A0A3Q0KSH8_SCHMA Loading...

Transient receptor potential channel,putative

AlphaFold DB , UniProt , Accession A0A3Q0KSH8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,147 aa.

						>A0A3Q0KSH8_SCHMA|A0A3Q0KSH8
MSLHNNIYSNKSSQLNNSSQCNNSHSVGLSQYKPYLNMITNYEFHNRFPQSQSKEVLKQYSGEFESLGDETRFYQGYQLSMSDLKKATTASKQTAGCLFTNFEDVRLTDEERVYLNAAATGDIGIIRMSLEDTDESADFNVNCVDYMGRNALHLAVDSENTEVMELLLDKLNFECIEEALLHAISKGHPKLVRVIIEHPNYQAGEDQIKRMDSRNAFFRTTEKSQFSPDITPLILSAHYNNHEMVQMFLSRNHTIDKPHSISCQCNDCQVRQDYDSLKRSRSRLNAYRALASPAYMALSSPDPIMTTFQLRQEMMKLAEIEKEFKKEYLMLVEKCMNFACEMMDLCRGTQEVEAVISDFLEDGTNIRDPLGRLRLAIRFEEKKFVAHPNCQQYLTSIWYGSETAFLQSWSLIRKIGLSIAATPLLPLFCLIYIILPTSNIARSMRCPAAKFATHVVSHFLFLILLAAATFRLEENYDALLDEQMLGTGDEETIRQWVQKNFRPSKAIITHVQICIVLWVAGLLLADIKHIYFAGFRSYICNAYNLLNFCILSMYIGSYTLRIIVDRWVRESDLFFNATTQVNFLLQTNNSILVHQMVQNWTQSCHHDKSYFITASRFRWKYDDPEIVSDVMFAVANVVSFARTTYLMPAFEALGPLQISFTRMLTDITRFMVLYLLVLFAFMVGLHNLYWYYGLQTFKIYDEATNTTQTLVATEMFEGLRHTLYSLFWSMFSQVSISKLPIRKPDQAEHKYTDGMIDTDSPTTIVDSVGMVLFAVYHGIIIIVLVNMLIAMMSHSFESIQEDCDVEWKFARTQLWLNYIDNGSTLPVPFNVIPTPHSVANAMKFMRNIFKDEVGFVSGNIRSTDFVKVRRDKVVKDKDLTIQETSHSDIMQRLVRRYLFKMERENDDKDKYKELPYVRTEDMTGNMEAFLNAYGDPNQTVQFADAEEFPPSVTAVGGKTTYENPQNPYQLSVQSGAPTINTNQSSCKRLKKQTYSVGRRCSSSVGNMTIGGAGCLLGGLNLQLPQLDAIQRMQKILDMRLQNLQAQSDQLNYASGNARIKEEISHVRQLISESQKALSCIVKAVSQMQDQVVQLNTNMEQWILAQASGREIRTVFMEERKSSTKSRDRHRRDRRERDREWDSFVREA
					

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Loading PAE data...

(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	32.7	Very low	32.1	Very low	253 Å²	253	161.3 Å²	161.3	100%	1.246	82%	0.819	S	S	*	*				0	113.3	0	-132.9	159.6	177.6	0	0	106.7
2	S	26.4	Very low	31.7	Very low	105 Å²	105	156.6 Å²	156.6	73%	0.734	81%	0.812	S	S	*	*			trans	-72.2	147	-165.3	51.9	0	0	0	0	114.1
3	L	34.4	Very low	31.6	Very low	153 Å²	153	152.6 Å²	152.6	80%	0.801	81%	0.806	S	S	*	*			trans	140.9	110.9	140.4	-78.1	155.1	0	0	0	110.8
4	H	38.2	Very low	31.6	Very low	174 Å²	174	154.1 Å²	154.1	81%	0.806	81%	0.806	S	S	*	*				156.2	120.4	96.4	-136.4	-81.5	0	0	0	111
5	N	32.8	Very low	31.6	Very low	136 Å²	136	155.4 Å²	155.4	73%	0.727	81%	0.813	S	S	*	*			trans	-77.8	164.6	169.7	-95.3	-26.8	0	0	0	111.5
6	N	32	Very low	31.5	Very low	143 Å²	143	154.7 Å²	154.7	77%	0.765	81%	0.81	S	S	*	*			trans	77.1	125.8	161.2	-62.2	-26.4	0	0	0	115.4
7	I	33.3	Very low	31.5	Very low	142 Å²	142	154.2 Å²	154.2	73%	0.728	81%	0.809	S	S	*	*				175.3	133.7	115.5	-89.3	162.3	0	0	0	112.1
8	Y	33.7	Very low	31.6	Very low	219 Å²	219	152 Å²	152	86%	0.859	81%	0.808	S	S	*	*			trans	85.6	101.4	159.9	-67.6	-51.6	0	0	0	123.1
9	S	28.2	Very low	31.6	Very low	92 Å²	92	149.5 Å²	149.5	64%	0.643	80%	0.804	S	S	*	*			trans	-79.5	172.3	150.7	98.2	0	0	0	0	111.8
10	N	29.5	Very low	31.4	Very low	144 Å²	144	151.3 Å²	151.3	77%	0.77	81%	0.807	S	S	*	*			trans	86	105.5	161.6	-73.1	-18.6	0	0	0	119.2
11	K	32.4	Very low	31.2	Very low	213 Å²	213	150.6 Å²	150.6	93%	0.926	81%	0.813	S	S	*	*				-170.2	105.3	113.5	-102.9	170.2	-178.5	-179.8	0	111.9
12	S	26.3	Very low	31	Very low	105 Å²	105	145.6 Å²	145.6	73%	0.734	79%	0.791	S	S	*	*			trans	-80.1	148.8	155.3	47.2	0	0	0	0	109.6
13	S	30.9	Very low	31.1	Very low	105 Å²	105	148 Å²	148	73%	0.734	80%	0.796	S	S	*	*				155.9	133.3	129.4	53.9	0	0	0	0	114.1
14	Q	31.1	Very low	30.9	Very low	174 Å²	174	146.1 Å²	146.1	81%	0.813	80%	0.795	S	S	*	*			trans	75.9	110.1	148.2	-68.4	178	13	0	0	120
15	L	32.4	Very low	30.5	Very low	173 Å²	173	146.4 Å²	146.4	91%	0.906	80%	0.797	S	S	*	*				-173.5	117.4	101.4	-95.2	152.2	0	0	0	111.7
16	N	29.1	Very low	30.2	Very low	144 Å²	144	144.4 Å²	144.4	77%	0.77	79%	0.793	S	S	*	*			trans	-72.4	142.7	166.3	-76.2	-26.9	0	0	0	110.7
17	N	32.6	Very low	30.1	Very low	147 Å²	147	145 Å²	145	79%	0.786	80%	0.801	S	S	*	*				164.2	138.9	112.6	-89.4	-21.8	0	0	0	113.5
18	S	32.1	Very low	29.9	Very low	114 Å²	114	141.6 Å²	141.6	80%	0.797	80%	0.802	S	S	*	*			trans	63.5	132.2	156.2	57.3	0	0	0	0	117.7
19	S	32.3	Very low	29.5	Very low	105 Å²	105	139.9 Å²	139.9	73%	0.734	81%	0.806	S	S	*	*			cis	-173.3	135.9	15.5	37.8	0	0	0	0	109.1
20	Q	27.1	Very low	29.5	Very low	185 Å²	185	140.3 Å²	140.3	86%	0.864	81%	0.81	S	S	*	*			trans	27.9	115.8	146.7	-71.5	173.6	-23.6	0	0	119.7
21	C	28.6	Very low	29.4	Very low	137 Å²	137	142.5 Å²	142.5	93%	0.926	82%	0.815	S	S	*	*				-163	132.9	120.5	-103.6	0	0	0	0	110.5
22	N	27	Very low	29.2	Very low	147 Å²	147	142.6 Å²	142.6	79%	0.786	81%	0.811	S	S	*	*			trans	-75.5	168.4	-168.6	-71.6	-31.7	0	0	0	114.7
23	N	28.7	Very low	29.3	Very low	156 Å²	156	146.8 Å²	146.8	83%	0.834	82%	0.816	S	S	*	*			trans	91.2	88	157.9	-58.3	-15.7	0	0	0	117.8
24	S	30.7	Very low	29.3	Very low	113 Å²	113	146.8 Å²	146.8	79%	0.79	81%	0.814	S	S	*	*				174.3	111.3	107.6	56.7	0	0	0	0	111.3
25	H	30	Very low	29.1	Very low	181 Å²	181	147.1 Å²	147.1	84%	0.838	81%	0.809	S	S	*	*			trans	-7.2	116.7	153.6	-69.9	-86.9	0	0	0	116.1
26	S	25.6	Very low	28.9	Very low	94 Å²	94	146.2 Å²	146.2	66%	0.657	80%	0.804	S	S	*	*				70.8	131.3	72.1	75.8	0	0	0	0	114.9
27	V	31	Very low	28.9	Very low	154 Å²	154	146.7 Å²	146.7	93%	0.933	81%	0.807	S	S	*	*			trans	103.7	116.5	175.7	-174.7	0	0	0	0	112.5
28	G	29.2	Very low	28.7	Very low	71 Å²	71	146.3 Å²	146.3	73%	0.732	80%	0.802	S	S	*	*			cis	-169.1	138.1	-1.9	0	0	0	0	0	109.3
29	L	24.2	Very low	28.6	Very low	183 Å²	183	147.8 Å²	147.8	96%	0.958	80%	0.799	S	S	*	*			trans	-68.2	129	173.5	-83.8	97.3	0	0	0	110.9
30	S	29.6	Very low	28.5	Very low	102 Å²	102	147.8 Å²	147.8	71%	0.713	80%	0.795	S	S	*	*			trans	-144.6	102.5	144	69.3	0	0	0	0	111.6
31	Q	27.3	Very low	28.5	Very low	189 Å²	189	146.4 Å²	146.4	88%	0.883	79%	0.794	S	S	*	*			trans	38.2	83.9	143.9	-64.5	-179.7	-4.8	0	0	118.9
32	Y	27	Very low	28.5	Very low	215 Å²	215	149.1 Å²	149.1	84%	0.843	79%	0.786	S	S	*	*			trans	-91.1	100.9	149.1	-91.8	-95.9	0	0	0	109
33	K	28.9	Very low	28.6	Very low	193 Å²	193	150.6 Å²	150.6	84%	0.839	79%	0.788	S	S	*	*			trans	-94.2	141.6	162.9	-106.4	-180	178.5	175.7	0	108.5
34	P	30.8	Very low	28.5	Very low	106 Å²	106	153.6 Å²	153.6	69%	0.688	79%	0.794	S	S	*	*			trans	-77.6	147.4	-155.2	31.1	-35.6	0	0	0	113.5	L36	P34-L36 VanDerWaalsContact C-N 3.34Å; P34-L36 PolarHBondContact O-N 2.99Å
35	Y	27.4	Very low	28.4	Very low	180 Å²	180	156.4 Å²	156.4	71%	0.706	79%	0.794	S	S	*	*			trans	-62.4	86	169.7	-79.1	-98.8	0	0	0	110.7	M38	Y35-M38 HydrophobicContact CD1-SD 4.27Å; Y35-M38 HydrophobicContact CE1-SD 4.09Å
36	L	27.6	Very low	28.2	Very low	155 Å²	155	154.4 Å²	154.4	81%	0.812	79%	0.79	S	S	*	*			trans	-127.4	22.5	171.4	-143.9	91.4	0	0	0	114.2	P34	P34-L36 VanDerWaalsContact C-N 3.34Å; P34-L36 PolarHBondContact O-N 2.99Å
37	N	28.7	Very low	28.3	Very low	153 Å²	153	161.5 Å²	161.5	82%	0.818	80%	0.802	S	S	*	*	S	Bend	trans	-136.8	15.9	177.1	-87.7	-25.8	0	0	0	115
38	M	29.3	Very low	27.9	Very low	139 Å²	139	163.9 Å²	163.9	69%	0.685	80%	0.8	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	34.9	-176.2	-145.8	179.3	-160.7	0	0	114.2	Y35	Y35-M38 HydrophobicContact CD1-SD 4.27Å; Y35-M38 HydrophobicContact CE1-SD 4.09Å
39	I	30.1	Very low	28	Very low	145 Å²	145	166.3 Å²	166.3	74%	0.744	80%	0.803	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.1	5.3	178.5	-63.8	-179.8	0	0	0	113.1	R536	I39-R536 PolarHBondContact O-NH1 3.15Å
40	T	28.6	Very low	28.1	Very low	106 Å²	106	166.1 Å²	166.1	65%	0.65	80%	0.797	S	S	*	*	S	Bend	trans	-110.9	6.7	-175.6	50.3	0	0	0	0	116.8
41	N	27.3	Very low	27.9	Very low	155 Å²	155	165.8 Å²	165.8	83%	0.829	80%	0.795	S	S	*	*			trans	-123.3	68.4	179.5	-70.9	-21.1	0	0	0	112.1
42	Y	30.1	Very low	28.1	Very low	194 Å²	194	165.3 Å²	165.3	76%	0.761	79%	0.793	S	S	*	*			trans	-124.6	71.7	159.3	-112.5	-80.3	0	0	0	105.9
43	E	27.9	Very low	28.1	Very low	178 Å²	178	159.7 Å²	159.7	83%	0.832	79%	0.785	S	S	*	*			trans	-162.1	80.1	172.4	-111.2	171.1	-150.9	0	0	107.7	H45	E43-H45 PolarHBondContact O-N 3.03Å
44	F	26.8	Very low	28	Very low	220 Å²	220	159.7 Å²	159.7	97%	0.965	79%	0.785	S	S	*	*			trans	-92.6	79	163.2	-123.1	-87.7	0	0	0	107.2
45	H	29.2	Very low	27.9	Very low	172 Å²	172	163.5 Å²	163.5	80%	0.796	79%	0.794	S	S	*	*			trans	-106.9	113.3	162.9	-122.5	-70.1	0	0	0	108.2	E43 R47	E43-H45 PolarHBondContact O-N 3.03Å; H45-R47 PolarHBondContact O-N 3.22Å
46	N	26.1	Very low	28.1	Very low	138 Å²	138	162.1 Å²	162.1	74%	0.738	80%	0.804	S	S	*	*			trans	-7.9	117.4	161	-70.9	-26.4	0	0	0	116
47	R	26.3	Very low	28	Very low	243 Å²	243	162.2 Å²	162.2	92%	0.917	80%	0.804	S	S	*	*			trans	-175.1	127.5	130.4	-102.6	173	-130.9	-143.8	4.7	111	H45	H45-R47 PolarHBondContact O-N 3.22Å
48	F	23.9	Very low	27.9	Very low	205 Å²	205	163.8 Å²	163.8	90%	0.899	80%	0.804	S	S	*	*			trans	-41.4	155.4	167	-78.4	-96.4	0	0	0	113.6
49	P	30.1	Very low	27.8	Very low	122 Å²	122	165.9 Å²	165.9	79%	0.792	81%	0.812	S	S	*	*			trans	-135.2	136.7	131.7	30.9	-15	0	0	0	113.9
50	Q	26.8	Very low	27.8	Very low	179 Å²	179	170.1 Å²	170.1	84%	0.836	82%	0.82	S	S	*	*			trans	-61.6	140.7	161.2	-71.8	169.3	-31.5	0	0	110.4
51	S	26	Very low	27.6	Very low	95 Å²	95	171 Å²	171	66%	0.664	83%	0.831	S	S	*	*			trans	30.1	120.6	143.9	66.6	0	0	0	0	119.4
52	Q	31.3	Very low	27.6	Very low	178 Å²	178	167.1 Å²	167.1	83%	0.832	83%	0.828	S	S	*	*				168.7	122.4	108.4	-92.5	178.1	7.8	0	0	112.1
53	S	27.4	Very low	27.5	Very low	98 Å²	98	167 Å²	167	69%	0.685	83%	0.834	S	S	*	*			trans	49.4	117.8	138.2	60.1	0	0	0	0	122.4
54	K	27.1	Very low	27.6	Very low	192 Å²	192	168.3 Å²	168.3	84%	0.835	84%	0.837	S	S	*	*				37.5	115.5	121.6	-66.4	-177.5	175.8	-179.5	0	118.1
55	E	28.8	Very low	27.5	Very low	187 Å²	187	166.5 Å²	166.5	87%	0.874	83%	0.832	S	S	*	*				155.2	128.2	121.4	-87.9	175.4	178.5	0	0	109.3
56	V	30.9	Very low	27.5	Very low	151 Å²	151	163.1 Å²	163.1	92%	0.915	83%	0.828	S	S	*	*			trans	166.6	102.5	133.3	170.1	0	0	0	0	107.4
57	L	25.4	Very low	27.6	Very low	157 Å²	157	165 Å²	165	82%	0.822	84%	0.836	S	S	*	*			trans	-123.7	123.4	171.9	-163.6	151.2	0	0	0	105
58	K	26.6	Very low	27.7	Very low	186 Å²	186	156.8 Å²	156.8	81%	0.809	83%	0.828	S	S	*	*			trans	144.8	108.1	156.7	-85.7	172.3	179.1	-179	0	111.5
59	Q	27	Very low	27.8	Very low	183 Å²	183	154.8 Å²	154.8	86%	0.855	83%	0.827	S	S	*	*				177.3	152.6	126.3	-100.6	169.7	-25.3	0	0	109.3
60	Y	29.6	Very low	27.7	Very low	233 Å²	233	158.3 Å²	158.3	91%	0.914	83%	0.833	S	S	*	*			trans	93.3	70.8	-173.8	-59.5	-77.3	0	0	0	116.5
61	S	25.3	Very low	27.6	Very low	125 Å²	125	156.3 Å²	156.3	87%	0.874	83%	0.833	S	S	*	*			trans	-121.7	124.9	148.6	55.5	0	0	0	0	107.6
62	G	27.5	Very low	27.6	Very low	74 Å²	74	162.7 Å²	162.7	76%	0.763	84%	0.842	S	S	*	*			trans	173.1	117.7	173.1	0	0	0	0	0	113
63	E	27.2	Very low	27.4	Very low	191 Å²	191	162 Å²	162	89%	0.893	84%	0.837	S	S	*	*			trans	81.9	93.4	156.9	-58.7	178	177.4	0	0	119
64	F	29.4	Very low	27.3	Very low	206 Å²	206	169 Å²	169	90%	0.904	85%	0.85	S	S	*	*				-165.1	105.4	108.3	-126.2	-98	0	0	0	110.5
65	E	26.2	Very low	27.3	Very low	181 Å²	181	167.5 Å²	167.5	85%	0.846	85%	0.846	S	S	*	*			trans	-86.3	135.7	161.8	-78.5	178.1	142.1	0	0	109.2
66	S	27.6	Very low	27.2	Very low	102 Å²	102	162.4 Å²	162.4	71%	0.713	84%	0.844	S	S	*	*				155.9	142.6	122.3	55.9	0	0	0	0	112.7
67	L	28.8	Very low	27	Very low	176 Å²	176	165.5 Å²	165.5	92%	0.921	84%	0.84	S	S	*	*			trans	74	111.4	-172.9	-77.7	82.2	0	0	0	114.2
68	G	28.1	Very low	27.2	Very low	72 Å²	72	167 Å²	167	74%	0.742	84%	0.843	S	S	*	*			cis	143.7	120.1	14.8	0	0	0	0	0	106.9
69	D	26.7	Very low	27.8	Very low	163 Å²	163	164.6 Å²	164.6	87%	0.872	84%	0.839	S	S	*	*			trans	62.4	93.8	169.9	-68.3	-21.8	0	0	0	119.7
70	E	28.6	Very low	28	Very low	196 Å²	196	158 Å²	158	92%	0.916	81%	0.813	S	S	*	*				-174.6	118.6	97.2	-93.9	-165.7	168.1	0	0	109.5
71	T	24.9	Very low	28.3	Very low	136 Å²	136	153.8 Å²	153.8	83%	0.834	80%	0.803	S	S	*	*			trans	-94	122.8	179.7	38.7	0	0	0	0	109.4
72	R	25.5	Very low	29	Very low	230 Å²	230	151 Å²	151	87%	0.868	78%	0.784	S	S	*	*			trans	-178	132.4	140.8	-106.1	164.5	-167.2	-168.1	4.9	114.8
73	F	26.8	Very low	29.9	Very low	164 Å²	164	150.8 Å²	150.8	72%	0.719	77%	0.765	S	S	*	*			trans	77.9	80.6	159.5	-71.3	-76.8	0	0	0	120.1
74	Y	25	Very low	30.7	Very low	245 Å²	245	146.5 Å²	146.5	96%	0.961	75%	0.748	S	S	*	*			trans	-109.5	109.7	138.7	-89.6	-88.3	0	0	0	108.5
75	Q	27	Very low	31.3	Very low	159 Å²	159	143.4 Å²	143.4	74%	0.743	73%	0.734	S	S	*	*			trans	-137.4	113.8	162.2	-127.1	170.4	-1	0	0	107.3
76	G	26.1	Very low	32	Very low	81 Å²	81	141.5 Å²	141.5	84%	0.835	72%	0.723	S	S	*	*			trans	-61.6	136	-176.5	0	0	0	0	0	112
77	Y	28.3	Very low	32.8	Very low	215 Å²	215	139.6 Å²	139.6	84%	0.843	71%	0.713	S	S	*	*			trans	-105.1	105.2	165.7	-87.1	-89.7	0	0	0	108.9	L79	Y77-L79 PolarHBondContact O-N 3.37Å
78	Q	29.2	Very low	33.4	Very low	190 Å²	190	134.5 Å²	134.5	89%	0.888	69%	0.69	S	S	*	*			trans	-62.8	111.9	152.1	-77.5	178.1	-50.4	0	0	106.6	S80	Q78-S80 PolarHBondContact O-N 3.38Å; Q78-S80 VanDerWaalsContact O-N 3.1Å
79	L	38.1	Very low	34	Very low	135 Å²	135	134.9 Å²	134.9	71%	0.707	68%	0.677	S	S	*	*			trans	-60.6	117.9	172	-105.5	96.4	0	0	0	108.7	Y77 D83	Y77-L79 PolarHBondContact O-N 3.37Å; L79-D83 HydrophobicContact CD2-CB 4.29Å
80	S	33.1	Very low	34.6	Very low	44 Å²	44	129.9 Å²	129.9	31%	0.308	66%	0.659	S	S	.	*			trans	-70	147.2	178.6	74	0	0	0	0	110	Q78 S82 D83 L84	Q78-S80 PolarHBondContact O-N 3.38Å; Q78-S80 VanDerWaalsContact O-N 3.1Å; S80-S82 WeakPolarHBondContact CB-OG 3.46Å; S80-S82 PolarHBondContact O-N 3.29Å; S80-S82 PolarHBondContact OG-OG 3.19Å; S80-D83 PolarHBondContact O-N 3.14Å; S80-D83 VanDerWaalsContact OG-CG 3.26Å; S80-D83 PolarHBondContact OG-N 2.84Å; S80-D83 PolarHBondContact OG-OD2 3.14Å; S80-L84 PolarHBondContact O-N 3.4Å
81	M	34.6	Very low	35.1	Very low	145 Å²	145	123.2 Å²	123.2	71%	0.714	63%	0.634	S	S	*	*	H	α-helix	trans	-55.4	-19.5	174.1	-163.7	73.6	100.5	0	0	112.2	L84 K85	M81-L84 HydrophobicContact SD-CD2 4.5Å; M81-K85 WeakPolarHBondContact O-CB 3.23Å; M81-K85 WeakPolarHBondContact O-CG 3.25Å; M81-K85 PolarHBondContact O-N 3.02Å
82	S	41	Very low	35.6	Very low	67 Å²	67	124.3 Å²	124.3	47%	0.469	63%	0.627	S	S	.	*	H	α-helix	trans	-71.6	-35.5	171.8	23	0	0	0	0	114	S80 K85 K86	S80-S82 WeakPolarHBondContact CB-OG 3.46Å; S80-S82 PolarHBondContact O-N 3.29Å; S80-S82 PolarHBondContact OG-OG 3.19Å; S82-K85 PolarHBondContact O-N 3.26Å; S82-K86 WeakPolarHBondContact O-CG 3.11Å; S82-K86 PolarHBondContact O-N 3.48Å
83	D	45.5	Very low	36.1	Very low	69 Å²	69	121.9 Å²	121.9	37%	0.369	63%	0.625	S	S	.	*	H	α-helix	trans	-77.2	-35.7	179	-58.6	-43.8	0	0	0	110.7	L79 S80 K85 K86 A87	L79-D83 HydrophobicContact CD2-CB 4.29Å; S80-D83 PolarHBondContact O-N 3.14Å; S80-D83 VanDerWaalsContact OG-CG 3.26Å; S80-D83 PolarHBondContact OG-N 2.84Å; S80-D83 PolarHBondContact OG-OD2 3.14Å; D83-K85 VanDerWaalsContact C-N 3.33Å; D83-K86 PolarHBondContact O-N 3.41Å; D83-A87 WeakPolarHBondContact O-CB 3.28Å; D83-A87 PolarHBondContact O-N 3.33Å
84	L	43.4	Very low	36.4	Very low	101 Å²	101	119 Å²	119	53%	0.529	62%	0.622	S	S	.	*	H	α-helix	trans	-65	-38.2	169	-158.8	75.8	0	0	0	111.3	S80 M81 T88	S80-L84 PolarHBondContact O-N 3.4Å; M81-L84 HydrophobicContact SD-CD2 4.5Å; L84-T88 WeakPolarHBondContact O-CB 3.42Å; L84-T88 PolarHBondContact O-N 3.17Å; L84-T88 PolarHBondContact O-OG1 3.39Å
85	K	42.5	Very low	36.7	Very low	141 Å²	141	109.8 Å²	109.8	61%	0.613	60%	0.596	S	S	*	*	H	α-helix	trans	-65.7	-38.1	171.6	-88	-178.1	178	180	0	112.6	M81 S82 D83 T88 T89	M81-K85 WeakPolarHBondContact O-CB 3.23Å; M81-K85 WeakPolarHBondContact O-CG 3.25Å; M81-K85 PolarHBondContact O-N 3.02Å; S82-K85 PolarHBondContact O-N 3.26Å; D83-K85 VanDerWaalsContact C-N 3.33Å; K85-T88 VanDerWaalsContact CA-OG1 3.26Å; K85-T88 WeakPolarHBondContact CA-OG1 3.22Å; K85-T88 CarbonylContact O-C 3.47Å; K85-T88 PolarHBondContact O-N 3.31Å; K85-T88 PolarHBondContact O-OG1 3.45Å; K85-T89 WeakPolarHBondContact O-CB 3.34Å; K85-T89 VanDerWaalsContact O-CG2 3.26Å; K85-T89 WeakPolarHBondContact O-CG2 3.34Å; K85-T89 PolarHBondContact O-N 2.83Å; K85-T89 PolarHBondContact O-OG1 3.48Å
86	K	41.9	Very low	36.7	Very low	140 Å²	140	105.5 Å²	105.5	61%	0.609	59%	0.594	S	S	*	*	H	α-helix	trans	-67.3	-42	175.6	-78.9	175.6	-179.3	177.1	0	112	S82 D83 T89 A90	S82-K86 WeakPolarHBondContact O-CG 3.11Å; S82-K86 PolarHBondContact O-N 3.48Å; D83-K86 PolarHBondContact O-N 3.41Å; K86-T89 VanDerWaalsContact CA-OG1 3.3Å; K86-T89 WeakPolarHBondContact CA-OG1 3.26Å; K86-T89 PolarHBondContact O-N 3.38Å; K86-T89 PolarHBondContact O-OG1 2.77Å; K86-T89 VanDerWaalsContact O-OG1 3.08Å; K86-A90 VanDerWaalsContact O-CB 3.31Å; K86-A90 WeakPolarHBondContact O-CB 3.31Å; K86-A90 PolarHBondContact O-N 2.99Å
87	A	43.6	Very low	37	Very low	63 Å²	63	105.4 Å²	105.4	52%	0.521	58%	0.58	S	S	.	*	H	α-helix	trans	-65.4	-40.2	172.9	0	0	0	0	0	111.8	D83 S91	D83-A87 WeakPolarHBondContact O-CB 3.28Å; D83-A87 PolarHBondContact O-N 3.33Å; A87-S91 WeakPolarHBondContact O-CB 3.07Å; A87-S91 PolarHBondContact O-N 3.39Å
88	T	41	Very low	36.9	Very low	69 Å²	69	101.9 Å²	101.9	42%	0.423	58%	0.575	S	S	.	*	H	α-helix	trans	-74.3	-24.1	173.4	35.8	0	0	0	0	113.8	L84 K85 K92	L84-T88 WeakPolarHBondContact O-CB 3.42Å; L84-T88 PolarHBondContact O-N 3.17Å; L84-T88 PolarHBondContact O-OG1 3.39Å; K85-T88 VanDerWaalsContact CA-OG1 3.26Å; K85-T88 WeakPolarHBondContact CA-OG1 3.22Å; K85-T88 CarbonylContact O-C 3.47Å; K85-T88 PolarHBondContact O-N 3.31Å; K85-T88 PolarHBondContact O-OG1 3.45Å; T88-K92 VanDerWaalsContact O-CB 3.3Å; T88-K92 WeakPolarHBondContact O-CB 3.28Å; T88-K92 WeakPolarHBondContact O-CG 3.08Å; T88-K92 PolarHBondContact O-N 2.86Å
89	T	40.6	Very low	36.9	Very low	79 Å²	79	102.6 Å²	102.6	49%	0.485	58%	0.576	S	S	.	*	H	α-helix	trans	-82.3	-35.1	173.8	50.1	0	0	0	0	112.6	K85 K86 S91 K92 Q93	K85-T89 WeakPolarHBondContact O-CB 3.34Å; K85-T89 VanDerWaalsContact O-CG2 3.26Å; K85-T89 WeakPolarHBondContact O-CG2 3.34Å; K85-T89 PolarHBondContact O-N 2.83Å; K85-T89 PolarHBondContact O-OG1 3.48Å; K86-T89 VanDerWaalsContact CA-OG1 3.3Å; K86-T89 WeakPolarHBondContact CA-OG1 3.26Å; K86-T89 PolarHBondContact O-N 3.38Å; K86-T89 PolarHBondContact O-OG1 2.77Å; K86-T89 VanDerWaalsContact O-OG1 3.08Å; T89-S91 VanDerWaalsContact C-N 3.29Å; T89-K92 PolarHBondContact O-N 3.32Å; T89-Q93 PolarHBondContact O-N 3.03Å; T89-Q93 VanDerWaalsContact O-N 3.1Å
90	A	40.5	Very low	36.7	Very low	58 Å²	58	99.9 Å²	99.9	48%	0.479	57%	0.565	S	S	.	*	H	α-helix	trans	-65	-37.4	168.1	0	0	0	0	0	110.7	K86 T94	K86-A90 VanDerWaalsContact O-CB 3.31Å; K86-A90 WeakPolarHBondContact O-CB 3.31Å; K86-A90 PolarHBondContact O-N 2.99Å; A90-T94 PolarHBondContact O-OG1 3Å; A90-T94 VanDerWaalsContact O-OG1 3.05Å
91	S	39.2	Very low	36.6	Very low	56 Å²	56	102.4 Å²	102.4	39%	0.392	58%	0.575	S	S	.	*	H	α-helix	trans	-68.3	-34.1	168.8	173.2	0	0	0	0	112.6	A87 T89 Q93 T94 A95	A87-S91 WeakPolarHBondContact O-CB 3.07Å; A87-S91 PolarHBondContact O-N 3.39Å; T89-S91 VanDerWaalsContact C-N 3.29Å; S91-Q93 PolarHBondContact O-N 3.42Å; S91-T94 VanDerWaalsContact CA-OG1 3.31Å; S91-T94 WeakPolarHBondContact CA-OG1 3.38Å; S91-T94 CarbonylContact O-C 3.57Å; S91-T94 PolarHBondContact O-N 3.24Å; S91-T94 VanDerWaalsContact O-N 3.08Å; S91-T94 PolarHBondContact O-OG1 3.46Å; S91-A95 WeakPolarHBondContact O-CA 3.47Å; S91-A95 WeakPolarHBondContact O-CB 3.45Å; S91-A95 PolarHBondContact O-N 3.08Å
92	K	34.4	Very low	37	Very low	159 Å²	159	104.1 Å²	104.1	69%	0.691	58%	0.579	S	S	*	*	H	α-helix	trans	-72.2	-22.7	177	-83.8	173.1	177.9	-174.3	0	114.6	T88 T89 T94	T88-K92 VanDerWaalsContact O-CB 3.3Å; T88-K92 WeakPolarHBondContact O-CB 3.28Å; T88-K92 WeakPolarHBondContact O-CG 3.08Å; T88-K92 PolarHBondContact O-N 2.86Å; T89-K92 PolarHBondContact O-N 3.32Å; K92-T94 VanDerWaalsContact C-N 3.26Å
93	Q	35.7	Very low	37	Very low	179 Å²	179	108.4 Å²	108.4	84%	0.836	59%	0.591	S	S	*	*	H	α-helix	trans	-75.5	-17.6	168.3	-77.8	179.1	-23.5	0	0	112.5	T89 S91	T89-Q93 PolarHBondContact O-N 3.03Å; T89-Q93 VanDerWaalsContact O-N 3.1Å; S91-Q93 PolarHBondContact O-N 3.42Å
94	T	33.2	Very low	37	Very low	104 Å²	104	111.2 Å²	111.2	64%	0.638	61%	0.606	S	S	*	*	H	α-helix	trans	-104.7	-10	174.5	41.1	0	0	0	0	113.3	A90 S91 K92 G96	A90-T94 PolarHBondContact O-OG1 3Å; A90-T94 VanDerWaalsContact O-OG1 3.05Å; S91-T94 VanDerWaalsContact CA-OG1 3.31Å; S91-T94 WeakPolarHBondContact CA-OG1 3.38Å; S91-T94 CarbonylContact O-C 3.57Å; S91-T94 PolarHBondContact O-N 3.24Å; S91-T94 VanDerWaalsContact O-N 3.08Å; S91-T94 PolarHBondContact O-OG1 3.46Å; K92-T94 VanDerWaalsContact C-N 3.26Å; T94-G96 VanDerWaalsContact C-N 3.34Å; T94-G96 PolarHBondContact O-N 3.44Å
95	A	31.6	Very low	37.6	Very low	51 Å²	51	110 Å²	110	42%	0.421	60%	0.603	S	S	.	*	T	Hydrogen-bonded Turn	trans	-89.6	16.6	-176.9	0	0	0	0	0	114.8	S91	S91-A95 WeakPolarHBondContact O-CA 3.47Å; S91-A95 WeakPolarHBondContact O-CB 3.45Å; S91-A95 PolarHBondContact O-N 3.08Å
96	G	28.3	Very low	38.4	Very low	69 Å²	69	114.2 Å²	114.2	71%	0.711	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.1	1	166.8	0	0	0	0	0	114.3	T94	T94-G96 VanDerWaalsContact C-N 3.34Å; T94-G96 PolarHBondContact O-N 3.44Å
97	C	31.3	Very low	39.8	Very low	80 Å²	80	108.8 Å²	108.8	54%	0.541	59%	0.592	S	S	.	*			trans	-115.7	30.6	-165.2	-159.8	0	0	0	0	113	F99 T100	C97-F99 PolarHBondContact O-N 3.49Å; C97-F99 VanDerWaalsContact O-N 3.16Å; C97-T100 WeakPolarHBondContact CA-OG1 3.3Å; C97-T100 PolarHBondContact SG-OG1 3.27Å
98	L	27.2	Very low	41.5	Very low	140 Å²	140	108.6 Å²	108.6	73%	0.733	59%	0.585	S	S	*	*	S	Bend	trans	-77.5	97.7	169.2	-83.3	161.2	0	0	0	107.3
99	F	28.7	Very low	43.5	Very low	205 Å²	205	111.2 Å²	111.2	90%	0.899	60%	0.596	S	S	*	*	S	Bend	trans	82	21.4	-176.9	-75	-87.8	0	0	0	119	C97 N101	C97-F99 PolarHBondContact O-N 3.49Å; C97-F99 VanDerWaalsContact O-N 3.16Å; F99-N101 PolarHBondContact O-N 2.93Å
100	T	32.8	Very low	45.5	Very low	79 Å²	79	113.1 Å²	113.1	49%	0.485	60%	0.6	S	S	.	*			trans	-95.1	98.5	173.4	58.6	0	0	0	0	112.3	C97	C97-T100 WeakPolarHBondContact CA-OG1 3.3Å; C97-T100 PolarHBondContact SG-OG1 3.27Å
101	N	32.5	Very low	47.6	Very low	96 Å²	96	111.3 Å²	111.3	51%	0.513	58%	0.581	S	S	.	*			trans	57.6	104.5	141.5	-62.8	-5.1	0	0	0	119.5	F99 E103	F99-N101 PolarHBondContact O-N 2.93Å; N101-E103 HydrophobicContact CB-CB 4.14Å; N101-E103 PolarHBondContact O-N 3.39Å
102	F	41.5	Very low	49.9	Very low	182 Å²	182	113.9 Å²	113.9	80%	0.798	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	9.8	151.8	-82.2	-89.8	0	0	0	113.9	Y146	F102-Y146 WeakPolarHBondContact CD1-O 3.42Å
103	E	41.5	Very low	52.4	Low	157 Å²	157	110 Å²	110	73%	0.734	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	-5.8	-178.4	-66.4	178.6	143	0	0	114.1	N101	N101-E103 HydrophobicContact CB-CB 4.14Å; N101-E103 PolarHBondContact O-N 3.39Å
104	D	45.8	Very low	55	Low	127 Å²	127	101.5 Å²	101.5	68%	0.679	53%	0.532	S	S	*	.			trans	-109.1	14.3	-173.4	-78.7	-26.1	0	0	0	116	R106	D104-R106 VanDerWaalsContact C-N 3.28Å; D104-R106 PolarHBondContact O-N 2.65Å; D104-R106 VanDerWaalsContact O-N 3.08Å
105	V	55.3	Low	57.6	Low	75 Å²	75	96.8 Å²	96.8	46%	0.455	50%	0.503	S	S	.	.			trans	-82.9	80.5	163.9	-167.1	0	0	0	0	108.2	L107	V105-L107 HydrophobicContact CB-CD1 4.28Å; V105-L107 HydrophobicContact CG1-CD1 3.58Å; V105-L107 HydrophobicContact CG1-CG 4.07Å; V105-L107 PolarHBondContact O-N 3.45Å
106	R	59.2	Low	60.3	Low	230 Å²	230	99 Å²	99	87%	0.868	51%	0.508	S	S	*	.			trans	-73.7	84.9	166.2	-74.3	-173.6	177.3	177.5	-0.5	108.4	D104 T108	D104-R106 VanDerWaalsContact C-N 3.28Å; D104-R106 PolarHBondContact O-N 2.65Å; D104-R106 VanDerWaalsContact O-N 3.08Å; R106-T108 PolarHBondContact O-N 3.31Å
107	L	71.9	Confident	63.2	Low	26 Å²	26	95.9 Å²	95.9	14%	0.136	48%	0.475	C	S	.	.			trans	-59.4	132.3	165.7	-71.8	98.9	0	0	0	108.6	V105 E111 L115	V105-L107 HydrophobicContact CB-CD1 4.28Å; V105-L107 HydrophobicContact CG1-CD1 3.58Å; V105-L107 HydrophobicContact CG1-CG 4.07Å; V105-L107 PolarHBondContact O-N 3.45Å; L107-E111 WeakPolarHBondContact CA-OE2 3.47Å; L107-E111 HydrophobicContact CB-CB 4.32Å; L107-E111 HydrophobicContact CD2-CB 4.21Å; L107-L115 HydrophobicContact CD2-CD1 3.34Å; L107-L115 HydrophobicContact CD2-CG 4.42Å
108	T	80.2	Confident	65.9	Low	60 Å²	60	92.1 Å²	92.1	37%	0.368	45%	0.45	S	S	.	.			trans	-61.6	156.2	165.4	61.3	0	0	0	0	109.4	R106 E110 E111 R112	R106-T108 PolarHBondContact O-N 3.31Å; T108-E110 PolarHBondContact O-N 2.91Å; T108-E111 PolarHBondContact N-OE2 3.27Å; T108-E111 PolarHBondContact O-N 3.39Å; T108-E111 WeakPolarHBondContact OG1-CB 3.42Å; T108-E111 VanDerWaalsContact OG1-CD 3.28Å; T108-E111 WeakPolarHBondContact OG1-CG 3.33Å; T108-E111 PolarHBondContact OG1-N 3.49Å; T108-E111 VanDerWaalsContact OG1-N 3.1Å; T108-E111 PolarHBondContact OG1-OE2 3.25Å; T108-R112 PolarHBondContact O-N 3.48Å
109	D	81.2	Confident	68.8	Low	124 Å²	124	87.6 Å²	87.6	66%	0.663	43%	0.432	S	S	*	.	H	α-helix	trans	-62.1	-32	177.8	-68.4	-26.5	0	0	0	111.1	R112 V113	D109-R112 PolarHBondContact O-N 2.76Å; D109-R112 IonicContact OD1-NH1 3.91Å; D109-R112 PolarHBondContact OD1-NH1 3.47Å; D109-V113 VanDerWaalsContact O-CG2 3.3Å; D109-V113 WeakPolarHBondContact O-CG2 3.28Å; D109-V113 PolarHBondContact O-N 3.01Å
110	E	83	Confident	71.5	Confident	118 Å²	118	83.1 Å²	83.1	55%	0.551	42%	0.422	S	S	*	.	H	α-helix	trans	-64.3	-48.2	172.6	-65.7	177.4	-174.8	0	0	112.3	T108 R112 V113 Y114 F139	T108-E110 PolarHBondContact O-N 2.91Å; E110-R112 VanDerWaalsContact C-N 3.29Å; E110-R112 PolarHBondContact O-N 3.49Å; E110-V113 PolarHBondContact O-N 3.31Å; E110-Y114 WeakPolarHBondContact O-CB 3.38Å; E110-Y114 PolarHBondContact O-N 3.34Å; E110-F139 HydrophobicContact CB-CD2 4.14Å; E110-F139 HydrophobicContact CB-CE2 4.4Å
111	E	85.8	Confident	74	Confident	20 Å²	20	80 Å²	80	9%	0.093	41%	0.405	C	S	.	.	H	α-helix	trans	-61.5	-36.7	175.2	-73.9	166.9	157.2	0	0	112.1	L107 T108 Y114 L115 F139 N140 C143	L107-E111 WeakPolarHBondContact CA-OE2 3.47Å; L107-E111 HydrophobicContact CB-CB 4.32Å; L107-E111 HydrophobicContact CD2-CB 4.21Å; T108-E111 PolarHBondContact N-OE2 3.27Å; T108-E111 PolarHBondContact O-N 3.39Å; T108-E111 WeakPolarHBondContact OG1-CB 3.42Å; T108-E111 VanDerWaalsContact OG1-CD 3.28Å; T108-E111 WeakPolarHBondContact OG1-CG 3.33Å; T108-E111 PolarHBondContact OG1-N 3.49Å; T108-E111 VanDerWaalsContact OG1-N 3.1Å; T108-E111 PolarHBondContact OG1-OE2 3.25Å; E111-Y114 PolarHBondContact O-N 3.47Å; E111-L115 WeakPolarHBondContact O-CG 3.47Å; E111-L115 PolarHBondContact O-N 3.38Å; E111-F139 HydrophobicContact CG-CD2 4.07Å; E111-F139 HydrophobicContact CG-CE2 4.04Å; E111-N140 WeakPolarHBondContact OE1-CB 3.32Å; E111-N140 PolarHBondContact OE1-N 3.36Å; E111-C143 HydrophobicContact CB-CB 4.32Å; E111-C143 HydrophobicContact CG-CB 4Å
112	R	86.3	Confident	76.7	Confident	111 Å²	111	78.7 Å²	78.7	42%	0.419	40%	0.398	S	S	.	.	H	α-helix	trans	-66.9	-41.9	176.3	-172.2	-179.7	-67.8	102.7	5.4	111.5	T108 D109 E110 N116	T108-R112 PolarHBondContact O-N 3.48Å; D109-R112 PolarHBondContact O-N 2.76Å; D109-R112 IonicContact OD1-NH1 3.91Å; D109-R112 PolarHBondContact OD1-NH1 3.47Å; E110-R112 VanDerWaalsContact C-N 3.29Å; E110-R112 PolarHBondContact O-N 3.49Å; R112-N116 VanDerWaalsContact O-CB 3.29Å; R112-N116 WeakPolarHBondContact O-CB 3.37Å; R112-N116 PolarHBondContact O-N 3.19Å; R112-N116 PolarHBondContact O-ND2 2.83Å
113	V	87.8	Confident	78.8	Confident	77 Å²	77	72.2 Å²	72.2	47%	0.467	37%	0.372	S	S	.	.	H	α-helix	trans	-63.5	-43.9	174.8	170.8	0	0	0	0	110.4	D109 E110 N116 A117 I125	D109-V113 VanDerWaalsContact O-CG2 3.3Å; D109-V113 WeakPolarHBondContact O-CG2 3.28Å; D109-V113 PolarHBondContact O-N 3.01Å; E110-V113 PolarHBondContact O-N 3.31Å; V113-N116 PolarHBondContact O-N 2.91Å; V113-A117 VanDerWaalsContact O-CB 3.31Å; V113-A117 WeakPolarHBondContact O-CB 3.46Å; V113-A117 PolarHBondContact O-N 3.21Å; V113-I125 HydrophobicContact CG1-CG2 3.89Å
