHBondContact O-CB 3.5Å; L283-R287 VanDerWaalsContact O-CG 3.26Å; L283-R287 WeakPolarHBondContact O-CG 3.4Å; L283-R287 PolarHBondContact O-N 3.17Å; N285-R287 PolarHBondContact O-N 3.47Å; R287-K291 PolarHBondContact O-N 3.39Å; R287-K291 VanDerWaalsContact O-N 3.1Å; R287-E624 IonicContact CZ-OE1 3.14Å; R287-E624 VanDerWaalsContact CZ-OE1 3.31Å; R287-E624 IonicContact CZ-OE2 3.43Å; R287-E624 IonicContact NE-OE1 2.74Å; R287-E624 PolarHBondContact NE-OE1 3.36Å; R287-E624 IonicContact NE-OE2 3.91Å; R287-E624 VanDerWaalsContact NH2-CD 3.29Å; R287-E624 IonicContact NH2-OE1 2.67Å; R287-E624 PolarHBondContact NH2-OE1 3.32Å; R287-E624 IonicContact NH2-OE2 3.04Å; R287-E624 PolarHBondContact NH2-OE2 3.01Å; R287-L628 HydrophobicContact CG-CD1 3.65Å; R287-L628 HydrophobicContact CG-CD2 4.18Å
288	T	96.7	Very high	95.4	Very high	44 Å²	44	50.9 Å²	50.9	27%	0.27	25%	0.247	S	C	.	.	H	α-helix	trans	-67.3	-40.2	-179.4	-56.3	0	0	0	0	110.8	Q284 N285 N286 K291 I292 L332	Q284-T288 VanDerWaalsContact O-CB 3.26Å; Q284-T288 WeakPolarHBondContact O-CB 3.49Å; Q284-T288 PolarHBondContact O-N 3.48Å; Q284-T288 PolarHBondContact O-OG1 2.74Å; N285-T288 PolarHBondContact O-N 3.02Å; N286-T288 PolarHBondContact O-N 2.76Å; T288-K291 WeakPolarHBondContact O-CB 3.46Å; T288-K291 PolarHBondContact O-N 2.92Å; T288-I292 HydrophobicContact CG2-CD1 4Å; T288-I292 HydrophobicContact CG2-CG1 4.47Å; T288-I292 WeakPolarHBondContact O-CG1 3.44Å; T288-I292 PolarHBondContact O-N 3.31Å; T288-L332 HydrophobicContact CG2-CD1 4.02Å; T288-L332 HydrophobicContact CG2-CD2 4.5Å
289	Y	95.7	Very high	95.6	Very high	38 Å²	38	49.7 Å²	49.7	15%	0.149	24%	0.239	C	C	.	.	H	α-helix	trans	-60.2	-50.6	174.7	-177.7	-90.2	0	0	0	112.3	N285 N286 K291 I292 E293 R329 L334 R636	N285-Y289 WeakPolarHBondContact O-CB 3.46Å; N285-Y289 PolarHBondContact O-N 2.7Å; N286-Y289 PolarHBondContact O-N 2.73Å; Y289-K291 PolarHBondContact O-N 3.09Å; Y289-I292 PolarHBondContact O-N 3.5Å; Y289-I292 VanDerWaalsContact O-N 3.13Å; Y289-E293 HydrophobicContact CD1-CG 4.09Å; Y289-E293 HydrophobicContact CE1-CG 3.74Å; Y289-E293 WeakPolarHBondContact O-CG 3.36Å; Y289-E293 PolarHBondContact O-N 3.34Å; Y289-R329 HydrophobicContact CD2-CG 3.57Å; Y289-R329 HydrophobicContact CE2-CG 3.34Å; Y289-L334 HydrophobicContact CD1-CD1 4.11Å; Y289-L334 HydrophobicContact CD2-CD1 3.41Å; Y289-L334 VanDerWaalsContact CD2-CD1 3.41Å; Y289-L334 HydrophobicContact CD2-CD2 3.83Å; Y289-L334 HydrophobicContact CD2-CG 4.2Å; Y289-L334 HydrophobicContact CE1-CD1 4.15Å; Y289-L334 HydrophobicContact CE2-CD1 3.43Å; Y289-L334 VanDerWaalsContact CE2-CD1 3.43Å; Y289-L334 HydrophobicContact CG-CD1 3.76Å; Y289-L334 HydrophobicContact CG-CD2 3.76Å; Y289-L334 HydrophobicContact CG-CG 4.42Å; Y289-R636 PolarHBondContact OH-NH2 3.07Å; Y289-R636 VanDerWaalsContact OH-NH2 3.13Å
290	T	94.6	Very high	95.7	Very high	14 Å²	14	53.8 Å²	53.8	9%	0.086	26%	0.258	C	S	.	.	H	α-helix	trans	-61.3	-32.4	177.2	-48.2	0	0	0	0	112	N286 S294 L628 R631 L635	N286-T290 PolarHBondContact O-N 2.97Å; N286-T290 VanDerWaalsContact O-N 3.1Å; N286-T290 PolarHBondContact O-OG1 3.13Å; T290-S294 PolarHBondContact O-N 2.83Å; T290-L628 PolarHBondContact OG1-O 3.1Å; T290-R631 HydrophobicContact CG2-CB 4.49Å; T290-R631 HydrophobicContact CG2-CG 3.98Å; T290-L635 HydrophobicContact CG2-CD1 4.17Å
291	K	96.3	Very high	95.8	Very high	140 Å²	140	54.1 Å²	54.1	61%	0.609	25%	0.254	S	S	*	.	H	α-helix	trans	-68.4	-46.1	173.1	-175.1	-174.5	175	-170.9	0	111.8	R287 T288 Y289 S294 M295	R287-K291 PolarHBondContact O-N 3.39Å; R287-K291 VanDerWaalsContact O-N 3.1Å; T288-K291 WeakPolarHBondContact O-CB 3.46Å; T288-K291 PolarHBondContact O-N 2.92Å; Y289-K291 PolarHBondContact O-N 3.09Å; K291-S294 PolarHBondContact O-N 3.23Å; K291-M295 HydrophobicContact CG-SD 4.19Å; K291-M295 WeakPolarHBondContact O-CG 3.2Å; K291-M295 PolarHBondContact O-N 2.72Å
292	I	95.9	Very high	95.9	Very high	8 Å²	8	53 Å²	53	4%	0.041	25%	0.247	C	C	.	.	H	α-helix	trans	-61.6	-47.6	178.2	-70.2	168.4	0	0	0	110.5	T288 Y289 S294 M295 M296 L325 E328 R329 L332	T288-I292 HydrophobicContact CG2-CD1 4Å; T288-I292 HydrophobicContact CG2-CG1 4.47Å; T288-I292 WeakPolarHBondContact O-CG1 3.44Å; T288-I292 PolarHBondContact O-N 3.31Å; Y289-I292 PolarHBondContact O-N 3.5Å; Y289-I292 VanDerWaalsContact O-N 3.13Å; I292-S294 VanDerWaalsContact C-N 3.3Å; I292-S294 PolarHBondContact O-N 2.73Å; I292-M295 CarbonylContact O-C 3.52Å; I292-M295 PolarHBondContact O-N 3.11Å; I292-M296 HydrophobicContact CG2-CG 4.04Å; I292-M296 HydrophobicContact CG2-SD 3.72Å; I292-M296 WeakPolarHBondContact O-CG 3.29Å; I292-M296 PolarHBondContact O-N 3.21Å; I292-L325 HydrophobicContact CG1-CD2 4.22Å; I292-L325 HydrophobicContact CG2-CB 4.03Å; I292-L325 HydrophobicContact CG2-CD2 4.05Å; I292-E328 HydrophobicContact CD1-CB 3.97Å; I292-R329 HydrophobicContact CG2-CB 3.92Å; I292-R329 HydrophobicContact CG2-CG 4.44Å; I292-L332 HydrophobicContact CD1-CD1 3.95Å
293	E	93.6	Very high	96	Very high	17 Å²	17	55.3 Å²	55.3	8%	0.079	26%	0.258	C	S	.	.	H	α-helix	trans	-54.7	-44.3	174.9	-74.2	-79.8	133.4	0	0	112	Y289 M295 M296 L297 R329 R636	Y289-E293 HydrophobicContact CD1-CG 4.09Å; Y289-E293 HydrophobicContact CE1-CG 3.74Å; Y289-E293 WeakPolarHBondContact O-CG 3.36Å; Y289-E293 PolarHBondContact O-N 3.34Å; E293-M295 VanDerWaalsContact C-N 3.34Å; E293-M295 PolarHBondContact O-N 3.3Å; E293-M296 PolarHBondContact O-N 3.05Å; E293-L297 WeakPolarHBondContact O-CB 3.49Å; E293-L297 PolarHBondContact O-N 3.48Å; E293-R329 WeakPolarHBondContact OE1-CD 3.21Å; E293-R329 IonicContact OE1-CZ 3.32Å; E293-R329 IonicContact OE1-NE 3.62Å; E293-R329 IonicContact OE1-NH1 3.01Å; E293-R329 PolarHBondContact OE1-NH1 2.94Å; E293-R636 IonicContact OE1-NH2 3.43Å; E293-R636 PolarHBondContact OE1-NH2 3.14Å; E293-R636 IonicContact OE2-CZ 3.46Å; E293-R636 VanDerWaalsContact OE2-CZ 3.26Å; E293-R636 IonicContact OE2-NE 2.71Å; E293-R636 PolarHBondContact OE2-NE 2.69Å; E293-R636 IonicContact OE2-NH2 3.14Å; E293-R636 PolarHBondContact OE2-NH2 3.24Å
294	S	94.6	Very high	96.1	Very high	33 Å²	33	59.6 Å²	59.6	23%	0.231	28%	0.278	C	S	.	.	H	α-helix	trans	-66	-33	176.5	-169.2	0	0	0	0	113.3	T290 K291 I292 K298	T290-S294 PolarHBondContact O-N 2.83Å; K291-S294 PolarHBondContact O-N 3.23Å; I292-S294 VanDerWaalsContact C-N 3.3Å; I292-S294 PolarHBondContact O-N 2.73Å; S294-K298 WeakPolarHBondContact O-CD 3.27Å; S294-K298 VanDerWaalsContact O-CG 3.31Å; S294-K298 WeakPolarHBondContact O-CG 3.47Å; S294-K298 PolarHBondContact O-N 3.46Å
295	M	96.6	Very high	96.1	Very high	75 Å²	75	61.2 Å²	61.2	37%	0.369	28%	0.283	S	S	.	.	H	α-helix	trans	-73.9	-43.9	175	-73.5	175.6	57	0	0	111.8	K291 I292 E293 L297 K298 L299 L325	K291-M295 HydrophobicContact CG-SD 4.19Å; K291-M295 WeakPolarHBondContact O-CG 3.2Å; K291-M295 PolarHBondContact O-N 2.72Å; I292-M295 CarbonylContact O-C 3.52Å; I292-M295 PolarHBondContact O-N 3.11Å; E293-M295 VanDerWaalsContact C-N 3.34Å; E293-M295 PolarHBondContact O-N 3.3Å; M295-L297 VanDerWaalsContact C-N 3.35Å; M295-L297 PolarHBondContact O-N 3.3Å; M295-K298 PolarHBondContact O-N 2.74Å; M295-L299 WeakPolarHBondContact O-CG 3.47Å; M295-L299 PolarHBondContact O-N 3.31Å; M295-L325 HydrophobicContact CB-CD1 4.1Å; M295-L325 HydrophobicContact CE-CD2 4.42Å
296	M	95.9	Very high	96.2	Very high	9 Å²	9	59.3 Å²	59.3	4%	0.044	27%	0.274	C	S	.	.	H	α-helix	trans	-58.4	-46.2	175.3	-70.3	176.1	66.4	0	0	111.2	I292 E293 K298 L299 Q300 L322 L325 C326	I292-M296 HydrophobicContact CG2-CG 4.04Å; I292-M296 HydrophobicContact CG2-SD 3.72Å; I292-M296 WeakPolarHBondContact O-CG 3.29Å; I292-M296 PolarHBondContact O-N 3.21Å; E293-M296 PolarHBondContact O-N 3.05Å; M296-K298 VanDerWaalsContact C-N 3.26Å; M296-K298 PolarHBondContact O-N 2.84Å; M296-L299 PolarHBondContact O-N 2.9Å; M296-L299 VanDerWaalsContact O-N 3.15Å; M296-Q300 WeakPolarHBondContact O-CB 3.4Å; M296-Q300 WeakPolarHBondContact O-CG 3.46Å; M296-Q300 PolarHBondContact O-N 2.97Å; M296-L322 HydrophobicContact CB-CD2 3.85Å; M296-L322 HydrophobicContact CG-CD2 4.08Å; M296-L322 WeakPolarHBondContact O-CD2 3.46Å; M296-L325 HydrophobicContact CG-CB 3.72Å; M296-L325 HydrophobicContact CG-CD1 3.94Å; M296-L325 HydrophobicContact CG-CG 4.47Å; M296-L325 HydrophobicContact SD-CB 4.19Å; M296-C326 WeakPolarHBondContact CE-SG 3.27Å
297	L	94.3	Very high	96.3	Very high	30 Å²	30	62.6 Å²	62.6	16%	0.157	29%	0.291	C	S	.	.	H	α-helix	trans	-62.9	-32.4	179.7	-166.7	64.4	0	0	0	113	E293 M295 R301	E293-L297 WeakPolarHBondContact O-CB 3.49Å; E293-L297 PolarHBondContact O-N 3.48Å; M295-L297 VanDerWaalsContact C-N 3.35Å; M295-L297 PolarHBondContact O-N 3.3Å; L297-R301 WeakPolarHBondContact O-CD 3.32Å; L297-R301 VanDerWaalsContact O-CG 3.32Å; L297-R301 WeakPolarHBondContact O-CG 3.38Å; L297-R301 PolarHBondContact O-N 2.85Å
298	K	95.8	Very high	96.3	Very high	129 Å²	129	64.8 Å²	64.8	56%	0.561	31%	0.308	S	S	*	.	H	α-helix	trans	-72.3	-45.1	172.9	-71.2	169.7	-177	179.3	0	111.5	S294 M295 M296 Q300 R301 L302	S294-K298 WeakPolarHBondContact O-CD 3.27Å; S294-K298 VanDerWaalsContact O-CG 3.31Å; S294-K298 WeakPolarHBondContact O-CG 3.47Å; S294-K298 PolarHBondContact O-N 3.46Å; M295-K298 PolarHBondContact O-N 2.74Å; M296-K298 VanDerWaalsContact C-N 3.26Å; M296-K298 PolarHBondContact O-N 2.84Å; K298-Q300 PolarHBondContact O-N 3.04Å; K298-R301 PolarHBondContact O-N 3.12Å; K298-L302 WeakPolarHBondContact O-CG 3.21Å; K298-L302 PolarHBondContact O-N 2.84Å
299	L	97.4	Very high	96.4	Very high	23 Å²	23	67.4 Å²	67.4	12%	0.12	32%	0.321	C	S	.	.	H	α-helix	trans	-64.7	-36.7	178.9	-75.1	162.8	0	0	0	112.4	M295 M296 R301 L302 Q303 F318 K321 L322 L325	M295-L299 WeakPolarHBondContact O-CG 3.47Å; M295-L299 PolarHBondContact O-N 3.31Å; M296-L299 PolarHBondContact O-N 2.9Å; M296-L299 VanDerWaalsContact O-N 3.15Å; L299-R301 VanDerWaalsContact C-N 3.34Å; L299-R301 PolarHBondContact O-N 3.14Å; L299-L302 PolarHBondContact O-N 3.16Å; L299-Q303 VanDerWaalsContact O-CB 3.3Å; L299-Q303 WeakPolarHBondContact O-CB 3.33Å; L299-Q303 PolarHBondContact O-N 3.1Å; L299-F318 HydrophobicContact CD2-CD1 3.55Å; L299-F318 HydrophobicContact CD2-CE1 4.19Å; L299-F318 HydrophobicContact CD2-CG 4.38Å; L299-K321 HydrophobicContact CD1-CB 4.34Å; L299-K321 HydrophobicContact CD1-CG 3.83Å; L299-L322 HydrophobicContact CB-CD1 4.32Å; L299-L322 HydrophobicContact CB-CD2 3.71Å; L299-L322 HydrophobicContact CB-CG 3.85Å; L299-L325 HydrophobicContact CD1-CD1 3.39Å
300	Q	96.4	Very high	96.5	Very high	93 Å²	93	71 Å²	71	44%	0.435	34%	0.342	S	S	.	.	H	α-helix	trans	-61	-41.4	172.1	-75.9	169.7	-21.7	0	0	112	M296 K298 Q303 Q304 L322	M296-Q300 WeakPolarHBondContact O-CB 3.4Å; M296-Q300 WeakPolarHBondContact O-CG 3.46Å; M296-Q300 PolarHBondContact O-N 2.97Å; K298-Q300 PolarHBondContact O-N 3.04Å; Q300-Q303 PolarHBondContact O-N 2.85Å; Q300-Q304 WeakPolarHBondContact O-CB 3.42Å; Q300-Q304 PolarHBondContact O-N 3.01Å; Q300-L322 HydrophobicContact CG-CD1 3.82Å; Q300-L322 HydrophobicContact CG-CD2 3.89Å
301	R	96.1	Very high	96.7	Very high	132 Å²	132	73.7 Å²	73.7	50%	0.498	36%	0.356	S	S	.	.	H	α-helix	trans	-68.7	-38.2	176.1	-67.6	169.6	-173.5	-170.7	0.8	112	L297 K298 L299 K305 S639	L297-R301 WeakPolarHBondContact O-CD 3.32Å; L297-R301 VanDerWaalsContact O-CG 3.32Å; L297-R301 WeakPolarHBondContact O-CG 3.38Å; L297-R301 PolarHBondContact O-N 2.85Å; K298-R301 PolarHBondContact O-N 3.12Å; L299-R301 VanDerWaalsContact C-N 3.34Å; L299-R301 PolarHBondContact O-N 3.14Å; R301-K305 WeakPolarHBondContact O-CB 3.13Å; R301-K305 PolarHBondContact O-N 3.4Å; R301-S639 VanDerWaalsContact NH2-CB 3.34Å; R301-S639 PolarHBondContact NH2-OG 3.24Å
302	L	97.5	Very high	96.8	Very high	83 Å²	83	73.5 Å²	73.5	44%	0.435	35%	0.353	S	S	.	.	H	α-helix	trans	-67.9	-40.9	174.6	-69.7	171.8	0	0	0	112.1	K298 L299 K305 A306 F318	K298-L302 WeakPolarHBondContact O-CG 3.21Å; K298-L302 PolarHBondContact O-N 2.84Å; L299-L302 PolarHBondContact O-N 3.16Å; L302-K305 PolarHBondContact O-N 3.27Å; L302-A306 WeakPolarHBondContact O-CB 3.08Å; L302-A306 PolarHBondContact O-N 3.02Å; L302-F318 HydrophobicContact CB-CD1 4.4Å; L302-F318 HydrophobicContact CB-CD2 3.96Å; L302-F318 HydrophobicContact CB-CE1 4.2Å; L302-F318 HydrophobicContact CB-CE2 3.74Å; L302-F318 HydrophobicContact CB-CG 4.29Å; L302-F318 HydrophobicContact CB-CZ 3.87Å; L302-F318 HydrophobicContact CD1-CE1 4.14Å; L302-F318 HydrophobicContact CD1-CZ 4.26Å
303	Q	97.9	Very high	96.9	Very high	53 Å²	53	78.8 Å²	78.8	25%	0.248	38%	0.381	C	S	.	.	H	α-helix	trans	-62.1	-48.1	173.2	-175.4	176.7	45.7	0	0	111.4	L299 Q300 K305 A306 I307 A315 F318	L299-Q303 VanDerWaalsContact O-CB 3.3Å; L299-Q303 WeakPolarHBondContact O-CB 3.33Å; L299-Q303 PolarHBondContact O-N 3.1Å; Q300-Q303 PolarHBondContact O-N 2.85Å; Q303-K305 VanDerWaalsContact C-N 3.27Å; Q303-K305 PolarHBondContact O-N 2.81Å; Q303-A306 PolarHBondContact O-N 3.04Å; Q303-I307 HydrophobicContact CG-CD1 4.05Å; Q303-I307 VanDerWaalsContact O-CG1 3.3Å; Q303-I307 WeakPolarHBondContact O-CG1 3.35Å; Q303-I307 PolarHBondContact O-N 3Å; Q303-A315 HydrophobicContact CG-CB 4.33Å; Q303-A315 PolarHBondContact NE2-O 2.79Å; Q303-F318 HydrophobicContact CB-CB 3.86Å; Q303-F318 HydrophobicContact CB-CD2 4.49Å; Q303-F318 HydrophobicContact CG-CB 4.41Å
304	Q	97.1	Very high	97.1	Very high	106 Å²	106	78.4 Å²	78.4	50%	0.495	38%	0.381	S	S	.	.	H	α-helix	trans	-63.4	-33.9	178	-175.2	57.4	79.2	0	0	112.2	Q300 L308	Q300-Q304 WeakPolarHBondContact O-CB 3.42Å; Q300-Q304 PolarHBondContact O-N 3.01Å; Q304-L308 WeakPolarHBondContact O-CD1 3.41Å; Q304-L308 VanDerWaalsContact O-CG 3.31Å; Q304-L308 WeakPolarHBondContact O-CG 3.13Å; Q304-L308 PolarHBondContact O-N 3.47Å
305	K	97.6	Very high	97.2	Very high	124 Å²	124	77.2 Å²	77.2	54%	0.539	37%	0.373	S	S	.	.	H	α-helix	trans	-66.8	-49.5	170.7	176.3	173.3	170.8	178.4	0	111.5	R301 L302 Q303 I307 L308 D309	R301-K305 WeakPolarHBondContact O-CB 3.13Å; R301-K305 PolarHBondContact O-N 3.4Å; L302-K305 PolarHBondContact O-N 3.27Å; Q303-K305 VanDerWaalsContact C-N 3.27Å; Q303-K305 PolarHBondContact O-N 2.81Å; K305-I307 VanDerWaalsContact C-N 3.25Å; K305-I307 PolarHBondContact O-N 3.01Å; K305-L308 CarbonylContact O-C 3.46Å; K305-L308 WeakPolarHBondContact O-CA 3.47Å; K305-L308 WeakPolarHBondContact O-CB 3.13Å; K305-L308 PolarHBondContact O-N 2.93Å; K305-D309 WeakPolarHBondContact CE-OD2 3.31Å; K305-D309 VanDerWaalsContact CG-OD2 3.31Å; K305-D309 WeakPolarHBondContact CG-OD2 3.25Å; K305-D309 IonicContact NZ-OD2 2.72Å; K305-D309 PolarHBondContact O-N 3.27Å
306	A	98.1	Very high	97.3	Very high	6 Å²	6	80.7 Å²	80.7	5%	0.05	39%	0.388	C	S	.	.	H	α-helix	trans	-57.2	-38.2	179.7	0	0	0	0	0	112.5	L302 Q303 L308 D309 D310 D311 A314 A315 F318	L302-A306 WeakPolarHBondContact O-CB 3.08Å; L302-A306 PolarHBondContact O-N 3.02Å; Q303-A306 PolarHBondContact O-N 3.04Å; A306-L308 VanDerWaalsContact C-N 3.32Å; A306-L308 PolarHBondContact O-N 2.81Å; A306-D309 PolarHBondContact O-N 3.38Å; A306-D310 PolarHBondContact O-N 2.92Å; A306-D311 HydrophobicContact CB-CB 4.43Å; A306-D311 PolarHBondContact O-N 3.46Å; A306-A314 HydrophobicContact CB-CB 3.91Å; A306-A315 HydrophobicContact CB-CB 4Å; A306-F318 HydrophobicContact CB-CD2 4.31Å; A306-F318 HydrophobicContact CB-CE2 4.3Å
307	I	97.4	Very high	97.4	Very high	71 Å²	71	87.7 Å²	87.7	36%	0.364	41%	0.414	S	S	.	.	H	α-helix	trans	-63.5	-33.6	172.7	-67	165.6	0	0	0	112.5	Q303 K305 A315	Q303-I307 HydrophobicContact CG-CD1 4.05Å; Q303-I307 VanDerWaalsContact O-CG1 3.3Å; Q303-I307 WeakPolarHBondContact O-CG1 3.35Å; Q303-I307 PolarHBondContact O-N 3Å; K305-I307 VanDerWaalsContact C-N 3.25Å; K305-I307 PolarHBondContact O-N 3.01Å; I307-A315 HydrophobicContact CD1-CB 4.47Å; I307-A315 HydrophobicContact CG1-CB 3.69Å
308	L	97.8	Very high	97.6	Very high	132 Å²	132	89 Å²	89	69%	0.691	42%	0.419	S	S	*	.	H	α-helix	trans	-81.3	-24.2	177.4	-68.9	168	0	0	0	112.9	Q304 K305 A306 D310	Q304-L308 WeakPolarHBondContact O-CD1 3.41Å; Q304-L308 VanDerWaalsContact O-CG 3.31Å; Q304-L308 WeakPolarHBondContact O-CG 3.13Å; Q304-L308 PolarHBondContact O-N 3.47Å; K305-L308 CarbonylContact O-C 3.46Å; K305-L308 WeakPolarHBondContact O-CA 3.47Å; K305-L308 WeakPolarHBondContact O-CB 3.13Å; K305-L308 PolarHBondContact O-N 2.93Å; A306-L308 VanDerWaalsContact C-N 3.32Å; A306-L308 PolarHBondContact O-N 2.81Å; L308-D310 VanDerWaalsContact C-N 3.33Å
309	D	97.9	Very high	97.6	Very high	99 Å²	99	83.9 Å²	83.9	53%	0.529	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	6.3	176.5	-65.8	-20	0	0	0	112.6	K305 A306 D311	K305-D309 WeakPolarHBondContact CE-OD2 3.31Å; K305-D309 VanDerWaalsContact CG-OD2 3.31Å; K305-D309 WeakPolarHBondContact CG-OD2 3.25Å; K305-D309 IonicContact NZ-OD2 2.72Å; K305-D309 PolarHBondContact O-N 3.27Å; A306-D309 PolarHBondContact O-N 3.38Å; D309-D311 PolarHBondContact O-N 2.94Å
310	D	98	Very high	97.6	Very high	113 Å²	113	89 Å²	89	60%	0.604	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.8	17.5	-172.5	-78.5	-52.6	0	0	0	115.1	A306 L308 Y312	A306-D310 PolarHBondContact O-N 2.92Å; L308-D310 VanDerWaalsContact C-N 3.33Å; D310-Y312 HydrophobicContact CB-CE2 3.9Å; D310-Y312 WeakPolarHBondContact O-CD2 3.31Å; D310-Y312 WeakPolarHBondContact O-CE2 3.44Å; D310-Y312 PolarHBondContact O-N 2.68Å; D310-Y312 VanDerWaalsContact O-N 3.12Å; D310-Y312 VanDerWaalsContact OD1-CE2 3.23Å; D310-Y312 WeakPolarHBondContact OD1-CE2 3.31Å; D310-Y312 VanDerWaalsContact OD1-CZ 3.29Å; D310-Y312 PolarHBondContact OD1-OH 2.97Å
311	D	97.9	Very high	97.7	Very high	71 Å²	71	87.7 Å²	87.7	38%	0.38	42%	0.416	S	S	.	.			trans	-86	73.8	173.8	-172.3	-11.2	0	0	0	110.5	A306 D309 D313 A314 A315	A306-D311 HydrophobicContact CB-CB 4.43Å; A306-D311 PolarHBondContact O-N 3.46Å; D309-D311 PolarHBondContact O-N 2.94Å; D311-D313 PolarHBondContact O-N 2.91Å; D311-D313 PolarHBondContact OD1-N 3.45Å; D311-A314 HydrophobicContact CB-CB 4.18Å; D311-A314 PolarHBondContact O-N 3.17Å; D311-A314 VanDerWaalsContact OD1-CB 3.29Å; D311-A314 WeakPolarHBondContact OD1-CB 3.43Å; D311-A314 PolarHBondContact OD1-N 3.07Å; D311-A314 VanDerWaalsContact OD2-CB 3.23Å; D311-A314 WeakPolarHBondContact OD2-CB 3.45Å; D311-A315 PolarHBondContact O-N 2.86Å
312	Y	97.9	Very high	97.8	Very high	136 Å²	136	82.1 Å²	82.1	53%	0.533	40%	0.397	S	S	.	.	H	α-helix	trans	-62.4	-30.5	179.4	-62.3	-81.2	0	0	0	112.6	D310 A315 E316	D310-Y312 HydrophobicContact CB-CE2 3.9Å; D310-Y312 WeakPolarHBondContact O-CD2 3.31Å; D310-Y312 WeakPolarHBondContact O-CE2 3.44Å; D310-Y312 PolarHBondContact O-N 2.68Å; D310-Y312 VanDerWaalsContact O-N 3.12Å; D310-Y312 VanDerWaalsContact OD1-CE2 3.23Å; D310-Y312 WeakPolarHBondContact OD1-CE2 3.31Å; D310-Y312 VanDerWaalsContact OD1-CZ 3.29Å; D310-Y312 PolarHBondContact OD1-OH 2.97Å; Y312-A315 PolarHBondContact O-N 3.44Å; Y312-E316 PolarHBondContact O-N 2.88Å
313	D	98	Very high	97.7	Very high	120 Å²	120	85.2 Å²	85.2	64%	0.642	41%	0.409	S	S	*	.	H	α-helix	trans	-68.8	-38.2	177.6	-63.2	-18.7	0	0	0	111.6	D311 R317	D311-D313 PolarHBondContact O-N 2.91Å; D311-D313 PolarHBondContact OD1-N 3.45Å; D313-R317 WeakPolarHBondContact O-CB 3.05Å; D313-R317 VanDerWaalsContact O-CG 3.24Å; D313-R317 WeakPolarHBondContact O-CG 3.45Å; D313-R317 PolarHBondContact O-N 2.82Å; D313-R317 PolarHBondContact O-NE 3.45Å
314	A	98	Very high	97.7	Very high	8 Å²	8	86.8 Å²	86.8	7%	0.066	42%	0.416	C	S	.	.	H	α-helix	trans	-69.7	-40.8	169	0	0	0	0	0	111.7	A306 D311 E316 R317 F318	A306-A314 HydrophobicContact CB-CB 3.91Å; D311-A314 HydrophobicContact CB-CB 4.18Å; D311-A314 PolarHBondContact O-N 3.17Å; D311-A314 VanDerWaalsContact OD1-CB 3.29Å; D311-A314 WeakPolarHBondContact OD1-CB 3.43Å; D311-A314 PolarHBondContact OD1-N 3.07Å; D311-A314 VanDerWaalsContact OD2-CB 3.23Å; D311-A314 WeakPolarHBondContact OD2-CB 3.45Å; A314-E316 VanDerWaalsContact C-N 3.32Å; A314-E316 PolarHBondContact O-N 2.91Å; A314-R317 VanDerWaalsContact CA-NH2 3.32Å; A314-R317 PolarHBondContact O-N 2.68Å; A314-F318 HydrophobicContact CB-CD2 4.3Å; A314-F318 HydrophobicContact CB-CE2 3.91Å; A314-F318 WeakPolarHBondContact O-CB 3.45Å; A314-F318 WeakPolarHBondContact O-CD2 3.3Å; A314-F318 VanDerWaalsContact O-CG 3.3Å; A314-F318 WeakPolarHBondContact O-CG 3.18Å; A314-F318 PolarHBondContact O-N 2.72Å
315	A	98.1	Very high	97.7	Very high	8 Å²	8	81.9 Å²	81.9	7%	0.066	39%	0.393	C	S	.	.	H	α-helix	trans	-60.6	-38.9	178.3	0	0	0	0	0	112.7	Q303 A306 I307 D311 Y312 G319	Q303-A315 HydrophobicContact CG-CB 4.33Å; Q303-A315 PolarHBondContact NE2-O 2.79Å; A306-A315 HydrophobicContact CB-CB 4Å; I307-A315 HydrophobicContact CD1-CB 4.47Å; I307-A315 HydrophobicContact CG1-CB 3.69Å; D311-A315 PolarHBondContact O-N 2.86Å; Y312-A315 PolarHBondContact O-N 3.44Å; A315-G319 PolarHBondContact O-N 3.32Å
316	E	97.4	Very high	97.4	Very high	148 Å²	148	78.6 Å²	78.6	69%	0.692	39%	0.385	S	S	*	.	H	α-helix	trans	-69.9	-46.6	173.7	-174.3	173.9	-138.9	0	0	111.6	Y312 A314 F318 G319 K320	Y312-E316 PolarHBondContact O-N 2.88Å; A314-E316 VanDerWaalsContact C-N 3.32Å; A314-E316 PolarHBondContact O-N 2.91Å; E316-F318 VanDerWaalsContact C-N 3.31Å; E316-F318 PolarHBondContact O-N 2.79Å; E316-G319 CarbonylContact O-C 3.59Å; E316-G319 WeakPolarHBondContact O-CA 3.4Å; E316-G319 PolarHBondContact O-N 3.34Å; E316-K320 PolarHBondContact O-N 2.85Å
317	R	98.1	Very high	97.2	Very high	157 Å²	157	80.6 Å²	80.6	59%	0.592	41%	0.407	S	S	*	.	H	α-helix	trans	-56.6	-42.7	176.3	-76.4	176.3	-68.7	159.7	-1.6	112.3	D313 A314 K321	D313-R317 WeakPolarHBondContact O-CB 3.05Å; D313-R317 VanDerWaalsContact O-CG 3.24Å; D313-R317 WeakPolarHBondContact O-CG 3.45Å; D313-R317 PolarHBondContact O-N 2.82Å; D313-R317 PolarHBondContact O-NE 3.45Å; A314-R317 VanDerWaalsContact CA-NH2 3.32Å; A314-R317 PolarHBondContact O-N 2.68Å; R317-K321 PolarHBondContact O-N 2.68Å; R317-K321 VanDerWaalsContact O-N 3.13Å
318	F	98.2	Very high	97.2	Very high	57 Å²	57	81.7 Å²	81.7	25%	0.25	41%	0.41	C	S	.	.	H	α-helix	trans	-67.7	-37.7	173.8	-63.9	-45.3	0	0	0	112.1	L299 L302 Q303 A306 A314 E316 K321 L322	L299-F318 HydrophobicContact CD2-CD1 3.55Å; L299-F318 HydrophobicContact CD2-CE1 4.19Å; L299-F318 HydrophobicContact CD2-CG 4.38Å; L302-F318 HydrophobicContact CB-CD1 4.4Å; L302-F318 HydrophobicContact CB-CD2 3.96Å; L302-F318 HydrophobicContact CB-CE1 4.2Å; L302-F318 HydrophobicContact CB-CE2 3.74Å; L302-F318 HydrophobicContact CB-CG 4.29Å; L302-F318 HydrophobicContact CB-CZ 3.87Å; L302-F318 HydrophobicContact CD1-CE1 4.14Å; L302-F318 HydrophobicContact CD1-CZ 4.26Å; Q303-F318 HydrophobicContact CB-CB 3.86Å; Q303-F318 HydrophobicContact CB-CD2 4.49Å; Q303-F318 HydrophobicContact CG-CB 4.41Å; A306-F318 HydrophobicContact CB-CD2 4.31Å; A306-F318 HydrophobicContact CB-CE2 4.3Å; A314-F318 HydrophobicContact CB-CD2 4.3Å; A314-F318 HydrophobicContact CB-CE2 3.91Å; A314-F318 WeakPolarHBondContact O-CB 3.45Å; A314-F318 WeakPolarHBondContact O-CD2 3.3Å; A314-F318 VanDerWaalsContact O-CG 3.3Å; A314-F318 WeakPolarHBondContact O-CG 3.18Å; A314-F318 PolarHBondContact O-N 2.72Å; E316-F318 VanDerWaalsContact C-N 3.31Å; E316-F318 PolarHBondContact O-N 2.79Å; F318-K321 PolarHBondContact O-N 2.8Å; F318-L322 VanDerWaalsContact O-CG 3.3Å; F318-L322 WeakPolarHBondContact O-CG 3.28Å; F318-L322 PolarHBondContact O-N 3.39Å
319	G	97	Very high	97	Very high	21 Å²	21	78.8 Å²	78.8	22%	0.216	39%	0.39	C	S	.	.	H	α-helix	trans	-60.2	-46.8	174.3	0	0	0	0	0	113.1	A315 E316 L322 E323	A315-G319 PolarHBondContact O-N 3.32Å; E316-G319 CarbonylContact O-C 3.59Å; E316-G319 WeakPolarHBondContact O-CA 3.4Å; E316-G319 PolarHBondContact O-N 3.34Å; G319-L322 WeakPolarHBondContact O-CB 3.38Å; G319-L322 PolarHBondContact O-N 3.35Å; G319-L322 VanDerWaalsContact O-N 3.16Å; G319-E323 PolarHBondContact O-N 2.86Å
320	K	97.3	Very high	96.6	Very high	131 Å²	131	77.2 Å²	77.2	57%	0.57	40%	0.398	S	S	*	.	H	α-helix	trans	-62.4	-43.2	175.6	-174.8	174.9	178.7	175.3	0	112.2	E316 L322 E323 E324	E316-K320 PolarHBondContact O-N 2.85Å; K320-L322 VanDerWaalsContact C-N 3.26Å; K320-L322 PolarHBondContact O-N 2.85Å; K320-E323 PolarHBondContact O-N 3.36Å; K320-E323 VanDerWaalsContact O-N 3.17Å; K320-E324 WeakPolarHBondContact O-CG 3.46Å; K320-E324 PolarHBondContact O-N 2.94Å
321	K	98	Very high	96.3	Very high	65 Å²	65	75.7 Å²	75.7	28%	0.283	40%	0.401	S	S	.	.	H	α-helix	trans	-66.5	-28.1	175.6	-168	60.7	-112	173.2	0	112.4	L299 R317 F318 E324 L325 E328	L299-K321 HydrophobicContact CD1-CB 4.34Å; L299-K321 HydrophobicContact CD1-CG 3.83Å; R317-K321 PolarHBondContact O-N 2.68Å; R317-K321 VanDerWaalsContact O-N 3.13Å; F318-K321 PolarHBondContact O-N 2.8Å; K321-E324 WeakPolarHBondContact CD-OE2 3.14Å; K321-E324 VanDerWaalsContact CE-OE2 3.3Å; K321-E324 WeakPolarHBondContact CE-OE2 3.43Å; K321-E324 IonicContact NZ-OE2 3.29Å; K321-E324 PolarHBondContact NZ-OE2 3.48Å; K321-L325 WeakPolarHBondContact O-CB 3.28Å; K321-L325 VanDerWaalsContact O-CG 3.25Å; K321-L325 WeakPolarHBondContact O-CG 3.43Å; K321-L325 PolarHBondContact O-N 2.9Å; K321-L325 VanDerWaalsContact O-N 3.09Å; K321-E328 IonicContact NZ-OE1 3.37Å; K321-E328 PolarHBondContact NZ-OE1 2.97Å
322	L	97.9	Very high	96.1	Very high	16 Å²	16	74.1 Å²	74.1	8%	0.084	39%	0.392	C	S	.	.	H	α-helix	trans	-69.6	-39.6	170.4	-76.2	165.8	0	0	0	112.5	M296 L299 Q300 F318 G319 K320 L325 C326	M296-L322 HydrophobicContact CB-CD2 3.85Å; M296-L322 HydrophobicContact CG-CD2 4.08Å; M296-L322 WeakPolarHBondContact O-CD2 3.46Å; L299-L322 HydrophobicContact CB-CD1 4.32Å; L299-L322 HydrophobicContact CB-CD2 3.71Å; L299-L322 HydrophobicContact CB-CG 3.85Å; Q300-L322 HydrophobicContact CG-CD1 3.82Å; Q300-L322 HydrophobicContact CG-CD2 3.89Å; F318-L322 VanDerWaalsContact O-CG 3.3Å; F318-L322 WeakPolarHBondContact O-CG 3.28Å; F318-L322 PolarHBondContact O-N 3.39Å; G319-L322 WeakPolarHBondContact O-CB 3.38Å; G319-L322 PolarHBondContact O-N 3.35Å; G319-L322 VanDerWaalsContact O-N 3.16Å; K320-L322 VanDerWaalsContact C-N 3.26Å; K320-L322 PolarHBondContact O-N 2.85Å; L322-L325 PolarHBondContact O-N 2.83Å; L322-C326 WeakPolarHBondContact O-CB 3.39Å; L322-C326 PolarHBondContact O-N 3.37Å; L322-C326 PolarHBondContact O-SG 3.35Å
323	E	96	Very high	95.8	Very high	147 Å²	147	75.2 Å²	75.2	69%	0.687	40%	0.399	S	S	*	.	H	α-helix	trans	-64.6	-45.8	174.8	-174.7	172.8	-148.3	0	0	111.8	G319 K320 L325 C326 G327	G319-E323 PolarHBondContact O-N 2.86Å; K320-E323 PolarHBondContact O-N 3.36Å; K320-E323 VanDerWaalsContact O-N 3.17Å; E323-L325 VanDerWaalsContact C-N 3.35Å; E323-L325 PolarHBondContact O-N 3.06Å; E323-C326 WeakPolarHBondContact O-CB 3.34Å; E323-C326 PolarHBondContact O-N 2.98Å; E323-C326 VanDerWaalsContact O-N 3.16Å; E323-G327 PolarHBondContact O-N 2.82Å
324	E	97	Very high	95.5	Very high	87 Å²	87	71.8 Å²	71.8	41%	0.407	38%	0.381	S	S	.	.	H	α-helix	trans	-55.7	-48	172.8	-70.9	171.7	-165.6	0	0	111.4	K320 K321 C326 G327 E328	K320-E324 WeakPolarHBondContact O-CG 3.46Å; K320-E324 PolarHBondContact O-N 2.94Å; K321-E324 WeakPolarHBondContact CD-OE2 3.14Å; K321-E324 VanDerWaalsContact CE-OE2 3.3Å; K321-E324 WeakPolarHBondContact CE-OE2 3.43Å; K321-E324 IonicContact NZ-OE2 3.29Å; K321-E324 PolarHBondContact NZ-OE2 3.48Å; E324-C326 PolarHBondContact O-N 3.21Å; E324-G327 PolarHBondContact O-N 3.04Å; E324-E328 WeakPolarHBondContact O-CG 3.45Å; E324-E328 PolarHBondContact O-N 3.3Å
325	L	97.3	Very high	95.3	Very high	3 Å²	3	72 Å²	72	2%	0.016	38%	0.384	C	S	.	.	H	α-helix	trans	-67.1	-32.4	177.2	-73.1	172.5	0	0	0	113.1	I292 M295 M296 L299 K321 L322 E323 G327 R329	I292-L325 HydrophobicContact CG1-CD2 4.22Å; I292-L325 HydrophobicContact CG2-CB 4.03Å; I292-L325 HydrophobicContact CG2-CD2 4.05Å; M295-L325 HydrophobicContact CB-CD1 4.1Å; M295-L325 HydrophobicContact CE-CD2 4.42Å; M296-L325 HydrophobicContact CG-CB 3.72Å; M296-L325 HydrophobicContact CG-CD1 3.94Å; M296-L325 HydrophobicContact CG-CG 4.47Å; M296-L325 HydrophobicContact SD-CB 4.19Å; L299-L325 HydrophobicContact CD1-CD1 3.39Å; K321-L325 WeakPolarHBondContact O-CB 3.28Å; K321-L325 VanDerWaalsContact O-CG 3.25Å; K321-L325 WeakPolarHBondContact O-CG 3.43Å; K321-L325 PolarHBondContact O-N 2.9Å; K321-L325 VanDerWaalsContact O-N 3.09Å; L322-L325 PolarHBondContact O-N 2.83Å; E323-L325 VanDerWaalsContact C-N 3.35Å; E323-L325 PolarHBondContact O-N 3.06Å; L325-G327 VanDerWaalsContact C-N 3.33Å; L325-R329 WeakPolarHBondContact O-CB 3.34Å; L325-R329 PolarHBondContact O-N 2.74Å
326	C	93	Very high	95.1	Very high	54 Å²	54	71.8 Å²	71.8	37%	0.365	38%	0.382	S	S	.	.	H	α-helix	trans	-61.1	-42.6	170.9	-86.7	0	0	0	0	111.4	M296 L322 E323 E324 G330	M296-C326 WeakPolarHBondContact CE-SG 3.27Å; L322-C326 WeakPolarHBondContact O-CB 3.39Å; L322-C326 PolarHBondContact O-N 3.37Å; L322-C326 PolarHBondContact O-SG 3.35Å; E323-C326 WeakPolarHBondContact O-CB 3.34Å; E323-C326 PolarHBondContact O-N 2.98Å; E323-C326 VanDerWaalsContact O-N 3.16Å; E324-C326 PolarHBondContact O-N 3.21Å; C326-G330 PolarHBondContact O-N 3.47Å
327	G	93.8	Very high	94.9	Very high	49 Å²	49	64.8 Å²	64.8	51%	0.505	35%	0.349	S	S	.	.	H	α-helix	trans	-65.7	-49.8	175.1	0	0	0	0	0	112.7	E323 E324 L325 R329 G330 A331	E323-G327 PolarHBondContact O-N 2.82Å; E324-G327 PolarHBondContact O-N 3.04Å; L325-G327 VanDerWaalsContact C-N 3.33Å; G327-R329 VanDerWaalsContact C-N 3.3Å; G327-R329 PolarHBondContact O-N 3.23Å; G327-G330 PolarHBondContact O-N 3.26Å; G327-A331 PolarHBondContact O-N 2.96Å
328	E	95.7	Very high	94.7	Very high	93 Å²	93	57.3 Å²	57.3	44%	0.435	32%	0.321	S	S	.	.	H	α-helix	trans	-54.6	-46.2	174.3	-70.4	174.1	-139.2	0	0	111.2	I292 K321 E324 A331	I292-E328 HydrophobicContact CD1-CB 3.97Å; K321-E328 IonicContact NZ-OE1 3.37Å; K321-E328 PolarHBondContact NZ-OE1 2.97Å; E324-E328 WeakPolarHBondContact O-CG 3.45Å; E324-E328 PolarHBondContact O-N 3.3Å; E328-A331 PolarHBondContact O-N 3.17Å
329	R	93.8	Very high	94.4	Very high	71 Å²	71	58 Å²	58	27%	0.268	33%	0.326	S	S	.	.	H	α-helix	trans	-61.6	-42.7	177.6	-174.8	-178	62.1	166.2	-1.1	112.6	Y289 I292 E293 L325 G327 A331 L332	Y289-R329 HydrophobicContact CD2-CG 3.57Å; Y289-R329 HydrophobicContact CE2-CG 3.34Å; I292-R329 HydrophobicContact CG2-CB 3.92Å; I292-R329 HydrophobicContact CG2-CG 4.44Å; E293-R329 WeakPolarHBondContact OE1-CD 3.21Å; E293-R329 IonicContact OE1-CZ 3.32Å; E293-R329 IonicContact OE1-NE 3.62Å; E293-R329 IonicContact OE1-NH1 3.01Å; E293-R329 PolarHBondContact OE1-NH1 2.94Å; L325-R329 WeakPolarHBondContact O-CB 3.34Å; L325-R329 PolarHBondContact O-N 2.74Å; G327-R329 VanDerWaalsContact C-N 3.3Å; G327-R329 PolarHBondContact O-N 3.23Å; R329-A331 VanDerWaalsContact C-N 3.27Å; R329-A331 PolarHBondContact O-N 3.24Å; R329-L332 PolarHBondContact O-N 3.5Å
330	G	89.6	Confident	94.2	Very high	67 Å²	67	59.1 Å²	59.1	69%	0.691	33%	0.325	S	S	*	.	H	α-helix	trans	-68.4	-22.3	-179.2	0	0	0	0	0	114.2	C326 G327	C326-G330 PolarHBondContact O-N 3.47Å; G327-G330 PolarHBondContact O-N 3.26Å
331	A	93.1	Very high	93.9	Very high	81 Å²	81	56.9 Å²	56.9	67%	0.669	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-15	177.2	0	0	0	0	0	114	G327 E328 R329	G327-A331 PolarHBondContact O-N 2.96Å; E328-A331 PolarHBondContact O-N 3.17Å; R329-A331 VanDerWaalsContact C-N 3.27Å; R329-A331 PolarHBondContact O-N 3.24Å
332	L	93.4	Very high	93.5	Very high	37 Å²	37	56.2 Å²	56.2	19%	0.194	33%	0.328	C	S	.	.			trans	-80.2	133.1	-175.3	-65.2	176.7	0	0	0	112.5	N285 T288 I292 R329 L334	N285-L332 HydrophobicContact CB-CD2 4.44Å; T288-L332 HydrophobicContact CG2-CD1 4.02Å; T288-L332 HydrophobicContact CG2-CD2 4.5Å; I292-L332 HydrophobicContact CD1-CD1 3.95Å; R329-L332 PolarHBondContact O-N 3.5Å; L332-L334 HydrophobicContact CB-CD2 3.95Å
333	K	91.8	Very high	93.3	Very high	159 Å²	159	55.5 Å²	55.5	69%	0.691	32%	0.324	S	S	*	.			trans	-92.3	111	173.5	-66.1	-178.6	-178.1	177.7	0	110	N285	N285-K333 VanDerWaalsContact CB-O 3.23Å; N285-K333 WeakPolarHBondContact CB-O 3.3Å; N285-K333 PolarHBondContact ND2-O 2.99Å
334	L	91.6	Very high	93.1	Very high	48 Å²	48	49.7 Å²	49.7	25%	0.251	30%	0.301	S	S	.	.			trans	-102.8	152.9	-175	-45.2	175.5	0	0	0	110.9	N286 Y289 L332 V465	N286-L334 WeakPolarHBondContact OD1-CA 3.45Å; Y289-L334 HydrophobicContact CD1-CD1 4.11Å; Y289-L334 HydrophobicContact CD2-CD1 3.41Å; Y289-L334 VanDerWaalsContact CD2-CD1 3.41Å; Y289-L334 HydrophobicContact CD2-CD2 3.83Å; Y289-L334 HydrophobicContact CD2-CG 4.2Å; Y289-L334 HydrophobicContact CE1-CD1 4.15Å; Y289-L334 HydrophobicContact CE2-CD1 3.43Å; Y289-L334 VanDerWaalsContact CE2-CD1 3.43Å; Y289-L334 HydrophobicContact CG-CD1 3.76Å; Y289-L334 HydrophobicContact CG-CD2 3.76Å; Y289-L334 HydrophobicContact CG-CG 4.42Å; L332-L334 HydrophobicContact CB-CD2 3.95Å; L334-V465 HydrophobicContact CB-CB 3.96Å; L334-V465 HydrophobicContact CB-CG1 4.09Å; L334-V465 HydrophobicContact CB-CG2 4.16Å; L334-V465 HydrophobicContact CD1-CB 4.24Å; L334-V465 HydrophobicContact CD1-CG1 3.6Å; L334-V465 HydrophobicContact CG-CG1 4.5Å
335	G	92.8	Very high	92.8	Very high	13 Å²	13	51.3 Å²	51.3	13%	0.134	31%	0.309	C	S	.	.	S	Bend	trans	150.7	-178	175.5	0	0	0	0	0	113.1	C282 N286	C282-G335 PolarHBondContact SG-O 2.72Å; C282-G335 VanDerWaalsContact SG-O 3.33Å; N286-G335 PolarHBondContact ND2-O 3.4Å; N286-G335 PolarHBondContact OD1-N 2.76Å
336	L	94.7	Very high	92.4	Very high	4 Å²	4	51.2 Å²	51.2	2%	0.021	31%	0.308	C	S	.	.			trans	-74	129.1	175.5	-67.1	174.1	0	0	0	110.5	S338 M339 Q340 R460 I463 Y599 D622 A625 F629	L336-S338 PolarHBondContact O-N 2.72Å; L336-M339 HydrophobicContact CB-CB 4.16Å; L336-M339 HydrophobicContact CB-CG 3.94Å; L336-M339 HydrophobicContact CD1-CG 4.24Å; L336-M339 WeakPolarHBondContact O-CA 3.35Å; L336-M339 WeakPolarHBondContact O-CB 3.49Å; L336-M339 PolarHBondContact O-N 2.71Å; L336-Q340 PolarHBondContact O-N 3.06Å; L336-R460 HydrophobicContact CD1-CG 3.83Å; L336-I463 HydrophobicContact CD1-CB 4.09Å; L336-I463 HydrophobicContact CD1-CD1 4.08Å; L336-I463 HydrophobicContact CD1-CG2 4.1Å; L336-I463 HydrophobicContact CD2-CG2 4.29Å; L336-I463 HydrophobicContact CG-CB 4.49Å; L336-I463 HydrophobicContact CG-CG2 3.96Å; L336-Y599 HydrophobicContact CD1-CD1 4Å; L336-Y599 HydrophobicContact CD1-CE1 3.56Å; L336-Y599 HydrophobicContact CD2-CD1 4.33Å; L336-Y599 HydrophobicContact CD2-CE1 4.03Å; L336-Y599 HydrophobicContact CG-CE1 4.43Å; L336-D622 HydrophobicContact CD2-CB 4.31Å; L336-A625 HydrophobicContact CD2-CB 4.19Å; L336-F629 HydrophobicContact CD2-CE2 4.05Å
337	P	93.8	Very high	92.4	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-50.4	-37.9	174	-32.2	38.5	0	0	0	114.4	L279 C282 L283 M339 Q340 A621 D622 A625	L279-P337 HydrophobicContact CB-CB 4.48Å; L279-P337 HydrophobicContact CD2-CB 3.54Å; C282-P337 HydrophobicContact CB-CB 4.4Å; C282-P337 HydrophobicContact CB-CG 4.19Å; L283-P337 HydrophobicContact CD2-CG 4.11Å; L283-P337 HydrophobicContact CG-CG 4Å; P337-M339 PolarHBondContact O-N 2.92Å; P337-Q340 WeakPolarHBondContact O-CB 3.28Å; P337-Q340 PolarHBondContact O-N 3.38Å; P337-A621 HydrophobicContact CB-CB 3.85Å; P337-A621 HydrophobicContact CG-CB 3.92Å; P337-D622 WeakPolarHBondContact CD-OD1 3.49Å; P337-A625 HydrophobicContact CG-CB 4.31Å
338	S	92.1	Very high	92.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-69.8	-15.9	176.4	82	0	0	0	0	114.3	L336 A344 R460 D622	L336-S338 PolarHBondContact O-N 2.72Å; S338-A344 PolarHBondContact O-N 3.44Å; S338-R460 PolarHBondContact O-NH2 2.86Å; S338-R460 PolarHBondContact OG-NE 2.83Å; S338-R460 PolarHBondContact OG-NH2 2.95Å; S338-D622 WeakPolarHBondContact CB-OD1 3.43Å; S338-D622 VanDerWaalsContact CB-OD2 3.25Å; S338-D622 WeakPolarHBondContact CB-OD2 3.49Å; S338-D622 PolarHBondContact N-OD1 3.41Å; S338-D622 VanDerWaalsContact OG-CG 3.31Å; S338-D622 PolarHBondContact OG-OD1 3.4Å; S338-D622 PolarHBondContact OG-OD2 2.97Å
339	M	92.4	Very high	91.9	Very high	72 Å²	72	49.5 Å²	49.5	36%	0.355	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-96.6	-1.1	177	-63.1	-92.2	48.1	0	0	112.6	L336 P337 A344 R460	L336-M339 HydrophobicContact CB-CB 4.16Å; L336-M339 HydrophobicContact CB-CG 3.94Å; L336-M339 HydrophobicContact CD1-CG 4.24Å; L336-M339 WeakPolarHBondContact O-CA 3.35Å; L336-M339 WeakPolarHBondContact O-CB 3.49Å; L336-M339 PolarHBondContact O-N 2.71Å; P337-M339 PolarHBondContact O-N 2.92Å; M339-A344 HydrophobicContact CE-CB 4.14Å; M339-R460 HydrophobicContact CG-CG 4.31Å; M339-R460 HydrophobicContact SD-CG 4.16Å
