A0A077YX17_TRITR Loading...

GCFC domain containing protein

AlphaFold DB , UniProt , Accession A0A077YX17, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 844 aa.

						>A0A077YX17_TRITR|A0A077YX17
MFRKRTVRNLRRKTANSDSSEGESEKAVSGPTPNVPPTVDPIAAPTSHVTGTAASLLSFAEDVEEDGCTVKFEKKSKIRRTPKSLLKQESGEMVFTKSYKSKPPKVLDSESNEKVETAITQSTNRPEIVVVESEETVVEVLSEVPTDDDDEEFQDVLIGGRIPDANLIHKARKKRERAREGTALPEVITFKDPDKNASTRRLIREEDSESDEERYKFYSRLESKAEEERREVEANFVSIEQDSDDERDDELERWEQEQMRKGVSFQKLAYYKKEITACTGFDGHGKDDSKPSGPYSEINEPLPMDLEVDLEQAEAAGSFVSGSRRTKQFPAEFYDDASAIASADDAYRNCLKKVKESLKECEETHQSRLNTLTGLHEQLEENEQMEARLSSAKPSLIRQYNFFQRLNVYVNSLLDCLNEKIPRIDVLEREAMDYLQRRSDYFIQRQKVDINDQYDDCMASASGLKGKSMDPEKVMRIAEREARRTRRRLKREKCDSSESHCEGMSSDDEDTSARISEFCSKKDSWAKSAEELFVDVADEYGKFESICQRFSEWYDKYPVFYREAFVTLCLPKLLSPFIRLEMLGWTPLEVNYKPLDSFNWYRSLLLFGCDSGLPEEHCIVVLIPTVVEKVVCPLLTELVKKVWRPASSSQTELLCTFLRHLFSTYPTLTGESKTTRQLLNAVYNCFEKMLNDEIFLPMFPKDILDVRSTGAFNFAERQFWFSVKCLKNALLLRGVLSDHSVKKLVFDCLLNHHIVVRLQSVPTVDVSVWTKTEAICDLIPLEWTNGPISECDQSRFEPLSGLLRRLSKTLTGTKALGARNVDKKIATLLKRFNSAKNTSSKGET
					

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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	38.4	Very low	44.9	Very low	246 Å²	246	202.2 Å²	202.2	100%	1.212	91%	0.908	S	S	*	*				0	114.9	0	-70.9	-173.4	-162.4	0	0	108.5
2	F	40.3	Very low	44.5	Very low	210 Å²	210	204.3 Å²	204.3	92%	0.921	90%	0.904	S	S	*	*			trans	-84.1	134	-172.2	-68.5	-90.9	0	0	0	112.5
3	R	53.6	Low	44.7	Very low	256 Å²	256	204.8 Å²	204.8	97%	0.966	91%	0.905	S	S	*	*			trans	-141.2	141.1	149.2	-78.8	-163.6	173.5	-177.7	-1.9	111.6
4	K	43.6	Very low	44.1	Very low	203 Å²	203	199 Å²	199	88%	0.883	90%	0.895	S	S	*	*			trans	-74.2	144.8	-154.4	-70.3	162.6	169	175	0	115.3
5	R	41.4	Very low	43.9	Very low	251 Å²	251	191.5 Å²	191.5	95%	0.947	88%	0.883	S	S	*	*			trans	-76.4	137.1	158.3	-86.4	-178	179	175.7	-0	110.2
6	T	53.4	Low	43.6	Very low	133 Å²	133	189.8 Å²	189.8	82%	0.816	88%	0.882	S	S	*	*			trans	-106.8	121.1	169.8	-11.1	0	0	0	0	109
7	V	42.4	Very low	43.4	Very low	117 Å²	117	183.9 Å²	183.9	71%	0.709	87%	0.868	S	S	*	*			trans	-89	135.5	172.9	178.8	0	0	0	0	108.1
8	R	48.8	Very low	43.6	Very low	236 Å²	236	182 Å²	182	89%	0.891	86%	0.864	S	S	*	*			trans	-132.4	138.1	160.1	-87.9	-167.9	177.7	109.7	-1.4	111.4
9	N	47.1	Very low	43.4	Very low	150 Å²	150	178.6 Å²	178.6	80%	0.802	86%	0.861	S	S	*	*			trans	-84.1	148.3	-156.7	-65.9	-43.4	0	0	0	114.3
10	L	38	Very low	43.6	Very low	174 Å²	174	175 Å²	175	91%	0.911	86%	0.855	S	S	*	*			trans	-70.4	134.6	166.1	-150.4	74.8	0	0	0	110.3
11	R	46.5	Very low	43.6	Very low	248 Å²	248	176.1 Å²	176.1	94%	0.936	86%	0.859	S	S	*	*			trans	-138.7	110.2	162.3	-163.3	172.4	-174.3	164.5	2.2	110.3
12	R	40.1	Very low	43.7	Very low	228 Å²	228	168 Å²	168	86%	0.86	84%	0.838	S	S	*	*			trans	-67.1	145.7	165	-94.1	177.2	169.8	164.7	-4.1	110.1
13	K	47.9	Very low	43.7	Very low	210 Å²	210	166.7 Å²	166.7	91%	0.913	84%	0.835	S	S	*	*			trans	-141.7	118.6	153.7	-161.4	168.6	-179.3	-179.8	0	109.6
14	T	36.6	Very low	43.1	Very low	124 Å²	124	158.9 Å²	158.9	76%	0.761	82%	0.82	S	S	*	*			trans	-91.2	148.6	171.5	43.9	0	0	0	0	110.1
15	A	40.8	Very low	42.9	Very low	86 Å²	86	157 Å²	157	71%	0.711	81%	0.814	S	S	*	*				147.3	129.8	127.5	0	0	0	0	0	114.6
16	N	39.6	Very low	42.9	Very low	164 Å²	164	154.3 Å²	154.3	88%	0.877	81%	0.809	S	S	*	*			trans	62.3	154.5	146.4	-74.6	21.6	0	0	0	120.5
17	S	39.7	Very low	42.1	Very low	91 Å²	91	152.5 Å²	152.5	64%	0.636	81%	0.808	S	S	*	*			cis	175.2	163.6	-17.1	175.4	0	0	0	0	104.8
18	D	47.3	Very low	42.1	Very low	149 Å²	149	153.5 Å²	153.5	80%	0.797	81%	0.814	S	S	*	*			trans	95.5	108.3	169.2	-58.9	-4.4	0	0	0	114.5
19	S	40	Very low	41.7	Very low	117 Å²	117	147.4 Å²	147.4	82%	0.818	81%	0.807	S	S	*	*			cis	86.6	103.2	37.6	-158.6	0	0	0	0	114.7
20	S	46.7	Very low	41.1	Very low	106 Å²	106	143.4 Å²	143.4	74%	0.741	80%	0.802	S	S	*	*			trans	172.5	108.8	142.6	67.8	0	0	0	0	108.8
21	E	42.7	Very low	41.2	Very low	200 Å²	200	140.6 Å²	140.6	94%	0.935	79%	0.794	S	S	*	*				87.5	129.5	87.2	-79	-164.1	171	0	0	116
22	G	41.8	Very low	41	Very low	74 Å²	74	134.8 Å²	134.8	76%	0.763	79%	0.786	S	S	*	*			trans	86.8	142.2	155.5	0	0	0	0	0	117.6
23	E	40.1	Very low	40.9	Very low	183 Å²	183	129.7 Å²	129.7	86%	0.855	78%	0.782	S	S	*	*			cis	-168	140.7	-1.1	-100.1	-176.7	155.5	0	0	107.7
24	S	39.7	Very low	40.6	Very low	93 Å²	93	127.5 Å²	127.5	65%	0.65	78%	0.781	S	S	*	*				52.8	124	129.4	-40.4	0	0	0	0	124.2
25	E	40.7	Very low	41	Very low	163 Å²	163	127.9 Å²	127.9	76%	0.762	78%	0.783	S	S	*	*				77.7	110.6	128.9	-74.4	-173.8	-167.8	0	0	122.3
26	K	40.6	Very low	41.7	Very low	194 Å²	194	129 Å²	129	84%	0.843	78%	0.783	S	S	*	*				172.6	138.4	98.6	-104.5	161.6	-171.7	174.6	0	113.6
27	A	36.1	Very low	41.8	Very low	96 Å²	96	126.3 Å²	126.3	79%	0.793	77%	0.774	S	S	*	*			trans	-80.9	145.8	178	0	0	0	0	0	113.2
28	V	42.7	Very low	41.5	Very low	138 Å²	138	128.4 Å²	128.4	84%	0.836	78%	0.783	S	S	*	*			trans	-147	113.5	157.8	177.2	0	0	0	0	110.4
29	S	41.7	Very low	41.3	Very low	107 Å²	107	127.7 Å²	127.7	75%	0.748	78%	0.784	S	S	*	*			trans	16.6	138	150.3	58.6	0	0	0	0	123.1
30	G	32.9	Very low	41.4	Very low	67 Å²	67	128.5 Å²	128.5	69%	0.691	78%	0.779	S	S	*	*			trans	-67.6	-164.8	161.4	0	0	0	0	0	114.3
31	P	42.1	Very low	41	Very low	115 Å²	115	129.5 Å²	129.5	75%	0.747	78%	0.783	S	S	*	*			cis	-153.6	-174	42.5	43.2	-21.1	0	0	0	117.9
32	T	42	Very low	40.9	Very low	125 Å²	125	128 Å²	128	77%	0.767	78%	0.78	S	S	*	*			trans	75.6	135.8	152.5	48.9	0	0	0	0	122.1
33	P	37.9	Very low	40.7	Very low	121 Å²	121	128.7 Å²	128.7	79%	0.786	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-88.7	131.4	179.7	35.8	-29.7	0	0	0	111.3
34	N	41.9	Very low	40.3	Very low	164 Å²	164	124.1 Å²	124.1	88%	0.877	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-101.8	116.8	171.7	-100.4	-14.2	0	0	0	110.7
35	V	45.2	Very low	40.2	Very low	132 Å²	132	125.7 Å²	125.7	80%	0.8	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-70.9	133.2	161.9	175.9	0	0	0	0	108.6
36	P	54.1	Low	39.8	Very low	110 Å²	110	124.1 Å²	124.1	71%	0.714	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-99.6	155.7	159	27.4	-13.2	0	0	0	111.6
37	P	42.9	Very low	39.6	Very low	108 Å²	108	120.4 Å²	120.4	70%	0.701	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-88.1	163.8	-155.1	35.6	-35.8	0	0	0	114.6
38	T	33.1	Very low	39.5	Very low	135 Å²	135	124.1 Å²	124.1	83%	0.828	78%	0.78	S	S	*	*			trans	-43.3	133.2	162.8	-18.3	0	0	0	0	112.3
39	V	43.6	Very low	39.3	Very low	134 Å²	134	124.4 Å²	124.4	81%	0.812	78%	0.782	S	S	*	*			trans	-126.3	125.1	166.4	-178.2	0	0	0	0	108.4
40	D	40.6	Very low	39	Very low	133 Å²	133	125.2 Å²	125.2	71%	0.711	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-61.4	154.5	-176	-60	-58.2	0	0	0	114.3
41	P	39.1	Very low	39.1	Very low	128 Å²	128	125.1 Å²	125.1	83%	0.831	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-80.3	123.9	173.4	32.4	-29.2	0	0	0	110.5
42	I	39.9	Very low	38.9	Very low	169 Å²	169	127.1 Å²	127.1	87%	0.867	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-77.7	129.5	171.2	-66.5	173.6	0	0	0	109.6
43	A	37.5	Very low	38.7	Very low	87 Å²	87	126.1 Å²	126.1	72%	0.719	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-75.7	141.5	179	0	0	0	0	0	114.1
44	A	32.9	Very low	38.9	Very low	87 Å²	87	125.2 Å²	125.2	72%	0.719	80%	0.799	S	S	*	*			trans	40.3	151.4	146.3	0	0	0	0	0	121.9
45	P	36.5	Very low	38.8	Very low	127 Å²	127	122.1 Å²	122.1	83%	0.825	79%	0.79	S	S	*	*				-136.3	136.5	101.2	35.3	-22.7	0	0	0	114.4
46	T	31.6	Very low	38.6	Very low	129 Å²	129	122.7 Å²	122.7	79%	0.791	79%	0.788	S	S	*	*			trans	-62.3	136	163	40.4	0	0	0	0	111.9
47	S	38.3	Very low	37.9	Very low	117 Å²	117	124.1 Å²	124.1	82%	0.818	79%	0.789	S	S	*	*			trans	-126.1	114.2	163.2	60.6	0	0	0	0	110.5
48	H	33.3	Very low	37.6	Very low	173 Å²	173	123 Å²	123	80%	0.801	78%	0.784	S	S	*	*			trans	-65.2	136.1	166.2	-79.7	-95.9	0	0	0	111.3
49	V	38.4	Very low	38	Very low	144 Å²	144	126.6 Å²	126.6	87%	0.873	79%	0.789	S	S	*	*			trans	-141.7	130.7	145.2	-179.4	0	0	0	0	109.4
50	T	36.2	Very low	37.6	Very low	125 Å²	125	124.8 Å²	124.8	77%	0.767	79%	0.787	S	S	*	*			trans	-86.7	149.3	-171.7	46	0	0	0	0	114.3
51	G	34	Very low	37.7	Very low	65 Å²	65	127.6 Å²	127.6	67%	0.67	80%	0.796	S	S	*	*			trans	102.2	111.2	130.9	0	0	0	0	0	118.4
52	T	38.1	Very low	37.8	Very low	157 Å²	157	128.5 Å²	128.5	96%	0.963	79%	0.794	S	S	*	*				-178.6	137.3	97.8	29.8	0	0	0	0	110.6
53	A	38.5	Very low	37.9	Very low	103 Å²	103	127.4 Å²	127.4	85%	0.851	80%	0.795	S	S	*	*			trans	-111.2	157.1	-174.8	0	0	0	0	0	111.4
54	A	42	Very low	37.9	Very low	102 Å²	102	131.8 Å²	131.8	84%	0.843	80%	0.801	S	S	*	*			trans	-167.4	140	146.4	0	0	0	0	0	106.9
55	S	39.1	Very low	38.2	Very low	99 Å²	99	136.1 Å²	136.1	69%	0.692	81%	0.806	S	S	*	*			cis	-179.5	158	-6.4	-175.5	0	0	0	0	106.3
56	L	41	Very low	38.2	Very low	144 Å²	144	137.6 Å²	137.6	75%	0.754	81%	0.807	S	S	*	*			trans	87	122.1	160	-52.1	178.3	0	0	0	117.5
57	L	38.6	Very low	38.4	Very low	141 Å²	141	135 Å²	135	74%	0.738	81%	0.806	S	S	*	*			cis	-166.2	110.1	6.4	-86.7	150.5	0	0	0	105.4
58	S	36.6	Very low	38.1	Very low	85 Å²	85	135.2 Å²	135.2	59%	0.594	81%	0.806	S	S	*	*				51.5	116	94.7	75.3	0	0	0	0	117.5
59	F	41.6	Very low	38	Very low	210 Å²	210	133.6 Å²	133.6	92%	0.921	81%	0.809	S	S	*	*				-159.8	118	116.3	-88	-70.9	0	0	0	109.3
60	A	35.4	Very low	37.7	Very low	95 Å²	95	132.1 Å²	132.1	79%	0.785	80%	0.8	S	S	*	*			trans	-106.2	141.5	165.8	0	0	0	0	0	107.1
61	E	44.1	Very low	37.6	Very low	193 Å²	193	135.9 Å²	135.9	90%	0.902	81%	0.805	S	S	*	*			trans	-151.3	136.4	152.1	-145.8	162.3	-160.6	0	0	109.8
62	D	41.1	Very low	37.7	Very low	146 Å²	146	141.7 Å²	141.7	78%	0.781	81%	0.812	S	S	*	*			trans	-69.6	151.8	-166.4	-56.1	-64.2	0	0	0	113.8
63	V	42.1	Very low	37.3	Very low	147 Å²	147	141.1 Å²	141.1	89%	0.891	80%	0.799	S	S	*	*				-159.6	118.6	126.6	179.8	0	0	0	0	108.6
64	E	35.9	Very low	37.4	Very low	179 Å²	179	145.9 Å²	145.9	84%	0.836	80%	0.8	S	S	*	*			trans	-75.9	136.7	166.1	-61	-176.5	150.9	0	0	111.1
65	E	38.9	Very low	37.1	Very low	178 Å²	178	148.9 Å²	148.9	83%	0.832	79%	0.794	S	S	*	*			trans	176	133.3	131	-109.6	178.5	161.2	0	0	112.3
66	D	37.7	Very low	36.9	Very low	157 Å²	157	148.9 Å²	148.9	84%	0.84	80%	0.795	S	S	*	*			trans	61.1	116.2	153.6	-68.6	-20.4	0	0	0	122.4
67	G	36.3	Very low	36.8	Very low	75 Å²	75	151.2 Å²	151.2	77%	0.773	80%	0.798	S	S	*	*			trans	179.3	63.3	169.2	0	0	0	0	0	118.2
68	C	31.3	Very low	36.7	Very low	122 Å²	122	151.8 Å²	151.8	82%	0.824	80%	0.801	S	S	*	*			trans	32.9	121.7	147.8	-72.2	0	0	0	0	121.9
69	T	31.4	Very low	36.9	Very low	139 Å²	139	158.5 Å²	158.5	85%	0.853	81%	0.813	S	S	*	*			trans	-51.5	138.9	154.4	51.6	0	0	0	0	113.8
70	V	32.8	Very low	36.8	Very low	112 Å²	112	158.6 Å²	158.6	68%	0.679	81%	0.807	S	S	*	*			trans	-129.1	106.4	162.8	-174.3	0	0	0	0	111.1	F72	V70-F72 HydrophobicContact CG1-CD2 3.83Å; V70-F72 HydrophobicContact CG1-CE2 3.57Å; V70-F72 HydrophobicContact CG1-CZ 4.17Å
71	K	33.3	Very low	36.9	Very low	204 Å²	204	159.9 Å²	159.9	89%	0.887	81%	0.806	S	S	*	*			trans	-86.1	131.2	159.1	-68.2	178.4	177.4	177.4	0	108.1
72	F	35.5	Very low	36.7	Very low	187 Å²	187	156.1 Å²	156.1	82%	0.82	80%	0.798	S	S	*	*			trans	-95.3	90	166.2	-84.5	-84.9	0	0	0	110.5	V70	V70-F72 HydrophobicContact CG1-CD2 3.83Å; V70-F72 HydrophobicContact CG1-CE2 3.57Å; V70-F72 HydrophobicContact CG1-CZ 4.17Å
73	E	31.3	Very low	36.4	Very low	145 Å²	145	158.5 Å²	158.5	68%	0.678	80%	0.801	S	S	*	*			trans	-108.5	125.7	148.3	-86	-157.4	168.3	0	0	107.7	K75	E73-K75 VanDerWaalsContact OE2-CE 3.3Å; E73-K75 WeakPolarHBondContact OE2-CE 3.19Å; E73-K75 IonicContact OE2-NZ 3.3Å; E73-K75 PolarHBondContact OE2-NZ 3.37Å
74	K	40.2	Very low	36.3	Very low	204 Å²	204	156.7 Å²	156.7	89%	0.887	80%	0.795	S	S	*	*			trans	-129.6	116.3	159.8	-96.6	-177.7	178.9	171.9	0	110
75	K	34.2	Very low	36.2	Very low	164 Å²	164	156 Å²	156	71%	0.713	80%	0.796	S	S	*	*			trans	-89.1	160.1	179.4	-69.5	172.8	175.6	162.7	0	111.7	E73	E73-K75 VanDerWaalsContact OE2-CE 3.3Å; E73-K75 WeakPolarHBondContact OE2-CE 3.19Å; E73-K75 IonicContact OE2-NZ 3.3Å; E73-K75 PolarHBondContact OE2-NZ 3.37Å
76	S	36.7	Very low	36.1	Very low	100 Å²	100	154.8 Å²	154.8	70%	0.699	80%	0.795	S	S	*	*			trans	84.5	117.2	134.2	54.8	0	0	0	0	121.7
77	K	39	Very low	35.8	Very low	192 Å²	192	156.3 Å²	156.3	84%	0.835	79%	0.794	S	S	*	*				168.4	106.9	107.7	-90.1	171.5	-179.5	175.9	0	109.9
78	I	36.1	Very low	35.8	Very low	153 Å²	153	161.8 Å²	161.8	79%	0.785	80%	0.799	S	S	*	*				61.9	104.9	92.6	-63.6	169.2	0	0	0	115
79	R	40.2	Very low	35.9	Very low	227 Å²	227	164.4 Å²	164.4	86%	0.857	80%	0.799	S	S	*	*			trans	-168.7	95.5	131.3	-152.8	167.1	168.1	-177.1	-4.1	109.7
80	R	40	Very low	36.1	Very low	211 Å²	211	163.8 Å²	163.8	80%	0.796	80%	0.801	S	S	*	*				72.9	94.5	106.6	-69.7	-178.7	170.3	152.7	-1.6	117.1
81	T	37.4	Very low	36	Very low	123 Å²	123	161.8 Å²	161.8	76%	0.755	80%	0.803	S	S	*	*				18.5	158.9	126.2	56.4	0	0	0	0	120.9
82	P	38.5	Very low	36	Very low	114 Å²	114	160.6 Å²	160.6	74%	0.74	80%	0.801	S	S	*	*			cis	-138.9	149.7	32.4	24.1	2.1	0	0	0	116.8
83	K	35.2	Very low	35.8	Very low	196 Å²	196	158.9 Å²	158.9	85%	0.852	80%	0.797	S	S	*	*				54.1	101.5	87.7	-74.4	-176.8	175.6	177.3	0	116.6
84	S	39.7	Very low	35.8	Very low	108 Å²	108	157.3 Å²	157.3	76%	0.755	80%	0.797	S	S	*	*			trans	171.3	132.1	131.3	86.8	0	0	0	0	105.2
85	L	35.1	Very low	35.5	Very low	165 Å²	165	157.1 Å²	157.1	86%	0.864	80%	0.796	S	S	*	*			cis	-162.7	137.3	48.5	-100.7	148.7	0	0	0	109.1
86	L	36.4	Very low	35.3	Very low	153 Å²	153	154.4 Å²	154.4	80%	0.801	79%	0.794	S	S	*	*			trans	-81.5	143.2	160.5	-105.1	106.2	0	0	0	109
87	K	31.6	Very low	35.2	Very low	188 Å²	188	159.2 Å²	159.2	82%	0.817	80%	0.802	S	S	*	*			trans	71.3	102.5	133.7	-156.1	175.6	-170.8	-179.6	0	119.4
88	Q	36.7	Very low	34.8	Very low	190 Å²	190	154.1 Å²	154.1	89%	0.888	79%	0.791	S	S	*	*			trans	-172.6	106.7	149.7	-108.4	173	-13.4	0	0	106.3
89	E	33.6	Very low	34.8	Very low	177 Å²	177	158 Å²	158	83%	0.827	80%	0.797	S	S	*	*				46.1	118.8	80.6	-79.7	-173.7	173.9	0	0	116.2
90	S	33.5	Very low	34.4	Very low	127 Å²	127	155.6 Å²	155.6	89%	0.888	79%	0.793	S	S	*	*			trans	80.6	126.7	153.5	70.5	0	0	0	0	121.3
91	G	31.5	Very low	34.3	Very low	70 Å²	70	151.4 Å²	151.4	72%	0.722	80%	0.796	S	S	*	*			trans	110.8	123.7	135.6	0	0	0	0	0	118.7
92	E	32.6	Very low	34.2	Very low	179 Å²	179	154.2 Å²	154.2	84%	0.836	80%	0.798	S	S	*	*			trans	71.1	142.5	153.1	-74	-179.7	141.1	0	0	118.1
93	M	32.9	Very low	34.2	Very low	151 Å²	151	154.4 Å²	154.4	74%	0.744	80%	0.799	S	S	*	*			cis	-164.6	135.9	14.2	-120.3	-170.7	-64.1	0	0	109.7
94	V	31.4	Very low	34.2	Very low	112 Å²	112	150.3 Å²	150.3	68%	0.679	79%	0.792	S	S	*	*			trans	36.6	118.1	132.5	-173.1	0	0	0	0	120.5
95	F	33	Very low	34	Very low	199 Å²	199	154.1 Å²	154.1	87%	0.873	80%	0.795	S	S	*	*				-149.7	125.1	117.6	-134	-92.2	0	0	0	112.2
96	T	31	Very low	33.8	Very low	107 Å²	107	151.4 Å²	151.4	66%	0.656	79%	0.785	S	S	*	*			trans	-82.2	143.2	176.7	50.7	0	0	0	0	111.6
97	K	34.3	Very low	33.8	Very low	201 Å²	201	151 Å²	151	87%	0.874	78%	0.783	S	S	*	*				-156.1	122.8	128.8	-109.3	173	-173.3	179.4	0	110.4
98	S	31	Very low	33.9	Very low	86 Å²	86	148.2 Å²	148.2	60%	0.601	78%	0.777	S	S	*	*			trans	-96.8	144.4	-178.4	178.1	0	0	0	0	109.3
99	Y	35.6	Very low	33.9	Very low	235 Å²	235	145 Å²	145	92%	0.922	78%	0.775	S	S	*	*			trans	-134	105.1	141.1	-81.6	-74.6	0	0	0	109.7
100	K	31.9	Very low	34	Very low	176 Å²	176	145.7 Å²	145.7	77%	0.765	78%	0.779	S	S	*	*			trans	-78.3	135.8	156.6	-94.5	168.7	173.3	162.6	0	107.9
101	S	38	Very low	34.2	Very low	123 Å²	123	145.3 Å²	145.3	86%	0.86	78%	0.776	S	S	*	*			trans	-128.6	121.1	144.6	60.5	0	0	0	0	109.1
102	K	35.5	Very low	34.2	Very low	182 Å²	182	149.9 Å²	149.9	79%	0.791	78%	0.784	S	S	*	*			trans	-93	149.1	167	-81	178.9	172.1	-177.8	0	107.8
103	P	38.1	Very low	34.4	Very low	118 Å²	118	150.1 Å²	150.1	77%	0.766	79%	0.785	S	S	*	*			trans	-82	167.9	175.4	40.4	-36.9	0	0	0	109.5
104	P	35.6	Very low	34.4	Very low	109 Å²	109	152.8 Å²	152.8	71%	0.708	79%	0.793	S	S	*	*				-162.8	176	73.4	42.4	-19.2	0	0	0	119.1
105	K	34.6	Very low	34.6	Very low	188 Å²	188	153.4 Å²	153.4	82%	0.817	80%	0.797	S	S	*	*			trans	84.1	113.7	132.6	-92.3	178.8	177.9	-178.3	0	122.4
106	V	32.2	Very low	34.6	Very low	108 Å²	108	152.6 Å²	152.6	66%	0.655	80%	0.796	S	S	*	*			trans	61	120.2	132.4	-142.6	0	0	0	0	119.5
107	L	36.2	Very low	34.9	Very low	145 Å²	145	154.2 Å²	154.2	76%	0.759	81%	0.806	S	S	*	*				167.7	111.9	105.6	-86.2	163.5	0	0	0	110.7
108	D	32.7	Very low	34.9	Very low	130 Å²	130	148.6 Å²	148.6	70%	0.695	80%	0.796	S	S	*	*			trans	28.2	129.2	132.8	-50.5	-23.7	0	0	0	118.9
109	S	37.9	Very low	35.2	Very low	121 Å²	121	152.8 Å²	152.8	85%	0.846	81%	0.81	S	S	*	*				169.7	134.3	105.3	-65.5	0	0	0	0	111.3
110	E	34	Very low	35.2	Very low	193 Å²	193	146.7 Å²	146.7	90%	0.902	80%	0.797	S	S	*	*			trans	-67.2	148.5	174.8	-58.6	164.1	127.8	0	0	112.6
111	S	38.5	Very low	35.5	Very low	119 Å²	119	146.3 Å²	146.3	83%	0.832	80%	0.799	S	S	*	*				-179.3	122.4	129	54.7	0	0	0	0	111.7
112	N	31.3	Very low	35.5	Very low	165 Å²	165	145 Å²	145	88%	0.882	79%	0.789	S	S	*	*			trans	-59.4	141.7	158.6	-88.6	-39.9	0	0	0	111
113	E	36	Very low	35.4	Very low	185 Å²	185	141.9 Å²	141.9	86%	0.864	79%	0.785	S	S	*	*			trans	-155.7	123.6	142.7	-119	175.3	-170.8	0	0	111.5
114	K	33.3	Very low	35.3	Very low	206 Å²	206	143.6 Å²	143.6	90%	0.896	79%	0.788	S	S	*	*			trans	-83	131	163.2	-87.7	176.8	168.9	-178.3	0	107.8
115	V	37.1	Very low	35.1	Very low	126 Å²	126	147.4 Å²	147.4	76%	0.764	79%	0.788	S	S	*	*			trans	-143.8	119.8	154.7	179.1	0	0	0	0	109.6
116	E	31.9	Very low	35.3	Very low	182 Å²	182	144.4 Å²	144.4	85%	0.85	79%	0.788	S	S	*	*			trans	-67.6	143.3	163.5	-67.2	167.2	132.8	0	0	110.5
117	T	36.5	Very low	35.2	Very low	141 Å²	141	145.9 Å²	145.9	87%	0.865	79%	0.788	S	S	*	*			trans	-162.6	140.5	134.8	-4.3	0	0	0	0	112.7
118	A	34.7	Very low	35.4	Very low	82 Å²	82	146.9 Å²	146.9	68%	0.678	79%	0.792	S	S	*	*			trans	-64.6	161.5	-174.3	0	0	0	0	0	115.4
119	I	38.1	Very low	35.5	Very low	175 Å²	175	146.4 Å²	146.4	90%	0.897	79%	0.794	S	S	*	*				-155.5	139.8	127.5	-88.4	141.3	0	0	0	109
120	T	35.5	Very low	35.2	Very low	106 Å²	106	146.2 Å²	146.2	65%	0.65	79%	0.787	S	S	*	*			trans	-99.9	157.3	-163.3	1.4	0	0	0	0	112.9
121	Q	38.7	Very low	35.4	Very low	169 Å²	169	144 Å²	144	79%	0.79	79%	0.786	S	S	*	*			trans	85.1	129.8	136.8	-76.1	169.8	22.1	0	0	123.2
122	S	37	Very low	35.1	Very low	94 Å²	94	146.2 Å²	146.2	66%	0.657	78%	0.784	S	S	*	*				77.6	109.1	127.9	-74.2	0	0	0	0	120.3
123	T	34	Very low	35.5	Very low	117 Å²	117	143.9 Å²	143.9	72%	0.718	78%	0.78	S	S	*	*				93.5	132.5	82.2	56	0	0	0	0	115.2
124	N	36	Very low	35.6	Very low	154 Å²	154	143.4 Å²	143.4	82%	0.824	78%	0.778	S	S	*	*			trans	90.2	128.7	146.2	-67.8	-11.9	0	0	0	122.2
125	R	30.7	Very low	35.9	Very low	189 Å²	189	141.1 Å²	141.1	71%	0.713	77%	0.771	S	S	*	*			trans	-40.1	157	163.2	-160.7	-177.4	178.8	-165.4	-4.8	114.4	E127	R125-E127 IonicContact CZ-OE1 3.9Å; R125-E127 IonicContact NH2-OE1 3.65Å; R125-E127 PolarHBondContact NH2-OE1 2.72Å; R125-E127 IonicContact NH2-OE2 2.84Å
126	P	39.6	Very low	35.7	Very low	125 Å²	125	141 Å²	141	81%	0.812	77%	0.77	S	S	*	*				-140.8	168.2	110.1	35	-19.1	0	0	0	114.5
127	E	29.7	Very low	36	Very low	140 Å²	140	138.9 Å²	138.9	65%	0.654	77%	0.769	S	S	*	*			trans	-108.9	130.5	-176.7	177.4	178.4	-124.1	0	0	107.5	R125	R125-E127 IonicContact CZ-OE1 3.9Å; R125-E127 IonicContact NH2-OE1 3.65Å; R125-E127 PolarHBondContact NH2-OE1 2.72Å; R125-E127 IonicContact NH2-OE2 2.84Å
128	I	40.4	Very low	35.8	Very low	165 Å²	165	137.9 Å²	137.9	85%	0.846	76%	0.763	S	S	*	*			trans	-141.6	137.8	163.7	-59.9	-176.7	0	0	0	111.1
129	V	35.2	Very low	36	Very low	121 Å²	121	142.9 Å²	142.9	73%	0.733	77%	0.772	S	S	*	*			trans	-69.6	139.8	-172	173.1	0	0	0	0	116.4
130	V	31.8	Very low	35.8	Very low	117 Å²	117	140 Å²	140	71%	0.709	76%	0.763	S	S	*	*			trans	7.4	134	139	-171.5	0	0	0	0	120
131	V	37.6	Very low	36.1	Very low	145 Å²	145	142.3 Å²	142.3	88%	0.879	77%	0.77	S	S	*	*				-157.1	137.4	129.5	179.7	0	0	0	0	110.5
132	E	33.2	Very low	35.9	Very low	167 Å²	167	139.7 Å²	139.7	78%	0.78	77%	0.77	S	S	*	*			trans	-70.1	156.6	-177.9	-59.4	159.2	146.1	0	0	115.8
133	S	38.7	Very low	36.2	Very low	115 Å²	115	144 Å²	144	80%	0.804	78%	0.78	S	S	*	*				176	115.8	127	30.8	0	0	0	0	114.1
134	E	37.7	Very low	36.7	Very low	176 Å²	176	144.6 Å²	144.6	82%	0.822	78%	0.784	S	S	*	*			trans	43.2	122	134	-66.1	-176.9	162.6	0	0	124.8
135	E	39.5	Very low	37.1	Very low	158 Å²	158	142.1 Å²	142.1	74%	0.738	78%	0.776	S	S	*	*				79.7	118.4	123.6	-72.6	-165.3	161.1	0	0	124.9
136	T	33.5	Very low	38.1	Very low	123 Å²	123	137.5 Å²	137.5	76%	0.755	77%	0.768	S	S	*	*			trans	75.6	133.1	139.7	64.3	0	0	0	0	117.5
137	V	37.9	Very low	39	Very low	137 Å²	137	138 Å²	138	83%	0.83	77%	0.765	S	S	*	*				-158.1	147.3	52.6	171.5	0	0	0	0	110.7
138	V	33.2	Very low	40.5	Very low	121 Å²	121	136.8 Å²	136.8	73%	0.733	76%	0.763	S	S	*	*			trans	-69.5	138.9	-179.6	175.9	0	0	0	0	113.7	V140	V138-V140 HydrophobicContact CG1-CG2 3.74Å
139	E	37.7	Very low	41.4	Very low	186 Å²	186	131.7 Å²	131.7	87%	0.869	74%	0.737	S	S	*	*			trans	-133.5	115.5	154.6	-156.6	170.8	-158.4	0	0	109.5
140	V	35	Very low	42.9	Very low	115 Å²	115	129.3 Å²	129.3	70%	0.697	72%	0.72	S	S	*	*			trans	-87.5	119.8	-178.5	172.2	0	0	0	0	109	V138	V138-V140 HydrophobicContact CG1-CG2 3.74Å
141	L	40.6	Very low	44.8	Very low	154 Å²	154	130.2 Å²	130.2	81%	0.806	72%	0.716	S	S	*	*			trans	-135.3	127.8	159.8	-74.5	176.2	0	0	0	110.6
142	S	35.7	Very low	46.5	Very low	114 Å²	114	128 Å²	128	80%	0.797	70%	0.697	S	S	*	*			trans	-77.9	123.4	-175.7	-14.9	0	0	0	0	110.9
143	E	42.9	Very low	48.5	Very low	186 Å²	186	123 Å²	123	87%	0.869	67%	0.673	S	S	*	*			trans	-122	139.1	171.1	-69.6	-168.7	171.1	0	0	112.4
144	V	44.9	Very low	50.2	Low	129 Å²	129	123.5 Å²	123.5	78%	0.782	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-80.8	132.6	-176.6	176.7	0	0	0	0	108.8
145	P	43.5	Very low	52.1	Low	101 Å²	101	120.3 Å²	120.3	66%	0.656	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-71.3	130.3	179.8	-13	27.7	0	0	0	111.8
146	T	51.2	Low	53.9	Low	92 Å²	92	114.5 Å²	114.5	56%	0.564	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-83.7	162.5	175.1	49.4	0	0	0	0	111.9	D148	T146-D148 PolarHBondContact O-N 3.44Å; T146-D148 PolarHBondContact OG1-OD2 2.88Å
147	D	58.6	Low	55.8	Low	137 Å²	137	113.4 Å²	113.4	73%	0.733	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	-7.9	-177.7	-76.4	-37.3	0	0	0	114.7	D149 D150	D147-D149 VanDerWaalsContact C-N 3.32Å; D147-D149 PolarHBondContact O-N 3.08Å; D147-D150 PolarHBondContact O-N 3.41Å
148	D	61.7	Low	57.6	Low	114 Å²	114	113.2 Å²	113.2	61%	0.61	61%	0.608	S	S	*	*	H	α-helix	trans	-66.6	-27.2	-175.5	-55.4	-58.2	0	0	0	113.6	T146 D150 E151 E152	T146-D148 PolarHBondContact O-N 3.44Å; T146-D148 PolarHBondContact OG1-OD2 2.88Å; D148-D150 VanDerWaalsContact C-N 3.27Å; D148-D150 PolarHBondContact O-N 3.12Å; D148-E151 PolarHBondContact O-N 3.22Å; D148-E152 PolarHBondContact O-N 3.43Å
149	D	60.1	Low	59.6	Low	58 Å²	58	110.2 Å²	110.2	31%	0.31	60%	0.601	S	S	.	*	H	α-helix	trans	-69.4	-21.1	-179.2	-75.8	-56.8	0	0	0	112.9	D147 K170	D147-D149 VanDerWaalsContact C-N 3.32Å; D147-D149 PolarHBondContact O-N 3.08Å; D149-K170 IonicContact OD1-NZ 3.61Å; D149-K170 PolarHBondContact OD1-NZ 3.39Å
150	D	66.2	Low	61.2	Low	70 Å²	70	104.7 Å²	104.7	37%	0.374	59%	0.594	S	S	.	*	H	α-helix	trans	-80.4	-32.7	178.9	-77	-26.7	0	0	0	112.7	D147 D148 Q154 K174	D147-D150 PolarHBondContact O-N 3.41Å; D148-D150 VanDerWaalsContact C-N 3.27Å; D148-D150 PolarHBondContact O-N 3.12Å; D150-Q154 PolarHBondContact O-N 2.82Å; D150-K174 IonicContact OD1-NZ 2.9Å; D150-K174 PolarHBondContact OD1-NZ 2.9Å; D150-K174 IonicContact OD2-NZ 3.06Å; D150-K174 PolarHBondContact OD2-NZ 2.97Å
151	E	71.8	Confident	63.3	Low	136 Å²	136	108.9 Å²	108.9	64%	0.636	60%	0.597	S	S	*	*	H	α-helix	trans	-69.3	-41.2	176	-65.5	-159.3	162.7	0	0	110.7	D148 F153 Q154 D155	D148-E151 PolarHBondContact O-N 3.22Å; E151-F153 VanDerWaalsContact C-N 3.3Å; E151-F153 PolarHBondContact O-N 3.21Å; E151-Q154 PolarHBondContact O-N 3.45Å; E151-Q154 VanDerWaalsContact O-N 3.15Å; E151-D155 WeakPolarHBondContact O-CB 3.25Å; E151-D155 PolarHBondContact O-N 2.99Å
152	E	74	Confident	64.9	Low	100 Å²	100	109 Å²	109	47%	0.467	60%	0.597	S	S	.	*	H	α-helix	trans	-60.8	-37.8	176.8	-169.7	177.4	-161.8	0	0	112	D148 V156 L167	D148-E152 PolarHBondContact O-N 3.43Å; E152-V156 WeakPolarHBondContact O-CG2 3.26Å; E152-V156 PolarHBondContact O-N 2.92Å; E152-V156 VanDerWaalsContact O-N 3.14Å; E152-L167 HydrophobicContact CG-CD1 4.17Å
153	F	74.4	Confident	67	Low	62 Å²	62	104.5 Å²	104.5	27%	0.272	57%	0.565	S	S	.	*	H	α-helix	trans	-69.4	-38.4	176.3	-164.5	-94	0	0	0	112.6	E151 L157 P163 L167 A171	E151-F153 VanDerWaalsContact C-N 3.3Å; E151-F153 PolarHBondContact O-N 3.21Å; F153-L157 HydrophobicContact CD1-CD1 3.79Å; F153-L157 HydrophobicContact CD1-CG 4.43Å; F153-L157 HydrophobicContact CE1-CD1 3.5Å; F153-L157 VanDerWaalsContact CE1-CD1 3.5Å; F153-L157 HydrophobicContact CE1-CG 4.24Å; F153-L157 HydrophobicContact CZ-CD1 4.35Å; F153-L157 WeakPolarHBondContact O-CG 3.27Å; F153-L157 PolarHBondContact O-N 3Å; F153-P163 HydrophobicContact CE2-CB 4.35Å; F153-P163 HydrophobicContact CE2-CG 4.25Å; F153-L167 HydrophobicContact CB-CD2 4.37Å; F153-L167 HydrophobicContact CD2-CD2 3.66Å; F153-L167 HydrophobicContact CD2-CG 3.93Å; F153-L167 HydrophobicContact CE2-CD2 4.41Å; F153-L167 HydrophobicContact CG-CD2 4.4Å; F153-A171 HydrophobicContact CD2-CB 4.21Å; F153-A171 HydrophobicContact CE2-CB 3.94Å; F153-A171 HydrophobicContact CZ-CB 4.42Å
154	Q	74.9	Confident	68.9	Low	125 Å²	125	102 Å²	102	58%	0.584	56%	0.558	S	S	*	*	H	α-helix	trans	-68.7	-42.1	175.6	-76.5	-172.6	15	0	0	111.8	D150 E151 V156 L157 I158	D150-Q154 PolarHBondContact O-N 2.82Å; E151-Q154 PolarHBondContact O-N 3.45Å; E151-Q154 VanDerWaalsContact O-N 3.15Å; Q154-V156 VanDerWaalsContact C-N 3.34Å; Q154-V156 PolarHBondContact O-N 3.45Å; Q154-L157 PolarHBondContact O-N 2.99Å; Q154-I158 HydrophobicContact CB-CD1 4.37Å; Q154-I158 WeakPolarHBondContact O-CB 3.39Å; Q154-I158 WeakPolarHBondContact O-CD1 3.32Å; Q154-I158 WeakPolarHBondContact O-CG1 3.24Å; Q154-I158 PolarHBondContact O-N 3.06Å
155	D	76.7	Confident	70.9	Confident	109 Å²	109	99.6 Å²	99.6	58%	0.583	55%	0.552	S	S	*	*	H	α-helix	trans	-63.7	-38.6	180	-78.5	-12.8	0	0	0	112.3	E151 G159	E151-D155 WeakPolarHBondContact O-CB 3.25Å; E151-D155 PolarHBondContact O-N 2.99Å; D155-G159 PolarHBondContact O-N 2.9Å
156	V	76.8	Confident	72.9	Confident	36 Å²	36	101.2 Å²	101.2	22%	0.218	56%	0.555	C	S	.	*	H	α-helix	trans	-66.3	-39.4	175.9	173	0	0	0	0	111.6	E152 Q154 G160 R161 P163 L167	E152-V156 WeakPolarHBondContact O-CG2 3.26Å; E152-V156 PolarHBondContact O-N 2.92Å; E152-V156 VanDerWaalsContact O-N 3.14Å; Q154-V156 VanDerWaalsContact C-N 3.34Å; Q154-V156 PolarHBondContact O-N 3.45Å; V156-G160 PolarHBondContact O-N 3.48Å; V156-R161 HydrophobicContact CG1-CB 4.15Å; V156-R161 WeakPolarHBondContact CG1-O 3.46Å; V156-R161 PolarHBondContact O-N 3.39Å; V156-P163 HydrophobicContact CG1-CB 4.21Å; V156-P163 HydrophobicContact CG1-CG 3.86Å; V156-L167 HydrophobicContact CB-CD2 4.34Å; V156-L167 HydrophobicContact CG2-CD2 4.12Å
157	L	75.2	Confident	74.5	Confident	100 Å²	100	97.8 Å²	97.8	52%	0.524	53%	0.533	S	S	.	.	H	α-helix	trans	-70.9	-41.5	176.9	-72.4	178.1	0	0	0	112.7	F153 Q154 G159 G160 P163	F153-L157 HydrophobicContact CD1-CD1 3.79Å; F153-L157 HydrophobicContact CD1-CG 4.43Å; F153-L157 HydrophobicContact CE1-CD1 3.5Å; F153-L157 VanDerWaalsContact CE1-CD1 3.5Å; F153-L157 HydrophobicContact CE1-CG 4.24Å; F153-L157 HydrophobicContact CZ-CD1 4.35Å; F153-L157 WeakPolarHBondContact O-CG 3.27Å; F153-L157 PolarHBondContact O-N 3Å; Q154-L157 PolarHBondContact O-N 2.99Å; L157-G159 VanDerWaalsContact C-N 3.29Å; L157-G159 PolarHBondContact O-N 3.45Å; L157-G160 PolarHBondContact O-N 3.25Å; L157-P163 HydrophobicContact CD2-CG 4.38Å
158	I	75.3	Confident	75.6	Confident	133 Å²	133	95.4 Å²	95.4	68%	0.682	52%	0.52	S	S	*	.	H	α-helix	trans	-66.9	-34.7	176.6	-66.4	165.1	0	0	0	110.2	Q154 G160	Q154-I158 HydrophobicContact CB-CD1 4.37Å; Q154-I158 WeakPolarHBondContact O-CB 3.39Å; Q154-I158 WeakPolarHBondContact O-CD1 3.32Å; Q154-I158 WeakPolarHBondContact O-CG1 3.24Å; Q154-I158 PolarHBondContact O-N 3.06Å; I158-G160 VanDerWaalsContact C-N 3.28Å; I158-G160 PolarHBondContact O-N 2.82Å
159	G	75.5	Confident	76.8	Confident	57 Å²	57	93.8 Å²	93.8	59%	0.588	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-1.5	176.4	0	0	0	0	0	115.6	D155 L157 R161	D155-G159 PolarHBondContact O-N 2.9Å; L157-G159 VanDerWaalsContact C-N 3.29Å; L157-G159 PolarHBondContact O-N 3.45Å; G159-R161 PolarHBondContact O-N 3.5Å
160	G	69.7	Low	77.9	Confident	70 Å²	70	96.1 Å²	96.1	72%	0.722	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	20	178.6	0	0	0	0	0	114.8	V156 L157 I158	V156-G160 PolarHBondContact O-N 3.48Å; L157-G160 PolarHBondContact O-N 3.25Å; I158-G160 VanDerWaalsContact C-N 3.28Å; I158-G160 PolarHBondContact O-N 2.82Å
161	R	79	Confident	78.6	Confident	204 Å²	204	94.3 Å²	94.3	77%	0.77	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-91.5	145.7	171.4	-75.5	-170.3	-174.4	-144.6	3.8	109.8	V156 G159 P163	V156-R161 HydrophobicContact CG1-CB 4.15Å; V156-R161 WeakPolarHBondContact CG1-O 3.46Å; V156-R161 PolarHBondContact O-N 3.39Å; G159-R161 PolarHBondContact O-N 3.5Å; R161-P163 WeakPolarHBondContact O-CD 3.35Å
162	I	75	Confident	79.3	Confident	155 Å²	155	95.6 Å²	95.6	80%	0.795	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-73.3	124.3	172.8	-60	171.7	0	0	0	107.1	D164	I162-D164 PolarHBondContact O-N 2.81Å
163	P	79.7	Confident	79.9	Confident	21 Å²	21	97.1 Å²	97.1	14%	0.136	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-57.9	135	175.9	-24.6	34	0	0	0	112.2	F153 V156 L157 R161 L167 I168	F153-P163 HydrophobicContact CE2-CB 4.35Å; F153-P163 HydrophobicContact CE2-CG 4.25Å; V156-P163 HydrophobicContact CG1-CB 4.21Å; V156-P163 HydrophobicContact CG1-CG 3.86Å; L157-P163 HydrophobicContact CD2-CG 4.38Å; R161-P163 WeakPolarHBondContact O-CD 3.35Å; P163-L167 HydrophobicContact CB-CB 4.15Å; P163-L167 HydrophobicContact CB-CD2 3.95Å; P163-I168 HydrophobicContact CB-CD1 4.49Å; P163-I168 HydrophobicContact CB-CG1 3.96Å; P163-I168 WeakPolarHBondContact O-CD1 3.43Å
164	D	83.9	Confident	80.2	Confident	132 Å²	132	99.1 Å²	99.1	71%	0.706	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-60.6	154.6	174.3	-92	-12.8	0	0	0	111.3	I162 N166 L167 I168	I162-D164 PolarHBondContact O-N 2.81Å; D164-N166 PolarHBondContact O-N 3.41Å; D164-L167 WeakPolarHBondContact O-CB 3.29Å; D164-L167 PolarHBondContact O-N 2.87Å; D164-I168 PolarHBondContact O-N 2.78Å; D164-I168 VanDerWaalsContact O-N 3.14Å
165	A	85.4	Confident	80.3	Confident	80 Å²	80	101.6 Å²	101.6	66%	0.661	53%	0.527	S	S	*	.	H	α-helix	trans	-51.7	-36.1	-178.3	0	0	0	0	0	112.9	I168 H169	A165-I168 PolarHBondContact O-N 2.83Å; A165-H169 WeakPolarHBondContact O-CB 3.22Å; A165-H169 PolarHBondContact O-N 3.35Å
166	N	85.2	Confident	80.5	Confident	134 Å²	134	100.6 Å²	100.6	72%	0.717	52%	0.518	S	S	*	.	H	α-helix	trans	-64.1	-40.8	175.2	-99.8	-12.3	0	0	0	113.3	D164 H169 K170	D164-N166 PolarHBondContact O-N 3.41Å; N166-H169 PolarHBondContact O-N 3.26Å; N166-K170 WeakPolarHBondContact O-CB 3.28Å; N166-K170 WeakPolarHBondContact O-CG 3.12Å; N166-K170 PolarHBondContact O-N 3.4Å
167	L	85.9	Confident	80.5	Confident	20 Å²	20	106.8 Å²	106.8	11%	0.105	54%	0.538	C	S	.	.	H	α-helix	trans	-68.8	-39.4	179.6	-147.3	79.4	0	0	0	110.6	E152 F153 V156 P163 D164 K170 A171	E152-L167 HydrophobicContact CG-CD1 4.17Å; F153-L167 HydrophobicContact CB-CD2 4.37Å; F153-L167 HydrophobicContact CD2-CD2 3.66Å; F153-L167 HydrophobicContact CD2-CG 3.93Å; F153-L167 HydrophobicContact CE2-CD2 4.41Å; F153-L167 HydrophobicContact CG-CD2 4.4Å; V156-L167 HydrophobicContact CB-CD2 4.34Å; V156-L167 HydrophobicContact CG2-CD2 4.12Å; P163-L167 HydrophobicContact CB-CB 4.15Å; P163-L167 HydrophobicContact CB-CD2 3.95Å; D164-L167 WeakPolarHBondContact O-CB 3.29Å; D164-L167 PolarHBondContact O-N 2.87Å; L167-K170 PolarHBondContact O-N 2.91Å; L167-A171 WeakPolarHBondContact O-CB 3.4Å; L167-A171 PolarHBondContact O-N 3.49Å
168	I	82.5	Confident	80.5	Confident	88 Å²	88	105.1 Å²	105.1	45%	0.451	54%	0.539	S	S	.	.	H	α-helix	trans	-64.2	-43.8	173.9	-59.7	175.8	0	0	0	110.6	P163 D164 A165 A171 R172	P163-I168 HydrophobicContact CB-CD1 4.49Å; P163-I168 HydrophobicContact CB-CG1 3.96Å; P163-I168 WeakPolarHBondContact O-CD1 3.43Å; D164-I168 PolarHBondContact O-N 2.78Å; D164-I168 VanDerWaalsContact O-N 3.14Å; A165-I168 PolarHBondContact O-N 2.83Å; I168-A171 PolarHBondContact O-N 2.86Å; I168-R172 VanDerWaalsContact O-CB 3.3Å; I168-R172 WeakPolarHBondContact O-CB 3.16Å; I168-R172 PolarHBondContact O-N 3Å
169	H	85.5	Confident	80.4	Confident	79 Å²	79	108.2 Å²	108.2	37%	0.366	54%	0.542	S	S	.	.	H	α-helix	trans	-66.9	-40	179.5	-146.6	-67.2	0	0	0	111.9	A165 N166 R172 K173 E300	A165-H169 WeakPolarHBondContact O-CB 3.22Å; A165-H169 PolarHBondContact O-N 3.35Å; N166-H169 PolarHBondContact O-N 3.26Å; H169-R172 PolarHBondContact O-N 3.49Å; H169-K173 WeakPolarHBondContact O-CB 3.31Å; H169-K173 PolarHBondContact O-N 2.83Å; H169-E300 IonicContact CE1-OE2 3.33Å
170	K	83.7	Confident	80.1	Confident	108 Å²	108	112.6 Å²	112.6	47%	0.47	55%	0.547	S	S	.	.	H	α-helix	trans	-60	-49.3	172.1	-81	-176.8	170.2	-167.6	0	111.3	D149 N166 L167 R172 K173 K174	D149-K170 IonicContact OD1-NZ 3.61Å; D149-K170 PolarHBondContact OD1-NZ 3.39Å; N166-K170 WeakPolarHBondContact O-CB 3.28Å; N166-K170 WeakPolarHBondContact O-CG 3.12Å; N166-K170 PolarHBondContact O-N 3.4Å; L167-K170 PolarHBondContact O-N 2.91Å; K170-R172 PolarHBondContact O-N 3.04Å; K170-K173 PolarHBondContact O-N 2.87Å; K170-K174 WeakPolarHBondContact O-CB 3.43Å; K170-K174 PolarHBondContact O-N 3.48Å
171	A	81.2	Confident	79.6	Confident	31 Å²	31	112.3 Å²	112.3	26%	0.256	54%	0.544	S	S	.	.	H	α-helix	trans	-63.8	-39.1	178.6	0	0	0	0	0	112.5	F153 L167 I168 K174 R175	F153-A171 HydrophobicContact CD2-CB 4.21Å; F153-A171 HydrophobicContact CE2-CB 3.94Å; F153-A171 HydrophobicContact CZ-CB 4.42Å; L167-A171 WeakPolarHBondContact O-CB 3.4Å; L167-A171 PolarHBondContact O-N 3.49Å; I168-A171 PolarHBondContact O-N 2.86Å; A171-K174 PolarHBondContact O-N 3.33Å; A171-R175 PolarHBondContact O-N 3.37Å; A171-R175 VanDerWaalsContact O-N 3.08Å
172	R	85.2	Confident	78	Confident	164 Å²	164	108 Å²	108	62%	0.619	54%	0.54	S	S	*	.	H	α-helix	trans	-65.6	-48.1	175.1	-171.7	176.9	-179.6	175.1	0.6	111.2	I168 H169 K170 K174 R175 E176	I168-R172 VanDerWaalsContact O-CB 3.3Å; I168-R172 WeakPolarHBondContact O-CB 3.16Å; I168-R172 PolarHBondContact O-N 3Å; H169-R172 PolarHBondContact O-N 3.49Å; K170-R172 PolarHBondContact O-N 3.04Å; R172-K174 VanDerWaalsContact C-N 3.28Å; R172-K174 PolarHBondContact O-N 3.46Å; R172-R175 PolarHBondContact O-N 2.86Å; R172-R175 VanDerWaalsContact O-N 3.11Å; R172-E176 WeakPolarHBondContact O-CB 3.35Å; R172-E176 PolarHBondContact O-N 2.91Å
173	K	86.5	Confident	76.4	Confident	132 Å²	132	104.8 Å²	104.8	57%	0.574	54%	0.537	S	S	*	.	H	α-helix	trans	-60.5	-35.9	176.6	-170.4	170.7	-173.1	170.1	0	112.2	H169 K170 E176 R177	H169-K173 WeakPolarHBondContact O-CB 3.31Å; H169-K173 PolarHBondContact O-N 2.83Å; K170-K173 PolarHBondContact O-N 2.87Å; K173-E176 PolarHBondContact O-N 3.04Å; K173-R177 WeakPolarHBondContact O-CB 3.37Å; K173-R177 PolarHBondContact O-N 3.34Å
174	K	81.7	Confident	74.7	Confident	104 Å²	104	111.5 Å²	111.5	45%	0.452	57%	0.571	S	S	.	*	H	α-helix	trans	-65.3	-44.7	172.9	-175	170.7	-179.9	168.8	0	112.1	D150 K170 A171 R172 E176 R177 A178	D150-K174 IonicContact OD1-NZ 2.9Å; D150-K174 PolarHBondContact OD1-NZ 2.9Å; D150-K174 IonicContact OD2-NZ 3.06Å; D150-K174 PolarHBondContact OD2-NZ 2.97Å; K170-K174 WeakPolarHBondContact O-CB 3.43Å; K170-K174 PolarHBondContact O-N 3.48Å; A171-K174 PolarHBondContact O-N 3.33Å; R172-K174 VanDerWaalsContact C-N 3.28Å; R172-K174 PolarHBondContact O-N 3.46Å; K174-E176 VanDerWaalsContact C-N 3.34Å; K174-R177 PolarHBondContact O-N 3.49Å; K174-A178 WeakPolarHBondContact O-CB 3.38Å; K174-A178 PolarHBondContact O-N 3.49Å
175	R	77.8	Confident	72.5	Confident	177 Å²	177	110.7 Å²	110.7	67%	0.668	57%	0.573	S	S	*	*	H	α-helix	trans	-63.8	-38.8	175	-79.3	-176.9	-174.9	179	3.2	112.6	A171 R172 A178 R179	A171-R175 PolarHBondContact O-N 3.37Å; A171-R175 VanDerWaalsContact O-N 3.08Å; R172-R175 PolarHBondContact O-N 2.86Å; R172-R175 VanDerWaalsContact O-N 3.11Å; R175-A178 PolarHBondContact O-N 3.49Å; R175-R179 VanDerWaalsContact O-CG 3.31Å; R175-R179 WeakPolarHBondContact O-CG 3.42Å; R175-R179 PolarHBondContact O-N 3.45Å; R175-R179 VanDerWaalsContact O-N 3.14Å
176	E	79.2	Confident	70.3	Confident	87 Å²	87	115.9 Å²	115.9	41%	0.407	58%	0.584	S	S	.	*	H	α-helix	trans	-67.6	-44.6	178.4	-159.8	135.3	-147.1	0	0	110.6	R172 K173 K174 A178 R179 E180	R172-E176 WeakPolarHBondContact O-CB 3.35Å; R172-E176 PolarHBondContact O-N 2.91Å; K173-E176 PolarHBondContact O-N 3.04Å; K174-E176 VanDerWaalsContact C-N 3.34Å; E176-A178 VanDerWaalsContact C-N 3.33Å; E176-A178 PolarHBondContact O-N 3.46Å; E176-R179 CarbonylContact O-C 3.59Å; E176-R179 WeakPolarHBondContact O-CA 3.41Å; E176-R179 WeakPolarHBondContact O-CB 3.43Å; E176-R179 PolarHBondContact O-N 2.88Å; E176-E180 WeakPolarHBondContact O-CG 3.22Å; E176-E180 PolarHBondContact O-N 3.14Å
177	R	76.9	Confident	68.1	Low	167 Å²	167	114.9 Å²	114.9	63%	0.63	58%	0.582	S	S	*	*	H	α-helix	trans	-62.4	-35.9	174.2	-158.9	-177.4	-136.7	119.7	0.9	113.2	K173 K174 R179 E180 G181	K173-R177 WeakPolarHBondContact O-CB 3.37Å; K173-R177 PolarHBondContact O-N 3.34Å; K174-R177 PolarHBondContact O-N 3.49Å; R177-R179 VanDerWaalsContact C-N 3.29Å; R177-R179 PolarHBondContact O-N 3.14Å; R177-E180 PolarHBondContact O-N 3.42Å; R177-G181 WeakPolarHBondContact O-CA 3.37Å; R177-G181 PolarHBondContact O-N 3.32Å
178	A	75.1	Confident	65.9	Low	65 Å²	65	121.2 Å²	121.2	54%	0.537	62%	0.615	S	S	.	*	H	α-helix	trans	-67.9	-29.3	174.1	0	0	0	0	0	112.5	K174 R175 E176 T182	K174-A178 WeakPolarHBondContact O-CB 3.38Å; K174-A178 PolarHBondContact O-N 3.49Å; R175-A178 PolarHBondContact O-N 3.49Å; E176-A178 VanDerWaalsContact C-N 3.33Å; E176-A178 PolarHBondContact O-N 3.46Å; A178-T182 PolarHBondContact O-OG1 3.23Å; A178-T182 VanDerWaalsContact O-OG1 3.09Å
179	R	74.3	Confident	64	Low	197 Å²	197	121.6 Å²	121.6	74%	0.743	62%	0.621	S	S	*	*	H	α-helix	trans	-78.1	-37.5	173.7	-68.8	173.7	-165.8	-154.4	2.5	112.1	R175 E176 R177	R175-R179 VanDerWaalsContact O-CG 3.31Å; R175-R179 WeakPolarHBondContact O-CG 3.42Å; R175-R179 PolarHBondContact O-N 3.45Å; R175-R179 VanDerWaalsContact O-N 3.14Å; E176-R179 CarbonylContact O-C 3.59Å; E176-R179 WeakPolarHBondContact O-CA 3.41Å; E176-R179 WeakPolarHBondContact O-CB 3.43Å; E176-R179 PolarHBondContact O-N 2.88Å; R177-R179 VanDerWaalsContact C-N 3.29Å; R177-R179 PolarHBondContact O-N 3.14Å
180	E	69.6	Low	61.6	Low	149 Å²	149	127.4 Å²	127.4	70%	0.696	65%	0.646	S	S	*	*	H	α-helix	trans	-81.7	-25.5	-179.4	-68.3	179.4	168	0	0	113.2	E176 R177 T182	E176-E180 WeakPolarHBondContact O-CG 3.22Å; E176-E180 PolarHBondContact O-N 3.14Å; R177-E180 PolarHBondContact O-N 3.42Å; E180-T182 VanDerWaalsContact C-N 3.31Å; E180-T182 PolarHBondContact O-N 2.87Å
181	G	59.4	Low	59.6	Low	65 Å²	65	131.2 Å²	131.2	67%	0.67	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	-0.8	179.4	0	0	0	0	0	115.4	R177	R177-G181 WeakPolarHBondContact O-CA 3.37Å; R177-G181 PolarHBondContact O-N 3.32Å
182	T	44.8	Very low	57.4	Low	112 Å²	112	136.6 Å²	136.6	69%	0.687	69%	0.687	S	S	*	*			trans	-123.9	69.6	-179.4	-32.7	0	0	0	0	110.3	A178 E180 L184	A178-T182 PolarHBondContact O-OG1 3.23Å; A178-T182 VanDerWaalsContact O-OG1 3.09Å; E180-T182 VanDerWaalsContact C-N 3.31Å; E180-T182 PolarHBondContact O-N 2.87Å; T182-L184 PolarHBondContact O-N 3.2Å
183	A	42.1	Very low	55.3	Low	89 Å²	89	134.7 Å²	134.7	74%	0.736	70%	0.696	S	S	*	*			trans	-76.9	109.5	172.9	0	0	0	0	0	111
184	L	43.8	Very low	52.9	Low	161 Å²	161	135.2 Å²	135.2	84%	0.843	71%	0.705	S	S	*	*	S	Bend	trans	84.9	146.1	157	-64.2	173	0	0	0	119	T182	T182-L184 PolarHBondContact O-N 3.2Å
185	P	36.2	Very low	50.9	Low	115 Å²	115	139.4 Å²	139.4	75%	0.747	72%	0.723	S	S	*	*				-107.5	132.4	-127.3	36.6	-29.4	0	0	0	112.6
186	E	39.7	Very low	48.9	Very low	189 Å²	189	139 Å²	139	88%	0.883	73%	0.734	S	S	*	*			trans	-98	103.6	168.9	-145.2	171.7	-161.9	0	0	110.2	I188	E186-I188 PolarHBondContact O-N 3.33Å
187	V	38.2	Very low	46.7	Very low	114 Å²	114	139 Å²	139	69%	0.691	75%	0.749	S	S	*	*			trans	-15.8	105.1	161.4	-174	0	0	0	0	113.5	T189	V187-T189 VanDerWaalsContact C-N 3.31Å; V187-T189 HydrophobicContact CG1-CG2 3.53Å; V187-T189 PolarHBondContact O-N 3.11Å
188	I	41.5	Very low	45	Very low	153 Å²	153	136.5 Å²	136.5	79%	0.785	76%	0.757	S	S	*	*			trans	-78.1	91	158.7	-57.8	175.7	0	0	0	106.5	E186 F190	E186-I188 PolarHBondContact O-N 3.33Å; I188-F190 PolarHBondContact O-N 2.88Å
189	T	41	Very low	43.3	Very low	96 Å²	96	139 Å²	139	59%	0.589	77%	0.766	S	S	*	*			trans	-63.9	118.1	166.3	53.4	0	0	0	0	108.5	V187 K191	V187-T189 VanDerWaalsContact C-N 3.31Å; V187-T189 HydrophobicContact CG1-CG2 3.53Å; V187-T189 PolarHBondContact O-N 3.11Å; T189-K191 PolarHBondContact O-N 3.29Å; T189-K191 VanDerWaalsContact O-N 3.08Å
190	F	35.8	Very low	41.4	Very low	201 Å²	201	141.9 Å²	141.9	88%	0.882	78%	0.777	S	S	*	*			trans	-60.2	110.4	162.5	-75.9	-87.8	0	0	0	108	I188	I188-F190 PolarHBondContact O-N 2.88Å
191	K	40.9	Very low	39.8	Very low	188 Å²	188	145.8 Å²	145.8	82%	0.817	79%	0.785	S	S	*	*			trans	-107.4	115.8	170.3	-119	177.8	-179.8	173.4	0	107.2	T189	T189-K191 PolarHBondContact O-N 3.29Å; T189-K191 VanDerWaalsContact O-N 3.08Å
192	D	35	Very low	38.7	Very low	144 Å²	144	150.8 Å²	150.8	77%	0.77	80%	0.796	S	S	*	*			trans	-50.9	146.6	-179.7	-60.9	-58.4	0	0	0	113.3
193	P	41.8	Very low	38.6	Very low	124 Å²	124	153.2 Å²	153.2	81%	0.805	80%	0.803	S	S	*	*				-121.1	113.6	127.4	32.6	-23.6	0	0	0	110.2
194	D	36.7	Very low	38.4	Very low	142 Å²	142	160.3 Å²	160.3	76%	0.759	81%	0.811	S	S	*	*			trans	-42.3	147	156.5	-70.4	-58.6	0	0	0	112.6
195	K	39.5	Very low	38.1	Very low	192 Å²	192	161.2 Å²	161.2	84%	0.835	81%	0.811	S	S	*	*			trans	102.8	79.3	168.7	-57.1	172.7	-176.4	178.8	0	116.1
196	N	36.3	Very low	38.3	Very low	168 Å²	168	164.4 Å²	164.4	90%	0.898	82%	0.816	S	S	*	*				-176	89.7	113.3	-93	-8.7	0	0	0	110.2
197	A	32.6	Very low	38.5	Very low	89 Å²	89	162.6 Å²	162.6	74%	0.736	81%	0.812	S	S	*	*			trans	-89.4	121	168	0	0	0	0	0	110
198	S	40.4	Very low	38.5	Very low	114 Å²	114	162.1 Å²	162.1	80%	0.797	81%	0.813	S	S	*	*			trans	-176	67.3	138.4	-81.9	0	0	0	0	107.5
199	T	40.4	Very low	38.2	Very low	118 Å²	118	163.9 Å²	163.9	72%	0.724	82%	0.818	S	S	*	*				48.7	95.1	98.1	60.5	0	0	0	0	114.6	R201	T199-R201 PolarHBondContact O-N 3.41Å
200	R	33.8	Very low	38.3	Very low	256 Å²	256	165.2 Å²	165.2	97%	0.966	83%	0.832	S	S	*	*			trans	-47.9	121.3	146.6	-62.1	173.2	-161.7	174.8	4.5	108.9
201	R	36.8	Very low	38.4	Very low	232 Å²	232	162.7 Å²	162.7	88%	0.875	83%	0.828	S	S	*	*			trans	-137.6	124.3	161.6	-118.7	-179.2	179.5	-175.1	-0.8	107.4	T199	T199-R201 PolarHBondContact O-N 3.41Å
202	L	35.1	Very low	38.5	Very low	169 Å²	169	162.7 Å²	162.7	89%	0.885	83%	0.83	S	S	*	*			trans	-41.6	132.4	177.2	-67.8	112.8	0	0	0	112.4
203	I	44	Very low	38.6	Very low	163 Å²	163	164.7 Å²	164.7	84%	0.836	84%	0.835	S	S	*	*			trans	-162.7	115.7	145.3	-83	127.7	0	0	0	109.1
204	R	37.9	Very low	38.4	Very low	238 Å²	238	169.3 Å²	169.3	90%	0.898	84%	0.837	S	S	*	*			trans	43.9	129.9	135.5	-144.8	171.4	-178.6	93.6	1.8	121.4
205	E	37.7	Very low	38.4	Very low	181 Å²	181	172.9 Å²	172.9	85%	0.846	84%	0.841	S	S	*	*			trans	-56.2	134.4	170.9	-56.5	178.4	166.7	0	0	112.3
206	E	40	Very low	38.3	Very low	182 Å²	182	172.5 Å²	172.5	85%	0.85	84%	0.839	S	S	*	*			trans	143.5	134.9	155	-77.6	168.3	-167.2	0	0	110.3
207	D	44	Very low	38.5	Very low	151 Å²	151	172 Å²	172	81%	0.807	83%	0.829	S	S	*	*			trans	88.7	86.8	172.3	-59	-22.1	0	0	0	121.1
208	S	38.3	Very low	39.2	Very low	103 Å²	103	176 Å²	176	72%	0.72	83%	0.827	S	S	*	*				56.6	118.7	114.1	-60.4	0	0	0	0	123
209	E	35.3	Very low	39.5	Very low	190 Å²	190	173.8 Å²	173.8	89%	0.888	81%	0.811	S	S	*	*			trans	60.8	98.1	134.7	-60.7	-172.6	172.5	0	0	119.6
210	S	42.6	Very low	39.6	Very low	124 Å²	124	179 Å²	179	87%	0.867	82%	0.818	S	S	*	*			trans	-165.1	129.4	134.4	-174.6	0	0	0	0	111.7
211	D	38.5	Very low	40.2	Very low	149 Å²	149	173 Å²	173	80%	0.797	80%	0.804	S	S	*	*			trans	-55.3	122.9	-175.3	-68.6	-40.8	0	0	0	115.9
212	E	42.4	Very low	40.8	Very low	187 Å²	187	168.8 Å²	168.8	87%	0.874	79%	0.794	S	S	*	*			trans	-137.4	86.4	148.6	-75.9	-160.4	178.5	0	0	110.4	R214	E212-R214 PolarHBondContact O-N 2.81Å
213	E	36.3	Very low	41.9	Very low	187 Å²	187	164.1 Å²	164.1	87%	0.874	78%	0.776	S	S	*	*			trans	-70.7	75	166.7	-78.1	-172.8	149.4	0	0	110.8
214	R	39	Very low	42.9	Very low	221 Å²	221	163 Å²	163	83%	0.834	77%	0.765	S	S	*	*			trans	-96.7	102.5	156.5	-175	-178.6	-90.1	-121.7	2	107.7	E212 K216	E212-R214 PolarHBondContact O-N 2.81Å; R214-K216 PolarHBondContact O-N 3.48Å
215	Y	36.4	Very low	44.4	Very low	216 Å²	216	153.8 Å²	153.8	85%	0.847	74%	0.739	S	S	*	*			trans	-36.7	100	176.1	-93.2	-97.7	0	0	0	113.5	F217	Y215-F217 PolarHBondContact O-N 2.88Å
216	K	36.4	Very low	45.8	Very low	184 Å²	184	150.5 Å²	150.5	80%	0.8	72%	0.724	S	S	*	*			trans	-91.2	78	165.9	-74.3	-179.1	179.3	176.4	0	109.4	R214 Y218	R214-K216 PolarHBondContact O-N 3.48Å; K216-Y218 VanDerWaalsContact C-N 3.3Å; K216-Y218 PolarHBondContact O-N 3.38Å
217	F	41.4	Very low	47.2	Very low	157 Å²	157	146.9 Å²	146.9	69%	0.689	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.8	-15.6	178.3	-172.7	-105.3	0	0	0	113.5	Y215	Y215-F217 PolarHBondContact O-N 2.88Å
218	Y	46.4	Very low	48.6	Very low	174 Å²	174	144.9 Å²	144.9	68%	0.682	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.1	2.4	-175.4	-73	-78.4	0	0	0	116.2	K216 R220	K216-Y218 VanDerWaalsContact C-N 3.3Å; K216-Y218 PolarHBondContact O-N 3.38Å; Y218-R220 VanDerWaalsContact C-N 3.32Å; Y218-R220 PolarHBondContact O-N 2.83Å
219	S	46	Very low	50.2	Low	68 Å²	68	148.5 Å²	148.5	48%	0.476	69%	0.691	S	S	.	*	H	α-helix	trans	-72.8	-16.2	-173.3	168.8	0	0	0	0	115.1
220	R	42.4	Very low	52	Low	227 Å²	227	145.2 Å²	145.2	86%	0.857	67%	0.67	S	S	*	*	H	α-helix	trans	-83	-20.7	-176	-131.7	177.9	-167.8	177.1	3.1	113.8	Y218	Y218-R220 VanDerWaalsContact C-N 3.32Å; Y218-R220 PolarHBondContact O-N 2.83Å
221	L	47.2	Very low	53.5	Low	131 Å²	131	145.8 Å²	145.8	69%	0.686	66%	0.659	S	S	*	*	H	α-helix	trans	-83	-37.1	177	-90.8	149.1	0	0	0	111.9	S223 K224 A225	L221-S223 VanDerWaalsContact C-N 3.32Å; L221-S223 PolarHBondContact O-N 2.8Å; L221-K224 PolarHBondContact O-N 3.11Å; L221-A225 PolarHBondContact O-N 2.91Å
222	E	49.5	Very low	55.2	Low	142 Å²	142	143.8 Å²	143.8	66%	0.664	65%	0.652	S	S	*	*	H	α-helix	trans	-62.7	-38.8	173.7	-81.5	172.6	155.6	0	0	111.7	K224 A225 E226	E222-K224 VanDerWaalsContact C-N 3.26Å; E222-K224 PolarHBondContact O-N 3.08Å; E222-A225 PolarHBondContact O-N 2.95Å; E222-E226 WeakPolarHBondContact O-CB 3.45Å; E222-E226 PolarHBondContact O-N 3.46Å
223	S	59.1	Low	56.6	Low	72 Å²	72	141 Å²	141	50%	0.503	64%	0.639	S	S	.	*	H	α-helix	trans	-64.7	-27.2	178.7	-167.1	0	0	0	0	113.7	L221 E227	L221-S223 VanDerWaalsContact C-N 3.32Å; L221-S223 PolarHBondContact O-N 2.8Å; S223-E227 PolarHBondContact O-N 2.9Å
224	K	63.9	Low	58.3	Low	140 Å²	140	134.9 Å²	134.9	61%	0.609	62%	0.621	S	S	*	*	H	α-helix	trans	-83.3	-38.6	179.3	-162.7	178.8	178.8	-173.8	0	111.7	L221 E222 E226 E227 E228	L221-K224 PolarHBondContact O-N 3.11Å; E222-K224 VanDerWaalsContact C-N 3.26Å; E222-K224 PolarHBondContact O-N 3.08Å; K224-E226 VanDerWaalsContact C-N 3.33Å; K224-E227 PolarHBondContact O-N 3.49Å; K224-E228 PolarHBondContact O-N 3.42Å; K224-E228 VanDerWaalsContact O-N 3.07Å
225	A	68.8	Low	59.9	Low	43 Å²	43	129.5 Å²	129.5	36%	0.355	61%	0.608	S	S	.	*	H	α-helix	trans	-69	-30.8	174.9	0	0	0	0	0	112.8	L221 E222 R229	L221-A225 PolarHBondContact O-N 2.91Å; E222-A225 PolarHBondContact O-N 2.95Å; A225-R229 WeakPolarHBondContact O-CG 3.44Å; A225-R229 PolarHBondContact O-N 3.26Å
226	E	68.8	Low	61.3	Low	113 Å²	113	125.3 Å²	125.3	53%	0.528	60%	0.595	S	S	.	*	H	α-helix	trans	-72.6	-35.7	173.8	-156.5	80	-165.8	0	0	111.8	E222 K224 R230	E222-E226 WeakPolarHBondContact O-CB 3.45Å; E222-E226 PolarHBondContact O-N 3.46Å; K224-E226 VanDerWaalsContact C-N 3.33Å; E226-R230 WeakPolarHBondContact O-CB 3.47Å; E226-R230 PolarHBondContact O-N 2.92Å; E226-R230 VanDerWaalsContact O-N 3.09Å
227	E	69.5	Low	62.7	Low	105 Å²	105	119.2 Å²	119.2	49%	0.491	57%	0.572	S	S	.	*	H	α-helix	trans	-67	-46.3	176.2	-152.8	71.8	-150.9	0	0	111.1	S223 K224 R229 R230 E231	S223-E227 PolarHBondContact O-N 2.9Å; K224-E227 PolarHBondContact O-N 3.49Å; E227-R229 VanDerWaalsContact C-N 3.35Å; E227-R229 PolarHBondContact O-N 2.84Å; E227-R230 PolarHBondContact O-N 3.48Å; E227-R230 IonicContact OE1-NH1 2.77Å; E227-R230 PolarHBondContact OE1-NH1 2.84Å; E227-R230 VanDerWaalsContact OE1-NH1 3.13Å; E227-R230 IonicContact OE2-CZ 3.79Å; E227-R230 IonicContact OE2-NH1 3.66Å; E227-R230 PolarHBondContact OE2-NH1 3.45Å; E227-R230 IonicContact OE2-NH2 3.29Å; E227-E231 PolarHBondContact O-N 2.86Å
228	E	71.5	Confident	63.7	Low	110 Å²	110	114.4 Å²	114.4	51%	0.514	56%	0.559	S	S	.	*	H	α-helix	trans	-62.6	-37.8	176.4	-77	173.3	-173.8	0	0	112.1	K224 E231 V232	K224-E228 PolarHBondContact O-N 3.42Å; K224-E228 VanDerWaalsContact O-N 3.07Å; E228-E231 PolarHBondContact O-N 3.46Å; E228-V232 VanDerWaalsContact O-CG2 3.28Å; E228-V232 WeakPolarHBondContact O-CG2 3.27Å; E228-V232 PolarHBondContact O-N 3.35Å
229	R	72.8	Confident	64.4	Low	178 Å²	178	112.1 Å²	112.1	67%	0.672	56%	0.557	S	S	*	*	H	α-helix	trans	-64.3	-42.3	173	-77.8	-177.8	-150.2	-125.4	3.2	112.3	A225 E227 E231 V232 E233	A225-R229 WeakPolarHBondContact O-CG 3.44Å; A225-R229 PolarHBondContact O-N 3.26Å; E227-R229 VanDerWaalsContact C-N 3.35Å; E227-R229 PolarHBondContact O-N 2.84Å; R229-E231 VanDerWaalsContact C-N 3.3Å; R229-E231 PolarHBondContact O-N 3.25Å; R229-V232 PolarHBondContact O-N 3.38Å; R229-E233 VanDerWaalsContact O-CB 3.28Å; R229-E233 WeakPolarHBondContact O-CB 3.36Å; R229-E233 PolarHBondContact O-N 3.49Å
230	R	73.7	Confident	65	Low	121 Å²	121	115.7 Å²	115.7	46%	0.457	57%	0.566	S	S	.	*	H	α-helix	trans	-67.6	-32.4	-179.3	-151.8	-176.9	-57.9	113.3	5.4	111.8	E226 E227 A234	E226-R230 WeakPolarHBondContact O-CB 3.47Å; E226-R230 PolarHBondContact O-N 2.92Å; E226-R230 VanDerWaalsContact O-N 3.09Å; E227-R230 PolarHBondContact O-N 3.48Å; E227-R230 IonicContact OE1-NH1 2.77Å; E227-R230 PolarHBondContact OE1-NH1 2.84Å; E227-R230 VanDerWaalsContact OE1-NH1 3.13Å; E227-R230 IonicContact OE2-CZ 3.79Å; E227-R230 IonicContact OE2-NH1 3.66Å; E227-R230 PolarHBondContact OE2-NH1 3.45Å; E227-R230 IonicContact OE2-NH2 3.29Å; R230-A234 WeakPolarHBondContact O-CB 3.16Å; R230-A234 PolarHBondContact O-N 3.05Å
231	E	74	Confident	65.7	Low	137 Å²	137	112 Å²	112	64%	0.64	56%	0.558	S	S	*	*	H	α-helix	trans	-73	-41.1	175.4	-159.8	170.8	-151.3	0	0	111.8	E227 E228 R229 A234 N235	E227-E231 PolarHBondContact O-N 2.86Å; E228-E231 PolarHBondContact O-N 3.46Å; R229-E231 VanDerWaalsContact C-N 3.3Å; R229-E231 PolarHBondContact O-N 3.25Å; E231-A234 PolarHBondContact O-N 3.26Å; E231-N235 WeakPolarHBondContact O-CB 3.36Å; E231-N235 PolarHBondContact O-N 3.32Å
232	V	73.6	Confident	65.4	Low	106 Å²	106	112.4 Å²	112.4	64%	0.642	56%	0.561	S	S	*	*	H	α-helix	trans	-63.7	-41.1	171.9	172.3	0	0	0	0	111.5	E228 R229 N235 F236	E228-V232 VanDerWaalsContact O-CG2 3.28Å; E228-V232 WeakPolarHBondContact O-CG2 3.27Å; E228-V232 PolarHBondContact O-N 3.35Å; R229-V232 PolarHBondContact O-N 3.38Å; V232-N235 PolarHBondContact O-N 3.3Å; V232-F236 PolarHBondContact O-N 2.91Å
233	E	71.1	Confident	65.2	Low	130 Å²	130	110.5 Å²	110.5	61%	0.607	56%	0.564	S	S	*	*	H	α-helix	trans	-70.9	-36.8	178.1	-161.1	165.7	-153.4	0	0	111.7	R229 F236 V237	R229-E233 VanDerWaalsContact O-CB 3.28Å; R229-E233 WeakPolarHBondContact O-CB 3.36Å; R229-E233 PolarHBondContact O-N 3.49Å; E233-F236 PolarHBondContact O-N 2.77Å; E233-V237 VanDerWaalsContact O-CG2 3.3Å; E233-V237 WeakPolarHBondContact O-CG2 3.43Å; E233-V237 PolarHBondContact O-N 2.87Å
234	A	73	Confident	64.4	Low	58 Å²	58	114 Å²	114	48%	0.479	58%	0.577	S	S	.	*	H	α-helix	trans	-66.8	-36	172.6	0	0	0	0	0	112.7	R230 E231 S238	R230-A234 WeakPolarHBondContact O-CB 3.16Å; R230-A234 PolarHBondContact O-N 3.05Å; E231-A234 PolarHBondContact O-N 3.26Å; A234-S238 WeakPolarHBondContact O-CB 3.39Å; A234-S238 PolarHBondContact O-N 3.36Å; A234-S238 PolarHBondContact O-OG 3.46Å