114	Y	89.3	Confident	80.9	Confident	0 Å²	0	67 Å²	67	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-60.2	-48.8	176.6	167	-110.6	0	0	0	113	E110 E111 N116 A117 A118 I126 L130 F139 V141 A151 L167	E110-Y114 WeakPolarHBondContact O-CB 3.38Å; E110-Y114 PolarHBondContact O-N 3.34Å; E111-Y114 PolarHBondContact O-N 3.47Å; Y114-N116 PolarHBondContact O-N 3.31Å; Y114-A117 PolarHBondContact O-N 3.49Å; Y114-A118 PolarHBondContact O-N 3.05Å; Y114-I126 HydrophobicContact CE2-CG2 4.28Å; Y114-L130 HydrophobicContact CE2-CD2 4.5Å; Y114-F139 HydrophobicContact CD1-CE2 4.42Å; Y114-F139 AromaticContact CD1-CZ 3.76Å; Y114-F139 HydrophobicContact CD1-CZ 3.76Å; Y114-F139 AromaticContact CD2-CZ 3.94Å; Y114-F139 HydrophobicContact CD2-CZ 3.94Å; Y114-F139 HydrophobicContact CE1-CZ 4.26Å; Y114-F139 HydrophobicContact CE2-CZ 4.45Å; Y114-F139 HydrophobicContact CG-CE2 4.21Å; Y114-F139 AromaticContact CG-CZ 3.55Å; Y114-F139 HydrophobicContact CG-CZ 3.55Å; Y114-V141 PolarHBondContact OH-O 2.93Å; Y114-A151 HydrophobicContact CD1-CB 4.47Å; Y114-A151 HydrophobicContact CE1-CB 3.55Å; Y114-A151 HydrophobicContact CE2-CB 4.45Å; Y114-A151 WeakPolarHBondContact OH-CB 3.21Å; Y114-L167 HydrophobicContact CE2-CD2 4.02Å; Y114-L167 WeakPolarHBondContact OH-CD2 3.46Å
115	L	87.9	Confident	82.8	Confident	6 Å²	6	63.6 Å²	63.6	3%	0.031	34%	0.341	C	S	.	.	H	α-helix	trans	-66.4	-37.8	177.5	-70	-178.9	0	0	0	112.2	L107 E111 A118 A119 D145 A151 L154	L107-L115 HydrophobicContact CD2-CD1 3.34Å; L107-L115 HydrophobicContact CD2-CG 4.42Å; E111-L115 WeakPolarHBondContact O-CG 3.47Å; E111-L115 PolarHBondContact O-N 3.38Å; L115-A118 PolarHBondContact O-N 2.9Å; L115-A119 PolarHBondContact O-N 3.44Å; L115-D145 HydrophobicContact CD1-CB 4.1Å; L115-A151 HydrophobicContact CD2-CB 3.97Å; L115-L154 HydrophobicContact CB-CD1 3.97Å; L115-L154 HydrophobicContact CD2-CD1 4.04Å; L115-L154 VanDerWaalsContact O-CD1 3.31Å; L115-L154 WeakPolarHBondContact O-CD1 3.4Å
116	N	88.5	Confident	84.4	Confident	98 Å²	98	60 Å²	60	52%	0.524	32%	0.32	S	S	.	.	H	α-helix	trans	-64.7	-41.1	174.3	-75.6	-17.1	0	0	0	111.4	R112 V113 Y114 A119 T120	R112-N116 VanDerWaalsContact O-CB 3.29Å; R112-N116 WeakPolarHBondContact O-CB 3.37Å; R112-N116 PolarHBondContact O-N 3.19Å; R112-N116 PolarHBondContact O-ND2 2.83Å; V113-N116 PolarHBondContact O-N 2.91Å; Y114-N116 PolarHBondContact O-N 3.31Å; N116-A119 WeakPolarHBondContact O-CB 3.33Å; N116-A119 PolarHBondContact O-N 3.27Å; N116-T120 PolarHBondContact O-N 3.27Å; N116-T120 PolarHBondContact O-OG1 3.15Å
117	A	89.1	Confident	85.7	Confident	3 Å²	3	54.7 Å²	54.7	3%	0.025	30%	0.3	C	S	.	.	H	α-helix	trans	-64	-39.5	175.4	0	0	0	0	0	112	V113 Y114 A119 T120 G121 D122 I125 I126	V113-A117 VanDerWaalsContact O-CB 3.31Å; V113-A117 WeakPolarHBondContact O-CB 3.46Å; V113-A117 PolarHBondContact O-N 3.21Å; Y114-A117 PolarHBondContact O-N 3.49Å; A117-A119 VanDerWaalsContact C-N 3.31Å; A117-A119 PolarHBondContact O-N 2.74Å; A117-T120 WeakPolarHBondContact CA-OG1 3.31Å; A117-T120 PolarHBondContact O-N 3.47Å; A117-T120 PolarHBondContact O-OG1 3.36Å; A117-G121 PolarHBondContact O-N 3.28Å; A117-D122 HydrophobicContact CB-CB 4.38Å; A117-D122 PolarHBondContact O-N 3.23Å; A117-I125 HydrophobicContact CB-CB 3.83Å; A117-I125 HydrophobicContact CB-CD1 4.46Å; A117-I125 HydrophobicContact CB-CG2 3.66Å; A117-I126 HydrophobicContact CB-CG1 3.92Å
118	A	88.5	Confident	86.3	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-63.3	-36	172.7	0	0	0	0	0	112.5	Y114 L115 I126 A151 L154	Y114-A118 PolarHBondContact O-N 3.05Å; L115-A118 PolarHBondContact O-N 2.9Å; A118-I126 HydrophobicContact CB-CD1 4.22Å; A118-A151 HydrophobicContact CB-CB 3.97Å; A118-L154 HydrophobicContact CB-CB 4.32Å
119	A	87.8	Confident	86.5	Confident	45 Å²	45	56.2 Å²	56.2	37%	0.372	31%	0.305	S	S	.	.	H	α-helix	trans	-71.8	-37.4	176.1	0	0	0	0	0	113.2	L115 N116 A117 L154 S158	L115-A119 PolarHBondContact O-N 3.44Å; N116-A119 WeakPolarHBondContact O-CB 3.33Å; N116-A119 PolarHBondContact O-N 3.27Å; A117-A119 VanDerWaalsContact C-N 3.31Å; A117-A119 PolarHBondContact O-N 2.74Å; A119-L154 HydrophobicContact CB-CB 4.25Å; A119-L154 HydrophobicContact CB-CD1 4.33Å; A119-L154 HydrophobicContact CB-CD2 4.43Å; A119-S158 WeakPolarHBondContact O-CB 3.41Å
120	T	86.4	Confident	86.5	Confident	111 Å²	111	50.9 Å²	50.9	68%	0.681	28%	0.276	S	S	*	.	H	α-helix	trans	-81.7	-19.3	177.3	55.7	0	0	0	0	113.2	N116 A117	N116-T120 PolarHBondContact O-N 3.27Å; N116-T120 PolarHBondContact O-OG1 3.15Å; A117-T120 WeakPolarHBondContact CA-OG1 3.31Å; A117-T120 PolarHBondContact O-N 3.47Å; A117-T120 PolarHBondContact O-OG1 3.36Å
121	G	85	Confident	86.5	Confident	13 Å²	13	50.8 Å²	50.8	13%	0.134	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.4	24.9	-176.4	0	0	0	0	0	113.9	A117 I123 N160	A117-G121 PolarHBondContact O-N 3.28Å; G121-I123 PolarHBondContact O-N 3.27Å; G121-I123 VanDerWaalsContact O-N 3.17Å; G121-N160 PolarHBondContact O-ND2 2.85Å
122	D	88	Confident	85.9	Confident	69 Å²	69	53.2 Å²	53.2	37%	0.369	29%	0.289	S	S	.	.			trans	-79	98.1	178.7	-169.4	-20.4	0	0	0	111.3	A117 G124 I125 I126	A117-D122 HydrophobicContact CB-CB 4.38Å; A117-D122 PolarHBondContact O-N 3.23Å; D122-G124 VanDerWaalsContact C-N 3.26Å; D122-G124 PolarHBondContact O-N 3.09Å; D122-G124 PolarHBondContact OD1-N 3.28Å; D122-I125 HydrophobicContact CB-CD1 4.37Å; D122-I125 PolarHBondContact OD1-N 3.04Å; D122-I125 WeakPolarHBondContact OD2-CD1 3.46Å; D122-I125 WeakPolarHBondContact OD2-CG1 3.48Å; D122-I126 WeakPolarHBondContact O-CD1 3.33Å; D122-I126 VanDerWaalsContact O-CG1 3.25Å; D122-I126 WeakPolarHBondContact O-CG1 3.43Å; D122-I126 PolarHBondContact O-N 2.8Å
123	I	86.7	Confident	85	Confident	47 Å²	47	49.4 Å²	49.4	24%	0.241	28%	0.279	C	S	.	.	H	α-helix	trans	-62.9	-32.2	-178.4	-61.7	160.5	0	0	0	112	G121 R127 E162 V163 L166	G121-I123 PolarHBondContact O-N 3.27Å; G121-I123 VanDerWaalsContact O-N 3.17Å; I123-R127 VanDerWaalsContact O-CB 3.3Å; I123-R127 WeakPolarHBondContact O-CB 3.44Å; I123-R127 PolarHBondContact O-N 3.24Å; I123-E162 HydrophobicContact CD1-CB 3.9Å; I123-E162 WeakPolarHBondContact CD1-OE2 3.25Å; I123-V163 HydrophobicContact CG1-CG2 3.62Å; I123-L166 HydrophobicContact CG2-CD1 3.64Å
124	G	85.5	Confident	83.9	Confident	48 Å²	48	51.5 Å²	51.5	50%	0.495	29%	0.287	S	S	.	.	H	α-helix	trans	-67.6	-48.8	-175.3	0	0	0	0	0	111.6	D122 M128	D122-G124 VanDerWaalsContact C-N 3.26Å; D122-G124 PolarHBondContact O-N 3.09Å; D122-G124 PolarHBondContact OD1-N 3.28Å; G124-M128 WeakPolarHBondContact O-CB 3.3Å; G124-M128 PolarHBondContact O-N 3.43Å; G124-M128 VanDerWaalsContact O-N 3.08Å
125	I	86	Confident	82.7	Confident	54 Å²	54	59.9 Å²	59.9	28%	0.277	33%	0.327	S	S	.	.	H	α-helix	trans	-65.9	-43.4	178.5	-61.6	175.4	0	0	0	110.5	V113 A117 D122 R127 M128 S129	V113-I125 HydrophobicContact CG1-CG2 3.89Å; A117-I125 HydrophobicContact CB-CB 3.83Å; A117-I125 HydrophobicContact CB-CD1 4.46Å; A117-I125 HydrophobicContact CB-CG2 3.66Å; D122-I125 HydrophobicContact CB-CD1 4.37Å; D122-I125 PolarHBondContact OD1-N 3.04Å; D122-I125 WeakPolarHBondContact OD2-CD1 3.46Å; D122-I125 WeakPolarHBondContact OD2-CG1 3.48Å; I125-R127 PolarHBondContact O-N 3.15Å; I125-M128 PolarHBondContact O-N 3.36Å; I125-S129 PolarHBondContact O-N 2.92Å; I125-S129 PolarHBondContact O-OG 3.32Å; I125-S129 VanDerWaalsContact O-OG 3.1Å
126	I	87.4	Confident	81.4	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-62.3	-44.9	-179.8	-66	168.7	0	0	0	111	Y114 A117 A118 D122 M128 S129 L130 V163 L167	Y114-I126 HydrophobicContact CE2-CG2 4.28Å; A117-I126 HydrophobicContact CB-CG1 3.92Å; A118-I126 HydrophobicContact CB-CD1 4.22Å; D122-I126 WeakPolarHBondContact O-CD1 3.33Å; D122-I126 VanDerWaalsContact O-CG1 3.25Å; D122-I126 WeakPolarHBondContact O-CG1 3.43Å; D122-I126 PolarHBondContact O-N 2.8Å; I126-M128 VanDerWaalsContact C-N 3.35Å; I126-M128 PolarHBondContact O-N 3.23Å; I126-S129 PolarHBondContact O-N 3.15Å; I126-L130 HydrophobicContact CG2-CD1 3.8Å; I126-L130 HydrophobicContact CG2-CG 4.31Å; I126-L130 WeakPolarHBondContact O-CB 3.38Å; I126-L130 WeakPolarHBondContact O-CG 3.3Å; I126-L130 PolarHBondContact O-N 2.88Å; I126-V163 HydrophobicContact CD1-CB 4.32Å; I126-V163 HydrophobicContact CD1-CG1 3.41Å; I126-V163 VanDerWaalsContact CD1-CG1 3.41Å; I126-V163 HydrophobicContact CD1-CG2 3.94Å; I126-L167 HydrophobicContact CG2-CD2 4Å
127	R	87.3	Confident	80.2	Confident	118 Å²	118	61.8 Å²	61.8	45%	0.445	35%	0.354	S	S	.	.	H	α-helix	trans	-60.3	-46.2	176.5	-178.6	-176.6	-61.6	-87.3	-3.3	111.2	I123 I125 L130 E131	I123-R127 VanDerWaalsContact O-CB 3.3Å; I123-R127 WeakPolarHBondContact O-CB 3.44Å; I123-R127 PolarHBondContact O-N 3.24Å; I125-R127 PolarHBondContact O-N 3.15Å; R127-L130 PolarHBondContact O-N 3.31Å; R127-E131 HydrophobicContact CG-CG 4.45Å; R127-E131 VanDerWaalsContact CG-OE1 3.23Å; R127-E131 WeakPolarHBondContact CG-OE1 3.38Å; R127-E131 WeakPolarHBondContact O-CB 3.48Å; R127-E131 WeakPolarHBondContact O-CG 3.4Å; R127-E131 PolarHBondContact O-N 3.04Å
128	M	84.9	Confident	79.3	Confident	103 Å²	103	68.8 Å²	68.8	51%	0.507	39%	0.391	S	S	.	.	H	α-helix	trans	-59.1	-49.7	177.2	-170.6	176.4	71.5	0	0	111	G124 I125 I126 L130 E131 D132	G124-M128 WeakPolarHBondContact O-CB 3.3Å; G124-M128 PolarHBondContact O-N 3.43Å; G124-M128 VanDerWaalsContact O-N 3.08Å; I125-M128 PolarHBondContact O-N 3.36Å; I126-M128 VanDerWaalsContact C-N 3.35Å; I126-M128 PolarHBondContact O-N 3.23Å; M128-L130 VanDerWaalsContact C-N 3.31Å; M128-L130 PolarHBondContact O-N 3.16Å; M128-E131 PolarHBondContact O-N 3.38Å; M128-D132 WeakPolarHBondContact O-CB 3.24Å; M128-D132 PolarHBondContact O-N 3.45Å
129	S	83.2	Confident	78.7	Confident	15 Å²	15	69.5 Å²	69.5	11%	0.105	40%	0.395	C	S	.	.	H	α-helix	trans	-61.9	-34.4	177.6	-58.2	0	0	0	0	113.5	I125 I126 T133	I125-S129 PolarHBondContact O-N 2.92Å; I125-S129 PolarHBondContact O-OG 3.32Å; I125-S129 VanDerWaalsContact O-OG 3.1Å; I126-S129 PolarHBondContact O-N 3.15Å; S129-T133 PolarHBondContact O-N 3.24Å; S129-T133 VanDerWaalsContact O-N 3.1Å; S129-T133 PolarHBondContact O-OG1 2.92Å
130	L	82.8	Confident	78.3	Confident	13 Å²	13	71 Å²	71	7%	0.068	40%	0.396	C	S	.	.	H	α-helix	trans	-74.5	-32.6	176.8	-71.5	173	0	0	0	113	Y114 I126 R127 M128 T133 V141 K170	Y114-L130 HydrophobicContact CE2-CD2 4.5Å; I126-L130 HydrophobicContact CG2-CD1 3.8Å; I126-L130 HydrophobicContact CG2-CG 4.31Å; I126-L130 WeakPolarHBondContact O-CB 3.38Å; I126-L130 WeakPolarHBondContact O-CG 3.3Å; I126-L130 PolarHBondContact O-N 2.88Å; R127-L130 PolarHBondContact O-N 3.31Å; M128-L130 VanDerWaalsContact C-N 3.31Å; M128-L130 PolarHBondContact O-N 3.16Å; L130-T133 WeakPolarHBondContact O-CB 3.2Å; L130-V141 HydrophobicContact CD2-CG1 3.87Å; L130-V141 HydrophobicContact CD2-CG2 4.45Å; L130-K170 HydrophobicContact CD2-CB 4.1Å; L130-K170 HydrophobicContact CD2-CG 4.21Å
131	E	81.1	Confident	78.1	Confident	115 Å²	115	66.4 Å²	66.4	54%	0.537	37%	0.368	S	S	.	.	H	α-helix	trans	-71.8	-42.3	172.2	-72.6	172	-171	0	0	110.3	R127 M128 T133 D134	R127-E131 HydrophobicContact CG-CG 4.45Å; R127-E131 VanDerWaalsContact CG-OE1 3.23Å; R127-E131 WeakPolarHBondContact CG-OE1 3.38Å; R127-E131 WeakPolarHBondContact O-CB 3.48Å; R127-E131 WeakPolarHBondContact O-CG 3.4Å; R127-E131 PolarHBondContact O-N 3.04Å; M128-E131 PolarHBondContact O-N 3.38Å; E131-T133 PolarHBondContact O-N 3.49Å; E131-D134 WeakPolarHBondContact O-CB 3.31Å; E131-D134 PolarHBondContact O-N 2.78Å; E131-D134 VanDerWaalsContact O-N 3.09Å
132	D	73.8	Confident	77.8	Confident	71 Å²	71	67.4 Å²	67.4	38%	0.38	37%	0.37	S	S	.	.	H	α-helix	trans	-63.7	-27.1	176.6	-66.6	-21.7	0	0	0	112.5	M128 D134 E135 S136	M128-D132 WeakPolarHBondContact O-CB 3.24Å; M128-D132 PolarHBondContact O-N 3.45Å; D132-D134 PolarHBondContact O-N 3.02Å; D132-E135 CarbonylContact O-C 3.48Å; D132-E135 WeakPolarHBondContact O-CA 3.1Å; D132-E135 PolarHBondContact O-N 2.99Å; D132-S136 PolarHBondContact O-N 3.1Å; D132-S136 PolarHBondContact O-OG 3.48Å
133	T	68.6	Low	77.5	Confident	32 Å²	32	64.4 Å²	64.4	20%	0.196	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-32	174.7	-52.5	0	0	0	0	111.9	S129 L130 E131 E135 F139 V141	S129-T133 PolarHBondContact O-N 3.24Å; S129-T133 VanDerWaalsContact O-N 3.1Å; S129-T133 PolarHBondContact O-OG1 2.92Å; L130-T133 WeakPolarHBondContact O-CB 3.2Å; E131-T133 PolarHBondContact O-N 3.49Å; T133-E135 PolarHBondContact O-N 3.46Å; T133-F139 HydrophobicContact CG2-CD1 4.17Å; T133-F139 WeakPolarHBondContact OG1-CD1 3.47Å; T133-F139 WeakPolarHBondContact OG1-CE1 3.21Å; T133-V141 HydrophobicContact CG2-CG2 3.53Å
134	D	64.6	Low	77.2	Confident	121 Å²	121	64.6 Å²	64.6	65%	0.647	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-13.7	178	-64.7	-24.4	0	0	0	110.9	E131 D132 K170	E131-D134 WeakPolarHBondContact O-CB 3.31Å; E131-D134 PolarHBondContact O-N 2.78Å; E131-D134 VanDerWaalsContact O-N 3.09Å; D132-D134 PolarHBondContact O-N 3.02Å; D134-K170 IonicContact OD1-NZ 3.14Å; D134-K170 PolarHBondContact OD1-NZ 2.73Å; D134-K170 IonicContact OD2-NZ 2.83Å; D134-K170 PolarHBondContact OD2-NZ 3.17Å
135	E	62.9	Low	77.1	Confident	176 Å²	176	63 Å²	63	82%	0.822	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-32	178.8	-57.3	-163.9	163.5	0	0	114.2	D132 T133	D132-E135 CarbonylContact O-C 3.48Å; D132-E135 WeakPolarHBondContact O-CA 3.1Å; D132-E135 PolarHBondContact O-N 2.99Å; T133-E135 PolarHBondContact O-N 3.46Å
136	S	62.1	Low	76.6	Confident	38 Å²	38	68 Å²	68	27%	0.266	36%	0.355	S	S	.	.			trans	-111.6	114	-176.5	65.9	0	0	0	0	112.8	D132 D138	D132-S136 PolarHBondContact O-N 3.1Å; D132-S136 PolarHBondContact O-OG 3.48Å; S136-D138 PolarHBondContact O-N 2.87Å
137	A	63.2	Low	76.1	Confident	106 Å²	106	73.3 Å²	73.3	88%	0.876	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-8.5	-179.6	0	0	0	0	0	114.5
138	D	69.3	Low	75.6	Confident	149 Å²	149	69.3 Å²	69.3	80%	0.797	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-11.6	-175.1	-70.9	-16.2	0	0	0	113.3	S136	S136-D138 PolarHBondContact O-N 2.87Å
139	F	75.9	Confident	75.5	Confident	16 Å²	16	67.6 Å²	67.6	7%	0.07	36%	0.364	C	S	.	.			trans	-87.1	115.8	-179.9	-179.2	-100.1	0	0	0	111.7	E110 E111 Y114 T133 V141	E110-F139 HydrophobicContact CB-CD2 4.14Å; E110-F139 HydrophobicContact CB-CE2 4.4Å; E111-F139 HydrophobicContact CG-CD2 4.07Å; E111-F139 HydrophobicContact CG-CE2 4.04Å; Y114-F139 HydrophobicContact CD1-CE2 4.42Å; Y114-F139 AromaticContact CD1-CZ 3.76Å; Y114-F139 HydrophobicContact CD1-CZ 3.76Å; Y114-F139 AromaticContact CD2-CZ 3.94Å; Y114-F139 HydrophobicContact CD2-CZ 3.94Å; Y114-F139 HydrophobicContact CE1-CZ 4.26Å; Y114-F139 HydrophobicContact CE2-CZ 4.45Å; Y114-F139 HydrophobicContact CG-CE2 4.21Å; Y114-F139 AromaticContact CG-CZ 3.55Å; Y114-F139 HydrophobicContact CG-CZ 3.55Å; T133-F139 HydrophobicContact CG2-CD1 4.17Å; T133-F139 WeakPolarHBondContact OG1-CD1 3.47Å; T133-F139 WeakPolarHBondContact OG1-CE1 3.21Å; F139-V141 HydrophobicContact CD1-CG2 4.1Å; F139-V141 HydrophobicContact CE1-CG2 3.97Å
140	N	79.6	Confident	75.7	Confident	77 Å²	77	66.9 Å²	66.9	41%	0.412	36%	0.359	S	S	.	.			trans	-93.4	104.9	176.7	-177.9	13	0	0	0	111.4	E111 N142 C143	E111-N140 WeakPolarHBondContact OE1-CB 3.32Å; E111-N140 PolarHBondContact OE1-N 3.36Å; N140-N142 PolarHBondContact O-N 3.37Å; N140-N142 VanDerWaalsContact O-N 3.16Å; N140-N142 WeakPolarHBondContact OD1-CA 3.2Å; N140-N142 WeakPolarHBondContact OD1-CB 3.29Å; N140-N142 PolarHBondContact OD1-N 3.5Å; N140-C143 VanDerWaalsContact O-CB 3.25Å; N140-C143 WeakPolarHBondContact O-CB 3.49Å; N140-C143 PolarHBondContact O-N 2.86Å; N140-C143 PolarHBondContact O-SG 2.74Å
141	V	81.4	Confident	75.9	Confident	13 Å²	13	66.3 Å²	66.3	8%	0.079	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-30.6	174.3	-172.7	0	0	0	0	112.5	Y114 L130 T133 F139 C143 K170 L171	Y114-V141 PolarHBondContact OH-O 2.93Å; L130-V141 HydrophobicContact CD2-CG1 3.87Å; L130-V141 HydrophobicContact CD2-CG2 4.45Å; T133-V141 HydrophobicContact CG2-CG2 3.53Å; F139-V141 HydrophobicContact CD1-CG2 4.1Å; F139-V141 HydrophobicContact CE1-CG2 3.97Å; V141-C143 VanDerWaalsContact C-N 3.25Å; V141-C143 PolarHBondContact O-N 3.02Å; V141-K170 HydrophobicContact CG1-CB 4.45Å; V141-L171 HydrophobicContact CG1-CD2 4.12Å
142	N	79.1	Confident	76.3	Confident	34 Å²	34	60.8 Å²	60.8	18%	0.182	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	23.9	179	-52.8	-72.8	0	0	0	112.2	N140 L171 N172	N140-N142 PolarHBondContact O-N 3.37Å; N140-N142 VanDerWaalsContact O-N 3.16Å; N140-N142 WeakPolarHBondContact OD1-CA 3.2Å; N140-N142 WeakPolarHBondContact OD1-CB 3.29Å; N140-N142 PolarHBondContact OD1-N 3.5Å; N142-L171 WeakPolarHBondContact OD1-CD2 3.36Å; N142-N172 PolarHBondContact ND2-ND2 2.9Å; N142-N172 VanDerWaalsContact ND2-ND2 3.15Å; N142-N172 PolarHBondContact OD1-N 3.26Å; N142-N172 VanDerWaalsContact OD1-N 3.14Å
143	C	83	Confident	77	Confident	6 Å²	6	58 Å²	58	4%	0.041	32%	0.315	C	S	.	.			trans	-59.7	149.5	172.5	58.5	0	0	0	0	111	E111 N140 V141	E111-C143 HydrophobicContact CB-CB 4.32Å; E111-C143 HydrophobicContact CG-CB 4Å; N140-C143 VanDerWaalsContact O-CB 3.25Å; N140-C143 WeakPolarHBondContact O-CB 3.49Å; N140-C143 PolarHBondContact O-N 2.86Å; N140-C143 PolarHBondContact O-SG 2.74Å; V141-C143 VanDerWaalsContact C-N 3.25Å; V141-C143 PolarHBondContact O-N 3.02Å
144	V	80	Confident	77.9	Confident	52 Å²	52	57 Å²	57	32%	0.315	31%	0.308	S	S	.	.	B	Isolated β-bridge	trans	-122.3	146.2	176.2	-67.4	0	0	0	0	109.1	R149 N150	V144-R149 VanDerWaalsContact CA-O 3.29Å; V144-R149 WeakPolarHBondContact CA-O 3.3Å; V144-N150 HydrophobicContact CG1-CB 4.4Å
145	D	82.5	Confident	79.1	Confident	13 Å²	13	51.3 Å²	51.3	7%	0.07	28%	0.278	C	S	.	.			trans	-71.6	-180	172.9	75.4	-3.8	0	0	0	111.9	L115 M147 G148 R149	L115-D145 HydrophobicContact CD1-CB 4.1Å; D145-M147 PolarHBondContact O-N 3.37Å; D145-M147 VanDerWaalsContact O-N 3.13Å; D145-M147 VanDerWaalsContact OD1-C 3.25Å; D145-M147 VanDerWaalsContact OD1-CA 3.24Å; D145-M147 WeakPolarHBondContact OD1-CA 3.45Å; D145-M147 WeakPolarHBondContact OD1-CB 3.2Å; D145-M147 PolarHBondContact OD1-N 3.39Å; D145-G148 PolarHBondContact O-N 3.19Å; D145-G148 PolarHBondContact OD1-N 3.06Å; D145-R149 PolarHBondContact N-O 3.2Å; D145-R149 WeakPolarHBondContact OD1-CB 3.48Å; D145-R149 PolarHBondContact OD1-N 3.31Å; D145-R149 IonicContact OD1-NE 2.65Å; D145-R149 IonicContact OD2-CZ 3.53Å; D145-R149 IonicContact OD2-NE 3.6Å; D145-R149 PolarHBondContact OD2-NE 3.45Å; D145-R149 IonicContact OD2-NH2 3.97Å; D145-R149 PolarHBondContact OD2-NH2 3Å
146	Y	76.8	Confident	80.3	Confident	161 Å²	161	43 Å²	43	63%	0.631	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-13.9	175.6	65.1	-88.1	0	0	0	113.8	F102	F102-Y146 WeakPolarHBondContact CD1-O 3.42Å
147	M	75.6	Confident	81.6	Confident	111 Å²	111	43.7 Å²	43.7	55%	0.547	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-5.5	175.6	-57.3	-177.6	60.2	0	0	112.7	D145 R149	D145-M147 PolarHBondContact O-N 3.37Å; D145-M147 VanDerWaalsContact O-N 3.13Å; D145-M147 VanDerWaalsContact OD1-C 3.25Å; D145-M147 VanDerWaalsContact OD1-CA 3.24Å; D145-M147 WeakPolarHBondContact OD1-CA 3.45Å; D145-M147 WeakPolarHBondContact OD1-CB 3.2Å; D145-M147 PolarHBondContact OD1-N 3.39Å; M147-R149 HydrophobicContact CB-CG 4.29Å
148	G	77.5	Confident	82.6	Confident	34 Å²	34	40.7 Å²	40.7	35%	0.351	21%	0.212	S	C	.	.	S	Bend	trans	83.5	16.2	-175.5	0	0	0	0	0	114.9	D145	D145-G148 PolarHBondContact O-N 3.19Å; D145-G148 PolarHBondContact OD1-N 3.06Å
149	R	82.5	Confident	83.3	Confident	66 Å²	66	39.1 Å²	39.1	25%	0.249	20%	0.2	C	C	.	.			trans	-88.5	134	177.6	-60.4	179.9	-64.7	171.8	2.8	110.5	V144 D145 M147 H153 D157	V144-R149 VanDerWaalsContact CA-O 3.29Å; V144-R149 WeakPolarHBondContact CA-O 3.3Å; D145-R149 PolarHBondContact N-O 3.2Å; D145-R149 WeakPolarHBondContact OD1-CB 3.48Å; D145-R149 PolarHBondContact OD1-N 3.31Å; D145-R149 IonicContact OD1-NE 2.65Å; D145-R149 IonicContact OD2-CZ 3.53Å; D145-R149 IonicContact OD2-NE 3.6Å; D145-R149 PolarHBondContact OD2-NE 3.45Å; D145-R149 IonicContact OD2-NH2 3.97Å; D145-R149 PolarHBondContact OD2-NH2 3Å; M147-R149 HydrophobicContact CB-CG 4.29Å; R149-H153 HydrophobicContact CB-CB 3.88Å; R149-H153 HydrophobicContact CG-CB 4.36Å; R149-D157 IonicContact NH1-OD2 2.66Å
150	N	86.3	Confident	83.8	Confident	1 Å²	1	40.2 Å²	40.2	1%	0.005	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-86.9	172.2	171.7	68.2	35.5	0	0	0	111.2	V144 L152 H153 L154 C175	V144-N150 HydrophobicContact CG1-CB 4.4Å; N150-L152 PolarHBondContact O-N 2.73Å; N150-L152 VanDerWaalsContact OD1-CA 3.32Å; N150-L152 WeakPolarHBondContact OD1-CA 3.29Å; N150-L152 VanDerWaalsContact OD1-CB 3.31Å; N150-L152 WeakPolarHBondContact OD1-CB 3.39Å; N150-L152 PolarHBondContact OD1-N 2.99Å; N150-H153 PolarHBondContact N-ND1 3.02Å; N150-H153 PolarHBondContact ND2-CE1 3.35Å; N150-H153 VanDerWaalsContact ND2-CE1 3.33Å; N150-H153 PolarHBondContact ND2-ND1 3.09Å; N150-H153 VanDerWaalsContact ND2-ND1 3.16Å; N150-H153 WeakPolarHBondContact O-CB 3.5Å; N150-H153 PolarHBondContact O-N 3.12Å; N150-H153 VanDerWaalsContact O-N 3.11Å; N150-H153 PolarHBondContact OD1-N 3.03Å; N150-H153 PolarHBondContact OD1-ND1 2.86Å; N150-L154 PolarHBondContact O-N 3.05Å; N150-C175 WeakPolarHBondContact ND2-CB 3.07Å; N150-C175 PolarHBondContact ND2-O 3.24Å
151	A	88.1	Confident	84.2	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-56.8	-34.4	177.7	0	0	0	0	0	113.1	Y114 L115 A118 L154 A155 L167	Y114-A151 HydrophobicContact CD1-CB 4.47Å; Y114-A151 HydrophobicContact CE1-CB 3.55Å; Y114-A151 HydrophobicContact CE2-CB 4.45Å; Y114-A151 WeakPolarHBondContact OH-CB 3.21Å; L115-A151 HydrophobicContact CD2-CB 3.97Å; A118-A151 HydrophobicContact CB-CB 3.97Å; A151-L154 PolarHBondContact O-N 3.33Å; A151-A155 PolarHBondContact O-N 3.41Å; A151-L167 HydrophobicContact CB-CD1 4.03Å; A151-L167 HydrophobicContact CB-CD2 4.12Å
152	L	88.8	Confident	84.4	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-72.3	-33	178.2	-171.9	63.3	0	0	0	112.4	N150 L154 A155 V156 M164 L167 L168 L171 I176 A179	N150-L152 PolarHBondContact O-N 2.73Å; N150-L152 VanDerWaalsContact OD1-CA 3.32Å; N150-L152 WeakPolarHBondContact OD1-CA 3.29Å; N150-L152 VanDerWaalsContact OD1-CB 3.31Å; N150-L152 WeakPolarHBondContact OD1-CB 3.39Å; N150-L152 PolarHBondContact OD1-N 2.99Å; L152-L154 VanDerWaalsContact C-N 3.3Å; L152-L154 PolarHBondContact O-N 2.89Å; L152-A155 PolarHBondContact O-N 3.18Å; L152-V156 WeakPolarHBondContact O-CB 3.4Å; L152-V156 VanDerWaalsContact O-CG2 3.22Å; L152-V156 WeakPolarHBondContact O-CG2 3.25Å; L152-V156 PolarHBondContact O-N 3.43Å; L152-M164 HydrophobicContact CD1-CB 4.07Å; L152-M164 HydrophobicContact CD1-CE 4.48Å; L152-M164 HydrophobicContact CD1-CG 3.94Å; L152-L167 HydrophobicContact CD1-CB 4.24Å; L152-L167 HydrophobicContact CD1-CD1 4.47Å; L152-L168 HydrophobicContact CD1-CG 4.38Å; L152-L168 HydrophobicContact CD2-CD2 3.78Å; L152-L168 HydrophobicContact CD2-CG 4.42Å; L152-L171 HydrophobicContact CB-CD1 3.63Å; L152-L171 HydrophobicContact CD2-CD1 4.06Å; L152-L171 HydrophobicContact CG-CD1 4.35Å; L152-I176 HydrophobicContact CD2-CG1 4.35Å; L152-A179 HydrophobicContact CB-CB 3.95Å; L152-A179 HydrophobicContact CD2-CB 3.54Å; L152-A179 HydrophobicContact CG-CB 3.64Å
153	H	89	Confident	84.8	Confident	13 Å²	13	42.7 Å²	42.7	6%	0.06	22%	0.218	C	C	.	.	H	α-helix	trans	-60.1	-42.8	170.7	-72.5	106.9	0	0	0	110.7	R149 N150 V156 D157 E178 H182	R149-H153 HydrophobicContact CB-CB 3.88Å; R149-H153 HydrophobicContact CG-CB 4.36Å; N150-H153 PolarHBondContact N-ND1 3.02Å; N150-H153 PolarHBondContact ND2-CE1 3.35Å; N150-H153 VanDerWaalsContact ND2-CE1 3.33Å; N150-H153 PolarHBondContact ND2-ND1 3.09Å; N150-H153 VanDerWaalsContact ND2-ND1 3.16Å; N150-H153 WeakPolarHBondContact O-CB 3.5Å; N150-H153 PolarHBondContact O-N 3.12Å; N150-H153 VanDerWaalsContact O-N 3.11Å; N150-H153 PolarHBondContact OD1-N 3.03Å; N150-H153 PolarHBondContact OD1-ND1 2.86Å; H153-V156 PolarHBondContact O-N 3.38Å; H153-D157 PolarHBondContact O-N 3.42Å; H153-E178 PolarHBondContact NE2-O 3.41Å; H153-H182 WeakPolarHBondContact CD2-CB 3.32Å; H153-H182 AromaticContact CD2-CD2 3.77Å; H153-H182 AromaticContact CD2-CG 3.58Å
154	L	88	Confident	85.1	Confident	11 Å²	11	42.4 Å²	42.4	6%	0.058	22%	0.216	C	C	.	.	H	α-helix	trans	-69.1	-39.1	177.9	-62	174.1	0	0	0	111.7	L115 A118 A119 N150 A151 L152 V156 D157 S158	L115-L154 HydrophobicContact CB-CD1 3.97Å; L115-L154 HydrophobicContact CD2-CD1 4.04Å; L115-L154 VanDerWaalsContact O-CD1 3.31Å; L115-L154 WeakPolarHBondContact O-CD1 3.4Å; A118-L154 HydrophobicContact CB-CB 4.32Å; A119-L154 HydrophobicContact CB-CB 4.25Å; A119-L154 HydrophobicContact CB-CD1 4.33Å; A119-L154 HydrophobicContact CB-CD2 4.43Å; N150-L154 PolarHBondContact O-N 3.05Å; A151-L154 PolarHBondContact O-N 3.33Å; L152-L154 VanDerWaalsContact C-N 3.3Å; L152-L154 PolarHBondContact O-N 2.89Å; L154-V156 VanDerWaalsContact C-N 3.34Å; L154-V156 PolarHBondContact O-N 3.13Å; L154-D157 WeakPolarHBondContact O-CB 3.38Å; L154-D157 PolarHBondContact O-N 2.93Å; L154-S158 PolarHBondContact O-N 3.22Å; L154-S158 PolarHBondContact O-OG 3.15Å
155	A	89.5	Confident	85.4	Confident	0 Å²	0	45 Å²	45	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.9	-34.7	174	0	0	0	0	0	112.9	A151 L152 S158 E159 N160 V163 M164 L167	A151-A155 PolarHBondContact O-N 3.41Å; L152-A155 PolarHBondContact O-N 3.18Å; A155-S158 WeakPolarHBondContact CA-OG 3.19Å; A155-S158 PolarHBondContact O-N 3.43Å; A155-S158 PolarHBondContact O-OG 3.34Å; A155-E159 PolarHBondContact O-N 3.16Å; A155-N160 PolarHBondContact O-N 2.87Å; A155-V163 HydrophobicContact CB-CB 4.41Å; A155-V163 HydrophobicContact CB-CG1 3.75Å; A155-M164 HydrophobicContact CB-CG 3.82Å; A155-L167 HydrophobicContact CB-CD1 3.86Å
156	V	89.2	Confident	85.5	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.018	23%	0.231	C	C	.	.	H	α-helix	trans	-68.4	-36.9	172.4	167.6	0	0	0	0	111	L152 H153 L154 E159 M164 A183 K186 L191 I195	L152-V156 WeakPolarHBondContact O-CB 3.4Å; L152-V156 VanDerWaalsContact O-CG2 3.22Å; L152-V156 WeakPolarHBondContact O-CG2 3.25Å; L152-V156 PolarHBondContact O-N 3.43Å; H153-V156 PolarHBondContact O-N 3.38Å; L154-V156 VanDerWaalsContact C-N 3.34Å; L154-V156 PolarHBondContact O-N 3.13Å; V156-E159 PolarHBondContact O-N 3.28Å; V156-M164 HydrophobicContact CG2-CE 3.79Å; V156-M164 HydrophobicContact CG2-SD 3.97Å; V156-A183 HydrophobicContact CG1-CB 3.79Å; V156-A183 HydrophobicContact CG2-CB 4.16Å; V156-K186 HydrophobicContact CG1-CG 4.5Å; V156-L191 HydrophobicContact CG1-CD1 4.17Å; V156-I195 HydrophobicContact CG2-CD1 4.34Å
157	D	88.6	Confident	86	Confident	52 Å²	52	38.6 Å²	38.6	28%	0.278	20%	0.202	S	C	.	.	H	α-helix	trans	-68	-32.7	175.8	-78.1	-19.5	0	0	0	112.5	R149 H153 L154 H182 K186	R149-D157 IonicContact NH1-OD2 2.66Å; H153-D157 PolarHBondContact O-N 3.42Å; L154-D157 WeakPolarHBondContact O-CB 3.38Å; L154-D157 PolarHBondContact O-N 2.93Å; D157-H182 IonicContact OD1-CD2 2.64Å; D157-H182 IonicContact OD1-CE1 2.84Å; D157-H182 IonicContact OD1-NE2 3.39Å; D157-H182 PolarHBondContact OD1-NE2 3.44Å; D157-H182 IonicContact OD2-NE2 3.83Å; D157-K186 WeakPolarHBondContact OD1-CE 3.35Å; D157-K186 IonicContact OD1-NZ 2.99Å; D157-K186 PolarHBondContact OD1-NZ 3.2Å
158	S	84.1	Confident	86.5	Confident	43 Å²	43	33.3 Å²	33.3	30%	0.301	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.9	0	177.6	62.5	0	0	0	0	114.5	A119 L154 A155 N160	A119-S158 WeakPolarHBondContact O-CB 3.41Å; L154-S158 PolarHBondContact O-N 3.22Å; L154-S158 PolarHBondContact O-OG 3.15Å; A155-S158 WeakPolarHBondContact CA-OG 3.19Å; A155-S158 PolarHBondContact O-N 3.43Å; A155-S158 PolarHBondContact O-OG 3.34Å; S158-N160 PolarHBondContact O-N 2.76Å
159	E	84.7	Confident	86.8	Confident	115 Å²	115	36.3 Å²	36.3	54%	0.537	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	22	-178.4	-56.6	-169.8	-147.2	0	0	115	A155 V156 T161 H188 L191	A155-E159 PolarHBondContact O-N 3.16Å; V156-E159 PolarHBondContact O-N 3.28Å; E159-T161 PolarHBondContact O-N 3.1Å; E159-H188 IonicContact OE1-CE1 2.84Å; E159-H188 PolarHBondContact OE1-CE1 3.01Å; E159-H188 IonicContact OE1-ND1 3.52Å; E159-H188 IonicContact OE1-NE2 2.85Å; E159-H188 IonicContact OE2-CE1 3.02Å; E159-H188 PolarHBondContact OE2-CE1 3.05Å; E159-H188 IonicContact OE2-ND1 2.62Å; E159-H188 PolarHBondContact OE2-ND1 3.5Å; E159-L191 HydrophobicContact CG-CD1 4.37Å
160	N	86	Confident	86.8	Confident	39 Å²	39	37.7 Å²	37.7	21%	0.209	19%	0.191	C	C	.	.			trans	-88.6	99.8	-176.8	-168.4	-24.2	0	0	0	111.5	G121 A155 S158 E162 V163 M164	G121-N160 PolarHBondContact O-ND2 2.85Å; A155-N160 PolarHBondContact O-N 2.87Å; S158-N160 PolarHBondContact O-N 2.76Å; N160-E162 VanDerWaalsContact C-N 3.33Å; N160-E162 PolarHBondContact O-N 3.16Å; N160-E162 PolarHBondContact OD1-N 2.94Å; N160-V163 HydrophobicContact CB-CB 4.23Å; N160-V163 HydrophobicContact CB-CG2 4.21Å; N160-V163 WeakPolarHBondContact ND2-CG2 3.33Å; N160-V163 PolarHBondContact O-N 3.34Å; N160-V163 PolarHBondContact OD1-N 3.27Å; N160-M164 WeakPolarHBondContact O-CG 3.32Å; N160-M164 PolarHBondContact O-N 2.88Å; N160-M164 VanDerWaalsContact O-N 3.16Å