340	Q	92.6	Very high	91.7	Very high	44 Å²	44	46.1 Å²	46.1	21%	0.206	27%	0.266	C	S	.	.	S	Bend	trans	-59.7	137.4	166.9	-71.5	-63.2	-21.9	0	0	110.2	V278 C282 L336 P337 S342 V343 A344	V278-Q340 HydrophobicContact CG1-CB 3.81Å; V278-Q340 HydrophobicContact CG1-CG 4.03Å; C282-Q340 HydrophobicContact CB-CG 3.9Å; C282-Q340 PolarHBondContact SG-NE2 2.76Å; L336-Q340 PolarHBondContact O-N 3.06Å; P337-Q340 WeakPolarHBondContact O-CB 3.28Å; P337-Q340 PolarHBondContact O-N 3.38Å; Q340-S342 VanDerWaalsContact C-N 3.34Å; Q340-S342 PolarHBondContact O-N 2.67Å; Q340-S342 VanDerWaalsContact O-N 3.14Å; Q340-V343 HydrophobicContact CB-CG2 4.18Å; Q340-V343 PolarHBondContact O-N 3.46Å; Q340-A344 PolarHBondContact O-N 2.95Å
341	P	91.3	Very high	91.7	Very high	85 Å²	85	43.6 Å²	43.6	55%	0.552	24%	0.237	S	C	*	.	H	α-helix	trans	-54.3	-42.7	-167.2	-30.6	35.8	0	0	0	114.9	H345	P341-H345 WeakPolarHBondContact O-CB 3.21Å; P341-H345 PolarHBondContact O-N 2.94Å; P341-H345 PolarHBondContact O-ND1 2.85Å
342	S	90.8	Very high	91.4	Very high	51 Å²	51	44.7 Å²	44.7	36%	0.357	23%	0.227	S	C	.	.	H	α-helix	trans	-65.3	-40.3	178.4	50.1	0	0	0	0	112.8	Q340 F346	Q340-S342 VanDerWaalsContact C-N 3.34Å; Q340-S342 PolarHBondContact O-N 2.67Å; Q340-S342 VanDerWaalsContact O-N 3.14Å; S342-F346 WeakPolarHBondContact O-CB 2.93Å; S342-F346 PolarHBondContact O-N 3.2Å
343	V	92.8	Very high	91.1	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-73	-40.4	179.5	-169.8	0	0	0	0	110.9	Y275 V278 L279 Q340 F346 L347 I618	Y275-V343 HydrophobicContact CD1-CG2 4.22Å; V278-V343 HydrophobicContact CG1-CG2 4.35Å; L279-V343 HydrophobicContact CD2-CG1 4.18Å; L279-V343 HydrophobicContact CD2-CG2 3.97Å; Q340-V343 HydrophobicContact CB-CG2 4.18Å; Q340-V343 PolarHBondContact O-N 3.46Å; V343-F346 WeakPolarHBondContact O-CB 3.25Å; V343-F346 PolarHBondContact O-N 3.48Å; V343-L347 HydrophobicContact CG1-CD1 4.2Å; V343-L347 VanDerWaalsContact O-CG 3.32Å; V343-L347 WeakPolarHBondContact O-CG 3.22Å; V343-L347 PolarHBondContact O-N 3.35Å; V343-I618 HydrophobicContact CG1-CD1 4.22Å; V343-I618 HydrophobicContact CG1-CG2 4.25Å
344	A	91.5	Very high	90.9	Very high	25 Å²	25	36.6 Å²	36.6	21%	0.207	19%	0.192	C	C	.	.	H	α-helix	trans	-62.8	-44.7	175.6	0	0	0	0	0	111.9	S338 M339 Q340 F346 L347 E348	S338-A344 PolarHBondContact O-N 3.44Å; M339-A344 HydrophobicContact CE-CB 4.14Å; Q340-A344 PolarHBondContact O-N 2.95Å; A344-F346 VanDerWaalsContact C-N 3.33Å; A344-F346 PolarHBondContact O-N 3.49Å; A344-L347 PolarHBondContact O-N 2.97Å; A344-E348 WeakPolarHBondContact O-CB 3.39Å; A344-E348 PolarHBondContact O-N 3.16Å
345	H	90	Very high	90.5	Very high	122 Å²	122	37.3 Å²	37.3	57%	0.565	19%	0.194	S	C	*	.	H	α-helix	trans	-66	-34.6	174.3	-75.8	80.9	0	0	0	112.3	P341 R349	P341-H345 WeakPolarHBondContact O-CB 3.21Å; P341-H345 PolarHBondContact O-N 2.94Å; P341-H345 PolarHBondContact O-ND1 2.85Å; H345-R349 VanDerWaalsContact O-CB 3.31Å; H345-R349 WeakPolarHBondContact O-CB 3.23Å; H345-R349 VanDerWaalsContact O-CG 3.22Å; H345-R349 WeakPolarHBondContact O-CG 3.3Å; H345-R349 PolarHBondContact O-N 3.29Å
346	F	90.9	Very high	90.1	Very high	1 Å²	1	39.1 Å²	39.1	0%	0.004	21%	0.205	C	C	.	.	H	α-helix	trans	-62.9	-50.7	173.1	165.7	-117.7	0	0	0	112	L271 Y275 S342 V343 A344 E348 R349 L350 E432 I618	L271-F346 HydrophobicContact CD1-CE2 3.77Å; L271-F346 HydrophobicContact CD1-CZ 4.28Å; L271-F346 HydrophobicContact CD2-CE2 3.79Å; L271-F346 HydrophobicContact CD2-CZ 3.83Å; L271-F346 HydrophobicContact CG-CE2 3.79Å; L271-F346 HydrophobicContact CG-CZ 3.81Å; Y275-F346 AromaticContact CD2-CD1 3.96Å; Y275-F346 HydrophobicContact CD2-CD1 3.96Å; Y275-F346 HydrophobicContact CD2-CE1 4.28Å; Y275-F346 HydrophobicContact CD2-CG 4.09Å; Y275-F346 HydrophobicContact CE1-CB 3.9Å; Y275-F346 HydrophobicContact CE1-CG 4.37Å; Y275-F346 HydrophobicContact CE2-CB 3.9Å; Y275-F346 AromaticContact CE2-CD1 3.81Å; Y275-F346 HydrophobicContact CE2-CD1 3.81Å; Y275-F346 AromaticContact CE2-CD2 3.63Å; Y275-F346 HydrophobicContact CE2-CD2 3.63Å; Y275-F346 HydrophobicContact CE2-CE1 4.26Å; Y275-F346 HydrophobicContact CE2-CE2 4.11Å; Y275-F346 AromaticContact CE2-CG 3.46Å; Y275-F346 HydrophobicContact CE2-CG 3.46Å; Y275-F346 VanDerWaalsContact CE2-CG 3.46Å; Y275-F346 HydrophobicContact CE2-CZ 4.39Å; Y275-F346 AromaticContact CZ-CD2 3.94Å; Y275-F346 AromaticContact CZ-CG 3.66Å; S342-F346 WeakPolarHBondContact O-CB 2.93Å; S342-F346 PolarHBondContact O-N 3.2Å; V343-F346 WeakPolarHBondContact O-CB 3.25Å; V343-F346 PolarHBondContact O-N 3.48Å; A344-F346 VanDerWaalsContact C-N 3.33Å; A344-F346 PolarHBondContact O-N 3.49Å; F346-E348 VanDerWaalsContact C-N 3.3Å; F346-E348 PolarHBondContact O-N 3.04Å; F346-R349 WeakPolarHBondContact O-CB 3.42Å; F346-R349 PolarHBondContact O-N 3.22Å; F346-L350 HydrophobicContact CE1-CD2 4.43Å; F346-L350 HydrophobicContact CE2-CB 4.19Å; F346-L350 HydrophobicContact CE2-CD2 4.29Å; F346-L350 HydrophobicContact CZ-CD2 3.84Å; F346-L350 WeakPolarHBondContact O-CB 3.36Å; F346-L350 PolarHBondContact O-N 3.11Å; F346-E432 HydrophobicContact CE2-CG 4.18Å; F346-I618 HydrophobicContact CD1-CD1 4.3Å; F346-I618 HydrophobicContact CE1-CD1 3.96Å
347	L	91.8	Very high	89.5	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-60.2	-41	178.9	-68.6	166.5	0	0	0	111.7	V343 A344 S351 L451 L454 I455 L615 I618	V343-L347 HydrophobicContact CG1-CD1 4.2Å; V343-L347 VanDerWaalsContact O-CG 3.32Å; V343-L347 WeakPolarHBondContact O-CG 3.22Å; V343-L347 PolarHBondContact O-N 3.35Å; A344-L347 PolarHBondContact O-N 2.97Å; L347-S351 WeakPolarHBondContact O-CB 3.5Å; L347-S351 PolarHBondContact O-N 2.94Å; L347-L451 HydrophobicContact CD2-CD2 3.89Å; L347-L454 HydrophobicContact CD1-CD2 3.71Å; L347-L454 HydrophobicContact CD2-CD2 3.82Å; L347-L454 HydrophobicContact CG-CD2 4.33Å; L347-I455 HydrophobicContact CB-CD1 4.35Å; L347-L615 HydrophobicContact CD2-CD2 3.92Å; L347-I618 HydrophobicContact CD1-CG2 4.48Å; L347-I618 HydrophobicContact CD2-CD1 4.16Å
348	E	90.6	Very high	88.9	Confident	86 Å²	86	43.2 Å²	43.2	40%	0.402	23%	0.23	S	C	.	.	H	α-helix	trans	-67.6	-39.2	176.6	-157.9	-138.2	-174.4	0	0	112.4	A344 F346 K352	A344-E348 WeakPolarHBondContact O-CB 3.39Å; A344-E348 PolarHBondContact O-N 3.16Å; F346-E348 VanDerWaalsContact C-N 3.3Å; F346-E348 PolarHBondContact O-N 3.04Å; E348-K352 VanDerWaalsContact CD-CE 3.41Å; E348-K352 WeakPolarHBondContact O-CD 3.42Å; E348-K352 VanDerWaalsContact O-CG 3.26Å; E348-K352 WeakPolarHBondContact O-CG 3.3Å; E348-K352 PolarHBondContact O-N 3.04Å; E348-K352 WeakPolarHBondContact OE1-CE 3.42Å; E348-K352 IonicContact OE1-NZ 2.74Å; E348-K352 PolarHBondContact OE1-NZ 3.13Å; E348-K352 IonicContact OE2-NZ 2.77Å; E348-K352 PolarHBondContact OE2-NZ 3.17Å
349	R	89.1	Confident	88	Confident	73 Å²	73	49.4 Å²	49.4	28%	0.275	26%	0.259	S	S	.	.	H	α-helix	trans	-64.5	-50.7	172.4	-81	172.9	53.8	-158.7	-6.6	112.2	H345 F346 S351 K352 V353 A428 E432	H345-R349 VanDerWaalsContact O-CB 3.31Å; H345-R349 WeakPolarHBondContact O-CB 3.23Å; H345-R349 VanDerWaalsContact O-CG 3.22Å; H345-R349 WeakPolarHBondContact O-CG 3.3Å; H345-R349 PolarHBondContact O-N 3.29Å; F346-R349 WeakPolarHBondContact O-CB 3.42Å; F346-R349 PolarHBondContact O-N 3.22Å; R349-S351 VanDerWaalsContact C-N 3.29Å; R349-S351 PolarHBondContact O-N 3.3Å; R349-K352 CarbonylContact O-C 3.51Å; R349-K352 WeakPolarHBondContact O-CA 3.11Å; R349-K352 WeakPolarHBondContact O-CB 3.42Å; R349-K352 PolarHBondContact O-N 2.99Å; R349-V353 WeakPolarHBondContact O-CG2 3.37Å; R349-V353 PolarHBondContact O-N 3.37Å; R349-A428 PolarHBondContact NH2-O 3.21Å; R349-A428 VanDerWaalsContact NH2-O 3.14Å; R349-E432 WeakPolarHBondContact CB-OE1 3.31Å; R349-E432 IonicContact CZ-OE1 3.69Å; R349-E432 IonicContact CZ-OE2 3.59Å; R349-E432 IonicContact NE-OE1 2.64Å; R349-E432 PolarHBondContact NE-OE1 3.42Å; R349-E432 IonicContact NE-OE2 3.18Å; R349-E432 PolarHBondContact NE-OE2 3.32Å; R349-E432 IonicContact NH1-OE1 2.68Å; R349-E432 IonicContact NH2-OE1 3.92Å; R349-E432 PolarHBondContact NH2-OE1 3.32Å; R349-E432 IonicContact NH2-OE2 2.72Å; R349-E432 PolarHBondContact NH2-OE2 2.65Å
350	L	88.8	Confident	86.6	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-57.5	-44.2	178.7	-179	63.3	0	0	0	110.4	W268 F346 K352 V353 V354 E432 V436 L451 L615	W268-L350 HydrophobicContact CH2-CD2 4.04Å; W268-L350 HydrophobicContact CZ3-CD2 4.06Å; F346-L350 HydrophobicContact CE1-CD2 4.43Å; F346-L350 HydrophobicContact CE2-CB 4.19Å; F346-L350 HydrophobicContact CE2-CD2 4.29Å; F346-L350 HydrophobicContact CZ-CD2 3.84Å; F346-L350 WeakPolarHBondContact O-CB 3.36Å; F346-L350 PolarHBondContact O-N 3.11Å; L350-K352 PolarHBondContact O-N 3.45Å; L350-V353 PolarHBondContact O-N 2.9Å; L350-V354 HydrophobicContact CD1-CG2 4.37Å; L350-V354 WeakPolarHBondContact O-CB 3.39Å; L350-V354 VanDerWaalsContact O-CG2 3.3Å; L350-V354 WeakPolarHBondContact O-CG2 3.45Å; L350-V354 PolarHBondContact O-N 3.29Å; L350-E432 HydrophobicContact CD1-CG 4.43Å; L350-V436 HydrophobicContact CD1-CG2 4.45Å; L350-L451 HydrophobicContact CB-CD1 4.48Å; L350-L451 HydrophobicContact CD2-CD1 4.04Å; L350-L451 HydrophobicContact CD2-CD2 4.2Å; L350-L451 HydrophobicContact CG-CD1 3.85Å; L350-L615 HydrophobicContact CD2-CD2 4.11Å
351	S	89.3	Confident	84.8	Confident	13 Å²	13	60.9 Å²	60.9	9%	0.091	30%	0.304	C	S	.	.	H	α-helix	trans	-56.9	-47.6	171.7	-179.7	0	0	0	0	111.9	L347 R349 V353 V354 H355	L347-S351 WeakPolarHBondContact O-CB 3.5Å; L347-S351 PolarHBondContact O-N 2.94Å; R349-S351 VanDerWaalsContact C-N 3.29Å; R349-S351 PolarHBondContact O-N 3.3Å; S351-V353 PolarHBondContact O-N 2.67Å; S351-V354 PolarHBondContact O-N 3.23Å; S351-H355 WeakPolarHBondContact O-CB 3.38Å; S351-H355 PolarHBondContact O-N 3Å; S351-H355 PolarHBondContact O-ND1 3.29Å; S351-H355 PolarHBondContact OG-CE1 3.18Å; S351-H355 PolarHBondContact OG-ND1 2.83Å
352	K	87.9	Confident	82.8	Confident	104 Å²	104	63.8 Å²	63.8	45%	0.452	32%	0.315	S	S	.	.	H	α-helix	trans	-61.3	-38.9	175.1	-72.1	163.8	-177.3	173.1	0	112.7	E348 R349 L350 S356	E348-K352 VanDerWaalsContact CD-CE 3.41Å; E348-K352 WeakPolarHBondContact O-CD 3.42Å; E348-K352 VanDerWaalsContact O-CG 3.26Å; E348-K352 WeakPolarHBondContact O-CG 3.3Å; E348-K352 PolarHBondContact O-N 3.04Å; E348-K352 WeakPolarHBondContact OE1-CE 3.42Å; E348-K352 IonicContact OE1-NZ 2.74Å; E348-K352 PolarHBondContact OE1-NZ 3.13Å; E348-K352 IonicContact OE2-NZ 2.77Å; E348-K352 PolarHBondContact OE2-NZ 3.17Å; R349-K352 CarbonylContact O-C 3.51Å; R349-K352 WeakPolarHBondContact O-CA 3.11Å; R349-K352 WeakPolarHBondContact O-CB 3.42Å; R349-K352 PolarHBondContact O-N 2.99Å; L350-K352 PolarHBondContact O-N 3.45Å; K352-S356 WeakPolarHBondContact O-CB 3.4Å; K352-S356 PolarHBondContact O-N 3Å; K352-S356 PolarHBondContact O-OG 3.43Å
353	V	87.1	Confident	80.3	Confident	26 Å²	26	67.6 Å²	67.6	16%	0.158	34%	0.34	C	S	.	.	H	α-helix	trans	-69.8	-42.5	179	175.8	0	0	0	0	111.1	R349 L350 S351 S356 A357 E432 V436	R349-V353 WeakPolarHBondContact O-CG2 3.37Å; R349-V353 PolarHBondContact O-N 3.37Å; L350-V353 PolarHBondContact O-N 2.9Å; S351-V353 PolarHBondContact O-N 2.67Å; V353-S356 PolarHBondContact O-N 3.12Å; V353-A357 WeakPolarHBondContact O-CB 3.47Å; V353-A357 PolarHBondContact O-N 2.88Å; V353-E432 HydrophobicContact CG1-CB 4.43Å; V353-E432 HydrophobicContact CG2-CB 4.42Å; V353-V436 HydrophobicContact CG1-CB 4.45Å; V353-V436 HydrophobicContact CG1-CG2 4.1Å
354	V	86.6	Confident	77.7	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-62.6	-50.8	175.3	172.3	0	0	0	0	110.8	L350 S351 S356 A357 L358 V436 L444 M447 L451	L350-V354 HydrophobicContact CD1-CG2 4.37Å; L350-V354 WeakPolarHBondContact O-CB 3.39Å; L350-V354 VanDerWaalsContact O-CG2 3.3Å; L350-V354 WeakPolarHBondContact O-CG2 3.45Å; L350-V354 PolarHBondContact O-N 3.29Å; S351-V354 PolarHBondContact O-N 3.23Å; V354-S356 VanDerWaalsContact C-N 3.29Å; V354-S356 PolarHBondContact O-N 2.9Å; V354-A357 PolarHBondContact O-N 3.46Å; V354-L358 HydrophobicContact CG1-CD1 4.32Å; V354-L358 WeakPolarHBondContact O-CG 3.32Å; V354-L358 PolarHBondContact O-N 3.4Å; V354-L358 VanDerWaalsContact O-N 3.08Å; V354-V436 HydrophobicContact CG2-CG2 3.78Å; V354-L444 WeakPolarHBondContact CG1-O 3.29Å; V354-M447 HydrophobicContact CG2-CE 3.62Å; V354-M447 HydrophobicContact CG2-CG 4.2Å; V354-M447 HydrophobicContact CG2-SD 3.86Å; V354-L451 HydrophobicContact CG2-CD1 4.39Å
355	H	84.4	Confident	75.5	Confident	64 Å²	64	79 Å²	79	30%	0.296	41%	0.407	S	S	.	.	H	α-helix	trans	-60.7	-37.3	174.6	-74.6	95.1	0	0	0	112.3	S351 L358 Q359 S448	S351-H355 WeakPolarHBondContact O-CB 3.38Å; S351-H355 PolarHBondContact O-N 3Å; S351-H355 PolarHBondContact O-ND1 3.29Å; S351-H355 PolarHBondContact OG-CE1 3.18Å; S351-H355 PolarHBondContact OG-ND1 2.83Å; H355-L358 PolarHBondContact O-N 3.5Å; H355-Q359 WeakPolarHBondContact O-CG 3.41Å; H355-Q359 PolarHBondContact O-N 2.9Å; H355-S448 PolarHBondContact CE1-OG 3.14Å; H355-S448 PolarHBondContact NE2-OG 3.01Å
356	S	84	Confident	72.9	Confident	50 Å²	50	84.9 Å²	84.9	35%	0.35	42%	0.424	S	S	.	.	H	α-helix	trans	-71.1	-31.7	176.7	-63	0	0	0	0	112.9	K352 V353 V354 Q359 R360	K352-S356 WeakPolarHBondContact O-CB 3.4Å; K352-S356 PolarHBondContact O-N 3Å; K352-S356 PolarHBondContact O-OG 3.43Å; V353-S356 PolarHBondContact O-N 3.12Å; V354-S356 VanDerWaalsContact C-N 3.29Å; V354-S356 PolarHBondContact O-N 2.9Å; S356-Q359 PolarHBondContact O-N 3.46Å; S356-R360 WeakPolarHBondContact O-CB 3.26Å; S356-R360 PolarHBondContact O-N 3.21Å
357	A	81.9	Confident	70.5	Confident	28 Å²	28	94 Å²	94	23%	0.231	46%	0.459	C	S	.	.	H	α-helix	trans	-68.3	-38.3	173.7	0	0	0	0	0	110.9	V353 V354 Q359 V436	V353-A357 WeakPolarHBondContact O-CB 3.47Å; V353-A357 PolarHBondContact O-N 2.88Å; V354-A357 PolarHBondContact O-N 3.46Å; A357-Q359 PolarHBondContact O-N 3.48Å; A357-V436 HydrophobicContact CB-CG1 3.5Å
358	L	80.5	Confident	67.9	Low	62 Å²	62	100.7 Å²	100.7	33%	0.325	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-5.1	171.9	-64.6	169.1	0	0	0	114.2	V354 H355 V441 L444 R445	V354-L358 HydrophobicContact CG1-CD1 4.32Å; V354-L358 WeakPolarHBondContact O-CG 3.32Å; V354-L358 PolarHBondContact O-N 3.4Å; V354-L358 VanDerWaalsContact O-N 3.08Å; H355-L358 PolarHBondContact O-N 3.5Å; L358-V441 HydrophobicContact CD2-CG1 4.21Å; L358-L444 HydrophobicContact CD2-CB 4.41Å; L358-R445 HydrophobicContact CD2-CG 4.48Å
359	Q	74.8	Confident	65.2	Low	131 Å²	131	99.7 Å²	99.7	61%	0.612	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-118.3	-18.8	178.4	-71.1	174.9	27.6	0	0	114.3	H355 S356 A357 E361 D362	H355-Q359 WeakPolarHBondContact O-CG 3.41Å; H355-Q359 PolarHBondContact O-N 2.9Å; S356-Q359 PolarHBondContact O-N 3.46Å; A357-Q359 PolarHBondContact O-N 3.48Å; Q359-E361 PolarHBondContact O-N 3Å; Q359-E361 VanDerWaalsContact O-N 3.17Å; Q359-D362 PolarHBondContact O-N 3.14Å
360	R	63.1	Low	62.8	Low	180 Å²	180	102.1 Å²	102.1	68%	0.679	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.7	-5.6	-169.5	-131.7	179.5	-62	-170	3.2	114.9	S356 D362	S356-R360 WeakPolarHBondContact O-CB 3.26Å; S356-R360 PolarHBondContact O-N 3.21Å; R360-D362 VanDerWaalsContact C-N 3.27Å; R360-D362 PolarHBondContact O-N 3Å
361	E	54.2	Low	60.3	Low	177 Å²	177	110.3 Å²	110.3	83%	0.827	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-12.3	178.9	-59.9	-173.1	111.4	0	0	112.9	Q359	Q359-E361 PolarHBondContact O-N 3Å; Q359-E361 VanDerWaalsContact O-N 3.17Å
362	D	48.1	Very low	58.7	Low	146 Å²	146	114.5 Å²	114.5	78%	0.781	60%	0.596	S	S	*	*	S	Bend	trans	-96.5	-14	-167.2	-88.6	-34.3	0	0	0	118	Q359 R360	Q359-D362 PolarHBondContact O-N 3.14Å; R360-D362 VanDerWaalsContact C-N 3.27Å; R360-D362 PolarHBondContact O-N 3Å
363	C	39.2	Very low	56.3	Low	130 Å²	130	116.3 Å²	116.3	88%	0.878	61%	0.611	S	S	*	*			trans	-152	153	-168.4	-88.3	0	0	0	0	117
364	G	38.4	Very low	53.9	Low	68 Å²	68	120.8 Å²	120.8	70%	0.701	64%	0.643	S	S	*	*			trans	-171.5	142.2	172.3	0	0	0	0	0	121.5
365	H	44.2	Very low	51.9	Low	197 Å²	197	127 Å²	127	91%	0.912	68%	0.681	S	S	*	*			trans	62	122.6	144.1	-72.3	83.3	0	0	0	125
366	R	36.3	Very low	49.6	Very low	245 Å²	245	133.3 Å²	133.3	93%	0.925	71%	0.71	S	S	*	*				-172.6	-178.6	116.3	-115	-174.7	-179.6	-92	-2.2	116.9
367	R	40.4	Very low	47.7	Very low	194 Å²	194	139.5 Å²	139.5	73%	0.732	73%	0.733	S	S	*	*			trans	-157.8	170.6	-163.2	-133.1	177.2	178.2	-141.2	9	109.1
368	E	37.5	Very low	45.9	Very low	140 Å²	140	144.2 Å²	144.2	65%	0.654	77%	0.765	S	S	*	*			cis	-170.6	157.2	15.6	-172.3	140.5	-145.4	0	0	114
369	G	33.3	Very low	44.3	Very low	65 Å²	65	147.6 Å²	147.6	67%	0.67	78%	0.783	S	S	*	*			trans	80.1	169.8	152.9	0	0	0	0	0	120.7
370	S	38	Very low	43.3	Very low	124 Å²	124	143 Å²	143	87%	0.867	77%	0.765	S	S	*	*			cis	-169.6	160.8	-20	-84.3	0	0	0	0	113.7
371	E	38	Very low	42.6	Very low	172 Å²	172	141 Å²	141	80%	0.804	77%	0.772	S	S	*	*			trans	-42.8	-173.4	166.2	-74.3	-69.1	143.1	0	0	119.8
372	P	54.8	Low	42.6	Very low	101 Å²	101	139.1 Å²	139.1	66%	0.656	76%	0.764	S	S	*	*			cis	-143.7	-172.8	-9.5	31	-5.6	0	0	0	118.3
373	D	36.8	Very low	42.9	Very low	143 Å²	143	138.6 Å²	138.6	77%	0.765	75%	0.751	S	S	*	*			trans	64.2	142.1	134.9	-91.6	-29.3	0	0	0	128.3
374	S	37.6	Very low	43.9	Very low	119 Å²	119	141.4 Å²	141.4	83%	0.832	74%	0.743	S	S	*	*				175.2	154.7	125.4	-76.5	0	0	0	0	114.8
375	V	43.3	Very low	45.3	Very low	131 Å²	131	143.5 Å²	143.5	79%	0.794	74%	0.738	S	S	*	*			trans	-147	151.7	-173.1	175.6	0	0	0	0	112.7
376	E	37.3	Very low	46.3	Very low	196 Å²	196	138.5 Å²	138.5	92%	0.916	71%	0.711	S	S	*	*			trans	-153.3	174.2	159.1	-133.5	174.7	-172.6	0	0	115
377	Q	44.2	Very low	48.2	Very low	180 Å²	180	131 Å²	131	84%	0.841	69%	0.689	S	S	*	*			trans	-128.3	-167.7	-157.3	-65.6	-174	-26.3	0	0	116.4
378	S	44.1	Very low	50.1	Low	127 Å²	127	125.7 Å²	125.7	89%	0.888	68%	0.675	S	S	*	*			trans	-157.6	172.5	-176.6	-77.7	0	0	0	0	115.7
379	D	46.2	Very low	52.3	Low	134 Å²	134	125.9 Å²	125.9	72%	0.717	68%	0.675	S	S	*	*			trans	-109.2	-176.7	-148.5	-134	24.7	0	0	0	116.2	R386	D379-R386 PolarHBondContact O-NH2 3.07Å
380	P	54.3	Low	54.7	Low	35 Å²	35	127 Å²	127	23%	0.227	66%	0.663	C	S	.	*				-149.7	64.1	-118.7	47.1	-21.6	0	0	0	116.4	R383	P380-R383 HydrophobicContact CB-CB 4.04Å; P380-R383 HydrophobicContact CB-CG 4.34Å; P380-R383 WeakPolarHBondContact O-CB 3.37Å; P380-R383 WeakPolarHBondContact O-CD 3.33Å
381	T	49.3	Very low	57	Low	136 Å²	136	125.9 Å²	125.9	83%	0.834	64%	0.643	S	S	*	*	S	Bend	trans	-131.5	-20.2	173.6	42.2	0	0	0	0	115.5	R383	T381-R383 PolarHBondContact O-N 2.9Å; T381-R383 VanDerWaalsContact O-N 3.16Å
382	Q	53.7	Low	59.4	Low	138 Å²	138	122.9 Å²	122.9	65%	0.645	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.3	-20.8	140.9	-107.8	177.8	-56.4	0	0	110.9	R384 D385 R386	Q382-R384 PolarHBondContact O-N 3.44Å; Q382-D385 PolarHBondContact O-N 3.24Å; Q382-R386 HydrophobicContact CB-CG 4.18Å; Q382-R386 VanDerWaalsContact O-CB 3.27Å; Q382-R386 WeakPolarHBondContact O-CB 3.4Å; Q382-R386 PolarHBondContact O-N 2.96Å
383	R	53.6	Low	61.2	Low	136 Å²	136	122.3 Å²	122.3	51%	0.513	62%	0.617	S	S	.	*	H	α-helix	trans	-41.5	-31.1	178.4	-177.8	-171.1	-122	152.3	0.9	116	P380 T381 L387	P380-R383 HydrophobicContact CB-CB 4.04Å; P380-R383 HydrophobicContact CB-CG 4.34Å; P380-R383 WeakPolarHBondContact O-CB 3.37Å; P380-R383 WeakPolarHBondContact O-CD 3.33Å; T381-R383 PolarHBondContact O-N 2.9Å; T381-R383 VanDerWaalsContact O-N 3.16Å; R383-L387 HydrophobicContact CG-CD1 3.66Å; R383-L387 HydrophobicContact CG-CG 3.92Å; R383-L387 WeakPolarHBondContact O-CA 3.39Å; R383-L387 WeakPolarHBondContact O-CB 3.44Å; R383-L387 WeakPolarHBondContact O-CD1 3.41Å; R383-L387 WeakPolarHBondContact O-CG 3.49Å; R383-L387 PolarHBondContact O-N 2.79Å
384	R	61.2	Low	63.9	Low	188 Å²	188	119 Å²	119	71%	0.709	60%	0.602	S	S	*	*	H	α-helix	trans	-72	-53.8	-179.4	-175.2	178.1	171.3	96.6	4.9	111.5	Q382 L387 I388	Q382-R384 PolarHBondContact O-N 3.44Å; R384-L387 PolarHBondContact O-N 3.18Å; R384-I388 PolarHBondContact O-N 2.87Å
385	D	66.7	Low	66.4	Low	112 Å²	112	117.1 Å²	117.1	60%	0.599	58%	0.58	S	S	*	*	H	α-helix	trans	-82.9	-25	-177.1	-50.1	-45.4	0	0	0	110.6	Q382 I388 Q389	Q382-D385 PolarHBondContact O-N 3.24Å; D385-I388 PolarHBondContact O-N 2.82Å; D385-Q389 WeakPolarHBondContact O-CB 3.48Å; D385-Q389 PolarHBondContact O-N 3.18Å
386	R	66.4	Low	68.8	Low	92 Å²	92	115.1 Å²	115.1	35%	0.347	56%	0.562	S	S	.	*	H	α-helix	trans	-51.8	-63.6	153.2	-87.1	-157.4	-78.4	-101.7	9.1	109.5	D379 Q382 I388 Q389 E390	D379-R386 PolarHBondContact O-NH2 3.07Å; Q382-R386 HydrophobicContact CB-CG 4.18Å; Q382-R386 VanDerWaalsContact O-CB 3.27Å; Q382-R386 WeakPolarHBondContact O-CB 3.4Å; Q382-R386 PolarHBondContact O-N 2.96Å; R386-I388 CarbonylContact O-C 3.6Å; R386-I388 PolarHBondContact O-N 3.44Å; R386-Q389 CarbonylContact O-C 3.54Å; R386-Q389 WeakPolarHBondContact O-CA 3.27Å; R386-Q389 PolarHBondContact O-N 3.37Å; R386-E390 WeakPolarHBondContact O-CA 3.26Å; R386-E390 WeakPolarHBondContact O-CB 3.43Å; R386-E390 PolarHBondContact O-N 3.36Å
387	L	76.2	Confident	71.5	Confident	88 Å²	88	109.5 Å²	109.5	46%	0.461	54%	0.535	S	S	.	.	H	α-helix	trans	-52.9	-21	-177.3	-83.3	171.5	0	0	0	115.2	R383 R384 E390 K391	R383-L387 HydrophobicContact CG-CD1 3.66Å; R383-L387 HydrophobicContact CG-CG 3.92Å; R383-L387 WeakPolarHBondContact O-CA 3.39Å; R383-L387 WeakPolarHBondContact O-CB 3.44Å; R383-L387 WeakPolarHBondContact O-CD1 3.41Å; R383-L387 WeakPolarHBondContact O-CG 3.49Å; R383-L387 PolarHBondContact O-N 2.79Å; R384-L387 PolarHBondContact O-N 3.18Å; L387-E390 PolarHBondContact N-OE2 3.42Å; L387-K391 WeakPolarHBondContact O-CB 3.37Å; L387-K391 PolarHBondContact O-N 3.36Å
388	I	80.8	Confident	73.8	Confident	83 Å²	83	104.6 Å²	104.6	43%	0.426	51%	0.514	S	S	.	.	H	α-helix	trans	-84.5	-48.2	172	-63	171	0	0	0	111.1	R384 D385 R386 E390 K391 H392	R384-I388 PolarHBondContact O-N 2.87Å; D385-I388 PolarHBondContact O-N 2.82Å; R386-I388 CarbonylContact O-C 3.6Å; R386-I388 PolarHBondContact O-N 3.44Å; I388-E390 VanDerWaalsContact C-N 3.31Å; I388-E390 PolarHBondContact O-N 2.94Å; I388-K391 WeakPolarHBondContact O-CB 3.23Å; I388-K391 PolarHBondContact O-N 3.19Å; I388-H392 PolarHBondContact O-CD2 3.02Å; I388-H392 PolarHBondContact O-N 2.93Å
389	Q	82.2	Confident	76.2	Confident	144 Å²	144	104.7 Å²	104.7	67%	0.673	50%	0.501	S	S	*	.	H	α-helix	trans	-65.1	-35.1	174	-171.3	175.3	15.7	0	0	112.4	D385 R386 H392 Q393	D385-Q389 WeakPolarHBondContact O-CB 3.48Å; D385-Q389 PolarHBondContact O-N 3.18Å; R386-Q389 CarbonylContact O-C 3.54Å; R386-Q389 WeakPolarHBondContact O-CA 3.27Å; R386-Q389 PolarHBondContact O-N 3.37Å; Q389-H392 PolarHBondContact O-N 2.79Å; Q389-Q393 VanDerWaalsContact O-CB 3.31Å; Q389-Q393 WeakPolarHBondContact O-CB 3.36Å; Q389-Q393 PolarHBondContact O-N 2.65Å
390	E	83.6	Confident	78.6	Confident	88 Å²	88	102.6 Å²	102.6	41%	0.411	49%	0.485	S	S	.	.	H	α-helix	trans	-74.8	-33.3	174.5	-178.7	-174.6	171.6	0	0	110.6	R386 L387 I388 V394	R386-E390 WeakPolarHBondContact O-CA 3.26Å; R386-E390 WeakPolarHBondContact O-CB 3.43Å; R386-E390 PolarHBondContact O-N 3.36Å; L387-E390 PolarHBondContact N-OE2 3.42Å; I388-E390 VanDerWaalsContact C-N 3.31Å; I388-E390 PolarHBondContact O-N 2.94Å; E390-V394 WeakPolarHBondContact O-CB 3.38Å; E390-V394 WeakPolarHBondContact O-CG2 3.27Å; E390-V394 PolarHBondContact O-N 3.45Å
391	K	86.9	Confident	80.6	Confident	101 Å²	101	106 Å²	106	44%	0.439	50%	0.501	S	S	.	.	H	α-helix	trans	-61.8	-48.2	165.1	170.3	-172.3	169.6	-69.5	0	110.1	L387 I388 V394 E395	L387-K391 WeakPolarHBondContact O-CB 3.37Å; L387-K391 PolarHBondContact O-N 3.36Å; I388-K391 WeakPolarHBondContact O-CB 3.23Å; I388-K391 PolarHBondContact O-N 3.19Å; K391-V394 CarbonylContact O-C 3.49Å; K391-V394 PolarHBondContact O-N 3.08Å; K391-E395 VanDerWaalsContact CE-OE1 3.31Å; K391-E395 WeakPolarHBondContact CE-OE1 3.31Å; K391-E395 IonicContact NZ-OE1 3.23Å; K391-E395 PolarHBondContact NZ-OE1 2.74Å; K391-E395 IonicContact NZ-OE2 2.6Å; K391-E395 PolarHBondContact NZ-OE2 3.04Å; K391-E395 WeakPolarHBondContact O-CG 3.22Å; K391-E395 PolarHBondContact O-N 2.85Å
392	H	89.4	Confident	82.8	Confident	108 Å²	108	105.4 Å²	105.4	50%	0.5	49%	0.489	S	S	.	.	H	α-helix	trans	-67	-38	178.2	-72.7	-48.7	0	0	0	112.2	I388 Q389 V394 E395 E396	I388-H392 PolarHBondContact O-CD2 3.02Å; I388-H392 PolarHBondContact O-N 2.93Å; Q389-H392 PolarHBondContact O-N 2.79Å; H392-V394 VanDerWaalsContact C-N 3.31Å; H392-V394 PolarHBondContact O-N 3Å; H392-E395 IonicContact CE1-OE2 2.71Å; H392-E395 IonicContact CG-OE2 2.81Å; H392-E395 IonicContact ND1-OE2 3.19Å; H392-E395 PolarHBondContact ND1-OE2 3.17Å; H392-E395 PolarHBondContact O-N 3.29Å; H392-E396 PolarHBondContact O-N 3.1Å
393	Q	92.3	Very high	84.8	Confident	89 Å²	89	102.8 Å²	102.8	42%	0.416	48%	0.482	S	S	.	.	H	α-helix	trans	-62.2	-39.3	170.6	-166.6	64.7	76.1	0	0	111.1	Q389 E396 E397	Q389-Q393 VanDerWaalsContact O-CB 3.31Å; Q389-Q393 WeakPolarHBondContact O-CB 3.36Å; Q389-Q393 PolarHBondContact O-N 2.65Å; Q393-E396 PolarHBondContact NE2-OE2 3.43Å; Q393-E396 PolarHBondContact O-N 3.07Å; Q393-E397 VanDerWaalsContact O-CB 3.31Å; Q393-E397 WeakPolarHBondContact O-CB 3.17Å; Q393-E397 VanDerWaalsContact O-CG 3.25Å; Q393-E397 WeakPolarHBondContact O-CG 3.44Å; Q393-E397 PolarHBondContact O-N 3.02Å
394	V	91.8	Very high	86.8	Confident	74 Å²	74	102.7 Å²	102.7	45%	0.448	48%	0.482	S	S	.	.	H	α-helix	trans	-71	-31.1	175.2	163	0	0	0	0	111.6	E390 K391 H392 I398	E390-V394 WeakPolarHBondContact O-CB 3.38Å; E390-V394 WeakPolarHBondContact O-CG2 3.27Å; E390-V394 PolarHBondContact O-N 3.45Å; K391-V394 CarbonylContact O-C 3.49Å; K391-V394 PolarHBondContact O-N 3.08Å; H392-V394 VanDerWaalsContact C-N 3.31Å; H392-V394 PolarHBondContact O-N 3Å; V394-I398 HydrophobicContact CG1-CD1 3.7Å; V394-I398 HydrophobicContact CG1-CG1 4.29Å; V394-I398 WeakPolarHBondContact O-CB 3.31Å; V394-I398 WeakPolarHBondContact O-CD1 3.34Å; V394-I398 WeakPolarHBondContact O-CG1 3.35Å; V394-I398 PolarHBondContact O-N 3.38Å
395	E	91	Very high	88.5	Confident	79 Å²	79	98 Å²	98	37%	0.369	47%	0.471	S	S	.	.	H	α-helix	trans	-67.3	-46	170.8	-74.4	166.9	147.8	0	0	110.6	K391 H392 I398 E399	K391-E395 VanDerWaalsContact CE-OE1 3.31Å; K391-E395 WeakPolarHBondContact CE-OE1 3.31Å; K391-E395 IonicContact NZ-OE1 3.23Å; K391-E395 PolarHBondContact NZ-OE1 2.74Å; K391-E395 IonicContact NZ-OE2 2.6Å; K391-E395 PolarHBondContact NZ-OE2 3.04Å; K391-E395 WeakPolarHBondContact O-CG 3.22Å; K391-E395 PolarHBondContact O-N 2.85Å; H392-E395 IonicContact CE1-OE2 2.71Å; H392-E395 IonicContact CG-OE2 2.81Å; H392-E395 IonicContact ND1-OE2 3.19Å; H392-E395 PolarHBondContact ND1-OE2 3.17Å; H392-E395 PolarHBondContact O-N 3.29Å; E395-I398 WeakPolarHBondContact O-CB 3.32Å; E395-I398 PolarHBondContact O-N 3.39Å; E395-E399 PolarHBondContact O-N 3.28Å
396	E	93.5	Very high	89.9	Confident	89 Å²	89	94.9 Å²	94.9	42%	0.416	46%	0.46	S	S	.	.	H	α-helix	trans	-63	-43.5	174	-160.2	-154.1	156.8	0	0	112.1	H392 Q393 I398 E399 K400	H392-E396 PolarHBondContact O-N 3.1Å; Q393-E396 PolarHBondContact NE2-OE2 3.43Å; Q393-E396 PolarHBondContact O-N 3.07Å; E396-I398 VanDerWaalsContact C-N 3.33Å; E396-E399 PolarHBondContact O-N 2.87Å; E396-K400 VanDerWaalsContact O-CG 3.3Å; E396-K400 WeakPolarHBondContact O-CG 3.48Å; E396-K400 PolarHBondContact O-N 3.13Å; E396-K400 WeakPolarHBondContact OE1-CE 3.49Å; E396-K400 IonicContact OE1-NZ 3.85Å; E396-K400 PolarHBondContact OE1-NZ 2.87Å; E396-K400 IonicContact OE2-NZ 2.7Å; E396-K400 PolarHBondContact OE2-NZ 2.99Å
397	E	95.3	Very high	91.4	Very high	78 Å²	78	95 Å²	95	36%	0.364	47%	0.465	S	S	.	.	H	α-helix	trans	-67.4	-31.5	173.3	-70.7	-47.9	124.5	0	0	111.7	Q393 K400 L401	Q393-E397 VanDerWaalsContact O-CB 3.31Å; Q393-E397 WeakPolarHBondContact O-CB 3.17Å; Q393-E397 VanDerWaalsContact O-CG 3.25Å; Q393-E397 WeakPolarHBondContact O-CG 3.44Å; Q393-E397 PolarHBondContact O-N 3.02Å; E397-K400 VanDerWaalsContact OE1-CD 3.25Å; E397-K400 WeakPolarHBondContact OE1-CD 3.3Å; E397-K400 IonicContact OE1-NZ 3.95Å; E397-K400 PolarHBondContact OE1-NZ 3.28Å; E397-L401 WeakPolarHBondContact O-CB 3.42Å; E397-L401 WeakPolarHBondContact O-CD1 3.44Å; E397-L401 WeakPolarHBondContact O-CG 3.41Å; E397-L401 PolarHBondContact O-N 3.1Å
398	I	91.8	Very high	92.4	Very high	78 Å²	78	95 Å²	95	40%	0.4	47%	0.465	S	S	.	.	H	α-helix	trans	-66.8	-40.1	171.8	-80.6	165.2	0	0	0	110.3	V394 E395 E396 L401 Q402	V394-I398 HydrophobicContact CG1-CD1 3.7Å; V394-I398 HydrophobicContact CG1-CG1 4.29Å; V394-I398 WeakPolarHBondContact O-CB 3.31Å; V394-I398 WeakPolarHBondContact O-CD1 3.34Å; V394-I398 WeakPolarHBondContact O-CG1 3.35Å; V394-I398 PolarHBondContact O-N 3.38Å; E395-I398 WeakPolarHBondContact O-CB 3.32Å; E395-I398 PolarHBondContact O-N 3.39Å; E396-I398 VanDerWaalsContact C-N 3.33Å; I398-L401 PolarHBondContact O-N 3.2Å; I398-Q402 HydrophobicContact CG2-CG 4.41Å; I398-Q402 WeakPolarHBondContact O-CB 3.47Å; I398-Q402 WeakPolarHBondContact O-CG 3.22Å; I398-Q402 PolarHBondContact O-N 3.24Å
399	E	94.8	Very high	93.2	Very high	129 Å²	129	97 Å²	97	60%	0.603	47%	0.47	S	S	*	.	H	α-helix	trans	-68.1	-41.5	175.3	-72.1	179.1	-176.1	0	0	111.9	E395 E396 Q402 T403	E395-E399 PolarHBondContact O-N 3.28Å; E396-E399 PolarHBondContact O-N 2.87Å; E399-Q402 PolarHBondContact O-N 3.21Å; E399-T403 WeakPolarHBondContact O-CB 3.31Å; E399-T403 PolarHBondContact O-N 3.15Å; E399-T403 PolarHBondContact O-OG1 2.89Å
400	K	95.6	Very high	93.8	Very high	89 Å²	89	93.8 Å²	93.8	39%	0.387	46%	0.458	S	S	.	.	H	α-helix	trans	-60.6	-43	170	-69.7	165.5	-170.7	167.3	0	111.7	E396 E397 T403 R404	E396-K400 VanDerWaalsContact O-CG 3.3Å; E396-K400 WeakPolarHBondContact O-CG 3.48Å; E396-K400 PolarHBondContact O-N 3.13Å; E396-K400 WeakPolarHBondContact OE1-CE 3.49Å; E396-K400 IonicContact OE1-NZ 3.85Å; E396-K400 PolarHBondContact OE1-NZ 2.87Å; E396-K400 IonicContact OE2-NZ 2.7Å; E396-K400 PolarHBondContact OE2-NZ 2.99Å; E397-K400 VanDerWaalsContact OE1-CD 3.25Å; E397-K400 WeakPolarHBondContact OE1-CD 3.3Å; E397-K400 IonicContact OE1-NZ 3.95Å; E397-K400 PolarHBondContact OE1-NZ 3.28Å; K400-T403 PolarHBondContact O-N 3.21Å; K400-R404 VanDerWaalsContact O-CB 3.23Å; K400-R404 WeakPolarHBondContact O-CB 3.47Å; K400-R404 PolarHBondContact O-N 3.43Å
401	L	96.1	Very high	94.5	Very high	108 Å²	108	97.2 Å²	97.2	57%	0.565	47%	0.467	S	S	*	.	H	α-helix	trans	-71.3	-33.3	178.3	-75.2	168.1	0	0	0	112.4	E397 I398 R404 L405	E397-L401 WeakPolarHBondContact O-CB 3.42Å; E397-L401 WeakPolarHBondContact O-CD1 3.44Å; E397-L401 WeakPolarHBondContact O-CG 3.41Å; E397-L401 PolarHBondContact O-N 3.1Å; I398-L401 PolarHBondContact O-N 3.2Å; L401-R404 PolarHBondContact O-N 3.26Å; L401-L405 WeakPolarHBondContact O-CB 3.41Å; L401-L405 PolarHBondContact O-N 3.45Å
402	Q	95.6	Very high	94.9	Very high	122 Å²	122	94.9 Å²	94.9	57%	0.57	46%	0.463	S	S	*	.	H	α-helix	trans	-66.1	-46.1	171.1	-77.4	177	39.3	0	0	110.8	I398 E399 R404 L405 A406	I398-Q402 HydrophobicContact CG2-CG 4.41Å; I398-Q402 WeakPolarHBondContact O-CB 3.47Å; I398-Q402 WeakPolarHBondContact O-CG 3.22Å; I398-Q402 PolarHBondContact O-N 3.24Å; E399-Q402 PolarHBondContact O-N 3.21Å; Q402-R404 VanDerWaalsContact C-N 3.32Å; Q402-R404 PolarHBondContact O-N 3.1Å; Q402-L405 PolarHBondContact O-N 3.43Å; Q402-A406 PolarHBondContact O-N 3.35Å
403	T	95.1	Very high	95.3	Very high	83 Å²	83	97 Å²	97	51%	0.509	47%	0.467	S	S	.	.	H	α-helix	trans	-59.5	-43.7	173.6	-56.6	0	0	0	0	110.9	E399 K400 A406 Q407	E399-T403 WeakPolarHBondContact O-CB 3.31Å; E399-T403 PolarHBondContact O-N 3.15Å; E399-T403 PolarHBondContact O-OG1 2.89Å; K400-T403 PolarHBondContact O-N 3.21Å; T403-A406 WeakPolarHBondContact O-CB 3.26Å; T403-A406 PolarHBondContact O-N 3.47Å; T403-Q407 WeakPolarHBondContact O-CG 3.14Å; T403-Q407 PolarHBondContact O-N 2.98Å
404	R	97.1	Very high	95.5	Very high	135 Å²	135	98 Å²	98	51%	0.509	47%	0.468	S	S	.	.	H	α-helix	trans	-68.7	-35.1	177	-171	53.4	167.2	-173.1	-4.4	112.4	K400 L401 Q402 Q407 L408	K400-R404 VanDerWaalsContact O-CB 3.23Å; K400-R404 WeakPolarHBondContact O-CB 3.47Å; K400-R404 PolarHBondContact O-N 3.43Å; L401-R404 PolarHBondContact O-N 3.26Å; Q402-R404 VanDerWaalsContact C-N 3.32Å; Q402-R404 PolarHBondContact O-N 3.1Å; R404-Q407 VanDerWaalsContact CD-OE1 3.31Å; R404-Q407 PolarHBondContact O-N 3.41Å; R404-L408 HydrophobicContact CG-CD1 4.08Å; R404-L408 HydrophobicContact CG-CG 4.47Å; R404-L408 VanDerWaalsContact O-CB 3.32Å; R404-L408 WeakPolarHBondContact O-CB 3.33Å; R404-L408 WeakPolarHBondContact O-CG 3.37Å; R404-L408 PolarHBondContact O-N 3.03Å
405	L	97.2	Very high	95.7	Very high	90 Å²	90	98 Å²	98	47%	0.471	47%	0.465	S	S	.	.	H	α-helix	trans	-67.9	-35.1	174.4	179.4	62.6	0	0	0	111.5	L401 Q402 L408 K409	L401-L405 WeakPolarHBondContact O-CB 3.41Å; L401-L405 PolarHBondContact O-N 3.45Å; Q402-L405 PolarHBondContact O-N 3.43Å; L405-L408 PolarHBondContact O-N 2.92Å; L405-K409 HydrophobicContact CD1-CG 4.5Å; L405-K409 HydrophobicContact CG-CD 4.42Å; L405-K409 WeakPolarHBondContact O-CB 3.49Å; L405-K409 VanDerWaalsContact O-CG 3.27Å; L405-K409 WeakPolarHBondContact O-CG 3.4Å; L405-K409 PolarHBondContact O-N 2.82Å
406	A	95.7	Very high	95.9	Very high	46 Å²	46	99.1 Å²	99.1	38%	0.38	47%	0.47	S	S	.	.	H	α-helix	trans	-62.6	-54.6	170.4	0	0	0	0	0	110.6	Q402 T403 L408 K409 D410	Q402-A406 PolarHBondContact O-N 3.35Å; T403-A406 WeakPolarHBondContact O-CB 3.26Å; T403-A406 PolarHBondContact O-N 3.47Å; A406-L408 PolarHBondContact O-N 3.21Å; A406-K409 WeakPolarHBondContact O-CB 3.43Å; A406-K409 PolarHBondContact O-N 3.31Å; A406-D410 PolarHBondContact O-N 2.86Å
407	Q	97.3	Very high	95.9	Very high	95 Å²	95	101 Å²	101	44%	0.444	48%	0.479	S	S	.	.	H	α-helix	trans	-53.6	-38.8	175	-67.7	171.8	5.1	0	0	113	T403 R404 R411	T403-Q407 WeakPolarHBondContact O-CG 3.14Å; T403-Q407 PolarHBondContact O-N 2.98Å; R404-Q407 VanDerWaalsContact CD-OE1 3.31Å; R404-Q407 PolarHBondContact O-N 3.41Å; Q407-R411 VanDerWaalsContact O-CB 3.28Å; Q407-R411 WeakPolarHBondContact O-CB 3.24Å; Q407-R411 PolarHBondContact O-N 3.24Å
408	L	97.3	Very high	95.9	Very high	87 Å²	87	100.3 Å²	100.3	46%	0.455	48%	0.477	S	S	.	.	H	α-helix	trans	-74.4	-33	178.1	-74.1	171	0	0	0	112.8	R404 L405 A406 S412	R404-L408 HydrophobicContact CG-CD1 4.08Å; R404-L408 HydrophobicContact CG-CG 4.47Å; R404-L408 VanDerWaalsContact O-CB 3.32Å; R404-L408 WeakPolarHBondContact O-CB 3.33Å; R404-L408 WeakPolarHBondContact O-CG 3.37Å; R404-L408 PolarHBondContact O-N 3.03Å; L405-L408 PolarHBondContact O-N 2.92Å; A406-L408 PolarHBondContact O-N 3.21Å; L408-S412 WeakPolarHBondContact O-CB 3.45Å; L408-S412 PolarHBondContact O-N 2.98Å
409	K	96.8	Very high	95.9	Very high	125 Å²	125	101 Å²	101	54%	0.543	48%	0.481	S	S	.	.	H	α-helix	trans	-68	-40.9	171.1	-77.6	171.3	177.5	179.8	0	111.8	L405 A406 R411 S412 R413	L405-K409 HydrophobicContact CD1-CG 4.5Å; L405-K409 HydrophobicContact CG-CD 4.42Å; L405-K409 WeakPolarHBondContact O-CB 3.49Å; L405-K409 VanDerWaalsContact O-CG 3.27Å; L405-K409 WeakPolarHBondContact O-CG 3.4Å; L405-K409 PolarHBondContact O-N 2.82Å; A406-K409 WeakPolarHBondContact O-CB 3.43Å; A406-K409 PolarHBondContact O-N 3.31Å; K409-R411 VanDerWaalsContact C-N 3.35Å; K409-S412 WeakPolarHBondContact O-CB 3.28Å; K409-S412 PolarHBondContact O-N 3.44Å; K409-S412 VanDerWaalsContact O-N 3.16Å; K409-R413 WeakPolarHBondContact O-CG 3.3Å; K409-R413 PolarHBondContact O-N 3.31Å
410	D	96.5	Very high	95.7	Very high	77 Å²	77	100.4 Å²	100.4	41%	0.412	48%	0.478	S	S	.	.	H	α-helix	trans	-65.7	-42.1	176.2	-62.2	-27.8	0	0	0	110.8	A406 S412 R413 Y414	A406-D410 PolarHBondContact O-N 2.86Å; D410-S412 VanDerWaalsContact C-N 3.32Å; D410-S412 PolarHBondContact O-N 2.85Å; D410-R413 PolarHBondContact O-N 3.42Å; D410-R413 IonicContact OD1-CZ 3.56Å; D410-R413 IonicContact OD1-NE 2.76Å; D410-R413 IonicContact OD1-NH2 2.74Å; D410-R413 PolarHBondContact OD1-NH2 3.09Å; D410-Y414 WeakPolarHBondContact O-CB 3.5Å; D410-Y414 PolarHBondContact O-N 2.87Å