235	N	72.4	Confident	63.4	Low	107 Å²	107	113.9 Å²	113.9	57%	0.572	58%	0.583	S	S	*	*	H	α-helix	trans	-68.4	-34.4	172	-101.9	18.8	0	0	0	112.5	E231 V232 S238 I239	E231-N235 WeakPolarHBondContact O-CB 3.36Å; E231-N235 PolarHBondContact O-N 3.32Å; V232-N235 PolarHBondContact O-N 3.3Å; N235-S238 WeakPolarHBondContact CA-OG 3.45Å; N235-S238 PolarHBondContact O-OG 2.83Å; N235-S238 VanDerWaalsContact O-OG 3.1Å; N235-I239 VanDerWaalsContact O-CD1 3.3Å; N235-I239 WeakPolarHBondContact O-CD1 3.32Å; N235-I239 VanDerWaalsContact O-CG1 3.25Å; N235-I239 WeakPolarHBondContact O-CG1 3.2Å; N235-I239 PolarHBondContact O-N 3.32Å
236	F	65.9	Low	62.5	Low	129 Å²	129	121.2 Å²	121.2	57%	0.566	61%	0.61	S	S	*	*	H	α-helix	trans	-68.1	-44.2	175	-174.7	-95.8	0	0	0	111.3	V232 E233 I239 E240	V232-F236 PolarHBondContact O-N 2.91Å; E233-F236 PolarHBondContact O-N 2.77Å; F236-I239 PolarHBondContact O-N 2.86Å; F236-E240 PolarHBondContact O-N 3.26Å
237	V	65.4	Low	61.3	Low	55 Å²	55	125.6 Å²	125.6	33%	0.333	62%	0.621	S	S	.	*	H	α-helix	trans	-71.7	-31.2	-179.8	174.1	0	0	0	0	112.8	E233 I239 E240 Q241	E233-V237 VanDerWaalsContact O-CG2 3.3Å; E233-V237 WeakPolarHBondContact O-CG2 3.43Å; E233-V237 PolarHBondContact O-N 2.87Å; V237-I239 VanDerWaalsContact C-N 3.32Å; V237-E240 PolarHBondContact O-N 2.85Å; V237-Q241 HydrophobicContact CG1-CG 4.37Å; V237-Q241 WeakPolarHBondContact O-CG 3.18Å; V237-Q241 PolarHBondContact O-N 3.24Å
238	S	63.5	Low	60.8	Low	57 Å²	57	126.5 Å²	126.5	40%	0.399	63%	0.629	S	S	.	*	H	α-helix	trans	-72.3	-25.5	175.7	57.1	0	0	0	0	113.2	A234 N235	A234-S238 WeakPolarHBondContact O-CB 3.39Å; A234-S238 PolarHBondContact O-N 3.36Å; A234-S238 PolarHBondContact O-OG 3.46Å; N235-S238 WeakPolarHBondContact CA-OG 3.45Å; N235-S238 PolarHBondContact O-OG 2.83Å; N235-S238 VanDerWaalsContact O-OG 3.1Å
239	I	61.1	Low	60.6	Low	125 Å²	125	126.8 Å²	126.8	64%	0.641	64%	0.635	S	S	*	*	H	α-helix	trans	-75.7	-30.9	171.7	-66.5	166.6	0	0	0	111.2	N235 F236 V237	N235-I239 VanDerWaalsContact O-CD1 3.3Å; N235-I239 WeakPolarHBondContact O-CD1 3.32Å; N235-I239 VanDerWaalsContact O-CG1 3.25Å; N235-I239 WeakPolarHBondContact O-CG1 3.2Å; N235-I239 PolarHBondContact O-N 3.32Å; F236-I239 PolarHBondContact O-N 2.86Å; V237-I239 VanDerWaalsContact C-N 3.32Å
240	E	58	Low	60.4	Low	144 Å²	144	125.4 Å²	125.4	67%	0.673	64%	0.636	S	S	*	*	H	α-helix	trans	-79.1	-17.9	176.3	-94.6	-173.6	162.2	0	0	114.6	F236 V237	F236-E240 PolarHBondContact O-N 3.26Å; V237-E240 PolarHBondContact O-N 2.85Å
241	Q	56.2	Low	60	Low	149 Å²	149	124.1 Å²	124.1	70%	0.696	64%	0.638	S	S	*	*	H	α-helix	trans	-102.7	-7.5	-172.8	-74.3	-176.6	3.7	0	0	115.5	V237 S243	V237-Q241 HydrophobicContact CG1-CG 4.37Å; V237-Q241 WeakPolarHBondContact O-CG 3.18Å; V237-Q241 PolarHBondContact O-N 3.24Å; Q241-S243 PolarHBondContact O-N 2.88Å
242	D	42.2	Very low	59.9	Low	140 Å²	140	122.3 Å²	122.3	75%	0.749	63%	0.629	S	S	*	*	S	Bend	trans	-87.5	91.7	174.5	-91.8	-7.6	0	0	0	111.1
243	S	44.5	Very low	60	Low	102 Å²	102	125.1 Å²	125.1	71%	0.713	63%	0.628	S	S	*	*			trans	-1.9	118.8	159.9	61	0	0	0	0	118.8	Q241	Q241-S243 PolarHBondContact O-N 2.88Å
244	D	42	Very low	60.3	Low	145 Å²	145	126.3 Å²	126.3	78%	0.775	63%	0.627	S	S	*	*				32.4	131.6	129	-101.2	-18.7	0	0	0	119.7
245	D	43.3	Very low	60.3	Low	137 Å²	137	129 Å²	129	73%	0.733	63%	0.63	S	S	*	*	S	Bend	trans	84.8	110.6	163.6	-54.7	-38.8	0	0	0	116.9
246	E	50.4	Low	60.6	Low	198 Å²	198	129.4 Å²	129.4	93%	0.925	63%	0.628	S	S	*	*	S	Bend	trans	100.8	8.3	161.2	-53.4	-174.1	162.4	0	0	120.5
247	R	44.4	Very low	61	Low	205 Å²	205	126.5 Å²	126.5	77%	0.774	62%	0.616	S	S	*	*			trans	-129.7	9.4	-179.1	-79	-175.9	-70.9	-155.2	-0.4	118.7	D249	R247-D249 PolarHBondContact O-N 2.85Å
248	D	58.2	Low	61.4	Low	123 Å²	123	127.7 Å²	127.7	66%	0.658	62%	0.618	S	S	*	*	H	α-helix	trans	-67.1	-28.7	-178.7	-100.6	-13.6	0	0	0	114.5	E250 E252	D248-E250 VanDerWaalsContact C-N 3.31Å; D248-E250 PolarHBondContact O-N 3.24Å; D248-E252 WeakPolarHBondContact O-CB 3.32Å; D248-E252 PolarHBondContact O-N 2.79Å
249	D	66.4	Low	61.4	Low	116 Å²	116	131 Å²	131	62%	0.62	63%	0.629	S	S	*	*	H	α-helix	trans	-70.4	-25	-174.1	-68.1	-23.8	0	0	0	114	R247 R253	R247-D249 PolarHBondContact O-N 2.85Å; D249-R253 WeakPolarHBondContact O-CB 3.39Å; D249-R253 WeakPolarHBondContact O-CD 3.45Å; D249-R253 WeakPolarHBondContact O-CG 3.24Å; D249-R253 PolarHBondContact O-N 2.9Å; D249-R253 VanDerWaalsContact O-N 3.15Å; D249-R253 PolarHBondContact O-NE 2.7Å
250	E	69.1	Low	61.8	Low	150 Å²	150	131.7 Å²	131.7	70%	0.701	62%	0.624	S	S	*	*	H	α-helix	trans	-85.1	-39.7	-178.8	-171.6	170.4	-167.3	0	0	111.4	D248 R253 W254	D248-E250 VanDerWaalsContact C-N 3.31Å; D248-E250 PolarHBondContact O-N 3.24Å; E250-R253 PolarHBondContact O-N 2.93Å; E250-W254 VanDerWaalsContact O-CB 3.28Å; E250-W254 WeakPolarHBondContact O-CB 3.27Å; E250-W254 PolarHBondContact O-N 2.95Å
251	L	65	Low	62.4	Low	94 Å²	94	131.4 Å²	131.4	49%	0.492	62%	0.62	S	S	.	*	H	α-helix	trans	-69.3	-41.3	174.9	-167	69.4	0	0	0	110.9	W254 E255	L251-W254 CarbonylContact O-C 3.59Å; L251-W254 PolarHBondContact O-N 3.1Å; L251-E255 WeakPolarHBondContact O-CB 3.33Å; L251-E255 PolarHBondContact O-N 2.77Å
252	E	72.1	Confident	62.7	Low	98 Å²	98	127.5 Å²	127.5	46%	0.458	62%	0.62	S	S	.	*	H	α-helix	trans	-65	-41.1	173.7	-173.8	106.7	-149.1	0	0	111.2	D248 W254 E255 Q256	D248-E252 WeakPolarHBondContact O-CB 3.32Å; D248-E252 PolarHBondContact O-N 2.79Å; E252-W254 VanDerWaalsContact C-N 3.31Å; E252-W254 PolarHBondContact O-N 3.2Å; E252-E255 PolarHBondContact O-N 2.93Å; E252-Q256 VanDerWaalsContact O-CB 3.25Å; E252-Q256 WeakPolarHBondContact O-CB 3.38Å; E252-Q256 WeakPolarHBondContact O-CG 3.31Å; E252-Q256 PolarHBondContact O-N 2.95Å
253	R	76.7	Confident	63.7	Low	166 Å²	166	123.2 Å²	123.2	63%	0.626	60%	0.599	S	S	*	*	H	α-helix	trans	-62.8	-38.3	172.5	-84.5	-179.4	-97.2	-172.3	-8.6	111.9	D249 E250 E257	D249-R253 WeakPolarHBondContact O-CB 3.39Å; D249-R253 WeakPolarHBondContact O-CD 3.45Å; D249-R253 WeakPolarHBondContact O-CG 3.24Å; D249-R253 PolarHBondContact O-N 2.9Å; D249-R253 VanDerWaalsContact O-N 3.15Å; D249-R253 PolarHBondContact O-NE 2.7Å; E250-R253 PolarHBondContact O-N 2.93Å; R253-E257 VanDerWaalsContact O-CB 3.23Å; R253-E257 WeakPolarHBondContact O-CB 3.42Å; R253-E257 PolarHBondContact O-N 3.43Å
254	W	76.4	Confident	64.4	Low	154 Å²	154	121.7 Å²	121.7	58%	0.583	59%	0.588	S	S	*	*	H	α-helix	trans	-70.4	-45.1	177.5	-175.8	92.7	0	0	0	111.8	E250 L251 E252 Q256 E257 Q258	E250-W254 VanDerWaalsContact O-CB 3.28Å; E250-W254 WeakPolarHBondContact O-CB 3.27Å; E250-W254 PolarHBondContact O-N 2.95Å; L251-W254 CarbonylContact O-C 3.59Å; L251-W254 PolarHBondContact O-N 3.1Å; E252-W254 VanDerWaalsContact C-N 3.31Å; E252-W254 PolarHBondContact O-N 3.2Å; W254-Q256 PolarHBondContact O-N 3.46Å; W254-E257 CarbonylContact O-C 3.59Å; W254-E257 WeakPolarHBondContact O-CB 3.42Å; W254-E257 PolarHBondContact O-N 2.97Å; W254-E257 VanDerWaalsContact O-N 3.15Å; W254-Q258 HydrophobicContact CD2-CG 3.97Å; W254-Q258 HydrophobicContact CE3-CG 3.98Å; W254-Q258 HydrophobicContact CH2-CG 3.84Å; W254-Q258 HydrophobicContact CZ2-CG 3.82Å; W254-Q258 HydrophobicContact CZ3-CG 3.91Å; W254-Q258 WeakPolarHBondContact O-CG 3.25Å; W254-Q258 PolarHBondContact O-N 2.79Å
255	E	74.2	Confident	64.9	Low	115 Å²	115	123.3 Å²	123.3	54%	0.537	59%	0.589	S	S	.	*	H	α-helix	trans	-60.9	-43.7	173.9	-98.1	-164.2	150.9	0	0	111.6	L251 E252 E257 Q258 M259	L251-E255 WeakPolarHBondContact O-CB 3.33Å; L251-E255 PolarHBondContact O-N 2.77Å; E252-E255 PolarHBondContact O-N 2.93Å; E255-E257 VanDerWaalsContact C-N 3.27Å; E255-E257 PolarHBondContact O-N 3.27Å; E255-Q258 PolarHBondContact O-N 3.44Å; E255-M259 VanDerWaalsContact O-CB 3.29Å; E255-M259 WeakPolarHBondContact O-CB 3.38Å; E255-M259 VanDerWaalsContact O-CG 3.22Å; E255-M259 WeakPolarHBondContact O-CG 3.4Å; E255-M259 PolarHBondContact O-N 2.84Å
256	Q	77.3	Confident	65.7	Low	115 Å²	115	123.1 Å²	123.1	54%	0.537	58%	0.583	S	S	.	*	H	α-helix	trans	-63.3	-34.7	174.8	-74.1	175.8	18.8	0	0	111.9	E252 W254 R260	E252-Q256 VanDerWaalsContact O-CB 3.25Å; E252-Q256 WeakPolarHBondContact O-CB 3.38Å; E252-Q256 WeakPolarHBondContact O-CG 3.31Å; E252-Q256 PolarHBondContact O-N 2.95Å; W254-Q256 PolarHBondContact O-N 3.46Å; Q256-R260 VanDerWaalsContact O-CB 3.26Å; Q256-R260 WeakPolarHBondContact O-CB 3.33Å; Q256-R260 PolarHBondContact O-N 3.01Å
257	E	75.1	Confident	66.2	Low	68 Å²	68	121 Å²	121	32%	0.318	57%	0.571	S	S	.	*	H	α-helix	trans	-72.7	-35.8	175.5	-175.3	60	-159.3	0	0	112.1	R253 W254 E255 R260 K261	R253-E257 VanDerWaalsContact O-CB 3.23Å; R253-E257 WeakPolarHBondContact O-CB 3.42Å; R253-E257 PolarHBondContact O-N 3.43Å; W254-E257 CarbonylContact O-C 3.59Å; W254-E257 WeakPolarHBondContact O-CB 3.42Å; W254-E257 PolarHBondContact O-N 2.97Å; W254-E257 VanDerWaalsContact O-N 3.15Å; E255-E257 VanDerWaalsContact C-N 3.27Å; E255-E257 PolarHBondContact O-N 3.27Å; E257-R260 PolarHBondContact O-N 2.89Å; E257-R260 IonicContact OE1-CZ 2.6Å; E257-R260 IonicContact OE1-NE 3.36Å; E257-R260 PolarHBondContact OE1-NE 2.87Å; E257-R260 IonicContact OE1-NH2 2.95Å; E257-R260 PolarHBondContact OE1-NH2 3.49Å; E257-R260 IonicContact OE2-CZ 2.68Å; E257-R260 IonicContact OE2-NE 3.66Å; E257-R260 PolarHBondContact OE2-NE 3.47Å; E257-R260 IonicContact OE2-NH2 2.7Å; E257-K261 WeakPolarHBondContact O-CG 3.32Å; E257-K261 PolarHBondContact O-N 2.93Å; E257-K261 WeakPolarHBondContact OE1-CE 3.34Å
258	Q	72.9	Confident	66.9	Low	80 Å²	80	114.4 Å²	114.4	37%	0.374	55%	0.551	S	S	.	*	H	α-helix	trans	-69.7	-39.4	171.4	-65.5	-54.3	-32.6	0	0	111.8	W254 E255 R260 K261 G262	W254-Q258 HydrophobicContact CD2-CG 3.97Å; W254-Q258 HydrophobicContact CE3-CG 3.98Å; W254-Q258 HydrophobicContact CH2-CG 3.84Å; W254-Q258 HydrophobicContact CZ2-CG 3.82Å; W254-Q258 HydrophobicContact CZ3-CG 3.91Å; W254-Q258 WeakPolarHBondContact O-CG 3.25Å; W254-Q258 PolarHBondContact O-N 2.79Å; E255-Q258 PolarHBondContact O-N 3.44Å; Q258-R260 VanDerWaalsContact C-N 3.34Å; Q258-K261 PolarHBondContact O-N 3.46Å; Q258-G262 PolarHBondContact O-N 2.8Å
259	M	63.4	Low	67.3	Low	128 Å²	128	110.9 Å²	110.9	63%	0.631	54%	0.539	S	S	*	.	H	α-helix	trans	-62.1	-40.8	171.3	-77.3	-89.9	-74.6	0	0	111.3	E255 K261 G262 V263	E255-M259 VanDerWaalsContact O-CB 3.29Å; E255-M259 WeakPolarHBondContact O-CB 3.38Å; E255-M259 VanDerWaalsContact O-CG 3.22Å; E255-M259 WeakPolarHBondContact O-CG 3.4Å; E255-M259 PolarHBondContact O-N 2.84Å; M259-K261 VanDerWaalsContact C-N 3.3Å; M259-K261 PolarHBondContact O-N 3.5Å; M259-G262 PolarHBondContact O-N 3.21Å; M259-V263 WeakPolarHBondContact O-CB 3.45Å; M259-V263 VanDerWaalsContact O-CG2 3.23Å; M259-V263 WeakPolarHBondContact O-CG2 3.36Å; M259-V263 PolarHBondContact O-N 3.16Å
260	R	69.7	Low	67.6	Low	139 Å²	139	114 Å²	114	53%	0.525	54%	0.543	S	S	.	.	H	α-helix	trans	-63.4	-35.6	175.2	-169.2	-173.3	74.3	78.6	-3	112	Q256 E257 Q258	Q256-R260 VanDerWaalsContact O-CB 3.26Å; Q256-R260 WeakPolarHBondContact O-CB 3.33Å; Q256-R260 PolarHBondContact O-N 3.01Å; E257-R260 PolarHBondContact O-N 2.89Å; E257-R260 IonicContact OE1-CZ 2.6Å; E257-R260 IonicContact OE1-NE 3.36Å; E257-R260 PolarHBondContact OE1-NE 2.87Å; E257-R260 IonicContact OE1-NH2 2.95Å; E257-R260 PolarHBondContact OE1-NH2 3.49Å; E257-R260 IonicContact OE2-CZ 2.68Å; E257-R260 IonicContact OE2-NE 3.66Å; E257-R260 PolarHBondContact OE2-NE 3.47Å; E257-R260 IonicContact OE2-NH2 2.7Å; Q258-R260 VanDerWaalsContact C-N 3.34Å
261	K	70.8	Confident	67.4	Low	137 Å²	137	114.1 Å²	114.1	60%	0.596	54%	0.538	S	S	*	.	H	α-helix	trans	-78.2	-28.9	175.4	-71.4	174.4	-178.1	178.4	0	112.9	E257 Q258 M259	E257-K261 WeakPolarHBondContact O-CG 3.32Å; E257-K261 PolarHBondContact O-N 2.93Å; E257-K261 WeakPolarHBondContact OE1-CE 3.34Å; Q258-K261 PolarHBondContact O-N 3.46Å; M259-K261 VanDerWaalsContact C-N 3.3Å; M259-K261 PolarHBondContact O-N 3.5Å
262	G	63.1	Low	67.5	Low	68 Å²	68	116.6 Å²	116.6	70%	0.701	55%	0.545	S	S	*	.	H	α-helix	trans	-88.8	-10.8	-178.4	0	0	0	0	0	115.9	Q258 M259	Q258-G262 PolarHBondContact O-N 2.8Å; M259-G262 PolarHBondContact O-N 3.21Å
263	V	62.2	Low	67.2	Low	50 Å²	50	119.8 Å²	119.8	30%	0.303	56%	0.557	S	S	.	*	S	Bend	trans	-113.4	118.7	-177.2	-178.9	0	0	0	0	110.4	M259 F265 K267 L268	M259-V263 WeakPolarHBondContact O-CB 3.45Å; M259-V263 VanDerWaalsContact O-CG2 3.23Å; M259-V263 WeakPolarHBondContact O-CG2 3.36Å; M259-V263 PolarHBondContact O-N 3.16Å; V263-F265 PolarHBondContact O-N 3.45Å; V263-K267 HydrophobicContact CG1-CB 3.62Å; V263-K267 HydrophobicContact CG1-CD 4.48Å; V263-L268 HydrophobicContact CB-CD1 3.99Å; V263-L268 HydrophobicContact CG1-CD1 3.91Å
264	S	59.1	Low	66.7	Low	69 Å²	69	117.8 Å²	117.8	48%	0.483	56%	0.555	S	S	.	*			trans	-45.4	132.8	174.6	168.6	0	0	0	0	111.4	Q266 K267 L268	S264-Q266 PolarHBondContact O-N 3.44Å; S264-Q266 PolarHBondContact OG-N 2.89Å; S264-K267 PolarHBondContact O-N 3.29Å; S264-L268 PolarHBondContact O-N 3.45Å
265	F	54.2	Low	66	Low	180 Å²	180	114.6 Å²	114.6	79%	0.789	55%	0.549	S	S	*	.	H	α-helix	trans	-47.2	-32.2	178.8	-175.2	-95	0	0	0	112.8	V263 L268 A269	V263-F265 PolarHBondContact O-N 3.45Å; F265-L268 PolarHBondContact O-N 3.37Å; F265-A269 WeakPolarHBondContact O-CB 3.4Å; F265-A269 PolarHBondContact O-N 2.94Å
266	Q	60	Low	65.5	Low	132 Å²	132	113.9 Å²	113.9	62%	0.617	55%	0.552	S	S	*	*	H	α-helix	trans	-67.1	-38.6	176.7	-68.9	176.4	-8.3	0	0	113.3	S264 Y270	S264-Q266 PolarHBondContact O-N 3.44Å; S264-Q266 PolarHBondContact OG-N 2.89Å; Q266-Y270 WeakPolarHBondContact O-CD2 3.33Å; Q266-Y270 PolarHBondContact O-N 2.85Å; Q266-Y270 VanDerWaalsContact O-N 3.15Å
267	K	60.8	Low	64.7	Low	155 Å²	155	112.2 Å²	112.2	67%	0.674	56%	0.558	S	S	*	*	H	α-helix	trans	-71.8	-35.6	175.8	-77.1	-175.9	178.4	179.4	0	111.7	V263 S264 Y270 Y271	V263-K267 HydrophobicContact CG1-CB 3.62Å; V263-K267 HydrophobicContact CG1-CD 4.48Å; S264-K267 PolarHBondContact O-N 3.29Å; K267-Y270 PolarHBondContact O-N 2.92Å; K267-Y271 WeakPolarHBondContact O-CB 3.43Å; K267-Y271 PolarHBondContact O-N 3.49Å
268	L	58.6	Low	63.8	Low	65 Å²	65	114.1 Å²	114.1	34%	0.34	58%	0.578	S	S	.	*	H	α-helix	trans	-69.5	-37.4	176.8	-132.7	95	0	0	0	112.3	V263 S264 F265 Y271 K272	V263-L268 HydrophobicContact CB-CD1 3.99Å; V263-L268 HydrophobicContact CG1-CD1 3.91Å; S264-L268 PolarHBondContact O-N 3.45Å; F265-L268 PolarHBondContact O-N 3.37Å; L268-Y271 PolarHBondContact O-N 2.89Å; L268-K272 WeakPolarHBondContact O-CB 3.29Å; L268-K272 PolarHBondContact O-N 2.95Å
269	A	67.3	Low	62.8	Low	50 Å²	50	115.6 Å²	115.6	41%	0.413	59%	0.592	S	S	.	*	H	α-helix	trans	-66.7	-38.7	174.6	0	0	0	0	0	112	F265 K273	F265-A269 WeakPolarHBondContact O-CB 3.4Å; F265-A269 PolarHBondContact O-N 2.94Å; A269-K273 WeakPolarHBondContact O-CB 3.34Å; A269-K273 PolarHBondContact O-N 3.35Å; A269-K273 VanDerWaalsContact O-N 3.1Å
270	Y	71.1	Confident	61.8	Low	180 Å²	180	112.6 Å²	112.6	71%	0.706	60%	0.595	S	S	*	*	H	α-helix	trans	-63.1	-47.2	171.9	-102.3	-90.9	0	0	0	111.7	Q266 K267 K272 K273 E274	Q266-Y270 WeakPolarHBondContact O-CD2 3.33Å; Q266-Y270 PolarHBondContact O-N 2.85Å; Q266-Y270 VanDerWaalsContact O-N 3.15Å; K267-Y270 PolarHBondContact O-N 2.92Å; Y270-K272 PolarHBondContact O-N 3.48Å; Y270-K273 PolarHBondContact O-N 3Å; Y270-E274 PolarHBondContact O-N 3.13Å
271	Y	65.7	Low	60.4	Low	153 Å²	153	115.4 Å²	115.4	60%	0.6	61%	0.611	S	S	*	*	H	α-helix	trans	-65.4	-39.5	-179.3	-148.6	-101.2	0	0	0	112.6	K267 L268 K273 E274 I275	K267-Y271 WeakPolarHBondContact O-CB 3.43Å; K267-Y271 PolarHBondContact O-N 3.49Å; L268-Y271 PolarHBondContact O-N 2.89Å; Y271-K273 VanDerWaalsContact C-N 3.34Å; Y271-K273 PolarHBondContact O-N 2.9Å; Y271-E274 PolarHBondContact O-N 2.9Å; Y271-I275 HydrophobicContact CD1-CD1 3.55Å; Y271-I275 HydrophobicContact CD1-CG1 4.28Å; Y271-I275 HydrophobicContact CE1-CD1 3.7Å; Y271-I275 HydrophobicContact CE1-CG1 4.38Å; Y271-I275 WeakPolarHBondContact O-CG1 3.28Å; Y271-I275 PolarHBondContact O-N 3.25Å
272	K	66.1	Low	59	Low	147 Å²	147	116.7 Å²	116.7	64%	0.639	62%	0.624	S	S	*	*	H	α-helix	trans	-63.6	-37.7	172.5	-98.9	-175.6	173.9	179	0	112.6	L268 Y270 T276	L268-K272 WeakPolarHBondContact O-CB 3.29Å; L268-K272 PolarHBondContact O-N 2.95Å; Y270-K272 PolarHBondContact O-N 3.48Å; K272-T276 WeakPolarHBondContact O-CB 3.48Å; K272-T276 PolarHBondContact O-N 3Å; K272-T276 PolarHBondContact O-OG1 3.39Å
273	K	67.6	Low	57.9	Low	164 Å²	164	116.7 Å²	116.7	71%	0.713	62%	0.624	S	S	*	*	H	α-helix	trans	-70.1	-35	177.4	-159.1	172.5	-174.2	176.5	0	111.3	A269 Y270 Y271 A277	A269-K273 WeakPolarHBondContact O-CB 3.34Å; A269-K273 PolarHBondContact O-N 3.35Å; A269-K273 VanDerWaalsContact O-N 3.1Å; Y270-K273 PolarHBondContact O-N 3Å; Y271-K273 VanDerWaalsContact C-N 3.34Å; Y271-K273 PolarHBondContact O-N 2.9Å; K273-A277 VanDerWaalsContact O-CB 3.24Å; K273-A277 WeakPolarHBondContact O-CB 3.44Å; K273-A277 PolarHBondContact O-N 2.87Å
274	E	64.7	Low	57	Low	124 Å²	124	124 Å²	124	58%	0.579	66%	0.655	S	S	*	*	H	α-helix	trans	-70.5	-42.7	175.4	-137.7	175.5	179.7	0	0	112.3	Y270 Y271 T276 A277 C278	Y270-E274 PolarHBondContact O-N 3.13Å; Y271-E274 PolarHBondContact O-N 2.9Å; E274-T276 PolarHBondContact O-N 2.91Å; E274-A277 PolarHBondContact O-N 2.91Å; E274-C278 PolarHBondContact O-N 3.28Å; E274-C278 PolarHBondContact O-SG 2.83Å; E274-C278 VanDerWaalsContact O-SG 3.38Å
275	I	63.1	Low	55.9	Low	88 Å²	88	123.8 Å²	123.8	45%	0.451	66%	0.664	S	S	.	*	H	α-helix	trans	-65	-39.1	174.8	-68.8	169.2	0	0	0	111.4	Y271 A277 C278 T279	Y271-I275 HydrophobicContact CD1-CD1 3.55Å; Y271-I275 HydrophobicContact CD1-CG1 4.28Å; Y271-I275 HydrophobicContact CE1-CD1 3.7Å; Y271-I275 HydrophobicContact CE1-CG1 4.38Å; Y271-I275 WeakPolarHBondContact O-CG1 3.28Å; Y271-I275 PolarHBondContact O-N 3.25Å; I275-A277 VanDerWaalsContact C-N 3.35Å; I275-C278 PolarHBondContact O-N 3.36Å; I275-T279 WeakPolarHBondContact O-CG2 3.35Å; I275-T279 PolarHBondContact O-N 3.37Å; I275-T279 PolarHBondContact O-OG1 2.68Å
276	T	62.4	Low	55.3	Low	100 Å²	100	125 Å²	125	61%	0.613	67%	0.669	S	S	*	*	H	α-helix	trans	-71.6	-30.6	177	-51	0	0	0	0	111.6	K272 E274	K272-T276 WeakPolarHBondContact O-CB 3.48Å; K272-T276 PolarHBondContact O-N 3Å; K272-T276 PolarHBondContact O-OG1 3.39Å; E274-T276 PolarHBondContact O-N 2.91Å
277	A	60.7	Low	54.4	Low	79 Å²	79	125.5 Å²	125.5	65%	0.653	68%	0.676	S	S	*	*	H	α-helix	trans	-74.1	-26.6	174.4	0	0	0	0	0	113.2	K273 E274 I275	K273-A277 VanDerWaalsContact O-CB 3.24Å; K273-A277 WeakPolarHBondContact O-CB 3.44Å; K273-A277 PolarHBondContact O-N 2.87Å; E274-A277 PolarHBondContact O-N 2.91Å; I275-A277 VanDerWaalsContact C-N 3.35Å
278	C	56	Low	53.2	Low	109 Å²	109	125.1 Å²	125.1	74%	0.736	68%	0.681	S	S	*	*	H	α-helix	trans	-90.2	-7.8	178.8	-70.2	0	0	0	0	114.5	E274 I275	E274-C278 PolarHBondContact O-N 3.28Å; E274-C278 PolarHBondContact O-SG 2.83Å; E274-C278 VanDerWaalsContact O-SG 3.38Å; I275-C278 PolarHBondContact O-N 3.36Å
279	T	53.2	Low	52.6	Low	110 Å²	110	127.7 Å²	127.7	68%	0.675	71%	0.705	S	S	*	*	S	Bend	trans	-115.1	4.1	-175.7	51.4	0	0	0	0	114.6	I275	I275-T279 WeakPolarHBondContact O-CG2 3.35Å; I275-T279 PolarHBondContact O-N 3.37Å; I275-T279 PolarHBondContact O-OG1 2.68Å
280	G	42.3	Very low	51.2	Low	66 Å²	66	135.2 Å²	135.2	68%	0.68	73%	0.728	S	S	*	*			trans	-115.5	64	-179.1	0	0	0	0	0	113.8
281	F	39.3	Very low	49.7	Very low	198 Å²	198	132.6 Å²	132.6	87%	0.868	73%	0.733	S	S	*	*			trans	-116.2	78.9	171.9	-157.9	-85.4	0	0	0	109.7
282	D	41.8	Very low	48.2	Very low	164 Å²	164	131.2 Å²	131.2	88%	0.877	75%	0.746	S	S	*	*			trans	-172.7	129.9	147.5	-111	-23.9	0	0	0	112.2
283	G	39.6	Very low	46.9	Very low	68 Å²	68	127.4 Å²	127.4	70%	0.701	75%	0.748	S	S	*	*			trans	101.7	72.8	149.4	0	0	0	0	0	120.4
284	H	43	Very low	45.5	Very low	202 Å²	202	125.9 Å²	125.9	94%	0.935	76%	0.755	S	S	*	*			trans	48.2	112.8	137.1	-90.7	-58.6	0	0	0	122.8
285	G	36.9	Very low	43.9	Very low	66 Å²	66	131.3 Å²	131.3	68%	0.68	77%	0.772	S	S	*	*				110.2	105	100.5	0	0	0	0	0	120.6
286	K	41.5	Very low	42.8	Very low	206 Å²	206	132.5 Å²	132.5	90%	0.896	79%	0.788	S	S	*	*			trans	66.3	137.9	153.9	-63.2	179.9	175.8	178.7	0	116.3
287	D	40.5	Very low	41.6	Very low	142 Å²	142	137.3 Å²	137.3	76%	0.759	80%	0.804	S	S	*	*			cis	-162.2	164.2	31.9	-145.9	-12.4	0	0	0	110.4
288	D	35.9	Very low	40.5	Very low	146 Å²	146	140.5 Å²	140.5	78%	0.781	81%	0.808	S	S	*	*			trans	-53.8	142	-170.1	-75	-52.2	0	0	0	118.3
289	S	46	Very low	39.8	Very low	120 Å²	120	142.9 Å²	142.9	84%	0.839	81%	0.814	S	S	*	*				-175.6	124	125.3	20.5	0	0	0	0	113.3
290	K	37.8	Very low	39.2	Very low	207 Å²	207	144 Å²	144	90%	0.9	81%	0.811	S	S	*	*			trans	-56.8	153.9	174.2	-79.2	173.4	172.7	174	0	113.3
291	P	40.1	Very low	39.4	Very low	126 Å²	126	146.7 Å²	146.7	82%	0.818	82%	0.817	S	S	*	*				-129.9	138	129.6	32.7	-19.8	0	0	0	113.1
292	S	33	Very low	39.6	Very low	123 Å²	123	144.1 Å²	144.1	86%	0.86	81%	0.811	S	S	*	*			trans	-82.1	132.9	168.1	49	0	0	0	0	110.8
293	G	39	Very low	39.6	Very low	68 Å²	68	141.9 Å²	141.9	70%	0.701	81%	0.806	S	S	*	*			trans	-140.2	129.4	167.2	0	0	0	0	0	109.9
294	P	39	Very low	39.6	Very low	132 Å²	132	147.2 Å²	147.2	86%	0.857	82%	0.815	S	S	*	*			trans	-84.8	155.7	-174.9	33.6	-31.7	0	0	0	113
295	Y	30.8	Very low	39.5	Very low	238 Å²	238	144.4 Å²	144.4	93%	0.933	81%	0.806	S	S	*	*			trans	-53.4	133.8	176.3	-87.7	-112.2	0	0	0	113.3
296	S	40.5	Very low	39.6	Very low	113 Å²	113	148.5 Å²	148.5	79%	0.79	81%	0.812	S	S	*	*			trans	-129	134.3	155.9	-84.9	0	0	0	0	110
297	E	37	Very low	39.6	Very low	200 Å²	200	146.2 Å²	146.2	94%	0.935	81%	0.805	S	S	*	*			trans	-53.9	133.2	-179.7	-76.4	165.3	135	0	0	112.8
298	I	38	Very low	39.4	Very low	147 Å²	147	144.7 Å²	144.7	75%	0.754	80%	0.8	S	S	*	*			trans	-93.4	106.7	179.7	-65.3	169.1	0	0	0	107.1
299	N	41	Very low	39.6	Very low	158 Å²	158	143.9 Å²	143.9	85%	0.845	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-67.6	130.8	162.9	-90.9	-31.4	0	0	0	109.6
300	E	40.2	Very low	39.1	Very low	133 Å²	133	145.2 Å²	145.2	62%	0.621	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-71.5	125.6	-179.2	-162.5	171.9	-169	0	0	110.1	H169 L302	H169-E300 IonicContact CE1-OE2 3.33Å; E300-L302 PolarHBondContact O-N 2.6Å
301	P	47.6	Very low	39.1	Very low	124 Å²	124	143.6 Å²	143.6	81%	0.805	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-79.4	122.8	-178.6	29.2	-29.2	0	0	0	110.8
302	L	43	Very low	38.7	Very low	143 Å²	143	146.1 Å²	146.1	75%	0.749	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-61.6	155.1	168.9	-76.8	164	0	0	0	111.4	E300 M304	E300-L302 PolarHBondContact O-N 2.6Å; L302-M304 PolarHBondContact O-N 3.46Å
303	P	41.4	Very low	38.7	Very low	117 Å²	117	145 Å²	145	76%	0.76	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-69.9	120.6	-174.8	28.6	-32.2	0	0	0	111.2	D305	P303-D305 PolarHBondContact O-N 3.37Å; P303-D305 VanDerWaalsContact O-N 3.11Å
304	M	40.2	Very low	38.3	Very low	180 Å²	180	150.9 Å²	150.9	89%	0.887	80%	0.797	S	S	*	*			trans	-5.1	92.7	167.2	-99.5	177.9	-66.1	0	0	115.6	L302	L302-M304 PolarHBondContact O-N 3.46Å
305	D	40	Very low	38.1	Very low	143 Å²	143	149 Å²	149	77%	0.765	79%	0.793	S	S	*	*			trans	-76.6	126.8	143	-82.6	-37.5	0	0	0	107	P303 E307	P303-D305 PolarHBondContact O-N 3.37Å; P303-D305 VanDerWaalsContact O-N 3.11Å; D305-E307 PolarHBondContact O-N 2.9Å
306	L	38.8	Very low	38.1	Very low	152 Å²	152	142.7 Å²	142.7	80%	0.796	79%	0.79	S	S	*	*			trans	-75.5	67.4	176.8	-161.7	88.7	0	0	0	108.6	V308	L306-V308 PolarHBondContact O-N 3.34Å
307	E	40.9	Very low	37.6	Very low	159 Å²	159	141.1 Å²	141.1	74%	0.743	79%	0.791	S	S	*	*			trans	-76.6	102.6	168.2	-75.7	-174.2	161.6	0	0	108.3	D305 D309	D305-E307 PolarHBondContact O-N 2.9Å; E307-D309 VanDerWaalsContact C-N 3.26Å; E307-D309 PolarHBondContact O-N 3.48Å
308	V	38	Very low	37.4	Very low	109 Å²	109	136.6 Å²	136.6	66%	0.661	78%	0.781	S	S	*	*			trans	-70.2	88.5	166.4	-180	0	0	0	0	106.9	L306 L310	L306-V308 PolarHBondContact O-N 3.34Å; V308-L310 VanDerWaalsContact C-N 3.27Å; V308-L310 HydrophobicContact CG1-CD1 3.82Å; V308-L310 PolarHBondContact O-N 2.93Å
309	D	40	Very low	37	Very low	130 Å²	130	138.7 Å²	138.7	70%	0.695	79%	0.785	S	S	*	*			trans	-68.3	89.7	169.7	-91.2	-27.8	0	0	0	109.6	E307 E311	E307-D309 VanDerWaalsContact C-N 3.26Å; E307-D309 PolarHBondContact O-N 3.48Å; D309-E311 PolarHBondContact O-N 3.49Å; D309-E311 VanDerWaalsContact O-N 3.08Å
310	L	34.5	Very low	37	Very low	147 Å²	147	137.2 Å²	137.2	77%	0.77	78%	0.782	S	S	*	*			trans	-77.3	69.9	166.6	-131.1	100.5	0	0	0	108.3	V308 Q312	V308-L310 VanDerWaalsContact C-N 3.27Å; V308-L310 HydrophobicContact CG1-CD1 3.82Å; V308-L310 PolarHBondContact O-N 2.93Å; L310-Q312 PolarHBondContact O-N 3.22Å; L310-Q312 VanDerWaalsContact O-N 3.12Å
311	E	37.4	Very low	36.6	Very low	173 Å²	173	135.9 Å²	135.9	81%	0.808	79%	0.787	S	S	*	*			trans	-73.6	106.8	172.1	-76.3	-163.8	157.3	0	0	110.5	D309 A313	D309-E311 PolarHBondContact O-N 3.49Å; D309-E311 VanDerWaalsContact O-N 3.08Å; E311-A313 PolarHBondContact O-N 3.15Å
312	Q	31.9	Very low	36.1	Very low	179 Å²	179	133.4 Å²	133.4	84%	0.836	78%	0.784	S	S	*	*			trans	-58.2	109.3	166.3	-67.8	169.9	-3.9	0	0	110.1	L310	L310-Q312 PolarHBondContact O-N 3.22Å; L310-Q312 VanDerWaalsContact O-N 3.12Å
313	A	33.7	Very low	35.8	Very low	101 Å²	101	132.4 Å²	132.4	84%	0.835	79%	0.789	S	S	*	*			trans	-99	73.1	163.8	0	0	0	0	0	110.2	E311 A315	E311-A313 PolarHBondContact O-N 3.15Å; A313-A315 PolarHBondContact O-N 3.32Å
314	E	29.7	Very low	35.5	Very low	190 Å²	190	137.4 Å²	137.4	89%	0.888	79%	0.793	S	S	*	*			trans	-77.8	100.8	151.7	-75.7	-168.7	158.8	0	0	108.1
315	A	35.3	Very low	35.5	Very low	94 Å²	94	140.3 Å²	140.3	78%	0.777	79%	0.794	S	S	*	*			trans	-147.2	101.5	161.3	0	0	0	0	0	110.3	A313	A313-A315 PolarHBondContact O-N 3.32Å
316	A	31.6	Very low	35.2	Very low	105 Å²	105	139.5 Å²	139.5	87%	0.868	80%	0.795	S	S	*	*			trans	-56.1	138.3	167	0	0	0	0	0	111.9
317	G	29.7	Very low	35.6	Very low	79 Å²	79	141.2 Å²	141.2	81%	0.814	80%	0.796	S	S	*	*			trans	68.5	109.3	146.3	0	0	0	0	0	118.2
318	S	33.3	Very low	35.4	Very low	105 Å²	105	142.6 Å²	142.6	73%	0.734	80%	0.802	S	S	*	*				-164.5	105.5	125.6	-161.1	0	0	0	0	111.7	V320	S318-V320 PolarHBondContact O-N 2.86Å
319	F	28.8	Very low	35.5	Very low	191 Å²	191	146.9 Å²	146.9	84%	0.838	81%	0.812	S	S	*	*			trans	-61.1	112	155.8	171.2	-93.2	0	0	0	108.7
320	V	40.4	Very low	35.4	Very low	128 Å²	128	146 Å²	146	78%	0.776	81%	0.814	S	S	*	*			trans	-132.9	108.4	161.6	-178.3	0	0	0	0	109.9	S318	S318-V320 PolarHBondContact O-N 2.86Å
321	S	33.4	Very low	35.4	Very low	104 Å²	104	143.9 Å²	143.9	73%	0.727	82%	0.817	S	S	*	*			trans	-69.7	137.3	167.7	-172.1	0	0	0	0	111.3
322	G	36.4	Very low	35.8	Very low	72 Å²	72	144.3 Å²	144.3	74%	0.742	82%	0.819	S	S	*	*			trans	169.9	129.2	163.6	0	0	0	0	0	109.2
323	S	36.8	Very low	36.2	Very low	123 Å²	123	144.8 Å²	144.8	86%	0.86	82%	0.819	S	S	*	*			cis	-161.3	149.5	11.6	-177.9	0	0	0	0	108.7
324	R	34.3	Very low	37	Very low	222 Å²	222	151 Å²	151	84%	0.838	82%	0.822	S	S	*	*			trans	-61.9	141.3	-176	-66.6	169.6	177.5	176.1	-2.1	113.2
325	R	40.9	Very low	37.5	Very low	240 Å²	240	149.5 Å²	149.5	91%	0.906	82%	0.82	S	S	*	*			trans	-142.5	92.2	134	-96.7	-173.5	-177.4	176.9	1.7	110.3
326	T	34.4	Very low	37.8	Very low	126 Å²	126	150.6 Å²	150.6	77%	0.773	81%	0.813	S	S	*	*			trans	-70.8	120.6	162.6	44.2	0	0	0	0	109.4
327	K	45.5	Very low	38.7	Very low	189 Å²	189	149.4 Å²	149.4	82%	0.822	80%	0.804	S	S	*	*			trans	-120.6	112.8	155.7	-76.7	-172.3	178.1	-178.6	0	107.7
328	Q	37.9	Very low	39.8	Very low	187 Å²	187	149.7 Å²	149.7	87%	0.874	79%	0.793	S	S	*	*			trans	-55.2	140.5	167	-83.7	156.2	-60.1	0	0	110.4
329	F	40.6	Very low	40.6	Very low	199 Å²	199	147.8 Å²	147.8	87%	0.873	78%	0.784	S	S	*	*			trans	-133.7	143.2	144.5	-98.2	-88.9	0	0	0	109.9
330	P	37.4	Very low	41.5	Very low	112 Å²	112	144.6 Å²	144.6	73%	0.727	77%	0.774	S	S	*	*			trans	-90.4	153.6	-148.4	-8.3	28.4	0	0	0	114.2	E332	P330-E332 PolarHBondContact O-N 2.85Å
331	A	35	Very low	42	Very low	103 Å²	103	141.2 Å²	141.2	85%	0.851	76%	0.76	S	S	*	*			trans	-73.9	111.8	167.7	0	0	0	0	0	110.3
332	E	45.2	Very low	43.1	Very low	182 Å²	182	140.3 Å²	140.3	85%	0.85	75%	0.753	S	S	*	*			trans	-131.1	122.7	154.8	-74.6	-171.3	171.2	0	0	108.8	P330	P330-E332 PolarHBondContact O-N 2.85Å
333	F	39.9	Very low	44	Very low	188 Å²	188	139.6 Å²	139.6	83%	0.825	74%	0.74	S	S	*	*			trans	-44.8	142	169.7	-92.8	-117	0	0	0	112.2
334	Y	50.8	Low	45.4	Very low	232 Å²	232	136.9 Å²	136.9	91%	0.91	72%	0.716	S	S	*	*				-156.9	127.5	127.9	-89.6	-68.9	0	0	0	110.2	D336	Y334-D336 PolarHBondContact O-N 3.38Å
335	D	39	Very low	47	Very low	158 Å²	158	130.5 Å²	130.5	85%	0.845	70%	0.699	S	S	*	*			trans	-47.3	119.7	165.3	-87.9	-50.3	0	0	0	111.3
336	D	42.8	Very low	48.3	Very low	117 Å²	117	121.9 Å²	121.9	63%	0.626	68%	0.679	S	S	*	*			trans	-155	116.9	150.6	-147.1	-9	0	0	0	110.8	Y334 S338 A339	Y334-D336 PolarHBondContact O-N 3.38Å; D336-S338 PolarHBondContact O-N 3.48Å; D336-A339 PolarHBondContact O-N 3.45Å
337	A	50.7	Low	50.4	Low	81 Å²	81	123 Å²	123	67%	0.669	67%	0.67	S	S	*	*	H	α-helix	trans	-61.4	-13.3	-176.6	0	0	0	0	0	113.4
338	S	52.6	Low	52	Low	85 Å²	85	120.9 Å²	120.9	59%	0.594	66%	0.657	S	S	*	*	H	α-helix	trans	-70	-34.7	172.3	178.6	0	0	0	0	113.4	D336 I340 A341 S342	D336-S338 PolarHBondContact O-N 3.48Å; S338-I340 VanDerWaalsContact C-N 3.33Å; S338-I340 PolarHBondContact O-N 2.99Å; S338-A341 PolarHBondContact O-N 2.95Å; S338-S342 PolarHBondContact O-N 3.36Å
339	A	49.1	Very low	53.9	Low	64 Å²	64	116.4 Å²	116.4	53%	0.529	64%	0.639	S	S	.	*	H	α-helix	trans	-73.3	-26.5	178.7	0	0	0	0	0	112.5	D336 A343	D336-A339 PolarHBondContact O-N 3.45Å; A339-A343 VanDerWaalsContact O-CB 3.25Å; A339-A343 WeakPolarHBondContact O-CB 3.4Å; A339-A343 PolarHBondContact O-N 3.3Å
340	I	48.4	Very low	55.8	Low	125 Å²	125	110.4 Å²	110.4	64%	0.641	62%	0.621	S	S	*	*	H	α-helix	trans	-73.8	-34.2	176.3	-58.3	174.8	0	0	0	110.7	S338 A343 D344	S338-I340 VanDerWaalsContact C-N 3.33Å; S338-I340 PolarHBondContact O-N 2.99Å; I340-A343 PolarHBondContact O-N 2.84Å; I340-D344 WeakPolarHBondContact O-CB 3.26Å; I340-D344 PolarHBondContact O-N 3.38Å
341	A	51.2	Low	58	Low	57 Å²	57	108.1 Å²	108.1	47%	0.471	60%	0.602	S	S	.	*	H	α-helix	trans	-69.4	-38.5	174.2	0	0	0	0	0	112.2	S338 D344 D345	S338-A341 PolarHBondContact O-N 2.95Å; A341-D344 PolarHBondContact O-N 3.29Å; A341-D345 PolarHBondContact O-N 2.65Å
342	S	56.2	Low	60.4	Low	84 Å²	84	109.1 Å²	109.1	59%	0.587	59%	0.587	S	S	*	*	H	α-helix	trans	-71	-32.9	173.5	-174.7	0	0	0	0	112.7	S338 A346	S338-S342 PolarHBondContact O-N 3.36Å; S342-A346 WeakPolarHBondContact O-CB 3.28Å; S342-A346 PolarHBondContact O-N 3.21Å
343	A	56.5	Low	62.4	Low	58 Å²	58	107.6 Å²	107.6	48%	0.479	58%	0.578	S	S	.	*	H	α-helix	trans	-71.3	-34.7	171.3	0	0	0	0	0	112.6	A339 I340 A346 Y347	A339-A343 VanDerWaalsContact O-CB 3.25Å; A339-A343 WeakPolarHBondContact O-CB 3.4Å; A339-A343 PolarHBondContact O-N 3.3Å; I340-A343 PolarHBondContact O-N 2.84Å; A343-A346 PolarHBondContact O-N 3.5Å; A343-Y347 VanDerWaalsContact O-CB 3.24Å; A343-Y347 WeakPolarHBondContact O-CB 3.48Å; A343-Y347 PolarHBondContact O-N 3Å
344	D	64.6	Low	64.6	Low	65 Å²	65	103 Å²	103	35%	0.348	57%	0.565	S	S	.	*	H	α-helix	trans	-71.7	-39.7	174.8	-162.8	50.4	0	0	0	111.2	I340 A341 Y347 R348	I340-D344 WeakPolarHBondContact O-CB 3.26Å; I340-D344 PolarHBondContact O-N 3.38Å; A341-D344 PolarHBondContact O-N 3.29Å; D344-Y347 PolarHBondContact O-N 3.12Å; D344-R348 WeakPolarHBondContact O-CB 3.35Å; D344-R348 WeakPolarHBondContact O-CG 3.47Å; D344-R348 PolarHBondContact O-N 3.22Å; D344-R348 IonicContact OD2-CZ 2.72Å; D344-R348 IonicContact OD2-NE 3.76Å; D344-R348 PolarHBondContact OD2-NE 2.92Å; D344-R348 IonicContact OD2-NH2 2.82Å; D344-R348 PolarHBondContact OD2-NH2 3.45Å
345	D	67.5	Low	66.4	Low	89 Å²	89	98.9 Å²	98.9	48%	0.476	55%	0.552	S	S	.	*	H	α-helix	trans	-67.7	-37.1	171.3	-85.4	-16.3	0	0	0	112.2	A341 R348 N349	A341-D345 PolarHBondContact O-N 2.65Å; D345-R348 PolarHBondContact O-N 3Å; D345-N349 WeakPolarHBondContact O-CB 3.39Å; D345-N349 PolarHBondContact O-N 2.82Å; D345-N349 PolarHBondContact O-ND2 3.28Å; D345-N349 VanDerWaalsContact O-ND2 3.11Å
346	A	69.5	Low	68.7	Low	58 Å²	58	96 Å²	96	48%	0.479	53%	0.533	S	S	.	.	H	α-helix	trans	-65.3	-39.5	172.3	0	0	0	0	0	111.9	S342 A343 C350	S342-A346 WeakPolarHBondContact O-CB 3.28Å; S342-A346 PolarHBondContact O-N 3.21Å; A343-A346 PolarHBondContact O-N 3.5Å; A346-C350 VanDerWaalsContact O-CB 3.26Å; A346-C350 WeakPolarHBondContact O-CB 3.33Å; A346-C350 PolarHBondContact O-N 2.74Å
347	Y	77.4	Confident	70.8	Confident	149 Å²	149	93.7 Å²	93.7	58%	0.584	53%	0.527	S	S	*	.	H	α-helix	trans	-66.9	-45	174.6	178.3	-109.2	0	0	0	111.6	A343 D344 C350 L351	A343-Y347 VanDerWaalsContact O-CB 3.24Å; A343-Y347 WeakPolarHBondContact O-CB 3.48Å; A343-Y347 PolarHBondContact O-N 3Å; D344-Y347 PolarHBondContact O-N 3.12Å; Y347-C350 PolarHBondContact O-N 3.36Å; Y347-L351 HydrophobicContact CD1-CD1 3.8Å; Y347-L351 HydrophobicContact CE1-CD1 3.22Å; Y347-L351 HydrophobicContact CE2-CD1 4.04Å; Y347-L351 HydrophobicContact CG-CD1 4.42Å; Y347-L351 WeakPolarHBondContact O-CB 3.43Å; Y347-L351 PolarHBondContact O-N 2.65Å
348	R	80.3	Confident	72.7	Confident	145 Å²	145	94.6 Å²	94.6	55%	0.547	52%	0.519	S	S	.	.	H	α-helix	trans	-62.5	-41.9	174.9	-73.6	172.5	-169.9	-167.5	4	111.8	D344 D345 L351 K352	D344-R348 WeakPolarHBondContact O-CB 3.35Å; D344-R348 WeakPolarHBondContact O-CG 3.47Å; D344-R348 PolarHBondContact O-N 3.22Å; D344-R348 IonicContact OD2-CZ 2.72Å; D344-R348 IonicContact OD2-NE 3.76Å; D344-R348 PolarHBondContact OD2-NE 2.92Å; D344-R348 IonicContact OD2-NH2 2.82Å; D344-R348 PolarHBondContact OD2-NH2 3.45Å; D345-R348 PolarHBondContact O-N 3Å; R348-L351 PolarHBondContact O-N 3.39Å; R348-K352 WeakPolarHBondContact O-CB 3.46Å; R348-K352 PolarHBondContact O-N 3.47Å
349	N	78.3	Confident	74.5	Confident	93 Å²	93	96.2 Å²	96.2	50%	0.497	52%	0.516	S	S	.	.	H	α-helix	trans	-67	-38.2	175	-76.3	-31	0	0	0	111.9	D345 K352 K353	D345-N349 WeakPolarHBondContact O-CB 3.39Å; D345-N349 PolarHBondContact O-N 2.82Å; D345-N349 PolarHBondContact O-ND2 3.28Å; D345-N349 VanDerWaalsContact O-ND2 3.11Å; N349-K352 PolarHBondContact O-N 3.23Å; N349-K353 WeakPolarHBondContact O-CB 3.18Å; N349-K353 WeakPolarHBondContact O-CG 3.4Å; N349-K353 PolarHBondContact O-N 3Å
350	C	80.5	Confident	76.4	Confident	74 Å²	74	99.1 Å²	99.1	50%	0.5	52%	0.519	S	S	.	.	H	α-helix	trans	-64.7	-46.2	173.1	-166.4	0	0	0	0	111	A346 Y347 K352 K353 V354	A346-C350 VanDerWaalsContact O-CB 3.26Å; A346-C350 WeakPolarHBondContact O-CB 3.33Å; A346-C350 PolarHBondContact O-N 2.74Å; Y347-C350 PolarHBondContact O-N 3.36Å; C350-K352 VanDerWaalsContact C-N 3.31Å; C350-K352 PolarHBondContact O-N 3.43Å; C350-K353 PolarHBondContact O-N 3.28Å; C350-V354 WeakPolarHBondContact O-CB 3.44Å; C350-V354 VanDerWaalsContact O-CG2 3.27Å; C350-V354 WeakPolarHBondContact O-CG2 3.3Å; C350-V354 PolarHBondContact O-N 3.03Å
351	L	83.4	Confident	78.4	Confident	64 Å²	64	96.8 Å²	96.8	34%	0.335	51%	0.512	S	S	.	.	H	α-helix	trans	-59	-40.3	173.2	-106.7	154.4	0	0	0	112.3	Y347 R348 V354 K355	Y347-L351 HydrophobicContact CD1-CD1 3.8Å; Y347-L351 HydrophobicContact CE1-CD1 3.22Å; Y347-L351 HydrophobicContact CE2-CD1 4.04Å; Y347-L351 HydrophobicContact CG-CD1 4.42Å; Y347-L351 WeakPolarHBondContact O-CB 3.43Å; Y347-L351 PolarHBondContact O-N 2.65Å; R348-L351 PolarHBondContact O-N 3.39Å; L351-V354 PolarHBondContact O-N 2.83Å; L351-K355 WeakPolarHBondContact O-CB 3.49Å; L351-K355 VanDerWaalsContact O-CG 3.29Å; L351-K355 WeakPolarHBondContact O-CG 3.2Å; L351-K355 PolarHBondContact O-N 2.64Å
352	K	85.6	Confident	80.3	Confident	123 Å²	123	99.5 Å²	99.5	54%	0.535	52%	0.515	S	S	.	.	H	α-helix	trans	-65.2	-47.4	176.2	-163.8	-170.4	-176.3	-143.4	0	110.8	R348 N349 C350 V354 K355 E356	R348-K352 WeakPolarHBondContact O-CB 3.46Å; R348-K352 PolarHBondContact O-N 3.47Å; N349-K352 PolarHBondContact O-N 3.23Å; C350-K352 VanDerWaalsContact C-N 3.31Å; C350-K352 PolarHBondContact O-N 3.43Å; K352-V354 PolarHBondContact O-N 3.44Å; K352-K355 PolarHBondContact O-N 3.33Å; K352-E356 WeakPolarHBondContact CE-OE1 3.39Å; K352-E356 HydrophobicContact CG-CG 4.48Å; K352-E356 IonicContact NZ-OE1 3.39Å; K352-E356 PolarHBondContact NZ-OE1 2.81Å; K352-E356 VanDerWaalsContact NZ-OE1 3.12Å; K352-E356 WeakPolarHBondContact O-CB 3.41Å; K352-E356 WeakPolarHBondContact O-CG 3.44Å; K352-E356 PolarHBondContact O-N 3.4Å
353	K	85.5	Confident	82	Confident	150 Å²	150	100.6 Å²	100.6	65%	0.652	51%	0.511	S	S	*	.	H	α-helix	trans	-61.2	-40.3	175	-76.2	-177.5	177.2	-173.5	0	112.8	N349 C350 E356 S357	N349-K353 WeakPolarHBondContact O-CB 3.18Å; N349-K353 WeakPolarHBondContact O-CG 3.4Å; N349-K353 PolarHBondContact O-N 3Å; C350-K353 PolarHBondContact O-N 3.28Å; K353-E356 PolarHBondContact O-N 2.96Å; K353-S357 WeakPolarHBondContact O-CB 3.02Å; K353-S357 PolarHBondContact O-N 3.49Å
354	V	86.1	Confident	83.6	Confident	93 Å²	93	100.5 Å²	100.5	56%	0.564	51%	0.505	S	S	*	.	H	α-helix	trans	-66.3	-39.8	175.9	170.5	0	0	0	0	110.7	C350 L351 K352 L358	C350-V354 WeakPolarHBondContact O-CB 3.44Å; C350-V354 VanDerWaalsContact O-CG2 3.27Å; C350-V354 WeakPolarHBondContact O-CG2 3.3Å; C350-V354 PolarHBondContact O-N 3.03Å; L351-V354 PolarHBondContact O-N 2.83Å; K352-V354 PolarHBondContact O-N 3.44Å; V354-L358 VanDerWaalsContact O-CB 3.28Å; V354-L358 WeakPolarHBondContact O-CB 3.18Å; V354-L358 PolarHBondContact O-N 3.44Å
355	K	89.6	Confident	84.8	Confident	144 Å²	144	102.4 Å²	102.4	63%	0.626	51%	0.511	S	S	*	.	H	α-helix	trans	-68.8	-41.6	174.7	-76	178.8	178.5	-175.3	0	112.9	L351 K352 L358 K359	L351-K355 WeakPolarHBondContact O-CB 3.49Å; L351-K355 VanDerWaalsContact O-CG 3.29Å; L351-K355 WeakPolarHBondContact O-CG 3.2Å; L351-K355 PolarHBondContact O-N 2.64Å; K352-K355 PolarHBondContact O-N 3.33Å; K355-L358 PolarHBondContact O-N 3.44Å; K355-K359 WeakPolarHBondContact O-CB 3Å; K355-K359 PolarHBondContact O-N 2.95Å
356	E	88.1	Confident	86	Confident	97 Å²	97	103 Å²	103	45%	0.453	51%	0.511	S	S	.	.	H	α-helix	trans	-63.7	-44.8	175.1	-74.7	168	176.8	0	0	110.3	K352 K353 L358 K359 E360	K352-E356 WeakPolarHBondContact CE-OE1 3.39Å; K352-E356 HydrophobicContact CG-CG 4.48Å; K352-E356 IonicContact NZ-OE1 3.39Å; K352-E356 PolarHBondContact NZ-OE1 2.81Å; K352-E356 VanDerWaalsContact NZ-OE1 3.12Å; K352-E356 WeakPolarHBondContact O-CB 3.41Å; K352-E356 WeakPolarHBondContact O-CG 3.44Å; K352-E356 PolarHBondContact O-N 3.4Å; K353-E356 PolarHBondContact O-N 2.96Å; E356-L358 PolarHBondContact O-N 2.84Å; E356-K359 PolarHBondContact O-N 3.26Å; E356-E360 WeakPolarHBondContact O-CB 3.33Å; E356-E360 PolarHBondContact O-N 3.08Å
357	S	85.5	Confident	87	Confident	70 Å²	70	103.5 Å²	103.5	49%	0.49	51%	0.511	S	S	.	.	H	α-helix	trans	-65.6	-35.3	175.1	-179.7	0	0	0	0	112.8	K353 C361	K353-S357 WeakPolarHBondContact O-CB 3.02Å; K353-S357 PolarHBondContact O-N 3.49Å; S357-C361 VanDerWaalsContact O-CB 3.22Å; S357-C361 WeakPolarHBondContact O-CB 3.35Å; S357-C361 PolarHBondContact O-N 3.11Å
358	L	90.6	Very high	87.6	Confident	99 Å²	99	104.4 Å²	104.4	52%	0.518	51%	0.513	S	S	.	.	H	α-helix	trans	-65.3	-44.4	172.6	-176.3	68	0	0	0	110.9	V354 K355 E356 C361 E362	V354-L358 VanDerWaalsContact O-CB 3.28Å; V354-L358 WeakPolarHBondContact O-CB 3.18Å; V354-L358 PolarHBondContact O-N 3.44Å; K355-L358 PolarHBondContact O-N 3.44Å; E356-L358 PolarHBondContact O-N 2.84Å; L358-C361 WeakPolarHBondContact O-CB 3.41Å; L358-C361 PolarHBondContact O-N 2.97Å; L358-E362 WeakPolarHBondContact O-CG 3.32Å; L358-E362 PolarHBondContact O-N 3.45Å
359	K	90.5	Very high	88.3	Confident	120 Å²	120	100.7 Å²	100.7	52%	0.522	50%	0.504	S	S	.	.	H	α-helix	trans	-64.2	-42.7	177.2	-172.7	173.9	-174.3	-77.3	0	111.9	K355 E356 C361 E362 E363	K355-K359 WeakPolarHBondContact O-CB 3Å; K355-K359 PolarHBondContact O-N 2.95Å; E356-K359 PolarHBondContact O-N 3.26Å; K359-C361 VanDerWaalsContact C-N 3.33Å; K359-E362 PolarHBondContact O-N 3.01Å; K359-E363 IonicContact NZ-OE1 2.73Å; K359-E363 PolarHBondContact NZ-OE1 3.43Å; K359-E363 WeakPolarHBondContact O-CB 3.49Å; K359-E363 WeakPolarHBondContact O-CG 3.28Å; K359-E363 PolarHBondContact O-N 2.89Å
360	E	89.9	Confident	88.9	Confident	125 Å²	125	100.9 Å²	100.9	58%	0.584	51%	0.505	S	S	*	.	H	α-helix	trans	-63.3	-40	173.5	-174.1	-179.4	-177	0	0	111.3	E356 E363 T364	E356-E360 WeakPolarHBondContact O-CB 3.33Å; E356-E360 PolarHBondContact O-N 3.08Å; E360-E363 PolarHBondContact O-N 3.14Å; E360-T364 WeakPolarHBondContact O-CB 3.19Å; E360-T364 VanDerWaalsContact O-CG2 3.27Å; E360-T364 WeakPolarHBondContact O-CG2 3.26Å; E360-T364 PolarHBondContact O-N 3.15Å; E360-T364 PolarHBondContact O-OG1 2.92Å
361	C	89.4	Confident	89.5	Confident	75 Å²	75	101.1 Å²	101.1	51%	0.507	51%	0.505	S	S	.	.	H	α-helix	trans	-64.4	-38.3	174	-170.9	0	0	0	0	112.2	S357 L358 K359 T364 H365	S357-C361 VanDerWaalsContact O-CB 3.22Å; S357-C361 WeakPolarHBondContact O-CB 3.35Å; S357-C361 PolarHBondContact O-N 3.11Å; L358-C361 WeakPolarHBondContact O-CB 3.41Å; L358-C361 PolarHBondContact O-N 2.97Å; K359-C361 VanDerWaalsContact C-N 3.33Å; C361-T364 WeakPolarHBondContact CA-OG1 3.5Å; C361-T364 PolarHBondContact O-OG1 3.44Å; C361-H365 WeakPolarHBondContact O-CB 3.37Å; C361-H365 PolarHBondContact O-N 3.35Å
362	E	91.3	Very high	89.9	Confident	115 Å²	115	103.4 Å²	103.4	54%	0.537	52%	0.516	S	S	.	.	H	α-helix	trans	-69	-43.5	175.5	-74.9	171.7	176.3	0	0	111.7	L358 K359 H365 Q366	L358-E362 WeakPolarHBondContact O-CG 3.32Å; L358-E362 PolarHBondContact O-N 3.45Å; K359-E362 PolarHBondContact O-N 3.01Å; E362-H365 PolarHBondContact O-N 3.32Å; E362-Q366 WeakPolarHBondContact O-CB 3.42Å; E362-Q366 PolarHBondContact O-N 3.17Å
363	E	91.9	Very high	90.2	Very high	107 Å²	107	101 Å²	101	50%	0.5	51%	0.512	S	S	.	.	H	α-helix	trans	-64.9	-43.7	176.6	-74.5	171.5	-175.9	0	0	111.8	K359 E360 Q366 S367	K359-E363 IonicContact NZ-OE1 2.73Å; K359-E363 PolarHBondContact NZ-OE1 3.43Å; K359-E363 WeakPolarHBondContact O-CB 3.49Å; K359-E363 WeakPolarHBondContact O-CG 3.28Å; K359-E363 PolarHBondContact O-N 2.89Å; E360-E363 PolarHBondContact O-N 3.14Å; E363-Q366 PolarHBondContact O-N 2.98Å; E363-S367 VanDerWaalsContact O-CB 3.32Å; E363-S367 WeakPolarHBondContact O-CB 3.4Å; E363-S367 PolarHBondContact O-N 3.1Å
364	T	89.7	Confident	90.6	Very high	56 Å²	56	95.1 Å²	95.1	34%	0.344	49%	0.494	S	S	.	.	H	α-helix	trans	-67.1	-36	174.2	52.7	0	0	0	0	111.9	E360 C361 R368	E360-T364 WeakPolarHBondContact O-CB 3.19Å; E360-T364 VanDerWaalsContact O-CG2 3.27Å; E360-T364 WeakPolarHBondContact O-CG2 3.26Å; E360-T364 PolarHBondContact O-N 3.15Å; E360-T364 PolarHBondContact O-OG1 2.92Å; C361-T364 WeakPolarHBondContact CA-OG1 3.5Å; C361-T364 PolarHBondContact O-OG1 3.44Å; T364-R368 WeakPolarHBondContact O-CB 3.24Å; T364-R368 VanDerWaalsContact O-CG 3.25Å; T364-R368 WeakPolarHBondContact O-CG 3.49Å; T364-R368 PolarHBondContact O-N 2.93Å
365	H	89.6	Confident	91	Very high	105 Å²	105	94.8 Å²	94.8	49%	0.486	49%	0.489	S	S	.	.	H	α-helix	trans	-64.3	-44.8	172.5	-178.9	61.6	0	0	0	111.5	C361 E362 R368 L369	C361-H365 WeakPolarHBondContact O-CB 3.37Å; C361-H365 PolarHBondContact O-N 3.35Å; E362-H365 PolarHBondContact O-N 3.32Å; H365-R368 PolarHBondContact O-N 3.43Å; H365-L369 WeakPolarHBondContact O-CG 3.46Å; H365-L369 PolarHBondContact O-N 2.7Å
366	Q	92.4	Very high	91.1	Very high	100 Å²	100	94.2 Å²	94.2	47%	0.467	49%	0.488	S	S	.	.	H	α-helix	trans	-65.6	-40.4	177.1	-169	62.8	40.6	0	0	112	E362 E363 L369 N370	E362-Q366 WeakPolarHBondContact O-CB 3.42Å; E362-Q366 PolarHBondContact O-N 3.17Å; E363-Q366 PolarHBondContact O-N 2.98Å; Q366-L369 PolarHBondContact O-N 3.02Å; Q366-N370 PolarHBondContact NE2-OD1 3.25Å; Q366-N370 PolarHBondContact O-N 2.82Å; Q366-N370 PolarHBondContact O-OD1 3.05Å
367	S	91.1	Very high	91.3	Very high	69 Å²	69	95 Å²	95	48%	0.483	49%	0.491	S	S	.	.	H	α-helix	trans	-60.7	-46.2	173.3	175.3	0	0	0	0	111.1	E363 L369 N370 T371	E363-S367 VanDerWaalsContact O-CB 3.32Å; E363-S367 WeakPolarHBondContact O-CB 3.4Å; E363-S367 PolarHBondContact O-N 3.1Å; S367-L369 PolarHBondContact O-N 3.27Å; S367-N370 PolarHBondContact O-N 3.47Å; S367-T371 PolarHBondContact O-N 3.03Å; S367-T371 PolarHBondContact O-OG1 3.48Å; S367-T371 VanDerWaalsContact O-OG1 3.05Å
368	R	90.8	Very high	91.7	Very high	168 Å²	168	96.9 Å²	96.9	63%	0.634	49%	0.493	S	S	*	.	H	α-helix	trans	-62	-41	174.7	-75.3	173	-179.2	159.4	2.1	112.4	T364 H365 T371 L372	T364-R368 WeakPolarHBondContact O-CB 3.24Å; T364-R368 VanDerWaalsContact O-CG 3.25Å; T364-R368 WeakPolarHBondContact O-CG 3.49Å; T364-R368 PolarHBondContact O-N 2.93Å; H365-R368 PolarHBondContact O-N 3.43Å; R368-T371 PolarHBondContact O-N 2.83Å; R368-L372 WeakPolarHBondContact O-CB 3.42Å; R368-L372 VanDerWaalsContact O-CG 3.29Å; R368-L372 WeakPolarHBondContact O-CG 3.46Å; R368-L372 PolarHBondContact O-N 3.43Å
369	L	93.6	Very high	91.9	Very high	67 Å²	67	96.7 Å²	96.7	35%	0.351	49%	0.492	S	S	.	.	H	α-helix	trans	-61.7	-44.8	174.8	-77.2	175.5	0	0	0	111.2	H365 Q366 S367 T371 L372 T373	H365-L369 WeakPolarHBondContact O-CG 3.46Å; H365-L369 PolarHBondContact O-N 2.7Å; Q366-L369 PolarHBondContact O-N 3.02Å; S367-L369 PolarHBondContact O-N 3.27Å; L369-T371 PolarHBondContact O-N 3.05Å; L369-L372 PolarHBondContact O-N 2.82Å; L369-T373 PolarHBondContact O-N 3.29Å; L369-T373 PolarHBondContact O-OG1 2.87Å
370	N	91.9	Very high	92	Very high	97 Å²	97	95.7 Å²	95.7	52%	0.519	49%	0.489	S	S	.	.	H	α-helix	trans	-63.7	-40.9	176.9	-66.7	-7.9	0	0	0	111.8	Q366 S367 T373 G374	Q366-N370 PolarHBondContact NE2-OD1 3.25Å; Q366-N370 PolarHBondContact O-N 2.82Å; Q366-N370 PolarHBondContact O-OD1 3.05Å; S367-N370 PolarHBondContact O-N 3.47Å; N370-T373 PolarHBondContact O-N 2.94Å; N370-G374 PolarHBondContact O-N 3.03Å
371	T	92.5	Very high	92.2	Very high	80 Å²	80	95.9 Å²	95.9	49%	0.491	49%	0.49	S	S	.	.	H	α-helix	trans	-64.4	-40.9	173.8	-54.4	0	0	0	0	111.7	S367 R368 L369 G374 L375	S367-T371 PolarHBondContact O-N 3.03Å; S367-T371 PolarHBondContact O-OG1 3.48Å; S367-T371 VanDerWaalsContact O-OG1 3.05Å; R368-T371 PolarHBondContact O-N 2.83Å; L369-T371 PolarHBondContact O-N 3.05Å; T371-G374 PolarHBondContact O-N 3.24Å; T371-L375 HydrophobicContact CG2-CD1 4.14Å; T371-L375 HydrophobicContact CG2-CG 4.4Å; T371-L375 WeakPolarHBondContact O-CB 3.31Å; T371-L375 VanDerWaalsContact O-CG 3.31Å; T371-L375 WeakPolarHBondContact O-CG 3.46Å; T371-L375 PolarHBondContact O-N 3.12Å
372	L	92	Very high	92.4	Very high	111 Å²	111	96.9 Å²	96.9	58%	0.581	49%	0.49	S	S	*	.	H	α-helix	trans	-63.2	-42	175.2	-76.9	172.6	0	0	0	111.7	R368 L369 L375 H376	R368-L372 WeakPolarHBondContact O-CB 3.42Å; R368-L372 VanDerWaalsContact O-CG 3.29Å; R368-L372 WeakPolarHBondContact O-CG 3.46Å; R368-L372 PolarHBondContact O-N 3.43Å; L369-L372 PolarHBondContact O-N 2.82Å; L372-L375 PolarHBondContact O-N 3.41Å; L372-H376 WeakPolarHBondContact O-CB 3.34Å; L372-H376 PolarHBondContact O-N 3.22Å
373	T	92.9	Very high	92.5	Very high	74 Å²	74	97.5 Å²	97.5	45%	0.454	49%	0.493	S	S	.	.	H	α-helix	trans	-62.3	-46.6	174	-55	0	0	0	0	111.1	L369 N370 L375 H376 E377	L369-T373 PolarHBondContact O-N 3.29Å; L369-T373 PolarHBondContact O-OG1 2.87Å; N370-T373 PolarHBondContact O-N 2.94Å; T373-L375 PolarHBondContact O-N 3.05Å; T373-H376 WeakPolarHBondContact O-CB 3.35Å; T373-H376 PolarHBondContact O-N 2.94Å; T373-H376 VanDerWaalsContact O-N 3.13Å; T373-E377 WeakPolarHBondContact O-CG 3.49Å; T373-E377 PolarHBondContact O-N 3.09Å
374	G	93.7	Very high	92.6	Very high	26 Å²	26	96.5 Å²	96.5	27%	0.268	49%	0.488	S	S	.	.	H	α-helix	trans	-64	-37.9	177.9	0	0	0	0	0	113.5	N370 T371 H376 Q378	N370-G374 PolarHBondContact O-N 3.03Å; T371-G374 PolarHBondContact O-N 3.24Å; G374-H376 VanDerWaalsContact C-N 3.34Å; G374-Q378 WeakPolarHBondContact O-CG 3.41Å; G374-Q378 PolarHBondContact O-N 3.4Å
375	L	93	Very high	92.7	Very high	86 Å²	86	99 Å²	99	45%	0.45	50%	0.498	S	S	.	.	H	α-helix	trans	-67.2	-35.6	172.3	-73	173.1	0	0	0	111.9	T371 L372 T373 Q378 L379	T371-L375 HydrophobicContact CG2-CD1 4.14Å; T371-L375 HydrophobicContact CG2-CG 4.4Å; T371-L375 WeakPolarHBondContact O-CB 3.31Å; T371-L375 VanDerWaalsContact O-CG 3.31Å; T371-L375 WeakPolarHBondContact O-CG 3.46Å; T371-L375 PolarHBondContact O-N 3.12Å; L372-L375 PolarHBondContact O-N 3.41Å; T373-L375 PolarHBondContact O-N 3.05Å; L375-Q378 PolarHBondContact O-N 2.96Å; L375-L379 WeakPolarHBondContact O-CB 3.5Å; L375-L379 WeakPolarHBondContact O-CG 3.32Å; L375-L379 PolarHBondContact O-N 3.34Å
376	H	92.8	Very high	92.8	Very high	131 Å²	131	100.3 Å²	100.3	61%	0.606	50%	0.504	S	S	*	.	H	α-helix	trans	-66.6	-43.3	175.8	-167.4	60	0	0	0	111.7	L372 T373 G374 L379 E380	L372-H376 WeakPolarHBondContact O-CB 3.34Å; L372-H376 PolarHBondContact O-N 3.22Å; T373-H376 WeakPolarHBondContact O-CB 3.35Å; T373-H376 PolarHBondContact O-N 2.94Å; T373-H376 VanDerWaalsContact O-N 3.13Å; G374-H376 VanDerWaalsContact C-N 3.34Å; H376-L379 PolarHBondContact O-N 3.43Å; H376-E380 PolarHBondContact O-N 3.39Å
377	E	92.7	Very high	92.8	Very high	113 Å²	113	98.4 Å²	98.4	53%	0.528	51%	0.505	S	S	.	.	H	α-helix	trans	-60.9	-45.4	173.4	-71.6	173	-178.7	0	0	111.5	T373 L379 E380 E381	T373-E377 WeakPolarHBondContact O-CG 3.49Å; T373-E377 PolarHBondContact O-N 3.09Å; E377-L379 PolarHBondContact O-N 2.95Å; E377-E380 PolarHBondContact O-N 2.86Å; E377-E381 WeakPolarHBondContact O-CG 3.47Å; E377-E381 PolarHBondContact O-N 3.28Å
378	Q	94.1	Very high	92.8	Very high	111 Å²	111	103 Å²	103	52%	0.519	51%	0.512	S	S	.	.	H	α-helix	trans	-64.7	-38	176.3	-74.9	-179	-17.7	0	0	113.2	G374 L375 E381 N382	G374-Q378 WeakPolarHBondContact O-CG 3.41Å; G374-Q378 PolarHBondContact O-N 3.4Å; L375-Q378 PolarHBondContact O-N 2.96Å; Q378-E381 PolarHBondContact O-N 3.04Å; Q378-N382 WeakPolarHBondContact O-CB 3.5Å; Q378-N382 PolarHBondContact O-N 2.87Å; Q378-N382 PolarHBondContact O-ND2 3.28Å
379	L	94	Very high	92.9	Very high	94 Å²	94	100 Å²	100	49%	0.492	51%	0.508	S	S	.	.	H	α-helix	trans	-62.6	-44.9	173.2	-82	167.9	0	0	0	110.6	L375 H376 E377 E381 N382 E383	L375-L379 WeakPolarHBondContact O-CB 3.5Å; L375-L379 WeakPolarHBondContact O-CG 3.32Å; L375-L379 PolarHBondContact O-N 3.34Å; H376-L379 PolarHBondContact O-N 3.43Å; E377-L379 PolarHBondContact O-N 2.95Å; L379-E381 PolarHBondContact O-N 3.39Å; L379-N382 PolarHBondContact O-N 3.47Å; L379-E383 WeakPolarHBondContact O-CB 3.27Å; L379-E383 VanDerWaalsContact O-CG 3.31Å; L379-E383 WeakPolarHBondContact O-CG 3.41Å; L379-E383 PolarHBondContact O-N 3.44Å
380	E	93.3	Very high	92.8	Very high	100 Å²	100	100.1 Å²	100.1	47%	0.467	52%	0.515	S	S	.	.	H	α-helix	trans	-62.4	-42.5	176.4	-169.5	-179.3	172.2	0	0	111.8	H376 E377 E383 Q384	H376-E380 PolarHBondContact O-N 3.39Å; E377-E380 PolarHBondContact O-N 2.86Å; E380-E383 PolarHBondContact O-N 2.82Å; E380-Q384 WeakPolarHBondContact O-CB 3.26Å; E380-Q384 VanDerWaalsContact O-CG 3.28Å; E380-Q384 WeakPolarHBondContact O-CG 3.4Å; E380-Q384 PolarHBondContact O-N 3.39Å
381	E	93.6	Very high	92.7	Very high	128 Å²	128	99.8 Å²	99.8	60%	0.598	52%	0.52	S	S	*	.	H	α-helix	trans	-62.3	-43	174.7	-74.4	-177.2	172.2	0	0	112.6	E377 Q378 L379 Q384 M385	E377-E381 WeakPolarHBondContact O-CG 3.47Å; E377-E381 PolarHBondContact O-N 3.28Å; Q378-E381 PolarHBondContact O-N 3.04Å; L379-E381 PolarHBondContact O-N 3.39Å; E381-Q384 PolarHBondContact O-N 3.37Å; E381-M385 WeakPolarHBondContact O-CB 3.5Å; E381-M385 PolarHBondContact O-N 3.23Å
382	N	93.2	Very high	92.6	Very high	97 Å²	97	97.6 Å²	97.6	52%	0.519	51%	0.51	S	S	.	.	H	α-helix	trans	-65.9	-43	177	-75.2	-24.7	0	0	0	111.6	Q378 L379 Q384 M385 E386	Q378-N382 WeakPolarHBondContact O-CB 3.5Å; Q378-N382 PolarHBondContact O-N 2.87Å; Q378-N382 PolarHBondContact O-ND2 3.28Å; L379-N382 PolarHBondContact O-N 3.47Å; N382-Q384 VanDerWaalsContact C-N 3.33Å; N382-Q384 PolarHBondContact O-N 3.15Å; N382-M385 PolarHBondContact O-N 2.96Å; N382-M385 VanDerWaalsContact O-N 3.16Å; N382-E386 WeakPolarHBondContact O-CB 3.34Å; N382-E386 PolarHBondContact O-N 3.44Å
383	E	93.9	Very high	92.5	Very high	128 Å²	128	98.6 Å²	98.6	60%	0.598	51%	0.509	S	S	*	.	H	α-helix	trans	-60.4	-42.3	174.3	-76.2	178.1	-178.9	0	0	111.2	L379 E380 E386 A387	L379-E383 WeakPolarHBondContact O-CB 3.27Å; L379-E383 VanDerWaalsContact O-CG 3.31Å; L379-E383 WeakPolarHBondContact O-CG 3.41Å; L379-E383 PolarHBondContact O-N 3.44Å; E380-E383 PolarHBondContact O-N 2.82Å; E383-E386 PolarHBondContact O-N 2.93Å; E383-A387 WeakPolarHBondContact O-CB 3.34Å; E383-A387 PolarHBondContact O-N 3.47Å