161	T	87.2	Confident	86.6	Confident	60 Å²	60	38.1 Å²	38.1	37%	0.368	19%	0.194	S	C	.	.	H	α-helix	trans	-63.2	-35.1	-178	53.2	0	0	0	0	113.5	E159 M164 E165 L191	E159-T161 PolarHBondContact O-N 3.1Å; T161-M164 PolarHBondContact O-N 3.23Å; T161-E165 WeakPolarHBondContact O-CG 3.46Å; T161-E165 PolarHBondContact O-N 3.3Å; T161-L191 HydrophobicContact CG2-CD2 3.98Å
162	E	85.1	Confident	86.2	Confident	117 Å²	117	42.7 Å²	42.7	55%	0.547	22%	0.218	S	C	.	.	H	α-helix	trans	-69.1	-40.3	-177.6	-62.2	-174.9	-179.5	0	0	111.1	I123 N160 E165 L166	I123-E162 HydrophobicContact CD1-CB 3.9Å; I123-E162 WeakPolarHBondContact CD1-OE2 3.25Å; N160-E162 VanDerWaalsContact C-N 3.33Å; N160-E162 PolarHBondContact O-N 3.16Å; N160-E162 PolarHBondContact OD1-N 2.94Å; E162-E165 PolarHBondContact O-N 3.45Å; E162-L166 WeakPolarHBondContact O-CG 3.39Å; E162-L166 PolarHBondContact O-N 3.07Å
163	V	87.6	Confident	85.8	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.6	-42	173.9	173	0	0	0	0	110.8	I123 I126 A155 N160 E165 L166 L167	I123-V163 HydrophobicContact CG1-CG2 3.62Å; I126-V163 HydrophobicContact CD1-CB 4.32Å; I126-V163 HydrophobicContact CD1-CG1 3.41Å; I126-V163 VanDerWaalsContact CD1-CG1 3.41Å; I126-V163 HydrophobicContact CD1-CG2 3.94Å; A155-V163 HydrophobicContact CB-CB 4.41Å; A155-V163 HydrophobicContact CB-CG1 3.75Å; N160-V163 HydrophobicContact CB-CB 4.23Å; N160-V163 HydrophobicContact CB-CG2 4.21Å; N160-V163 WeakPolarHBondContact ND2-CG2 3.33Å; N160-V163 PolarHBondContact O-N 3.34Å; N160-V163 PolarHBondContact OD1-N 3.27Å; V163-E165 PolarHBondContact O-N 2.85Å; V163-L166 PolarHBondContact O-N 3.24Å; V163-L167 HydrophobicContact CG1-CD1 3.69Å; V163-L167 HydrophobicContact CG1-CG 4.16Å; V163-L167 WeakPolarHBondContact O-CB 3.23Å; V163-L167 VanDerWaalsContact O-CG 3.26Å; V163-L167 WeakPolarHBondContact O-CG 3.44Å; V163-L167 PolarHBondContact O-N 3.44Å
164	M	89.1	Confident	85.2	Confident	0 Å²	0	51 Å²	51	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-60.1	-44.5	177.1	-70.3	178.7	59.3	0	0	112.5	L152 A155 V156 N160 T161 L166 L167 L168 L191 I195	L152-M164 HydrophobicContact CD1-CB 4.07Å; L152-M164 HydrophobicContact CD1-CE 4.48Å; L152-M164 HydrophobicContact CD1-CG 3.94Å; A155-M164 HydrophobicContact CB-CG 3.82Å; V156-M164 HydrophobicContact CG2-CE 3.79Å; V156-M164 HydrophobicContact CG2-SD 3.97Å; N160-M164 WeakPolarHBondContact O-CG 3.32Å; N160-M164 PolarHBondContact O-N 2.88Å; N160-M164 VanDerWaalsContact O-N 3.16Å; T161-M164 PolarHBondContact O-N 3.23Å; M164-L166 VanDerWaalsContact C-N 3.35Å; M164-L166 PolarHBondContact O-N 2.96Å; M164-L167 PolarHBondContact O-N 2.97Å; M164-L168 WeakPolarHBondContact O-CB 3.5Å; M164-L168 WeakPolarHBondContact O-CD1 3.17Å; M164-L168 WeakPolarHBondContact O-CG 3.29Å; M164-L168 PolarHBondContact O-N 2.88Å; M164-L191 HydrophobicContact CE-CB 4.14Å; M164-L191 HydrophobicContact SD-CB 4.3Å; M164-L191 HydrophobicContact SD-CD2 3.79Å; M164-L191 HydrophobicContact SD-CG 4.43Å; M164-I195 HydrophobicContact CE-CD1 3.63Å; M164-I195 HydrophobicContact CE-CG1 3.49Å; M164-I195 VanDerWaalsContact CE-CG1 3.49Å
165	E	86.8	Confident	84.9	Confident	105 Å²	105	51.4 Å²	51.4	49%	0.491	26%	0.259	S	S	.	.	H	α-helix	trans	-60.3	-43	178.1	-74.1	178.8	-176.5	0	0	111.7	T161 E162 V163 V194	T161-E165 WeakPolarHBondContact O-CG 3.46Å; T161-E165 PolarHBondContact O-N 3.3Å; E162-E165 PolarHBondContact O-N 3.45Å; V163-E165 PolarHBondContact O-N 2.85Å; E165-V194 HydrophobicContact CG-CG1 3.95Å
166	L	84.9	Confident	84.7	Confident	40 Å²	40	51.5 Å²	51.5	21%	0.209	26%	0.26	C	S	.	.	H	α-helix	trans	-66.1	-39.3	177.1	-67.8	171.4	0	0	0	113	I123 E162 V163 M164	I123-L166 HydrophobicContact CG2-CD1 3.64Å; E162-L166 WeakPolarHBondContact O-CG 3.39Å; E162-L166 PolarHBondContact O-N 3.07Å; V163-L166 PolarHBondContact O-N 3.24Å; M164-L166 VanDerWaalsContact C-N 3.35Å; M164-L166 PolarHBondContact O-N 2.96Å
167	L	86.8	Confident	84.4	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.005	27%	0.268	C	S	.	.	H	α-helix	trans	-72	-35.8	-179.1	-71.7	176.7	0	0	0	112.4	Y114 I126 A151 L152 A155 V163 M164 D169 K170 L171	Y114-L167 HydrophobicContact CE2-CD2 4.02Å; Y114-L167 WeakPolarHBondContact OH-CD2 3.46Å; I126-L167 HydrophobicContact CG2-CD2 4Å; A151-L167 HydrophobicContact CB-CD1 4.03Å; A151-L167 HydrophobicContact CB-CD2 4.12Å; L152-L167 HydrophobicContact CD1-CB 4.24Å; L152-L167 HydrophobicContact CD1-CD1 4.47Å; A155-L167 HydrophobicContact CB-CD1 3.86Å; V163-L167 HydrophobicContact CG1-CD1 3.69Å; V163-L167 HydrophobicContact CG1-CG 4.16Å; V163-L167 WeakPolarHBondContact O-CB 3.23Å; V163-L167 VanDerWaalsContact O-CG 3.26Å; V163-L167 WeakPolarHBondContact O-CG 3.44Å; V163-L167 PolarHBondContact O-N 3.44Å; M164-L167 PolarHBondContact O-N 2.97Å; L167-D169 PolarHBondContact O-N 3.49Å; L167-K170 PolarHBondContact O-N 3.49Å; L167-L171 HydrophobicContact CB-CD1 3.88Å; L167-L171 WeakPolarHBondContact O-CB 3.16Å; L167-L171 WeakPolarHBondContact O-CD1 3.46Å; L167-L171 VanDerWaalsContact O-CG 3.24Å; L167-L171 WeakPolarHBondContact O-CG 3.26Å; L167-L171 PolarHBondContact O-N 3.1Å
168	L	87.3	Confident	84	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.8	-24.7	-178.6	-77.6	166.6	0	0	0	113.3	L152 M164 I176 V194 I195 H198 N200	L152-L168 HydrophobicContact CD1-CG 4.38Å; L152-L168 HydrophobicContact CD2-CD2 3.78Å; L152-L168 HydrophobicContact CD2-CG 4.42Å; M164-L168 WeakPolarHBondContact O-CB 3.5Å; M164-L168 WeakPolarHBondContact O-CD1 3.17Å; M164-L168 WeakPolarHBondContact O-CG 3.29Å; M164-L168 PolarHBondContact O-N 2.88Å; L168-I176 HydrophobicContact CD2-CD1 4.19Å; L168-I176 HydrophobicContact CD2-CG1 4.12Å; L168-I176 HydrophobicContact CD2-CG2 3.8Å; L168-V194 HydrophobicContact CD1-CG1 4.31Å; L168-I195 HydrophobicContact CD1-CG1 4.42Å; L168-I195 HydrophobicContact CD2-CG2 4.33Å; L168-H198 HydrophobicContact CD1-CB 4.06Å; L168-N200 PolarHBondContact O-ND2 3.31Å
169	D	83.4	Confident	84.2	Confident	96 Å²	96	51.2 Å²	51.2	51%	0.513	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-33.3	178.7	-82.9	-23.8	0	0	0	113.7	L167 H198 N200	L167-D169 PolarHBondContact O-N 3.49Å; D169-H198 IonicContact OD1-CE1 3.96Å; D169-H198 PolarHBondContact OD1-CE1 3.12Å; D169-H198 IonicContact OD1-NE2 2.74Å; D169-H198 PolarHBondContact OD1-NE2 2.97Å; D169-N200 VanDerWaalsContact CA-ND2 3.31Å; D169-N200 WeakPolarHBondContact CA-ND2 3.42Å; D169-N200 PolarHBondContact O-ND2 3.18Å
170	K	81.6	Confident	84.4	Confident	95 Å²	95	45.7 Å²	45.7	41%	0.413	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.1	-12.4	-169.6	-66.1	-83.5	-167.1	162.9	0	114.1	L130 D134 V141 L167	L130-K170 HydrophobicContact CD2-CB 4.1Å; L130-K170 HydrophobicContact CD2-CG 4.21Å; D134-K170 IonicContact OD1-NZ 3.14Å; D134-K170 PolarHBondContact OD1-NZ 2.73Å; D134-K170 IonicContact OD2-NZ 2.83Å; D134-K170 PolarHBondContact OD2-NZ 3.17Å; V141-K170 HydrophobicContact CG1-CB 4.45Å; L167-K170 PolarHBondContact O-N 3.49Å
171	L	81.8	Confident	84.5	Confident	11 Å²	11	44.4 Å²	44.4	6%	0.058	22%	0.219	C	C	.	.	S	Bend	trans	-82.6	152.2	-177.2	-75.7	168	0	0	0	114.5	V141 N142 L152 L167 I176	V141-L171 HydrophobicContact CG1-CD2 4.12Å; N142-L171 WeakPolarHBondContact OD1-CD2 3.36Å; L152-L171 HydrophobicContact CB-CD1 3.63Å; L152-L171 HydrophobicContact CD2-CD1 4.06Å; L152-L171 HydrophobicContact CG-CD1 4.35Å; L167-L171 HydrophobicContact CB-CD1 3.88Å; L167-L171 WeakPolarHBondContact O-CB 3.16Å; L167-L171 WeakPolarHBondContact O-CD1 3.46Å; L167-L171 VanDerWaalsContact O-CG 3.24Å; L167-L171 WeakPolarHBondContact O-CG 3.26Å; L167-L171 PolarHBondContact O-N 3.1Å; L171-I176 HydrophobicContact CB-CD1 4.35Å; L171-I176 HydrophobicContact CB-CG1 4.08Å
172	N	81.3	Confident	84.6	Confident	95 Å²	95	42.4 Å²	42.4	51%	0.508	21%	0.206	S	C	.	.			trans	-72.1	150.5	173.5	-75.2	-21.1	0	0	0	112.6	N142 E174 C175 I176	N142-N172 PolarHBondContact ND2-ND2 2.9Å; N142-N172 VanDerWaalsContact ND2-ND2 3.15Å; N142-N172 PolarHBondContact OD1-N 3.26Å; N142-N172 VanDerWaalsContact OD1-N 3.14Å; N172-E174 VanDerWaalsContact C-N 3.31Å; N172-E174 PolarHBondContact O-N 3.38Å; N172-C175 PolarHBondContact O-N 3.4Å; N172-C175 VanDerWaalsContact O-N 3.14Å; N172-I176 WeakPolarHBondContact O-CG1 3.27Å; N172-I176 PolarHBondContact O-N 3.44Å; N172-I176 VanDerWaalsContact O-N 3.14Å
173	F	80.8	Confident	84.8	Confident	46 Å²	46	36.8 Å²	36.8	20%	0.202	18%	0.18	C	C	.	.	H	α-helix	trans	-56.4	-39.1	-179.4	-177.6	-89	0	0	0	113.8	C175 I176 E177 Y201 G204 I208	F173-C175 VanDerWaalsContact C-N 3.34Å; F173-C175 PolarHBondContact O-N 2.89Å; F173-I176 PolarHBondContact O-N 3.41Å; F173-E177 HydrophobicContact CE1-CB 4.04Å; F173-E177 HydrophobicContact CE1-CG 4.5Å; F173-E177 PolarHBondContact O-N 3.35Å; F173-Y201 AromaticContact CE2-CD2 3.92Å; F173-Y201 HydrophobicContact CE2-CD2 3.92Å; F173-Y201 HydrophobicContact CE2-CE2 4.03Å; F173-Y201 HydrophobicContact CZ-CE2 4.21Å; F173-G204 VanDerWaalsContact CD2-CA 3.45Å; F173-G204 VanDerWaalsContact CE2-C 3.4Å; F173-I208 HydrophobicContact CD1-CD1 3.87Å; F173-I208 HydrophobicContact CE1-CD1 3.09Å; F173-I208 HydrophobicContact CE1-CG1 4.21Å; F173-I208 HydrophobicContact CZ-CD1 3.61Å
174	E	76.3	Confident	85.1	Confident	142 Å²	142	37 Å²	37	66%	0.664	18%	0.18	S	C	*	.	H	α-helix	trans	-61.4	-41.6	179.5	-63.4	-176.4	169.3	0	0	111.9	N172 I176 E177 E178	N172-E174 VanDerWaalsContact C-N 3.31Å; N172-E174 PolarHBondContact O-N 3.38Å; E174-I176 VanDerWaalsContact C-N 3.35Å; E174-E177 PolarHBondContact O-N 3.17Å; E174-E178 WeakPolarHBondContact O-CG 3.5Å; E174-E178 PolarHBondContact O-N 2.7Å
175	C	80.6	Confident	85.1	Confident	19 Å²	19	38.2 Å²	38.2	13%	0.128	19%	0.189	C	C	.	.	H	α-helix	trans	-67.6	-35.9	176.3	-63.5	0	0	0	0	111.9	N150 N172 F173 A179	N150-C175 WeakPolarHBondContact ND2-CB 3.07Å; N150-C175 PolarHBondContact ND2-O 3.24Å; N172-C175 PolarHBondContact O-N 3.4Å; N172-C175 VanDerWaalsContact O-N 3.14Å; F173-C175 VanDerWaalsContact C-N 3.34Å; F173-C175 PolarHBondContact O-N 2.89Å; C175-A179 VanDerWaalsContact O-CB 3.28Å; C175-A179 WeakPolarHBondContact O-CB 3.38Å; C175-A179 PolarHBondContact O-N 3.26Å
176	I	85.6	Confident	85.1	Confident	2 Å²	2	37.9 Å²	37.9	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-69	-41.4	175.6	-59.1	170.3	0	0	0	110.7	L152 L168 L171 N172 F173 E174 A179 L180 I195 Y201	L152-I176 HydrophobicContact CD2-CG1 4.35Å; L168-I176 HydrophobicContact CD2-CD1 4.19Å; L168-I176 HydrophobicContact CD2-CG1 4.12Å; L168-I176 HydrophobicContact CD2-CG2 3.8Å; L171-I176 HydrophobicContact CB-CD1 4.35Å; L171-I176 HydrophobicContact CB-CG1 4.08Å; N172-I176 WeakPolarHBondContact O-CG1 3.27Å; N172-I176 PolarHBondContact O-N 3.44Å; N172-I176 VanDerWaalsContact O-N 3.14Å; F173-I176 PolarHBondContact O-N 3.41Å; E174-I176 VanDerWaalsContact C-N 3.35Å; I176-A179 PolarHBondContact O-N 3.09Å; I176-L180 VanDerWaalsContact O-CB 3.26Å; I176-L180 WeakPolarHBondContact O-CB 3.48Å; I176-L180 PolarHBondContact O-N 3.32Å; I176-I195 HydrophobicContact CG2-CG2 3.84Å; I176-Y201 HydrophobicContact CG2-CD2 3.75Å
177	E	81.8	Confident	85.1	Confident	42 Å²	42	37.4 Å²	37.4	20%	0.196	19%	0.191	C	C	.	.	H	α-helix	trans	-61.9	-44.9	176.6	-173.4	178.6	-167.3	0	0	111.1	F173 E174 L180 L181 R219	F173-E177 HydrophobicContact CE1-CB 4.04Å; F173-E177 HydrophobicContact CE1-CG 4.5Å; F173-E177 PolarHBondContact O-N 3.35Å; E174-E177 PolarHBondContact O-N 3.17Å; E177-L180 WeakPolarHBondContact O-CB 3.46Å; E177-L180 PolarHBondContact O-N 2.85Å; E177-L181 WeakPolarHBondContact O-CG 3.41Å; E177-L181 PolarHBondContact O-N 3.23Å; E177-R219 IonicContact OE2-NH1 3.45Å
178	E	81.9	Confident	85	Confident	50 Å²	50	40.2 Å²	40.2	23%	0.234	20%	0.204	C	C	.	.	H	α-helix	trans	-66.6	-40.5	176.4	-71.6	-174.8	162.5	0	0	112.9	H153 E174 L180 L181 H182 S224	H153-E178 PolarHBondContact NE2-O 3.41Å; E174-E178 WeakPolarHBondContact O-CG 3.5Å; E174-E178 PolarHBondContact O-N 2.7Å; E178-L180 VanDerWaalsContact C-N 3.34Å; E178-L181 PolarHBondContact O-N 3.22Å; E178-H182 PolarHBondContact O-N 3.38Å; E178-S224 VanDerWaalsContact OE1-CA 3.31Å; E178-S224 WeakPolarHBondContact OE1-CA 3.27Å; E178-S224 WeakPolarHBondContact OE1-CB 3.42Å
179	A	87	Confident	85	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-68.2	-33.8	175.6	0	0	0	0	0	112	L152 C175 I176 H182 A183	L152-A179 HydrophobicContact CB-CB 3.95Å; L152-A179 HydrophobicContact CD2-CB 3.54Å; L152-A179 HydrophobicContact CG-CB 3.64Å; C175-A179 VanDerWaalsContact O-CB 3.28Å; C175-A179 WeakPolarHBondContact O-CB 3.38Å; C175-A179 PolarHBondContact O-N 3.26Å; I176-A179 PolarHBondContact O-N 3.09Å; A179-H182 WeakPolarHBondContact O-CB 3.24Å; A179-H182 PolarHBondContact O-N 3.02Å; A179-A183 WeakPolarHBondContact O-CB 3.29Å; A179-A183 PolarHBondContact O-N 2.84Å
180	L	89.4	Confident	85.3	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-63.5	-46	172.6	175.9	64	0	0	0	111.3	I176 E177 E178 H182 A183 I184 V192 I195 I196 Y201 P232	I176-L180 VanDerWaalsContact O-CB 3.26Å; I176-L180 WeakPolarHBondContact O-CB 3.48Å; I176-L180 PolarHBondContact O-N 3.32Å; E177-L180 WeakPolarHBondContact O-CB 3.46Å; E177-L180 PolarHBondContact O-N 2.85Å; E178-L180 VanDerWaalsContact C-N 3.34Å; L180-H182 VanDerWaalsContact C-N 3.26Å; L180-H182 PolarHBondContact O-N 3.14Å; L180-A183 PolarHBondContact O-N 3.23Å; L180-I184 HydrophobicContact CD1-CD1 4.36Å; L180-I184 HydrophobicContact CG-CD1 4.08Å; L180-I184 WeakPolarHBondContact O-CD1 2.96Å; L180-I184 VanDerWaalsContact O-CG1 3.26Å; L180-I184 WeakPolarHBondContact O-CG1 3.43Å; L180-I184 PolarHBondContact O-N 2.54Å; L180-V192 HydrophobicContact CD1-CG1 3.85Å; L180-I195 HydrophobicContact CB-CG2 4.1Å; L180-I195 HydrophobicContact CD1-CB 4.18Å; L180-I195 HydrophobicContact CD1-CD1 4.4Å; L180-I195 HydrophobicContact CD1-CG2 3.95Å; L180-I195 HydrophobicContact CG-CG2 4.47Å; L180-I196 HydrophobicContact CD1-CD1 4.38Å; L180-I196 HydrophobicContact CD1-CG1 3.98Å; L180-I196 HydrophobicContact CD2-CG1 4.48Å; L180-Y201 HydrophobicContact CD2-CD2 4.5Å; L180-Y201 HydrophobicContact CD2-CE1 4.26Å; L180-Y201 HydrophobicContact CD2-CE2 3.51Å; L180-Y201 WeakPolarHBondContact CD2-OH 3.19Å; L180-P232 HydrophobicContact CD2-CB 4.25Å; L180-P232 HydrophobicContact CD2-CG 4.07Å
181	L	88.8	Confident	85.7	Confident	11 Å²	11	41 Å²	41	6%	0.058	21%	0.206	C	C	.	.	H	α-helix	trans	-61.5	-37.5	175.9	-67.4	172.3	0	0	0	111.3	E177 E178 I184 S185 F226 P232 L235	E177-L181 WeakPolarHBondContact O-CG 3.41Å; E177-L181 PolarHBondContact O-N 3.23Å; E178-L181 PolarHBondContact O-N 3.22Å; L181-I184 HydrophobicContact CD2-CD1 4.41Å; L181-I184 PolarHBondContact O-N 2.62Å; L181-S185 PolarHBondContact O-N 3.18Å; L181-F226 HydrophobicContact CB-CD2 3.52Å; L181-F226 HydrophobicContact CB-CE2 3.51Å; L181-F226 HydrophobicContact CB-CG 4.35Å; L181-F226 HydrophobicContact CB-CZ 4.34Å; L181-F226 HydrophobicContact CD1-CB 4.26Å; L181-F226 HydrophobicContact CD1-CD2 3.89Å; L181-F226 HydrophobicContact CD1-CG 4.32Å; L181-F226 HydrophobicContact CG-CD2 4.32Å; L181-P232 HydrophobicContact CD2-CB 4.46Å; L181-P232 HydrophobicContact CD2-CG 4.17Å; L181-L235 HydrophobicContact CB-CD2 3.88Å; L181-L235 HydrophobicContact CD2-CB 4.29Å; L181-L235 HydrophobicContact CD2-CD2 3.68Å; L181-L235 HydrophobicContact CG-CD2 4.38Å; L181-L235 VanDerWaalsContact O-CD2 3.25Å; L181-L235 WeakPolarHBondContact O-CD2 3.47Å
182	H	88.2	Confident	86.1	Confident	18 Å²	18	40.5 Å²	40.5	8%	0.083	20%	0.203	C	C	.	.	H	α-helix	trans	-65.6	-44.1	172.9	-173.3	67.9	0	0	0	112.6	H153 D157 E178 A179 L180 I184 S185 K186	H153-H182 WeakPolarHBondContact CD2-CB 3.32Å; H153-H182 AromaticContact CD2-CD2 3.77Å; H153-H182 AromaticContact CD2-CG 3.58Å; D157-H182 IonicContact OD1-CD2 2.64Å; D157-H182 IonicContact OD1-CE1 2.84Å; D157-H182 IonicContact OD1-NE2 3.39Å; D157-H182 PolarHBondContact OD1-NE2 3.44Å; D157-H182 IonicContact OD2-NE2 3.83Å; E178-H182 PolarHBondContact O-N 3.38Å; A179-H182 WeakPolarHBondContact O-CB 3.24Å; A179-H182 PolarHBondContact O-N 3.02Å; L180-H182 VanDerWaalsContact C-N 3.26Å; L180-H182 PolarHBondContact O-N 3.14Å; H182-I184 VanDerWaalsContact C-N 3.31Å; H182-I184 PolarHBondContact O-N 2.94Å; H182-S185 WeakPolarHBondContact O-CA 3.48Å; H182-S185 WeakPolarHBondContact O-CB 3.42Å; H182-S185 PolarHBondContact O-N 3.38Å; H182-S185 PolarHBondContact O-OG 3.45Å; H182-K186 WeakPolarHBondContact NE2-CE 3.27Å; H182-K186 PolarHBondContact O-N 3.09Å
183	A	90.6	Very high	86.6	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.5	-38.7	176.3	0	0	0	0	0	112.2	V156 A179 L180 S185 K186 G187 V192 I195	V156-A183 HydrophobicContact CG1-CB 3.79Å; V156-A183 HydrophobicContact CG2-CB 4.16Å; A179-A183 WeakPolarHBondContact O-CB 3.29Å; A179-A183 PolarHBondContact O-N 2.84Å; L180-A183 PolarHBondContact O-N 3.23Å; A183-S185 VanDerWaalsContact C-N 3.3Å; A183-S185 PolarHBondContact O-N 2.79Å; A183-K186 PolarHBondContact O-N 3.14Å; A183-G187 PolarHBondContact O-N 3.22Å; A183-V192 HydrophobicContact CB-CG2 3.69Å; A183-I195 HydrophobicContact CB-CD1 3.88Å
184	I	92.2	Very high	87	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.015	20%	0.204	C	C	.	.	H	α-helix	trans	-61.4	-41	170.8	-65.6	160.3	0	0	0	110.6	L180 L181 H182 K186 G187 V192 P232 L235 Y239 M244 F248	L180-I184 HydrophobicContact CD1-CD1 4.36Å; L180-I184 HydrophobicContact CG-CD1 4.08Å; L180-I184 WeakPolarHBondContact O-CD1 2.96Å; L180-I184 VanDerWaalsContact O-CG1 3.26Å; L180-I184 WeakPolarHBondContact O-CG1 3.43Å; L180-I184 PolarHBondContact O-N 2.54Å; L181-I184 HydrophobicContact CD2-CD1 4.41Å; L181-I184 PolarHBondContact O-N 2.62Å; H182-I184 VanDerWaalsContact C-N 3.31Å; H182-I184 PolarHBondContact O-N 2.94Å; I184-K186 VanDerWaalsContact C-N 3.32Å; I184-K186 PolarHBondContact O-N 2.91Å; I184-G187 PolarHBondContact O-N 3.39Å; I184-G187 VanDerWaalsContact O-N 3.15Å; I184-V192 HydrophobicContact CG1-CG2 4.2Å; I184-P232 HydrophobicContact CD1-CB 3.72Å; I184-L235 HydrophobicContact CB-CD2 4.15Å; I184-L235 HydrophobicContact CB-CG 4.48Å; I184-L235 HydrophobicContact CG2-CB 4.08Å; I184-L235 HydrophobicContact CG2-CD2 4.05Å; I184-L235 HydrophobicContact CG2-CG 3.82Å; I184-Y239 HydrophobicContact CG2-CD2 4.33Å; I184-M244 HydrophobicContact CB-CE 3.99Å; I184-M244 HydrophobicContact CG1-CE 3.4Å; I184-M244 VanDerWaalsContact CG1-CE 3.4Å; I184-M244 HydrophobicContact CG2-CE 4.1Å; I184-F248 HydrophobicContact CD1-CE2 4.09Å; I184-F248 HydrophobicContact CD1-CZ 4.03Å
185	S	90.2	Very high	87.7	Confident	27 Å²	27	35.1 Å²	35.1	19%	0.189	17%	0.172	C	C	.	.	H	α-helix	trans	-66.1	-31.6	-179.1	84.9	0	0	0	0	113.9	L181 H182 A183 G187	L181-S185 PolarHBondContact O-N 3.18Å; H182-S185 WeakPolarHBondContact O-CA 3.48Å; H182-S185 WeakPolarHBondContact O-CB 3.42Å; H182-S185 PolarHBondContact O-N 3.38Å; H182-S185 PolarHBondContact O-OG 3.45Å; A183-S185 VanDerWaalsContact C-N 3.3Å; A183-S185 PolarHBondContact O-N 2.79Å; S185-G187 VanDerWaalsContact C-N 3.32Å
186	K	86	Confident	88	Confident	98 Å²	98	34.2 Å²	34.2	43%	0.426	17%	0.166	S	C	.	.	H	α-helix	trans	-71.6	-28.5	173.9	-66.5	-70.8	179.4	143.5	0	112.2	V156 D157 H182 A183 I184 H188	V156-K186 HydrophobicContact CG1-CG 4.5Å; D157-K186 WeakPolarHBondContact OD1-CE 3.35Å; D157-K186 IonicContact OD1-NZ 2.99Å; D157-K186 PolarHBondContact OD1-NZ 3.2Å; H182-K186 WeakPolarHBondContact NE2-CE 3.27Å; H182-K186 PolarHBondContact O-N 3.09Å; A183-K186 PolarHBondContact O-N 3.14Å; I184-K186 VanDerWaalsContact C-N 3.32Å; I184-K186 PolarHBondContact O-N 2.91Å; K186-H188 PolarHBondContact O-CD2 3.31Å; K186-H188 VanDerWaalsContact O-CD2 3.32Å
187	G	84.7	Confident	88.1	Confident	30 Å²	30	38.5 Å²	38.5	31%	0.309	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	20.3	178	0	0	0	0	0	114.6	A183 I184 S185 P189	A183-G187 PolarHBondContact O-N 3.22Å; I184-G187 PolarHBondContact O-N 3.39Å; I184-G187 VanDerWaalsContact O-N 3.15Å; S185-G187 VanDerWaalsContact C-N 3.32Å; G187-P189 VanDerWaalsContact O-CD 3.22Å; G187-P189 WeakPolarHBondContact O-CD 3.45Å
188	H	85.6	Confident	88.2	Confident	60 Å²	60	37.6 Å²	37.6	28%	0.278	18%	0.182	S	C	.	.			trans	-97.5	101.8	-177.7	-66.2	-123.3	0	0	0	110.1	E159 K186 K190 L191 V192	E159-H188 IonicContact OE1-CE1 2.84Å; E159-H188 PolarHBondContact OE1-CE1 3.01Å; E159-H188 IonicContact OE1-ND1 3.52Å; E159-H188 IonicContact OE1-NE2 2.85Å; E159-H188 IonicContact OE2-CE1 3.02Å; E159-H188 PolarHBondContact OE2-CE1 3.05Å; E159-H188 IonicContact OE2-ND1 2.62Å; E159-H188 PolarHBondContact OE2-ND1 3.5Å; K186-H188 PolarHBondContact O-CD2 3.31Å; K186-H188 VanDerWaalsContact O-CD2 3.32Å; H188-K190 VanDerWaalsContact C-N 3.3Å; H188-K190 PolarHBondContact O-N 3.32Å; H188-L191 HydrophobicContact CB-CB 4.36Å; H188-L191 HydrophobicContact CB-CD1 3.86Å; H188-L191 HydrophobicContact CB-CG 3.92Å; H188-L191 PolarHBondContact O-N 2.78Å; H188-V192 WeakPolarHBondContact O-CG2 3.09Å; H188-V192 PolarHBondContact O-N 3.13Å
189	P	87.6	Confident	88.3	Confident	30 Å²	30	39 Å²	39	20%	0.195	20%	0.195	C	C	.	.	H	α-helix	trans	-68.5	-28.3	-174	26.9	-34.3	0	0	0	113.4	G187 V192 R193 E243 M244 M247	G187-P189 VanDerWaalsContact O-CD 3.22Å; G187-P189 WeakPolarHBondContact O-CD 3.45Å; P189-V192 PolarHBondContact O-N 3.13Å; P189-R193 WeakPolarHBondContact O-CB 3.47Å; P189-R193 PolarHBondContact O-N 3.06Å; P189-E243 HydrophobicContact CB-CB 4.21Å; P189-E243 VanDerWaalsContact CB-OE2 3.29Å; P189-E243 WeakPolarHBondContact CB-OE2 3.3Å; P189-E243 WeakPolarHBondContact CG-OE2 3.42Å; P189-M244 VanDerWaalsContact CA-SD 3.55Å; P189-M244 HydrophobicContact CB-CG 4.4Å; P189-M244 HydrophobicContact CB-SD 3.91Å; P189-M247 HydrophobicContact CB-CE 4.08Å
190	K	88.9	Confident	88	Confident	173 Å²	173	41.9 Å²	41.9	75%	0.752	21%	0.211	S	C	*	.	H	α-helix	trans	-62.9	-49.1	177.3	-64.9	179	-176.1	171	0	111.9	H188 V192 R193 V194	H188-K190 VanDerWaalsContact C-N 3.3Å; H188-K190 PolarHBondContact O-N 3.32Å; K190-V192 VanDerWaalsContact C-N 3.3Å; K190-V192 PolarHBondContact O-N 3.32Å; K190-R193 WeakPolarHBondContact O-CB 3.38Å; K190-R193 PolarHBondContact O-N 3.33Å; K190-V194 WeakPolarHBondContact O-CG2 3.46Å; K190-V194 PolarHBondContact O-N 3.03Å; K190-V194 VanDerWaalsContact O-N 3.15Å
191	L	89.9	Confident	87.7	Confident	5 Å²	5	42.4 Å²	42.4	3%	0.026	21%	0.212	C	C	.	.	H	α-helix	trans	-62.5	-41.8	-180	-57	-175.9	0	0	0	111	V156 E159 T161 M164 H188 R193 V194 I195	V156-L191 HydrophobicContact CG1-CD1 4.17Å; E159-L191 HydrophobicContact CG-CD1 4.37Å; T161-L191 HydrophobicContact CG2-CD2 3.98Å; M164-L191 HydrophobicContact CE-CB 4.14Å; M164-L191 HydrophobicContact SD-CB 4.3Å; M164-L191 HydrophobicContact SD-CD2 3.79Å; M164-L191 HydrophobicContact SD-CG 4.43Å; H188-L191 HydrophobicContact CB-CB 4.36Å; H188-L191 HydrophobicContact CB-CD1 3.86Å; H188-L191 HydrophobicContact CB-CG 3.92Å; H188-L191 PolarHBondContact O-N 2.78Å; L191-R193 VanDerWaalsContact C-N 3.31Å; L191-R193 PolarHBondContact O-N 3Å; L191-V194 PolarHBondContact O-N 3.24Å; L191-I195 WeakPolarHBondContact O-CG1 3.48Å; L191-I195 PolarHBondContact O-N 3.33Å; L191-I195 VanDerWaalsContact O-N 3.12Å
192	V	91.1	Very high	87.4	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.5	-38.5	178.7	171.2	0	0	0	0	111.2	L180 A183 I184 H188 P189 K190 V194 I195 I196 M244 M247	L180-V192 HydrophobicContact CD1-CG1 3.85Å; A183-V192 HydrophobicContact CB-CG2 3.69Å; I184-V192 HydrophobicContact CG1-CG2 4.2Å; H188-V192 WeakPolarHBondContact O-CG2 3.09Å; H188-V192 PolarHBondContact O-N 3.13Å; P189-V192 PolarHBondContact O-N 3.13Å; K190-V192 VanDerWaalsContact C-N 3.3Å; K190-V192 PolarHBondContact O-N 3.32Å; V192-V194 VanDerWaalsContact C-N 3.34Å; V192-V194 PolarHBondContact O-N 2.84Å; V192-I195 PolarHBondContact O-N 3.4Å; V192-I196 HydrophobicContact CG1-CD1 3.38Å; V192-I196 HydrophobicContact CG1-CG1 4.09Å; V192-I196 VanDerWaalsContact O-CG1 3.23Å; V192-I196 WeakPolarHBondContact O-CG1 3.42Å; V192-I196 PolarHBondContact O-N 2.77Å; V192-M244 HydrophobicContact CB-CE 3.66Å; V192-M244 HydrophobicContact CB-SD 3.69Å; V192-M244 HydrophobicContact CG1-CE 3.44Å; V192-M244 VanDerWaalsContact CG1-CE 3.44Å; V192-M244 HydrophobicContact CG1-SD 3.79Å; V192-M244 HydrophobicContact CG2-CE 3.39Å; V192-M244 HydrophobicContact CG2-SD 3.84Å; V192-M247 HydrophobicContact CB-CE 4.39Å; V192-M247 HydrophobicContact CG1-CE 4.11Å
193	R	90.9	Very high	86.9	Confident	139 Å²	139	47.4 Å²	47.4	53%	0.525	24%	0.244	S	C	.	.	H	α-helix	trans	-60	-44.3	174.9	-173.4	175.9	179	-176.4	-4.4	111.8	P189 K190 L191 I195 I196 E197 M247	P189-R193 WeakPolarHBondContact O-CB 3.47Å; P189-R193 PolarHBondContact O-N 3.06Å; K190-R193 WeakPolarHBondContact O-CB 3.38Å; K190-R193 PolarHBondContact O-N 3.33Å; L191-R193 VanDerWaalsContact C-N 3.31Å; L191-R193 PolarHBondContact O-N 3Å; R193-I195 PolarHBondContact O-N 3.42Å; R193-I196 PolarHBondContact O-N 3.26Å; R193-E197 VanDerWaalsContact CG-CD 3.5Å; R193-E197 HydrophobicContact CG-CG 4.2Å; R193-E197 WeakPolarHBondContact CG-OE1 3.34Å; R193-E197 IonicContact CZ-OE1 3.29Å; R193-E197 IonicContact NE-OE1 2.65Å; R193-E197 PolarHBondContact NE-OE1 3.26Å; R193-E197 IonicContact NE-OE2 3.54Å; R193-E197 IonicContact NH2-OE1 3.38Å; R193-E197 PolarHBondContact NH2-OE1 2.93Å; R193-E197 VanDerWaalsContact O-CB 3.28Å; R193-E197 WeakPolarHBondContact O-CB 3.45Å; R193-E197 WeakPolarHBondContact O-CG 3.49Å; R193-E197 PolarHBondContact O-N 3.36Å; R193-M247 HydrophobicContact CB-SD 3.91Å; R193-M247 HydrophobicContact CG-SD 4.28Å
194	V	89.9	Confident	86	Confident	31 Å²	31	47.7 Å²	47.7	19%	0.188	25%	0.247	C	C	.	.	H	α-helix	trans	-58.9	-47	176.3	175.3	0	0	0	0	110.8	E165 L168 K190 L191 V192 I196 H198	E165-V194 HydrophobicContact CG-CG1 3.95Å; L168-V194 HydrophobicContact CD1-CG1 4.31Å; K190-V194 WeakPolarHBondContact O-CG2 3.46Å; K190-V194 PolarHBondContact O-N 3.03Å; K190-V194 VanDerWaalsContact O-N 3.15Å; L191-V194 PolarHBondContact O-N 3.24Å; V192-V194 VanDerWaalsContact C-N 3.34Å; V192-V194 PolarHBondContact O-N 2.84Å; V194-I196 PolarHBondContact O-N 2.92Å; V194-H198 PolarHBondContact O-N 3.05Å
195	I	90.1	Very high	85.1	Confident	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-63.4	-45	179.8	-61.7	168.5	0	0	0	111.7	V156 M164 L168 I176 L180 A183 L191 V192 R193 H198 Y201	V156-I195 HydrophobicContact CG2-CD1 4.34Å; M164-I195 HydrophobicContact CE-CD1 3.63Å; M164-I195 HydrophobicContact CE-CG1 3.49Å; M164-I195 VanDerWaalsContact CE-CG1 3.49Å; L168-I195 HydrophobicContact CD1-CG1 4.42Å; L168-I195 HydrophobicContact CD2-CG2 4.33Å; I176-I195 HydrophobicContact CG2-CG2 3.84Å; L180-I195 HydrophobicContact CB-CG2 4.1Å; L180-I195 HydrophobicContact CD1-CB 4.18Å; L180-I195 HydrophobicContact CD1-CD1 4.4Å; L180-I195 HydrophobicContact CD1-CG2 3.95Å; L180-I195 HydrophobicContact CG-CG2 4.47Å; A183-I195 HydrophobicContact CB-CD1 3.88Å; L191-I195 WeakPolarHBondContact O-CG1 3.48Å; L191-I195 PolarHBondContact O-N 3.33Å; L191-I195 VanDerWaalsContact O-N 3.12Å; V192-I195 PolarHBondContact O-N 3.4Å; R193-I195 PolarHBondContact O-N 3.42Å; I195-H198 WeakPolarHBondContact O-CB 3.47Å; I195-H198 PolarHBondContact O-N 3.44Å; I195-Y201 HydrophobicContact CG2-CD2 4.45Å; I195-Y201 VanDerWaalsContact O-CB 3.27Å; I195-Y201 WeakPolarHBondContact O-CB 3.48Å
196	I	87.8	Confident	84.2	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-75.2	-31.6	-175.9	-59.6	168.7	0	0	0	112	L180 V192 R193 V194 H198 Y201 Q202 F248 R251	L180-I196 HydrophobicContact CD1-CD1 4.38Å; L180-I196 HydrophobicContact CD1-CG1 3.98Å; L180-I196 HydrophobicContact CD2-CG1 4.48Å; V192-I196 HydrophobicContact CG1-CD1 3.38Å; V192-I196 HydrophobicContact CG1-CG1 4.09Å; V192-I196 VanDerWaalsContact O-CG1 3.23Å; V192-I196 WeakPolarHBondContact O-CG1 3.42Å; V192-I196 PolarHBondContact O-N 2.77Å; R193-I196 PolarHBondContact O-N 3.26Å; V194-I196 PolarHBondContact O-N 2.92Å; I196-H198 VanDerWaalsContact C-N 3.27Å; I196-Y201 HydrophobicContact CB-CD1 4.48Å; I196-Y201 HydrophobicContact CG1-CE1 4.31Å; I196-Y201 HydrophobicContact CG2-CD1 4.39Å; I196-Y201 HydrophobicContact CG2-CE1 4.25Å; I196-Q202 PolarHBondContact O-NE2 3.49Å; I196-F248 HydrophobicContact CD1-CD1 4.26Å; I196-F248 HydrophobicContact CD1-CE1 3.48Å; I196-F248 VanDerWaalsContact CD1-CE1 3.48Å; I196-F248 HydrophobicContact CD1-CE2 4.18Å; I196-F248 HydrophobicContact CD1-CZ 3.42Å; I196-F248 VanDerWaalsContact CD1-CZ 3.42Å; I196-F248 HydrophobicContact CG1-CE1 4.28Å; I196-F248 HydrophobicContact CG1-CZ 4.39Å; I196-R251 VanDerWaalsContact CG2-NE 3.31Å