411	R	97.3	Very high	95.4	Very high	160 Å²	160	100.3 Å²	100.3	60%	0.604	48%	0.479	S	S	*	.	H	α-helix	trans	-63.4	-34.1	170.2	-174.7	172	177.7	147.8	0.1	112.9	Q407 K409 L415	Q407-R411 VanDerWaalsContact O-CB 3.28Å; Q407-R411 WeakPolarHBondContact O-CB 3.24Å; Q407-R411 PolarHBondContact O-N 3.24Å; K409-R411 VanDerWaalsContact C-N 3.35Å; R411-L415 HydrophobicContact CG-CD1 3.99Å; R411-L415 HydrophobicContact CG-CG 4.38Å; R411-L415 WeakPolarHBondContact O-CB 3.27Å; R411-L415 WeakPolarHBondContact O-CG 3.47Å; R411-L415 PolarHBondContact O-N 3.36Å
412	S	96.1	Very high	94.9	Very high	52 Å²	52	100.5 Å²	100.5	36%	0.364	48%	0.477	S	S	.	.	H	α-helix	trans	-63.2	-52.4	174.1	-159	0	0	0	0	110.3	L408 K409 D410 Y414 L415 E416	L408-S412 WeakPolarHBondContact O-CB 3.45Å; L408-S412 PolarHBondContact O-N 2.98Å; K409-S412 WeakPolarHBondContact O-CB 3.28Å; K409-S412 PolarHBondContact O-N 3.44Å; K409-S412 VanDerWaalsContact O-N 3.16Å; D410-S412 VanDerWaalsContact C-N 3.32Å; D410-S412 PolarHBondContact O-N 2.85Å; S412-Y414 VanDerWaalsContact C-N 3.31Å; S412-Y414 PolarHBondContact O-N 3.16Å; S412-L415 CarbonylContact O-C 3.49Å; S412-L415 WeakPolarHBondContact O-CA 3.45Å; S412-L415 PolarHBondContact O-N 2.63Å; S412-E416 VanDerWaalsContact CB-OE1 3.29Å; S412-E416 WeakPolarHBondContact CB-OE1 3.18Å; S412-E416 WeakPolarHBondContact O-CB 3.18Å; S412-E416 VanDerWaalsContact O-CD 3.29Å; S412-E416 VanDerWaalsContact O-CG 3.27Å; S412-E416 WeakPolarHBondContact O-CG 3.42Å; S412-E416 PolarHBondContact O-N 2.68Å; S412-E416 PolarHBondContact OG-OE1 2.57Å
413	R	97	Very high	94.5	Very high	151 Å²	151	99.9 Å²	99.9	57%	0.57	47%	0.474	S	S	*	.	H	α-helix	trans	-57.3	-41.1	177.2	-67.3	-171.3	-67.4	154.3	-4.4	112.8	K409 D410 E416 Q417	K409-R413 WeakPolarHBondContact O-CG 3.3Å; K409-R413 PolarHBondContact O-N 3.31Å; D410-R413 PolarHBondContact O-N 3.42Å; D410-R413 IonicContact OD1-CZ 3.56Å; D410-R413 IonicContact OD1-NE 2.76Å; D410-R413 IonicContact OD1-NH2 2.74Å; D410-R413 PolarHBondContact OD1-NH2 3.09Å; R413-E416 PolarHBondContact O-N 3.42Å; R413-Q417 WeakPolarHBondContact O-CG 3.48Å; R413-Q417 PolarHBondContact O-N 2.62Å
414	Y	96.4	Very high	93.9	Very high	111 Å²	111	101.2 Å²	101.2	44%	0.435	48%	0.475	S	S	.	.	H	α-helix	trans	-66.4	-39.1	174.3	175.8	-103.1	0	0	0	112.8	D410 S412 L418	D410-Y414 WeakPolarHBondContact O-CB 3.5Å; D410-Y414 PolarHBondContact O-N 2.87Å; S412-Y414 VanDerWaalsContact C-N 3.31Å; S412-Y414 PolarHBondContact O-N 3.16Å; Y414-L418 HydrophobicContact CD1-CD1 3.98Å; Y414-L418 HydrophobicContact CE1-CD1 3.38Å; Y414-L418 HydrophobicContact CE1-CG 4.24Å; Y414-L418 HydrophobicContact CE2-CD1 4.46Å; Y414-L418 WeakPolarHBondContact O-CG 3.3Å; Y414-L418 PolarHBondContact O-N 3.31Å
415	L	95.8	Very high	93.1	Very high	75 Å²	75	100.2 Å²	100.2	39%	0.393	47%	0.471	S	S	.	.	H	α-helix	trans	-70.1	-36.3	174.7	-74	169.9	0	0	0	112.2	R411 S412 L418 I419	R411-L415 HydrophobicContact CG-CD1 3.99Å; R411-L415 HydrophobicContact CG-CG 4.38Å; R411-L415 WeakPolarHBondContact O-CB 3.27Å; R411-L415 WeakPolarHBondContact O-CG 3.47Å; R411-L415 PolarHBondContact O-N 3.36Å; S412-L415 CarbonylContact O-C 3.49Å; S412-L415 WeakPolarHBondContact O-CA 3.45Å; S412-L415 PolarHBondContact O-N 2.63Å; L415-L418 HydrophobicContact CD2-CD1 4.43Å; L415-L418 PolarHBondContact O-N 2.79Å; L415-I419 WeakPolarHBondContact O-CB 3.3Å; L415-I419 WeakPolarHBondContact O-CD1 3.19Å; L415-I419 WeakPolarHBondContact O-CG1 3.38Å; L415-I419 PolarHBondContact O-N 3.44Å
416	E	95.2	Very high	92.2	Very high	102 Å²	102	98.8 Å²	98.8	48%	0.477	47%	0.472	S	S	.	.	H	α-helix	trans	-61.4	-44.2	173.4	-71.3	149.7	-142.5	0	0	110.7	S412 R413 I419 Q420	S412-E416 VanDerWaalsContact CB-OE1 3.29Å; S412-E416 WeakPolarHBondContact CB-OE1 3.18Å; S412-E416 WeakPolarHBondContact O-CB 3.18Å; S412-E416 VanDerWaalsContact O-CD 3.29Å; S412-E416 VanDerWaalsContact O-CG 3.27Å; S412-E416 WeakPolarHBondContact O-CG 3.42Å; S412-E416 PolarHBondContact O-N 2.68Å; S412-E416 PolarHBondContact OG-OE1 2.57Å; R413-E416 PolarHBondContact O-N 3.42Å; E416-I419 PolarHBondContact O-N 3.28Å; E416-Q420 WeakPolarHBondContact O-CB 3.25Å; E416-Q420 PolarHBondContact O-N 2.85Å
417	Q	94.6	Very high	91.5	Very high	128 Å²	128	102.8 Å²	102.8	60%	0.598	48%	0.483	S	S	*	.	H	α-helix	trans	-62	-42.4	172.5	-73.3	172.4	-19.8	0	0	112.6	R413 Q421	R413-Q417 WeakPolarHBondContact O-CG 3.48Å; R413-Q417 PolarHBondContact O-N 2.62Å; Q417-Q421 WeakPolarHBondContact O-CB 3.36Å; Q417-Q421 PolarHBondContact O-N 3.24Å
418	L	94.1	Very high	90.6	Very high	63 Å²	63	99.2 Å²	99.2	33%	0.33	47%	0.47	S	S	.	.	H	α-helix	trans	-66.6	-39.1	175.8	-77.2	176.3	0	0	0	112.7	Y414 L415 Q421 E422	Y414-L418 HydrophobicContact CD1-CD1 3.98Å; Y414-L418 HydrophobicContact CE1-CD1 3.38Å; Y414-L418 HydrophobicContact CE1-CG 4.24Å; Y414-L418 HydrophobicContact CE2-CD1 4.46Å; Y414-L418 WeakPolarHBondContact O-CG 3.3Å; Y414-L418 PolarHBondContact O-N 3.31Å; L415-L418 HydrophobicContact CD2-CD1 4.43Å; L415-L418 PolarHBondContact O-N 2.79Å; L418-Q421 PolarHBondContact O-N 2.66Å; L418-E422 WeakPolarHBondContact O-CB 3.45Å; L418-E422 PolarHBondContact O-N 3.19Å
419	I	92	Very high	89.7	Confident	93 Å²	93	97.3 Å²	97.3	48%	0.477	47%	0.467	S	S	.	.	H	α-helix	trans	-62.6	-50.9	175.7	-73.3	161.9	0	0	0	109.4	L415 E416 Q421 E422 E423	L415-I419 WeakPolarHBondContact O-CB 3.3Å; L415-I419 WeakPolarHBondContact O-CD1 3.19Å; L415-I419 WeakPolarHBondContact O-CG1 3.38Å; L415-I419 PolarHBondContact O-N 3.44Å; E416-I419 PolarHBondContact O-N 3.28Å; I419-Q421 VanDerWaalsContact C-N 3.25Å; I419-Q421 PolarHBondContact O-N 2.91Å; I419-E422 CarbonylContact O-C 3.59Å; I419-E422 PolarHBondContact O-N 3.37Å; I419-E423 HydrophobicContact CG2-CG 4.28Å; I419-E423 WeakPolarHBondContact O-CG 3.38Å; I419-E423 PolarHBondContact O-N 3.36Å
420	Q	91.9	Very high	89	Confident	116 Å²	116	97.5 Å²	97.5	54%	0.542	47%	0.47	S	S	.	.	H	α-helix	trans	-60	-36.3	178.4	-169.6	176.3	25	0	0	112.3	E416 Q424	E416-Q420 WeakPolarHBondContact O-CB 3.25Å; E416-Q420 PolarHBondContact O-N 2.85Å; Q420-Q424 VanDerWaalsContact O-CG 3.28Å; Q420-Q424 WeakPolarHBondContact O-CG 3.33Å; Q420-Q424 PolarHBondContact O-N 3.42Å; Q420-Q424 VanDerWaalsContact O-N 3.1Å
421	Q	88.4	Confident	88.1	Confident	87 Å²	87	96.7 Å²	96.7	41%	0.407	47%	0.465	S	S	.	.	H	α-helix	trans	-70.3	-33.6	174.9	-165.1	-173.7	65.2	0	0	112.6	Q417 L418 I419 R425	Q417-Q421 WeakPolarHBondContact O-CB 3.36Å; Q417-Q421 PolarHBondContact O-N 3.24Å; L418-Q421 PolarHBondContact O-N 2.66Å; I419-Q421 VanDerWaalsContact C-N 3.25Å; I419-Q421 PolarHBondContact O-N 2.91Å; Q421-R425 WeakPolarHBondContact O-CG 3.25Å; Q421-R425 PolarHBondContact O-N 2.89Å; Q421-R425 VanDerWaalsContact O-N 3.16Å; Q421-R425 VanDerWaalsContact OE1-NH1 3.17Å
422	E	85.6	Confident	87.5	Confident	112 Å²	112	89.2 Å²	89.2	52%	0.523	44%	0.437	S	S	.	.	H	α-helix	trans	-77.5	-33.3	176.4	-159.4	66.2	-168.3	0	0	112.1	L418 I419 R425 A426	L418-E422 WeakPolarHBondContact O-CB 3.45Å; L418-E422 PolarHBondContact O-N 3.19Å; I419-E422 CarbonylContact O-C 3.59Å; I419-E422 PolarHBondContact O-N 3.37Å; E422-R425 WeakPolarHBondContact O-CB 3.42Å; E422-R425 PolarHBondContact O-N 3.21Å; E422-R425 WeakPolarHBondContact OE2-CD 3.33Å; E422-R425 IonicContact OE2-CZ 2.68Å; E422-R425 IonicContact OE2-NE 3.45Å; E422-R425 IonicContact OE2-NH1 2.68Å; E422-R425 PolarHBondContact OE2-NH1 3.33Å; E422-A426 WeakPolarHBondContact O-CB 3.33Å; E422-A426 PolarHBondContact O-N 3.18Å
423	E	87	Confident	86.6	Confident	109 Å²	109	87.5 Å²	87.5	51%	0.509	43%	0.428	S	S	.	.	H	α-helix	trans	-60.4	-48.2	169.7	-72.7	170.1	162.2	0	0	110.4	I419 R425 A426 E427	I419-E423 HydrophobicContact CG2-CG 4.28Å; I419-E423 WeakPolarHBondContact O-CG 3.38Å; I419-E423 PolarHBondContact O-N 3.36Å; E423-R425 VanDerWaalsContact C-N 3.29Å; E423-R425 PolarHBondContact O-N 3.2Å; E423-A426 WeakPolarHBondContact O-CB 3.43Å; E423-A426 PolarHBondContact O-N 3.21Å; E423-E427 WeakPolarHBondContact O-CG 3.22Å; E423-E427 PolarHBondContact O-N 3.35Å
424	Q	82.6	Confident	85.7	Confident	112 Å²	112	82.2 Å²	82.2	52%	0.523	41%	0.414	S	S	.	.	H	α-helix	trans	-59	-36.9	173.3	-73	169.8	4.4	0	0	113	Q420 A428	Q420-Q424 VanDerWaalsContact O-CG 3.28Å; Q420-Q424 WeakPolarHBondContact O-CG 3.33Å; Q420-Q424 PolarHBondContact O-N 3.42Å; Q420-Q424 VanDerWaalsContact O-N 3.1Å; Q424-A428 VanDerWaalsContact O-CB 3.28Å; Q424-A428 WeakPolarHBondContact O-CB 3.42Å; Q424-A428 PolarHBondContact O-N 2.9Å; Q424-A428 VanDerWaalsContact O-N 3.12Å
425	R	80.2	Confident	85	Confident	113 Å²	113	76.9 Å²	76.9	43%	0.426	39%	0.393	S	S	.	.	H	α-helix	trans	-67.3	-40.5	172.7	-73.6	176	-171.8	111.2	8.3	111.8	Q421 E422 E423 A429	Q421-R425 WeakPolarHBondContact O-CG 3.25Å; Q421-R425 PolarHBondContact O-N 2.89Å; Q421-R425 VanDerWaalsContact O-N 3.16Å; Q421-R425 VanDerWaalsContact OE1-NH1 3.17Å; E422-R425 WeakPolarHBondContact O-CB 3.42Å; E422-R425 PolarHBondContact O-N 3.21Å; E422-R425 WeakPolarHBondContact OE2-CD 3.33Å; E422-R425 IonicContact OE2-CZ 2.68Å; E422-R425 IonicContact OE2-NE 3.45Å; E422-R425 IonicContact OE2-NH1 2.68Å; E422-R425 PolarHBondContact OE2-NH1 3.33Å; E423-R425 VanDerWaalsContact C-N 3.29Å; E423-R425 PolarHBondContact O-N 3.2Å; R425-A429 WeakPolarHBondContact O-CB 3.45Å; R425-A429 PolarHBondContact O-N 3Å
426	A	78.2	Confident	84.3	Confident	61 Å²	61	73.9 Å²	73.9	50%	0.504	38%	0.378	S	S	.	.	H	α-helix	trans	-66.4	-47.1	179.9	0	0	0	0	0	111.6	E422 E423 A429 E430	E422-A426 WeakPolarHBondContact O-CB 3.33Å; E422-A426 PolarHBondContact O-N 3.18Å; E423-A426 WeakPolarHBondContact O-CB 3.43Å; E423-A426 PolarHBondContact O-N 3.21Å; A426-A429 PolarHBondContact O-N 3.37Å; A426-E430 WeakPolarHBondContact O-CB 3.34Å; A426-E430 PolarHBondContact O-N 2.88Å
427	E	81.3	Confident	83.6	Confident	129 Å²	129	77.3 Å²	77.3	60%	0.603	39%	0.386	S	S	*	.	H	α-helix	trans	-56.9	-51.1	174	-71.2	178	170	0	0	111.3	E423 A429 E430 L431	E423-E427 WeakPolarHBondContact O-CG 3.22Å; E423-E427 PolarHBondContact O-N 3.35Å; E427-A429 VanDerWaalsContact C-N 3.31Å; E427-A429 PolarHBondContact O-N 2.92Å; E427-E430 PolarHBondContact O-N 2.94Å; E427-E430 VanDerWaalsContact O-N 3.14Å; E427-L431 WeakPolarHBondContact O-CG 3.39Å; E427-L431 PolarHBondContact O-N 2.88Å
428	A	78.2	Confident	82.8	Confident	21 Å²	21	73.6 Å²	73.6	17%	0.174	37%	0.374	C	S	.	.	H	α-helix	trans	-69	-29.1	-177.9	0	0	0	0	0	112.6	R349 Q424 E432	R349-A428 PolarHBondContact NH2-O 3.21Å; R349-A428 VanDerWaalsContact NH2-O 3.14Å; Q424-A428 VanDerWaalsContact O-CB 3.28Å; Q424-A428 WeakPolarHBondContact O-CB 3.42Å; Q424-A428 PolarHBondContact O-N 2.9Å; Q424-A428 VanDerWaalsContact O-N 3.12Å; A428-E432 WeakPolarHBondContact O-CG 3.5Å; A428-E432 PolarHBondContact O-N 3.48Å; A428-E432 VanDerWaalsContact O-N 3.11Å
429	A	79.4	Confident	82.1	Confident	47 Å²	47	71.5 Å²	71.5	39%	0.388	37%	0.365	S	S	.	.	H	α-helix	trans	-77.2	-26.3	172.1	0	0	0	0	0	112.9	R425 A426 E427 G433	R425-A429 WeakPolarHBondContact O-CB 3.45Å; R425-A429 PolarHBondContact O-N 3Å; A426-A429 PolarHBondContact O-N 3.37Å; E427-A429 VanDerWaalsContact C-N 3.31Å; E427-A429 PolarHBondContact O-N 2.92Å; A429-G433 WeakPolarHBondContact O-CA 3.34Å; A429-G433 PolarHBondContact O-N 2.66Å
430	E	81.4	Confident	81.7	Confident	129 Å²	129	70.9 Å²	70.9	60%	0.603	37%	0.365	S	S	*	.	H	α-helix	trans	-71	-39.9	169.7	176.4	158.8	-146.5	0	0	111.3	A426 E427 G433 S434	A426-E430 WeakPolarHBondContact O-CB 3.34Å; A426-E430 PolarHBondContact O-N 2.88Å; E427-E430 PolarHBondContact O-N 2.94Å; E427-E430 VanDerWaalsContact O-N 3.14Å; E430-G433 CarbonylContact O-C 3.51Å; E430-G433 PolarHBondContact O-N 3.44Å; E430-S434 WeakPolarHBondContact O-CB 3.18Å; E430-S434 PolarHBondContact O-N 3.15Å
431	L	77.9	Confident	81.2	Confident	60 Å²	60	68.7 Å²	68.7	31%	0.314	36%	0.36	S	S	.	.	H	α-helix	trans	-61.5	-55.6	173.3	-69.9	174.2	0	0	0	111.4	L271 E427 G433 S434 V435	L271-L431 HydrophobicContact CD1-CB 4.13Å; E427-L431 WeakPolarHBondContact O-CG 3.39Å; E427-L431 PolarHBondContact O-N 2.88Å; L431-G433 PolarHBondContact O-N 3.28Å; L431-S434 PolarHBondContact O-N 2.78Å; L431-S434 PolarHBondContact O-OG 3.49Å; L431-V435 PolarHBondContact O-N 3.5Å
432	E	83.3	Confident	81	Confident	2 Å²	2	67.9 Å²	67.9	1%	0.009	37%	0.368	C	S	.	.	H	α-helix	trans	-55.3	-41.4	172.6	-72.8	168.8	166.7	0	0	111.6	L271 F346 R349 L350 V353 A428 S434 V435 V436	L271-E432 HydrophobicContact CD1-CG 4.33Å; L271-E432 HydrophobicContact CD2-CG 4.32Å; F346-E432 HydrophobicContact CE2-CG 4.18Å; R349-E432 WeakPolarHBondContact CB-OE1 3.31Å; R349-E432 IonicContact CZ-OE1 3.69Å; R349-E432 IonicContact CZ-OE2 3.59Å; R349-E432 IonicContact NE-OE1 2.64Å; R349-E432 PolarHBondContact NE-OE1 3.42Å; R349-E432 IonicContact NE-OE2 3.18Å; R349-E432 PolarHBondContact NE-OE2 3.32Å; R349-E432 IonicContact NH1-OE1 2.68Å; R349-E432 IonicContact NH2-OE1 3.92Å; R349-E432 PolarHBondContact NH2-OE1 3.32Å; R349-E432 IonicContact NH2-OE2 2.72Å; R349-E432 PolarHBondContact NH2-OE2 2.65Å; L350-E432 HydrophobicContact CD1-CG 4.43Å; V353-E432 HydrophobicContact CG1-CB 4.43Å; V353-E432 HydrophobicContact CG2-CB 4.42Å; A428-E432 WeakPolarHBondContact O-CG 3.5Å; A428-E432 PolarHBondContact O-N 3.48Å; A428-E432 VanDerWaalsContact O-N 3.11Å; E432-S434 VanDerWaalsContact C-N 3.34Å; E432-S434 PolarHBondContact O-N 2.93Å; E432-V435 PolarHBondContact O-N 2.96Å; E432-V436 WeakPolarHBondContact O-CB 3.15Å; E432-V436 WeakPolarHBondContact O-CG2 3.26Å; E432-V436 PolarHBondContact O-N 3.07Å
433	G	78.3	Confident	80.9	Confident	17 Å²	17	66.8 Å²	66.8	18%	0.175	36%	0.363	C	S	.	.	H	α-helix	trans	-68.6	-26.2	177.3	0	0	0	0	0	114.1	A429 E430 L431 R437	A429-G433 WeakPolarHBondContact O-CA 3.34Å; A429-G433 PolarHBondContact O-N 2.66Å; E430-G433 CarbonylContact O-C 3.51Å; E430-G433 PolarHBondContact O-N 3.44Å; L431-G433 PolarHBondContact O-N 3.28Å; G433-R437 VanDerWaalsContact O-CB 3.3Å; G433-R437 WeakPolarHBondContact O-CB 3.35Å; G433-R437 WeakPolarHBondContact O-CG 3.47Å; G433-R437 PolarHBondContact O-N 3.49Å; G433-R437 PolarHBondContact O-NE 2.81Å
434	S	78.7	Confident	80.8	Confident	39 Å²	39	62.3 Å²	62.3	27%	0.273	34%	0.342	S	S	.	.	H	α-helix	trans	-72.4	-45.9	175	74.7	0	0	0	0	110.8	E430 L431 E432 R437 S438	E430-S434 WeakPolarHBondContact O-CB 3.18Å; E430-S434 PolarHBondContact O-N 3.15Å; L431-S434 PolarHBondContact O-N 2.78Å; L431-S434 PolarHBondContact O-OG 3.49Å; E432-S434 VanDerWaalsContact C-N 3.34Å; E432-S434 PolarHBondContact O-N 2.93Å; S434-R437 PolarHBondContact O-N 3.2Å; S434-S438 PolarHBondContact O-N 3.35Å; S434-S438 VanDerWaalsContact O-N 3.14Å
435	V	80.3	Confident	80.9	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-56.1	-53.4	171.6	161.7	0	0	0	0	110.4	W268 L271 L431 E432 R437 S438 C439	W268-V435 HydrophobicContact CD2-CB 4.47Å; W268-V435 HydrophobicContact CD2-CG1 3.63Å; W268-V435 HydrophobicContact CD2-CG2 3.96Å; W268-V435 HydrophobicContact CE3-CG1 3.86Å; W268-V435 HydrophobicContact CE3-CG2 4.11Å; W268-V435 HydrophobicContact CG-CG1 4.4Å; W268-V435 HydrophobicContact CG-CG2 4.17Å; W268-V435 HydrophobicContact CH2-CG1 3.68Å; W268-V435 HydrophobicContact CZ2-CG1 3.36Å; W268-V435 HydrophobicContact CZ3-CG1 3.9Å; L271-V435 HydrophobicContact CD2-CB 4.44Å; L271-V435 HydrophobicContact CD2-CG2 3.9Å; L431-V435 PolarHBondContact O-N 3.5Å; E432-V435 PolarHBondContact O-N 2.96Å; V435-R437 VanDerWaalsContact C-N 3.3Å; V435-R437 PolarHBondContact O-N 3.28Å; V435-S438 WeakPolarHBondContact O-CB 3.23Å; V435-S438 PolarHBondContact O-N 3.22Å; V435-S438 PolarHBondContact O-OG 2.96Å; V435-C439 PolarHBondContact O-N 3.41Å; V435-C439 PolarHBondContact O-SG 3.35Å
436	V	81.7	Confident	81.1	Confident	12 Å²	12	60.4 Å²	60.4	7%	0.073	33%	0.333	C	S	.	.	H	α-helix	trans	-65.7	-29.1	-178.2	167.7	0	0	0	0	113	L350 V353 V354 A357 E432 S438 L444 M447	L350-V436 HydrophobicContact CD1-CG2 4.45Å; V353-V436 HydrophobicContact CG1-CB 4.45Å; V353-V436 HydrophobicContact CG1-CG2 4.1Å; V354-V436 HydrophobicContact CG2-CG2 3.78Å; A357-V436 HydrophobicContact CB-CG1 3.5Å; E432-V436 WeakPolarHBondContact O-CB 3.15Å; E432-V436 WeakPolarHBondContact O-CG2 3.26Å; E432-V436 PolarHBondContact O-N 3.07Å; V436-S438 VanDerWaalsContact C-N 3.32Å; V436-L444 HydrophobicContact CB-CD2 4.35Å; V436-L444 HydrophobicContact CG1-CD1 4.48Å; V436-L444 HydrophobicContact CG1-CD2 3.9Å; V436-L444 HydrophobicContact CG2-CD2 4.34Å; V436-M447 HydrophobicContact CG2-CE 4.43Å
437	R	80.1	Confident	81.5	Confident	173 Å²	173	57.5 Å²	57.5	65%	0.653	31%	0.309	S	S	*	.	H	α-helix	trans	-70.2	-24.7	170.3	-81.3	175	-71.4	174	-4	113.5	G433 S434 V435	G433-R437 VanDerWaalsContact O-CB 3.3Å; G433-R437 WeakPolarHBondContact O-CB 3.35Å; G433-R437 WeakPolarHBondContact O-CG 3.47Å; G433-R437 PolarHBondContact O-N 3.49Å; G433-R437 PolarHBondContact O-NE 2.81Å; S434-R437 PolarHBondContact O-N 3.2Å; V435-R437 VanDerWaalsContact C-N 3.3Å; V435-R437 PolarHBondContact O-N 3.28Å
438	S	78.3	Confident	81.7	Confident	50 Å²	50	52.1 Å²	52.1	35%	0.35	29%	0.286	S	S	.	.	H	α-helix	trans	-85.1	-20.4	-178.5	79.4	0	0	0	0	113.8	S434 V435 V436	S434-S438 PolarHBondContact O-N 3.35Å; S434-S438 VanDerWaalsContact O-N 3.14Å; V435-S438 WeakPolarHBondContact O-CB 3.23Å; V435-S438 PolarHBondContact O-N 3.22Å; V435-S438 PolarHBondContact O-OG 2.96Å; V436-S438 VanDerWaalsContact C-N 3.32Å
439	C	79.8	Confident	82.2	Confident	20 Å²	20	58 Å²	58	14%	0.135	30%	0.304	C	S	.	.	S	Bend	trans	-84.5	138.6	-178.8	-65.2	0	0	0	0	112.6	V435 Q443 L444	V435-C439 PolarHBondContact O-N 3.41Å; V435-C439 PolarHBondContact O-SG 3.35Å; C439-Q443 HydrophobicContact CB-CB 4.08Å; C439-L444 HydrophobicContact CB-CD2 3.55Å; C439-L444 HydrophobicContact CB-CG 3.82Å
440	T	83.5	Confident	82.5	Confident	79 Å²	79	55.9 Å²	55.9	49%	0.485	29%	0.286	S	S	.	.			trans	-67	157.9	167.7	64.7	0	0	0	0	111.3	A442 Q443 L444	T440-A442 PolarHBondContact O-N 3.17Å; T440-Q443 CarbonylContact O-C 3.57Å; T440-Q443 PolarHBondContact O-N 2.87Å; T440-Q443 PolarHBondContact OG1-N 3.33Å; T440-Q443 PolarHBondContact OG1-OE1 3.13Å; T440-L444 PolarHBondContact O-N 3.28Å
441	V	82.1	Confident	82.8	Confident	71 Å²	71	49.8 Å²	49.8	43%	0.43	26%	0.257	S	S	.	.	H	α-helix	trans	-59.7	-22.4	176.9	-164	0	0	0	0	112.7	L358 R445	L358-V441 HydrophobicContact CD2-CG1 4.21Å; V441-R445 VanDerWaalsContact O-CG 3.31Å; V441-R445 WeakPolarHBondContact O-CG 3.41Å; V441-R445 PolarHBondContact O-N 3.39Å
442	A	82.6	Confident	83.3	Confident	70 Å²	70	50.9 Å²	50.9	58%	0.579	26%	0.261	S	S	*	.	H	α-helix	trans	-70.4	-49.1	170.9	0	0	0	0	0	111.7	T440 R445 D446	T440-A442 PolarHBondContact O-N 3.17Å; A442-R445 PolarHBondContact O-N 3Å; A442-D446 PolarHBondContact O-N 3Å
443	Q	83.9	Confident	83.5	Confident	88 Å²	88	53.3 Å²	53.3	41%	0.411	27%	0.274	S	S	.	.	H	α-helix	trans	-64.9	-37.9	175.6	-70.4	158.3	-55.7	0	0	112.2	C439 T440 R445 D446 M447	C439-Q443 HydrophobicContact CB-CB 4.08Å; T440-Q443 CarbonylContact O-C 3.57Å; T440-Q443 PolarHBondContact O-N 2.87Å; T440-Q443 PolarHBondContact OG1-N 3.33Å; T440-Q443 PolarHBondContact OG1-OE1 3.13Å; Q443-R445 VanDerWaalsContact C-N 3.34Å; Q443-R445 PolarHBondContact O-N 2.93Å; Q443-D446 PolarHBondContact O-N 3.46Å; Q443-M447 VanDerWaalsContact O-CB 3.31Å; Q443-M447 WeakPolarHBondContact O-CB 3.44Å; Q443-M447 PolarHBondContact O-N 3.44Å
444	L	85.3	Confident	83.9	Confident	15 Å²	15	52.9 Å²	52.9	8%	0.079	27%	0.267	C	S	.	.	H	α-helix	trans	-61.7	-40.5	174.2	-69.1	-179.4	0	0	0	112	V354 L358 V436 C439 T440 M447 S448	V354-L444 WeakPolarHBondContact CG1-O 3.29Å; L358-L444 HydrophobicContact CD2-CB 4.41Å; V436-L444 HydrophobicContact CB-CD2 4.35Å; V436-L444 HydrophobicContact CG1-CD1 4.48Å; V436-L444 HydrophobicContact CG1-CD2 3.9Å; V436-L444 HydrophobicContact CG2-CD2 4.34Å; C439-L444 HydrophobicContact CB-CD2 3.55Å; C439-L444 HydrophobicContact CB-CG 3.82Å; T440-L444 PolarHBondContact O-N 3.28Å; L444-M447 HydrophobicContact CD2-CE 3.54Å; L444-S448 WeakPolarHBondContact O-CB 3.45Å; L444-S448 PolarHBondContact O-N 3.01Å
445	R	85.8	Confident	84.3	Confident	145 Å²	145	53.5 Å²	53.5	55%	0.547	27%	0.267	S	S	.	.	H	α-helix	trans	-68.6	-34.8	173.6	-73.4	178.7	-168.6	120	1	112.4	L358 V441 A442 Q443 S448 R449	L358-R445 HydrophobicContact CD2-CG 4.48Å; V441-R445 VanDerWaalsContact O-CG 3.31Å; V441-R445 WeakPolarHBondContact O-CG 3.41Å; V441-R445 PolarHBondContact O-N 3.39Å; A442-R445 PolarHBondContact O-N 3Å; Q443-R445 VanDerWaalsContact C-N 3.34Å; Q443-R445 PolarHBondContact O-N 2.93Å; R445-S448 PolarHBondContact O-N 2.96Å; R445-R449 WeakPolarHBondContact O-CG 3.03Å; R445-R449 PolarHBondContact O-N 3.38Å; R445-R449 VanDerWaalsContact O-N 3.14Å
446	D	84.3	Confident	84.5	Confident	40 Å²	40	57.1 Å²	57.1	21%	0.214	29%	0.293	C	S	.	.	H	α-helix	trans	-69.8	-50.8	177.9	-163.3	60.7	0	0	0	111.9	A442 Q443 S448 R449 T450	A442-D446 PolarHBondContact O-N 3Å; Q443-D446 PolarHBondContact O-N 3.46Å; D446-S448 VanDerWaalsContact C-N 3.25Å; D446-S448 PolarHBondContact O-N 2.98Å; D446-R449 WeakPolarHBondContact O-CA 3.47Å; D446-R449 WeakPolarHBondContact O-CB 3.31Å; D446-R449 PolarHBondContact O-N 2.83Å; D446-R449 IonicContact OD1-CZ 2.62Å; D446-R449 IonicContact OD1-NE 3.5Å; D446-R449 IonicContact OD1-NH2 3.7Å; D446-R449 PolarHBondContact OD1-NH2 2.8Å; D446-T450 PolarHBondContact O-N 3.44Å; D446-T450 PolarHBondContact O-OG1 2.9Å
447	M	86.3	Confident	84.9	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-55.5	-38.7	170.4	173.7	171	41.7	0	0	112.1	W268 V354 V436 Q443 L444 R449 T450 L451 L615	W268-M447 HydrophobicContact CH2-SD 3.51Å; W268-M447 VanDerWaalsContact CH2-SD 3.51Å; W268-M447 HydrophobicContact CZ2-CE 4.35Å; W268-M447 HydrophobicContact CZ2-SD 3.63Å; V354-M447 HydrophobicContact CG2-CE 3.62Å; V354-M447 HydrophobicContact CG2-CG 4.2Å; V354-M447 HydrophobicContact CG2-SD 3.86Å; V436-M447 HydrophobicContact CG2-CE 4.43Å; Q443-M447 VanDerWaalsContact O-CB 3.31Å; Q443-M447 WeakPolarHBondContact O-CB 3.44Å; Q443-M447 PolarHBondContact O-N 3.44Å; L444-M447 HydrophobicContact CD2-CE 3.54Å; M447-R449 VanDerWaalsContact C-N 3.27Å; M447-R449 PolarHBondContact O-N 3.02Å; M447-T450 WeakPolarHBondContact CA-OG1 3.3Å; M447-T450 PolarHBondContact O-N 3.31Å; M447-T450 PolarHBondContact O-OG1 3.07Å; M447-L451 HydrophobicContact CG-CD1 3.58Å; M447-L451 HydrophobicContact CG-CG 4.11Å; M447-L451 WeakPolarHBondContact O-CB 3.28Å; M447-L451 VanDerWaalsContact O-CG 3.27Å; M447-L451 WeakPolarHBondContact O-CG 3.42Å; M447-L451 PolarHBondContact O-N 2.91Å; M447-L451 HydrophobicContact SD-CD1 4.31Å; M447-L615 HydrophobicContact CG-CD1 4.31Å
448	S	85.8	Confident	85.3	Confident	16 Å²	16	54.9 Å²	54.9	11%	0.112	29%	0.29	C	S	.	.	H	α-helix	trans	-64.1	-31.2	175	-168.4	0	0	0	0	112.8	H355 L444 R445 D446 Q452	H355-S448 PolarHBondContact CE1-OG 3.14Å; H355-S448 PolarHBondContact NE2-OG 3.01Å; L444-S448 WeakPolarHBondContact O-CB 3.45Å; L444-S448 PolarHBondContact O-N 3.01Å; R445-S448 PolarHBondContact O-N 2.96Å; D446-S448 VanDerWaalsContact C-N 3.25Å; D446-S448 PolarHBondContact O-N 2.98Å; S448-Q452 WeakPolarHBondContact O-CB 3.37Å; S448-Q452 PolarHBondContact O-N 3.5Å
449	R	87.4	Confident	85.9	Confident	145 Å²	145	54.1 Å²	54.1	55%	0.547	28%	0.282	S	S	.	.	H	α-helix	trans	-74.4	-55.8	171.9	-69.2	-179.8	-63.4	-140.1	5.4	110.2	R445 D446 M447 L451 Q452 D453	R445-R449 WeakPolarHBondContact O-CG 3.03Å; R445-R449 PolarHBondContact O-N 3.38Å; R445-R449 VanDerWaalsContact O-N 3.14Å; D446-R449 WeakPolarHBondContact O-CA 3.47Å; D446-R449 WeakPolarHBondContact O-CB 3.31Å; D446-R449 PolarHBondContact O-N 2.83Å; D446-R449 IonicContact OD1-CZ 2.62Å; D446-R449 IonicContact OD1-NE 3.5Å; D446-R449 IonicContact OD1-NH2 3.7Å; D446-R449 PolarHBondContact OD1-NH2 2.8Å; M447-R449 VanDerWaalsContact C-N 3.27Å; M447-R449 PolarHBondContact O-N 3.02Å; R449-L451 VanDerWaalsContact C-N 3.32Å; R449-L451 PolarHBondContact O-N 2.87Å; R449-Q452 CarbonylContact O-C 3.58Å; R449-Q452 WeakPolarHBondContact O-CA 3.36Å; R449-Q452 VanDerWaalsContact O-CB 3.31Å; R449-Q452 WeakPolarHBondContact O-CB 3.49Å; R449-Q452 PolarHBondContact O-N 3.33Å; R449-D453 PolarHBondContact O-N 3.25Å
450	T	86.2	Confident	86.5	Confident	3 Å²	3	53.8 Å²	53.8	2%	0.018	28%	0.278	C	S	.	.	H	α-helix	trans	-64.8	-32.5	-173.5	57.5	0	0	0	0	113.5	D446 M447 L454 C610 W619	D446-T450 PolarHBondContact O-N 3.44Å; D446-T450 PolarHBondContact O-OG1 2.9Å; M447-T450 WeakPolarHBondContact CA-OG1 3.3Å; M447-T450 PolarHBondContact O-N 3.31Å; M447-T450 PolarHBondContact O-OG1 3.07Å; T450-L454 WeakPolarHBondContact O-CB 3.49Å; T450-L454 PolarHBondContact O-N 3.21Å; T450-C610 HydrophobicContact CG2-CB 4.48Å; T450-W619 HydrophobicContact CG2-CH2 4.1Å
451	L	88.3	Confident	86.7	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-65.5	-40.3	167.6	-74.1	170.7	0	0	0	112.3	L347 L350 V354 M447 R449 I455 L615	L347-L451 HydrophobicContact CD2-CD2 3.89Å; L350-L451 HydrophobicContact CB-CD1 4.48Å; L350-L451 HydrophobicContact CD2-CD1 4.04Å; L350-L451 HydrophobicContact CD2-CD2 4.2Å; L350-L451 HydrophobicContact CG-CD1 3.85Å; V354-L451 HydrophobicContact CG2-CD1 4.39Å; M447-L451 HydrophobicContact CG-CD1 3.58Å; M447-L451 HydrophobicContact CG-CG 4.11Å; M447-L451 WeakPolarHBondContact O-CB 3.28Å; M447-L451 VanDerWaalsContact O-CG 3.27Å; M447-L451 WeakPolarHBondContact O-CG 3.42Å; M447-L451 PolarHBondContact O-N 2.91Å; M447-L451 HydrophobicContact SD-CD1 4.31Å; R449-L451 VanDerWaalsContact C-N 3.32Å; R449-L451 PolarHBondContact O-N 2.87Å; L451-I455 VanDerWaalsContact O-CB 3.26Å; L451-I455 WeakPolarHBondContact O-CB 3.49Å; L451-I455 WeakPolarHBondContact O-CD1 3.43Å; L451-I455 WeakPolarHBondContact O-CG1 3.3Å; L451-I455 PolarHBondContact O-N 2.87Å; L451-L615 HydrophobicContact CD2-CD1 3.81Å; L451-L615 HydrophobicContact CD2-CD2 3.8Å; L451-L615 HydrophobicContact CD2-CG 4.5Å; L451-L615 HydrophobicContact CG-CD1 3.92Å
452	Q	88.1	Confident	87.1	Confident	84 Å²	84	54.5 Å²	54.5	39%	0.393	28%	0.278	S	S	.	.	H	α-helix	trans	-65.7	-46.8	175.9	-176.8	59.9	54.2	0	0	110.8	S448 R449 L454 I455 S456	S448-Q452 WeakPolarHBondContact O-CB 3.37Å; S448-Q452 PolarHBondContact O-N 3.5Å; R449-Q452 CarbonylContact O-C 3.58Å; R449-Q452 WeakPolarHBondContact O-CA 3.36Å; R449-Q452 VanDerWaalsContact O-CB 3.31Å; R449-Q452 WeakPolarHBondContact O-CB 3.49Å; R449-Q452 PolarHBondContact O-N 3.33Å; Q452-L454 VanDerWaalsContact C-N 3.3Å; Q452-L454 PolarHBondContact O-N 3Å; Q452-I455 PolarHBondContact O-N 2.84Å; Q452-S456 PolarHBondContact NE2-OG 2.97Å; Q452-S456 PolarHBondContact O-N 3.17Å; Q452-S456 PolarHBondContact O-OG 3.36Å
453	D	86.4	Confident	87.5	Confident	53 Å²	53	52 Å²	52	28%	0.283	25%	0.254	S	S	.	.	H	α-helix	trans	-56.7	-42.7	176.5	-66.7	-69.2	0	0	0	111.7	R449 S457 R606	R449-D453 PolarHBondContact O-N 3.25Å; D453-S457 WeakPolarHBondContact O-CB 3.45Å; D453-S457 PolarHBondContact O-N 3.37Å; D453-R606 VanDerWaalsContact CG-CZ 3.43Å; D453-R606 VanDerWaalsContact CG-NH1 3.33Å; D453-R606 IonicContact OD1-CZ 3.84Å; D453-R606 IonicContact OD1-NH1 3.21Å; D453-R606 IonicContact OD1-NH2 3.31Å; D453-R606 PolarHBondContact OD1-NH2 2.9Å; D453-R606 IonicContact OD2-CZ 2.72Å; D453-R606 VanDerWaalsContact OD2-CZ 3.23Å; D453-R606 IonicContact OD2-NH1 2.98Å; D453-R606 PolarHBondContact OD2-NH1 3Å; D453-R606 IonicContact OD2-NH2 3.68Å; D453-R606 PolarHBondContact OD2-NH2 3.18Å
454	L	87.3	Confident	87.6	Confident	7 Å²	7	50.1 Å²	50.1	4%	0.037	25%	0.251	C	S	.	.	H	α-helix	trans	-65.7	-48.6	174	-178.9	70.4	0	0	0	112.4	L347 T450 Q452 R460 Y599	L347-L454 HydrophobicContact CD1-CD2 3.71Å; L347-L454 HydrophobicContact CD2-CD2 3.82Å; L347-L454 HydrophobicContact CG-CD2 4.33Å; T450-L454 WeakPolarHBondContact O-CB 3.49Å; T450-L454 PolarHBondContact O-N 3.21Å; Q452-L454 VanDerWaalsContact C-N 3.3Å; Q452-L454 PolarHBondContact O-N 3Å; L454-R460 WeakPolarHBondContact O-CD 3.3Å; L454-R460 PolarHBondContact O-NH1 3.23Å; L454-Y599 VanDerWaalsContact CD1-OH 3.22Å; L454-Y599 WeakPolarHBondContact CD1-OH 3.33Å
455	I	86.6	Confident	87.5	Confident	52 Å²	52	50.5 Å²	50.5	27%	0.267	25%	0.254	S	S	.	.	H	α-helix	trans	-73.4	-34.9	-172.3	-68.8	166.9	0	0	0	111.8	L347 L451 Q452	L347-I455 HydrophobicContact CB-CD1 4.35Å; L451-I455 VanDerWaalsContact O-CB 3.26Å; L451-I455 WeakPolarHBondContact O-CB 3.49Å; L451-I455 WeakPolarHBondContact O-CD1 3.43Å; L451-I455 WeakPolarHBondContact O-CG1 3.3Å; L451-I455 PolarHBondContact O-N 2.87Å; Q452-I455 PolarHBondContact O-N 2.84Å
456	S	86.1	Confident	87.4	Confident	77 Å²	77	47.3 Å²	47.3	54%	0.538	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	13.6	176.3	57.5	0	0	0	0	115	Q452 E458	Q452-S456 PolarHBondContact NE2-OG 2.97Å; Q452-S456 PolarHBondContact O-N 3.17Å; Q452-S456 PolarHBondContact O-OG 3.36Å; S456-E458 PolarHBondContact O-N 2.96Å; S456-E458 VanDerWaalsContact O-N 3.17Å
457	S	90	Very high	87.4	Confident	10 Å²	10	48 Å²	48	7%	0.07	26%	0.26	C	S	.	.			trans	-65.2	111.1	169.9	174.7	0	0	0	0	110.6	D453 N459 R460 T461	D453-S457 WeakPolarHBondContact O-CB 3.45Å; D453-S457 PolarHBondContact O-N 3.37Å; S457-N459 VanDerWaalsContact C-N 3.33Å; S457-R460 WeakPolarHBondContact O-CB 3.32Å; S457-R460 PolarHBondContact O-N 3.16Å; S457-R460 WeakPolarHBondContact OG-CB 3.43Å; S457-R460 PolarHBondContact OG-N 3.16Å; S457-T461 PolarHBondContact O-N 3.45Å
458	E	88.4	Confident	87.5	Confident	128 Å²	128	50 Å²	50	60%	0.598	27%	0.273	S	S	*	.	H	α-helix	trans	-63.3	-39.2	175.7	-179.1	177.9	-178.4	0	0	111.7	S456 R460 T461 Q462	S456-E458 PolarHBondContact O-N 2.96Å; S456-E458 VanDerWaalsContact O-N 3.17Å; E458-R460 VanDerWaalsContact C-N 3.26Å; E458-R460 PolarHBondContact O-N 3.47Å; E458-T461 PolarHBondContact O-N 2.73Å; E458-T461 PolarHBondContact O-OG1 2.85Å; E458-T461 VanDerWaalsContact O-OG1 3.08Å; E458-Q462 HydrophobicContact CG-CG 4.38Å; E458-Q462 WeakPolarHBondContact O-CB 3.19Å; E458-Q462 WeakPolarHBondContact O-CG 3.47Å; E458-Q462 PolarHBondContact O-N 2.97Å; E458-Q462 VanDerWaalsContact O-N 3.08Å; E458-Q462 PolarHBondContact OE1-NE2 3.3Å
459	N	89.8	Confident	87.7	Confident	34 Å²	34	54 Å²	54	18%	0.182	30%	0.299	C	S	.	.	H	α-helix	trans	-60.1	-39.9	177.6	-58.7	-56	0	0	0	111.2	S457 Q462 I463 N595 K598	S457-N459 VanDerWaalsContact C-N 3.33Å; N459-Q462 PolarHBondContact O-N 3.13Å; N459-I463 WeakPolarHBondContact O-CD1 3.4Å; N459-I463 VanDerWaalsContact O-CG1 3.25Å; N459-I463 WeakPolarHBondContact O-CG1 3.44Å; N459-I463 PolarHBondContact O-N 3.18Å; N459-N595 HydrophobicContact CB-CB 4.48Å; N459-K598 HydrophobicContact CB-CB 4.39Å; N459-K598 WeakPolarHBondContact ND2-CB 3.48Å; N459-K598 WeakPolarHBondContact OD1-CD 3.38Å
460	R	91.8	Very high	87.7	Confident	12 Å²	12	49.4 Å²	49.4	5%	0.045	29%	0.289	C	S	.	.	H	α-helix	trans	-62.6	-42.8	178.9	-177.8	-174.2	174.1	-113.3	-3.9	112.5	L336 S338 M339 L454 S457 E458 Q462 Y599	L336-R460 HydrophobicContact CD1-CG 3.83Å; S338-R460 PolarHBondContact O-NH2 2.86Å; S338-R460 PolarHBondContact OG-NE 2.83Å; S338-R460 PolarHBondContact OG-NH2 2.95Å; M339-R460 HydrophobicContact CG-CG 4.31Å; M339-R460 HydrophobicContact SD-CG 4.16Å; L454-R460 WeakPolarHBondContact O-CD 3.3Å; L454-R460 PolarHBondContact O-NH1 3.23Å; S457-R460 WeakPolarHBondContact O-CB 3.32Å; S457-R460 PolarHBondContact O-N 3.16Å; S457-R460 WeakPolarHBondContact OG-CB 3.43Å; S457-R460 PolarHBondContact OG-N 3.16Å; E458-R460 VanDerWaalsContact C-N 3.26Å; E458-R460 PolarHBondContact O-N 3.47Å; R460-Q462 VanDerWaalsContact C-N 3.33Å; R460-Y599 HydrophobicContact CB-CD2 4.1Å; R460-Y599 HydrophobicContact CB-CE1 4.22Å; R460-Y599 HydrophobicContact CB-CE2 3.74Å; R460-Y599 WeakPolarHBondContact CD-OH 3.32Å; R460-Y599 HydrophobicContact CG-CE1 4.04Å; R460-Y599 HydrophobicContact CG-CE2 4.07Å
461	T	88.8	Confident	88	Confident	91 Å²	91	49.4 Å²	49.4	56%	0.558	29%	0.289	S	S	*	.	H	α-helix	trans	-77	-20.8	179.5	57.9	0	0	0	0	112.9	S457 E458	S457-T461 PolarHBondContact O-N 3.45Å; E458-T461 PolarHBondContact O-N 2.73Å; E458-T461 PolarHBondContact O-OG1 2.85Å; E458-T461 VanDerWaalsContact O-OG1 3.08Å
462	Q	89.6	Confident	88.1	Confident	75 Å²	75	52.6 Å²	52.6	35%	0.35	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	2.9	176.7	-64.8	-176.9	14.4	0	0	114.8	E458 N459 R460 S464 N595	E458-Q462 HydrophobicContact CG-CG 4.38Å; E458-Q462 WeakPolarHBondContact O-CB 3.19Å; E458-Q462 WeakPolarHBondContact O-CG 3.47Å; E458-Q462 PolarHBondContact O-N 2.97Å; E458-Q462 VanDerWaalsContact O-N 3.08Å; E458-Q462 PolarHBondContact OE1-NE2 3.3Å; N459-Q462 PolarHBondContact O-N 3.13Å; R460-Q462 VanDerWaalsContact C-N 3.33Å; Q462-S464 PolarHBondContact O-N 2.85Å; Q462-S464 VanDerWaalsContact O-N 3.12Å; Q462-N595 WeakPolarHBondContact CB-ND2 3.35Å; Q462-N595 PolarHBondContact OE1-ND2 3.22Å
463	I	91.3	Very high	88.4	Confident	17 Å²	17	55.7 Å²	55.7	9%	0.087	31%	0.314	C	S	.	.			trans	-81.1	87.7	172.4	-74.7	157.8	0	0	0	109.2	L336 N459 L592 N595 Y599 F629	L336-I463 HydrophobicContact CD1-CB 4.09Å; L336-I463 HydrophobicContact CD1-CD1 4.08Å; L336-I463 HydrophobicContact CD1-CG2 4.1Å; L336-I463 HydrophobicContact CD2-CG2 4.29Å; L336-I463 HydrophobicContact CG-CB 4.49Å; L336-I463 HydrophobicContact CG-CG2 3.96Å; N459-I463 WeakPolarHBondContact O-CD1 3.4Å; N459-I463 VanDerWaalsContact O-CG1 3.25Å; N459-I463 WeakPolarHBondContact O-CG1 3.44Å; N459-I463 PolarHBondContact O-N 3.18Å; I463-L592 HydrophobicContact CB-CD1 4.39Å; I463-L592 HydrophobicContact CG1-CD1 4.43Å; I463-L592 HydrophobicContact CG2-CD1 3.96Å; I463-N595 HydrophobicContact CG1-CB 4.12Å; I463-Y599 HydrophobicContact CD1-CD1 3.61Å; I463-Y599 HydrophobicContact CD1-CG 4.01Å; I463-F629 HydrophobicContact CG2-CD2 4.03Å; I463-F629 HydrophobicContact CG2-CE2 3.83Å
464	S	85.6	Confident	88.7	Confident	48 Å²	48	53.8 Å²	53.8	34%	0.336	30%	0.303	S	S	.	.			trans	-101.6	123.8	169.1	179.1	0	0	0	0	110.3	Q462 S466 H588 L592	Q462-S464 PolarHBondContact O-N 2.85Å; Q462-S464 VanDerWaalsContact O-N 3.12Å; S464-S466 PolarHBondContact OG-O 3.21Å; S464-S466 PolarHBondContact OG-OG 3.4Å; S464-S466 VanDerWaalsContact OG-OG 3.08Å; S464-H588 PolarHBondContact O-CE1 3.01Å; S464-H588 PolarHBondContact O-NE2 3Å; S464-L592 WeakPolarHBondContact O-CD1 3.38Å
465	V	83.7	Confident	89	Confident	24 Å²	24	57.2 Å²	57.2	15%	0.145	32%	0.319	C	S	.	.			trans	-88.1	-27.2	172.6	-164.2	0	0	0	0	111.1	L334 F629	L334-V465 HydrophobicContact CB-CB 3.96Å; L334-V465 HydrophobicContact CB-CG1 4.09Å; L334-V465 HydrophobicContact CB-CG2 4.16Å; L334-V465 HydrophobicContact CD1-CB 4.24Å; L334-V465 HydrophobicContact CD1-CG1 3.6Å; L334-V465 HydrophobicContact CG-CG1 4.5Å; V465-F629 HydrophobicContact CG1-CD1 4.47Å; V465-F629 HydrophobicContact CG2-CD1 3.91Å; V465-F629 HydrophobicContact CG2-CD2 4.32Å; V465-F629 HydrophobicContact CG2-CE1 3.54Å; V465-F629 HydrophobicContact CG2-CE2 3.97Å; V465-F629 HydrophobicContact CG2-CG 4.32Å; V465-F629 HydrophobicContact CG2-CZ 3.58Å
466	S	84.8	Confident	89.3	Confident	77 Å²	77	60.5 Å²	60.5	54%	0.538	33%	0.334	S	S	.	.	S	Bend	trans	-71.4	136.4	173.7	41.1	0	0	0	0	111.7	S464 H588	S464-S466 PolarHBondContact OG-O 3.21Å; S464-S466 PolarHBondContact OG-OG 3.4Å; S464-S466 VanDerWaalsContact OG-OG 3.08Å; S466-H588 PolarHBondContact O-CE1 2.85Å; S466-H588 PolarHBondContact O-NE2 3.45Å
467	P	84.3	Confident	89.7	Confident	56 Å²	56	61.9 Å²	61.9	36%	0.364	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-60.4	148.8	173.5	-21.8	32.8	0	0	0	112.6	T471 L472	P467-T471 WeakPolarHBondContact CB-OG1 3.35Å; P467-L472 HydrophobicContact CB-CD2 4.16Å; P467-L472 HydrophobicContact CB-CG 4.48Å; P467-L472 HydrophobicContact CG-CD2 4.39Å
468	P	88.1	Confident	89.9	Confident	42 Å²	42	62.6 Å²	62.6	27%	0.273	33%	0.333	S	S	.	.	P	Polyproline II helix	trans	-61.4	150.8	177.4	-24.7	34.8	0	0	0	113	S470 T471 L472	P468-S470 PolarHBondContact O-N 2.81Å; P468-T471 WeakPolarHBondContact CD-OG1 3.43Å; P468-T471 PolarHBondContact O-N 2.93Å; P468-T471 PolarHBondContact O-OG1 2.89Å; P468-L472 PolarHBondContact O-N 3.26Å
469	P	88.8	Confident	90.2	Very high	99 Å²	99	61.7 Å²	61.7	64%	0.643	33%	0.329	S	S	*	.	H	α-helix	trans	-56.8	-25	177.7	-27.1	35.4	0	0	0	114.8	T471 R473	P469-T471 VanDerWaalsContact C-N 3.35Å; P469-R473 WeakPolarHBondContact O-CG 3.43Å; P469-R473 PolarHBondContact O-N 2.68Å; P469-R473 VanDerWaalsContact O-N 3.11Å
470	S	88.6	Confident	90.4	Very high	48 Å²	48	63 Å²	63	34%	0.336	35%	0.345	S	S	.	.	H	α-helix	trans	-77.1	-15.2	174	54.9	0	0	0	0	114.3	P468 R584	P468-S470 PolarHBondContact O-N 2.81Å; S470-R584 PolarHBondContact O-NH1 2.71Å