384	Q	93.7	Very high	92.4	Very high	85 Å²	85	98.5 Å²	98.5	40%	0.397	51%	0.51	S	S	.	.	H	α-helix	trans	-64	-40.1	173.9	-72.5	-179.5	33.5	0	0	112.2	E380 E381 N382 A387 R388	E380-Q384 WeakPolarHBondContact O-CB 3.26Å; E380-Q384 VanDerWaalsContact O-CG 3.28Å; E380-Q384 WeakPolarHBondContact O-CG 3.4Å; E380-Q384 PolarHBondContact O-N 3.39Å; E381-Q384 PolarHBondContact O-N 3.37Å; N382-Q384 VanDerWaalsContact C-N 3.33Å; N382-Q384 PolarHBondContact O-N 3.15Å; Q384-A387 PolarHBondContact O-N 3.08Å; Q384-R388 VanDerWaalsContact O-CG 3.26Å; Q384-R388 WeakPolarHBondContact O-CG 3.45Å; Q384-R388 PolarHBondContact O-N 2.9Å
385	M	92.3	Very high	92.2	Very high	110 Å²	110	100.5 Å²	100.5	54%	0.542	52%	0.52	S	S	.	.	H	α-helix	trans	-67	-43.5	177	-171	177.8	-58.4	0	0	111.6	E381 N382 A387 R388 L389	E381-M385 WeakPolarHBondContact O-CB 3.5Å; E381-M385 PolarHBondContact O-N 3.23Å; N382-M385 PolarHBondContact O-N 2.96Å; N382-M385 VanDerWaalsContact O-N 3.16Å; M385-A387 VanDerWaalsContact C-N 3.33Å; M385-A387 PolarHBondContact O-N 3.33Å; M385-R388 PolarHBondContact O-N 3.31Å; M385-L389 HydrophobicContact CG-CD1 4.12Å; M385-L389 HydrophobicContact CG-CG 4.42Å; M385-L389 WeakPolarHBondContact O-CB 3.39Å; M385-L389 WeakPolarHBondContact O-CG 3.49Å; M385-L389 PolarHBondContact O-N 3.2Å
386	E	91.9	Very high	92	Very high	131 Å²	131	100.7 Å²	100.7	61%	0.612	52%	0.521	S	S	*	.	H	α-helix	trans	-62.1	-41.2	175.9	-169.9	-178.3	170.9	0	0	111	N382 E383 R388 L389 S390	N382-E386 WeakPolarHBondContact O-CB 3.34Å; N382-E386 PolarHBondContact O-N 3.44Å; E383-E386 PolarHBondContact O-N 2.93Å; E386-R388 PolarHBondContact O-N 3.06Å; E386-L389 PolarHBondContact O-N 3.42Å; E386-S390 WeakPolarHBondContact O-CB 3.27Å; E386-S390 PolarHBondContact O-N 2.86Å; E386-S390 PolarHBondContact O-OG 3.36Å
387	A	91.7	Very high	91.9	Very high	61 Å²	61	98.2 Å²	98.2	50%	0.504	51%	0.511	S	S	.	.	H	α-helix	trans	-63.1	-40.9	174.1	0	0	0	0	0	112.3	E383 Q384 M385 S391	E383-A387 WeakPolarHBondContact O-CB 3.34Å; E383-A387 PolarHBondContact O-N 3.47Å; Q384-A387 PolarHBondContact O-N 3.08Å; M385-A387 VanDerWaalsContact C-N 3.33Å; M385-A387 PolarHBondContact O-N 3.33Å; A387-S391 WeakPolarHBondContact O-CB 3.31Å; A387-S391 PolarHBondContact O-N 3.41Å; A387-S391 PolarHBondContact O-OG 3.48Å
388	R	92.2	Very high	91.7	Very high	165 Å²	165	100.7 Å²	100.7	62%	0.623	52%	0.516	S	S	*	.	H	α-helix	trans	-66.3	-45.6	175.5	-72.7	173.6	-165.4	172.4	9.9	112.1	Q384 M385 E386 S391 A392	Q384-R388 VanDerWaalsContact O-CG 3.26Å; Q384-R388 WeakPolarHBondContact O-CG 3.45Å; Q384-R388 PolarHBondContact O-N 2.9Å; M385-R388 PolarHBondContact O-N 3.31Å; E386-R388 PolarHBondContact O-N 3.06Å; R388-S391 WeakPolarHBondContact CA-OG 3.14Å; R388-S391 PolarHBondContact O-N 3.25Å; R388-S391 PolarHBondContact O-OG 2.85Å; R388-A392 WeakPolarHBondContact O-CB 3.27Å; R388-A392 PolarHBondContact O-N 3.06Å
389	L	91.5	Very high	91.5	Very high	105 Å²	105	98 Å²	98	55%	0.55	50%	0.503	S	S	.	.	H	α-helix	trans	-67.1	-41.4	177.9	-71.2	174.8	0	0	0	111.4	M385 E386 S391 A392 K393	M385-L389 HydrophobicContact CG-CD1 4.12Å; M385-L389 HydrophobicContact CG-CG 4.42Å; M385-L389 WeakPolarHBondContact O-CB 3.39Å; M385-L389 WeakPolarHBondContact O-CG 3.49Å; M385-L389 PolarHBondContact O-N 3.2Å; E386-L389 PolarHBondContact O-N 3.42Å; L389-S391 VanDerWaalsContact C-N 3.33Å; L389-S391 PolarHBondContact O-N 3.21Å; L389-A392 PolarHBondContact O-N 3.01Å; L389-K393 VanDerWaalsContact O-CB 3.27Å; L389-K393 WeakPolarHBondContact O-CB 3.42Å; L389-K393 PolarHBondContact O-N 2.96Å
390	S	91.2	Very high	91.4	Very high	70 Å²	70	100.5 Å²	100.5	49%	0.49	51%	0.507	S	S	.	.	H	α-helix	trans	-63.9	-38.1	176.7	-67.6	0	0	0	0	112.1	E386	E386-S390 WeakPolarHBondContact O-CB 3.27Å; E386-S390 PolarHBondContact O-N 2.86Å; E386-S390 PolarHBondContact O-OG 3.36Å
391	S	90.1	Very high	91.3	Very high	90 Å²	90	99 Å²	99	63%	0.629	50%	0.502	S	S	*	.	H	α-helix	trans	-72.4	-33.1	174.3	57.7	0	0	0	0	113.4	A387 R388 L389	A387-S391 WeakPolarHBondContact O-CB 3.31Å; A387-S391 PolarHBondContact O-N 3.41Å; A387-S391 PolarHBondContact O-OG 3.48Å; R388-S391 WeakPolarHBondContact CA-OG 3.14Å; R388-S391 PolarHBondContact O-N 3.25Å; R388-S391 PolarHBondContact O-OG 2.85Å; L389-S391 VanDerWaalsContact C-N 3.33Å; L389-S391 PolarHBondContact O-N 3.21Å
392	A	91.9	Very high	91.2	Very high	33 Å²	33	93 Å²	93	27%	0.273	47%	0.474	S	S	.	.	H	α-helix	trans	-82.8	-21.9	176.6	0	0	0	0	0	114.3	R388 L389 P394 S395 L396	R388-A392 WeakPolarHBondContact O-CB 3.27Å; R388-A392 PolarHBondContact O-N 3.06Å; L389-A392 PolarHBondContact O-N 3.01Å; A392-P394 VanDerWaalsContact C-CD 3.49Å; A392-S395 PolarHBondContact O-N 2.9Å; A392-S395 VanDerWaalsContact O-N 3.1Å; A392-S395 PolarHBondContact O-OG 3.27Å; A392-L396 HydrophobicContact CB-CD1 4.11Å; A392-L396 PolarHBondContact O-N 3.25Å
393	K	89.8	Confident	91.2	Very high	133 Å²	133	91.8 Å²	91.8	58%	0.578	47%	0.465	S	S	*	.	H	α-helix	trans	-51.3	-45.2	-176.6	176.5	176.9	-178.4	177.1	0	113.5	L389 S395 L396 I397	L389-K393 VanDerWaalsContact O-CB 3.27Å; L389-K393 WeakPolarHBondContact O-CB 3.42Å; L389-K393 PolarHBondContact O-N 2.96Å; K393-S395 PolarHBondContact O-N 3.43Å; K393-L396 PolarHBondContact O-N 2.89Å; K393-I397 HydrophobicContact CD-CD1 4.45Å; K393-I397 HydrophobicContact CG-CD1 3.64Å; K393-I397 HydrophobicContact CG-CG1 4.35Å; K393-I397 WeakPolarHBondContact O-CB 3.37Å; K393-I397 VanDerWaalsContact O-CG1 3.24Å; K393-I397 WeakPolarHBondContact O-CG1 3.46Å; K393-I397 PolarHBondContact O-N 3.37Å
394	P	90.8	Very high	91.2	Very high	71 Å²	71	89.9 Å²	89.9	46%	0.461	46%	0.455	S	S	.	.	H	α-helix	trans	-65.3	-34.6	179.7	-21.7	34.1	0	0	0	113.9	A392 R398	A392-P394 VanDerWaalsContact C-CD 3.49Å; P394-R398 VanDerWaalsContact O-CG 3.28Å; P394-R398 WeakPolarHBondContact O-CG 3.45Å; P394-R398 PolarHBondContact O-N 3.09Å
395	S	88.2	Confident	91.3	Very high	69 Å²	69	93 Å²	93	48%	0.483	46%	0.464	S	S	.	.	H	α-helix	trans	-74.9	-41.8	178.2	61.6	0	0	0	0	111.2	A392 K393 R398 Q399	A392-S395 PolarHBondContact O-N 2.9Å; A392-S395 VanDerWaalsContact O-N 3.1Å; A392-S395 PolarHBondContact O-OG 3.27Å; K393-S395 PolarHBondContact O-N 3.43Å; S395-R398 WeakPolarHBondContact O-CB 3.22Å; S395-R398 PolarHBondContact O-N 3.38Å; S395-Q399 PolarHBondContact O-N 3.39Å
396	L	89.5	Confident	91.3	Very high	89 Å²	89	88.6 Å²	88.6	47%	0.466	44%	0.442	S	S	.	.	H	α-helix	trans	-62	-43	175.4	-72	168.1	0	0	0	112.1	A392 K393 R398 Q399 Y400	A392-L396 HydrophobicContact CB-CD1 4.11Å; A392-L396 PolarHBondContact O-N 3.25Å; K393-L396 PolarHBondContact O-N 2.89Å; L396-R398 VanDerWaalsContact C-N 3.32Å; L396-R398 PolarHBondContact O-N 3.01Å; L396-Q399 PolarHBondContact O-N 3.09Å; L396-Y400 WeakPolarHBondContact O-CB 3.37Å; L396-Y400 PolarHBondContact O-N 3.47Å
397	I	91.6	Very high	91.5	Very high	80 Å²	80	86.4 Å²	86.4	41%	0.41	44%	0.435	S	S	.	.	H	α-helix	trans	-61.7	-41	175.6	-70.8	168.2	0	0	0	110.9	K393 N401	K393-I397 HydrophobicContact CD-CD1 4.45Å; K393-I397 HydrophobicContact CG-CD1 3.64Å; K393-I397 HydrophobicContact CG-CG1 4.35Å; K393-I397 WeakPolarHBondContact O-CB 3.37Å; K393-I397 VanDerWaalsContact O-CG1 3.24Å; K393-I397 WeakPolarHBondContact O-CG1 3.46Å; K393-I397 PolarHBondContact O-N 3.37Å; I397-N401 WeakPolarHBondContact CG2-ND2 3.37Å; I397-N401 VanDerWaalsContact O-CB 3.28Å; I397-N401 WeakPolarHBondContact O-CB 3.39Å; I397-N401 PolarHBondContact O-N 3.29Å; I397-N401 PolarHBondContact O-ND2 3.43Å; I397-N401 VanDerWaalsContact O-ND2 3.08Å
398	R	88	Confident	91.7	Very high	164 Å²	164	87.2 Å²	87.2	62%	0.619	43%	0.433	S	S	*	.	H	α-helix	trans	-63.9	-44.2	176.6	-73.2	172.9	-171.7	-172.6	3.8	111.6	P394 S395 L396 N401 F402	P394-R398 VanDerWaalsContact O-CG 3.28Å; P394-R398 WeakPolarHBondContact O-CG 3.45Å; P394-R398 PolarHBondContact O-N 3.09Å; S395-R398 WeakPolarHBondContact O-CB 3.22Å; S395-R398 PolarHBondContact O-N 3.38Å; L396-R398 VanDerWaalsContact C-N 3.32Å; L396-R398 PolarHBondContact O-N 3.01Å; R398-N401 PolarHBondContact O-N 2.93Å; R398-F402 PolarHBondContact O-N 3.25Å
399	Q	89.1	Confident	91.8	Very high	56 Å²	56	79.8 Å²	79.8	26%	0.262	41%	0.405	S	S	.	.	H	α-helix	trans	-62.2	-48.7	176.9	-175.4	178	32.4	0	0	111.4	S395 L396 N401 F402 F403 F560	S395-Q399 PolarHBondContact O-N 3.39Å; L396-Q399 PolarHBondContact O-N 3.09Å; Q399-N401 PolarHBondContact O-N 2.72Å; Q399-F402 WeakPolarHBondContact O-CB 3.46Å; Q399-F402 PolarHBondContact O-N 2.89Å; Q399-F403 HydrophobicContact CG-CD2 3.74Å; Q399-F403 HydrophobicContact CG-CE2 3.37Å; Q399-F403 HydrophobicContact CG-CZ 4.47Å; Q399-F403 WeakPolarHBondContact O-CD2 3.37Å; Q399-F403 PolarHBondContact O-N 3.32Å; Q399-F560 HydrophobicContact CB-CE1 3.94Å; Q399-F560 HydrophobicContact CB-CE2 4.11Å; Q399-F560 HydrophobicContact CB-CZ 3.68Å; Q399-F560 HydrophobicContact CG-CD1 3.9Å; Q399-F560 HydrophobicContact CG-CE1 3.58Å; Q399-F560 HydrophobicContact CG-CE2 4.41Å; Q399-F560 HydrophobicContact CG-CG 4.46Å; Q399-F560 HydrophobicContact CG-CZ 3.87Å
400	Y	91.5	Very high	92	Very high	146 Å²	146	76.3 Å²	76.3	57%	0.573	39%	0.388	S	S	*	.	H	α-helix	trans	-57.4	-48.6	176.3	176	-99.1	0	0	0	111.6	L396 F402 F403 Q404	L396-Y400 WeakPolarHBondContact O-CB 3.37Å; L396-Y400 PolarHBondContact O-N 3.47Å; Y400-F402 VanDerWaalsContact C-N 3.31Å; Y400-F402 PolarHBondContact O-N 3.47Å; Y400-F403 PolarHBondContact O-N 2.77Å; Y400-Q404 VanDerWaalsContact O-CB 3.31Å; Y400-Q404 WeakPolarHBondContact O-CB 3.37Å; Y400-Q404 PolarHBondContact O-N 2.83Å
401	N	92.4	Very high	92.2	Very high	68 Å²	68	76.6 Å²	76.6	36%	0.364	38%	0.384	S	S	.	.	H	α-helix	trans	-61.7	-37.7	178.5	-75.6	-30.9	0	0	0	112.7	I397 R398 Q399 R405	I397-N401 WeakPolarHBondContact CG2-ND2 3.37Å; I397-N401 VanDerWaalsContact O-CB 3.28Å; I397-N401 WeakPolarHBondContact O-CB 3.39Å; I397-N401 PolarHBondContact O-N 3.29Å; I397-N401 PolarHBondContact O-ND2 3.43Å; I397-N401 VanDerWaalsContact O-ND2 3.08Å; R398-N401 PolarHBondContact O-N 2.93Å; Q399-N401 PolarHBondContact O-N 2.72Å; N401-R405 VanDerWaalsContact O-CB 3.32Å; N401-R405 WeakPolarHBondContact O-CB 3.47Å; N401-R405 WeakPolarHBondContact O-CD 3.37Å; N401-R405 WeakPolarHBondContact O-CG 3.39Å; N401-R405 PolarHBondContact O-N 3.25Å
402	F	91.9	Very high	92.5	Very high	3 Å²	3	74.5 Å²	74.5	1%	0.013	37%	0.369	C	S	.	.	H	α-helix	trans	-61.3	-55.6	174.8	168.7	-97	0	0	0	111	R398 Q399 Y400 Q404 R405 L406 W553 Y557 F560	R398-F402 PolarHBondContact O-N 3.25Å; Q399-F402 WeakPolarHBondContact O-CB 3.46Å; Q399-F402 PolarHBondContact O-N 2.89Å; Y400-F402 VanDerWaalsContact C-N 3.31Å; Y400-F402 PolarHBondContact O-N 3.47Å; F402-Q404 VanDerWaalsContact C-N 3.32Å; F402-Q404 PolarHBondContact O-N 2.78Å; F402-R405 PolarHBondContact O-N 2.84Å; F402-L406 HydrophobicContact CE1-CD2 4.12Å; F402-L406 HydrophobicContact CZ-CD2 4.17Å; F402-L406 WeakPolarHBondContact O-CB 3.31Å; F402-L406 PolarHBondContact O-N 3.4Å; F402-W553 HydrophobicContact CE2-CB 4Å; F402-W553 HydrophobicContact CE2-CG 4.03Å; F402-Y557 AromaticContact CD2-CD2 3.38Å; F402-Y557 HydrophobicContact CD2-CD2 3.38Å; F402-Y557 HydrophobicContact CD2-CE2 4.09Å; F402-Y557 AromaticContact CD2-CG 3.72Å; F402-Y557 HydrophobicContact CD2-CG 3.72Å; F402-Y557 AromaticContact CE2-CD2 3.92Å; F402-Y557 HydrophobicContact CE2-CD2 3.92Å; F402-Y557 HydrophobicContact CE2-CG 4.21Å; F402-Y557 HydrophobicContact CG-CD2 4.29Å; F402-Y557 HydrophobicContact CG-CG 4.31Å; F402-F560 HydrophobicContact CB-CD2 4.4Å; F402-F560 HydrophobicContact CD1-CB 3.44Å; F402-F560 VanDerWaalsContact CD1-CB 3.44Å; F402-F560 HydrophobicContact CD1-CD2 4.32Å; F402-F560 HydrophobicContact CD1-CG 4.2Å; F402-F560 HydrophobicContact CE1-CB 3.39Å; F402-F560 HydrophobicContact CG-CB 4.14Å; F402-F560 HydrophobicContact CG-CD2 4.33Å; F402-F560 HydrophobicContact CZ-CB 4.06Å
403	F	93.1	Very high	92.7	Very high	71 Å²	71	72.9 Å²	72.9	31%	0.311	36%	0.356	S	S	.	.	H	α-helix	trans	-63.6	-38.2	-178	-70.9	-60.6	0	0	0	112	Q399 Y400 L406 N407 F560 A564	Q399-F403 HydrophobicContact CG-CD2 3.74Å; Q399-F403 HydrophobicContact CG-CE2 3.37Å; Q399-F403 HydrophobicContact CG-CZ 4.47Å; Q399-F403 WeakPolarHBondContact O-CD2 3.37Å; Q399-F403 PolarHBondContact O-N 3.32Å; Y400-F403 PolarHBondContact O-N 2.77Å; F403-L406 PolarHBondContact O-N 2.7Å; F403-N407 WeakPolarHBondContact O-CB 3.44Å; F403-N407 PolarHBondContact O-N 2.98Å; F403-F560 HydrophobicContact CZ-CB 4.26Å; F403-A564 HydrophobicContact CE1-CB 3.99Å
404	Q	93.9	Very high	93	Very high	87 Å²	87	69.5 Å²	69.5	41%	0.407	34%	0.344	S	S	.	.	H	α-helix	trans	-64.5	-45.3	177.2	-170.4	65.2	3.8	0	0	111.6	Y400 F402 N407 V408	Y400-Q404 VanDerWaalsContact O-CB 3.31Å; Y400-Q404 WeakPolarHBondContact O-CB 3.37Å; Y400-Q404 PolarHBondContact O-N 2.83Å; F402-Q404 VanDerWaalsContact C-N 3.32Å; F402-Q404 PolarHBondContact O-N 2.78Å; Q404-N407 PolarHBondContact O-N 3.15Å; Q404-V408 WeakPolarHBondContact O-CB 3.29Å; Q404-V408 VanDerWaalsContact O-CG2 3.27Å; Q404-V408 WeakPolarHBondContact O-CG2 3.33Å; Q404-V408 PolarHBondContact O-N 2.86Å
405	R	94.2	Very high	93.2	Very high	152 Å²	152	71.3 Å²	71.3	57%	0.574	35%	0.35	S	S	*	.	H	α-helix	trans	-65.4	-41.9	177.3	-73.5	173.9	-179.7	-170.8	-0.2	112.3	N401 F402 Y409	N401-R405 VanDerWaalsContact O-CB 3.32Å; N401-R405 WeakPolarHBondContact O-CB 3.47Å; N401-R405 WeakPolarHBondContact O-CD 3.37Å; N401-R405 WeakPolarHBondContact O-CG 3.39Å; N401-R405 PolarHBondContact O-N 3.25Å; F402-R405 PolarHBondContact O-N 2.84Å; R405-Y409 WeakPolarHBondContact O-CB 3.4Å; R405-Y409 PolarHBondContact O-N 3.19Å; R405-Y409 VanDerWaalsContact O-N 3.09Å
406	L	93.8	Very high	93.5	Very high	17 Å²	17	68.9 Å²	68.9	9%	0.089	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-48	175.5	179.7	68	0	0	0	110.3	F402 F403 Y409 V410 F550 W553 A564 V566	F402-L406 HydrophobicContact CE1-CD2 4.12Å; F402-L406 HydrophobicContact CZ-CD2 4.17Å; F402-L406 WeakPolarHBondContact O-CB 3.31Å; F402-L406 PolarHBondContact O-N 3.4Å; F403-L406 PolarHBondContact O-N 2.7Å; L406-Y409 PolarHBondContact O-N 3.03Å; L406-V410 HydrophobicContact CD1-CG2 4.01Å; L406-V410 HydrophobicContact CG-CG2 4.34Å; L406-V410 WeakPolarHBondContact O-CB 3.23Å; L406-V410 WeakPolarHBondContact O-CG2 3.29Å; L406-V410 PolarHBondContact O-N 3.3Å; L406-F550 HydrophobicContact CD1-CE1 4.08Å; L406-W553 HydrophobicContact CD1-CD2 4.28Å; L406-W553 HydrophobicContact CD1-CE3 3.6Å; L406-W553 HydrophobicContact CD1-CH2 4.01Å; L406-W553 HydrophobicContact CD1-CZ3 3.46Å; L406-W553 VanDerWaalsContact CD1-CZ3 3.46Å; L406-A564 HydrophobicContact CD2-CB 3.85Å; L406-V566 HydrophobicContact CD2-CG2 3.99Å
407	N	94.5	Very high	93.8	Very high	85 Å²	85	64.8 Å²	64.8	46%	0.455	31%	0.311	S	S	.	.	H	α-helix	trans	-63	-49.9	-178.2	-168.8	-12.4	0	0	0	111.7	F403 Q404 Y409 V410 N411	F403-N407 WeakPolarHBondContact O-CB 3.44Å; F403-N407 PolarHBondContact O-N 2.98Å; Q404-N407 PolarHBondContact O-N 3.15Å; N407-Y409 VanDerWaalsContact C-N 3.35Å; N407-Y409 PolarHBondContact O-N 3.22Å; N407-V410 PolarHBondContact O-N 3.43Å; N407-N411 WeakPolarHBondContact O-CB 3.3Å; N407-N411 VanDerWaalsContact O-CG 3.28Å; N407-N411 PolarHBondContact O-N 3.1Å; N407-N411 PolarHBondContact O-ND2 2.82Å; N407-N411 VanDerWaalsContact O-ND2 3.15Å; N407-N411 PolarHBondContact OD1-ND2 2.85Å
408	V	95.6	Very high	94	Very high	77 Å²	77	66 Å²	66	47%	0.467	32%	0.318	S	S	.	.	H	α-helix	trans	-56.7	-49.4	177	171.5	0	0	0	0	111	Q404 N411 S412	Q404-V408 WeakPolarHBondContact O-CB 3.29Å; Q404-V408 VanDerWaalsContact O-CG2 3.27Å; Q404-V408 WeakPolarHBondContact O-CG2 3.33Å; Q404-V408 PolarHBondContact O-N 2.86Å; V408-N411 PolarHBondContact O-N 3.5Å; V408-S412 PolarHBondContact O-N 2.89Å; V408-S412 PolarHBondContact O-OG 2.87Å; V408-S412 VanDerWaalsContact O-OG 3.12Å
409	Y	96	Very high	94.4	Very high	10 Å²	10	63 Å²	63	4%	0.039	31%	0.312	C	S	.	.	H	α-helix	trans	-65.3	-44.1	-179.3	178.3	-90.5	0	0	0	112.9	R405 L406 N407 N411 S412 L413 E539 Y540 R549 F550 W553	R405-Y409 WeakPolarHBondContact O-CB 3.4Å; R405-Y409 PolarHBondContact O-N 3.19Å; R405-Y409 VanDerWaalsContact O-N 3.09Å; L406-Y409 PolarHBondContact O-N 3.03Å; N407-Y409 VanDerWaalsContact C-N 3.35Å; N407-Y409 PolarHBondContact O-N 3.22Å; Y409-N411 VanDerWaalsContact C-N 3.33Å; Y409-N411 PolarHBondContact O-N 3.45Å; Y409-S412 PolarHBondContact O-N 3.36Å; Y409-L413 HydrophobicContact CE1-CD2 4.25Å; Y409-L413 WeakPolarHBondContact O-CB 3.43Å; Y409-L413 PolarHBondContact O-N 3.5Å; Y409-E539 PolarHBondContact OH-O 2.85Å; Y409-Y540 HydrophobicContact CD2-CD1 4.4Å; Y409-Y540 AromaticContact CD2-CE1 3.5Å; Y409-Y540 HydrophobicContact CD2-CE1 3.5Å; Y409-Y540 AromaticContact CD2-CZ 3.93Å; Y409-Y540 HydrophobicContact CE2-CD1 4.02Å; Y409-Y540 AromaticContact CE2-CE1 3.53Å; Y409-Y540 HydrophobicContact CE2-CE1 3.53Å; Y409-Y540 HydrophobicContact CG-CE1 4.13Å; Y409-R549 HydrophobicContact CD2-CG 4.41Å; Y409-R549 HydrophobicContact CE1-CG 4.14Å; Y409-R549 HydrophobicContact CE2-CG 3.95Å; Y409-F550 HydrophobicContact CE1-CE2 4.06Å; Y409-F550 HydrophobicContact CE1-CZ 4.3Å; Y409-W553 AromaticContact CD1-CH2 3.45Å; Y409-W553 HydrophobicContact CD1-CH2 3.45Å; Y409-W553 VanDerWaalsContact CD1-CH2 3.45Å; Y409-W553 AromaticContact CD1-CZ3 3.77Å; Y409-W553 HydrophobicContact CD1-CZ3 3.77Å; Y409-W553 HydrophobicContact CD2-CH2 4.32Å; Y409-W553 HydrophobicContact CE1-CH2 4.15Å; Y409-W553 HydrophobicContact CE1-CZ3 4.17Å; Y409-W553 AromaticContact CG-CH2 3.54Å; Y409-W553 HydrophobicContact CG-CH2 3.54Å; Y409-W553 HydrophobicContact CG-CZ2 4.43Å; Y409-W553 HydrophobicContact CG-CZ3 4.32Å
410	V	95.2	Very high	94.6	Very high	31 Å²	31	60.5 Å²	60.5	19%	0.188	30%	0.3	C	S	.	.	H	α-helix	trans	-64.3	-39.2	179.2	170	0	0	0	0	110.6	L406 N407 L413 L414 F550	L406-V410 HydrophobicContact CD1-CG2 4.01Å; L406-V410 HydrophobicContact CG-CG2 4.34Å; L406-V410 WeakPolarHBondContact O-CB 3.23Å; L406-V410 WeakPolarHBondContact O-CG2 3.29Å; L406-V410 PolarHBondContact O-N 3.3Å; N407-V410 PolarHBondContact O-N 3.43Å; V410-L413 PolarHBondContact O-N 3.35Å; V410-L414 HydrophobicContact CG1-CD1 3.84Å; V410-L414 HydrophobicContact CG1-CG 4.18Å; V410-L414 WeakPolarHBondContact O-CB 3.25Å; V410-L414 WeakPolarHBondContact O-CG 3.22Å; V410-L414 PolarHBondContact O-N 2.72Å; V410-F550 HydrophobicContact CG2-CE1 4.44Å; V410-F550 HydrophobicContact CG2-CZ 4.15Å
411	N	95.7	Very high	94.9	Very high	77 Å²	77	55.9 Å²	55.9	41%	0.412	29%	0.285	S	S	.	.	H	α-helix	trans	-63.6	-46.9	174.9	-69.5	-30.5	0	0	0	111.7	N407 V408 Y409 L413 L414 D415	N407-N411 WeakPolarHBondContact O-CB 3.3Å; N407-N411 VanDerWaalsContact O-CG 3.28Å; N407-N411 PolarHBondContact O-N 3.1Å; N407-N411 PolarHBondContact O-ND2 2.82Å; N407-N411 VanDerWaalsContact O-ND2 3.15Å; N407-N411 PolarHBondContact OD1-ND2 2.85Å; V408-N411 PolarHBondContact O-N 3.5Å; Y409-N411 VanDerWaalsContact C-N 3.33Å; Y409-N411 PolarHBondContact O-N 3.45Å; N411-L413 VanDerWaalsContact C-N 3.3Å; N411-L413 PolarHBondContact O-N 2.82Å; N411-L414 PolarHBondContact O-N 3.21Å; N411-L414 VanDerWaalsContact O-N 3.14Å; N411-D415 VanDerWaalsContact O-CG 3.25Å; N411-D415 PolarHBondContact O-N 3.14Å
412	S	96	Very high	95.1	Very high	45 Å²	45	56 Å²	56	32%	0.315	29%	0.289	S	S	.	.	H	α-helix	trans	-61	-39	175.8	-56.8	0	0	0	0	112.6	V408 Y409 D415 C416	V408-S412 PolarHBondContact O-N 2.89Å; V408-S412 PolarHBondContact O-OG 2.87Å; V408-S412 VanDerWaalsContact O-OG 3.12Å; Y409-S412 PolarHBondContact O-N 3.36Å; S412-D415 PolarHBondContact O-N 3.36Å; S412-C416 PolarHBondContact O-N 2.84Å; S412-C416 VanDerWaalsContact O-N 3.1Å
413	L	95.8	Very high	95.2	Very high	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.31	C	S	.	.	H	α-helix	trans	-65	-43.2	174.5	-179.7	60.8	0	0	0	111.3	Y409 V410 N411 C416 L417 Y540 I546 F550 F577	Y409-L413 HydrophobicContact CE1-CD2 4.25Å; Y409-L413 WeakPolarHBondContact O-CB 3.43Å; Y409-L413 PolarHBondContact O-N 3.5Å; V410-L413 PolarHBondContact O-N 3.35Å; N411-L413 VanDerWaalsContact C-N 3.3Å; N411-L413 PolarHBondContact O-N 2.82Å; L413-C416 PolarHBondContact O-N 3.48Å; L413-L417 HydrophobicContact CD1-CD1 4.24Å; L413-L417 HydrophobicContact CD1-CG 4.23Å; L413-L417 HydrophobicContact CG-CD1 4.02Å; L413-L417 HydrophobicContact CG-CG 4.4Å; L413-L417 WeakPolarHBondContact O-CB 3.35Å; L413-L417 VanDerWaalsContact O-CG 3.25Å; L413-L417 WeakPolarHBondContact O-CG 3.18Å; L413-L417 PolarHBondContact O-N 3.15Å; L413-Y540 HydrophobicContact CB-CD1 3.99Å; L413-Y540 HydrophobicContact CB-CE1 4.43Å; L413-Y540 HydrophobicContact CD1-CD1 4.28Å; L413-I546 HydrophobicContact CD1-CD1 3.89Å; L413-I546 HydrophobicContact CD1-CG1 4.44Å; L413-I546 HydrophobicContact CD2-CG2 4.22Å; L413-F550 HydrophobicContact CD2-CE2 4.29Å; L413-F577 HydrophobicContact CD1-CE2 4.48Å; L413-F577 HydrophobicContact CD1-CZ 4.28Å
414	L	95.8	Very high	95.4	Very high	62 Å²	62	58.3 Å²	58.3	33%	0.325	30%	0.296	S	S	.	.	H	α-helix	trans	-66.4	-39	177.8	-74.1	174.9	0	0	0	111.9	V410 N411 L417 N418 L573	V410-L414 HydrophobicContact CG1-CD1 3.84Å; V410-L414 HydrophobicContact CG1-CG 4.18Å; V410-L414 WeakPolarHBondContact O-CB 3.25Å; V410-L414 WeakPolarHBondContact O-CG 3.22Å; V410-L414 PolarHBondContact O-N 2.72Å; N411-L414 PolarHBondContact O-N 3.21Å; N411-L414 VanDerWaalsContact O-N 3.14Å; L414-L417 PolarHBondContact O-N 2.91Å; L414-N418 VanDerWaalsContact O-CB 3.27Å; L414-N418 WeakPolarHBondContact O-CB 3.38Å; L414-N418 PolarHBondContact O-N 2.86Å; L414-N418 PolarHBondContact O-ND2 3.36Å; L414-N418 VanDerWaalsContact O-ND2 3.08Å; L414-L573 HydrophobicContact CD2-CD2 3.77Å; L414-L573 HydrophobicContact CG-CD2 4.46Å
415	D	95.6	Very high	95.5	Very high	109 Å²	109	56.7 Å²	56.7	58%	0.583	29%	0.29	S	S	*	.	H	α-helix	trans	-61.1	-46.6	175.3	-70	-23	0	0	0	110.9	N411 S412 N418 E419	N411-D415 VanDerWaalsContact O-CG 3.25Å; N411-D415 PolarHBondContact O-N 3.14Å; S412-D415 PolarHBondContact O-N 3.36Å; D415-N418 PolarHBondContact O-N 2.86Å; D415-E419 PolarHBondContact O-N 3.18Å
416	C	95.3	Very high	95.6	Very high	17 Å²	17	53 Å²	53	12%	0.115	28%	0.284	C	S	.	.	H	α-helix	trans	-58.6	-51.5	172.3	175.2	0	0	0	0	111.2	S412 L413 N418 E419 K420	S412-C416 PolarHBondContact O-N 2.84Å; S412-C416 VanDerWaalsContact O-N 3.1Å; L413-C416 PolarHBondContact O-N 3.48Å; C416-N418 VanDerWaalsContact C-N 3.33Å; C416-N418 PolarHBondContact O-N 3.3Å; C416-E419 PolarHBondContact O-N 3.32Å; C416-K420 WeakPolarHBondContact O-CB 3.47Å; C416-K420 VanDerWaalsContact O-CG 3.26Å; C416-K420 WeakPolarHBondContact O-CG 3.23Å; C416-K420 PolarHBondContact O-N 2.93Å
417	L	95.6	Very high	95.7	Very high	4 Å²	4	53.2 Å²	53.2	2%	0.021	29%	0.285	C	S	.	.	H	α-helix	trans	-62.7	-37.1	-178.8	-73.7	178.8	0	0	0	112.6	L413 L414 E419 K420 I421 P576 F577	L413-L417 HydrophobicContact CD1-CD1 4.24Å; L413-L417 HydrophobicContact CD1-CG 4.23Å; L413-L417 HydrophobicContact CG-CD1 4.02Å; L413-L417 HydrophobicContact CG-CG 4.4Å; L413-L417 WeakPolarHBondContact O-CB 3.35Å; L413-L417 VanDerWaalsContact O-CG 3.25Å; L413-L417 WeakPolarHBondContact O-CG 3.18Å; L413-L417 PolarHBondContact O-N 3.15Å; L414-L417 PolarHBondContact O-N 2.91Å; L417-E419 VanDerWaalsContact C-N 3.28Å; L417-E419 PolarHBondContact O-N 3.35Å; L417-K420 PolarHBondContact O-N 2.81Å; L417-I421 HydrophobicContact CB-CD1 3.99Å; L417-I421 HydrophobicContact CB-CG1 4.41Å; L417-I421 VanDerWaalsContact O-CB 3.24Å; L417-I421 WeakPolarHBondContact O-CB 3.36Å; L417-I421 WeakPolarHBondContact O-CD1 3.47Å; L417-I421 WeakPolarHBondContact O-CG1 3.25Å; L417-I421 PolarHBondContact O-N 3.34Å; L417-P576 HydrophobicContact CD2-CB 4.03Å; L417-P576 HydrophobicContact CD2-CG 4.06Å; L417-F577 HydrophobicContact CD1-CE2 4.44Å; L417-F577 HydrophobicContact CD2-CE2 3.71Å; L417-F577 HydrophobicContact CD2-CZ 3.8Å; L417-F577 HydrophobicContact CG-CE2 4.5Å
418	N	95.7	Very high	95.8	Very high	104 Å²	104	51.1 Å²	51.1	56%	0.556	27%	0.273	S	S	*	.	H	α-helix	trans	-62.4	-35.5	178.3	-76.1	-31.1	0	0	0	112	L414 D415 C416 P422	L414-N418 VanDerWaalsContact O-CB 3.27Å; L414-N418 WeakPolarHBondContact O-CB 3.38Å; L414-N418 PolarHBondContact O-N 2.86Å; L414-N418 PolarHBondContact O-ND2 3.36Å; L414-N418 VanDerWaalsContact O-ND2 3.08Å; D415-N418 PolarHBondContact O-N 2.86Å; C416-N418 VanDerWaalsContact C-N 3.33Å; C416-N418 PolarHBondContact O-N 3.3Å; N418-P422 VanDerWaalsContact O-CD 3.23Å; N418-P422 WeakPolarHBondContact O-CD 3.28Å
419	E	94.9	Very high	95.8	Very high	103 Å²	103	54.6 Å²	54.6	48%	0.481	28%	0.278	S	S	.	.	H	α-helix	trans	-75.7	-38.6	174.1	-166.9	-171.8	156.7	0	0	112.4	D415 C416 L417 R423	D415-E419 PolarHBondContact O-N 3.18Å; C416-E419 PolarHBondContact O-N 3.32Å; L417-E419 VanDerWaalsContact C-N 3.28Å; L417-E419 PolarHBondContact O-N 3.35Å; E419-R423 IonicContact OE1-CZ 3.29Å; E419-R423 IonicContact OE1-NH2 2.74Å; E419-R423 PolarHBondContact OE1-NH2 3.43Å
420	K	94.8	Very high	95.8	Very high	2 Å²	2	57.8 Å²	57.8	1%	0.009	29%	0.293	C	S	.	.	H	α-helix	trans	-84.3	-34.7	-171.7	-65.5	-47.5	179.2	168.5	0	113.9	C416 L417 R423 I424 L532 F533 D535	C416-K420 WeakPolarHBondContact O-CB 3.47Å; C416-K420 VanDerWaalsContact O-CG 3.26Å; C416-K420 WeakPolarHBondContact O-CG 3.23Å; C416-K420 PolarHBondContact O-N 2.93Å; L417-K420 PolarHBondContact O-N 2.81Å; K420-R423 WeakPolarHBondContact O-CB 3.46Å; K420-R423 PolarHBondContact O-N 3.14Å; K420-I424 WeakPolarHBondContact O-CG1 3.48Å; K420-I424 PolarHBondContact O-N 3.47Å; K420-L532 HydrophobicContact CB-CD2 3.74Å; K420-L532 HydrophobicContact CD-CD2 3.68Å; K420-L532 HydrophobicContact CD-CG 4.42Å; K420-L532 WeakPolarHBondContact CE-O 3.44Å; K420-L532 HydrophobicContact CG-CD2 3.86Å; K420-L532 PolarHBondContact NZ-O 2.97Å; K420-F533 HydrophobicContact CB-CE1 4.24Å; K420-F533 HydrophobicContact CB-CZ 4.27Å; K420-F533 HydrophobicContact CG-CD1 4.4Å; K420-F533 HydrophobicContact CG-CE1 3.91Å; K420-F533 HydrophobicContact CG-CZ 4.4Å; K420-D535 IonicContact NZ-OD1 3.77Å; K420-D535 PolarHBondContact NZ-OD1 3.44Å; K420-D535 IonicContact NZ-OD2 3.21Å; K420-D535 PolarHBondContact NZ-OD2 3.33Å
421	I	96.2	Very high	95.9	Very high	50 Å²	50	56.4 Å²	56.4	26%	0.256	28%	0.284	S	S	.	.	H	α-helix	trans	-54.1	-47.7	-178.8	-75.9	165	0	0	0	112.4	L417 R423 I424 D425 P576	L417-I421 HydrophobicContact CB-CD1 3.99Å; L417-I421 HydrophobicContact CB-CG1 4.41Å; L417-I421 VanDerWaalsContact O-CB 3.24Å; L417-I421 WeakPolarHBondContact O-CB 3.36Å; L417-I421 WeakPolarHBondContact O-CD1 3.47Å; L417-I421 WeakPolarHBondContact O-CG1 3.25Å; L417-I421 PolarHBondContact O-N 3.34Å; I421-R423 PolarHBondContact O-N 2.99Å; I421-I424 WeakPolarHBondContact O-CB 3.07Å; I421-I424 PolarHBondContact O-N 2.91Å; I421-I424 VanDerWaalsContact O-N 3.1Å; I421-D425 PolarHBondContact O-N 2.78Å; I421-P576 HydrophobicContact CD1-CG 3.97Å; I421-P576 HydrophobicContact CG1-CB 4.1Å; I421-P576 HydrophobicContact CG1-CG 3.86Å
422	P	96.6	Very high	95.9	Very high	70 Å²	70	53.4 Å²	53.4	46%	0.455	27%	0.268	S	S	.	.	H	α-helix	trans	-58.3	-33.7	177.5	-26.5	35.3	0	0	0	113.4	N418 V426	N418-P422 VanDerWaalsContact O-CD 3.23Å; N418-P422 WeakPolarHBondContact O-CD 3.28Å; P422-V426 WeakPolarHBondContact O-CG2 3.22Å; P422-V426 PolarHBondContact O-N 3.25Å
423	R	95.6	Very high	96	Very high	120 Å²	120	54.1 Å²	54.1	45%	0.453	27%	0.268	S	S	.	.	H	α-helix	trans	-72.9	-41.6	176.5	-56.2	-174.6	-168.3	-177.8	7.4	111.1	E419 K420 I421 D425 V426 L427 L532	E419-R423 IonicContact OE1-CZ 3.29Å; E419-R423 IonicContact OE1-NH2 2.74Å; E419-R423 PolarHBondContact OE1-NH2 3.43Å; K420-R423 WeakPolarHBondContact O-CB 3.46Å; K420-R423 PolarHBondContact O-N 3.14Å; I421-R423 PolarHBondContact O-N 2.99Å; R423-D425 VanDerWaalsContact C-N 3.32Å; R423-D425 PolarHBondContact O-N 2.9Å; R423-V426 PolarHBondContact O-N 3.39Å; R423-L427 PolarHBondContact O-N 3.36Å; R423-L532 HydrophobicContact CB-CD1 3.91Å
424	I	96.4	Very high	96	Very high	3 Å²	3	55.7 Å²	55.7	2%	0.015	28%	0.275	C	S	.	.	H	α-helix	trans	-59.1	-44.3	173.3	-63.5	170.2	0	0	0	110.2	K420 I421 V426 L427 E428 L532 F533 P576 L580	K420-I424 WeakPolarHBondContact O-CG1 3.48Å; K420-I424 PolarHBondContact O-N 3.47Å; I421-I424 WeakPolarHBondContact O-CB 3.07Å; I421-I424 PolarHBondContact O-N 2.91Å; I421-I424 VanDerWaalsContact O-N 3.1Å; I424-V426 VanDerWaalsContact C-N 3.28Å; I424-V426 PolarHBondContact O-N 3.39Å; I424-L427 PolarHBondContact O-N 3.47Å; I424-E428 WeakPolarHBondContact O-CB 3.16Å; I424-E428 PolarHBondContact O-N 3.45Å; I424-L532 HydrophobicContact CD1-CD2 4.43Å; I424-L532 HydrophobicContact CG1-CD1 3.81Å; I424-L532 HydrophobicContact CG1-CD2 4.18Å; I424-F533 HydrophobicContact CD1-CE2 4.47Å; I424-F533 HydrophobicContact CD1-CZ 4.34Å; I424-P576 HydrophobicContact CD1-CB 3.87Å; I424-L580 HydrophobicContact CG1-CD1 4.35Å
425	D	96.5	Very high	96	Very high	53 Å²	53	53.1 Å²	53.1	28%	0.283	26%	0.261	S	S	.	.	H	α-helix	trans	-63.4	-30.5	177.9	-70.3	-21.5	0	0	0	113	I421 R423 R429 R579	I421-D425 PolarHBondContact O-N 2.78Å; R423-D425 VanDerWaalsContact C-N 3.32Å; R423-D425 PolarHBondContact O-N 2.9Å; D425-R429 WeakPolarHBondContact O-CB 3.38Å; D425-R429 VanDerWaalsContact O-CG 3.28Å; D425-R429 WeakPolarHBondContact O-CG 3.21Å; D425-R429 PolarHBondContact O-N 3.37Å; D425-R429 PolarHBondContact O-NE 3.48Å; D425-R579 IonicContact OD1-CZ 3.28Å; D425-R579 IonicContact OD1-NH1 3.23Å; D425-R579 PolarHBondContact OD1-NH1 3.19Å; D425-R579 IonicContact OD1-NH2 2.75Å; D425-R579 PolarHBondContact OD1-NH2 3.3Å
426	V	96.7	Very high	96.1	Very high	75 Å²	75	50.7 Å²	50.7	46%	0.455	25%	0.246	S	C	.	.	H	α-helix	trans	-71.5	-47.9	173.2	171.9	0	0	0	0	110.6	P422 R423 I424 E428 R429 E430	P422-V426 WeakPolarHBondContact O-CG2 3.22Å; P422-V426 PolarHBondContact O-N 3.25Å; R423-V426 PolarHBondContact O-N 3.39Å; I424-V426 VanDerWaalsContact C-N 3.28Å; I424-V426 PolarHBondContact O-N 3.39Å; V426-E428 PolarHBondContact O-N 3.21Å; V426-R429 VanDerWaalsContact CG2-NH2 3.31Å; V426-R429 PolarHBondContact O-N 3Å; V426-E430 PolarHBondContact O-N 3.28Å
427	L	96.1	Very high	96.2	Very high	21 Å²	21	56.9 Å²	56.9	11%	0.11	27%	0.267	C	S	.	.	H	α-helix	trans	-61.6	-43.5	179.1	-70.8	175.9	0	0	0	111.8	R423 I424 R429 E430 A431 L532 L580 L583	R423-L427 PolarHBondContact O-N 3.36Å; I424-L427 PolarHBondContact O-N 3.47Å; L427-R429 PolarHBondContact O-N 2.85Å; L427-E430 PolarHBondContact O-N 2.85Å; L427-A431 WeakPolarHBondContact O-CB 3.33Å; L427-A431 PolarHBondContact O-N 2.78Å; L427-L532 HydrophobicContact CD1-CD1 3.84Å; L427-L580 HydrophobicContact CD1-CD1 4.33Å; L427-L583 HydrophobicContact CB-CD2 4.13Å
428	E	95.7	Very high	96.1	Very high	41 Å²	41	59 Å²	59	19%	0.192	28%	0.275	C	S	.	.	H	α-helix	trans	-62.8	-42.9	177.4	-174	177.5	165	0	0	111.7	I424 V426 A431 M432 R579 L583	I424-E428 WeakPolarHBondContact O-CB 3.16Å; I424-E428 PolarHBondContact O-N 3.45Å; V426-E428 PolarHBondContact O-N 3.21Å; E428-A431 PolarHBondContact O-N 3.21Å; E428-M432 VanDerWaalsContact O-CB 3.32Å; E428-M432 WeakPolarHBondContact O-CB 3.46Å; E428-M432 PolarHBondContact O-N 3.32Å; E428-R579 IonicContact OE2-CZ 2.83Å; E428-R579 IonicContact OE2-NE 3.65Å; E428-R579 PolarHBondContact OE2-NE 3.33Å; E428-R579 IonicContact OE2-NH2 3.58Å; E428-R579 PolarHBondContact OE2-NH2 3.46Å; E428-L583 HydrophobicContact CB-CD1 4.36Å
429	R	96.3	Very high	96.1	Very high	150 Å²	150	54.3 Å²	54.3	57%	0.566	25%	0.25	S	S	*	.	H	α-helix	trans	-62.4	-44.3	174.5	-79	-177.9	-68.2	154.9	-5.7	111.9	D425 V426 L427 A431 M432 D433	D425-R429 WeakPolarHBondContact O-CB 3.38Å; D425-R429 VanDerWaalsContact O-CG 3.28Å; D425-R429 WeakPolarHBondContact O-CG 3.21Å; D425-R429 PolarHBondContact O-N 3.37Å; D425-R429 PolarHBondContact O-NE 3.48Å; V426-R429 VanDerWaalsContact CG2-NH2 3.31Å; V426-R429 PolarHBondContact O-N 3Å; L427-R429 PolarHBondContact O-N 2.85Å; R429-A431 VanDerWaalsContact C-N 3.33Å; R429-A431 PolarHBondContact O-N 3.04Å; R429-M432 PolarHBondContact O-N 3.25Å; R429-D433 VanDerWaalsContact O-CB 3.25Å; R429-D433 WeakPolarHBondContact O-CB 3.5Å; R429-D433 PolarHBondContact O-N 3.1Å
430	E	96	Very high	96.2	Very high	76 Å²	76	52.9 Å²	52.9	36%	0.355	25%	0.246	S	C	.	.	H	α-helix	trans	-59.1	-46.2	176.8	-172.2	-171.9	157.8	0	0	111.4	V426 L427 Y434 K521	V426-E430 PolarHBondContact O-N 3.28Å; L427-E430 PolarHBondContact O-N 2.85Å; E430-Y434 WeakPolarHBondContact O-CB 3.05Å; E430-Y434 PolarHBondContact O-N 3.34Å; E430-K521 IonicContact OE1-NZ 3.12Å
431	A	96.3	Very high	96.2	Very high	2 Å²	2	56.9 Å²	56.9	2%	0.017	26%	0.262	C	S	.	.	H	α-helix	trans	-63.4	-47.2	178.9	0	0	0	0	0	111.9	L427 E428 R429 Y434 L435 W525 L583	L427-A431 WeakPolarHBondContact O-CB 3.33Å; L427-A431 PolarHBondContact O-N 2.78Å; E428-A431 PolarHBondContact O-N 3.21Å; R429-A431 VanDerWaalsContact C-N 3.33Å; R429-A431 PolarHBondContact O-N 3.04Å; A431-Y434 PolarHBondContact O-N 3.24Å; A431-L435 WeakPolarHBondContact O-CG 3.31Å; A431-L435 PolarHBondContact O-N 3.42Å; A431-W525 HydrophobicContact CB-CD2 3.95Å; A431-W525 HydrophobicContact CB-CE3 4.01Å; A431-W525 HydrophobicContact CB-CH2 4.16Å; A431-W525 HydrophobicContact CB-CZ2 4.09Å; A431-W525 HydrophobicContact CB-CZ3 4.11Å; A431-L583 HydrophobicContact CB-CD1 3.6Å; A431-L583 HydrophobicContact CB-CG 4.2Å
432	M	96.6	Very high	96.1	Very high	14 Å²	14	55 Å²	55	7%	0.069	25%	0.252	C	S	.	.	H	α-helix	trans	-64.1	-43.9	179.2	-168.1	62.4	65.8	0	0	111.8	E428 R429 Y434 L435 Q436 L634 E637 L638 K641 V642	E428-M432 VanDerWaalsContact O-CB 3.32Å; E428-M432 WeakPolarHBondContact O-CB 3.46Å; E428-M432 PolarHBondContact O-N 3.32Å; R429-M432 PolarHBondContact O-N 3.25Å; M432-Y434 VanDerWaalsContact C-N 3.32Å; M432-Y434 PolarHBondContact O-N 3.42Å; M432-L435 PolarHBondContact O-N 3.05Å; M432-Q436 WeakPolarHBondContact O-CB 3.31Å; M432-Q436 PolarHBondContact O-N 2.98Å; M432-L634 HydrophobicContact CE-CD1 3.81Å; M432-E637 HydrophobicContact CE-CB 4.05Å; M432-E637 HydrophobicContact SD-CB 4.49Å; M432-L638 HydrophobicContact CE-CD2 3.92Å; M432-L638 HydrophobicContact CE-CG 4.15Å; M432-L638 HydrophobicContact SD-CD2 3.94Å; M432-K641 HydrophobicContact CG-CD 3.76Å; M432-K641 HydrophobicContact SD-CD 4.42Å; M432-V642 HydrophobicContact SD-CG2 3.99Å
433	D	96.8	Very high	95.9	Very high	60 Å²	60	53.3 Å²	53.3	32%	0.321	24%	0.238	S	C	.	.	H	α-helix	trans	-62.8	-39.1	176.9	-76.9	-0.6	0	0	0	111.4	R429 Q436 R437	R429-D433 VanDerWaalsContact O-CB 3.25Å; R429-D433 WeakPolarHBondContact O-CB 3.5Å; R429-D433 PolarHBondContact O-N 3.1Å; D433-Q436 PolarHBondContact O-N 3.34Å; D433-R437 VanDerWaalsContact O-CG 3.28Å; D433-R437 WeakPolarHBondContact O-CG 3.49Å; D433-R437 PolarHBondContact O-N 3.37Å; D433-R437 IonicContact OD2-NH2 2.65Å
434	Y	96.7	Very high	95.9	Very high	34 Å²	34	52.9 Å²	52.9	13%	0.133	24%	0.242	C	C	.	.	H	α-helix	trans	-64.4	-46.3	175.3	-173.3	-79.6	0	0	0	111.6	E430 A431 M432 Q436 R437 R438 F518 K521 W525	E430-Y434 WeakPolarHBondContact O-CB 3.05Å; E430-Y434 PolarHBondContact O-N 3.34Å; A431-Y434 PolarHBondContact O-N 3.24Å; M432-Y434 VanDerWaalsContact C-N 3.32Å; M432-Y434 PolarHBondContact O-N 3.42Å; Y434-Q436 VanDerWaalsContact C-N 3.31Å; Y434-Q436 PolarHBondContact O-N 3.22Å; Y434-R437 PolarHBondContact O-N 3.47Å; Y434-R438 PolarHBondContact O-N 3.45Å; Y434-F518 HydrophobicContact CD1-CD2 4.27Å; Y434-F518 AromaticContact CE1-CD2 3.67Å; Y434-F518 HydrophobicContact CE1-CD2 3.67Å; Y434-F518 HydrophobicContact CE1-CE2 4.38Å; Y434-K521 HydrophobicContact CD2-CG 4.26Å; Y434-K521 HydrophobicContact CE2-CB 4.39Å; Y434-K521 HydrophobicContact CE2-CD 4.37Å; Y434-K521 HydrophobicContact CE2-CG 3.74Å; Y434-W525 AromaticContact CD1-CH2 3.76Å; Y434-W525 HydrophobicContact CD1-CH2 3.76Å; Y434-W525 HydrophobicContact CD1-CZ2 4.2Å; Y434-W525 HydrophobicContact CD2-CZ2 4.48Å; Y434-W525 AromaticContact CG-CH2 3.87Å; Y434-W525 HydrophobicContact CG-CH2 3.87Å; Y434-W525 AromaticContact CG-CZ2 3.84Å; Y434-W525 HydrophobicContact CG-CZ2 3.84Å
435	L	96	Very high	95.8	Very high	7 Å²	7	54.1 Å²	54.1	4%	0.037	25%	0.246	C	C	.	.	H	α-helix	trans	-61.2	-40.7	176.6	-69.7	174.3	0	0	0	111.6	A431 M432 R438 S439 F518 L638 V642	A431-L435 WeakPolarHBondContact O-CG 3.31Å; A431-L435 PolarHBondContact O-N 3.42Å; M432-L435 PolarHBondContact O-N 3.05Å; L435-R438 PolarHBondContact O-N 3.5Å; L435-S439 PolarHBondContact O-N 3.11Å; L435-F518 HydrophobicContact CD2-CE2 3.63Å; L435-F518 HydrophobicContact CD2-CZ 4Å; L435-L638 HydrophobicContact CD1-CD2 4.16Å; L435-V642 HydrophobicContact CB-CG1 4.13Å; L435-V642 HydrophobicContact CB-CG2 3.65Å
436	Q	97.2	Very high	95.6	Very high	58 Å²	58	53.4 Å²	53.4	27%	0.271	24%	0.241	S	C	.	.	H	α-helix	trans	-61.1	-51.1	174.4	-177.5	172.5	1.2	0	0	111.4	M432 D433 Y434 R438 S439 D440 K641	M432-Q436 WeakPolarHBondContact O-CB 3.31Å; M432-Q436 PolarHBondContact O-N 2.98Å; D433-Q436 PolarHBondContact O-N 3.34Å; Y434-Q436 VanDerWaalsContact C-N 3.31Å; Y434-Q436 PolarHBondContact O-N 3.22Å; Q436-R438 PolarHBondContact O-N 3.47Å; Q436-S439 CarbonylContact O-C 3.57Å; Q436-S439 WeakPolarHBondContact O-CA 3.42Å; Q436-S439 WeakPolarHBondContact O-CB 3.22Å; Q436-S439 PolarHBondContact O-N 2.98Å; Q436-D440 PolarHBondContact O-N 3.33Å; Q436-K641 HydrophobicContact CB-CB 4.17Å; Q436-K641 HydrophobicContact CG-CB 4.15Å
437	R	96.7	Very high	95.5	Very high	147 Å²	147	54.2 Å²	54.2	56%	0.555	24%	0.238	S	C	*	.	H	α-helix	trans	-57	-37.6	176.9	-72.2	178.2	-159	109.7	3.7	112.3	D433 Y434 Y441	D433-R437 VanDerWaalsContact O-CG 3.28Å; D433-R437 WeakPolarHBondContact O-CG 3.49Å; D433-R437 PolarHBondContact O-N 3.37Å; D433-R437 IonicContact OD2-NH2 2.65Å; Y434-R437 PolarHBondContact O-N 3.47Å; R437-Y441 WeakPolarHBondContact O-CB 3.17Å; R437-Y441 PolarHBondContact O-N 3.33Å
438	R	94.9	Very high	95.4	Very high	48 Å²	48	55.2 Å²	55.2	18%	0.181	25%	0.245	C	C	.	.	H	α-helix	trans	-64.8	-42.6	174.8	-176.1	177.1	174.9	-149	-4	111.1	Y434 L435 Q436 Y441 F442 D510 F518 E589	Y434-R438 PolarHBondContact O-N 3.45Å; L435-R438 PolarHBondContact O-N 3.5Å; Q436-R438 PolarHBondContact O-N 3.47Å; R438-Y441 WeakPolarHBondContact O-CB 3.34Å; R438-F442 HydrophobicContact CG-CE2 4.1Å; R438-F442 WeakPolarHBondContact O-CD2 3.31Å; R438-D510 IonicContact CZ-OD2 2.66Å; R438-D510 IonicContact NE-OD2 3.94Å; R438-D510 PolarHBondContact NE-OD2 3.28Å; R438-D510 VanDerWaalsContact NE-OD2 3.09Å; R438-D510 IonicContact NH2-OD2 3.85Å; R438-D510 PolarHBondContact NH2-OD2 3.26Å; R438-F518 VanDerWaalsContact NH1-CD1 3.31Å; R438-E589 IonicContact CZ-OE1 3.72Å; R438-E589 IonicContact NH1-OE1 3.9Å; R438-E589 PolarHBondContact NH1-OE1 3.3Å
439	S	95.2	Very high	95.3	Very high	6 Å²	6	54 Å²	54	4%	0.042	24%	0.24	C	C	.	.	H	α-helix	trans	-64.3	-49.2	175.5	-170.6	0	0	0	0	112.4	L435 Q436 Y441 F442 I443 V642 R644	L435-S439 PolarHBondContact O-N 3.11Å; Q436-S439 CarbonylContact O-C 3.57Å; Q436-S439 WeakPolarHBondContact O-CA 3.42Å; Q436-S439 WeakPolarHBondContact O-CB 3.22Å; Q436-S439 PolarHBondContact O-N 2.98Å; S439-Y441 PolarHBondContact O-N 3.37Å; S439-F442 WeakPolarHBondContact O-CB 3.43Å; S439-F442 PolarHBondContact O-N 2.76Å; S439-I443 PolarHBondContact O-N 3.45Å; S439-I443 VanDerWaalsContact O-N 3.14Å; S439-V642 WeakPolarHBondContact CB-O 3.08Å; S439-V642 PolarHBondContact OG-O 2.62Å; S439-R644 WeakPolarHBondContact OG-CD 3.4Å; S439-R644 WeakPolarHBondContact OG-CG 3.29Å
440	D	95.8	Very high	95.1	Very high	73 Å²	73	47.9 Å²	47.9	39%	0.39	22%	0.218	S	C	.	.	H	α-helix	trans	-58.3	-37.1	178.7	-71.2	-24.5	0	0	0	111.8	Q436 F442 I443 Q444	Q436-D440 PolarHBondContact O-N 3.33Å; D440-F442 VanDerWaalsContact C-N 3.31Å; D440-F442 PolarHBondContact O-N 2.88Å; D440-I443 PolarHBondContact O-N 3.28Å; D440-Q444 VanDerWaalsContact O-CB 3.27Å; D440-Q444 WeakPolarHBondContact O-CB 3.27Å; D440-Q444 PolarHBondContact O-N 2.78Å
441	Y	95.3	Very high	95	Very high	87 Å²	87	48.3 Å²	48.3	34%	0.341	22%	0.223	S	C	.	.	H	α-helix	trans	-56.7	-43.1	173.1	169.5	-96.8	0	0	0	112.4	R437 R438 S439 R445	R437-Y441 WeakPolarHBondContact O-CB 3.17Å; R437-Y441 PolarHBondContact O-N 3.33Å; R438-Y441 WeakPolarHBondContact O-CB 3.34Å; S439-Y441 PolarHBondContact O-N 3.37Å; Y441-R445 WeakPolarHBondContact O-CB 3.48Å; Y441-R445 PolarHBondContact O-N 2.77Å
442	F	94.1	Very high	94.8	Very high	10 Å²	10	48.7 Å²	48.7	4%	0.044	23%	0.225	C	C	.	.	H	α-helix	trans	-68.5	-43.1	177.7	-73.8	-76	0	0	0	112.3	R438 S439 D440 Q444 R445 Q446 D510	R438-F442 HydrophobicContact CG-CE2 4.1Å; R438-F442 WeakPolarHBondContact O-CD2 3.31Å; S439-F442 WeakPolarHBondContact O-CB 3.43Å; S439-F442 PolarHBondContact O-N 2.76Å; D440-F442 VanDerWaalsContact C-N 3.31Å; D440-F442 PolarHBondContact O-N 2.88Å; F442-Q444 VanDerWaalsContact C-N 3.35Å; F442-R445 VanDerWaalsContact CD1-NH2 3.31Å; F442-R445 PolarHBondContact O-N 2.94Å; F442-Q446 WeakPolarHBondContact O-CB 3.5Å; F442-Q446 PolarHBondContact O-N 3.28Å; F442-D510 VanDerWaalsContact CZ-CG 3.42Å; F442-D510 WeakPolarHBondContact CZ-OD1 3.28Å; F442-D510 WeakPolarHBondContact CZ-OD2 3.3Å
443	I	93.8	Very high	94.6	Very high	34 Å²	34	48.5 Å²	48.5	17%	0.174	22%	0.224	C	C	.	.	H	α-helix	trans	-61.7	-46.8	178.2	-63.1	171.1	0	0	0	109.5	S439 D440 Q446 K447 R644	S439-I443 PolarHBondContact O-N 3.45Å; S439-I443 VanDerWaalsContact O-N 3.14Å; D440-I443 PolarHBondContact O-N 3.28Å; I443-Q446 WeakPolarHBondContact O-CB 3.09Å; I443-Q446 PolarHBondContact O-N 3.38Å; I443-K447 HydrophobicContact CG2-CD 4.4Å; I443-K447 WeakPolarHBondContact O-CG 3.46Å; I443-K447 PolarHBondContact O-N 3.01Å; I443-R644 HydrophobicContact CD1-CG 4.28Å; I443-R644 HydrophobicContact CG1-CG 4.17Å
444	Q	94.5	Very high	94.4	Very high	112 Å²	112	49.2 Å²	49.2	52%	0.523	22%	0.223	S	C	.	.	H	α-helix	trans	-65.5	-42.1	178.7	-171.6	62.2	10.8	0	0	111.9	D440 F442 Q446 K447 V448	D440-Q444 VanDerWaalsContact O-CB 3.27Å; D440-Q444 WeakPolarHBondContact O-CB 3.27Å; D440-Q444 PolarHBondContact O-N 2.78Å; F442-Q444 VanDerWaalsContact C-N 3.35Å; Q444-Q446 VanDerWaalsContact C-N 3.29Å; Q444-Q446 PolarHBondContact O-N 3.28Å; Q444-K447 PolarHBondContact O-N 3.08Å; Q444-V448 HydrophobicContact CG-CG2 4.48Å; Q444-V448 VanDerWaalsContact O-CG2 3.32Å; Q444-V448 WeakPolarHBondContact O-CG2 3.43Å; Q444-V448 PolarHBondContact O-N 3.41Å
445	R	94	Very high	94.2	Very high	29 Å²	29	50.6 Å²	50.6	11%	0.109	23%	0.232	C	C	.	.	H	α-helix	trans	-56.9	-43.9	173.9	-176.9	177.4	78.3	-178.5	3.4	111.3	Y441 F442 D449 R483 D507 E509	Y441-R445 WeakPolarHBondContact O-CB 3.48Å; Y441-R445 PolarHBondContact O-N 2.77Å; F442-R445 VanDerWaalsContact CD1-NH2 3.31Å; F442-R445 PolarHBondContact O-N 2.94Å; R445-D449 VanDerWaalsContact O-CB 3.26Å; R445-D449 WeakPolarHBondContact O-CB 3.41Å; R445-D449 PolarHBondContact O-N 3.42Å; R445-R483 VanDerWaalsContact NE-NH1 3.17Å; R445-D507 IonicContact CZ-OD2 3.37Å; R445-D507 VanDerWaalsContact CZ-OD2 3.31Å; R445-D507 IonicContact NE-OD2 2.95Å; R445-D507 PolarHBondContact NE-OD2 3.28Å; R445-D507 PolarHBondContact NH2-O 3.45Å; R445-D507 VanDerWaalsContact NH2-O 3.08Å; R445-D507 IonicContact NH2-OD1 3.2Å; R445-D507 IonicContact NH2-OD2 2.69Å; R445-D507 PolarHBondContact NH2-OD2 3.15Å; R445-E509 PolarHBondContact NH1-O 2.88Å; R445-E509 PolarHBondContact NH2-O 2.63Å
446	Q	92.6	Very high	93.8	Very high	37 Å²	37	52.2 Å²	52.2	17%	0.173	24%	0.241	C	C	.	.	H	α-helix	trans	-64.1	-45.2	176.7	177.6	-178.6	-28.5	0	0	111.9	F442 I443 Q444 D449 I450 E693	F442-Q446 WeakPolarHBondContact O-CB 3.5Å; F442-Q446 PolarHBondContact O-N 3.28Å; I443-Q446 WeakPolarHBondContact O-CB 3.09Å; I443-Q446 PolarHBondContact O-N 3.38Å; Q444-Q446 VanDerWaalsContact C-N 3.29Å; Q444-Q446 PolarHBondContact O-N 3.28Å; Q446-D449 PolarHBondContact O-N 2.93Å; Q446-I450 HydrophobicContact CG-CD1 3.92Å; Q446-I450 WeakPolarHBondContact O-CB 3.33Å; Q446-I450 VanDerWaalsContact O-CG1 3.26Å; Q446-I450 WeakPolarHBondContact O-CG1 3.37Å; Q446-I450 PolarHBondContact O-N 3.29Å; Q446-E693 PolarHBondContact NE2-OE2 2.86Å
447	K	93.8	Very high	93.5	Very high	93 Å²	93	49.7 Å²	49.7	40%	0.404	23%	0.23	S	C	.	.	H	α-helix	trans	-59.7	-47.1	176.9	-73.3	-179.5	178.1	-176.8	0	111.8	I443 Q444 I450 N451	I443-K447 HydrophobicContact CG2-CD 4.4Å; I443-K447 WeakPolarHBondContact O-CG 3.46Å; I443-K447 PolarHBondContact O-N 3.01Å; Q444-K447 PolarHBondContact O-N 3.08Å; K447-I450 PolarHBondContact O-N 3.19Å; K447-N451 WeakPolarHBondContact O-CB 3.24Å; K447-N451 PolarHBondContact O-N 2.96Å
448	V	94.1	Very high	93.2	Very high	42 Å²	42	45.7 Å²	45.7	26%	0.255	22%	0.218	S	C	.	.	H	α-helix	trans	-62.4	-45.4	176.2	174.5	0	0	0	0	110.9	Q444 I450 N451 D452	Q444-V448 HydrophobicContact CG-CG2 4.48Å; Q444-V448 VanDerWaalsContact O-CG2 3.32Å; Q444-V448 WeakPolarHBondContact O-CG2 3.43Å; Q444-V448 PolarHBondContact O-N 3.41Å; V448-I450 VanDerWaalsContact C-N 3.28Å; V448-I450 PolarHBondContact O-N 3.27Å; V448-N451 PolarHBondContact O-N 3.33Å; V448-D452 WeakPolarHBondContact O-CB 3.26Å; V448-D452 PolarHBondContact O-N 3.21Å
449	D	93.8	Very high	92.9	Very high	14 Å²	14	45 Å²	45	8%	0.075	22%	0.223	C	C	.	.	H	α-helix	trans	-60.4	-35.9	177.6	-80.6	-21.9	0	0	0	112.8	R445 Q446 Q453 R483	R445-D449 VanDerWaalsContact O-CB 3.26Å; R445-D449 WeakPolarHBondContact O-CB 3.41Å; R445-D449 PolarHBondContact O-N 3.42Å; Q446-D449 PolarHBondContact O-N 2.93Å; D449-Q453 VanDerWaalsContact O-CG 3.28Å; D449-Q453 WeakPolarHBondContact O-CG 3.11Å; D449-Q453 PolarHBondContact O-N 3.44Å; D449-Q453 PolarHBondContact O-NE2 2.88Å; D449-R483 IonicContact OD1-NH2 2.88Å; D449-R483 PolarHBondContact OD1-NH2 3.25Å; D449-R483 IonicContact OD2-CZ 2.63Å; D449-R483 VanDerWaalsContact OD2-CZ 3.28Å; D449-R483 IonicContact OD2-NH1 3.91Å; D449-R483 PolarHBondContact OD2-NH1 3.46Å; D449-R483 IonicContact OD2-NH2 2.79Å; D449-R483 PolarHBondContact OD2-NH2 2.89Å
450	I	93.2	Very high	92.5	Very high	23 Å²	23	45.7 Å²	45.7	12%	0.118	23%	0.227	C	C	.	.	H	α-helix	trans	-72.3	-46.8	176.6	-70.5	170.3	0	0	0	110.2	Q446 K447 V448 Q453 Y454 F695 F714	Q446-I450 HydrophobicContact CG-CD1 3.92Å; Q446-I450 WeakPolarHBondContact O-CB 3.33Å; Q446-I450 VanDerWaalsContact O-CG1 3.26Å; Q446-I450 WeakPolarHBondContact O-CG1 3.37Å; Q446-I450 PolarHBondContact O-N 3.29Å; K447-I450 PolarHBondContact O-N 3.19Å; V448-I450 VanDerWaalsContact C-N 3.28Å; V448-I450 PolarHBondContact O-N 3.27Å; I450-Q453 PolarHBondContact O-N 2.89Å; I450-Y454 PolarHBondContact O-N 3.24Å; I450-F695 HydrophobicContact CG2-CB 4.35Å; I450-F695 HydrophobicContact CG2-CD1 3.61Å; I450-F695 HydrophobicContact CG2-CE1 4.29Å; I450-F695 HydrophobicContact CG2-CG 4.28Å; I450-F714 HydrophobicContact CG2-CE2 4.47Å; I450-F714 HydrophobicContact CG2-CZ 4.09Å
451	N	93.5	Very high	92	Very high	85 Å²	85	44 Å²	44	46%	0.455	22%	0.224	S	C	.	.	H	α-helix	trans	-62.1	-48.6	179.1	-169.9	76.9	0	0	0	111.7	K447 V448 Q453 Y454 D455	K447-N451 WeakPolarHBondContact O-CB 3.24Å; K447-N451 PolarHBondContact O-N 2.96Å; V448-N451 PolarHBondContact O-N 3.33Å; N451-Q453 VanDerWaalsContact C-N 3.26Å; N451-Q453 PolarHBondContact O-N 3.07Å; N451-Y454 PolarHBondContact O-N 3.17Å; N451-Y454 VanDerWaalsContact O-N 3.08Å; N451-D455 PolarHBondContact ND2-OD2 3.1Å; N451-D455 WeakPolarHBondContact O-CB 3.2Å; N451-D455 PolarHBondContact O-N 3.17Å
452	D	92.9	Very high	91.6	Very high	9 Å²	9	43.8 Å²	43.8	5%	0.048	24%	0.235	C	C	.	.	H	α-helix	trans	-55.6	-43	177.4	-82	-20.3	0	0	0	111.3	V448 D456 K473 R476	V448-D452 WeakPolarHBondContact O-CB 3.26Å; V448-D452 PolarHBondContact O-N 3.21Å; D452-D456 WeakPolarHBondContact O-CB 3.38Å; D452-D456 PolarHBondContact O-N 2.97Å; D452-K473 WeakPolarHBondContact OD1-CE 3.48Å; D452-K473 IonicContact OD1-NZ 3.62Å; D452-R476 IonicContact OD2-NE 3.13Å
453	Q	92.2	Very high	90.9	Very high	10 Å²	10	46.5 Å²	46.5	5%	0.047	27%	0.265	C	S	.	.	H	α-helix	trans	-67.8	-40.4	177.2	-77.6	175.7	97	0	0	113.3	D449 I450 N451 D456 C457 F714	D449-Q453 VanDerWaalsContact O-CG 3.28Å; D449-Q453 WeakPolarHBondContact O-CG 3.11Å; D449-Q453 PolarHBondContact O-N 3.44Å; D449-Q453 PolarHBondContact O-NE2 2.88Å; I450-Q453 PolarHBondContact O-N 2.89Å; N451-Q453 VanDerWaalsContact C-N 3.26Å; N451-Q453 PolarHBondContact O-N 3.07Å; Q453-D456 PolarHBondContact O-N 3.4Å; Q453-C457 PolarHBondContact O-N 2.66Å; Q453-C457 PolarHBondContact O-SG 3.5Å; Q453-F714 HydrophobicContact CB-CD2 3.52Å; Q453-F714 HydrophobicContact CB-CE2 3.42Å; Q453-F714 VanDerWaalsContact CB-CE2 3.42Å; Q453-F714 HydrophobicContact CB-CG 4.3Å; Q453-F714 HydrophobicContact CB-CZ 4.16Å; Q453-F714 HydrophobicContact CG-CD2 4.22Å; Q453-F714 HydrophobicContact CG-CE2 4.32Å
454	Y	92.6	Very high	90	Very high	76 Å²	76	48.9 Å²	48.9	30%	0.298	28%	0.278	S	S	.	.	H	α-helix	trans	-63.4	-47.6	177.2	179	-103.2	0	0	0	110.5	I450 N451 D456 C457 M458 F695 P697 F699 F714	I450-Y454 PolarHBondContact O-N 3.24Å; N451-Y454 PolarHBondContact O-N 3.17Å; N451-Y454 VanDerWaalsContact O-N 3.08Å; Y454-D456 VanDerWaalsContact C-N 3.33Å; Y454-D456 PolarHBondContact O-N 3.03Å; Y454-C457 WeakPolarHBondContact O-CB 3.34Å; Y454-C457 PolarHBondContact O-N 3.13Å; Y454-C457 VanDerWaalsContact O-N 3.13Å; Y454-M458 HydrophobicContact CD1-CG 4.28Å; Y454-M458 HydrophobicContact CE1-CG 3.88Å; Y454-M458 HydrophobicContact CE2-CG 4.13Å; Y454-M458 HydrophobicContact CE2-SD 4.33Å; Y454-M458 WeakPolarHBondContact O-CG 3.44Å; Y454-M458 PolarHBondContact O-N 3.22Å; Y454-F695 AromaticContact CD2-CE1 3.82Å; Y454-F695 HydrophobicContact CD2-CE1 3.82Å; Y454-F695 AromaticContact CD2-CZ 3.76Å; Y454-F695 HydrophobicContact CD2-CZ 3.76Å; Y454-F695 HydrophobicContact CE2-CE1 4.46Å; Y454-F695 AromaticContact CE2-CZ 3.99Å; Y454-F695 HydrophobicContact CE2-CZ 3.99Å; Y454-F695 HydrophobicContact CG-CE1 4.13Å; Y454-F695 HydrophobicContact CG-CZ 4.14Å; Y454-P697 HydrophobicContact CD2-CB 4.26Å; Y454-P697 HydrophobicContact CE2-CB 4.07Å; Y454-F699 HydrophobicContact CD2-CE1 4.2Å; Y454-F699 AromaticContact CD2-CZ 3.91Å; Y454-F699 HydrophobicContact CD2-CZ 3.91Å; Y454-F699 AromaticContact CE2-CE1 3.91Å; Y454-F699 HydrophobicContact CE2-CE1 3.91Å; Y454-F699 HydrophobicContact CE2-CZ 4.01Å; Y454-F714 HydrophobicContact CD2-CE1 4.06Å
455	D	91.1	Very high	88.7	Confident	63 Å²	63	50.2 Å²	50.2	34%	0.337	28%	0.282	S	S	.	.	H	α-helix	trans	-60.2	-41.9	176.9	-69	-17	0	0	0	111.7	N451 C457 M458 A459	N451-D455 PolarHBondContact ND2-OD2 3.1Å; N451-D455 WeakPolarHBondContact O-CB 3.2Å; N451-D455 PolarHBondContact O-N 3.17Å; D455-C457 VanDerWaalsContact C-N 3.32Å; D455-C457 PolarHBondContact O-N 3.08Å; D455-M458 PolarHBondContact O-N 3.28Å; D455-A459 WeakPolarHBondContact O-CB 3.43Å; D455-A459 PolarHBondContact O-N 3.16Å
456	D	89.4	Confident	87.1	Confident	40 Å²	40	52.5 Å²	52.5	21%	0.214	31%	0.314	C	S	.	.	H	α-helix	trans	-64.7	-37.1	177	-68.6	-11.1	0	0	0	111.7	D452 Q453 Y454 S460 K473 R480	D452-D456 WeakPolarHBondContact O-CB 3.38Å; D452-D456 PolarHBondContact O-N 2.97Å; Q453-D456 PolarHBondContact O-N 3.4Å; Y454-D456 VanDerWaalsContact C-N 3.33Å; Y454-D456 PolarHBondContact O-N 3.03Å; D456-S460 VanDerWaalsContact O-CB 3.23Å; D456-S460 WeakPolarHBondContact O-CB 3.3Å; D456-S460 PolarHBondContact O-N 3.21Å; D456-S460 PolarHBondContact O-OG 3.21Å; D456-K473 WeakPolarHBondContact OD1-CE 3.23Å; D456-K473 IonicContact OD1-NZ 3.24Å; D456-K473 PolarHBondContact OD1-NZ 3.05Å; D456-R480 IonicContact OD2-NH2 2.79Å
457	C	90	Very high	85.6	Confident	6 Å²	6	58 Å²	58	4%	0.041	34%	0.338	C	S	.	.	H	α-helix	trans	-66	-45.9	175.1	-67.5	0	0	0	0	110.9	Q453 Y454 D455 S460 A461 F699 A711	Q453-C457 PolarHBondContact O-N 2.66Å; Q453-C457 PolarHBondContact O-SG 3.5Å; Y454-C457 WeakPolarHBondContact O-CB 3.34Å; Y454-C457 PolarHBondContact O-N 3.13Å; Y454-C457 VanDerWaalsContact O-N 3.13Å; D455-C457 VanDerWaalsContact C-N 3.32Å; D455-C457 PolarHBondContact O-N 3.08Å; C457-S460 PolarHBondContact O-N 2.94Å; C457-A461 WeakPolarHBondContact O-CB 3.44Å; C457-A461 PolarHBondContact O-N 3.01Å; C457-F699 HydrophobicContact CB-CE1 4.33Å; C457-F699 HydrophobicContact CB-CZ 4.25Å; C457-A711 HydrophobicContact CB-CB 4.15Å
458	M	89.6	Confident	84.2	Confident	62 Å²	62	59.5 Å²	59.5	31%	0.305	36%	0.36	S	S	.	.	H	α-helix	trans	-67.9	-44.6	179.6	-67.2	-53.4	-63.3	0	0	112	Y454 D455 S460 A461 S462 F699	Y454-M458 HydrophobicContact CD1-CG 4.28Å; Y454-M458 HydrophobicContact CE1-CG 3.88Å; Y454-M458 HydrophobicContact CE2-CG 4.13Å; Y454-M458 HydrophobicContact CE2-SD 4.33Å; Y454-M458 WeakPolarHBondContact O-CG 3.44Å; Y454-M458 PolarHBondContact O-N 3.22Å; D455-M458 PolarHBondContact O-N 3.28Å; M458-S460 VanDerWaalsContact C-N 3.29Å; M458-S460 PolarHBondContact O-N 3.04Å; M458-A461 WeakPolarHBondContact O-CB 3.39Å; M458-A461 PolarHBondContact O-N 3.26Å; M458-A461 VanDerWaalsContact O-N 3.14Å; M458-S462 PolarHBondContact O-N 3.35Å; M458-S462 PolarHBondContact O-OG 3.31Å; M458-F699 HydrophobicContact SD-CD1 4.26Å; M458-F699 HydrophobicContact SD-CE1 3.86Å
459	A	88.6	Confident	83.2	Confident	35 Å²	35	61.9 Å²	61.9	29%	0.289	37%	0.37	S	S	.	.	H	α-helix	trans	-61.9	-38.3	175.4	0	0	0	0	0	111.8	D455 S462 G463 L464	D455-A459 WeakPolarHBondContact O-CB 3.43Å; D455-A459 PolarHBondContact O-N 3.16Å; A459-S462 PolarHBondContact O-N 3.19Å; A459-G463 PolarHBondContact O-N 3.32Å; A459-L464 HydrophobicContact CB-CB 4.46Å; A459-L464 PolarHBondContact O-N 3.17Å