197	E	87.1	Confident	83.1	Confident	92 Å²	92	51.3 Å²	51.3	43%	0.43	27%	0.265	S	S	.	.	H	α-helix	trans	-75.4	-16.1	177.4	-72.1	178.6	177.7	0	0	112.8	R193 Q202 R251	R193-E197 VanDerWaalsContact CG-CD 3.5Å; R193-E197 HydrophobicContact CG-CG 4.2Å; R193-E197 WeakPolarHBondContact CG-OE1 3.34Å; R193-E197 IonicContact CZ-OE1 3.29Å; R193-E197 IonicContact NE-OE1 2.65Å; R193-E197 PolarHBondContact NE-OE1 3.26Å; R193-E197 IonicContact NE-OE2 3.54Å; R193-E197 IonicContact NH2-OE1 3.38Å; R193-E197 PolarHBondContact NH2-OE1 2.93Å; R193-E197 VanDerWaalsContact O-CB 3.28Å; R193-E197 WeakPolarHBondContact O-CB 3.45Å; R193-E197 WeakPolarHBondContact O-CG 3.49Å; R193-E197 PolarHBondContact O-N 3.36Å; E197-Q202 PolarHBondContact O-NE2 2.99Å; E197-Q202 VanDerWaalsContact O-NE2 3.15Å; E197-R251 VanDerWaalsContact CG-NH2 3.35Å
198	H	85	Confident	82.3	Confident	23 Å²	23	53 Å²	53	11%	0.106	27%	0.266	C	S	.	.	S	Bend	trans	-67	136.7	-179.2	-157.9	-90.2	0	0	0	113.3	L168 D169 V194 I195 I196 N200 Y201 Q202	L168-H198 HydrophobicContact CD1-CB 4.06Å; D169-H198 IonicContact OD1-CE1 3.96Å; D169-H198 PolarHBondContact OD1-CE1 3.12Å; D169-H198 IonicContact OD1-NE2 2.74Å; D169-H198 PolarHBondContact OD1-NE2 2.97Å; V194-H198 PolarHBondContact O-N 3.05Å; I195-H198 WeakPolarHBondContact O-CB 3.47Å; I195-H198 PolarHBondContact O-N 3.44Å; I196-H198 VanDerWaalsContact C-N 3.27Å; H198-N200 VanDerWaalsContact C-N 3.33Å; H198-N200 PolarHBondContact ND1-N 3.48Å; H198-N200 PolarHBondContact O-N 3.22Å; H198-Y201 PolarHBondContact O-N 2.87Å; H198-Q202 PolarHBondContact O-N 3.19Å
199	P	83	Confident	81.2	Confident	80 Å²	80	55.9 Å²	55.9	52%	0.519	28%	0.278	S	S	.	.	H	α-helix	trans	-60.7	-36.6	-177.5	22.2	-34.2	0	0	0	113.6	Y201 Q202 A203	P199-Y201 VanDerWaalsContact C-N 3.34Å; P199-Y201 PolarHBondContact O-N 3.19Å; P199-Q202 PolarHBondContact O-N 3.02Å; P199-A203 WeakPolarHBondContact O-CB 3.2Å; P199-A203 PolarHBondContact O-N 3Å
200	N	80.8	Confident	79.8	Confident	60 Å²	60	63.1 Å²	63.1	32%	0.321	30%	0.301	S	S	.	.	H	α-helix	trans	-64.9	-37	179.4	-74.1	-10.4	0	0	0	112.8	L168 D169 H198 G204	L168-N200 PolarHBondContact O-ND2 3.31Å; D169-N200 VanDerWaalsContact CA-ND2 3.31Å; D169-N200 WeakPolarHBondContact CA-ND2 3.42Å; D169-N200 PolarHBondContact O-ND2 3.18Å; H198-N200 VanDerWaalsContact C-N 3.33Å; H198-N200 PolarHBondContact ND1-N 3.48Å; H198-N200 PolarHBondContact O-N 3.22Å; N200-G204 PolarHBondContact O-N 3.25Å; N200-G204 VanDerWaalsContact O-N 3.16Å
201	Y	83.5	Confident	77.9	Confident	10 Å²	10	61.7 Å²	61.7	4%	0.039	30%	0.299	C	S	.	.	H	α-helix	trans	-68.7	-46.8	175.7	-177.4	-99	0	0	0	111	F173 I176 L180 I195 I196 H198 P199 A203 G204 E205	F173-Y201 AromaticContact CE2-CD2 3.92Å; F173-Y201 HydrophobicContact CE2-CD2 3.92Å; F173-Y201 HydrophobicContact CE2-CE2 4.03Å; F173-Y201 HydrophobicContact CZ-CE2 4.21Å; I176-Y201 HydrophobicContact CG2-CD2 3.75Å; L180-Y201 HydrophobicContact CD2-CD2 4.5Å; L180-Y201 HydrophobicContact CD2-CE1 4.26Å; L180-Y201 HydrophobicContact CD2-CE2 3.51Å; L180-Y201 WeakPolarHBondContact CD2-OH 3.19Å; I195-Y201 HydrophobicContact CG2-CD2 4.45Å; I195-Y201 VanDerWaalsContact O-CB 3.27Å; I195-Y201 WeakPolarHBondContact O-CB 3.48Å; I196-Y201 HydrophobicContact CB-CD1 4.48Å; I196-Y201 HydrophobicContact CG1-CE1 4.31Å; I196-Y201 HydrophobicContact CG2-CD1 4.39Å; I196-Y201 HydrophobicContact CG2-CE1 4.25Å; H198-Y201 PolarHBondContact O-N 2.87Å; P199-Y201 VanDerWaalsContact C-N 3.34Å; P199-Y201 PolarHBondContact O-N 3.19Å; Y201-A203 VanDerWaalsContact C-N 3.32Å; Y201-A203 PolarHBondContact O-N 3.17Å; Y201-G204 PolarHBondContact O-N 2.94Å; Y201-E205 HydrophobicContact CE1-CB 4.46Å; Y201-E205 VanDerWaalsContact O-CB 3.32Å; Y201-E205 WeakPolarHBondContact O-CB 3.48Å; Y201-E205 PolarHBondContact O-N 3.4Å
202	Q	82.1	Confident	76.1	Confident	84 Å²	84	64.6 Å²	64.6	39%	0.393	32%	0.315	S	S	.	.	H	α-helix	trans	-59.8	-42.1	178.4	-68.5	175.5	12.2	0	0	112.1	I196 E197 H198 P199 E205 D206	I196-Q202 PolarHBondContact O-NE2 3.49Å; E197-Q202 PolarHBondContact O-NE2 2.99Å; E197-Q202 VanDerWaalsContact O-NE2 3.15Å; H198-Q202 PolarHBondContact O-N 3.19Å; P199-Q202 PolarHBondContact O-N 3.02Å; Q202-E205 PolarHBondContact O-N 3.18Å; Q202-D206 WeakPolarHBondContact O-CB 3.33Å; Q202-D206 PolarHBondContact O-N 3.19Å; Q202-D206 VanDerWaalsContact O-N 3.1Å
203	A	77.2	Confident	74.2	Confident	50 Å²	50	69.1 Å²	69.1	41%	0.413	35%	0.347	S	S	.	.	H	α-helix	trans	-63.9	-41	177.9	0	0	0	0	0	112.5	P199 Y201 Q207	P199-A203 WeakPolarHBondContact O-CB 3.2Å; P199-A203 PolarHBondContact O-N 3Å; Y201-A203 VanDerWaalsContact C-N 3.32Å; Y201-A203 PolarHBondContact O-N 3.17Å; A203-Q207 WeakPolarHBondContact O-CG 3.43Å; A203-Q207 PolarHBondContact O-N 2.98Å
204	G	71.5	Confident	72.3	Confident	7 Å²	7	68.8 Å²	68.8	7%	0.072	35%	0.345	C	S	.	.	H	α-helix	trans	-75.2	-35.2	177.8	0	0	0	0	0	113.5	F173 N200 Y201 D206 Q207 I208	F173-G204 VanDerWaalsContact CD2-CA 3.45Å; F173-G204 VanDerWaalsContact CE2-C 3.4Å; N200-G204 PolarHBondContact O-N 3.25Å; N200-G204 VanDerWaalsContact O-N 3.16Å; Y201-G204 PolarHBondContact O-N 2.94Å; G204-D206 VanDerWaalsContact C-N 3.33Å; G204-D206 PolarHBondContact O-N 2.89Å; G204-Q207 WeakPolarHBondContact O-CB 3.5Å; G204-Q207 PolarHBondContact O-N 3.26Å; G204-Q207 VanDerWaalsContact O-N 3.14Å; G204-I208 PolarHBondContact O-N 2.89Å; G204-I208 VanDerWaalsContact O-N 3.09Å
205	E	74.9	Confident	70.8	Confident	18 Å²	18	71.9 Å²	71.9	8%	0.084	36%	0.361	C	S	.	.	H	α-helix	trans	-61.4	-43.4	175.1	-166.9	-160.2	148.1	0	0	111.3	Y201 Q202 Q207 I208 K209 H253	Y201-E205 HydrophobicContact CE1-CB 4.46Å; Y201-E205 VanDerWaalsContact O-CB 3.32Å; Y201-E205 WeakPolarHBondContact O-CB 3.48Å; Y201-E205 PolarHBondContact O-N 3.4Å; Q202-E205 PolarHBondContact O-N 3.18Å; E205-Q207 VanDerWaalsContact C-N 3.27Å; E205-Q207 PolarHBondContact O-N 3.12Å; E205-I208 PolarHBondContact O-N 3.11Å; E205-K209 WeakPolarHBondContact O-CG 3.38Å; E205-K209 PolarHBondContact O-N 2.88Å; E205-K209 WeakPolarHBondContact OE1-CE 3.49Å; E205-K209 IonicContact OE1-NZ 3.85Å; E205-K209 PolarHBondContact OE1-NZ 3.08Å; E205-H253 IonicContact OE1-CE1 3.34Å; E205-H253 PolarHBondContact OE1-CE1 3.09Å; E205-H253 IonicContact OE1-NE2 3.75Å; E205-H253 PolarHBondContact OE1-NE2 3.4Å
206	D	69.9	Low	69.4	Low	70 Å²	70	73.6 Å²	73.6	37%	0.374	38%	0.375	S	S	.	.	H	α-helix	trans	-63.1	-31.7	175.2	-92.2	1.1	0	0	0	113	Q202 G204 R210	Q202-D206 WeakPolarHBondContact O-CB 3.33Å; Q202-D206 PolarHBondContact O-N 3.19Å; Q202-D206 VanDerWaalsContact O-N 3.1Å; G204-D206 VanDerWaalsContact C-N 3.33Å; G204-D206 PolarHBondContact O-N 2.89Å; D206-R210 VanDerWaalsContact O-CG 3.27Å; D206-R210 WeakPolarHBondContact O-CG 3.48Å; D206-R210 PolarHBondContact O-N 3.32Å; D206-R210 PolarHBondContact O-NE 3.21Å; D206-R210 IonicContact OD2-NH2 3.69Å
207	Q	64.3	Low	68.3	Low	115 Å²	115	74.1 Å²	74.1	54%	0.537	38%	0.377	S	S	.	.	H	α-helix	trans	-69.5	-40.9	173.5	-69.8	174.6	28.2	0	0	111.3	A203 G204 E205 R210 M211	A203-Q207 WeakPolarHBondContact O-CG 3.43Å; A203-Q207 PolarHBondContact O-N 2.98Å; G204-Q207 WeakPolarHBondContact O-CB 3.5Å; G204-Q207 PolarHBondContact O-N 3.26Å; G204-Q207 VanDerWaalsContact O-N 3.14Å; E205-Q207 VanDerWaalsContact C-N 3.27Å; E205-Q207 PolarHBondContact O-N 3.12Å; Q207-R210 PolarHBondContact O-N 3.41Å; Q207-M211 PolarHBondContact O-N 3.37Å; Q207-M211 VanDerWaalsContact O-N 3.13Å
208	I	66.4	Low	67.2	Low	66 Å²	66	73 Å²	73	34%	0.338	37%	0.371	S	S	.	.	H	α-helix	trans	-67.1	-41.1	177.5	-68.4	-175.9	0	0	0	111.7	F173 G204 E205 R210 M211	F173-I208 HydrophobicContact CD1-CD1 3.87Å; F173-I208 HydrophobicContact CE1-CD1 3.09Å; F173-I208 HydrophobicContact CE1-CG1 4.21Å; F173-I208 HydrophobicContact CZ-CD1 3.61Å; G204-I208 PolarHBondContact O-N 2.89Å; G204-I208 VanDerWaalsContact O-N 3.09Å; E205-I208 PolarHBondContact O-N 3.11Å; I208-R210 PolarHBondContact O-N 2.99Å; I208-M211 PolarHBondContact O-N 3.06Å
209	K	63.4	Low	66.2	Low	121 Å²	121	77.2 Å²	77.2	53%	0.526	39%	0.386	S	S	.	.	H	α-helix	trans	-57.6	-31.1	174.6	-74.8	176.4	-176.7	164.3	0	112.3	E205	E205-K209 WeakPolarHBondContact O-CG 3.38Å; E205-K209 PolarHBondContact O-N 2.88Å; E205-K209 WeakPolarHBondContact OE1-CE 3.49Å; E205-K209 IonicContact OE1-NZ 3.85Å; E205-K209 PolarHBondContact OE1-NZ 3.08Å
210	R	57.1	Low	64.9	Low	181 Å²	181	77.4 Å²	77.4	68%	0.683	39%	0.386	S	S	*	.	H	α-helix	trans	-84.5	-25	179	-67.1	175.2	-153.7	134.4	5.4	114	D206 Q207 I208	D206-R210 VanDerWaalsContact O-CG 3.27Å; D206-R210 WeakPolarHBondContact O-CG 3.48Å; D206-R210 PolarHBondContact O-N 3.32Å; D206-R210 PolarHBondContact O-NE 3.21Å; D206-R210 IonicContact OD2-NH2 3.69Å; Q207-R210 PolarHBondContact O-N 3.41Å; I208-R210 PolarHBondContact O-N 2.99Å
211	M	50.7	Low	63.7	Low	143 Å²	143	79.6 Å²	79.6	70%	0.704	40%	0.402	S	S	*	.	S	Bend	trans	-96.5	14.6	-174.8	-74.9	-172.6	73.9	0	0	115.5	Q207 I208 N215	Q207-M211 PolarHBondContact O-N 3.37Å; Q207-M211 VanDerWaalsContact O-N 3.13Å; I208-M211 PolarHBondContact O-N 3.06Å; M211-N215 PolarHBondContact O-ND2 3.4Å
212	D	51.3	Low	62.4	Low	66 Å²	66	87.8 Å²	87.8	35%	0.353	44%	0.44	S	S	.	.			trans	78.5	122.3	170.5	-146.2	1.6	0	0	0	113.9	R214	D212-R214 PolarHBondContact O-N 2.88Å; D212-R214 IonicContact OD1-CZ 3.87Å; D212-R214 IonicContact OD1-NE 3.2Å; D212-R214 PolarHBondContact OD1-NE 3.5Å; D212-R214 IonicContact OD1-NH2 2.8Å; D212-R214 PolarHBondContact OD1-NH2 2.94Å; D212-R214 WeakPolarHBondContact OD2-CD 3.42Å; D212-R214 IonicContact OD2-CZ 2.66Å; D212-R214 IonicContact OD2-NE 2.83Å; D212-R214 PolarHBondContact OD2-NE 3.35Å; D212-R214 IonicContact OD2-NH1 2.88Å; D212-R214 IonicContact OD2-NH2 3.66Å; D212-R214 PolarHBondContact OD2-NH2 3.47Å
213	S	51.8	Low	61.2	Low	96 Å²	96	92.7 Å²	92.7	67%	0.671	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-1.4	174.4	54.7	0	0	0	0	114.2
214	R	51.2	Low	60.7	Low	132 Å²	132	92.4 Å²	92.4	50%	0.498	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-22.1	-174.9	-64.6	-178.4	-141.1	170.3	15	113.8	D212 F218	D212-R214 PolarHBondContact O-N 2.88Å; D212-R214 IonicContact OD1-CZ 3.87Å; D212-R214 IonicContact OD1-NE 3.2Å; D212-R214 PolarHBondContact OD1-NE 3.5Å; D212-R214 IonicContact OD1-NH2 2.8Å; D212-R214 PolarHBondContact OD1-NH2 2.94Å; D212-R214 WeakPolarHBondContact OD2-CD 3.42Å; D212-R214 IonicContact OD2-CZ 2.66Å; D212-R214 IonicContact OD2-NE 2.83Å; D212-R214 PolarHBondContact OD2-NE 3.35Å; D212-R214 IonicContact OD2-NH1 2.88Å; D212-R214 IonicContact OD2-NH2 3.66Å; D212-R214 PolarHBondContact OD2-NH2 3.47Å; R214-F218 WeakPolarHBondContact O-CD2 3.22Å; R214-F218 WeakPolarHBondContact O-CE2 3.45Å
215	N	58	Low	60.9	Low	96 Å²	96	99.6 Å²	99.6	51%	0.513	49%	0.487	S	S	.	.	S	Bend	trans	-84.2	-23.4	-173	-68.6	-32	0	0	0	114.3	M211 F217 F218	M211-N215 PolarHBondContact O-ND2 3.4Å; N215-F217 VanDerWaalsContact C-N 3.31Å; N215-F217 PolarHBondContact O-N 2.98Å; N215-F218 PolarHBondContact O-N 3.37Å; N215-F218 VanDerWaalsContact O-N 3.12Å
216	A	61.3	Low	61	Low	35 Å²	35	100.2 Å²	100.2	29%	0.289	49%	0.489	S	S	.	.	G	3₁₀ helix	trans	-59.8	-39.4	-175.7	0	0	0	0	0	112.6	F218 R219	A216-F218 PolarHBondContact O-N 2.91Å; A216-R219 PolarHBondContact O-N 2.83Å
217	F	64.5	Low	61.4	Low	12 Å²	12	99.4 Å²	99.4	5%	0.053	49%	0.489	C	S	.	.	G	3₁₀ helix	trans	-60.7	-29.9	179	-174.1	-95.3	0	0	0	113.7	N215 R271 Y274 K278 R279	N215-F217 VanDerWaalsContact C-N 3.31Å; N215-F217 PolarHBondContact O-N 2.98Å; F217-R271 HydrophobicContact CD1-CB 4.41Å; F217-R271 HydrophobicContact CD1-CG 3.83Å; F217-R271 HydrophobicContact CD2-CG 4.47Å; F217-R271 HydrophobicContact CE1-CB 3.88Å; F217-R271 HydrophobicContact CE1-CG 3.83Å; F217-R271 HydrophobicContact CE2-CG 4.46Å; F217-R271 HydrophobicContact CG-CG 4.16Å; F217-R271 HydrophobicContact CZ-CB 3.96Å; F217-R271 HydrophobicContact CZ-CG 4.16Å; F217-Y274 HydrophobicContact CD1-CD1 4.35Å; F217-Y274 AromaticContact CE1-CD1 3.85Å; F217-Y274 HydrophobicContact CE1-CD1 3.85Å; F217-K278 HydrophobicContact CE2-CB 3.67Å; F217-K278 HydrophobicContact CZ-CB 3.64Å; F217-R279 HydrophobicContact CE2-CB 4.5Å; F217-R279 HydrophobicContact CZ-CB 4.28Å
218	F	63.8	Low	61.8	Low	69 Å²	69	96.5 Å²	96.5	30%	0.303	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-94	1	-176.5	-57.4	-75.9	0	0	0	113.4	R214 N215 A216 T220 V270 Y274	R214-F218 WeakPolarHBondContact O-CD2 3.22Å; R214-F218 WeakPolarHBondContact O-CE2 3.45Å; N215-F218 PolarHBondContact O-N 3.37Å; N215-F218 VanDerWaalsContact O-N 3.12Å; A216-F218 PolarHBondContact O-N 2.91Å; F218-T220 PolarHBondContact O-N 3.29Å; F218-V270 HydrophobicContact CE1-CG1 4.28Å; F218-V270 HydrophobicContact CZ-CG1 3.84Å; F218-Y274 AromaticContact CD1-CD1 3.91Å; F218-Y274 HydrophobicContact CD1-CD1 3.91Å; F218-Y274 AromaticContact CD1-CD2 3.76Å; F218-Y274 HydrophobicContact CD1-CD2 3.76Å; F218-Y274 AromaticContact CD1-CE1 3.96Å; F218-Y274 HydrophobicContact CD1-CE1 3.96Å; F218-Y274 AromaticContact CD1-CE2 3.82Å; F218-Y274 HydrophobicContact CD1-CE2 3.82Å; F218-Y274 AromaticContact CD1-CG 3.81Å; F218-Y274 HydrophobicContact CD1-CG 3.81Å; F218-Y274 AromaticContact CD1-CZ 3.92Å; F218-Y274 HydrophobicContact CE1-CD1 4.11Å; F218-Y274 AromaticContact CE1-CD2 3.87Å; F218-Y274 HydrophobicContact CE1-CD2 3.87Å; F218-Y274 HydrophobicContact CE1-CE2 4.4Å; F218-Y274 AromaticContact CE1-CG 3.71Å; F218-Y274 HydrophobicContact CE1-CG 3.71Å
219	R	64	Low	62.3	Low	110 Å²	110	94.8 Å²	94.8	42%	0.415	47%	0.472	S	S	.	.			trans	-65.3	119.3	173.6	-68.8	-174.1	-173.5	173.6	2.3	109.2	E177 A216 P228	E177-R219 IonicContact OE2-NH1 3.45Å; A216-R219 PolarHBondContact O-N 2.83Å; R219-P228 HydrophobicContact CB-CB 4.4Å
220	T	55.8	Low	63.4	Low	85 Å²	85	90.1 Å²	90.1	52%	0.521	45%	0.452	S	S	.	.			trans	-105.9	0.5	177.9	47.1	0	0	0	0	113.2	F218 E222 Y274	F218-T220 PolarHBondContact O-N 3.29Å; T220-E222 PolarHBondContact O-N 3.5Å; T220-E222 VanDerWaalsContact O-N 3.13Å; T220-Y274 VanDerWaalsContact CG2-OH 3.29Å; T220-Y274 WeakPolarHBondContact CG2-OH 3.25Å
221	T	54.8	Low	64.8	Low	106 Å²	106	84.6 Å²	84.6	65%	0.65	44%	0.438	S	S	*	.			trans	-76	101.4	-179.7	48.2	0	0	0	0	109.8	K223	T221-K223 PolarHBondContact O-N 2.98Å
222	E	55.6	Low	66.6	Low	181 Å²	181	78.6 Å²	78.6	85%	0.846	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	26	-175	-59.1	-177.8	161	0	0	114.8	T220	T220-E222 PolarHBondContact O-N 3.5Å; T220-E222 VanDerWaalsContact O-N 3.13Å
223	K	58	Low	68.5	Low	188 Å²	188	75.7 Å²	75.7	82%	0.817	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-23.9	-177.7	-67.3	-168.9	177.8	-173	0	113.9	T221	T221-K223 PolarHBondContact O-N 2.98Å
224	S	66.8	Low	70.4	Confident	44 Å²	44	71.8 Å²	71.8	31%	0.308	37%	0.366	S	S	.	.			trans	-82.2	135.2	-177.5	67.5	0	0	0	0	112.3	E178 F226	E178-S224 VanDerWaalsContact OE1-CA 3.31Å; E178-S224 WeakPolarHBondContact OE1-CA 3.27Å; E178-S224 WeakPolarHBondContact OE1-CB 3.42Å; S224-F226 PolarHBondContact O-N 3.37Å; S224-F226 PolarHBondContact OG-O 3.42Å
225	Q	74.7	Confident	72.4	Confident	157 Å²	157	65.8 Å²	65.8	73%	0.734	34%	0.344	S	S	*	.	S	Bend	trans	-61.3	-29.1	175.4	-170.9	-178.7	24.5	0	0	113.1
226	F	78	Confident	74	Confident	32 Å²	32	61.3 Å²	61.3	14%	0.14	32%	0.32	C	S	.	.	S	Bend	trans	-96.7	153.2	-178.5	-58.3	-75.9	0	0	0	111.7	L181 S224 I230 L235	L181-F226 HydrophobicContact CB-CD2 3.52Å; L181-F226 HydrophobicContact CB-CE2 3.51Å; L181-F226 HydrophobicContact CB-CG 4.35Å; L181-F226 HydrophobicContact CB-CZ 4.34Å; L181-F226 HydrophobicContact CD1-CB 4.26Å; L181-F226 HydrophobicContact CD1-CD2 3.89Å; L181-F226 HydrophobicContact CD1-CG 4.32Å; L181-F226 HydrophobicContact CG-CD2 4.32Å; S224-F226 PolarHBondContact O-N 3.37Å; S224-F226 PolarHBondContact OG-O 3.42Å; F226-I230 HydrophobicContact CB-CD1 4.46Å; F226-L235 HydrophobicContact CD1-CD1 4.26Å; F226-L235 HydrophobicContact CD1-CD2 4.18Å; F226-L235 HydrophobicContact CE1-CD1 4.16Å; F226-L235 HydrophobicContact CE1-CD2 3.9Å; F226-L235 HydrophobicContact CZ-CD2 4.08Å
227	S	78.3	Confident	75.6	Confident	52 Å²	52	59.6 Å²	59.6	36%	0.364	31%	0.306	S	S	.	.			trans	-68.5	143.1	175.1	-58.3	0	0	0	0	110.6	D229 I230	S227-D229 WeakPolarHBondContact CB-OD1 3.44Å; S227-D229 PolarHBondContact O-N 2.88Å; S227-I230 WeakPolarHBondContact O-CB 3.48Å; S227-I230 PolarHBondContact O-N 3.23Å
228	P	72.8	Confident	76.9	Confident	54 Å²	54	61.1 Å²	61.1	35%	0.351	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-9.6	-170.4	27.5	-36.6	0	0	0	114.5	R219	R219-P228 HydrophobicContact CB-CB 4.4Å
229	D	77	Confident	78.2	Confident	31 Å²	31	63.7 Å²	63.7	17%	0.166	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-10.4	174.4	60.6	-60.6	0	0	0	113.8	S227 T231 S282 N285	S227-D229 WeakPolarHBondContact CB-OD1 3.44Å; S227-D229 PolarHBondContact O-N 2.88Å; D229-T231 PolarHBondContact O-N 2.99Å; D229-S282 VanDerWaalsContact OD2-CA 3.26Å; D229-S282 WeakPolarHBondContact OD2-CA 3.49Å; D229-N285 PolarHBondContact OD2-ND2 3.38Å
230	I	86.2	Confident	79.5	Confident	22 Å²	22	59.9 Å²	59.9	11%	0.113	31%	0.31	C	S	.	.			trans	-85.2	110.6	-177.7	-61	177.3	0	0	0	109.4	F226 S227 I234 L235	F226-I230 HydrophobicContact CB-CD1 4.46Å; S227-I230 WeakPolarHBondContact O-CB 3.48Å; S227-I230 PolarHBondContact O-N 3.23Å; I230-I234 HydrophobicContact CG2-CG2 4.26Å; I230-L235 HydrophobicContact CG2-CB 3.7Å; I230-L235 HydrophobicContact CG2-CD1 4.07Å; I230-L235 HydrophobicContact CG2-CG 4.34Å
231	T	86.1	Confident	81.1	Confident	65 Å²	65	57.1 Å²	57.1	40%	0.399	29%	0.292	S	S	.	.			trans	-84.4	160	169.9	67	0	0	0	0	111.2	D229 L233 I234 L235	D229-T231 PolarHBondContact O-N 2.99Å; T231-L233 PolarHBondContact O-N 3.26Å; T231-I234 HydrophobicContact CG2-CD1 4.19Å; T231-I234 WeakPolarHBondContact O-CB 3.31Å; T231-I234 PolarHBondContact O-N 3.03Å; T231-I234 WeakPolarHBondContact OG1-CD1 3.3Å; T231-I234 VanDerWaalsContact OG1-CG1 3.25Å; T231-I234 WeakPolarHBondContact OG1-CG1 3.31Å; T231-I234 PolarHBondContact OG1-N 3.19Å; T231-L235 PolarHBondContact O-N 3.21Å
232	P	88.8	Confident	82.8	Confident	17 Å²	17	52.9 Å²	52.9	11%	0.11	26%	0.264	C	S	.	.	H	α-helix	trans	-52.8	-36.9	175.5	-29.7	36.5	0	0	0	114	L180 L181 I184 S236 F248	L180-P232 HydrophobicContact CD2-CB 4.25Å; L180-P232 HydrophobicContact CD2-CG 4.07Å; L181-P232 HydrophobicContact CD2-CB 4.46Å; L181-P232 HydrophobicContact CD2-CG 4.17Å; I184-P232 HydrophobicContact CD1-CB 3.72Å; P232-S236 WeakPolarHBondContact O-CB 3.11Å; P232-S236 PolarHBondContact O-N 3.44Å; P232-S236 PolarHBondContact O-OG 2.9Å; P232-F248 HydrophobicContact CB-CE1 3.7Å; P232-F248 HydrophobicContact CB-CE2 4.15Å; P232-F248 HydrophobicContact CB-CZ 3.49Å; P232-F248 VanDerWaalsContact CB-CZ 3.49Å
233	L	90.8	Very high	84.5	Confident	5 Å²	5	48.2 Å²	48.2	3%	0.026	24%	0.243	C	C	.	.	H	α-helix	trans	-70	-41.2	175.2	177.9	57.8	0	0	0	112.3	T231 L235 S236 A237 V245 F248 H253 I255 Y295	T231-L233 PolarHBondContact O-N 3.26Å; L233-L235 VanDerWaalsContact C-N 3.35Å; L233-S236 PolarHBondContact O-N 3.39Å; L233-A237 WeakPolarHBondContact O-CB 3.43Å; L233-A237 PolarHBondContact O-N 3.01Å; L233-V245 HydrophobicContact CD1-CG1 4.31Å; L233-F248 HydrophobicContact CB-CB 4.34Å; L233-F248 HydrophobicContact CD1-CB 3.86Å; L233-H253 HydrophobicContact CD2-CB 3.84Å; L233-H253 WeakPolarHBondContact CD2-O 3.34Å; L233-I255 HydrophobicContact CD2-CD1 4.4Å; L233-I255 HydrophobicContact CD2-CG1 3.64Å; L233-I255 HydrophobicContact CG-CD1 4.08Å; L233-I255 HydrophobicContact CG-CG1 3.81Å; L233-Y295 HydrophobicContact CD1-CD2 4.37Å; L233-Y295 HydrophobicContact CD1-CE2 4.37Å; L233-Y295 HydrophobicContact CD2-CE2 4.27Å
234	I	92.1	Very high	86	Confident	15 Å²	15	39.3 Å²	39.3	8%	0.077	20%	0.204	C	C	.	.	H	α-helix	trans	-62	-44.9	175.6	-72	170.8	0	0	0	110	I230 T231 A237 H238 I255 A289	I230-I234 HydrophobicContact CG2-CG2 4.26Å; T231-I234 HydrophobicContact CG2-CD1 4.19Å; T231-I234 WeakPolarHBondContact O-CB 3.31Å; T231-I234 PolarHBondContact O-N 3.03Å; T231-I234 WeakPolarHBondContact OG1-CD1 3.3Å; T231-I234 VanDerWaalsContact OG1-CG1 3.25Å; T231-I234 WeakPolarHBondContact OG1-CG1 3.31Å; T231-I234 PolarHBondContact OG1-N 3.19Å; I234-A237 WeakPolarHBondContact O-CB 3.46Å; I234-A237 PolarHBondContact O-N 2.9Å; I234-H238 WeakPolarHBondContact CG2-NE2 3.43Å; I234-H238 PolarHBondContact O-CD2 3.23Å; I234-H238 PolarHBondContact O-N 2.98Å; I234-I255 HydrophobicContact CG1-CD1 4.21Å; I234-I255 HydrophobicContact CG1-CG1 4.41Å; I234-I255 HydrophobicContact CG1-CG2 4.48Å; I234-A289 HydrophobicContact CB-CB 4.24Å; I234-A289 HydrophobicContact CG1-CB 4.16Å; I234-A289 HydrophobicContact CG2-CB 4.02Å
235	L	92.2	Very high	87.2	Confident	6 Å²	6	37.2 Å²	37.2	3%	0.031	19%	0.19	C	C	.	.	H	α-helix	trans	-65.7	-43.7	179.1	-166.9	59.5	0	0	0	111.8	L181 I184 F226 I230 T231 L233 A237 H238 Y239	L181-L235 HydrophobicContact CB-CD2 3.88Å; L181-L235 HydrophobicContact CD2-CB 4.29Å; L181-L235 HydrophobicContact CD2-CD2 3.68Å; L181-L235 HydrophobicContact CG-CD2 4.38Å; L181-L235 VanDerWaalsContact O-CD2 3.25Å; L181-L235 WeakPolarHBondContact O-CD2 3.47Å; I184-L235 HydrophobicContact CB-CD2 4.15Å; I184-L235 HydrophobicContact CB-CG 4.48Å; I184-L235 HydrophobicContact CG2-CB 4.08Å; I184-L235 HydrophobicContact CG2-CD2 4.05Å; I184-L235 HydrophobicContact CG2-CG 3.82Å; F226-L235 HydrophobicContact CD1-CD1 4.26Å; F226-L235 HydrophobicContact CD1-CD2 4.18Å; F226-L235 HydrophobicContact CE1-CD1 4.16Å; F226-L235 HydrophobicContact CE1-CD2 3.9Å; F226-L235 HydrophobicContact CZ-CD2 4.08Å; I230-L235 HydrophobicContact CG2-CB 3.7Å; I230-L235 HydrophobicContact CG2-CD1 4.07Å; I230-L235 HydrophobicContact CG2-CG 4.34Å; T231-L235 PolarHBondContact O-N 3.21Å; L233-L235 VanDerWaalsContact C-N 3.35Å; L235-A237 VanDerWaalsContact C-N 3.26Å; L235-A237 PolarHBondContact O-N 3.49Å; L235-H238 WeakPolarHBondContact O-CB 3.3Å; L235-H238 PolarHBondContact O-N 2.96Å; L235-Y239 HydrophobicContact CD1-CD2 4.08Å; L235-Y239 HydrophobicContact CD1-CE2 3.58Å; L235-Y239 HydrophobicContact CD2-CE2 4.49Å; L235-Y239 HydrophobicContact CG-CD2 4.06Å; L235-Y239 HydrophobicContact CG-CE2 3.85Å; L235-Y239 WeakPolarHBondContact O-CD2 3.31Å; L235-Y239 PolarHBondContact O-N 3.16Å; L235-Y239 VanDerWaalsContact O-N 3.11Å
236	S	92.7	Very high	88	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.007	18%	0.18	C	C	.	.	H	α-helix	trans	-59	-39.9	176	-60.9	0	0	0	0	112	P232 L233 N240 N241 F248	P232-S236 WeakPolarHBondContact O-CB 3.11Å; P232-S236 PolarHBondContact O-N 3.44Å; P232-S236 PolarHBondContact O-OG 2.9Å; L233-S236 PolarHBondContact O-N 3.39Å; S236-N240 PolarHBondContact O-N 3.38Å; S236-N241 PolarHBondContact O-N 3.47Å; S236-F248 VanDerWaalsContact OG-CE2 3.22Å; S236-F248 WeakPolarHBondContact OG-CE2 3.43Å
237	A	93.7	Very high	88.6	Confident	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-67.7	-36.9	174.3	0	0	0	0	0	112.5	L233 I234 L235 Y239 N240 V245 A289 S292	L233-A237 WeakPolarHBondContact O-CB 3.43Å; L233-A237 PolarHBondContact O-N 3.01Å; I234-A237 WeakPolarHBondContact O-CB 3.46Å; I234-A237 PolarHBondContact O-N 2.9Å; L235-A237 VanDerWaalsContact C-N 3.26Å; L235-A237 PolarHBondContact O-N 3.49Å; A237-Y239 PolarHBondContact O-N 3.48Å; A237-N240 PolarHBondContact O-N 3.47Å; A237-N240 VanDerWaalsContact O-N 3.14Å; A237-V245 HydrophobicContact CB-CG2 4.47Å; A237-A289 HydrophobicContact CB-CB 3.74Å; A237-S292 WeakPolarHBondContact CB-OG 3.3Å; A237-S292 WeakPolarHBondContact O-CB 3.14Å; A237-S292 PolarHBondContact O-OG 3.25Å
238	H	93.6	Very high	89.2	Confident	44 Å²	44	32.5 Å²	32.5	20%	0.204	16%	0.163	C	C	.	.	H	α-helix	trans	-61.9	-42.5	176.3	-73.7	-167.5	0	0	0	112	I234 L235 N240 N285	I234-H238 WeakPolarHBondContact CG2-NE2 3.43Å; I234-H238 PolarHBondContact O-CD2 3.23Å; I234-H238 PolarHBondContact O-N 2.98Å; L235-H238 WeakPolarHBondContact O-CB 3.3Å; L235-H238 PolarHBondContact O-N 2.96Å; H238-N240 PolarHBondContact O-N 2.92Å; H238-N285 PolarHBondContact NE2-O 3.43Å
239	Y	90.3	Very high	90	Very high	123 Å²	123	31.7 Å²	31.7	48%	0.482	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-5.7	175.6	-73.3	-75.2	0	0	0	114.2	I184 L235 A237 N241	I184-Y239 HydrophobicContact CG2-CD2 4.33Å; L235-Y239 HydrophobicContact CD1-CD2 4.08Å; L235-Y239 HydrophobicContact CD1-CE2 3.58Å; L235-Y239 HydrophobicContact CD2-CE2 4.49Å; L235-Y239 HydrophobicContact CG-CD2 4.06Å; L235-Y239 HydrophobicContact CG-CE2 3.85Å; L235-Y239 WeakPolarHBondContact O-CD2 3.31Å; L235-Y239 PolarHBondContact O-N 3.16Å; L235-Y239 VanDerWaalsContact O-N 3.11Å; A237-Y239 PolarHBondContact O-N 3.48Å; Y239-N241 VanDerWaalsContact C-N 3.27Å; Y239-N241 PolarHBondContact O-N 2.85Å
240	N	90.4	Very high	90.6	Very high	30 Å²	30	34.1 Å²	34.1	16%	0.16	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	35	177.8	-164.6	55.5	0	0	0	114.1	S236 A237 H238 P293 A294 M901	S236-N240 PolarHBondContact O-N 3.38Å; A237-N240 PolarHBondContact O-N 3.47Å; A237-N240 VanDerWaalsContact O-N 3.14Å; H238-N240 PolarHBondContact O-N 2.92Å; N240-P293 WeakPolarHBondContact OD1-CD 3.21Å; N240-A294 WeakPolarHBondContact OD1-CB 3.17Å; N240-A294 PolarHBondContact OD1-N 3.2Å; N240-M901 PolarHBondContact ND2-SD 2.91Å; N240-M901 VanDerWaalsContact ND2-SD 3.36Å; N240-M901 WeakPolarHBondContact O-CE 3.46Å
241	N	90.8	Very high	90.5	Very high	27 Å²	27	36.2 Å²	36.2	14%	0.144	18%	0.181	C	C	.	.			trans	-91.6	112.1	173.9	-173.2	-25.6	0	0	0	110.1	S236 Y239 E243 M244 V245	S236-N241 PolarHBondContact O-N 3.47Å; Y239-N241 VanDerWaalsContact C-N 3.27Å; Y239-N241 PolarHBondContact O-N 2.85Å; N241-E243 PolarHBondContact OD1-N 2.83Å; N241-E243 VanDerWaalsContact OD1-N 3.08Å; N241-M244 HydrophobicContact CB-CB 4.06Å; N241-M244 HydrophobicContact CB-CG 3.83Å; N241-M244 VanDerWaalsContact CG-CG 3.4Å; N241-M244 WeakPolarHBondContact ND2-CG 3.42Å; N241-V245 VanDerWaalsContact O-CG2 3.3Å; N241-V245 WeakPolarHBondContact O-CG2 3.47Å; N241-V245 PolarHBondContact O-N 3.49Å; N241-V245 VanDerWaalsContact O-N 3.16Å
242	H	90.6	Very high	90.4	Very high	16 Å²	16	40.1 Å²	40.1	7%	0.074	20%	0.199	C	C	.	.	H	α-helix	trans	-66.2	-35.2	-178.7	60.7	161.2	0	0	0	115	M244 V245 Q246 A294 L298 L898 M901 E902	H242-M244 VanDerWaalsContact C-N 3.34Å; H242-V245 PolarHBondContact O-N 3.22Å; H242-Q246 VanDerWaalsContact O-CB 3.25Å; H242-Q246 WeakPolarHBondContact O-CB 3.48Å; H242-Q246 PolarHBondContact O-N 3.32Å; H242-A294 HydrophobicContact CB-CB 4.25Å; H242-L298 HydrophobicContact CB-CD1 4.21Å; H242-L298 WeakPolarHBondContact O-CD1 3.49Å; H242-L898 HydrophobicContact CB-CD2 3.82Å; H242-M901 HydrophobicContact CB-CE 3.48Å; H242-M901 VanDerWaalsContact CB-CE 3.48Å; H242-E902 IonicContact CE1-OE2 3.54Å
243	E	89.9	Confident	90.2	Very high	83 Å²	83	41.4 Å²	41.4	39%	0.388	20%	0.204	S	C	.	.	H	α-helix	trans	-65.9	-44.4	-178.5	-61.3	-168.1	165.1	0	0	110.1	P189 N241 Q246 M247	P189-E243 HydrophobicContact CB-CB 4.21Å; P189-E243 VanDerWaalsContact CB-OE2 3.29Å; P189-E243 WeakPolarHBondContact CB-OE2 3.3Å; P189-E243 WeakPolarHBondContact CG-OE2 3.42Å; N241-E243 PolarHBondContact OD1-N 2.83Å; N241-E243 VanDerWaalsContact OD1-N 3.08Å; E243-Q246 WeakPolarHBondContact O-CB 3.22Å; E243-Q246 PolarHBondContact O-N 3.11Å; E243-M247 VanDerWaalsContact O-CG 3.32Å; E243-M247 WeakPolarHBondContact O-CG 3.31Å; E243-M247 PolarHBondContact O-N 2.73Å
244	M	90.8	Very high	90	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	23%	0.232	C	C	.	.	H	α-helix	trans	-59	-51	175.8	-63.5	-69.3	-64.8	0	0	111.8	I184 P189 V192 N241 H242 Q246 M247 F248	I184-M244 HydrophobicContact CB-CE 3.99Å; I184-M244 HydrophobicContact CG1-CE 3.4Å; I184-M244 VanDerWaalsContact CG1-CE 3.4Å; I184-M244 HydrophobicContact CG2-CE 4.1Å; P189-M244 VanDerWaalsContact CA-SD 3.55Å; P189-M244 HydrophobicContact CB-CG 4.4Å; P189-M244 HydrophobicContact CB-SD 3.91Å; V192-M244 HydrophobicContact CB-CE 3.66Å; V192-M244 HydrophobicContact CB-SD 3.69Å; V192-M244 HydrophobicContact CG1-CE 3.44Å; V192-M244 VanDerWaalsContact CG1-CE 3.44Å; V192-M244 HydrophobicContact CG1-SD 3.79Å; V192-M244 HydrophobicContact CG2-CE 3.39Å; V192-M244 HydrophobicContact CG2-SD 3.84Å; N241-M244 HydrophobicContact CB-CB 4.06Å; N241-M244 HydrophobicContact CB-CG 3.83Å; N241-M244 VanDerWaalsContact CG-CG 3.4Å; N241-M244 WeakPolarHBondContact ND2-CG 3.42Å; H242-M244 VanDerWaalsContact C-N 3.34Å; M244-Q246 VanDerWaalsContact C-N 3.3Å; M244-Q246 PolarHBondContact O-N 3.34Å; M244-M247 HydrophobicContact CB-CE 4.49Å; M244-M247 HydrophobicContact CG-CE 4.25Å; M244-M247 PolarHBondContact O-N 3.23Å; M244-M247 HydrophobicContact SD-CE 3.29Å; M244-M247 WeakPolarHBondContact SD-CE 3.32Å; M244-F248 HydrophobicContact CE-CE2 4.46Å; M244-F248 WeakPolarHBondContact O-CD2 3.41Å; M244-F248 PolarHBondContact O-N 3.1Å; M244-F248 VanDerWaalsContact O-N 3.17Å