471	T	91.1	Very high	90.6	Very high	4 Å²	4	63.7 Å²	63.7	3%	0.025	35%	0.349	C	S	.	.	H	α-helix	trans	-89.9	-38.6	169.6	59.2	0	0	0	0	111.2	P467 P468 P469 R473 L474 Q475 L581 R584	P467-T471 WeakPolarHBondContact CB-OG1 3.35Å; P468-T471 WeakPolarHBondContact CD-OG1 3.43Å; P468-T471 PolarHBondContact O-N 2.93Å; P468-T471 PolarHBondContact O-OG1 2.89Å; P469-T471 VanDerWaalsContact C-N 3.35Å; T471-R473 PolarHBondContact O-N 3.18Å; T471-L474 PolarHBondContact O-N 3.34Å; T471-L474 VanDerWaalsContact O-N 3.16Å; T471-Q475 PolarHBondContact O-N 2.97Å; T471-L581 WeakPolarHBondContact O-CD1 3.04Å; T471-R584 HydrophobicContact CG2-CB 3.62Å
472	L	91.4	Very high	91	Very high	67 Å²	67	61 Å²	61	35%	0.351	33%	0.331	S	S	.	.	H	α-helix	trans	-59.8	-45.1	173.9	-60.6	177	0	0	0	111.4	P467 P468 L474 Q475 E476	P467-L472 HydrophobicContact CB-CD2 4.16Å; P467-L472 HydrophobicContact CB-CG 4.48Å; P467-L472 HydrophobicContact CG-CD2 4.39Å; P468-L472 PolarHBondContact O-N 3.26Å; L472-L474 VanDerWaalsContact C-N 3.34Å; L472-L474 PolarHBondContact O-N 2.91Å; L472-Q475 WeakPolarHBondContact O-CB 3.43Å; L472-Q475 PolarHBondContact O-N 2.84Å; L472-Q475 VanDerWaalsContact O-N 3.07Å; L472-E476 WeakPolarHBondContact O-CG 3.11Å; L472-E476 PolarHBondContact O-N 2.74Å
473	R	93.3	Very high	91.2	Very high	149 Å²	149	62.1 Å²	62.1	56%	0.562	34%	0.339	S	S	*	.	H	α-helix	trans	-59.2	-38	173.7	-76.8	-167.1	-69.7	148.5	-7.5	113.9	P469 T471 Q477 E721	P469-R473 WeakPolarHBondContact O-CG 3.43Å; P469-R473 PolarHBondContact O-N 2.68Å; P469-R473 VanDerWaalsContact O-N 3.11Å; T471-R473 PolarHBondContact O-N 3.18Å; R473-Q477 WeakPolarHBondContact O-CB 3.39Å; R473-Q477 PolarHBondContact O-N 3.35Å; R473-E721 IonicContact NH1-OE1 2.66Å
474	L	93.6	Very high	91.4	Very high	12 Å²	12	63.6 Å²	63.6	6%	0.063	35%	0.351	C	S	.	.	H	α-helix	trans	-68.3	-36.7	174	-75.7	-176.1	0	0	0	111.9	T471 L472 Q477 E478 L577 E580 L581	T471-L474 PolarHBondContact O-N 3.34Å; T471-L474 VanDerWaalsContact O-N 3.16Å; L472-L474 VanDerWaalsContact C-N 3.34Å; L472-L474 PolarHBondContact O-N 2.91Å; L474-Q477 PolarHBondContact O-N 3.12Å; L474-E478 PolarHBondContact O-N 2.92Å; L474-L577 HydrophobicContact CD2-CD2 3.75Å; L474-E580 HydrophobicContact CD1-CB 4.31Å; L474-E580 HydrophobicContact CD1-CG 3.83Å; L474-L581 HydrophobicContact CB-CD1 3.93Å
475	Q	92.8	Very high	91.9	Very high	79 Å²	79	62.1 Å²	62.1	37%	0.369	34%	0.339	S	S	.	.	H	α-helix	trans	-66.4	-41.6	177.2	-166.9	-175.9	7.2	0	0	111.2	T471 L472 E478 Q479 L581	T471-Q475 PolarHBondContact O-N 2.97Å; L472-Q475 WeakPolarHBondContact O-CB 3.43Å; L472-Q475 PolarHBondContact O-N 2.84Å; L472-Q475 VanDerWaalsContact O-N 3.07Å; Q475-E478 PolarHBondContact O-N 3.44Å; Q475-Q479 VanDerWaalsContact O-CG 3.28Å; Q475-Q479 WeakPolarHBondContact O-CG 3.36Å; Q475-Q479 PolarHBondContact O-N 3.19Å; Q475-L581 HydrophobicContact CB-CD1 4.19Å
476	E	93.8	Very high	92.4	Very high	122 Å²	122	67.7 Å²	67.7	57%	0.57	36%	0.361	S	S	*	.	H	α-helix	trans	-61.8	-42.9	171.6	-69.4	165.5	168.2	0	0	111.2	L472 Q479 A480	L472-E476 WeakPolarHBondContact O-CG 3.11Å; L472-E476 PolarHBondContact O-N 2.74Å; E476-Q479 PolarHBondContact O-N 2.86Å; E476-A480 PolarHBondContact O-N 3.36Å
477	Q	94.9	Very high	92.7	Very high	105 Å²	105	70.2 Å²	70.2	49%	0.491	37%	0.365	S	S	.	.	H	α-helix	trans	-65.1	-41.4	175.9	-169	179.8	7	0	0	112.6	R473 L474 Q479 A480 L481 L577	R473-Q477 WeakPolarHBondContact O-CB 3.39Å; R473-Q477 PolarHBondContact O-N 3.35Å; L474-Q477 PolarHBondContact O-N 3.12Å; Q477-Q479 VanDerWaalsContact C-N 3.32Å; Q477-Q479 PolarHBondContact O-N 3.36Å; Q477-A480 PolarHBondContact O-N 3.29Å; Q477-L481 WeakPolarHBondContact O-CB 3.14Å; Q477-L481 PolarHBondContact O-N 2.9Å; Q477-L577 HydrophobicContact CG-CD1 3.97Å; Q477-L577 HydrophobicContact CG-CD2 4.37Å
478	E	94.3	Very high	93	Very high	25 Å²	25	67.8 Å²	67.8	12%	0.117	35%	0.349	C	S	.	.	H	α-helix	trans	-64	-39.7	173.4	-155.3	-136.5	146.2	0	0	110.4	L474 Q475 L481 N482 R574	L474-E478 PolarHBondContact O-N 2.92Å; Q475-E478 PolarHBondContact O-N 3.44Å; E478-L481 PolarHBondContact O-N 3.5Å; E478-N482 WeakPolarHBondContact O-CB 3.32Å; E478-N482 PolarHBondContact O-N 3.48Å; E478-N482 PolarHBondContact O-ND2 3.46Å; E478-N482 PolarHBondContact OE1-ND2 3.19Å; E478-R574 HydrophobicContact CG-CG 3.9Å; E478-R574 IonicContact OE1-CZ 2.68Å; E478-R574 IonicContact OE1-NE 3.98Å; E478-R574 PolarHBondContact OE1-NE 2.97Å; E478-R574 IonicContact OE1-NH2 3.31Å; E478-R574 PolarHBondContact OE1-NH2 3.15Å
479	Q	94.1	Very high	93.3	Very high	110 Å²	110	68.4 Å²	68.4	51%	0.514	35%	0.352	S	S	.	.	H	α-helix	trans	-63.9	-46.2	177.1	-74.1	174.5	31.3	0	0	112.2	Q475 E476 Q477 L481 N482 L483	Q475-Q479 VanDerWaalsContact O-CG 3.28Å; Q475-Q479 WeakPolarHBondContact O-CG 3.36Å; Q475-Q479 PolarHBondContact O-N 3.19Å; E476-Q479 PolarHBondContact O-N 2.86Å; Q477-Q479 VanDerWaalsContact C-N 3.32Å; Q477-Q479 PolarHBondContact O-N 3.36Å; Q479-L481 PolarHBondContact O-N 2.79Å; Q479-N482 WeakPolarHBondContact O-CB 3.47Å; Q479-N482 PolarHBondContact O-N 3.43Å; Q479-L483 PolarHBondContact O-N 3.45Å; Q479-L483 VanDerWaalsContact O-N 3.09Å
480	A	94.8	Very high	93.3	Very high	61 Å²	61	66.3 Å²	66.3	50%	0.504	34%	0.343	S	S	.	.	H	α-helix	trans	-60.3	-45.5	175.4	0	0	0	0	0	111.8	E476 Q477 N482 L483 S484	E476-A480 PolarHBondContact O-N 3.36Å; Q477-A480 PolarHBondContact O-N 3.29Å; A480-N482 VanDerWaalsContact C-N 3.33Å; A480-N482 PolarHBondContact O-N 3.34Å; A480-L483 PolarHBondContact O-N 2.81Å; A480-L483 VanDerWaalsContact O-N 3.13Å; A480-S484 PolarHBondContact O-N 2.97Å
481	L	96.1	Very high	93.2	Very high	26 Å²	26	67.7 Å²	67.7	14%	0.136	34%	0.343	C	S	.	.	H	α-helix	trans	-65.7	-34.2	176.3	-174.6	59.2	0	0	0	112.2	Q477 E478 Q479 L483 S484 M485 M570 Q573 R574 L577	Q477-L481 WeakPolarHBondContact O-CB 3.14Å; Q477-L481 PolarHBondContact O-N 2.9Å; E478-L481 PolarHBondContact O-N 3.5Å; Q479-L481 PolarHBondContact O-N 2.79Å; L481-L483 VanDerWaalsContact C-N 3.31Å; L481-L483 PolarHBondContact O-N 3.08Å; L481-S484 PolarHBondContact O-N 3.3Å; L481-M485 HydrophobicContact CG-SD 4.43Å; L481-M485 VanDerWaalsContact O-CB 3.3Å; L481-M485 WeakPolarHBondContact O-CB 3.09Å; L481-M485 VanDerWaalsContact O-CG 3.27Å; L481-M485 WeakPolarHBondContact O-CG 3.41Å; L481-M485 PolarHBondContact O-N 2.79Å; L481-M570 HydrophobicContact CD1-CB 4.08Å; L481-M570 HydrophobicContact CD1-CG 4.2Å; L481-Q573 HydrophobicContact CD2-CB 3.93Å; L481-R574 HydrophobicContact CD2-CB 3.76Å; L481-R574 HydrophobicContact CG-CB 4.36Å; L481-L577 HydrophobicContact CD2-CD1 3.8Å
482	N	96	Very high	93.2	Very high	35 Å²	35	67.9 Å²	67.9	19%	0.187	34%	0.344	C	S	.	.	H	α-helix	trans	-64.3	-32.2	172.4	-89.4	-79.8	0	0	0	112.8	E478 Q479 A480 K486 R574	E478-N482 WeakPolarHBondContact O-CB 3.32Å; E478-N482 PolarHBondContact O-N 3.48Å; E478-N482 PolarHBondContact O-ND2 3.46Å; E478-N482 PolarHBondContact OE1-ND2 3.19Å; Q479-N482 WeakPolarHBondContact O-CB 3.47Å; Q479-N482 PolarHBondContact O-N 3.43Å; A480-N482 VanDerWaalsContact C-N 3.33Å; A480-N482 PolarHBondContact O-N 3.34Å; N482-K486 VanDerWaalsContact O-CG 3.32Å; N482-K486 WeakPolarHBondContact O-CG 2.77Å; N482-K486 PolarHBondContact O-N 3.5Å; N482-R574 PolarHBondContact ND2-NE 2.95Å; N482-R574 PolarHBondContact OD1-NE 3.18Å; N482-R574 PolarHBondContact OD1-NH1 3.03Å; N482-R574 PolarHBondContact OD1-NH2 3.36Å
483	L	94.4	Very high	93.1	Very high	99 Å²	99	68.6 Å²	68.6	52%	0.518	35%	0.352	S	S	.	.	H	α-helix	trans	-71.4	-50.7	173.9	-65.5	173.1	0	0	0	110.6	Q479 A480 L481 M485 K486 E487	Q479-L483 PolarHBondContact O-N 3.45Å; Q479-L483 VanDerWaalsContact O-N 3.09Å; A480-L483 PolarHBondContact O-N 2.81Å; A480-L483 VanDerWaalsContact O-N 3.13Å; L481-L483 VanDerWaalsContact C-N 3.31Å; L481-L483 PolarHBondContact O-N 3.08Å; L483-M485 VanDerWaalsContact C-N 3.29Å; L483-M485 PolarHBondContact O-N 2.87Å; L483-K486 WeakPolarHBondContact O-CB 3.42Å; L483-K486 PolarHBondContact O-N 3.25Å; L483-E487 PolarHBondContact O-N 2.92Å; L483-E487 VanDerWaalsContact O-N 3.11Å
484	S	95.1	Very high	92.6	Very high	47 Å²	47	64.9 Å²	64.9	33%	0.329	34%	0.341	S	S	.	.	H	α-helix	trans	-54.6	-43.1	174.4	178	0	0	0	0	112.2	A480 L481 K486 E487 A488	A480-S484 PolarHBondContact O-N 2.97Å; L481-S484 PolarHBondContact O-N 3.3Å; S484-K486 VanDerWaalsContact C-N 3.32Å; S484-K486 PolarHBondContact O-N 2.89Å; S484-E487 PolarHBondContact O-N 2.78Å; S484-A488 WeakPolarHBondContact O-CB 3.34Å; S484-A488 PolarHBondContact O-N 2.99Å
485	M	95.9	Very high	92.2	Very high	18 Å²	18	64.3 Å²	64.3	9%	0.089	34%	0.339	C	S	.	.	H	α-helix	trans	-61.2	-33.7	174.5	-81.2	179.8	50.4	0	0	114	L481 L483 T489 L567 M570 K571 R574	L481-M485 HydrophobicContact CG-SD 4.43Å; L481-M485 VanDerWaalsContact O-CB 3.3Å; L481-M485 WeakPolarHBondContact O-CB 3.09Å; L481-M485 VanDerWaalsContact O-CG 3.27Å; L481-M485 WeakPolarHBondContact O-CG 3.41Å; L481-M485 PolarHBondContact O-N 2.79Å; L483-M485 VanDerWaalsContact C-N 3.29Å; L483-M485 PolarHBondContact O-N 2.87Å; M485-T489 VanDerWaalsContact O-CB 3.25Å; M485-T489 WeakPolarHBondContact O-CB 3.44Å; M485-T489 PolarHBondContact O-N 3.3Å; M485-T489 PolarHBondContact O-OG1 3.28Å; M485-L567 HydrophobicContact CB-CD1 4.47Å; M485-L567 HydrophobicContact CG-CD1 4.45Å; M485-M570 HydrophobicContact CG-CB 3.59Å; M485-M570 HydrophobicContact CG-CG 4.43Å; M485-M570 HydrophobicContact CG-SD 4.07Å; M485-M570 HydrophobicContact SD-CB 4.25Å; M485-K571 HydrophobicContact CE-CB 4.48Å; M485-K571 HydrophobicContact CE-CG 3.49Å; M485-K571 VanDerWaalsContact CE-CG 3.49Å; M485-K571 HydrophobicContact SD-CG 4.28Å; M485-R574 HydrophobicContact SD-CB 3.77Å; M485-R574 VanDerWaalsContact SD-CD 3.56Å; M485-R574 HydrophobicContact SD-CG 4.12Å
486	K	94.5	Very high	91.9	Very high	141 Å²	141	65.7 Å²	65.7	61%	0.613	35%	0.345	S	S	*	.	H	α-helix	trans	-68.5	-44.7	174.7	-72.6	168.1	-175.7	-179.6	0	110.4	N482 L483 S484 T489 A490	N482-K486 VanDerWaalsContact O-CG 3.32Å; N482-K486 WeakPolarHBondContact O-CG 2.77Å; N482-K486 PolarHBondContact O-N 3.5Å; L483-K486 WeakPolarHBondContact O-CB 3.42Å; L483-K486 PolarHBondContact O-N 3.25Å; S484-K486 VanDerWaalsContact C-N 3.32Å; S484-K486 PolarHBondContact O-N 2.89Å; K486-T489 WeakPolarHBondContact O-CB 3.42Å; K486-T489 PolarHBondContact O-N 2.88Å; K486-A490 PolarHBondContact O-N 2.99Å
487	E	90.6	Very high	91.6	Very high	129 Å²	129	65.8 Å²	65.8	60%	0.603	34%	0.34	S	S	*	.	H	α-helix	trans	-64	-47.8	178	-67	176.3	-167.4	0	0	111.8	L483 S484 T489 A490 K491	L483-E487 PolarHBondContact O-N 2.92Å; L483-E487 VanDerWaalsContact O-N 3.11Å; S484-E487 PolarHBondContact O-N 2.78Å; E487-T489 VanDerWaalsContact C-N 3.31Å; E487-T489 PolarHBondContact O-N 3.28Å; E487-A490 CarbonylContact O-C 3.57Å; E487-A490 WeakPolarHBondContact O-CA 3.47Å; E487-A490 WeakPolarHBondContact O-CB 3.23Å; E487-A490 PolarHBondContact O-N 2.72Å; E487-K491 WeakPolarHBondContact O-CG 3.31Å; E487-K491 PolarHBondContact O-N 2.84Å
488	A	91.5	Very high	91	Very high	5 Å²	5	61 Å²	61	4%	0.041	32%	0.318	C	S	.	.	H	α-helix	trans	-61.5	-37.5	174.2	0	0	0	0	0	112.2	S484 A490 K491 V492 L567 M570	S484-A488 WeakPolarHBondContact O-CB 3.34Å; S484-A488 PolarHBondContact O-N 2.99Å; A488-A490 VanDerWaalsContact C-N 3.35Å; A488-K491 PolarHBondContact O-N 3.08Å; A488-V492 WeakPolarHBondContact O-CG2 3.4Å; A488-V492 PolarHBondContact O-N 3.44Å; A488-L567 HydrophobicContact CB-CB 4.42Å; A488-L567 HydrophobicContact CB-CD1 4.05Å; A488-M570 HydrophobicContact CB-CE 3.82Å; A488-M570 HydrophobicContact CB-SD 3.76Å
489	T	93.9	Very high	90.6	Very high	55 Å²	55	60.3 Å²	60.3	34%	0.337	32%	0.317	S	S	.	.	H	α-helix	trans	-62.5	-41.4	171.7	-60.5	0	0	0	0	111.4	M485 K486 E487 V492 V493 L567	M485-T489 VanDerWaalsContact O-CB 3.25Å; M485-T489 WeakPolarHBondContact O-CB 3.44Å; M485-T489 PolarHBondContact O-N 3.3Å; M485-T489 PolarHBondContact O-OG1 3.28Å; K486-T489 WeakPolarHBondContact O-CB 3.42Å; K486-T489 PolarHBondContact O-N 2.88Å; E487-T489 VanDerWaalsContact C-N 3.31Å; E487-T489 PolarHBondContact O-N 3.28Å; T489-V492 PolarHBondContact O-N 3.03Å; T489-V493 HydrophobicContact CG2-CG2 4.45Å; T489-V493 WeakPolarHBondContact O-CG2 3.1Å; T489-V493 PolarHBondContact O-N 3.38Å; T489-L567 WeakPolarHBondContact OG1-CD1 3.43Å
490	A	88.9	Confident	90.1	Very high	55 Å²	55	57.5 Å²	57.5	46%	0.455	31%	0.31	S	S	.	.	H	α-helix	trans	-65.6	-44.1	175.5	0	0	0	0	0	112.4	K486 E487 A488 V492 V493 M494	K486-A490 PolarHBondContact O-N 2.99Å; E487-A490 CarbonylContact O-C 3.57Å; E487-A490 WeakPolarHBondContact O-CA 3.47Å; E487-A490 WeakPolarHBondContact O-CB 3.23Å; E487-A490 PolarHBondContact O-N 2.72Å; A488-A490 VanDerWaalsContact C-N 3.35Å; A490-V492 VanDerWaalsContact C-N 3.33Å; A490-V492 PolarHBondContact O-N 2.89Å; A490-V493 PolarHBondContact O-N 3.47Å; A490-M494 WeakPolarHBondContact O-CB 3.41Å; A490-M494 WeakPolarHBondContact O-CG 3.34Å; A490-M494 PolarHBondContact O-N 3.48Å
491	K	87.3	Confident	89.5	Confident	77 Å²	77	55.4 Å²	55.4	34%	0.335	29%	0.291	S	S	.	.	H	α-helix	trans	-53.1	-49.5	172.2	-69.8	-176.3	-173	-178.8	0	110.6	E487 A488 M494 S495 E701	E487-K491 WeakPolarHBondContact O-CG 3.31Å; E487-K491 PolarHBondContact O-N 2.84Å; A488-K491 PolarHBondContact O-N 3.08Å; K491-M494 PolarHBondContact O-N 3.33Å; K491-S495 WeakPolarHBondContact O-CB 3.3Å; K491-S495 PolarHBondContact O-N 3.12Å; K491-E701 IonicContact NZ-OE1 3.94Å; K491-E701 PolarHBondContact NZ-OE1 2.87Å; K491-E701 IonicContact NZ-OE2 3.66Å
492	V	90.6	Very high	88.9	Confident	8 Å²	8	54.2 Å²	54.2	5%	0.048	29%	0.285	C	S	.	.	H	α-helix	trans	-64.4	-45.2	179.9	170.5	0	0	0	0	112.1	A488 T489 A490 S495 Q496 L567	A488-V492 WeakPolarHBondContact O-CG2 3.4Å; A488-V492 PolarHBondContact O-N 3.44Å; T489-V492 PolarHBondContact O-N 3.03Å; A490-V492 VanDerWaalsContact C-N 3.33Å; A490-V492 PolarHBondContact O-N 2.89Å; V492-S495 PolarHBondContact O-N 3.22Å; V492-Q496 WeakPolarHBondContact O-CG 3.39Å; V492-Q496 PolarHBondContact O-N 3.32Å; V492-L567 HydrophobicContact CB-CD2 4.44Å; V492-L567 HydrophobicContact CG2-CD2 4.14Å
493	V	88.3	Confident	88.5	Confident	83 Å²	83	59.4 Å²	59.4	50%	0.503	30%	0.302	S	S	.	.	H	α-helix	trans	-63.8	-42.1	178.7	169	0	0	0	0	111.7	T489 A490 Q496 R497	T489-V493 HydrophobicContact CG2-CG2 4.45Å; T489-V493 WeakPolarHBondContact O-CG2 3.1Å; T489-V493 PolarHBondContact O-N 3.38Å; A490-V493 PolarHBondContact O-N 3.47Å; V493-Q496 PolarHBondContact O-N 3.08Å; V493-R497 WeakPolarHBondContact O-CB 3.47Å; V493-R497 PolarHBondContact O-N 3.33Å
494	M	83.9	Confident	88.1	Confident	70 Å²	70	62.5 Å²	62.5	35%	0.345	31%	0.307	S	S	.	.	H	α-helix	trans	-63.9	-41.9	175.3	-73.8	-65.6	-76.6	0	0	111.8	A490 K491 R497 L498	A490-M494 WeakPolarHBondContact O-CB 3.41Å; A490-M494 WeakPolarHBondContact O-CG 3.34Å; A490-M494 PolarHBondContact O-N 3.48Å; K491-M494 PolarHBondContact O-N 3.33Å; M494-R497 PolarHBondContact O-N 3.32Å; M494-L498 WeakPolarHBondContact O-CG 3.3Å; M494-L498 PolarHBondContact O-N 2.8Å
495	S	84.7	Confident	87.6	Confident	1 Å²	1	61.5 Å²	61.5	1%	0.007	30%	0.296	C	S	.	.	H	α-helix	trans	-61.4	-43.6	175.3	-169.6	0	0	0	0	112.4	K491 V492 R497 L498 G499 L556 S560	K491-S495 WeakPolarHBondContact O-CB 3.3Å; K491-S495 PolarHBondContact O-N 3.12Å; V492-S495 PolarHBondContact O-N 3.22Å; S495-R497 PolarHBondContact O-N 3.08Å; S495-L498 PolarHBondContact O-N 3.23Å; S495-G499 PolarHBondContact O-N 3.34Å; S495-L556 VanDerWaalsContact OG-CD1 3.27Å; S495-L556 WeakPolarHBondContact OG-CD1 3.32Å; S495-S560 VanDerWaalsContact OG-CB 3.3Å; S495-S560 WeakPolarHBondContact OG-CB 3.12Å
496	Q	87.4	Confident	87.1	Confident	108 Å²	108	61.4 Å²	61.4	51%	0.505	30%	0.297	S	S	.	.	H	α-helix	trans	-63.3	-38.7	174.3	-70.9	179.4	23	0	0	113	V492 V493 S500	V492-Q496 WeakPolarHBondContact O-CG 3.39Å; V492-Q496 PolarHBondContact O-N 3.32Å; V493-Q496 PolarHBondContact O-N 3.08Å; Q496-S500 WeakPolarHBondContact O-CB 3.22Å; Q496-S500 PolarHBondContact O-N 3.28Å; Q496-S500 PolarHBondContact O-OG 3.38Å
497	R	85.9	Confident	86.8	Confident	123 Å²	123	57.7 Å²	57.7	46%	0.464	29%	0.289	S	S	.	.	H	α-helix	trans	-64.7	-47.6	175.7	-175.2	177.9	-176.8	155.8	3.9	111.3	V493 M494 S495 S500 S501 L670	V493-R497 WeakPolarHBondContact O-CB 3.47Å; V493-R497 PolarHBondContact O-N 3.33Å; M494-R497 PolarHBondContact O-N 3.32Å; S495-R497 PolarHBondContact O-N 3.08Å; R497-S500 PolarHBondContact O-N 3.17Å; R497-S501 PolarHBondContact O-N 2.85Å; R497-L670 VanDerWaalsContact NH1-CD1 3.29Å
498	L	83.5	Confident	86.7	Confident	6 Å²	6	54.6 Å²	54.6	3%	0.031	27%	0.274	C	S	.	.	H	α-helix	trans	-60.2	-47.3	175.5	-76	170.8	0	0	0	111.7	M494 S495 S500 S501 L502 L556 L673 L692 F695	M494-L498 WeakPolarHBondContact O-CG 3.3Å; M494-L498 PolarHBondContact O-N 2.8Å; S495-L498 PolarHBondContact O-N 3.23Å; L498-S500 PolarHBondContact O-N 3.32Å; L498-S501 WeakPolarHBondContact O-CB 3.42Å; L498-S501 PolarHBondContact O-N 2.82Å; L498-S501 VanDerWaalsContact O-N 3.1Å; L498-L502 WeakPolarHBondContact O-CB 3.41Å; L498-L502 PolarHBondContact O-N 3.39Å; L498-L556 HydrophobicContact CB-CD2 3.75Å; L498-L673 HydrophobicContact CD2-CB 4.38Å; L498-L673 HydrophobicContact CD2-CD1 4.15Å; L498-L673 HydrophobicContact CD2-CD2 3.97Å; L498-L673 HydrophobicContact CD2-CG 4.39Å; L498-L692 HydrophobicContact CD1-CD1 4.32Å; L498-L692 HydrophobicContact CD2-CD1 4.12Å; L498-F695 HydrophobicContact CD1-CD1 3.86Å; L498-F695 HydrophobicContact CD1-CE1 3.33Å; L498-F695 HydrophobicContact CD1-CZ 4.19Å
499	G	86	Confident	86.6	Confident	9 Å²	9	54.4 Å²	54.4	9%	0.093	27%	0.272	C	S	.	.	H	α-helix	trans	-61.9	-32.7	178.5	0	0	0	0	0	112.7	S495 R503	S495-G499 PolarHBondContact O-N 3.34Å; G499-R503 WeakPolarHBondContact O-CB 3.44Å; G499-R503 VanDerWaalsContact O-CG 3.3Å; G499-R503 WeakPolarHBondContact O-CG 3.13Å; G499-R503 PolarHBondContact O-N 3.24Å; G499-R503 PolarHBondContact O-NE 2.62Å
500	S	83.4	Confident	86.4	Confident	52 Å²	52	56 Å²	56	36%	0.364	28%	0.276	S	S	.	.	H	α-helix	trans	-73.4	-36.9	174.6	-58	0	0	0	0	112.8	Q496 R497 L498 R503 R504	Q496-S500 WeakPolarHBondContact O-CB 3.22Å; Q496-S500 PolarHBondContact O-N 3.28Å; Q496-S500 PolarHBondContact O-OG 3.38Å; R497-S500 PolarHBondContact O-N 3.17Å; L498-S500 PolarHBondContact O-N 3.32Å; S500-R503 PolarHBondContact OG-NH2 3.35Å; S500-R504 PolarHBondContact O-N 3.26Å
501	S	81.6	Confident	86.6	Confident	16 Å²	16	57.5 Å²	57.5	11%	0.112	28%	0.28	C	S	.	.	H	α-helix	trans	-66.2	-45.2	173.3	-155.4	0	0	0	0	111.3	R497 L498 R504 K505	R497-S501 PolarHBondContact O-N 2.85Å; L498-S501 WeakPolarHBondContact O-CB 3.42Å; L498-S501 PolarHBondContact O-N 2.82Å; L498-S501 VanDerWaalsContact O-N 3.1Å; S501-R504 WeakPolarHBondContact O-CB 3.39Å; S501-R504 PolarHBondContact O-N 3.14Å; S501-K505 PolarHBondContact O-N 3.48Å; S501-K505 VanDerWaalsContact O-N 3.08Å
502	L	84.1	Confident	86.8	Confident	1 Å²	1	56.1 Å²	56.1	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-66.4	-43.4	-179	-176	54.7	0	0	0	112.5	L498 R504 K505 V506 L549 L552 A553 L556 L692	L498-L502 WeakPolarHBondContact O-CB 3.41Å; L498-L502 PolarHBondContact O-N 3.39Å; L502-R504 VanDerWaalsContact C-N 3.26Å; L502-R504 PolarHBondContact O-N 3.02Å; L502-K505 PolarHBondContact O-N 2.94Å; L502-V506 WeakPolarHBondContact O-CG2 3.1Å; L502-V506 PolarHBondContact O-N 3.47Å; L502-L549 HydrophobicContact CD1-CB 4.03Å; L502-L549 HydrophobicContact CD1-CD2 3.41Å; L502-L549 VanDerWaalsContact CD1-CD2 3.41Å; L502-L549 HydrophobicContact CD1-CG 4.34Å; L502-L552 HydrophobicContact CD2-CB 4Å; L502-A553 VanDerWaalsContact CD2-CA 3.49Å; L502-A553 HydrophobicContact CD2-CB 3.72Å; L502-A553 HydrophobicContact CG-CB 4.03Å; L502-L556 HydrophobicContact CD2-CD2 4.37Å; L502-L692 HydrophobicContact CD1-CD2 4.4Å; L502-L692 HydrophobicContact CD2-CD2 4.09Å
503	R	86.6	Confident	86.9	Confident	144 Å²	144	56.3 Å²	56.3	54%	0.543	28%	0.275	S	S	.	.	H	α-helix	trans	-55.2	-41.4	171	-79.4	-175.8	-65.6	-96.5	3.7	112.2	G499 S500 V506 S507	G499-R503 WeakPolarHBondContact O-CB 3.44Å; G499-R503 VanDerWaalsContact O-CG 3.3Å; G499-R503 WeakPolarHBondContact O-CG 3.13Å; G499-R503 PolarHBondContact O-N 3.24Å; G499-R503 PolarHBondContact O-NE 2.62Å; S500-R503 PolarHBondContact OG-NH2 3.35Å; R503-V506 PolarHBondContact O-N 3.24Å; R503-S507 PolarHBondContact O-N 3.3Å; R503-S507 VanDerWaalsContact O-N 3.13Å
504	R	87.2	Confident	87.3	Confident	164 Å²	164	58.4 Å²	58.4	62%	0.619	28%	0.283	S	S	*	.	H	α-helix	trans	-63.1	-48	177.7	-169	-168.3	-59.5	122.7	-2.3	111.8	S500 S501 L502 V506 S507 E508	S500-R504 PolarHBondContact O-N 3.26Å; S501-R504 WeakPolarHBondContact O-CB 3.39Å; S501-R504 PolarHBondContact O-N 3.14Å; L502-R504 VanDerWaalsContact C-N 3.26Å; L502-R504 PolarHBondContact O-N 3.02Å; R504-V506 VanDerWaalsContact C-N 3.34Å; R504-V506 PolarHBondContact O-N 3.29Å; R504-S507 PolarHBondContact O-N 3.36Å; R504-E508 PolarHBondContact O-N 2.89Å
505	K	83.1	Confident	87.8	Confident	26 Å²	26	57.7 Å²	57.7	11%	0.113	29%	0.288	C	S	.	.	H	α-helix	trans	-66.2	-33.3	179.2	-64.9	-81.2	-90.4	174.3	0	112	S501 L502 E508 T509 W677	S501-K505 PolarHBondContact O-N 3.48Å; S501-K505 VanDerWaalsContact O-N 3.08Å; L502-K505 PolarHBondContact O-N 2.94Å; K505-E508 WeakPolarHBondContact O-CB 3.36Å; K505-E508 PolarHBondContact O-N 3.07Å; K505-T509 PolarHBondContact O-N 3.09Å; K505-W677 HydrophobicContact CB-CH2 3.18Å; K505-W677 HydrophobicContact CB-CZ2 3.63Å; K505-W677 HydrophobicContact CB-CZ3 3.83Å; K505-W677 HydrophobicContact CD-CD2 2.32Å; K505-W677 HydrophobicContact CD-CE3 2.31Å; K505-W677 HydrophobicContact CD-CG 3.5Å; K505-W677 VanDerWaalsContact CD-CG 3.5Å; K505-W677 HydrophobicContact CD-CH2 2.31Å; K505-W677 HydrophobicContact CD-CZ2 2.31Å; K505-W677 HydrophobicContact CD-CZ3 2.31Å; K505-W677 HydrophobicContact CG-CD2 3.84Å; K505-W677 HydrophobicContact CG-CE3 3.33Å; K505-W677 HydrophobicContact CG-CH2 2.78Å; K505-W677 HydrophobicContact CG-CZ2 3.37Å; K505-W677 HydrophobicContact CG-CZ3 2.77Å; K505-W677 VanDerWaalsContact NZ-CE3 3.33Å
506	V	87.2	Confident	88.3	Confident	17 Å²	17	58.4 Å²	58.4	10%	0.103	29%	0.292	C	S	.	.	H	α-helix	trans	-58.6	-55.2	169.4	171.6	0	0	0	0	110.3	L502 R503 R504 E508 T509 E510 R546 L549 E550	L502-V506 WeakPolarHBondContact O-CG2 3.1Å; L502-V506 PolarHBondContact O-N 3.47Å; R503-V506 PolarHBondContact O-N 3.24Å; R504-V506 VanDerWaalsContact C-N 3.34Å; R504-V506 PolarHBondContact O-N 3.29Å; V506-E508 PolarHBondContact O-N 3.38Å; V506-T509 PolarHBondContact O-N 3.4Å; V506-T509 PolarHBondContact O-OG1 2.98Å; V506-E510 PolarHBondContact O-N 2.94Å; V506-E510 VanDerWaalsContact O-N 3.14Å; V506-R546 HydrophobicContact CG1-CG 4.39Å; V506-L549 HydrophobicContact CG2-CB 3.67Å; V506-E550 HydrophobicContact CG1-CG 4.19Å; V506-E550 HydrophobicContact CG2-CG 4.46Å
507	S	88.2	Confident	88.8	Confident	63 Å²	63	57.2 Å²	57.2	44%	0.441	29%	0.286	S	S	.	.	H	α-helix	trans	-62.2	-27.1	178.1	-65.7	0	0	0	0	113.7	R503 R504 E510 T511	R503-S507 PolarHBondContact O-N 3.3Å; R503-S507 VanDerWaalsContact O-N 3.13Å; R504-S507 PolarHBondContact O-N 3.36Å; S507-E510 WeakPolarHBondContact CA-OE2 3.46Å; S507-E510 WeakPolarHBondContact O-CB 3.44Å; S507-E510 PolarHBondContact O-N 3.34Å; S507-E510 PolarHBondContact OG-OE2 2.82Å; S507-T511 PolarHBondContact O-N 3.07Å; S507-T511 VanDerWaalsContact O-N 3.11Å
508	E	87.3	Confident	89.4	Confident	64 Å²	64	58.2 Å²	58.2	30%	0.299	30%	0.296	S	S	.	.	H	α-helix	trans	-66.7	-44.1	172	-158.4	178.7	142.1	0	0	112	R504 K505 V506 E510 T511 Q512 W677	R504-E508 PolarHBondContact O-N 2.89Å; K505-E508 WeakPolarHBondContact O-CB 3.36Å; K505-E508 PolarHBondContact O-N 3.07Å; V506-E508 PolarHBondContact O-N 3.38Å; E508-E510 PolarHBondContact O-N 2.85Å; E508-T511 PolarHBondContact O-N 3.36Å; E508-T511 PolarHBondContact O-OG1 3.03Å; E508-Q512 PolarHBondContact O-N 2.83Å; E508-W677 VanDerWaalsContact OE1-CD1 3.25Å; E508-W677 PolarHBondContact OE1-NE1 3.24Å; E508-W677 VanDerWaalsContact OE2-CD1 3.28Å; E508-W677 PolarHBondContact OE2-NE1 2.97Å
509	T	88.8	Confident	90	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.8	-33.9	172.6	64.5	0	0	0	0	112.6	K505 V506 Q512 L513 V542 R546 L549 L683	K505-T509 PolarHBondContact O-N 3.09Å; V506-T509 PolarHBondContact O-N 3.4Å; V506-T509 PolarHBondContact O-OG1 2.98Å; T509-Q512 PolarHBondContact O-N 3.13Å; T509-L513 WeakPolarHBondContact O-CB 3.4Å; T509-L513 VanDerWaalsContact O-CG 3.28Å; T509-L513 WeakPolarHBondContact O-CG 3.25Å; T509-L513 PolarHBondContact O-N 2.94Å; T509-V542 HydrophobicContact CG2-CG1 4.26Å; T509-R546 WeakPolarHBondContact OG1-CB 3.5Å; T509-R546 WeakPolarHBondContact OG1-CG 3.35Å; T509-L549 HydrophobicContact CG2-CD1 3.86Å; T509-L683 HydrophobicContact CG2-CD2 3.63Å
510	E	90.2	Very high	90.5	Very high	89 Å²	89	61.3 Å²	61.3	42%	0.416	32%	0.315	S	S	.	.	H	α-helix	trans	-63.6	-44	173.6	-60.8	-179.9	127.5	0	0	111.1	V506 S507 E508 L513 L514	V506-E510 PolarHBondContact O-N 2.94Å; V506-E510 VanDerWaalsContact O-N 3.14Å; S507-E510 WeakPolarHBondContact CA-OE2 3.46Å; S507-E510 WeakPolarHBondContact O-CB 3.44Å; S507-E510 PolarHBondContact O-N 3.34Å; S507-E510 PolarHBondContact OG-OE2 2.82Å; E508-E510 PolarHBondContact O-N 2.85Å; E510-L513 PolarHBondContact O-N 2.82Å; E510-L514 WeakPolarHBondContact O-CG 3.31Å; E510-L514 PolarHBondContact O-N 2.89Å
511	T	92.7	Very high	91.2	Very high	87 Å²	87	63 Å²	63	53%	0.534	32%	0.32	S	S	.	.	H	α-helix	trans	-66.9	-37.5	175.5	61.4	0	0	0	0	113.1	S507 E508 L514 A515	S507-T511 PolarHBondContact O-N 3.07Å; S507-T511 VanDerWaalsContact O-N 3.11Å; E508-T511 PolarHBondContact O-N 3.36Å; E508-T511 PolarHBondContact O-OG1 3.03Å; T511-L514 PolarHBondContact O-N 3.19Å; T511-A515 PolarHBondContact O-N 2.7Å; T511-A515 VanDerWaalsContact O-N 3.08Å
512	Q	92.1	Very high	92	Very high	48 Å²	48	65.2 Å²	65.2	22%	0.224	34%	0.339	C	S	.	.	H	α-helix	trans	-64.7	-41.4	174.5	-168.5	-166.7	3.1	0	0	111.3	E508 T509 L514 A515 L516	E508-Q512 PolarHBondContact O-N 2.83Å; T509-Q512 PolarHBondContact O-N 3.13Å; Q512-L514 VanDerWaalsContact C-N 3.27Å; Q512-L514 PolarHBondContact O-N 3.02Å; Q512-A515 PolarHBondContact O-N 3.46Å; Q512-L516 HydrophobicContact CG-CD1 4.04Å; Q512-L516 HydrophobicContact CG-CG 4.23Å; Q512-L516 WeakPolarHBondContact O-CB 3.23Å; Q512-L516 WeakPolarHBondContact O-CG 3.39Å; Q512-L516 PolarHBondContact O-N 3.48Å
513	L	93.8	Very high	92.6	Very high	11 Å²	11	65.9 Å²	65.9	6%	0.058	34%	0.344	C	S	.	.	H	α-helix	trans	-60.5	-35.9	176.1	-78.7	165.5	0	0	0	112.4	T509 E510 H517 M539 V542 Y543	T509-L513 WeakPolarHBondContact O-CB 3.4Å; T509-L513 VanDerWaalsContact O-CG 3.28Å; T509-L513 WeakPolarHBondContact O-CG 3.25Å; T509-L513 PolarHBondContact O-N 2.94Å; E510-L513 PolarHBondContact O-N 2.82Å; L513-H517 WeakPolarHBondContact O-CB 3.37Å; L513-H517 PolarHBondContact O-N 2.92Å; L513-M539 HydrophobicContact CD2-CB 4.38Å; L513-M539 HydrophobicContact CD2-CE 4.35Å; L513-M539 WeakPolarHBondContact CD2-O 3.23Å; L513-V542 HydrophobicContact CD1-CG1 4.21Å; L513-V542 HydrophobicContact CD2-CB 3.92Å; L513-V542 HydrophobicContact CD2-CG1 4.03Å; L513-V542 HydrophobicContact CG-CB 4.19Å; L513-V542 HydrophobicContact CG-CG1 3.71Å; L513-Y543 HydrophobicContact CD1-CD1 3.7Å; L513-Y543 HydrophobicContact CD1-CE1 3.67Å; L513-Y543 HydrophobicContact CD1-CG 4.28Å; L513-Y543 HydrophobicContact CD2-CD1 4.19Å; L513-Y543 HydrophobicContact CD2-CD2 3.85Å; L513-Y543 HydrophobicContact CD2-CE1 4.12Å; L513-Y543 HydrophobicContact CD2-CE2 3.76Å; L513-Y543 HydrophobicContact CD2-CG 4.05Å; L513-Y543 HydrophobicContact CG-CE1 4.48Å
514	L	95.4	Very high	93.1	Very high	128 Å²	128	62.5 Å²	62.5	67%	0.67	34%	0.336	S	S	*	.	H	α-helix	trans	-66.5	-48.1	172.9	-66.5	172.3	0	0	0	111.5	E510 T511 Q512 L516 H517 E518	E510-L514 WeakPolarHBondContact O-CG 3.31Å; E510-L514 PolarHBondContact O-N 2.89Å; T511-L514 PolarHBondContact O-N 3.19Å; Q512-L514 VanDerWaalsContact C-N 3.27Å; Q512-L514 PolarHBondContact O-N 3.02Å; L514-L516 PolarHBondContact O-N 3.11Å; L514-H517 WeakPolarHBondContact O-CB 3.5Å; L514-H517 PolarHBondContact O-N 2.94Å; L514-H517 VanDerWaalsContact O-N 3.16Å; L514-E518 PolarHBondContact O-N 2.99Å
515	A	95.5	Very high	93.5	Very high	55 Å²	55	59.5 Å²	59.5	46%	0.455	34%	0.341	S	S	.	.	H	α-helix	trans	-62.3	-43.3	178.8	0	0	0	0	0	112.7	T511 Q512 H517 E518 A519	T511-A515 PolarHBondContact O-N 2.7Å; T511-A515 VanDerWaalsContact O-N 3.08Å; Q512-A515 PolarHBondContact O-N 3.46Å; A515-H517 VanDerWaalsContact C-N 3.29Å; A515-H517 PolarHBondContact O-N 2.89Å; A515-E518 PolarHBondContact O-N 2.9Å; A515-A519 WeakPolarHBondContact O-CB 3.46Å; A515-A519 PolarHBondContact O-N 3.5Å
516	L	95.2	Very high	94.2	Very high	16 Å²	16	61 Å²	61	8%	0.084	36%	0.363	C	S	.	.	H	α-helix	trans	-64.7	-33.1	174.5	-69.8	175.4	0	0	0	112.2	Q512 L514 K520 L535 E538 M539 V542	Q512-L516 HydrophobicContact CG-CD1 4.04Å; Q512-L516 HydrophobicContact CG-CG 4.23Å; Q512-L516 WeakPolarHBondContact O-CB 3.23Å; Q512-L516 WeakPolarHBondContact O-CG 3.39Å; Q512-L516 PolarHBondContact O-N 3.48Å; L514-L516 PolarHBondContact O-N 3.11Å; L516-K520 WeakPolarHBondContact O-CB 3.47Å; L516-K520 PolarHBondContact O-N 3.08Å; L516-L535 HydrophobicContact CD2-CD2 3.74Å; L516-E538 HydrophobicContact CD1-CG 3.9Å; L516-E538 VanDerWaalsContact CD2-CD 3.47Å; L516-E538 HydrophobicContact CD2-CG 4.4Å; L516-E538 WeakPolarHBondContact CD2-OE1 3.39Å; L516-E538 WeakPolarHBondContact CD2-OE2 3.43Å; L516-M539 HydrophobicContact CB-CG 3.72Å; L516-M539 HydrophobicContact CD1-CG 4.36Å; L516-V542 HydrophobicContact CD1-CG2 3.98Å
517	H	97.1	Very high	94.6	Very high	82 Å²	82	65.7 Å²	65.7	38%	0.38	39%	0.387	S	S	.	.	H	α-helix	trans	-67.3	-42.8	173.8	-168.8	-96.9	0	0	0	111.9	L513 L514 A515 K520 L521 M539	L513-H517 WeakPolarHBondContact O-CB 3.37Å; L513-H517 PolarHBondContact O-N 2.92Å; L514-H517 WeakPolarHBondContact O-CB 3.5Å; L514-H517 PolarHBondContact O-N 2.94Å; L514-H517 VanDerWaalsContact O-N 3.16Å; A515-H517 VanDerWaalsContact C-N 3.29Å; A515-H517 PolarHBondContact O-N 2.89Å; H517-K520 PolarHBondContact O-N 2.93Å; H517-L521 WeakPolarHBondContact O-CG 3.49Å; H517-L521 PolarHBondContact O-N 3.46Å; H517-M539 HydrophobicContact CB-CE 3.79Å; H517-M539 HydrophobicContact CB-SD 4.36Å
518	E	97.6	Very high	95	Very high	145 Å²	145	66.4 Å²	66.4	68%	0.678	39%	0.387	S	S	*	.	H	α-helix	trans	-63.8	-50.7	175.5	-176.3	172.5	-172.8	0	0	111.8	L514 A515 K520 L521 A522	L514-E518 PolarHBondContact O-N 2.99Å; A515-E518 PolarHBondContact O-N 2.9Å; E518-K520 PolarHBondContact O-N 3.48Å; E518-L521 WeakPolarHBondContact O-CB 3.25Å; E518-L521 PolarHBondContact O-N 3.34Å; E518-A522 PolarHBondContact O-N 2.9Å
519	A	96.8	Very high	95.4	Very high	45 Å²	45	70 Å²	70	37%	0.372	40%	0.401	S	S	.	.	H	α-helix	trans	-56.2	-39.7	176.3	0	0	0	0	0	112	A515 A522 A523 L535	A515-A519 WeakPolarHBondContact O-CB 3.46Å; A515-A519 PolarHBondContact O-N 3.5Å; A519-A522 PolarHBondContact O-N 3.35Å; A519-A523 WeakPolarHBondContact O-CB 3.25Å; A519-A523 PolarHBondContact O-N 3.32Å; A519-L535 HydrophobicContact CB-CD1 4.11Å; A519-L535 HydrophobicContact CB-CD2 4.47Å
520	K	97.6	Very high	95.7	Very high	35 Å²	35	71.7 Å²	71.7	15%	0.152	42%	0.419	C	S	.	.	H	α-helix	trans	-67.2	-37.5	175.9	172.1	168.5	137.5	-84.3	0	112.9	L516 H517 E518 I524 L535 K536 M539	L516-K520 WeakPolarHBondContact O-CB 3.47Å; L516-K520 PolarHBondContact O-N 3.08Å; H517-K520 PolarHBondContact O-N 2.93Å; E518-K520 PolarHBondContact O-N 3.48Å; K520-I524 HydrophobicContact CG-CD1 4.19Å; K520-I524 WeakPolarHBondContact O-CD1 3.44Å; K520-I524 VanDerWaalsContact O-CG1 3.25Å; K520-I524 WeakPolarHBondContact O-CG1 3.18Å; K520-I524 PolarHBondContact O-N 3.33Å; K520-I524 VanDerWaalsContact O-N 3.11Å; K520-L535 HydrophobicContact CB-CB 4.04Å; K520-L535 HydrophobicContact CB-CD1 4.17Å; K520-K536 HydrophobicContact CD-CB 4.1Å; K520-M539 HydrophobicContact CD-SD 4.05Å
521	L	97.4	Very high	95.9	Very high	88 Å²	88	70 Å²	70	46%	0.461	42%	0.417	S	S	.	.	H	α-helix	trans	-66.4	-42.7	172.7	-71.9	176.3	0	0	0	111	H517 E518 A523 I524 S525	H517-L521 WeakPolarHBondContact O-CG 3.49Å; H517-L521 PolarHBondContact O-N 3.46Å; E518-L521 WeakPolarHBondContact O-CB 3.25Å; E518-L521 PolarHBondContact O-N 3.34Å; L521-A523 PolarHBondContact O-N 3.35Å; L521-I524 PolarHBondContact O-N 3.15Å; L521-S525 PolarHBondContact O-N 3.02Å; L521-S525 PolarHBondContact O-OG 3.05Å
522	A	97.6	Very high	96.1	Very high	61 Å²	61	66.4 Å²	66.4	50%	0.504	40%	0.395	S	S	.	.	H	α-helix	trans	-60.2	-44.2	175.6	0	0	0	0	0	112.1	E518 A519 I524 S525 G526	E518-A522 PolarHBondContact O-N 2.9Å; A519-A522 PolarHBondContact O-N 3.35Å; A522-I524 PolarHBondContact O-N 3.25Å; A522-S525 PolarHBondContact O-N 3.08Å; A522-G526 PolarHBondContact O-N 3.18Å
523	A	97.4	Very high	96.3	Very high	15 Å²	15	71.9 Å²	71.9	12%	0.124	42%	0.418	C	S	.	.	H	α-helix	trans	-60.2	-43.8	174.9	0	0	0	0	0	112.3	A519 L521 S525 G526 N527 D528 C531 A532 L535	A519-A523 WeakPolarHBondContact O-CB 3.25Å; A519-A523 PolarHBondContact O-N 3.32Å; L521-A523 PolarHBondContact O-N 3.35Å; A523-S525 PolarHBondContact O-N 2.98Å; A523-G526 CarbonylContact O-C 3.55Å; A523-G526 PolarHBondContact O-N 3.18Å; A523-N527 PolarHBondContact O-N 2.81Å; A523-N527 VanDerWaalsContact O-N 3.09Å; A523-D528 PolarHBondContact O-N 2.98Å; A523-C531 HydrophobicContact CB-CB 4.41Å; A523-A532 HydrophobicContact CB-CB 4.05Å; A523-L535 HydrophobicContact CB-CD1 4.41Å
524	I	96.4	Very high	96.3	Very high	73 Å²	73	77.4 Å²	77.4	37%	0.374	44%	0.444	S	S	.	.	H	α-helix	trans	-61.6	-44.2	174.9	-68.4	164.5	0	0	0	111	K520 L521 A522 G526 N527 A532	K520-I524 HydrophobicContact CG-CD1 4.19Å; K520-I524 WeakPolarHBondContact O-CD1 3.44Å; K520-I524 VanDerWaalsContact O-CG1 3.25Å; K520-I524 WeakPolarHBondContact O-CG1 3.18Å; K520-I524 PolarHBondContact O-N 3.33Å; K520-I524 VanDerWaalsContact O-N 3.11Å; L521-I524 PolarHBondContact O-N 3.15Å; A522-I524 PolarHBondContact O-N 3.25Å; I524-G526 VanDerWaalsContact C-N 3.3Å; I524-G526 PolarHBondContact O-N 2.65Å; I524-N527 PolarHBondContact O-N 3.03Å; I524-N527 VanDerWaalsContact O-N 3.07Å; I524-A532 HydrophobicContact CD1-CB 4.45Å; I524-A532 HydrophobicContact CG1-CB 3.69Å
525	S	96.9	Very high	96.3	Very high	102 Å²	102	72.8 Å²	72.8	71%	0.713	42%	0.42	S	S	*	.	H	α-helix	trans	-66.6	-29.8	176	-63.9	0	0	0	0	113.4	L521 A522 A523 N527	L521-S525 PolarHBondContact O-N 3.02Å; L521-S525 PolarHBondContact O-OG 3.05Å; A522-S525 PolarHBondContact O-N 3.08Å; A523-S525 PolarHBondContact O-N 2.98Å; S525-N527 VanDerWaalsContact C-N 3.26Å; S525-N527 PolarHBondContact O-N 3.17Å
526	G	96.4	Very high	96.3	Very high	56 Å²	56	76.2 Å²	76.2	58%	0.577	42%	0.424	S	S	*	.	H	α-helix	trans	-75.1	-9.6	170.6	0	0	0	0	0	114.4	A522 A523 I524 D528	A522-G526 PolarHBondContact O-N 3.18Å; A523-G526 CarbonylContact O-C 3.55Å; A523-G526 PolarHBondContact O-N 3.18Å; I524-G526 VanDerWaalsContact C-N 3.3Å; I524-G526 PolarHBondContact O-N 2.65Å; G526-D528 VanDerWaalsContact C-N 3.28Å
527	N	95.7	Very high	96.2	Very high	116 Å²	116	78.4 Å²	78.4	62%	0.62	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	68	17.4	-170.5	-47.6	-91.7	0	0	0	114.7	A523 I524 S525 F529	A523-N527 PolarHBondContact O-N 2.81Å; A523-N527 VanDerWaalsContact O-N 3.09Å; I524-N527 PolarHBondContact O-N 3.03Å; I524-N527 VanDerWaalsContact O-N 3.07Å; S525-N527 VanDerWaalsContact C-N 3.26Å; S525-N527 PolarHBondContact O-N 3.17Å; N527-F529 HydrophobicContact CB-CE2 3.97Å; N527-F529 HydrophobicContact CB-CZ 4.43Å; N527-F529 WeakPolarHBondContact O-CD2 3.16Å; N527-F529 WeakPolarHBondContact O-CE2 3.34Å; N527-F529 PolarHBondContact O-N 2.89Å; N527-F529 VanDerWaalsContact O-N 3.15Å
528	D	96.4	Very high	95.9	Very high	79 Å²	79	78.4 Å²	78.4	42%	0.422	45%	0.445	S	S	.	.			trans	-84.5	86.2	171.1	-160.7	-39.5	0	0	0	110.8	A523 G526 G530 C531 A532	A523-D528 PolarHBondContact O-N 2.98Å; G526-D528 VanDerWaalsContact C-N 3.28Å; D528-G530 PolarHBondContact O-N 2.99Å; D528-G530 WeakPolarHBondContact OD1-CA 3.18Å; D528-G530 PolarHBondContact OD1-N 2.99Å; D528-C531 PolarHBondContact OD1-N 3.46Å; D528-A532 VanDerWaalsContact O-CB 3.25Å; D528-A532 WeakPolarHBondContact O-CB 3.38Å; D528-A532 PolarHBondContact O-N 3.28Å; D528-A532 VanDerWaalsContact O-N 3.12Å