460	S	87.4	Confident	82.8	Confident	19 Å²	19	64.9 Å²	64.9	13%	0.133	39%	0.386	C	S	.	.	H	α-helix	trans	-66.3	-39.5	174	-59.8	0	0	0	0	112.2	D456 C457 M458 G463 K465	D456-S460 VanDerWaalsContact O-CB 3.23Å; D456-S460 WeakPolarHBondContact O-CB 3.3Å; D456-S460 PolarHBondContact O-N 3.21Å; D456-S460 PolarHBondContact O-OG 3.21Å; C457-S460 PolarHBondContact O-N 2.94Å; M458-S460 VanDerWaalsContact C-N 3.29Å; M458-S460 PolarHBondContact O-N 3.04Å; S460-G463 PolarHBondContact O-N 2.96Å; S460-K465 VanDerWaalsContact OG-CD 3.29Å; S460-K465 WeakPolarHBondContact OG-CD 2.94Å; S460-K465 VanDerWaalsContact OG-CE 3.32Å; S460-K465 WeakPolarHBondContact OG-CE 3.39Å; S460-K465 PolarHBondContact OG-NZ 3.01Å
461	A	86	Confident	82.5	Confident	39 Å²	39	68.7 Å²	68.7	32%	0.322	41%	0.412	S	S	.	.	H	α-helix	trans	-67.4	-35.1	177.1	0	0	0	0	0	112.7	C457 M458 G463 I703 T709	C457-A461 WeakPolarHBondContact O-CB 3.44Å; C457-A461 PolarHBondContact O-N 3.01Å; M458-A461 WeakPolarHBondContact O-CB 3.39Å; M458-A461 PolarHBondContact O-N 3.26Å; M458-A461 VanDerWaalsContact O-N 3.14Å; A461-G463 VanDerWaalsContact C-N 3.28Å; A461-G463 PolarHBondContact O-N 3.03Å; A461-I703 HydrophobicContact CB-CB 4.46Å; A461-I703 HydrophobicContact CB-CD1 3.7Å; A461-I703 HydrophobicContact CB-CG1 3.92Å; A461-I703 HydrophobicContact CB-CG2 3.81Å; A461-T709 HydrophobicContact CB-CG2 4.3Å
462	S	86.1	Confident	82.3	Confident	82 Å²	82	70.2 Å²	70.2	57%	0.573	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	3.7	176.2	-56.5	0	0	0	0	114.3	M458 A459 L464	M458-S462 PolarHBondContact O-N 3.35Å; M458-S462 PolarHBondContact O-OG 3.31Å; A459-S462 PolarHBondContact O-N 3.19Å; S462-L464 PolarHBondContact O-N 3.2Å
463	G	79.9	Confident	82.1	Confident	66 Å²	66	71.5 Å²	71.5	68%	0.68	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	13.3	-178.6	0	0	0	0	0	114.8	A459 S460 A461 K465	A459-G463 PolarHBondContact O-N 3.32Å; S460-G463 PolarHBondContact O-N 2.96Å; A461-G463 VanDerWaalsContact C-N 3.28Å; A461-G463 PolarHBondContact O-N 3.03Å; G463-K465 PolarHBondContact O-N 3.28Å
464	L	75.7	Confident	82	Confident	84 Å²	84	74.4 Å²	74.4	44%	0.44	44%	0.44	S	S	.	.			trans	-86.3	7.4	-179.2	-67.1	171.2	0	0	0	113.3	A459 S462 G466 K467	A459-L464 HydrophobicContact CB-CB 4.46Å; A459-L464 PolarHBondContact O-N 3.17Å; S462-L464 PolarHBondContact O-N 3.2Å; L464-G466 PolarHBondContact O-N 2.93Å; L464-K467 HydrophobicContact CD2-CD 4.43Å; L464-K467 PolarHBondContact O-N 3.29Å
465	K	65.5	Low	81.9	Confident	141 Å²	141	77.1 Å²	77.1	61%	0.613	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	89.4	-178.4	-156.2	177.4	-167.4	145.8	0	109.9	S460 G463 S708	S460-K465 VanDerWaalsContact OG-CD 3.29Å; S460-K465 WeakPolarHBondContact OG-CD 2.94Å; S460-K465 VanDerWaalsContact OG-CE 3.32Å; S460-K465 WeakPolarHBondContact OG-CE 3.39Å; S460-K465 PolarHBondContact OG-NZ 3.01Å; G463-K465 PolarHBondContact O-N 3.28Å; K465-S708 PolarHBondContact NZ-O 2.77Å
466	G	60.9	Low	82	Confident	76 Å²	76	78 Å²	78	78%	0.784	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	151.1	-6.1	-177.8	0	0	0	0	0	116.2	L464	L464-G466 PolarHBondContact O-N 2.93Å
467	K	61.8	Low	82	Confident	152 Å²	152	78 Å²	78	66%	0.661	46%	0.455	S	S	*	.	S	Bend	trans	-65.3	144.2	166.3	-73.2	-178.6	175.7	177.7	0	109.7	L464 M469	L464-K467 HydrophobicContact CD2-CD 4.43Å; L464-K467 PolarHBondContact O-N 3.29Å; K467-M469 PolarHBondContact O-N 3.27Å
468	S	63.1	Low	82.1	Confident	125 Å²	125	80.5 Å²	80.5	87%	0.874	48%	0.476	S	S	*	.			trans	-51.2	109.4	-178.7	64.3	0	0	0	0	109.8
469	M	74	Confident	82.3	Confident	93 Å²	93	81.2 Å²	81.2	46%	0.458	48%	0.479	S	S	.	.			trans	-72.8	136.9	175.5	-66.6	-179.2	71.8	0	0	108	K467 K473 V474 I477	K467-M469 PolarHBondContact O-N 3.27Å; M469-K473 HydrophobicContact CE-CD 4.17Å; M469-K473 HydrophobicContact CE-CG 4.3Å; M469-V474 HydrophobicContact CB-CG2 3.66Å; M469-I477 HydrophobicContact CE-CD1 3.42Å; M469-I477 VanDerWaalsContact CE-CD1 3.42Å
470	D	84.6	Confident	82.5	Confident	77 Å²	77	80.2 Å²	80.2	41%	0.412	47%	0.468	S	S	.	.			trans	-50.3	124.3	169.5	169.3	18.8	0	0	0	109.4	E472 K473 V474	D470-E472 PolarHBondContact O-N 3.02Å; D470-E472 VanDerWaalsContact O-N 3.14Å; D470-E472 PolarHBondContact OD1-N 2.88Å; D470-E472 VanDerWaalsContact OD1-N 3.14Å; D470-K473 HydrophobicContact CB-CB 4.22Å; D470-K473 WeakPolarHBondContact O-CB 3.46Å; D470-K473 PolarHBondContact O-N 3.28Å; D470-V474 PolarHBondContact O-N 3.48Å; D470-V474 VanDerWaalsContact O-N 3.09Å
471	P	87.2	Confident	82.6	Confident	103 Å²	103	82.6 Å²	82.6	67%	0.669	48%	0.477	S	S	*	.	H	α-helix	trans	-54.5	-32	-178.7	22.2	-35.1	0	0	0	112.6	V474 M475	P471-V474 PolarHBondContact O-N 3.22Å; P471-M475 PolarHBondContact O-N 3.1Å
472	E	88.8	Confident	83	Confident	117 Å²	117	82.4 Å²	82.4	55%	0.547	48%	0.475	S	S	.	.	H	α-helix	trans	-66.2	-43.2	176.1	-61.6	-171.9	174.8	0	0	111.8	D470 V474 M475 R476	D470-E472 PolarHBondContact O-N 3.02Å; D470-E472 VanDerWaalsContact O-N 3.14Å; D470-E472 PolarHBondContact OD1-N 2.88Å; D470-E472 VanDerWaalsContact OD1-N 3.14Å; E472-V474 VanDerWaalsContact C-N 3.3Å; E472-V474 PolarHBondContact O-N 3.19Å; E472-M475 PolarHBondContact O-N 2.99Å; E472-R476 WeakPolarHBondContact O-CG 3.3Å; E472-R476 PolarHBondContact O-N 3.33Å; E472-R476 IonicContact OE2-NH1 3.17Å
473	K	90.4	Very high	83.3	Confident	35 Å²	35	78.9 Å²	78.9	15%	0.152	45%	0.449	C	S	.	.	H	α-helix	trans	-60.1	-42.2	174.6	-175.1	172.9	176.5	178.5	0	110.9	D452 D456 M469 D470 M475 R476 I477	D452-K473 WeakPolarHBondContact OD1-CE 3.48Å; D452-K473 IonicContact OD1-NZ 3.62Å; D456-K473 WeakPolarHBondContact OD1-CE 3.23Å; D456-K473 IonicContact OD1-NZ 3.24Å; D456-K473 PolarHBondContact OD1-NZ 3.05Å; M469-K473 HydrophobicContact CE-CD 4.17Å; M469-K473 HydrophobicContact CE-CG 4.3Å; D470-K473 HydrophobicContact CB-CB 4.22Å; D470-K473 WeakPolarHBondContact O-CB 3.46Å; D470-K473 PolarHBondContact O-N 3.28Å; K473-M475 PolarHBondContact O-N 2.84Å; K473-R476 PolarHBondContact O-N 3.47Å; K473-I477 HydrophobicContact CG-CD1 3.88Å; K473-I477 HydrophobicContact CG-CG1 4.39Å; K473-I477 WeakPolarHBondContact O-CG1 3.31Å; K473-I477 PolarHBondContact O-N 3.15Å
474	V	89.5	Confident	83.8	Confident	72 Å²	72	77.1 Å²	77.1	44%	0.436	42%	0.422	S	S	.	.	H	α-helix	trans	-60.7	-44.7	176.8	178.5	0	0	0	0	111.3	M469 D470 P471 E472 I477 A478	M469-V474 HydrophobicContact CB-CG2 3.66Å; D470-V474 PolarHBondContact O-N 3.48Å; D470-V474 VanDerWaalsContact O-N 3.09Å; P471-V474 PolarHBondContact O-N 3.22Å; E472-V474 VanDerWaalsContact C-N 3.3Å; E472-V474 PolarHBondContact O-N 3.19Å; V474-I477 PolarHBondContact O-N 3.47Å; V474-A478 WeakPolarHBondContact O-CB 3.47Å; V474-A478 PolarHBondContact O-N 2.97Å
475	M	90.9	Very high	84.5	Confident	132 Å²	132	75.9 Å²	75.9	65%	0.65	42%	0.418	S	S	*	.	H	α-helix	trans	-62.2	-44.1	176.7	-174.3	178.3	65.8	0	0	111.9	P471 E472 K473 I477 A478 E479	P471-M475 PolarHBondContact O-N 3.1Å; E472-M475 PolarHBondContact O-N 2.99Å; K473-M475 PolarHBondContact O-N 2.84Å; M475-I477 PolarHBondContact O-N 2.96Å; M475-A478 PolarHBondContact O-N 3.48Å; M475-E479 PolarHBondContact O-N 3.26Å
476	R	92.2	Very high	85.8	Confident	83 Å²	83	74.2 Å²	74.2	31%	0.313	41%	0.408	S	S	.	.	H	α-helix	trans	-60.6	-43	175.9	-70.6	-168.9	-61.2	-95.1	4.2	112.2	D452 E472 K473 E479 R480	D452-R476 IonicContact OD2-NE 3.13Å; E472-R476 WeakPolarHBondContact O-CG 3.3Å; E472-R476 PolarHBondContact O-N 3.33Å; E472-R476 IonicContact OE2-NH1 3.17Å; K473-R476 PolarHBondContact O-N 3.47Å; R476-E479 PolarHBondContact O-N 3.02Å; R476-R480 WeakPolarHBondContact O-CB 3.42Å; R476-R480 PolarHBondContact O-N 2.93Å
477	I	90.8	Very high	87.2	Confident	38 Å²	38	72.2 Å²	72.2	20%	0.195	38%	0.377	C	S	.	.	H	α-helix	trans	-62.6	-45.7	176.8	-66.3	166.4	0	0	0	111	M469 K473 V474 M475 R480 E481	M469-I477 HydrophobicContact CE-CD1 3.42Å; M469-I477 VanDerWaalsContact CE-CD1 3.42Å; K473-I477 HydrophobicContact CG-CD1 3.88Å; K473-I477 HydrophobicContact CG-CG1 4.39Å; K473-I477 WeakPolarHBondContact O-CG1 3.31Å; K473-I477 PolarHBondContact O-N 3.15Å; V474-I477 PolarHBondContact O-N 3.47Å; M475-I477 PolarHBondContact O-N 2.96Å; I477-R480 PolarHBondContact O-N 3.47Å; I477-E481 PolarHBondContact O-N 3.12Å
478	A	92	Very high	88.5	Confident	60 Å²	60	69.7 Å²	69.7	50%	0.496	36%	0.363	S	S	.	.	H	α-helix	trans	-61.1	-45.6	177.8	0	0	0	0	0	111.4	V474 M475 R480 E481 A482	V474-A478 WeakPolarHBondContact O-CB 3.47Å; V474-A478 PolarHBondContact O-N 2.97Å; M475-A478 PolarHBondContact O-N 3.48Å; A478-R480 PolarHBondContact O-N 2.93Å; A478-E481 PolarHBondContact O-N 3.36Å; A478-A482 WeakPolarHBondContact O-CB 3.26Å; A478-A482 PolarHBondContact O-N 3.29Å
479	E	92.1	Very high	89.8	Confident	77 Å²	77	67.9 Å²	67.9	36%	0.36	34%	0.343	S	S	.	.	H	α-helix	trans	-65.5	-38.4	178.1	-178.9	52.9	-146.1	0	0	112.2	M475 R476 A482 R483 R486	M475-E479 PolarHBondContact O-N 3.26Å; R476-E479 PolarHBondContact O-N 3.02Å; E479-A482 PolarHBondContact O-N 3.48Å; E479-R483 PolarHBondContact O-N 3.04Å; E479-R486 IonicContact OE1-CZ 2.85Å; E479-R486 IonicContact OE1-NH1 3.72Å; E479-R486 IonicContact OE1-NH2 3.74Å; E479-R486 PolarHBondContact OE1-NH2 3.15Å
480	R	92.9	Very high	90.4	Very high	14 Å²	14	70.5 Å²	70.5	5%	0.053	35%	0.352	C	S	.	.	H	α-helix	trans	-59.3	-45.9	173.1	171.4	173.2	52.7	97.2	-16.4	112.1	D456 R476 I477 A478 A482 R483 R484	D456-R480 IonicContact OD2-NH2 2.79Å; R476-R480 WeakPolarHBondContact O-CB 3.42Å; R476-R480 PolarHBondContact O-N 2.93Å; I477-R480 PolarHBondContact O-N 3.47Å; A478-R480 PolarHBondContact O-N 2.93Å; R480-A482 VanDerWaalsContact C-N 3.35Å; R480-R483 PolarHBondContact O-N 3.49Å; R480-R484 VanDerWaalsContact NH1-NH1 3.14Å; R480-R484 WeakPolarHBondContact O-CG 3.29Å; R480-R484 PolarHBondContact O-N 3.45Å; R480-R484 VanDerWaalsContact O-N 3.09Å
481	E	91.3	Very high	90.5	Very high	69 Å²	69	69.5 Å²	69.5	32%	0.322	34%	0.343	S	S	.	.	H	α-helix	trans	-72.2	-31.3	179.2	-163.4	58.6	-153.1	0	0	111.7	I477 A478 R484 T485	I477-E481 PolarHBondContact O-N 3.12Å; A478-E481 PolarHBondContact O-N 3.36Å; E481-R484 PolarHBondContact O-N 3.31Å; E481-R484 WeakPolarHBondContact OE2-CD 3.19Å; E481-R484 IonicContact OE2-NH1 2.85Å; E481-R484 PolarHBondContact OE2-NH1 3.23Å; E481-T485 WeakPolarHBondContact O-CB 3.21Å; E481-T485 PolarHBondContact O-N 3.02Å; E481-T485 PolarHBondContact O-OG1 3.4Å
482	A	92.5	Very high	90.5	Very high	35 Å²	35	71 Å²	71	29%	0.289	34%	0.341	S	S	.	.	H	α-helix	trans	-62.2	-48.4	170.9	0	0	0	0	0	111.4	A478 E479 R480 R484 T485 R486	A478-A482 WeakPolarHBondContact O-CB 3.26Å; A478-A482 PolarHBondContact O-N 3.29Å; E479-A482 PolarHBondContact O-N 3.48Å; R480-A482 VanDerWaalsContact C-N 3.35Å; A482-R484 VanDerWaalsContact C-N 3.34Å; A482-R484 PolarHBondContact O-N 2.92Å; A482-T485 PolarHBondContact O-N 2.89Å; A482-R486 WeakPolarHBondContact O-CG 3.1Å; A482-R486 PolarHBondContact O-N 3.16Å
483	R	93.2	Very high	90.4	Very high	8 Å²	8	74 Å²	74	3%	0.03	35%	0.352	C	S	.	.	H	α-helix	trans	-54.5	-46	172.9	-80.1	-177.5	-77	137.9	-1.8	112.3	R445 D449 E479 R480 R486 R487 D507	R445-R483 VanDerWaalsContact NE-NH1 3.17Å; D449-R483 IonicContact OD1-NH2 2.88Å; D449-R483 PolarHBondContact OD1-NH2 3.25Å; D449-R483 IonicContact OD2-CZ 2.63Å; D449-R483 VanDerWaalsContact OD2-CZ 3.28Å; D449-R483 IonicContact OD2-NH1 3.91Å; D449-R483 PolarHBondContact OD2-NH1 3.46Å; D449-R483 IonicContact OD2-NH2 2.79Å; D449-R483 PolarHBondContact OD2-NH2 2.89Å; E479-R483 PolarHBondContact O-N 3.04Å; R480-R483 PolarHBondContact O-N 3.49Å; R483-R486 PolarHBondContact O-N 2.88Å; R483-R487 WeakPolarHBondContact O-CG 3.34Å; R483-R487 PolarHBondContact O-N 3.14Å; R483-R487 PolarHBondContact O-NE 3.28Å; R483-D507 IonicContact CZ-OD2 3.97Å; R483-D507 IonicContact NH1-OD1 3.87Å; R483-D507 IonicContact NH1-OD2 3.86Å; R483-D507 PolarHBondContact NH1-OD2 2.91Å
484	R	91	Very high	89.8	Confident	28 Å²	28	76.7 Å²	76.7	11%	0.106	37%	0.374	C	S	.	.	H	α-helix	trans	-64.1	-44.3	177.7	-72.1	173.8	-175.4	172.1	-4.8	112.2	R480 E481 A482 R487 R488	R480-R484 VanDerWaalsContact NH1-NH1 3.14Å; R480-R484 WeakPolarHBondContact O-CG 3.29Å; R480-R484 PolarHBondContact O-N 3.45Å; R480-R484 VanDerWaalsContact O-N 3.09Å; E481-R484 PolarHBondContact O-N 3.31Å; E481-R484 WeakPolarHBondContact OE2-CD 3.19Å; E481-R484 IonicContact OE2-NH1 2.85Å; E481-R484 PolarHBondContact OE2-NH1 3.23Å; A482-R484 VanDerWaalsContact C-N 3.34Å; A482-R484 PolarHBondContact O-N 2.92Å; R484-R487 PolarHBondContact O-N 2.9Å; R484-R488 WeakPolarHBondContact O-CG 3.32Å; R484-R488 PolarHBondContact O-N 2.91Å
485	T	90.8	Very high	88.6	Confident	59 Å²	59	80.3 Å²	80.3	36%	0.362	39%	0.391	S	S	.	.	H	α-helix	trans	-60.8	-45.4	178.3	-57.5	0	0	0	0	111	E481 A482 R487 R488 L489	E481-T485 WeakPolarHBondContact O-CB 3.21Å; E481-T485 PolarHBondContact O-N 3.02Å; E481-T485 PolarHBondContact O-OG1 3.4Å; A482-T485 PolarHBondContact O-N 2.89Å; T485-R487 VanDerWaalsContact C-N 3.32Å; T485-R487 PolarHBondContact O-N 2.82Å; T485-R488 PolarHBondContact O-N 3.47Å; T485-R488 VanDerWaalsContact O-N 3.14Å; T485-L489 HydrophobicContact CG2-CD1 4.1Å; T485-L489 HydrophobicContact CG2-CG 4.4Å; T485-L489 WeakPolarHBondContact O-CG 3.41Å; T485-L489 PolarHBondContact O-N 3.22Å
486	R	91.5	Very high	87.2	Confident	105 Å²	105	77.1 Å²	77.1	40%	0.396	38%	0.381	S	S	.	.	H	α-helix	trans	-55.4	-45.6	174.6	-73.8	-171.8	-65.1	-105.1	14	112	E479 A482 R483 L489 K490 E509	E479-R486 IonicContact OE1-CZ 2.85Å; E479-R486 IonicContact OE1-NH1 3.72Å; E479-R486 IonicContact OE1-NH2 3.74Å; E479-R486 PolarHBondContact OE1-NH2 3.15Å; A482-R486 WeakPolarHBondContact O-CG 3.1Å; A482-R486 PolarHBondContact O-N 3.16Å; R483-R486 PolarHBondContact O-N 2.88Å; R486-L489 PolarHBondContact O-N 3.48Å; R486-K490 WeakPolarHBondContact O-CB 3.23Å; R486-K490 PolarHBondContact O-N 3.27Å; R486-E509 IonicContact CZ-OE2 2.78Å; R486-E509 IonicContact NE-OE2 3.1Å; R486-E509 PolarHBondContact NE-OE2 3.41Å; R486-E509 IonicContact NH2-OE2 3.72Å; R486-E509 PolarHBondContact NH2-OE2 3.25Å
487	R	90.2	Very high	85.5	Confident	34 Å²	34	79.3 Å²	79.3	13%	0.128	41%	0.409	C	S	.	.	H	α-helix	trans	-66	-36.6	177.3	-66.3	-176.9	-70.3	159.5	-15.8	113.1	R483 R484 T485 R491 S505 S506 D507 E509	R483-R487 WeakPolarHBondContact O-CG 3.34Å; R483-R487 PolarHBondContact O-N 3.14Å; R483-R487 PolarHBondContact O-NE 3.28Å; R484-R487 PolarHBondContact O-N 2.9Å; T485-R487 VanDerWaalsContact C-N 3.32Å; T485-R487 PolarHBondContact O-N 2.82Å; R487-R491 VanDerWaalsContact O-CZ 3.3Å; R487-R491 PolarHBondContact O-N 3.33Å; R487-R491 PolarHBondContact O-NH1 3.26Å; R487-S505 WeakPolarHBondContact CD-OG 3.45Å; R487-S505 PolarHBondContact NH1-O 2.86Å; R487-S505 PolarHBondContact NH1-OG 2.91Å; R487-S506 PolarHBondContact NH1-O 3.19Å; R487-S506 VanDerWaalsContact NH1-O 3.12Å; R487-D507 IonicContact CZ-OD1 3.41Å; R487-D507 IonicContact NE-OD1 3.96Å; R487-D507 IonicContact NH2-OD1 2.64Å; R487-D507 PolarHBondContact NH2-OD1 3.42Å; R487-E509 WeakPolarHBondContact CG-OE1 3.41Å
488	R	89.1	Confident	84.2	Confident	99 Å²	99	85.4 Å²	85.4	37%	0.374	44%	0.437	S	S	.	.	H	α-helix	trans	-64.4	-50.1	173.7	-70.2	176.3	-173.6	-179.9	5.3	111.2	R484 T485 K490 R491 E492 E502	R484-R488 WeakPolarHBondContact O-CG 3.32Å; R484-R488 PolarHBondContact O-N 2.91Å; T485-R488 PolarHBondContact O-N 3.47Å; T485-R488 VanDerWaalsContact O-N 3.14Å; R488-K490 VanDerWaalsContact C-N 3.3Å; R488-K490 PolarHBondContact O-N 3.07Å; R488-R491 PolarHBondContact O-N 3.31Å; R488-R491 VanDerWaalsContact O-N 3.11Å; R488-E492 WeakPolarHBondContact O-CG 3.48Å; R488-E492 PolarHBondContact O-N 3.38Å; R488-E502 IonicContact CZ-OE1 3.57Å; R488-E502 IonicContact NE-OE1 3.35Å; R488-E502 IonicContact NH2-OE1 3.72Å; R488-E502 PolarHBondContact NH2-OE1 2.68Å
489	L	90.2	Very high	83.3	Confident	88 Å²	88	88.1 Å²	88.1	46%	0.461	45%	0.452	S	S	.	.	H	α-helix	trans	-60.9	-37.5	177.6	-67.9	172.8	0	0	0	112.4	T485 R486 R491 E492 K493	T485-L489 HydrophobicContact CG2-CD1 4.1Å; T485-L489 HydrophobicContact CG2-CG 4.4Å; T485-L489 WeakPolarHBondContact O-CG 3.41Å; T485-L489 PolarHBondContact O-N 3.22Å; R486-L489 PolarHBondContact O-N 3.48Å; L489-R491 VanDerWaalsContact C-N 3.34Å; L489-E492 PolarHBondContact O-N 2.69Å; L489-K493 WeakPolarHBondContact O-CG 3.38Å; L489-K493 PolarHBondContact O-N 2.98Å
490	K	87.6	Confident	82.9	Confident	147 Å²	147	88.1 Å²	88.1	64%	0.639	45%	0.452	S	S	*	.	H	α-helix	trans	-62.5	-40.5	175.3	-171.2	176.5	179.9	179.9	0	111.6	R486 R488 K493 C494	R486-K490 WeakPolarHBondContact O-CB 3.23Å; R486-K490 PolarHBondContact O-N 3.27Å; R488-K490 VanDerWaalsContact C-N 3.3Å; R488-K490 PolarHBondContact O-N 3.07Å; K490-K493 PolarHBondContact O-N 3.28Å; K490-C494 PolarHBondContact O-N 3.21Å; K490-C494 PolarHBondContact O-SG 3.49Å; K490-C494 VanDerWaalsContact O-SG 3.4Å
491	R	87.1	Confident	82.6	Confident	57 Å²	57	89.1 Å²	89.1	22%	0.215	46%	0.461	C	S	.	.	H	α-helix	trans	-69.2	-41.8	176.8	-73	-175.2	-67.6	-89	0.2	112.8	R487 R488 L489 K493 C494 H500 S505	R487-R491 VanDerWaalsContact O-CZ 3.3Å; R487-R491 PolarHBondContact O-N 3.33Å; R487-R491 PolarHBondContact O-NH1 3.26Å; R488-R491 PolarHBondContact O-N 3.31Å; R488-R491 VanDerWaalsContact O-N 3.11Å; L489-R491 VanDerWaalsContact C-N 3.34Å; R491-K493 PolarHBondContact O-N 2.92Å; R491-C494 PolarHBondContact O-N 2.94Å; R491-H500 VanDerWaalsContact CD-CD2 3.4Å; R491-H500 WeakPolarHBondContact CD-CD2 3.44Å; R491-H500 VanDerWaalsContact CZ-CE1 3.44Å; R491-H500 PolarHBondContact NH1-NE2 3.44Å; R491-S505 PolarHBondContact NH1-OG 3.29Å
492	E	86.8	Confident	82.2	Confident	134 Å²	134	88.4 Å²	88.4	63%	0.626	46%	0.458	S	S	*	.	H	α-helix	trans	-60	-28.6	176.3	-71.8	173.3	-172.3	0	0	112.5	R488 L489	R488-E492 WeakPolarHBondContact O-CG 3.48Å; R488-E492 PolarHBondContact O-N 3.38Å; L489-E492 PolarHBondContact O-N 2.69Å
493	K	87.2	Confident	82	Confident	181 Å²	181	87.6 Å²	87.6	79%	0.787	45%	0.452	S	S	*	.	H	α-helix	trans	-77.6	-22.4	174.3	-72	176.7	-179.2	-175.3	0	114.1	L489 K490 R491	L489-K493 WeakPolarHBondContact O-CG 3.38Å; L489-K493 PolarHBondContact O-N 2.98Å; K490-K493 PolarHBondContact O-N 3.28Å; R491-K493 PolarHBondContact O-N 2.92Å
494	C	76.6	Confident	81.8	Confident	90 Å²	90	88.8 Å²	88.8	61%	0.608	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	7.9	-174.2	-71.5	0	0	0	0	113.9	K490 R491 S496	K490-C494 PolarHBondContact O-N 3.21Å; K490-C494 PolarHBondContact O-SG 3.49Å; K490-C494 VanDerWaalsContact O-SG 3.4Å; R491-C494 PolarHBondContact O-N 2.94Å; C494-S496 PolarHBondContact O-N 3.26Å
495	D	64.6	Low	81.8	Confident	149 Å²	149	88.9 Å²	88.9	80%	0.797	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	45	32.9	179.1	-89.5	-10	0	0	0	114.5	S497	D495-S497 PolarHBondContact O-N 3.3Å
496	S	61.9	Low	81.8	Confident	64 Å²	64	86.9 Å²	86.9	45%	0.448	45%	0.452	S	S	.	.			trans	-70.4	103.8	174.4	62.6	0	0	0	0	108.6	C494 E498	C494-S496 PolarHBondContact O-N 3.26Å; S496-E498 PolarHBondContact O-N 3.48Å; S496-E498 VanDerWaalsContact O-N 3.11Å
497	S	56.3	Low	81.7	Confident	129 Å²	129	83.2 Å²	83.2	90%	0.902	44%	0.44	S	S	*	.			trans	-67.7	-2	178.2	-72.7	0	0	0	0	114	D495	D495-S497 PolarHBondContact O-N 3.3Å
498	E	63.5	Low	81.7	Confident	167 Å²	167	83.9 Å²	83.9	78%	0.78	45%	0.447	S	S	*	.	S	Bend	trans	-80.8	132	177.9	-64.7	-174.5	168.7	0	0	111.4	S496 H500	S496-E498 PolarHBondContact O-N 3.48Å; S496-E498 VanDerWaalsContact O-N 3.11Å; E498-H500 PolarHBondContact O-N 2.69Å
499	S	72.2	Confident	81.6	Confident	116 Å²	116	81.5 Å²	81.5	81%	0.811	44%	0.439	S	S	*	.			trans	-64.3	102.6	175.3	58.6	0	0	0	0	110.4	C501	S499-C501 PolarHBondContact O-N 2.99Å
500	H	84.3	Confident	81.5	Confident	78 Å²	78	78.5 Å²	78.5	36%	0.361	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-80	117.1	179.1	174.7	-75.5	0	0	0	111.7	R491 E498	R491-H500 VanDerWaalsContact CD-CD2 3.4Å; R491-H500 WeakPolarHBondContact CD-CD2 3.44Å; R491-H500 VanDerWaalsContact CZ-CE1 3.44Å; R491-H500 PolarHBondContact NH1-NE2 3.44Å; E498-H500 PolarHBondContact O-N 2.69Å
501	C	86.3	Confident	81.6	Confident	35 Å²	35	74.4 Å²	74.4	24%	0.236	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-77.6	135.9	174.3	-58.8	0	0	0	0	112	S499 G503 M504 W720	S499-C501 PolarHBondContact O-N 2.99Å; C501-G503 PolarHBondContact O-N 3.2Å; C501-M504 HydrophobicContact CB-CG 4.25Å; C501-M504 WeakPolarHBondContact O-CB 3.47Å; C501-M504 PolarHBondContact O-N 3.43Å; C501-W720 HydrophobicContact CB-CB 4.33Å; C501-W720 HydrophobicContact CB-CD2 3.49Å; C501-W720 VanDerWaalsContact CB-CD2 3.49Å; C501-W720 HydrophobicContact CB-CE3 4.05Å; C501-W720 HydrophobicContact CB-CG 3.62Å; C501-W720 HydrophobicContact CB-CZ2 4.17Å; C501-W720 VanDerWaalsContact SG-CE2 3.59Å; C501-W720 VanDerWaalsContact SG-CZ2 3.52Å
502	E	84.3	Confident	81.7	Confident	54 Å²	54	76.7 Å²	76.7	25%	0.252	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	126.5	176.2	-152.1	-177	-157.2	0	0	110.1	R488 R717 W720	R488-E502 IonicContact CZ-OE1 3.57Å; R488-E502 IonicContact NE-OE1 3.35Å; R488-E502 IonicContact NH2-OE1 3.72Å; R488-E502 PolarHBondContact NH2-OE1 2.68Å; E502-R717 HydrophobicContact CB-CG 3.96Å; E502-R717 HydrophobicContact CG-CG 3.77Å; E502-R717 WeakPolarHBondContact O-CA 3.36Å; E502-R717 IonicContact OE1-NH1 2.86Å; E502-R717 WeakPolarHBondContact OE2-CD 3.34Å; E502-R717 IonicContact OE2-CZ 3.31Å; E502-R717 IonicContact OE2-NH1 3.47Å; E502-R717 PolarHBondContact OE2-NH1 2.82Å; E502-W720 WeakPolarHBondContact O-CB 3.27Å
503	G	87	Confident	82	Confident	17 Å²	17	73.5 Å²	73.5	18%	0.175	43%	0.432	C	S	.	.	T	Hydrogen-bonded Turn	trans	113	-21.8	-171	0	0	0	0	0	114.1	C501 S505 F721	C501-G503 PolarHBondContact O-N 3.2Å; G503-S505 VanDerWaalsContact C-N 3.28Å; G503-S505 PolarHBondContact O-N 3.04Å; G503-F721 WeakPolarHBondContact O-CA 3.23Å
504	M	90	Very high	82.3	Confident	33 Å²	33	67.9 Å²	67.9	16%	0.163	41%	0.406	C	S	.	.			trans	-74.6	-13	176.9	-79.7	-70.9	153.8	0	0	114.9	C501 W720 V723 K724 K727	C501-M504 HydrophobicContact CB-CG 4.25Å; C501-M504 WeakPolarHBondContact O-CB 3.47Å; C501-M504 PolarHBondContact O-N 3.43Å; M504-W720 HydrophobicContact CE-CB 4.23Å; M504-W720 HydrophobicContact CE-CD2 4.42Å; M504-W720 HydrophobicContact CE-CE3 3.53Å; M504-W720 HydrophobicContact CE-CZ3 4.28Å; M504-W720 WeakPolarHBondContact CE-O 3.28Å; M504-W720 HydrophobicContact CG-CB 4.4Å; M504-V723 HydrophobicContact CE-CB 3.43Å; M504-V723 VanDerWaalsContact CE-CB 3.43Å; M504-V723 HydrophobicContact CE-CG1 3.4Å; M504-K724 HydrophobicContact CE-CB 4.29Å; M504-K724 WeakPolarHBondContact O-CD 3.45Å; M504-K724 HydrophobicContact SD-CB 3.84Å; M504-K724 HydrophobicContact SD-CG 4.31Å; M504-K727 HydrophobicContact SD-CD 4.3Å
505	S	89.7	Confident	83	Confident	31 Å²	31	67.5 Å²	67.5	22%	0.217	40%	0.397	C	S	.	.	S	Bend	trans	-92.4	128.2	-174.4	-172.6	0	0	0	0	111.2	R487 R491 G503	R487-S505 WeakPolarHBondContact CD-OG 3.45Å; R487-S505 PolarHBondContact NH1-O 2.86Å; R487-S505 PolarHBondContact NH1-OG 2.91Å; R491-S505 PolarHBondContact NH1-OG 3.29Å; G503-S505 VanDerWaalsContact C-N 3.28Å; G503-S505 PolarHBondContact O-N 3.04Å
506	S	90.4	Very high	84.4	Confident	17 Å²	17	63.8 Å²	63.8	12%	0.119	38%	0.383	C	S	.	.			trans	-73.1	144.6	171.7	-62	0	0	0	0	111.2	R487 D508 S648 K724	R487-S506 PolarHBondContact NH1-O 3.19Å; R487-S506 VanDerWaalsContact NH1-O 3.12Å; S506-D508 VanDerWaalsContact CB-OD2 3.28Å; S506-D508 WeakPolarHBondContact CB-OD2 3.49Å; S506-S648 PolarHBondContact OG-N 2.75Å; S506-S648 PolarHBondContact OG-OG 2.97Å; S506-K724 PolarHBondContact OG-NZ 3.16Å; S506-K724 VanDerWaalsContact OG-NZ 3.09Å
507	D	90.2	Very high	85.9	Confident	28 Å²	28	65.4 Å²	65.4	15%	0.15	38%	0.384	C	S	.	.			trans	-107	71.7	-174.3	-175.1	59	0	0	0	110.3	R445 R483 R487	R445-D507 IonicContact CZ-OD2 3.37Å; R445-D507 VanDerWaalsContact CZ-OD2 3.31Å; R445-D507 IonicContact NE-OD2 2.95Å; R445-D507 PolarHBondContact NE-OD2 3.28Å; R445-D507 PolarHBondContact NH2-O 3.45Å; R445-D507 VanDerWaalsContact NH2-O 3.08Å; R445-D507 IonicContact NH2-OD1 3.2Å; R445-D507 IonicContact NH2-OD2 2.69Å; R445-D507 PolarHBondContact NH2-OD2 3.15Å; R483-D507 IonicContact CZ-OD2 3.97Å; R483-D507 IonicContact NH1-OD1 3.87Å; R483-D507 IonicContact NH1-OD2 3.86Å; R483-D507 PolarHBondContact NH1-OD2 2.91Å; R487-D507 IonicContact CZ-OD1 3.41Å; R487-D507 IonicContact NE-OD1 3.96Å; R487-D507 IonicContact NH2-OD1 2.64Å; R487-D507 PolarHBondContact NH2-OD1 3.42Å
508	D	89.3	Confident	87.7	Confident	48 Å²	48	59.8 Å²	59.8	26%	0.257	34%	0.343	S	S	.	.			trans	-101.2	13.3	-174.5	-55.4	-49.7	0	0	0	112.7	S506 D510 R644 S647 S649	S506-D508 VanDerWaalsContact CB-OD2 3.28Å; S506-D508 WeakPolarHBondContact CB-OD2 3.49Å; D508-D510 PolarHBondContact O-N 2.79Å; D508-R644 IonicContact OD1-CZ 2.89Å; D508-R644 IonicContact OD1-NH1 2.78Å; D508-R644 PolarHBondContact OD1-NH1 3.5Å; D508-R644 IonicContact OD1-NH2 3.76Å; D508-R644 PolarHBondContact OD1-NH2 3.47Å; D508-S647 WeakPolarHBondContact OD1-CB 3.49Å; D508-S647 PolarHBondContact OD1-OG 3.34Å; D508-S647 PolarHBondContact OD2-OG 3.03Å; D508-S649 PolarHBondContact OD2-OG 3.43Å
509	E	88.9	Confident	89	Confident	48 Å²	48	54.7 Å²	54.7	22%	0.224	33%	0.325	C	S	.	.	P	Polyproline II helix	trans	-77.5	121.7	-177.9	-61.6	-175.6	176.8	0	0	111.5	R445 R486 R487	R445-E509 PolarHBondContact NH1-O 2.88Å; R445-E509 PolarHBondContact NH2-O 2.63Å; R486-E509 IonicContact CZ-OE2 2.78Å; R486-E509 IonicContact NE-OE2 3.1Å; R486-E509 PolarHBondContact NE-OE2 3.41Å; R486-E509 IonicContact NH2-OE2 3.72Å; R486-E509 PolarHBondContact NH2-OE2 3.25Å; R487-E509 WeakPolarHBondContact CG-OE1 3.41Å
510	D	87.6	Confident	90.1	Very high	25 Å²	25	52.4 Å²	52.4	13%	0.134	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-93.8	155.7	165.9	-92.3	-42.6	0	0	0	111.2	R438 F442 D508 R514 I515	R438-D510 IonicContact CZ-OD2 2.66Å; R438-D510 IonicContact NE-OD2 3.94Å; R438-D510 PolarHBondContact NE-OD2 3.28Å; R438-D510 VanDerWaalsContact NE-OD2 3.09Å; R438-D510 IonicContact NH2-OD2 3.85Å; R438-D510 PolarHBondContact NH2-OD2 3.26Å; F442-D510 VanDerWaalsContact CZ-CG 3.42Å; F442-D510 WeakPolarHBondContact CZ-OD1 3.28Å; F442-D510 WeakPolarHBondContact CZ-OD2 3.3Å; D508-D510 PolarHBondContact O-N 2.79Å; D510-R514 HydrophobicContact CB-CB 4.49Å; D510-R514 IonicContact OD1-NE 2.82Å; D510-I515 HydrophobicContact CB-CD1 4.14Å; D510-I515 HydrophobicContact CB-CG1 3.66Å
511	T	89.1	Confident	90.7	Very high	62 Å²	62	52.1 Å²	52.1	38%	0.38	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-73.4	151.3	168.4	58.2	0	0	0	0	110.1	A513 R514 I515	T511-A513 PolarHBondContact O-N 3.21Å; T511-R514 PolarHBondContact O-N 3.46Å; T511-R514 WeakPolarHBondContact OG1-CG 3.23Å; T511-R514 PolarHBondContact OG1-N 2.89Å; T511-I515 WeakPolarHBondContact O-CG1 3.25Å; T511-I515 PolarHBondContact O-N 3.38Å
512	S	90.3	Very high	91	Very high	104 Å²	104	53.6 Å²	53.6	73%	0.727	31%	0.309	S	S	*	.	H	α-helix	trans	-54.8	-37	177.2	52.8	0	0	0	0	112.6	I515 S516	S512-I515 PolarHBondContact O-N 3.38Å; S512-S516 WeakPolarHBondContact O-CB 3.26Å; S512-S516 PolarHBondContact O-N 2.98Å
513	A	92.7	Very high	91.4	Very high	67 Å²	67	55.5 Å²	55.5	55%	0.554	32%	0.322	S	S	*	.	H	α-helix	trans	-60.7	-46	175.1	0	0	0	0	0	112.6	T511 S516 E517	T511-A513 PolarHBondContact O-N 3.21Å; A513-S516 PolarHBondContact O-N 3.09Å; A513-E517 WeakPolarHBondContact O-CB 3.28Å; A513-E517 PolarHBondContact O-N 3.17Å
514	R	92.3	Very high	91.9	Very high	63 Å²	63	57.1 Å²	57.1	24%	0.238	33%	0.33	C	S	.	.	H	α-helix	trans	-69	-35.2	178.7	-72.2	179.8	73	80.8	-2.3	112.5	D510 T511 E517 F518	D510-R514 HydrophobicContact CB-CB 4.49Å; D510-R514 IonicContact OD1-NE 2.82Å; T511-R514 PolarHBondContact O-N 3.46Å; T511-R514 WeakPolarHBondContact OG1-CG 3.23Å; T511-R514 PolarHBondContact OG1-N 2.89Å; R514-E517 PolarHBondContact O-N 3.43Å; R514-F518 VanDerWaalsContact O-CB 3.31Å; R514-F518 WeakPolarHBondContact O-CB 3.34Å; R514-F518 PolarHBondContact O-N 3.28Å
515	I	91.4	Very high	92.1	Very high	82 Å²	82	55.7 Å²	55.7	42%	0.421	32%	0.323	S	S	.	.	H	α-helix	trans	-62.4	-46.5	173.1	-62.7	170.9	0	0	0	109.6	D510 T511 S512 E517 F518 C519	D510-I515 HydrophobicContact CB-CD1 4.14Å; D510-I515 HydrophobicContact CB-CG1 3.66Å; T511-I515 WeakPolarHBondContact O-CG1 3.25Å; T511-I515 PolarHBondContact O-N 3.38Å; S512-I515 PolarHBondContact O-N 3.38Å; I515-E517 PolarHBondContact O-N 2.99Å; I515-F518 PolarHBondContact O-N 3.1Å; I515-C519 PolarHBondContact O-N 3.41Å; I515-C519 PolarHBondContact O-SG 3.43Å; I515-C519 VanDerWaalsContact O-SG 3.34Å
516	S	94.4	Very high	92.2	Very high	71 Å²	71	56.6 Å²	56.6	50%	0.497	33%	0.332	S	S	.	.	H	α-helix	trans	-63.1	-41.4	177.8	-168.2	0	0	0	0	112.7	S512 A513 C519 S520	S512-S516 WeakPolarHBondContact O-CB 3.26Å; S512-S516 PolarHBondContact O-N 2.98Å; A513-S516 PolarHBondContact O-N 3.09Å; S516-C519 PolarHBondContact O-N 3.43Å; S516-S520 WeakPolarHBondContact O-CB 3.46Å; S516-S520 PolarHBondContact O-N 2.87Å; S516-S520 PolarHBondContact O-OG 3.34Å
517	E	94.6	Very high	92.4	Very high	98 Å²	98	61.8 Å²	61.8	46%	0.458	35%	0.353	S	S	.	.	H	α-helix	trans	-62.3	-44	175.1	-173.1	-175.3	-177.8	0	0	111	A513 R514 I515 S520 K521	A513-E517 WeakPolarHBondContact O-CB 3.28Å; A513-E517 PolarHBondContact O-N 3.17Å; R514-E517 PolarHBondContact O-N 3.43Å; I515-E517 PolarHBondContact O-N 2.99Å; E517-S520 PolarHBondContact O-N 2.96Å; E517-K521 PolarHBondContact O-N 3.38Å
518	F	92.2	Very high	92.6	Very high	11 Å²	11	62.2 Å²	62.2	5%	0.048	36%	0.358	C	S	.	.	H	α-helix	trans	-62.4	-45.9	176.6	178.4	-119.4	0	0	0	112.6	Y434 L435 R438 R514 I515 S520 K521 K522 E589	Y434-F518 HydrophobicContact CD1-CD2 4.27Å; Y434-F518 AromaticContact CE1-CD2 3.67Å; Y434-F518 HydrophobicContact CE1-CD2 3.67Å; Y434-F518 HydrophobicContact CE1-CE2 4.38Å; L435-F518 HydrophobicContact CD2-CE2 3.63Å; L435-F518 HydrophobicContact CD2-CZ 4Å; R438-F518 VanDerWaalsContact NH1-CD1 3.31Å; R514-F518 VanDerWaalsContact O-CB 3.31Å; R514-F518 WeakPolarHBondContact O-CB 3.34Å; R514-F518 PolarHBondContact O-N 3.28Å; I515-F518 PolarHBondContact O-N 3.1Å; F518-S520 VanDerWaalsContact C-N 3.34Å; F518-S520 PolarHBondContact O-N 3.29Å; F518-K521 PolarHBondContact O-N 2.99Å; F518-K522 HydrophobicContact CD1-CD 4.27Å; F518-K522 HydrophobicContact CD2-CG 4.44Å; F518-K522 HydrophobicContact CE1-CD 3.63Å; F518-K522 HydrophobicContact CE1-CG 4.47Å; F518-K522 HydrophobicContact CE2-CD 4.01Å; F518-K522 HydrophobicContact CE2-CG 4.11Å; F518-K522 HydrophobicContact CZ-CD 3.54Å; F518-K522 HydrophobicContact CZ-CG 4.16Å; F518-K522 PolarHBondContact O-N 3.36Å; F518-E589 WeakPolarHBondContact CE1-OE1 3.39Å; F518-E589 WeakPolarHBondContact CZ-OE1 3.45Å
519	C	92.8	Very high	92.8	Very high	61 Å²	61	60.7 Å²	60.7	41%	0.412	35%	0.351	S	S	.	.	H	α-helix	trans	-58.8	-46.8	174.4	-69	0	0	0	0	111.1	I515 S516 K521 K522 D523	I515-C519 PolarHBondContact O-N 3.41Å; I515-C519 PolarHBondContact O-SG 3.43Å; I515-C519 VanDerWaalsContact O-SG 3.34Å; S516-C519 PolarHBondContact O-N 3.43Å; C519-K521 VanDerWaalsContact C-N 3.27Å; C519-K521 PolarHBondContact O-N 2.88Å; C519-K522 PolarHBondContact O-N 3.36Å; C519-K522 VanDerWaalsContact O-N 3.15Å; C519-D523 VanDerWaalsContact O-CG 3.28Å; C519-D523 PolarHBondContact O-N 2.97Å
520	S	95.4	Very high	92.9	Very high	68 Å²	68	65.4 Å²	65.4	48%	0.476	37%	0.373	S	S	.	.	H	α-helix	trans	-60.6	-37	178.8	-54.8	0	0	0	0	112.4	S516 E517 F518 S524	S516-S520 WeakPolarHBondContact O-CB 3.46Å; S516-S520 PolarHBondContact O-N 2.87Å; S516-S520 PolarHBondContact O-OG 3.34Å; E517-S520 PolarHBondContact O-N 2.96Å; F518-S520 VanDerWaalsContact C-N 3.34Å; F518-S520 PolarHBondContact O-N 3.29Å; S520-S524 WeakPolarHBondContact O-CB 3.4Å; S520-S524 PolarHBondContact O-N 2.98Å
521	K	94.9	Very high	93.2	Very high	71 Å²	71	70.4 Å²	70.4	31%	0.309	40%	0.396	S	S	.	.	H	α-helix	trans	-69.5	-41.3	175.4	-81.2	-70.4	-173.8	179.4	0	112.7	E430 Y434 E517 F518 C519 D523 S524 W525	E430-K521 IonicContact OE1-NZ 3.12Å; Y434-K521 HydrophobicContact CD2-CG 4.26Å; Y434-K521 HydrophobicContact CE2-CB 4.39Å; Y434-K521 HydrophobicContact CE2-CD 4.37Å; Y434-K521 HydrophobicContact CE2-CG 3.74Å; E517-K521 PolarHBondContact O-N 3.38Å; F518-K521 PolarHBondContact O-N 2.99Å; C519-K521 VanDerWaalsContact C-N 3.27Å; C519-K521 PolarHBondContact O-N 2.88Å; K521-D523 VanDerWaalsContact C-N 3.32Å; K521-D523 PolarHBondContact O-N 3.49Å; K521-S524 WeakPolarHBondContact O-CB 3.47Å; K521-S524 PolarHBondContact O-N 3.24Å; K521-W525 HydrophobicContact CB-CH2 4.41Å; K521-W525 HydrophobicContact CB-CZ2 4.2Å; K521-W525 VanDerWaalsContact O-CD2 3.31Å; K521-W525 PolarHBondContact O-N 2.84Å
522	K	92.7	Very high	93.4	Very high	66 Å²	66	68 Å²	68	29%	0.287	38%	0.381	S	S	.	.	H	α-helix	trans	-60.6	-42.6	172.9	-71.1	-172.8	70	146.5	0	111.8	F518 C519 S524 W525 A526 G584	F518-K522 HydrophobicContact CD1-CD 4.27Å; F518-K522 HydrophobicContact CD2-CG 4.44Å; F518-K522 HydrophobicContact CE1-CD 3.63Å; F518-K522 HydrophobicContact CE1-CG 4.47Å; F518-K522 HydrophobicContact CE2-CD 4.01Å; F518-K522 HydrophobicContact CE2-CG 4.11Å; F518-K522 HydrophobicContact CZ-CD 3.54Å; F518-K522 HydrophobicContact CZ-CG 4.16Å; F518-K522 PolarHBondContact O-N 3.36Å; C519-K522 PolarHBondContact O-N 3.36Å; C519-K522 VanDerWaalsContact O-N 3.15Å; K522-S524 VanDerWaalsContact C-N 3.32Å; K522-S524 PolarHBondContact O-N 2.87Å; K522-W525 HydrophobicContact CB-CE3 4.49Å; K522-W525 HydrophobicContact CG-CE3 4.1Å; K522-W525 HydrophobicContact CG-CZ3 3.91Å; K522-W525 PolarHBondContact O-N 3.15Å; K522-A526 PolarHBondContact O-N 3.49Å; K522-G584 PolarHBondContact NZ-O 3.07Å; K522-G584 VanDerWaalsContact NZ-O 3.12Å
523	D	94.6	Very high	93.5	Very high	95 Å²	95	64.1 Å²	64.1	51%	0.508	35%	0.351	S	S	.	.	H	α-helix	trans	-65.2	-36.9	176.7	-63.8	-18.6	0	0	0	111.7	C519 K521 A526 K527	C519-D523 VanDerWaalsContact O-CG 3.28Å; C519-D523 PolarHBondContact O-N 2.97Å; K521-D523 VanDerWaalsContact C-N 3.32Å; K521-D523 PolarHBondContact O-N 3.49Å; D523-A526 PolarHBondContact O-N 2.94Å; D523-K527 WeakPolarHBondContact O-CG 3.44Å; D523-K527 PolarHBondContact O-N 3.25Å
524	S	95.6	Very high	93.5	Very high	51 Å²	51	66.6 Å²	66.6	36%	0.357	36%	0.359	S	S	.	.	H	α-helix	trans	-62.3	-44.2	174.1	-171.7	0	0	0	0	111.9	S520 K521 K522 K527 S528	S520-S524 WeakPolarHBondContact O-CB 3.4Å; S520-S524 PolarHBondContact O-N 2.98Å; K521-S524 WeakPolarHBondContact O-CB 3.47Å; K521-S524 PolarHBondContact O-N 3.24Å; K522-S524 VanDerWaalsContact C-N 3.32Å; K522-S524 PolarHBondContact O-N 2.87Å; S524-K527 PolarHBondContact O-N 2.8Å; S524-S528 PolarHBondContact O-N 2.88Å; S524-S528 PolarHBondContact O-OG 3.12Å; S524-S528 VanDerWaalsContact O-OG 3.11Å
525	W	94.9	Very high	93.5	Very high	3 Å²	3	68.7 Å²	68.7	1%	0.011	38%	0.375	C	S	.	.	H	α-helix	trans	-65.7	-40.5	177.6	-62.4	-32.5	0	0	0	112.3	A431 Y434 K521 K522 K527 S528 A529 L583	A431-W525 HydrophobicContact CB-CD2 3.95Å; A431-W525 HydrophobicContact CB-CE3 4.01Å; A431-W525 HydrophobicContact CB-CH2 4.16Å; A431-W525 HydrophobicContact CB-CZ2 4.09Å; A431-W525 HydrophobicContact CB-CZ3 4.11Å; Y434-W525 AromaticContact CD1-CH2 3.76Å; Y434-W525 HydrophobicContact CD1-CH2 3.76Å; Y434-W525 HydrophobicContact CD1-CZ2 4.2Å; Y434-W525 HydrophobicContact CD2-CZ2 4.48Å; Y434-W525 AromaticContact CG-CH2 3.87Å; Y434-W525 HydrophobicContact CG-CH2 3.87Å; Y434-W525 AromaticContact CG-CZ2 3.84Å; Y434-W525 HydrophobicContact CG-CZ2 3.84Å; K521-W525 HydrophobicContact CB-CH2 4.41Å; K521-W525 HydrophobicContact CB-CZ2 4.2Å; K521-W525 VanDerWaalsContact O-CD2 3.31Å; K521-W525 PolarHBondContact O-N 2.84Å; K522-W525 HydrophobicContact CB-CE3 4.49Å; K522-W525 HydrophobicContact CG-CE3 4.1Å; K522-W525 HydrophobicContact CG-CZ3 3.91Å; K522-W525 PolarHBondContact O-N 3.15Å; W525-K527 PolarHBondContact O-N 3.48Å; W525-S528 PolarHBondContact O-N 3Å; W525-A529 WeakPolarHBondContact O-CB 3.26Å; W525-A529 PolarHBondContact O-N 2.95Å; W525-L583 HydrophobicContact CB-CD2 3.69Å; W525-L583 HydrophobicContact CB-CG 4.11Å; W525-L583 HydrophobicContact CG-CD2 4.36Å
526	A	92.8	Very high	93.6	Very high	49 Å²	49	66.1 Å²	66.1	41%	0.405	36%	0.363	S	S	.	.	H	α-helix	trans	-60.5	-44.3	175.6	0	0	0	0	0	111.6	K522 D523 A529 E530	K522-A526 PolarHBondContact O-N 3.49Å; D523-A526 PolarHBondContact O-N 2.94Å; A526-A529 WeakPolarHBondContact O-CB 3.35Å; A526-A529 PolarHBondContact O-N 3.28Å; A526-E530 PolarHBondContact O-N 2.94Å
527	K	94.1	Very high	93.6	Very high	127 Å²	127	65.2 Å²	65.2	55%	0.552	36%	0.36	S	S	*	.	H	α-helix	trans	-62.3	-46.5	174.5	-71.1	172.8	-176.6	179.4	0	112.4	D523 S524 W525 A529 E530 E531	D523-K527 WeakPolarHBondContact O-CG 3.44Å; D523-K527 PolarHBondContact O-N 3.25Å; S524-K527 PolarHBondContact O-N 2.8Å; W525-K527 PolarHBondContact O-N 3.48Å; K527-A529 PolarHBondContact O-N 3.5Å; K527-E530 PolarHBondContact O-N 3.28Å; K527-E531 WeakPolarHBondContact O-CB 3.23Å; K527-E531 VanDerWaalsContact O-CG 3.3Å; K527-E531 WeakPolarHBondContact O-CG 3.36Å; K527-E531 PolarHBondContact O-N 3.02Å
528	S	94.4	Very high	93.5	Very high	37 Å²	37	64.9 Å²	64.9	26%	0.259	36%	0.361	S	S	.	.	H	α-helix	trans	-63.7	-30.6	177.6	-62	0	0	0	0	112.8	S524 W525 L532	S524-S528 PolarHBondContact O-N 2.88Å; S524-S528 PolarHBondContact O-OG 3.12Å; S524-S528 VanDerWaalsContact O-OG 3.11Å; W525-S528 PolarHBondContact O-N 3Å; S528-L532 PolarHBondContact O-N 2.89Å
529	A	93.3	Very high	93.5	Very high	15 Å²	15	69.6 Å²	69.6	12%	0.124	38%	0.383	C	S	.	.	H	α-helix	trans	-68.6	-43.6	173.1	0	0	0	0	0	112.2	W525 A526 K527 L532 L580	W525-A529 WeakPolarHBondContact O-CB 3.26Å; W525-A529 PolarHBondContact O-N 2.95Å; A526-A529 WeakPolarHBondContact O-CB 3.35Å; A526-A529 PolarHBondContact O-N 3.28Å; K527-A529 PolarHBondContact O-N 3.5Å; A529-L532 WeakPolarHBondContact O-CB 3.26Å; A529-L532 PolarHBondContact O-N 2.88Å; A529-L580 HydrophobicContact CB-CD1 3.55Å; A529-L580 HydrophobicContact CB-CD2 4.13Å; A529-L580 HydrophobicContact CB-CG 3.68Å
530	E	91.3	Very high	93.6	Very high	147 Å²	147	68.8 Å²	68.8	69%	0.687	37%	0.372	S	S	*	.	H	α-helix	trans	-64.3	-45.1	175.4	-72.5	172.9	-169.5	0	0	111.6	A526 K527 L532 V534	A526-E530 PolarHBondContact O-N 2.94Å; K527-E530 PolarHBondContact O-N 3.28Å; E530-L532 PolarHBondContact O-N 3.33Å; E530-V534 WeakPolarHBondContact O-CG2 3.44Å
531	E	93.3	Very high	93.4	Very high	130 Å²	130	66.1 Å²	66.1	61%	0.607	36%	0.355	S	S	*	.	H	α-helix	trans	-63.1	-24	-180	-73.6	170.8	-173.4	0	0	113.5	K527 F533 V534	K527-E531 WeakPolarHBondContact O-CB 3.23Å; K527-E531 VanDerWaalsContact O-CG 3.3Å; K527-E531 WeakPolarHBondContact O-CG 3.36Å; K527-E531 PolarHBondContact O-N 3.02Å; E531-F533 VanDerWaalsContact C-N 3.29Å; E531-F533 PolarHBondContact O-N 2.99Å; E531-V534 PolarHBondContact O-N 3.41Å
532	L	92.7	Very high	93.3	Very high	12 Å²	12	67.2 Å²	67.2	6%	0.063	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-30.6	-173	-165.1	147.2	0	0	0	113.4	K420 R423 I424 L427 S528 A529 E530	K420-L532 HydrophobicContact CB-CD2 3.74Å; K420-L532 HydrophobicContact CD-CD2 3.68Å; K420-L532 HydrophobicContact CD-CG 4.42Å; K420-L532 WeakPolarHBondContact CE-O 3.44Å; K420-L532 HydrophobicContact CG-CD2 3.86Å; K420-L532 PolarHBondContact NZ-O 2.97Å; R423-L532 HydrophobicContact CB-CD1 3.91Å; I424-L532 HydrophobicContact CD1-CD2 4.43Å; I424-L532 HydrophobicContact CG1-CD1 3.81Å; I424-L532 HydrophobicContact CG1-CD2 4.18Å; L427-L532 HydrophobicContact CD1-CD1 3.84Å; S528-L532 PolarHBondContact O-N 2.89Å; A529-L532 WeakPolarHBondContact O-CB 3.26Å; A529-L532 PolarHBondContact O-N 2.88Å; E530-L532 PolarHBondContact O-N 3.33Å
533	F	93	Very high	93.4	Very high	23 Å²	23	64.7 Å²	64.7	10%	0.101	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	8.1	-176.6	-72.4	-77.8	0	0	0	113.9	K420 I424 E531 D535 V536 F577 L580	K420-F533 HydrophobicContact CB-CE1 4.24Å; K420-F533 HydrophobicContact CB-CZ 4.27Å; K420-F533 HydrophobicContact CG-CD1 4.4Å; K420-F533 HydrophobicContact CG-CE1 3.91Å; K420-F533 HydrophobicContact CG-CZ 4.4Å; I424-F533 HydrophobicContact CD1-CE2 4.47Å; I424-F533 HydrophobicContact CD1-CZ 4.34Å; E531-F533 VanDerWaalsContact C-N 3.29Å; E531-F533 PolarHBondContact O-N 2.99Å; F533-D535 PolarHBondContact O-N 3.08Å; F533-V536 HydrophobicContact CD1-CB 4.21Å; F533-V536 HydrophobicContact CD1-CG1 4.48Å; F533-V536 HydrophobicContact CD1-CG2 3.97Å; F533-V536 WeakPolarHBondContact O-CB 3.4Å; F533-V536 PolarHBondContact O-N 2.93Å; F533-F577 HydrophobicContact CD1-CE1 4.5Å; F533-F577 AromaticContact CE1-CE1 3.77Å; F533-F577 HydrophobicContact CE1-CE1 3.77Å; F533-F577 HydrophobicContact CE1-CZ 4.29Å; F533-F577 HydrophobicContact CE2-CD1 4.17Å; F533-F577 HydrophobicContact CE2-CE1 4.06Å; F533-F577 HydrophobicContact CZ-CD1 4Å; F533-F577 AromaticContact CZ-CE1 3.52Å; F533-F577 HydrophobicContact CZ-CE1 3.52Å; F533-F577 HydrophobicContact CZ-CZ 4.21Å; F533-L580 HydrophobicContact CD2-CD2 3.92Å; F533-L580 HydrophobicContact CE2-CD2 3.54Å
534	V	92.5	Very high	93.3	Very high	119 Å²	119	64 Å²	64	72%	0.721	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-30	-179.3	171.9	0	0	0	0	112.7	E530 E531 V536	E530-V534 WeakPolarHBondContact O-CG2 3.44Å; E531-V534 PolarHBondContact O-N 3.41Å; V534-V536 VanDerWaalsContact C-N 3.31Å
535	D	93.3	Very high	93.2	Very high	107 Å²	107	63.2 Å²	63.2	57%	0.572	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-0.8	177.4	61.2	-32.7	0	0	0	113.7	K420 F533	K420-D535 IonicContact NZ-OD1 3.77Å; K420-D535 PolarHBondContact NZ-OD1 3.44Å; K420-D535 IonicContact NZ-OD2 3.21Å; K420-D535 PolarHBondContact NZ-OD2 3.33Å; F533-D535 PolarHBondContact O-N 3.08Å
536	V	93.5	Very high	93.2	Very high	27 Å²	27	63.1 Å²	63.1	16%	0.164	34%	0.337	C	S	.	.	S	Bend	trans	-106.2	139.5	-176.4	-176.1	0	0	0	0	109.7	F533 V534	F533-V536 HydrophobicContact CD1-CB 4.21Å; F533-V536 HydrophobicContact CD1-CG1 4.48Å; F533-V536 HydrophobicContact CD1-CG2 3.97Å; F533-V536 WeakPolarHBondContact O-CB 3.4Å; F533-V536 PolarHBondContact O-N 2.93Å; V534-V536 VanDerWaalsContact C-N 3.31Å
537	A	93.8	Very high	93.2	Very high	52 Å²	52	61 Å²	61	43%	0.43	32%	0.319	S	S	.	.			trans	-59.8	142.1	173.2	0	0	0	0	0	110.9	E539 Y540 G541	A537-E539 HydrophobicContact CB-CG 4.02Å; A537-E539 PolarHBondContact O-N 3.46Å; A537-Y540 HydrophobicContact CB-CD2 4.28Å; A537-Y540 PolarHBondContact O-N 2.85Å; A537-G541 PolarHBondContact O-N 3.38Å
538	D	92.4	Very high	93.1	Very high	91 Å²	91	60.1 Å²	60.1	49%	0.487	32%	0.317	S	S	.	.	H	α-helix	trans	-50.4	-37.4	-175.6	-81.7	-11	0	0	0	113.3	Y540 G541 K542 S545	D538-Y540 PolarHBondContact O-N 3.45Å; D538-G541 PolarHBondContact O-N 3.01Å; D538-K542 HydrophobicContact CB-CD 4.01Å; D538-K542 HydrophobicContact CB-CG 4.48Å; D538-K542 VanDerWaalsContact CG-CE 3.44Å; D538-K542 WeakPolarHBondContact O-CB 3.35Å; D538-K542 PolarHBondContact O-N 3.35Å; D538-K542 WeakPolarHBondContact OD1-CE 3.27Å; D538-K542 IonicContact OD1-NZ 2.65Å; D538-K542 PolarHBondContact OD1-NZ 3Å; D538-K542 IonicContact OD2-NZ 3.65Å; D538-K542 PolarHBondContact OD2-NZ 3.32Å; D538-S545 WeakPolarHBondContact O-CB 3.28Å
539	E	92.8	Very high	93.1	Very high	110 Å²	110	62.4 Å²	62.4	51%	0.514	32%	0.32	S	S	.	.	H	α-helix	trans	-61.4	-22.2	178.1	39.3	-175.7	150.6	0	0	114.5	Y409 A537 I546	Y409-E539 PolarHBondContact OH-O 2.85Å; A537-E539 HydrophobicContact CB-CG 4.02Å; A537-E539 PolarHBondContact O-N 3.46Å; E539-I546 WeakPolarHBondContact O-CG1 3.29Å
540	Y	94.3	Very high	93.1	Very high	45 Å²	45	61.8 Å²	61.8	18%	0.176	31%	0.314	C	S	.	.	H	α-helix	trans	-115.1	-15.2	175.5	-54.7	-77.3	0	0	0	113.6	Y409 L413 A537 D538 F577	Y409-Y540 HydrophobicContact CD2-CD1 4.4Å; Y409-Y540 AromaticContact CD2-CE1 3.5Å; Y409-Y540 HydrophobicContact CD2-CE1 3.5Å; Y409-Y540 AromaticContact CD2-CZ 3.93Å; Y409-Y540 HydrophobicContact CE2-CD1 4.02Å; Y409-Y540 AromaticContact CE2-CE1 3.53Å; Y409-Y540 HydrophobicContact CE2-CE1 3.53Å; Y409-Y540 HydrophobicContact CG-CE1 4.13Å; L413-Y540 HydrophobicContact CB-CD1 3.99Å; L413-Y540 HydrophobicContact CB-CE1 4.43Å; L413-Y540 HydrophobicContact CD1-CD1 4.28Å; A537-Y540 HydrophobicContact CB-CD2 4.28Å; A537-Y540 PolarHBondContact O-N 2.85Å; D538-Y540 PolarHBondContact O-N 3.45Å; Y540-F577 WeakPolarHBondContact O-CZ 3.47Å
541	G	91.2	Very high	93.1	Very high	12 Å²	12	55 Å²	55	12%	0.124	28%	0.283	C	S	.	.	H	α-helix	trans	-98.1	-27.9	-177	0	0	0	0	0	114.8	A537 D538	A537-G541 PolarHBondContact O-N 3.38Å; D538-G541 PolarHBondContact O-N 3.01Å
542	K	93.1	Very high	93	Very high	94 Å²	94	51.1 Å²	51.1	41%	0.409	27%	0.265	S	S	.	.			trans	-99.3	131.3	-177.1	-67.1	179.4	176.2	163.4	0	111.7	D538 E544 S545 I546	D538-K542 HydrophobicContact CB-CD 4.01Å; D538-K542 HydrophobicContact CB-CG 4.48Å; D538-K542 VanDerWaalsContact CG-CE 3.44Å; D538-K542 WeakPolarHBondContact O-CB 3.35Å; D538-K542 PolarHBondContact O-N 3.35Å; D538-K542 WeakPolarHBondContact OD1-CE 3.27Å; D538-K542 IonicContact OD1-NZ 2.65Å; D538-K542 PolarHBondContact OD1-NZ 3Å; D538-K542 IonicContact OD2-NZ 3.65Å; D538-K542 PolarHBondContact OD2-NZ 3.32Å; K542-E544 VanDerWaalsContact C-N 3.31Å; K542-E544 PolarHBondContact O-N 2.99Å; K542-S545 PolarHBondContact O-N 3.21Å; K542-I546 WeakPolarHBondContact O-CG1 3.34Å; K542-I546 PolarHBondContact O-N 3.27Å; K542-I546 VanDerWaalsContact O-N 3.15Å
543	F	93.8	Very high	92.9	Very high	13 Å²	13	51 Å²	51	6%	0.057	26%	0.264	C	S	.	.	H	α-helix	trans	-57.9	-45.3	179.3	-173.7	-90.3	0	0	0	111.8	S545 I546 C547 L574 F577 I578 W600 L604	F543-S545 VanDerWaalsContact C-N 3.34Å; F543-S545 PolarHBondContact O-N 3.21Å; F543-I546 PolarHBondContact O-N 2.76Å; F543-C547 HydrophobicContact CE1-CB 4.49Å; F543-C547 WeakPolarHBondContact CE1-SG 3.41Å; F543-C547 VanDerWaalsContact CZ-SG 3.6Å; F543-C547 WeakPolarHBondContact O-CB 3.47Å; F543-C547 PolarHBondContact O-N 3.32Å; F543-L574 HydrophobicContact CD2-CD2 4.33Å; F543-L574 HydrophobicContact CE2-CB 3.92Å; F543-L574 HydrophobicContact CE2-CD1 4.31Å; F543-L574 HydrophobicContact CE2-CD2 3.8Å; F543-L574 HydrophobicContact CE2-CG 4.21Å; F543-L574 HydrophobicContact CZ-CB 4.41Å; F543-L574 HydrophobicContact CZ-CD1 4.05Å; F543-L574 HydrophobicContact CZ-CD2 4.17Å; F543-L574 HydrophobicContact CZ-CG 4.44Å; F543-F577 HydrophobicContact CD2-CB 3.56Å; F543-F577 HydrophobicContact CD2-CG 4.21Å; F543-F577 HydrophobicContact CE2-CB 4.25Å; F543-I578 HydrophobicContact CE2-CD1 4.17Å; F543-I578 HydrophobicContact CE2-CG1 3.71Å; F543-I578 HydrophobicContact CZ-CD1 4.36Å; F543-I578 HydrophobicContact CZ-CG1 4.24Å; F543-W600 HydrophobicContact CD1-CB 4.13Å; F543-W600 HydrophobicContact CD2-CB 4.39Å; F543-W600 HydrophobicContact CE1-CB 3.7Å; F543-W600 HydrophobicContact CE2-CB 3.94Å; F543-W600 HydrophobicContact CG-CB 4.46Å; F543-W600 HydrophobicContact CZ-CB 3.57Å; F543-L604 HydrophobicContact CE1-CG 4.33Å; F543-L604 HydrophobicContact CZ-CD1 4.49Å; F543-L604 HydrophobicContact CZ-CD2 4.4Å; F543-L604 HydrophobicContact CZ-CG 4.14Å
544	E	93.6	Very high	92.8	Very high	81 Å²	81	50.8 Å²	50.8	38%	0.379	26%	0.262	S	S	.	.	H	α-helix	trans	-60.5	-44	-178.8	-64	76.6	-172.4	0	0	111.2	K542 C547 Q548	K542-E544 VanDerWaalsContact C-N 3.31Å; K542-E544 PolarHBondContact O-N 2.99Å; E544-C547 PolarHBondContact O-N 3.44Å; E544-Q548 VanDerWaalsContact O-CB 3.27Å; E544-Q548 WeakPolarHBondContact O-CB 3.48Å; E544-Q548 PolarHBondContact O-N 2.96Å
545	S	93.1	Very high	92.5	Very high	34 Å²	34	46.9 Å²	46.9	24%	0.238	24%	0.238	C	C	.	.	H	α-helix	trans	-65.7	-41.1	-179.9	-59.4	0	0	0	0	111.9	D538 K542 F543 Q548 R549	D538-S545 WeakPolarHBondContact O-CB 3.28Å; K542-S545 PolarHBondContact O-N 3.21Å; F543-S545 VanDerWaalsContact C-N 3.34Å; F543-S545 PolarHBondContact O-N 3.21Å; S545-Q548 PolarHBondContact O-N 3.49Å; S545-R549 WeakPolarHBondContact O-CB 3.28Å; S545-R549 PolarHBondContact O-N 3.23Å
546	I	94.6	Very high	92.2	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.5	-48.3	175.7	-63.2	165.4	0	0	0	110.3	L413 E539 K542 F543 Q548 R549 F550 L574 F577	L413-I546 HydrophobicContact CD1-CD1 3.89Å; L413-I546 HydrophobicContact CD1-CG1 4.44Å; L413-I546 HydrophobicContact CD2-CG2 4.22Å; E539-I546 WeakPolarHBondContact O-CG1 3.29Å; K542-I546 WeakPolarHBondContact O-CG1 3.34Å; K542-I546 PolarHBondContact O-N 3.27Å; K542-I546 VanDerWaalsContact O-N 3.15Å; F543-I546 PolarHBondContact O-N 2.76Å; I546-Q548 PolarHBondContact O-N 3.09Å; I546-R549 PolarHBondContact O-N 3.16Å; I546-F550 HydrophobicContact CG2-CD2 3.77Å; I546-F550 HydrophobicContact CG2-CE2 3.74Å; I546-F550 VanDerWaalsContact O-CD2 3.27Å; I546-F550 WeakPolarHBondContact O-CD2 3.42Å; I546-F550 PolarHBondContact O-N 2.95Å; I546-F550 VanDerWaalsContact O-N 3.08Å; I546-L574 HydrophobicContact CG2-CD2 3.97Å; I546-F577 HydrophobicContact CD1-CD2 4.19Å; I546-F577 HydrophobicContact CD1-CE1 3.8Å; I546-F577 HydrophobicContact CD1-CE2 3.41Å; I546-F577 VanDerWaalsContact CD1-CE2 3.41Å; I546-F577 HydrophobicContact CD1-CZ 3.18Å
547	C	93.4	Very high	92	Very high	4 Å²	4	49.7 Å²	49.7	3%	0.027	24%	0.241	C	C	.	.	H	α-helix	trans	-59.9	-44.9	177.4	-80.8	0	0	0	0	112.1	F543 E544 R549 F550 S551 F607	F543-C547 HydrophobicContact CE1-CB 4.49Å; F543-C547 WeakPolarHBondContact CE1-SG 3.41Å; F543-C547 VanDerWaalsContact CZ-SG 3.6Å; F543-C547 WeakPolarHBondContact O-CB 3.47Å; F543-C547 PolarHBondContact O-N 3.32Å; E544-C547 PolarHBondContact O-N 3.44Å; C547-R549 VanDerWaalsContact C-N 3.32Å; C547-R549 PolarHBondContact O-N 3.49Å; C547-F550 PolarHBondContact O-N 3.25Å; C547-S551 WeakPolarHBondContact O-CB 3.39Å; C547-S551 PolarHBondContact O-N 3.47Å; C547-F607 HydrophobicContact CB-CD2 4.43Å; C547-F607 WeakPolarHBondContact O-CE2 3.31Å
548	Q	92.2	Very high	91.6	Very high	110 Å²	110	49.8 Å²	49.8	51%	0.514	24%	0.237	S	C	.	.	H	α-helix	trans	-58.6	-45.4	175.9	-177.9	-178.5	-4.9	0	0	110.9	E544 S545 I546 F550 S551 E552	E544-Q548 VanDerWaalsContact O-CB 3.27Å; E544-Q548 WeakPolarHBondContact O-CB 3.48Å; E544-Q548 PolarHBondContact O-N 2.96Å; S545-Q548 PolarHBondContact O-N 3.49Å; I546-Q548 PolarHBondContact O-N 3.09Å; Q548-F550 PolarHBondContact O-N 3.07Å; Q548-S551 WeakPolarHBondContact O-CB 3.41Å; Q548-S551 PolarHBondContact O-N 3.38Å; Q548-E552 HydrophobicContact CG-CG 4.49Å; Q548-E552 PolarHBondContact NE2-OE1 3.27Å; Q548-E552 WeakPolarHBondContact O-CG 3.49Å; Q548-E552 PolarHBondContact O-N 3.43Å
549	R	93	Very high	91.4	Very high	85 Å²	85	48.7 Å²	48.7	32%	0.321	23%	0.234	S	C	.	.	H	α-helix	trans	-60.9	-44.5	-180	-174.1	56.7	168.2	-163.5	-9.3	112.7	Y409 S545 I546 C547 W553	Y409-R549 HydrophobicContact CD2-CG 4.41Å; Y409-R549 HydrophobicContact CE1-CG 4.14Å; Y409-R549 HydrophobicContact CE2-CG 3.95Å; S545-R549 WeakPolarHBondContact O-CB 3.28Å; S545-R549 PolarHBondContact O-N 3.23Å; I546-R549 PolarHBondContact O-N 3.16Å; C547-R549 VanDerWaalsContact C-N 3.32Å; C547-R549 PolarHBondContact O-N 3.49Å; R549-W553 HydrophobicContact CG-CD2 4.49Å; R549-W553 HydrophobicContact CG-CE3 4.23Å; R549-W553 HydrophobicContact CG-CH2 3.77Å; R549-W553 HydrophobicContact CG-CZ2 4.07Å; R549-W553 HydrophobicContact CG-CZ3 3.85Å; R549-W553 PolarHBondContact O-N 2.89Å
550	F	93.7	Very high	91.3	Very high	1 Å²	1	45.5 Å²	45.5	0%	0.004	22%	0.218	C	C	.	.	H	α-helix	trans	-69	-35.7	176	-79.4	-71.5	0	0	0	112.6	L406 Y409 V410 L413 I546 C547 Q548 W553 Y554 Y561 V566 L570 L573 F607	L406-F550 HydrophobicContact CD1-CE1 4.08Å; Y409-F550 HydrophobicContact CE1-CE2 4.06Å; Y409-F550 HydrophobicContact CE1-CZ 4.3Å; V410-F550 HydrophobicContact CG2-CE1 4.44Å; V410-F550 HydrophobicContact CG2-CZ 4.15Å; L413-F550 HydrophobicContact CD2-CE2 4.29Å; I546-F550 HydrophobicContact CG2-CD2 3.77Å; I546-F550 HydrophobicContact CG2-CE2 3.74Å; I546-F550 VanDerWaalsContact O-CD2 3.27Å; I546-F550 WeakPolarHBondContact O-CD2 3.42Å; I546-F550 PolarHBondContact O-N 2.95Å; I546-F550 VanDerWaalsContact O-N 3.08Å; C547-F550 PolarHBondContact O-N 3.25Å; Q548-F550 PolarHBondContact O-N 3.07Å; F550-W553 AromaticContact CD1-CE3 3.79Å; F550-W553 HydrophobicContact CD1-CE3 3.79Å; F550-W553 AromaticContact CD1-CZ3 3.96Å; F550-W553 HydrophobicContact CD1-CZ3 3.96Å; F550-W553 HydrophobicContact CE1-CE3 4.1Å; F550-W553 AromaticContact CE1-CZ3 3.85Å; F550-W553 HydrophobicContact CE1-CZ3 3.85Å; F550-W553 HydrophobicContact CG-CE3 4.38Å; F550-W553 HydrophobicContact CG-CZ3 4.5Å; F550-W553 HydrophobicContact CZ-CZ3 4.3Å; F550-W553 PolarHBondContact O-N 2.86Å; F550-Y554 PolarHBondContact O-N 2.79Å; F550-Y561 HydrophobicContact CD1-CE2 4.28Å; F550-Y561 WeakPolarHBondContact O-CE2 3.32Å; F550-V566 HydrophobicContact CD1-CG1 3.56Å; F550-V566 HydrophobicContact CE1-CG1 3.63Å; F550-L570 HydrophobicContact CB-CD1 4.26Å; F550-L570 HydrophobicContact CD1-CD1 4.34Å; F550-L570 HydrophobicContact CD2-CD1 3.74Å; F550-L570 HydrophobicContact CE2-CD1 4.14Å; F550-L570 HydrophobicContact CG-CD1 3.86Å; F550-L573 HydrophobicContact CE2-CD1 4.4Å; F550-L573 HydrophobicContact CZ-CD1 3.85Å; F550-F607 HydrophobicContact CB-CE2 3.83Å; F550-F607 HydrophobicContact CB-CZ 3.93Å