245	V	92.1	Very high	89.8	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-60.5	-41.8	176.5	171.8	0	0	0	0	110.8	L233 A237 N241 H242 F248 L249 A294 Y295 L298	L233-V245 HydrophobicContact CD1-CG1 4.31Å; A237-V245 HydrophobicContact CB-CG2 4.47Å; N241-V245 VanDerWaalsContact O-CG2 3.3Å; N241-V245 WeakPolarHBondContact O-CG2 3.47Å; N241-V245 PolarHBondContact O-N 3.49Å; N241-V245 VanDerWaalsContact O-N 3.16Å; H242-V245 PolarHBondContact O-N 3.22Å; V245-F248 PolarHBondContact O-N 2.93Å; V245-L249 HydrophobicContact CG1-CD1 3.69Å; V245-L249 HydrophobicContact CG1-CG 4.13Å; V245-L249 WeakPolarHBondContact O-CB 3.24Å; V245-L249 VanDerWaalsContact O-CG 3.27Å; V245-L249 WeakPolarHBondContact O-CG 3.21Å; V245-L249 PolarHBondContact O-N 3.37Å; V245-A294 HydrophobicContact CG2-CB 4.44Å; V245-Y295 HydrophobicContact CG1-CD2 4.08Å; V245-L298 HydrophobicContact CB-CD1 4.25Å; V245-L298 HydrophobicContact CG1-CD1 3.97Å
246	Q	91.7	Very high	89.4	Confident	112 Å²	112	51.9 Å²	51.9	52%	0.523	26%	0.264	S	S	.	.	H	α-helix	trans	-63.9	-40.7	177.2	-174.6	175.4	-12.3	0	0	112.2	H242 E243 M244 F248 L249 S250 L298	H242-Q246 VanDerWaalsContact O-CB 3.25Å; H242-Q246 WeakPolarHBondContact O-CB 3.48Å; H242-Q246 PolarHBondContact O-N 3.32Å; E243-Q246 WeakPolarHBondContact O-CB 3.22Å; E243-Q246 PolarHBondContact O-N 3.11Å; M244-Q246 VanDerWaalsContact C-N 3.3Å; M244-Q246 PolarHBondContact O-N 3.34Å; Q246-F248 VanDerWaalsContact C-N 3.33Å; Q246-F248 PolarHBondContact O-N 2.91Å; Q246-L249 PolarHBondContact O-N 3.3Å; Q246-S250 WeakPolarHBondContact O-CB 3.22Å; Q246-S250 PolarHBondContact O-N 2.8Å; Q246-S250 PolarHBondContact O-OG 3.32Å; Q246-L298 HydrophobicContact CB-CD1 4.03Å
247	M	89.2	Confident	89.1	Confident	29 Å²	29	57.5 Å²	57.5	14%	0.143	29%	0.288	C	S	.	.	H	α-helix	trans	-59.1	-43.2	176	-74.6	-170.2	-69	0	0	111.7	P189 V192 R193 E243 M244 S250	P189-M247 HydrophobicContact CB-CE 4.08Å; V192-M247 HydrophobicContact CB-CE 4.39Å; V192-M247 HydrophobicContact CG1-CE 4.11Å; R193-M247 HydrophobicContact CB-SD 3.91Å; R193-M247 HydrophobicContact CG-SD 4.28Å; E243-M247 VanDerWaalsContact O-CG 3.32Å; E243-M247 WeakPolarHBondContact O-CG 3.31Å; E243-M247 PolarHBondContact O-N 2.73Å; M244-M247 HydrophobicContact CB-CE 4.49Å; M244-M247 HydrophobicContact CG-CE 4.25Å; M244-M247 PolarHBondContact O-N 3.23Å; M244-M247 HydrophobicContact SD-CE 3.29Å; M244-M247 WeakPolarHBondContact SD-CE 3.32Å; M247-S250 PolarHBondContact O-OG 2.93Å
248	F	90.6	Very high	88.9	Confident	1 Å²	1	59 Å²	59	0%	0.004	30%	0.297	C	S	.	.	H	α-helix	trans	-73.7	-41.1	177.3	-72.6	-64.6	0	0	0	113	I184 I196 P232 L233 S236 M244 V245 Q246 S250 R251 H253	I184-F248 HydrophobicContact CD1-CE2 4.09Å; I184-F248 HydrophobicContact CD1-CZ 4.03Å; I196-F248 HydrophobicContact CD1-CD1 4.26Å; I196-F248 HydrophobicContact CD1-CE1 3.48Å; I196-F248 VanDerWaalsContact CD1-CE1 3.48Å; I196-F248 HydrophobicContact CD1-CE2 4.18Å; I196-F248 HydrophobicContact CD1-CZ 3.42Å; I196-F248 VanDerWaalsContact CD1-CZ 3.42Å; I196-F248 HydrophobicContact CG1-CE1 4.28Å; I196-F248 HydrophobicContact CG1-CZ 4.39Å; P232-F248 HydrophobicContact CB-CE1 3.7Å; P232-F248 HydrophobicContact CB-CE2 4.15Å; P232-F248 HydrophobicContact CB-CZ 3.49Å; P232-F248 VanDerWaalsContact CB-CZ 3.49Å; L233-F248 HydrophobicContact CB-CB 4.34Å; L233-F248 HydrophobicContact CD1-CB 3.86Å; S236-F248 VanDerWaalsContact OG-CE2 3.22Å; S236-F248 WeakPolarHBondContact OG-CE2 3.43Å; M244-F248 HydrophobicContact CE-CE2 4.46Å; M244-F248 WeakPolarHBondContact O-CD2 3.41Å; M244-F248 PolarHBondContact O-N 3.1Å; M244-F248 VanDerWaalsContact O-N 3.17Å; V245-F248 PolarHBondContact O-N 2.93Å; Q246-F248 VanDerWaalsContact C-N 3.33Å; Q246-F248 PolarHBondContact O-N 2.91Å; F248-S250 VanDerWaalsContact C-N 3.28Å; F248-S250 PolarHBondContact O-N 2.76Å; F248-R251 PolarHBondContact O-N 3.21Å; F248-R251 VanDerWaalsContact O-N 3.15Å; F248-H253 HydrophobicContact CB-CB 4.37Å; F248-H253 AromaticContact CD1-CD2 3.93Å; F248-H253 WeakPolarHBondContact O-CB 3.14Å; F248-H253 PolarHBondContact O-CD2 2.76Å; F248-H253 PolarHBondContact O-N 2.65Å
249	L	90.1	Very high	88.6	Confident	37 Å²	37	61.6 Å²	61.6	19%	0.194	31%	0.31	C	S	.	.	H	α-helix	trans	-62.4	-36.1	176	-72.3	175.2	0	0	0	111.8	V245 Q246 R251 N252 H253 Y295 L298	V245-L249 HydrophobicContact CG1-CD1 3.69Å; V245-L249 HydrophobicContact CG1-CG 4.13Å; V245-L249 WeakPolarHBondContact O-CB 3.24Å; V245-L249 VanDerWaalsContact O-CG 3.27Å; V245-L249 WeakPolarHBondContact O-CG 3.21Å; V245-L249 PolarHBondContact O-N 3.37Å; Q246-L249 PolarHBondContact O-N 3.3Å; L249-R251 PolarHBondContact O-N 3.42Å; L249-N252 PolarHBondContact O-N 3.44Å; L249-N252 VanDerWaalsContact O-N 3.09Å; L249-H253 WeakPolarHBondContact CD2-O 3.49Å; L249-Y295 HydrophobicContact CD2-CE2 4.02Å; L249-L298 HydrophobicContact CD1-CB 3.66Å
250	S	89.2	Confident	88.4	Confident	82 Å²	82	59.1 Å²	59.1	57%	0.573	31%	0.31	S	S	*	.	H	α-helix	trans	-64.4	-21.6	177.2	75.4	0	0	0	0	113.9	Q246 M247 F248	Q246-S250 WeakPolarHBondContact O-CB 3.22Å; Q246-S250 PolarHBondContact O-N 2.8Å; Q246-S250 PolarHBondContact O-OG 3.32Å; M247-S250 PolarHBondContact O-OG 2.93Å; F248-S250 VanDerWaalsContact C-N 3.28Å; F248-S250 PolarHBondContact O-N 2.76Å
251	R	85.1	Confident	88	Confident	65 Å²	65	60.3 Å²	60.3	25%	0.245	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96	15	176.4	-70.5	-179.2	167.5	85.7	-6.2	113.3	I196 E197 F248 L249 H253	I196-R251 VanDerWaalsContact CG2-NE 3.31Å; E197-R251 VanDerWaalsContact CG-NH2 3.35Å; F248-R251 PolarHBondContact O-N 3.21Å; F248-R251 VanDerWaalsContact O-N 3.15Å; L249-R251 PolarHBondContact O-N 3.42Å; R251-H253 VanDerWaalsContact C-N 3.32Å; R251-H253 PolarHBondContact O-N 3.14Å
252	N	84.1	Confident	87.6	Confident	147 Å²	147	63.5 Å²	63.5	79%	0.786	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	25.2	-179	-56.3	-46.2	0	0	0	115.1	L249	L249-N252 PolarHBondContact O-N 3.44Å; L249-N252 VanDerWaalsContact O-N 3.09Å
253	H	84.2	Confident	87.4	Confident	44 Å²	44	64.3 Å²	64.3	20%	0.204	35%	0.348	C	S	.	.			trans	-76.7	129.3	167.1	-65.3	-80.6	0	0	0	110.4	E205 L233 F248 L249 R251	E205-H253 IonicContact OE1-CE1 3.34Å; E205-H253 PolarHBondContact OE1-CE1 3.09Å; E205-H253 IonicContact OE1-NE2 3.75Å; E205-H253 PolarHBondContact OE1-NE2 3.4Å; L233-H253 HydrophobicContact CD2-CB 3.84Å; L233-H253 WeakPolarHBondContact CD2-O 3.34Å; F248-H253 HydrophobicContact CB-CB 4.37Å; F248-H253 AromaticContact CD1-CD2 3.93Å; F248-H253 WeakPolarHBondContact O-CB 3.14Å; F248-H253 PolarHBondContact O-CD2 2.76Å; F248-H253 PolarHBondContact O-N 2.65Å; L249-H253 WeakPolarHBondContact CD2-O 3.49Å; R251-H253 VanDerWaalsContact C-N 3.32Å; R251-H253 PolarHBondContact O-N 3.14Å
254	T	85.5	Confident	87.2	Confident	100 Å²	100	68.8 Å²	68.8	61%	0.613	37%	0.368	S	S	*	.			trans	-127.3	149.5	175.1	55.2	0	0	0	0	110.7
255	I	88.4	Confident	87.1	Confident	18 Å²	18	70.5 Å²	70.5	9%	0.092	38%	0.38	C	S	.	.	P	Polyproline II helix	trans	-89.6	117.5	172.4	-54.2	179.1	0	0	0	108.5	L233 I234 A289 L290 Y295	L233-I255 HydrophobicContact CD2-CD1 4.4Å; L233-I255 HydrophobicContact CD2-CG1 3.64Å; L233-I255 HydrophobicContact CG-CD1 4.08Å; L233-I255 HydrophobicContact CG-CG1 3.81Å; I234-I255 HydrophobicContact CG1-CD1 4.21Å; I234-I255 HydrophobicContact CG1-CG1 4.41Å; I234-I255 HydrophobicContact CG1-CG2 4.48Å; I255-A289 HydrophobicContact CD1-CB 3.61Å; I255-L290 HydrophobicContact CB-CD2 3.97Å; I255-L290 HydrophobicContact CG2-CD2 3.92Å; I255-L290 HydrophobicContact CG2-CG 4.14Å; I255-Y295 HydrophobicContact CB-CE2 4.44Å; I255-Y295 HydrophobicContact CD1-CD2 3.96Å; I255-Y295 HydrophobicContact CD1-CE1 4.37Å; I255-Y295 HydrophobicContact CD1-CE2 3.69Å; I255-Y295 HydrophobicContact CD1-CG 4.41Å; I255-Y295 HydrophobicContact CG1-CE2 3.79Å; I255-Y295 PolarHBondContact N-OH 3.29Å
256	D	84.5	Confident	86.9	Confident	129 Å²	129	76.1 Å²	76.1	69%	0.69	41%	0.41	S	S	*	.	P	Polyproline II helix	trans	-68.3	131.9	175.1	-67	-32.2	0	0	0	110.8
257	K	86.7	Confident	86.5	Confident	119 Å²	119	74.8 Å²	74.8	52%	0.517	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-67.6	129.4	174.9	-70	-172.1	177.9	-172.3	0	109.7	L290	K257-L290 HydrophobicContact CG-CD1 4.2Å
258	P	88.7	Confident	86.3	Confident	30 Å²	30	74 Å²	74	20%	0.195	40%	0.404	C	S	.	.	P	Polyproline II helix	trans	-65.3	142.1	179.4	27.1	-34.2	0	0	0	110.9	R283 A286 Y287	P258-R283 HydrophobicContact CB-CG 4.15Å; P258-R283 HydrophobicContact CG-CG 4.28Å; P258-A286 HydrophobicContact CG-CB 4.47Å; P258-Y287 HydrophobicContact CB-CE2 4.34Å; P258-Y287 HydrophobicContact CG-CD2 3.85Å; P258-Y287 HydrophobicContact CG-CE1 4.15Å; P258-Y287 HydrophobicContact CG-CE2 3.28Å; P258-Y287 HydrophobicContact CG-CG 4.46Å; P258-Y287 VanDerWaalsContact CG-CZ 3.45Å
259	H	87.9	Confident	86.1	Confident	100 Å²	100	78.7 Å²	78.7	46%	0.463	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-60.7	151.5	176.3	-67.8	-172.9	0	0	0	111.5	C263 C265	H259-C263 HydrophobicContact CB-CB 3.8Å; H259-C263 PolarHBondContact ND1-SG 2.65Å; H259-C263 VanDerWaalsContact ND1-SG 3.43Å; H259-C265 PolarHBondContact ND1-SG 2.81Å; H259-C265 VanDerWaalsContact ND1-SG 3.38Å
260	S	84.8	Confident	86	Confident	70 Å²	70	79.9 Å²	79.9	49%	0.49	43%	0.434	S	S	.	.	P	Polyproline II helix	trans	-51.6	144.5	171	62	0	0	0	0	110.7	S262 C263	S260-S262 PolarHBondContact O-N 3.47Å; S260-S262 VanDerWaalsContact O-N 3.09Å; S260-S262 PolarHBondContact OG-OG 3.5Å; S260-C263 WeakPolarHBondContact O-CB 3.26Å; S260-C263 PolarHBondContact O-N 2.89Å
261	I	82.5	Confident	85.7	Confident	56 Å²	56	79.9 Å²	79.9	29%	0.287	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-28.5	-179.5	-162.7	165.5	0	0	0	113.3	C263 I320 E321	I261-C263 VanDerWaalsContact C-N 3.26Å; I261-C263 PolarHBondContact O-N 3.38Å; I261-I320 HydrophobicContact CD1-CG2 3.92Å; I261-I320 HydrophobicContact CG2-CD1 4.11Å; I261-I320 HydrophobicContact CG2-CG2 4.13Å; I261-E321 HydrophobicContact CD1-CG 3.82Å; I261-E321 WeakPolarHBondContact CD1-OE1 3.12Å
262	S	83.1	Confident	85.7	Confident	94 Å²	94	81.6 Å²	81.6	66%	0.657	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.3	3.5	175.5	57.5	0	0	0	0	114.5	S260 Q264	S260-S262 PolarHBondContact O-N 3.47Å; S260-S262 VanDerWaalsContact O-N 3.09Å; S260-S262 PolarHBondContact OG-OG 3.5Å; S262-Q264 PolarHBondContact O-N 2.74Å
263	C	87.1	Confident	85.7	Confident	33 Å²	33	80.4 Å²	80.4	22%	0.223	43%	0.426	C	S	.	.			trans	-70.4	125	179.9	-174.3	0	0	0	0	110.4	H259 S260 I261 C265	H259-C263 HydrophobicContact CB-CB 3.8Å; H259-C263 PolarHBondContact ND1-SG 2.65Å; H259-C263 VanDerWaalsContact ND1-SG 3.43Å; S260-C263 WeakPolarHBondContact O-CB 3.26Å; S260-C263 PolarHBondContact O-N 2.89Å; I261-C263 VanDerWaalsContact C-N 3.26Å; I261-C263 PolarHBondContact O-N 3.38Å; C263-C265 VanDerWaalsContact SG-SG 3.62Å
264	Q	84.7	Confident	85.7	Confident	177 Å²	177	83.5 Å²	83.5	83%	0.827	44%	0.437	S	S	*	.			trans	-103.2	26.4	178.4	-60.5	178.8	3	0	0	112.1	S262	S262-Q264 PolarHBondContact O-N 2.74Å
265	C	89.1	Confident	85.7	Confident	38 Å²	38	80.9 Å²	80.9	26%	0.257	42%	0.419	S	S	.	.			trans	-67.3	151.7	173.2	74.5	0	0	0	0	110.4	H259 C263 D267 C268 Q269	H259-C265 PolarHBondContact ND1-SG 2.81Å; H259-C265 VanDerWaalsContact ND1-SG 3.38Å; C263-C265 VanDerWaalsContact SG-SG 3.62Å; C265-D267 PolarHBondContact O-N 3.4Å; C265-C268 PolarHBondContact O-N 2.98Å; C265-C268 VanDerWaalsContact O-N 3.09Å; C265-C268 VanDerWaalsContact SG-CB 3.5Å; C265-C268 PolarHBondContact SG-N 3.03Å; C265-C268 VanDerWaalsContact SG-N 3.4Å; C265-Q269 PolarHBondContact O-N 3.37Å
266	N	87.3	Confident	85.6	Confident	117 Å²	117	84 Å²	84	63%	0.626	44%	0.442	S	S	*	.	H	α-helix	trans	-54.3	-42.1	-178	-166.9	36.2	0	0	0	111.6	C268 Q269 V270	N266-C268 PolarHBondContact O-N 2.95Å; N266-Q269 PolarHBondContact O-N 2.95Å; N266-V270 WeakPolarHBondContact O-CB 3.08Å; N266-V270 WeakPolarHBondContact O-CG2 3.49Å; N266-V270 PolarHBondContact O-N 3.33Å
267	D	83.1	Confident	85.7	Confident	84 Å²	84	81.5 Å²	81.5	45%	0.449	43%	0.429	S	S	.	.	H	α-helix	trans	-63.2	-40.8	179.7	-56.4	-35.7	0	0	0	112.9	C265 R271	C265-D267 PolarHBondContact O-N 3.4Å; D267-R271 WeakPolarHBondContact O-CB 3.28Å; D267-R271 VanDerWaalsContact O-CG 3.27Å; D267-R271 WeakPolarHBondContact O-CG 3.45Å; D267-R271 PolarHBondContact O-N 3.4Å
268	C	86.1	Confident	85.6	Confident	14 Å²	14	78.9 Å²	78.9	10%	0.095	42%	0.417	C	S	.	.	H	α-helix	trans	-68.6	-39	177.1	-87.2	0	0	0	0	112	C265 N266 Q272 R279	C265-C268 PolarHBondContact O-N 2.98Å; C265-C268 VanDerWaalsContact O-N 3.09Å; C265-C268 VanDerWaalsContact SG-CB 3.5Å; C265-C268 PolarHBondContact SG-N 3.03Å; C265-C268 VanDerWaalsContact SG-N 3.4Å; N266-C268 PolarHBondContact O-N 2.95Å; C268-Q272 VanDerWaalsContact O-CB 3.32Å; C268-Q272 WeakPolarHBondContact O-CB 3.26Å; C268-Q272 PolarHBondContact O-N 3.16Å; C268-R279 VanDerWaalsContact CB-NH2 3.35Å
269	Q	86	Confident	85.6	Confident	99 Å²	99	78.5 Å²	78.5	46%	0.463	41%	0.412	S	S	.	.	H	α-helix	trans	-68.4	-47.2	178.8	-172.5	174.1	-8.6	0	0	110.8	C265 N266 R271 Q272 D273	C265-Q269 PolarHBondContact O-N 3.37Å; N266-Q269 PolarHBondContact O-N 2.95Å; Q269-R271 PolarHBondContact O-N 3Å; Q269-Q272 WeakPolarHBondContact O-CB 3.41Å; Q269-Q272 PolarHBondContact O-N 3.5Å; Q269-Q272 VanDerWaalsContact O-N 3.08Å; Q269-D273 WeakPolarHBondContact O-CB 3.37Å; Q269-D273 PolarHBondContact O-N 3.22Å
270	V	86.9	Confident	85.6	Confident	61 Å²	61	74.6 Å²	74.6	37%	0.37	40%	0.396	S	S	.	.	H	α-helix	trans	-60.4	-44	176.6	175.2	0	0	0	0	111.2	F218 N266 Q272 D273 Y274	F218-V270 HydrophobicContact CE1-CG1 4.28Å; F218-V270 HydrophobicContact CZ-CG1 3.84Å; N266-V270 WeakPolarHBondContact O-CB 3.08Å; N266-V270 WeakPolarHBondContact O-CG2 3.49Å; N266-V270 PolarHBondContact O-N 3.33Å; V270-Q272 VanDerWaalsContact C-N 3.29Å; V270-Q272 PolarHBondContact O-N 3.42Å; V270-D273 PolarHBondContact O-N 3.16Å; V270-Y274 VanDerWaalsContact O-CB 3.29Å; V270-Y274 WeakPolarHBondContact O-CB 3.49Å; V270-Y274 PolarHBondContact O-N 3.23Å
271	R	84.2	Confident	85.8	Confident	82 Å²	82	77.6 Å²	77.6	31%	0.309	40%	0.397	S	S	.	.	H	α-helix	trans	-63.2	-35.3	175.4	-73.2	-178.6	-176.9	-178.2	2.4	112.5	F217 D267 Q269 D275 R279	F217-R271 HydrophobicContact CD1-CB 4.41Å; F217-R271 HydrophobicContact CD1-CG 3.83Å; F217-R271 HydrophobicContact CD2-CG 4.47Å; F217-R271 HydrophobicContact CE1-CB 3.88Å; F217-R271 HydrophobicContact CE1-CG 3.83Å; F217-R271 HydrophobicContact CE2-CG 4.46Å; F217-R271 HydrophobicContact CG-CG 4.16Å; F217-R271 HydrophobicContact CZ-CB 3.96Å; F217-R271 HydrophobicContact CZ-CG 4.16Å; D267-R271 WeakPolarHBondContact O-CB 3.28Å; D267-R271 VanDerWaalsContact O-CG 3.27Å; D267-R271 WeakPolarHBondContact O-CG 3.45Å; D267-R271 PolarHBondContact O-N 3.4Å; Q269-R271 PolarHBondContact O-N 3Å; R271-D275 CarbonylContact O-C 3.55Å; R271-D275 PolarHBondContact O-N 3Å; R271-D275 VanDerWaalsContact O-N 3.14Å; R271-R279 HydrophobicContact CB-CG 4.42Å
272	Q	85.4	Confident	86	Confident	102 Å²	102	76.2 Å²	76.2	48%	0.477	39%	0.392	S	S	.	.	H	α-helix	trans	-69.1	-45.3	177.5	-172.3	168.9	-5.9	0	0	112.3	C268 Q269 V270 Y274 S276	C268-Q272 VanDerWaalsContact O-CB 3.32Å; C268-Q272 WeakPolarHBondContact O-CB 3.26Å; C268-Q272 PolarHBondContact O-N 3.16Å; Q269-Q272 WeakPolarHBondContact O-CB 3.41Å; Q269-Q272 PolarHBondContact O-N 3.5Å; Q269-Q272 VanDerWaalsContact O-N 3.08Å; V270-Q272 VanDerWaalsContact C-N 3.29Å; V270-Q272 PolarHBondContact O-N 3.42Å; Q272-Y274 VanDerWaalsContact C-N 3.33Å; Q272-S276 PolarHBondContact O-N 3.17Å
273	D	84.5	Confident	86.4	Confident	121 Å²	121	72.6 Å²	72.6	65%	0.647	36%	0.364	S	S	*	.	H	α-helix	trans	-72.5	-29.7	-177.7	-67.5	-18.9	0	0	0	111.6	Q269 V270	Q269-D273 WeakPolarHBondContact O-CB 3.37Å; Q269-D273 PolarHBondContact O-N 3.22Å; V270-D273 PolarHBondContact O-N 3.16Å
274	Y	84	Confident	86.6	Confident	110 Å²	110	71.3 Å²	71.3	43%	0.431	36%	0.355	S	S	.	.	H	α-helix	trans	-72	-57.8	173.8	-174.3	-95.2	0	0	0	111.8	F217 F218 T220 V270 Q272	F217-Y274 HydrophobicContact CD1-CD1 4.35Å; F217-Y274 AromaticContact CE1-CD1 3.85Å; F217-Y274 HydrophobicContact CE1-CD1 3.85Å; F218-Y274 AromaticContact CD1-CD1 3.91Å; F218-Y274 HydrophobicContact CD1-CD1 3.91Å; F218-Y274 AromaticContact CD1-CD2 3.76Å; F218-Y274 HydrophobicContact CD1-CD2 3.76Å; F218-Y274 AromaticContact CD1-CE1 3.96Å; F218-Y274 HydrophobicContact CD1-CE1 3.96Å; F218-Y274 AromaticContact CD1-CE2 3.82Å; F218-Y274 HydrophobicContact CD1-CE2 3.82Å; F218-Y274 AromaticContact CD1-CG 3.81Å; F218-Y274 HydrophobicContact CD1-CG 3.81Å; F218-Y274 AromaticContact CD1-CZ 3.92Å; F218-Y274 HydrophobicContact CE1-CD1 4.11Å; F218-Y274 AromaticContact CE1-CD2 3.87Å; F218-Y274 HydrophobicContact CE1-CD2 3.87Å; F218-Y274 HydrophobicContact CE1-CE2 4.4Å; F218-Y274 AromaticContact CE1-CG 3.71Å; F218-Y274 HydrophobicContact CE1-CG 3.71Å; T220-Y274 VanDerWaalsContact CG2-OH 3.29Å; T220-Y274 WeakPolarHBondContact CG2-OH 3.25Å; V270-Y274 VanDerWaalsContact O-CB 3.29Å; V270-Y274 WeakPolarHBondContact O-CB 3.49Å; V270-Y274 PolarHBondContact O-N 3.23Å; Q272-Y274 VanDerWaalsContact C-N 3.33Å
275	D	84.4	Confident	87	Confident	45 Å²	45	63.8 Å²	63.8	24%	0.241	32%	0.32	C	S	.	.			trans	-157.8	105	179.1	-172.8	-18	0	0	0	111.8	R271 L277 K278 R279	R271-D275 CarbonylContact O-C 3.55Å; R271-D275 PolarHBondContact O-N 3Å; R271-D275 VanDerWaalsContact O-N 3.14Å; D275-L277 VanDerWaalsContact C-N 3.31Å; D275-L277 PolarHBondContact O-N 3.39Å; D275-L277 WeakPolarHBondContact OD1-CA 3.11Å; D275-L277 WeakPolarHBondContact OD1-CB 3.41Å; D275-L277 PolarHBondContact OD1-N 2.84Å; D275-K278 HydrophobicContact CB-CB 3.94Å; D275-K278 HydrophobicContact CB-CD 4.11Å; D275-K278 HydrophobicContact CB-CG 4.24Å; D275-K278 PolarHBondContact O-N 3.14Å; D275-K278 PolarHBondContact OD1-N 3.43Å; D275-K278 WeakPolarHBondContact OD2-CD 3.44Å; D275-K278 WeakPolarHBondContact OD2-CE 3.49Å; D275-K278 WeakPolarHBondContact OD2-CG 3.47Å; D275-R279 WeakPolarHBondContact O-CB 3.49Å; D275-R279 PolarHBondContact O-N 3.14Å
276	S	86.8	Confident	87.1	Confident	82 Å²	82	62.5 Å²	62.5	57%	0.573	31%	0.312	S	S	*	.	H	α-helix	trans	-62.5	-32.9	177.3	67.9	0	0	0	0	113.9	Q272 S280	Q272-S276 PolarHBondContact O-N 3.17Å; S276-S280 PolarHBondContact O-N 3.23Å; S276-S280 PolarHBondContact O-OG 3.44Å; S276-S280 VanDerWaalsContact O-OG 3.1Å
277	L	86.7	Confident	87.5	Confident	78 Å²	78	57.6 Å²	57.6	41%	0.408	29%	0.285	S	S	.	.	H	α-helix	trans	-75.3	-45.1	179.9	-178.8	64.8	0	0	0	110.5	D275 R279 S280 R281 F324	D275-L277 VanDerWaalsContact C-N 3.31Å; D275-L277 PolarHBondContact O-N 3.39Å; D275-L277 WeakPolarHBondContact OD1-CA 3.11Å; D275-L277 WeakPolarHBondContact OD1-CB 3.41Å; D275-L277 PolarHBondContact OD1-N 2.84Å; L277-R279 VanDerWaalsContact C-N 3.26Å; L277-R279 PolarHBondContact O-N 3.19Å; L277-S280 WeakPolarHBondContact CA-OG 3.17Å; L277-S280 PolarHBondContact O-N 3.15Å; L277-S280 PolarHBondContact O-OG 2.99Å; L277-R281 HydrophobicContact CD1-CG 4.36Å; L277-R281 WeakPolarHBondContact O-CB 3.49Å; L277-R281 WeakPolarHBondContact O-CG 3.4Å; L277-R281 PolarHBondContact O-N 2.87Å; L277-F324 HydrophobicContact CD1-CZ 4.19Å
278	K	85.2	Confident	88	Confident	64 Å²	64	57.3 Å²	57.3	28%	0.278	28%	0.278	S	S	.	.	H	α-helix	trans	-59.6	-39.4	173.1	-79.8	177.7	-174	-170.7	0	111.5	F217 D275 S282	F217-K278 HydrophobicContact CE2-CB 3.67Å; F217-K278 HydrophobicContact CZ-CB 3.64Å; D275-K278 HydrophobicContact CB-CB 3.94Å; D275-K278 HydrophobicContact CB-CD 4.11Å; D275-K278 HydrophobicContact CB-CG 4.24Å; D275-K278 PolarHBondContact O-N 3.14Å; D275-K278 PolarHBondContact OD1-N 3.43Å; D275-K278 WeakPolarHBondContact OD2-CD 3.44Å; D275-K278 WeakPolarHBondContact OD2-CE 3.49Å; D275-K278 WeakPolarHBondContact OD2-CG 3.47Å; K278-S282 WeakPolarHBondContact O-CB 3.26Å; K278-S282 PolarHBondContact O-N 3.28Å
279	R	87	Confident	88.4	Confident	21 Å²	21	56.6 Å²	56.6	8%	0.079	27%	0.273	C	S	.	.	H	α-helix	trans	-62.4	-45	176.2	-175.8	-179.8	179.3	-152.2	4.5	112.3	F217 C268 R271 D275 L277 R283	F217-R279 HydrophobicContact CE2-CB 4.5Å; F217-R279 HydrophobicContact CZ-CB 4.28Å; C268-R279 VanDerWaalsContact CB-NH2 3.35Å; R271-R279 HydrophobicContact CB-CG 4.42Å; D275-R279 WeakPolarHBondContact O-CB 3.49Å; D275-R279 PolarHBondContact O-N 3.14Å; L277-R279 VanDerWaalsContact C-N 3.26Å; L277-R279 PolarHBondContact O-N 3.19Å; R279-R283 WeakPolarHBondContact O-CB 2.92Å; R279-R283 PolarHBondContact O-N 2.93Å; R279-R283 VanDerWaalsContact O-N 3.09Å
280	S	88.1	Confident	88.8	Confident	18 Å²	18	52.5 Å²	52.5	13%	0.126	25%	0.254	C	S	.	.	H	α-helix	trans	-69.3	-42.4	178.8	53.2	0	0	0	0	112.3	S276 L277 R283 L284	S276-S280 PolarHBondContact O-N 3.23Å; S276-S280 PolarHBondContact O-OG 3.44Å; S276-S280 VanDerWaalsContact O-OG 3.1Å; L277-S280 WeakPolarHBondContact CA-OG 3.17Å; L277-S280 PolarHBondContact O-N 3.15Å; L277-S280 PolarHBondContact O-OG 2.99Å; S280-R283 PolarHBondContact O-N 3.41Å; S280-L284 WeakPolarHBondContact O-CB 2.87Å; S280-L284 PolarHBondContact O-N 3.46Å
281	R	88.7	Confident	89.1	Confident	134 Å²	134	49.6 Å²	49.6	51%	0.506	24%	0.236	S	C	.	.	H	α-helix	trans	-61.1	-44.9	173.5	-76.1	-175.9	171.8	-177.8	-1.4	112.7	L277 R283 L284 N285	L277-R281 HydrophobicContact CD1-CG 4.36Å; L277-R281 WeakPolarHBondContact O-CB 3.49Å; L277-R281 WeakPolarHBondContact O-CG 3.4Å; L277-R281 PolarHBondContact O-N 2.87Å; R281-R283 PolarHBondContact O-N 3.17Å; R281-L284 PolarHBondContact O-N 2.83Å; R281-N285 WeakPolarHBondContact O-CB 3.44Å; R281-N285 PolarHBondContact O-N 2.92Å; R281-N285 PolarHBondContact O-ND2 3.42Å
282	S	87.4	Confident	89.6	Confident	27 Å²	27	45.7 Å²	45.7	19%	0.189	22%	0.222	C	C	.	.	H	α-helix	trans	-61.2	-43	176.9	174.7	0	0	0	0	112.4	D229 K278 N285 A286	D229-S282 VanDerWaalsContact OD2-CA 3.26Å; D229-S282 WeakPolarHBondContact OD2-CA 3.49Å; K278-S282 WeakPolarHBondContact O-CB 3.26Å; K278-S282 PolarHBondContact O-N 3.28Å; S282-N285 PolarHBondContact O-N 3.48Å; S282-A286 WeakPolarHBondContact O-CB 3.43Å; S282-A286 PolarHBondContact O-N 3.48Å
283	R	90.9	Very high	90	Very high	18 Å²	18	41.2 Å²	41.2	7%	0.068	20%	0.202	C	C	.	.	H	α-helix	trans	-59.5	-47.3	172.9	177.4	-175.6	-64.9	133.5	3.8	111.5	P258 R279 S280 R281 A286 Y287 E321	P258-R283 HydrophobicContact CB-CG 4.15Å; P258-R283 HydrophobicContact CG-CG 4.28Å; R279-R283 WeakPolarHBondContact O-CB 2.92Å; R279-R283 PolarHBondContact O-N 2.93Å; R279-R283 VanDerWaalsContact O-N 3.09Å; S280-R283 PolarHBondContact O-N 3.41Å; R281-R283 PolarHBondContact O-N 3.17Å; R283-A286 PolarHBondContact O-N 3.01Å; R283-Y287 HydrophobicContact CG-CD2 3.75Å; R283-Y287 HydrophobicContact CG-CE2 3.65Å; R283-Y287 VanDerWaalsContact O-CD2 3.26Å; R283-Y287 WeakPolarHBondContact O-CD2 3.31Å; R283-Y287 PolarHBondContact O-N 2.96Å; R283-E321 IonicContact CZ-OE1 2.87Å; R283-E321 IonicContact NH1-OE1 3.82Å; R283-E321 PolarHBondContact NH1-OE1 3.04Å
284	L	91.9	Very high	90.3	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.026	17%	0.171	C	C	.	.	H	α-helix	trans	-63.2	-42.3	-179.9	-178.4	62.3	0	0	0	111.9	S280 R281 Y287 R288 F324 E327 Y328 L331	S280-L284 WeakPolarHBondContact O-CB 2.87Å; S280-L284 PolarHBondContact O-N 3.46Å; R281-L284 PolarHBondContact O-N 2.83Å; L284-Y287 PolarHBondContact O-N 3.39Å; L284-R288 WeakPolarHBondContact O-CB 3.43Å; L284-R288 PolarHBondContact O-N 3.22Å; L284-F324 HydrophobicContact CD2-CB 4.42Å; L284-F324 HydrophobicContact CD2-CD1 3.92Å; L284-F324 HydrophobicContact CD2-CE1 4.45Å; L284-F324 HydrophobicContact CD2-CG 4.18Å; L284-E327 HydrophobicContact CD1-CB 4.17Å; L284-E327 HydrophobicContact CD2-CB 4.35Å; L284-E327 WeakPolarHBondContact CD2-OE2 3.43Å; L284-Y328 HydrophobicContact CD1-CD1 4.1Å; L284-Y328 HydrophobicContact CD1-CE1 3.79Å; L284-Y328 HydrophobicContact CD1-CE2 4.39Å; L284-L331 HydrophobicContact CD1-CD1 4.2Å
285	N	92.8	Very high	90.8	Very high	20 Å²	20	31.2 Å²	31.2	11%	0.107	15%	0.154	C	C	.	.	H	α-helix	trans	-64	-39.8	176.1	-76.5	-23.9	0	0	0	112.2	D229 H238 R281 S282 R288 A289	D229-N285 PolarHBondContact OD2-ND2 3.38Å; H238-N285 PolarHBondContact NE2-O 3.43Å; R281-N285 WeakPolarHBondContact O-CB 3.44Å; R281-N285 PolarHBondContact O-N 2.92Å; R281-N285 PolarHBondContact O-ND2 3.42Å; S282-N285 PolarHBondContact O-N 3.48Å; N285-R288 PolarHBondContact O-N 3.47Å; N285-A289 PolarHBondContact O-N 2.99Å
286	A	92.6	Very high	91.2	Very high	11 Å²	11	29.3 Å²	29.3	9%	0.091	14%	0.144	C	C	.	.	H	α-helix	trans	-62.7	-47.6	172.9	0	0	0	0	0	111.5	P258 S282 R283 R288 A289 L290	P258-A286 HydrophobicContact CG-CB 4.47Å; S282-A286 WeakPolarHBondContact O-CB 3.43Å; S282-A286 PolarHBondContact O-N 3.48Å; R283-A286 PolarHBondContact O-N 3.01Å; A286-R288 VanDerWaalsContact C-N 3.34Å; A286-R288 PolarHBondContact O-N 2.92Å; A286-A289 PolarHBondContact O-N 2.73Å; A286-L290 WeakPolarHBondContact O-CG 3.33Å; A286-L290 PolarHBondContact O-N 3Å
287	Y	94.4	Very high	91.4	Very high	13 Å²	13	25.6 Å²	25.6	5%	0.051	12%	0.118	C	C	.	.	H	α-helix	trans	-63.8	-37.5	175.5	-81.9	-65.4	0	0	0	112.8	P258 R283 L284 A289 L290 A291 L310 M314 L317 Y328	P258-Y287 HydrophobicContact CB-CE2 4.34Å; P258-Y287 HydrophobicContact CG-CD2 3.85Å; P258-Y287 HydrophobicContact CG-CE1 4.15Å; P258-Y287 HydrophobicContact CG-CE2 3.28Å; P258-Y287 HydrophobicContact CG-CG 4.46Å; P258-Y287 VanDerWaalsContact CG-CZ 3.45Å; R283-Y287 HydrophobicContact CG-CD2 3.75Å; R283-Y287 HydrophobicContact CG-CE2 3.65Å; R283-Y287 VanDerWaalsContact O-CD2 3.26Å; R283-Y287 WeakPolarHBondContact O-CD2 3.31Å; R283-Y287 PolarHBondContact O-N 2.96Å; L284-Y287 PolarHBondContact O-N 3.39Å; Y287-A289 VanDerWaalsContact C-N 3.28Å; Y287-A289 PolarHBondContact O-N 2.92Å; Y287-L290 HydrophobicContact CD1-CD1 4.48Å; Y287-L290 PolarHBondContact O-N 3.24Å; Y287-A291 WeakPolarHBondContact O-CB 3.42Å; Y287-A291 PolarHBondContact O-N 3.01Å; Y287-L310 HydrophobicContact CD1-CD1 3.9Å; Y287-L310 HydrophobicContact CE1-CD1 3.99Å; Y287-M314 HydrophobicContact CD1-CG 3.95Å; Y287-M314 HydrophobicContact CD1-SD 4.45Å; Y287-M314 HydrophobicContact CE1-CG 4.44Å; Y287-M314 HydrophobicContact CG-CG 4.41Å; Y287-L317 HydrophobicContact CD2-CD1 3.93Å; Y287-L317 HydrophobicContact CE1-CD1 4.22Å; Y287-L317 HydrophobicContact CE2-CD1 3.19Å; Y287-L317 WeakPolarHBondContact OH-CD1 3.42Å; Y287-Y328 HydrophobicContact CD2-CE1 4.13Å
288	R	94.8	Very high	91.7	Very high	78 Å²	78	24.3 Å²	24.3	29%	0.294	11%	0.111	S	C	.	.	H	α-helix	trans	-60.7	-38.2	174.9	177.9	174.6	-79.7	158.2	3.4	111.8	L284 N285 A286 E327 L331	L284-R288 WeakPolarHBondContact O-CB 3.43Å; L284-R288 PolarHBondContact O-N 3.22Å; N285-R288 PolarHBondContact O-N 3.47Å; A286-R288 VanDerWaalsContact C-N 3.34Å; A286-R288 PolarHBondContact O-N 2.92Å; R288-E327 IonicContact CZ-OE2 3.28Å; R288-E327 IonicContact NH2-OE2 3.65Å; R288-E327 PolarHBondContact NH2-OE2 3.13Å; R288-L331 HydrophobicContact CB-CD1 4.15Å; R288-L331 HydrophobicContact CB-CD2 4.13Å; R288-L331 HydrophobicContact CG-CD2 4.08Å
289	A	94.4	Very high	91.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-73.1	-44.6	175.7	0	0	0	0	0	112.4	I234 A237 I255 N285 A286 Y287 A291 S292	I234-A289 HydrophobicContact CB-CB 4.24Å; I234-A289 HydrophobicContact CG1-CB 4.16Å; I234-A289 HydrophobicContact CG2-CB 4.02Å; A237-A289 HydrophobicContact CB-CB 3.74Å; I255-A289 HydrophobicContact CD1-CB 3.61Å; N285-A289 PolarHBondContact O-N 2.99Å; A286-A289 PolarHBondContact O-N 2.73Å; Y287-A289 VanDerWaalsContact C-N 3.28Å; Y287-A289 PolarHBondContact O-N 2.92Å; A289-A291 VanDerWaalsContact C-N 3.26Å; A289-A291 PolarHBondContact O-N 3.31Å; A289-S292 VanDerWaalsContact O-CB 3.31Å; A289-S292 WeakPolarHBondContact O-CB 3.35Å; A289-S292 PolarHBondContact O-N 3.3Å; A289-S292 VanDerWaalsContact O-N 3.1Å; A289-S292 PolarHBondContact O-OG 2.84Å