529	F	95.9	Very high	95.7	Very high	138 Å²	138	72.1 Å²	72.1	61%	0.605	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-8.4	175.6	-56.7	-72.8	0	0	0	113.4	N527 K533	N527-F529 HydrophobicContact CB-CE2 3.97Å; N527-F529 HydrophobicContact CB-CZ 4.43Å; N527-F529 WeakPolarHBondContact O-CD2 3.16Å; N527-F529 WeakPolarHBondContact O-CE2 3.34Å; N527-F529 PolarHBondContact O-N 2.89Å; N527-F529 VanDerWaalsContact O-N 3.15Å; F529-K533 WeakPolarHBondContact O-CB 3.45Å; F529-K533 PolarHBondContact O-N 2.98Å
530	G	96.2	Very high	95.6	Very high	36 Å²	36	76.7 Å²	76.7	37%	0.371	43%	0.427	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-63.9	171.7	0	0	0	0	0	110.1	D528 A532 K533 E534	D528-G530 PolarHBondContact O-N 2.99Å; D528-G530 WeakPolarHBondContact OD1-CA 3.18Å; D528-G530 PolarHBondContact OD1-N 2.99Å; G530-A532 VanDerWaalsContact C-N 3.27Å; G530-A532 PolarHBondContact O-N 3.35Å; G530-K533 WeakPolarHBondContact O-CA 3.42Å; G530-K533 VanDerWaalsContact O-CB 3.32Å; G530-K533 WeakPolarHBondContact O-CB 3.28Å; G530-K533 PolarHBondContact O-N 3.21Å; G530-E534 PolarHBondContact O-N 2.81Å; G530-E534 VanDerWaalsContact O-N 3.11Å
531	C	94.8	Very high	95.1	Very high	55 Å²	55	75.8 Å²	75.8	37%	0.372	43%	0.427	S	S	.	.	H	α-helix	trans	-60.1	-36.9	177.7	-64.5	0	0	0	0	111.9	A523 D528 K533 E534 L535	A523-C531 HydrophobicContact CB-CB 4.41Å; D528-C531 PolarHBondContact OD1-N 3.46Å; C531-K533 PolarHBondContact O-N 3.01Å; C531-E534 PolarHBondContact O-N 3.16Å; C531-L535 WeakPolarHBondContact O-CB 3.26Å; C531-L535 VanDerWaalsContact O-CG 3.3Å; C531-L535 WeakPolarHBondContact O-CG 3.44Å; C531-L535 PolarHBondContact O-N 2.96Å
532	A	96.1	Very high	94.7	Very high	10 Å²	10	72 Å²	72	8%	0.083	41%	0.407	C	S	.	.	H	α-helix	trans	-64.3	-23.1	174.9	0	0	0	0	0	114.3	A523 I524 D528 G530 K536	A523-A532 HydrophobicContact CB-CB 4.05Å; I524-A532 HydrophobicContact CD1-CB 4.45Å; I524-A532 HydrophobicContact CG1-CB 3.69Å; D528-A532 VanDerWaalsContact O-CB 3.25Å; D528-A532 WeakPolarHBondContact O-CB 3.38Å; D528-A532 PolarHBondContact O-N 3.28Å; D528-A532 VanDerWaalsContact O-N 3.12Å; G530-A532 VanDerWaalsContact C-N 3.27Å; G530-A532 PolarHBondContact O-N 3.35Å; A532-K536 WeakPolarHBondContact O-CB 3.37Å; A532-K536 PolarHBondContact O-N 2.74Å
533	K	96.4	Very high	94.4	Very high	163 Å²	163	74.2 Å²	74.2	71%	0.709	40%	0.403	S	S	*	.	H	α-helix	trans	-81.5	-39	173.2	177.9	-166.5	170.2	-160.5	0	111.2	F529 G530 C531 K536 A537	F529-K533 WeakPolarHBondContact O-CB 3.45Å; F529-K533 PolarHBondContact O-N 2.98Å; G530-K533 WeakPolarHBondContact O-CA 3.42Å; G530-K533 VanDerWaalsContact O-CB 3.32Å; G530-K533 WeakPolarHBondContact O-CB 3.28Å; G530-K533 PolarHBondContact O-N 3.21Å; C531-K533 PolarHBondContact O-N 3.01Å; K533-K536 WeakPolarHBondContact O-CB 3.45Å; K533-K536 PolarHBondContact O-N 2.82Å; K533-A537 PolarHBondContact O-N 2.71Å
534	E	94.4	Very high	94	Very high	128 Å²	128	79.4 Å²	79.4	60%	0.598	43%	0.428	S	S	*	.	H	α-helix	trans	-67.9	-50.7	178.3	-71.1	162.9	176.3	0	0	111	G530 C531 K536 A537 E538	G530-E534 PolarHBondContact O-N 2.81Å; G530-E534 VanDerWaalsContact O-N 3.11Å; C531-E534 PolarHBondContact O-N 3.16Å; E534-K536 PolarHBondContact O-N 2.89Å; E534-K536 VanDerWaalsContact O-N 3.17Å; E534-A537 CarbonylContact O-C 3.6Å; E534-A537 WeakPolarHBondContact O-CA 3.32Å; E534-A537 WeakPolarHBondContact O-CB 3.31Å; E534-A537 PolarHBondContact O-N 3.11Å; E534-E538 PolarHBondContact O-N 3.45Å
535	L	94.2	Very high	93.5	Very high	31 Å²	31	76.8 Å²	76.8	16%	0.162	41%	0.414	C	S	.	.	H	α-helix	trans	-56.8	-32.9	172.6	-67.5	165.8	0	0	0	112	L516 A519 K520 A523 C531 A537 E538 M539	L516-L535 HydrophobicContact CD2-CD2 3.74Å; A519-L535 HydrophobicContact CB-CD1 4.11Å; A519-L535 HydrophobicContact CB-CD2 4.47Å; K520-L535 HydrophobicContact CB-CB 4.04Å; K520-L535 HydrophobicContact CB-CD1 4.17Å; A523-L535 HydrophobicContact CB-CD1 4.41Å; C531-L535 WeakPolarHBondContact O-CB 3.26Å; C531-L535 VanDerWaalsContact O-CG 3.3Å; C531-L535 WeakPolarHBondContact O-CG 3.44Å; C531-L535 PolarHBondContact O-N 2.96Å; L535-A537 VanDerWaalsContact C-N 3.33Å; L535-E538 PolarHBondContact O-N 3.29Å; L535-M539 WeakPolarHBondContact O-CB 3.47Å; L535-M539 VanDerWaalsContact O-CG 3.25Å; L535-M539 WeakPolarHBondContact O-CG 3.27Å; L535-M539 PolarHBondContact O-N 3.13Å
536	K	95.3	Very high	93.1	Very high	127 Å²	127	74.8 Å²	74.8	55%	0.552	39%	0.391	S	S	*	.	H	α-helix	trans	-70.2	-26.7	173.7	-177.1	177.1	177	-179.2	0	113.1	K520 A532 K533 E534	K520-K536 HydrophobicContact CD-CB 4.1Å; A532-K536 WeakPolarHBondContact O-CB 3.37Å; A532-K536 PolarHBondContact O-N 2.74Å; K533-K536 WeakPolarHBondContact O-CB 3.45Å; K533-K536 PolarHBondContact O-N 2.82Å; E534-K536 PolarHBondContact O-N 2.89Å; E534-K536 VanDerWaalsContact O-N 3.17Å
537	A	92.9	Very high	92.8	Very high	62 Å²	62	75.5 Å²	75.5	51%	0.512	38%	0.381	S	S	.	.	H	α-helix	trans	-79.3	-41.5	172.3	0	0	0	0	0	111	K533 E534 L535 K540 A541	K533-A537 PolarHBondContact O-N 2.71Å; E534-A537 CarbonylContact O-C 3.6Å; E534-A537 WeakPolarHBondContact O-CA 3.32Å; E534-A537 WeakPolarHBondContact O-CB 3.31Å; E534-A537 PolarHBondContact O-N 3.11Å; L535-A537 VanDerWaalsContact C-N 3.33Å; A537-K540 WeakPolarHBondContact O-CB 3.4Å; A537-K540 PolarHBondContact O-N 3.26Å; A537-A541 PolarHBondContact O-N 3.09Å
538	E	92.2	Very high	92.4	Very high	81 Å²	81	72.7 Å²	72.7	38%	0.379	36%	0.362	S	S	.	.	H	α-helix	trans	-60.5	-49.4	175.1	-168.7	-174.8	168	0	0	111.8	L516 E534 L535 K540 A541 V542	L516-E538 HydrophobicContact CD1-CG 3.9Å; L516-E538 VanDerWaalsContact CD2-CD 3.47Å; L516-E538 HydrophobicContact CD2-CG 4.4Å; L516-E538 WeakPolarHBondContact CD2-OE1 3.39Å; L516-E538 WeakPolarHBondContact CD2-OE2 3.43Å; E534-E538 PolarHBondContact O-N 3.45Å; L535-E538 PolarHBondContact O-N 3.29Å; E538-K540 PolarHBondContact O-N 3.5Å; E538-K540 VanDerWaalsContact O-N 3.15Å; E538-A541 WeakPolarHBondContact O-CA 3.48Å; E538-A541 WeakPolarHBondContact O-CB 3.32Å; E538-A541 PolarHBondContact O-N 2.97Å; E538-V542 PolarHBondContact O-N 3.5Å
539	M	93.6	Very high	92	Very high	13 Å²	13	69.1 Å²	69.1	6%	0.064	34%	0.343	C	S	.	.	H	α-helix	trans	-51.2	-41.2	174	-76.7	-170.9	84.7	0	0	112.3	L513 L516 H517 K520 L535 A541 V542 Y543	L513-M539 HydrophobicContact CD2-CB 4.38Å; L513-M539 HydrophobicContact CD2-CE 4.35Å; L513-M539 WeakPolarHBondContact CD2-O 3.23Å; L516-M539 HydrophobicContact CB-CG 3.72Å; L516-M539 HydrophobicContact CD1-CG 4.36Å; H517-M539 HydrophobicContact CB-CE 3.79Å; H517-M539 HydrophobicContact CB-SD 4.36Å; K520-M539 HydrophobicContact CD-SD 4.05Å; L535-M539 WeakPolarHBondContact O-CB 3.47Å; L535-M539 VanDerWaalsContact O-CG 3.25Å; L535-M539 WeakPolarHBondContact O-CG 3.27Å; L535-M539 PolarHBondContact O-N 3.13Å; M539-A541 VanDerWaalsContact C-N 3.34Å; M539-A541 PolarHBondContact O-N 3.23Å; M539-V542 PolarHBondContact O-N 3.44Å; M539-Y543 HydrophobicContact CE-CE2 4.32Å; M539-Y543 WeakPolarHBondContact O-CD2 3.38Å; M539-Y543 PolarHBondContact O-N 2.83Å
540	K	93.9	Very high	91.7	Very high	141 Å²	141	64.9 Å²	64.9	61%	0.613	33%	0.325	S	S	*	.	H	α-helix	trans	-65	-36.7	176.9	-76.8	-179.9	165.9	-160.8	0	112.6	A537 E538 L544	A537-K540 WeakPolarHBondContact O-CB 3.4Å; A537-K540 PolarHBondContact O-N 3.26Å; E538-K540 PolarHBondContact O-N 3.5Å; E538-K540 VanDerWaalsContact O-N 3.15Å; K540-L544 WeakPolarHBondContact O-CG 3.44Å; K540-L544 PolarHBondContact O-N 3.45Å
541	A	87.9	Confident	91.4	Very high	17 Å²	17	65.4 Å²	65.4	14%	0.14	33%	0.326	C	S	.	.	H	α-helix	trans	-69.6	-41.9	177.8	0	0	0	0	0	111.6	A537 E538 M539 Y543 L544 E545 Q684	A537-A541 PolarHBondContact O-N 3.09Å; E538-A541 WeakPolarHBondContact O-CA 3.48Å; E538-A541 WeakPolarHBondContact O-CB 3.32Å; E538-A541 PolarHBondContact O-N 2.97Å; M539-A541 VanDerWaalsContact C-N 3.34Å; M539-A541 PolarHBondContact O-N 3.23Å; A541-Y543 VanDerWaalsContact C-N 3.35Å; A541-Y543 PolarHBondContact O-N 3.26Å; A541-L544 PolarHBondContact O-N 2.82Å; A541-L544 VanDerWaalsContact O-N 3.14Å; A541-E545 PolarHBondContact O-N 3.47Å; A541-Q684 HydrophobicContact CB-CG 3.91Å; A541-Q684 VanDerWaalsContact CB-NE2 3.33Å
542	V	87.7	Confident	91	Very high	7 Å²	7	63 Å²	63	4%	0.042	31%	0.309	C	S	.	.	H	α-helix	trans	-65.8	-36.8	176.5	-175.9	0	0	0	0	111.4	T509 L513 L516 E538 M539 L544 R546	T509-V542 HydrophobicContact CG2-CG1 4.26Å; L513-V542 HydrophobicContact CD1-CG1 4.21Å; L513-V542 HydrophobicContact CD2-CB 3.92Å; L513-V542 HydrophobicContact CD2-CG1 4.03Å; L513-V542 HydrophobicContact CG-CB 4.19Å; L513-V542 HydrophobicContact CG-CG1 3.71Å; L516-V542 HydrophobicContact CD1-CG2 3.98Å; E538-V542 PolarHBondContact O-N 3.5Å; M539-V542 PolarHBondContact O-N 3.44Å; V542-L544 PolarHBondContact O-N 2.99Å; V542-R546 VanDerWaalsContact O-CB 3.31Å; V542-R546 WeakPolarHBondContact O-CB 3.48Å; V542-R546 PolarHBondContact O-N 3.33Å
543	Y	91.1	Very high	90.7	Very high	108 Å²	108	63.8 Å²	63.8	42%	0.424	32%	0.316	S	S	.	.	H	α-helix	trans	-58.4	-44	169.6	-80.3	-61.4	0	0	0	112.4	L513 M539 A541 R546 D547	L513-Y543 HydrophobicContact CD1-CD1 3.7Å; L513-Y543 HydrophobicContact CD1-CE1 3.67Å; L513-Y543 HydrophobicContact CD1-CG 4.28Å; L513-Y543 HydrophobicContact CD2-CD1 4.19Å; L513-Y543 HydrophobicContact CD2-CD2 3.85Å; L513-Y543 HydrophobicContact CD2-CE1 4.12Å; L513-Y543 HydrophobicContact CD2-CE2 3.76Å; L513-Y543 HydrophobicContact CD2-CG 4.05Å; L513-Y543 HydrophobicContact CG-CE1 4.48Å; M539-Y543 HydrophobicContact CE-CE2 4.32Å; M539-Y543 WeakPolarHBondContact O-CD2 3.38Å; M539-Y543 PolarHBondContact O-N 2.83Å; A541-Y543 VanDerWaalsContact C-N 3.35Å; A541-Y543 PolarHBondContact O-N 3.26Å; Y543-R546 PolarHBondContact O-N 3.16Å; Y543-D547 PolarHBondContact O-N 3.44Å
544	L	89.9	Confident	90.4	Very high	124 Å²	124	63.3 Å²	63.3	65%	0.649	31%	0.309	S	S	*	.	H	α-helix	trans	-68.2	-42.4	-179.2	-70.9	168.9	0	0	0	113	K540 A541 V542 D547 R548	K540-L544 WeakPolarHBondContact O-CG 3.44Å; K540-L544 PolarHBondContact O-N 3.45Å; A541-L544 PolarHBondContact O-N 2.82Å; A541-L544 VanDerWaalsContact O-N 3.14Å; V542-L544 PolarHBondContact O-N 2.99Å; L544-D547 PolarHBondContact O-N 2.85Å; L544-R548 PolarHBondContact O-N 3.06Å; L544-R548 VanDerWaalsContact O-N 3.08Å
545	E	84.6	Confident	90.2	Very high	19 Å²	19	60 Å²	60	9%	0.089	29%	0.291	C	S	.	.	H	α-helix	trans	-70.5	-34	176.5	-170.7	72.2	173.1	0	0	111.1	A541 R548 L549 T689	A541-E545 PolarHBondContact O-N 3.47Å; E545-R548 PolarHBondContact O-N 2.94Å; E545-R548 IonicContact OE1-NH1 2.71Å; E545-R548 PolarHBondContact OE1-NH1 2.91Å; E545-R548 IonicContact OE2-NH1 3.1Å; E545-R548 PolarHBondContact OE2-NH1 2.95Å; E545-R548 VanDerWaalsContact OE2-NH1 3.14Å; E545-L549 HydrophobicContact CG-CD1 4.2Å; E545-L549 HydrophobicContact CG-CG 4.39Å; E545-L549 WeakPolarHBondContact O-CB 3.46Å; E545-L549 WeakPolarHBondContact O-CG 3.32Å; E545-L549 PolarHBondContact O-N 3.14Å; E545-T689 WeakPolarHBondContact OE1-CB 3.27Å; E545-T689 VanDerWaalsContact OE1-CG2 3.3Å; E545-T689 WeakPolarHBondContact OE1-CG2 3.47Å; E545-T689 PolarHBondContact OE1-OG1 3.09Å
546	R	88.9	Confident	90	Very high	60 Å²	60	58.6 Å²	58.6	23%	0.226	28%	0.284	C	S	.	.	H	α-helix	trans	-57.9	-50.4	169.3	-178	-158.6	69.2	150.5	4.1	111.4	V506 T509 V542 Y543 R548 L549 E550	V506-R546 HydrophobicContact CG1-CG 4.39Å; T509-R546 WeakPolarHBondContact OG1-CB 3.5Å; T509-R546 WeakPolarHBondContact OG1-CG 3.35Å; V542-R546 VanDerWaalsContact O-CB 3.31Å; V542-R546 WeakPolarHBondContact O-CB 3.48Å; V542-R546 PolarHBondContact O-N 3.33Å; Y543-R546 PolarHBondContact O-N 3.16Å; R546-R548 PolarHBondContact O-N 3.46Å; R546-L549 PolarHBondContact O-N 2.96Å; R546-L549 VanDerWaalsContact O-N 3.12Å; R546-E550 IonicContact CZ-OE1 3.54Å; R546-E550 IonicContact NE-OE1 3.5Å; R546-E550 IonicContact NH1-OE1 3.81Å; R546-E550 IonicContact NH2-OE1 4Å; R546-E550 PolarHBondContact O-N 3.33Å
547	D	90.5	Very high	89.7	Confident	70 Å²	70	58.9 Å²	58.9	37%	0.374	29%	0.287	S	S	.	.	H	α-helix	trans	-61.3	-33	-178.6	-67.5	-1.5	0	0	0	111.4	Y543 L544 A551	Y543-D547 PolarHBondContact O-N 3.44Å; L544-D547 PolarHBondContact O-N 2.85Å; D547-A551 PolarHBondContact O-N 3.48Å; D547-A551 VanDerWaalsContact O-N 3.1Å
548	R	88.3	Confident	89.6	Confident	58 Å²	58	59.6 Å²	59.6	22%	0.219	29%	0.289	C	S	.	.	H	α-helix	trans	-71	-45.5	171.5	-176.9	172.6	172.4	-124.3	-1.1	112.9	L544 E545 R546 E550 A551 L552 T689 E693	L544-R548 PolarHBondContact O-N 3.06Å; L544-R548 VanDerWaalsContact O-N 3.08Å; E545-R548 PolarHBondContact O-N 2.94Å; E545-R548 IonicContact OE1-NH1 2.71Å; E545-R548 PolarHBondContact OE1-NH1 2.91Å; E545-R548 IonicContact OE2-NH1 3.1Å; E545-R548 PolarHBondContact OE2-NH1 2.95Å; E545-R548 VanDerWaalsContact OE2-NH1 3.14Å; R546-R548 PolarHBondContact O-N 3.46Å; R548-E550 VanDerWaalsContact C-N 3.3Å; R548-E550 PolarHBondContact O-N 3.44Å; R548-A551 WeakPolarHBondContact O-CB 3.4Å; R548-A551 PolarHBondContact O-N 2.83Å; R548-A551 VanDerWaalsContact O-N 3.13Å; R548-L552 HydrophobicContact CG-CD1 4.45Å; R548-L552 WeakPolarHBondContact O-CG 3.45Å; R548-L552 PolarHBondContact O-N 2.93Å; R548-T689 PolarHBondContact NH1-OG1 3.05Å; R548-T689 PolarHBondContact NH2-O 3.36Å; R548-E693 IonicContact CZ-OE2 2.89Å; R548-E693 IonicContact NE-OE2 2.72Å; R548-E693 IonicContact NH2-OE2 3.64Å; R548-E693 PolarHBondContact NH2-OE2 3.19Å
549	L	86.4	Confident	89.4	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.016	28%	0.279	C	S	.	.	H	α-helix	trans	-59.7	-40.5	175.2	-71.6	163	0	0	0	111.3	L502 V506 T509 E545 R546 A553 T689	L502-L549 HydrophobicContact CD1-CB 4.03Å; L502-L549 HydrophobicContact CD1-CD2 3.41Å; L502-L549 VanDerWaalsContact CD1-CD2 3.41Å; L502-L549 HydrophobicContact CD1-CG 4.34Å; V506-L549 HydrophobicContact CG2-CB 3.67Å; T509-L549 HydrophobicContact CG2-CD1 3.86Å; E545-L549 HydrophobicContact CG-CD1 4.2Å; E545-L549 HydrophobicContact CG-CG 4.39Å; E545-L549 WeakPolarHBondContact O-CB 3.46Å; E545-L549 WeakPolarHBondContact O-CG 3.32Å; E545-L549 PolarHBondContact O-N 3.14Å; R546-L549 PolarHBondContact O-N 2.96Å; R546-L549 VanDerWaalsContact O-N 3.12Å; L549-A553 WeakPolarHBondContact O-CB 3.34Å; L549-A553 PolarHBondContact O-N 3.13Å; L549-T689 HydrophobicContact CD2-CG2 3.39Å; L549-T689 HydrophobicContact CG-CG2 4.26Å
550	E	90.8	Very high	89.3	Confident	49 Å²	49	57.7 Å²	57.7	23%	0.229	28%	0.282	C	S	.	.	H	α-helix	trans	-64	-41.5	172.4	-73.4	-174.3	-143.4	0	0	112.4	V506 R546 R548 A553 R554	V506-E550 HydrophobicContact CG1-CG 4.19Å; V506-E550 HydrophobicContact CG2-CG 4.46Å; R546-E550 IonicContact CZ-OE1 3.54Å; R546-E550 IonicContact NE-OE1 3.5Å; R546-E550 IonicContact NH1-OE1 3.81Å; R546-E550 IonicContact NH2-OE1 4Å; R546-E550 PolarHBondContact O-N 3.33Å; R548-E550 VanDerWaalsContact C-N 3.3Å; R548-E550 PolarHBondContact O-N 3.44Å; E550-A553 WeakPolarHBondContact O-CB 3.36Å; E550-A553 PolarHBondContact O-N 2.82Å; E550-R554 VanDerWaalsContact O-CG 3.31Å; E550-R554 WeakPolarHBondContact O-CG 3.38Å; E550-R554 PolarHBondContact O-N 2.83Å; E550-R554 IonicContact OE2-CZ 3.84Å; E550-R554 IonicContact OE2-NH2 2.72Å; E550-R554 PolarHBondContact OE2-NH2 2.71Å
551	A	89.7	Confident	89.1	Confident	47 Å²	47	54 Å²	54	39%	0.388	28%	0.275	S	S	.	.	H	α-helix	trans	-63	-45.2	177.3	0	0	0	0	0	111.7	D547 R548 A553 R554 R555	D547-A551 PolarHBondContact O-N 3.48Å; D547-A551 VanDerWaalsContact O-N 3.1Å; R548-A551 WeakPolarHBondContact O-CB 3.4Å; R548-A551 PolarHBondContact O-N 2.83Å; R548-A551 VanDerWaalsContact O-N 3.13Å; A551-A553 VanDerWaalsContact C-N 3.27Å; A551-A553 PolarHBondContact O-N 3.15Å; A551-R554 PolarHBondContact O-N 3.27Å; A551-R555 PolarHBondContact O-N 2.96Å
552	L	86.7	Confident	89.2	Confident	5 Å²	5	54.9 Å²	54.9	3%	0.026	29%	0.285	C	S	.	.	H	α-helix	trans	-60.5	-36.7	172.7	-65.6	172.7	0	0	0	111.5	L502 R548 R555 L556 T689 E693 L696	L502-L552 HydrophobicContact CD2-CB 4Å; R548-L552 HydrophobicContact CG-CD1 4.45Å; R548-L552 WeakPolarHBondContact O-CG 3.45Å; R548-L552 PolarHBondContact O-N 2.93Å; L552-R555 PolarHBondContact O-N 3.03Å; L552-L556 VanDerWaalsContact O-CB 3.26Å; L552-L556 WeakPolarHBondContact O-CB 3.34Å; L552-L556 PolarHBondContact O-N 3.39Å; L552-T689 HydrophobicContact CD1-CG2 4.25Å; L552-E693 HydrophobicContact CD2-CB 3.91Å; L552-E693 HydrophobicContact CD2-CG 3.99Å; L552-L696 HydrophobicContact CB-CD1 4.31Å; L552-L696 HydrophobicContact CD2-CD1 3.88Å
553	A	88.3	Confident	89.3	Confident	26 Å²	26	55.2 Å²	55.2	22%	0.215	29%	0.288	C	S	.	.	H	α-helix	trans	-67.1	-35.9	177.5	0	0	0	0	0	112.6	L502 L549 E550 A551 H557	L502-A553 VanDerWaalsContact CD2-CA 3.49Å; L502-A553 HydrophobicContact CD2-CB 3.72Å; L502-A553 HydrophobicContact CG-CB 4.03Å; L549-A553 WeakPolarHBondContact O-CB 3.34Å; L549-A553 PolarHBondContact O-N 3.13Å; E550-A553 WeakPolarHBondContact O-CB 3.36Å; E550-A553 PolarHBondContact O-N 2.82Å; A551-A553 VanDerWaalsContact C-N 3.27Å; A551-A553 PolarHBondContact O-N 3.15Å; A553-H557 VanDerWaalsContact O-CB 3.26Å; A553-H557 WeakPolarHBondContact O-CB 3.42Å; A553-H557 PolarHBondContact O-N 2.88Å
554	R	90.4	Very high	89.3	Confident	153 Å²	153	52.8 Å²	52.8	58%	0.577	29%	0.287	S	S	*	.	H	α-helix	trans	-69	-44.9	174.7	-64.3	169	-143.9	149.4	1.3	111.2	E550 A551 H557 S558	E550-R554 VanDerWaalsContact O-CG 3.31Å; E550-R554 WeakPolarHBondContact O-CG 3.38Å; E550-R554 PolarHBondContact O-N 2.83Å; E550-R554 IonicContact OE2-CZ 3.84Å; E550-R554 IonicContact OE2-NH2 2.72Å; E550-R554 PolarHBondContact OE2-NH2 2.71Å; A551-R554 PolarHBondContact O-N 3.27Å; R554-H557 PolarHBondContact O-N 2.98Å; R554-S558 PolarHBondContact O-N 2.81Å
555	R	90.5	Very high	89.5	Confident	58 Å²	58	52.3 Å²	52.3	22%	0.219	28%	0.281	C	S	.	.	H	α-helix	trans	-60.6	-50.8	175.4	-174.2	174.4	175.2	-141.6	3.6	111.4	A551 L552 H557 S558 L559 E693 F697 E700	A551-R555 PolarHBondContact O-N 2.96Å; L552-R555 PolarHBondContact O-N 3.03Å; R555-H557 VanDerWaalsContact C-N 3.32Å; R555-H557 PolarHBondContact O-N 2.72Å; R555-S558 WeakPolarHBondContact O-CB 3.4Å; R555-S558 PolarHBondContact O-N 3.41Å; R555-S558 VanDerWaalsContact O-N 3.12Å; R555-L559 HydrophobicContact CG-CD1 4.41Å; R555-L559 PolarHBondContact O-N 2.99Å; R555-E693 PolarHBondContact NH1-O 3.47Å; R555-F697 VanDerWaalsContact NH2-CA 3.31Å; R555-E700 IonicContact CZ-OE1 2.79Å; R555-E700 IonicContact CZ-OE2 3.83Å; R555-E700 VanDerWaalsContact CZ-OE2 3.27Å; R555-E700 IonicContact NE-OE1 3.26Å; R555-E700 PolarHBondContact NE-OE1 2.66Å; R555-E700 VanDerWaalsContact NE-OE1 3.14Å; R555-E700 IonicContact NE-OE2 3.77Å; R555-E700 PolarHBondContact NE-OE2 3.18Å; R555-E700 VanDerWaalsContact NE-OE2 3.08Å; R555-E700 IonicContact NH2-OE1 2.66Å; R555-E700 IonicContact NH2-OE2 2.64Å; R555-E700 PolarHBondContact NH2-OE2 3.12Å
556	L	90.3	Very high	89.9	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.01	29%	0.293	C	S	.	.	H	α-helix	trans	-58.9	-39.6	176.2	-179.6	58	0	0	0	112.6	S495 L498 L502 L552 S560 L696	S495-L556 VanDerWaalsContact OG-CD1 3.27Å; S495-L556 WeakPolarHBondContact OG-CD1 3.32Å; L498-L556 HydrophobicContact CB-CD2 3.75Å; L502-L556 HydrophobicContact CD2-CD2 4.37Å; L552-L556 VanDerWaalsContact O-CB 3.26Å; L552-L556 WeakPolarHBondContact O-CB 3.34Å; L552-L556 PolarHBondContact O-N 3.39Å; L556-S560 WeakPolarHBondContact O-CB 3.26Å; L556-S560 PolarHBondContact O-N 3.37Å; L556-L696 HydrophobicContact CB-CD1 4.48Å; L556-L696 HydrophobicContact CB-CD2 3.82Å; L556-L696 HydrophobicContact CD1-CD2 3.76Å; L556-L696 HydrophobicContact CG-CD2 4.33Å
557	H	90.1	Very high	90.3	Very high	133 Å²	133	52.2 Å²	52.2	62%	0.616	28%	0.284	S	S	*	.	H	α-helix	trans	-65.9	-38.4	176.2	-174.8	33.9	0	0	0	112.3	A553 R554 R555 S560 S561	A553-H557 VanDerWaalsContact O-CB 3.26Å; A553-H557 WeakPolarHBondContact O-CB 3.42Å; A553-H557 PolarHBondContact O-N 2.88Å; R554-H557 PolarHBondContact O-N 2.98Å; R555-H557 VanDerWaalsContact C-N 3.32Å; R555-H557 PolarHBondContact O-N 2.72Å; H557-S560 PolarHBondContact O-N 3.05Å; H557-S561 WeakPolarHBondContact O-CB 3.15Å; H557-S561 PolarHBondContact O-N 3.25Å
558	S	90.8	Very high	90.5	Very high	78 Å²	78	51.4 Å²	51.4	55%	0.545	29%	0.287	S	S	.	.	H	α-helix	trans	-60.2	-54.5	174.4	-161.1	0	0	0	0	111.2	R554 R555 S560 S561 G562	R554-S558 PolarHBondContact O-N 2.81Å; R555-S558 WeakPolarHBondContact O-CB 3.4Å; R555-S558 PolarHBondContact O-N 3.41Å; R555-S558 VanDerWaalsContact O-N 3.12Å; S558-S560 VanDerWaalsContact C-N 3.31Å; S558-S560 PolarHBondContact O-N 3.3Å; S558-S561 WeakPolarHBondContact O-CA 3.45Å; S558-S561 WeakPolarHBondContact O-CB 3.21Å; S558-S561 PolarHBondContact O-N 2.67Å; S558-S561 PolarHBondContact O-OG 2.92Å; S558-G562 PolarHBondContact O-N 3.42Å
559	L	88.1	Confident	90.9	Very high	34 Å²	34	55 Å²	55	18%	0.178	30%	0.3	C	S	.	.	H	α-helix	trans	-61.1	-38.2	177.8	-62.7	173.8	0	0	0	112.3	R555 S561 S563 L696 M699 E700	R555-L559 HydrophobicContact CG-CD1 4.41Å; R555-L559 PolarHBondContact O-N 2.99Å; L559-S561 VanDerWaalsContact C-N 3.26Å; L559-S561 PolarHBondContact O-N 3.47Å; L559-S563 PolarHBondContact O-N 3.31Å; L559-S563 VanDerWaalsContact O-N 3.09Å; L559-S563 PolarHBondContact O-OG 2.84Å; L559-L696 HydrophobicContact CD1-CD2 3.8Å; L559-M699 HydrophobicContact CD1-CB 4.32Å; L559-E700 HydrophobicContact CD1-CB 4.08Å; L559-E700 HydrophobicContact CD2-CB 4.11Å; L559-E700 HydrophobicContact CD2-CG 4.02Å
560	S	89.9	Confident	91.4	Very high	19 Å²	19	55.4 Å²	55.4	13%	0.133	30%	0.302	C	S	.	.	H	α-helix	trans	-63.4	-29	172.7	-173.7	0	0	0	0	113.3	S495 L556 H557 S558 S563 S564	S495-S560 VanDerWaalsContact OG-CB 3.3Å; S495-S560 WeakPolarHBondContact OG-CB 3.12Å; L556-S560 WeakPolarHBondContact O-CB 3.26Å; L556-S560 PolarHBondContact O-N 3.37Å; H557-S560 PolarHBondContact O-N 3.05Å; S558-S560 VanDerWaalsContact C-N 3.31Å; S558-S560 PolarHBondContact O-N 3.3Å; S560-S563 PolarHBondContact O-OG 3.38Å; S560-S564 WeakPolarHBondContact O-CB 3.41Å; S560-S564 PolarHBondContact O-N 2.89Å
561	S	89.9	Confident	91.7	Very high	64 Å²	64	58 Å²	58	45%	0.448	31%	0.313	S	S	.	.	H	α-helix	trans	-80.6	-40.9	179.4	74.6	0	0	0	0	111.7	H557 S558 L559 S564 Q565	H557-S561 WeakPolarHBondContact O-CB 3.15Å; H557-S561 PolarHBondContact O-N 3.25Å; S558-S561 WeakPolarHBondContact O-CA 3.45Å; S558-S561 WeakPolarHBondContact O-CB 3.21Å; S558-S561 PolarHBondContact O-N 2.67Å; S558-S561 PolarHBondContact O-OG 2.92Å; L559-S561 VanDerWaalsContact C-N 3.26Å; L559-S561 PolarHBondContact O-N 3.47Å; S561-S564 PolarHBondContact O-N 2.94Å; S561-Q565 PolarHBondContact O-N 3.29Å
562	G	89.6	Confident	92	Very high	36 Å²	36	62.5 Å²	62.5	37%	0.371	33%	0.326	S	S	.	.	H	α-helix	trans	-60.2	-57.3	173.8	0	0	0	0	0	111.8	S558 S564 Q565 E566	S558-G562 PolarHBondContact O-N 3.42Å; G562-S564 VanDerWaalsContact C-N 3.26Å; G562-S564 PolarHBondContact O-N 3.23Å; G562-Q565 WeakPolarHBondContact O-CA 3.29Å; G562-Q565 WeakPolarHBondContact O-CB 3.3Å; G562-Q565 PolarHBondContact O-N 3.24Å; G562-E566 WeakPolarHBondContact O-CB 3.33Å; G562-E566 PolarHBondContact O-N 2.94Å
563	S	89.8	Confident	92.5	Very high	14 Å²	14	67.1 Å²	67.1	10%	0.098	35%	0.347	C	S	.	.	H	α-helix	trans	-59.3	-31.7	177.1	52.5	0	0	0	0	113.7	L559 S560 L567	L559-S563 PolarHBondContact O-N 3.31Å; L559-S563 VanDerWaalsContact O-N 3.09Å; L559-S563 PolarHBondContact O-OG 2.84Å; S560-S563 PolarHBondContact O-OG 3.38Å; S563-L567 VanDerWaalsContact O-CB 3.28Å; S563-L567 WeakPolarHBondContact O-CB 3.49Å; S563-L567 PolarHBondContact O-N 3.32Å
564	S	92.2	Very high	92.9	Very high	57 Å²	57	69 Å²	69	40%	0.399	35%	0.349	S	S	.	.	H	α-helix	trans	-74	-28.3	173.2	-172.7	0	0	0	0	113.5	S560 S561 G562 A568	S560-S564 WeakPolarHBondContact O-CB 3.41Å; S560-S564 PolarHBondContact O-N 2.89Å; S561-S564 PolarHBondContact O-N 2.94Å; G562-S564 VanDerWaalsContact C-N 3.26Å; G562-S564 PolarHBondContact O-N 3.23Å; S564-A568 PolarHBondContact O-N 3.41Å
565	Q	94.3	Very high	93.2	Very high	113 Å²	113	66.6 Å²	66.6	53%	0.528	34%	0.344	S	S	.	.	H	α-helix	trans	-77	-40.9	173.2	-173.4	-175.8	0.9	0	0	110.8	S561 G562 A568 R569	S561-Q565 PolarHBondContact O-N 3.29Å; G562-Q565 WeakPolarHBondContact O-CA 3.29Å; G562-Q565 WeakPolarHBondContact O-CB 3.3Å; G562-Q565 PolarHBondContact O-N 3.24Å; Q565-A568 WeakPolarHBondContact O-CA 3.25Å; Q565-A568 WeakPolarHBondContact O-CB 3.29Å; Q565-A568 PolarHBondContact O-N 2.84Å; Q565-R569 PolarHBondContact O-N 2.79Å
566	E	93.4	Very high	93.5	Very high	70 Å²	70	70.2 Å²	70.2	33%	0.327	36%	0.364	S	S	.	.	H	α-helix	trans	-58.1	-50.4	174.2	-166.2	-156	161.7	0	0	111.1	G562 A568 R569 M570	G562-E566 WeakPolarHBondContact O-CB 3.33Å; G562-E566 PolarHBondContact O-N 2.94Å; E566-A568 PolarHBondContact O-N 2.91Å; E566-A568 VanDerWaalsContact O-N 3.14Å; E566-R569 WeakPolarHBondContact O-CA 3.25Å; E566-R569 WeakPolarHBondContact O-CB 3.34Å; E566-R569 PolarHBondContact O-N 3.07Å; E566-M570 HydrophobicContact CG-CE 3.95Å; E566-M570 WeakPolarHBondContact O-CG 3.44Å; E566-M570 PolarHBondContact O-N 3.4Å; E566-M570 WeakPolarHBondContact OE1-CE 3.42Å
567	L	95.7	Very high	93.8	Very high	8 Å²	8	71.1 Å²	71.1	4%	0.042	37%	0.368	C	S	.	.	H	α-helix	trans	-59	-25.8	173.2	177.9	60.6	0	0	0	113.2	M485 A488 T489 V492 S563 K571	M485-L567 HydrophobicContact CB-CD1 4.47Å; M485-L567 HydrophobicContact CG-CD1 4.45Å; A488-L567 HydrophobicContact CB-CB 4.42Å; A488-L567 HydrophobicContact CB-CD1 4.05Å; T489-L567 WeakPolarHBondContact OG1-CD1 3.43Å; V492-L567 HydrophobicContact CB-CD2 4.44Å; V492-L567 HydrophobicContact CG2-CD2 4.14Å; S563-L567 VanDerWaalsContact O-CB 3.28Å; S563-L567 WeakPolarHBondContact O-CB 3.49Å; S563-L567 PolarHBondContact O-N 3.32Å; L567-K571 WeakPolarHBondContact O-CD 3.3Å; L567-K571 VanDerWaalsContact O-CG 3.23Å; L567-K571 WeakPolarHBondContact O-CG 3.5Å; L567-K571 PolarHBondContact O-N 3.41Å
568	A	95.9	Very high	94	Very high	53 Å²	53	70.7 Å²	70.7	44%	0.438	36%	0.361	S	S	.	.	H	α-helix	trans	-75.3	-41.5	172.2	0	0	0	0	0	111.8	S564 Q565 E566 K571 E572	S564-A568 PolarHBondContact O-N 3.41Å; Q565-A568 WeakPolarHBondContact O-CA 3.25Å; Q565-A568 WeakPolarHBondContact O-CB 3.29Å; Q565-A568 PolarHBondContact O-N 2.84Å; E566-A568 PolarHBondContact O-N 2.91Å; E566-A568 VanDerWaalsContact O-N 3.14Å; A568-K571 WeakPolarHBondContact O-CB 3.48Å; A568-K571 PolarHBondContact O-N 2.94Å; A568-E572 PolarHBondContact O-N 2.98Å
569	R	96.4	Very high	94.2	Very high	132 Å²	132	71.4 Å²	71.4	50%	0.498	36%	0.358	S	S	.	.	H	α-helix	trans	-60.2	-44.9	172.4	-61.2	174.2	-164.7	155.6	5.1	111.4	Q565 E566 K571 E572 Q573	Q565-R569 PolarHBondContact O-N 2.79Å; E566-R569 WeakPolarHBondContact O-CA 3.25Å; E566-R569 WeakPolarHBondContact O-CB 3.34Å; E566-R569 PolarHBondContact O-N 3.07Å; R569-K571 VanDerWaalsContact C-N 3.29Å; R569-K571 PolarHBondContact O-N 3.31Å; R569-E572 PolarHBondContact O-N 2.84Å; R569-E572 VanDerWaalsContact O-N 3.15Å; R569-Q573 WeakPolarHBondContact O-CB 3.48Å; R569-Q573 WeakPolarHBondContact O-CG 3.39Å; R569-Q573 PolarHBondContact O-N 3.19Å
570	M	97.1	Very high	94.6	Very high	12 Å²	12	73.2 Å²	73.2	6%	0.059	37%	0.366	C	S	.	.	H	α-helix	trans	-58.4	-40.6	175.4	-64.4	177.7	-172.5	0	0	112.2	L481 M485 A488 E566 R574	L481-M570 HydrophobicContact CD1-CB 4.08Å; L481-M570 HydrophobicContact CD1-CG 4.2Å; M485-M570 HydrophobicContact CG-CB 3.59Å; M485-M570 HydrophobicContact CG-CG 4.43Å; M485-M570 HydrophobicContact CG-SD 4.07Å; M485-M570 HydrophobicContact SD-CB 4.25Å; A488-M570 HydrophobicContact CB-CE 3.82Å; A488-M570 HydrophobicContact CB-SD 3.76Å; E566-M570 HydrophobicContact CG-CE 3.95Å; E566-M570 WeakPolarHBondContact O-CG 3.44Å; E566-M570 PolarHBondContact O-N 3.4Å; E566-M570 WeakPolarHBondContact OE1-CE 3.42Å; M570-R574 VanDerWaalsContact O-CB 3.25Å; M570-R574 WeakPolarHBondContact O-CB 3.27Å; M570-R574 PolarHBondContact O-N 3.33Å
571	K	96.4	Very high	94.7	Very high	105 Å²	105	73.2 Å²	73.2	46%	0.457	36%	0.364	S	S	.	.	H	α-helix	trans	-65.4	-38.9	176.7	-76.8	165.8	-176.2	172	0	112.1	M485 L567 A568 R569 Q575	M485-K571 HydrophobicContact CE-CB 4.48Å; M485-K571 HydrophobicContact CE-CG 3.49Å; M485-K571 VanDerWaalsContact CE-CG 3.49Å; M485-K571 HydrophobicContact SD-CG 4.28Å; L567-K571 WeakPolarHBondContact O-CD 3.3Å; L567-K571 VanDerWaalsContact O-CG 3.23Å; L567-K571 WeakPolarHBondContact O-CG 3.5Å; L567-K571 PolarHBondContact O-N 3.41Å; A568-K571 WeakPolarHBondContact O-CB 3.48Å; A568-K571 PolarHBondContact O-N 2.94Å; R569-K571 VanDerWaalsContact C-N 3.29Å; R569-K571 PolarHBondContact O-N 3.31Å; K571-Q575 WeakPolarHBondContact O-CB 3.5Å; K571-Q575 PolarHBondContact O-N 3.4Å
572	E	97.2	Very high	94.9	Very high	140 Å²	140	75.4 Å²	75.4	65%	0.654	37%	0.367	S	S	*	.	H	α-helix	trans	-67.8	-48.5	175.7	-174.1	167.9	-151.7	0	0	111.5	A568 R569 R574 Q575 Q576	A568-E572 PolarHBondContact O-N 2.98Å; R569-E572 PolarHBondContact O-N 2.84Å; R569-E572 VanDerWaalsContact O-N 3.15Å; E572-R574 VanDerWaalsContact C-N 3.33Å; E572-R574 PolarHBondContact O-N 2.84Å; E572-Q575 PolarHBondContact O-N 3.04Å; E572-Q575 VanDerWaalsContact O-N 3.12Å; E572-Q576 PolarHBondContact O-N 3.02Å
573	Q	96.5	Very high	95.1	Very high	103 Å²	103	79 Å²	79	48%	0.481	37%	0.374	S	S	.	.	H	α-helix	trans	-55.9	-45	172.9	-73.2	170.9	-32.6	0	0	111.9	L481 R569 Q575 Q576 L577	L481-Q573 HydrophobicContact CD2-CB 3.93Å; R569-Q573 WeakPolarHBondContact O-CB 3.48Å; R569-Q573 WeakPolarHBondContact O-CG 3.39Å; R569-Q573 PolarHBondContact O-N 3.19Å; Q573-Q575 PolarHBondContact O-N 3.29Å; Q573-Q576 PolarHBondContact O-N 2.87Å; Q573-L577 WeakPolarHBondContact O-CG 3.41Å; Q573-L577 PolarHBondContact O-N 3.06Å
574	R	96.8	Very high	95.2	Very high	65 Å²	65	82.1 Å²	82.1	25%	0.245	38%	0.384	C	S	.	.	H	α-helix	trans	-62	-43.5	175.9	-171.8	-160.8	161.5	-179.7	7.4	111.6	E478 L481 N482 M485 M570 E572 Q576 L577 R578	E478-R574 HydrophobicContact CG-CG 3.9Å; E478-R574 IonicContact OE1-CZ 2.68Å; E478-R574 IonicContact OE1-NE 3.98Å; E478-R574 PolarHBondContact OE1-NE 2.97Å; E478-R574 IonicContact OE1-NH2 3.31Å; E478-R574 PolarHBondContact OE1-NH2 3.15Å; L481-R574 HydrophobicContact CD2-CB 3.76Å; L481-R574 HydrophobicContact CG-CB 4.36Å; N482-R574 PolarHBondContact ND2-NE 2.95Å; N482-R574 PolarHBondContact OD1-NE 3.18Å; N482-R574 PolarHBondContact OD1-NH1 3.03Å; N482-R574 PolarHBondContact OD1-NH2 3.36Å; M485-R574 HydrophobicContact SD-CB 3.77Å; M485-R574 VanDerWaalsContact SD-CD 3.56Å; M485-R574 HydrophobicContact SD-CG 4.12Å; M570-R574 VanDerWaalsContact O-CB 3.25Å; M570-R574 WeakPolarHBondContact O-CB 3.27Å; M570-R574 PolarHBondContact O-N 3.33Å; E572-R574 VanDerWaalsContact C-N 3.33Å; E572-R574 PolarHBondContact O-N 2.84Å; R574-Q576 VanDerWaalsContact C-N 3.31Å; R574-Q576 PolarHBondContact O-N 3.45Å; R574-L577 PolarHBondContact O-N 2.64Å; R574-R578 VanDerWaalsContact O-CB 3.29Å; R574-R578 WeakPolarHBondContact O-CB 3.36Å; R574-R578 PolarHBondContact O-N 3.04Å
575	Q	96.4	Very high	95.2	Very high	103 Å²	103	83.2 Å²	83.2	48%	0.481	38%	0.383	S	S	.	.	H	α-helix	trans	-64	-37.8	177.7	-175.2	58.5	40	0	0	111.5	K571 E572 Q573 L579	K571-Q575 WeakPolarHBondContact O-CB 3.5Å; K571-Q575 PolarHBondContact O-N 3.4Å; E572-Q575 PolarHBondContact O-N 3.04Å; E572-Q575 VanDerWaalsContact O-N 3.12Å; Q573-Q575 PolarHBondContact O-N 3.29Å; Q575-L579 HydrophobicContact CG-CD1 4.29Å; Q575-L579 VanDerWaalsContact O-CG 3.3Å; Q575-L579 WeakPolarHBondContact O-CG 3.47Å; Q575-L579 PolarHBondContact O-N 3.14Å
576	Q	96.4	Very high	95.1	Very high	134 Å²	134	80.5 Å²	80.5	63%	0.626	38%	0.38	S	S	*	.	H	α-helix	trans	-65	-50.5	173.9	-177.8	176.6	-14	0	0	111.9	E572 Q573 R574 R578 L579 E580	E572-Q576 PolarHBondContact O-N 3.02Å; Q573-Q576 PolarHBondContact O-N 2.87Å; R574-Q576 VanDerWaalsContact C-N 3.31Å; R574-Q576 PolarHBondContact O-N 3.45Å; Q576-R578 VanDerWaalsContact C-N 3.25Å; Q576-R578 PolarHBondContact O-N 2.94Å; Q576-L579 PolarHBondContact O-N 2.67Å; Q576-E580 PolarHBondContact O-N 3.37Å
577	L	96	Very high	95.1	Very high	20 Å²	20	82 Å²	82	11%	0.105	39%	0.389	C	S	.	.	H	α-helix	trans	-56.7	-40	176.1	-73.1	170.4	0	0	0	111.9	L474 Q477 L481 Q573 R574 E580 L581	L474-L577 HydrophobicContact CD2-CD2 3.75Å; Q477-L577 HydrophobicContact CG-CD1 3.97Å; Q477-L577 HydrophobicContact CG-CD2 4.37Å; L481-L577 HydrophobicContact CD2-CD1 3.8Å; Q573-L577 WeakPolarHBondContact O-CG 3.41Å; Q573-L577 PolarHBondContact O-N 3.06Å; R574-L577 PolarHBondContact O-N 2.64Å; L577-E580 PolarHBondContact O-N 3.44Å; L577-L581 WeakPolarHBondContact O-CB 3.09Å; L577-L581 PolarHBondContact O-N 3.41Å
578	R	94.9	Very high	94.9	Very high	125 Å²	125	83.2 Å²	83.2	47%	0.472	40%	0.395	S	S	.	.	H	α-helix	trans	-68.9	-40.9	179.5	-170.4	174	-173.6	160.7	5.4	112.9	R574 Q576 E580 L581 E582	R574-R578 VanDerWaalsContact O-CB 3.29Å; R574-R578 WeakPolarHBondContact O-CB 3.36Å; R574-R578 PolarHBondContact O-N 3.04Å; Q576-R578 VanDerWaalsContact C-N 3.25Å; Q576-R578 PolarHBondContact O-N 2.94Å; R578-E580 VanDerWaalsContact C-N 3.32Å; R578-L581 PolarHBondContact O-N 3.49Å; R578-E582 WeakPolarHBondContact O-CB 3.12Å; R578-E582 PolarHBondContact O-N 3.08Å
579	L	95.4	Very high	94.8	Very high	93 Å²	93	82.4 Å²	82.4	49%	0.487	38%	0.382	S	S	.	.	H	α-helix	trans	-66.2	-35.8	173.7	-72.6	168	0	0	0	111.6	Q575 Q576 H583	Q575-L579 HydrophobicContact CG-CD1 4.29Å; Q575-L579 VanDerWaalsContact O-CG 3.3Å; Q575-L579 WeakPolarHBondContact O-CG 3.47Å; Q575-L579 PolarHBondContact O-N 3.14Å; Q576-L579 PolarHBondContact O-N 2.67Å; L579-H583 VanDerWaalsContact O-CB 3.29Å; L579-H583 WeakPolarHBondContact O-CB 3.44Å; L579-H583 PolarHBondContact O-N 2.91Å
580	E	95.5	Very high	94.7	Very high	72 Å²	72	79.6 Å²	79.6	34%	0.336	38%	0.382	S	S	.	.	H	α-helix	trans	-70.4	-39.7	174.4	-173.2	170.7	-161.9	0	0	112.3	L474 Q576 L577 R578 H583 R584	L474-E580 HydrophobicContact CD1-CB 4.31Å; L474-E580 HydrophobicContact CD1-CG 3.83Å; Q576-E580 PolarHBondContact O-N 3.37Å; L577-E580 PolarHBondContact O-N 3.44Å; R578-E580 VanDerWaalsContact C-N 3.32Å; E580-H583 PolarHBondContact O-N 2.9Å; E580-R584 HydrophobicContact CG-CG 4.28Å; E580-R584 WeakPolarHBondContact O-CB 3.17Å; E580-R584 WeakPolarHBondContact O-CG 3.25Å; E580-R584 PolarHBondContact O-N 3.41Å; E580-R584 IonicContact OE1-CZ 3.84Å; E580-R584 IonicContact OE1-NE 3.14Å; E580-R584 PolarHBondContact OE1-NE 2.91Å; E580-R584 IonicContact OE1-NH2 2.66Å; E580-R584 PolarHBondContact OE1-NH2 2.89Å; E580-R584 IonicContact OE2-NH2 2.65Å
581	L	93.6	Very high	94.5	Very high	18 Å²	18	86.6 Å²	86.6	9%	0.094	41%	0.408	C	S	.	.	H	α-helix	trans	-57.8	-54.9	172.9	-170.8	79.7	0	0	0	110.2	T471 L474 Q475 L577 R578 H583 R584 E585	T471-L581 WeakPolarHBondContact O-CD1 3.04Å; L474-L581 HydrophobicContact CB-CD1 3.93Å; Q475-L581 HydrophobicContact CB-CD1 4.19Å; L577-L581 WeakPolarHBondContact O-CB 3.09Å; L577-L581 PolarHBondContact O-N 3.41Å; R578-L581 PolarHBondContact O-N 3.49Å; L581-H583 VanDerWaalsContact C-N 3.28Å; L581-H583 PolarHBondContact O-N 2.98Å; L581-R584 PolarHBondContact O-N 2.92Å; L581-R584 VanDerWaalsContact O-N 3.16Å; L581-E585 HydrophobicContact CG-CG 4.41Å; L581-E585 WeakPolarHBondContact O-CB 3.25Å; L581-E585 WeakPolarHBondContact O-CG 3.5Å; L581-E585 PolarHBondContact O-N 2.87Å
582	E	93.1	Very high	94.4	Very high	110 Å²	110	82.1 Å²	82.1	51%	0.514	39%	0.389	S	S	.	.	H	α-helix	trans	-56.5	-41.4	178	-177.6	177	-173.2	0	0	111.9	R578 A586	R578-E582 WeakPolarHBondContact O-CB 3.12Å; R578-E582 PolarHBondContact O-N 3.08Å; E582-A586 VanDerWaalsContact O-CB 3.27Å; E582-A586 WeakPolarHBondContact O-CB 3.3Å; E582-A586 PolarHBondContact O-N 2.86Å
583	H	93.3	Very high	94.3	Very high	112 Å²	112	81.1 Å²	81.1	52%	0.519	38%	0.382	S	S	.	.	H	α-helix	trans	-64.8	-46.6	176.2	-178.4	52.5	0	0	0	112.7	L579 E580 L581 A586 L587	L579-H583 VanDerWaalsContact O-CB 3.29Å; L579-H583 WeakPolarHBondContact O-CB 3.44Å; L579-H583 PolarHBondContact O-N 2.91Å; E580-H583 PolarHBondContact O-N 2.9Å; L581-H583 VanDerWaalsContact C-N 3.28Å; L581-H583 PolarHBondContact O-N 2.98Å; H583-A586 PolarHBondContact O-N 3.14Å; H583-L587 WeakPolarHBondContact O-CB 3.45Å; H583-L587 VanDerWaalsContact O-CG 3.32Å; H583-L587 WeakPolarHBondContact O-CG 3.43Å; H583-L587 PolarHBondContact O-N 2.91Å