551	S	91.5	Very high	91.1	Very high	6 Å²	6	43.3 Å²	43.3	4%	0.042	21%	0.21	C	C	.	.	H	α-helix	trans	-61.9	-49	173.4	-167.9	0	0	0	0	111.1	C547 Q548 W553 Y554 D555 G608	C547-S551 WeakPolarHBondContact O-CB 3.39Å; C547-S551 PolarHBondContact O-N 3.47Å; Q548-S551 WeakPolarHBondContact O-CB 3.41Å; Q548-S551 PolarHBondContact O-N 3.38Å; S551-W553 PolarHBondContact O-N 3.4Å; S551-Y554 WeakPolarHBondContact O-CA 3.28Å; S551-Y554 WeakPolarHBondContact O-CB 3.19Å; S551-Y554 PolarHBondContact O-N 2.9Å; S551-D555 PolarHBondContact O-N 3.35Å; S551-D555 VanDerWaalsContact O-OD2 3.09Å; S551-D555 PolarHBondContact OG-OD2 2.7Å; S551-G608 WeakPolarHBondContact OG-CA 3.45Å; S551-G608 PolarHBondContact OG-N 3.29Å
552	E	91.1	Very high	90.9	Very high	47 Å²	47	48.7 Å²	48.7	22%	0.22	23%	0.226	C	C	.	.	H	α-helix	trans	-57.9	-36.9	178.5	-76.1	-176	-153	0	0	112.9	Q548 K556	Q548-E552 HydrophobicContact CG-CG 4.49Å; Q548-E552 PolarHBondContact NE2-OE1 3.27Å; Q548-E552 WeakPolarHBondContact O-CG 3.49Å; Q548-E552 PolarHBondContact O-N 3.43Å; E552-K556 VanDerWaalsContact O-CB 3.26Å; E552-K556 WeakPolarHBondContact O-CB 3.3Å; E552-K556 WeakPolarHBondContact O-CD 3.12Å; E552-K556 WeakPolarHBondContact O-CG 3.35Å; E552-K556 PolarHBondContact O-N 3.13Å; E552-K556 IonicContact OE2-NZ 3.69Å; E552-K556 PolarHBondContact OE2-NZ 3.5Å
553	W	91.5	Very high	90.8	Very high	10 Å²	10	48.9 Å²	48.9	4%	0.038	23%	0.228	C	C	.	.	H	α-helix	trans	-70.5	-37.6	175.5	-78.6	-32.6	0	0	0	113	F402 L406 Y409 R549 F550 S551 Y557 Y561	F402-W553 HydrophobicContact CE2-CB 4Å; F402-W553 HydrophobicContact CE2-CG 4.03Å; L406-W553 HydrophobicContact CD1-CD2 4.28Å; L406-W553 HydrophobicContact CD1-CE3 3.6Å; L406-W553 HydrophobicContact CD1-CH2 4.01Å; L406-W553 HydrophobicContact CD1-CZ3 3.46Å; L406-W553 VanDerWaalsContact CD1-CZ3 3.46Å; Y409-W553 AromaticContact CD1-CH2 3.45Å; Y409-W553 HydrophobicContact CD1-CH2 3.45Å; Y409-W553 VanDerWaalsContact CD1-CH2 3.45Å; Y409-W553 AromaticContact CD1-CZ3 3.77Å; Y409-W553 HydrophobicContact CD1-CZ3 3.77Å; Y409-W553 HydrophobicContact CD2-CH2 4.32Å; Y409-W553 HydrophobicContact CE1-CH2 4.15Å; Y409-W553 HydrophobicContact CE1-CZ3 4.17Å; Y409-W553 AromaticContact CG-CH2 3.54Å; Y409-W553 HydrophobicContact CG-CH2 3.54Å; Y409-W553 HydrophobicContact CG-CZ2 4.43Å; Y409-W553 HydrophobicContact CG-CZ3 4.32Å; R549-W553 HydrophobicContact CG-CD2 4.49Å; R549-W553 HydrophobicContact CG-CE3 4.23Å; R549-W553 HydrophobicContact CG-CH2 3.77Å; R549-W553 HydrophobicContact CG-CZ2 4.07Å; R549-W553 HydrophobicContact CG-CZ3 3.85Å; R549-W553 PolarHBondContact O-N 2.89Å; F550-W553 AromaticContact CD1-CE3 3.79Å; F550-W553 HydrophobicContact CD1-CE3 3.79Å; F550-W553 AromaticContact CD1-CZ3 3.96Å; F550-W553 HydrophobicContact CD1-CZ3 3.96Å; F550-W553 HydrophobicContact CE1-CE3 4.1Å; F550-W553 AromaticContact CE1-CZ3 3.85Å; F550-W553 HydrophobicContact CE1-CZ3 3.85Å; F550-W553 HydrophobicContact CG-CE3 4.38Å; F550-W553 HydrophobicContact CG-CZ3 4.5Å; F550-W553 HydrophobicContact CZ-CZ3 4.3Å; F550-W553 PolarHBondContact O-N 2.86Å; S551-W553 PolarHBondContact O-N 3.4Å; W553-Y557 PolarHBondContact O-N 2.76Å; W553-Y561 HydrophobicContact CB-CD2 4.03Å; W553-Y561 HydrophobicContact CB-CE2 4.2Å
554	Y	89.8	Confident	90.6	Very high	18 Å²	18	49.8 Å²	49.8	7%	0.071	24%	0.238	C	C	.	.	H	α-helix	trans	-62.1	-48	173.2	172	-101.9	0	0	0	111.1	F550 S551 P558 Y561 E616 I619	F550-Y554 PolarHBondContact O-N 2.79Å; S551-Y554 WeakPolarHBondContact O-CA 3.28Å; S551-Y554 WeakPolarHBondContact O-CB 3.19Å; S551-Y554 PolarHBondContact O-N 2.9Å; Y554-P558 WeakPolarHBondContact O-CA 3.31Å; Y554-P558 WeakPolarHBondContact O-CD 3.39Å; Y554-Y561 AromaticContact CD2-CD1 3.78Å; Y554-Y561 HydrophobicContact CD2-CD1 3.78Å; Y554-Y561 HydrophobicContact CD2-CE1 4.1Å; Y554-Y561 HydrophobicContact CD2-CG 4.23Å; Y554-E616 HydrophobicContact CE2-CG 4.43Å; Y554-E616 WeakPolarHBondContact OH-CG 3.31Å; Y554-I619 HydrophobicContact CD1-CD1 3.55Å; Y554-I619 HydrophobicContact CD2-CD1 3.6Å; Y554-I619 HydrophobicContact CE1-CD1 3.24Å; Y554-I619 HydrophobicContact CE2-CD1 3.3Å; Y554-I619 HydrophobicContact CE2-CG1 4.3Å; Y554-I619 HydrophobicContact CG-CD1 3.7Å
555	D	87.1	Confident	90.5	Very high	38 Å²	38	51.6 Å²	51.6	20%	0.203	25%	0.245	C	C	.	.	H	α-helix	trans	-66.5	-40.4	-179.3	-69.5	-54.3	0	0	0	112.6	S551 S611	S551-D555 PolarHBondContact O-N 3.35Å; S551-D555 VanDerWaalsContact O-OD2 3.09Å; S551-D555 PolarHBondContact OG-OD2 2.7Å; D555-S611 WeakPolarHBondContact OD1-CB 3.37Å; D555-S611 PolarHBondContact OD1-OG 3Å
556	K	87.1	Confident	90.4	Very high	122 Å²	122	50.4 Å²	50.4	53%	0.53	24%	0.236	S	C	.	.	H	α-helix	trans	-77.3	-32.9	-178.6	-70.2	167.7	-174.5	160.8	0	113.2	E552	E552-K556 VanDerWaalsContact O-CB 3.26Å; E552-K556 WeakPolarHBondContact O-CB 3.3Å; E552-K556 WeakPolarHBondContact O-CD 3.12Å; E552-K556 WeakPolarHBondContact O-CG 3.35Å; E552-K556 PolarHBondContact O-N 3.13Å; E552-K556 IonicContact OE2-NZ 3.69Å; E552-K556 PolarHBondContact OE2-NZ 3.5Å
557	Y	87.9	Confident	90.1	Very high	71 Å²	71	51.5 Å²	51.5	28%	0.278	24%	0.243	S	C	.	.			trans	-143.2	60	-168.8	-56	-72.2	0	0	0	113.1	F402 W553 V559 F560 Y561	F402-Y557 AromaticContact CD2-CD2 3.38Å; F402-Y557 HydrophobicContact CD2-CD2 3.38Å; F402-Y557 HydrophobicContact CD2-CE2 4.09Å; F402-Y557 AromaticContact CD2-CG 3.72Å; F402-Y557 HydrophobicContact CD2-CG 3.72Å; F402-Y557 AromaticContact CE2-CD2 3.92Å; F402-Y557 HydrophobicContact CE2-CD2 3.92Å; F402-Y557 HydrophobicContact CE2-CG 4.21Å; F402-Y557 HydrophobicContact CG-CD2 4.29Å; F402-Y557 HydrophobicContact CG-CG 4.31Å; W553-Y557 PolarHBondContact O-N 2.76Å; Y557-V559 VanDerWaalsContact C-N 3.33Å; Y557-V559 PolarHBondContact O-N 3.07Å; Y557-F560 AromaticContact CD1-CD2 3.89Å; Y557-F560 HydrophobicContact CD1-CD2 3.89Å; Y557-F560 HydrophobicContact CD1-CE2 4.12Å; Y557-F560 HydrophobicContact CG-CD2 4.21Å; Y557-F560 PolarHBondContact O-N 2.9Å; Y557-Y561 VanDerWaalsContact O-CB 3.31Å; Y557-Y561 WeakPolarHBondContact O-CB 3.31Å; Y557-Y561 PolarHBondContact O-N 3.37Å
558	P	86.6	Confident	89.9	Confident	54 Å²	54	57.1 Å²	57.1	35%	0.351	27%	0.272	S	S	.	.	H	α-helix	trans	-60.8	-38	-171.8	22.7	-33.9	0	0	0	113.5	Y554 Y561 R562	Y554-P558 WeakPolarHBondContact O-CA 3.31Å; Y554-P558 WeakPolarHBondContact O-CD 3.39Å; P558-Y561 PolarHBondContact O-N 3.33Å; P558-R562 PolarHBondContact O-N 3.21Å; P558-R562 VanDerWaalsContact O-N 3.1Å
559	V	87.7	Confident	89.8	Confident	68 Å²	68	55 Å²	55	41%	0.412	27%	0.268	S	S	.	.	H	α-helix	trans	-64.2	-51.1	178.8	-178.5	0	0	0	0	111.1	Y557 Y561 R562 E563	Y557-V559 VanDerWaalsContact C-N 3.33Å; Y557-V559 PolarHBondContact O-N 3.07Å; V559-Y561 VanDerWaalsContact C-N 3.3Å; V559-Y561 PolarHBondContact O-N 3.35Å; V559-R562 PolarHBondContact O-N 3.22Å; V559-E563 WeakPolarHBondContact O-CG 3.38Å; V559-E563 PolarHBondContact O-N 3.44Å
560	F	90	Very high	89.8	Confident	42 Å²	42	50.9 Å²	50.9	18%	0.184	25%	0.253	C	S	.	.	H	α-helix	trans	-68.1	-32.4	-179.9	-53.8	-42.6	0	0	0	112	Q399 F402 F403 Y557 R562 E563 A564	Q399-F560 HydrophobicContact CB-CE1 3.94Å; Q399-F560 HydrophobicContact CB-CE2 4.11Å; Q399-F560 HydrophobicContact CB-CZ 3.68Å; Q399-F560 HydrophobicContact CG-CD1 3.9Å; Q399-F560 HydrophobicContact CG-CE1 3.58Å; Q399-F560 HydrophobicContact CG-CE2 4.41Å; Q399-F560 HydrophobicContact CG-CG 4.46Å; Q399-F560 HydrophobicContact CG-CZ 3.87Å; F402-F560 HydrophobicContact CB-CD2 4.4Å; F402-F560 HydrophobicContact CD1-CB 3.44Å; F402-F560 VanDerWaalsContact CD1-CB 3.44Å; F402-F560 HydrophobicContact CD1-CD2 4.32Å; F402-F560 HydrophobicContact CD1-CG 4.2Å; F402-F560 HydrophobicContact CE1-CB 3.39Å; F402-F560 HydrophobicContact CG-CB 4.14Å; F402-F560 HydrophobicContact CG-CD2 4.33Å; F402-F560 HydrophobicContact CZ-CB 4.06Å; F403-F560 HydrophobicContact CZ-CB 4.26Å; Y557-F560 AromaticContact CD1-CD2 3.89Å; Y557-F560 HydrophobicContact CD1-CD2 3.89Å; Y557-F560 HydrophobicContact CD1-CE2 4.12Å; Y557-F560 HydrophobicContact CG-CD2 4.21Å; Y557-F560 PolarHBondContact O-N 2.9Å; F560-R562 VanDerWaalsContact C-N 3.32Å; F560-R562 PolarHBondContact O-N 3.5Å; F560-E563 PolarHBondContact O-N 3.48Å; F560-A564 VanDerWaalsContact O-CB 3.29Å; F560-A564 WeakPolarHBondContact O-CB 3.29Å; F560-A564 PolarHBondContact O-N 3.47Å
561	Y	90.6	Very high	89.7	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.3	-41	174.5	-166	-91.3	0	0	0	111.9	F550 W553 Y554 Y557 P558 V559 V566 T567	F550-Y561 HydrophobicContact CD1-CE2 4.28Å; F550-Y561 WeakPolarHBondContact O-CE2 3.32Å; W553-Y561 HydrophobicContact CB-CD2 4.03Å; W553-Y561 HydrophobicContact CB-CE2 4.2Å; Y554-Y561 AromaticContact CD2-CD1 3.78Å; Y554-Y561 HydrophobicContact CD2-CD1 3.78Å; Y554-Y561 HydrophobicContact CD2-CE1 4.1Å; Y554-Y561 HydrophobicContact CD2-CG 4.23Å; Y557-Y561 VanDerWaalsContact O-CB 3.31Å; Y557-Y561 WeakPolarHBondContact O-CB 3.31Å; Y557-Y561 PolarHBondContact O-N 3.37Å; P558-Y561 PolarHBondContact O-N 3.33Å; V559-Y561 VanDerWaalsContact C-N 3.3Å; V559-Y561 PolarHBondContact O-N 3.35Å; Y561-V566 HydrophobicContact CD1-CB 4.06Å; Y561-V566 HydrophobicContact CD2-CB 4.11Å; Y561-V566 HydrophobicContact CD2-CG1 4.34Å; Y561-V566 HydrophobicContact CD2-CG2 4.06Å; Y561-V566 HydrophobicContact CE1-CB 3.73Å; Y561-V566 HydrophobicContact CE1-CG1 4.05Å; Y561-V566 HydrophobicContact CE2-CB 3.76Å; Y561-V566 HydrophobicContact CE2-CG1 3.55Å; Y561-V566 HydrophobicContact CE2-CG2 4.09Å; Y561-V566 HydrophobicContact CG-CB 4.24Å; Y561-V566 HydrophobicContact CG-CG2 4.3Å; Y561-V566 PolarHBondContact O-N 2.62Å; Y561-V566 VanDerWaalsContact OH-CG1 3.31Å; Y561-V566 WeakPolarHBondContact OH-CG1 3.47Å; Y561-T567 HydrophobicContact CD1-CG2 4.2Å; Y561-T567 HydrophobicContact CE1-CG2 3.58Å
562	R	88.3	Confident	89.8	Confident	125 Å²	125	59 Å²	59	47%	0.472	29%	0.288	S	S	.	.	H	α-helix	trans	-70.6	-43.5	175.3	-175.4	173.6	60.3	-118.8	-1.9	112.3	P558 V559 F560 A564 F565 E616	P558-R562 PolarHBondContact O-N 3.21Å; P558-R562 VanDerWaalsContact O-N 3.1Å; V559-R562 PolarHBondContact O-N 3.22Å; F560-R562 VanDerWaalsContact C-N 3.32Å; F560-R562 PolarHBondContact O-N 3.5Å; R562-A564 VanDerWaalsContact C-N 3.26Å; R562-A564 PolarHBondContact O-N 3.4Å; R562-F565 PolarHBondContact O-N 2.99Å; R562-E616 IonicContact NH1-OE1 2.62Å; R562-E616 PolarHBondContact NH1-OE1 3.49Å
563	E	89.9	Confident	89.9	Confident	98 Å²	98	57.7 Å²	57.7	46%	0.458	28%	0.283	S	S	.	.	H	α-helix	trans	-62.7	-32.1	176.1	-72	174.3	179	0	0	112.6	V559 F560 F565	V559-E563 WeakPolarHBondContact O-CG 3.38Å; V559-E563 PolarHBondContact O-N 3.44Å; F560-E563 PolarHBondContact O-N 3.48Å; E563-F565 VanDerWaalsContact O-CD2 3.26Å; E563-F565 WeakPolarHBondContact O-CD2 3.34Å; E563-F565 WeakPolarHBondContact O-CE2 3.45Å; E563-F565 PolarHBondContact O-N 3.11Å
564	A	90.4	Very high	90.1	Very high	31 Å²	31	57.2 Å²	57.2	26%	0.256	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-3.2	173.4	0	0	0	0	0	114.2	F403 L406 F560 R562 V566	F403-A564 HydrophobicContact CE1-CB 3.99Å; L406-A564 HydrophobicContact CD2-CB 3.85Å; F560-A564 VanDerWaalsContact O-CB 3.29Å; F560-A564 WeakPolarHBondContact O-CB 3.29Å; F560-A564 PolarHBondContact O-N 3.47Å; R562-A564 VanDerWaalsContact C-N 3.26Å; R562-A564 PolarHBondContact O-N 3.4Å; A564-V566 HydrophobicContact CB-CG2 3.59Å; A564-V566 PolarHBondContact O-N 3.44Å; A564-V566 VanDerWaalsContact O-N 3.16Å
565	F	90.8	Very high	90.4	Very high	120 Å²	120	57.6 Å²	57.6	53%	0.526	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.9	29.2	-176.9	-57.6	-81.5	0	0	0	114.3	R562 E563 T567 L568 C569	R562-F565 PolarHBondContact O-N 2.99Å; E563-F565 VanDerWaalsContact O-CD2 3.26Å; E563-F565 WeakPolarHBondContact O-CD2 3.34Å; E563-F565 WeakPolarHBondContact O-CE2 3.45Å; E563-F565 PolarHBondContact O-N 3.11Å; F565-T567 VanDerWaalsContact C-N 3.31Å; F565-T567 PolarHBondContact O-N 2.7Å; F565-L568 HydrophobicContact CB-CD1 4.17Å; F565-L568 HydrophobicContact CD1-CD1 3.82Å; F565-L568 HydrophobicContact CG-CD1 4.42Å; F565-L568 WeakPolarHBondContact O-CB 3.44Å; F565-L568 PolarHBondContact O-N 2.87Å; F565-L568 VanDerWaalsContact O-N 3.08Å; F565-C569 PolarHBondContact O-N 2.9Å
566	V	91.7	Very high	90.8	Very high	8 Å²	8	56.1 Å²	56.1	5%	0.048	28%	0.278	C	S	.	.	H	α-helix	trans	-61.3	-39.7	-171.6	-175.6	0	0	0	0	111.8	L406 F550 Y561 A564 L568 C569 L570	L406-V566 HydrophobicContact CD2-CG2 3.99Å; F550-V566 HydrophobicContact CD1-CG1 3.56Å; F550-V566 HydrophobicContact CE1-CG1 3.63Å; Y561-V566 HydrophobicContact CD1-CB 4.06Å; Y561-V566 HydrophobicContact CD2-CB 4.11Å; Y561-V566 HydrophobicContact CD2-CG1 4.34Å; Y561-V566 HydrophobicContact CD2-CG2 4.06Å; Y561-V566 HydrophobicContact CE1-CB 3.73Å; Y561-V566 HydrophobicContact CE1-CG1 4.05Å; Y561-V566 HydrophobicContact CE2-CB 3.76Å; Y561-V566 HydrophobicContact CE2-CG1 3.55Å; Y561-V566 HydrophobicContact CE2-CG2 4.09Å; Y561-V566 HydrophobicContact CG-CB 4.24Å; Y561-V566 HydrophobicContact CG-CG2 4.3Å; Y561-V566 PolarHBondContact O-N 2.62Å; Y561-V566 VanDerWaalsContact OH-CG1 3.31Å; Y561-V566 WeakPolarHBondContact OH-CG1 3.47Å; A564-V566 HydrophobicContact CB-CG2 3.59Å; A564-V566 PolarHBondContact O-N 3.44Å; A564-V566 VanDerWaalsContact O-N 3.16Å; V566-L568 PolarHBondContact O-N 3.35Å; V566-C569 PolarHBondContact O-N 3Å; V566-L570 WeakPolarHBondContact O-CB 3.29Å; V566-L570 PolarHBondContact O-N 3.3Å
567	T	87.3	Confident	91.2	Very high	24 Å²	24	51 Å²	51	15%	0.147	26%	0.256	C	S	.	.	H	α-helix	trans	-59.5	-30.5	178.2	51.3	0	0	0	0	113.6	Y561 F565 P571 C618 I619	Y561-T567 HydrophobicContact CD1-CG2 4.2Å; Y561-T567 HydrophobicContact CE1-CG2 3.58Å; F565-T567 VanDerWaalsContact C-N 3.31Å; F565-T567 PolarHBondContact O-N 2.7Å; T567-P571 VanDerWaalsContact O-CD 3.31Å; T567-P571 WeakPolarHBondContact O-CD 3.28Å; T567-C618 HydrophobicContact CG2-CB 4.04Å; T567-I619 HydrophobicContact CG2-CG1 4.48Å
568	L	88.9	Confident	91.6	Very high	122 Å²	122	47.6 Å²	47.6	64%	0.639	24%	0.243	S	C	*	.	H	α-helix	trans	-74.6	-31	177.6	-61.2	-178.3	0	0	0	112.2	F565 V566	F565-L568 HydrophobicContact CB-CD1 4.17Å; F565-L568 HydrophobicContact CD1-CD1 3.82Å; F565-L568 HydrophobicContact CG-CD1 4.42Å; F565-L568 WeakPolarHBondContact O-CB 3.44Å; F565-L568 PolarHBondContact O-N 2.87Å; F565-L568 VanDerWaalsContact O-N 3.08Å; V566-L568 PolarHBondContact O-N 3.35Å
569	C	91.1	Very high	92	Very high	64 Å²	64	48.2 Å²	48.2	43%	0.432	24%	0.238	S	C	.	.	H	α-helix	trans	-89.2	-26.5	-178.6	-65.4	0	0	0	0	112.6	F565 V566 K572 L573	F565-C569 PolarHBondContact O-N 2.9Å; V566-C569 PolarHBondContact O-N 3Å; C569-K572 WeakPolarHBondContact O-CB 3.47Å; C569-K572 PolarHBondContact O-N 2.85Å; C569-L573 PolarHBondContact O-N 3.49Å; C569-L573 VanDerWaalsContact O-N 3.1Å
570	L	92.4	Very high	92.4	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-56	-45.7	-172.6	-170.9	63.4	0	0	0	113.7	F550 V566 K572 L573 L574 F607 L622	F550-L570 HydrophobicContact CB-CD1 4.26Å; F550-L570 HydrophobicContact CD1-CD1 4.34Å; F550-L570 HydrophobicContact CD2-CD1 3.74Å; F550-L570 HydrophobicContact CE2-CD1 4.14Å; F550-L570 HydrophobicContact CG-CD1 3.86Å; V566-L570 WeakPolarHBondContact O-CB 3.29Å; V566-L570 PolarHBondContact O-N 3.3Å; L570-K572 PolarHBondContact O-N 3.44Å; L570-L573 PolarHBondContact O-N 2.94Å; L570-L573 VanDerWaalsContact O-N 3.17Å; L570-L574 HydrophobicContact CD1-CD1 3.9Å; L570-L574 HydrophobicContact CD1-CD2 4.3Å; L570-L574 HydrophobicContact CD1-CG 3.91Å; L570-L574 HydrophobicContact CD2-CD1 4.39Å; L570-L574 HydrophobicContact CG-CD1 3.73Å; L570-L574 HydrophobicContact CG-CG 4.14Å; L570-L574 WeakPolarHBondContact O-CB 3.49Å; L570-L574 VanDerWaalsContact O-CG 3.3Å; L570-L574 WeakPolarHBondContact O-CG 3.42Å; L570-L574 PolarHBondContact O-N 3.37Å; L570-F607 HydrophobicContact CD2-CE1 4.3Å; L570-F607 HydrophobicContact CD2-CE2 3.88Å; L570-F607 HydrophobicContact CD2-CZ 3.68Å; L570-L622 HydrophobicContact CB-CD1 4.42Å; L570-L622 HydrophobicContact CD2-CD1 4.02Å; L570-L622 HydrophobicContact CD2-CD2 3.74Å; L570-L622 HydrophobicContact CG-CD1 4.34Å
571	P	92.6	Very high	92.6	Very high	8 Å²	8	46.4 Å²	46.4	5%	0.052	23%	0.226	C	C	.	.	H	α-helix	trans	-57.2	-33.5	175.3	-25.3	33.9	0	0	0	113.8	T567 S575 L622 T625 V626	T567-P571 VanDerWaalsContact O-CD 3.31Å; T567-P571 WeakPolarHBondContact O-CD 3.28Å; P571-S575 WeakPolarHBondContact O-CB 3.33Å; P571-S575 PolarHBondContact O-N 3.17Å; P571-S575 VanDerWaalsContact O-N 3.14Å; P571-L622 HydrophobicContact CG-CD1 3.94Å; P571-T625 HydrophobicContact CB-CG2 4.24Å; P571-T625 HydrophobicContact CG-CG2 3.77Å; P571-V626 HydrophobicContact CB-CG2 4.04Å; P571-V626 HydrophobicContact CG-CG2 4.41Å
572	K	92.9	Very high	92.8	Very high	169 Å²	169	46.7 Å²	46.7	74%	0.735	23%	0.228	S	C	*	.	H	α-helix	trans	-74.2	-41.4	178.7	-65	-179.2	178.7	175.9	0	111.5	C569 L570 L574 S575	C569-K572 WeakPolarHBondContact O-CB 3.47Å; C569-K572 PolarHBondContact O-N 2.85Å; L570-K572 PolarHBondContact O-N 3.44Å; K572-L574 VanDerWaalsContact C-N 3.34Å; K572-S575 PolarHBondContact O-N 3.27Å
573	L	94.1	Very high	93.1	Very high	20 Å²	20	42.1 Å²	42.1	11%	0.105	21%	0.213	C	C	.	.	H	α-helix	trans	-65.6	-36.9	177.1	-69.5	173.4	0	0	0	112.2	L414 F550 C569 L570 P576	L414-L573 HydrophobicContact CD2-CD2 3.77Å; L414-L573 HydrophobicContact CG-CD2 4.46Å; F550-L573 HydrophobicContact CE2-CD1 4.4Å; F550-L573 HydrophobicContact CZ-CD1 3.85Å; C569-L573 PolarHBondContact O-N 3.49Å; C569-L573 VanDerWaalsContact O-N 3.1Å; L570-L573 PolarHBondContact O-N 2.94Å; L570-L573 VanDerWaalsContact O-N 3.17Å; L573-P576 WeakPolarHBondContact O-CD 3.29Å
574	L	95	Very high	93.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-81.3	-21.9	-178.9	-65.2	-177.7	0	0	0	113.6	F543 I546 L570 K572 P576 F577 I578 L604	F543-L574 HydrophobicContact CD2-CD2 4.33Å; F543-L574 HydrophobicContact CE2-CB 3.92Å; F543-L574 HydrophobicContact CE2-CD1 4.31Å; F543-L574 HydrophobicContact CE2-CD2 3.8Å; F543-L574 HydrophobicContact CE2-CG 4.21Å; F543-L574 HydrophobicContact CZ-CB 4.41Å; F543-L574 HydrophobicContact CZ-CD1 4.05Å; F543-L574 HydrophobicContact CZ-CD2 4.17Å; F543-L574 HydrophobicContact CZ-CG 4.44Å; I546-L574 HydrophobicContact CG2-CD2 3.97Å; L570-L574 HydrophobicContact CD1-CD1 3.9Å; L570-L574 HydrophobicContact CD1-CD2 4.3Å; L570-L574 HydrophobicContact CD1-CG 3.91Å; L570-L574 HydrophobicContact CD2-CD1 4.39Å; L570-L574 HydrophobicContact CG-CD1 3.73Å; L570-L574 HydrophobicContact CG-CG 4.14Å; L570-L574 WeakPolarHBondContact O-CB 3.49Å; L570-L574 VanDerWaalsContact O-CG 3.3Å; L570-L574 WeakPolarHBondContact O-CG 3.42Å; L570-L574 PolarHBondContact O-N 3.37Å; K572-L574 VanDerWaalsContact C-N 3.34Å; L574-P576 VanDerWaalsContact C-CD 3.5Å; L574-F577 PolarHBondContact O-N 2.94Å; L574-I578 HydrophobicContact CB-CD1 4.23Å; L574-I578 WeakPolarHBondContact O-CG1 3.29Å; L574-I578 PolarHBondContact O-N 3.02Å; L574-L604 HydrophobicContact CD1-CD2 3.71Å
575	S	95.7	Very high	93.4	Very high	25 Å²	25	37.2 Å²	37.2	18%	0.175	19%	0.186	C	C	.	.	H	α-helix	trans	-51	-46.6	-175.7	177.1	0	0	0	0	114.7	P571 K572 F577 I578 R579	P571-S575 WeakPolarHBondContact O-CB 3.33Å; P571-S575 PolarHBondContact O-N 3.17Å; P571-S575 VanDerWaalsContact O-N 3.14Å; K572-S575 PolarHBondContact O-N 3.27Å; S575-F577 VanDerWaalsContact C-N 3.32Å; S575-F577 PolarHBondContact O-N 2.99Å; S575-I578 PolarHBondContact O-N 3.26Å; S575-R579 WeakPolarHBondContact O-CB 3.28Å; S575-R579 VanDerWaalsContact O-CG 3.28Å; S575-R579 WeakPolarHBondContact O-CG 3.25Å; S575-R579 PolarHBondContact O-N 2.82Å
576	P	95.2	Very high	93.6	Very high	7 Å²	7	31.7 Å²	31.7	5%	0.045	16%	0.162	C	C	.	.	H	α-helix	trans	-59.3	-40.5	-179.1	-24.9	36.2	0	0	0	113.4	L417 I421 I424 L573 L574 L580	L417-P576 HydrophobicContact CD2-CB 4.03Å; L417-P576 HydrophobicContact CD2-CG 4.06Å; I421-P576 HydrophobicContact CD1-CG 3.97Å; I421-P576 HydrophobicContact CG1-CB 4.1Å; I421-P576 HydrophobicContact CG1-CG 3.86Å; I424-P576 HydrophobicContact CD1-CB 3.87Å; L573-P576 WeakPolarHBondContact O-CD 3.29Å; L574-P576 VanDerWaalsContact C-CD 3.5Å; P576-L580 WeakPolarHBondContact O-CB 3.36Å; P576-L580 PolarHBondContact O-N 2.97Å
577	F	95.6	Very high	93.7	Very high	14 Å²	14	31.4 Å²	31.4	6%	0.061	16%	0.16	C	C	.	.	H	α-helix	trans	-69.5	-40.5	178.7	-59.7	-82.9	0	0	0	112	L413 L417 F533 Y540 F543 I546 L574 S575 L580 E581	L413-F577 HydrophobicContact CD1-CE2 4.48Å; L413-F577 HydrophobicContact CD1-CZ 4.28Å; L417-F577 HydrophobicContact CD1-CE2 4.44Å; L417-F577 HydrophobicContact CD2-CE2 3.71Å; L417-F577 HydrophobicContact CD2-CZ 3.8Å; L417-F577 HydrophobicContact CG-CE2 4.5Å; F533-F577 HydrophobicContact CD1-CE1 4.5Å; F533-F577 AromaticContact CE1-CE1 3.77Å; F533-F577 HydrophobicContact CE1-CE1 3.77Å; F533-F577 HydrophobicContact CE1-CZ 4.29Å; F533-F577 HydrophobicContact CE2-CD1 4.17Å; F533-F577 HydrophobicContact CE2-CE1 4.06Å; F533-F577 HydrophobicContact CZ-CD1 4Å; F533-F577 AromaticContact CZ-CE1 3.52Å; F533-F577 HydrophobicContact CZ-CE1 3.52Å; F533-F577 HydrophobicContact CZ-CZ 4.21Å; Y540-F577 WeakPolarHBondContact O-CZ 3.47Å; F543-F577 HydrophobicContact CD2-CB 3.56Å; F543-F577 HydrophobicContact CD2-CG 4.21Å; F543-F577 HydrophobicContact CE2-CB 4.25Å; I546-F577 HydrophobicContact CD1-CD2 4.19Å; I546-F577 HydrophobicContact CD1-CE1 3.8Å; I546-F577 HydrophobicContact CD1-CE2 3.41Å; I546-F577 VanDerWaalsContact CD1-CE2 3.41Å; I546-F577 HydrophobicContact CD1-CZ 3.18Å; L574-F577 PolarHBondContact O-N 2.94Å; S575-F577 VanDerWaalsContact C-N 3.32Å; S575-F577 PolarHBondContact O-N 2.99Å; F577-L580 PolarHBondContact O-N 3.23Å; F577-E581 PolarHBondContact O-N 2.86Å
578	I	96.5	Very high	94.1	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-65	-45	177.1	-62.2	175.9	0	0	0	110.3	F543 L574 S575 L580 E581 M582 W600 V626 V630	F543-I578 HydrophobicContact CE2-CD1 4.17Å; F543-I578 HydrophobicContact CE2-CG1 3.71Å; F543-I578 HydrophobicContact CZ-CD1 4.36Å; F543-I578 HydrophobicContact CZ-CG1 4.24Å; L574-I578 HydrophobicContact CB-CD1 4.23Å; L574-I578 WeakPolarHBondContact O-CG1 3.29Å; L574-I578 PolarHBondContact O-N 3.02Å; S575-I578 PolarHBondContact O-N 3.26Å; I578-L580 PolarHBondContact O-N 2.79Å; I578-E581 PolarHBondContact O-N 3.19Å; I578-M582 HydrophobicContact CG2-CG 4.34Å; I578-M582 HydrophobicContact CG2-SD 3.8Å; I578-M582 WeakPolarHBondContact O-CB 3.34Å; I578-M582 VanDerWaalsContact O-CG 3.26Å; I578-M582 WeakPolarHBondContact O-CG 3.41Å; I578-M582 PolarHBondContact O-N 3.14Å; I578-W600 HydrophobicContact CB-CG 4.45Å; I578-W600 HydrophobicContact CD1-CB 4.43Å; I578-W600 HydrophobicContact CD1-CD2 4.23Å; I578-W600 HydrophobicContact CD1-CE3 4.05Å; I578-W600 HydrophobicContact CD1-CG 4.4Å; I578-W600 HydrophobicContact CG1-CB 3.82Å; I578-W600 HydrophobicContact CG1-CD2 4.2Å; I578-W600 HydrophobicContact CG1-CG 3.9Å; I578-W600 HydrophobicContact CG2-CD2 4.04Å; I578-W600 HydrophobicContact CG2-CG 4.1Å; I578-V626 HydrophobicContact CD1-CG1 3.37Å; I578-V626 HydrophobicContact CD1-CG2 4.49Å; I578-V630 HydrophobicContact CB-CG1 4.17Å; I578-V630 HydrophobicContact CG2-CG1 3.84Å
579	R	95.9	Very high	94.2	Very high	67 Å²	67	27.4 Å²	27.4	25%	0.253	14%	0.137	S	C	.	.	H	α-helix	trans	-57.9	-40.1	174.9	-72	168.8	66.3	-163.1	0.4	111.3	D425 E428 S575 M582 L583 V630	D425-R579 IonicContact OD1-CZ 3.28Å; D425-R579 IonicContact OD1-NH1 3.23Å; D425-R579 PolarHBondContact OD1-NH1 3.19Å; D425-R579 IonicContact OD1-NH2 2.75Å; D425-R579 PolarHBondContact OD1-NH2 3.3Å; E428-R579 IonicContact OE2-CZ 2.83Å; E428-R579 IonicContact OE2-NE 3.65Å; E428-R579 PolarHBondContact OE2-NE 3.33Å; E428-R579 IonicContact OE2-NH2 3.58Å; E428-R579 PolarHBondContact OE2-NH2 3.46Å; S575-R579 WeakPolarHBondContact O-CB 3.28Å; S575-R579 VanDerWaalsContact O-CG 3.28Å; S575-R579 WeakPolarHBondContact O-CG 3.25Å; S575-R579 PolarHBondContact O-N 2.82Å; R579-M582 PolarHBondContact O-N 2.87Å; R579-L583 PolarHBondContact O-N 3.45Å; R579-V630 HydrophobicContact CG-CG1 3.96Å
580	L	95	Very high	94	Very high	17 Å²	17	29.8 Å²	29.8	9%	0.089	15%	0.149	C	C	.	.	H	α-helix	trans	-69.6	-42.9	177.9	-168.1	64.4	0	0	0	112.7	I424 L427 A529 F533 P576 F577 I578 M582 L583	I424-L580 HydrophobicContact CG1-CD1 4.35Å; L427-L580 HydrophobicContact CD1-CD1 4.33Å; A529-L580 HydrophobicContact CB-CD1 3.55Å; A529-L580 HydrophobicContact CB-CD2 4.13Å; A529-L580 HydrophobicContact CB-CG 3.68Å; F533-L580 HydrophobicContact CD2-CD2 3.92Å; F533-L580 HydrophobicContact CE2-CD2 3.54Å; P576-L580 WeakPolarHBondContact O-CB 3.36Å; P576-L580 PolarHBondContact O-N 2.97Å; F577-L580 PolarHBondContact O-N 3.23Å; I578-L580 PolarHBondContact O-N 2.79Å; L580-M582 VanDerWaalsContact C-N 3.27Å; L580-M582 PolarHBondContact O-N 2.86Å; L580-L583 HydrophobicContact CD1-CD2 4.41Å; L580-L583 WeakPolarHBondContact O-CB 3.46Å; L580-L583 PolarHBondContact O-N 3.24Å
581	E	95	Very high	93.7	Very high	56 Å²	56	37.2 Å²	37.2	26%	0.262	19%	0.189	S	C	.	.	H	α-helix	trans	-65.5	-32.9	175.4	-162	-168.1	155.8	0	0	111.7	F577 I578 L583 K593 F598 N599 W600	F577-E581 PolarHBondContact O-N 2.86Å; I578-E581 PolarHBondContact O-N 3.19Å; E581-L583 VanDerWaalsContact C-N 3.26Å; E581-L583 PolarHBondContact O-N 3.08Å; E581-K593 IonicContact OE1-NZ 3Å; E581-F598 HydrophobicContact CG-CD1 4.01Å; E581-F598 WeakPolarHBondContact OE1-CA 3.38Å; E581-F598 VanDerWaalsContact OE1-CD1 3.3Å; E581-F598 WeakPolarHBondContact OE1-CD1 3.26Å; E581-N599 PolarHBondContact OE1-N 3.21Å; E581-N599 PolarHBondContact OE2-N 2.72Å; E581-W600 PolarHBondContact OE2-N 2.96Å
582	M	95.2	Very high	93.6	Very high	5 Å²	5	40 Å²	40	3%	0.025	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	11.7	179.3	-63.3	-173.1	74.6	0	0	113.5	I578 R579 L580 G584 W585 L595 F598 W600 V631 L634	I578-M582 HydrophobicContact CG2-CG 4.34Å; I578-M582 HydrophobicContact CG2-SD 3.8Å; I578-M582 WeakPolarHBondContact O-CB 3.34Å; I578-M582 VanDerWaalsContact O-CG 3.26Å; I578-M582 WeakPolarHBondContact O-CG 3.41Å; I578-M582 PolarHBondContact O-N 3.14Å; R579-M582 PolarHBondContact O-N 2.87Å; L580-M582 VanDerWaalsContact C-N 3.27Å; L580-M582 PolarHBondContact O-N 2.86Å; M582-G584 PolarHBondContact O-N 2.86Å; M582-W585 HydrophobicContact CB-CB 4.38Å; M582-W585 HydrophobicContact CE-CD2 3.66Å; M582-W585 HydrophobicContact CE-CE3 3.35Å; M582-W585 HydrophobicContact CE-CG 4.34Å; M582-W585 HydrophobicContact CE-CH2 3.99Å; M582-W585 HydrophobicContact CE-CZ2 4.28Å; M582-W585 HydrophobicContact CE-CZ3 3.52Å; M582-W585 VanDerWaalsContact O-CB 3.23Å; M582-W585 WeakPolarHBondContact O-CB 3.4Å; M582-W585 PolarHBondContact O-N 2.96Å; M582-L595 HydrophobicContact CE-CD2 3.76Å; M582-F598 HydrophobicContact CG-CD1 4.17Å; M582-F598 HydrophobicContact CG-CE1 3.87Å; M582-F598 HydrophobicContact CG-CZ 4.29Å; M582-W600 HydrophobicContact SD-CZ2 4.25Å; M582-V631 HydrophobicContact CE-CG1 4.36Å; M582-V631 HydrophobicContact CE-CG2 4.34Å; M582-V631 HydrophobicContact SD-CG2 4.11Å; M582-L634 HydrophobicContact CB-CD2 4.05Å; M582-L634 HydrophobicContact CE-CD2 4.03Å; M582-L634 HydrophobicContact SD-CD2 4.45Å
583	L	94.4	Very high	93.6	Very high	30 Å²	30	35.8 Å²	35.8	16%	0.157	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	121.8	-179.1	-169.6	62.8	0	0	0	111.3	L427 E428 A431 W525 R579 L580 E581 W585	L427-L583 HydrophobicContact CB-CD2 4.13Å; E428-L583 HydrophobicContact CB-CD1 4.36Å; A431-L583 HydrophobicContact CB-CD1 3.6Å; A431-L583 HydrophobicContact CB-CG 4.2Å; W525-L583 HydrophobicContact CB-CD2 3.69Å; W525-L583 HydrophobicContact CB-CG 4.11Å; W525-L583 HydrophobicContact CG-CD2 4.36Å; R579-L583 PolarHBondContact O-N 3.45Å; L580-L583 HydrophobicContact CD1-CD2 4.41Å; L580-L583 WeakPolarHBondContact O-CB 3.46Å; L580-L583 PolarHBondContact O-N 3.24Å; E581-L583 VanDerWaalsContact C-N 3.26Å; E581-L583 PolarHBondContact O-N 3.08Å; L583-W585 PolarHBondContact O-N 3.23Å
584	G	92.1	Very high	93.6	Very high	8 Å²	8	37.7 Å²	37.7	8%	0.082	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	71	11.7	-177.2	0	0	0	0	0	115.1	K522 M582	K522-G584 PolarHBondContact NZ-O 3.07Å; K522-G584 VanDerWaalsContact NZ-O 3.12Å; M582-G584 PolarHBondContact O-N 2.86Å
585	W	94.9	Very high	93.6	Very high	17 Å²	17	38.3 Å²	38.3	6%	0.064	20%	0.197	C	C	.	.			trans	-73.7	141.5	169.8	174.2	80.7	0	0	0	111.3	M582 L583 P587 K593 L595 F598 V631 L634 L635 L638 F657	M582-W585 HydrophobicContact CB-CB 4.38Å; M582-W585 HydrophobicContact CE-CD2 3.66Å; M582-W585 HydrophobicContact CE-CE3 3.35Å; M582-W585 HydrophobicContact CE-CG 4.34Å; M582-W585 HydrophobicContact CE-CH2 3.99Å; M582-W585 HydrophobicContact CE-CZ2 4.28Å; M582-W585 HydrophobicContact CE-CZ3 3.52Å; M582-W585 VanDerWaalsContact O-CB 3.23Å; M582-W585 WeakPolarHBondContact O-CB 3.4Å; M582-W585 PolarHBondContact O-N 2.96Å; L583-W585 PolarHBondContact O-N 3.23Å; W585-P587 HydrophobicContact CH2-CB 4.36Å; W585-P587 HydrophobicContact CH2-CG 4.17Å; W585-P587 HydrophobicContact CZ2-CB 4.19Å; W585-P587 HydrophobicContact CZ2-CG 4.46Å; W585-K593 PolarHBondContact NE1-O 3.11Å; W585-L595 HydrophobicContact CH2-CD2 3.92Å; W585-L595 HydrophobicContact CZ2-CD2 3.73Å; W585-F598 HydrophobicContact CB-CZ 4.29Å; W585-F598 AromaticContact CD1-CE2 3.93Å; W585-F598 AromaticContact CD1-CZ 3.43Å; W585-F598 VanDerWaalsContact CD1-CZ 3.43Å; W585-F598 HydrophobicContact CD2-CZ 4.48Å; W585-F598 AromaticContact CG-CZ 3.83Å; W585-F598 HydrophobicContact CG-CZ 3.83Å; W585-F598 AromaticContact NE1-CE2 3.8Å; W585-F598 AromaticContact NE1-CZ 3.8Å; W585-V631 HydrophobicContact CH2-CG1 4.41Å; W585-V631 HydrophobicContact CZ3-CG1 4.45Å; W585-L634 HydrophobicContact CE3-CD2 3.92Å; W585-L634 HydrophobicContact CZ3-CD2 4.22Å; W585-L635 HydrophobicContact CH2-CD2 3.86Å; W585-L635 HydrophobicContact CZ3-CD2 3.85Å; W585-L635 HydrophobicContact CZ3-CG 4.45Å; W585-L638 HydrophobicContact CE3-CD1 4.3Å; W585-L638 HydrophobicContact CZ3-CD1 4.34Å; W585-F657 HydrophobicContact CH2-CE1 4.3Å; W585-F657 HydrophobicContact CH2-CE2 4.25Å; W585-F657 AromaticContact CH2-CZ 3.72Å; W585-F657 HydrophobicContact CH2-CZ 3.72Å; W585-F657 HydrophobicContact CZ2-CE2 4.04Å; W585-F657 AromaticContact CZ2-CZ 3.98Å; W585-F657 HydrophobicContact CZ2-CZ 3.98Å
586	T	93.9	Very high	93.4	Very high	5 Å²	5	41.6 Å²	41.6	3%	0.031	21%	0.213	C	C	.	.			trans	-152	133.3	173.2	176.9	0	0	0	0	110.4	L588 E589 Y592	T586-L588 PolarHBondContact O-N 2.95Å; T586-L588 WeakPolarHBondContact OG1-CB 3.44Å; T586-L588 WeakPolarHBondContact OG1-CG 3.33Å; T586-L588 PolarHBondContact OG1-N 3.4Å; T586-E589 HydrophobicContact CG2-CG 3.83Å; T586-Y592 VanDerWaalsContact O-CB 3.31Å; T586-Y592 WeakPolarHBondContact O-CB 3.41Å
587	P	94.8	Very high	93.4	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.006	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	6.9	174.7	34.3	-36.3	0	0	0	112.7	W585 L635 F657	W585-P587 HydrophobicContact CH2-CB 4.36Å; W585-P587 HydrophobicContact CH2-CG 4.17Å; W585-P587 HydrophobicContact CZ2-CB 4.19Å; W585-P587 HydrophobicContact CZ2-CG 4.46Å; P587-L635 HydrophobicContact CG-CD2 3.72Å; P587-F657 HydrophobicContact CB-CB 4.23Å; P587-F657 HydrophobicContact CB-CD1 4.06Å; P587-F657 HydrophobicContact CB-CD2 3.93Å; P587-F657 HydrophobicContact CB-CE1 4.45Å; P587-F657 HydrophobicContact CB-CE2 4.32Å; P587-F657 HydrophobicContact CB-CG 3.78Å; P587-F657 HydrophobicContact CG-CD1 4.23Å; P587-F657 HydrophobicContact CG-CE1 4.47Å; P587-F657 HydrophobicContact CG-CG 4.44Å
588	L	94.8	Very high	93.4	Very high	9 Å²	9	41.9 Å²	41.9	5%	0.047	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-3.6	-176.9	-55.7	176.1	0	0	0	113.6	T586 V642 W643 Q650 L653 L654	T586-L588 PolarHBondContact O-N 2.95Å; T586-L588 WeakPolarHBondContact OG1-CB 3.44Å; T586-L588 WeakPolarHBondContact OG1-CG 3.33Å; T586-L588 PolarHBondContact OG1-N 3.4Å; L588-V642 HydrophobicContact CD1-CB 4.33Å; L588-V642 HydrophobicContact CD1-CG1 4.08Å; L588-W643 HydrophobicContact CD1-CB 3.89Å; L588-W643 HydrophobicContact CD2-CB 4.41Å; L588-W643 HydrophobicContact CD2-CG 4.35Å; L588-Q650 HydrophobicContact CB-CG 4.29Å; L588-Q650 HydrophobicContact CD2-CB 4.41Å; L588-L653 WeakPolarHBondContact O-CD1 3.21Å; L588-L654 HydrophobicContact CD2-CB 3.8Å; L588-L654 HydrophobicContact CD2-CD1 4.17Å; L588-L654 HydrophobicContact CD2-CD2 4.45Å; L588-L654 HydrophobicContact CD2-CG 4.35Å
589	E	90.8	Very high	93.3	Very high	53 Å²	53	45.2 Å²	45.2	25%	0.248	23%	0.234	C	C	.	.	S	Bend	trans	-103.1	143.9	179.1	-68.4	-174.4	154.5	0	0	110.8	R438 F518 T586 N591 Y592	R438-E589 IonicContact CZ-OE1 3.72Å; R438-E589 IonicContact NH1-OE1 3.9Å; R438-E589 PolarHBondContact NH1-OE1 3.3Å; F518-E589 WeakPolarHBondContact CE1-OE1 3.39Å; F518-E589 WeakPolarHBondContact CZ-OE1 3.45Å; T586-E589 HydrophobicContact CG2-CG 3.83Å; E589-N591 PolarHBondContact O-N 2.88Å; E589-N591 VanDerWaalsContact O-N 3.15Å; E589-Y592 WeakPolarHBondContact O-CB 3.37Å; E589-Y592 VanDerWaalsContact O-CD1 3.29Å; E589-Y592 WeakPolarHBondContact O-CD1 3.37Å; E589-Y592 PolarHBondContact O-N 2.84Å; E589-Y592 VanDerWaalsContact O-N 3.16Å
590	V	86.6	Confident	93.2	Very high	114 Å²	114	42 Å²	42	69%	0.691	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-33.3	-174.3	179	0	0	0	0	113	L653	V590-L653 HydrophobicContact CG2-CD1 4.26Å
591	N	86.7	Confident	93.3	Very high	157 Å²	157	42.8 Å²	42.8	84%	0.84	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107	40.4	-178.5	-59.5	-29.1	0	0	0	111.3	E589	E589-N591 PolarHBondContact O-N 2.88Å; E589-N591 VanDerWaalsContact O-N 3.15Å
592	Y	91	Very high	93.2	Very high	65 Å²	65	46.1 Å²	46.1	26%	0.255	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-64.8	145.5	177.4	74.4	-89.1	0	0	0	111	T586 E589 L653 F657	T586-Y592 VanDerWaalsContact O-CB 3.31Å; T586-Y592 WeakPolarHBondContact O-CB 3.41Å; E589-Y592 WeakPolarHBondContact O-CB 3.37Å; E589-Y592 VanDerWaalsContact O-CD1 3.29Å; E589-Y592 WeakPolarHBondContact O-CD1 3.37Å; E589-Y592 PolarHBondContact O-N 2.84Å; E589-Y592 VanDerWaalsContact O-N 3.16Å; Y592-L653 HydrophobicContact CE1-CD2 4.28Å; Y592-F657 AromaticContact CE2-CD2 3.92Å; Y592-F657 HydrophobicContact CE2-CD2 3.92Å; Y592-F657 HydrophobicContact CE2-CE2 4.37Å
593	K	92.5	Very high	93.1	Very high	82 Å²	82	47 Å²	47	36%	0.357	24%	0.24	S	C	.	.	P	Polyproline II helix	trans	-74.9	119.6	174.3	-176.1	177.2	176.7	-170	0	108.6	E581 W585 S597 F598	E581-K593 IonicContact OE1-NZ 3Å; W585-K593 PolarHBondContact NE1-O 3.11Å; K593-S597 VanDerWaalsContact CE-C 3.45Å; K593-S597 WeakPolarHBondContact CE-O 3.46Å; K593-S597 VanDerWaalsContact CE-OG 3.23Å; K593-S597 WeakPolarHBondContact CE-OG 3.39Å; K593-S597 WeakPolarHBondContact CG-OG 3.37Å; K593-S597 PolarHBondContact NZ-O 3.41Å; K593-F598 HydrophobicContact CB-CE2 4.14Å; K593-F598 HydrophobicContact CB-CZ 4.22Å; K593-F598 HydrophobicContact CD-CD1 4.31Å; K593-F598 HydrophobicContact CD-CD2 4.23Å; K593-F598 HydrophobicContact CD-CE1 4.03Å; K593-F598 HydrophobicContact CD-CE2 3.97Å; K593-F598 HydrophobicContact CD-CG 4.41Å; K593-F598 HydrophobicContact CD-CZ 3.86Å; K593-F598 HydrophobicContact CG-CD2 4.24Å; K593-F598 HydrophobicContact CG-CE2 3.84Å; K593-F598 HydrophobicContact CG-CZ 4.11Å
594	P	93.8	Very high	93	Very high	59 Å²	59	45.9 Å²	45.9	38%	0.383	24%	0.235	S	C	.	.	P	Polyproline II helix	trans	-68.9	154.1	178.4	31.1	-36.3	0	0	0	110.9	D596 S597 F598	P594-D596 VanDerWaalsContact C-N 3.3Å; P594-D596 VanDerWaalsContact CB-OD1 3.23Å; P594-D596 WeakPolarHBondContact CB-OD1 3.23Å; P594-D596 VanDerWaalsContact CG-OD1 3.29Å; P594-D596 WeakPolarHBondContact CG-OD1 3.38Å; P594-D596 PolarHBondContact O-N 3.49Å; P594-S597 PolarHBondContact O-N 2.89Å; P594-S597 VanDerWaalsContact O-N 3.13Å; P594-S597 PolarHBondContact O-OG 3.4Å; P594-F598 WeakPolarHBondContact O-CD2 3.47Å
595	L	94.3	Very high	92.9	Very high	13 Å²	13	50.5 Å²	50.5	7%	0.068	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-61.1	-37.5	-171	-68	-178.5	0	0	0	113.1	M582 W585 S597 F598 W600 Y601 V631 F657 L661	M582-L595 HydrophobicContact CE-CD2 3.76Å; W585-L595 HydrophobicContact CH2-CD2 3.92Å; W585-L595 HydrophobicContact CZ2-CD2 3.73Å; L595-S597 PolarHBondContact O-N 3.17Å; L595-F598 HydrophobicContact CD2-CE2 4.47Å; L595-F598 WeakPolarHBondContact O-CD2 3.28Å; L595-F598 PolarHBondContact O-N 3.33Å; L595-W600 HydrophobicContact CD2-CZ2 4.39Å; L595-Y601 WeakPolarHBondContact O-CB 3.38Å; L595-V631 HydrophobicContact CD1-CG1 4.31Å; L595-V631 HydrophobicContact CD2-CG1 4.29Å; L595-F657 HydrophobicContact CD1-CE2 4.37Å; L595-F657 HydrophobicContact CD1-CZ 3.96Å; L595-F657 HydrophobicContact CG-CE2 4.21Å; L595-F657 HydrophobicContact CG-CZ 4.17Å; L595-L661 HydrophobicContact CD1-CD1 3.88Å
596	D	92.7	Very high	92.5	Very high	94 Å²	94	55.4 Å²	55.4	50%	0.503	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-63.6	-18.4	178.7	62.6	-17.4	0	0	0	114.5	P594 Y601	P594-D596 VanDerWaalsContact C-N 3.3Å; P594-D596 VanDerWaalsContact CB-OD1 3.23Å; P594-D596 WeakPolarHBondContact CB-OD1 3.23Å; P594-D596 VanDerWaalsContact CG-OD1 3.29Å; P594-D596 WeakPolarHBondContact CG-OD1 3.38Å; P594-D596 PolarHBondContact O-N 3.49Å; D596-Y601 HydrophobicContact CB-CD1 4.15Å; D596-Y601 HydrophobicContact CB-CE1 4.04Å
597	S	94	Very high	92.3	Very high	22 Å²	22	55.4 Å²	55.4	15%	0.154	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-90.3	-4.9	179.5	73.5	0	0	0	0	114.3	K593 P594 L595 R602	K593-S597 VanDerWaalsContact CE-C 3.45Å; K593-S597 WeakPolarHBondContact CE-O 3.46Å; K593-S597 VanDerWaalsContact CE-OG 3.23Å; K593-S597 WeakPolarHBondContact CE-OG 3.39Å; K593-S597 WeakPolarHBondContact CG-OG 3.37Å; K593-S597 PolarHBondContact NZ-O 3.41Å; P594-S597 PolarHBondContact O-N 2.89Å; P594-S597 VanDerWaalsContact O-N 3.13Å; P594-S597 PolarHBondContact O-OG 3.4Å; L595-S597 PolarHBondContact O-N 3.17Å; S597-R602 VanDerWaalsContact O-CZ 3.27Å; S597-R602 PolarHBondContact O-NH1 3.45Å; S597-R602 PolarHBondContact O-NH2 3.21Å
598	F	95.8	Very high	91.6	Very high	5 Å²	5	55.4 Å²	55.4	2%	0.022	28%	0.283	C	S	.	.	S	Bend	trans	-74.9	149.6	173.9	-74.6	-95	0	0	0	111.8	E581 M582 W585 K593 P594 L595 W600 Y601 R602	E581-F598 HydrophobicContact CG-CD1 4.01Å; E581-F598 WeakPolarHBondContact OE1-CA 3.38Å; E581-F598 VanDerWaalsContact OE1-CD1 3.3Å; E581-F598 WeakPolarHBondContact OE1-CD1 3.26Å; M582-F598 HydrophobicContact CG-CD1 4.17Å; M582-F598 HydrophobicContact CG-CE1 3.87Å; M582-F598 HydrophobicContact CG-CZ 4.29Å; W585-F598 HydrophobicContact CB-CZ 4.29Å; W585-F598 AromaticContact CD1-CE2 3.93Å; W585-F598 AromaticContact CD1-CZ 3.43Å; W585-F598 VanDerWaalsContact CD1-CZ 3.43Å; W585-F598 HydrophobicContact CD2-CZ 4.48Å; W585-F598 AromaticContact CG-CZ 3.83Å; W585-F598 HydrophobicContact CG-CZ 3.83Å; W585-F598 AromaticContact NE1-CE2 3.8Å; W585-F598 AromaticContact NE1-CZ 3.8Å; K593-F598 HydrophobicContact CB-CE2 4.14Å; K593-F598 HydrophobicContact CB-CZ 4.22Å; K593-F598 HydrophobicContact CD-CD1 4.31Å; K593-F598 HydrophobicContact CD-CD2 4.23Å; K593-F598 HydrophobicContact CD-CE1 4.03Å; K593-F598 HydrophobicContact CD-CE2 3.97Å; K593-F598 HydrophobicContact CD-CG 4.41Å; K593-F598 HydrophobicContact CD-CZ 3.86Å; K593-F598 HydrophobicContact CG-CD2 4.24Å; K593-F598 HydrophobicContact CG-CE2 3.84Å; K593-F598 HydrophobicContact CG-CZ 4.11Å; P594-F598 WeakPolarHBondContact O-CD2 3.47Å; L595-F598 HydrophobicContact CD2-CE2 4.47Å; L595-F598 WeakPolarHBondContact O-CD2 3.28Å; L595-F598 PolarHBondContact O-N 3.33Å; F598-W600 VanDerWaalsContact C-N 3.34Å; F598-W600 VanDerWaalsContact CB-CD1 3.43Å; F598-W600 HydrophobicContact CB-CG 4.17Å; F598-W600 VanDerWaalsContact CB-NE1 3.27Å; F598-W600 AromaticContact CD1-NE1 3.84Å; F598-W600 AromaticContact CG-CD1 3.99Å; F598-W600 AromaticContact CG-NE1 3.54Å; F598-Y601 WeakPolarHBondContact O-CB 3.43Å; F598-Y601 PolarHBondContact O-N 2.73Å; F598-R602 WeakPolarHBondContact O-CG 3.45Å; F598-R602 PolarHBondContact O-N 2.73Å; F598-R602 VanDerWaalsContact O-N 3.14Å
599	N	94.2	Very high	90.9	Very high	71 Å²	71	57.1 Å²	57.1	38%	0.38	30%	0.296	S	S	.	.	H	α-helix	trans	-67.5	-39.1	-179.4	-66.5	-16.6	0	0	0	110.6	E581 Y601 R602 S603	E581-N599 PolarHBondContact OE1-N 3.21Å; E581-N599 PolarHBondContact OE2-N 2.72Å; N599-Y601 VanDerWaalsContact C-N 3.25Å; N599-Y601 PolarHBondContact O-N 2.92Å; N599-R602 PolarHBondContact O-N 3.13Å; N599-S603 VanDerWaalsContact O-CB 3.31Å; N599-S603 WeakPolarHBondContact O-CB 3.32Å; N599-S603 PolarHBondContact O-N 3.4Å; N599-S603 PolarHBondContact O-OG 3.48Å
600	W	95.6	Very high	90	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-57.8	-40.2	173.5	71.9	-101.9	0	0	0	112.4	F543 I578 E581 M582 L595 F598 L604 V626 V627 V631	F543-W600 HydrophobicContact CD1-CB 4.13Å; F543-W600 HydrophobicContact CD2-CB 4.39Å; F543-W600 HydrophobicContact CE1-CB 3.7Å; F543-W600 HydrophobicContact CE2-CB 3.94Å; F543-W600 HydrophobicContact CG-CB 4.46Å; F543-W600 HydrophobicContact CZ-CB 3.57Å; I578-W600 HydrophobicContact CB-CG 4.45Å; I578-W600 HydrophobicContact CD1-CB 4.43Å; I578-W600 HydrophobicContact CD1-CD2 4.23Å; I578-W600 HydrophobicContact CD1-CE3 4.05Å; I578-W600 HydrophobicContact CD1-CG 4.4Å; I578-W600 HydrophobicContact CG1-CB 3.82Å; I578-W600 HydrophobicContact CG1-CD2 4.2Å; I578-W600 HydrophobicContact CG1-CG 3.9Å; I578-W600 HydrophobicContact CG2-CD2 4.04Å; I578-W600 HydrophobicContact CG2-CG 4.1Å; E581-W600 PolarHBondContact OE2-N 2.96Å; M582-W600 HydrophobicContact SD-CZ2 4.25Å; L595-W600 HydrophobicContact CD2-CZ2 4.39Å; F598-W600 VanDerWaalsContact C-N 3.34Å; F598-W600 VanDerWaalsContact CB-CD1 3.43Å; F598-W600 HydrophobicContact CB-CG 4.17Å; F598-W600 VanDerWaalsContact CB-NE1 3.27Å; F598-W600 AromaticContact CD1-NE1 3.84Å; F598-W600 AromaticContact CG-CD1 3.99Å; F598-W600 AromaticContact CG-NE1 3.54Å; W600-L604 HydrophobicContact CE3-CD1 3.95Å; W600-L604 HydrophobicContact CZ3-CD1 4.28Å; W600-L604 WeakPolarHBondContact O-CB 3.44Å; W600-L604 VanDerWaalsContact O-CG 3.31Å; W600-L604 WeakPolarHBondContact O-CG 3.47Å; W600-L604 PolarHBondContact O-N 3.48Å; W600-V626 HydrophobicContact CE3-CG1 4.12Å; W600-V626 HydrophobicContact CH2-CG1 4.26Å; W600-V626 HydrophobicContact CZ3-CG1 3.69Å; W600-V627 HydrophobicContact CH2-CG2 4.3Å; W600-V631 HydrophobicContact CH2-CG2 4.3Å; W600-V631 HydrophobicContact CZ2-CG2 4.2Å
601	Y	95.4	Very high	89.1	Confident	32 Å²	32	59.5 Å²	59.5	13%	0.125	31%	0.313	C	S	.	.	H	α-helix	trans	-67.1	-48.3	-179	-168	-80.5	0	0	0	111.2	L595 D596 F598 N599 S603 L604 L605 I623 Y665	L595-Y601 WeakPolarHBondContact O-CB 3.38Å; D596-Y601 HydrophobicContact CB-CD1 4.15Å; D596-Y601 HydrophobicContact CB-CE1 4.04Å; F598-Y601 WeakPolarHBondContact O-CB 3.43Å; F598-Y601 PolarHBondContact O-N 2.73Å; N599-Y601 VanDerWaalsContact C-N 3.25Å; N599-Y601 PolarHBondContact O-N 2.92Å; Y601-S603 VanDerWaalsContact C-N 3.32Å; Y601-S603 PolarHBondContact O-N 3.07Å; Y601-L604 PolarHBondContact O-N 2.92Å; Y601-L605 WeakPolarHBondContact O-CB 3.25Å; Y601-L605 PolarHBondContact O-N 3.14Å; Y601-I623 HydrophobicContact CD2-CG2 4.17Å; Y601-I623 HydrophobicContact CE1-CD1 4.36Å; Y601-I623 HydrophobicContact CE2-CD1 4.42Å; Y601-I623 HydrophobicContact CE2-CG2 3.49Å; Y601-I623 VanDerWaalsContact CE2-CG2 3.49Å; Y601-Y665 WeakPolarHBondContact CE2-OH 3.24Å; Y601-Y665 PolarHBondContact OH-OH 3.24Å
602	R	93.7	Very high	88.4	Confident	126 Å²	126	53.9 Å²	53.9	48%	0.475	29%	0.292	S	S	.	.	H	α-helix	trans	-62.5	-41.1	178.8	-67.4	177.5	-176.1	139.5	-2.8	111.9	S597 F598 N599 L605 L606	S597-R602 VanDerWaalsContact O-CZ 3.27Å; S597-R602 PolarHBondContact O-NH1 3.45Å; S597-R602 PolarHBondContact O-NH2 3.21Å; F598-R602 WeakPolarHBondContact O-CG 3.45Å; F598-R602 PolarHBondContact O-N 2.73Å; F598-R602 VanDerWaalsContact O-N 3.14Å; N599-R602 PolarHBondContact O-N 3.13Å; R602-L605 PolarHBondContact O-N 3.36Å; R602-L606 WeakPolarHBondContact O-CG 3.46Å; R602-L606 PolarHBondContact O-N 2.96Å
603	S	92.5	Very high	87.4	Confident	23 Å²	23	58.1 Å²	58.1	16%	0.161	32%	0.318	C	S	.	.	H	α-helix	trans	-65.6	-40.2	178.2	-59	0	0	0	0	111.7	N599 Y601 L606 F607	N599-S603 VanDerWaalsContact O-CB 3.31Å; N599-S603 WeakPolarHBondContact O-CB 3.32Å; N599-S603 PolarHBondContact O-N 3.4Å; N599-S603 PolarHBondContact O-OG 3.48Å; Y601-S603 VanDerWaalsContact C-N 3.32Å; Y601-S603 PolarHBondContact O-N 3.07Å; S603-L606 PolarHBondContact O-N 3.22Å; S603-F607 PolarHBondContact O-N 2.94Å
604	L	92.7	Very high	86.3	Confident	8 Å²	8	55.5 Å²	55.5	4%	0.042	31%	0.31	C	S	.	.	H	α-helix	trans	-72.1	-30.4	174.4	-71.6	-174.6	0	0	0	113.4	F543 L574 W600 Y601 L606 F607 L622 I623 V626	F543-L604 HydrophobicContact CE1-CG 4.33Å; F543-L604 HydrophobicContact CZ-CD1 4.49Å; F543-L604 HydrophobicContact CZ-CD2 4.4Å; F543-L604 HydrophobicContact CZ-CG 4.14Å; L574-L604 HydrophobicContact CD1-CD2 3.71Å; W600-L604 HydrophobicContact CE3-CD1 3.95Å; W600-L604 HydrophobicContact CZ3-CD1 4.28Å; W600-L604 WeakPolarHBondContact O-CB 3.44Å; W600-L604 VanDerWaalsContact O-CG 3.31Å; W600-L604 WeakPolarHBondContact O-CG 3.47Å; W600-L604 PolarHBondContact O-N 3.48Å; Y601-L604 PolarHBondContact O-N 2.92Å; L604-L606 VanDerWaalsContact C-N 3.25Å; L604-L606 PolarHBondContact O-N 3.36Å; L604-F607 HydrophobicContact CD2-CD2 4.46Å; L604-F607 WeakPolarHBondContact O-CB 3.27Å; L604-F607 PolarHBondContact O-N 3.41Å; L604-L622 HydrophobicContact CD2-CD2 3.73Å; L604-L622 HydrophobicContact CD2-CG 4.29Å; L604-I623 HydrophobicContact CB-CD1 4.19Å; L604-I623 HydrophobicContact CB-CG1 3.77Å; L604-I623 HydrophobicContact CD1-CG1 4.41Å; L604-V626 HydrophobicContact CD1-CB 4.42Å; L604-V626 HydrophobicContact CD1-CG1 4.4Å; L604-V626 HydrophobicContact CD1-CG2 3.94Å
605	L	89.5	Confident	85	Confident	104 Å²	104	61.7 Å²	61.7	55%	0.545	33%	0.334	S	S	.	.	H	α-helix	trans	-66.3	-31.7	176.3	-174.9	66.5	0	0	0	111.8	Y601 R602 F607 I623	Y601-L605 WeakPolarHBondContact O-CB 3.25Å; Y601-L605 PolarHBondContact O-N 3.14Å; R602-L605 PolarHBondContact O-N 3.36Å; L605-F607 VanDerWaalsContact C-N 3.35Å; L605-I623 HydrophobicContact CB-CD1 4.27Å; L605-I623 HydrophobicContact CD1-CD1 4.3Å
606	L	87.3	Confident	83.9	Confident	120 Å²	120	63 Å²	63	63%	0.628	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	2.5	176.4	-61.5	175.4	0	0	0	113	R602 S603 L604 G608 C609	R602-L606 WeakPolarHBondContact O-CG 3.46Å; R602-L606 PolarHBondContact O-N 2.96Å; S603-L606 PolarHBondContact O-N 3.22Å; L604-L606 VanDerWaalsContact C-N 3.25Å; L604-L606 PolarHBondContact O-N 3.36Å; L606-G608 PolarHBondContact O-N 2.9Å; L606-C609 WeakPolarHBondContact O-CB 3.44Å; L606-C609 PolarHBondContact O-N 3.25Å
607	F	88.9	Confident	83.1	Confident	6 Å²	6	65.2 Å²	65.2	3%	0.026	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	127.2	-175.7	-170.9	-83.1	0	0	0	111.8	C547 F550 L570 S603 L604 L605 C609 I619 L622	C547-F607 HydrophobicContact CB-CD2 4.43Å; C547-F607 WeakPolarHBondContact O-CE2 3.31Å; F550-F607 HydrophobicContact CB-CE2 3.83Å; F550-F607 HydrophobicContact CB-CZ 3.93Å; L570-F607 HydrophobicContact CD2-CE1 4.3Å; L570-F607 HydrophobicContact CD2-CE2 3.88Å; L570-F607 HydrophobicContact CD2-CZ 3.68Å; S603-F607 PolarHBondContact O-N 2.94Å; L604-F607 HydrophobicContact CD2-CD2 4.46Å; L604-F607 WeakPolarHBondContact O-CB 3.27Å; L604-F607 PolarHBondContact O-N 3.41Å; L605-F607 VanDerWaalsContact C-N 3.35Å; F607-C609 PolarHBondContact O-N 3.18Å; F607-I619 HydrophobicContact CD1-CD1 4.35Å; F607-I619 HydrophobicContact CD1-CG2 4.04Å; F607-I619 HydrophobicContact CE1-CD1 4.19Å; F607-L622 HydrophobicContact CD1-CD2 4.07Å; F607-L622 HydrophobicContact CE1-CD2 4.42Å; F607-L622 HydrophobicContact CG-CD2 4.15Å
608	G	81.3	Confident	82.2	Confident	0 Å²	0	66 Å²	66	0%	0	35%	0.351	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	13.7	179.6	0	0	0	0	0	114.3	S551 L606	S551-G608 WeakPolarHBondContact OG-CA 3.45Å; S551-G608 PolarHBondContact OG-N 3.29Å; L606-G608 PolarHBondContact O-N 2.9Å
609	C	79.3	Confident	81.6	Confident	45 Å²	45	66.3 Å²	66.3	30%	0.304	35%	0.353	S	S	.	.			trans	-86.4	-4.1	-177.5	-72.4	0	0	0	0	114	L606 F607 S611 G612	L606-C609 WeakPolarHBondContact O-CB 3.44Å; L606-C609 PolarHBondContact O-N 3.25Å; F607-C609 PolarHBondContact O-N 3.18Å; C609-S611 VanDerWaalsContact C-N 3.29Å; C609-S611 PolarHBondContact O-N 3.12Å; C609-G612 CarbonylContact C-O 3.58Å; C609-G612 VanDerWaalsContact CA-O 3.29Å; C609-G612 WeakPolarHBondContact CA-O 3.1Å; C609-G612 PolarHBondContact O-N 3.46Å
610	D	73	Confident	81.1	Confident	127 Å²	127	67.3 Å²	67.3	68%	0.679	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-30.6	-175.8	-69.3	-22.9	0	0	0	112.2
611	S	66.7	Low	80.7	Confident	91 Å²	91	68.8 Å²	68.8	64%	0.636	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.7	-0.4	178.6	58.9	0	0	0	0	114.4	D555 C609	D555-S611 WeakPolarHBondContact OD1-CB 3.37Å; D555-S611 PolarHBondContact OD1-OG 3Å; C609-S611 VanDerWaalsContact C-N 3.29Å; C609-S611 PolarHBondContact O-N 3.12Å
612	G	72.1	Confident	80.5	Confident	38 Å²	38	67.6 Å²	67.6	39%	0.392	37%	0.366	S	S	.	.	S	Bend	trans	128.1	-173	-173.3	0	0	0	0	0	111.8	C609	C609-G612 CarbonylContact C-O 3.58Å; C609-G612 VanDerWaalsContact CA-O 3.29Å; C609-G612 WeakPolarHBondContact CA-O 3.1Å; C609-G612 PolarHBondContact O-N 3.46Å
613	L	70.9	Confident	80.5	Confident	154 Å²	154	62.4 Å²	62.4	81%	0.806	35%	0.348	S	S	*	.	S	Bend	trans	-68.5	130	174.6	-74.8	169.1	0	0	0	109.6	E615	L613-E615 PolarHBondContact O-N 3.45Å; L613-E615 VanDerWaalsContact O-N 3.09Å
614	P	68.1	Low	80.6	Confident	27 Å²	27	62.2 Å²	62.2	18%	0.175	35%	0.346	C	S	.	.			trans	-59.3	116.3	177.9	-20.9	29.3	0	0	0	111	I619	P614-I619 HydrophobicContact CB-CB 3.95Å; P614-I619 HydrophobicContact CB-CD1 4.26Å; P614-I619 HydrophobicContact CB-CG2 3.69Å; P614-I619 HydrophobicContact CG-CG2 3.77Å
615	E	67.8	Low	80.6	Confident	190 Å²	190	63.7 Å²	63.7	89%	0.888	36%	0.355	S	S	*	.			trans	-78.9	-24.3	173.9	-64.4	-173.9	173.6	0	0	111.7	L613 H617	L613-E615 PolarHBondContact O-N 3.45Å; L613-E615 VanDerWaalsContact O-N 3.09Å; E615-H617 PolarHBondContact O-N 2.78Å
616	E	71.4	Confident	80.8	Confident	41 Å²	41	58.7 Å²	58.7	19%	0.192	33%	0.329	C	S	.	.			trans	-72.1	118.8	-177.2	-65.6	-161.3	162.7	0	0	111.7	Y554 R562 C618 I619 V620	Y554-E616 HydrophobicContact CE2-CG 4.43Å; Y554-E616 WeakPolarHBondContact OH-CG 3.31Å; R562-E616 IonicContact NH1-OE1 2.62Å; R562-E616 PolarHBondContact NH1-OE1 3.49Å; E616-C618 VanDerWaalsContact CB-SG 3.6Å; E616-C618 PolarHBondContact O-N 2.98Å; E616-C618 PolarHBondContact OE2-SG 2.94Å; E616-I619 PolarHBondContact O-N 3.21Å; E616-V620 PolarHBondContact O-N 3.48Å
617	H	75.2	Confident	81.2	Confident	139 Å²	139	53 Å²	53	64%	0.644	30%	0.3	S	S	*	.	H	α-helix	trans	-51.2	-33.1	177.6	-178.8	-85	0	0	0	113	E615 I619 V620 V621	E615-H617 PolarHBondContact O-N 2.78Å; H617-I619 PolarHBondContact O-N 3.47Å; H617-V620 PolarHBondContact O-N 3.37Å; H617-V621 WeakPolarHBondContact CE1-CG1 3.1Å; H617-V621 WeakPolarHBondContact O-CG2 3.47Å; H617-V621 PolarHBondContact O-N 3Å
618	C	75.5	Confident	81.5	Confident	38 Å²	38	54 Å²	54	26%	0.257	31%	0.305	S	S	.	.	H	α-helix	trans	-63.1	-27.6	179.8	61.8	0	0	0	0	113.4	T567 E616	T567-C618 HydrophobicContact CG2-CB 4.04Å; E616-C618 VanDerWaalsContact CB-SG 3.6Å; E616-C618 PolarHBondContact O-N 2.98Å; E616-C618 PolarHBondContact OE2-SG 2.94Å
619	I	81.9	Confident	82	Confident	12 Å²	12	59.3 Å²	59.3	6%	0.062	33%	0.327	C	S	.	.	H	α-helix	trans	-84.5	-41.6	173.8	-64.9	-174.2	0	0	0	110.7	Y554 T567 F607 P614 E616 H617 V621 L622	Y554-I619 HydrophobicContact CD1-CD1 3.55Å; Y554-I619 HydrophobicContact CD2-CD1 3.6Å; Y554-I619 HydrophobicContact CE1-CD1 3.24Å; Y554-I619 HydrophobicContact CE2-CD1 3.3Å; Y554-I619 HydrophobicContact CE2-CG1 4.3Å; Y554-I619 HydrophobicContact CG-CD1 3.7Å; T567-I619 HydrophobicContact CG2-CG1 4.48Å; F607-I619 HydrophobicContact CD1-CD1 4.35Å; F607-I619 HydrophobicContact CD1-CG2 4.04Å; F607-I619 HydrophobicContact CE1-CD1 4.19Å; P614-I619 HydrophobicContact CB-CB 3.95Å; P614-I619 HydrophobicContact CB-CD1 4.26Å; P614-I619 HydrophobicContact CB-CG2 3.69Å; P614-I619 HydrophobicContact CG-CG2 3.77Å; E616-I619 PolarHBondContact O-N 3.21Å; H617-I619 PolarHBondContact O-N 3.47Å; I619-V621 PolarHBondContact O-N 2.99Å; I619-L622 WeakPolarHBondContact O-CB 3.37Å; I619-L622 PolarHBondContact O-N 3.27Å
620	V	83.8	Confident	82.8	Confident	93 Å²	93	57.7 Å²	57.7	56%	0.564	32%	0.316	S	S	*	.	H	α-helix	trans	-57.7	-35.9	178.1	179.6	0	0	0	0	111.4	E616 H617 L622	E616-V620 PolarHBondContact O-N 3.48Å; H617-V620 PolarHBondContact O-N 3.37Å; V620-L622 VanDerWaalsContact C-N 3.34Å