290	L	93.9	Very high	91.8	Very high	12 Å²	12	23.5 Å²	23.5	6%	0.063	12%	0.117	C	C	.	.	H	α-helix	trans	-62	-33.2	176.4	-68.9	174.5	0	0	0	112.7	I255 K257 A286 Y287 S292 Y295 M296 L310	I255-L290 HydrophobicContact CB-CD2 3.97Å; I255-L290 HydrophobicContact CG2-CD2 3.92Å; I255-L290 HydrophobicContact CG2-CG 4.14Å; K257-L290 HydrophobicContact CG-CD1 4.2Å; A286-L290 WeakPolarHBondContact O-CG 3.33Å; A286-L290 PolarHBondContact O-N 3Å; Y287-L290 HydrophobicContact CD1-CD1 4.48Å; Y287-L290 PolarHBondContact O-N 3.24Å; L290-S292 VanDerWaalsContact C-N 3.27Å; L290-S292 PolarHBondContact O-N 3.32Å; L290-Y295 HydrophobicContact CD2-CD1 4.21Å; L290-Y295 HydrophobicContact CD2-CE1 3.53Å; L290-M296 WeakPolarHBondContact O-CG 3.29Å; L290-L310 HydrophobicContact CB-CD1 4.18Å; L290-L310 HydrophobicContact CB-CD2 4.09Å; L290-L310 HydrophobicContact CD1-CD1 4.43Å; L290-L310 WeakPolarHBondContact O-CD2 3.5Å
291	A	94.1	Very high	91.6	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	6.5	177.6	0	0	0	0	0	113.5	Y287 A289 L310 M314 L331 C335	Y287-A291 WeakPolarHBondContact O-CB 3.42Å; Y287-A291 PolarHBondContact O-N 3.01Å; A289-A291 VanDerWaalsContact C-N 3.26Å; A289-A291 PolarHBondContact O-N 3.31Å; A291-L310 HydrophobicContact CB-CD2 3.96Å; A291-M314 HydrophobicContact CB-CE 4.19Å; A291-M314 HydrophobicContact CB-SD 4.16Å; A291-L331 HydrophobicContact CB-CB 4.33Å; A291-L331 HydrophobicContact CB-CD2 4.4Å; A291-C335 VanDerWaalsContact CB-SG 3.55Å
292	S	93.2	Very high	91.4	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.132	C	C	.	.			trans	-76.8	131.4	175.7	70.4	0	0	0	0	110.9	A237 A289 L290 A294 Y295 M296	A237-S292 WeakPolarHBondContact CB-OG 3.3Å; A237-S292 WeakPolarHBondContact O-CB 3.14Å; A237-S292 PolarHBondContact O-OG 3.25Å; A289-S292 VanDerWaalsContact O-CB 3.31Å; A289-S292 WeakPolarHBondContact O-CB 3.35Å; A289-S292 PolarHBondContact O-N 3.3Å; A289-S292 VanDerWaalsContact O-N 3.1Å; A289-S292 PolarHBondContact O-OG 2.84Å; L290-S292 VanDerWaalsContact C-N 3.27Å; L290-S292 PolarHBondContact O-N 3.32Å; S292-A294 VanDerWaalsContact C-N 3.29Å; S292-A294 PolarHBondContact O-N 3.31Å; S292-Y295 PolarHBondContact O-N 3.37Å; S292-Y295 WeakPolarHBondContact OG-CB 3.47Å; S292-Y295 PolarHBondContact OG-N 3.43Å; S292-M296 VanDerWaalsContact O-CG 3.29Å; S292-M296 WeakPolarHBondContact O-CG 3.24Å; S292-M296 PolarHBondContact O-N 3.41Å
293	P	93.3	Very high	91.6	Very high	9 Å²	9	22.1 Å²	22.1	6%	0.058	12%	0.123	C	C	.	.	H	α-helix	trans	-54.9	-41.2	178.8	-29.4	34.4	0	0	0	114	N240 M296 A297 K334 F338 Y897	N240-P293 WeakPolarHBondContact OD1-CD 3.21Å; P293-M296 PolarHBondContact O-N 3.26Å; P293-A297 WeakPolarHBondContact O-CB 3.38Å; P293-A297 PolarHBondContact O-N 2.63Å; P293-K334 VanDerWaalsContact CD-CE 3.45Å; P293-F338 HydrophobicContact CB-CD2 3.78Å; P293-F338 HydrophobicContact CB-CE2 4.33Å; P293-F338 HydrophobicContact CB-CG 4.43Å; P293-F338 HydrophobicContact CG-CB 4.48Å; P293-Y897 HydrophobicContact CB-CE1 3.98Å; P293-Y897 VanDerWaalsContact CB-OH 3.3Å; P293-Y897 WeakPolarHBondContact CB-OH 3.28Å
294	A	92.7	Very high	91.5	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-60.1	-47.7	177.1	0	0	0	0	0	112.2	N240 H242 V245 S292 L298 M901	N240-A294 WeakPolarHBondContact OD1-CB 3.17Å; N240-A294 PolarHBondContact OD1-N 3.2Å; H242-A294 HydrophobicContact CB-CB 4.25Å; V245-A294 HydrophobicContact CG2-CB 4.44Å; S292-A294 VanDerWaalsContact C-N 3.29Å; S292-A294 PolarHBondContact O-N 3.31Å; A294-L298 WeakPolarHBondContact O-CG 3.42Å; A294-L298 PolarHBondContact O-N 2.93Å; A294-M901 HydrophobicContact CB-CE 4.17Å; A294-M901 HydrophobicContact CB-SD 4.45Å
295	Y	93.8	Very high	91.2	Very high	20 Å²	20	22.2 Å²	22.2	8%	0.078	12%	0.124	C	C	.	.	H	α-helix	trans	-67.2	-43.1	178.8	-173.5	-97.1	0	0	0	111.8	L233 V245 L249 I255 L290 S292 A297 L298 S299	L233-Y295 HydrophobicContact CD1-CD2 4.37Å; L233-Y295 HydrophobicContact CD1-CE2 4.37Å; L233-Y295 HydrophobicContact CD2-CE2 4.27Å; V245-Y295 HydrophobicContact CG1-CD2 4.08Å; L249-Y295 HydrophobicContact CD2-CE2 4.02Å; I255-Y295 HydrophobicContact CB-CE2 4.44Å; I255-Y295 HydrophobicContact CD1-CD2 3.96Å; I255-Y295 HydrophobicContact CD1-CE1 4.37Å; I255-Y295 HydrophobicContact CD1-CE2 3.69Å; I255-Y295 HydrophobicContact CD1-CG 4.41Å; I255-Y295 HydrophobicContact CG1-CE2 3.79Å; I255-Y295 PolarHBondContact N-OH 3.29Å; L290-Y295 HydrophobicContact CD2-CD1 4.21Å; L290-Y295 HydrophobicContact CD2-CE1 3.53Å; S292-Y295 PolarHBondContact O-N 3.37Å; S292-Y295 WeakPolarHBondContact OG-CB 3.47Å; S292-Y295 PolarHBondContact OG-N 3.43Å; Y295-A297 PolarHBondContact O-N 3.28Å; Y295-L298 PolarHBondContact O-N 3.38Å; Y295-S299 WeakPolarHBondContact CE1-OG 3.46Å; Y295-S299 WeakPolarHBondContact O-CB 2.95Å; Y295-S299 PolarHBondContact O-N 2.94Å; Y295-S299 PolarHBondContact O-OG 3.46Å
296	M	92.2	Very high	91.1	Very high	6 Å²	6	23.2 Å²	23.2	3%	0.03	13%	0.131	C	C	.	.	H	α-helix	trans	-63.2	-42.5	-179.8	-68.5	169	56.9	0	0	112.2	L290 S292 P293 L298 S300 T307 F338	L290-M296 WeakPolarHBondContact O-CG 3.29Å; S292-M296 VanDerWaalsContact O-CG 3.29Å; S292-M296 WeakPolarHBondContact O-CG 3.24Å; S292-M296 PolarHBondContact O-N 3.41Å; P293-M296 PolarHBondContact O-N 3.26Å; M296-L298 PolarHBondContact O-N 2.96Å; M296-S300 PolarHBondContact O-OG 3.36Å; M296-T307 HydrophobicContact CE-CG2 3.76Å; M296-T307 WeakPolarHBondContact CE-OG1 3.39Å; M296-F338 HydrophobicContact CB-CE1 4.09Å; M296-F338 HydrophobicContact CB-CZ 4.21Å; M296-F338 HydrophobicContact CE-CD1 3.44Å; M296-F338 VanDerWaalsContact CE-CD1 3.44Å; M296-F338 HydrophobicContact CE-CE1 3.66Å; M296-F338 HydrophobicContact CE-CG 4.34Å; M296-F338 HydrophobicContact SD-CD1 4.47Å
297	A	92.2	Very high	91	Very high	4 Å²	4	22.7 Å²	22.7	3%	0.033	13%	0.127	C	C	.	.	H	α-helix	trans	-65.1	-36.1	179.2	0	0	0	0	0	113	P293 Y295 F338 V894 Y897 L898	P293-A297 WeakPolarHBondContact O-CB 3.38Å; P293-A297 PolarHBondContact O-N 2.63Å; Y295-A297 PolarHBondContact O-N 3.28Å; A297-F338 HydrophobicContact CB-CE2 4.19Å; A297-F338 HydrophobicContact CB-CZ 4.23Å; A297-V894 HydrophobicContact CB-CG1 4.22Å; A297-V894 VanDerWaalsContact O-CG1 3.31Å; A297-V894 WeakPolarHBondContact O-CG1 3.44Å; A297-Y897 HydrophobicContact CB-CD1 4.22Å; A297-L898 HydrophobicContact CB-CD2 4.28Å
298	L	91.4	Very high	90.8	Very high	50 Å²	50	22 Å²	22	26%	0.262	12%	0.124	S	C	.	.	H	α-helix	trans	-93.2	-33.5	-174.9	-68.6	172	0	0	0	114.3	H242 V245 Q246 L249 A294 Y295 M296 L898	H242-L298 HydrophobicContact CB-CD1 4.21Å; H242-L298 WeakPolarHBondContact O-CD1 3.49Å; V245-L298 HydrophobicContact CB-CD1 4.25Å; V245-L298 HydrophobicContact CG1-CD1 3.97Å; Q246-L298 HydrophobicContact CB-CD1 4.03Å; L249-L298 HydrophobicContact CD1-CB 3.66Å; A294-L298 WeakPolarHBondContact O-CG 3.42Å; A294-L298 PolarHBondContact O-N 2.93Å; Y295-L298 PolarHBondContact O-N 3.38Å; M296-L298 PolarHBondContact O-N 2.96Å; L298-L898 HydrophobicContact CD2-CD1 3.68Å; L298-L898 HydrophobicContact CD2-CD2 4.42Å; L298-L898 HydrophobicContact CG-CD1 4.5Å; L298-L898 HydrophobicContact CG-CD2 4.4Å
299	S	89.3	Confident	90.6	Very high	51 Å²	51	22.3 Å²	22.3	36%	0.357	13%	0.129	S	C	.	.	H	α-helix	trans	-86.2	-27.7	-172.2	64.3	0	0	0	0	114.2	Y295	Y295-S299 WeakPolarHBondContact CE1-OG 3.46Å; Y295-S299 WeakPolarHBondContact O-CB 2.95Å; Y295-S299 PolarHBondContact O-N 2.94Å; Y295-S299 PolarHBondContact O-OG 3.46Å
300	S	85.3	Confident	90.6	Very high	18 Å²	18	22.9 Å²	22.9	13%	0.126	13%	0.132	C	C	.	.			trans	-108.6	136.5	-169	67	0	0	0	0	113.2	M296 D302 P303 T306	M296-S300 PolarHBondContact O-OG 3.36Å; S300-D302 VanDerWaalsContact C-N 3.26Å; S300-D302 PolarHBondContact O-N 2.88Å; S300-P303 VanDerWaalsContact OG-CA 3.24Å; S300-P303 WeakPolarHBondContact OG-CA 3.37Å; S300-T306 PolarHBondContact OG-OG1 3.3Å; S300-T306 VanDerWaalsContact OG-OG1 3.09Å
301	P	83.6	Confident	90.5	Very high	122 Å²	122	23.6 Å²	23.6	79%	0.792	13%	0.134	S	C	*	.	S	Bend	trans	-69	-27.2	179.3	27.8	-34.8	0	0	0	112.5
302	D	85.3	Confident	90.4	Very high	28 Å²	28	25.7 Å²	25.7	15%	0.15	14%	0.144	C	C	.	.	S	Bend	trans	-130.8	87.8	174.9	-170.6	-1.4	0	0	0	110	S300 I304 M305 T306 R372 H886 M890	S300-D302 VanDerWaalsContact C-N 3.26Å; S300-D302 PolarHBondContact O-N 2.88Å; D302-I304 PolarHBondContact O-N 3.03Å; D302-M305 HydrophobicContact CB-CB 4.37Å; D302-M305 PolarHBondContact O-N 3.34Å; D302-T306 PolarHBondContact O-N 3Å; D302-T306 PolarHBondContact O-OG1 3.15Å; D302-R372 IonicContact OD1-CZ 3.26Å; D302-R372 IonicContact OD1-NH2 3.98Å; D302-R372 IonicContact OD2-CZ 3.26Å; D302-R372 IonicContact OD2-NE 3.56Å; D302-R372 IonicContact OD2-NH2 3.49Å; D302-R372 PolarHBondContact OD2-NH2 3.43Å; D302-H886 IonicContact OD2-CE1 3.13Å; D302-M890 WeakPolarHBondContact OD1-CE 3.37Å
303	P	90.8	Very high	90.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.2	-27.8	-173.6	24.4	-34.1	0	0	0	113.4	S300 T306 T307 F338 M890 V894	S300-P303 VanDerWaalsContact OG-CA 3.24Å; S300-P303 WeakPolarHBondContact OG-CA 3.37Å; P303-T306 WeakPolarHBondContact CA-OG1 3.36Å; P303-T306 PolarHBondContact O-OG1 3.34Å; P303-T307 WeakPolarHBondContact O-CB 3.33Å; P303-T307 PolarHBondContact O-N 3.44Å; P303-T307 PolarHBondContact O-OG1 3.4Å; P303-F338 HydrophobicContact CB-CE1 3.94Å; P303-F338 HydrophobicContact CB-CZ 3.91Å; P303-M890 HydrophobicContact CG-CG 4.05Å; P303-M890 HydrophobicContact CG-SD 3.65Å; P303-V894 HydrophobicContact CG-CG2 3.94Å
304	I	88.9	Confident	90.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-76.7	-42	-176.3	-58.4	-179.8	0	0	0	110.4	D302 T307 F308 M342 V355 F384 M890	D302-I304 PolarHBondContact O-N 3.03Å; I304-T307 WeakPolarHBondContact O-CB 3.03Å; I304-T307 PolarHBondContact O-N 2.69Å; I304-F308 HydrophobicContact CG2-CD2 4.37Å; I304-F308 HydrophobicContact CG2-CE1 4.32Å; I304-F308 HydrophobicContact CG2-CE2 3.73Å; I304-F308 HydrophobicContact CG2-CZ 3.71Å; I304-F308 WeakPolarHBondContact O-CG 3.34Å; I304-F308 PolarHBondContact O-N 2.82Å; I304-F308 VanDerWaalsContact O-N 3.12Å; I304-M342 HydrophobicContact CD1-CB 4.17Å; I304-M342 HydrophobicContact CG1-CB 4.4Å; I304-M342 HydrophobicContact CG1-CG 4.33Å; I304-V355 HydrophobicContact CD1-CB 4.08Å; I304-V355 HydrophobicContact CD1-CG1 3.41Å; I304-V355 VanDerWaalsContact CD1-CG1 3.41Å; I304-V355 HydrophobicContact CD1-CG2 3.75Å; I304-F384 HydrophobicContact CG2-CE2 4.02Å; I304-F384 HydrophobicContact CG2-CZ 4.12Å; I304-M890 HydrophobicContact CD1-CE 4.14Å; I304-M890 HydrophobicContact CG1-CE 4.39Å
305	M	87	Confident	90.3	Very high	24 Å²	24	30.7 Å²	30.7	12%	0.118	17%	0.167	C	C	.	.	H	α-helix	trans	-65.4	-43.1	175.8	-177	59.6	77.4	0	0	111.5	D302 T307 F308 Q309 D358 R372 L375	D302-M305 HydrophobicContact CB-CB 4.37Å; D302-M305 PolarHBondContact O-N 3.34Å; M305-T307 VanDerWaalsContact C-N 3.3Å; M305-T307 PolarHBondContact O-N 3.1Å; M305-F308 PolarHBondContact O-N 3.41Å; M305-Q309 WeakPolarHBondContact O-CG 3.33Å; M305-Q309 PolarHBondContact O-N 3.12Å; M305-Q309 HydrophobicContact SD-CG 4.49Å; M305-D358 VanDerWaalsContact CE-OD2 3.26Å; M305-D358 WeakPolarHBondContact CE-OD2 3.36Å; M305-R372 HydrophobicContact CE-CG 4.24Å; M305-L375 HydrophobicContact CE-CD1 4.01Å; M305-L375 HydrophobicContact CE-CD2 4.06Å; M305-L375 HydrophobicContact SD-CD1 4.08Å; M305-L375 HydrophobicContact SD-CD2 3.84Å
306	T	89.4	Confident	90.2	Very high	41 Å²	41	34.4 Å²	34.4	25%	0.252	18%	0.183	S	C	.	.	H	α-helix	trans	-63.7	-37.8	176.9	57.5	0	0	0	0	111.8	S300 D302 P303 F308 Q309 L310	S300-T306 PolarHBondContact OG-OG1 3.3Å; S300-T306 VanDerWaalsContact OG-OG1 3.09Å; D302-T306 PolarHBondContact O-N 3Å; D302-T306 PolarHBondContact O-OG1 3.15Å; P303-T306 WeakPolarHBondContact CA-OG1 3.36Å; P303-T306 PolarHBondContact O-OG1 3.34Å; T306-F308 PolarHBondContact O-N 3.41Å; T306-Q309 PolarHBondContact O-N 3.29Å; T306-L310 VanDerWaalsContact O-CB 3.27Å; T306-L310 WeakPolarHBondContact O-CB 3.38Å; T306-L310 PolarHBondContact O-N 3.48Å
307	T	91.8	Very high	90.1	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-55.4	-50.5	172	-56.6	0	0	0	0	111.6	M296 P303 I304 M305 L310 R311 C335 F338 A339	M296-T307 HydrophobicContact CE-CG2 3.76Å; M296-T307 WeakPolarHBondContact CE-OG1 3.39Å; P303-T307 WeakPolarHBondContact O-CB 3.33Å; P303-T307 PolarHBondContact O-N 3.44Å; P303-T307 PolarHBondContact O-OG1 3.4Å; I304-T307 WeakPolarHBondContact O-CB 3.03Å; I304-T307 PolarHBondContact O-N 2.69Å; M305-T307 VanDerWaalsContact C-N 3.3Å; M305-T307 PolarHBondContact O-N 3.1Å; T307-L310 PolarHBondContact O-N 2.89Å; T307-R311 VanDerWaalsContact O-CB 3.25Å; T307-R311 WeakPolarHBondContact O-CB 3.41Å; T307-R311 PolarHBondContact O-N 3.28Å; T307-C335 HydrophobicContact CG2-CB 3.85Å; T307-C335 WeakPolarHBondContact CG2-O 3.49Å; T307-F338 HydrophobicContact CG2-CD1 4.43Å; T307-F338 WeakPolarHBondContact OG1-CD1 3.37Å; T307-F338 WeakPolarHBondContact OG1-CE1 3.26Å; T307-A339 HydrophobicContact CG2-CB 4.05Å
308	F	90.4	Very high	90.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-65.4	-41.2	-178	-65.6	-20.7	0	0	0	112.7	I304 M305 T306 R311 Q312 A339 R372 L375 A376 F379 E381 F384	I304-F308 HydrophobicContact CG2-CD2 4.37Å; I304-F308 HydrophobicContact CG2-CE1 4.32Å; I304-F308 HydrophobicContact CG2-CE2 3.73Å; I304-F308 HydrophobicContact CG2-CZ 3.71Å; I304-F308 WeakPolarHBondContact O-CG 3.34Å; I304-F308 PolarHBondContact O-N 2.82Å; I304-F308 VanDerWaalsContact O-N 3.12Å; M305-F308 PolarHBondContact O-N 3.41Å; T306-F308 PolarHBondContact O-N 3.41Å; F308-R311 PolarHBondContact O-N 2.95Å; F308-Q312 PolarHBondContact O-N 3.46Å; F308-A339 HydrophobicContact CE1-CB 4.19Å; F308-R372 HydrophobicContact CD2-CG 4.41Å; F308-R372 HydrophobicContact CE2-CG 4.05Å; F308-L375 HydrophobicContact CB-CD2 4.29Å; F308-L375 HydrophobicContact CD2-CD2 3.64Å; F308-L375 HydrophobicContact CE2-CD2 4.46Å; F308-L375 HydrophobicContact CG-CD2 4.41Å; F308-A376 HydrophobicContact CE2-CB 4.14Å; F308-A376 HydrophobicContact CZ-CB 4.3Å; F308-F379 HydrophobicContact CB-CD2 3.98Å; F308-F379 HydrophobicContact CB-CE2 4.25Å; F308-E381 HydrophobicContact CD1-CG 3.5Å; F308-E381 HydrophobicContact CE1-CG 3.37Å; F308-E381 HydrophobicContact CG-CG 4.29Å; F308-E381 HydrophobicContact CZ-CG 4.03Å; F308-F384 HydrophobicContact CE1-CD2 4.21Å; F308-F384 HydrophobicContact CE1-CE2 4.48Å; F308-F384 HydrophobicContact CE1-CG 4.22Å; F308-F384 HydrophobicContact CE2-CE1 4.24Å; F308-F384 HydrophobicContact CE2-CZ 4.31Å; F308-F384 AromaticContact CZ-CD1 3.73Å; F308-F384 HydrophobicContact CZ-CD1 3.73Å; F308-F384 AromaticContact CZ-CD2 3.82Å; F308-F384 HydrophobicContact CZ-CD2 3.82Å; F308-F384 AromaticContact CZ-CE1 3.72Å; F308-F384 HydrophobicContact CZ-CE1 3.72Å; F308-F384 AromaticContact CZ-CE2 3.77Å; F308-F384 HydrophobicContact CZ-CE2 3.77Å; F308-F384 AromaticContact CZ-CG 3.77Å; F308-F384 HydrophobicContact CZ-CG 3.77Å; F308-F384 AromaticContact CZ-CZ 3.73Å; F308-F384 HydrophobicContact CZ-CZ 3.73Å
309	Q	90.7	Very high	90.1	Very high	83 Å²	83	39.1 Å²	39.1	39%	0.388	20%	0.204	S	C	.	.	H	α-helix	trans	-63.5	-49.7	176.2	-69.7	176.7	-0.8	0	0	111.5	M305 T306 R311 Q312 E313	M305-Q309 WeakPolarHBondContact O-CG 3.33Å; M305-Q309 PolarHBondContact O-N 3.12Å; M305-Q309 HydrophobicContact SD-CG 4.49Å; T306-Q309 PolarHBondContact O-N 3.29Å; Q309-R311 VanDerWaalsContact C-N 3.29Å; Q309-R311 PolarHBondContact O-N 2.96Å; Q309-Q312 PolarHBondContact O-N 3.45Å; Q309-E313 WeakPolarHBondContact O-CG 3.25Å; Q309-E313 PolarHBondContact O-N 2.97Å
310	L	92.5	Very high	90.2	Very high	12 Å²	12	41.3 Å²	41.3	6%	0.063	21%	0.211	C	C	.	.	H	α-helix	trans	-61.7	-40.2	179.5	-169.7	70	0	0	0	111	Y287 L290 A291 T306 T307 E313 M314	Y287-L310 HydrophobicContact CD1-CD1 3.9Å; Y287-L310 HydrophobicContact CE1-CD1 3.99Å; L290-L310 HydrophobicContact CB-CD1 4.18Å; L290-L310 HydrophobicContact CB-CD2 4.09Å; L290-L310 HydrophobicContact CD1-CD1 4.43Å; L290-L310 WeakPolarHBondContact O-CD2 3.5Å; A291-L310 HydrophobicContact CB-CD2 3.96Å; T306-L310 VanDerWaalsContact O-CB 3.27Å; T306-L310 WeakPolarHBondContact O-CB 3.38Å; T306-L310 PolarHBondContact O-N 3.48Å; T307-L310 PolarHBondContact O-N 2.89Å; L310-E313 PolarHBondContact O-N 3.14Å; L310-M314 HydrophobicContact CD2-CE 4.35Å; L310-M314 HydrophobicContact CG-CE 4.05Å; L310-M314 HydrophobicContact CG-SD 4.41Å; L310-M314 VanDerWaalsContact O-CG 3.32Å; L310-M314 WeakPolarHBondContact O-CG 3.29Å; L310-M314 PolarHBondContact O-N 3.02Å
311	R	93.6	Very high	90.4	Very high	28 Å²	28	41.1 Å²	41.1	11%	0.106	21%	0.208	C	C	.	.	H	α-helix	trans	-61.5	-47.2	176.4	-164.5	-177.4	119.7	147.1	7.4	111.8	T307 F308 Q309 E313 M314 M315 V332 E381	T307-R311 VanDerWaalsContact O-CB 3.25Å; T307-R311 WeakPolarHBondContact O-CB 3.41Å; T307-R311 PolarHBondContact O-N 3.28Å; F308-R311 PolarHBondContact O-N 2.95Å; Q309-R311 VanDerWaalsContact C-N 3.29Å; Q309-R311 PolarHBondContact O-N 2.96Å; R311-E313 VanDerWaalsContact C-N 3.31Å; R311-E313 PolarHBondContact O-N 3.4Å; R311-M314 PolarHBondContact O-N 2.64Å; R311-M315 HydrophobicContact CG-CE 4.25Å; R311-M315 WeakPolarHBondContact O-CB 3.49Å; R311-M315 WeakPolarHBondContact O-CG 3.4Å; R311-M315 PolarHBondContact O-N 3.24Å; R311-V332 HydrophobicContact CG-CB 4.16Å; R311-V332 HydrophobicContact CG-CG1 3.63Å; R311-V332 HydrophobicContact CG-CG2 4.08Å; R311-E381 WeakPolarHBondContact CD-OE1 3.4Å; R311-E381 WeakPolarHBondContact CD-OE2 3.34Å; R311-E381 IonicContact CZ-OE1 3.8Å; R311-E381 IonicContact CZ-OE2 2.82Å; R311-E381 IonicContact NE-OE1 3.22Å; R311-E381 PolarHBondContact NE-OE1 3.13Å; R311-E381 IonicContact NE-OE2 3.86Å; R311-E381 PolarHBondContact NE-OE2 3.4Å; R311-E381 IonicContact NH1-OE1 3.64Å; R311-E381 IonicContact NH1-OE2 2.59Å; R311-E381 PolarHBondContact NH1-OE2 3.42Å; R311-E381 IonicContact NH2-OE1 2.85Å; R311-E381 IonicContact NH2-OE2 2.81Å
312	Q	91.3	Very high	90.7	Very high	44 Å²	44	43.1 Å²	43.1	21%	0.206	20%	0.204	C	C	.	.	H	α-helix	trans	-63.3	-38	178.3	-172.4	64.6	34.4	0	0	112.2	F308 Q309 K316 F379	F308-Q312 PolarHBondContact O-N 3.46Å; Q309-Q312 PolarHBondContact O-N 3.45Å; Q312-K316 WeakPolarHBondContact O-CG 3.34Å; Q312-K316 PolarHBondContact O-N 3.47Å; Q312-K316 VanDerWaalsContact O-N 3.14Å; Q312-F379 HydrophobicContact CB-CD1 4.37Å; Q312-F379 HydrophobicContact CB-CE1 4.47Å; Q312-F379 HydrophobicContact CG-CD1 4.08Å; Q312-F379 HydrophobicContact CG-CE1 4.13Å
313	E	91.3	Very high	90.9	Very high	65 Å²	65	49.2 Å²	49.2	30%	0.304	23%	0.232	S	C	.	.	H	α-helix	trans	-63.3	-48.6	174.7	-73.1	175.7	-178.6	0	0	111.4	Q309 L310 R311 M315 K316 L317	Q309-E313 WeakPolarHBondContact O-CG 3.25Å; Q309-E313 PolarHBondContact O-N 2.97Å; L310-E313 PolarHBondContact O-N 3.14Å; R311-E313 VanDerWaalsContact C-N 3.31Å; R311-E313 PolarHBondContact O-N 3.4Å; E313-M315 PolarHBondContact O-N 3.41Å; E313-K316 PolarHBondContact O-N 3.49Å; E313-L317 WeakPolarHBondContact O-CG 3.4Å; E313-L317 PolarHBondContact O-N 2.96Å
314	M	92.6	Very high	91	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.1	-37.1	177.9	-68.8	-173.4	-61	0	0	112.8	Y287 A291 L310 R311 L317 A318 Y328 L331 V332 C335	Y287-M314 HydrophobicContact CD1-CG 3.95Å; Y287-M314 HydrophobicContact CD1-SD 4.45Å; Y287-M314 HydrophobicContact CE1-CG 4.44Å; Y287-M314 HydrophobicContact CG-CG 4.41Å; A291-M314 HydrophobicContact CB-CE 4.19Å; A291-M314 HydrophobicContact CB-SD 4.16Å; L310-M314 HydrophobicContact CD2-CE 4.35Å; L310-M314 HydrophobicContact CG-CE 4.05Å; L310-M314 HydrophobicContact CG-SD 4.41Å; L310-M314 VanDerWaalsContact O-CG 3.32Å; L310-M314 WeakPolarHBondContact O-CG 3.29Å; L310-M314 PolarHBondContact O-N 3.02Å; R311-M314 PolarHBondContact O-N 2.64Å; M314-L317 PolarHBondContact O-N 3.22Å; M314-A318 WeakPolarHBondContact O-CB 3.43Å; M314-A318 PolarHBondContact O-N 3.03Å; M314-Y328 HydrophobicContact CB-CD1 4.5Å; M314-L331 HydrophobicContact CE-CB 4.22Å; M314-L331 HydrophobicContact SD-CB 3.7Å; M314-L331 HydrophobicContact SD-CD1 4.27Å; M314-V332 HydrophobicContact CB-CG2 3.61Å; M314-V332 HydrophobicContact CE-CG2 4.05Å; M314-C335 HydrophobicContact CE-CB 4.37Å
315	M	92.3	Very high	91.2	Very high	49 Å²	49	56.2 Å²	56.2	24%	0.241	26%	0.262	C	S	.	.	H	α-helix	trans	-62.6	-41.8	174.6	-75.4	-170.5	-63.6	0	0	111.7	R311 E313 L317 A318 E319 V332	R311-M315 HydrophobicContact CG-CE 4.25Å; R311-M315 WeakPolarHBondContact O-CB 3.49Å; R311-M315 WeakPolarHBondContact O-CG 3.4Å; R311-M315 PolarHBondContact O-N 3.24Å; E313-M315 PolarHBondContact O-N 3.41Å; M315-L317 VanDerWaalsContact C-N 3.35Å; M315-A318 PolarHBondContact O-N 3.25Å; M315-E319 PolarHBondContact O-N 3.01Å; M315-V332 HydrophobicContact CG-CG1 3.97Å; M315-V332 HydrophobicContact CG-CG2 3.81Å; M315-V332 HydrophobicContact SD-CG1 4.34Å
316	K	91.7	Very high	91.6	Very high	98 Å²	98	62.8 Å²	62.8	43%	0.426	29%	0.29	S	S	.	.	H	α-helix	trans	-63.7	-41.1	173.9	-71.5	172.1	-177.4	175	0	111.4	Q312 E313 E319 I320	Q312-K316 WeakPolarHBondContact O-CG 3.34Å; Q312-K316 PolarHBondContact O-N 3.47Å; Q312-K316 VanDerWaalsContact O-N 3.14Å; E313-K316 PolarHBondContact O-N 3.49Å; K316-E319 PolarHBondContact O-N 2.95Å; K316-I320 VanDerWaalsContact O-CG1 3.31Å; K316-I320 WeakPolarHBondContact O-CG1 3.43Å; K316-I320 PolarHBondContact O-N 2.97Å
317	L	91.3	Very high	91.8	Very high	13 Å²	13	63.6 Å²	63.6	7%	0.068	29%	0.291	C	S	.	.	H	α-helix	trans	-65.9	-37.4	176.9	-70	171.4	0	0	0	112.4	Y287 E313 M314 M315 E319 I320 E321 Y328	Y287-L317 HydrophobicContact CD2-CD1 3.93Å; Y287-L317 HydrophobicContact CE1-CD1 4.22Å; Y287-L317 HydrophobicContact CE2-CD1 3.19Å; Y287-L317 WeakPolarHBondContact OH-CD1 3.42Å; E313-L317 WeakPolarHBondContact O-CG 3.4Å; E313-L317 PolarHBondContact O-N 2.96Å; M314-L317 PolarHBondContact O-N 3.22Å; M315-L317 VanDerWaalsContact C-N 3.35Å; L317-E319 PolarHBondContact O-N 3.13Å; L317-I320 PolarHBondContact O-N 2.69Å; L317-I320 VanDerWaalsContact O-N 3.13Å; L317-E321 PolarHBondContact O-N 2.77Å; L317-Y328 HydrophobicContact CB-CE1 4.3Å; L317-Y328 HydrophobicContact CB-CE2 4.49Å; L317-Y328 HydrophobicContact CD1-CE1 4.32Å
318	A	92.7	Very high	92	Very high	3 Å²	3	63.6 Å²	63.6	3%	0.025	29%	0.291	C	S	.	.	H	α-helix	trans	-64.6	-25.4	176.1	0	0	0	0	0	113.4	M314 M315 K325 Y328 L329	M314-A318 WeakPolarHBondContact O-CB 3.43Å; M314-A318 PolarHBondContact O-N 3.03Å; M315-A318 PolarHBondContact O-N 3.25Å; A318-K325 HydrophobicContact CB-CG 4.26Å; A318-K325 WeakPolarHBondContact O-CG 3.18Å; A318-Y328 HydrophobicContact CB-CG 4.46Å; A318-L329 HydrophobicContact CB-CD2 4.46Å; A318-L329 HydrophobicContact CB-CG 4.45Å
319	E	91.3	Very high	92.2	Very high	143 Å²	143	67.4 Å²	67.4	67%	0.668	31%	0.311	S	S	*	.	H	α-helix	trans	-78.9	-35.6	173.1	-171.6	174.9	-172.9	0	0	112	M315 K316 L317	M315-E319 PolarHBondContact O-N 3.01Å; K316-E319 PolarHBondContact O-N 2.95Å; L317-E319 PolarHBondContact O-N 3.13Å
320	I	90.3	Very high	92.4	Very high	97 Å²	97	68 Å²	68	50%	0.497	32%	0.315	S	S	.	.	H	α-helix	trans	-79.4	-51.2	-178.9	-60.2	164.1	0	0	0	111.5	I261 K316 L317 K322	I261-I320 HydrophobicContact CD1-CG2 3.92Å; I261-I320 HydrophobicContact CG2-CD1 4.11Å; I261-I320 HydrophobicContact CG2-CG2 4.13Å; K316-I320 VanDerWaalsContact O-CG1 3.31Å; K316-I320 WeakPolarHBondContact O-CG1 3.43Å; K316-I320 PolarHBondContact O-N 2.97Å; L317-I320 PolarHBondContact O-N 2.69Å; L317-I320 VanDerWaalsContact O-N 3.13Å; I320-K322 PolarHBondContact O-N 3.32Å
321	E	88.8	Confident	92.5	Very high	13 Å²	13	67.9 Å²	67.9	6%	0.061	31%	0.314	C	S	.	.			trans	-92.3	90.4	179.2	-65.8	-174.5	173.3	0	0	109.7	I261 R283 L317 E323 K325 Y328	I261-E321 HydrophobicContact CD1-CG 3.82Å; I261-E321 WeakPolarHBondContact CD1-OE1 3.12Å; R283-E321 IonicContact CZ-OE1 2.87Å; R283-E321 IonicContact NH1-OE1 3.82Å; R283-E321 PolarHBondContact NH1-OE1 3.04Å; L317-E321 PolarHBondContact O-N 2.77Å; E321-E323 PolarHBondContact O-N 3.25Å; E321-K325 PolarHBondContact O-N 3.28Å; E321-Y328 HydrophobicContact CB-CE2 4.15Å; E321-Y328 WeakPolarHBondContact OE2-CE2 3.37Å; E321-Y328 VanDerWaalsContact OE2-CZ 3.3Å; E321-Y328 PolarHBondContact OE2-OH 3.12Å
322	K	90.3	Very high	92.6	Very high	164 Å²	164	67.1 Å²	67.1	71%	0.713	31%	0.313	S	S	*	.	S	Bend	trans	-67.8	-26.1	-176.2	-67.1	-178.8	-179.2	175.8	0	112.6	I320 K325	I320-K322 PolarHBondContact O-N 3.32Å; K322-K325 WeakPolarHBondContact O-CB 3.2Å
323	E	90.6	Very high	92.6	Very high	156 Å²	156	69.6 Å²	69.6	73%	0.729	32%	0.324	S	S	*	.	S	Bend	trans	-69.3	-44.8	-175.7	-59	75	-165	0	0	111.7	E321	E321-E323 PolarHBondContact O-N 3.25Å
324	F	91.4	Very high	92.7	Very high	41 Å²	41	69.9 Å²	69.9	18%	0.18	32%	0.324	C	S	.	.	S	Bend	trans	-100.3	14.4	-179.8	-59.7	-69.3	0	0	0	113.3	L277 L284 K326 E327 Y328	L277-F324 HydrophobicContact CD1-CZ 4.19Å; L284-F324 HydrophobicContact CD2-CB 4.42Å; L284-F324 HydrophobicContact CD2-CD1 3.92Å; L284-F324 HydrophobicContact CD2-CE1 4.45Å; L284-F324 HydrophobicContact CD2-CG 4.18Å; F324-K326 VanDerWaalsContact C-N 3.25Å; F324-K326 PolarHBondContact O-N 3.03Å; F324-K326 VanDerWaalsContact O-N 3.16Å; F324-E327 PolarHBondContact O-N 2.72Å; F324-Y328 HydrophobicContact CB-CD2 4.04Å; F324-Y328 HydrophobicContact CB-CE2 3.82Å; F324-Y328 WeakPolarHBondContact O-CD2 3.34Å; F324-Y328 PolarHBondContact O-N 3.38Å; F324-Y328 VanDerWaalsContact O-N 3.1Å
325	K	93.5	Very high	92.8	Very high	106 Å²	106	69.9 Å²	69.9	46%	0.461	32%	0.324	S	S	.	.	H	α-helix	trans	-51.2	-42.8	-177.2	178.4	173.6	-179.3	178.6	0	112.9	A318 E321 K322 E327 L329	A318-K325 HydrophobicContact CB-CG 4.26Å; A318-K325 WeakPolarHBondContact O-CG 3.18Å; E321-K325 PolarHBondContact O-N 3.28Å; K322-K325 WeakPolarHBondContact O-CB 3.2Å; K325-E327 PolarHBondContact O-N 3.38Å; K325-L329 HydrophobicContact CG-CD1 3.99Å; K325-L329 HydrophobicContact CG-CG 4.43Å; K325-L329 WeakPolarHBondContact O-CB 3.4Å; K325-L329 VanDerWaalsContact O-CG 3.27Å; K325-L329 WeakPolarHBondContact O-CG 3.36Å; K325-L329 PolarHBondContact O-N 3.22Å
326	K	95	Very high	92.7	Very high	163 Å²	163	67.7 Å²	67.7	71%	0.709	31%	0.314	S	S	*	.	H	α-helix	trans	-61.8	-42.5	178.7	-172.7	-178.7	177.5	-176.9	0	111.6	F324 L329 M330	F324-K326 VanDerWaalsContact C-N 3.25Å; F324-K326 PolarHBondContact O-N 3.03Å; F324-K326 VanDerWaalsContact O-N 3.16Å; K326-L329 PolarHBondContact O-N 2.56Å; K326-M330 WeakPolarHBondContact O-CG 3.37Å; K326-M330 PolarHBondContact O-N 2.96Å
327	E	94.6	Very high	92.8	Very high	57 Å²	57	66 Å²	66	27%	0.266	31%	0.309	S	S	.	.	H	α-helix	trans	-68.2	-44.3	-179.2	-64.1	-166	-132.1	0	0	112.1	L284 R288 F324 K325 L329 M330 L331	L284-E327 HydrophobicContact CD1-CB 4.17Å; L284-E327 HydrophobicContact CD2-CB 4.35Å; L284-E327 WeakPolarHBondContact CD2-OE2 3.43Å; R288-E327 IonicContact CZ-OE2 3.28Å; R288-E327 IonicContact NH2-OE2 3.65Å; R288-E327 PolarHBondContact NH2-OE2 3.13Å; F324-E327 PolarHBondContact O-N 2.72Å; K325-E327 PolarHBondContact O-N 3.38Å; E327-L329 VanDerWaalsContact C-N 3.33Å; E327-L329 PolarHBondContact O-N 3Å; E327-M330 HydrophobicContact CB-CE 4.36Å; E327-M330 HydrophobicContact CG-CE 4.03Å; E327-M330 PolarHBondContact O-N 2.96Å; E327-L331 WeakPolarHBondContact O-CG 3.1Å; E327-L331 PolarHBondContact O-N 2.74Å
328	Y	95.5	Very high	92.9	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-61.3	-40.9	174.2	-72.1	-65.7	0	0	0	112.3	L284 Y287 M314 L317 A318 E321 F324 M330 L331 V332	L284-Y328 HydrophobicContact CD1-CD1 4.1Å; L284-Y328 HydrophobicContact CD1-CE1 3.79Å; L284-Y328 HydrophobicContact CD1-CE2 4.39Å; Y287-Y328 HydrophobicContact CD2-CE1 4.13Å; M314-Y328 HydrophobicContact CB-CD1 4.5Å; L317-Y328 HydrophobicContact CB-CE1 4.3Å; L317-Y328 HydrophobicContact CB-CE2 4.49Å; L317-Y328 HydrophobicContact CD1-CE1 4.32Å; A318-Y328 HydrophobicContact CB-CG 4.46Å; E321-Y328 HydrophobicContact CB-CE2 4.15Å; E321-Y328 WeakPolarHBondContact OE2-CE2 3.37Å; E321-Y328 VanDerWaalsContact OE2-CZ 3.3Å; E321-Y328 PolarHBondContact OE2-OH 3.12Å; F324-Y328 HydrophobicContact CB-CD2 4.04Å; F324-Y328 HydrophobicContact CB-CE2 3.82Å; F324-Y328 WeakPolarHBondContact O-CD2 3.34Å; F324-Y328 PolarHBondContact O-N 3.38Å; F324-Y328 VanDerWaalsContact O-N 3.1Å; Y328-M330 VanDerWaalsContact C-N 3.34Å; Y328-M330 PolarHBondContact O-N 3.19Å; Y328-L331 PolarHBondContact O-N 3.1Å; Y328-V332 WeakPolarHBondContact O-CB 3.29Å; Y328-V332 VanDerWaalsContact O-CG2 3.26Å; Y328-V332 WeakPolarHBondContact O-CG2 3.43Å; Y328-V332 PolarHBondContact O-N 3.35Å