584	R	93	Very high	94.3	Very high	79 Å²	79	80.8 Å²	80.8	30%	0.298	38%	0.381	S	S	.	.	H	α-helix	trans	-68.8	-35.5	178.7	-68.3	-179.9	-175	-168.9	0.2	111.8	S470 T471 E580 L581 H588	S470-R584 PolarHBondContact O-NH1 2.71Å; T471-R584 HydrophobicContact CG2-CB 3.62Å; E580-R584 HydrophobicContact CG-CG 4.28Å; E580-R584 WeakPolarHBondContact O-CB 3.17Å; E580-R584 WeakPolarHBondContact O-CG 3.25Å; E580-R584 PolarHBondContact O-N 3.41Å; E580-R584 IonicContact OE1-CZ 3.84Å; E580-R584 IonicContact OE1-NE 3.14Å; E580-R584 PolarHBondContact OE1-NE 2.91Å; E580-R584 IonicContact OE1-NH2 2.66Å; E580-R584 PolarHBondContact OE1-NH2 2.89Å; E580-R584 IonicContact OE2-NH2 2.65Å; L581-R584 PolarHBondContact O-N 2.92Å; L581-R584 VanDerWaalsContact O-N 3.16Å; R584-H588 WeakPolarHBondContact O-CB 3.42Å; R584-H588 PolarHBondContact O-N 3.14Å
585	E	92.1	Very high	94.2	Very high	81 Å²	81	77.9 Å²	77.9	38%	0.379	37%	0.371	S	S	.	.	H	α-helix	trans	-64.5	-48.5	172.7	-74.9	-176.7	155.1	0	0	111.3	L581 L587 H588 E589	L581-E585 HydrophobicContact CG-CG 4.41Å; L581-E585 WeakPolarHBondContact O-CB 3.25Å; L581-E585 WeakPolarHBondContact O-CG 3.5Å; L581-E585 PolarHBondContact O-N 2.87Å; E585-L587 VanDerWaalsContact C-N 3.32Å; E585-L587 PolarHBondContact O-N 3.07Å; E585-H588 WeakPolarHBondContact O-CB 3.35Å; E585-H588 PolarHBondContact O-N 3.33Å; E585-H588 VanDerWaalsContact O-N 3.07Å; E585-E589 PolarHBondContact O-N 3.27Å
586	A	92.2	Very high	94.3	Very high	56 Å²	56	73 Å²	73	46%	0.463	35%	0.348	S	S	.	.	H	α-helix	trans	-62	-37.4	176.8	0	0	0	0	0	112.7	E582 H583 S590	E582-A586 VanDerWaalsContact O-CB 3.27Å; E582-A586 WeakPolarHBondContact O-CB 3.3Å; E582-A586 PolarHBondContact O-N 2.86Å; H583-A586 PolarHBondContact O-N 3.14Å; A586-S590 VanDerWaalsContact O-CB 3.23Å; A586-S590 WeakPolarHBondContact O-CB 3.45Å; A586-S590 PolarHBondContact O-N 3.31Å
587	L	92.8	Very high	94.3	Very high	100 Å²	100	69.2 Å²	69.2	52%	0.524	33%	0.334	S	S	.	.	H	α-helix	trans	-64.5	-39.5	171.9	-75.6	174.3	0	0	0	112.3	H583 E585 R591	H583-L587 WeakPolarHBondContact O-CB 3.45Å; H583-L587 VanDerWaalsContact O-CG 3.32Å; H583-L587 WeakPolarHBondContact O-CG 3.43Å; H583-L587 PolarHBondContact O-N 2.91Å; E585-L587 VanDerWaalsContact C-N 3.32Å; E585-L587 PolarHBondContact O-N 3.07Å; L587-R591 WeakPolarHBondContact O-CB 3.48Å; L587-R591 PolarHBondContact O-N 3.44Å; L587-R591 VanDerWaalsContact O-N 3.09Å
588	H	92.6	Very high	94.3	Very high	34 Å²	34	71.8 Å²	71.8	16%	0.157	34%	0.344	C	S	.	.	H	α-helix	trans	-67.4	-48.7	176	-178.6	-104.3	0	0	0	111.8	S464 S466 R584 E585 S590 R591 L592	S464-H588 PolarHBondContact O-CE1 3.01Å; S464-H588 PolarHBondContact O-NE2 3Å; S466-H588 PolarHBondContact O-CE1 2.85Å; S466-H588 PolarHBondContact O-NE2 3.45Å; R584-H588 WeakPolarHBondContact O-CB 3.42Å; R584-H588 PolarHBondContact O-N 3.14Å; E585-H588 WeakPolarHBondContact O-CB 3.35Å; E585-H588 PolarHBondContact O-N 3.33Å; E585-H588 VanDerWaalsContact O-N 3.07Å; H588-S590 VanDerWaalsContact C-N 3.31Å; H588-S590 PolarHBondContact O-N 3.13Å; H588-R591 PolarHBondContact O-N 3.34Å; H588-L592 WeakPolarHBondContact O-CB 3.46Å; H588-L592 PolarHBondContact O-N 3.48Å
589	E	93.7	Very high	94.3	Very high	37 Å²	37	65.9 Å²	65.9	17%	0.173	32%	0.322	C	S	.	.	H	α-helix	trans	-60.8	-39.2	176.8	-72.5	-156.5	165	0	0	112.1	E585 K593 L633 R636	E585-E589 PolarHBondContact O-N 3.27Å; E589-K593 VanDerWaalsContact O-CB 3.25Å; E589-K593 WeakPolarHBondContact O-CB 3.39Å; E589-K593 PolarHBondContact O-N 3.04Å; E589-L633 HydrophobicContact CB-CD2 3.83Å; E589-L633 VanDerWaalsContact CD-CD2 3.42Å; E589-L633 HydrophobicContact CG-CD2 3.59Å; E589-R636 WeakPolarHBondContact OE1-CD 3.32Å; E589-R636 IonicContact OE1-CZ 3.51Å; E589-R636 IonicContact OE1-NE 3.06Å; E589-R636 IonicContact OE1-NH1 2.67Å; E589-R636 PolarHBondContact OE1-NH1 2.86Å
590	S	92.9	Very high	94.4	Very high	72 Å²	72	62 Å²	62	50%	0.503	30%	0.302	S	S	.	.	H	α-helix	trans	-63.1	-46.1	174.9	-169.7	0	0	0	0	112.1	A586 H588 K593 E594	A586-S590 VanDerWaalsContact O-CB 3.23Å; A586-S590 WeakPolarHBondContact O-CB 3.45Å; A586-S590 PolarHBondContact O-N 3.31Å; H588-S590 VanDerWaalsContact C-N 3.31Å; H588-S590 PolarHBondContact O-N 3.13Å; S590-K593 WeakPolarHBondContact O-CB 3.42Å; S590-K593 PolarHBondContact O-N 3.38Å; S590-E594 WeakPolarHBondContact O-CB 3.38Å; S590-E594 PolarHBondContact O-N 3.17Å
591	R	94	Very high	94.3	Very high	159 Å²	159	64.2 Å²	64.2	60%	0.6	31%	0.312	S	S	*	.	H	α-helix	trans	-65.7	-43	177.1	-171.9	-176.1	-60.1	-159.8	1.6	112.1	L587 H588 K593 E594 N595	L587-R591 WeakPolarHBondContact O-CB 3.48Å; L587-R591 PolarHBondContact O-N 3.44Å; L587-R591 VanDerWaalsContact O-N 3.09Å; H588-R591 PolarHBondContact O-N 3.34Å; R591-K593 VanDerWaalsContact C-N 3.32Å; R591-K593 PolarHBondContact O-N 2.79Å; R591-E594 PolarHBondContact O-N 3.27Å; R591-N595 WeakPolarHBondContact O-CB 3.41Å; R591-N595 PolarHBondContact O-N 2.98Å
592	L	94.2	Very high	94.3	Very high	11 Å²	11	65.5 Å²	65.5	6%	0.058	32%	0.319	C	S	.	.	H	α-helix	trans	-60.7	-43.3	175.8	176.5	58.2	0	0	0	110.8	I463 S464 H588 A596 L633	I463-L592 HydrophobicContact CB-CD1 4.39Å; I463-L592 HydrophobicContact CG1-CD1 4.43Å; I463-L592 HydrophobicContact CG2-CD1 3.96Å; S464-L592 WeakPolarHBondContact O-CD1 3.38Å; H588-L592 WeakPolarHBondContact O-CB 3.46Å; H588-L592 PolarHBondContact O-N 3.48Å; L592-A596 WeakPolarHBondContact O-CB 3.34Å; L592-A596 PolarHBondContact O-N 3.3Å; L592-L633 HydrophobicContact CD2-CD1 4.39Å; L592-L633 HydrophobicContact CG-CD1 4.28Å
593	K	95.5	Very high	94.3	Very high	119 Å²	119	60.4 Å²	60.4	52%	0.517	30%	0.295	S	S	.	.	H	α-helix	trans	-59.8	-51.2	174.5	-174.9	-177.4	178.3	-176.9	0	111.7	E589 S590 R591 A596 T597 L630 L633	E589-K593 VanDerWaalsContact O-CB 3.25Å; E589-K593 WeakPolarHBondContact O-CB 3.39Å; E589-K593 PolarHBondContact O-N 3.04Å; S590-K593 WeakPolarHBondContact O-CB 3.42Å; S590-K593 PolarHBondContact O-N 3.38Å; R591-K593 VanDerWaalsContact C-N 3.32Å; R591-K593 PolarHBondContact O-N 2.79Å; K593-A596 PolarHBondContact O-N 3.04Å; K593-T597 PolarHBondContact O-N 3.28Å; K593-T597 PolarHBondContact O-OG1 3.49Å; K593-L630 HydrophobicContact CB-CD2 4.48Å; K593-L630 HydrophobicContact CG-CD2 3.87Å; K593-L633 HydrophobicContact CB-CD1 3.82Å
594	E	95.8	Very high	94.3	Very high	96 Å²	96	59.2 Å²	59.2	45%	0.449	29%	0.29	S	S	.	.	H	α-helix	trans	-58.4	-49.7	-179.1	-176	-177.8	169.1	0	0	111.6	S590 R591 T597 K598	S590-E594 WeakPolarHBondContact O-CB 3.38Å; S590-E594 PolarHBondContact O-N 3.17Å; R591-E594 PolarHBondContact O-N 3.27Å; E594-T597 WeakPolarHBondContact CA-OG1 3.23Å; E594-T597 PolarHBondContact O-N 2.9Å; E594-T597 PolarHBondContact O-OG1 3.12Å; E594-K598 HydrophobicContact CG-CD 4.35Å; E594-K598 WeakPolarHBondContact O-CG 3.3Å; E594-K598 PolarHBondContact O-N 3.04Å; E594-K598 VanDerWaalsContact OE1-CE 3.25Å; E594-K598 WeakPolarHBondContact OE1-CE 3.48Å; E594-K598 IonicContact OE1-NZ 3.24Å; E594-K598 PolarHBondContact OE1-NZ 3.15Å
595	N	95.9	Very high	94.2	Very high	5 Å²	5	60.6 Å²	60.6	3%	0.027	30%	0.303	C	S	.	.	H	α-helix	trans	-68.4	-38.9	-179.5	-69.9	-9.2	0	0	0	111.9	N459 Q462 I463 R591 Y599	N459-N595 HydrophobicContact CB-CB 4.48Å; Q462-N595 WeakPolarHBondContact CB-ND2 3.35Å; Q462-N595 PolarHBondContact OE1-ND2 3.22Å; I463-N595 HydrophobicContact CG1-CB 4.12Å; R591-N595 WeakPolarHBondContact O-CB 3.41Å; R591-N595 PolarHBondContact O-N 2.98Å; N595-Y599 WeakPolarHBondContact O-CB 3.5Å; N595-Y599 PolarHBondContact O-N 3.38Å
596	A	96.8	Very high	93.9	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-61.7	-43.6	172.1	0	0	0	0	0	111.8	L592 K593 Y599 V600 L630	L592-A596 WeakPolarHBondContact O-CB 3.34Å; L592-A596 PolarHBondContact O-N 3.3Å; K593-A596 PolarHBondContact O-N 3.04Å; A596-Y599 PolarHBondContact O-N 3.35Å; A596-V600 VanDerWaalsContact O-CG2 3.3Å; A596-V600 WeakPolarHBondContact O-CG2 3.28Å; A596-V600 PolarHBondContact O-N 2.85Å; A596-L630 HydrophobicContact CB-CD1 4.49Å; A596-L630 HydrophobicContact CB-CD2 4Å; A596-L630 HydrophobicContact CB-CG 4.11Å
597	T	96.6	Very high	93.8	Very high	54 Å²	54	59.4 Å²	59.4	33%	0.331	29%	0.287	S	S	.	.	H	α-helix	trans	-62.7	-47.2	176.9	41.6	0	0	0	0	112.8	K593 E594 Y599 V600 E601 L630	K593-T597 PolarHBondContact O-N 3.28Å; K593-T597 PolarHBondContact O-OG1 3.49Å; E594-T597 WeakPolarHBondContact CA-OG1 3.23Å; E594-T597 PolarHBondContact O-N 2.9Å; E594-T597 PolarHBondContact O-OG1 3.12Å; T597-Y599 PolarHBondContact O-N 2.87Å; T597-V600 PolarHBondContact O-N 2.99Å; T597-E601 WeakPolarHBondContact O-CG 3.47Å; T597-E601 PolarHBondContact O-N 3.1Å; T597-L630 HydrophobicContact CG2-CD1 4.18Å; T597-L630 HydrophobicContact CG2-CD2 4.04Å
598	K	95.9	Very high	93.4	Very high	74 Å²	74	62.2 Å²	62.2	32%	0.322	30%	0.297	S	S	.	.	H	α-helix	trans	-63.2	-29.5	176.7	-66.3	167.7	-176.5	165.2	0	112.9	N459 E594 L602	N459-K598 HydrophobicContact CB-CB 4.39Å; N459-K598 WeakPolarHBondContact ND2-CB 3.48Å; N459-K598 WeakPolarHBondContact OD1-CD 3.38Å; E594-K598 HydrophobicContact CG-CD 4.35Å; E594-K598 WeakPolarHBondContact O-CG 3.3Å; E594-K598 PolarHBondContact O-N 3.04Å; E594-K598 VanDerWaalsContact OE1-CE 3.25Å; E594-K598 WeakPolarHBondContact OE1-CE 3.48Å; E594-K598 IonicContact OE1-NZ 3.24Å; E594-K598 PolarHBondContact OE1-NZ 3.15Å; K598-L602 PolarHBondContact O-N 3.28Å
599	Y	96.2	Very high	92.9	Very high	1 Å²	1	64.4 Å²	64.4	0%	0.004	32%	0.316	C	S	.	.	H	α-helix	trans	-80.8	-34.3	177.3	-168.4	-132.8	0	0	0	112.2	L336 L454 R460 I463 N595 A596 T597 L602 L603 D622	L336-Y599 HydrophobicContact CD1-CD1 4Å; L336-Y599 HydrophobicContact CD1-CE1 3.56Å; L336-Y599 HydrophobicContact CD2-CD1 4.33Å; L336-Y599 HydrophobicContact CD2-CE1 4.03Å; L336-Y599 HydrophobicContact CG-CE1 4.43Å; L454-Y599 VanDerWaalsContact CD1-OH 3.22Å; L454-Y599 WeakPolarHBondContact CD1-OH 3.33Å; R460-Y599 HydrophobicContact CB-CD2 4.1Å; R460-Y599 HydrophobicContact CB-CE1 4.22Å; R460-Y599 HydrophobicContact CB-CE2 3.74Å; R460-Y599 WeakPolarHBondContact CD-OH 3.32Å; R460-Y599 HydrophobicContact CG-CE1 4.04Å; R460-Y599 HydrophobicContact CG-CE2 4.07Å; I463-Y599 HydrophobicContact CD1-CD1 3.61Å; I463-Y599 HydrophobicContact CD1-CG 4.01Å; N595-Y599 WeakPolarHBondContact O-CB 3.5Å; N595-Y599 PolarHBondContact O-N 3.38Å; A596-Y599 PolarHBondContact O-N 3.35Å; T597-Y599 PolarHBondContact O-N 2.87Å; Y599-L602 HydrophobicContact CD2-CD2 4.14Å; Y599-L602 HydrophobicContact CE2-CD2 4.35Å; Y599-L602 PolarHBondContact O-N 2.92Å; Y599-L603 HydrophobicContact CD1-CD1 3.84Å; Y599-L603 HydrophobicContact CD2-CD1 4.47Å; Y599-L603 HydrophobicContact CD2-CG 4.29Å; Y599-L603 HydrophobicContact CE1-CD1 3.69Å; Y599-L603 HydrophobicContact CE1-CG 4.29Å; Y599-L603 HydrophobicContact CE2-CD1 4.33Å; Y599-L603 HydrophobicContact CE2-CD2 4.15Å; Y599-L603 HydrophobicContact CE2-CG 4.06Å; Y599-L603 HydrophobicContact CG-CD1 4.22Å; Y599-L603 WeakPolarHBondContact O-CB 3.37Å; Y599-L603 WeakPolarHBondContact O-CG 3.43Å; Y599-L603 PolarHBondContact O-N 3.25Å; Y599-D622 HydrophobicContact CE1-CB 4.03Å; Y599-D622 WeakPolarHBondContact CE1-OD2 3.42Å; Y599-D622 PolarHBondContact OH-OD2 3.01Å
600	V	96.4	Very high	91.6	Very high	13 Å²	13	63.7 Å²	63.7	8%	0.079	32%	0.315	C	S	.	.	H	α-helix	trans	-57.6	-51.3	167.5	167.2	0	0	0	0	110.3	A596 T597 L602 L603 E604 L623 C626 L630	A596-V600 VanDerWaalsContact O-CG2 3.3Å; A596-V600 WeakPolarHBondContact O-CG2 3.28Å; A596-V600 PolarHBondContact O-N 2.85Å; T597-V600 PolarHBondContact O-N 2.99Å; V600-L602 VanDerWaalsContact C-N 3.31Å; V600-L602 PolarHBondContact O-N 3.39Å; V600-L603 PolarHBondContact O-N 2.99Å; V600-L603 VanDerWaalsContact O-N 3.07Å; V600-E604 HydrophobicContact CG1-CG 4.27Å; V600-E604 WeakPolarHBondContact O-CG 3.48Å; V600-E604 PolarHBondContact O-N 3.38Å; V600-L623 HydrophobicContact CB-CD1 4.28Å; V600-L623 HydrophobicContact CG1-CD1 3.87Å; V600-L623 HydrophobicContact CG2-CD1 4.11Å; V600-C626 HydrophobicContact CG2-CB 3.48Å; V600-C626 VanDerWaalsContact CG2-CB 3.48Å; V600-L630 HydrophobicContact CG2-CD1 4.2Å
601	E	94.7	Very high	90.4	Very high	118 Å²	118	62.8 Å²	62.8	55%	0.551	32%	0.317	S	S	*	.	H	α-helix	trans	-53.8	-47.1	176.6	-70.1	168.4	174.8	0	0	111.6	T597 L603 D605	T597-E601 WeakPolarHBondContact O-CG 3.47Å; T597-E601 PolarHBondContact O-N 3.1Å; E601-L603 PolarHBondContact O-N 3.46Å; E601-D605 WeakPolarHBondContact O-CB 3.35Å; E601-D605 PolarHBondContact O-N 3.3Å
602	L	93.2	Very high	89.5	Confident	44 Å²	44	55.6 Å²	55.6	23%	0.23	29%	0.291	C	S	.	.	H	α-helix	trans	-63.4	-40.5	176.4	-178.4	64.2	0	0	0	112.9	K598 Y599 V600 R606	K598-L602 PolarHBondContact O-N 3.28Å; Y599-L602 HydrophobicContact CD2-CD2 4.14Å; Y599-L602 HydrophobicContact CE2-CD2 4.35Å; Y599-L602 PolarHBondContact O-N 2.92Å; V600-L602 VanDerWaalsContact C-N 3.31Å; V600-L602 PolarHBondContact O-N 3.39Å; L602-R606 HydrophobicContact CD1-CG 4.28Å; L602-R606 WeakPolarHBondContact O-CB 3.09Å; L602-R606 WeakPolarHBondContact O-CG 3.16Å; L602-R606 PolarHBondContact O-N 2.97Å; L602-R606 VanDerWaalsContact O-N 3.16Å
603	L	92.6	Very high	88.4	Confident	4 Å²	4	58.2 Å²	58.2	2%	0.021	31%	0.309	C	S	.	.	H	α-helix	trans	-69.4	-42.2	179.8	-71.9	165.9	0	0	0	111.4	Y599 V600 E601 R606 L607 W619 D622 L623	Y599-L603 HydrophobicContact CD1-CD1 3.84Å; Y599-L603 HydrophobicContact CD2-CD1 4.47Å; Y599-L603 HydrophobicContact CD2-CG 4.29Å; Y599-L603 HydrophobicContact CE1-CD1 3.69Å; Y599-L603 HydrophobicContact CE1-CG 4.29Å; Y599-L603 HydrophobicContact CE2-CD1 4.33Å; Y599-L603 HydrophobicContact CE2-CD2 4.15Å; Y599-L603 HydrophobicContact CE2-CG 4.06Å; Y599-L603 HydrophobicContact CG-CD1 4.22Å; Y599-L603 WeakPolarHBondContact O-CB 3.37Å; Y599-L603 WeakPolarHBondContact O-CG 3.43Å; Y599-L603 PolarHBondContact O-N 3.25Å; V600-L603 PolarHBondContact O-N 2.99Å; V600-L603 VanDerWaalsContact O-N 3.07Å; E601-L603 PolarHBondContact O-N 3.46Å; L603-R606 PolarHBondContact O-N 3.49Å; L603-L607 WeakPolarHBondContact O-CB 3.41Å; L603-L607 WeakPolarHBondContact O-CG 3.39Å; L603-L607 PolarHBondContact O-N 3.21Å; L603-W619 HydrophobicContact CD2-CB 3.76Å; L603-W619 HydrophobicContact CD2-CG 3.93Å; L603-D622 HydrophobicContact CD1-CB 3.89Å; L603-D622 HydrophobicContact CD2-CB 4.34Å; L603-L623 HydrophobicContact CB-CD1 4.3Å; L603-L623 HydrophobicContact CD1-CB 4.14Å
604	E	93.3	Very high	87.3	Confident	86 Å²	86	52.6 Å²	52.6	40%	0.402	29%	0.285	S	S	.	.	H	α-helix	trans	-64.6	-43.1	177.1	-70.2	-174.8	154.5	0	0	111.8	V600 R606 Q608 L623	V600-E604 HydrophobicContact CG1-CG 4.27Å; V600-E604 WeakPolarHBondContact O-CG 3.48Å; V600-E604 PolarHBondContact O-N 3.38Å; E604-R606 VanDerWaalsContact C-N 3.28Å; E604-R606 PolarHBondContact O-N 2.93Å; E604-Q608 WeakPolarHBondContact O-CB 3.43Å; E604-Q608 VanDerWaalsContact O-CG 3.28Å; E604-Q608 WeakPolarHBondContact O-CG 3.27Å; E604-Q608 PolarHBondContact O-N 3.39Å; E604-Q608 PolarHBondContact O-NE2 2.82Å; E604-Q608 VanDerWaalsContact O-NE2 3.1Å; E604-L623 HydrophobicContact CG-CD1 4.11Å; E604-L623 HydrophobicContact CG-CD2 4.44Å
605	D	90.3	Very high	86.8	Confident	108 Å²	108	48 Å²	48	58%	0.578	26%	0.263	S	S	*	.	H	α-helix	trans	-59.6	-37.2	173.4	-94.2	-4.7	0	0	0	112	E601 S609	E601-D605 WeakPolarHBondContact O-CB 3.35Å; E601-D605 PolarHBondContact O-N 3.3Å; D605-S609 VanDerWaalsContact O-CB 3.3Å; D605-S609 WeakPolarHBondContact O-CB 3.37Å; D605-S609 PolarHBondContact O-N 3.22Å; D605-S609 PolarHBondContact O-OG 2.9Å
606	R	87.4	Confident	86.5	Confident	64 Å²	64	50.1 Å²	50.1	24%	0.242	27%	0.273	C	S	.	.	H	α-helix	trans	-83.3	-34.6	-177.4	-63.7	-58	172.6	132.3	13.4	113.7	D453 L602 L603 E604 Q608 S609 C610 W619	D453-R606 VanDerWaalsContact CG-CZ 3.43Å; D453-R606 VanDerWaalsContact CG-NH1 3.33Å; D453-R606 IonicContact OD1-CZ 3.84Å; D453-R606 IonicContact OD1-NH1 3.21Å; D453-R606 IonicContact OD1-NH2 3.31Å; D453-R606 PolarHBondContact OD1-NH2 2.9Å; D453-R606 IonicContact OD2-CZ 2.72Å; D453-R606 VanDerWaalsContact OD2-CZ 3.23Å; D453-R606 IonicContact OD2-NH1 2.98Å; D453-R606 PolarHBondContact OD2-NH1 3Å; D453-R606 IonicContact OD2-NH2 3.68Å; D453-R606 PolarHBondContact OD2-NH2 3.18Å; L602-R606 HydrophobicContact CD1-CG 4.28Å; L602-R606 WeakPolarHBondContact O-CB 3.09Å; L602-R606 WeakPolarHBondContact O-CG 3.16Å; L602-R606 PolarHBondContact O-N 2.97Å; L602-R606 VanDerWaalsContact O-N 3.16Å; L603-R606 PolarHBondContact O-N 3.49Å; E604-R606 VanDerWaalsContact C-N 3.28Å; E604-R606 PolarHBondContact O-N 2.93Å; R606-Q608 PolarHBondContact O-N 3.36Å; R606-S609 PolarHBondContact O-N 3.27Å; R606-C610 VanDerWaalsContact O-CB 3.27Å; R606-C610 WeakPolarHBondContact O-CB 3.23Å; R606-C610 PolarHBondContact O-N 2.98Å; R606-W619 HydrophobicContact CB-CE3 4.14Å; R606-W619 HydrophobicContact CB-CH2 4.19Å; R606-W619 HydrophobicContact CB-CZ3 3.87Å
607	L	88.8	Confident	86.1	Confident	49 Å²	49	53.4 Å²	53.4	26%	0.257	29%	0.285	S	S	.	.	H	α-helix	trans	-64	-30.3	168.4	-73.4	164	0	0	0	111.8	L603 E616 W619 E620 L623	L603-L607 WeakPolarHBondContact O-CB 3.41Å; L603-L607 WeakPolarHBondContact O-CG 3.39Å; L603-L607 PolarHBondContact O-N 3.21Å; L607-E616 HydrophobicContact CD2-CB 4.13Å; L607-E616 HydrophobicContact CD2-CG 4.14Å; L607-W619 HydrophobicContact CD1-CB 4.38Å; L607-W619 HydrophobicContact CD2-CB 4.03Å; L607-W619 HydrophobicContact CD2-CE3 4.06Å; L607-W619 HydrophobicContact CG-CB 4.17Å; L607-W619 HydrophobicContact CG-CE3 4.22Å; L607-E620 HydrophobicContact CD2-CG 4.13Å; L607-L623 HydrophobicContact CD1-CD2 3.76Å
608	Q	85	Confident	85.8	Confident	158 Å²	158	50.9 Å²	50.9	74%	0.738	27%	0.27	S	S	*	.	H	α-helix	trans	-81	-19.8	174.6	-74.5	174.3	73.2	0	0	114.8	E604 R606	E604-Q608 WeakPolarHBondContact O-CB 3.43Å; E604-Q608 VanDerWaalsContact O-CG 3.28Å; E604-Q608 WeakPolarHBondContact O-CG 3.27Å; E604-Q608 PolarHBondContact O-N 3.39Å; E604-Q608 PolarHBondContact O-NE2 2.82Å; E604-Q608 VanDerWaalsContact O-NE2 3.1Å; R606-Q608 PolarHBondContact O-N 3.36Å
609	S	81.3	Confident	85.6	Confident	80 Å²	80	47.5 Å²	47.5	56%	0.559	26%	0.255	S	S	*	.	H	α-helix	trans	-117.6	-13.1	-170.7	60	0	0	0	0	115.8	D605 R606	D605-S609 VanDerWaalsContact O-CB 3.3Å; D605-S609 WeakPolarHBondContact O-CB 3.37Å; D605-S609 PolarHBondContact O-N 3.22Å; D605-S609 PolarHBondContact O-OG 2.9Å; R606-S609 PolarHBondContact O-N 3.27Å
610	C	67.8	Low	85.5	Confident	23 Å²	23	52.9 Å²	52.9	16%	0.155	28%	0.28	C	S	.	.			trans	-90.6	169.4	176.4	-153.4	0	0	0	0	112.6	T450 R606 C612 W619	T450-C610 HydrophobicContact CG2-CB 4.48Å; R606-C610 VanDerWaalsContact O-CB 3.27Å; R606-C610 WeakPolarHBondContact O-CB 3.23Å; R606-C610 PolarHBondContact O-N 2.98Å; C610-C612 VanDerWaalsContact SG-SG 3.7Å; C610-W619 HydrophobicContact CB-CH2 3.88Å; C610-W619 HydrophobicContact CB-CZ3 3.63Å
611	G	66.8	Low	85.4	Confident	53 Å²	53	52.6 Å²	52.6	55%	0.546	28%	0.279	S	S	.	.			trans	-145	56.1	170.7	0	0	0	0	0	109.6
612	C	74.8	Confident	85.4	Confident	7 Å²	7	47 Å²	47	5%	0.047	25%	0.253	C	S	.	.			trans	-129.9	79.3	-176.5	-72.4	0	0	0	0	108.5	C610 G614 L615 E616	C610-C612 VanDerWaalsContact SG-SG 3.7Å; C612-G614 PolarHBondContact O-N 3.49Å; C612-L615 HydrophobicContact CB-CD1 4.45Å; C612-L615 PolarHBondContact O-N 3.2Å; C612-E616 WeakPolarHBondContact CA-OE1 3.34Å; C612-E616 PolarHBondContact N-OE1 3.42Å; C612-E616 PolarHBondContact O-N 2.88Å
613	P	71.9	Confident	85.6	Confident	66 Å²	66	46.1 Å²	46.1	43%	0.429	25%	0.248	S	C	.	.	H	α-helix	trans	-59.3	-19.5	-170	20.1	-33.2	0	0	0	114.8	E616	P613-E616 WeakPolarHBondContact CA-OE2 3.41Å
614	G	73.1	Confident	85.8	Confident	1 Å²	1	49 Å²	49	1%	0.01	26%	0.261	C	S	.	.	H	α-helix	trans	-78.2	-12.1	173.3	0	0	0	0	0	116.2	V272 C612	V272-G614 WeakPolarHBondContact CG2-O 3.35Å; C612-G614 PolarHBondContact O-N 3.49Å
615	L	85.1	Confident	85.9	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-102.7	-29.1	172.4	-65	177.6	0	0	0	112	W268 L347 L350 M447 L451 C612 R617 I618 W619	W268-L615 HydrophobicContact CH2-CG 4.43Å; L347-L615 HydrophobicContact CD2-CD2 3.92Å; L350-L615 HydrophobicContact CD2-CD2 4.11Å; M447-L615 HydrophobicContact CG-CD1 4.31Å; L451-L615 HydrophobicContact CD2-CD1 3.81Å; L451-L615 HydrophobicContact CD2-CD2 3.8Å; L451-L615 HydrophobicContact CD2-CG 4.5Å; L451-L615 HydrophobicContact CG-CD1 3.92Å; C612-L615 HydrophobicContact CB-CD1 4.45Å; C612-L615 PolarHBondContact O-N 3.2Å; L615-R617 VanDerWaalsContact C-N 3.35Å; L615-R617 PolarHBondContact O-N 2.62Å; L615-I618 PolarHBondContact O-N 3.28Å; L615-W619 HydrophobicContact CB-CH2 4.36Å; L615-W619 HydrophobicContact CB-CZ2 4.02Å; L615-W619 HydrophobicContact CD1-CZ2 4.29Å; L615-W619 PolarHBondContact O-N 3.2Å; L615-W619 VanDerWaalsContact O-N 3.13Å
616	E	88.4	Confident	86.2	Confident	50 Å²	50	39.7 Å²	39.7	23%	0.234	22%	0.215	C	C	.	.	H	α-helix	trans	-51.5	-48.6	179	-73.6	152.5	-142.2	0	0	111.8	L607 C612 P613 I618 W619 E620	L607-E616 HydrophobicContact CD2-CB 4.13Å; L607-E616 HydrophobicContact CD2-CG 4.14Å; C612-E616 WeakPolarHBondContact CA-OE1 3.34Å; C612-E616 PolarHBondContact N-OE1 3.42Å; C612-E616 PolarHBondContact O-N 2.88Å; P613-E616 WeakPolarHBondContact CA-OE2 3.41Å; E616-I618 VanDerWaalsContact C-N 3.26Å; E616-I618 PolarHBondContact O-N 3.43Å; E616-W619 CarbonylContact O-C 3.56Å; E616-W619 PolarHBondContact O-N 2.84Å; E616-E620 WeakPolarHBondContact O-CG 3.36Å; E616-E620 PolarHBondContact O-N 2.75Å
617	R	88.6	Confident	86.7	Confident	68 Å²	68	40.8 Å²	40.8	26%	0.257	22%	0.223	S	C	.	.	H	α-helix	trans	-58.1	-32.5	176.8	-58.3	-157.4	-138.3	154.7	-3.3	114.8	D269 V272 D276 L615 A621	D269-R617 IonicContact OD1-CZ 2.83Å; D269-R617 IonicContact OD1-NH2 3.8Å; D269-R617 PolarHBondContact OD1-NH2 2.86Å; V272-R617 HydrophobicContact CG1-CB 4.15Å; V272-R617 HydrophobicContact CG1-CG 4.4Å; D276-R617 IonicContact OD1-CZ 3.98Å; D276-R617 IonicContact OD1-NH1 2.63Å; D276-R617 PolarHBondContact OD1-NH1 2.84Å; D276-R617 IonicContact OD2-NH1 2.68Å; D276-R617 PolarHBondContact OD2-NH1 3.4Å; L615-R617 VanDerWaalsContact C-N 3.35Å; L615-R617 PolarHBondContact O-N 2.62Å; R617-A621 WeakPolarHBondContact O-CB 3.42Å; R617-A621 PolarHBondContact O-N 2.89Å; R617-A621 VanDerWaalsContact O-N 3.16Å
618	I	91.4	Very high	87	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-75.3	-36	179.3	-61.2	175.5	0	0	0	109.7	L279 V343 F346 L347 L615 E616 D622	L279-I618 HydrophobicContact CD1-CG1 4.12Å; V343-I618 HydrophobicContact CG1-CD1 4.22Å; V343-I618 HydrophobicContact CG1-CG2 4.25Å; F346-I618 HydrophobicContact CD1-CD1 4.3Å; F346-I618 HydrophobicContact CE1-CD1 3.96Å; L347-I618 HydrophobicContact CD1-CG2 4.48Å; L347-I618 HydrophobicContact CD2-CD1 4.16Å; L615-I618 PolarHBondContact O-N 3.28Å; E616-I618 VanDerWaalsContact C-N 3.26Å; E616-I618 PolarHBondContact O-N 3.43Å; I618-D622 PolarHBondContact O-N 3.33Å
619	W	91.4	Very high	87.5	Confident	4 Å²	4	32.4 Å²	32.4	2%	0.015	18%	0.182	C	C	.	.	H	α-helix	trans	-72.5	-39.1	174.9	-61.5	-17.6	0	0	0	112.5	T450 L603 R606 L607 C610 L615 E616 A621 D622 L623	T450-W619 HydrophobicContact CG2-CH2 4.1Å; L603-W619 HydrophobicContact CD2-CB 3.76Å; L603-W619 HydrophobicContact CD2-CG 3.93Å; R606-W619 HydrophobicContact CB-CE3 4.14Å; R606-W619 HydrophobicContact CB-CH2 4.19Å; R606-W619 HydrophobicContact CB-CZ3 3.87Å; L607-W619 HydrophobicContact CD1-CB 4.38Å; L607-W619 HydrophobicContact CD2-CB 4.03Å; L607-W619 HydrophobicContact CD2-CE3 4.06Å; L607-W619 HydrophobicContact CG-CB 4.17Å; L607-W619 HydrophobicContact CG-CE3 4.22Å; C610-W619 HydrophobicContact CB-CH2 3.88Å; C610-W619 HydrophobicContact CB-CZ3 3.63Å; L615-W619 HydrophobicContact CB-CH2 4.36Å; L615-W619 HydrophobicContact CB-CZ2 4.02Å; L615-W619 HydrophobicContact CD1-CZ2 4.29Å; L615-W619 PolarHBondContact O-N 3.2Å; L615-W619 VanDerWaalsContact O-N 3.13Å; E616-W619 CarbonylContact O-C 3.56Å; E616-W619 PolarHBondContact O-N 2.84Å; W619-A621 VanDerWaalsContact C-N 3.29Å; W619-A621 PolarHBondContact O-N 2.95Å; W619-D622 PolarHBondContact O-N 3.01Å; W619-L623 WeakPolarHBondContact O-CB 3.21Å; W619-L623 PolarHBondContact O-N 2.85Å
620	E	93.6	Very high	88.1	Confident	114 Å²	114	29.7 Å²	29.7	53%	0.533	16%	0.161	S	C	.	.	H	α-helix	trans	-58.2	-42.1	171.2	-71.1	175.4	149.9	0	0	111.3	L607 E616 L623 E624	L607-E620 HydrophobicContact CD2-CG 4.13Å; E616-E620 WeakPolarHBondContact O-CG 3.36Å; E616-E620 PolarHBondContact O-N 2.75Å; E620-L623 PolarHBondContact O-N 3.02Å; E620-E624 PolarHBondContact O-N 3.31Å
621	A	94.4	Very high	89.4	Confident	6 Å²	6	35.9 Å²	35.9	5%	0.05	18%	0.182	C	C	.	.	H	α-helix	trans	-67.4	-42	176.5	0	0	0	0	0	112.7	L283 P337 R617 W619 L623 A625	L283-A621 HydrophobicContact CD1-CB 3.94Å; L283-A621 WeakPolarHBondContact CD2-O 3.48Å; L283-A621 HydrophobicContact CG-CB 4.42Å; P337-A621 HydrophobicContact CB-CB 3.85Å; P337-A621 HydrophobicContact CG-CB 3.92Å; R617-A621 WeakPolarHBondContact O-CB 3.42Å; R617-A621 PolarHBondContact O-N 2.89Å; R617-A621 VanDerWaalsContact O-N 3.16Å; W619-A621 VanDerWaalsContact C-N 3.29Å; W619-A621 PolarHBondContact O-N 2.95Å; A621-L623 VanDerWaalsContact C-N 3.34Å; A621-A625 WeakPolarHBondContact O-CB 3.42Å; A621-A625 PolarHBondContact O-N 2.92Å
622	D	95.1	Very high	90.6	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-65.3	-36.4	173	-90.3	19.8	0	0	0	112.3	L336 P337 S338 Y599 L603 I618 W619 A625 C626	L336-D622 HydrophobicContact CD2-CB 4.31Å; P337-D622 WeakPolarHBondContact CD-OD1 3.49Å; S338-D622 WeakPolarHBondContact CB-OD1 3.43Å; S338-D622 VanDerWaalsContact CB-OD2 3.25Å; S338-D622 WeakPolarHBondContact CB-OD2 3.49Å; S338-D622 PolarHBondContact N-OD1 3.41Å; S338-D622 VanDerWaalsContact OG-CG 3.31Å; S338-D622 PolarHBondContact OG-OD1 3.4Å; S338-D622 PolarHBondContact OG-OD2 2.97Å; Y599-D622 HydrophobicContact CE1-CB 4.03Å; Y599-D622 WeakPolarHBondContact CE1-OD2 3.42Å; Y599-D622 PolarHBondContact OH-OD2 3.01Å; L603-D622 HydrophobicContact CD1-CB 3.89Å; L603-D622 HydrophobicContact CD2-CB 4.34Å; I618-D622 PolarHBondContact O-N 3.33Å; W619-D622 PolarHBondContact O-N 3.01Å; D622-A625 PolarHBondContact O-N 3.02Å; D622-C626 PolarHBondContact O-N 3.18Å; D622-C626 PolarHBondContact O-SG 3.06Å
623	L	96	Very high	91.4	Very high	26 Å²	26	34.3 Å²	34.3	14%	0.136	16%	0.162	C	C	.	.	H	α-helix	trans	-67.3	-45.7	178.2	-178.9	64.1	0	0	0	111.2	V600 L603 E604 L607 W619 E620 A621 A625 C626 H627	V600-L623 HydrophobicContact CB-CD1 4.28Å; V600-L623 HydrophobicContact CG1-CD1 3.87Å; V600-L623 HydrophobicContact CG2-CD1 4.11Å; L603-L623 HydrophobicContact CB-CD1 4.3Å; L603-L623 HydrophobicContact CD1-CB 4.14Å; E604-L623 HydrophobicContact CG-CD1 4.11Å; E604-L623 HydrophobicContact CG-CD2 4.44Å; L607-L623 HydrophobicContact CD1-CD2 3.76Å; W619-L623 WeakPolarHBondContact O-CB 3.21Å; W619-L623 PolarHBondContact O-N 2.85Å; E620-L623 PolarHBondContact O-N 3.02Å; A621-L623 VanDerWaalsContact C-N 3.34Å; L623-A625 VanDerWaalsContact C-N 3.35Å; L623-C626 PolarHBondContact O-N 3.44Å; L623-H627 VanDerWaalsContact CD1-CE1 3.49Å; L623-H627 WeakPolarHBondContact CD1-CE1 3.41Å; L623-H627 PolarHBondContact O-N 2.77Å; L623-H627 PolarHBondContact O-ND1 3.35Å
624	E	96.6	Very high	92.3	Very high	64 Å²	64	37 Å²	37	30%	0.299	17%	0.169	S	C	.	.	H	α-helix	trans	-63	-41.7	173.5	-163.9	-163.3	151.8	0	0	111.2	L283 R287 E620 C626 H627 L628	L283-E624 HydrophobicContact CD2-CB 3.95Å; L283-E624 HydrophobicContact CD2-CG 4.33Å; R287-E624 IonicContact CZ-OE1 3.14Å; R287-E624 VanDerWaalsContact CZ-OE1 3.31Å; R287-E624 IonicContact CZ-OE2 3.43Å; R287-E624 IonicContact NE-OE1 2.74Å; R287-E624 PolarHBondContact NE-OE1 3.36Å; R287-E624 IonicContact NE-OE2 3.91Å; R287-E624 VanDerWaalsContact NH2-CD 3.29Å; R287-E624 IonicContact NH2-OE1 2.67Å; R287-E624 PolarHBondContact NH2-OE1 3.32Å; R287-E624 IonicContact NH2-OE2 3.04Å; R287-E624 PolarHBondContact NH2-OE2 3.01Å; E620-E624 PolarHBondContact O-N 3.31Å; E624-C626 PolarHBondContact O-N 2.97Å; E624-H627 PolarHBondContact O-N 2.74Å; E624-L628 HydrophobicContact CG-CD1 4.24Å; E624-L628 VanDerWaalsContact O-CG 3.3Å; E624-L628 WeakPolarHBondContact O-CG 3.47Å; E624-L628 PolarHBondContact O-N 3.36Å
625	A	96.8	Very high	92.9	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-59.1	-45.2	175.5	0	0	0	0	0	112	L283 L336 P337 A621 D622 L623 H627 L628 F629	L283-A625 HydrophobicContact CD2-CB 4.34Å; L336-A625 HydrophobicContact CD2-CB 4.19Å; P337-A625 HydrophobicContact CG-CB 4.31Å; A621-A625 WeakPolarHBondContact O-CB 3.42Å; A621-A625 PolarHBondContact O-N 2.92Å; D622-A625 PolarHBondContact O-N 3.02Å; L623-A625 VanDerWaalsContact C-N 3.35Å; A625-H627 PolarHBondContact O-N 3.39Å; A625-L628 WeakPolarHBondContact O-CB 3.41Å; A625-L628 PolarHBondContact O-N 3.48Å; A625-F629 HydrophobicContact CB-CE2 4.2Å; A625-F629 HydrophobicContact CB-CZ 4.11Å; A625-F629 WeakPolarHBondContact O-CD1 3.4Å; A625-F629 VanDerWaalsContact O-CD2 3.27Å; A625-F629 WeakPolarHBondContact O-CD2 3.49Å; A625-F629 WeakPolarHBondContact O-CG 3.26Å; A625-F629 PolarHBondContact O-N 2.92Å
626	C	96.8	Very high	92.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.1	-42.7	174.4	-69.1	0	0	0	0	112.4	V600 D622 L623 E624 L628 F629 L630	V600-C626 HydrophobicContact CG2-CB 3.48Å; V600-C626 VanDerWaalsContact CG2-CB 3.48Å; D622-C626 PolarHBondContact O-N 3.18Å; D622-C626 PolarHBondContact O-SG 3.06Å; L623-C626 PolarHBondContact O-N 3.44Å; E624-C626 PolarHBondContact O-N 2.97Å; C626-L628 VanDerWaalsContact C-N 3.31Å; C626-L628 PolarHBondContact O-N 3.37Å; C626-F629 PolarHBondContact O-N 3.18Å; C626-L630 WeakPolarHBondContact O-CB 3.48Å; C626-L630 WeakPolarHBondContact O-CG 3.42Å; C626-L630 PolarHBondContact O-N 2.97Å
627	H	96.6	Very high	91.8	Very high	87 Å²	87	45 Å²	45	40%	0.403	21%	0.209	S	C	.	.	H	α-helix	trans	-63.4	-35.1	175.5	-71.1	140.9	0	0	0	113	L623 E624 A625 R631	L623-H627 VanDerWaalsContact CD1-CE1 3.49Å; L623-H627 WeakPolarHBondContact CD1-CE1 3.41Å; L623-H627 PolarHBondContact O-N 2.77Å; L623-H627 PolarHBondContact O-ND1 3.35Å; E624-H627 PolarHBondContact O-N 2.74Å; A625-H627 PolarHBondContact O-N 3.39Å; H627-R631 VanDerWaalsContact O-CB 3.28Å; H627-R631 WeakPolarHBondContact O-CB 3.42Å; H627-R631 PolarHBondContact O-N 3.14Å
628	L	96	Very high	90.4	Very high	17 Å²	17	45.4 Å²	45.4	9%	0.089	22%	0.223	C	C	.	.	H	α-helix	trans	-67.8	-39.6	173.8	-70.3	164.9	0	0	0	112.1	N286 R287 T290 E624 A625 C626 G632	N286-L628 HydrophobicContact CB-CD1 3.86Å; R287-L628 HydrophobicContact CG-CD1 3.65Å; R287-L628 HydrophobicContact CG-CD2 4.18Å; T290-L628 PolarHBondContact OG1-O 3.1Å; E624-L628 HydrophobicContact CG-CD1 4.24Å; E624-L628 VanDerWaalsContact O-CG 3.3Å; E624-L628 WeakPolarHBondContact O-CG 3.47Å; E624-L628 PolarHBondContact O-N 3.36Å; A625-L628 WeakPolarHBondContact O-CB 3.41Å; A625-L628 PolarHBondContact O-N 3.48Å; C626-L628 VanDerWaalsContact C-N 3.31Å; C626-L628 PolarHBondContact O-N 3.37Å; L628-G632 PolarHBondContact O-N 2.96Å
629	F	94.9	Very high	88.5	Confident	14 Å²	14	47.9 Å²	47.9	6%	0.061	24%	0.24	C	C	.	.	H	α-helix	trans	-65.2	-49.6	174.1	-54.4	-29.6	0	0	0	111.4	N286 L336 I463 V465 A625 C626 R631 G632 L633	N286-F629 HydrophobicContact CB-CE1 4.36Å; L336-F629 HydrophobicContact CD2-CE2 4.05Å; I463-F629 HydrophobicContact CG2-CD2 4.03Å; I463-F629 HydrophobicContact CG2-CE2 3.83Å; V465-F629 HydrophobicContact CG1-CD1 4.47Å; V465-F629 HydrophobicContact CG2-CD1 3.91Å; V465-F629 HydrophobicContact CG2-CD2 4.32Å; V465-F629 HydrophobicContact CG2-CE1 3.54Å; V465-F629 HydrophobicContact CG2-CE2 3.97Å; V465-F629 HydrophobicContact CG2-CG 4.32Å; V465-F629 HydrophobicContact CG2-CZ 3.58Å; A625-F629 HydrophobicContact CB-CE2 4.2Å; A625-F629 HydrophobicContact CB-CZ 4.11Å; A625-F629 WeakPolarHBondContact O-CD1 3.4Å; A625-F629 VanDerWaalsContact O-CD2 3.27Å; A625-F629 WeakPolarHBondContact O-CD2 3.49Å; A625-F629 WeakPolarHBondContact O-CG 3.26Å; A625-F629 PolarHBondContact O-N 2.92Å; C626-F629 PolarHBondContact O-N 3.18Å; F629-R631 VanDerWaalsContact C-N 3.3Å; F629-R631 PolarHBondContact O-N 3.11Å; F629-G632 WeakPolarHBondContact O-CA 3.41Å; F629-G632 PolarHBondContact O-N 3.42Å; F629-L633 WeakPolarHBondContact O-CG 3.37Å; F629-L633 PolarHBondContact O-N 3.49Å
630	L	95.1	Very high	86.1	Confident	23 Å²	23	52.9 Å²	52.9	12%	0.12	27%	0.274	C	S	.	.	H	α-helix	trans	-60.1	-39.1	178.3	-69.4	171.3	0	0	0	111.8	K593 A596 T597 V600 C626 Q634	K593-L630 HydrophobicContact CB-CD2 4.48Å; K593-L630 HydrophobicContact CG-CD2 3.87Å; A596-L630 HydrophobicContact CB-CD1 4.49Å; A596-L630 HydrophobicContact CB-CD2 4Å; A596-L630 HydrophobicContact CB-CG 4.11Å; T597-L630 HydrophobicContact CG2-CD1 4.18Å; T597-L630 HydrophobicContact CG2-CD2 4.04Å; V600-L630 HydrophobicContact CG2-CD1 4.2Å; C626-L630 WeakPolarHBondContact O-CB 3.48Å; C626-L630 WeakPolarHBondContact O-CG 3.42Å; C626-L630 PolarHBondContact O-N 2.97Å; L630-Q634 WeakPolarHBondContact O-CG 3.49Å; L630-Q634 PolarHBondContact O-N 3.47Å
631	R	93.7	Very high	83.2	Confident	153 Å²	153	50.6 Å²	50.6	58%	0.577	28%	0.282	S	S	*	.	H	α-helix	trans	-64.7	-39.1	171.5	176.6	174.7	-80.5	175.6	-4.1	112.6	T290 H627 F629 Q634 L635	T290-R631 HydrophobicContact CG2-CB 4.49Å; T290-R631 HydrophobicContact CG2-CG 3.98Å; H627-R631 VanDerWaalsContact O-CB 3.28Å; H627-R631 WeakPolarHBondContact O-CB 3.42Å; H627-R631 PolarHBondContact O-N 3.14Å; F629-R631 VanDerWaalsContact C-N 3.3Å; F629-R631 PolarHBondContact O-N 3.11Å; R631-Q634 PolarHBondContact O-N 3.43Å; R631-L635 WeakPolarHBondContact O-CG 3.36Å; R631-L635 PolarHBondContact O-N 3.36Å; R631-L635 VanDerWaalsContact O-N 3.07Å
632	G	91.8	Very high	80.3	Confident	9 Å²	9	53.7 Å²	53.7	9%	0.093	31%	0.314	C	S	.	.	H	α-helix	trans	-59.4	-47.9	175.1	0	0	0	0	0	112.4	L628 F629 Q634 L635 R636	L628-G632 PolarHBondContact O-N 2.96Å; F629-G632 WeakPolarHBondContact O-CA 3.41Å; F629-G632 PolarHBondContact O-N 3.42Å; G632-Q634 VanDerWaalsContact C-N 3.34Å; G632-Q634 PolarHBondContact O-N 2.95Å; G632-L635 WeakPolarHBondContact O-CB 3.5Å; G632-L635 PolarHBondContact O-N 3.03Å; G632-R636 PolarHBondContact O-N 3.13Å
633	L	91.3	Very high	77.9	Confident	17 Å²	17	59 Å²	59	9%	0.089	35%	0.348	C	S	.	.	H	α-helix	trans	-65.1	-35.4	177.2	-60.1	178	0	0	0	112.4	E589 L592 K593 F629 R636 T637	E589-L633 HydrophobicContact CB-CD2 3.83Å; E589-L633 VanDerWaalsContact CD-CD2 3.42Å; E589-L633 HydrophobicContact CG-CD2 3.59Å; L592-L633 HydrophobicContact CD2-CD1 4.39Å; L592-L633 HydrophobicContact CG-CD1 4.28Å; K593-L633 HydrophobicContact CB-CD1 3.82Å; F629-L633 WeakPolarHBondContact O-CG 3.37Å; F629-L633 PolarHBondContact O-N 3.49Å; L633-R636 PolarHBondContact O-N 2.99Å; L633-T637 PolarHBondContact O-N 3.16Å; L633-T637 VanDerWaalsContact O-N 3.08Å; L633-T637 PolarHBondContact O-OG1 3.17Å
634	Q	91.1	Very high	75	Confident	122 Å²	122	66 Å²	66	57%	0.57	39%	0.386	S	S	*	.	H	α-helix	trans	-62.5	-39.9	172.5	-74.6	166	10.8	0	0	112.5	L630 R631 G632 T637 S638	L630-Q634 WeakPolarHBondContact O-CG 3.49Å; L630-Q634 PolarHBondContact O-N 3.47Å; R631-Q634 PolarHBondContact O-N 3.43Å; G632-Q634 VanDerWaalsContact C-N 3.34Å; G632-Q634 PolarHBondContact O-N 2.95Å; Q634-T637 WeakPolarHBondContact CA-OG1 3.34Å; Q634-T637 PolarHBondContact O-OG1 3.41Å; Q634-S638 VanDerWaalsContact O-CB 3.23Å; Q634-S638 WeakPolarHBondContact O-CB 3.46Å; Q634-S638 PolarHBondContact O-N 3.27Å; Q634-S638 PolarHBondContact O-OG 3.15Å
635	L	86.3	Confident	72.4	Confident	42 Å²	42	68.2 Å²	68.2	22%	0.22	40%	0.404	C	S	.	.	H	α-helix	trans	-61.3	-47.1	178	-71.7	168.8	0	0	0	111.5	T290 R631 G632 S638	T290-L635 HydrophobicContact CG2-CD1 4.17Å; R631-L635 WeakPolarHBondContact O-CG 3.36Å; R631-L635 PolarHBondContact O-N 3.36Å; R631-L635 VanDerWaalsContact O-N 3.07Å; G632-L635 WeakPolarHBondContact O-CB 3.5Å; G632-L635 PolarHBondContact O-N 3.03Å; L635-S638 PolarHBondContact O-N 3.44Å; L635-S638 PolarHBondContact O-OG 3.2Å
636	R	80.8	Confident	69.9	Low	89 Å²	89	76 Å²	76	34%	0.336	45%	0.445	S	S	.	.	H	α-helix	trans	-63.6	-52.5	179.4	-67.9	179.3	178.4	177.5	-1	112	Y289 E293 E589 G632 L633 S638 S639	Y289-R636 PolarHBondContact OH-NH2 3.07Å; Y289-R636 VanDerWaalsContact OH-NH2 3.13Å; E293-R636 IonicContact OE1-NH2 3.43Å; E293-R636 PolarHBondContact OE1-NH2 3.14Å; E293-R636 IonicContact OE2-CZ 3.46Å; E293-R636 VanDerWaalsContact OE2-CZ 3.26Å; E293-R636 IonicContact OE2-NE 2.71Å; E293-R636 PolarHBondContact OE2-NE 2.69Å; E293-R636 IonicContact OE2-NH2 3.14Å; E293-R636 PolarHBondContact OE2-NH2 3.24Å; E589-R636 WeakPolarHBondContact OE1-CD 3.32Å; E589-R636 IonicContact OE1-CZ 3.51Å; E589-R636 IonicContact OE1-NE 3.06Å; E589-R636 IonicContact OE1-NH1 2.67Å; E589-R636 PolarHBondContact OE1-NH1 2.86Å; G632-R636 PolarHBondContact O-N 3.13Å; L633-R636 PolarHBondContact O-N 2.99Å; R636-S638 VanDerWaalsContact C-N 3.28Å; R636-S638 PolarHBondContact O-N 3.04Å; R636-S639 PolarHBondContact O-N 3.33Å