621	V	88.1	Confident	83.9	Confident	30 Å²	30	51.6 Å²	51.6	18%	0.182	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	2.8	177.1	-57	0	0	0	0	114.7	H617 I619 P624 T625	H617-V621 WeakPolarHBondContact CE1-CG1 3.1Å; H617-V621 WeakPolarHBondContact O-CG2 3.47Å; H617-V621 PolarHBondContact O-N 3Å; I619-V621 PolarHBondContact O-N 2.99Å; V621-P624 WeakPolarHBondContact O-CD 3.41Å; V621-T625 VanDerWaalsContact O-CB 3.26Å; V621-T625 WeakPolarHBondContact O-CB 3.4Å; V621-T625 PolarHBondContact O-N 3.5Å; V621-T625 PolarHBondContact O-OG1 3.44Å
622	L	91.4	Very high	85.2	Confident	7 Å²	7	47.3 Å²	47.3	4%	0.037	25%	0.253	C	S	.	.	H	α-helix	trans	-61.5	-51.9	-177	-177.8	58.8	0	0	0	111.9	L570 P571 L604 F607 I619 V620 T625 V626	L570-L622 HydrophobicContact CB-CD1 4.42Å; L570-L622 HydrophobicContact CD2-CD1 4.02Å; L570-L622 HydrophobicContact CD2-CD2 3.74Å; L570-L622 HydrophobicContact CG-CD1 4.34Å; P571-L622 HydrophobicContact CG-CD1 3.94Å; L604-L622 HydrophobicContact CD2-CD2 3.73Å; L604-L622 HydrophobicContact CD2-CG 4.29Å; F607-L622 HydrophobicContact CD1-CD2 4.07Å; F607-L622 HydrophobicContact CE1-CD2 4.42Å; F607-L622 HydrophobicContact CG-CD2 4.15Å; I619-L622 WeakPolarHBondContact O-CB 3.37Å; I619-L622 PolarHBondContact O-N 3.27Å; V620-L622 VanDerWaalsContact C-N 3.34Å; L622-T625 PolarHBondContact O-N 3.39Å; L622-V626 HydrophobicContact CD1-CG2 4.47Å; L622-V626 WeakPolarHBondContact O-CG2 3.43Å; L622-V626 PolarHBondContact O-N 3.46Å
623	I	93.7	Very high	86.4	Confident	18 Å²	18	47.8 Å²	47.8	9%	0.092	25%	0.25	C	C	.	.	H	α-helix	trans	-60.5	-51.8	176.5	-67	173.7	0	0	0	111.1	Y601 L604 L605 T625 V626 V627 Y665	Y601-I623 HydrophobicContact CD2-CG2 4.17Å; Y601-I623 HydrophobicContact CE1-CD1 4.36Å; Y601-I623 HydrophobicContact CE2-CD1 4.42Å; Y601-I623 HydrophobicContact CE2-CG2 3.49Å; Y601-I623 VanDerWaalsContact CE2-CG2 3.49Å; L604-I623 HydrophobicContact CB-CD1 4.19Å; L604-I623 HydrophobicContact CB-CG1 3.77Å; L604-I623 HydrophobicContact CD1-CG1 4.41Å; L605-I623 HydrophobicContact CB-CD1 4.27Å; L605-I623 HydrophobicContact CD1-CD1 4.3Å; I623-T625 PolarHBondContact O-N 2.97Å; I623-V626 PolarHBondContact O-N 3.36Å; I623-V626 VanDerWaalsContact O-N 3.15Å; I623-V627 HydrophobicContact CG2-CG2 4.33Å; I623-V627 WeakPolarHBondContact O-CG2 3.41Å; I623-V627 PolarHBondContact O-N 3.43Å; I623-Y665 HydrophobicContact CG2-CE1 3.91Å
624	P	93.4	Very high	87.6	Confident	18 Å²	18	41.5 Å²	41.5	12%	0.117	22%	0.217	C	C	.	.	H	α-helix	trans	-55	-38.6	175.3	-23.1	26.6	0	0	0	113.9	V621 V627 E628 Y665 T667	V621-P624 WeakPolarHBondContact O-CD 3.41Å; P624-V627 PolarHBondContact O-N 2.91Å; P624-E628 WeakPolarHBondContact O-CB 3.38Å; P624-E628 PolarHBondContact O-N 2.86Å; P624-Y665 HydrophobicContact CB-CD1 4.14Å; P624-Y665 HydrophobicContact CG-CD1 3.95Å; P624-T667 HydrophobicContact CB-CG2 4.21Å; P624-T667 VanDerWaalsContact CB-OG1 3.28Å; P624-T667 WeakPolarHBondContact CB-OG1 3.44Å
625	T	92.9	Very high	89	Confident	39 Å²	39	40.3 Å²	40.3	24%	0.239	21%	0.209	C	C	.	.	H	α-helix	trans	-67.9	-42.2	177.7	-56.6	0	0	0	0	111.5	P571 V621 L622 I623 E628 K629	P571-T625 HydrophobicContact CB-CG2 4.24Å; P571-T625 HydrophobicContact CG-CG2 3.77Å; V621-T625 VanDerWaalsContact O-CB 3.26Å; V621-T625 WeakPolarHBondContact O-CB 3.4Å; V621-T625 PolarHBondContact O-N 3.5Å; V621-T625 PolarHBondContact O-OG1 3.44Å; L622-T625 PolarHBondContact O-N 3.39Å; I623-T625 PolarHBondContact O-N 2.97Å; T625-E628 PolarHBondContact O-N 3.41Å; T625-K629 HydrophobicContact CG2-CG 4.1Å; T625-K629 WeakPolarHBondContact O-CB 3.45Å; T625-K629 VanDerWaalsContact O-CG 3.29Å; T625-K629 WeakPolarHBondContact O-CG 3.34Å; T625-K629 PolarHBondContact O-N 3.22Å
626	V	94.8	Very high	90.4	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.4	-43.6	174.3	165.9	0	0	0	0	110.9	P571 I578 W600 L604 L622 I623 E628 K629 V630 V631	P571-V626 HydrophobicContact CB-CG2 4.04Å; P571-V626 HydrophobicContact CG-CG2 4.41Å; I578-V626 HydrophobicContact CD1-CG1 3.37Å; I578-V626 HydrophobicContact CD1-CG2 4.49Å; W600-V626 HydrophobicContact CE3-CG1 4.12Å; W600-V626 HydrophobicContact CH2-CG1 4.26Å; W600-V626 HydrophobicContact CZ3-CG1 3.69Å; L604-V626 HydrophobicContact CD1-CB 4.42Å; L604-V626 HydrophobicContact CD1-CG1 4.4Å; L604-V626 HydrophobicContact CD1-CG2 3.94Å; L622-V626 HydrophobicContact CD1-CG2 4.47Å; L622-V626 WeakPolarHBondContact O-CG2 3.43Å; L622-V626 PolarHBondContact O-N 3.46Å; I623-V626 PolarHBondContact O-N 3.36Å; I623-V626 VanDerWaalsContact O-N 3.15Å; V626-E628 PolarHBondContact O-N 2.99Å; V626-K629 PolarHBondContact O-N 3.23Å; V626-V630 HydrophobicContact CG1-CG2 4.39Å; V626-V630 WeakPolarHBondContact O-CA 3.47Å; V626-V630 VanDerWaalsContact O-CB 3.26Å; V626-V630 WeakPolarHBondContact O-CB 3.37Å; V626-V630 PolarHBondContact O-N 2.9Å; V626-V631 PolarHBondContact O-N 3Å
627	V	95.5	Very high	91.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.172	C	C	.	.	I	π-helix	trans	-59.9	-47	175.3	171.4	0	0	0	0	110.6	W600 I623 P624 V631 C632 L661 Y665 L668	W600-V627 HydrophobicContact CH2-CG2 4.3Å; I623-V627 HydrophobicContact CG2-CG2 4.33Å; I623-V627 WeakPolarHBondContact O-CG2 3.41Å; I623-V627 PolarHBondContact O-N 3.43Å; P624-V627 PolarHBondContact O-N 2.91Å; V627-V631 HydrophobicContact CG1-CB 4.32Å; V627-V631 HydrophobicContact CG2-CG2 4.44Å; V627-V631 CarbonylContact O-C 3.59Å; V627-V631 WeakPolarHBondContact O-CA 3.33Å; V627-V631 WeakPolarHBondContact O-CB 3.37Å; V627-V631 PolarHBondContact O-N 3.21Å; V627-V631 VanDerWaalsContact O-N 3.12Å; V627-C632 PolarHBondContact O-N 2.84Å; V627-L661 HydrophobicContact CG1-CD1 3.82Å; V627-L661 HydrophobicContact CG1-CG 4.48Å; V627-Y665 HydrophobicContact CB-CD2 4.49Å; V627-Y665 HydrophobicContact CB-CE2 4.49Å; V627-Y665 HydrophobicContact CG1-CD2 3.97Å; V627-Y665 HydrophobicContact CG1-CE2 4.15Å; V627-Y665 HydrophobicContact CG2-CD2 4.4Å; V627-Y665 HydrophobicContact CG2-CE2 3.93Å; V627-L668 HydrophobicContact CG1-CD1 4.16Å
628	E	94.3	Very high	92.7	Very high	28 Å²	28	26 Å²	26	13%	0.131	14%	0.143	C	C	.	.	I	π-helix	trans	-65.3	-42	179	-165.7	-160.3	145.4	0	0	112.9	P624 T625 V626 C632 L668 S672 T674	P624-E628 WeakPolarHBondContact O-CB 3.38Å; P624-E628 PolarHBondContact O-N 2.86Å; T625-E628 PolarHBondContact O-N 3.41Å; V626-E628 PolarHBondContact O-N 2.99Å; E628-C632 WeakPolarHBondContact O-CB 3.36Å; E628-L668 HydrophobicContact CB-CD2 3.63Å; E628-L668 HydrophobicContact CG-CD2 3.74Å; E628-S672 WeakPolarHBondContact OE1-CB 3.43Å; E628-S672 PolarHBondContact OE1-OG 3.14Å; E628-T674 VanDerWaalsContact O-CG2 3.28Å; E628-T674 WeakPolarHBondContact O-CG2 3.11Å
629	K	93.2	Very high	93.8	Very high	110 Å²	110	24.2 Å²	24.2	48%	0.478	13%	0.131	S	C	.	.	I	π-helix	trans	-92.1	-19	-171.8	-60	-52.7	-176.8	-155	0	114.5	T625 V626 P633	T625-K629 HydrophobicContact CG2-CG 4.1Å; T625-K629 WeakPolarHBondContact O-CB 3.45Å; T625-K629 VanDerWaalsContact O-CG 3.29Å; T625-K629 WeakPolarHBondContact O-CG 3.34Å; T625-K629 PolarHBondContact O-N 3.22Å; V626-K629 PolarHBondContact O-N 3.23Å; K629-P633 WeakPolarHBondContact O-CG 3.32Å
630	V	94.8	Very high	94.5	Very high	11 Å²	11	29.3 Å²	29.3	7%	0.067	15%	0.153	C	C	.	.	I	π-helix	trans	-120.3	-49.9	-176.7	-171.4	0	0	0	0	111.6	I578 R579 V626 P633 L634	I578-V630 HydrophobicContact CB-CG1 4.17Å; I578-V630 HydrophobicContact CG2-CG1 3.84Å; R579-V630 HydrophobicContact CG-CG1 3.96Å; V626-V630 HydrophobicContact CG1-CG2 4.39Å; V626-V630 WeakPolarHBondContact O-CA 3.47Å; V626-V630 VanDerWaalsContact O-CB 3.26Å; V626-V630 WeakPolarHBondContact O-CB 3.37Å; V626-V630 PolarHBondContact O-N 2.9Å; V630-P633 WeakPolarHBondContact O-CD 3.17Å; V630-L634 PolarHBondContact O-N 3.46Å
631	V	95.7	Very high	95.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.139	C	C	.	.	I	π-helix	trans	-75.8	-43.3	-175.8	-176.5	0	0	0	0	111.8	M582 W585 L595 W600 V626 V627 L634 L635	M582-V631 HydrophobicContact CE-CG1 4.36Å; M582-V631 HydrophobicContact CE-CG2 4.34Å; M582-V631 HydrophobicContact SD-CG2 4.11Å; W585-V631 HydrophobicContact CH2-CG1 4.41Å; W585-V631 HydrophobicContact CZ3-CG1 4.45Å; L595-V631 HydrophobicContact CD1-CG1 4.31Å; L595-V631 HydrophobicContact CD2-CG1 4.29Å; W600-V631 HydrophobicContact CH2-CG2 4.3Å; W600-V631 HydrophobicContact CZ2-CG2 4.2Å; V626-V631 PolarHBondContact O-N 3Å; V627-V631 HydrophobicContact CG1-CB 4.32Å; V627-V631 HydrophobicContact CG2-CG2 4.44Å; V627-V631 CarbonylContact O-C 3.59Å; V627-V631 WeakPolarHBondContact O-CA 3.33Å; V627-V631 WeakPolarHBondContact O-CB 3.37Å; V627-V631 PolarHBondContact O-N 3.21Å; V627-V631 VanDerWaalsContact O-N 3.12Å; V631-L634 WeakPolarHBondContact O-CB 3.28Å; V631-L634 PolarHBondContact O-N 3.03Å; V631-L635 HydrophobicContact CG1-CD1 3.95Å; V631-L635 HydrophobicContact CG1-CG 4.17Å; V631-L635 VanDerWaalsContact O-CG 3.31Å; V631-L635 WeakPolarHBondContact O-CG 3.42Å; V631-L635 PolarHBondContact O-N 3.11Å
632	C	95.8	Very high	95.5	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.1	-41	179	-70.7	0	0	0	0	113.9	V627 E628 L635 T636 T674	V627-C632 PolarHBondContact O-N 2.84Å; E628-C632 WeakPolarHBondContact O-CB 3.36Å; C632-L635 PolarHBondContact O-N 2.97Å; C632-T636 WeakPolarHBondContact O-CB 3.43Å; C632-T636 PolarHBondContact O-N 3.41Å; C632-T636 PolarHBondContact O-OG1 2.95Å; C632-T674 HydrophobicContact CB-CG2 3.7Å
633	P	96	Very high	95.9	Very high	49 Å²	49	27 Å²	27	32%	0.318	13%	0.133	S	C	.	.	H	α-helix	trans	-60.2	-44	171	-27.6	37.2	0	0	0	113.2	K629 V630 L635 T636 E637 T674	K629-P633 WeakPolarHBondContact O-CG 3.32Å; V630-P633 WeakPolarHBondContact O-CD 3.17Å; P633-L635 PolarHBondContact O-N 3.28Å; P633-T636 WeakPolarHBondContact O-CB 3.35Å; P633-T636 PolarHBondContact O-N 2.65Å; P633-T636 VanDerWaalsContact O-N 3.16Å; P633-E637 PolarHBondContact O-N 2.93Å; P633-E637 VanDerWaalsContact O-N 3.07Å; P633-T674 HydrophobicContact CG-CG2 3.7Å
634	L	96.5	Very high	96	Very high	22 Å²	22	26.9 Å²	26.9	12%	0.115	13%	0.131	C	C	.	.	H	α-helix	trans	-60.1	-46.6	175.4	175.9	61.4	0	0	0	111.4	M432 M582 W585 V630 V631 T636 E637 L638	M432-L634 HydrophobicContact CE-CD1 3.81Å; M582-L634 HydrophobicContact CB-CD2 4.05Å; M582-L634 HydrophobicContact CE-CD2 4.03Å; M582-L634 HydrophobicContact SD-CD2 4.45Å; W585-L634 HydrophobicContact CE3-CD2 3.92Å; W585-L634 HydrophobicContact CZ3-CD2 4.22Å; V630-L634 PolarHBondContact O-N 3.46Å; V631-L634 WeakPolarHBondContact O-CB 3.28Å; V631-L634 PolarHBondContact O-N 3.03Å; L634-T636 VanDerWaalsContact C-N 3.28Å; L634-T636 PolarHBondContact O-N 3.41Å; L634-E637 PolarHBondContact O-N 3.29Å; L634-L638 HydrophobicContact CD1-CD1 4.43Å; L634-L638 HydrophobicContact CD1-CG 4.44Å; L634-L638 HydrophobicContact CG-CD1 4.17Å; L634-L638 WeakPolarHBondContact O-CG 3.34Å; L634-L638 PolarHBondContact O-N 2.82Å
635	L	97.1	Very high	96.1	Very high	2 Å²	2	26.2 Å²	26.2	1%	0.01	13%	0.127	C	C	.	.	H	α-helix	trans	-59.4	-39.7	174.9	-71.3	170.9	0	0	0	112	W585 P587 V631 C632 P633 E637 L638 V639 F657 L661 L678	W585-L635 HydrophobicContact CH2-CD2 3.86Å; W585-L635 HydrophobicContact CZ3-CD2 3.85Å; W585-L635 HydrophobicContact CZ3-CG 4.45Å; P587-L635 HydrophobicContact CG-CD2 3.72Å; V631-L635 HydrophobicContact CG1-CD1 3.95Å; V631-L635 HydrophobicContact CG1-CG 4.17Å; V631-L635 VanDerWaalsContact O-CG 3.31Å; V631-L635 WeakPolarHBondContact O-CG 3.42Å; V631-L635 PolarHBondContact O-N 3.11Å; C632-L635 PolarHBondContact O-N 2.97Å; P633-L635 PolarHBondContact O-N 3.28Å; L635-E637 VanDerWaalsContact C-N 3.33Å; L635-E637 PolarHBondContact O-N 3.47Å; L635-L638 PolarHBondContact O-N 3.29Å; L635-V639 WeakPolarHBondContact O-CB 3.38Å; L635-V639 VanDerWaalsContact O-CG2 3.23Å; L635-V639 WeakPolarHBondContact O-CG2 3.39Å; L635-V639 PolarHBondContact O-N 3.31Å; L635-F657 HydrophobicContact CD1-CE1 3.73Å; L635-F657 HydrophobicContact CD2-CD1 4.42Å; L635-F657 HydrophobicContact CD2-CE1 3.82Å; L635-F657 HydrophobicContact CG-CE1 4.42Å; L635-L661 HydrophobicContact CD1-CD2 3.92Å; L635-L678 HydrophobicContact CB-CD1 3.82Å; L635-L678 HydrophobicContact CB-CD2 4.32Å; L635-L678 HydrophobicContact CD1-CD2 4.3Å
636	T	97.8	Very high	96.1	Very high	6 Å²	6	24.6 Å²	24.6	4%	0.037	12%	0.117	C	C	.	.	H	α-helix	trans	-61.7	-43.2	178.7	-59.9	0	0	0	0	110.7	C632 P633 L634 V639 K640 L678 A681	C632-T636 WeakPolarHBondContact O-CB 3.43Å; C632-T636 PolarHBondContact O-N 3.41Å; C632-T636 PolarHBondContact O-OG1 2.95Å; P633-T636 WeakPolarHBondContact O-CB 3.35Å; P633-T636 PolarHBondContact O-N 2.65Å; P633-T636 VanDerWaalsContact O-N 3.16Å; L634-T636 VanDerWaalsContact C-N 3.28Å; L634-T636 PolarHBondContact O-N 3.41Å; T636-V639 PolarHBondContact O-N 2.87Å; T636-K640 HydrophobicContact CG2-CD 4.46Å; T636-K640 WeakPolarHBondContact O-CG 3.43Å; T636-K640 PolarHBondContact O-N 3.29Å; T636-K640 VanDerWaalsContact O-N 3.11Å; T636-L678 WeakPolarHBondContact OG1-CA 3.28Å; T636-L678 WeakPolarHBondContact OG1-CB 3.46Å; T636-A681 HydrophobicContact CG2-CB 4Å
637	E	97.1	Very high	96.2	Very high	58 Å²	58	24.7 Å²	24.7	27%	0.271	12%	0.118	S	C	.	.	H	α-helix	trans	-68.2	-42.1	175.8	-72.3	-61.3	110	0	0	112.3	M432 P633 L634 L635 V639 K640 K641	M432-E637 HydrophobicContact CE-CB 4.05Å; M432-E637 HydrophobicContact SD-CB 4.49Å; P633-E637 PolarHBondContact O-N 2.93Å; P633-E637 VanDerWaalsContact O-N 3.07Å; L634-E637 PolarHBondContact O-N 3.29Å; L635-E637 VanDerWaalsContact C-N 3.33Å; L635-E637 PolarHBondContact O-N 3.47Å; E637-V639 VanDerWaalsContact C-N 3.32Å; E637-V639 PolarHBondContact O-N 2.89Å; E637-K640 PolarHBondContact O-N 3.48Å; E637-K640 IonicContact OE1-NZ 3.52Å; E637-K640 PolarHBondContact OE1-NZ 3.39Å; E637-K641 WeakPolarHBondContact O-CB 3.47Å; E637-K641 PolarHBondContact O-N 3.02Å; E637-K641 WeakPolarHBondContact OE2-CE 3.28Å; E637-K641 IonicContact OE2-NZ 2.7Å; E637-K641 PolarHBondContact OE2-NZ 3.36Å
638	L	97.7	Very high	96.1	Very high	4 Å²	4	26 Å²	26	2%	0.021	13%	0.128	C	C	.	.	H	α-helix	trans	-59.5	-41.2	174.4	-71.8	171.5	0	0	0	112.1	M432 L435 W585 L634 L635 V642 W643	M432-L638 HydrophobicContact CE-CD2 3.92Å; M432-L638 HydrophobicContact CE-CG 4.15Å; M432-L638 HydrophobicContact SD-CD2 3.94Å; L435-L638 HydrophobicContact CD1-CD2 4.16Å; W585-L638 HydrophobicContact CE3-CD1 4.3Å; W585-L638 HydrophobicContact CZ3-CD1 4.34Å; L634-L638 HydrophobicContact CD1-CD1 4.43Å; L634-L638 HydrophobicContact CD1-CG 4.44Å; L634-L638 HydrophobicContact CG-CD1 4.17Å; L634-L638 WeakPolarHBondContact O-CG 3.34Å; L634-L638 PolarHBondContact O-N 2.82Å; L635-L638 PolarHBondContact O-N 3.29Å; L638-V642 HydrophobicContact CD2-CB 4.36Å; L638-V642 HydrophobicContact CD2-CG2 3.94Å; L638-V642 CarbonylContact O-C 3.58Å; L638-V642 WeakPolarHBondContact O-CA 3.39Å; L638-V642 WeakPolarHBondContact O-CB 3.47Å; L638-V642 PolarHBondContact O-N 2.92Å; L638-W643 PolarHBondContact O-N 3.38Å
639	V	98	Very high	96.1	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.012	14%	0.136	C	C	.	.	H	α-helix	trans	-65.7	-39.9	177.2	166	0	0	0	0	111.7	L635 T636 E637 W643 L654 L678 A681 V682 C685	L635-V639 WeakPolarHBondContact O-CB 3.38Å; L635-V639 VanDerWaalsContact O-CG2 3.23Å; L635-V639 WeakPolarHBondContact O-CG2 3.39Å; L635-V639 PolarHBondContact O-N 3.31Å; T636-V639 PolarHBondContact O-N 2.87Å; E637-V639 VanDerWaalsContact C-N 3.32Å; E637-V639 PolarHBondContact O-N 2.89Å; V639-W643 HydrophobicContact CG1-CE3 3.81Å; V639-W643 HydrophobicContact CG1-CZ3 4.23Å; V639-L654 HydrophobicContact CG2-CD1 4.19Å; V639-L654 HydrophobicContact CG2-CD2 4.07Å; V639-L678 HydrophobicContact CG2-CD1 4.08Å; V639-A681 HydrophobicContact CG1-CB 3.89Å; V639-V682 HydrophobicContact CG1-CB 4.34Å; V639-V682 HydrophobicContact CG1-CG2 3.75Å; V639-V682 HydrophobicContact CG2-CG2 4.09Å; V639-C685 PolarHBondContact O-SG 3.33Å; V639-C685 VanDerWaalsContact O-SG 3.4Å
640	K	97.5	Very high	96.2	Very high	118 Å²	118	22.8 Å²	22.8	51%	0.513	12%	0.119	S	C	.	.	H	α-helix	trans	-72.6	-39	179.9	-72.4	174	-172.3	165.6	0	113.4	T636 E637 A681	T636-K640 HydrophobicContact CG2-CD 4.46Å; T636-K640 WeakPolarHBondContact O-CG 3.43Å; T636-K640 PolarHBondContact O-N 3.29Å; T636-K640 VanDerWaalsContact O-N 3.11Å; E637-K640 PolarHBondContact O-N 3.48Å; E637-K640 IonicContact OE1-NZ 3.52Å; E637-K640 PolarHBondContact OE1-NZ 3.39Å; K640-A681 HydrophobicContact CG-CB 3.93Å
641	K	96.6	Very high	96.3	Very high	64 Å²	64	22.2 Å²	22.2	28%	0.278	12%	0.116	S	C	.	.	H	α-helix	trans	-106.4	-29.9	-168	-70.3	175.2	172.2	157.5	0	114.5	M432 Q436 E637	M432-K641 HydrophobicContact CG-CD 3.76Å; M432-K641 HydrophobicContact SD-CD 4.42Å; Q436-K641 HydrophobicContact CB-CB 4.17Å; Q436-K641 HydrophobicContact CG-CB 4.15Å; E637-K641 WeakPolarHBondContact O-CB 3.47Å; E637-K641 PolarHBondContact O-N 3.02Å; E637-K641 WeakPolarHBondContact OE2-CE 3.28Å; E637-K641 IonicContact OE2-NZ 2.7Å; E637-K641 PolarHBondContact OE2-NZ 3.36Å
642	V	96.9	Very high	96.3	Very high	11 Å²	11	27.7 Å²	27.7	7%	0.067	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-37.1	-166.9	-172.3	0	0	0	0	112.4	M432 L435 S439 L588 L638 R644	M432-V642 HydrophobicContact SD-CG2 3.99Å; L435-V642 HydrophobicContact CB-CG1 4.13Å; L435-V642 HydrophobicContact CB-CG2 3.65Å; S439-V642 WeakPolarHBondContact CB-O 3.08Å; S439-V642 PolarHBondContact OG-O 2.62Å; L588-V642 HydrophobicContact CD1-CB 4.33Å; L588-V642 HydrophobicContact CD1-CG1 4.08Å; L638-V642 HydrophobicContact CD2-CB 4.36Å; L638-V642 HydrophobicContact CD2-CG2 3.94Å; L638-V642 CarbonylContact O-C 3.58Å; L638-V642 WeakPolarHBondContact O-CA 3.39Å; L638-V642 WeakPolarHBondContact O-CB 3.47Å; L638-V642 PolarHBondContact O-N 2.92Å; V642-R644 PolarHBondContact O-N 3.29Å
643	W	97.8	Very high	96.4	Very high	6 Å²	6	29.3 Å²	29.3	2%	0.023	15%	0.15	C	C	.	.			trans	-65.2	131.5	-178.7	177.9	45.9	0	0	0	112.4	L588 L638 V639 P645 T651 L654 V682 C685 F686 L732	L588-W643 HydrophobicContact CD1-CB 3.89Å; L588-W643 HydrophobicContact CD2-CB 4.41Å; L588-W643 HydrophobicContact CD2-CG 4.35Å; L638-W643 PolarHBondContact O-N 3.38Å; V639-W643 HydrophobicContact CG1-CE3 3.81Å; V639-W643 HydrophobicContact CG1-CZ3 4.23Å; W643-P645 HydrophobicContact CD2-CG 4.07Å; W643-P645 HydrophobicContact CE3-CG 3.94Å; W643-P645 HydrophobicContact CH2-CB 4.27Å; W643-P645 HydrophobicContact CH2-CG 4.11Å; W643-P645 HydrophobicContact CZ2-CB 4.09Å; W643-P645 HydrophobicContact CZ2-CG 4.17Å; W643-P645 HydrophobicContact CZ3-CG 3.97Å; W643-P645 WeakPolarHBondContact O-CD 3.5Å; W643-T651 HydrophobicContact CZ2-CG2 4.18Å; W643-L654 HydrophobicContact CD2-CD2 3.56Å; W643-L654 HydrophobicContact CE3-CD2 4.03Å; W643-L654 HydrophobicContact CG-CD2 3.89Å; W643-L654 HydrophobicContact CH2-CD2 4.3Å; W643-L654 HydrophobicContact CZ2-CD2 3.92Å; W643-L654 HydrophobicContact CZ3-CD2 4.36Å; W643-V682 HydrophobicContact CH2-CG1 3.86Å; W643-V682 HydrophobicContact CZ3-CB 4.37Å; W643-V682 HydrophobicContact CZ3-CG1 3.95Å; W643-V682 WeakPolarHBondContact CZ3-O 3.34Å; W643-C685 HydrophobicContact CE3-CB 4.03Å; W643-C685 HydrophobicContact CZ3-CB 4.01Å; W643-F686 HydrophobicContact CH2-CB 4.3Å; W643-F686 AromaticContact CH2-CD2 3.81Å; W643-F686 HydrophobicContact CH2-CD2 3.81Å; W643-F686 HydrophobicContact CZ2-CD2 4.15Å; W643-L732 HydrophobicContact CH2-CD2 4.29Å
644	R	96.2	Very high	96.4	Very high	16 Å²	16	27.1 Å²	27.1	6%	0.06	14%	0.135	C	C	.	.			trans	-108	101.1	173.7	-62.2	179.3	-65.6	124.7	8.1	109.6	S439 I443 D508 V642 A646 S647	S439-R644 WeakPolarHBondContact OG-CD 3.4Å; S439-R644 WeakPolarHBondContact OG-CG 3.29Å; I443-R644 HydrophobicContact CD1-CG 4.28Å; I443-R644 HydrophobicContact CG1-CG 4.17Å; D508-R644 IonicContact OD1-CZ 2.89Å; D508-R644 IonicContact OD1-NH1 2.78Å; D508-R644 PolarHBondContact OD1-NH1 3.5Å; D508-R644 IonicContact OD1-NH2 3.76Å; D508-R644 PolarHBondContact OD1-NH2 3.47Å; V642-R644 PolarHBondContact O-N 3.29Å; R644-A646 PolarHBondContact O-N 2.75Å; R644-A646 VanDerWaalsContact O-N 3.13Å; R644-S647 WeakPolarHBondContact O-CB 3.35Å; R644-S647 PolarHBondContact O-N 3.23Å
645	P	95.6	Very high	96.4	Very high	5 Å²	5	26.1 Å²	26.1	3%	0.032	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.6	-177.8	-25.9	35.5	0	0	0	114.4	W643 S647 T651 F686 M689 N728	W643-P645 HydrophobicContact CD2-CG 4.07Å; W643-P645 HydrophobicContact CE3-CG 3.94Å; W643-P645 HydrophobicContact CH2-CB 4.27Å; W643-P645 HydrophobicContact CH2-CG 4.11Å; W643-P645 HydrophobicContact CZ2-CB 4.09Å; W643-P645 HydrophobicContact CZ2-CG 4.17Å; W643-P645 HydrophobicContact CZ3-CG 3.97Å; W643-P645 WeakPolarHBondContact O-CD 3.5Å; P645-S647 PolarHBondContact O-N 2.83Å; P645-T651 PolarHBondContact O-OG1 3.25Å; P645-F686 HydrophobicContact CB-CD2 3.58Å; P645-F686 HydrophobicContact CB-CE2 3.91Å; P645-F686 HydrophobicContact CB-CG 4.19Å; P645-F686 HydrophobicContact CG-CD2 4.44Å; P645-M689 HydrophobicContact CB-CB 3.93Å; P645-M689 HydrophobicContact CB-CE 3.75Å; P645-M689 HydrophobicContact CB-CG 3.98Å; P645-M689 HydrophobicContact CG-CB 3.96Å; P645-M689 HydrophobicContact CG-CG 4.38Å; P645-N728 PolarHBondContact O-ND2 3.17Å
646	A	94.3	Very high	96.4	Very high	4 Å²	4	29.3 Å²	29.3	3%	0.033	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-17.8	175	0	0	0	0	0	113.4	R644 M689 E693 F721 K724 N728	R644-A646 PolarHBondContact O-N 2.75Å; R644-A646 VanDerWaalsContact O-N 3.13Å; A646-M689 HydrophobicContact CB-CG 4.25Å; A646-M689 HydrophobicContact CB-SD 4.18Å; A646-E693 WeakPolarHBondContact CB-OE2 3.34Å; A646-F721 HydrophobicContact CB-CE2 4.19Å; A646-F721 HydrophobicContact CB-CZ 3.95Å; A646-K724 WeakPolarHBondContact O-CE 3.49Å; A646-K724 PolarHBondContact O-NZ 3.44Å; A646-N728 PolarHBondContact O-ND2 2.96Å
647	S	95.2	Very high	96.3	Very high	3 Å²	3	29.3 Å²	29.3	2%	0.021	15%	0.149	C	C	.	.			trans	-85.5	113.5	175.8	179.7	0	0	0	0	110.6	D508 R644 P645 S649 Q650 T651	D508-S647 WeakPolarHBondContact OD1-CB 3.49Å; D508-S647 PolarHBondContact OD1-OG 3.34Å; D508-S647 PolarHBondContact OD2-OG 3.03Å; R644-S647 WeakPolarHBondContact O-CB 3.35Å; R644-S647 PolarHBondContact O-N 3.23Å; P645-S647 PolarHBondContact O-N 2.83Å; S647-S649 VanDerWaalsContact C-N 3.29Å; S647-S649 PolarHBondContact O-N 3.09Å; S647-S649 PolarHBondContact OG-OG 2.95Å; S647-Q650 PolarHBondContact OG-N 3.5Å; S647-T651 WeakPolarHBondContact O-CB 3.33Å; S647-T651 PolarHBondContact O-N 2.95Å; S647-T651 PolarHBondContact O-OG1 3.26Å
648	S	94.5	Very high	96.2	Very high	28 Å²	28	26.6 Å²	26.6	20%	0.196	14%	0.137	C	C	.	.	H	α-helix	trans	-63.8	-35.5	176.5	-53.3	0	0	0	0	112.1	S506 T651 E652 K724 N728	S506-S648 PolarHBondContact OG-N 2.75Å; S506-S648 PolarHBondContact OG-OG 2.97Å; S648-T651 PolarHBondContact O-N 2.88Å; S648-E652 VanDerWaalsContact O-CB 3.25Å; S648-E652 WeakPolarHBondContact O-CB 3.46Å; S648-E652 PolarHBondContact O-N 3.38Å; S648-K724 WeakPolarHBondContact OG-CG 3.47Å; S648-N728 WeakPolarHBondContact CA-OD1 3.46Å; S648-N728 WeakPolarHBondContact CB-OD1 3.5Å; S648-N728 PolarHBondContact N-ND2 2.89Å; S648-N728 PolarHBondContact OG-ND2 3.01Å; S648-N728 PolarHBondContact OG-OD1 2.85Å
649	S	93.7	Very high	96.1	Very high	43 Å²	43	30.5 Å²	30.5	30%	0.301	15%	0.151	S	C	.	.	H	α-helix	trans	-64.6	-49.5	179.4	63.4	0	0	0	0	111.1	D508 S647 E652 L653	D508-S649 PolarHBondContact OD2-OG 3.43Å; S647-S649 VanDerWaalsContact C-N 3.29Å; S647-S649 PolarHBondContact O-N 3.09Å; S647-S649 PolarHBondContact OG-OG 2.95Å; S649-E652 PolarHBondContact O-N 3.16Å; S649-L653 WeakPolarHBondContact O-CB 3.36Å; S649-L653 VanDerWaalsContact O-CG 3.26Å; S649-L653 WeakPolarHBondContact O-CG 3.48Å; S649-L653 PolarHBondContact O-N 3.22Å
650	Q	95.6	Very high	96	Very high	26 Å²	26	35.9 Å²	35.9	12%	0.121	18%	0.176	C	C	.	.	H	α-helix	trans	-65.7	-40.1	177.2	-65.8	-167.5	-15.1	0	0	112.3	L588 S647 L653 L654	L588-Q650 HydrophobicContact CB-CG 4.29Å; L588-Q650 HydrophobicContact CD2-CB 4.41Å; S647-Q650 PolarHBondContact OG-N 3.5Å; Q650-L653 PolarHBondContact O-N 3.19Å; Q650-L654 VanDerWaalsContact O-CB 3.28Å; Q650-L654 WeakPolarHBondContact O-CB 3.19Å; Q650-L654 PolarHBondContact O-N 2.76Å
651	T	97	Very high	95.8	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-66.1	-42.4	179.5	-56.6	0	0	0	0	111.7	W643 P645 S647 S648 C655 N728 L731	W643-T651 HydrophobicContact CZ2-CG2 4.18Å; P645-T651 PolarHBondContact O-OG1 3.25Å; S647-T651 WeakPolarHBondContact O-CB 3.33Å; S647-T651 PolarHBondContact O-N 2.95Å; S647-T651 PolarHBondContact O-OG1 3.26Å; S648-T651 PolarHBondContact O-N 2.88Å; T651-C655 WeakPolarHBondContact O-CB 3.27Å; T651-C655 PolarHBondContact O-N 3.27Å; T651-C655 PolarHBondContact O-SG 3.38Å; T651-N728 HydrophobicContact CG2-CB 4.13Å; T651-L731 HydrophobicContact CG2-CB 4.29Å; T651-L731 HydrophobicContact CG2-CD1 4.22Å
652	E	96.1	Very high	95.6	Very high	114 Å²	114	29.4 Å²	29.4	53%	0.533	15%	0.148	S	C	.	.	H	α-helix	trans	-64.2	-45	176.5	-174.6	173.4	-170.4	0	0	111.8	S648 S649 T656 L731	S648-E652 VanDerWaalsContact O-CB 3.25Å; S648-E652 WeakPolarHBondContact O-CB 3.46Å; S648-E652 PolarHBondContact O-N 3.38Å; S649-E652 PolarHBondContact O-N 3.16Å; E652-T656 VanDerWaalsContact O-CB 3.24Å; E652-T656 WeakPolarHBondContact O-CB 3.43Å; E652-T656 PolarHBondContact O-N 3.38Å; E652-T656 PolarHBondContact O-OG1 2.97Å; E652-L731 HydrophobicContact CB-CD1 4.14Å
653	L	96.6	Very high	95.5	Very high	35 Å²	35	33.5 Å²	33.5	18%	0.183	18%	0.177	C	C	.	.	H	α-helix	trans	-61.6	-49	176.5	-72.1	170.3	0	0	0	111.7	L588 V590 Y592 S649 Q650 T656 F657	L588-L653 WeakPolarHBondContact O-CD1 3.21Å; V590-L653 HydrophobicContact CG2-CD1 4.26Å; Y592-L653 HydrophobicContact CE1-CD2 4.28Å; S649-L653 WeakPolarHBondContact O-CB 3.36Å; S649-L653 VanDerWaalsContact O-CG 3.26Å; S649-L653 WeakPolarHBondContact O-CG 3.48Å; S649-L653 PolarHBondContact O-N 3.22Å; Q650-L653 PolarHBondContact O-N 3.19Å; L653-T656 PolarHBondContact O-N 2.9Å; L653-F657 VanDerWaalsContact O-CB 3.29Å; L653-F657 WeakPolarHBondContact O-CB 3.21Å; L653-F657 PolarHBondContact O-N 3.09Å
654	L	97.2	Very high	95.2	Very high	3 Å²	3	35.9 Å²	35.9	2%	0.016	19%	0.193	C	C	.	.	H	α-helix	trans	-59.6	-50.1	178.1	-178.9	63.5	0	0	0	111.5	L588 V639 W643 Q650 T656 F657 L658	L588-L654 HydrophobicContact CD2-CB 3.8Å; L588-L654 HydrophobicContact CD2-CD1 4.17Å; L588-L654 HydrophobicContact CD2-CD2 4.45Å; L588-L654 HydrophobicContact CD2-CG 4.35Å; V639-L654 HydrophobicContact CG2-CD1 4.19Å; V639-L654 HydrophobicContact CG2-CD2 4.07Å; W643-L654 HydrophobicContact CD2-CD2 3.56Å; W643-L654 HydrophobicContact CE3-CD2 4.03Å; W643-L654 HydrophobicContact CG-CD2 3.89Å; W643-L654 HydrophobicContact CH2-CD2 4.3Å; W643-L654 HydrophobicContact CZ2-CD2 3.92Å; W643-L654 HydrophobicContact CZ3-CD2 4.36Å; Q650-L654 VanDerWaalsContact O-CB 3.28Å; Q650-L654 WeakPolarHBondContact O-CB 3.19Å; Q650-L654 PolarHBondContact O-N 2.76Å; L654-T656 VanDerWaalsContact C-N 3.32Å; L654-T656 PolarHBondContact O-N 3.49Å; L654-F657 PolarHBondContact O-N 3.27Å; L654-L658 HydrophobicContact CD1-CD1 4.02Å; L654-L658 HydrophobicContact CD1-CG 4.11Å; L654-L658 HydrophobicContact CG-CD1 3.95Å; L654-L658 HydrophobicContact CG-CG 4.38Å; L654-L658 WeakPolarHBondContact O-CB 3.42Å; L654-L658 VanDerWaalsContact O-CG 3.32Å; L654-L658 WeakPolarHBondContact O-CG 3.47Å; L654-L658 PolarHBondContact O-N 3.27Å
655	C	96.8	Very high	95	Very high	0 Å²	0	36 Å²	36	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-65.1	-37.5	-179.2	-69	0	0	0	0	112.1	T651 R659 L731 V735	T651-C655 WeakPolarHBondContact O-CB 3.27Å; T651-C655 PolarHBondContact O-N 3.27Å; T651-C655 PolarHBondContact O-SG 3.38Å; C655-R659 WeakPolarHBondContact O-CB 3.13Å; C655-R659 VanDerWaalsContact O-CG 3.27Å; C655-R659 WeakPolarHBondContact O-CG 3.28Å; C655-R659 PolarHBondContact O-N 3.12Å; C655-L731 WeakPolarHBondContact CB-O 3.44Å; C655-L731 PolarHBondContact SG-O 3.48Å; C655-V735 HydrophobicContact CB-CG2 4.36Å
656	T	95.7	Very high	94.6	Very high	70 Å²	70	40.7 Å²	40.7	43%	0.429	22%	0.224	S	C	.	.	H	α-helix	trans	-64.2	-46.3	175.6	-59.2	0	0	0	0	110.6	E652 L653 L654 R659 H660	E652-T656 VanDerWaalsContact O-CB 3.24Å; E652-T656 WeakPolarHBondContact O-CB 3.43Å; E652-T656 PolarHBondContact O-N 3.38Å; E652-T656 PolarHBondContact O-OG1 2.97Å; L653-T656 PolarHBondContact O-N 2.9Å; L654-T656 VanDerWaalsContact C-N 3.32Å; L654-T656 PolarHBondContact O-N 3.49Å; T656-R659 PolarHBondContact O-N 2.92Å; T656-H660 WeakPolarHBondContact O-CB 3.44Å; T656-H660 PolarHBondContact O-N 3.37Å
657	F	96.3	Very high	94.2	Very high	5 Å²	5	43.5 Å²	43.5	2%	0.022	24%	0.24	C	C	.	.	H	α-helix	trans	-60.6	-48.3	176.6	179.1	-92.9	0	0	0	111.8	W585 P587 Y592 L595 L635 L653 L654 R659 H660 L661	W585-F657 HydrophobicContact CH2-CE1 4.3Å; W585-F657 HydrophobicContact CH2-CE2 4.25Å; W585-F657 AromaticContact CH2-CZ 3.72Å; W585-F657 HydrophobicContact CH2-CZ 3.72Å; W585-F657 HydrophobicContact CZ2-CE2 4.04Å; W585-F657 AromaticContact CZ2-CZ 3.98Å; W585-F657 HydrophobicContact CZ2-CZ 3.98Å; P587-F657 HydrophobicContact CB-CB 4.23Å; P587-F657 HydrophobicContact CB-CD1 4.06Å; P587-F657 HydrophobicContact CB-CD2 3.93Å; P587-F657 HydrophobicContact CB-CE1 4.45Å; P587-F657 HydrophobicContact CB-CE2 4.32Å; P587-F657 HydrophobicContact CB-CG 3.78Å; P587-F657 HydrophobicContact CG-CD1 4.23Å; P587-F657 HydrophobicContact CG-CE1 4.47Å; P587-F657 HydrophobicContact CG-CG 4.44Å; Y592-F657 AromaticContact CE2-CD2 3.92Å; Y592-F657 HydrophobicContact CE2-CD2 3.92Å; Y592-F657 HydrophobicContact CE2-CE2 4.37Å; L595-F657 HydrophobicContact CD1-CE2 4.37Å; L595-F657 HydrophobicContact CD1-CZ 3.96Å; L595-F657 HydrophobicContact CG-CE2 4.21Å; L595-F657 HydrophobicContact CG-CZ 4.17Å; L635-F657 HydrophobicContact CD1-CE1 3.73Å; L635-F657 HydrophobicContact CD2-CD1 4.42Å; L635-F657 HydrophobicContact CD2-CE1 3.82Å; L635-F657 HydrophobicContact CG-CE1 4.42Å; L653-F657 VanDerWaalsContact O-CB 3.29Å; L653-F657 WeakPolarHBondContact O-CB 3.21Å; L653-F657 PolarHBondContact O-N 3.09Å; L654-F657 PolarHBondContact O-N 3.27Å; F657-R659 PolarHBondContact O-N 3.29Å; F657-H660 PolarHBondContact O-N 2.75Å; F657-L661 HydrophobicContact CE1-CD1 4.42Å; F657-L661 HydrophobicContact CE1-CD2 4.24Å; F657-L661 HydrophobicContact CZ-CD1 4.29Å; F657-L661 WeakPolarHBondContact O-CB 3.13Å; F657-L661 PolarHBondContact O-N 2.91Å
658	L	96	Very high	93.8	Very high	1 Å²	1	44 Å²	44	1%	0.005	24%	0.243	C	C	.	.	H	α-helix	trans	-64.4	-41.3	-179.9	-70.1	177.3	0	0	0	112.5	L654 H660 L661 F662 L678 V682 V735	L654-L658 HydrophobicContact CD1-CD1 4.02Å; L654-L658 HydrophobicContact CD1-CG 4.11Å; L654-L658 HydrophobicContact CG-CD1 3.95Å; L654-L658 HydrophobicContact CG-CG 4.38Å; L654-L658 WeakPolarHBondContact O-CB 3.42Å; L654-L658 VanDerWaalsContact O-CG 3.32Å; L654-L658 WeakPolarHBondContact O-CG 3.47Å; L654-L658 PolarHBondContact O-N 3.27Å; L658-H660 VanDerWaalsContact C-N 3.34Å; L658-H660 PolarHBondContact O-N 3.47Å; L658-L661 HydrophobicContact CD2-CD2 4.39Å; L658-L661 WeakPolarHBondContact O-CB 3.08Å; L658-L661 PolarHBondContact O-N 3.26Å; L658-F662 HydrophobicContact CB-CE2 4.11Å; L658-F662 HydrophobicContact CD2-CZ 4.46Å; L658-F662 WeakPolarHBondContact O-CD2 3.47Å; L658-F662 VanDerWaalsContact O-CG 3.31Å; L658-F662 WeakPolarHBondContact O-CG 3.42Å; L658-F662 PolarHBondContact O-N 3.03Å; L658-L678 HydrophobicContact CD2-CD2 3.88Å; L658-V682 HydrophobicContact CD1-CG2 4.19Å; L658-V735 HydrophobicContact CB-CG1 4.21Å; L658-V735 HydrophobicContact CB-CG2 4.02Å; L658-V735 HydrophobicContact CD1-CG1 3.7Å
659	R	95.1	Very high	93.4	Very high	86 Å²	86	45.4 Å²	45.4	33%	0.325	25%	0.25	S	S	.	.	H	α-helix	trans	-61.6	-43.4	174	-73.4	-176.5	-161.4	106.3	-4.1	111.7	C655 T656 F657 L661 S663 L731 R733 V735	C655-R659 WeakPolarHBondContact O-CB 3.13Å; C655-R659 VanDerWaalsContact O-CG 3.27Å; C655-R659 WeakPolarHBondContact O-CG 3.28Å; C655-R659 PolarHBondContact O-N 3.12Å; T656-R659 PolarHBondContact O-N 2.92Å; F657-R659 PolarHBondContact O-N 3.29Å; R659-L661 VanDerWaalsContact C-N 3.35Å; R659-S663 VanDerWaalsContact O-CB 3.29Å; R659-S663 WeakPolarHBondContact O-CB 3.36Å; R659-S663 PolarHBondContact O-N 3.28Å; R659-L731 PolarHBondContact NH2-O 2.81Å; R659-R733 PolarHBondContact NE-O 2.99Å; R659-R733 PolarHBondContact NH2-O 3.25Å; R659-V735 HydrophobicContact CG-CG2 3.94Å
660	H	94.3	Very high	92.8	Very high	116 Å²	116	45.8 Å²	45.8	54%	0.537	26%	0.261	S	S	.	.	H	α-helix	trans	-63.8	-42.1	175.9	178.9	59	0	0	0	111.5	T656 F657 L658 S663 T664	T656-H660 WeakPolarHBondContact O-CB 3.44Å; T656-H660 PolarHBondContact O-N 3.37Å; F657-H660 PolarHBondContact O-N 2.75Å; L658-H660 VanDerWaalsContact C-N 3.34Å; L658-H660 PolarHBondContact O-N 3.47Å; H660-S663 PolarHBondContact O-N 3.37Å; H660-T664 PolarHBondContact CE1-OG1 2.85Å; H660-T664 VanDerWaalsContact CE1-OG1 3.22Å; H660-T664 PolarHBondContact ND1-OG1 3.37Å; H660-T664 VanDerWaalsContact O-CB 3.29Å; H660-T664 WeakPolarHBondContact O-CB 3.27Å; H660-T664 PolarHBondContact O-N 2.95Å; H660-T664 PolarHBondContact O-OG1 2.97Å
661	L	94.5	Very high	92.3	Very high	4 Å²	4	52.2 Å²	52.2	2%	0.021	29%	0.291	C	S	.	.	H	α-helix	trans	-59.3	-50.3	177.8	-168.4	74.5	0	0	0	111.5	L595 V627 L635 F657 L658 R659 S663 T664 Y665 L668	L595-L661 HydrophobicContact CD1-CD1 3.88Å; V627-L661 HydrophobicContact CG1-CD1 3.82Å; V627-L661 HydrophobicContact CG1-CG 4.48Å; L635-L661 HydrophobicContact CD1-CD2 3.92Å; F657-L661 HydrophobicContact CE1-CD1 4.42Å; F657-L661 HydrophobicContact CE1-CD2 4.24Å; F657-L661 HydrophobicContact CZ-CD1 4.29Å; F657-L661 WeakPolarHBondContact O-CB 3.13Å; F657-L661 PolarHBondContact O-N 2.91Å; L658-L661 HydrophobicContact CD2-CD2 4.39Å; L658-L661 WeakPolarHBondContact O-CB 3.08Å; L658-L661 PolarHBondContact O-N 3.26Å; R659-L661 VanDerWaalsContact C-N 3.35Å; L661-S663 PolarHBondContact O-N 3.43Å; L661-T664 PolarHBondContact O-N 3.17Å; L661-Y665 HydrophobicContact CD1-CD2 3.84Å; L661-Y665 HydrophobicContact CD1-CE2 3.86Å; L661-Y665 HydrophobicContact CG-CD2 4.32Å; L661-Y665 WeakPolarHBondContact O-CD2 3.34Å; L661-Y665 PolarHBondContact O-N 3.45Å; L661-L668 HydrophobicContact CD2-CD1 4.01Å; L661-L668 HydrophobicContact CG-CD1 3.8Å
662	F	93.1	Very high	92	Very high	41 Å²	41	53 Å²	53	18%	0.18	30%	0.296	C	S	.	.	H	α-helix	trans	-69.6	-31.5	179.2	-60.1	-40.4	0	0	0	113.1	L658 L668 T675 L679 V735	L658-F662 HydrophobicContact CB-CE2 4.11Å; L658-F662 HydrophobicContact CD2-CZ 4.46Å; L658-F662 WeakPolarHBondContact O-CD2 3.47Å; L658-F662 VanDerWaalsContact O-CG 3.31Å; L658-F662 WeakPolarHBondContact O-CG 3.42Å; L658-F662 PolarHBondContact O-N 3.03Å; F662-L668 HydrophobicContact CD1-CB 3.95Å; F662-L668 HydrophobicContact CD1-CD1 4.12Å; F662-L668 HydrophobicContact CE1-CB 4.3Å; F662-L668 HydrophobicContact CE1-CD1 4.38Å; F662-T675 HydrophobicContact CE1-CG2 3.92Å; F662-T675 HydrophobicContact CZ-CG2 4.36Å; F662-L679 HydrophobicContact CE2-CD2 4.02Å; F662-L679 HydrophobicContact CZ-CD2 3.88Å; F662-V735 HydrophobicContact CE2-CG1 4.25Å
663	S	93.3	Very high	91.9	Very high	97 Å²	97	54.5 Å²	54.5	68%	0.678	30%	0.301	S	S	*	.	H	α-helix	trans	-71.3	-32.4	173.2	-175	0	0	0	0	112.6	R659 H660 L661	R659-S663 VanDerWaalsContact O-CB 3.29Å; R659-S663 WeakPolarHBondContact O-CB 3.36Å; R659-S663 PolarHBondContact O-N 3.28Å; H660-S663 PolarHBondContact O-N 3.37Å; L661-S663 PolarHBondContact O-N 3.43Å
664	T	92.5	Very high	91.7	Very high	57 Å²	57	53.7 Å²	53.7	35%	0.35	30%	0.298	S	S	.	.	H	α-helix	trans	-82.9	-34.7	-177.2	-54.6	0	0	0	0	111.5	H660 L661 P666	H660-T664 PolarHBondContact CE1-OG1 2.85Å; H660-T664 VanDerWaalsContact CE1-OG1 3.22Å; H660-T664 PolarHBondContact ND1-OG1 3.37Å; H660-T664 VanDerWaalsContact O-CB 3.29Å; H660-T664 WeakPolarHBondContact O-CB 3.27Å; H660-T664 PolarHBondContact O-N 2.95Å; H660-T664 PolarHBondContact O-OG1 2.97Å; L661-T664 PolarHBondContact O-N 3.17Å; T664-P666 WeakPolarHBondContact O-CD 3.45Å
665	Y	92	Very high	91.6	Very high	18 Å²	18	53.7 Å²	53.7	7%	0.071	30%	0.298	C	S	.	.			trans	-120.7	83.9	179.7	-51.3	-64.9	0	0	0	111.1	Y601 I623 P624 V627 L661 T667 L668	Y601-Y665 WeakPolarHBondContact CE2-OH 3.24Å; Y601-Y665 PolarHBondContact OH-OH 3.24Å; I623-Y665 HydrophobicContact CG2-CE1 3.91Å; P624-Y665 HydrophobicContact CB-CD1 4.14Å; P624-Y665 HydrophobicContact CG-CD1 3.95Å; V627-Y665 HydrophobicContact CB-CD2 4.49Å; V627-Y665 HydrophobicContact CB-CE2 4.49Å; V627-Y665 HydrophobicContact CG1-CD2 3.97Å; V627-Y665 HydrophobicContact CG1-CE2 4.15Å; V627-Y665 HydrophobicContact CG2-CD2 4.4Å; V627-Y665 HydrophobicContact CG2-CE2 3.93Å; L661-Y665 HydrophobicContact CD1-CD2 3.84Å; L661-Y665 HydrophobicContact CD1-CE2 3.86Å; L661-Y665 HydrophobicContact CG-CD2 4.32Å; L661-Y665 WeakPolarHBondContact O-CD2 3.34Å; L661-Y665 PolarHBondContact O-N 3.45Å; Y665-T667 PolarHBondContact O-N 3.49Å; Y665-L668 HydrophobicContact CD2-CD1 4.33Å; Y665-L668 WeakPolarHBondContact O-CB 3.25Å; Y665-L668 PolarHBondContact O-N 3.13Å
666	P	86.5	Confident	91.5	Very high	104 Å²	104	59.7 Å²	59.7	68%	0.675	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-13.7	176.4	-24	34.1	0	0	0	114.4	T664 L668	T664-P666 WeakPolarHBondContact O-CD 3.45Å; P666-L668 PolarHBondContact O-N 3.19Å
667	T	85.2	Confident	91.5	Very high	62 Å²	62	60.8 Å²	60.8	38%	0.38	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-18.9	173.1	59.1	0	0	0	0	112.9	P624 Y665 T669	P624-T667 HydrophobicContact CB-CG2 4.21Å; P624-T667 VanDerWaalsContact CB-OG1 3.28Å; P624-T667 WeakPolarHBondContact CB-OG1 3.44Å; Y665-T667 PolarHBondContact O-N 3.49Å; T667-T669 PolarHBondContact O-N 3.19Å
668	L	88.5	Confident	91.5	Very high	14 Å²	14	60.5 Å²	60.5	7%	0.073	32%	0.319	C	S	.	.			trans	-77.2	71.9	175.5	-61.2	178.6	0	0	0	110.1	V627 E628 L661 F662 Y665 P666	V627-L668 HydrophobicContact CG1-CD1 4.16Å; E628-L668 HydrophobicContact CB-CD2 3.63Å; E628-L668 HydrophobicContact CG-CD2 3.74Å; L661-L668 HydrophobicContact CD2-CD1 4.01Å; L661-L668 HydrophobicContact CG-CD1 3.8Å; F662-L668 HydrophobicContact CD1-CB 3.95Å; F662-L668 HydrophobicContact CD1-CD1 4.12Å; F662-L668 HydrophobicContact CE1-CB 4.3Å; F662-L668 HydrophobicContact CE1-CD1 4.38Å; Y665-L668 HydrophobicContact CD2-CD1 4.33Å; Y665-L668 WeakPolarHBondContact O-CB 3.25Å; Y665-L668 PolarHBondContact O-N 3.13Å; P666-L668 PolarHBondContact O-N 3.19Å
669	T	85.7	Confident	91.6	Very high	58 Å²	58	62.2 Å²	62.2	36%	0.356	33%	0.328	S	S	.	.			trans	-86.7	164.7	-179.3	70.4	0	0	0	0	111.8	T667 E671 S672 T675	T667-T669 PolarHBondContact O-N 3.19Å; T669-E671 PolarHBondContact O-N 3.06Å; T669-E671 PolarHBondContact OG1-N 2.87Å; T669-S672 PolarHBondContact O-N 2.66Å; T669-T675 WeakPolarHBondContact O-CB 3.4Å
670	G	80.7	Confident	91.6	Very high	51 Å²	51	62.7 Å²	62.7	53%	0.526	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	-7.4	171.9	0	0	0	0	0	114.3	R676	G670-R676 WeakPolarHBondContact O-CD 3.26Å; G670-R676 WeakPolarHBondContact O-CG 3.32Å; G670-R676 PolarHBondContact O-NE 3.35Å
671	E	85.7	Confident	91.8	Very high	161 Å²	161	57.5 Å²	57.5	75%	0.752	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-32.2	176	-60	-179.6	167.7	0	0	111.2	T669 K673 R676	T669-E671 PolarHBondContact O-N 3.06Å; T669-E671 PolarHBondContact OG1-N 2.87Å; E671-K673 PolarHBondContact O-N 3.39Å; E671-R676 PolarHBondContact O-NE 2.95Å; E671-R676 PolarHBondContact O-NH2 2.84Å
672	S	90.1	Very high	91.9	Very high	16 Å²	16	57.3 Å²	57.3	11%	0.112	31%	0.314	C	S	.	.	S	Bend	trans	-59.6	124.9	176.7	173	0	0	0	0	110.8	E628 T669 T674 T675 R676	E628-S672 WeakPolarHBondContact OE1-CB 3.43Å; E628-S672 PolarHBondContact OE1-OG 3.14Å; T669-S672 PolarHBondContact O-N 2.66Å; S672-T674 PolarHBondContact O-N 3.02Å; S672-T674 PolarHBondContact OG-N 3.46Å; S672-T675 PolarHBondContact O-N 3.34Å; S672-T675 PolarHBondContact OG-N 3.09Å; S672-R676 WeakPolarHBondContact O-CG 3.28Å; S672-R676 PolarHBondContact O-N 2.98Å
673	K	93.9	Very high	92.2	Very high	145 Å²	145	56.7 Å²	56.7	63%	0.63	31%	0.31	S	S	*	.	H	α-helix	trans	-57.1	-39.9	175.4	-175.1	176.5	-179.1	174.5	0	111	E671 R676 Q677	E671-K673 PolarHBondContact O-N 3.39Å; K673-R676 PolarHBondContact O-N 3.14Å; K673-Q677 VanDerWaalsContact O-CG 3.28Å; K673-Q677 WeakPolarHBondContact O-CG 3.5Å; K673-Q677 PolarHBondContact O-N 3.33Å
674	T	93.7	Very high	92.4	Very high	19 Å²	19	56.3 Å²	56.3	12%	0.117	30%	0.301	C	S	.	.	H	α-helix	trans	-69.5	-43.5	-178	-42.9	0	0	0	0	111.7	E628 C632 P633 S672 R676 Q677 L678	E628-T674 VanDerWaalsContact O-CG2 3.28Å; E628-T674 WeakPolarHBondContact O-CG2 3.11Å; C632-T674 HydrophobicContact CB-CG2 3.7Å; P633-T674 HydrophobicContact CG-CG2 3.7Å; S672-T674 PolarHBondContact O-N 3.02Å; S672-T674 PolarHBondContact OG-N 3.46Å; T674-R676 PolarHBondContact O-N 3.25Å; T674-Q677 PolarHBondContact O-N 3.26Å; T674-L678 PolarHBondContact O-N 3.38Å; T674-L678 VanDerWaalsContact O-N 3.07Å
675	T	93.9	Very high	92.6	Very high	2 Å²	2	54.7 Å²	54.7	1%	0.012	29%	0.291	C	S	.	.	H	α-helix	trans	-63.2	-42.7	175.4	-54.1	0	0	0	0	111.1	F662 T669 S672 Q677 L678 L679	F662-T675 HydrophobicContact CE1-CG2 3.92Å; F662-T675 HydrophobicContact CZ-CG2 4.36Å; T669-T675 WeakPolarHBondContact O-CB 3.4Å; S672-T675 PolarHBondContact O-N 3.34Å; S672-T675 PolarHBondContact OG-N 3.09Å; T675-Q677 VanDerWaalsContact C-N 3.35Å; T675-Q677 PolarHBondContact O-N 2.91Å; T675-L678 WeakPolarHBondContact O-CB 3.26Å; T675-L678 PolarHBondContact O-N 3.3Å; T675-L679 HydrophobicContact CG2-CD1 4.3Å; T675-L679 WeakPolarHBondContact O-CG 3.19Å; T675-L679 PolarHBondContact O-N 3.31Å
676	R	94.8	Very high	92.8	Very high	127 Å²	127	53.9 Å²	53.9	48%	0.479	29%	0.288	S	S	.	.	H	α-helix	trans	-60.1	-41.8	174.1	-76.5	-175	-75.5	173.5	-4.7	112.7	G670 E671 S672 K673 T674 L678 L679 N680	G670-R676 WeakPolarHBondContact O-CD 3.26Å; G670-R676 WeakPolarHBondContact O-CG 3.32Å; G670-R676 PolarHBondContact O-NE 3.35Å; E671-R676 PolarHBondContact O-NE 2.95Å; E671-R676 PolarHBondContact O-NH2 2.84Å; S672-R676 WeakPolarHBondContact O-CG 3.28Å; S672-R676 PolarHBondContact O-N 2.98Å; K673-R676 PolarHBondContact O-N 3.14Å; T674-R676 PolarHBondContact O-N 3.25Å; R676-L678 VanDerWaalsContact C-N 3.33Å; R676-L678 PolarHBondContact O-N 2.93Å; R676-L679 PolarHBondContact O-N 2.89Å; R676-N680 VanDerWaalsContact O-CB 3.28Å; R676-N680 WeakPolarHBondContact O-CB 3.37Å; R676-N680 PolarHBondContact O-N 3.43Å; R676-N680 PolarHBondContact O-ND2 2.94Å
677	Q	96.3	Very high	93.3	Very high	92 Å²	92	51 Å²	51	43%	0.43	27%	0.266	S	S	.	.	H	α-helix	trans	-61.3	-41.5	176.5	-76.5	173.1	-10	0	0	112	K673 T674 T675 A681	K673-Q677 VanDerWaalsContact O-CG 3.28Å; K673-Q677 WeakPolarHBondContact O-CG 3.5Å; K673-Q677 PolarHBondContact O-N 3.33Å; T674-Q677 PolarHBondContact O-N 3.26Å; T675-Q677 VanDerWaalsContact C-N 3.35Å; T675-Q677 PolarHBondContact O-N 2.91Å; Q677-A681 WeakPolarHBondContact O-CB 3.45Å; Q677-A681 PolarHBondContact O-N 3.23Å
678	L	96.8	Very high	93.8	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-61.8	-50.2	174.9	176.6	59.4	0	0	0	111.5	L635 T636 V639 L658 T674 T675 R676 N680 A681 V682	L635-L678 HydrophobicContact CB-CD1 3.82Å; L635-L678 HydrophobicContact CB-CD2 4.32Å; L635-L678 HydrophobicContact CD1-CD2 4.3Å; T636-L678 WeakPolarHBondContact OG1-CA 3.28Å; T636-L678 WeakPolarHBondContact OG1-CB 3.46Å; V639-L678 HydrophobicContact CG2-CD1 4.08Å; L658-L678 HydrophobicContact CD2-CD2 3.88Å; T674-L678 PolarHBondContact O-N 3.38Å; T674-L678 VanDerWaalsContact O-N 3.07Å; T675-L678 WeakPolarHBondContact O-CB 3.26Å; T675-L678 PolarHBondContact O-N 3.3Å; R676-L678 VanDerWaalsContact C-N 3.33Å; R676-L678 PolarHBondContact O-N 2.93Å; L678-N680 PolarHBondContact O-N 3.37Å; L678-A681 WeakPolarHBondContact O-CB 3.27Å; L678-A681 PolarHBondContact O-N 3.41Å; L678-V682 WeakPolarHBondContact O-CG2 3.35Å; L678-V682 PolarHBondContact O-N 2.84Å
679	L	96.2	Very high	94.1	Very high	36 Å²	36	54 Å²	54	19%	0.188	27%	0.273	C	S	.	.	H	α-helix	trans	-64.7	-40	-179.5	-64.4	177.6	0	0	0	112.3	F662 T675 R676 A681 V682 Y683 V735 L736	F662-L679 HydrophobicContact CE2-CD2 4.02Å; F662-L679 HydrophobicContact CZ-CD2 3.88Å; T675-L679 HydrophobicContact CG2-CD1 4.3Å; T675-L679 WeakPolarHBondContact O-CG 3.19Å; T675-L679 PolarHBondContact O-N 3.31Å; R676-L679 PolarHBondContact O-N 2.89Å; L679-A681 VanDerWaalsContact C-N 3.33Å; L679-A681 PolarHBondContact O-N 3.24Å; L679-V682 PolarHBondContact O-N 3Å; L679-Y683 PolarHBondContact O-N 2.92Å; L679-V735 HydrophobicContact CD2-CG1 3.92Å; L679-L736 HydrophobicContact CB-CD2 4.13Å; L679-L736 HydrophobicContact CD2-CD2 4.17Å
680	N	96.7	Very high	94.6	Very high	97 Å²	97	51.2 Å²	51.2	52%	0.519	26%	0.256	S	S	.	.	H	α-helix	trans	-63.2	-39.7	173.5	-74.6	-19.4	0	0	0	111.5	R676 L678 Y683 N684	R676-N680 VanDerWaalsContact O-CB 3.28Å; R676-N680 WeakPolarHBondContact O-CB 3.37Å; R676-N680 PolarHBondContact O-N 3.43Å; R676-N680 PolarHBondContact O-ND2 2.94Å; L678-N680 PolarHBondContact O-N 3.37Å; N680-Y683 PolarHBondContact O-N 2.95Å; N680-N684 VanDerWaalsContact O-CB 3.28Å; N680-N684 WeakPolarHBondContact O-CB 3.48Å; N680-N684 PolarHBondContact O-N 3.41Å; N680-N684 PolarHBondContact O-ND2 2.94Å
681	A	97.6	Very high	95.2	Very high	7 Å²	7	53.2 Å²	53.2	6%	0.058	26%	0.255	C	S	.	.	H	α-helix	trans	-62.6	-41.9	174.8	0	0	0	0	0	111.8	T636 V639 K640 Q677 L678 L679 C685	T636-A681 HydrophobicContact CG2-CB 4Å; V639-A681 HydrophobicContact CG1-CB 3.89Å; K640-A681 HydrophobicContact CG-CB 3.93Å; Q677-A681 WeakPolarHBondContact O-CB 3.45Å; Q677-A681 PolarHBondContact O-N 3.23Å; L678-A681 WeakPolarHBondContact O-CB 3.27Å; L678-A681 PolarHBondContact O-N 3.41Å; L679-A681 VanDerWaalsContact C-N 3.33Å; L679-A681 PolarHBondContact O-N 3.24Å; A681-C685 WeakPolarHBondContact O-CB 3.31Å; A681-C685 PolarHBondContact O-N 3.43Å
682	V	97.8	Very high	95.5	Very high	0 Å²	0	50 Å²	50	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.1	-48	175.6	173.7	0	0	0	0	110.7	V639 W643 L658 L678 L679 F686 L732 L736	V639-V682 HydrophobicContact CG1-CB 4.34Å; V639-V682 HydrophobicContact CG1-CG2 3.75Å; V639-V682 HydrophobicContact CG2-CG2 4.09Å; W643-V682 HydrophobicContact CH2-CG1 3.86Å; W643-V682 HydrophobicContact CZ3-CB 4.37Å; W643-V682 HydrophobicContact CZ3-CG1 3.95Å; W643-V682 WeakPolarHBondContact CZ3-O 3.34Å; L658-V682 HydrophobicContact CD1-CG2 4.19Å; L678-V682 WeakPolarHBondContact O-CG2 3.35Å; L678-V682 PolarHBondContact O-N 2.84Å; L679-V682 PolarHBondContact O-N 3Å; V682-F686 WeakPolarHBondContact O-CB 3.49Å; V682-F686 PolarHBondContact O-N 3.48Å; V682-F686 VanDerWaalsContact O-N 3.16Å; V682-L732 HydrophobicContact CG1-CD2 3.65Å; V682-L736 HydrophobicContact CG1-CD1 4.35Å
683	Y	97.7	Very high	95.5	Very high	28 Å²	28	50.2 Å²	50.2	11%	0.11	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-53.5	178.6	-178.2	-91.1	0	0	0	112.1	L679 N680 C685 F686 E687 L736 K743 L744	L679-Y683 PolarHBondContact O-N 2.92Å; N680-Y683 PolarHBondContact O-N 2.95Å; Y683-C685 PolarHBondContact O-N 3.43Å; Y683-F686 PolarHBondContact O-N 3.2Å; Y683-E687 HydrophobicContact CE1-CB 4.43Å; Y683-E687 WeakPolarHBondContact CE1-OE2 3.25Å; Y683-E687 PolarHBondContact O-N 3.04Å; Y683-E687 PolarHBondContact OH-OE1 2.9Å; Y683-L736 HydrophobicContact CD2-CD1 4.2Å; Y683-K743 WeakPolarHBondContact OH-CD 3.36Å; Y683-K743 WeakPolarHBondContact OH-CE 3.46Å; Y683-K743 WeakPolarHBondContact OH-CG 3.41Å; Y683-K743 PolarHBondContact OH-NZ 3.33Å; Y683-L744 HydrophobicContact CD2-CD1 3.87Å; Y683-L744 HydrophobicContact CD2-CD2 4.24Å; Y683-L744 HydrophobicContact CD2-CG 4.06Å; Y683-L744 HydrophobicContact CE2-CD1 3.94Å; Y683-L744 HydrophobicContact CE2-CD2 3.76Å; Y683-L744 HydrophobicContact CE2-CG 3.6Å
684	N	97.4	Very high	95.5	Very high	89 Å²	89	44 Å²	44	48%	0.476	22%	0.215	S	C	.	.	H	α-helix	trans	-64.7	-38.9	-175.7	-68.3	-18.7	0	0	0	112.1	N680 K688	N680-N684 VanDerWaalsContact O-CB 3.28Å; N680-N684 WeakPolarHBondContact O-CB 3.48Å; N680-N684 PolarHBondContact O-N 3.41Å; N680-N684 PolarHBondContact O-ND2 2.94Å; N684-K688 VanDerWaalsContact O-CB 3.25Å; N684-K688 WeakPolarHBondContact O-CB 3.46Å; N684-K688 PolarHBondContact O-N 3.23Å
685	C	97.2	Very high	95.4	Very high	23 Å²	23	46.8 Å²	46.8	16%	0.155	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-41.1	177	-170.8	0	0	0	0	111.1	V639 W643 A681 Y683 M689	V639-C685 PolarHBondContact O-SG 3.33Å; V639-C685 VanDerWaalsContact O-SG 3.4Å; W643-C685 HydrophobicContact CE3-CB 4.03Å; W643-C685 HydrophobicContact CZ3-CB 4.01Å; A681-C685 WeakPolarHBondContact O-CB 3.31Å; A681-C685 PolarHBondContact O-N 3.43Å; Y683-C685 PolarHBondContact O-N 3.43Å; C685-M689 PolarHBondContact O-N 2.89Å
686	F	97.2	Very high	95.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-68.1	-45.5	176.3	-155.6	-76.2	0	0	0	112.3	W643 P645 V682 Y683 K688 M689 L690 N728 A729 L732 L744	W643-F686 HydrophobicContact CH2-CB 4.3Å; W643-F686 AromaticContact CH2-CD2 3.81Å; W643-F686 HydrophobicContact CH2-CD2 3.81Å; W643-F686 HydrophobicContact CZ2-CD2 4.15Å; P645-F686 HydrophobicContact CB-CD2 3.58Å; P645-F686 HydrophobicContact CB-CE2 3.91Å; P645-F686 HydrophobicContact CB-CG 4.19Å; P645-F686 HydrophobicContact CG-CD2 4.44Å; V682-F686 WeakPolarHBondContact O-CB 3.49Å; V682-F686 PolarHBondContact O-N 3.48Å; V682-F686 VanDerWaalsContact O-N 3.16Å; Y683-F686 PolarHBondContact O-N 3.2Å; F686-K688 VanDerWaalsContact C-N 3.32Å; F686-K688 PolarHBondContact O-N 2.93Å; F686-M689 HydrophobicContact CD1-CE 4.22Å; F686-M689 HydrophobicContact CE1-CE 3.8Å; F686-M689 HydrophobicContact CE2-CE 4.14Å; F686-M689 HydrophobicContact CZ-CE 3.74Å; F686-M689 PolarHBondContact O-N 3.33Å; F686-L690 HydrophobicContact CD1-CD1 3.8Å; F686-L690 HydrophobicContact CD1-CD2 4.42Å; F686-L690 HydrophobicContact CD1-CG 3.86Å; F686-L690 HydrophobicContact CE1-CD1 3.82Å; F686-L690 HydrophobicContact CE1-CD2 3.87Å; F686-L690 HydrophobicContact CE1-CG 3.81Å; F686-L690 WeakPolarHBondContact O-CG 3.4Å; F686-L690 PolarHBondContact O-N 3.45Å; F686-N728 HydrophobicContact CE2-CB 4.1Å; F686-N728 HydrophobicContact CZ-CB 4.1Å; F686-A729 HydrophobicContact CE1-CB 3.6Å; F686-A729 VanDerWaalsContact CZ-CA 3.47Å; F686-A729 HydrophobicContact CZ-CB 3.6Å; F686-L732 HydrophobicContact CB-CD1 4.3Å; F686-L732 HydrophobicContact CD1-CD1 4.45Å; F686-L732 HydrophobicContact CD2-CD1 3.66Å; F686-L732 HydrophobicContact CE2-CD1 4.1Å; F686-L732 HydrophobicContact CG-CD1 3.87Å; F686-L744 HydrophobicContact CB-CD1 4.3Å; F686-L744 HydrophobicContact CD1-CD1 4.1Å; F686-L744 HydrophobicContact CD1-CD2 4.38Å; F686-L744 HydrophobicContact CG-CD1 4.35Å
687	E	97	Very high	94.8	Very high	45 Å²	45	42.3 Å²	42.3	21%	0.21	21%	0.212	C	C	.	.	H	α-helix	trans	-58.9	-43.7	176.5	-169.3	174.1	-136.5	0	0	111.1	Y683 M689 L690 N691 K743 L744	Y683-E687 HydrophobicContact CE1-CB 4.43Å; Y683-E687 WeakPolarHBondContact CE1-OE2 3.25Å; Y683-E687 PolarHBondContact O-N 3.04Å; Y683-E687 PolarHBondContact OH-OE1 2.9Å; E687-M689 PolarHBondContact O-N 3.28Å; E687-L690 PolarHBondContact O-N 2.91Å; E687-N691 PolarHBondContact O-N 2.88Å; E687-N691 VanDerWaalsContact O-N 3.08Å; E687-N691 PolarHBondContact O-ND2 3.22Å; E687-K743 IonicContact OE1-NZ 2.72Å; E687-K743 PolarHBondContact OE1-NZ 3.45Å; E687-L744 HydrophobicContact CB-CD2 3.81Å; E687-L744 HydrophobicContact CG-CD2 4.31Å
688	K	95.8	Very high	94.2	Very high	132 Å²	132	43.1 Å²	43.1	57%	0.574	22%	0.217	S	C	*	.	H	α-helix	trans	-59.4	-45.9	174.3	-175.8	-178.6	178.4	-174.1	0	112.3	N684 F686 L690 N691 D692	N684-K688 VanDerWaalsContact O-CB 3.25Å; N684-K688 WeakPolarHBondContact O-CB 3.46Å; N684-K688 PolarHBondContact O-N 3.23Å; F686-K688 VanDerWaalsContact C-N 3.32Å; F686-K688 PolarHBondContact O-N 2.93Å; K688-L690 VanDerWaalsContact C-N 3.3Å; K688-L690 PolarHBondContact O-N 3.08Å; K688-N691 PolarHBondContact O-N 3.44Å; K688-D692 VanDerWaalsContact CE-OD2 3.27Å; K688-D692 WeakPolarHBondContact CE-OD2 3.43Å; K688-D692 WeakPolarHBondContact CG-OD2 3.26Å; K688-D692 WeakPolarHBondContact O-CB 3.09Å; K688-D692 PolarHBondContact O-N 2.64Å
689	M	95	Very high	93.6	Very high	6 Å²	6	43.8 Å²	43.8	3%	0.03	22%	0.22	C	C	.	.	H	α-helix	trans	-59.9	-41.8	176.8	179.8	-79.9	-63.6	0	0	111.7	P645 A646 C685 F686 E687 N691 D692 E693 C725	P645-M689 HydrophobicContact CB-CB 3.93Å; P645-M689 HydrophobicContact CB-CE 3.75Å; P645-M689 HydrophobicContact CB-CG 3.98Å; P645-M689 HydrophobicContact CG-CB 3.96Å; P645-M689 HydrophobicContact CG-CG 4.38Å; A646-M689 HydrophobicContact CB-CG 4.25Å; A646-M689 HydrophobicContact CB-SD 4.18Å; C685-M689 PolarHBondContact O-N 2.89Å; F686-M689 HydrophobicContact CD1-CE 4.22Å; F686-M689 HydrophobicContact CE1-CE 3.8Å; F686-M689 HydrophobicContact CE2-CE 4.14Å; F686-M689 HydrophobicContact CZ-CE 3.74Å; F686-M689 PolarHBondContact O-N 3.33Å; E687-M689 PolarHBondContact O-N 3.28Å; M689-N691 VanDerWaalsContact C-N 3.32Å; M689-N691 PolarHBondContact O-N 3.41Å; M689-D692 PolarHBondContact O-N 2.87Å; M689-E693 HydrophobicContact CG-CB 4.27Å; M689-E693 HydrophobicContact CG-CG 4.17Å; M689-E693 WeakPolarHBondContact O-CB 3.38Å; M689-E693 PolarHBondContact O-N 3.45Å; M689-E693 HydrophobicContact SD-CB 4.34Å; M689-C725 HydrophobicContact CE-CB 4.27Å