329	L	94.4	Very high	92.9	Very high	80 Å²	80	65.3 Å²	65.3	42%	0.419	31%	0.305	S	S	.	.	H	α-helix	trans	-65.1	-36	177	-70.9	176.1	0	0	0	112.5	A318 K325 K326 E327 V332 E333	A318-L329 HydrophobicContact CB-CD2 4.46Å; A318-L329 HydrophobicContact CB-CG 4.45Å; K325-L329 HydrophobicContact CG-CD1 3.99Å; K325-L329 HydrophobicContact CG-CG 4.43Å; K325-L329 WeakPolarHBondContact O-CB 3.4Å; K325-L329 VanDerWaalsContact O-CG 3.27Å; K325-L329 WeakPolarHBondContact O-CG 3.36Å; K325-L329 PolarHBondContact O-N 3.22Å; K326-L329 PolarHBondContact O-N 2.56Å; E327-L329 VanDerWaalsContact C-N 3.33Å; E327-L329 PolarHBondContact O-N 3Å; L329-V332 WeakPolarHBondContact O-CB 3.04Å; L329-V332 PolarHBondContact O-N 3.34Å; L329-E333 PolarHBondContact O-N 3.33Å
330	M	95.6	Very high	93	Very high	96 Å²	96	59.4 Å²	59.4	47%	0.473	28%	0.279	S	S	.	.	H	α-helix	trans	-64.7	-40.7	172.4	-70.5	-173.3	-60.2	0	0	112	K326 E327 Y328 E333 K334	K326-M330 WeakPolarHBondContact O-CG 3.37Å; K326-M330 PolarHBondContact O-N 2.96Å; E327-M330 HydrophobicContact CB-CE 4.36Å; E327-M330 HydrophobicContact CG-CE 4.03Å; E327-M330 PolarHBondContact O-N 2.96Å; Y328-M330 VanDerWaalsContact C-N 3.34Å; Y328-M330 PolarHBondContact O-N 3.19Å; M330-E333 PolarHBondContact O-N 3.39Å; M330-K334 PolarHBondContact O-N 3.45Å
331	L	94.7	Very high	93.1	Very high	10 Å²	10	57.2 Å²	57.2	5%	0.052	27%	0.267	C	S	.	.	H	α-helix	trans	-66.2	-39.5	175.2	-64.9	177.2	0	0	0	112.1	L284 R288 A291 M314 E327 Y328 E333 K334 C335	L284-L331 HydrophobicContact CD1-CD1 4.2Å; R288-L331 HydrophobicContact CB-CD1 4.15Å; R288-L331 HydrophobicContact CB-CD2 4.13Å; R288-L331 HydrophobicContact CG-CD2 4.08Å; A291-L331 HydrophobicContact CB-CB 4.33Å; A291-L331 HydrophobicContact CB-CD2 4.4Å; M314-L331 HydrophobicContact CE-CB 4.22Å; M314-L331 HydrophobicContact SD-CB 3.7Å; M314-L331 HydrophobicContact SD-CD1 4.27Å; E327-L331 WeakPolarHBondContact O-CG 3.1Å; E327-L331 PolarHBondContact O-N 2.74Å; Y328-L331 PolarHBondContact O-N 3.1Å; L331-E333 VanDerWaalsContact C-N 3.32Å; L331-E333 PolarHBondContact O-N 2.99Å; L331-K334 WeakPolarHBondContact O-CB 3.31Å; L331-K334 PolarHBondContact O-N 2.96Å; L331-C335 PolarHBondContact O-N 3.06Å
332	V	94.5	Very high	93.2	Very high	11 Å²	11	56.6 Å²	56.6	7%	0.067	26%	0.264	C	S	.	.	H	α-helix	trans	-58.2	-43.8	173.4	159.1	0	0	0	0	111.1	R311 M314 M315 Y328 L329 C335 M336	R311-V332 HydrophobicContact CG-CB 4.16Å; R311-V332 HydrophobicContact CG-CG1 3.63Å; R311-V332 HydrophobicContact CG-CG2 4.08Å; M314-V332 HydrophobicContact CB-CG2 3.61Å; M314-V332 HydrophobicContact CE-CG2 4.05Å; M315-V332 HydrophobicContact CG-CG1 3.97Å; M315-V332 HydrophobicContact CG-CG2 3.81Å; M315-V332 HydrophobicContact SD-CG1 4.34Å; Y328-V332 WeakPolarHBondContact O-CB 3.29Å; Y328-V332 VanDerWaalsContact O-CG2 3.26Å; Y328-V332 WeakPolarHBondContact O-CG2 3.43Å; Y328-V332 PolarHBondContact O-N 3.35Å; L329-V332 WeakPolarHBondContact O-CB 3.04Å; L329-V332 PolarHBondContact O-N 3.34Å; V332-C335 PolarHBondContact O-N 2.93Å; V332-M336 PolarHBondContact O-N 3.07Å
333	E	93	Very high	93.2	Very high	96 Å²	96	48.8 Å²	48.8	45%	0.449	23%	0.23	S	C	.	.	H	α-helix	trans	-66.3	-41.6	176	-179.7	160.7	-143.9	0	0	112.3	L329 M330 L331 C335 M336 N337 K383	L329-E333 PolarHBondContact O-N 3.33Å; M330-E333 PolarHBondContact O-N 3.39Å; L331-E333 VanDerWaalsContact C-N 3.32Å; L331-E333 PolarHBondContact O-N 2.99Å; E333-C335 VanDerWaalsContact C-N 3.35Å; E333-C335 PolarHBondContact O-N 3.39Å; E333-M336 PolarHBondContact O-N 3.15Å; E333-M336 VanDerWaalsContact O-N 3.14Å; E333-N337 VanDerWaalsContact O-CG 3.29Å; E333-N337 PolarHBondContact O-N 2.87Å; E333-K383 IonicContact OE1-NZ 3.41Å; E333-K383 PolarHBondContact OE1-NZ 3.32Å
334	K	92.9	Very high	93.3	Very high	71 Å²	71	45.9 Å²	45.9	31%	0.309	22%	0.22	S	C	.	.	H	α-helix	trans	-57.6	-46.5	175.3	-166.2	-178.4	-171.6	-173.7	0	111.8	P293 M330 L331 M336 N337 F338	P293-K334 VanDerWaalsContact CD-CE 3.45Å; M330-K334 PolarHBondContact O-N 3.45Å; L331-K334 WeakPolarHBondContact O-CB 3.31Å; L331-K334 PolarHBondContact O-N 2.96Å; K334-M336 PolarHBondContact O-N 3.05Å; K334-N337 PolarHBondContact O-N 2.91Å; K334-F338 PolarHBondContact O-N 3.07Å
335	C	93.6	Very high	93.4	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-59.9	-43.8	174.2	-78.6	0	0	0	0	112.2	A291 T307 M314 L331 V332 E333 N337 F338 A339	A291-C335 VanDerWaalsContact CB-SG 3.55Å; T307-C335 HydrophobicContact CG2-CB 3.85Å; T307-C335 WeakPolarHBondContact CG2-O 3.49Å; M314-C335 HydrophobicContact CE-CB 4.37Å; L331-C335 PolarHBondContact O-N 3.06Å; V332-C335 PolarHBondContact O-N 2.93Å; E333-C335 VanDerWaalsContact C-N 3.35Å; E333-C335 PolarHBondContact O-N 3.39Å; C335-N337 PolarHBondContact O-N 3.21Å; C335-F338 WeakPolarHBondContact O-CB 3.41Å; C335-F338 PolarHBondContact O-N 3.42Å; C335-A339 PolarHBondContact O-N 3.21Å; C335-A339 VanDerWaalsContact O-N 3.1Å
336	M	91.7	Very high	93.3	Very high	3 Å²	3	40.9 Å²	40.9	2%	0.015	20%	0.201	C	C	.	.	H	α-helix	trans	-65.1	-40.1	179.1	-179.4	52.9	125.3	0	0	112.3	V332 E333 K334 F338 A339 C340 E381 K383 F384	V332-M336 PolarHBondContact O-N 3.07Å; E333-M336 PolarHBondContact O-N 3.15Å; E333-M336 VanDerWaalsContact O-N 3.14Å; K334-M336 PolarHBondContact O-N 3.05Å; M336-F338 VanDerWaalsContact C-N 3.34Å; M336-A339 PolarHBondContact O-N 3.04Å; M336-C340 PolarHBondContact O-N 3.22Å; M336-C340 PolarHBondContact O-SG 3.26Å; M336-E381 HydrophobicContact CE-CB 4.15Å; M336-E381 HydrophobicContact CE-CG 3.87Å; M336-E381 WeakPolarHBondContact CE-O 3.31Å; M336-E381 WeakPolarHBondContact CE-OE2 3.33Å; M336-E381 HydrophobicContact SD-CG 4.5Å; M336-K383 HydrophobicContact CE-CB 3.76Å; M336-K383 HydrophobicContact CG-CB 3.96Å; M336-K383 HydrophobicContact CG-CD 4.05Å; M336-K383 HydrophobicContact CG-CG 4.36Å; M336-K383 HydrophobicContact SD-CB 4.11Å; M336-F384 HydrophobicContact CE-CB 3.96Å; M336-F384 HydrophobicContact SD-CB 4.01Å
337	N	92.8	Very high	93	Very high	63 Å²	63	42.8 Å²	42.8	34%	0.337	20%	0.203	S	C	.	.	H	α-helix	trans	-63.3	-42.1	176	-67.7	-15.7	0	0	0	110.8	E333 K334 C335 A339 C340 E341	E333-N337 VanDerWaalsContact O-CG 3.29Å; E333-N337 PolarHBondContact O-N 2.87Å; K334-N337 PolarHBondContact O-N 2.91Å; C335-N337 PolarHBondContact O-N 3.21Å; N337-A339 PolarHBondContact O-N 3.41Å; N337-C340 PolarHBondContact O-N 3.13Å; N337-C340 VanDerWaalsContact O-N 3.15Å; N337-E341 WeakPolarHBondContact O-CB 3.42Å; N337-E341 WeakPolarHBondContact O-CG 3.44Å; N337-E341 PolarHBondContact O-N 2.99Å
338	F	93.6	Very high	92.6	Very high	1 Å²	1	41.6 Å²	41.6	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-56.9	-45.9	173.1	169.5	-103.5	0	0	0	112.8	P293 M296 A297 P303 T307 K334 C335 M336 C340 E341 M342 Y897	P293-F338 HydrophobicContact CB-CD2 3.78Å; P293-F338 HydrophobicContact CB-CE2 4.33Å; P293-F338 HydrophobicContact CB-CG 4.43Å; P293-F338 HydrophobicContact CG-CB 4.48Å; M296-F338 HydrophobicContact CB-CE1 4.09Å; M296-F338 HydrophobicContact CB-CZ 4.21Å; M296-F338 HydrophobicContact CE-CD1 3.44Å; M296-F338 VanDerWaalsContact CE-CD1 3.44Å; M296-F338 HydrophobicContact CE-CE1 3.66Å; M296-F338 HydrophobicContact CE-CG 4.34Å; M296-F338 HydrophobicContact SD-CD1 4.47Å; A297-F338 HydrophobicContact CB-CE2 4.19Å; A297-F338 HydrophobicContact CB-CZ 4.23Å; P303-F338 HydrophobicContact CB-CE1 3.94Å; P303-F338 HydrophobicContact CB-CZ 3.91Å; T307-F338 HydrophobicContact CG2-CD1 4.43Å; T307-F338 WeakPolarHBondContact OG1-CD1 3.37Å; T307-F338 WeakPolarHBondContact OG1-CE1 3.26Å; K334-F338 PolarHBondContact O-N 3.07Å; C335-F338 WeakPolarHBondContact O-CB 3.41Å; C335-F338 PolarHBondContact O-N 3.42Å; M336-F338 VanDerWaalsContact C-N 3.34Å; F338-C340 VanDerWaalsContact C-N 3.32Å; F338-C340 PolarHBondContact O-N 3.33Å; F338-E341 PolarHBondContact O-N 3.43Å; F338-M342 HydrophobicContact CD2-CE 4.03Å; F338-M342 HydrophobicContact CE1-CG 4.22Å; F338-M342 HydrophobicContact CE2-CE 3.61Å; F338-M342 HydrophobicContact CE2-CG 4.27Å; F338-M342 HydrophobicContact CE2-SD 4.15Å; F338-M342 HydrophobicContact CZ-CE 4.18Å; F338-M342 HydrophobicContact CZ-CG 4.04Å; F338-M342 HydrophobicContact CZ-SD 4.12Å; F338-M342 WeakPolarHBondContact O-CG 3.25Å; F338-M342 PolarHBondContact O-N 3.18Å; F338-Y897 HydrophobicContact CD2-CD1 4.45Å; F338-Y897 AromaticContact CD2-CE1 3.69Å; F338-Y897 HydrophobicContact CD2-CE1 3.69Å; F338-Y897 HydrophobicContact CD2-CE2 4.32Å; F338-Y897 AromaticContact CD2-CZ 3.6Å; F338-Y897 AromaticContact CE2-CD1 3.87Å; F338-Y897 HydrophobicContact CE2-CD1 3.87Å; F338-Y897 AromaticContact CE2-CE1 3.49Å; F338-Y897 HydrophobicContact CE2-CE1 3.49Å; F338-Y897 VanDerWaalsContact CE2-CE1 3.49Å; F338-Y897 AromaticContact CE2-CZ 3.88Å
339	A	92.9	Very high	92.1	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-64.3	-35.3	177	0	0	0	0	0	113	T307 F308 C335 M336 N337 M343 F384	T307-A339 HydrophobicContact CG2-CB 4.05Å; F308-A339 HydrophobicContact CE1-CB 4.19Å; C335-A339 PolarHBondContact O-N 3.21Å; C335-A339 VanDerWaalsContact O-N 3.1Å; M336-A339 PolarHBondContact O-N 3.04Å; N337-A339 PolarHBondContact O-N 3.41Å; A339-M343 PolarHBondContact O-N 3.18Å; A339-F384 HydrophobicContact CB-CD2 4.08Å; A339-F384 HydrophobicContact CB-CE2 4.45Å
340	C	92.4	Very high	91.5	Very high	19 Å²	19	45.5 Å²	45.5	13%	0.128	23%	0.228	C	C	.	.	H	α-helix	trans	-69.2	-43.8	174.7	-64	0	0	0	0	111.2	M336 N337 F338 M342 M343 D344 H387	M336-C340 PolarHBondContact O-N 3.22Å; M336-C340 PolarHBondContact O-SG 3.26Å; N337-C340 PolarHBondContact O-N 3.13Å; N337-C340 VanDerWaalsContact O-N 3.15Å; F338-C340 VanDerWaalsContact C-N 3.32Å; F338-C340 PolarHBondContact O-N 3.33Å; C340-M342 VanDerWaalsContact C-N 3.31Å; C340-M342 PolarHBondContact O-N 3.04Å; C340-M343 CarbonylContact O-C 3.56Å; C340-M343 WeakPolarHBondContact O-CA 3.49Å; C340-M343 WeakPolarHBondContact O-CB 3.17Å; C340-M343 PolarHBondContact O-N 3.48Å; C340-D344 PolarHBondContact O-N 3.45Å; C340-H387 PolarHBondContact O-NE2 3.03Å
341	E	92.5	Very high	91.2	Very high	51 Å²	51	42.1 Å²	42.1	24%	0.238	21%	0.211	C	C	.	.	H	α-helix	trans	-61.4	-37.7	176	-72.3	169	-171.4	0	0	112.3	N337 F338 M343 D344 L345 Y897	N337-E341 WeakPolarHBondContact O-CB 3.42Å; N337-E341 WeakPolarHBondContact O-CG 3.44Å; N337-E341 PolarHBondContact O-N 2.99Å; F338-E341 PolarHBondContact O-N 3.43Å; E341-M343 VanDerWaalsContact C-N 3.26Å; E341-M343 PolarHBondContact O-N 3.47Å; E341-D344 PolarHBondContact O-N 2.87Å; E341-L345 WeakPolarHBondContact O-CG 3.31Å; E341-L345 PolarHBondContact O-N 3.19Å; E341-Y897 HydrophobicContact CB-CE2 3.96Å; E341-Y897 WeakPolarHBondContact OE2-CE2 3.18Å; E341-Y897 PolarHBondContact OE2-OH 2.91Å
342	M	91.7	Very high	90.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-58.4	-40.7	170.7	-76	-49	91.2	0	0	111.6	I304 F338 C340 L345 Y897	I304-M342 HydrophobicContact CD1-CB 4.17Å; I304-M342 HydrophobicContact CG1-CB 4.4Å; I304-M342 HydrophobicContact CG1-CG 4.33Å; F338-M342 HydrophobicContact CD2-CE 4.03Å; F338-M342 HydrophobicContact CE1-CG 4.22Å; F338-M342 HydrophobicContact CE2-CE 3.61Å; F338-M342 HydrophobicContact CE2-CG 4.27Å; F338-M342 HydrophobicContact CE2-SD 4.15Å; F338-M342 HydrophobicContact CZ-CE 4.18Å; F338-M342 HydrophobicContact CZ-CG 4.04Å; F338-M342 HydrophobicContact CZ-SD 4.12Å; F338-M342 WeakPolarHBondContact O-CG 3.25Å; F338-M342 PolarHBondContact O-N 3.18Å; C340-M342 VanDerWaalsContact C-N 3.31Å; C340-M342 PolarHBondContact O-N 3.04Å; M342-L345 HydrophobicContact CE-CD1 4.23Å; M342-L345 PolarHBondContact O-N 3.12Å; M342-Y897 HydrophobicContact CE-CD1 3.61Å; M342-Y897 HydrophobicContact CE-CD2 2.97Å; M342-Y897 HydrophobicContact CE-CE1 4.09Å; M342-Y897 HydrophobicContact CE-CE2 3.5Å; M342-Y897 HydrophobicContact CE-CG 3Å; M342-Y897 HydrophobicContact SD-CG 4.29Å
343	M	91.1	Very high	90.3	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-73.6	-33	-179	-168.1	175.5	-73	0	0	112.7	A339 C340 E341 L345 C346 V355 F384 H387 N389 C390	A339-M343 PolarHBondContact O-N 3.18Å; C340-M343 CarbonylContact O-C 3.56Å; C340-M343 WeakPolarHBondContact O-CA 3.49Å; C340-M343 WeakPolarHBondContact O-CB 3.17Å; C340-M343 PolarHBondContact O-N 3.48Å; E341-M343 VanDerWaalsContact C-N 3.26Å; E341-M343 PolarHBondContact O-N 3.47Å; M343-L345 VanDerWaalsContact C-N 3.27Å; M343-L345 PolarHBondContact O-N 2.87Å; M343-C346 WeakPolarHBondContact O-CB 3.34Å; M343-C346 PolarHBondContact O-N 2.76Å; M343-V355 HydrophobicContact CE-CG1 3.97Å; M343-F384 HydrophobicContact CE-CD1 4.08Å; M343-F384 HydrophobicContact CE-CD2 3.72Å; M343-F384 HydrophobicContact CE-CE1 3.59Å; M343-F384 HydrophobicContact CE-CE2 3.2Å; M343-F384 HydrophobicContact CE-CG 4.15Å; M343-F384 HydrophobicContact CE-CZ 3.13Å; M343-H387 HydrophobicContact SD-CB 3.51Å; M343-H387 VanDerWaalsContact SD-CB 3.51Å; M343-H387 PolarHBondContact SD-ND1 3.13Å; M343-N389 HydrophobicContact CG-CB 4.16Å; M343-N389 PolarHBondContact O-ND2 3.11Å; M343-N389 HydrophobicContact SD-CB 4.44Å; M343-C390 HydrophobicContact CE-CB 4.11Å; M343-C390 HydrophobicContact SD-CB 3.62Å
344	D	92.6	Very high	89.8	Confident	96 Å²	96	37.4 Å²	37.4	51%	0.513	19%	0.189	S	C	.	.	H	α-helix	trans	-62.5	-33.3	173.3	-82.5	-37.8	0	0	0	112.5	C340 E341 C346 H387	C340-D344 PolarHBondContact O-N 3.45Å; E341-D344 PolarHBondContact O-N 2.87Å; D344-C346 PolarHBondContact O-N 2.88Å; D344-H387 VanDerWaalsContact CG-NE2 3.31Å; D344-H387 IonicContact OD1-CE1 2.85Å; D344-H387 PolarHBondContact OD1-CE1 2.93Å; D344-H387 IonicContact OD1-NE2 3.71Å; D344-H387 PolarHBondContact OD1-NE2 3.36Å; D344-H387 IonicContact OD2-NE2 2.72Å
345	L	92.5	Very high	89.4	Confident	30 Å²	30	34 Å²	34	16%	0.157	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-7.7	-179.9	-68.2	171.1	0	0	0	114.5	E341 M342 M343 R347 L893 R896 Y897 K900	E341-L345 WeakPolarHBondContact O-CG 3.31Å; E341-L345 PolarHBondContact O-N 3.19Å; M342-L345 HydrophobicContact CE-CD1 4.23Å; M342-L345 PolarHBondContact O-N 3.12Å; M343-L345 VanDerWaalsContact C-N 3.27Å; M343-L345 PolarHBondContact O-N 2.87Å; L345-R347 PolarHBondContact O-N 2.89Å; L345-L893 HydrophobicContact CB-CD2 4.37Å; L345-R896 HydrophobicContact CD1-CB 4.35Å; L345-R896 HydrophobicContact CD2-CB 4.37Å; L345-R896 PolarHBondContact O-NH1 3.48Å; L345-Y897 VanDerWaalsContact CD1-CA 3.47Å; L345-Y897 HydrophobicContact CD1-CD2 3.8Å; L345-Y897 HydrophobicContact CD1-CG 4.24Å; L345-K900 HydrophobicContact CD2-CD 4.16Å
346	C	91.5	Very high	89	Confident	11 Å²	11	34 Å²	34	7%	0.074	17%	0.174	C	C	.	.			trans	-71.9	118.8	175.2	-65.1	0	0	0	0	110.3	M343 D344 E351 V352	M343-C346 WeakPolarHBondContact O-CB 3.34Å; M343-C346 PolarHBondContact O-N 2.76Å; D344-C346 PolarHBondContact O-N 2.88Å; C346-E351 WeakPolarHBondContact CA-OE2 3.35Å; C346-E351 HydrophobicContact CB-CB 4.15Å; C346-V352 HydrophobicContact CB-CG2 3.65Å
347	R	88.8	Confident	88.3	Confident	203 Å²	203	33.9 Å²	33.9	77%	0.766	17%	0.174	S	C	*	.			trans	-96.5	-15.6	-176.9	-65.5	178	-176	177.2	-0.2	113.6	L345 E351	L345-R347 PolarHBondContact O-N 2.89Å; R347-E351 PolarHBondContact N-OE2 3.28Å
348	G	86.5	Confident	87.2	Confident	32 Å²	32	33 Å²	33	33%	0.33	17%	0.169	S	C	.	.	S	Bend	trans	-141.5	159.7	-174.1	0	0	0	0	0	113.4	Q350 E351 V352	G348-Q350 PolarHBondContact O-N 3.2Å; G348-E351 PolarHBondContact O-N 3.43Å; G348-E351 VanDerWaalsContact O-N 3.11Å; G348-V352 PolarHBondContact O-N 3.04Å; G348-V352 VanDerWaalsContact O-N 3.12Å
349	T	84.7	Confident	85.5	Confident	84 Å²	84	38.7 Å²	38.7	52%	0.515	19%	0.194	S	C	.	.	H	α-helix	trans	-62.4	-28.9	179.2	53.7	0	0	0	0	113.1	E353 R870	T349-E353 WeakPolarHBondContact O-CB 3.48Å; T349-E353 PolarHBondContact O-N 2.9Å; T349-R870 PolarHBondContact OG1-NH2 3.15Å
350	Q	82	Confident	83.7	Confident	78 Å²	78	42.4 Å²	42.4	36%	0.364	21%	0.213	S	C	.	.	H	α-helix	trans	-66.8	-39.9	174.5	-73.3	178.4	-23	0	0	112.2	G348 E353 A354	G348-Q350 PolarHBondContact O-N 3.2Å; Q350-E353 PolarHBondContact O-N 2.79Å; Q350-A354 WeakPolarHBondContact O-CB 3.16Å; Q350-A354 PolarHBondContact O-N 2.75Å
351	E	88.2	Confident	81.6	Confident	25 Å²	25	50.5 Å²	50.5	12%	0.117	25%	0.25	C	C	.	.	H	α-helix	trans	-68.8	-43.4	177.8	-60	-177.4	165.2	0	0	110.3	C346 R347 G348 E353 A354 V355 I889 R896	C346-E351 WeakPolarHBondContact CA-OE2 3.35Å; C346-E351 HydrophobicContact CB-CB 4.15Å; R347-E351 PolarHBondContact N-OE2 3.28Å; G348-E351 PolarHBondContact O-N 3.43Å; G348-E351 VanDerWaalsContact O-N 3.11Å; E351-E353 PolarHBondContact O-N 2.63Å; E351-A354 WeakPolarHBondContact O-CB 3.31Å; E351-A354 PolarHBondContact O-N 2.9Å; E351-V355 WeakPolarHBondContact O-CG2 3.4Å; E351-V355 PolarHBondContact O-N 3.19Å; E351-I889 HydrophobicContact CB-CG2 4.2Å; E351-I889 HydrophobicContact CG-CG2 4.1Å; E351-R896 VanDerWaalsContact CD-NH1 3.34Å; E351-R896 IonicContact OE1-CZ 3.52Å; E351-R896 IonicContact OE1-NH1 3.69Å; E351-R896 PolarHBondContact OE1-NH1 2.92Å; E351-R896 VanDerWaalsContact OE1-NH1 3.13Å; E351-R896 IonicContact OE1-NH2 2.76Å; E351-R896 PolarHBondContact OE1-NH2 2.73Å; E351-R896 IonicContact OE2-CZ 3.19Å; E351-R896 IonicContact OE2-NH1 3.91Å; E351-R896 PolarHBondContact OE2-NH1 2.77Å; E351-R896 IonicContact OE2-NH2 3.53Å
352	V	87.9	Confident	79.2	Confident	10 Å²	10	54.2 Å²	54.2	6%	0.061	27%	0.271	C	S	.	.	H	α-helix	trans	-62.3	-43.2	174.4	177.5	0	0	0	0	111.6	C346 G348 A354 V355 I356 N389 Y393	C346-V352 HydrophobicContact CB-CG2 3.65Å; G348-V352 PolarHBondContact O-N 3.04Å; G348-V352 VanDerWaalsContact O-N 3.12Å; V352-A354 VanDerWaalsContact C-N 3.31Å; V352-A354 PolarHBondContact O-N 3.25Å; V352-V355 PolarHBondContact O-N 3.32Å; V352-I356 HydrophobicContact CG1-CD1 3.59Å; V352-I356 HydrophobicContact CG1-CG1 4.41Å; V352-I356 WeakPolarHBondContact O-CB 3.44Å; V352-I356 WeakPolarHBondContact O-CG1 3.24Å; V352-I356 PolarHBondContact O-N 3.49Å; V352-N389 HydrophobicContact CG2-CB 4.3Å; V352-Y393 HydrophobicContact CG1-CG 4.19Å
353	E	82.9	Confident	76.8	Confident	7 Å²	7	58.3 Å²	58.3	3%	0.033	31%	0.313	C	S	.	.	H	α-helix	trans	-62.8	-37.1	176	-175	-178.5	174.4	0	0	111.3	T349 Q350 E351 I356 S357 R367 Y393 K867 R870	T349-E353 WeakPolarHBondContact O-CB 3.48Å; T349-E353 PolarHBondContact O-N 2.9Å; Q350-E353 PolarHBondContact O-N 2.79Å; E351-E353 PolarHBondContact O-N 2.63Å; E353-I356 PolarHBondContact O-N 3.28Å; E353-S357 WeakPolarHBondContact O-CB 3.49Å; E353-S357 PolarHBondContact O-N 3.24Å; E353-S357 PolarHBondContact O-OG 3.08Å; E353-R367 PolarHBondContact O-NH2 3.22Å; E353-Y393 HydrophobicContact CB-CE2 4.42Å; E353-K867 WeakPolarHBondContact OE1-CE 3.37Å; E353-R870 IonicContact OE2-CZ 3.04Å; E353-R870 IonicContact OE2-NH1 3.55Å; E353-R870 PolarHBondContact OE2-NH1 3.2Å; E353-R870 IonicContact OE2-NH2 2.78Å
354	A	81.9	Confident	74.5	Confident	1 Å²	1	62 Å²	62	1%	0.008	34%	0.336	C	S	.	.	H	α-helix	trans	-64	-42	172.8	0	0	0	0	0	112.8	Q350 E351 V352 I356 S357 R372 H886 I889	Q350-A354 WeakPolarHBondContact O-CB 3.16Å; Q350-A354 PolarHBondContact O-N 2.75Å; E351-A354 WeakPolarHBondContact O-CB 3.31Å; E351-A354 PolarHBondContact O-N 2.9Å; V352-A354 VanDerWaalsContact C-N 3.31Å; V352-A354 PolarHBondContact O-N 3.25Å; A354-I356 VanDerWaalsContact C-N 3.32Å; A354-I356 PolarHBondContact O-N 2.86Å; A354-S357 PolarHBondContact O-OG 3.25Å; A354-R372 PolarHBondContact O-NH1 3.1Å; A354-H886 PolarHBondContact O-CD2 3.12Å; A354-H886 PolarHBondContact O-NE2 3.25Å; A354-I889 HydrophobicContact CB-CB 4.23Å; A354-I889 HydrophobicContact CB-CD1 3.63Å; A354-I889 HydrophobicContact CB-CG2 3.78Å
355	V	85.8	Confident	72.2	Confident	0 Å²	0	66 Å²	66	0%	0	36%	0.357	C	S	.	.	H	α-helix	trans	-68.1	-28.5	176.1	167	0	0	0	0	112.7	I304 M343 E351 V352 R372 F384 L893	I304-V355 HydrophobicContact CD1-CB 4.08Å; I304-V355 HydrophobicContact CD1-CG1 3.41Å; I304-V355 VanDerWaalsContact CD1-CG1 3.41Å; I304-V355 HydrophobicContact CD1-CG2 3.75Å; M343-V355 HydrophobicContact CE-CG1 3.97Å; E351-V355 WeakPolarHBondContact O-CG2 3.4Å; E351-V355 PolarHBondContact O-N 3.19Å; V352-V355 PolarHBondContact O-N 3.32Å; V355-R372 WeakPolarHBondContact O-CD 3.41Å; V355-R372 PolarHBondContact O-NH1 3.1Å; V355-F384 HydrophobicContact CG1-CE2 4.28Å; V355-F384 HydrophobicContact CG1-CZ 3.92Å; V355-L893 HydrophobicContact CG2-CD1 3.56Å
356	I	84.9	Confident	70.2	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-96.9	-25.2	-175.7	-70.9	174.5	0	0	0	113.3	V352 E353 A354 L370 R372 L373 C390 Y393	V352-I356 HydrophobicContact CG1-CD1 3.59Å; V352-I356 HydrophobicContact CG1-CG1 4.41Å; V352-I356 WeakPolarHBondContact O-CB 3.44Å; V352-I356 WeakPolarHBondContact O-CG1 3.24Å; V352-I356 PolarHBondContact O-N 3.49Å; E353-I356 PolarHBondContact O-N 3.28Å; A354-I356 VanDerWaalsContact C-N 3.32Å; A354-I356 PolarHBondContact O-N 2.86Å; I356-L370 HydrophobicContact CG2-CG 4.43Å; I356-R372 WeakPolarHBondContact O-CA 3.46Å; I356-R372 WeakPolarHBondContact O-CB 3.47Å; I356-R372 PolarHBondContact O-N 2.89Å; I356-L373 HydrophobicContact CG2-CB 3.71Å; I356-L373 HydrophobicContact CG2-CD2 4.47Å; I356-L373 PolarHBondContact O-N 3.16Å; I356-C390 HydrophobicContact CD1-CB 4.23Å; I356-Y393 HydrophobicContact CD1-CD1 3.86Å; I356-Y393 HydrophobicContact CD1-CE1 4.48Å; I356-Y393 HydrophobicContact CG2-CE1 4.46Å
357	S	77	Confident	68.4	Low	1 Å²	1	71.3 Å²	71.3	1%	0.007	38%	0.379	C	S	.	.			trans	-81	154	178.2	66.1	0	0	0	0	112.4	E353 A354 R367 R372	E353-S357 WeakPolarHBondContact O-CB 3.49Å; E353-S357 PolarHBondContact O-N 3.24Å; E353-S357 PolarHBondContact O-OG 3.08Å; A354-S357 PolarHBondContact O-OG 3.25Å; S357-R367 PolarHBondContact OG-NE 3.12Å; S357-R367 PolarHBondContact OG-NH2 3.17Å; S357-R372 PolarHBondContact O-NH1 3.14Å
358	D	68.7	Low	67.2	Low	43 Å²	43	62.7 Å²	62.7	23%	0.23	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	158	170.8	-154.4	-4.2	0	0	0	110.7	M305 D368 R372	M305-D358 VanDerWaalsContact CE-OD2 3.26Å; M305-D358 WeakPolarHBondContact CE-OD2 3.36Å; D358-D368 PolarHBondContact N-O 3.16Å; D358-R372 HydrophobicContact CB-CB 4.33Å
359	F	59.2	Low	66.2	Low	121 Å²	121	61.5 Å²	61.5	53%	0.531	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	121.3	167.2	-69.6	-85.5	0	0	0	108.1	E361 H886	F359-E361 PolarHBondContact O-N 3.39Å; F359-H886 HydrophobicContact CE2-CB 3.61Å; F359-H886 AromaticContact CE2-CG 3.72Å; F359-H886 HydrophobicContact CZ-CB 3.77Å
360	L	53.9	Low	65.8	Low	78 Å²	78	57.8 Å²	57.8	41%	0.408	31%	0.312	S	S	.	.			trans	-69.9	127.5	164.6	-70.5	167.5	0	0	0	107.3	D362 D368	L360-D362 PolarHBondContact O-N 2.56Å; L360-D368 HydrophobicContact CD1-CB 4.28Å
361	E	49.7	Very low	65.6	Low	190 Å²	190	54.8 Å²	54.8	89%	0.888	30%	0.302	S	S	*	.	S	Bend	trans	-58.9	-12.4	-179.7	-68	-180	155.4	0	0	113.4	F359 G363	F359-E361 PolarHBondContact O-N 3.39Å; E361-G363 VanDerWaalsContact C-N 3.27Å; E361-G363 PolarHBondContact O-N 3.2Å
362	D	42.7	Very low	65.5	Low	128 Å²	128	53.6 Å²	53.6	68%	0.684	30%	0.296	S	S	*	.	S	Bend	trans	-79.6	58.8	-176.1	-70.6	-23.2	0	0	0	113.3	L360 T364	L360-D362 PolarHBondContact O-N 2.56Å; D362-T364 WeakPolarHBondContact O-CA 3.36Å; D362-T364 VanDerWaalsContact O-CB 3.29Å; D362-T364 WeakPolarHBondContact O-CB 3.38Å; D362-T364 WeakPolarHBondContact O-CG2 3.44Å; D362-T364 PolarHBondContact O-N 3.05Å; D362-T364 PolarHBondContact O-OG1 3.27Å
363	G	39.6	Very low	65.5	Low	86 Å²	86	53.1 Å²	53.1	89%	0.887	29%	0.293	S	S	*	.	S	Bend	trans	44.9	8.6	155.6	0	0	0	0	0	119.7	E361	E361-G363 VanDerWaalsContact C-N 3.27Å; E361-G363 PolarHBondContact O-N 3.2Å
364	T	43.9	Very low	65.6	Low	78 Å²	78	56.3 Å²	56.3	48%	0.479	31%	0.305	S	S	.	.	S	Bend	trans	-120.2	130	-172	54.8	0	0	0	0	104.3	D362 I366	D362-T364 WeakPolarHBondContact O-CA 3.36Å; D362-T364 VanDerWaalsContact O-CB 3.29Å; D362-T364 WeakPolarHBondContact O-CB 3.38Å; D362-T364 WeakPolarHBondContact O-CG2 3.44Å; D362-T364 PolarHBondContact O-N 3.05Å; D362-T364 PolarHBondContact O-OG1 3.27Å; T364-I366 PolarHBondContact O-N 3.43Å
365	N	44.3	Very low	65.8	Low	179 Å²	179	57.9 Å²	57.9	96%	0.957	31%	0.313	S	S	*	.			trans	-67.3	30.3	-178.5	-71.9	-45.2	0	0	0	113.2	R367	N365-R367 PolarHBondContact O-N 2.84Å
366	I	50.6	Low	66	Low	87 Å²	87	57.9 Å²	57.9	45%	0.446	31%	0.313	S	S	.	.			trans	-95.5	93.5	-177.2	-53.3	174.2	0	0	0	107.3	T364 D368	T364-I366 PolarHBondContact O-N 3.43Å; I366-D368 PolarHBondContact O-N 3.41Å
367	R	54	Low	66.2	Low	67 Å²	67	59 Å²	59	25%	0.253	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	115.1	174.6	-177.9	171.1	172.8	-160.7	-7.4	109.3	E353 S357 N365 P369	E353-R367 PolarHBondContact O-NH2 3.22Å; S357-R367 PolarHBondContact OG-NE 3.12Å; S357-R367 PolarHBondContact OG-NH2 3.17Å; N365-R367 PolarHBondContact O-N 2.84Å; R367-P369 WeakPolarHBondContact O-CD 3.26Å
368	D	62.2	Low	66.6	Low	21 Å²	21	68.5 Å²	68.5	11%	0.112	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	107.6	166.5	-97.6	4.3	0	0	0	108	D358 L360 I366 L370 G371 R374	D358-D368 PolarHBondContact N-O 3.16Å; L360-D368 HydrophobicContact CD1-CB 4.28Å; I366-D368 PolarHBondContact O-N 3.41Å; D368-L370 PolarHBondContact O-N 3.04Å; D368-G371 PolarHBondContact O-N 3.46Å; D368-G371 VanDerWaalsContact O-N 3.07Å; D368-R374 IonicContact OD2-NH1 3.74Å
369	P	65.2	Low	67.5	Low	7 Å²	7	68.9 Å²	68.9	5%	0.045	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-12.6	-168.6	26.1	-31	0	0	0	113.3	R367 T863	R367-P369 WeakPolarHBondContact O-CD 3.26Å; P369-T863 WeakPolarHBondContact CD-OG1 3.29Å; P369-T863 HydrophobicContact CG-CG2 3.86Å; P369-T863 WeakPolarHBondContact CG-OG1 3.16Å
370	L	76.8	Confident	68.8	Low	6 Å²	6	68.9 Å²	68.9	3%	0.031	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	14.9	176.8	-83	74.8	0	0	0	112.4	I356 D368 R372 L373 R374 L394 I397 L816 I819	I356-L370 HydrophobicContact CG2-CG 4.43Å; D368-L370 PolarHBondContact O-N 3.04Å; L370-R372 PolarHBondContact O-N 3.43Å; L370-L373 HydrophobicContact CD2-CD2 4.01Å; L370-L373 HydrophobicContact CG-CD2 4.23Å; L370-L373 PolarHBondContact O-N 3.35Å; L370-R374 WeakPolarHBondContact O-CG 3.32Å; L370-R374 PolarHBondContact O-N 2.85Å; L370-L394 HydrophobicContact CD2-CD2 4.19Å; L370-I397 HydrophobicContact CD1-CD1 3.92Å; L370-L816 HydrophobicContact CD2-CD1 3.9Å; L370-I819 HydrophobicContact CD2-CG2 4.46Å
371	G	78.8	Confident	70.5	Confident	15 Å²	15	65.1 Å²	65.1	16%	0.155	34%	0.336	C	S	.	.	H	α-helix	trans	-53.4	-51.6	-176.9	0	0	0	0	0	113.1	D368 L373 R374 L375	D368-G371 PolarHBondContact O-N 3.46Å; D368-G371 VanDerWaalsContact O-N 3.07Å; G371-L373 PolarHBondContact O-N 2.73Å; G371-R374 PolarHBondContact O-N 3.34Å; G371-L375 PolarHBondContact O-N 3.15Å; G371-L375 VanDerWaalsContact O-N 3.1Å
372	R	84.8	Confident	72.5	Confident	1 Å²	1	58.9 Å²	58.9	0%	0.004	31%	0.306	C	S	.	.	H	α-helix	trans	-69.9	-33.8	-178.7	-158.4	179.9	-68.4	126.6	-3.8	111.9	D302 M305 F308 A354 V355 I356 S357 D358 L370 L375 A376 H886	D302-R372 IonicContact OD1-CZ 3.26Å; D302-R372 IonicContact OD1-NH2 3.98Å; D302-R372 IonicContact OD2-CZ 3.26Å; D302-R372 IonicContact OD2-NE 3.56Å; D302-R372 IonicContact OD2-NH2 3.49Å; D302-R372 PolarHBondContact OD2-NH2 3.43Å; M305-R372 HydrophobicContact CE-CG 4.24Å; F308-R372 HydrophobicContact CD2-CG 4.41Å; F308-R372 HydrophobicContact CE2-CG 4.05Å; A354-R372 PolarHBondContact O-NH1 3.1Å; V355-R372 WeakPolarHBondContact O-CD 3.41Å; V355-R372 PolarHBondContact O-NH1 3.1Å; I356-R372 WeakPolarHBondContact O-CA 3.46Å; I356-R372 WeakPolarHBondContact O-CB 3.47Å; I356-R372 PolarHBondContact O-N 2.89Å; S357-R372 PolarHBondContact O-NH1 3.14Å; D358-R372 HydrophobicContact CB-CB 4.33Å; L370-R372 PolarHBondContact O-N 3.43Å; R372-L375 WeakPolarHBondContact O-CB 3.41Å; R372-L375 PolarHBondContact O-N 2.88Å; R372-A376 WeakPolarHBondContact O-CB 3.49Å; R372-A376 PolarHBondContact O-N 3.23Å; R372-H886 PolarHBondContact NH2-CE1 2.87Å; R372-H886 PolarHBondContact NH2-NE2 3.01Å; R372-H886 VanDerWaalsContact NH2-NE2 3.14Å