637	T	70.4	Confident	66.9	Low	89 Å²	89	83.4 Å²	83.4	55%	0.546	49%	0.485	S	S	.	.	H	α-helix	trans	-59.1	-36.9	178	49.3	0	0	0	0	112.8	L633 Q634 S639 C640	L633-T637 PolarHBondContact O-N 3.16Å; L633-T637 VanDerWaalsContact O-N 3.08Å; L633-T637 PolarHBondContact O-OG1 3.17Å; Q634-T637 WeakPolarHBondContact CA-OG1 3.34Å; Q634-T637 PolarHBondContact O-OG1 3.41Å; T637-S639 PolarHBondContact O-N 3.18Å; T637-S639 VanDerWaalsContact O-N 3.14Å; T637-C640 PolarHBondContact O-N 3.31Å
638	S	59	Low	63.9	Low	76 Å²	76	83.1 Å²	83.1	53%	0.531	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-13.1	176.1	78	0	0	0	0	115	Q634 L635 R636	Q634-S638 VanDerWaalsContact O-CB 3.23Å; Q634-S638 WeakPolarHBondContact O-CB 3.46Å; Q634-S638 PolarHBondContact O-N 3.27Å; Q634-S638 PolarHBondContact O-OG 3.15Å; L635-S638 PolarHBondContact O-N 3.44Å; L635-S638 PolarHBondContact O-OG 3.2Å; R636-S638 VanDerWaalsContact C-N 3.28Å; R636-S638 PolarHBondContact O-N 3.04Å
639	S	51.4	Low	61.5	Low	54 Å²	54	87.5 Å²	87.5	38%	0.378	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-105.3	-2.8	179.1	-156.4	0	0	0	0	114.5	R301 R636 T637	R301-S639 VanDerWaalsContact NH2-CB 3.34Å; R301-S639 PolarHBondContact NH2-OG 3.24Å; R636-S639 PolarHBondContact O-N 3.33Å; T637-S639 PolarHBondContact O-N 3.18Å; T637-S639 VanDerWaalsContact O-N 3.14Å
640	C	40.9	Very low	58.4	Low	108 Å²	108	94.1 Å²	94.1	73%	0.73	56%	0.563	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.3	-9.5	178.1	-154.5	0	0	0	0	112.7	T637	T637-C640 PolarHBondContact O-N 3.31Å
641	G	32.3	Very low	56.1	Low	67 Å²	67	98.4 Å²	98.4	69%	0.691	59%	0.592	S	S	*	*			trans	-94.6	97.3	172.5	0	0	0	0	0	112.7
642	G	33.9	Very low	53.1	Low	70 Å²	70	96.1 Å²	96.1	72%	0.722	60%	0.595	S	S	*	*			trans	-106.6	-159.9	154.4	0	0	0	0	0	110.4
643	P	44.9	Very low	50.4	Low	111 Å²	111	102 Å²	102	72%	0.721	63%	0.629	S	S	*	*			cis	-97.4	174.2	-23.2	38.5	-30.2	0	0	0	110.8	V645	P643-V645 HydrophobicContact CG-CG2 3.96Å
644	D	35	Very low	47.4	Very low	173 Å²	173	110.7 Å²	110.7	93%	0.925	66%	0.662	S	S	*	*			trans	-82.8	140	156.7	-151.5	-8.9	0	0	0	108.5
645	V	42.6	Very low	44.4	Very low	111 Å²	111	110.5 Å²	110.5	67%	0.673	67%	0.669	S	S	*	*			trans	-117.4	116.8	-162.5	175.4	0	0	0	0	110.9	P643	P643-V645 HydrophobicContact CG-CG2 3.96Å
646	D	42.3	Very low	41.5	Very low	164 Å²	164	114.2 Å²	114.2	88%	0.877	70%	0.699	S	S	*	*			trans	-145	112	152.4	-134.9	-15.1	0	0	0	112.4
647	D	35.4	Very low	38.8	Very low	155 Å²	155	115.1 Å²	115.1	83%	0.829	71%	0.714	S	S	*	*			trans	44.9	163	170.1	-127.5	-19.1	0	0	0	123.2
648	A	32.7	Very low	36.8	Very low	81 Å²	81	119.4 Å²	119.4	67%	0.669	73%	0.728	S	S	*	*			trans	-134.9	-167.4	-169.4	0	0	0	0	0	110.8
649	P	45.3	Very low	35.8	Very low	110 Å²	110	121.3 Å²	121.3	71%	0.714	74%	0.738	S	S	*	*			cis	-134.9	-161.2	-7.7	44	-26.1	0	0	0	114.4
650	D	30.8	Very low	34.5	Very low	152 Å²	152	123.6 Å²	123.6	81%	0.813	75%	0.754	S	S	*	*			trans	85.6	148.9	158	-85.8	3	0	0	0	120.7
651	P	46	Very low	33.7	Very low	113 Å²	113	124.5 Å²	124.5	73%	0.734	76%	0.757	S	S	*	*			trans	-101.1	145.9	-153.8	37.4	-34	0	0	0	114.1
652	V	30.8	Very low	33.7	Very low	106 Å²	106	131.2 Å²	131.2	64%	0.642	77%	0.767	S	S	*	*			trans	-122.7	107	167.5	-164.3	0	0	0	0	111.1	Y654	V652-Y654 HydrophobicContact CB-CD2 4.17Å; V652-Y654 HydrophobicContact CB-CE2 4.06Å; V652-Y654 HydrophobicContact CG1-CD2 3.61Å; V652-Y654 HydrophobicContact CG1-CE2 3.33Å; V652-Y654 HydrophobicContact CG1-CG 4.4Å; V652-Y654 PolarHBondContact O-N 3.42Å
653	V	35.8	Very low	33.8	Very low	131 Å²	131	134.7 Å²	134.7	79%	0.794	76%	0.764	S	S	*	*			trans	-66.7	108.8	164.9	174.4	0	0	0	0	108.2
654	Y	27	Very low	33.2	Very low	201 Å²	201	137.9 Å²	137.9	79%	0.788	77%	0.77	S	S	*	*			trans	-100.9	96.6	168.9	-91.6	-67.3	0	0	0	111.7	V652	V652-Y654 HydrophobicContact CB-CD2 4.17Å; V652-Y654 HydrophobicContact CB-CE2 4.06Å; V652-Y654 HydrophobicContact CG1-CD2 3.61Å; V652-Y654 HydrophobicContact CG1-CE2 3.33Å; V652-Y654 HydrophobicContact CG1-CG 4.4Å; V652-Y654 PolarHBondContact O-N 3.42Å
655	T	28.6	Very low	33.3	Very low	118 Å²	118	138.3 Å²	138.3	72%	0.724	77%	0.766	S	S	*	*			trans	-66.7	142.5	147	45.7	0	0	0	0	109
656	S	25.4	Very low	32.7	Very low	119 Å²	119	140.6 Å²	140.6	83%	0.832	78%	0.775	S	S	*	*			trans	-144.2	137.9	170.1	-172.1	0	0	0	0	110
657	T	23.9	Very low	32.4	Very low	108 Å²	108	136 Å²	136	66%	0.663	75%	0.754	S	S	*	*			trans	-148.5	104.7	-167.4	-59.9	0	0	0	0	111.3
658	H	28.6	Very low	32.5	Very low	179 Å²	179	133.4 Å²	133.4	83%	0.829	76%	0.755	S	S	*	*			trans	65.6	170.3	161.9	-61.1	-38.1	0	0	0	117.8
659	P	37.2	Very low	32.5	Very low	116 Å²	116	137.4 Å²	137.4	75%	0.753	76%	0.762	S	S	*	*			cis	-130.5	151.9	-9.4	20	3.4	0	0	0	116.8
660	S	24.1	Very low	32.2	Very low	103 Å²	103	134.2 Å²	134.2	72%	0.72	74%	0.738	S	S	*	*			trans	45.1	126.3	135.9	-159.6	0	0	0	0	122.2
661	T	25.7	Very low	32.9	Very low	127 Å²	127	132 Å²	132	78%	0.779	73%	0.73	S	S	*	*				179.3	116.2	99.3	27.1	0	0	0	0	113.7
662	K	31.7	Very low	32.7	Very low	208 Å²	208	130.2 Å²	130.2	90%	0.904	73%	0.725	S	S	*	*				166.3	137.2	127.9	-94.5	177.9	179.7	-174.4	0	111.8
663	E	35.7	Very low	33.1	Very low	143 Å²	143	127.7 Å²	127.7	67%	0.668	71%	0.708	S	S	*	*			trans	-72.1	159.3	154.8	-64.2	141.8	139.8	0	0	106.7	R676	E663-R676 IonicContact OE1-NH2 3.54Å; E663-R676 PolarHBondContact OE1-NH2 3.48Å; E663-R676 IonicContact OE2-NH2 3.27Å
664	E	33.6	Very low	33.3	Very low	178 Å²	178	123.4 Å²	123.4	83%	0.832	69%	0.69	S	S	*	*			cis	-162.3	144.1	34.7	-147.7	150	-156.4	0	0	104.6
665	E	35.5	Very low	33.9	Very low	181 Å²	181	115.7 Å²	115.7	85%	0.846	67%	0.672	S	S	*	*				-165.7	-167.5	74	-84	178.1	156.6	0	0	109.9
666	D	31.4	Very low	34.3	Very low	160 Å²	160	119.7 Å²	119.7	86%	0.856	67%	0.674	S	S	*	*			trans	60.5	83.2	170.9	-130.4	10.8	0	0	0	117.5
667	C	35.7	Very low	35.3	Very low	67 Å²	67	117.4 Å²	117.4	45%	0.453	65%	0.647	S	S	.	*			trans	-173.8	92.9	138.8	-108.9	0	0	0	0	113.1	M669 L670	C667-M669 PolarHBondContact O-N 3.39Å; C667-M669 VanDerWaalsContact O-N 3.13Å; C667-L670 HydrophobicContact CB-CB 3.71Å; C667-L670 HydrophobicContact CB-CD1 3.5Å; C667-L670 VanDerWaalsContact CB-CD1 3.5Å; C667-L670 HydrophobicContact CB-CG 3.55Å; C667-L670 PolarHBondContact O-N 2.93Å
668	A	36.7	Very low	35.8	Very low	101 Å²	101	116.3 Å²	116.3	84%	0.835	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-24.7	171.2	0	0	0	0	0	113.5
669	M	33.5	Very low	36.3	Very low	165 Å²	165	112.4 Å²	112.4	81%	0.813	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	-25.7	173.8	-71.8	-165.6	-71.6	0	0	114.5	C667 T671	C667-M669 PolarHBondContact O-N 3.39Å; C667-M669 VanDerWaalsContact O-N 3.13Å; M669-T671 PolarHBondContact O-N 3.07Å
670	L	38.7	Very low	36.1	Very low	43 Å²	43	115 Å²	115	23%	0.225	64%	0.635	C	S	.	*	T	Hydrogen-bonded Turn	trans	-78.8	-18	-174.7	-73.8	176.6	0	0	0	113.5	R497 C667 A672 L673 G674	R497-L670 VanDerWaalsContact NH1-CD1 3.29Å; C667-L670 HydrophobicContact CB-CB 3.71Å; C667-L670 HydrophobicContact CB-CD1 3.5Å; C667-L670 VanDerWaalsContact CB-CD1 3.5Å; C667-L670 HydrophobicContact CB-CG 3.55Å; C667-L670 PolarHBondContact O-N 2.93Å; L670-A672 PolarHBondContact O-N 2.67Å; L670-A672 VanDerWaalsContact O-N 3.15Å; L670-L673 PolarHBondContact O-N 2.98Å; L670-G674 WeakPolarHBondContact O-CA 3.49Å; L670-G674 PolarHBondContact O-N 3.25Å
671	T	44.8	Very low	36.8	Very low	104 Å²	104	112.5 Å²	112.5	64%	0.638	62%	0.621	S	S	*	*	H	α-helix	trans	-54.8	-34	177.4	-50.8	0	0	0	0	112.3	M669 L673 G675	M669-T671 PolarHBondContact O-N 3.07Å; T671-L673 VanDerWaalsContact C-N 3.31Å; T671-L673 PolarHBondContact O-N 3.14Å; T671-G675 PolarHBondContact O-N 3.08Å
672	A	42.9	Very low	37.6	Very low	77 Å²	77	111.9 Å²	111.9	64%	0.636	61%	0.613	S	S	*	*	H	α-helix	trans	-68	-22.5	179.2	0	0	0	0	0	114.8	L670	L670-A672 PolarHBondContact O-N 2.67Å; L670-A672 VanDerWaalsContact O-N 3.15Å
673	L	39.2	Very low	38.5	Very low	52 Å²	52	103.2 Å²	103.2	27%	0.272	58%	0.576	S	S	.	*	H	α-helix	trans	-127.3	-11.3	-173.6	-62.2	174.4	0	0	0	114.1	L498 L670 T671 F688	L498-L673 HydrophobicContact CD2-CB 4.38Å; L498-L673 HydrophobicContact CD2-CD1 4.15Å; L498-L673 HydrophobicContact CD2-CD2 3.97Å; L498-L673 HydrophobicContact CD2-CG 4.39Å; L670-L673 PolarHBondContact O-N 2.98Å; T671-L673 VanDerWaalsContact C-N 3.31Å; T671-L673 PolarHBondContact O-N 3.14Å; L673-F688 HydrophobicContact CD2-CD2 4.35Å; L673-F688 HydrophobicContact CD2-CE2 3.77Å
674	G	40.4	Very low	38.9	Very low	42 Å²	42	101.7 Å²	101.7	43%	0.433	57%	0.569	S	S	.	*	H	α-helix	trans	-136.3	3.1	-175.1	0	0	0	0	0	115.4	L670	L670-G674 WeakPolarHBondContact O-CA 3.49Å; L670-G674 PolarHBondContact O-N 3.25Å
675	G	37.7	Very low	39.8	Very low	39 Å²	39	98.5 Å²	98.5	40%	0.402	56%	0.558	S	S	.	*	S	Bend	trans	-59.5	151.1	175.6	0	0	0	0	0	113.2	T671 W677	T671-G675 PolarHBondContact O-N 3.08Å; G675-W677 PolarHBondContact O-N 2.93Å
676	R	38.8	Very low	40.9	Very low	202 Å²	202	91.2 Å²	91.2	76%	0.762	53%	0.526	S	S	*	.			trans	-62.4	121.2	178.1	-162.9	172.3	-62.9	-120.1	-2.6	109.2	E663 C678	E663-R676 IonicContact OE1-NH2 3.54Å; E663-R676 PolarHBondContact OE1-NH2 3.48Å; E663-R676 IonicContact OE2-NH2 3.27Å; R676-C678 PolarHBondContact O-N 3.27Å
677	W	44.7	Very low	42.2	Very low	71 Å²	71	89.9 Å²	89.9	27%	0.269	52%	0.515	S	S	.	.			trans	-75.8	113.1	-165.8	176.3	-81.1	0	0	0	111.4	K505 E508 G675 F688	K505-W677 HydrophobicContact CB-CH2 3.18Å; K505-W677 HydrophobicContact CB-CZ2 3.63Å; K505-W677 HydrophobicContact CB-CZ3 3.83Å; K505-W677 HydrophobicContact CD-CD2 2.32Å; K505-W677 HydrophobicContact CD-CE3 2.31Å; K505-W677 HydrophobicContact CD-CG 3.5Å; K505-W677 VanDerWaalsContact CD-CG 3.5Å; K505-W677 HydrophobicContact CD-CH2 2.31Å; K505-W677 HydrophobicContact CD-CZ2 2.31Å; K505-W677 HydrophobicContact CD-CZ3 2.31Å; K505-W677 HydrophobicContact CG-CD2 3.84Å; K505-W677 HydrophobicContact CG-CE3 3.33Å; K505-W677 HydrophobicContact CG-CH2 2.78Å; K505-W677 HydrophobicContact CG-CZ2 3.37Å; K505-W677 HydrophobicContact CG-CZ3 2.77Å; K505-W677 VanDerWaalsContact NZ-CE3 3.33Å; E508-W677 VanDerWaalsContact OE1-CD1 3.25Å; E508-W677 PolarHBondContact OE1-NE1 3.24Å; E508-W677 VanDerWaalsContact OE2-CD1 3.28Å; E508-W677 PolarHBondContact OE2-NE1 2.97Å; G675-W677 PolarHBondContact O-N 2.93Å; W677-F688 HydrophobicContact CZ3-CD1 4.16Å; W677-F688 HydrophobicContact CZ3-CE1 4.23Å
678	C	35.9	Very low	43.4	Very low	85 Å²	85	88.3 Å²	88.3	57%	0.574	50%	0.501	S	S	*	.			trans	-65.4	127.9	178.2	-61.4	0	0	0	0	111.7	R676	R676-C678 PolarHBondContact O-N 3.27Å
679	P	38.3	Very low	44.7	Very low	96 Å²	96	83.5 Å²	83.5	62%	0.623	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-37.6	-179.8	-20.7	33.3	0	0	0	114.3	A681	P679-A681 VanDerWaalsContact C-N 3.26Å; P679-A681 PolarHBondContact O-N 2.85Å
680	E	34.2	Very low	46.3	Very low	172 Å²	172	81.5 Å²	81.5	80%	0.804	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-1.9	-173.7	-82.5	64.9	-151.8	0	0	115.7	N682	E680-N682 PolarHBondContact O-N 3.03Å
681	A	37.8	Very low	47.7	Very low	50 Å²	50	85 Å²	85	41%	0.413	46%	0.461	S	S	.	.	S	Bend	trans	-77.7	104	-178.9	0	0	0	0	0	111.4	P679 L683	P679-A681 VanDerWaalsContact C-N 3.26Å; P679-A681 PolarHBondContact O-N 2.85Å; A681-L683 PolarHBondContact O-N 3.27Å; A681-L683 VanDerWaalsContact O-N 3.16Å
682	N	43	Very low	48.9	Very low	114 Å²	114	80.2 Å²	80.2	61%	0.61	43%	0.432	S	S	*	.			trans	-43.1	119	177.3	179.9	-4.9	0	0	0	111.7	E680 Q684	E680-N682 PolarHBondContact O-N 3.03Å; N682-Q684 PolarHBondContact O-N 2.88Å; N682-Q684 VanDerWaalsContact O-N 3.17Å; N682-Q684 WeakPolarHBondContact OD1-CB 3.45Å; N682-Q684 WeakPolarHBondContact OD1-CG 3.38Å; N682-Q684 PolarHBondContact OD1-N 3.27Å
683	L	49.2	Very low	50.2	Low	26 Å²	26	80.3 Å²	80.3	14%	0.136	42%	0.419	C	S	.	.			trans	-71.2	-9.4	-172.6	-73	82.6	0	0	0	113.8	T509 A681 N685	T509-L683 HydrophobicContact CG2-CD2 3.63Å; A681-L683 PolarHBondContact O-N 3.27Å; A681-L683 VanDerWaalsContact O-N 3.16Å; L683-N685 PolarHBondContact O-N 3.4Å
684	Q	46.1	Very low	51.8	Low	110 Å²	110	83.8 Å²	83.8	51%	0.514	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	107.7	175.7	-62	-171.4	-74.1	0	0	111.6	A541 N682	A541-Q684 HydrophobicContact CB-CG 3.91Å; A541-Q684 VanDerWaalsContact CB-NE2 3.33Å; N682-Q684 PolarHBondContact O-N 2.88Å; N682-Q684 VanDerWaalsContact O-N 3.17Å; N682-Q684 WeakPolarHBondContact OD1-CB 3.45Å; N682-Q684 WeakPolarHBondContact OD1-CG 3.38Å; N682-Q684 PolarHBondContact OD1-N 3.27Å
685	N	51.7	Low	53.4	Low	112 Å²	112	85.5 Å²	85.5	60%	0.599	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.4	50	175.7	-42.1	-83.2	0	0	0	114.8	L683 E687	L683-N685 PolarHBondContact O-N 3.4Å; N685-E687 PolarHBondContact O-N 3.24Å
686	S	57.7	Low	55.2	Low	27 Å²	27	83.6 Å²	83.6	19%	0.189	41%	0.41	C	S	.	.			trans	-55.8	134.6	172.8	85.2	0	0	0	0	111	F688 T689	S686-F688 PolarHBondContact O-N 2.85Å; S686-T689 PolarHBondContact O-N 2.98Å; S686-T689 PolarHBondContact O-OG1 3.17Å; S686-T689 VanDerWaalsContact O-OG1 3.08Å; S686-T689 PolarHBondContact OG-N 3.16Å; S686-T689 PolarHBondContact OG-OG1 2.88Å
687	E	59.1	Low	56.7	Low	132 Å²	132	80 Å²	80	62%	0.617	40%	0.4	S	S	*	.	H	α-helix	trans	-58.9	-31.4	173.4	-65.2	-172.9	-176.2	0	0	111.4	N685 T689 K690 K691	N685-E687 PolarHBondContact O-N 3.24Å; E687-T689 PolarHBondContact O-N 2.88Å; E687-K690 PolarHBondContact O-N 3.5Å; E687-K691 HydrophobicContact CB-CD 4.31Å; E687-K691 WeakPolarHBondContact O-CB 3.48Å; E687-K691 WeakPolarHBondContact O-CG 3.3Å; E687-K691 PolarHBondContact O-N 2.73Å; E687-K691 IonicContact OE2-NZ 3.8Å; E687-K691 PolarHBondContact OE2-NZ 2.63Å
688	F	60.6	Low	57.7	Low	34 Å²	34	81 Å²	81	15%	0.149	42%	0.417	C	S	.	.	H	α-helix	trans	-58.2	-44.6	176.1	175	-90.2	0	0	0	112.4	L673 W677 S686 K690 K691 L692	L673-F688 HydrophobicContact CD2-CD2 4.35Å; L673-F688 HydrophobicContact CD2-CE2 3.77Å; W677-F688 HydrophobicContact CZ3-CD1 4.16Å; W677-F688 HydrophobicContact CZ3-CE1 4.23Å; S686-F688 PolarHBondContact O-N 2.85Å; F688-K690 VanDerWaalsContact C-N 3.28Å; F688-K690 PolarHBondContact O-N 2.99Å; F688-K691 PolarHBondContact O-N 2.95Å; F688-L692 HydrophobicContact CE1-CD2 4.01Å; F688-L692 HydrophobicContact CZ-CD2 4.25Å; F688-L692 VanDerWaalsContact O-CB 3.23Å; F688-L692 WeakPolarHBondContact O-CB 3.22Å; F688-L692 PolarHBondContact O-N 2.97Å
689	T	64.1	Low	59	Low	0 Å²	0	78.5 Å²	78.5	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-70	-24.9	178.3	41.6	0	0	0	0	112.9	E545 R548 L549 L552 S686 E687 E693	E545-T689 WeakPolarHBondContact OE1-CB 3.27Å; E545-T689 VanDerWaalsContact OE1-CG2 3.3Å; E545-T689 WeakPolarHBondContact OE1-CG2 3.47Å; E545-T689 PolarHBondContact OE1-OG1 3.09Å; R548-T689 PolarHBondContact NH1-OG1 3.05Å; R548-T689 PolarHBondContact NH2-O 3.36Å; L549-T689 HydrophobicContact CD2-CG2 3.39Å; L549-T689 HydrophobicContact CG-CG2 4.26Å; L552-T689 HydrophobicContact CD1-CG2 4.25Å; S686-T689 PolarHBondContact O-N 2.98Å; S686-T689 PolarHBondContact O-OG1 3.17Å; S686-T689 VanDerWaalsContact O-OG1 3.08Å; S686-T689 PolarHBondContact OG-N 3.16Å; S686-T689 PolarHBondContact OG-OG1 2.88Å; E687-T689 PolarHBondContact O-N 2.88Å; T689-E693 WeakPolarHBondContact O-CB 3.18Å; T689-E693 PolarHBondContact O-N 3.19Å
690	K	67.6	Low	60.3	Low	123 Å²	123	77.7 Å²	77.7	54%	0.535	39%	0.385	S	S	.	.	H	α-helix	trans	-73.7	-50.5	168.4	-63.7	-178.1	179.2	180	0	111.9	E687 F688 L692 E693 E694	E687-K690 PolarHBondContact O-N 3.5Å; F688-K690 VanDerWaalsContact C-N 3.28Å; F688-K690 PolarHBondContact O-N 2.99Å; K690-L692 PolarHBondContact O-N 3.01Å; K690-E693 WeakPolarHBondContact O-CB 3.4Å; K690-E693 PolarHBondContact O-N 3.5Å; K690-E694 WeakPolarHBondContact O-CB 3.47Å; K690-E694 PolarHBondContact O-N 3.08Å
691	K	67	Low	61.1	Low	118 Å²	118	74 Å²	74	51%	0.513	37%	0.368	S	S	.	.	H	α-helix	trans	-60.6	-31.4	178.6	-73.3	165.1	175.2	167.5	0	112.5	E687 F688 F695	E687-K691 HydrophobicContact CB-CD 4.31Å; E687-K691 WeakPolarHBondContact O-CB 3.48Å; E687-K691 WeakPolarHBondContact O-CG 3.3Å; E687-K691 PolarHBondContact O-N 2.73Å; E687-K691 IonicContact OE2-NZ 3.8Å; E687-K691 PolarHBondContact OE2-NZ 2.63Å; F688-K691 PolarHBondContact O-N 2.95Å; K691-F695 WeakPolarHBondContact O-CB 3.45Å; K691-F695 PolarHBondContact O-N 2.92Å
692	L	70.3	Confident	61.3	Low	3 Å²	3	78 Å²	78	2%	0.016	38%	0.382	C	S	.	.	H	α-helix	trans	-75.7	-35.8	173	-177	59.3	0	0	0	112.6	L498 L502 F688 K690 F695 L696	L498-L692 HydrophobicContact CD1-CD1 4.32Å; L498-L692 HydrophobicContact CD2-CD1 4.12Å; L502-L692 HydrophobicContact CD1-CD2 4.4Å; L502-L692 HydrophobicContact CD2-CD2 4.09Å; F688-L692 HydrophobicContact CE1-CD2 4.01Å; F688-L692 HydrophobicContact CZ-CD2 4.25Å; F688-L692 VanDerWaalsContact O-CB 3.23Å; F688-L692 WeakPolarHBondContact O-CB 3.22Å; F688-L692 PolarHBondContact O-N 2.97Å; K690-L692 PolarHBondContact O-N 3.01Å; L692-F695 HydrophobicContact CD1-CD1 4.41Å; L692-L696 HydrophobicContact CD1-CD1 4.4Å; L692-L696 HydrophobicContact CD1-CG 4.38Å; L692-L696 HydrophobicContact CG-CD1 4.12Å; L692-L696 WeakPolarHBondContact O-CB 3.3Å; L692-L696 WeakPolarHBondContact O-CD1 3.22Å; L692-L696 WeakPolarHBondContact O-CG 3.4Å; L692-L696 PolarHBondContact O-N 2.89Å
693	E	71.6	Confident	61.1	Low	79 Å²	79	79.1 Å²	79.1	37%	0.369	38%	0.384	S	S	.	.	H	α-helix	trans	-70.2	-36.4	177.2	-173.2	161.1	-132.9	0	0	111.7	R548 L552 R555 T689 K690 F697	R548-E693 IonicContact CZ-OE2 2.89Å; R548-E693 IonicContact NE-OE2 2.72Å; R548-E693 IonicContact NH2-OE2 3.64Å; R548-E693 PolarHBondContact NH2-OE2 3.19Å; L552-E693 HydrophobicContact CD2-CB 3.91Å; L552-E693 HydrophobicContact CD2-CG 3.99Å; R555-E693 PolarHBondContact NH1-O 3.47Å; T689-E693 WeakPolarHBondContact O-CB 3.18Å; T689-E693 PolarHBondContact O-N 3.19Å; K690-E693 WeakPolarHBondContact O-CB 3.4Å; K690-E693 PolarHBondContact O-N 3.5Å; E693-F697 PolarHBondContact O-N 2.96Å; E693-F697 VanDerWaalsContact O-N 3.12Å
694	E	72.7	Confident	60.5	Low	124 Å²	124	83 Å²	83	58%	0.579	41%	0.41	S	S	*	.	H	α-helix	trans	-65.7	-52.7	167.8	179.5	179.1	-159	0	0	111.8	K690 L696 F697 C698	K690-E694 WeakPolarHBondContact O-CB 3.47Å; K690-E694 PolarHBondContact O-N 3.08Å; E694-L696 VanDerWaalsContact C-N 3.28Å; E694-L696 PolarHBondContact O-N 2.99Å; E694-F697 CarbonylContact O-C 3.6Å; E694-F697 WeakPolarHBondContact O-CA 3.26Å; E694-F697 WeakPolarHBondContact O-CB 3.48Å; E694-F697 PolarHBondContact O-N 3.27Å; E694-C698 PolarHBondContact O-N 3.03Å
695	F	73.9	Confident	60.3	Low	78 Å²	78	85.9 Å²	85.9	34%	0.342	42%	0.424	S	S	.	.	H	α-helix	trans	-60	-37.2	175.6	177.1	-97.8	0	0	0	112.6	L498 K691 L692 F697 C698 M699	L498-F695 HydrophobicContact CD1-CD1 3.86Å; L498-F695 HydrophobicContact CD1-CE1 3.33Å; L498-F695 HydrophobicContact CD1-CZ 4.19Å; K691-F695 WeakPolarHBondContact O-CB 3.45Å; K691-F695 PolarHBondContact O-N 2.92Å; L692-F695 HydrophobicContact CD1-CD1 4.41Å; F695-F697 VanDerWaalsContact C-N 3.3Å; F695-F697 PolarHBondContact O-N 3.38Å; F695-C698 CarbonylContact O-C 3.58Å; F695-C698 PolarHBondContact O-N 2.84Å; F695-M699 HydrophobicContact CD1-CG 4.18Å; F695-M699 HydrophobicContact CD1-SD 4.27Å; F695-M699 HydrophobicContact CE1-CG 3.62Å; F695-M699 HydrophobicContact CE1-SD 3.35Å; F695-M699 WeakPolarHBondContact CE1-SD 3.49Å; F695-M699 HydrophobicContact CE2-CG 4.38Å; F695-M699 HydrophobicContact CZ-CG 3.73Å; F695-M699 HydrophobicContact CZ-SD 3.7Å; F695-M699 PolarHBondContact O-N 3.32Å
696	L	73.9	Confident	59.9	Low	0 Å²	0	88.9 Å²	88.9	0%	0	44%	0.44	C	S	.	.	H	α-helix	trans	-65.6	-32.3	172.5	-79.8	166.2	0	0	0	112.4	L552 L556 L559 L692 E694 C698 M699 E700	L552-L696 HydrophobicContact CB-CD1 4.31Å; L552-L696 HydrophobicContact CD2-CD1 3.88Å; L556-L696 HydrophobicContact CB-CD1 4.48Å; L556-L696 HydrophobicContact CB-CD2 3.82Å; L556-L696 HydrophobicContact CD1-CD2 3.76Å; L556-L696 HydrophobicContact CG-CD2 4.33Å; L559-L696 HydrophobicContact CD1-CD2 3.8Å; L692-L696 HydrophobicContact CD1-CD1 4.4Å; L692-L696 HydrophobicContact CD1-CG 4.38Å; L692-L696 HydrophobicContact CG-CD1 4.12Å; L692-L696 WeakPolarHBondContact O-CB 3.3Å; L692-L696 WeakPolarHBondContact O-CD1 3.22Å; L692-L696 WeakPolarHBondContact O-CG 3.4Å; L692-L696 PolarHBondContact O-N 2.89Å; E694-L696 VanDerWaalsContact C-N 3.28Å; E694-L696 PolarHBondContact O-N 2.99Å; L696-C698 VanDerWaalsContact C-N 3.33Å; L696-M699 PolarHBondContact O-N 3.12Å; L696-E700 WeakPolarHBondContact O-CB 3.41Å; L696-E700 PolarHBondContact O-N 2.88Å
697	F	71.1	Confident	59.2	Low	126 Å²	126	90.6 Å²	90.6	55%	0.553	46%	0.456	S	S	*	.	H	α-helix	trans	-72.8	-24.6	172.8	-174.9	-97.4	0	0	0	112.7	R555 E693 E694 F695	R555-F697 VanDerWaalsContact NH2-CA 3.31Å; E693-F697 PolarHBondContact O-N 2.96Å; E693-F697 VanDerWaalsContact O-N 3.12Å; E694-F697 CarbonylContact O-C 3.6Å; E694-F697 WeakPolarHBondContact O-CA 3.26Å; E694-F697 WeakPolarHBondContact O-CB 3.48Å; E694-F697 PolarHBondContact O-N 3.27Å; F695-F697 VanDerWaalsContact C-N 3.3Å; F695-F697 PolarHBondContact O-N 3.38Å
698	C	64.9	Low	58.5	Low	91 Å²	91	89.6 Å²	89.6	62%	0.615	46%	0.462	S	S	*	.	H	α-helix	trans	-83.8	-25.4	169.2	-59.1	0	0	0	0	113.8	E694 F695 L696	E694-C698 PolarHBondContact O-N 3.03Å; F695-C698 CarbonylContact O-C 3.58Å; F695-C698 PolarHBondContact O-N 2.84Å; L696-C698 VanDerWaalsContact C-N 3.33Å
699	M	64.5	Low	57.9	Low	33 Å²	33	90.9 Å²	90.9	16%	0.163	48%	0.475	C	S	.	.	H	α-helix	trans	-82.1	-24.3	172.8	-82.4	-153.1	73.1	0	0	113.5	L559 F695 L696 E701	L559-M699 HydrophobicContact CD1-CB 4.32Å; F695-M699 HydrophobicContact CD1-CG 4.18Å; F695-M699 HydrophobicContact CD1-SD 4.27Å; F695-M699 HydrophobicContact CE1-CG 3.62Å; F695-M699 HydrophobicContact CE1-SD 3.35Å; F695-M699 WeakPolarHBondContact CE1-SD 3.49Å; F695-M699 HydrophobicContact CE2-CG 4.38Å; F695-M699 HydrophobicContact CZ-CG 3.73Å; F695-M699 HydrophobicContact CZ-SD 3.7Å; F695-M699 PolarHBondContact O-N 3.32Å; L696-M699 PolarHBondContact O-N 3.12Å; M699-E701 PolarHBondContact O-N 3.17Å
700	E	65.3	Low	57.4	Low	79 Å²	79	99.6 Å²	99.6	37%	0.369	52%	0.516	S	S	.	.	S	Bend	trans	-76.7	74.5	167.1	-160.2	154.6	-94.6	0	0	106.5	R555 L559 L696 N702	R555-E700 IonicContact CZ-OE1 2.79Å; R555-E700 IonicContact CZ-OE2 3.83Å; R555-E700 VanDerWaalsContact CZ-OE2 3.27Å; R555-E700 IonicContact NE-OE1 3.26Å; R555-E700 PolarHBondContact NE-OE1 2.66Å; R555-E700 VanDerWaalsContact NE-OE1 3.14Å; R555-E700 IonicContact NE-OE2 3.77Å; R555-E700 PolarHBondContact NE-OE2 3.18Å; R555-E700 VanDerWaalsContact NE-OE2 3.08Å; R555-E700 IonicContact NH2-OE1 2.66Å; R555-E700 IonicContact NH2-OE2 2.64Å; R555-E700 PolarHBondContact NH2-OE2 3.12Å; L559-E700 HydrophobicContact CD1-CB 4.08Å; L559-E700 HydrophobicContact CD2-CB 4.11Å; L559-E700 HydrophobicContact CD2-CG 4.02Å; L696-E700 WeakPolarHBondContact O-CB 3.41Å; L696-E700 PolarHBondContact O-N 2.88Å; E700-N702 PolarHBondContact O-N 3.13Å
701	E	51.2	Low	56.8	Low	94 Å²	94	97.1 Å²	97.1	44%	0.439	52%	0.518	S	S	.	.			trans	-52.6	122.3	179.3	-80.2	170.3	-161.9	0	0	108.8	K491 M699 H703	K491-E701 IonicContact NZ-OE1 3.94Å; K491-E701 PolarHBondContact NZ-OE1 2.87Å; K491-E701 IonicContact NZ-OE2 3.66Å; M699-E701 PolarHBondContact O-N 3.17Å; E701-H703 PolarHBondContact O-N 2.78Å
702	N	42	Very low	56.4	Low	134 Å²	134	96 Å²	96	72%	0.717	52%	0.518	S	S	*	.			trans	-70.2	79.8	172.2	-66.4	-81	0	0	0	107.9	E700 P704	E700-N702 PolarHBondContact O-N 3.13Å; N702-P704 VanDerWaalsContact O-CD 3.27Å; N702-P704 WeakPolarHBondContact O-CD 3.15Å
703	H	38.3	Very low	56.1	Low	139 Å²	139	98.5 Å²	98.5	64%	0.644	54%	0.539	S	S	*	.			trans	-56.6	121.8	149.8	-61.6	-60.8	0	0	0	106.5	E701 E705	E701-H703 PolarHBondContact O-N 2.78Å; H703-E705 PolarHBondContact O-N 3.49Å
704	P	37.4	Very low	56	Low	106 Å²	106	97.5 Å²	97.5	69%	0.688	54%	0.544	S	S	*	.			trans	-68.5	87.6	158.7	29.7	-31.3	0	0	0	107.1	N702 D706 A707	N702-P704 VanDerWaalsContact O-CD 3.27Å; N702-P704 WeakPolarHBondContact O-CD 3.15Å; P704-D706 PolarHBondContact O-N 2.83Å; P704-A707 HydrophobicContact CB-CB 4.42Å
705	E	41.8	Very low	56.2	Low	172 Å²	172	94.4 Å²	94.4	80%	0.804	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	128.8	165.3	-67.7	-168.3	161.5	0	0	108.1	H703	H703-E705 PolarHBondContact O-N 3.49Å
706	D	43.5	Very low	56.5	Low	174 Å²	174	93.4 Å²	93.4	93%	0.93	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.9	55	174.6	-61.8	-16.4	0	0	0	117.4	P704	P704-D706 PolarHBondContact O-N 2.83Å
707	A	42.8	Very low	56.8	Low	64 Å²	64	97.3 Å²	97.3	53%	0.529	55%	0.553	S	S	.	*	S	Bend	trans	-114.2	-48	161.2	0	0	0	0	0	113.6	P704	P704-A707 HydrophobicContact CB-CB 4.42Å
708	C	44.7	Very low	57.4	Low	110 Å²	110	97 Å²	97	74%	0.743	55%	0.554	S	S	*	*	S	Bend	trans	-139.4	130.4	169.3	-85.8	0	0	0	0	109
709	S	47.5	Very low	58.2	Low	62 Å²	62	98.3 Å²	98.3	43%	0.434	55%	0.546	S	S	.	.			trans	-71.1	135.9	-173.8	-33.5	0	0	0	0	111.2	A711 D712 A713	S709-A711 PolarHBondContact O-N 3.05Å; S709-A711 VanDerWaalsContact O-N 3.14Å; S709-D712 WeakPolarHBondContact CB-OD2 3.21Å; S709-D712 PolarHBondContact O-N 2.87Å; S709-D712 PolarHBondContact OG-OD2 2.71Å; S709-A713 PolarHBondContact O-N 3.43Å; S709-A713 VanDerWaalsContact O-N 3.13Å
710	E	53.1	Low	59	Low	183 Å²	183	99.5 Å²	99.5	86%	0.855	56%	0.557	S	S	*	*	H	α-helix	trans	-55.1	-31	166.7	-170.4	178.4	-155	0	0	111	A714	E710-A714 WeakPolarHBondContact O-CB 3.49Å; E710-A714 PolarHBondContact O-N 3.46Å
711	A	54.5	Low	60	Low	70 Å²	70	100.9 Å²	100.9	58%	0.579	56%	0.563	S	S	*	*	H	α-helix	trans	-65.3	-34.9	171.4	0	0	0	0	0	114.2	S709 A714 D715	S709-A711 PolarHBondContact O-N 3.05Å; S709-A711 VanDerWaalsContact O-N 3.14Å; A711-A714 PolarHBondContact O-N 3.27Å; A711-D715 VanDerWaalsContact O-CB 3.25Å; A711-D715 WeakPolarHBondContact O-CB 3.2Å; A711-D715 PolarHBondContact O-N 3.18Å
712	D	59	Low	61.7	Low	94 Å²	94	101.4 Å²	101.4	50%	0.503	57%	0.569	S	S	.	*	H	α-helix	trans	-75.9	-36.4	178.4	-66	-48.4	0	0	0	110.6	S709 L716	S709-D712 WeakPolarHBondContact CB-OD2 3.21Å; S709-D712 PolarHBondContact O-N 2.87Å; S709-D712 PolarHBondContact OG-OD2 2.71Å; D712-L716 WeakPolarHBondContact O-CB 3.35Å; D712-L716 PolarHBondContact O-N 3.05Å
713	A	63.8	Low	63.9	Low	57 Å²	57	96.2 Å²	96.2	47%	0.471	54%	0.541	S	S	.	.	H	α-helix	trans	-65.1	-38.7	170.7	0	0	0	0	0	112	S709 T717	S709-A713 PolarHBondContact O-N 3.43Å; S709-A713 VanDerWaalsContact O-N 3.13Å; A713-T717 WeakPolarHBondContact O-CB 3.38Å; A713-T717 PolarHBondContact O-N 2.95Å; A713-T717 PolarHBondContact O-OG1 3.26Å
714	A	69.6	Low	66.1	Low	57 Å²	57	92.4 Å²	92.4	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-67.7	-46.8	174.4	0	0	0	0	0	112.4	E710 A711 T717 E718	E710-A714 WeakPolarHBondContact O-CB 3.49Å; E710-A714 PolarHBondContact O-N 3.46Å; A711-A714 PolarHBondContact O-N 3.27Å; A714-T717 WeakPolarHBondContact O-CA 3.45Å; A714-T717 WeakPolarHBondContact O-CB 3.1Å; A714-T717 PolarHBondContact O-N 3.03Å; A714-T717 VanDerWaalsContact O-N 3.12Å; A714-E718 PolarHBondContact O-N 3.24Å
715	D	78.5	Confident	68.5	Low	59 Å²	59	92.4 Å²	92.4	32%	0.316	52%	0.524	S	S	.	.	H	α-helix	trans	-65.4	-39.1	177.1	-173.1	2.7	0	0	0	111.1	A711 T717 E718 R719	A711-D715 VanDerWaalsContact O-CB 3.25Å; A711-D715 WeakPolarHBondContact O-CB 3.2Å; A711-D715 PolarHBondContact O-N 3.18Å; D715-T717 VanDerWaalsContact C-N 3.3Å; D715-T717 PolarHBondContact O-N 3.15Å; D715-E718 PolarHBondContact O-N 2.74Å; D715-R719 VanDerWaalsContact CG-NE 3.3Å; D715-R719 VanDerWaalsContact CG-NH2 3.33Å; D715-R719 VanDerWaalsContact O-CB 3.28Å; D715-R719 WeakPolarHBondContact O-CB 3.27Å; D715-R719 WeakPolarHBondContact O-CD 3.25Å; D715-R719 WeakPolarHBondContact O-CG 3.15Å; D715-R719 PolarHBondContact O-N 3.07Å; D715-R719 WeakPolarHBondContact OD1-CD 3.48Å; D715-R719 IonicContact OD1-CZ 2.71Å; D715-R719 IonicContact OD1-NE 3.54Å; D715-R719 PolarHBondContact OD1-NE 2.83Å; D715-R719 IonicContact OD1-NH2 3.56Å; D715-R719 PolarHBondContact OD1-NH2 3.37Å; D715-R719 IonicContact OD2-CZ 3.34Å; D715-R719 IonicContact OD2-NE 2.68Å; D715-R719 PolarHBondContact OD2-NE 3.35Å; D715-R719 IonicContact OD2-NH2 2.65Å; D715-R719 PolarHBondContact OD2-NH2 3.44Å
716	L	79.9	Confident	70.9	Confident	57 Å²	57	88.5 Å²	88.5	30%	0.298	50%	0.502	S	S	.	.	H	α-helix	trans	-58.6	-42	170	-178.9	64.2	0	0	0	111.7	D712 C720 M763 L767	D712-L716 WeakPolarHBondContact O-CB 3.35Å; D712-L716 PolarHBondContact O-N 3.05Å; L716-C720 WeakPolarHBondContact O-CB 3.34Å; L716-C720 PolarHBondContact O-N 2.74Å; L716-C720 PolarHBondContact O-SG 3.4Å; L716-M763 HydrophobicContact CD1-CE 3.7Å; L716-L767 HydrophobicContact CD2-CD1 4.32Å; L716-L767 HydrophobicContact CD2-CD2 3.86Å
717	T	80.1	Confident	73.1	Confident	82 Å²	82	83.2 Å²	83.2	50%	0.503	47%	0.473	S	S	.	.	H	α-helix	trans	-66.1	-49	177.1	-57.6	0	0	0	0	111.3	A713 A714 D715 R719 C720 E721	A713-T717 WeakPolarHBondContact O-CB 3.38Å; A713-T717 PolarHBondContact O-N 2.95Å; A713-T717 PolarHBondContact O-OG1 3.26Å; A714-T717 WeakPolarHBondContact O-CA 3.45Å; A714-T717 WeakPolarHBondContact O-CB 3.1Å; A714-T717 PolarHBondContact O-N 3.03Å; A714-T717 VanDerWaalsContact O-N 3.12Å; D715-T717 VanDerWaalsContact C-N 3.3Å; D715-T717 PolarHBondContact O-N 3.15Å; T717-R719 VanDerWaalsContact C-N 3.34Å; T717-R719 PolarHBondContact O-N 3.24Å; T717-C720 WeakPolarHBondContact O-CA 3.28Å; T717-C720 WeakPolarHBondContact O-CB 3.29Å; T717-C720 PolarHBondContact O-N 3.01Å; T717-E721 PolarHBondContact O-N 3.42Å
718	E	83.4	Confident	75.2	Confident	120 Å²	120	84.5 Å²	84.5	56%	0.561	47%	0.47	S	S	*	.	H	α-helix	trans	-60	-42.3	177	-172.6	179.5	168.8	0	0	111.3	A714 D715 C720 E721 L722	A714-E718 PolarHBondContact O-N 3.24Å; D715-E718 PolarHBondContact O-N 2.74Å; E718-C720 VanDerWaalsContact C-N 3.33Å; E718-C720 PolarHBondContact O-N 3.3Å; E718-E721 PolarHBondContact O-N 3.08Å; E718-L722 HydrophobicContact CG-CD1 4.09Å; E718-L722 HydrophobicContact CG-CG 4.48Å; E718-L722 WeakPolarHBondContact O-CB 3.16Å; E718-L722 VanDerWaalsContact O-CG 3.27Å; E718-L722 WeakPolarHBondContact O-CG 3.42Å; E718-L722 PolarHBondContact O-N 3.14Å
719	R	81.9	Confident	77.3	Confident	118 Å²	118	80.9 Å²	80.9	45%	0.445	45%	0.448	S	S	.	.	H	α-helix	trans	-60.7	-39.7	173	-71.1	166.7	-170.3	-168	8.5	112.1	D715 T717 I723 M763	D715-R719 VanDerWaalsContact CG-NE 3.3Å; D715-R719 VanDerWaalsContact CG-NH2 3.33Å; D715-R719 VanDerWaalsContact O-CB 3.28Å; D715-R719 WeakPolarHBondContact O-CB 3.27Å; D715-R719 WeakPolarHBondContact O-CD 3.25Å; D715-R719 WeakPolarHBondContact O-CG 3.15Å; D715-R719 PolarHBondContact O-N 3.07Å; D715-R719 WeakPolarHBondContact OD1-CD 3.48Å; D715-R719 IonicContact OD1-CZ 2.71Å; D715-R719 IonicContact OD1-NE 3.54Å; D715-R719 PolarHBondContact OD1-NE 2.83Å; D715-R719 IonicContact OD1-NH2 3.56Å; D715-R719 PolarHBondContact OD1-NH2 3.37Å; D715-R719 IonicContact OD2-CZ 3.34Å; D715-R719 IonicContact OD2-NE 2.68Å; D715-R719 PolarHBondContact OD2-NE 3.35Å; D715-R719 IonicContact OD2-NH2 2.65Å; D715-R719 PolarHBondContact OD2-NH2 3.44Å; T717-R719 VanDerWaalsContact C-N 3.34Å; T717-R719 PolarHBondContact O-N 3.24Å; R719-I723 WeakPolarHBondContact O-CB 3.41Å; R719-I723 WeakPolarHBondContact O-CD1 3.49Å; R719-I723 WeakPolarHBondContact O-CG1 3.4Å; R719-I723 PolarHBondContact O-N 3.11Å; R719-M763 HydrophobicContact CB-CE 4.04Å
720	C	81.6	Confident	79.4	Confident	59 Å²	59	78 Å²	78	40%	0.399	43%	0.428	S	S	.	.	H	α-helix	trans	-67.7	-40.6	175.7	-77.4	0	0	0	0	112.4	L716 T717 E718 I723 S724	L716-C720 WeakPolarHBondContact O-CB 3.34Å; L716-C720 PolarHBondContact O-N 2.74Å; L716-C720 PolarHBondContact O-SG 3.4Å; T717-C720 WeakPolarHBondContact O-CA 3.28Å; T717-C720 WeakPolarHBondContact O-CB 3.29Å; T717-C720 PolarHBondContact O-N 3.01Å; E718-C720 VanDerWaalsContact C-N 3.33Å; E718-C720 PolarHBondContact O-N 3.3Å; C720-I723 PolarHBondContact O-N 3.13Å; C720-S724 PolarHBondContact O-N 3.45Å
721	E	86.4	Confident	81.1	Confident	107 Å²	107	74.7 Å²	74.7	50%	0.5	41%	0.412	S	S	.	.	H	α-helix	trans	-65.4	-46	174.4	-67.9	-159.9	132.7	0	0	111.7	R473 T717 E718 I723 S724 D725	R473-E721 IonicContact NH1-OE1 2.66Å; T717-E721 PolarHBondContact O-N 3.42Å; E718-E721 PolarHBondContact O-N 3.08Å; E721-I723 VanDerWaalsContact C-N 3.26Å; E721-I723 PolarHBondContact O-N 2.9Å; E721-S724 WeakPolarHBondContact O-CA 3.45Å; E721-S724 WeakPolarHBondContact O-CB 3.39Å; E721-S724 PolarHBondContact O-N 2.91Å; E721-D725 PolarHBondContact O-N 3.3Å
722	L	86.8	Confident	82.9	Confident	106 Å²	106	75.9 Å²	75.9	56%	0.555	41%	0.409	S	S	*	.	H	α-helix	trans	-59.1	-35.1	174.4	-73.3	169.1	0	0	0	112.7	E718 R726	E718-L722 HydrophobicContact CG-CD1 4.09Å; E718-L722 HydrophobicContact CG-CG 4.48Å; E718-L722 WeakPolarHBondContact O-CB 3.16Å; E718-L722 VanDerWaalsContact O-CG 3.27Å; E718-L722 WeakPolarHBondContact O-CG 3.42Å; E718-L722 PolarHBondContact O-N 3.14Å; L722-R726 VanDerWaalsContact O-CB 3.26Å; L722-R726 WeakPolarHBondContact O-CB 3.3Å; L722-R726 PolarHBondContact O-N 3.04Å
723	I	87	Confident	84.3	Confident	25 Å²	25	76.6 Å²	76.6	13%	0.128	41%	0.407	C	S	.	.	H	α-helix	trans	-72	-39.2	173.1	-71.8	166	0	0	0	111.3	R719 C720 E721 R726 L727 V756 T759 L760 M763	R719-I723 WeakPolarHBondContact O-CB 3.41Å; R719-I723 WeakPolarHBondContact O-CD1 3.49Å; R719-I723 WeakPolarHBondContact O-CG1 3.4Å; R719-I723 PolarHBondContact O-N 3.11Å; C720-I723 PolarHBondContact O-N 3.13Å; E721-I723 VanDerWaalsContact C-N 3.26Å; E721-I723 PolarHBondContact O-N 2.9Å; I723-R726 PolarHBondContact O-N 3.05Å; I723-L727 HydrophobicContact CG2-CD1 4.01Å; I723-L727 HydrophobicContact CG2-CG 4.41Å; I723-L727 WeakPolarHBondContact O-CB 3.28Å; I723-L727 VanDerWaalsContact O-CG 3.3Å; I723-L727 WeakPolarHBondContact O-CG 3.47Å; I723-L727 PolarHBondContact O-N 3.44Å; I723-V756 HydrophobicContact CG2-CG1 3.68Å; I723-T759 HydrophobicContact CD1-CG2 4.36Å; I723-L760 HydrophobicContact CD1-CD2 4.12Å; I723-L760 HydrophobicContact CG2-CD1 3.99Å; I723-L760 HydrophobicContact CG2-CD2 3.86Å; I723-L760 HydrophobicContact CG2-CG 3.95Å; I723-M763 HydrophobicContact CD1-CE 4.22Å; I723-M763 HydrophobicContact CD1-SD 3.56Å; I723-M763 VanDerWaalsContact CD1-SD 3.56Å
724	S	84.1	Confident	85.5	Confident	58 Å²	58	75.6 Å²	75.6	41%	0.406	39%	0.394	S	S	.	.	H	α-helix	trans	-61.1	-50	175.5	-175.9	0	0	0	0	111.5	C720 E721 R726 L727 I728	C720-S724 PolarHBondContact O-N 3.45Å; E721-S724 WeakPolarHBondContact O-CA 3.45Å; E721-S724 WeakPolarHBondContact O-CB 3.39Å; E721-S724 PolarHBondContact O-N 2.91Å; S724-R726 VanDerWaalsContact C-N 3.34Å; S724-R726 PolarHBondContact O-N 3.2Å; S724-L727 WeakPolarHBondContact O-CB 3.42Å; S724-L727 PolarHBondContact O-N 2.98Å; S724-L727 VanDerWaalsContact O-N 3.08Å; S724-I728 WeakPolarHBondContact O-CG1 3.39Å; S724-I728 PolarHBondContact O-N 2.7Å
725	D	89	Confident	86.3	Confident	107 Å²	107	77.6 Å²	77.6	57%	0.572	39%	0.394	S	S	*	.	H	α-helix	trans	-65	-37.5	178.1	-80.3	2.6	0	0	0	111.7	E721 L727 A729	E721-D725 PolarHBondContact O-N 3.3Å; D725-L727 VanDerWaalsContact C-N 3.34Å; D725-L727 PolarHBondContact O-N 2.64Å; D725-A729 VanDerWaalsContact O-CB 3.25Å; D725-A729 WeakPolarHBondContact O-CB 3.45Å; D725-A729 PolarHBondContact O-N 3.12Å
726	R	91	Very high	86.7	Confident	90 Å²	90	78.2 Å²	78.2	34%	0.34	40%	0.4	S	S	.	.	H	α-helix	trans	-63.5	-37.8	171.3	-172.9	176.7	-179	-159.1	1.4	111.7	L722 I723 S724 L730 E752 E755 V756	L722-R726 VanDerWaalsContact O-CB 3.26Å; L722-R726 WeakPolarHBondContact O-CB 3.3Å; L722-R726 PolarHBondContact O-N 3.04Å; I723-R726 PolarHBondContact O-N 3.05Å; S724-R726 VanDerWaalsContact C-N 3.34Å; S724-R726 PolarHBondContact O-N 3.2Å; R726-L730 HydrophobicContact CG-CD1 4Å; R726-L730 HydrophobicContact CG-CG 4.42Å; R726-L730 VanDerWaalsContact O-CB 3.25Å; R726-L730 WeakPolarHBondContact O-CB 3.39Å; R726-L730 WeakPolarHBondContact O-CG 3.26Å; R726-L730 PolarHBondContact O-N 3.31Å; R726-E752 IonicContact CZ-OE1 2.97Å; R726-E752 VanDerWaalsContact CZ-OE1 3.29Å; R726-E752 IonicContact NE-OE1 2.85Å; R726-E752 PolarHBondContact NE-OE1 3.31Å; R726-E752 VanDerWaalsContact NH2-CD 3.32Å; R726-E752 IonicContact NH2-OE1 3.69Å; R726-E752 PolarHBondContact NH2-OE1 3.34Å; R726-E755 IonicContact CZ-OE2 2.73Å; R726-E755 IonicContact NH1-OE2 3.18Å; R726-E755 PolarHBondContact NH1-OE2 2.99Å; R726-E755 IonicContact NH2-OE2 3.23Å; R726-E755 PolarHBondContact NH2-OE2 3.35Å; R726-V756 HydrophobicContact CG-CG2 4.38Å