690	L	95.2	Very high	93	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-61.3	-41.4	177.6	-68.3	179.1	0	0	0	112	F686 E687 K688 I694 C725 L744 C748 L749	F686-L690 HydrophobicContact CD1-CD1 3.8Å; F686-L690 HydrophobicContact CD1-CD2 4.42Å; F686-L690 HydrophobicContact CD1-CG 3.86Å; F686-L690 HydrophobicContact CE1-CD1 3.82Å; F686-L690 HydrophobicContact CE1-CD2 3.87Å; F686-L690 HydrophobicContact CE1-CG 3.81Å; F686-L690 WeakPolarHBondContact O-CG 3.4Å; F686-L690 PolarHBondContact O-N 3.45Å; E687-L690 PolarHBondContact O-N 2.91Å; K688-L690 VanDerWaalsContact C-N 3.3Å; K688-L690 PolarHBondContact O-N 3.08Å; L690-I694 HydrophobicContact CD2-CD1 4.34Å; L690-I694 HydrophobicContact CD2-CG1 4.11Å; L690-I694 WeakPolarHBondContact O-CB 3.43Å; L690-I694 VanDerWaalsContact O-CG1 3.23Å; L690-I694 WeakPolarHBondContact O-CG1 3.35Å; L690-C725 HydrophobicContact CD2-CB 4.36Å; L690-L744 HydrophobicContact CD1-CB 4.29Å; L690-L744 HydrophobicContact CD1-CD2 4.23Å; L690-C748 HydrophobicContact CB-CB 4.43Å; L690-C748 HydrophobicContact CD1-CB 3.66Å; L690-L749 HydrophobicContact CD1-CB 4.28Å; L690-L749 HydrophobicContact CD2-CB 4.19Å; L690-L749 HydrophobicContact CD2-CD1 4.1Å; L690-L749 HydrophobicContact CD2-CD2 4.04Å; L690-L749 HydrophobicContact CD2-CG 4.33Å
691	N	93.1	Very high	92.2	Very high	93 Å²	93	45.9 Å²	45.9	50%	0.497	23%	0.231	S	C	.	.	H	α-helix	trans	-72.6	-38.9	179.4	-64.9	-25.6	0	0	0	112.9	E687 K688 M689	E687-N691 PolarHBondContact O-N 2.88Å; E687-N691 VanDerWaalsContact O-N 3.08Å; E687-N691 PolarHBondContact O-ND2 3.22Å; K688-N691 PolarHBondContact O-N 3.44Å; M689-N691 VanDerWaalsContact C-N 3.32Å; M689-N691 PolarHBondContact O-N 3.41Å
692	D	91.6	Very high	91.5	Very high	93 Å²	93	51.8 Å²	51.8	50%	0.497	26%	0.261	S	S	.	.	H	α-helix	trans	-93.4	-29.5	-169.3	-68.4	-8.5	0	0	0	113.9	K688 M689	K688-D692 VanDerWaalsContact CE-OD2 3.27Å; K688-D692 WeakPolarHBondContact CE-OD2 3.43Å; K688-D692 WeakPolarHBondContact CG-OD2 3.26Å; K688-D692 WeakPolarHBondContact O-CB 3.09Å; K688-D692 PolarHBondContact O-N 2.64Å; M689-D692 PolarHBondContact O-N 2.87Å
693	E	91.2	Very high	90.9	Very high	20 Å²	20	53.2 Å²	53.2	9%	0.093	27%	0.268	C	S	.	.	H	α-helix	trans	-109	-18.8	-170.7	-64.2	-169.4	-154.5	0	0	114.8	Q446 A646 M689 F695	Q446-E693 PolarHBondContact NE2-OE2 2.86Å; A646-E693 WeakPolarHBondContact CB-OE2 3.34Å; M689-E693 HydrophobicContact CG-CB 4.27Å; M689-E693 HydrophobicContact CG-CG 4.17Å; M689-E693 WeakPolarHBondContact O-CB 3.38Å; M689-E693 PolarHBondContact O-N 3.45Å; M689-E693 HydrophobicContact SD-CB 4.34Å; E693-F695 PolarHBondContact O-N 3.43Å
694	I	92.9	Very high	90.2	Very high	15 Å²	15	53.4 Å²	53.4	8%	0.077	27%	0.271	C	S	.	.			trans	-77.4	107.6	-177.6	-60.5	-66.9	0	0	0	110.1	L690 L696 F721 C725 L749 H753	L690-I694 HydrophobicContact CD2-CD1 4.34Å; L690-I694 HydrophobicContact CD2-CG1 4.11Å; L690-I694 WeakPolarHBondContact O-CB 3.43Å; L690-I694 VanDerWaalsContact O-CG1 3.23Å; L690-I694 WeakPolarHBondContact O-CG1 3.35Å; I694-L696 HydrophobicContact CG2-CD1 4.05Å; I694-F721 HydrophobicContact CD1-CD1 4.38Å; I694-F721 HydrophobicContact CD1-CE1 4Å; I694-C725 HydrophobicContact CD1-CB 3.99Å; I694-L749 HydrophobicContact CD1-CD1 4.08Å; I694-L749 HydrophobicContact CG1-CD1 4.18Å; I694-L749 HydrophobicContact CG2-CD1 4.36Å; I694-H753 HydrophobicContact CG2-CB 4.01Å
695	F	92.7	Very high	89.5	Confident	77 Å²	77	55 Å²	55	34%	0.338	28%	0.28	S	S	.	.			trans	-118.2	104.8	178	-178.4	-115.8	0	0	0	111.9	I450 Y454 E693 P697 F714 Q718	I450-F695 HydrophobicContact CG2-CB 4.35Å; I450-F695 HydrophobicContact CG2-CD1 3.61Å; I450-F695 HydrophobicContact CG2-CE1 4.29Å; I450-F695 HydrophobicContact CG2-CG 4.28Å; Y454-F695 AromaticContact CD2-CE1 3.82Å; Y454-F695 HydrophobicContact CD2-CE1 3.82Å; Y454-F695 AromaticContact CD2-CZ 3.76Å; Y454-F695 HydrophobicContact CD2-CZ 3.76Å; Y454-F695 HydrophobicContact CE2-CE1 4.46Å; Y454-F695 AromaticContact CE2-CZ 3.99Å; Y454-F695 HydrophobicContact CE2-CZ 3.99Å; Y454-F695 HydrophobicContact CG-CE1 4.13Å; Y454-F695 HydrophobicContact CG-CZ 4.14Å; E693-F695 PolarHBondContact O-N 3.43Å; F695-P697 HydrophobicContact CD1-CG 4.27Å; F695-P697 HydrophobicContact CE1-CB 3.86Å; F695-P697 HydrophobicContact CE1-CG 3.81Å; F695-P697 HydrophobicContact CE2-CB 4.47Å; F695-P697 HydrophobicContact CZ-CB 3.77Å; F695-P697 HydrophobicContact CZ-CG 4.24Å; F695-P697 VanDerWaalsContact O-CD 3.27Å; F695-P697 WeakPolarHBondContact O-CD 3.48Å; F695-F714 HydrophobicContact CD1-CE1 4.45Å; F695-F714 HydrophobicContact CD1-CZ 4.14Å; F695-F714 AromaticContact CE1-CE1 3.97Å; F695-F714 HydrophobicContact CE1-CE1 3.97Å; F695-F714 AromaticContact CE1-CZ 3.99Å; F695-F714 HydrophobicContact CE1-CZ 3.99Å; F695-Q718 VanDerWaalsContact O-CB 3.28Å; F695-Q718 WeakPolarHBondContact O-CB 3.47Å; F695-Q718 WeakPolarHBondContact O-CG 3.35Å
696	L	90.4	Very high	88.9	Confident	26 Å²	26	57.1 Å²	57.1	14%	0.136	29%	0.292	C	S	.	.			trans	-113.8	83.2	178.8	-81.7	157.5	0	0	0	110.8	I694 Q718 F719 S722 H753 I754 R757	I694-L696 HydrophobicContact CG2-CD1 4.05Å; L696-Q718 HydrophobicContact CD2-CB 4.35Å; L696-F719 HydrophobicContact CD2-CB 4.3Å; L696-S722 VanDerWaalsContact CD1-OG 3.23Å; L696-S722 WeakPolarHBondContact CD1-OG 3.46Å; L696-H753 HydrophobicContact CD1-CB 3.64Å; L696-I754 HydrophobicContact CD1-CG1 4.45Å; L696-R757 HydrophobicContact CD2-CG 4.37Å
697	P	85.3	Confident	88.3	Confident	9 Å²	9	64.4 Å²	64.4	6%	0.058	32%	0.319	C	S	.	.			trans	-66.4	142.1	-174.6	27.3	-36.1	0	0	0	112.6	Y454 F695 F699 F714 R757	Y454-P697 HydrophobicContact CD2-CB 4.26Å; Y454-P697 HydrophobicContact CE2-CB 4.07Å; F695-P697 HydrophobicContact CD1-CG 4.27Å; F695-P697 HydrophobicContact CE1-CB 3.86Å; F695-P697 HydrophobicContact CE1-CG 3.81Å; F695-P697 HydrophobicContact CE2-CB 4.47Å; F695-P697 HydrophobicContact CZ-CB 3.77Å; F695-P697 HydrophobicContact CZ-CG 4.24Å; F695-P697 VanDerWaalsContact O-CD 3.27Å; F695-P697 WeakPolarHBondContact O-CD 3.48Å; P697-F699 HydrophobicContact CB-CD2 4.33Å; P697-F699 HydrophobicContact CB-CE2 3.78Å; P697-F699 HydrophobicContact CB-CZ 3.97Å; P697-F699 HydrophobicContact CG-CD2 4.31Å; P697-F699 HydrophobicContact CG-CE2 3.53Å; P697-F699 HydrophobicContact CG-CZ 4Å; P697-F714 HydrophobicContact CG-CD1 4.14Å; P697-F714 HydrophobicContact CG-CE1 3.74Å; P697-R757 VanDerWaalsContact O-CZ 3.28Å; P697-R757 PolarHBondContact O-NE 3.22Å; P697-R757 PolarHBondContact O-NH2 2.85Å
698	M	83.5	Confident	87.6	Confident	110 Å²	110	66.5 Å²	66.5	54%	0.542	34%	0.339	S	S	.	.			trans	-100.7	90.1	178.7	-67.4	-84.9	-68.6	0	0	109.8	R757 S760	M698-R757 VanDerWaalsContact SD-CD 3.57Å; M698-R757 PolarHBondContact SD-NH1 3.11Å; M698-R757 VanDerWaalsContact SD-NH1 3.35Å; M698-S760 WeakPolarHBondContact CE-OG 3.28Å; M698-S760 VanDerWaalsContact SD-CB 3.54Å; M698-S760 PolarHBondContact SD-OG 3.41Å
699	F	83.6	Confident	87.1	Confident	14 Å²	14	60.6 Å²	60.6	6%	0.061	31%	0.314	C	S	.	.			trans	-81.5	139	176.3	-64.9	-72.4	0	0	0	111.9	Y454 C457 M458 P697 I703 L704 A711 F714 A715	Y454-F699 HydrophobicContact CD2-CE1 4.2Å; Y454-F699 AromaticContact CD2-CZ 3.91Å; Y454-F699 HydrophobicContact CD2-CZ 3.91Å; Y454-F699 AromaticContact CE2-CE1 3.91Å; Y454-F699 HydrophobicContact CE2-CE1 3.91Å; Y454-F699 HydrophobicContact CE2-CZ 4.01Å; C457-F699 HydrophobicContact CB-CE1 4.33Å; C457-F699 HydrophobicContact CB-CZ 4.25Å; M458-F699 HydrophobicContact SD-CD1 4.26Å; M458-F699 HydrophobicContact SD-CE1 3.86Å; P697-F699 HydrophobicContact CB-CD2 4.33Å; P697-F699 HydrophobicContact CB-CE2 3.78Å; P697-F699 HydrophobicContact CB-CZ 3.97Å; P697-F699 HydrophobicContact CG-CD2 4.31Å; P697-F699 HydrophobicContact CG-CE2 3.53Å; P697-F699 HydrophobicContact CG-CZ 4Å; F699-I703 HydrophobicContact CD1-CG2 4.19Å; F699-L704 HydrophobicContact CB-CD1 4.14Å; F699-L704 HydrophobicContact CB-CD2 3.83Å; F699-L704 HydrophobicContact CB-CG 3.7Å; F699-L704 HydrophobicContact CD2-CD2 4.15Å; F699-L704 HydrophobicContact CG-CD2 4.35Å; F699-L704 WeakPolarHBondContact O-CD1 3.16Å; F699-A711 HydrophobicContact CD1-CB 4.24Å; F699-A711 HydrophobicContact CD2-CB 4.19Å; F699-A711 HydrophobicContact CE1-CB 4.29Å; F699-A711 HydrophobicContact CE2-CB 4.23Å; F699-A711 HydrophobicContact CG-CB 4.19Å; F699-A711 HydrophobicContact CZ-CB 4.29Å; F699-F714 AromaticContact CE2-CD1 3.93Å; F699-F714 HydrophobicContact CE2-CD1 3.93Å; F699-F714 HydrophobicContact CE2-CE1 4.5Å; F699-F714 AromaticContact CZ-CD1 3.89Å; F699-F714 HydrophobicContact CZ-CD1 3.89Å; F699-F714 HydrophobicContact CZ-CE1 4.27Å; F699-A715 HydrophobicContact CD2-CB 4.2Å; F699-A715 HydrophobicContact CE2-CB 4.27Å
700	P	83.3	Confident	86.9	Confident	76 Å²	76	61.5 Å²	61.5	49%	0.494	33%	0.325	S	S	.	.			trans	-54.6	151.5	164.8	-24	32.4	0	0	0	112.4	D702 I703 L704	P700-D702 VanDerWaalsContact C-N 3.28Å; P700-D702 PolarHBondContact O-N 3.02Å; P700-I703 HydrophobicContact CB-CG1 4.46Å; P700-I703 HydrophobicContact CG-CD1 4.18Å; P700-I703 PolarHBondContact O-N 3.37Å; P700-I703 VanDerWaalsContact O-N 3.15Å; P700-L704 PolarHBondContact O-N 3.26Å
701	K	81.3	Confident	86.7	Confident	101 Å²	101	61.5 Å²	61.5	44%	0.439	33%	0.325	S	S	.	.	H	α-helix	trans	-53.9	-45.2	179.6	-70.1	-174.6	179	-174.5	0	112.6	I703 L704 D705 P762	K701-I703 PolarHBondContact O-N 2.92Å; K701-I703 VanDerWaalsContact O-N 3.14Å; K701-L704 PolarHBondContact O-N 3.27Å; K701-D705 PolarHBondContact O-N 3.12Å; K701-P762 HydrophobicContact CD-CB 4.47Å; K701-P762 HydrophobicContact CD-CG 4.27Å; K701-P762 HydrophobicContact CG-CG 4.08Å
702	D	82.4	Confident	86.5	Confident	131 Å²	131	59.6 Å²	59.6	70%	0.701	31%	0.312	S	S	*	.	H	α-helix	trans	-59.1	-31.5	-176.1	-50.7	-28.5	0	0	0	112.1	P700 V706	P700-D702 VanDerWaalsContact C-N 3.28Å; P700-D702 PolarHBondContact O-N 3.02Å; D702-V706 VanDerWaalsContact O-CG2 3.31Å; D702-V706 WeakPolarHBondContact O-CG2 3.36Å
703	I	84.6	Confident	86.4	Confident	29 Å²	29	58.8 Å²	58.8	15%	0.149	31%	0.308	C	S	.	.	H	α-helix	trans	-79.8	-35.2	177.6	-58.7	-174.4	0	0	0	111.5	A461 F699 P700 K701 T709 A711	A461-I703 HydrophobicContact CB-CB 4.46Å; A461-I703 HydrophobicContact CB-CD1 3.7Å; A461-I703 HydrophobicContact CB-CG1 3.92Å; A461-I703 HydrophobicContact CB-CG2 3.81Å; F699-I703 HydrophobicContact CD1-CG2 4.19Å; P700-I703 HydrophobicContact CB-CG1 4.46Å; P700-I703 HydrophobicContact CG-CD1 4.18Å; P700-I703 PolarHBondContact O-N 3.37Å; P700-I703 VanDerWaalsContact O-N 3.15Å; K701-I703 PolarHBondContact O-N 2.92Å; K701-I703 VanDerWaalsContact O-N 3.14Å; I703-T709 HydrophobicContact CG2-CG2 4.36Å; I703-T709 PolarHBondContact O-OG1 3.49Å; I703-A711 HydrophobicContact CG2-CB 3.65Å
704	L	83.8	Confident	86.5	Confident	32 Å²	32	57.9 Å²	57.9	17%	0.168	30%	0.304	C	S	.	.	H	α-helix	trans	-73.2	-36.6	-178.7	-72.9	170.7	0	0	0	112.7	F699 P700 K701 V706	F699-L704 HydrophobicContact CB-CD1 4.14Å; F699-L704 HydrophobicContact CB-CD2 3.83Å; F699-L704 HydrophobicContact CB-CG 3.7Å; F699-L704 HydrophobicContact CD2-CD2 4.15Å; F699-L704 HydrophobicContact CG-CD2 4.35Å; F699-L704 WeakPolarHBondContact O-CD1 3.16Å; P700-L704 PolarHBondContact O-N 3.26Å; K701-L704 PolarHBondContact O-N 3.27Å; L704-V706 VanDerWaalsContact C-N 3.3Å; L704-V706 PolarHBondContact O-N 2.82Å
705	D	82.1	Confident	86.4	Confident	123 Å²	123	57.6 Å²	57.6	66%	0.658	30%	0.304	S	S	*	.	H	α-helix	trans	-70	-31	-179	-71.6	-22.5	0	0	0	111.6	K701 R707	K701-D705 PolarHBondContact O-N 3.12Å; D705-R707 PolarHBondContact O-N 3.4Å
706	V	84.5	Confident	86.3	Confident	68 Å²	68	55.7 Å²	55.7	41%	0.412	30%	0.296	S	S	.	.			trans	-79.5	91.7	177.5	-177.3	0	0	0	0	110.4	D702 L704 S708 T709	D702-V706 VanDerWaalsContact O-CG2 3.31Å; D702-V706 WeakPolarHBondContact O-CG2 3.36Å; L704-V706 VanDerWaalsContact C-N 3.3Å; L704-V706 PolarHBondContact O-N 2.82Å; V706-S708 WeakPolarHBondContact CG1-OG 3.3Å; V706-S708 PolarHBondContact O-N 2.86Å; V706-T709 HydrophobicContact CB-CG2 3.97Å; V706-T709 HydrophobicContact CG1-CG2 3.86Å; V706-T709 PolarHBondContact O-N 3.41Å; V706-T709 PolarHBondContact O-OG1 2.94Å
707	R	84.8	Confident	86.4	Confident	152 Å²	152	56.3 Å²	56.3	57%	0.574	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-56.4	-25.8	-178.1	-62	-64	178.9	158.4	-9.7	114.7	D705 T709 G710	D705-R707 PolarHBondContact O-N 3.4Å; R707-T709 VanDerWaalsContact C-N 3.25Å; R707-T709 PolarHBondContact O-N 3.44Å; R707-G710 PolarHBondContact O-N 2.99Å
708	S	82.4	Confident	86.8	Confident	89 Å²	89	56.3 Å²	56.3	62%	0.622	30%	0.296	S	S	*	.	G	3₁₀ helix	trans	-70.6	-16.5	178.9	60.2	0	0	0	0	114	K465 V706 G710	K465-S708 PolarHBondContact NZ-O 2.77Å; V706-S708 WeakPolarHBondContact CG1-OG 3.3Å; V706-S708 PolarHBondContact O-N 2.86Å; S708-G710 VanDerWaalsContact C-N 3.27Å
709	T	86.5	Confident	87.3	Confident	9 Å²	9	51.4 Å²	51.4	6%	0.055	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-69.9	-27.6	174.1	64.8	0	0	0	0	111.9	A461 I703 V706 R707 A711	A461-T709 HydrophobicContact CB-CG2 4.3Å; I703-T709 HydrophobicContact CG2-CG2 4.36Å; I703-T709 PolarHBondContact O-OG1 3.49Å; V706-T709 HydrophobicContact CB-CG2 3.97Å; V706-T709 HydrophobicContact CG1-CG2 3.86Å; V706-T709 PolarHBondContact O-N 3.41Å; V706-T709 PolarHBondContact O-OG1 2.94Å; R707-T709 VanDerWaalsContact C-N 3.25Å; R707-T709 PolarHBondContact O-N 3.44Å; T709-A711 PolarHBondContact O-N 3.06Å; T709-A711 WeakPolarHBondContact OG1-CB 3.35Å; T709-A711 PolarHBondContact OG1-N 2.68Å
710	G	89.3	Confident	87.8	Confident	24 Å²	24	52.4 Å²	52.4	25%	0.247	28%	0.275	C	S	.	.			trans	76.5	-4.9	-171.3	0	0	0	0	0	114.2	R707 S708 F712 N713 F714	R707-G710 PolarHBondContact O-N 2.99Å; S708-G710 VanDerWaalsContact C-N 3.27Å; G710-F712 VanDerWaalsContact C-N 3.32Å; G710-F712 PolarHBondContact O-N 3.16Å; G710-N713 PolarHBondContact O-N 3.35Å; G710-N713 VanDerWaalsContact O-N 3.16Å; G710-F714 PolarHBondContact O-N 3.18Å
711	A	90.9	Very high	88.3	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60	-39.7	-176.1	0	0	0	0	0	112.5	C457 F699 I703 T709 F714 A715	C457-A711 HydrophobicContact CB-CB 4.15Å; F699-A711 HydrophobicContact CD1-CB 4.24Å; F699-A711 HydrophobicContact CD2-CB 4.19Å; F699-A711 HydrophobicContact CE1-CB 4.29Å; F699-A711 HydrophobicContact CE2-CB 4.23Å; F699-A711 HydrophobicContact CG-CB 4.19Å; F699-A711 HydrophobicContact CZ-CB 4.29Å; I703-A711 HydrophobicContact CG2-CB 3.65Å; T709-A711 PolarHBondContact O-N 3.06Å; T709-A711 WeakPolarHBondContact OG1-CB 3.35Å; T709-A711 PolarHBondContact OG1-N 2.68Å; A711-F714 PolarHBondContact O-N 3.39Å; A711-A715 VanDerWaalsContact O-CB 3.32Å; A711-A715 WeakPolarHBondContact O-CB 3.17Å; A711-A715 PolarHBondContact O-N 3.47Å
712	F	88.8	Confident	89	Confident	53 Å²	53	44.9 Å²	44.9	23%	0.232	23%	0.234	C	C	.	.	H	α-helix	trans	-58.6	-53	174.3	-179.5	-84.7	0	0	0	111.6	G710 F714 A715 E716	G710-F712 VanDerWaalsContact C-N 3.32Å; G710-F712 PolarHBondContact O-N 3.16Å; F712-F714 VanDerWaalsContact C-N 3.27Å; F712-F714 PolarHBondContact O-N 3.41Å; F712-A715 PolarHBondContact O-N 3.39Å; F712-E716 HydrophobicContact CD1-CG 3.84Å; F712-E716 HydrophobicContact CE1-CG 3.42Å; F712-E716 VanDerWaalsContact CE1-CG 3.42Å; F712-E716 HydrophobicContact CZ-CG 3.83Å; F712-E716 WeakPolarHBondContact O-CG 3.3Å; F712-E716 PolarHBondContact O-N 3.25Å
713	N	90.2	Very high	89.5	Confident	77 Å²	77	38.7 Å²	38.7	41%	0.412	20%	0.201	S	C	.	.	H	α-helix	trans	-64	-36.2	-177.7	-66.6	-24.8	0	0	0	111.5	G710 R717	G710-N713 PolarHBondContact O-N 3.35Å; G710-N713 VanDerWaalsContact O-N 3.16Å; N713-R717 WeakPolarHBondContact O-CG 3.46Å; N713-R717 PolarHBondContact O-N 3.01Å
714	F	92.6	Very high	90	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-65.8	-47.3	174.4	177.5	-117.4	0	0	0	112	I450 Q453 Y454 F695 P697 F699 G710 A711 F712 E716 R717 Q718	I450-F714 HydrophobicContact CG2-CE2 4.47Å; I450-F714 HydrophobicContact CG2-CZ 4.09Å; Q453-F714 HydrophobicContact CB-CD2 3.52Å; Q453-F714 HydrophobicContact CB-CE2 3.42Å; Q453-F714 VanDerWaalsContact CB-CE2 3.42Å; Q453-F714 HydrophobicContact CB-CG 4.3Å; Q453-F714 HydrophobicContact CB-CZ 4.16Å; Q453-F714 HydrophobicContact CG-CD2 4.22Å; Q453-F714 HydrophobicContact CG-CE2 4.32Å; Y454-F714 HydrophobicContact CD2-CE1 4.06Å; F695-F714 HydrophobicContact CD1-CE1 4.45Å; F695-F714 HydrophobicContact CD1-CZ 4.14Å; F695-F714 AromaticContact CE1-CE1 3.97Å; F695-F714 HydrophobicContact CE1-CE1 3.97Å; F695-F714 AromaticContact CE1-CZ 3.99Å; F695-F714 HydrophobicContact CE1-CZ 3.99Å; P697-F714 HydrophobicContact CG-CD1 4.14Å; P697-F714 HydrophobicContact CG-CE1 3.74Å; F699-F714 AromaticContact CE2-CD1 3.93Å; F699-F714 HydrophobicContact CE2-CD1 3.93Å; F699-F714 HydrophobicContact CE2-CE1 4.5Å; F699-F714 AromaticContact CZ-CD1 3.89Å; F699-F714 HydrophobicContact CZ-CD1 3.89Å; F699-F714 HydrophobicContact CZ-CE1 4.27Å; G710-F714 PolarHBondContact O-N 3.18Å; A711-F714 PolarHBondContact O-N 3.39Å; F712-F714 VanDerWaalsContact C-N 3.27Å; F712-F714 PolarHBondContact O-N 3.41Å; F714-E716 VanDerWaalsContact C-N 3.34Å; F714-E716 PolarHBondContact O-N 3.3Å; F714-R717 PolarHBondContact O-N 3.48Å; F714-R717 VanDerWaalsContact O-N 3.16Å; F714-Q718 HydrophobicContact CD2-CG 4.31Å; F714-Q718 HydrophobicContact CE1-CG 4.31Å; F714-Q718 HydrophobicContact CE2-CG 3.97Å; F714-Q718 HydrophobicContact CZ-CG 3.96Å; F714-Q718 WeakPolarHBondContact O-CG 3.38Å; F714-Q718 PolarHBondContact O-N 2.91Å
715	A	91	Very high	90.6	Very high	10 Å²	10	36.2 Å²	36.2	8%	0.083	19%	0.188	C	C	.	.	H	α-helix	trans	-61.6	-39.8	176.7	0	0	0	0	0	112.4	F699 A711 F712 Q718 F719	F699-A715 HydrophobicContact CD2-CB 4.2Å; F699-A715 HydrophobicContact CE2-CB 4.27Å; A711-A715 VanDerWaalsContact O-CB 3.32Å; A711-A715 WeakPolarHBondContact O-CB 3.17Å; A711-A715 PolarHBondContact O-N 3.47Å; F712-A715 PolarHBondContact O-N 3.39Å; A715-Q718 PolarHBondContact O-N 2.78Å; A715-F719 WeakPolarHBondContact O-CB 3.44Å; A715-F719 PolarHBondContact O-N 3.26Å
716	E	90.9	Very high	91.2	Very high	37 Å²	37	30.5 Å²	30.5	17%	0.173	16%	0.157	C	C	.	.	H	α-helix	trans	-59.1	-47.5	172	-72.9	-54.2	121.2	0	0	111.4	F712 F714 Q718 F719 W720 K771	F712-E716 HydrophobicContact CD1-CG 3.84Å; F712-E716 HydrophobicContact CE1-CG 3.42Å; F712-E716 VanDerWaalsContact CE1-CG 3.42Å; F712-E716 HydrophobicContact CZ-CG 3.83Å; F712-E716 WeakPolarHBondContact O-CG 3.3Å; F712-E716 PolarHBondContact O-N 3.25Å; F714-E716 VanDerWaalsContact C-N 3.34Å; F714-E716 PolarHBondContact O-N 3.3Å; E716-Q718 PolarHBondContact O-N 2.89Å; E716-F719 WeakPolarHBondContact O-CB 3.36Å; E716-F719 PolarHBondContact O-N 3.32Å; E716-W720 PolarHBondContact O-N 2.98Å; E716-K771 VanDerWaalsContact CD-NZ 3.27Å; E716-K771 IonicContact OE1-NZ 3.79Å; E716-K771 PolarHBondContact OE1-NZ 3.44Å; E716-K771 WeakPolarHBondContact OE2-CE 3.18Å; E716-K771 IonicContact OE2-NZ 2.88Å; E716-K771 PolarHBondContact OE2-NZ 2.94Å
717	R	92.8	Very high	91.7	Very high	38 Å²	38	31.9 Å²	31.9	14%	0.143	16%	0.158	C	C	.	.	H	α-helix	trans	-60.9	-43.3	179.1	-78	-170.2	-68.6	-100.1	4.3	112.5	E502 N713 F714 W720 F721	E502-R717 HydrophobicContact CB-CG 3.96Å; E502-R717 HydrophobicContact CG-CG 3.77Å; E502-R717 WeakPolarHBondContact O-CA 3.36Å; E502-R717 IonicContact OE1-NH1 2.86Å; E502-R717 WeakPolarHBondContact OE2-CD 3.34Å; E502-R717 IonicContact OE2-CZ 3.31Å; E502-R717 IonicContact OE2-NH1 3.47Å; E502-R717 PolarHBondContact OE2-NH1 2.82Å; N713-R717 WeakPolarHBondContact O-CG 3.46Å; N713-R717 PolarHBondContact O-N 3.01Å; F714-R717 PolarHBondContact O-N 3.48Å; F714-R717 VanDerWaalsContact O-N 3.16Å; R717-W720 PolarHBondContact O-N 3.45Å; R717-F721 VanDerWaalsContact O-CB 3.31Å; R717-F721 WeakPolarHBondContact O-CB 3.34Å; R717-F721 PolarHBondContact O-N 2.97Å
718	Q	93.8	Very high	92.3	Very high	10 Å²	10	24.8 Å²	24.8	5%	0.047	13%	0.131	C	C	.	.	H	α-helix	trans	-66.7	-39.1	177.4	-64.2	-45.8	-38.9	0	0	111.9	F695 L696 F714 A715 E716 F721 S722	F695-Q718 VanDerWaalsContact O-CB 3.28Å; F695-Q718 WeakPolarHBondContact O-CB 3.47Å; F695-Q718 WeakPolarHBondContact O-CG 3.35Å; L696-Q718 HydrophobicContact CD2-CB 4.35Å; F714-Q718 HydrophobicContact CD2-CG 4.31Å; F714-Q718 HydrophobicContact CE1-CG 4.31Å; F714-Q718 HydrophobicContact CE2-CG 3.97Å; F714-Q718 HydrophobicContact CZ-CG 3.96Å; F714-Q718 WeakPolarHBondContact O-CG 3.38Å; F714-Q718 PolarHBondContact O-N 2.91Å; A715-Q718 PolarHBondContact O-N 2.78Å; E716-Q718 PolarHBondContact O-N 2.89Å; Q718-F721 WeakPolarHBondContact O-CB 3.46Å; Q718-F721 PolarHBondContact O-N 2.93Å; Q718-S722 PolarHBondContact O-N 3.42Å; Q718-S722 PolarHBondContact O-OG 2.95Å
719	F	93.7	Very high	92.9	Very high	6 Å²	6	20.5 Å²	20.5	3%	0.026	10%	0.102	C	C	.	.	H	α-helix	trans	-57.8	-52.4	173.3	178.8	-91.1	0	0	0	112	L696 A715 E716 F721 S722 V723 I754 L758 K771 I775	L696-F719 HydrophobicContact CD2-CB 4.3Å; A715-F719 WeakPolarHBondContact O-CB 3.44Å; A715-F719 PolarHBondContact O-N 3.26Å; E716-F719 WeakPolarHBondContact O-CB 3.36Å; E716-F719 PolarHBondContact O-N 3.32Å; F719-F721 VanDerWaalsContact C-N 3.29Å; F719-F721 PolarHBondContact O-N 3.18Å; F719-S722 WeakPolarHBondContact O-CB 3.45Å; F719-S722 PolarHBondContact O-N 3.05Å; F719-S722 VanDerWaalsContact O-N 3.16Å; F719-V723 HydrophobicContact CD1-CG2 4.21Å; F719-V723 HydrophobicContact CE1-CG2 3.63Å; F719-V723 HydrophobicContact CZ-CG2 3.8Å; F719-V723 WeakPolarHBondContact O-CG2 3.18Å; F719-V723 PolarHBondContact O-N 2.87Å; F719-I754 HydrophobicContact CE2-CG2 3.93Å; F719-I754 HydrophobicContact CZ-CG2 4.5Å; F719-L758 HydrophobicContact CD2-CD2 4.44Å; F719-L758 HydrophobicContact CE2-CD1 4.11Å; F719-L758 HydrophobicContact CE2-CD2 3.71Å; F719-L758 HydrophobicContact CE2-CG 3.96Å; F719-L758 HydrophobicContact CZ-CD1 4.41Å; F719-L758 HydrophobicContact CZ-CD2 4.22Å; F719-K771 HydrophobicContact CD1-CD 3.81Å; F719-K771 HydrophobicContact CD1-CG 4.01Å; F719-K771 HydrophobicContact CD2-CD 4.46Å; F719-K771 HydrophobicContact CE1-CB 3.64Å; F719-K771 HydrophobicContact CE1-CD 3.59Å; F719-K771 HydrophobicContact CE1-CG 3.4Å; F719-K771 HydrophobicContact CE2-CB 4.46Å; F719-K771 HydrophobicContact CE2-CD 4.25Å; F719-K771 HydrophobicContact CG-CD 4.27Å; F719-K771 HydrophobicContact CZ-CB 3.53Å; F719-K771 HydrophobicContact CZ-CD 3.83Å; F719-K771 HydrophobicContact CZ-CG 3.8Å; F719-I775 HydrophobicContact CE2-CD1 4.37Å; F719-I775 HydrophobicContact CZ-CD1 3.88Å
720	W	94.4	Very high	93.4	Very high	35 Å²	35	21.3 Å²	21.3	13%	0.133	11%	0.105	C	C	.	.	H	α-helix	trans	-69.4	-27.4	179.3	-69.1	114.6	0	0	0	112.6	C501 E502 M504 E716 R717 V723 K724 K771 A774	C501-W720 HydrophobicContact CB-CB 4.33Å; C501-W720 HydrophobicContact CB-CD2 3.49Å; C501-W720 VanDerWaalsContact CB-CD2 3.49Å; C501-W720 HydrophobicContact CB-CE3 4.05Å; C501-W720 HydrophobicContact CB-CG 3.62Å; C501-W720 HydrophobicContact CB-CZ2 4.17Å; C501-W720 VanDerWaalsContact SG-CE2 3.59Å; C501-W720 VanDerWaalsContact SG-CZ2 3.52Å; E502-W720 WeakPolarHBondContact O-CB 3.27Å; M504-W720 HydrophobicContact CE-CB 4.23Å; M504-W720 HydrophobicContact CE-CD2 4.42Å; M504-W720 HydrophobicContact CE-CE3 3.53Å; M504-W720 HydrophobicContact CE-CZ3 4.28Å; M504-W720 WeakPolarHBondContact CE-O 3.28Å; M504-W720 HydrophobicContact CG-CB 4.4Å; E716-W720 PolarHBondContact O-N 2.98Å; R717-W720 PolarHBondContact O-N 3.45Å; W720-V723 HydrophobicContact CE3-CB 4.17Å; W720-V723 HydrophobicContact CE3-CG1 4.28Å; W720-V723 HydrophobicContact CE3-CG2 4.29Å; W720-V723 HydrophobicContact CZ3-CG1 4.37Å; W720-V723 PolarHBondContact O-N 3.08Å; W720-K724 WeakPolarHBondContact O-CB 3.33Å; W720-K724 PolarHBondContact O-N 2.97Å; W720-K771 HydrophobicContact CZ2-CG 4.15Å; W720-A774 HydrophobicContact CH2-CB 4.07Å; W720-A774 HydrophobicContact CZ3-CB 4.04Å
721	F	94.5	Very high	93.7	Very high	19 Å²	19	22.6 Å²	22.6	8%	0.083	11%	0.106	C	C	.	.	H	α-helix	trans	-62.7	-44.5	168.6	175.3	-102.8	0	0	0	111.7	G503 A646 I694 R717 Q718 F719 V723 K724 C725	G503-F721 WeakPolarHBondContact O-CA 3.23Å; A646-F721 HydrophobicContact CB-CE2 4.19Å; A646-F721 HydrophobicContact CB-CZ 3.95Å; I694-F721 HydrophobicContact CD1-CD1 4.38Å; I694-F721 HydrophobicContact CD1-CE1 4Å; R717-F721 VanDerWaalsContact O-CB 3.31Å; R717-F721 WeakPolarHBondContact O-CB 3.34Å; R717-F721 PolarHBondContact O-N 2.97Å; Q718-F721 WeakPolarHBondContact O-CB 3.46Å; Q718-F721 PolarHBondContact O-N 2.93Å; F719-F721 VanDerWaalsContact C-N 3.29Å; F719-F721 PolarHBondContact O-N 3.18Å; F721-V723 PolarHBondContact O-N 3.08Å; F721-K724 WeakPolarHBondContact O-CA 3.23Å; F721-K724 VanDerWaalsContact O-CB 3.26Å; F721-K724 WeakPolarHBondContact O-CB 3.47Å; F721-K724 PolarHBondContact O-N 3.33Å; F721-K724 VanDerWaalsContact O-N 3.08Å; F721-C725 PolarHBondContact O-N 3.34Å; F721-C725 PolarHBondContact O-SG 2.95Å
722	S	94.8	Very high	93.9	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-63	-39.7	174.3	-55.8	0	0	0	0	112.5	L696 Q718 F719 K724 C725 L726	L696-S722 VanDerWaalsContact CD1-OG 3.23Å; L696-S722 WeakPolarHBondContact CD1-OG 3.46Å; Q718-S722 PolarHBondContact O-N 3.42Å; Q718-S722 PolarHBondContact O-OG 2.95Å; F719-S722 WeakPolarHBondContact O-CB 3.45Å; F719-S722 PolarHBondContact O-N 3.05Å; F719-S722 VanDerWaalsContact O-N 3.16Å; S722-K724 VanDerWaalsContact C-N 3.27Å; S722-K724 PolarHBondContact O-N 3.44Å; S722-C725 PolarHBondContact O-N 2.88Å; S722-L726 PolarHBondContact O-N 3.16Å
723	V	94.1	Very high	94.1	Very high	2 Å²	2	22.8 Å²	22.8	1%	0.012	11%	0.105	C	C	.	.	H	α-helix	trans	-66.3	-30.9	173.6	-179.4	0	0	0	0	111.3	M504 F719 W720 F721 L726 K727 I775 L778	M504-V723 HydrophobicContact CE-CB 3.43Å; M504-V723 VanDerWaalsContact CE-CB 3.43Å; M504-V723 HydrophobicContact CE-CG1 3.4Å; F719-V723 HydrophobicContact CD1-CG2 4.21Å; F719-V723 HydrophobicContact CE1-CG2 3.63Å; F719-V723 HydrophobicContact CZ-CG2 3.8Å; F719-V723 WeakPolarHBondContact O-CG2 3.18Å; F719-V723 PolarHBondContact O-N 2.87Å; W720-V723 HydrophobicContact CE3-CB 4.17Å; W720-V723 HydrophobicContact CE3-CG1 4.28Å; W720-V723 HydrophobicContact CE3-CG2 4.29Å; W720-V723 HydrophobicContact CZ3-CG1 4.37Å; W720-V723 PolarHBondContact O-N 3.08Å; F721-V723 PolarHBondContact O-N 3.08Å; V723-L726 WeakPolarHBondContact O-CB 3.16Å; V723-L726 PolarHBondContact O-N 2.94Å; V723-K727 PolarHBondContact O-N 3.25Å; V723-I775 HydrophobicContact CG2-CG1 4.2Å; V723-L778 HydrophobicContact CG1-CD1 3.54Å
724	K	94.7	Very high	94	Very high	9 Å²	9	22 Å²	22	4%	0.039	12%	0.116	C	C	.	.	H	α-helix	trans	-67.2	-44.5	172.5	-171.3	-164.3	72.1	163.4	0	110.9	M504 S506 A646 S648 W720 F721 S722 L726 K727 N728	M504-K724 HydrophobicContact CE-CB 4.29Å; M504-K724 WeakPolarHBondContact O-CD 3.45Å; M504-K724 HydrophobicContact SD-CB 3.84Å; M504-K724 HydrophobicContact SD-CG 4.31Å; S506-K724 PolarHBondContact OG-NZ 3.16Å; S506-K724 VanDerWaalsContact OG-NZ 3.09Å; A646-K724 WeakPolarHBondContact O-CE 3.49Å; A646-K724 PolarHBondContact O-NZ 3.44Å; S648-K724 WeakPolarHBondContact OG-CG 3.47Å; W720-K724 WeakPolarHBondContact O-CB 3.33Å; W720-K724 PolarHBondContact O-N 2.97Å; F721-K724 WeakPolarHBondContact O-CA 3.23Å; F721-K724 VanDerWaalsContact O-CB 3.26Å; F721-K724 WeakPolarHBondContact O-CB 3.47Å; F721-K724 PolarHBondContact O-N 3.33Å; F721-K724 VanDerWaalsContact O-N 3.08Å; S722-K724 VanDerWaalsContact C-N 3.27Å; S722-K724 PolarHBondContact O-N 3.44Å; K724-L726 PolarHBondContact O-N 3.44Å; K724-K727 WeakPolarHBondContact O-CB 3.08Å; K724-K727 PolarHBondContact O-N 3.48Å; K724-K727 VanDerWaalsContact O-N 3.12Å; K724-N728 PolarHBondContact O-N 3.15Å; K724-N728 PolarHBondContact O-OD1 3.3Å
725	C	95.6	Very high	94.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.9	-34.4	173.9	-65.3	0	0	0	0	111.7	M689 L690 I694 F721 S722 N728 A729 L749	M689-C725 HydrophobicContact CE-CB 4.27Å; L690-C725 HydrophobicContact CD2-CB 4.36Å; I694-C725 HydrophobicContact CD1-CB 3.99Å; F721-C725 PolarHBondContact O-N 3.34Å; F721-C725 PolarHBondContact O-SG 2.95Å; S722-C725 PolarHBondContact O-N 2.88Å; C725-N728 PolarHBondContact O-N 3.23Å; C725-A729 WeakPolarHBondContact O-CB 3.29Å; C725-A729 PolarHBondContact O-N 3.17Å; C725-L749 HydrophobicContact CB-CD2 4.26Å
726	L	95.2	Very high	94.2	Very high	2 Å²	2	23 Å²	23	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-61.6	-45.7	171.5	176.6	64	0	0	0	111.6	S722 V723 K724 N728 A729 L730 V745 L749 I775 L778	S722-L726 PolarHBondContact O-N 3.16Å; V723-L726 WeakPolarHBondContact O-CB 3.16Å; V723-L726 PolarHBondContact O-N 2.94Å; K724-L726 PolarHBondContact O-N 3.44Å; L726-N728 VanDerWaalsContact C-N 3.33Å; L726-N728 PolarHBondContact O-N 2.95Å; L726-A729 PolarHBondContact O-N 3.46Å; L726-L730 HydrophobicContact CG-CD1 4.45Å; L726-L730 WeakPolarHBondContact O-CG 3.33Å; L726-L730 PolarHBondContact O-N 3.24Å; L726-V745 HydrophobicContact CD1-CB 4.17Å; L726-V745 HydrophobicContact CD1-CG1 3.48Å; L726-V745 VanDerWaalsContact CD1-CG1 3.48Å; L726-V745 HydrophobicContact CD1-CG2 4.02Å; L726-L749 VanDerWaalsContact CA-CD2 3.49Å; L726-L749 HydrophobicContact CB-CD2 3.66Å; L726-L749 HydrophobicContact CD1-CD2 4.29Å; L726-I775 HydrophobicContact CD2-CG2 4.28Å; L726-L778 HydrophobicContact CD2-CD1 4.08Å; L726-L778 HydrophobicContact CG-CD1 4.49Å
727	K	95.1	Very high	94.3	Very high	98 Å²	98	24.5 Å²	24.5	43%	0.426	14%	0.135	S	C	.	.	H	α-helix	trans	-57.9	-46	172.5	-74.3	-179.1	168.8	-174.8	0	111.6	M504 V723 K724 A729 L730 L731 L778	M504-K727 HydrophobicContact SD-CD 4.3Å; V723-K727 PolarHBondContact O-N 3.25Å; K724-K727 WeakPolarHBondContact O-CB 3.08Å; K724-K727 PolarHBondContact O-N 3.48Å; K724-K727 VanDerWaalsContact O-N 3.12Å; K727-A729 VanDerWaalsContact C-N 3.32Å; K727-A729 PolarHBondContact O-N 3.4Å; K727-L730 PolarHBondContact O-N 2.96Å; K727-L731 PolarHBondContact O-N 3.46Å; K727-L731 VanDerWaalsContact O-N 3.13Å; K727-L778 HydrophobicContact CD-CD2 4.2Å; K727-L778 HydrophobicContact CG-CD1 3.78Å; K727-L778 HydrophobicContact CG-CD2 3.74Å; K727-L778 HydrophobicContact CG-CG 4.39Å
728	N	96.1	Very high	94.3	Very high	2 Å²	2	25.7 Å²	25.7	1%	0.011	14%	0.144	C	C	.	.	H	α-helix	trans	-61.6	-39.9	177.9	-68.3	4.8	0	0	0	111.7	P645 A646 S648 T651 F686 K724 C725 L726 L730 L731	P645-N728 PolarHBondContact O-ND2 3.17Å; A646-N728 PolarHBondContact O-ND2 2.96Å; S648-N728 WeakPolarHBondContact CA-OD1 3.46Å; S648-N728 WeakPolarHBondContact CB-OD1 3.5Å; S648-N728 PolarHBondContact N-ND2 2.89Å; S648-N728 PolarHBondContact OG-ND2 3.01Å; S648-N728 PolarHBondContact OG-OD1 2.85Å; T651-N728 HydrophobicContact CG2-CB 4.13Å; F686-N728 HydrophobicContact CE2-CB 4.1Å; F686-N728 HydrophobicContact CZ-CB 4.1Å; K724-N728 PolarHBondContact O-N 3.15Å; K724-N728 PolarHBondContact O-OD1 3.3Å; C725-N728 PolarHBondContact O-N 3.23Å; L726-N728 VanDerWaalsContact C-N 3.33Å; L726-N728 PolarHBondContact O-N 2.95Å; N728-L730 VanDerWaalsContact C-N 3.32Å; N728-L730 PolarHBondContact O-N 2.82Å; N728-L731 WeakPolarHBondContact O-CB 3.36Å; N728-L731 PolarHBondContact O-N 3.48Å; N728-L731 VanDerWaalsContact O-N 3.17Å
729	A	96.3	Very high	94.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-63.2	-39.7	176.4	0	0	0	0	0	111.4	F686 C725 L726 K727 L731 L732 V741 V745	F686-A729 HydrophobicContact CE1-CB 3.6Å; F686-A729 VanDerWaalsContact CZ-CA 3.47Å; F686-A729 HydrophobicContact CZ-CB 3.6Å; C725-A729 WeakPolarHBondContact O-CB 3.29Å; C725-A729 PolarHBondContact O-N 3.17Å; L726-A729 PolarHBondContact O-N 3.46Å; K727-A729 VanDerWaalsContact C-N 3.32Å; K727-A729 PolarHBondContact O-N 3.4Å; A729-L731 VanDerWaalsContact C-N 3.26Å; A729-L731 PolarHBondContact O-N 2.87Å; A729-L732 VanDerWaalsContact O-CB 3.27Å; A729-L732 WeakPolarHBondContact O-CB 3.41Å; A729-L732 PolarHBondContact O-N 3.19Å; A729-V741 WeakPolarHBondContact O-CG1 3.47Å; A729-V745 HydrophobicContact CB-CG2 3.84Å
730	L	95.6	Very high	94.2	Very high	26 Å²	26	32.3 Å²	32.3	14%	0.136	18%	0.178	C	C	.	.	H	α-helix	trans	-67.7	-24.3	176.5	-68.2	168.2	0	0	0	113	L726 K727 N728 L732 R733 V745 L778 P780 W783	L726-L730 HydrophobicContact CG-CD1 4.45Å; L726-L730 WeakPolarHBondContact O-CG 3.33Å; L726-L730 PolarHBondContact O-N 3.24Å; K727-L730 PolarHBondContact O-N 2.96Å; N728-L730 VanDerWaalsContact C-N 3.32Å; N728-L730 PolarHBondContact O-N 2.82Å; L730-L732 PolarHBondContact O-N 3.44Å; L730-R733 WeakPolarHBondContact O-CB 3.34Å; L730-R733 VanDerWaalsContact O-CG 3.25Å; L730-R733 WeakPolarHBondContact O-CG 3.45Å; L730-R733 PolarHBondContact O-N 3.1Å; L730-V745 HydrophobicContact CD2-CG2 4.06Å; L730-V745 HydrophobicContact CG-CG2 4.35Å; L730-L778 HydrophobicContact CD1-CB 3.99Å; L730-L778 WeakPolarHBondContact CD1-O 3.33Å; L730-P780 HydrophobicContact CD2-CG 4.02Å; L730-W783 HydrophobicContact CD2-CH2 3.88Å; L730-W783 HydrophobicContact CD2-CZ3 4.09Å
731	L	95.7	Very high	94.3	Very high	51 Å²	51	30.6 Å²	30.6	27%	0.267	17%	0.172	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.3	-14	170.5	-64.3	175.4	0	0	0	112.8	T651 E652 C655 R659 K727 N728 A729 R733	T651-L731 HydrophobicContact CG2-CB 4.29Å; T651-L731 HydrophobicContact CG2-CD1 4.22Å; E652-L731 HydrophobicContact CB-CD1 4.14Å; C655-L731 WeakPolarHBondContact CB-O 3.44Å; C655-L731 PolarHBondContact SG-O 3.48Å; R659-L731 PolarHBondContact NH2-O 2.81Å; K727-L731 PolarHBondContact O-N 3.46Å; K727-L731 VanDerWaalsContact O-N 3.13Å; N728-L731 WeakPolarHBondContact O-CB 3.36Å; N728-L731 PolarHBondContact O-N 3.48Å; N728-L731 VanDerWaalsContact O-N 3.17Å; A729-L731 VanDerWaalsContact C-N 3.26Å; A729-L731 PolarHBondContact O-N 2.87Å; L731-R733 PolarHBondContact O-N 3.12Å
732	L	95.6	Very high	94.2	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-8.4	174.5	-60.8	170	0	0	0	112.6	W643 V682 F686 A729 L730 G734 V735 L736 V741 L744	W643-L732 HydrophobicContact CH2-CD2 4.29Å; V682-L732 HydrophobicContact CG1-CD2 3.65Å; F686-L732 HydrophobicContact CB-CD1 4.3Å; F686-L732 HydrophobicContact CD1-CD1 4.45Å; F686-L732 HydrophobicContact CD2-CD1 3.66Å; F686-L732 HydrophobicContact CE2-CD1 4.1Å; F686-L732 HydrophobicContact CG-CD1 3.87Å; A729-L732 VanDerWaalsContact O-CB 3.27Å; A729-L732 WeakPolarHBondContact O-CB 3.41Å; A729-L732 PolarHBondContact O-N 3.19Å; L730-L732 PolarHBondContact O-N 3.44Å; L732-G734 PolarHBondContact O-N 2.91Å; L732-V735 PolarHBondContact O-N 3.05Å; L732-L736 HydrophobicContact CB-CD1 4.14Å; L732-L736 HydrophobicContact CB-CG 4.43Å; L732-L736 HydrophobicContact CD1-CD1 4.05Å; L732-L736 PolarHBondContact O-N 2.8Å; L732-V741 HydrophobicContact CB-CG2 4.17Å; L732-L744 HydrophobicContact CD1-CD1 3.88Å
733	R	93.6	Very high	94.2	Very high	56 Å²	56	34.3 Å²	34.3	21%	0.211	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-62	131.3	171.9	-63.8	-177.6	70.7	-139.6	-0.2	110	R659 L730 L731 V735 D738 V741 P780 E782 W783	R659-R733 PolarHBondContact NE-O 2.99Å; R659-R733 PolarHBondContact NH2-O 3.25Å; L730-R733 WeakPolarHBondContact O-CB 3.34Å; L730-R733 VanDerWaalsContact O-CG 3.25Å; L730-R733 WeakPolarHBondContact O-CG 3.45Å; L730-R733 PolarHBondContact O-N 3.1Å; L731-R733 PolarHBondContact O-N 3.12Å; R733-V735 VanDerWaalsContact C-N 3.3Å; R733-D738 IonicContact NE-OD1 2.79Å; R733-D738 IonicContact NH2-OD2 4Å; R733-V741 HydrophobicContact CG-CB 4.42Å; R733-V741 HydrophobicContact CG-CG1 3.89Å; R733-V741 HydrophobicContact CG-CG2 4.34Å; R733-P780 VanDerWaalsContact NH1-CG 3.28Å; R733-E782 IonicContact CZ-OE2 2.76Å; R733-E782 IonicContact NH1-OE2 3.84Å; R733-E782 IonicContact NH2-OE2 3.09Å; R733-E782 PolarHBondContact NH2-OE2 3.31Å; R733-W783 HydrophobicContact CG-CZ2 4.3Å
734	G	88.5	Confident	94.3	Very high	61 Å²	61	34.2 Å²	34.2	63%	0.629	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.7	-5.4	-173.5	0	0	0	0	0	114.7	L732	L732-G734 PolarHBondContact O-N 2.91Å
735	V	93.2	Very high	94.3	Very high	13 Å²	13	33.9 Å²	33.9	8%	0.079	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-47.8	167.5	176.3	0	0	0	0	109.5	C655 L658 R659 F662 L679 L732 R733	C655-V735 HydrophobicContact CB-CG2 4.36Å; L658-V735 HydrophobicContact CB-CG1 4.21Å; L658-V735 HydrophobicContact CB-CG2 4.02Å; L658-V735 HydrophobicContact CD1-CG1 3.7Å; R659-V735 HydrophobicContact CG-CG2 3.94Å; F662-V735 HydrophobicContact CE2-CG1 4.25Å; L679-V735 HydrophobicContact CD2-CG1 3.92Å; L732-V735 PolarHBondContact O-N 3.05Å; R733-V735 VanDerWaalsContact C-N 3.3Å
736	L	94.6	Very high	94.1	Very high	18 Å²	18	33.9 Å²	33.9	9%	0.094	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-102.3	159.4	174.9	-60.8	178.8	0	0	0	111	L679 V682 Y683 L732 V741 L744	L679-L736 HydrophobicContact CB-CD2 4.13Å; L679-L736 HydrophobicContact CD2-CD2 4.17Å; V682-L736 HydrophobicContact CG1-CD1 4.35Å; Y683-L736 HydrophobicContact CD2-CD1 4.2Å; L732-L736 HydrophobicContact CB-CD1 4.14Å; L732-L736 HydrophobicContact CB-CG 4.43Å; L732-L736 HydrophobicContact CD1-CD1 4.05Å; L732-L736 PolarHBondContact O-N 2.8Å; L736-V741 HydrophobicContact CB-CG2 3.87Å; L736-L744 HydrophobicContact CD1-CD1 4.43Å
737	S	92.8	Very high	93.9	Very high	69 Å²	69	36.6 Å²	36.6	48%	0.483	20%	0.2	S	C	.	.			trans	-63.3	145.5	173	65.4	0	0	0	0	111.3	H739 S740 V741	S737-H739 PolarHBondContact O-N 2.97Å; S737-H739 VanDerWaalsContact O-N 3.16Å; S737-S740 WeakPolarHBondContact O-CB 3.36Å; S737-S740 PolarHBondContact O-N 3.03Å; S737-S740 PolarHBondContact OG-OG 2.88Å; S737-V741 PolarHBondContact O-N 2.63Å
738	D	92	Very high	93.8	Very high	63 Å²	63	32.6 Å²	32.6	34%	0.337	19%	0.185	S	C	.	.	H	α-helix	trans	-56.5	-34.8	-179.3	-97.1	17	0	0	0	112.5	R733 S740 V741 K742 W783	R733-D738 IonicContact NE-OD1 2.79Å; R733-D738 IonicContact NH2-OD2 4Å; D738-S740 PolarHBondContact O-N 2.85Å; D738-V741 PolarHBondContact O-N 2.89Å; D738-K742 VanDerWaalsContact O-CB 3.3Å; D738-K742 WeakPolarHBondContact O-CB 3.37Å; D738-K742 WeakPolarHBondContact O-CG 3.49Å; D738-K742 PolarHBondContact O-N 3.4Å; D738-W783 PolarHBondContact OD2-NE1 3.15Å
739	H	92.1	Very high	93.7	Very high	123 Å²	123	32.5 Å²	32.5	57%	0.569	18%	0.184	S	C	*	.	H	α-helix	trans	-58.8	-46.1	173.1	177.7	-91	0	0	0	112.4	S737 K742 K743	S737-H739 PolarHBondContact O-N 2.97Å; S737-H739 VanDerWaalsContact O-N 3.16Å; H739-K742 PolarHBondContact O-N 3.42Å; H739-K743 PolarHBondContact O-N 3.42Å
740	S	94.3	Very high	93.5	Very high	31 Å²	31	32.6 Å²	32.6	22%	0.217	18%	0.184	C	C	.	.	H	α-helix	trans	-67.6	-41.9	-179.5	-53	0	0	0	0	111.3	S737 D738 K743 L744	S737-S740 WeakPolarHBondContact O-CB 3.36Å; S737-S740 PolarHBondContact O-N 3.03Å; S737-S740 PolarHBondContact OG-OG 2.88Å; D738-S740 PolarHBondContact O-N 2.85Å; S740-K743 PolarHBondContact O-N 2.83Å; S740-L744 PolarHBondContact O-N 2.88Å; S740-L744 VanDerWaalsContact O-N 3.12Å
741	V	95.7	Very high	93.3	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.5	-42	176.4	-173.9	0	0	0	0	110.8	A729 L732 R733 L736 S737 D738 K743 L744 V745 W783	A729-V741 WeakPolarHBondContact O-CG1 3.47Å; L732-V741 HydrophobicContact CB-CG2 4.17Å; R733-V741 HydrophobicContact CG-CB 4.42Å; R733-V741 HydrophobicContact CG-CG1 3.89Å; R733-V741 HydrophobicContact CG-CG2 4.34Å; L736-V741 HydrophobicContact CB-CG2 3.87Å; S737-V741 PolarHBondContact O-N 2.63Å; D738-V741 PolarHBondContact O-N 2.89Å; V741-K743 VanDerWaalsContact C-N 3.31Å; V741-K743 PolarHBondContact O-N 3.32Å; V741-L744 PolarHBondContact O-N 2.93Å; V741-V745 HydrophobicContact CG1-CG2 4.07Å; V741-V745 WeakPolarHBondContact O-CB 3.39Å; V741-V745 VanDerWaalsContact O-CG2 3.3Å; V741-V745 WeakPolarHBondContact O-CG2 3.4Å; V741-V745 PolarHBondContact O-N 2.95Å; V741-W783 HydrophobicContact CB-CH2 4.41Å; V741-W783 HydrophobicContact CB-CZ2 4.38Å; V741-W783 HydrophobicContact CG1-CH2 3.95Å; V741-W783 HydrophobicContact CG1-CZ2 4.23Å
742	K	93.4	Very high	93.1	Very high	27 Å²	27	35.8 Å²	35.8	12%	0.117	20%	0.198	C	C	.	.	H	α-helix	trans	-58.5	-41	173.8	-76.6	172	171.8	-169.6	0	111.7	D738 H739 V745 F746 W783 D792 R795	D738-K742 VanDerWaalsContact O-CB 3.3Å; D738-K742 WeakPolarHBondContact O-CB 3.37Å; D738-K742 WeakPolarHBondContact O-CG 3.49Å; D738-K742 PolarHBondContact O-N 3.4Å; H739-K742 PolarHBondContact O-N 3.42Å; K742-V745 PolarHBondContact O-N 2.67Å; K742-F746 HydrophobicContact CB-CD2 4.07Å; K742-F746 HydrophobicContact CB-CE2 4.45Å; K742-F746 HydrophobicContact CG-CD2 4.3Å; K742-F746 HydrophobicContact CG-CE2 4.18Å; K742-F746 WeakPolarHBondContact O-CB 3.5Å; K742-F746 WeakPolarHBondContact O-CD2 3.47Å; K742-F746 PolarHBondContact O-N 3.13Å; K742-W783 HydrophobicContact CD-CD2 4.49Å; K742-W783 HydrophobicContact CG-CD2 3.98Å; K742-W783 HydrophobicContact CG-CE3 3.99Å; K742-W783 HydrophobicContact CG-CH2 3.79Å; K742-W783 HydrophobicContact CG-CZ2 3.77Å; K742-W783 HydrophobicContact CG-CZ3 3.91Å; K742-D792 WeakPolarHBondContact CD-OD1 3.42Å; K742-D792 IonicContact NZ-OD1 2.62Å; K742-D792 PolarHBondContact NZ-OD1 2.96Å; K742-D792 IonicContact NZ-OD2 2.63Å; K742-D792 PolarHBondContact NZ-OD2 3.32Å; K742-R795 VanDerWaalsContact C-NH1 3.32Å; K742-R795 PolarHBondContact O-NH1 2.89Å; K742-R795 VanDerWaalsContact O-NH1 3.12Å
743	K	93.9	Very high	92.8	Very high	70 Å²	70	37.4 Å²	37.4	30%	0.304	21%	0.205	S	C	.	.	I	π-helix	trans	-58.4	-50.2	173.9	-179.4	164.7	176.7	-103	0	112	Y683 E687 H739 S740 V741 V745 D747 C748 R795	Y683-K743 WeakPolarHBondContact OH-CD 3.36Å; Y683-K743 WeakPolarHBondContact OH-CE 3.46Å; Y683-K743 WeakPolarHBondContact OH-CG 3.41Å; Y683-K743 PolarHBondContact OH-NZ 3.33Å; E687-K743 IonicContact OE1-NZ 2.72Å; E687-K743 PolarHBondContact OE1-NZ 3.45Å; H739-K743 PolarHBondContact O-N 3.42Å; S740-K743 PolarHBondContact O-N 2.83Å; V741-K743 VanDerWaalsContact C-N 3.31Å; V741-K743 PolarHBondContact O-N 3.32Å; K743-V745 PolarHBondContact O-N 3.02Å; K743-D747 HydrophobicContact CG-CB 4.39Å; K743-D747 WeakPolarHBondContact O-CA 3.26Å; K743-D747 VanDerWaalsContact O-CB 3.29Å; K743-D747 WeakPolarHBondContact O-CB 3.37Å; K743-D747 PolarHBondContact O-N 2.79Å; K743-C748 PolarHBondContact O-N 3.07Å; K743-R795 VanDerWaalsContact CA-NH1 3.34Å
744	L	95.2	Very high	92.8	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.195	C	C	.	.	I	π-helix	trans	-61.8	-43.8	177.4	-65.9	173.5	0	0	0	112.4	Y683 F686 E687 L690 L732 L736 S740 V741 C748 L749	Y683-L744 HydrophobicContact CD2-CD1 3.87Å; Y683-L744 HydrophobicContact CD2-CD2 4.24Å; Y683-L744 HydrophobicContact CD2-CG 4.06Å; Y683-L744 HydrophobicContact CE2-CD1 3.94Å; Y683-L744 HydrophobicContact CE2-CD2 3.76Å; Y683-L744 HydrophobicContact CE2-CG 3.6Å; F686-L744 HydrophobicContact CB-CD1 4.3Å; F686-L744 HydrophobicContact CD1-CD1 4.1Å; F686-L744 HydrophobicContact CD1-CD2 4.38Å; F686-L744 HydrophobicContact CG-CD1 4.35Å; E687-L744 HydrophobicContact CB-CD2 3.81Å; E687-L744 HydrophobicContact CG-CD2 4.31Å; L690-L744 HydrophobicContact CD1-CB 4.29Å; L690-L744 HydrophobicContact CD1-CD2 4.23Å; L732-L744 HydrophobicContact CD1-CD1 3.88Å; L736-L744 HydrophobicContact CD1-CD1 4.43Å; S740-L744 PolarHBondContact O-N 2.88Å; S740-L744 VanDerWaalsContact O-N 3.12Å; V741-L744 PolarHBondContact O-N 2.93Å; L744-C748 WeakPolarHBondContact O-CB 3.22Å; L744-L749 PolarHBondContact O-N 3.05Å
745	V	94.9	Very high	92.8	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	17%	0.166	C	C	.	.	I	π-helix	trans	-70.5	-53.3	-176.3	164.3	0	0	0	0	111.6	L726 A729 L730 V741 K742 K743 L750 W783	L726-V745 HydrophobicContact CD1-CB 4.17Å; L726-V745 HydrophobicContact CD1-CG1 3.48Å; L726-V745 VanDerWaalsContact CD1-CG1 3.48Å; L726-V745 HydrophobicContact CD1-CG2 4.02Å; A729-V745 HydrophobicContact CB-CG2 3.84Å; L730-V745 HydrophobicContact CD2-CG2 4.06Å; L730-V745 HydrophobicContact CG-CG2 4.35Å; V741-V745 HydrophobicContact CG1-CG2 4.07Å; V741-V745 WeakPolarHBondContact O-CB 3.39Å; V741-V745 VanDerWaalsContact O-CG2 3.3Å; V741-V745 WeakPolarHBondContact O-CG2 3.4Å; V741-V745 PolarHBondContact O-N 2.95Å; K742-V745 PolarHBondContact O-N 2.67Å; K743-V745 PolarHBondContact O-N 3.02Å; V745-L750 WeakPolarHBondContact O-CB 3.39Å; V745-L750 PolarHBondContact O-N 3.3Å; V745-W783 HydrophobicContact CB-CZ3 4.44Å; V745-W783 HydrophobicContact CG1-CZ3 4.19Å; V745-W783 HydrophobicContact CG2-CH2 4.36Å
746	F	92.6	Very high	92.6	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.184	C	C	.	.	I	π-helix	trans	-85.7	-52.7	-172.7	-68.4	-73.2	0	0	0	112.2	K742 L750 N751 I779 W783 R795 F796	K742-F746 HydrophobicContact CB-CD2 4.07Å; K742-F746 HydrophobicContact CB-CE2 4.45Å; K742-F746 HydrophobicContact CG-CD2 4.3Å; K742-F746 HydrophobicContact CG-CE2 4.18Å; K742-F746 WeakPolarHBondContact O-CB 3.5Å; K742-F746 WeakPolarHBondContact O-CD2 3.47Å; K742-F746 PolarHBondContact O-N 3.13Å; F746-L750 HydrophobicContact CD1-CD2 3.65Å; F746-L750 HydrophobicContact CE1-CD2 3.73Å; F746-N751 WeakPolarHBondContact O-CB 3.32Å; F746-N751 PolarHBondContact O-N 3.36Å; F746-I779 HydrophobicContact CE1-CD1 4.21Å; F746-I779 HydrophobicContact CZ-CD1 4.4Å; F746-I779 HydrophobicContact CZ-CG2 4.35Å; F746-W783 HydrophobicContact CD2-CZ3 4.44Å; F746-W783 AromaticContact CE2-CE3 3.59Å; F746-W783 HydrophobicContact CE2-CE3 3.59Å; F746-W783 AromaticContact CE2-CZ3 3.54Å; F746-W783 HydrophobicContact CE2-CZ3 3.54Å; F746-W783 AromaticContact CZ-CE3 3.99Å; F746-W783 HydrophobicContact CZ-CE3 3.99Å; F746-W783 HydrophobicContact CZ-CZ3 4.12Å; F746-R795 HydrophobicContact CB-CB 3.99Å; F746-R795 HydrophobicContact CB-CG 4.12Å; F746-R795 HydrophobicContact CD1-CB 4.27Å; F746-R795 HydrophobicContact CD2-CB 4.41Å; F746-R795 HydrophobicContact CG-CB 3.97Å; F746-R795 HydrophobicContact CG-CG 4.48Å; F746-F796 AromaticContact CE1-CD1 3.8Å; F746-F796 HydrophobicContact CE1-CD1 3.8Å; F746-F796 AromaticContact CE1-CE1 3.51Å; F746-F796 HydrophobicContact CE1-CE1 3.51Å; F746-F796 HydrophobicContact CE1-CZ 4.34Å; F746-F796 HydrophobicContact CE2-CE1 4.24Å; F746-F796 HydrophobicContact CE2-CZ 4.31Å; F746-F796 HydrophobicContact CZ-CD1 4.04Å; F746-F796 AromaticContact CZ-CE1 3.28Å; F746-F796 HydrophobicContact CZ-CE1 3.28Å; F746-F796 AromaticContact CZ-CZ 3.74Å; F746-F796 HydrophobicContact CZ-CZ 3.74Å
747	D	90.9	Very high	92.2	Very high	60 Å²	60	35.4 Å²	35.4	32%	0.321	19%	0.185	S	C	.	.	I	π-helix	trans	-78.3	-47.4	-168.6	-51.8	-20.7	0	0	0	110.2	K743 H752 R795	K743-D747 HydrophobicContact CG-CB 4.39Å; K743-D747 WeakPolarHBondContact O-CA 3.26Å; K743-D747 VanDerWaalsContact O-CB 3.29Å; K743-D747 WeakPolarHBondContact O-CB 3.37Å; K743-D747 PolarHBondContact O-N 2.79Å; D747-H752 WeakPolarHBondContact O-CB 3.23Å; D747-R795 IonicContact OD1-CZ 3.85Å; D747-R795 IonicContact OD1-NH1 3.14Å; D747-R795 PolarHBondContact OD1-NH1 3Å; D747-R795 IonicContact OD1-NH2 2.85Å; D747-R795 IonicContact OD2-CZ 2.86Å; D747-R795 IonicContact OD2-NH1 3.48Å; D747-R795 PolarHBondContact OD2-NH1 3.47Å; D747-R795 IonicContact OD2-NH2 2.74Å; D747-R795 PolarHBondContact OD2-NH2 3.4Å
748	C	92.3	Very high	92	Very high	14 Å²	14	32.2 Å²	32.2	10%	0.095	16%	0.162	C	C	.	.	I	π-helix	trans	-81.7	-33.1	-175	-54.6	0	0	0	0	113.3	L690 K743 L744 H753	L690-C748 HydrophobicContact CB-CB 4.43Å; L690-C748 HydrophobicContact CD1-CB 3.66Å; K743-C748 PolarHBondContact O-N 3.07Å; L744-C748 WeakPolarHBondContact O-CB 3.22Å; C748-H753 PolarHBondContact O-CD2 2.93Å; C748-H753 VanDerWaalsContact O-CD2 3.23Å
749	L	93.8	Very high	91.6	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.164	C	C	.	.	I	π-helix	trans	-113.9	-59.9	-171.5	-178.3	58	0	0	0	114.2	L690 I694 C725 L726 L744 H753 I754	L690-L749 HydrophobicContact CD1-CB 4.28Å; L690-L749 HydrophobicContact CD2-CB 4.19Å; L690-L749 HydrophobicContact CD2-CD1 4.1Å; L690-L749 HydrophobicContact CD2-CD2 4.04Å; L690-L749 HydrophobicContact CD2-CG 4.33Å; I694-L749 HydrophobicContact CD1-CD1 4.08Å; I694-L749 HydrophobicContact CG1-CD1 4.18Å; I694-L749 HydrophobicContact CG2-CD1 4.36Å; C725-L749 HydrophobicContact CB-CD2 4.26Å; L726-L749 VanDerWaalsContact CA-CD2 3.49Å; L726-L749 HydrophobicContact CB-CD2 3.66Å; L726-L749 HydrophobicContact CD1-CD2 4.29Å; L744-L749 PolarHBondContact O-N 3.05Å; L749-H753 WeakPolarHBondContact O-CB 3.4Å; L749-H753 PolarHBondContact O-N 3.05Å; L749-H753 VanDerWaalsContact O-N 3.07Å; L749-I754 HydrophobicContact CD1-CD1 4.09Å; L749-I754 HydrophobicContact CD1-CG1 4.27Å; L749-I754 HydrophobicContact CD2-CD1 4.43Å; L749-I754 HydrophobicContact CG-CD1 3.89Å; L749-I754 HydrophobicContact CG-CG1 4.44Å; L749-I754 PolarHBondContact O-N 3.18Å
750	L	92.7	Very high	91.2	Very high	1 Å²	1	29 Å²	29	1%	0.005	15%	0.149	C	C	.	.	I	π-helix	trans	-68.6	-57.4	-169.9	-175.2	68.4	0	0	0	111.5	V745 F746 I754 V755 I775 L799	V745-L750 WeakPolarHBondContact O-CB 3.39Å; V745-L750 PolarHBondContact O-N 3.3Å; F746-L750 HydrophobicContact CD1-CD2 3.65Å; F746-L750 HydrophobicContact CE1-CD2 3.73Å; L750-I754 HydrophobicContact CD1-CB 4.12Å; L750-I754 HydrophobicContact CD1-CD1 4.37Å; L750-I754 HydrophobicContact CD1-CG2 4.09Å; L750-I754 PolarHBondContact O-N 3.16Å; L750-V755 HydrophobicContact CD1-CG2 3.98Å; L750-V755 HydrophobicContact CG-CG2 3.82Å; L750-V755 WeakPolarHBondContact O-CB 3.49Å; L750-V755 WeakPolarHBondContact O-CG2 3.29Å; L750-V755 PolarHBondContact O-N 3.21Å; L750-I775 HydrophobicContact CD1-CG2 3.58Å; L750-L799 HydrophobicContact CD2-CD2 4.5Å
751	N	91.8	Very high	90.5	Very high	31 Å²	31	29.2 Å²	29.2	17%	0.166	15%	0.149	C	C	.	.	I	π-helix	trans	-76.2	-32.4	-175.2	-67.4	-23.4	0	0	0	112	F746 V756 R795 P798	F746-N751 WeakPolarHBondContact O-CB 3.32Å; F746-N751 PolarHBondContact O-N 3.36Å; N751-V756 WeakPolarHBondContact O-CG2 3.39Å; N751-R795 PolarHBondContact ND2-O 3.43Å; N751-P798 HydrophobicContact CB-CG 4.48Å
752	H	90	Very high	89.1	Confident	114 Å²	114	33 Å²	33	53%	0.528	17%	0.174	S	C	.	.	I	π-helix	trans	-76.7	-40.7	-179.6	-170.5	58.5	0	0	0	113.3	D747 V756	D747-H752 WeakPolarHBondContact O-CB 3.23Å; H752-V756 WeakPolarHBondContact O-CG2 3.41Å
753	H	90.9	Very high	88.1	Confident	33 Å²	33	36 Å²	36	15%	0.153	20%	0.195	C	C	.	.	I	π-helix	trans	-115.8	-55.6	-173.7	-58.3	-70.3	0	0	0	114.1	I694 L696 C748 L749 R757	I694-H753 HydrophobicContact CG2-CB 4.01Å; L696-H753 HydrophobicContact CD1-CB 3.64Å; C748-H753 PolarHBondContact O-CD2 2.93Å; C748-H753 VanDerWaalsContact O-CD2 3.23Å; L749-H753 WeakPolarHBondContact O-CB 3.4Å; L749-H753 PolarHBondContact O-N 3.05Å; L749-H753 VanDerWaalsContact O-N 3.07Å; H753-R757 WeakPolarHBondContact O-CB 3.47Å; H753-R757 PolarHBondContact O-N 3.37Å; H753-R757 VanDerWaalsContact O-N 3.11Å
754	I	92	Very high	87.1	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.192	C	C	.	.	I	π-helix	trans	-70.7	-50.8	-167	-61.9	177.7	0	0	0	111.6	L696 F719 L749 L750 R757 L758 I775	L696-I754 HydrophobicContact CD1-CG1 4.45Å; F719-I754 HydrophobicContact CE2-CG2 3.93Å; F719-I754 HydrophobicContact CZ-CG2 4.5Å; L749-I754 HydrophobicContact CD1-CD1 4.09Å; L749-I754 HydrophobicContact CD1-CG1 4.27Å; L749-I754 HydrophobicContact CD2-CD1 4.43Å; L749-I754 HydrophobicContact CG-CD1 3.89Å; L749-I754 HydrophobicContact CG-CG1 4.44Å; L749-I754 PolarHBondContact O-N 3.18Å; L750-I754 HydrophobicContact CD1-CB 4.12Å; L750-I754 HydrophobicContact CD1-CD1 4.37Å; L750-I754 HydrophobicContact CD1-CG2 4.09Å; L750-I754 PolarHBondContact O-N 3.16Å; I754-R757 PolarHBondContact O-N 3.33Å; I754-L758 HydrophobicContact CG2-CD1 4.18Å; I754-L758 WeakPolarHBondContact O-CG 3.37Å; I754-L758 PolarHBondContact O-N 2.98Å; I754-I775 HydrophobicContact CG2-CD1 3.42Å; I754-I775 VanDerWaalsContact CG2-CD1 3.42Å; I754-I775 HydrophobicContact CG2-CG1 4.46Å
755	V	90.4	Very high	86.1	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.012	21%	0.209	C	C	.	.	H	α-helix	trans	-65.7	-41.8	-178.3	172.7	0	0	0	0	110.4	L750 R757 L758 Q759 P798	L750-V755 HydrophobicContact CD1-CG2 3.98Å; L750-V755 HydrophobicContact CG-CG2 3.82Å; L750-V755 WeakPolarHBondContact O-CB 3.49Å; L750-V755 WeakPolarHBondContact O-CG2 3.29Å; L750-V755 PolarHBondContact O-N 3.21Å; V755-R757 VanDerWaalsContact C-N 3.29Å; V755-R757 PolarHBondContact O-N 3.26Å; V755-L758 PolarHBondContact O-N 2.85Å; V755-Q759 HydrophobicContact CG1-CG 4.07Å; V755-Q759 WeakPolarHBondContact O-CB 3.4Å; V755-Q759 VanDerWaalsContact O-CG 3.28Å; V755-Q759 WeakPolarHBondContact O-CG 3.32Å; V755-Q759 PolarHBondContact O-N 2.87Å; V755-P798 HydrophobicContact CG1-CB 3.82Å
756	V	88.5	Confident	85.4	Confident	75 Å²	75	42.5 Å²	42.5	46%	0.455	24%	0.238	S	C	.	.	H	α-helix	trans	-55.5	-46.3	174.6	176.4	0	0	0	0	110.5	N751 H752 Q759 S760	N751-V756 WeakPolarHBondContact O-CG2 3.39Å; H752-V756 WeakPolarHBondContact O-CG2 3.41Å; V756-Q759 PolarHBondContact O-N 2.62Å; V756-S760 PolarHBondContact O-N 2.81Å
757	R	86.8	Confident	84.9	Confident	29 Å²	29	44.3 Å²	44.3	11%	0.109	25%	0.25	C	S	.	.	H	α-helix	trans	-63	-47.8	177.4	-177.4	58.1	177.5	145.7	-1.8	112	L696 P697 M698 H753 I754 V755 Q759 S760	L696-R757 HydrophobicContact CD2-CG 4.37Å; P697-R757 VanDerWaalsContact O-CZ 3.28Å; P697-R757 PolarHBondContact O-NE 3.22Å; P697-R757 PolarHBondContact O-NH2 2.85Å; M698-R757 VanDerWaalsContact SD-CD 3.57Å; M698-R757 PolarHBondContact SD-NH1 3.11Å; M698-R757 VanDerWaalsContact SD-NH1 3.35Å; H753-R757 WeakPolarHBondContact O-CB 3.47Å; H753-R757 PolarHBondContact O-N 3.37Å; H753-R757 VanDerWaalsContact O-N 3.11Å; I754-R757 PolarHBondContact O-N 3.33Å; V755-R757 VanDerWaalsContact C-N 3.29Å; V755-R757 PolarHBondContact O-N 3.26Å; R757-Q759 VanDerWaalsContact C-N 3.28Å; R757-Q759 PolarHBondContact O-N 2.99Å; R757-S760 PolarHBondContact NH1-OG 3.07Å; R757-S760 PolarHBondContact O-N 3.2Å; R757-S760 PolarHBondContact O-OG 2.74Å
758	L	87.6	Confident	84.7	Confident	3 Å²	3	41.5 Å²	41.5	2%	0.016	24%	0.235	C	C	.	.	H	α-helix	trans	-64.6	-33.2	178.8	-67.3	174.9	0	0	0	112.2	F719 I754 V755 S760 V761 V768 K771 I775 L802 R805	F719-L758 HydrophobicContact CD2-CD2 4.44Å; F719-L758 HydrophobicContact CE2-CD1 4.11Å; F719-L758 HydrophobicContact CE2-CD2 3.71Å; F719-L758 HydrophobicContact CE2-CG 3.96Å; F719-L758 HydrophobicContact CZ-CD1 4.41Å; F719-L758 HydrophobicContact CZ-CD2 4.22Å; I754-L758 HydrophobicContact CG2-CD1 4.18Å; I754-L758 WeakPolarHBondContact O-CG 3.37Å; I754-L758 PolarHBondContact O-N 2.98Å; V755-L758 PolarHBondContact O-N 2.85Å; L758-S760 VanDerWaalsContact C-N 3.34Å; L758-V761 PolarHBondContact O-N 3.03Å; L758-V768 HydrophobicContact CD2-CG1 4.3Å; L758-K771 HydrophobicContact CD2-CB 4.3Å; L758-K771 HydrophobicContact CD2-CD 4.2Å; L758-I775 HydrophobicContact CD1-CD1 3.75Å; L758-L802 HydrophobicContact CB-CD1 4.22Å; L758-L802 HydrophobicContact CB-CD2 3.78Å; L758-L802 HydrophobicContact CD1-CD2 3.71Å; L758-L802 HydrophobicContact CG-CD2 4.4Å; L758-R805 PolarHBondContact O-NH2 2.86Å
759	Q	84.8	Confident	84.4	Confident	80 Å²	80	41.1 Å²	41.1	37%	0.374	23%	0.232	S	C	.	.	H	α-helix	trans	-67.3	-33.9	175.1	-75.6	-179.5	-2.7	0	0	112.6	V755 V756 R757 V761 L802 R805	V755-Q759 HydrophobicContact CG1-CG 4.07Å; V755-Q759 WeakPolarHBondContact O-CB 3.4Å; V755-Q759 VanDerWaalsContact O-CG 3.28Å; V755-Q759 WeakPolarHBondContact O-CG 3.32Å; V755-Q759 PolarHBondContact O-N 2.87Å; V756-Q759 PolarHBondContact O-N 2.62Å; R757-Q759 VanDerWaalsContact C-N 3.28Å; R757-Q759 PolarHBondContact O-N 2.99Å; Q759-V761 VanDerWaalsContact C-N 3.31Å; Q759-V761 PolarHBondContact O-N 2.61Å; Q759-L802 HydrophobicContact CG-CD1 4.3Å; Q759-R805 VanDerWaalsContact CA-NH2 3.31Å; Q759-R805 PolarHBondContact O-NH1 3.05Å; Q759-R805 PolarHBondContact O-NH2 3.33Å
760	S	81.9	Confident	84.1	Confident	37 Å²	37	44.2 Å²	44.2	26%	0.259	25%	0.251	S	S	.	.	H	α-helix	trans	-73.5	-17	178.5	76.6	0	0	0	0	115.6	M698 V756 R757 L758 P762	M698-S760 WeakPolarHBondContact CE-OG 3.28Å; M698-S760 VanDerWaalsContact SD-CB 3.54Å; M698-S760 PolarHBondContact SD-OG 3.41Å; V756-S760 PolarHBondContact O-N 2.81Å; R757-S760 PolarHBondContact NH1-OG 3.07Å; R757-S760 PolarHBondContact O-N 3.2Å; R757-S760 PolarHBondContact O-OG 2.74Å; L758-S760 VanDerWaalsContact C-N 3.34Å; S760-P762 WeakPolarHBondContact O-CD 3.5Å; S760-P762 WeakPolarHBondContact O-CG 3.35Å
761	V	79.5	Confident	84	Confident	36 Å²	36	45.1 Å²	45.1	22%	0.218	26%	0.255	C	S	.	.			trans	-68.3	115.7	-177.4	-176.5	0	0	0	0	108.7	L758 Q759 T763 V768	L758-V761 PolarHBondContact O-N 3.03Å; Q759-V761 VanDerWaalsContact C-N 3.31Å; Q759-V761 PolarHBondContact O-N 2.61Å; V761-T763 PolarHBondContact O-N 3.25Å; V761-V768 HydrophobicContact CB-CG2 4.25Å; V761-V768 HydrophobicContact CG1-CG2 3.95Å
762	P	68.4	Low	83.9	Confident	81 Å²	81	43.6 Å²	43.6	53%	0.526	25%	0.247	S	C	.	.	S	Bend	trans	-81.4	-22.2	-166.4	-15.7	32.5	0	0	0	113.5	K701 S760	K701-P762 HydrophobicContact CD-CB 4.47Å; K701-P762 HydrophobicContact CD-CG 4.27Å; K701-P762 HydrophobicContact CG-CG 4.08Å; S760-P762 WeakPolarHBondContact O-CD 3.5Å; S760-P762 WeakPolarHBondContact O-CG 3.35Å
763	T	70.7	Confident	83.8	Confident	90 Å²	90	39.7 Å²	39.7	55%	0.552	23%	0.229	S	C	*	.	S	Bend	trans	-107.4	105.6	173.5	49.7	0	0	0	0	108.3	V761 D765	V761-T763 PolarHBondContact O-N 3.25Å; T763-D765 PolarHBondContact O-N 2.89Å
764	V	73	Confident	83.8	Confident	38 Å²	38	39.4 Å²	39.4	23%	0.23	23%	0.232	C	C	.	.			trans	-72.4	112.4	172.8	177.5	0	0	0	0	108.3	L806 T809	V764-L806 HydrophobicContact CB-CD2 4.44Å; V764-L806 HydrophobicContact CG1-CD2 3.19Å; V764-L806 HydrophobicContact CG2-CD2 4.46Å; V764-T809 HydrophobicContact CB-CG2 4.3Å; V764-T809 VanDerWaalsContact CG1-OG1 3.27Å; V764-T809 WeakPolarHBondContact CG1-OG1 3.46Å; V764-T809 HydrophobicContact CG2-CG2 4.36Å
765	D	74.6	Confident	83.8	Confident	68 Å²	68	39.4 Å²	39.4	36%	0.364	23%	0.232	S	C	.	.			trans	-120.4	179.6	179.2	68.3	0.8	0	0	0	111.5	T763 S767 V768 W769	T763-D765 PolarHBondContact O-N 2.89Å; D765-S767 PolarHBondContact O-N 3.37Å; D765-S767 WeakPolarHBondContact OD1-CA 3.43Å; D765-S767 VanDerWaalsContact OD1-CB 3.28Å; D765-S767 WeakPolarHBondContact OD1-CB 3.28Å; D765-S767 PolarHBondContact OD1-N 3.23Å; D765-S767 PolarHBondContact OD1-OG 2.94Å; D765-S767 PolarHBondContact OD2-OG 3.33Å; D765-V768 PolarHBondContact O-N 3.28Å; D765-V768 WeakPolarHBondContact OD1-CG2 3.22Å; D765-V768 PolarHBondContact OD1-N 2.73Å; D765-W769 PolarHBondContact O-N 3.03Å
766	V	80	Confident	83.8	Confident	100 Å²	100	39.3 Å²	39.3	61%	0.606	23%	0.231	S	C	*	.	H	α-helix	trans	-60.1	-27	175.2	-179.5	0	0	0	0	111.1	W769 T770	V766-W769 WeakPolarHBondContact O-CB 3.39Å; V766-W769 PolarHBondContact O-N 2.99Å; V766-T770 HydrophobicContact CG1-CG2 4.4Å; V766-T770 WeakPolarHBondContact O-CG2 3.41Å; V766-T770 PolarHBondContact O-N 3.13Å; V766-T770 PolarHBondContact O-OG1 3.2Å
767	S	82.7	Confident	83.9	Confident	38 Å²	38	41.1 Å²	41.1	27%	0.266	24%	0.238	S	C	.	.	H	α-helix	trans	-67	-44.3	177.7	89.3	0	0	0	0	111.6	D765 W769 T770 K771	D765-S767 PolarHBondContact O-N 3.37Å; D765-S767 WeakPolarHBondContact OD1-CA 3.43Å; D765-S767 VanDerWaalsContact OD1-CB 3.28Å; D765-S767 WeakPolarHBondContact OD1-CB 3.28Å; D765-S767 PolarHBondContact OD1-N 3.23Å; D765-S767 PolarHBondContact OD1-OG 2.94Å; D765-S767 PolarHBondContact OD2-OG 3.33Å; S767-W769 VanDerWaalsContact C-N 3.26Å; S767-W769 PolarHBondContact O-N 3.05Å; S767-T770 WeakPolarHBondContact CA-OG1 3.39Å; S767-T770 PolarHBondContact O-N 2.76Å; S767-T770 PolarHBondContact O-OG1 2.92Å; S767-K771 WeakPolarHBondContact O-CG 3.41Å; S767-K771 PolarHBondContact O-N 3.23Å
768	V	85.6	Confident	84.1	Confident	1 Å²	1	41.8 Å²	41.8	1%	0.006	24%	0.244	C	C	.	.	H	α-helix	trans	-61.7	-38.6	175.1	-178.5	0	0	0	0	110.4	L758 V761 D765 T772 L806	L758-V768 HydrophobicContact CD2-CG1 4.3Å; V761-V768 HydrophobicContact CB-CG2 4.25Å; V761-V768 HydrophobicContact CG1-CG2 3.95Å; D765-V768 PolarHBondContact O-N 3.28Å; D765-V768 WeakPolarHBondContact OD1-CG2 3.22Å; D765-V768 PolarHBondContact OD1-N 2.73Å; V768-T772 WeakPolarHBondContact O-CB 2.97Å; V768-T772 PolarHBondContact O-N 3.4Å; V768-T772 PolarHBondContact O-OG1 3.38Å; V768-L806 HydrophobicContact CB-CD2 4.44Å; V768-L806 HydrophobicContact CG1-CD2 3.81Å
769	W	87.4	Confident	84.2	Confident	7 Å²	7	41.9 Å²	41.9	3%	0.027	24%	0.244	C	C	.	.	H	α-helix	trans	-59.8	-54.6	172.8	169.7	-102.7	0	0	0	111.9	D765 V766 S767 K771 T772 E773 L803 L806 L810 V821 K824 I825 L828	D765-W769 PolarHBondContact O-N 3.03Å; V766-W769 WeakPolarHBondContact O-CB 3.39Å; V766-W769 PolarHBondContact O-N 2.99Å; S767-W769 VanDerWaalsContact C-N 3.26Å; S767-W769 PolarHBondContact O-N 3.05Å; W769-K771 PolarHBondContact O-N 3.47Å; W769-T772 PolarHBondContact O-N 2.9Å; W769-E773 HydrophobicContact CZ2-CB 4.11Å; W769-E773 HydrophobicContact CZ2-CG 4.18Å; W769-E773 PolarHBondContact NE1-OE2 3.09Å; W769-E773 WeakPolarHBondContact O-CB 3.37Å; W769-E773 PolarHBondContact O-N 3.13Å; W769-L803 HydrophobicContact CZ3-CD2 4.15Å; W769-L806 HydrophobicContact CE3-CD1 3.98Å; W769-L810 HydrophobicContact CB-CD1 4.12Å; W769-V821 HydrophobicContact CD2-CG1 3.66Å; W769-V821 HydrophobicContact CE3-CG1 4.19Å; W769-V821 HydrophobicContact CG-CG1 3.97Å; W769-V821 HydrophobicContact CZ2-CG1 4.11Å; W769-K824 HydrophobicContact CH2-CB 4.07Å; W769-K824 HydrophobicContact CZ2-CB 3.86Å; W769-K824 HydrophobicContact CZ2-CD 4.31Å; W769-I825 HydrophobicContact CE3-CD1 4.03Å; W769-I825 HydrophobicContact CE3-CG1 3.74Å; W769-I825 HydrophobicContact CH2-CB 4.37Å; W769-I825 HydrophobicContact CH2-CD1 4.42Å; W769-I825 HydrophobicContact CH2-CG1 3.4Å; W769-I825 HydrophobicContact CZ2-CG1 4.29Å; W769-I825 HydrophobicContact CZ3-CB 4.3Å; W769-I825 HydrophobicContact CZ3-CD1 3.92Å; W769-I825 HydrophobicContact CZ3-CG1 3.1Å; W769-L828 HydrophobicContact CH2-CD1 4.02Å
770	T	86.7	Confident	84.4	Confident	65 Å²	65	38.9 Å²	38.9	40%	0.399	23%	0.232	S	C	.	.	H	α-helix	trans	-57.7	-36	-178.4	55.4	0	0	0	0	113.1	V766 S767 A774	V766-T770 HydrophobicContact CG1-CG2 4.4Å; V766-T770 WeakPolarHBondContact O-CG2 3.41Å; V766-T770 PolarHBondContact O-N 3.13Å; V766-T770 PolarHBondContact O-OG1 3.2Å; S767-T770 WeakPolarHBondContact CA-OG1 3.39Å; S767-T770 PolarHBondContact O-N 2.76Å; S767-T770 PolarHBondContact O-OG1 2.92Å; T770-A774 WeakPolarHBondContact O-CB 3.5Å; T770-A774 PolarHBondContact O-N 3.29Å
771	K	90.9	Very high	84.6	Confident	19 Å²	19	42.2 Å²	42.2	8%	0.083	25%	0.246	C	C	.	.	H	α-helix	trans	-68.2	-43.8	175.2	-73.6	177.1	-178.1	171.2	0	112.7	E716 F719 W720 L758 S767 W769 A774 I775	E716-K771 VanDerWaalsContact CD-NZ 3.27Å; E716-K771 IonicContact OE1-NZ 3.79Å; E716-K771 PolarHBondContact OE1-NZ 3.44Å; E716-K771 WeakPolarHBondContact OE2-CE 3.18Å; E716-K771 IonicContact OE2-NZ 2.88Å; E716-K771 PolarHBondContact OE2-NZ 2.94Å; F719-K771 HydrophobicContact CD1-CD 3.81Å; F719-K771 HydrophobicContact CD1-CG 4.01Å; F719-K771 HydrophobicContact CD2-CD 4.46Å; F719-K771 HydrophobicContact CE1-CB 3.64Å; F719-K771 HydrophobicContact CE1-CD 3.59Å; F719-K771 HydrophobicContact CE1-CG 3.4Å; F719-K771 HydrophobicContact CE2-CB 4.46Å; F719-K771 HydrophobicContact CE2-CD 4.25Å; F719-K771 HydrophobicContact CG-CD 4.27Å; F719-K771 HydrophobicContact CZ-CB 3.53Å; F719-K771 HydrophobicContact CZ-CD 3.83Å; F719-K771 HydrophobicContact CZ-CG 3.8Å; W720-K771 HydrophobicContact CZ2-CG 4.15Å; L758-K771 HydrophobicContact CD2-CB 4.3Å; L758-K771 HydrophobicContact CD2-CD 4.2Å; S767-K771 WeakPolarHBondContact O-CG 3.41Å; S767-K771 PolarHBondContact O-N 3.23Å; W769-K771 PolarHBondContact O-N 3.47Å; K771-A774 PolarHBondContact O-N 3.22Å; K771-I775 WeakPolarHBondContact O-CD1 3.45Å; K771-I775 WeakPolarHBondContact O-CG1 3.37Å; K771-I775 PolarHBondContact O-N 3.45Å; K771-I775 VanDerWaalsContact O-N 3.1Å
772	T	89.2	Confident	84.8	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-69.1	-39.7	179.1	-51.5	0	0	0	0	110.8	V768 W769 I775 C776 L799 L802 L803 L806	V768-T772 WeakPolarHBondContact O-CB 2.97Å; V768-T772 PolarHBondContact O-N 3.4Å; V768-T772 PolarHBondContact O-OG1 3.38Å; W769-T772 PolarHBondContact O-N 2.9Å; T772-I775 PolarHBondContact O-N 3.38Å; T772-C776 PolarHBondContact O-N 2.97Å; T772-C776 PolarHBondContact O-SG 3.1Å; T772-L799 HydrophobicContact CG2-CD1 4.23Å; T772-L802 HydrophobicContact CG2-CD2 3.91Å; T772-L802 HydrophobicContact CG2-CG 4.42Å; T772-L803 HydrophobicContact CG2-CD2 3.79Å; T772-L803 HydrophobicContact CG2-CG 4.4Å; T772-L806 HydrophobicContact CG2-CD1 3.85Å
773	E	89.4	Confident	85.6	Confident	32 Å²	32	43.6 Å²	43.6	15%	0.15	24%	0.243	C	C	.	.	H	α-helix	trans	-58.4	-51.2	172.8	-175.9	171.9	-156.2	0	0	110.3	W769 I775 C776 D777 K824	W769-E773 HydrophobicContact CZ2-CB 4.11Å; W769-E773 HydrophobicContact CZ2-CG 4.18Å; W769-E773 PolarHBondContact NE1-OE2 3.09Å; W769-E773 WeakPolarHBondContact O-CB 3.37Å; W769-E773 PolarHBondContact O-N 3.13Å; E773-I775 VanDerWaalsContact C-N 3.29Å; E773-I775 PolarHBondContact O-N 2.83Å; E773-C776 PolarHBondContact O-N 3Å; E773-D777 VanDerWaalsContact O-CG 3.31Å; E773-D777 PolarHBondContact O-N 3.15Å; E773-K824 VanDerWaalsContact OE1-CD 3.26Å; E773-K824 WeakPolarHBondContact OE1-CD 3.28Å; E773-K824 WeakPolarHBondContact OE1-CE 3.07Å; E773-K824 IonicContact OE1-NZ 3.42Å; E773-K824 PolarHBondContact OE1-NZ 3.41Å
774	A	90.2	Very high	86.1	Confident	26 Å²	26	39.5 Å²	39.5	22%	0.215	22%	0.218	C	C	.	.	H	α-helix	trans	-56.9	-39.3	176.9	0	0	0	0	0	113	W720 T770 K771 L778	W720-A774 HydrophobicContact CH2-CB 4.07Å; W720-A774 HydrophobicContact CZ3-CB 4.04Å; T770-A774 WeakPolarHBondContact O-CB 3.5Å; T770-A774 PolarHBondContact O-N 3.29Å; K771-A774 PolarHBondContact O-N 3.22Å; A774-L778 VanDerWaalsContact O-CG 3.28Å; A774-L778 WeakPolarHBondContact O-CG 3.36Å; A774-L778 PolarHBondContact O-N 2.98Å
775	I	91.8	Very high	85.9	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	24%	0.236	C	C	.	.	H	α-helix	trans	-66.5	-44.2	175.5	-68.6	160	0	0	0	111.2	F719 V723 L726 L750 I754 L758 K771 T772 E773 D777 L778 I779	F719-I775 HydrophobicContact CE2-CD1 4.37Å; F719-I775 HydrophobicContact CZ-CD1 3.88Å; V723-I775 HydrophobicContact CG2-CG1 4.2Å; L726-I775 HydrophobicContact CD2-CG2 4.28Å; L750-I775 HydrophobicContact CD1-CG2 3.58Å; I754-I775 HydrophobicContact CG2-CD1 3.42Å; I754-I775 VanDerWaalsContact CG2-CD1 3.42Å; I754-I775 HydrophobicContact CG2-CG1 4.46Å; L758-I775 HydrophobicContact CD1-CD1 3.75Å; K771-I775 WeakPolarHBondContact O-CD1 3.45Å; K771-I775 WeakPolarHBondContact O-CG1 3.37Å; K771-I775 PolarHBondContact O-N 3.45Å; K771-I775 VanDerWaalsContact O-N 3.1Å; T772-I775 PolarHBondContact O-N 3.38Å; E773-I775 VanDerWaalsContact C-N 3.29Å; E773-I775 PolarHBondContact O-N 2.83Å; I775-D777 VanDerWaalsContact C-N 3.28Å; I775-D777 PolarHBondContact O-N 3.26Å; I775-L778 PolarHBondContact O-N 2.93Å; I775-I779 PolarHBondContact O-N 2.83Å
776	C	90.2	Very high	85.5	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.5	-33.6	-179.4	-66.9	0	0	0	0	112.5	T772 E773 L778 I779 L828 R831 F832	T772-C776 PolarHBondContact O-N 2.97Å; T772-C776 PolarHBondContact O-SG 3.1Å; E773-C776 PolarHBondContact O-N 3Å; C776-L778 VanDerWaalsContact C-N 3.29Å; C776-I779 PolarHBondContact O-N 3.11Å; C776-L828 HydrophobicContact CB-CD1 3.81Å; C776-L828 HydrophobicContact CB-CD2 3.89Å; C776-L828 HydrophobicContact CB-CG 4.46Å; C776-R831 PolarHBondContact O-NH1 3.33Å; C776-F832 HydrophobicContact CB-CE2 4.26Å; C776-F832 HydrophobicContact CB-CZ 4.38Å
777	D	89.9	Confident	84.9	Confident	112 Å²	112	43.4 Å²	43.4	60%	0.599	25%	0.25	S	S	*	.	H	α-helix	trans	-69.8	-26.1	176.3	-69.6	-17.7	0	0	0	112.3	E773 I775	E773-D777 VanDerWaalsContact O-CG 3.31Å; E773-D777 PolarHBondContact O-N 3.15Å; I775-D777 VanDerWaalsContact C-N 3.28Å; I775-D777 PolarHBondContact O-N 3.26Å
778	L	91	Very high	84.1	Confident	43 Å²	43	42.5 Å²	42.5	23%	0.225	24%	0.242	C	C	.	.	H	α-helix	trans	-78.3	-28.4	176.4	-67.1	175.2	0	0	0	113.7	V723 L726 K727 L730 A774 I775 C776 P780	V723-L778 HydrophobicContact CG1-CD1 3.54Å; L726-L778 HydrophobicContact CD2-CD1 4.08Å; L726-L778 HydrophobicContact CG-CD1 4.49Å; K727-L778 HydrophobicContact CD-CD2 4.2Å; K727-L778 HydrophobicContact CG-CD1 3.78Å; K727-L778 HydrophobicContact CG-CD2 3.74Å; K727-L778 HydrophobicContact CG-CG 4.39Å; L730-L778 HydrophobicContact CD1-CB 3.99Å; L730-L778 WeakPolarHBondContact CD1-O 3.33Å; A774-L778 VanDerWaalsContact O-CG 3.28Å; A774-L778 WeakPolarHBondContact O-CG 3.36Å; A774-L778 PolarHBondContact O-N 2.98Å; I775-L778 PolarHBondContact O-N 2.93Å; C776-L778 VanDerWaalsContact C-N 3.29Å; L778-P780 WeakPolarHBondContact O-CD 3.45Å
779	I	90.8	Very high	83.5	Confident	6 Å²	6	45 Å²	45	3%	0.031	26%	0.26	C	S	.	.	S	Bend	trans	-66.5	128.6	-179.7	-64.2	169.1	0	0	0	108.4	F746 I775 C776 W783 F796 L799 R831 F832	F746-I779 HydrophobicContact CE1-CD1 4.21Å; F746-I779 HydrophobicContact CZ-CD1 4.4Å; F746-I779 HydrophobicContact CZ-CG2 4.35Å; I775-I779 PolarHBondContact O-N 2.83Å; C776-I779 PolarHBondContact O-N 3.11Å; I779-W783 HydrophobicContact CG2-CE3 4.26Å; I779-F796 HydrophobicContact CG2-CE1 4.25Å; I779-L799 HydrophobicContact CD1-CD2 3.66Å; I779-R831 PolarHBondContact O-NH2 3.06Å; I779-F832 HydrophobicContact CD1-CE1 3.94Å; I779-F832 HydrophobicContact CD1-CZ 3.89Å; I779-F832 HydrophobicContact CG2-CE1 4.2Å
780	P	89.3	Confident	82.9	Confident	17 Å²	17	53 Å²	53	11%	0.11	30%	0.297	C	S	.	.			trans	-58.5	141.1	177	-26.6	35.2	0	0	0	113.1	L730 R733 L778 E782 W783 R831	L730-P780 HydrophobicContact CD2-CG 4.02Å; R733-P780 VanDerWaalsContact NH1-CG 3.28Å; L778-P780 WeakPolarHBondContact O-CD 3.45Å; P780-E782 VanDerWaalsContact C-N 3.27Å; P780-E782 PolarHBondContact O-N 3.27Å; P780-W783 HydrophobicContact CB-CD2 4.37Å; P780-W783 HydrophobicContact CB-CG 4.35Å; P780-W783 HydrophobicContact CG-CD2 4.15Å; P780-W783 HydrophobicContact CG-CE3 4.3Å; P780-W783 HydrophobicContact CG-CZ2 4.49Å; P780-W783 PolarHBondContact O-N 3.43Å; P780-R831 VanDerWaalsContact C-NH2 3.25Å; P780-R831 PolarHBondContact O-NH2 3.46Å
781	L	84.6	Confident	82.2	Confident	106 Å²	106	52.9 Å²	52.9	56%	0.555	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-64.4	-33.5	177.1	-73.2	165.7	0	0	0	112.1	W783 T784 N785	L781-W783 PolarHBondContact O-N 3.5Å; L781-T784 CarbonylContact O-C 3.58Å; L781-T784 PolarHBondContact O-N 3.41Å; L781-T784 PolarHBondContact O-OG1 2.91Å; L781-N785 WeakPolarHBondContact O-CB 3.41Å; L781-N785 PolarHBondContact O-N 3.37Å; L781-N785 PolarHBondContact O-ND2 2.8Å; L781-N785 PolarHBondContact O-OD1 2.89Å
782	E	84.3	Confident	81.5	Confident	135 Å²	135	53 Å²	53	63%	0.631	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-58	-32.8	178.9	-67.5	160.5	-157.1	0	0	113.1	R733 P780 T784	R733-E782 IonicContact CZ-OE2 2.76Å; R733-E782 IonicContact NH1-OE2 3.84Å; R733-E782 IonicContact NH2-OE2 3.09Å; R733-E782 PolarHBondContact NH2-OE2 3.31Å; P780-E782 VanDerWaalsContact C-N 3.27Å; P780-E782 PolarHBondContact O-N 3.27Å; E782-T784 PolarHBondContact O-N 3.23Å
783	W	85.5	Confident	81	Confident	12 Å²	12	55.3 Å²	55.3	5%	0.045	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-74.9	-10.9	178.2	-66.2	-4.4	0	0	0	113.7	L730 R733 D738 V741 K742 V745 F746 I779 P780 L781 F796	L730-W783 HydrophobicContact CD2-CH2 3.88Å; L730-W783 HydrophobicContact CD2-CZ3 4.09Å; R733-W783 HydrophobicContact CG-CZ2 4.3Å; D738-W783 PolarHBondContact OD2-NE1 3.15Å; V741-W783 HydrophobicContact CB-CH2 4.41Å; V741-W783 HydrophobicContact CB-CZ2 4.38Å; V741-W783 HydrophobicContact CG1-CH2 3.95Å; V741-W783 HydrophobicContact CG1-CZ2 4.23Å; K742-W783 HydrophobicContact CD-CD2 4.49Å; K742-W783 HydrophobicContact CG-CD2 3.98Å; K742-W783 HydrophobicContact CG-CE3 3.99Å; K742-W783 HydrophobicContact CG-CH2 3.79Å; K742-W783 HydrophobicContact CG-CZ2 3.77Å; K742-W783 HydrophobicContact CG-CZ3 3.91Å; V745-W783 HydrophobicContact CB-CZ3 4.44Å; V745-W783 HydrophobicContact CG1-CZ3 4.19Å; V745-W783 HydrophobicContact CG2-CH2 4.36Å; F746-W783 HydrophobicContact CD2-CZ3 4.44Å; F746-W783 AromaticContact CE2-CE3 3.59Å; F746-W783 HydrophobicContact CE2-CE3 3.59Å; F746-W783 AromaticContact CE2-CZ3 3.54Å; F746-W783 HydrophobicContact CE2-CZ3 3.54Å; F746-W783 AromaticContact CZ-CE3 3.99Å; F746-W783 HydrophobicContact CZ-CE3 3.99Å; F746-W783 HydrophobicContact CZ-CZ3 4.12Å; I779-W783 HydrophobicContact CG2-CE3 4.26Å; P780-W783 HydrophobicContact CB-CD2 4.37Å; P780-W783 HydrophobicContact CB-CG 4.35Å; P780-W783 HydrophobicContact CG-CD2 4.15Å; P780-W783 HydrophobicContact CG-CE3 4.3Å; P780-W783 HydrophobicContact CG-CZ2 4.49Å; P780-W783 PolarHBondContact O-N 3.43Å; L781-W783 PolarHBondContact O-N 3.5Å; W783-F796 HydrophobicContact CB-CZ 4.42Å
784	T	81.1	Confident	80.7	Confident	4 Å²	4	57.5 Å²	57.5	3%	0.025	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-13.7	-178.6	54.4	0	0	0	0	113.1	L781 E782 G786 F796 R831 F832	L781-T784 CarbonylContact O-C 3.58Å; L781-T784 PolarHBondContact O-N 3.41Å; L781-T784 PolarHBondContact O-OG1 2.91Å; E782-T784 PolarHBondContact O-N 3.23Å; T784-G786 PolarHBondContact O-N 3.14Å; T784-F796 HydrophobicContact CG2-CE1 4.35Å; T784-F796 HydrophobicContact CG2-CZ 4.01Å; T784-R831 HydrophobicContact CG2-CG 3.9Å; T784-R831 WeakPolarHBondContact OG1-CG 3.1Å; T784-R831 PolarHBondContact OG1-NE 3.21Å; T784-F832 HydrophobicContact CG2-CD1 3.66Å; T784-F832 HydrophobicContact CG2-CE1 3.63Å
785	N	69.4	Low	80.5	Confident	114 Å²	114	57.1 Å²	57.1	61%	0.61	32%	0.323	S	S	*	.	S	Bend	trans	-97.7	74.5	-177.2	-70.2	-10.3	0	0	0	109.9	L781	L781-N785 WeakPolarHBondContact O-CB 3.41Å; L781-N785 PolarHBondContact O-N 3.37Å; L781-N785 PolarHBondContact O-ND2 2.8Å; L781-N785 PolarHBondContact O-OD1 2.89Å
786	G	66.2	Low	80.2	Confident	38 Å²	38	57.1 Å²	57.1	39%	0.392	32%	0.323	S	S	.	.	S	Bend	trans	170.4	176.5	177.6	0	0	0	0	0	112.1	T784 I788	T784-G786 PolarHBondContact O-N 3.14Å; G786-I788 PolarHBondContact O-N 2.98Å
787	P	66.1	Low	80	Confident	136 Å²	136	61 Å²	61	88%	0.883	34%	0.341	S	S	*	.			trans	-60.2	107.4	166.7	26.2	-31.4	0	0	0	108.3	S789	P787-S789 PolarHBondContact O-N 2.96Å
788	I	67.2	Low	79.9	Confident	18 Å²	18	57.7 Å²	57.7	9%	0.092	33%	0.325	C	S	.	.			trans	-69	121.3	-179.8	-55.8	175.7	0	0	0	107	G786 D792 Q793 F796 A835	G786-I788 PolarHBondContact O-N 2.98Å; I788-D792 HydrophobicContact CG2-CB 3.53Å; I788-Q793 HydrophobicContact CG2-CB 3.95Å; I788-F796 HydrophobicContact CG2-CD2 4.42Å; I788-A835 HydrophobicContact CB-CB 4.5Å
789	S	71.8	Confident	79.7	Confident	55 Å²	55	55.7 Å²	55.7	39%	0.385	32%	0.315	S	S	.	.			trans	-58.9	150.5	173.3	68.5	0	0	0	0	110.2	P787 C791 D792 Q793	P787-S789 PolarHBondContact O-N 2.96Å; S789-C791 PolarHBondContact O-N 3.41Å; S789-C791 VanDerWaalsContact O-N 3.13Å; S789-D792 PolarHBondContact O-N 3.45Å; S789-D792 WeakPolarHBondContact OG-CB 3.45Å; S789-D792 PolarHBondContact OG-N 2.83Å; S789-D792 VanDerWaalsContact OG-N 3.1Å; S789-D792 PolarHBondContact OG-OD2 3.46Å; S789-Q793 PolarHBondContact O-N 2.94Å
790	E	74.8	Confident	79.5	Confident	174 Å²	174	55.4 Å²	55.4	81%	0.813	31%	0.314	S	S	*	.	H	α-helix	trans	-55.1	-35.1	178	-66.2	-175.8	168.3	0	0	112	Q793 S794	E790-Q793 PolarHBondContact O-N 3.46Å; E790-S794 PolarHBondContact O-N 3.48Å; E790-S794 VanDerWaalsContact O-N 3.1Å
791	C	72	Confident	79.4	Confident	63 Å²	63	55.9 Å²	55.9	43%	0.426	32%	0.321	S	S	.	.	H	α-helix	trans	-64.3	-46.3	173.9	-175.9	0	0	0	0	112.2	S789 Q793 S794 R795	S789-C791 PolarHBondContact O-N 3.41Å; S789-C791 VanDerWaalsContact O-N 3.13Å; C791-Q793 VanDerWaalsContact C-N 3.29Å; C791-Q793 PolarHBondContact O-N 2.76Å; C791-S794 PolarHBondContact O-N 3.38Å; C791-S794 PolarHBondContact O-OG 3.27Å; C791-R795 WeakPolarHBondContact O-CG 3.39Å; C791-R795 PolarHBondContact O-N 3.29Å
792	D	77.5	Confident	79.4	Confident	21 Å²	21	50.9 Å²	50.9	11%	0.112	30%	0.295	C	S	.	.	H	α-helix	trans	-64.9	-36.7	176.5	-71.8	-44.2	0	0	0	111.6	K742 I788 S789 S794 R795 F796	K742-D792 WeakPolarHBondContact CD-OD1 3.42Å; K742-D792 IonicContact NZ-OD1 2.62Å; K742-D792 PolarHBondContact NZ-OD1 2.96Å; K742-D792 IonicContact NZ-OD2 2.63Å; K742-D792 PolarHBondContact NZ-OD2 3.32Å; I788-D792 HydrophobicContact CG2-CB 3.53Å; S789-D792 PolarHBondContact O-N 3.45Å; S789-D792 WeakPolarHBondContact OG-CB 3.45Å; S789-D792 PolarHBondContact OG-N 2.83Å; S789-D792 VanDerWaalsContact OG-N 3.1Å; S789-D792 PolarHBondContact OG-OD2 3.46Å; D792-S794 VanDerWaalsContact C-N 3.35Å; D792-S794 PolarHBondContact O-N 3.29Å; D792-R795 WeakPolarHBondContact O-CB 3.27Å; D792-R795 PolarHBondContact O-N 3.48Å; D792-F796 HydrophobicContact CB-CE2 4.22Å; D792-F796 WeakPolarHBondContact O-CD2 3.3Å; D792-F796 PolarHBondContact O-N 2.91Å; D792-F796 VanDerWaalsContact O-N 3.13Å
793	Q	77.5	Confident	79.5	Confident	49 Å²	49	44.4 Å²	44.4	23%	0.229	27%	0.265	C	S	.	.	H	α-helix	trans	-63.7	-41.2	178.7	-169.9	165.5	24.2	0	0	111.8	I788 S789 E790 C791 R795 F796 E797	I788-Q793 HydrophobicContact CG2-CB 3.95Å; S789-Q793 PolarHBondContact O-N 2.94Å; E790-Q793 PolarHBondContact O-N 3.46Å; C791-Q793 VanDerWaalsContact C-N 3.29Å; C791-Q793 PolarHBondContact O-N 2.76Å; Q793-R795 VanDerWaalsContact C-N 3.32Å; Q793-R795 PolarHBondContact O-N 3.33Å; Q793-F796 PolarHBondContact O-N 3.14Å; Q793-E797 PolarHBondContact O-N 3.38Å
794	S	83.2	Confident	79.6	Confident	77 Å²	77	48.8 Å²	48.8	54%	0.538	28%	0.281	S	S	.	.	H	α-helix	trans	-65.4	-35.1	175.4	69.9	0	0	0	0	112.5	E790 C791 D792 F796 E797 P798	E790-S794 PolarHBondContact O-N 3.48Å; E790-S794 VanDerWaalsContact O-N 3.1Å; C791-S794 PolarHBondContact O-N 3.38Å; C791-S794 PolarHBondContact O-OG 3.27Å; D792-S794 VanDerWaalsContact C-N 3.35Å; D792-S794 PolarHBondContact O-N 3.29Å; S794-F796 VanDerWaalsContact C-N 3.33Å; S794-F796 PolarHBondContact O-N 3.4Å; S794-E797 PolarHBondContact O-N 2.9Å; S794-P798 WeakPolarHBondContact O-CD 3.49Å
795	R	85.7	Confident	79.7	Confident	18 Å²	18	52.3 Å²	52.3	7%	0.068	29%	0.294	C	S	.	.	H	α-helix	trans	-63.4	-35.6	174.6	-68.3	167.5	-177.1	-85.5	-8.8	112.7	K742 K743 F746 D747 N751 C791 D792 Q793	K742-R795 VanDerWaalsContact C-NH1 3.32Å; K742-R795 PolarHBondContact O-NH1 2.89Å; K742-R795 VanDerWaalsContact O-NH1 3.12Å; K743-R795 VanDerWaalsContact CA-NH1 3.34Å; F746-R795 HydrophobicContact CB-CB 3.99Å; F746-R795 HydrophobicContact CB-CG 4.12Å; F746-R795 HydrophobicContact CD1-CB 4.27Å; F746-R795 HydrophobicContact CD2-CB 4.41Å; F746-R795 HydrophobicContact CG-CB 3.97Å; F746-R795 HydrophobicContact CG-CG 4.48Å; D747-R795 IonicContact OD1-CZ 3.85Å; D747-R795 IonicContact OD1-NH1 3.14Å; D747-R795 PolarHBondContact OD1-NH1 3Å; D747-R795 IonicContact OD1-NH2 2.85Å; D747-R795 IonicContact OD2-CZ 2.86Å; D747-R795 IonicContact OD2-NH1 3.48Å; D747-R795 PolarHBondContact OD2-NH1 3.47Å; D747-R795 IonicContact OD2-NH2 2.74Å; D747-R795 PolarHBondContact OD2-NH2 3.4Å; N751-R795 PolarHBondContact ND2-O 3.43Å; C791-R795 WeakPolarHBondContact O-CG 3.39Å; C791-R795 PolarHBondContact O-N 3.29Å; D792-R795 WeakPolarHBondContact O-CB 3.27Å; D792-R795 PolarHBondContact O-N 3.48Å; Q793-R795 VanDerWaalsContact C-N 3.32Å; Q793-R795 PolarHBondContact O-N 3.33Å
796	F	85.4	Confident	80.4	Confident	1 Å²	1	46.9 Å²	46.9	0%	0.004	27%	0.265	C	S	.	.	H	α-helix	trans	-83.2	-18.7	179.8	-68.6	-61.5	0	0	0	114.1	F746 I779 W783 T784 I788 D792 Q793 S794 L799 S800 F832	F746-F796 AromaticContact CE1-CD1 3.8Å; F746-F796 HydrophobicContact CE1-CD1 3.8Å; F746-F796 AromaticContact CE1-CE1 3.51Å; F746-F796 HydrophobicContact CE1-CE1 3.51Å; F746-F796 HydrophobicContact CE1-CZ 4.34Å; F746-F796 HydrophobicContact CE2-CE1 4.24Å; F746-F796 HydrophobicContact CE2-CZ 4.31Å; F746-F796 HydrophobicContact CZ-CD1 4.04Å; F746-F796 AromaticContact CZ-CE1 3.28Å; F746-F796 HydrophobicContact CZ-CE1 3.28Å; F746-F796 AromaticContact CZ-CZ 3.74Å; F746-F796 HydrophobicContact CZ-CZ 3.74Å; I779-F796 HydrophobicContact CG2-CE1 4.25Å; W783-F796 HydrophobicContact CB-CZ 4.42Å; T784-F796 HydrophobicContact CG2-CE1 4.35Å; T784-F796 HydrophobicContact CG2-CZ 4.01Å; I788-F796 HydrophobicContact CG2-CD2 4.42Å; D792-F796 HydrophobicContact CB-CE2 4.22Å; D792-F796 WeakPolarHBondContact O-CD2 3.3Å; D792-F796 PolarHBondContact O-N 2.91Å; D792-F796 VanDerWaalsContact O-N 3.13Å; Q793-F796 PolarHBondContact O-N 3.14Å; S794-F796 VanDerWaalsContact C-N 3.33Å; S794-F796 PolarHBondContact O-N 3.4Å; F796-L799 PolarHBondContact O-N 2.86Å; F796-L799 VanDerWaalsContact O-N 3.13Å; F796-S800 PolarHBondContact O-N 3.5Å; F796-S800 PolarHBondContact O-OG 2.94Å; F796-F832 HydrophobicContact CB-CB 4.45Å; F796-F832 AromaticContact CD1-CD1 3.41Å; F796-F832 HydrophobicContact CD1-CD1 3.41Å; F796-F832 VanDerWaalsContact CD1-CD1 3.41Å; F796-F832 AromaticContact CD1-CE1 3.8Å; F796-F832 HydrophobicContact CD1-CE1 3.8Å; F796-F832 HydrophobicContact CD1-CG 4.37Å; F796-F832 AromaticContact CE1-CD1 3.63Å; F796-F832 HydrophobicContact CE1-CD1 3.63Å; F796-F832 AromaticContact CE1-CE1 3.65Å; F796-F832 HydrophobicContact CE1-CE1 3.65Å; F796-F832 AromaticContact CG-CD1 3.97Å; F796-F832 HydrophobicContact CG-CD1 3.97Å; F796-F832 HydrophobicContact CZ-CD1 4.37Å
797	E	86.6	Confident	81.3	Confident	83 Å²	83	46.9 Å²	46.9	39%	0.388	26%	0.259	S	S	.	.	H	α-helix	trans	-57.7	-41.6	-173.3	-173.6	61.7	-168.6	0	0	114.2	Q793 S794 L799 S800 G801 R804	Q793-E797 PolarHBondContact O-N 3.38Å; S794-E797 PolarHBondContact O-N 2.9Å; E797-L799 VanDerWaalsContact C-N 3.34Å; E797-L799 PolarHBondContact O-N 3.03Å; E797-S800 PolarHBondContact O-N 2.96Å; E797-G801 PolarHBondContact O-N 3.27Å; E797-R804 IonicContact OE1-CZ 3.76Å; E797-R804 IonicContact OE1-NH2 2.66Å; E797-R804 PolarHBondContact OE1-NH2 3.42Å; E797-R804 IonicContact OE2-NH2 3.57Å
798	P	87.3	Confident	82	Confident	41 Å²	41	48.6 Å²	48.6	27%	0.266	25%	0.253	S	S	.	.	H	α-helix	trans	-61.8	-39.2	176.2	-25.1	36.5	0	0	0	113.3	N751 V755 S794 G801 L802	N751-P798 HydrophobicContact CB-CG 4.48Å; V755-P798 HydrophobicContact CG1-CB 3.82Å; S794-P798 WeakPolarHBondContact O-CD 3.49Å; P798-G801 PolarHBondContact O-N 3.36Å; P798-L802 PolarHBondContact O-N 3.32Å
799	L	87.9	Confident	82.6	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-70.2	-43.6	176.4	-177.4	65.3	0	0	0	111.2	L750 T772 I779 F796 E797 G801 L802 L803 F832	L750-L799 HydrophobicContact CD2-CD2 4.5Å; T772-L799 HydrophobicContact CG2-CD1 4.23Å; I779-L799 HydrophobicContact CD1-CD2 3.66Å; F796-L799 PolarHBondContact O-N 2.86Å; F796-L799 VanDerWaalsContact O-N 3.13Å; E797-L799 VanDerWaalsContact C-N 3.34Å; E797-L799 PolarHBondContact O-N 3.03Å; L799-G801 VanDerWaalsContact C-N 3.29Å; L799-G801 PolarHBondContact O-N 3.07Å; L799-L802 WeakPolarHBondContact O-CB 3.41Å; L799-L802 PolarHBondContact O-N 3.32Å; L799-L802 VanDerWaalsContact O-N 3.16Å; L799-L803 HydrophobicContact CG-CD1 4.47Å; L799-L803 WeakPolarHBondContact O-CG 3.42Å; L799-L803 PolarHBondContact O-N 3.21Å; L799-F832 HydrophobicContact CD2-CD2 4.44Å; L799-F832 HydrophobicContact CD2-CE1 4.26Å; L799-F832 HydrophobicContact CD2-CE2 4.02Å; L799-F832 HydrophobicContact CD2-CZ 3.93Å
800	S	86.3	Confident	82.6	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.007	25%	0.252	C	S	.	.	H	α-helix	trans	-60.2	-38.2	173	-73.2	0	0	0	0	112	F796 E797 R804	F796-S800 PolarHBondContact O-N 3.5Å; F796-S800 PolarHBondContact O-OG 2.94Å; E797-S800 PolarHBondContact O-N 2.96Å; S800-R804 WeakPolarHBondContact O-CB 3.19Å; S800-R804 WeakPolarHBondContact O-CG 3.47Å; S800-R804 PolarHBondContact O-N 3.19Å; S800-R804 PolarHBondContact O-NE 2.97Å
801	G	86.7	Confident	82.1	Confident	26 Å²	26	44.1 Å²	44.1	27%	0.268	24%	0.235	S	C	.	.	H	α-helix	trans	-61	-46.2	171.7	0	0	0	0	0	112.4	E797 P798 L799 R804 R805	E797-G801 PolarHBondContact O-N 3.27Å; P798-G801 PolarHBondContact O-N 3.36Å; L799-G801 VanDerWaalsContact C-N 3.29Å; L799-G801 PolarHBondContact O-N 3.07Å; G801-R804 PolarHBondContact O-N 3.35Å; G801-R805 PolarHBondContact O-N 3.39Å
802	L	85.5	Confident	81.5	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-60.9	-49.1	175.4	-178.6	65.3	0	0	0	111.4	L758 Q759 T772 P798 L799 R804 R805 L806	L758-L802 HydrophobicContact CB-CD1 4.22Å; L758-L802 HydrophobicContact CB-CD2 3.78Å; L758-L802 HydrophobicContact CD1-CD2 3.71Å; L758-L802 HydrophobicContact CG-CD2 4.4Å; Q759-L802 HydrophobicContact CG-CD1 4.3Å; T772-L802 HydrophobicContact CG2-CD2 3.91Å; T772-L802 HydrophobicContact CG2-CG 4.42Å; P798-L802 PolarHBondContact O-N 3.32Å; L799-L802 WeakPolarHBondContact O-CB 3.41Å; L799-L802 PolarHBondContact O-N 3.32Å; L799-L802 VanDerWaalsContact O-N 3.16Å; L802-R804 VanDerWaalsContact C-N 3.33Å; L802-R804 PolarHBondContact O-N 3.07Å; L802-R805 WeakPolarHBondContact O-CB 3.33Å; L802-R805 PolarHBondContact O-N 2.63Å; L802-R805 VanDerWaalsContact O-N 3.08Å; L802-L806 HydrophobicContact CG-CD1 4.46Å; L802-L806 WeakPolarHBondContact O-CG 3.28Å; L802-L806 PolarHBondContact O-N 2.8Å
803	L	86.3	Confident	80.6	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-59.4	-40.4	177.7	-73	172	0	0	0	112.5	W769 T772 L799 R805 L806 S807 L828 L829 F832	W769-L803 HydrophobicContact CZ3-CD2 4.15Å; T772-L803 HydrophobicContact CG2-CD2 3.79Å; T772-L803 HydrophobicContact CG2-CG 4.4Å; L799-L803 HydrophobicContact CG-CD1 4.47Å; L799-L803 WeakPolarHBondContact O-CG 3.42Å; L799-L803 PolarHBondContact O-N 3.21Å; L803-R805 VanDerWaalsContact C-N 3.34Å; L803-R805 PolarHBondContact O-N 3.37Å; L803-L806 PolarHBondContact O-N 3.02Å; L803-S807 PolarHBondContact O-N 3.44Å; L803-L828 HydrophobicContact CD1-CB 4.04Å; L803-L828 HydrophobicContact CD2-CD1 4.36Å; L803-L829 HydrophobicContact CB-CD2 3.57Å; L803-L829 HydrophobicContact CB-CG 4.03Å; L803-L829 HydrophobicContact CD1-CD2 4.28Å; L803-F832 HydrophobicContact CD1-CD2 3.85Å; L803-F832 HydrophobicContact CD1-CE2 4.16Å
804	R	86.7	Confident	79.4	Confident	103 Å²	103	54.6 Å²	54.6	39%	0.389	30%	0.296	S	S	.	.	H	α-helix	trans	-62.7	-39.7	173.8	-80.2	-177.9	-72.2	-158.7	-1	112	E797 S800 G801 L802 S807 K808 L829	E797-R804 IonicContact OE1-CZ 3.76Å; E797-R804 IonicContact OE1-NH2 2.66Å; E797-R804 PolarHBondContact OE1-NH2 3.42Å; E797-R804 IonicContact OE2-NH2 3.57Å; S800-R804 WeakPolarHBondContact O-CB 3.19Å; S800-R804 WeakPolarHBondContact O-CG 3.47Å; S800-R804 PolarHBondContact O-N 3.19Å; S800-R804 PolarHBondContact O-NE 2.97Å; G801-R804 PolarHBondContact O-N 3.35Å; L802-R804 VanDerWaalsContact C-N 3.33Å; L802-R804 PolarHBondContact O-N 3.07Å; R804-S807 PolarHBondContact O-N 2.86Å; R804-K808 WeakPolarHBondContact O-CG 3.47Å; R804-K808 PolarHBondContact O-N 3.08Å; R804-K808 VanDerWaalsContact O-N 3.16Å; R804-L829 HydrophobicContact CG-CD1 4.21Å; R804-L829 HydrophobicContact CG-CD2 3.89Å
805	R	84.5	Confident	77.9	Confident	79 Å²	79	54 Å²	54	30%	0.298	30%	0.296	S	S	.	.	H	α-helix	trans	-65.1	-44.5	175.7	-170.2	176.7	67.4	165	11.9	111.5	L758 Q759 G801 L802 L803 S807 K808 T809	L758-R805 PolarHBondContact O-NH2 2.86Å; Q759-R805 VanDerWaalsContact CA-NH2 3.31Å; Q759-R805 PolarHBondContact O-NH1 3.05Å; Q759-R805 PolarHBondContact O-NH2 3.33Å; G801-R805 PolarHBondContact O-N 3.39Å; L802-R805 WeakPolarHBondContact O-CB 3.33Å; L802-R805 PolarHBondContact O-N 2.63Å; L802-R805 VanDerWaalsContact O-N 3.08Å; L803-R805 VanDerWaalsContact C-N 3.34Å; L803-R805 PolarHBondContact O-N 3.37Å; R805-S807 VanDerWaalsContact C-N 3.34Å; R805-S807 PolarHBondContact O-N 3.34Å; R805-K808 PolarHBondContact O-N 3.39Å; R805-T809 PolarHBondContact O-N 3.02Å; R805-T809 PolarHBondContact O-OG1 3.46Å; R805-T809 VanDerWaalsContact O-OG1 3.11Å
806	L	83.9	Confident	76	Confident	0 Å²	0	61 Å²	61	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-59	-45.2	175.4	-66.1	-177.4	0	0	0	111.5	V764 V768 W769 T772 L802 L803 K808 T809 L810 I825	V764-L806 HydrophobicContact CB-CD2 4.44Å; V764-L806 HydrophobicContact CG1-CD2 3.19Å; V764-L806 HydrophobicContact CG2-CD2 4.46Å; V768-L806 HydrophobicContact CB-CD2 4.44Å; V768-L806 HydrophobicContact CG1-CD2 3.81Å; W769-L806 HydrophobicContact CE3-CD1 3.98Å; T772-L806 HydrophobicContact CG2-CD1 3.85Å; L802-L806 HydrophobicContact CG-CD1 4.46Å; L802-L806 WeakPolarHBondContact O-CG 3.28Å; L802-L806 PolarHBondContact O-N 2.8Å; L803-L806 PolarHBondContact O-N 3.02Å; L806-K808 PolarHBondContact O-N 3.23Å; L806-T809 PolarHBondContact O-N 2.85Å; L806-T809 PolarHBondContact O-OG1 2.78Å; L806-T809 VanDerWaalsContact O-OG1 3.05Å; L806-L810 HydrophobicContact CB-CD1 4.04Å; L806-L810 HydrophobicContact CD2-CD1 4.44Å; L806-L810 WeakPolarHBondContact O-CB 3.27Å; L806-L810 WeakPolarHBondContact O-CD1 3.36Å; L806-L810 PolarHBondContact O-N 3.38Å; L806-I825 HydrophobicContact CB-CD1 4.45Å
807	S	83.4	Confident	74.6	Confident	37 Å²	37	63.2 Å²	63.2	26%	0.259	36%	0.357	S	S	.	.	H	α-helix	trans	-56	-47.5	176.3	-174.9	0	0	0	0	111.9	L803 R804 R805 T809 T811	L803-S807 PolarHBondContact O-N 3.44Å; R804-S807 PolarHBondContact O-N 2.86Å; R805-S807 VanDerWaalsContact C-N 3.34Å; R805-S807 PolarHBondContact O-N 3.34Å; S807-T809 VanDerWaalsContact C-N 3.32Å; S807-T809 PolarHBondContact O-N 3.41Å; S807-T811 WeakPolarHBondContact O-CB 3.36Å; S807-T811 WeakPolarHBondContact O-CG2 3.42Å; S807-T811 PolarHBondContact O-N 2.92Å; S807-T811 PolarHBondContact O-OG1 2.89Å
808	K	82.7	Confident	73.1	Confident	173 Å²	173	59.9 Å²	59.9	75%	0.752	34%	0.343	S	S	*	.	H	α-helix	trans	-63.8	-34.4	-179.3	-70.9	177.1	-178.5	-176.9	0	113.3	R804 R805 L806 T811	R804-K808 WeakPolarHBondContact O-CG 3.47Å; R804-K808 PolarHBondContact O-N 3.08Å; R804-K808 VanDerWaalsContact O-N 3.16Å; R805-K808 PolarHBondContact O-N 3.39Å; L806-K808 PolarHBondContact O-N 3.23Å; K808-T811 PolarHBondContact O-OG1 3.16Å
809	T	78.8	Confident	71.8	Confident	63 Å²	63	67.2 Å²	67.2	39%	0.387	37%	0.366	S	S	.	.	H	α-helix	trans	-87.1	-36.8	-176.6	49.7	0	0	0	0	113.4	V764 R805 L806 S807	V764-T809 HydrophobicContact CB-CG2 4.3Å; V764-T809 VanDerWaalsContact CG1-OG1 3.27Å; V764-T809 WeakPolarHBondContact CG1-OG1 3.46Å; V764-T809 HydrophobicContact CG2-CG2 4.36Å; R805-T809 PolarHBondContact O-N 3.02Å; R805-T809 PolarHBondContact O-OG1 3.46Å; R805-T809 VanDerWaalsContact O-OG1 3.11Å; L806-T809 PolarHBondContact O-N 2.85Å; L806-T809 PolarHBondContact O-OG1 2.78Å; L806-T809 VanDerWaalsContact O-OG1 3.05Å; S807-T809 VanDerWaalsContact C-N 3.32Å; S807-T809 PolarHBondContact O-N 3.41Å
810	L	72.9	Confident	71.1	Confident	13 Å²	13	72.2 Å²	72.2	7%	0.068	39%	0.392	C	S	.	.	H	α-helix	trans	-82	-31.4	-175.1	-77.4	148	0	0	0	113	W769 L806 G812 T813 V821 I825	W769-L810 HydrophobicContact CB-CD1 4.12Å; L806-L810 HydrophobicContact CB-CD1 4.04Å; L806-L810 HydrophobicContact CD2-CD1 4.44Å; L806-L810 WeakPolarHBondContact O-CB 3.27Å; L806-L810 WeakPolarHBondContact O-CD1 3.36Å; L806-L810 PolarHBondContact O-N 3.38Å; L810-G812 PolarHBondContact O-N 3.32Å; L810-G812 VanDerWaalsContact O-N 3.08Å; L810-T813 PolarHBondContact O-N 2.88Å; L810-T813 PolarHBondContact O-OG1 3.4Å; L810-V821 HydrophobicContact CD1-CG1 4.26Å; L810-I825 HydrophobicContact CD1-CD1 4.28Å
811	T	64.1	Low	70.5	Confident	77 Å²	77	73.4 Å²	73.4	47%	0.472	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-20	177.7	45.6	0	0	0	0	113.8	S807 K808 D822	S807-T811 WeakPolarHBondContact O-CB 3.36Å; S807-T811 WeakPolarHBondContact O-CG2 3.42Å; S807-T811 PolarHBondContact O-N 2.92Å; S807-T811 PolarHBondContact O-OG1 2.89Å; K808-T811 PolarHBondContact O-OG1 3.16Å; T811-D822 VanDerWaalsContact CG2-OD1 3.26Å; T811-D822 WeakPolarHBondContact CG2-OD1 3.38Å
812	G	59.2	Low	69.9	Low	63 Å²	63	74 Å²	74	65%	0.649	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-15.1	176	0	0	0	0	0	115.1	L810	L810-G812 PolarHBondContact O-N 3.32Å; L810-G812 VanDerWaalsContact O-N 3.08Å
813	T	57.3	Low	69.7	Low	76 Å²	76	80.9 Å²	80.9	47%	0.466	43%	0.426	S	S	.	.			trans	-94.8	105.4	-173.6	57.9	0	0	0	0	111.3	L810 A815 A818	L810-T813 PolarHBondContact O-N 2.88Å; L810-T813 PolarHBondContact O-OG1 3.4Å; T813-A815 PolarHBondContact O-N 3.13Å; T813-A818 WeakPolarHBondContact O-CB 3.39Å
814	K	52.4	Low	69.6	Low	214 Å²	214	86 Å²	86	93%	0.93	45%	0.448	S	S	*	.			trans	-68.1	21.5	-175.8	-65.4	-177.8	179.5	176.8	0	115.6
815	A	53.1	Low	69.4	Low	64 Å²	64	81 Å²	81	53%	0.529	43%	0.43	S	S	.	.			trans	-74.7	137.3	175.9	0	0	0	0	0	110.2	T813 G817 A818	T813-A815 PolarHBondContact O-N 3.13Å; A815-G817 PolarHBondContact O-N 3.38Å; A815-A818 VanDerWaalsContact O-CB 3.28Å; A815-A818 WeakPolarHBondContact O-CB 3.43Å; A815-A818 PolarHBondContact O-N 2.83Å
816	L	45.9	Very low	69.4	Low	166 Å²	166	80.1 Å²	80.1	87%	0.869	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-17.2	-177.5	-82.9	124.7	0	0	0	114.9
817	G	54.9	Low	69.4	Low	47 Å²	47	84.7 Å²	84.7	49%	0.485	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-25.6	171.2	0	0	0	0	0	114.9	A815 R819 N820 V821	A815-G817 PolarHBondContact O-N 3.38Å; G817-R819 PolarHBondContact O-N 2.91Å; G817-N820 PolarHBondContact O-N 3.17Å; G817-V821 PolarHBondContact O-N 3.1Å
818	A	56.2	Low	69.5	Low	12 Å²	12	83.8 Å²	83.8	10%	0.099	46%	0.459	C	S	.	.	H	α-helix	trans	-66	-34.2	-174.3	0	0	0	0	0	112.8	T813 A815 N820 V821 D822	T813-A818 WeakPolarHBondContact O-CB 3.39Å; A815-A818 VanDerWaalsContact O-CB 3.28Å; A815-A818 WeakPolarHBondContact O-CB 3.43Å; A815-A818 PolarHBondContact O-N 2.83Å; A818-N820 VanDerWaalsContact C-N 3.27Å; A818-N820 PolarHBondContact O-N 3.48Å; A818-V821 WeakPolarHBondContact O-CB 3.46Å; A818-V821 PolarHBondContact O-N 3.41Å; A818-V821 VanDerWaalsContact O-N 3.11Å; A818-D822 VanDerWaalsContact O-CG 3.27Å; A818-D822 PolarHBondContact O-N 2.92Å
819	R	60.2	Low	69.5	Low	196 Å²	196	77 Å²	77	74%	0.74	43%	0.431	S	S	*	.	H	α-helix	trans	-61.9	-32.8	177.2	-72.8	-175.3	177.5	172.9	-0.6	113.4	G817 K823	G817-R819 PolarHBondContact O-N 2.91Å; R819-K823 WeakPolarHBondContact O-CG 3.45Å; R819-K823 PolarHBondContact O-N 3.26Å
820	N	72	Confident	69.7	Low	106 Å²	106	82 Å²	82	57%	0.567	45%	0.447	S	S	*	.	H	α-helix	trans	-76.5	-37.4	175.9	-73.8	-20.7	0	0	0	111	G817 A818 K824	G817-N820 PolarHBondContact O-N 3.17Å; A818-N820 VanDerWaalsContact C-N 3.27Å; A818-N820 PolarHBondContact O-N 3.48Å; N820-K824 WeakPolarHBondContact O-CG 3.46Å; N820-K824 PolarHBondContact O-N 3.46Å
821	V	73.9	Confident	70.2	Confident	25 Å²	25	83.1 Å²	83.1	15%	0.152	45%	0.451	C	S	.	.	H	α-helix	trans	-62.2	-46.8	174.7	173.1	0	0	0	0	110.6	W769 L810 G817 A818 K823 K824 I825	W769-V821 HydrophobicContact CD2-CG1 3.66Å; W769-V821 HydrophobicContact CE3-CG1 4.19Å; W769-V821 HydrophobicContact CG-CG1 3.97Å; W769-V821 HydrophobicContact CZ2-CG1 4.11Å; L810-V821 HydrophobicContact CD1-CG1 4.26Å; G817-V821 PolarHBondContact O-N 3.1Å; A818-V821 WeakPolarHBondContact O-CB 3.46Å; A818-V821 PolarHBondContact O-N 3.41Å; A818-V821 VanDerWaalsContact O-N 3.11Å; V821-K823 PolarHBondContact O-N 2.96Å; V821-K824 WeakPolarHBondContact O-CB 3.4Å; V821-K824 PolarHBondContact O-N 2.83Å; V821-K824 VanDerWaalsContact O-N 3.14Å; V821-I825 HydrophobicContact CG1-CD1 3.61Å; V821-I825 HydrophobicContact CG1-CG1 4.2Å; V821-I825 VanDerWaalsContact O-CG1 3.28Å; V821-I825 WeakPolarHBondContact O-CG1 3.19Å; V821-I825 PolarHBondContact O-N 3.14Å
822	D	74.4	Confident	71	Confident	39 Å²	39	79.5 Å²	79.5	21%	0.209	43%	0.428	C	S	.	.	H	α-helix	trans	-61.7	-43	179.9	-68	-25.9	0	0	0	112.6	T811 A818 K824 I825 A826	T811-D822 VanDerWaalsContact CG2-OD1 3.26Å; T811-D822 WeakPolarHBondContact CG2-OD1 3.38Å; A818-D822 VanDerWaalsContact O-CG 3.27Å; A818-D822 PolarHBondContact O-N 2.92Å; D822-K824 VanDerWaalsContact C-N 3.35Å; D822-K824 PolarHBondContact O-N 3.08Å; D822-I825 PolarHBondContact O-N 3.15Å; D822-A826 WeakPolarHBondContact O-CB 3.34Å; D822-A826 PolarHBondContact O-N 3.3Å
823	K	81.6	Confident	71.6	Confident	146 Å²	146	78.8 Å²	78.8	64%	0.635	41%	0.41	S	S	*	.	H	α-helix	trans	-61.2	-44	174.3	-74.3	178.5	-179.2	-177.5	0	111.4	R819 V821 A826 T827	R819-K823 WeakPolarHBondContact O-CG 3.45Å; R819-K823 PolarHBondContact O-N 3.26Å; V821-K823 PolarHBondContact O-N 2.96Å; K823-A826 PolarHBondContact O-N 3.41Å; K823-T827 PolarHBondContact O-N 3.39Å; K823-T827 PolarHBondContact O-OG1 2.82Å
824	K	84.2	Confident	71.6	Confident	106 Å²	106	78.6 Å²	78.6	46%	0.461	41%	0.411	S	S	.	.	H	α-helix	trans	-64.2	-44.6	176.7	-76.6	-176.4	170.1	-169.1	0	111.8	W769 E773 N820 V821 D822 A826 T827 L828	W769-K824 HydrophobicContact CH2-CB 4.07Å; W769-K824 HydrophobicContact CZ2-CB 3.86Å; W769-K824 HydrophobicContact CZ2-CD 4.31Å; E773-K824 VanDerWaalsContact OE1-CD 3.26Å; E773-K824 WeakPolarHBondContact OE1-CD 3.28Å; E773-K824 WeakPolarHBondContact OE1-CE 3.07Å; E773-K824 IonicContact OE1-NZ 3.42Å; E773-K824 PolarHBondContact OE1-NZ 3.41Å; N820-K824 WeakPolarHBondContact O-CG 3.46Å; N820-K824 PolarHBondContact O-N 3.46Å; V821-K824 WeakPolarHBondContact O-CB 3.4Å; V821-K824 PolarHBondContact O-N 2.83Å; V821-K824 VanDerWaalsContact O-N 3.14Å; D822-K824 VanDerWaalsContact C-N 3.35Å; D822-K824 PolarHBondContact O-N 3.08Å; K824-A826 VanDerWaalsContact C-N 3.33Å; K824-A826 PolarHBondContact O-N 3.47Å; K824-T827 PolarHBondContact O-N 3.02Å; K824-L828 WeakPolarHBondContact O-CG 3.35Å; K824-L828 PolarHBondContact O-N 3.2Å
825	I	82	Confident	71.5	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-58.3	-46.6	175.7	-65.9	164.1	0	0	0	110.4	W769 L806 L810 V821 D822 T827 L828 L829	W769-I825 HydrophobicContact CE3-CD1 4.03Å; W769-I825 HydrophobicContact CE3-CG1 3.74Å; W769-I825 HydrophobicContact CH2-CB 4.37Å; W769-I825 HydrophobicContact CH2-CD1 4.42Å; W769-I825 HydrophobicContact CH2-CG1 3.4Å; W769-I825 HydrophobicContact CZ2-CG1 4.29Å; W769-I825 HydrophobicContact CZ3-CB 4.3Å; W769-I825 HydrophobicContact CZ3-CD1 3.92Å; W769-I825 HydrophobicContact CZ3-CG1 3.1Å; L806-I825 HydrophobicContact CB-CD1 4.45Å; L810-I825 HydrophobicContact CD1-CD1 4.28Å; V821-I825 HydrophobicContact CG1-CD1 3.61Å; V821-I825 HydrophobicContact CG1-CG1 4.2Å; V821-I825 VanDerWaalsContact O-CG1 3.28Å; V821-I825 WeakPolarHBondContact O-CG1 3.19Å; V821-I825 PolarHBondContact O-N 3.14Å; D822-I825 PolarHBondContact O-N 3.15Å; I825-T827 PolarHBondContact O-N 3.5Å; I825-L828 PolarHBondContact O-N 3.05Å; I825-L829 HydrophobicContact CG2-CD1 3.86Å; I825-L829 HydrophobicContact CG2-CG 4.23Å; I825-L829 WeakPolarHBondContact O-CB 3.28Å; I825-L829 WeakPolarHBondContact O-CG 3.43Å; I825-L829 PolarHBondContact O-N 3.38Å
826	A	83.7	Confident	71	Confident	59 Å²	59	75.8 Å²	75.8	49%	0.488	39%	0.394	S	S	.	.	H	α-helix	trans	-61.7	-42	178.2	0	0	0	0	0	112.1	D822 K823 K824 L829 K830	D822-A826 WeakPolarHBondContact O-CB 3.34Å; D822-A826 PolarHBondContact O-N 3.3Å; K823-A826 PolarHBondContact O-N 3.41Å; K824-A826 VanDerWaalsContact C-N 3.33Å; K824-A826 PolarHBondContact O-N 3.47Å; A826-L829 PolarHBondContact O-N 2.66Å; A826-K830 WeakPolarHBondContact O-CB 3.26Å; A826-K830 PolarHBondContact O-N 3.49Å
827	T	85.8	Confident	70.4	Confident	97 Å²	97	75.5 Å²	75.5	60%	0.595	39%	0.394	S	S	*	.	H	α-helix	trans	-62.5	-44.5	175.1	-59.1	0	0	0	0	111.8	K823 K824 I825 K830 R831	K823-T827 PolarHBondContact O-N 3.39Å; K823-T827 PolarHBondContact O-OG1 2.82Å; K824-T827 PolarHBondContact O-N 3.02Å; I825-T827 PolarHBondContact O-N 3.5Å; T827-K830 PolarHBondContact O-N 2.73Å; T827-R831 WeakPolarHBondContact O-CB 3.43Å; T827-R831 PolarHBondContact O-N 3.11Å
828	L	84	Confident	69.6	Low	18 Å²	18	79.9 Å²	79.9	9%	0.094	41%	0.412	C	S	.	.	H	α-helix	trans	-66.9	-41.4	177.5	-69.6	176.3	0	0	0	111.9	W769 C776 L803 K824 I825 K830 R831 F832	W769-L828 HydrophobicContact CH2-CD1 4.02Å; C776-L828 HydrophobicContact CB-CD1 3.81Å; C776-L828 HydrophobicContact CB-CD2 3.89Å; C776-L828 HydrophobicContact CB-CG 4.46Å; L803-L828 HydrophobicContact CD1-CB 4.04Å; L803-L828 HydrophobicContact CD2-CD1 4.36Å; K824-L828 WeakPolarHBondContact O-CG 3.35Å; K824-L828 PolarHBondContact O-N 3.2Å; I825-L828 PolarHBondContact O-N 3.05Å; L828-K830 VanDerWaalsContact C-N 3.3Å; L828-K830 PolarHBondContact O-N 3.04Å; L828-R831 WeakPolarHBondContact O-CB 3.31Å; L828-R831 PolarHBondContact O-N 3.49Å; L828-R831 VanDerWaalsContact O-N 3.15Å; L828-F832 HydrophobicContact CB-CD2 4.5Å; L828-F832 HydrophobicContact CB-CE2 4.34Å; L828-F832 HydrophobicContact CD2-CE2 4.29Å; L828-F832 WeakPolarHBondContact O-CD2 3.32Å; L828-F832 PolarHBondContact O-N 3.27Å
829	L	83.3	Confident	68.6	Low	29 Å²	29	85.2 Å²	85.2	15%	0.152	45%	0.448	C	S	.	.	H	α-helix	trans	-61.8	-38.9	174.1	-76.9	173.7	0	0	0	111.7	L803 R804 I825 A826 R831 N833	L803-L829 HydrophobicContact CB-CD2 3.57Å; L803-L829 HydrophobicContact CB-CG 4.03Å; L803-L829 HydrophobicContact CD1-CD2 4.28Å; R804-L829 HydrophobicContact CG-CD1 4.21Å; R804-L829 HydrophobicContact CG-CD2 3.89Å; I825-L829 HydrophobicContact CG2-CD1 3.86Å; I825-L829 HydrophobicContact CG2-CG 4.23Å; I825-L829 WeakPolarHBondContact O-CB 3.28Å; I825-L829 WeakPolarHBondContact O-CG 3.43Å; I825-L829 PolarHBondContact O-N 3.38Å; A826-L829 PolarHBondContact O-N 2.66Å; L829-R831 VanDerWaalsContact C-N 3.34Å; L829-N833 VanDerWaalsContact O-CB 3.27Å; L829-N833 WeakPolarHBondContact O-CB 3.17Å; L829-N833 PolarHBondContact O-N 3.16Å; L829-N833 VanDerWaalsContact O-N 3.09Å; L829-N833 PolarHBondContact O-ND2 2.66Å
830	K	83.7	Confident	67.5	Low	169 Å²	169	80.9 Å²	80.9	74%	0.735	45%	0.448	S	S	*	.	H	α-helix	trans	-64.3	-41	174.2	-171.6	178.8	179.6	-176.8	0	111.4	A826 T827 L828 S834	A826-K830 WeakPolarHBondContact O-CB 3.26Å; A826-K830 PolarHBondContact O-N 3.49Å; T827-K830 PolarHBondContact O-N 2.73Å; L828-K830 VanDerWaalsContact C-N 3.3Å; L828-K830 PolarHBondContact O-N 3.04Å; K830-S834 PolarHBondContact O-N 3.37Å
831	R	82.3	Confident	65.8	Low	37 Å²	37	86 Å²	86	14%	0.14	47%	0.465	C	S	.	.	H	α-helix	trans	-60.5	-45.4	177.7	179.4	-176.9	173.8	-164.7	-4.5	112.4	C776 I779 P780 T784 T827 L828 L829	C776-R831 PolarHBondContact O-NH1 3.33Å; I779-R831 PolarHBondContact O-NH2 3.06Å; P780-R831 VanDerWaalsContact C-NH2 3.25Å; P780-R831 PolarHBondContact O-NH2 3.46Å; T784-R831 HydrophobicContact CG2-CG 3.9Å; T784-R831 WeakPolarHBondContact OG1-CG 3.1Å; T784-R831 PolarHBondContact OG1-NE 3.21Å; T827-R831 WeakPolarHBondContact O-CB 3.43Å; T827-R831 PolarHBondContact O-N 3.11Å; L828-R831 WeakPolarHBondContact O-CB 3.31Å; L828-R831 PolarHBondContact O-N 3.49Å; L828-R831 VanDerWaalsContact O-N 3.15Å; L829-R831 VanDerWaalsContact C-N 3.34Å
832	F	80.8	Confident	64	Low	1 Å²	1	88.3 Å²	88.3	0%	0.004	49%	0.494	C	S	.	.	H	α-helix	trans	-87.5	-15.1	-175.8	-64.1	-63.9	0	0	0	114.9	C776 I779 T784 F796 L799 L803 L828	C776-F832 HydrophobicContact CB-CE2 4.26Å; C776-F832 HydrophobicContact CB-CZ 4.38Å; I779-F832 HydrophobicContact CD1-CE1 3.94Å; I779-F832 HydrophobicContact CD1-CZ 3.89Å; I779-F832 HydrophobicContact CG2-CE1 4.2Å; T784-F832 HydrophobicContact CG2-CD1 3.66Å; T784-F832 HydrophobicContact CG2-CE1 3.63Å; F796-F832 HydrophobicContact CB-CB 4.45Å; F796-F832 AromaticContact CD1-CD1 3.41Å; F796-F832 HydrophobicContact CD1-CD1 3.41Å; F796-F832 VanDerWaalsContact CD1-CD1 3.41Å; F796-F832 AromaticContact CD1-CE1 3.8Å; F796-F832 HydrophobicContact CD1-CE1 3.8Å; F796-F832 HydrophobicContact CD1-CG 4.37Å; F796-F832 AromaticContact CE1-CD1 3.63Å; F796-F832 HydrophobicContact CE1-CD1 3.63Å; F796-F832 AromaticContact CE1-CE1 3.65Å; F796-F832 HydrophobicContact CE1-CE1 3.65Å; F796-F832 AromaticContact CG-CD1 3.97Å; F796-F832 HydrophobicContact CG-CD1 3.97Å; F796-F832 HydrophobicContact CZ-CD1 4.37Å; L799-F832 HydrophobicContact CD2-CD2 4.44Å; L799-F832 HydrophobicContact CD2-CE1 4.26Å; L799-F832 HydrophobicContact CD2-CE2 4.02Å; L799-F832 HydrophobicContact CD2-CZ 3.93Å; L803-F832 HydrophobicContact CD1-CD2 3.85Å; L803-F832 HydrophobicContact CD1-CE2 4.16Å; L828-F832 HydrophobicContact CB-CD2 4.5Å; L828-F832 HydrophobicContact CB-CE2 4.34Å; L828-F832 HydrophobicContact CD2-CE2 4.29Å; L828-F832 WeakPolarHBondContact O-CD2 3.32Å; L828-F832 PolarHBondContact O-N 3.27Å
833	N	72.7	Confident	62	Low	48 Å²	48	95.6 Å²	95.6	26%	0.257	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	12.3	-178.6	-66.8	-64.7	0	0	0	114.2	L829 A835	L829-N833 VanDerWaalsContact O-CB 3.27Å; L829-N833 WeakPolarHBondContact O-CB 3.17Å; L829-N833 PolarHBondContact O-N 3.16Å; L829-N833 VanDerWaalsContact O-N 3.09Å; L829-N833 PolarHBondContact O-ND2 2.66Å; N833-A835 PolarHBondContact O-N 3.24Å
834	S	57.5	Low	60	Low	71 Å²	71	99 Å²	99	50%	0.497	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.9	68.9	-173.7	-168.1	0	0	0	0	113.1	K830	K830-S834 PolarHBondContact O-N 3.37Å
835	A	48.5	Very low	58.8	Low	39 Å²	39	98.7 Å²	98.7	32%	0.322	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	-147.2	-3.4	171.8	0	0	0	0	0	114.6	I788 N833	I788-A835 HydrophobicContact CB-CB 4.5Å; N833-A835 PolarHBondContact O-N 3.24Å
836	K	42.8	Very low	57.5	Low	180 Å²	180	103.9 Å²	103.9	78%	0.783	60%	0.595	S	S	*	*	S	Bend	trans	-93.5	3.5	-174.3	-72.1	-166.9	176.2	-173.7	0	116.9
837	N	34.9	Very low	56.1	Low	160 Å²	160	106.4 Å²	106.4	86%	0.856	60%	0.601	S	S	*	*	S	Bend	trans	-114.1	12.8	-169.9	-90.3	7.5	0	0	0	117
838	T	36.9	Very low	54.3	Low	140 Å²	140	106.9 Å²	106.9	86%	0.859	60%	0.602	S	S	*	*	S	Bend	trans	-111.9	3.8	-178.5	51.1	0	0	0	0	115.7
839	S	35.7	Very low	52.5	Low	124 Å²	124	112.5 Å²	112.5	87%	0.867	63%	0.633	S	S	*	*	S	Bend	trans	-108.5	14.9	-175.6	-166.6	0	0	0	0	115.9
840	S	36.8	Very low	50.4	Low	105 Å²	105	118.1 Å²	118.1	73%	0.734	67%	0.665	S	S	*	*	S	Bend	trans	-135	24.4	-175	84.6	0	0	0	0	116.2
841	K	36.3	Very low	48	Very low	212 Å²	212	114.4 Å²	114.4	92%	0.922	66%	0.661	S	S	*	*	S	Bend	trans	-139.5	43.4	179.5	-78.8	-166.4	173.2	-174.5	0	113.8
842	G	35.4	Very low	45.4	Very low	75 Å²	75	120.4 Å²	120.4	77%	0.773	70%	0.701	S	S	*	*			trans	-147.2	39.5	-178.9	0	0	0	0	0	113.9
843	E	34.2	Very low	42.5	Very low	192 Å²	192	130.3 Å²	130.3	90%	0.897	76%	0.759	S	S	*	*			trans	-140.4	84.1	167.3	-78.3	-175.5	158.2	0	0	108.2
844	T	37.9	Very low	39.7	Very low	218 Å²	218	137.8 Å²	137.8	100%	1.337	80%	0.804	S	S	*	*			trans	-160.9	0	154.4	38.4	0	0	0	0	108.2

Retrieved 844 of 844 residues in 240.4 ms (Link to these results)

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