727	L	89.5	Confident	87.1	Confident	63 Å²	63	75.6 Å²	75.6	33%	0.33	39%	0.386	S	S	.	.	H	α-helix	trans	-67.6	-45.8	177	-78.6	169.4	0	0	0	112.1	I723 S724 D725 L730 E731 V756 L760	I723-L727 HydrophobicContact CG2-CD1 4.01Å; I723-L727 HydrophobicContact CG2-CG 4.41Å; I723-L727 WeakPolarHBondContact O-CB 3.28Å; I723-L727 VanDerWaalsContact O-CG 3.3Å; I723-L727 WeakPolarHBondContact O-CG 3.47Å; I723-L727 PolarHBondContact O-N 3.44Å; S724-L727 WeakPolarHBondContact O-CB 3.42Å; S724-L727 PolarHBondContact O-N 2.98Å; S724-L727 VanDerWaalsContact O-N 3.08Å; D725-L727 VanDerWaalsContact C-N 3.34Å; D725-L727 PolarHBondContact O-N 2.64Å; L727-L730 PolarHBondContact O-N 3.06Å; L727-L730 VanDerWaalsContact O-N 3.13Å; L727-E731 PolarHBondContact O-N 2.95Å; L727-V756 HydrophobicContact CD1-CG1 4.25Å; L727-V756 HydrophobicContact CD2-CB 4.37Å; L727-V756 HydrophobicContact CD2-CG1 3.74Å; L727-V756 HydrophobicContact CG-CG1 3.89Å; L727-L760 HydrophobicContact CD1-CD1 4.31Å
728	I	88.1	Confident	87.3	Confident	91 Å²	91	76.2 Å²	76.2	47%	0.467	39%	0.386	S	S	.	.	H	α-helix	trans	-59.2	-50.4	175.1	-64.8	163.4	0	0	0	109.7	S724 L730 E731 D732	S724-I728 WeakPolarHBondContact O-CG1 3.39Å; S724-I728 PolarHBondContact O-N 2.7Å; I728-L730 PolarHBondContact O-N 2.95Å; I728-E731 PolarHBondContact O-N 3.38Å; I728-E731 VanDerWaalsContact O-N 3.14Å; I728-D732 PolarHBondContact O-N 2.81Å
729	A	89.3	Confident	87.5	Confident	34 Å²	34	76.7 Å²	76.7	28%	0.281	39%	0.391	S	S	.	.	H	α-helix	trans	-68.4	-14.6	178.3	0	0	0	0	0	113.9	D725 K733	D725-A729 VanDerWaalsContact O-CB 3.25Å; D725-A729 WeakPolarHBondContact O-CB 3.45Å; D725-A729 PolarHBondContact O-N 3.12Å; A729-K733 WeakPolarHBondContact O-CD 3.5Å; A729-K733 WeakPolarHBondContact O-CE 3.4Å; A729-K733 WeakPolarHBondContact O-CG 3.48Å; A729-K733 PolarHBondContact O-NZ 3.42Å; A729-K733 VanDerWaalsContact O-NZ 3.14Å
730	L	91	Very high	87.8	Confident	1 Å²	1	76.9 Å²	76.9	1%	0.005	40%	0.401	C	S	.	.	H	α-helix	trans	-87.5	-37.7	170.1	-81.7	172.3	0	0	0	111.6	R726 L727 I728 K733 L734 L749 E752 V753 V756	R726-L730 HydrophobicContact CG-CD1 4Å; R726-L730 HydrophobicContact CG-CG 4.42Å; R726-L730 VanDerWaalsContact O-CB 3.25Å; R726-L730 WeakPolarHBondContact O-CB 3.39Å; R726-L730 WeakPolarHBondContact O-CG 3.26Å; R726-L730 PolarHBondContact O-N 3.31Å; L727-L730 PolarHBondContact O-N 3.06Å; L727-L730 VanDerWaalsContact O-N 3.13Å; I728-L730 PolarHBondContact O-N 2.95Å; L730-K733 PolarHBondContact O-N 3.39Å; L730-L734 WeakPolarHBondContact O-CB 3.42Å; L730-L734 PolarHBondContact O-N 2.84Å; L730-L749 HydrophobicContact CD2-CD2 3.63Å; L730-E752 HydrophobicContact CD1-CB 4.31Å; L730-E752 HydrophobicContact CD1-CG 4.04Å; L730-E752 HydrophobicContact CD2-CB 4.05Å; L730-E752 HydrophobicContact CD2-CG 4.09Å; L730-V753 HydrophobicContact CB-CG2 4.22Å; L730-V753 HydrophobicContact CD1-CG2 4.22Å; L730-V756 HydrophobicContact CD1-CG2 4.05Å
731	E	89.6	Confident	88	Confident	113 Å²	113	84 Å²	84	53%	0.528	42%	0.42	S	S	.	.	H	α-helix	trans	-60.5	-51.2	173.1	176.9	157.5	-151.5	0	0	110.7	L727 I728 K733 L734 Q735	L727-E731 PolarHBondContact O-N 2.95Å; I728-E731 PolarHBondContact O-N 3.38Å; I728-E731 VanDerWaalsContact O-N 3.14Å; E731-K733 VanDerWaalsContact C-N 3.33Å; E731-K733 PolarHBondContact O-N 2.94Å; E731-L734 PolarHBondContact O-N 2.91Å; E731-L734 VanDerWaalsContact O-N 3.15Å; E731-Q735 HydrophobicContact CG-CG 4.18Å; E731-Q735 VanDerWaalsContact CG-NE2 3.25Å; E731-Q735 WeakPolarHBondContact O-CB 3.35Å; E731-Q735 VanDerWaalsContact O-CG 3.31Å; E731-Q735 WeakPolarHBondContact O-CG 3.41Å; E731-Q735 PolarHBondContact O-N 3.43Å; E731-Q735 PolarHBondContact OE1-NE2 3.03Å
732	D	90.3	Very high	88.2	Confident	95 Å²	95	82.4 Å²	82.4	51%	0.508	42%	0.415	S	S	.	.	H	α-helix	trans	-55.5	-46.1	176.5	-77.3	-24.4	0	0	0	112.1	I728 T736	I728-D732 PolarHBondContact O-N 2.81Å; D732-T736 WeakPolarHBondContact O-CB 3.48Å; D732-T736 PolarHBondContact O-N 3.22Å; D732-T736 PolarHBondContact O-OG1 3.2Å
733	K	89.4	Confident	88.2	Confident	109 Å²	109	85.4 Å²	85.4	47%	0.474	43%	0.426	S	S	.	.	H	α-helix	trans	-66.9	-39.5	178.7	-72.1	169.8	-157.9	142.7	0	111.9	A729 L730 E731 T736 A737 L749	A729-K733 WeakPolarHBondContact O-CD 3.5Å; A729-K733 WeakPolarHBondContact O-CE 3.4Å; A729-K733 WeakPolarHBondContact O-CG 3.48Å; A729-K733 PolarHBondContact O-NZ 3.42Å; A729-K733 VanDerWaalsContact O-NZ 3.14Å; L730-K733 PolarHBondContact O-N 3.39Å; E731-K733 VanDerWaalsContact C-N 3.33Å; E731-K733 PolarHBondContact O-N 2.94Å; K733-T736 PolarHBondContact O-N 3Å; K733-A737 VanDerWaalsContact O-CB 3.26Å; K733-A737 WeakPolarHBondContact O-CB 3.41Å; K733-A737 PolarHBondContact O-N 3.14Å; K733-L749 HydrophobicContact CB-CD1 3.87Å; K733-L749 HydrophobicContact CB-CD2 4.07Å; K733-L749 HydrophobicContact CD-CD2 4.41Å
734	L	88.3	Confident	88.2	Confident	36 Å²	36	87.5 Å²	87.5	19%	0.188	45%	0.447	C	S	.	.	H	α-helix	trans	-71.2	-46	-178.8	-178.4	63.5	0	0	0	110.7	L730 E731 T736 A737 I738 T746 L749 E750	L730-L734 WeakPolarHBondContact O-CB 3.42Å; L730-L734 PolarHBondContact O-N 2.84Å; E731-L734 PolarHBondContact O-N 2.91Å; E731-L734 VanDerWaalsContact O-N 3.15Å; L734-T736 VanDerWaalsContact C-N 3.32Å; L734-T736 PolarHBondContact O-N 3.05Å; L734-A737 PolarHBondContact O-N 3.24Å; L734-I738 HydrophobicContact CD1-CD1 4.12Å; L734-I738 HydrophobicContact CG-CD1 3.93Å; L734-I738 WeakPolarHBondContact O-CB 3.46Å; L734-I738 WeakPolarHBondContact O-CD1 3.42Å; L734-I738 WeakPolarHBondContact O-CG1 3.2Å; L734-I738 PolarHBondContact O-N 3.21Å; L734-T746 HydrophobicContact CD1-CG2 3.82Å; L734-L749 HydrophobicContact CB-CB 4.48Å; L734-L749 HydrophobicContact CB-CD1 4.39Å; L734-L749 HydrophobicContact CD1-CB 3.95Å; L734-E750 HydrophobicContact CD1-CG 4.31Å
735	Q	86.9	Confident	88.3	Confident	99 Å²	99	88.5 Å²	88.5	46%	0.463	45%	0.447	S	S	.	.	H	α-helix	trans	-58.7	-44.9	172.1	-67.5	-173.6	19.8	0	0	110.6	E731 A737 I738 L739	E731-Q735 HydrophobicContact CG-CG 4.18Å; E731-Q735 VanDerWaalsContact CG-NE2 3.25Å; E731-Q735 WeakPolarHBondContact O-CB 3.35Å; E731-Q735 VanDerWaalsContact O-CG 3.31Å; E731-Q735 WeakPolarHBondContact O-CG 3.41Å; E731-Q735 PolarHBondContact O-N 3.43Å; E731-Q735 PolarHBondContact OE1-NE2 3.03Å; Q735-A737 PolarHBondContact O-N 3.05Å; Q735-I738 PolarHBondContact O-N 3.08Å; Q735-L739 WeakPolarHBondContact O-CB 3.48Å; Q735-L739 VanDerWaalsContact O-CG 3.26Å; Q735-L739 WeakPolarHBondContact O-CG 3.43Å; Q735-L739 PolarHBondContact O-N 3.14Å
736	T	87.6	Confident	88.3	Confident	72 Å²	72	84.3 Å²	84.3	44%	0.442	43%	0.425	S	S	.	.	H	α-helix	trans	-62.7	-41.7	175.8	-62.2	0	0	0	0	112.6	D732 K733 L734 N740	D732-T736 WeakPolarHBondContact O-CB 3.48Å; D732-T736 PolarHBondContact O-N 3.22Å; D732-T736 PolarHBondContact O-OG1 3.2Å; K733-T736 PolarHBondContact O-N 3Å; L734-T736 VanDerWaalsContact C-N 3.32Å; L734-T736 PolarHBondContact O-N 3.05Å; T736-N740 WeakPolarHBondContact CG2-ND2 3.05Å; T736-N740 WeakPolarHBondContact O-CB 3.49Å; T736-N740 PolarHBondContact O-N 3.12Å; T736-N740 PolarHBondContact O-ND2 3.17Å
737	A	87.9	Confident	88.1	Confident	2 Å²	2	84.8 Å²	84.8	2%	0.017	43%	0.431	C	S	.	.	H	α-helix	trans	-65.9	-40.2	176.8	0	0	0	0	0	112	K733 L734 Q735 N740 R741 D742 L745 L749	K733-A737 VanDerWaalsContact O-CB 3.26Å; K733-A737 WeakPolarHBondContact O-CB 3.41Å; K733-A737 PolarHBondContact O-N 3.14Å; L734-A737 PolarHBondContact O-N 3.24Å; Q735-A737 PolarHBondContact O-N 3.05Å; A737-N740 CarbonylContact O-C 3.6Å; A737-N740 PolarHBondContact O-N 3.14Å; A737-R741 PolarHBondContact O-N 2.9Å; A737-D742 PolarHBondContact O-N 2.8Å; A737-L745 HydrophobicContact CB-CB 4.28Å; A737-L745 HydrophobicContact CB-CD2 3.83Å; A737-L745 HydrophobicContact CB-CG 3.88Å; A737-L749 HydrophobicContact CB-CD1 4Å
738	I	84.4	Confident	88.1	Confident	96 Å²	96	85.5 Å²	85.5	49%	0.492	44%	0.441	S	S	.	.	H	α-helix	trans	-65.1	-46	176.1	-71.8	165.4	0	0	0	111	L734 Q735 N740 R741 T746	L734-I738 HydrophobicContact CD1-CD1 4.12Å; L734-I738 HydrophobicContact CG-CD1 3.93Å; L734-I738 WeakPolarHBondContact O-CB 3.46Å; L734-I738 WeakPolarHBondContact O-CD1 3.42Å; L734-I738 WeakPolarHBondContact O-CG1 3.2Å; L734-I738 PolarHBondContact O-N 3.21Å; Q735-I738 PolarHBondContact O-N 3.08Å; I738-N740 PolarHBondContact O-N 2.71Å; I738-R741 PolarHBondContact O-N 3.36Å; I738-R741 VanDerWaalsContact O-N 3.08Å; I738-T746 HydrophobicContact CD1-CG2 4.47Å; I738-T746 HydrophobicContact CG1-CG2 3.93Å
739	L	88.1	Confident	88.3	Confident	130 Å²	130	81.6 Å²	81.6	68%	0.681	42%	0.421	S	S	*	.	H	α-helix	trans	-60.3	-44.4	176.1	-73.2	168.4	0	0	0	111.6	Q735 R741	Q735-L739 WeakPolarHBondContact O-CB 3.48Å; Q735-L739 VanDerWaalsContact O-CG 3.26Å; Q735-L739 WeakPolarHBondContact O-CG 3.43Å; Q735-L739 PolarHBondContact O-N 3.14Å; L739-R741 PolarHBondContact O-N 2.6Å
740	N	87.4	Confident	88.2	Confident	121 Å²	121	84.9 Å²	84.9	65%	0.647	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-3.9	176.1	-70.2	-46.5	0	0	0	114.1	T736 A737 I738 D742	T736-N740 WeakPolarHBondContact CG2-ND2 3.05Å; T736-N740 WeakPolarHBondContact O-CB 3.49Å; T736-N740 PolarHBondContact O-N 3.12Å; T736-N740 PolarHBondContact O-ND2 3.17Å; A737-N740 CarbonylContact O-C 3.6Å; A737-N740 PolarHBondContact O-N 3.14Å; I738-N740 PolarHBondContact O-N 2.71Å; N740-D742 VanDerWaalsContact C-N 3.26Å; N740-D742 PolarHBondContact O-N 2.66Å
741	R	86.6	Confident	88.1	Confident	210 Å²	210	90.7 Å²	90.7	79%	0.792	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	26	-177.8	-62.8	179.2	164.1	78.5	-4.4	115.4	A737 I738 L739 Q743	A737-R741 PolarHBondContact O-N 2.9Å; I738-R741 PolarHBondContact O-N 3.36Å; I738-R741 VanDerWaalsContact O-N 3.08Å; L739-R741 PolarHBondContact O-N 2.6Å; R741-Q743 PolarHBondContact O-N 2.64Å
742	D	89.7	Confident	88.1	Confident	73 Å²	73	88.5 Å²	88.5	39%	0.39	45%	0.445	S	S	.	.			trans	-78	92.2	174	-170.4	-22.3	0	0	0	110.3	A737 N740 A744 L745 T746	A737-D742 PolarHBondContact O-N 2.8Å; N740-D742 VanDerWaalsContact C-N 3.26Å; N740-D742 PolarHBondContact O-N 2.66Å; D742-A744 VanDerWaalsContact C-N 3.27Å; D742-A744 PolarHBondContact O-N 3.48Å; D742-A744 WeakPolarHBondContact OD1-CB 3.49Å; D742-A744 PolarHBondContact OD1-N 3.16Å; D742-L745 HydrophobicContact CB-CB 3.91Å; D742-L745 PolarHBondContact O-N 3.2Å; D742-L745 PolarHBondContact OD1-N 3.5Å; D742-T746 VanDerWaalsContact O-CB 3.3Å; D742-T746 WeakPolarHBondContact O-CB 3.34Å; D742-T746 PolarHBondContact O-N 2.99Å; D742-T746 PolarHBondContact O-OG1 3.48Å
743	Q	86.4	Confident	88.2	Confident	168 Å²	168	86.3 Å²	86.3	79%	0.785	44%	0.435	S	S	*	.	H	α-helix	trans	-65	-28.1	179.4	-65.8	-177.6	-18.4	0	0	113.2	R741 H747	R741-Q743 PolarHBondContact O-N 2.64Å; Q743-H747 WeakPolarHBondContact O-CB 3.14Å; Q743-H747 PolarHBondContact O-N 3.2Å
744	A	87	Confident	88.1	Confident	69 Å²	69	86.1 Å²	86.1	57%	0.57	44%	0.436	S	S	*	.	H	α-helix	trans	-75	-45.1	179.4	0	0	0	0	0	110.4	D742 C748	D742-A744 VanDerWaalsContact C-N 3.27Å; D742-A744 PolarHBondContact O-N 3.48Å; D742-A744 WeakPolarHBondContact OD1-CB 3.49Å; D742-A744 PolarHBondContact OD1-N 3.16Å; A744-C748 PolarHBondContact O-N 3.46Å; A744-C748 VanDerWaalsContact O-N 3.17Å; A744-C748 PolarHBondContact O-SG 3.38Å; A744-C748 VanDerWaalsContact O-SG 3.34Å
745	L	87.5	Confident	88.2	Confident	80 Å²	80	89.2 Å²	89.2	42%	0.419	45%	0.449	S	S	.	.	H	α-helix	trans	-64.8	-44.1	173.7	-178.1	58.6	0	0	0	111.6	A737 D742 H747 C748 L749	A737-L745 HydrophobicContact CB-CB 4.28Å; A737-L745 HydrophobicContact CB-CD2 3.83Å; A737-L745 HydrophobicContact CB-CG 3.88Å; D742-L745 HydrophobicContact CB-CB 3.91Å; D742-L745 PolarHBondContact O-N 3.2Å; D742-L745 PolarHBondContact OD1-N 3.5Å; L745-H747 PolarHBondContact O-N 2.9Å; L745-C748 WeakPolarHBondContact O-CB 3.43Å; L745-C748 PolarHBondContact O-N 3.02Å; L745-C748 VanDerWaalsContact O-N 3.13Å; L745-L749 HydrophobicContact CD1-CD1 4Å; L745-L749 HydrophobicContact CD1-CG 4.11Å; L745-L749 HydrophobicContact CG-CD1 3.81Å; L745-L749 HydrophobicContact CG-CG 4.37Å; L745-L749 WeakPolarHBondContact O-CG 3.42Å; L745-L749 PolarHBondContact O-N 2.9Å
746	T	88.2	Confident	88.3	Confident	19 Å²	19	84.6 Å²	84.6	12%	0.117	43%	0.428	C	S	.	.	H	α-helix	trans	-54.4	-52.9	177.4	-58	0	0	0	0	111.1	L734 I738 D742 C748 L749 E750	L734-T746 HydrophobicContact CD1-CG2 3.82Å; I738-T746 HydrophobicContact CD1-CG2 4.47Å; I738-T746 HydrophobicContact CG1-CG2 3.93Å; D742-T746 VanDerWaalsContact O-CB 3.3Å; D742-T746 WeakPolarHBondContact O-CB 3.34Å; D742-T746 PolarHBondContact O-N 2.99Å; D742-T746 PolarHBondContact O-OG1 3.48Å; T746-C748 VanDerWaalsContact C-N 3.28Å; T746-C748 PolarHBondContact O-N 3.34Å; T746-L749 PolarHBondContact O-N 3.26Å; T746-L749 VanDerWaalsContact O-N 3.14Å; T746-E750 WeakPolarHBondContact O-CG 3.34Å; T746-E750 PolarHBondContact O-N 2.84Å
747	H	86.7	Confident	88.3	Confident	99 Å²	99	85.6 Å²	85.6	46%	0.458	43%	0.426	S	S	.	.	H	α-helix	trans	-69.9	-19.3	179.9	172.6	-119.3	0	0	0	114.1	Q743 L745 K751	Q743-H747 WeakPolarHBondContact O-CB 3.14Å; Q743-H747 PolarHBondContact O-N 3.2Å; L745-H747 PolarHBondContact O-N 2.9Å; H747-K751 PolarHBondContact CE1-NZ 3.26Å; H747-K751 WeakPolarHBondContact NE2-CE 3.39Å; H747-K751 WeakPolarHBondContact O-CG 3.3Å
748	C	90.2	Very high	88.3	Confident	78 Å²	78	87.6 Å²	87.6	53%	0.527	44%	0.44	S	S	.	.	H	α-helix	trans	-76	-42.9	167.8	-74.5	0	0	0	0	111.7	A744 L745 T746 K751 E752	A744-C748 PolarHBondContact O-N 3.46Å; A744-C748 VanDerWaalsContact O-N 3.17Å; A744-C748 PolarHBondContact O-SG 3.38Å; A744-C748 VanDerWaalsContact O-SG 3.34Å; L745-C748 WeakPolarHBondContact O-CB 3.43Å; L745-C748 PolarHBondContact O-N 3.02Å; L745-C748 VanDerWaalsContact O-N 3.13Å; T746-C748 VanDerWaalsContact C-N 3.28Å; T746-C748 PolarHBondContact O-N 3.34Å; C748-K751 WeakPolarHBondContact O-CB 3.25Å; C748-K751 PolarHBondContact O-N 2.89Å; C748-E752 PolarHBondContact O-N 3.03Å; C748-E752 VanDerWaalsContact O-N 3.14Å
749	L	91	Very high	88.4	Confident	9 Å²	9	84.9 Å²	84.9	5%	0.047	43%	0.428	C	S	.	.	H	α-helix	trans	-68.5	-37.4	178.3	-67.5	168	0	0	0	112.1	L730 K733 L734 A737 L745 T746 K751 E752 V753	L730-L749 HydrophobicContact CD2-CD2 3.63Å; K733-L749 HydrophobicContact CB-CD1 3.87Å; K733-L749 HydrophobicContact CB-CD2 4.07Å; K733-L749 HydrophobicContact CD-CD2 4.41Å; L734-L749 HydrophobicContact CB-CB 4.48Å; L734-L749 HydrophobicContact CB-CD1 4.39Å; L734-L749 HydrophobicContact CD1-CB 3.95Å; A737-L749 HydrophobicContact CB-CD1 4Å; L745-L749 HydrophobicContact CD1-CD1 4Å; L745-L749 HydrophobicContact CD1-CG 4.11Å; L745-L749 HydrophobicContact CG-CD1 3.81Å; L745-L749 HydrophobicContact CG-CG 4.37Å; L745-L749 WeakPolarHBondContact O-CG 3.42Å; L745-L749 PolarHBondContact O-N 2.9Å; T746-L749 PolarHBondContact O-N 3.26Å; T746-L749 VanDerWaalsContact O-N 3.14Å; L749-K751 VanDerWaalsContact C-N 3.25Å; L749-K751 PolarHBondContact O-N 3.42Å; L749-E752 PolarHBondContact O-N 3.06Å; L749-V753 WeakPolarHBondContact O-CG2 3.04Å; L749-V753 PolarHBondContact O-N 2.9Å
750	E	87.2	Confident	88.4	Confident	104 Å²	104	81.9 Å²	81.9	49%	0.486	41%	0.412	S	S	.	.	H	α-helix	trans	-56.8	-38.4	171.5	-75.2	173.9	161.8	0	0	112.2	L734 T746 Q754	L734-E750 HydrophobicContact CD1-CG 4.31Å; T746-E750 WeakPolarHBondContact O-CG 3.34Å; T746-E750 PolarHBondContact O-N 2.84Å; E750-Q754 WeakPolarHBondContact O-CB 3.31Å; E750-Q754 PolarHBondContact O-N 3.49Å
751	K	89.5	Confident	88.3	Confident	123 Å²	123	81.5 Å²	81.5	54%	0.535	41%	0.407	S	S	.	.	H	α-helix	trans	-69.8	-36.4	174.6	-71.5	172.7	-179.5	179.8	0	112.3	H747 C748 L749 Q754 E755	H747-K751 PolarHBondContact CE1-NZ 3.26Å; H747-K751 WeakPolarHBondContact NE2-CE 3.39Å; H747-K751 WeakPolarHBondContact O-CG 3.3Å; C748-K751 WeakPolarHBondContact O-CB 3.25Å; C748-K751 PolarHBondContact O-N 2.89Å; L749-K751 VanDerWaalsContact C-N 3.25Å; L749-K751 PolarHBondContact O-N 3.42Å; K751-Q754 PolarHBondContact O-N 3.02Å; K751-E755 PolarHBondContact O-N 3.46Å
752	E	90.7	Very high	88.3	Confident	66 Å²	66	77.9 Å²	77.9	31%	0.308	39%	0.393	S	S	.	.	H	α-helix	trans	-68.1	-40.2	176.8	-156.3	180	155	0	0	111.5	R726 L730 C748 L749 Q754 E755 V756	R726-E752 IonicContact CZ-OE1 2.97Å; R726-E752 VanDerWaalsContact CZ-OE1 3.29Å; R726-E752 IonicContact NE-OE1 2.85Å; R726-E752 PolarHBondContact NE-OE1 3.31Å; R726-E752 VanDerWaalsContact NH2-CD 3.32Å; R726-E752 IonicContact NH2-OE1 3.69Å; R726-E752 PolarHBondContact NH2-OE1 3.34Å; L730-E752 HydrophobicContact CD1-CB 4.31Å; L730-E752 HydrophobicContact CD1-CG 4.04Å; L730-E752 HydrophobicContact CD2-CB 4.05Å; L730-E752 HydrophobicContact CD2-CG 4.09Å; C748-E752 PolarHBondContact O-N 3.03Å; C748-E752 VanDerWaalsContact O-N 3.14Å; L749-E752 PolarHBondContact O-N 3.06Å; E752-Q754 VanDerWaalsContact C-N 3.32Å; E752-Q754 PolarHBondContact O-N 3.35Å; E752-E755 WeakPolarHBondContact O-CB 3.31Å; E752-E755 PolarHBondContact O-N 2.72Å; E752-V756 WeakPolarHBondContact O-CG2 3.32Å; E752-V756 PolarHBondContact O-N 2.95Å
753	V	90.6	Very high	88	Confident	50 Å²	50	75.8 Å²	75.8	30%	0.303	38%	0.381	S	S	.	.	H	α-helix	trans	-60.7	-40.7	170.5	172.3	0	0	0	0	111.3	L730 L749 V756 K757	L730-V753 HydrophobicContact CB-CG2 4.22Å; L730-V753 HydrophobicContact CD1-CG2 4.22Å; L749-V753 WeakPolarHBondContact O-CG2 3.04Å; L749-V753 PolarHBondContact O-N 2.9Å; V753-V756 PolarHBondContact O-N 3.48Å; V753-K757 WeakPolarHBondContact O-CB 3.47Å; V753-K757 PolarHBondContact O-N 3.45Å
754	Q	88.4	Confident	87.7	Confident	105 Å²	105	72.1 Å²	72.1	49%	0.491	37%	0.367	S	S	.	.	H	α-helix	trans	-69.2	-31	175.4	-177	61	30.2	0	0	112.9	E750 K751 E752 S758	E750-Q754 WeakPolarHBondContact O-CB 3.31Å; E750-Q754 PolarHBondContact O-N 3.49Å; K751-Q754 PolarHBondContact O-N 3.02Å; E752-Q754 VanDerWaalsContact C-N 3.32Å; E752-Q754 PolarHBondContact O-N 3.35Å; Q754-S758 PolarHBondContact O-N 3.38Å
755	E	89.9	Confident	87.5	Confident	100 Å²	100	72.6 Å²	72.6	47%	0.467	36%	0.362	S	S	.	.	H	α-helix	trans	-66	-47.5	170.7	-178.4	-170.7	-116.4	0	0	111.2	R726 K751 E752 K757 S758 T759	R726-E755 IonicContact CZ-OE2 2.73Å; R726-E755 IonicContact NH1-OE2 3.18Å; R726-E755 PolarHBondContact NH1-OE2 2.99Å; R726-E755 IonicContact NH2-OE2 3.23Å; R726-E755 PolarHBondContact NH2-OE2 3.35Å; K751-E755 PolarHBondContact O-N 3.46Å; E752-E755 WeakPolarHBondContact O-CB 3.31Å; E752-E755 PolarHBondContact O-N 2.72Å; E755-K757 VanDerWaalsContact C-N 3.35Å; E755-K757 PolarHBondContact O-N 3.1Å; E755-S758 WeakPolarHBondContact O-CB 3.39Å; E755-S758 PolarHBondContact O-N 3.26Å; E755-S758 VanDerWaalsContact O-N 3.13Å; E755-S758 PolarHBondContact O-OG 2.9Å; E755-T759 PolarHBondContact O-N 2.87Å; E755-T759 PolarHBondContact O-OG1 3.11Å
756	V	90	Very high	87	Confident	2 Å²	2	73.6 Å²	73.6	1%	0.012	37%	0.365	C	S	.	.	H	α-helix	trans	-60.2	-45.2	176.2	173.9	0	0	0	0	110.6	I723 R726 L727 L730 E752 V753 S758 T759 L760	I723-V756 HydrophobicContact CG2-CG1 3.68Å; R726-V756 HydrophobicContact CG-CG2 4.38Å; L727-V756 HydrophobicContact CD1-CG1 4.25Å; L727-V756 HydrophobicContact CD2-CB 4.37Å; L727-V756 HydrophobicContact CD2-CG1 3.74Å; L727-V756 HydrophobicContact CG-CG1 3.89Å; L730-V756 HydrophobicContact CD1-CG2 4.05Å; E752-V756 WeakPolarHBondContact O-CG2 3.32Å; E752-V756 PolarHBondContact O-N 2.95Å; V753-V756 PolarHBondContact O-N 3.48Å; V756-S758 VanDerWaalsContact C-N 3.33Å; V756-S758 PolarHBondContact O-N 2.98Å; V756-T759 WeakPolarHBondContact O-CB 3.38Å; V756-T759 PolarHBondContact O-N 3.49Å; V756-L760 HydrophobicContact CG1-CD1 4.31Å; V756-L760 PolarHBondContact O-N 3.47Å
757	K	87.4	Confident	86.3	Confident	94 Å²	94	76.4 Å²	76.4	41%	0.409	38%	0.379	S	S	.	.	H	α-helix	trans	-55.7	-45.5	172.3	177.7	176.9	173	-179.2	0	112.1	V753 E755 T759 L760 Q761	V753-K757 WeakPolarHBondContact O-CB 3.47Å; V753-K757 PolarHBondContact O-N 3.45Å; E755-K757 VanDerWaalsContact C-N 3.35Å; E755-K757 PolarHBondContact O-N 3.1Å; K757-T759 PolarHBondContact O-N 2.94Å; K757-L760 PolarHBondContact O-N 3.19Å; K757-Q761 WeakPolarHBondContact O-CB 3.32Å; K757-Q761 WeakPolarHBondContact O-CG 3.48Å; K757-Q761 PolarHBondContact O-N 3.24Å
758	S	87.7	Confident	85.6	Confident	44 Å²	44	76.1 Å²	76.1	31%	0.308	38%	0.378	S	S	.	.	H	α-helix	trans	-63.6	-26.2	177.4	82.3	0	0	0	0	113.2	Q754 E755 V756 R762	Q754-S758 PolarHBondContact O-N 3.38Å; E755-S758 WeakPolarHBondContact O-CB 3.39Å; E755-S758 PolarHBondContact O-N 3.26Å; E755-S758 VanDerWaalsContact O-N 3.13Å; E755-S758 PolarHBondContact O-OG 2.9Å; V756-S758 VanDerWaalsContact C-N 3.33Å; V756-S758 PolarHBondContact O-N 2.98Å; S758-R762 WeakPolarHBondContact O-CB 3.35Å; S758-R762 PolarHBondContact O-N 3.2Å; S758-R762 PolarHBondContact O-NH2 3.13Å
759	T	87.3	Confident	84.3	Confident	38 Å²	38	76.6 Å²	76.6	23%	0.233	38%	0.378	C	S	.	.	H	α-helix	trans	-82.6	-42.3	179.1	-63.3	0	0	0	0	111.6	I723 E755 V756 K757 Q761 R762 M763	I723-T759 HydrophobicContact CD1-CG2 4.36Å; E755-T759 PolarHBondContact O-N 2.87Å; E755-T759 PolarHBondContact O-OG1 3.11Å; V756-T759 WeakPolarHBondContact O-CB 3.38Å; V756-T759 PolarHBondContact O-N 3.49Å; K757-T759 PolarHBondContact O-N 2.94Å; T759-Q761 VanDerWaalsContact C-N 3.34Å; T759-Q761 PolarHBondContact O-N 2.91Å; T759-R762 WeakPolarHBondContact O-CB 3.39Å; T759-R762 PolarHBondContact O-N 2.84Å; T759-R762 VanDerWaalsContact O-N 3.16Å; T759-R762 PolarHBondContact OG1-NH1 2.87Å; T759-M763 HydrophobicContact CG2-SD 4.26Å; T759-M763 WeakPolarHBondContact O-CG 3.42Å; T759-M763 PolarHBondContact O-N 3.21Å
760	L	87	Confident	82.6	Confident	68 Å²	68	80.3 Å²	80.3	36%	0.356	40%	0.395	S	S	.	.	H	α-helix	trans	-59.4	-43.2	169.6	-75.3	170.5	0	0	0	112	I723 L727 V756 K757 R762 M763 L764	I723-L760 HydrophobicContact CD1-CD2 4.12Å; I723-L760 HydrophobicContact CG2-CD1 3.99Å; I723-L760 HydrophobicContact CG2-CD2 3.86Å; I723-L760 HydrophobicContact CG2-CG 3.95Å; L727-L760 HydrophobicContact CD1-CD1 4.31Å; V756-L760 HydrophobicContact CG1-CD1 4.31Å; V756-L760 PolarHBondContact O-N 3.47Å; K757-L760 PolarHBondContact O-N 3.19Å; L760-R762 VanDerWaalsContact C-N 3.31Å; L760-R762 PolarHBondContact O-N 3.17Å; L760-M763 PolarHBondContact O-N 3.15Å; L760-L764 PolarHBondContact O-N 3.25Å
761	Q	84.7	Confident	81	Confident	112 Å²	112	81.8 Å²	81.8	52%	0.523	40%	0.402	S	S	.	.	H	α-helix	trans	-63.2	-36.6	175.3	-71.1	-174.3	-78.9	0	0	112.2	K757 T759 L764 T765	K757-Q761 WeakPolarHBondContact O-CB 3.32Å; K757-Q761 WeakPolarHBondContact O-CG 3.48Å; K757-Q761 PolarHBondContact O-N 3.24Å; T759-Q761 VanDerWaalsContact C-N 3.34Å; T759-Q761 PolarHBondContact O-N 2.91Å; Q761-L764 PolarHBondContact O-N 3.45Å; Q761-T765 PolarHBondContact O-N 3.07Å; Q761-T765 PolarHBondContact O-OG1 3.19Å
762	R	86.9	Confident	79	Confident	135 Å²	135	82.7 Å²	82.7	51%	0.509	41%	0.408	S	S	.	.	H	α-helix	trans	-66.3	-43.4	176	-169.2	-171.9	-50.1	107.4	14.3	112.3	S758 T759 L760 T765 Q766	S758-R762 WeakPolarHBondContact O-CB 3.35Å; S758-R762 PolarHBondContact O-N 3.2Å; S758-R762 PolarHBondContact O-NH2 3.13Å; T759-R762 WeakPolarHBondContact O-CB 3.39Å; T759-R762 PolarHBondContact O-N 2.84Å; T759-R762 VanDerWaalsContact O-N 3.16Å; T759-R762 PolarHBondContact OG1-NH1 2.87Å; L760-R762 VanDerWaalsContact C-N 3.31Å; L760-R762 PolarHBondContact O-N 3.17Å; R762-T765 WeakPolarHBondContact CA-OG1 3.46Å; R762-T765 PolarHBondContact O-N 2.98Å; R762-T765 PolarHBondContact O-OG1 2.9Å; R762-Q766 PolarHBondContact O-N 3.25Å
763	M	83.6	Confident	76.7	Confident	29 Å²	29	86.5 Å²	86.5	14%	0.143	43%	0.426	C	S	.	.	H	α-helix	trans	-63	-43.8	175.8	-68.9	166.3	69	0	0	111	L716 R719 I723 T759 L760 T765 Q766 L767	L716-M763 HydrophobicContact CD1-CE 3.7Å; R719-M763 HydrophobicContact CB-CE 4.04Å; I723-M763 HydrophobicContact CD1-CE 4.22Å; I723-M763 HydrophobicContact CD1-SD 3.56Å; I723-M763 VanDerWaalsContact CD1-SD 3.56Å; T759-M763 HydrophobicContact CG2-SD 4.26Å; T759-M763 WeakPolarHBondContact O-CG 3.42Å; T759-M763 PolarHBondContact O-N 3.21Å; L760-M763 PolarHBondContact O-N 3.15Å; M763-T765 PolarHBondContact O-N 3Å; M763-Q766 WeakPolarHBondContact O-CB 3.4Å; M763-Q766 PolarHBondContact O-N 3.14Å; M763-Q766 VanDerWaalsContact O-N 3.11Å; M763-L767 WeakPolarHBondContact O-CG 3.17Å; M763-L767 PolarHBondContact O-N 3.08Å; M763-L767 VanDerWaalsContact O-N 3.14Å
764	L	80.9	Confident	74.5	Confident	91 Å²	91	90.3 Å²	90.3	48%	0.476	44%	0.44	S	S	.	.	H	α-helix	trans	-59.1	-44.8	175.1	-165.6	103.5	0	0	0	112	L760 Q761 Q766 L767 Q768	L760-L764 PolarHBondContact O-N 3.25Å; Q761-L764 PolarHBondContact O-N 3.45Å; L764-Q766 VanDerWaalsContact C-N 3.26Å; L764-Q766 PolarHBondContact O-N 3.21Å; L764-L767 PolarHBondContact O-N 2.84Å; L764-Q768 WeakPolarHBondContact O-CG 3.42Å; L764-Q768 PolarHBondContact O-N 3.5Å
765	T	81.3	Confident	72.3	Confident	78 Å²	78	92 Å²	92	48%	0.479	45%	0.453	S	S	.	.	H	α-helix	trans	-69.9	-19.8	176.6	51.2	0	0	0	0	114.2	Q761 R762 M763 V769	Q761-T765 PolarHBondContact O-N 3.07Å; Q761-T765 PolarHBondContact O-OG1 3.19Å; R762-T765 WeakPolarHBondContact CA-OG1 3.46Å; R762-T765 PolarHBondContact O-N 2.98Å; R762-T765 PolarHBondContact O-OG1 2.9Å; M763-T765 PolarHBondContact O-N 3Å; T765-V769 VanDerWaalsContact O-CG2 3.29Å; T765-V769 WeakPolarHBondContact O-CG2 3.35Å
766	Q	77.9	Confident	69.9	Low	102 Å²	102	94.4 Å²	94.4	48%	0.477	47%	0.469	S	S	.	.	H	α-helix	trans	-74.8	-50.1	174.8	178.1	174.1	-16.1	0	0	110	R762 M763 L764 Q768 V769 E770	R762-Q766 PolarHBondContact O-N 3.25Å; M763-Q766 WeakPolarHBondContact O-CB 3.4Å; M763-Q766 PolarHBondContact O-N 3.14Å; M763-Q766 VanDerWaalsContact O-N 3.11Å; L764-Q766 VanDerWaalsContact C-N 3.26Å; L764-Q766 PolarHBondContact O-N 3.21Å; Q766-Q768 VanDerWaalsContact C-N 3.27Å; Q766-Q768 PolarHBondContact O-N 2.92Å; Q766-V769 PolarHBondContact O-N 3.5Å; Q766-E770 WeakPolarHBondContact CG-OE1 3.25Å; Q766-E770 PolarHBondContact NE2-OE1 2.89Å; Q766-E770 PolarHBondContact O-N 3.48Å
767	L	73.4	Confident	67.4	Low	77 Å²	77	99.5 Å²	99.5	40%	0.403	50%	0.5	S	S	.	.	H	α-helix	trans	-57.5	-39.1	177.2	-63.3	167.6	0	0	0	112.1	L716 M763 L764 V769 E770 E771	L716-L767 HydrophobicContact CD2-CD1 4.32Å; L716-L767 HydrophobicContact CD2-CD2 3.86Å; M763-L767 WeakPolarHBondContact O-CG 3.17Å; M763-L767 PolarHBondContact O-N 3.08Å; M763-L767 VanDerWaalsContact O-N 3.14Å; L764-L767 PolarHBondContact O-N 2.84Å; L767-V769 VanDerWaalsContact C-N 3.27Å; L767-V769 PolarHBondContact O-N 3.26Å; L767-E770 PolarHBondContact O-N 3.11Å; L767-E771 WeakPolarHBondContact O-CB 3.42Å; L767-E771 PolarHBondContact O-N 3.03Å
768	Q	72.8	Confident	65	Low	94 Å²	94	102.4 Å²	102.4	44%	0.439	52%	0.52	S	S	.	.	H	α-helix	trans	-69.8	-17.7	176.2	-71.9	-178.1	-38.3	0	0	114.7	L764 Q766 Q772	L764-Q768 WeakPolarHBondContact O-CG 3.42Å; L764-Q768 PolarHBondContact O-N 3.5Å; Q766-Q768 VanDerWaalsContact C-N 3.27Å; Q766-Q768 PolarHBondContact O-N 2.92Å; Q768-Q772 WeakPolarHBondContact O-CG 3.25Å
769	V	62.7	Low	62.7	Low	87 Å²	87	106 Å²	106	53%	0.527	54%	0.54	S	S	.	.	H	α-helix	trans	-90.8	-31.2	174.8	167.4	0	0	0	0	110.7	T765 Q766 L767 Q773	T765-V769 VanDerWaalsContact O-CG2 3.29Å; T765-V769 WeakPolarHBondContact O-CG2 3.35Å; Q766-V769 PolarHBondContact O-N 3.5Å; L767-V769 VanDerWaalsContact C-N 3.27Å; L767-V769 PolarHBondContact O-N 3.26Å; V769-Q773 PolarHBondContact O-N 3.09Å
770	E	55.5	Low	60.4	Low	88 Å²	88	109.7 Å²	109.7	41%	0.411	57%	0.567	S	S	.	*	H	α-helix	trans	-67.2	-47	172	-71	154	-179.8	0	0	110.1	Q766 L767 Q772 Q773	Q766-E770 WeakPolarHBondContact CG-OE1 3.25Å; Q766-E770 PolarHBondContact NE2-OE1 2.89Å; Q766-E770 PolarHBondContact O-N 3.48Å; L767-E770 PolarHBondContact O-N 3.11Å; E770-Q772 VanDerWaalsContact C-N 3.29Å; E770-Q772 PolarHBondContact O-N 3.15Å; E770-Q773 WeakPolarHBondContact O-CB 3.42Å; E770-Q773 PolarHBondContact O-N 3.12Å
771	E	52.3	Low	58.2	Low	135 Å²	135	114.3 Å²	114.3	63%	0.631	59%	0.592	S	S	*	*	H	α-helix	trans	-57.5	-34.3	174.7	-173.5	177.4	-140.2	0	0	113.5	L767 Q773	L767-E771 WeakPolarHBondContact O-CB 3.42Å; L767-E771 PolarHBondContact O-N 3.03Å; E771-Q773 VanDerWaalsContact C-N 3.33Å
772	Q	47	Very low	55.7	Low	141 Å²	141	118.1 Å²	118.1	66%	0.659	61%	0.61	S	S	*	*	H	α-helix	trans	-82.9	-5.5	177.9	-72.8	177.5	7.2	0	0	114.1	Q768 E770	Q768-Q772 WeakPolarHBondContact O-CG 3.25Å; E770-Q772 VanDerWaalsContact C-N 3.29Å; E770-Q772 PolarHBondContact O-N 3.15Å
773	Q	43.6	Very low	53.4	Low	146 Å²	146	119.4 Å²	119.4	68%	0.682	63%	0.626	S	S	*	*	H	α-helix	trans	-96.3	-16.2	-177.1	-165.1	140.1	105.3	0	0	113	V769 E770 E771	V769-Q773 PolarHBondContact O-N 3.09Å; E770-Q773 WeakPolarHBondContact O-CB 3.42Å; E770-Q773 PolarHBondContact O-N 3.12Å; E771-Q773 VanDerWaalsContact C-N 3.33Å
774	E	44.4	Very low	51.3	Low	131 Å²	131	124.1 Å²	124.1	61%	0.612	66%	0.656	S	S	*	*	H	α-helix	trans	-77.7	-43.5	172.6	-63.1	-170.3	118.9	0	0	112	D776 T777	E774-D776 VanDerWaalsContact C-N 3.3Å; E774-D776 PolarHBondContact O-N 3.28Å; E774-T777 WeakPolarHBondContact O-CB 3.48Å; E774-T777 PolarHBondContact O-N 3.41Å; E774-T777 VanDerWaalsContact O-N 3.15Å; E774-T777 PolarHBondContact O-OG1 3.46Å
775	D	41.6	Very low	49.1	Very low	140 Å²	140	129.3 Å²	129.3	75%	0.749	68%	0.675	S	S	*	*	G	3₁₀ helix	trans	-58.4	-32.9	-176.4	-105.8	0.4	0	0	0	114.2	T777	D775-T777 PolarHBondContact O-N 3.48Å
776	D	39.4	Very low	46.8	Very low	150 Å²	150	133 Å²	133	80%	0.802	69%	0.692	S	S	*	*	G	3₁₀ helix	trans	-73.7	-5.9	-178.4	-108.5	-6	0	0	0	113.2	E774	E774-D776 VanDerWaalsContact C-N 3.3Å; E774-D776 PolarHBondContact O-N 3.28Å
777	T	38.1	Very low	44.6	Very low	109 Å²	109	135.9 Å²	135.9	67%	0.669	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-88.5	-24.2	-170.5	-29.1	0	0	0	0	114.5	E774 D775 V779	E774-T777 WeakPolarHBondContact O-CB 3.48Å; E774-T777 PolarHBondContact O-N 3.41Å; E774-T777 VanDerWaalsContact O-N 3.15Å; E774-T777 PolarHBondContact O-OG1 3.46Å; D775-T777 PolarHBondContact O-N 3.48Å; T777-V779 PolarHBondContact O-N 3.17Å
778	D	36.9	Very low	42.5	Very low	155 Å²	155	139.4 Å²	139.4	83%	0.829	73%	0.73	S	S	*	*	S	Bend	trans	-97.1	16.7	-164	-154.6	30.2	0	0	0	114.9
779	V	39.7	Very low	40.5	Very low	121 Å²	121	145.8 Å²	145.8	73%	0.733	75%	0.75	S	S	*	*			trans	-114.9	50.2	-172.4	-160	0	0	0	0	112.7	T777	T777-V779 PolarHBondContact O-N 3.17Å
780	S	39.3	Very low	39	Very low	114 Å²	114	148.6 Å²	148.6	80%	0.797	77%	0.767	S	S	*	*	S	Bend	trans	-153.9	30.6	179.4	-85.5	0	0	0	0	118.7
781	D	39.2	Very low	37.8	Very low	165 Å²	165	152.9 Å²	152.9	88%	0.882	78%	0.784	S	S	*	*	S	Bend	trans	-158.8	69.9	158.2	-128.7	-8.6	0	0	0	117.9
782	E	32.4	Very low	36.7	Very low	192 Å²	192	152.8 Å²	152.8	90%	0.897	79%	0.793	S	S	*	*			trans	-150.8	106.7	146.4	-148.1	179.6	-162.4	0	0	113.7
783	L	40	Very low	35.9	Very low	162 Å²	162	153.8 Å²	153.8	85%	0.848	80%	0.795	S	S	*	*			trans	-153.9	41.8	179.1	-130.5	178.8	0	0	0	116.8
784	V	39.6	Very low	35.4	Very low	128 Å²	128	150.8 Å²	150.8	78%	0.776	80%	0.795	S	S	*	*			trans	-152.3	109.9	154.2	-134.9	0	0	0	0	115.3
785	K	34.1	Very low	34.8	Very low	201 Å²	201	152.3 Å²	152.3	87%	0.874	80%	0.802	S	S	*	*				148.7	114.9	125	-81.2	157.5	-169.3	160.2	0	113.1
786	D	32.2	Very low	34.4	Very low	155 Å²	155	154.3 Å²	154.3	83%	0.829	81%	0.807	S	S	*	*			trans	-97.4	178.1	161.7	-168.5	9.7	0	0	0	110.1
787	E	31.3	Very low	34.1	Very low	163 Å²	163	156.5 Å²	156.5	76%	0.762	81%	0.812	S	S	*	*			trans	66.9	99.2	169.9	-58	-159.8	119.4	0	0	117.9
788	T	31	Very low	33.7	Very low	150 Å²	150	158 Å²	158	92%	0.92	82%	0.816	S	S	*	*				-157.8	148	94.7	8.1	0	0	0	0	113.5
789	R	29.9	Very low	33.4	Very low	229 Å²	229	158 Å²	158	86%	0.864	82%	0.816	S	S	*	*			trans	-122.5	118.6	-165.2	178	-170	-171	-178.7	7.8	110.9
790	V	30.3	Very low	33.1	Very low	146 Å²	146	161 Å²	161	89%	0.885	82%	0.823	S	S	*	*			trans	-121.9	145.2	167.9	-177.2	0	0	0	0	109.2
791	K	31.5	Very low	32.9	Very low	178 Å²	178	164.8 Å²	164.8	77%	0.774	83%	0.827	S	S	*	*			trans	-125.7	-180	-174.2	-156.2	-176	-176.2	-172.5	0	108.1
792	V	30.1	Very low	32.8	Very low	132 Å²	132	166.3 Å²	166.3	80%	0.8	83%	0.83	S	S	*	*			trans	88.3	125.9	-177.4	-178.4	0	0	0	0	110.8
793	K	28.8	Very low	32.9	Very low	162 Å²	162	166.1 Å²	166.1	70%	0.704	83%	0.828	S	S	*	*			cis	-148	167.6	2.8	-141.2	174.1	168.5	-150.8	0	110.2	E795	K793-E795 IonicContact NZ-OE1 3.08Å; K793-E795 PolarHBondContact NZ-OE1 3.37Å
794	A	32.9	Very low	32.7	Very low	84 Å²	84	168 Å²	168	69%	0.694	83%	0.833	S	S	*	*			trans	-105.9	145	159.2	0	0	0	0	0	108.6
795	E	32.7	Very low	32.4	Very low	162 Å²	162	168.1 Å²	168.1	76%	0.757	83%	0.829	S	S	*	*			trans	-136.6	133.3	161.7	-63.4	-171.9	160.8	0	0	106.1	K793	K793-E795 IonicContact NZ-OE1 3.08Å; K793-E795 PolarHBondContact NZ-OE1 3.37Å
796	E	33.3	Very low	32.4	Very low	182 Å²	182	164.6 Å²	164.6	85%	0.85	82%	0.816	S	S	*	*			trans	-109.6	135.7	179.2	-64.5	160.1	138	0	0	106.4
797	E	33.1	Very low	32.4	Very low	196 Å²	196	168.4 Å²	168.4	92%	0.916	82%	0.82	S	S	*	*			trans	-134.9	134.6	159.8	-70.8	-167.4	140.2	0	0	107.7
798	D	29.8	Very low	32.4	Very low	141 Å²	141	168 Å²	168	75%	0.754	82%	0.816	S	S	*	*			trans	-92.9	-179.2	-175.6	-63.9	-68.7	0	0	0	111.8
799	D	30	Very low	32.5	Very low	154 Å²	154	164.6 Å²	164.6	82%	0.824	80%	0.799	S	S	*	*			trans	67.8	147.7	164.3	-54.5	-35.4	0	0	0	115.9
800	E	33.8	Very low	32.6	Very low	186 Å²	186	159.5 Å²	159.5	87%	0.869	79%	0.789	S	S	*	*			cis	-147.7	157.4	25.6	-143.3	154.3	-144.8	0	0	110.8
801	E	35.2	Very low	32.5	Very low	192 Å²	192	157.9 Å²	157.9	90%	0.897	78%	0.784	S	S	*	*			trans	-83.1	140.1	171.8	-61.6	177.2	138.3	0	0	110.4
802	E	35.9	Very low	32.4	Very low	198 Å²	198	158.7 Å²	158.7	93%	0.925	78%	0.782	S	S	*	*			trans	-146.4	127.2	155.9	-132.3	170.8	-147.2	0	0	111.7
803	E	35.4	Very low	32.3	Very low	187 Å²	187	158.6 Å²	158.6	87%	0.874	78%	0.777	S	S	*	*			trans	-80.1	146.5	171.1	-55	173.9	125	0	0	109.3
804	E	36.2	Very low	32.8	Very low	202 Å²	202	162.1 Å²	162.1	94%	0.944	80%	0.801	S	S	*	*				-172.9	166.8	119.8	-106.8	-173.7	178.6	0	0	112.5
805	D	33.3	Very low	32.8	Very low	131 Å²	131	166.1 Å²	166.1	70%	0.701	81%	0.807	S	S	*	*			trans	-108	152.3	-154.5	-115.7	-39.6	0	0	0	114.7
806	Q	33.8	Very low	32.8	Very low	127 Å²	127	166.3 Å²	166.3	59%	0.593	81%	0.809	S	S	*	*			trans	47.5	118.4	144	-66.1	156.2	47.6	0	0	120.7	F808	Q806-F808 HydrophobicContact CB-CD2 4.33Å; Q806-F808 HydrophobicContact CG-CD2 4.26Å; Q806-F808 HydrophobicContact CG-CE2 3.96Å
807	Y	33	Very low	32.8	Very low	235 Å²	235	165.4 Å²	165.4	92%	0.922	81%	0.807	S	S	*	*			trans	-135.8	89.5	141.5	-149.2	-90.8	0	0	0	112.7
808	F	31	Very low	32.8	Very low	154 Å²	154	163.6 Å²	163.6	68%	0.675	80%	0.8	S	S	*	*			trans	-58.4	165.6	158.9	-73.9	-80.8	0	0	0	111.1	Q806	Q806-F808 HydrophobicContact CB-CD2 4.33Å; Q806-F808 HydrophobicContact CG-CD2 4.26Å; Q806-F808 HydrophobicContact CG-CE2 3.96Å
809	S	32.3	Very low	32.9	Very low	79 Å²	79	165 Å²	165	55%	0.552	80%	0.803	S	S	*	*			cis	-161.8	162.5	1.5	-119	0	0	0	0	110.3
810	D	31.7	Very low	33.1	Very low	122 Å²	122	165.7 Å²	165.7	65%	0.652	80%	0.802	S	S	*	*			trans	17.7	139.7	134.9	-31.6	-45.4	0	0	0	122.5	W812	D810-W812 VanDerWaalsContact CB-CD1 3.48Å
811	S	29.3	Very low	33.1	Very low	111 Å²	111	164.3 Å²	164.3	78%	0.776	80%	0.797	S	S	*	*			trans	-145.1	106.7	134.3	-168.9	0	0	0	0	106.1
812	W	30.1	Very low	32.9	Very low	195 Å²	195	162.2 Å²	162.2	74%	0.739	79%	0.79	S	S	*	*				51.7	118.2	76.1	-63	91.8	0	0	0	110.2	D810	D810-W812 VanDerWaalsContact CB-CD1 3.48Å
813	D	26.4	Very low	32.7	Very low	130 Å²	130	159.2 Å²	159.2	70%	0.695	78%	0.778	S	S	*	*				-178	156.2	59.5	-105.7	-44	0	0	0	112.1
814	I	39.9	Very low	32.4	Very low	237 Å²	237	156.6 Å²	156.6	100%	1.215	77%	0.77	S	S	*	*			trans	62.5	0	162.7	-54.2	168.4	0	0	0	117.2

Retrieved 814 of 814 residues in 239.3 ms (Link to these results)

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