373	L	87.7	Confident	74.9	Confident	0 Å²	0	56.3 Å²	56.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-66	-38.8	173	176.5	68.6	0	0	0	112.6	I356 L370 G371 L375 A376 I377 V385 L394	I356-L373 HydrophobicContact CG2-CB 3.71Å; I356-L373 HydrophobicContact CG2-CD2 4.47Å; I356-L373 PolarHBondContact O-N 3.16Å; L370-L373 HydrophobicContact CD2-CD2 4.01Å; L370-L373 HydrophobicContact CG-CD2 4.23Å; L370-L373 PolarHBondContact O-N 3.35Å; G371-L373 PolarHBondContact O-N 2.73Å; L373-L375 VanDerWaalsContact C-N 3.28Å; L373-L375 PolarHBondContact O-N 2.92Å; L373-A376 WeakPolarHBondContact O-CB 3.18Å; L373-A376 PolarHBondContact O-N 3.12Å; L373-I377 HydrophobicContact CG-CD1 4.28Å; L373-I377 WeakPolarHBondContact O-CG1 3.39Å; L373-I377 PolarHBondContact O-N 3.48Å; L373-V385 HydrophobicContact CD1-CB 4.44Å; L373-V385 HydrophobicContact CD1-CG1 4.19Å; L373-V385 HydrophobicContact CD1-CG2 3.83Å; L373-L394 HydrophobicContact CD2-CD1 4.06Å; L373-L394 HydrophobicContact CD2-CD2 3.67Å; L373-L394 HydrophobicContact CD2-CG 4.2Å
374	R	86.6	Confident	77.4	Confident	73 Å²	73	52.2 Å²	52.2	28%	0.275	25%	0.247	S	C	.	.	H	α-helix	trans	-63	-39.3	173.4	-70.3	-171.6	-178.1	152.4	4.3	111.1	D368 L370 G371 I377 R378 L816 D820	D368-R374 IonicContact OD2-NH1 3.74Å; L370-R374 WeakPolarHBondContact O-CG 3.32Å; L370-R374 PolarHBondContact O-N 2.85Å; G371-R374 PolarHBondContact O-N 3.34Å; R374-I377 PolarHBondContact O-N 2.74Å; R374-R378 WeakPolarHBondContact O-CG 3.5Å; R374-R378 PolarHBondContact O-N 3.25Å; R374-L816 HydrophobicContact CG-CD1 4.33Å; R374-L816 HydrophobicContact CG-CD2 3.89Å; R374-D820 IonicContact CZ-OD1 3.09Å; R374-D820 IonicContact CZ-OD2 3.77Å; R374-D820 IonicContact NE-OD1 2.6Å; R374-D820 IonicContact NE-OD2 3.01Å; R374-D820 PolarHBondContact NE-OD2 3.32Å; R374-D820 IonicContact NH2-OD1 2.98Å; R374-D820 PolarHBondContact NH2-OD1 2.85Å; R374-D820 IonicContact NH2-OD2 2.83Å; R374-D820 PolarHBondContact NH2-OD2 2.84Å
375	L	85.8	Confident	79.7	Confident	35 Å²	35	48.5 Å²	48.5	18%	0.183	22%	0.224	C	C	.	.	H	α-helix	trans	-64.9	-42.6	174	176.7	135.9	0	0	0	111.7	M305 F308 G371 R372 L373 I377 R378 F379	M305-L375 HydrophobicContact CE-CD1 4.01Å; M305-L375 HydrophobicContact CE-CD2 4.06Å; M305-L375 HydrophobicContact SD-CD1 4.08Å; M305-L375 HydrophobicContact SD-CD2 3.84Å; F308-L375 HydrophobicContact CB-CD2 4.29Å; F308-L375 HydrophobicContact CD2-CD2 3.64Å; F308-L375 HydrophobicContact CE2-CD2 4.46Å; F308-L375 HydrophobicContact CG-CD2 4.41Å; G371-L375 PolarHBondContact O-N 3.15Å; G371-L375 VanDerWaalsContact O-N 3.1Å; R372-L375 WeakPolarHBondContact O-CB 3.41Å; R372-L375 PolarHBondContact O-N 2.88Å; L373-L375 VanDerWaalsContact C-N 3.28Å; L373-L375 PolarHBondContact O-N 2.92Å; L375-I377 VanDerWaalsContact C-N 3.31Å; L375-I377 PolarHBondContact O-N 2.83Å; L375-R378 WeakPolarHBondContact O-CB 3.32Å; L375-R378 PolarHBondContact O-N 3.24Å; L375-R378 VanDerWaalsContact O-N 3.1Å; L375-F379 HydrophobicContact CD1-CE2 3.82Å; L375-F379 HydrophobicContact CD1-CZ 4.25Å; L375-F379 HydrophobicContact CD2-CD2 3.56Å; L375-F379 HydrophobicContact CD2-CE2 3.42Å; L375-F379 VanDerWaalsContact CD2-CE2 3.42Å; L375-F379 HydrophobicContact CG-CD2 3.75Å; L375-F379 HydrophobicContact CG-CE2 3.43Å; L375-F379 VanDerWaalsContact CG-CE2 3.43Å; L375-F379 HydrophobicContact CG-CZ 4.19Å; L375-F379 PolarHBondContact O-N 3.46Å
376	A	89.8	Confident	82	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-59.6	-38.4	172.3	0	0	0	0	0	112.3	F308 R372 L373 F379 E380 E381 F384 V385	F308-A376 HydrophobicContact CE2-CB 4.14Å; F308-A376 HydrophobicContact CZ-CB 4.3Å; R372-A376 WeakPolarHBondContact O-CB 3.49Å; R372-A376 PolarHBondContact O-N 3.23Å; L373-A376 WeakPolarHBondContact O-CB 3.18Å; L373-A376 PolarHBondContact O-N 3.12Å; A376-F379 PolarHBondContact O-N 3.42Å; A376-E380 PolarHBondContact O-N 2.72Å; A376-E381 HydrophobicContact CB-CB 3.92Å; A376-E381 HydrophobicContact CB-CG 4.44Å; A376-E381 WeakPolarHBondContact O-CB 3.28Å; A376-E381 PolarHBondContact O-N 3.47Å; A376-F384 HydrophobicContact CB-CD1 4.04Å; A376-F384 HydrophobicContact CB-CE1 4.35Å; A376-V385 HydrophobicContact CB-CG2 4.24Å
377	I	88.3	Confident	84.1	Confident	22 Å²	22	36.8 Å²	36.8	11%	0.113	16%	0.162	C	C	.	.	H	α-helix	trans	-67.8	-38.5	174.4	-68.8	166	0	0	0	111.4	L373 R374 L375 E380 V385 F809 T812 Q813 L816	L373-I377 HydrophobicContact CG-CD1 4.28Å; L373-I377 WeakPolarHBondContact O-CG1 3.39Å; L373-I377 PolarHBondContact O-N 3.48Å; R374-I377 PolarHBondContact O-N 2.74Å; L375-I377 VanDerWaalsContact C-N 3.31Å; L375-I377 PolarHBondContact O-N 2.83Å; I377-E380 PolarHBondContact O-N 3.36Å; I377-V385 HydrophobicContact CG1-CG2 4.2Å; I377-F809 HydrophobicContact CG1-CE2 4.27Å; I377-F809 HydrophobicContact CG2-CZ 4.25Å; I377-T812 HydrophobicContact CD1-CG2 4.2Å; I377-Q813 HydrophobicContact CG2-CG 3.82Å; I377-L816 HydrophobicContact CD1-CD2 3.73Å
378	R	86.3	Confident	86	Confident	201 Å²	201	37.8 Å²	37.8	76%	0.758	18%	0.178	S	C	*	.	H	α-helix	trans	-67.4	-33.2	176.2	-71.6	176.1	-170.3	173.1	3	113	R374 L375 E380	R374-R378 WeakPolarHBondContact O-CG 3.5Å; R374-R378 PolarHBondContact O-N 3.25Å; L375-R378 WeakPolarHBondContact O-CB 3.32Å; L375-R378 PolarHBondContact O-N 3.24Å; L375-R378 VanDerWaalsContact O-N 3.1Å; R378-E380 VanDerWaalsContact C-N 3.28Å
379	F	86.5	Confident	87.4	Confident	52 Å²	52	39.3 Å²	39.3	23%	0.228	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	5.7	174.5	-64.7	-35.6	0	0	0	113.7	F308 Q312 L375 A376 E381	F308-F379 HydrophobicContact CB-CD2 3.98Å; F308-F379 HydrophobicContact CB-CE2 4.25Å; Q312-F379 HydrophobicContact CB-CD1 4.37Å; Q312-F379 HydrophobicContact CB-CE1 4.47Å; Q312-F379 HydrophobicContact CG-CD1 4.08Å; Q312-F379 HydrophobicContact CG-CE1 4.13Å; L375-F379 HydrophobicContact CD1-CE2 3.82Å; L375-F379 HydrophobicContact CD1-CZ 4.25Å; L375-F379 HydrophobicContact CD2-CD2 3.56Å; L375-F379 HydrophobicContact CD2-CE2 3.42Å; L375-F379 VanDerWaalsContact CD2-CE2 3.42Å; L375-F379 HydrophobicContact CG-CD2 3.75Å; L375-F379 HydrophobicContact CG-CE2 3.43Å; L375-F379 VanDerWaalsContact CG-CE2 3.43Å; L375-F379 HydrophobicContact CG-CZ 4.19Å; L375-F379 PolarHBondContact O-N 3.46Å; A376-F379 PolarHBondContact O-N 3.42Å; F379-E381 VanDerWaalsContact C-N 3.25Å; F379-E381 PolarHBondContact O-N 2.89Å
380	E	87.6	Confident	88.7	Confident	120 Å²	120	39 Å²	39	56%	0.561	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.5	42.9	-179.1	-58.3	-167.6	167.5	0	0	113.3	A376 I377 R378 K382	A376-E380 PolarHBondContact O-N 2.72Å; I377-E380 PolarHBondContact O-N 3.36Å; R378-E380 VanDerWaalsContact C-N 3.28Å; E380-K382 PolarHBondContact O-N 3.04Å
381	E	89.5	Confident	89.4	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.185	C	C	.	.			trans	-84.2	62.1	-171.4	-138.8	41.1	62.9	0	0	109.3	F308 R311 M336 A376 F379 K383 F384 V385	F308-E381 HydrophobicContact CD1-CG 3.5Å; F308-E381 HydrophobicContact CE1-CG 3.37Å; F308-E381 HydrophobicContact CG-CG 4.29Å; F308-E381 HydrophobicContact CZ-CG 4.03Å; R311-E381 WeakPolarHBondContact CD-OE1 3.4Å; R311-E381 WeakPolarHBondContact CD-OE2 3.34Å; R311-E381 IonicContact CZ-OE1 3.8Å; R311-E381 IonicContact CZ-OE2 2.82Å; R311-E381 IonicContact NE-OE1 3.22Å; R311-E381 PolarHBondContact NE-OE1 3.13Å; R311-E381 IonicContact NE-OE2 3.86Å; R311-E381 PolarHBondContact NE-OE2 3.4Å; R311-E381 IonicContact NH1-OE1 3.64Å; R311-E381 IonicContact NH1-OE2 2.59Å; R311-E381 PolarHBondContact NH1-OE2 3.42Å; R311-E381 IonicContact NH2-OE1 2.85Å; R311-E381 IonicContact NH2-OE2 2.81Å; M336-E381 HydrophobicContact CE-CB 4.15Å; M336-E381 HydrophobicContact CE-CG 3.87Å; M336-E381 WeakPolarHBondContact CE-O 3.31Å; M336-E381 WeakPolarHBondContact CE-OE2 3.33Å; M336-E381 HydrophobicContact SD-CG 4.5Å; A376-E381 HydrophobicContact CB-CB 3.92Å; A376-E381 HydrophobicContact CB-CG 4.44Å; A376-E381 WeakPolarHBondContact O-CB 3.28Å; A376-E381 PolarHBondContact O-N 3.47Å; F379-E381 VanDerWaalsContact C-N 3.25Å; F379-E381 PolarHBondContact O-N 2.89Å; E381-K383 PolarHBondContact O-N 3.12Å; E381-F384 PolarHBondContact O-N 3.06Å; E381-V385 WeakPolarHBondContact O-CG2 3.22Å; E381-V385 PolarHBondContact O-N 3.38Å
382	K	91.5	Very high	90	Very high	58 Å²	58	44.2 Å²	44.2	25%	0.252	20%	0.204	S	C	.	.	H	α-helix	trans	-58.2	-50	-163.5	-62.7	168.6	-172.2	170	0	115.2	E380 F384 V385 A386 R662 V805 E806 F809	E380-K382 PolarHBondContact O-N 3.04Å; K382-F384 PolarHBondContact O-N 3.5Å; K382-V385 PolarHBondContact O-N 3.5Å; K382-A386 WeakPolarHBondContact O-CB 3.12Å; K382-A386 PolarHBondContact O-N 3.11Å; K382-R662 VanDerWaalsContact NZ-NH2 3.15Å; K382-V805 HydrophobicContact CB-CG1 3.93Å; K382-E806 HydrophobicContact CD-CG 4.28Å; K382-F809 HydrophobicContact CB-CD2 4.31Å; K382-F809 HydrophobicContact CB-CG 4.44Å; K382-F809 HydrophobicContact CG-CB 4.38Å; K382-F809 HydrophobicContact CG-CD1 4.25Å; K382-F809 HydrophobicContact CG-CD2 3.98Å; K382-F809 HydrophobicContact CG-CE2 4.3Å; K382-F809 HydrophobicContact CG-CG 3.95Å
383	K	92.2	Very high	90.2	Very high	75 Å²	75	44.8 Å²	44.8	33%	0.326	21%	0.206	S	C	.	.	H	α-helix	trans	-59.6	-44	-178.8	-63.5	-175.9	178.8	-179.5	0	111.9	E333 M336 E381 V385 A386 H387 V805	E333-K383 IonicContact OE1-NZ 3.41Å; E333-K383 PolarHBondContact OE1-NZ 3.32Å; M336-K383 HydrophobicContact CE-CB 3.76Å; M336-K383 HydrophobicContact CG-CB 3.96Å; M336-K383 HydrophobicContact CG-CD 4.05Å; M336-K383 HydrophobicContact CG-CG 4.36Å; M336-K383 HydrophobicContact SD-CB 4.11Å; E381-K383 PolarHBondContact O-N 3.12Å; K383-V385 PolarHBondContact O-N 3.3Å; K383-A386 PolarHBondContact O-N 3.1Å; K383-H387 PolarHBondContact O-N 2.76Å; K383-H387 VanDerWaalsContact O-N 3.09Å; K383-V805 HydrophobicContact CG-CG1 4.28Å
384	F	92.3	Very high	90.3	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-60.8	-44	177.2	-177.1	-94.2	0	0	0	112.5	I304 F308 M336 A339 M343 V355 A376 E381 K382 H387	I304-F384 HydrophobicContact CG2-CE2 4.02Å; I304-F384 HydrophobicContact CG2-CZ 4.12Å; F308-F384 HydrophobicContact CE1-CD2 4.21Å; F308-F384 HydrophobicContact CE1-CE2 4.48Å; F308-F384 HydrophobicContact CE1-CG 4.22Å; F308-F384 HydrophobicContact CE2-CE1 4.24Å; F308-F384 HydrophobicContact CE2-CZ 4.31Å; F308-F384 AromaticContact CZ-CD1 3.73Å; F308-F384 HydrophobicContact CZ-CD1 3.73Å; F308-F384 AromaticContact CZ-CD2 3.82Å; F308-F384 HydrophobicContact CZ-CD2 3.82Å; F308-F384 AromaticContact CZ-CE1 3.72Å; F308-F384 HydrophobicContact CZ-CE1 3.72Å; F308-F384 AromaticContact CZ-CE2 3.77Å; F308-F384 HydrophobicContact CZ-CE2 3.77Å; F308-F384 AromaticContact CZ-CG 3.77Å; F308-F384 HydrophobicContact CZ-CG 3.77Å; F308-F384 AromaticContact CZ-CZ 3.73Å; F308-F384 HydrophobicContact CZ-CZ 3.73Å; M336-F384 HydrophobicContact CE-CB 3.96Å; M336-F384 HydrophobicContact SD-CB 4.01Å; A339-F384 HydrophobicContact CB-CD2 4.08Å; A339-F384 HydrophobicContact CB-CE2 4.45Å; M343-F384 HydrophobicContact CE-CD1 4.08Å; M343-F384 HydrophobicContact CE-CD2 3.72Å; M343-F384 HydrophobicContact CE-CE1 3.59Å; M343-F384 HydrophobicContact CE-CE2 3.2Å; M343-F384 HydrophobicContact CE-CG 4.15Å; M343-F384 HydrophobicContact CE-CZ 3.13Å; V355-F384 HydrophobicContact CG1-CE2 4.28Å; V355-F384 HydrophobicContact CG1-CZ 3.92Å; A376-F384 HydrophobicContact CB-CD1 4.04Å; A376-F384 HydrophobicContact CB-CE1 4.35Å; E381-F384 PolarHBondContact O-N 3.06Å; K382-F384 PolarHBondContact O-N 3.5Å; F384-H387 WeakPolarHBondContact O-CB 3.4Å; F384-H387 PolarHBondContact O-N 2.86Å
385	V	92.8	Very high	90.4	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-68.4	-40.5	177.9	178.8	0	0	0	0	111.2	L373 A376 I377 E381 K382 K383 H387 Q391 F809 T812	L373-V385 HydrophobicContact CD1-CB 4.44Å; L373-V385 HydrophobicContact CD1-CG1 4.19Å; L373-V385 HydrophobicContact CD1-CG2 3.83Å; A376-V385 HydrophobicContact CB-CG2 4.24Å; I377-V385 HydrophobicContact CG1-CG2 4.2Å; E381-V385 WeakPolarHBondContact O-CG2 3.22Å; E381-V385 PolarHBondContact O-N 3.38Å; K382-V385 PolarHBondContact O-N 3.5Å; K383-V385 PolarHBondContact O-N 3.3Å; V385-H387 PolarHBondContact O-N 2.84Å; V385-Q391 PolarHBondContact O-NE2 2.68Å; V385-F809 HydrophobicContact CB-CD2 4Å; V385-F809 HydrophobicContact CG1-CD2 4.21Å; V385-F809 HydrophobicContact CG2-CD2 4.06Å; V385-F809 HydrophobicContact CG2-CE2 4.22Å; V385-T812 HydrophobicContact CG1-CG2 3.68Å
386	A	93.1	Very high	90.3	Very high	7 Å²	7	43 Å²	43	6%	0.058	21%	0.207	C	C	.	.	H	α-helix	trans	-72.1	-9.5	179.9	0	0	0	0	0	114.1	K382 K383 V805 K808	K382-A386 WeakPolarHBondContact O-CB 3.12Å; K382-A386 PolarHBondContact O-N 3.11Å; K383-A386 PolarHBondContact O-N 3.1Å; A386-V805 HydrophobicContact CB-CB 4.23Å; A386-V805 HydrophobicContact CB-CG1 3.83Å; A386-V805 HydrophobicContact CB-CG2 4.43Å; A386-K808 HydrophobicContact CB-CB 3.87Å; A386-K808 HydrophobicContact CB-CD 4.06Å
387	H	94	Very high	90	Very high	12 Å²	12	43.3 Å²	43.3	6%	0.056	21%	0.209	C	C	.	.			trans	-54.3	136	-178.5	-168	-82.2	0	0	0	112.4	C340 M343 D344 K383 F384 V385 N389 C390 Q391	C340-H387 PolarHBondContact O-NE2 3.03Å; M343-H387 HydrophobicContact SD-CB 3.51Å; M343-H387 VanDerWaalsContact SD-CB 3.51Å; M343-H387 PolarHBondContact SD-ND1 3.13Å; D344-H387 VanDerWaalsContact CG-NE2 3.31Å; D344-H387 IonicContact OD1-CE1 2.85Å; D344-H387 PolarHBondContact OD1-CE1 2.93Å; D344-H387 IonicContact OD1-NE2 3.71Å; D344-H387 PolarHBondContact OD1-NE2 3.36Å; D344-H387 IonicContact OD2-NE2 2.72Å; K383-H387 PolarHBondContact O-N 2.76Å; K383-H387 VanDerWaalsContact O-N 3.09Å; F384-H387 WeakPolarHBondContact O-CB 3.4Å; F384-H387 PolarHBondContact O-N 2.86Å; V385-H387 PolarHBondContact O-N 2.84Å; H387-N389 VanDerWaalsContact C-N 3.34Å; H387-N389 PolarHBondContact ND1-N 3.39Å; H387-N389 VanDerWaalsContact ND1-N 3.19Å; H387-N389 PolarHBondContact O-N 3.16Å; H387-C390 HydrophobicContact CB-CB 4.3Å; H387-C390 PolarHBondContact O-N 3.32Å; H387-C390 VanDerWaalsContact O-N 3.12Å; H387-Q391 WeakPolarHBondContact O-CG 3.19Å; H387-Q391 PolarHBondContact O-N 2.99Å
388	P	93.5	Very high	90	Very high	89 Å²	89	42.9 Å²	42.9	58%	0.578	21%	0.205	S	C	*	.	H	α-helix	trans	-53.8	-44	-176.4	-28.1	35.2	0	0	0	114.2	C390 Q391 Q392	P388-C390 PolarHBondContact O-N 2.83Å; P388-Q391 PolarHBondContact O-N 2.97Å; P388-Q392 WeakPolarHBondContact O-CB 3.14Å; P388-Q392 PolarHBondContact O-N 3.46Å
389	N	92.9	Very high	89.9	Confident	53 Å²	53	35.2 Å²	35.2	28%	0.283	18%	0.177	S	C	.	.	H	α-helix	trans	-63.2	-41.9	179	-66.9	-18.1	0	0	0	112.6	M343 V352 H387 Y393	M343-N389 HydrophobicContact CG-CB 4.16Å; M343-N389 PolarHBondContact O-ND2 3.11Å; M343-N389 HydrophobicContact SD-CB 4.44Å; V352-N389 HydrophobicContact CG2-CB 4.3Å; H387-N389 VanDerWaalsContact C-N 3.34Å; H387-N389 PolarHBondContact ND1-N 3.39Å; H387-N389 VanDerWaalsContact ND1-N 3.19Å; H387-N389 PolarHBondContact O-N 3.16Å; N389-Y393 WeakPolarHBondContact O-CB 3.33Å; N389-Y393 PolarHBondContact O-N 2.92Å; N389-Y393 VanDerWaalsContact O-N 3.1Å
390	C	91.7	Very high	89.5	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.5	-45.8	175	177.5	0	0	0	0	111.1	M343 I356 H387 P388 Q392 Y393 L394	M343-C390 HydrophobicContact CE-CB 4.11Å; M343-C390 HydrophobicContact SD-CB 3.62Å; I356-C390 HydrophobicContact CD1-CB 4.23Å; H387-C390 HydrophobicContact CB-CB 4.3Å; H387-C390 PolarHBondContact O-N 3.32Å; H387-C390 VanDerWaalsContact O-N 3.12Å; P388-C390 PolarHBondContact O-N 2.83Å; C390-Q392 PolarHBondContact O-N 3.39Å; C390-Y393 PolarHBondContact O-N 3.24Å; C390-L394 WeakPolarHBondContact O-CB 3.37Å; C390-L394 WeakPolarHBondContact O-CG 3.45Å; C390-L394 PolarHBondContact O-N 3.25Å
391	Q	92.6	Very high	88.8	Confident	11 Å²	11	30.4 Å²	30.4	5%	0.051	17%	0.165	C	C	.	.	H	α-helix	trans	-63.8	-37.8	179.2	-70.3	-63.7	-39.4	0	0	112.8	V385 H387 P388 L394 T395 T812	V385-Q391 PolarHBondContact O-NE2 2.68Å; H387-Q391 WeakPolarHBondContact O-CG 3.19Å; H387-Q391 PolarHBondContact O-N 2.99Å; P388-Q391 PolarHBondContact O-N 2.97Å; Q391-L394 PolarHBondContact O-N 2.91Å; Q391-T395 WeakPolarHBondContact O-CB 3.48Å; Q391-T395 PolarHBondContact O-N 3.29Å; Q391-T395 PolarHBondContact O-OG1 2.93Å; Q391-T812 PolarHBondContact NE2-OG1 2.95Å
392	Q	90.8	Very high	88	Confident	120 Å²	120	34.4 Å²	34.4	56%	0.561	18%	0.184	S	C	*	.	H	α-helix	trans	-66.5	-42.4	175	-178.9	64	2.8	0	0	111.3	P388 C390 T395 S396	P388-Q392 WeakPolarHBondContact O-CB 3.14Å; P388-Q392 PolarHBondContact O-N 3.46Å; C390-Q392 PolarHBondContact O-N 3.39Å; Q392-T395 PolarHBondContact O-N 3.47Å; Q392-S396 PolarHBondContact O-N 2.82Å
393	Y	88.6	Confident	87.3	Confident	12 Å²	12	31.8 Å²	31.8	5%	0.047	17%	0.173	C	C	.	.	H	α-helix	trans	-61.2	-46.7	174.5	-177.3	-111.5	0	0	0	111.4	V352 E353 I356 N389 C390 T395 S396 I397	V352-Y393 HydrophobicContact CG1-CG 4.19Å; E353-Y393 HydrophobicContact CB-CE2 4.42Å; I356-Y393 HydrophobicContact CD1-CD1 3.86Å; I356-Y393 HydrophobicContact CD1-CE1 4.48Å; I356-Y393 HydrophobicContact CG2-CE1 4.46Å; N389-Y393 WeakPolarHBondContact O-CB 3.33Å; N389-Y393 PolarHBondContact O-N 2.92Å; N389-Y393 VanDerWaalsContact O-N 3.1Å; C390-Y393 PolarHBondContact O-N 3.24Å; Y393-T395 PolarHBondContact O-N 3.47Å; Y393-S396 WeakPolarHBondContact O-CB 3.42Å; Y393-S396 PolarHBondContact O-N 3.28Å; Y393-S396 VanDerWaalsContact O-N 3.16Å; Y393-S396 PolarHBondContact O-OG 2.86Å; Y393-I397 HydrophobicContact CD1-CD1 3.84Å; Y393-I397 HydrophobicContact CE1-CD1 3.53Å; Y393-I397 PolarHBondContact O-N 3.22Å
394	L	89	Confident	86.4	Confident	1 Å²	1	30.5 Å²	30.5	1%	0.005	18%	0.176	C	C	.	.	H	α-helix	trans	-61.6	-39.9	175.4	-75.9	165.8	0	0	0	113.2	L370 L373 C390 Q391 S396 I397 W398 T812 W815 I819	L370-L394 HydrophobicContact CD2-CD2 4.19Å; L373-L394 HydrophobicContact CD2-CD1 4.06Å; L373-L394 HydrophobicContact CD2-CD2 3.67Å; L373-L394 HydrophobicContact CD2-CG 4.2Å; C390-L394 WeakPolarHBondContact O-CB 3.37Å; C390-L394 WeakPolarHBondContact O-CG 3.45Å; C390-L394 PolarHBondContact O-N 3.25Å; Q391-L394 PolarHBondContact O-N 2.91Å; L394-S396 VanDerWaalsContact C-N 3.28Å; L394-S396 PolarHBondContact O-N 3.44Å; L394-I397 HydrophobicContact CD2-CD1 4.47Å; L394-I397 WeakPolarHBondContact O-CB 3.24Å; L394-I397 PolarHBondContact O-N 3.05Å; L394-I397 VanDerWaalsContact O-N 3.12Å; L394-W398 WeakPolarHBondContact O-CB 3.35Å; L394-W398 PolarHBondContact O-N 2.97Å; L394-T812 HydrophobicContact CD1-CG2 3.49Å; L394-T812 VanDerWaalsContact CD1-CG2 3.49Å; L394-T812 HydrophobicContact CD2-CG2 4.47Å; L394-W815 HydrophobicContact CB-CE3 4.2Å; L394-W815 HydrophobicContact CB-CZ3 4.14Å; L394-I819 HydrophobicContact CD2-CD1 4.42Å
395	T	88.8	Confident	85.8	Confident	20 Å²	20	35.2 Å²	35.2	12%	0.123	20%	0.197	C	C	.	.	H	α-helix	trans	-62.3	-38.3	176	-61.1	0	0	0	0	111.1	Q391 Q392 Y393 I397 W398 Y399	Q391-T395 WeakPolarHBondContact O-CB 3.48Å; Q391-T395 PolarHBondContact O-N 3.29Å; Q391-T395 PolarHBondContact O-OG1 2.93Å; Q392-T395 PolarHBondContact O-N 3.47Å; Y393-T395 PolarHBondContact O-N 3.47Å; T395-I397 VanDerWaalsContact C-N 3.29Å; T395-I397 PolarHBondContact O-N 3.41Å; T395-W398 PolarHBondContact O-N 3.26Å; T395-Y399 HydrophobicContact CG2-CD2 3.78Å; T395-Y399 HydrophobicContact CG2-CE2 3.83Å; T395-Y399 WeakPolarHBondContact O-CD2 3.44Å; T395-Y399 PolarHBondContact O-N 3.08Å
396	S	84.5	Confident	85.1	Confident	49 Å²	49	36.6 Å²	36.6	34%	0.343	20%	0.204	S	C	.	.	H	α-helix	trans	-64.7	-33.6	175.1	83.1	0	0	0	0	112.7	Q392 Y393 L394 G400	Q392-S396 PolarHBondContact O-N 2.82Å; Y393-S396 WeakPolarHBondContact O-CB 3.42Å; Y393-S396 PolarHBondContact O-N 3.28Å; Y393-S396 VanDerWaalsContact O-N 3.16Å; Y393-S396 PolarHBondContact O-OG 2.86Å; L394-S396 VanDerWaalsContact C-N 3.28Å; L394-S396 PolarHBondContact O-N 3.44Å; S396-G400 PolarHBondContact O-N 3.48Å
397	I	84.2	Confident	84.5	Confident	7 Å²	7	40.7 Å²	40.7	4%	0.036	22%	0.222	C	C	.	.	H	α-helix	trans	-71.4	-42	172.8	-60.7	158.7	0	0	0	111.9	L370 Y393 L394 T395 I819 F865 V866	L370-I397 HydrophobicContact CD1-CD1 3.92Å; Y393-I397 HydrophobicContact CD1-CD1 3.84Å; Y393-I397 HydrophobicContact CE1-CD1 3.53Å; Y393-I397 PolarHBondContact O-N 3.22Å; L394-I397 HydrophobicContact CD2-CD1 4.47Å; L394-I397 WeakPolarHBondContact O-CB 3.24Å; L394-I397 PolarHBondContact O-N 3.05Å; L394-I397 VanDerWaalsContact O-N 3.12Å; T395-I397 VanDerWaalsContact C-N 3.29Å; T395-I397 PolarHBondContact O-N 3.41Å; I397-I819 HydrophobicContact CG2-CD1 3.88Å; I397-I819 HydrophobicContact CG2-CG1 4.01Å; I397-I819 HydrophobicContact CG2-CG2 4.04Å; I397-F865 HydrophobicContact CB-CE1 3.93Å; I397-F865 HydrophobicContact CB-CZ 3.68Å; I397-F865 HydrophobicContact CG1-CE1 3.69Å; I397-F865 HydrophobicContact CG1-CZ 3.41Å; I397-F865 VanDerWaalsContact CG1-CZ 3.41Å; I397-F865 HydrophobicContact CG2-CE1 3.66Å; I397-F865 HydrophobicContact CG2-CZ 3.94Å; I397-V866 HydrophobicContact CG1-CG2 4.5Å
398	W	87.2	Confident	83.8	Confident	13 Å²	13	44.8 Å²	44.8	5%	0.049	25%	0.252	C	S	.	.	H	α-helix	trans	-61.7	-50	-175.8	-175.3	-105.6	0	0	0	113	L394 T395 C446 P447 A448 F451 W815 Y818 I819	L394-W398 WeakPolarHBondContact O-CB 3.35Å; L394-W398 PolarHBondContact O-N 2.97Å; T395-W398 PolarHBondContact O-N 3.26Å; W398-C446 PolarHBondContact O-SG 2.93Å; W398-P447 HydrophobicContact CD2-CB 4.25Å; W398-P447 HydrophobicContact CE3-CB 3.57Å; W398-P447 HydrophobicContact CZ3-CB 3.74Å; W398-A448 HydrophobicContact CD2-CB 4.47Å; W398-A448 HydrophobicContact CG-CB 4.35Å; W398-A448 VanDerWaalsContact O-CB 3.26Å; W398-A448 WeakPolarHBondContact O-CB 3.18Å; W398-A448 PolarHBondContact O-N 2.98Å; W398-F451 HydrophobicContact CH2-CB 3.62Å; W398-F451 HydrophobicContact CH2-CD2 4.47Å; W398-F451 AromaticContact CH2-CG 3.99Å; W398-F451 HydrophobicContact CH2-CG 3.99Å; W398-F451 HydrophobicContact CZ2-CB 3.59Å; W398-F451 AromaticContact CZ2-CD1 3.97Å; W398-F451 HydrophobicContact CZ2-CD1 3.97Å; W398-F451 AromaticContact CZ2-CG 3.81Å; W398-F451 HydrophobicContact CZ2-CG 3.81Å; W398-W815 HydrophobicContact CB-CE3 4.31Å; W398-W815 HydrophobicContact CB-CZ3 4.41Å; W398-W815 AromaticContact CD2-CD1 3.96Å; W398-W815 AromaticContact CD2-CD2 3.93Å; W398-W815 HydrophobicContact CD2-CD2 3.93Å; W398-W815 AromaticContact CD2-CG 3.91Å; W398-W815 HydrophobicContact CD2-CG 3.91Å; W398-W815 AromaticContact CE2-CD1 3.96Å; W398-W815 AromaticContact CE2-NE1 3.8Å; W398-W815 HydrophobicContact CE3-CB 3.63Å; W398-W815 AromaticContact CE3-CD1 3.74Å; W398-W815 AromaticContact CE3-CD2 3.92Å; W398-W815 HydrophobicContact CE3-CD2 3.92Å; W398-W815 AromaticContact CE3-CG 3.48Å; W398-W815 HydrophobicContact CE3-CG 3.48Å; W398-W815 VanDerWaalsContact CE3-CG 3.48Å; W398-W815 HydrophobicContact CG-CD2 4.23Å; W398-W815 HydrophobicContact CG-CE3 4.46Å; W398-W815 HydrophobicContact CG-CZ2 4.46Å; W398-W815 HydrophobicContact CH2-CB 4.4Å; W398-W815 AromaticContact CH2-CD1 3.52Å; W398-W815 HydrophobicContact CH2-CG 4.06Å; W398-W815 AromaticContact CZ2-CD1 3.75Å; W398-W815 HydrophobicContact CZ2-CG 4.45Å; W398-W815 AromaticContact CZ2-NE1 3.86Å; W398-W815 VanDerWaalsContact CZ3-CA 3.43Å; W398-W815 HydrophobicContact CZ3-CB 3.58Å; W398-W815 AromaticContact CZ3-CD1 3.53Å; W398-W815 HydrophobicContact CZ3-CD2 4.45Å; W398-W815 AromaticContact CZ3-CG 3.58Å; W398-W815 HydrophobicContact CZ3-CG 3.58Å; W398-Y818 HydrophobicContact CH2-CD2 4.02Å; W398-Y818 HydrophobicContact CH2-CG 4.31Å; W398-Y818 HydrophobicContact CZ3-CD2 4.41Å; W398-I819 HydrophobicContact CE3-CG1 4.42Å
399	Y	84.8	Confident	83.4	Confident	41 Å²	41	44.6 Å²	44.6	16%	0.161	24%	0.24	C	C	.	.	H	α-helix	trans	-84.2	-21.6	-179.6	-69.3	-74.3	0	0	0	113.2	T395 T403 L406 Q407 K414 C446 A448	T395-Y399 HydrophobicContact CG2-CD2 3.78Å; T395-Y399 HydrophobicContact CG2-CE2 3.83Å; T395-Y399 WeakPolarHBondContact O-CD2 3.44Å; T395-Y399 PolarHBondContact O-N 3.08Å; Y399-T403 CarbonylContact O-C 3.48Å; Y399-T403 WeakPolarHBondContact O-CB 3.38Å; Y399-T403 PolarHBondContact O-N 3.26Å; Y399-T403 PolarHBondContact O-OG1 3.45Å; Y399-L406 HydrophobicContact CD1-CB 4Å; Y399-L406 HydrophobicContact CE1-CB 3.97Å; Y399-Q407 HydrophobicContact CD2-CB 4.09Å; Y399-Q407 HydrophobicContact CD2-CG 4.22Å; Y399-Q407 HydrophobicContact CE2-CB 4.15Å; Y399-Q407 HydrophobicContact CE2-CG 4.07Å; Y399-Q407 HydrophobicContact CG-CB 4.29Å; Y399-K414 PolarHBondContact OH-NZ 2.65Å; Y399-C446 PolarHBondContact O-SG 3.29Å; Y399-A448 HydrophobicContact CD1-CB 4.19Å
400	G	79	Confident	83	Confident	14 Å²	14	45 Å²	45	14%	0.144	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.9	-173.2	-177.6	0	0	0	0	0	113.6	S396	S396-G400 PolarHBondContact O-N 3.48Å
401	S	71.6	Confident	82.5	Confident	57 Å²	57	49.9 Å²	49.9	40%	0.399	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-38.4	179.9	56.1	0	0	0	0	113.5
402	E	73.2	Confident	82.1	Confident	83 Å²	83	56 Å²	56	39%	0.388	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-29.4	-171.3	-53.4	-61	164.7	0	0	112.3	F405 R442	E402-F405 WeakPolarHBondContact O-CE1 3.47Å; E402-R442 HydrophobicContact CG-CG 4.39Å
403	T	75.8	Confident	82	Confident	4 Å²	4	58.2 Å²	58.2	3%	0.025	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.8	14.3	-178.2	85.5	0	0	0	0	113.5	Y399 F405 L406 C446	Y399-T403 CarbonylContact O-C 3.48Å; Y399-T403 WeakPolarHBondContact O-CB 3.38Å; Y399-T403 PolarHBondContact O-N 3.26Å; Y399-T403 PolarHBondContact O-OG1 3.45Å; T403-F405 PolarHBondContact O-N 3.23Å; T403-F405 VanDerWaalsContact O-N 3.1Å; T403-L406 HydrophobicContact CG2-CD1 4.45Å; T403-L406 VanDerWaalsContact O-CB 3.24Å; T403-L406 WeakPolarHBondContact O-CB 3.48Å; T403-L406 PolarHBondContact O-N 3.41Å; T403-C446 HydrophobicContact CG2-CB 4.14Å
404	A	74.1	Confident	81.8	Confident	48 Å²	48	60.7 Å²	60.7	40%	0.397	32%	0.318	S	S	.	.	H	α-helix	trans	-55.3	-30.9	178.8	0	0	0	0	0	113.2	L406 Q407	A404-L406 PolarHBondContact O-N 3.03Å; A404-Q407 WeakPolarHBondContact O-CB 2.84Å; A404-Q407 PolarHBondContact O-N 3.1Å; A404-Q407 VanDerWaalsContact O-N 3.12Å
405	F	79.1	Confident	81.6	Confident	99 Å²	99	64.3 Å²	64.3	43%	0.434	34%	0.337	S	S	.	.	H	α-helix	trans	-59.6	-32.1	175.7	70.2	-92.2	0	0	0	112.5	E402 T403 Q407 S408 W409	E402-F405 WeakPolarHBondContact O-CE1 3.47Å; T403-F405 PolarHBondContact O-N 3.23Å; T403-F405 VanDerWaalsContact O-N 3.1Å; F405-Q407 PolarHBondContact O-N 3.38Å; F405-S408 PolarHBondContact O-N 2.99Å; F405-S408 PolarHBondContact O-OG 2.89Å; F405-W409 HydrophobicContact CD2-CD2 4.43Å; F405-W409 AromaticContact CD2-CE2 3.79Å; F405-W409 HydrophobicContact CD2-CH2 4.23Å; F405-W409 AromaticContact CD2-CZ2 3.67Å; F405-W409 HydrophobicContact CD2-CZ2 3.67Å; F405-W409 AromaticContact CE2-CH2 3.98Å; F405-W409 HydrophobicContact CE2-CH2 3.98Å; F405-W409 AromaticContact CE2-CZ2 3.9Å; F405-W409 HydrophobicContact CE2-CZ2 3.9Å; F405-W409 HydrophobicContact CE2-CZ3 4.46Å; F405-W409 VanDerWaalsContact O-CD1 3.24Å
406	L	78.6	Confident	81.4	Confident	29 Å²	29	65.2 Å²	65.2	15%	0.152	35%	0.35	C	S	.	.	H	α-helix	trans	-61.4	-33.1	178.7	-67	176.5	0	0	0	111.4	Y399 T403 A404 S408 W409 K414 L417	Y399-L406 HydrophobicContact CD1-CB 4Å; Y399-L406 HydrophobicContact CE1-CB 3.97Å; T403-L406 HydrophobicContact CG2-CD1 4.45Å; T403-L406 VanDerWaalsContact O-CB 3.24Å; T403-L406 WeakPolarHBondContact O-CB 3.48Å; T403-L406 PolarHBondContact O-N 3.41Å; A404-L406 PolarHBondContact O-N 3.03Å; L406-S408 PolarHBondContact O-N 3.47Å; L406-W409 HydrophobicContact CD2-CE3 4.36Å; L406-W409 PolarHBondContact O-N 3.46Å; L406-W409 VanDerWaalsContact O-N 3.14Å; L406-K414 WeakPolarHBondContact O-CE 3.47Å; L406-K414 PolarHBondContact O-NZ 3.48Å; L406-L417 HydrophobicContact CD2-CD2 3.59Å
407	Q	81.4	Confident	81.5	Confident	92 Å²	92	66.2 Å²	66.2	43%	0.43	35%	0.351	S	S	.	.	H	α-helix	trans	-56.8	-39.1	-179.2	-172.1	176.1	-2.4	0	0	111.5	Y399 A404 F405 W409	Y399-Q407 HydrophobicContact CD2-CB 4.09Å; Y399-Q407 HydrophobicContact CD2-CG 4.22Å; Y399-Q407 HydrophobicContact CE2-CB 4.15Å; Y399-Q407 HydrophobicContact CE2-CG 4.07Å; Y399-Q407 HydrophobicContact CG-CB 4.29Å; A404-Q407 WeakPolarHBondContact O-CB 2.84Å; A404-Q407 PolarHBondContact O-N 3.1Å; A404-Q407 VanDerWaalsContact O-N 3.12Å; F405-Q407 PolarHBondContact O-N 3.38Å; Q407-W409 VanDerWaalsContact C-N 3.34Å; Q407-W409 PolarHBondContact O-N 2.91Å
408	S	79	Confident	81.3	Confident	98 Å²	98	67.7 Å²	67.7	69%	0.685	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-11.5	-177.5	70.3	0	0	0	0	115.2	F405 L406	F405-S408 PolarHBondContact O-N 2.99Å; F405-S408 PolarHBondContact O-OG 2.89Å; L406-S408 PolarHBondContact O-N 3.47Å
409	W	83.5	Confident	81.2	Confident	86 Å²	86	72.6 Å²	72.6	33%	0.326	39%	0.388	S	S	.	.	S	Bend	trans	-84.6	145.6	-173.7	-72.6	16.4	0	0	0	112.2	F405 L406 Q407 R413 K414 L417	F405-W409 HydrophobicContact CD2-CD2 4.43Å; F405-W409 AromaticContact CD2-CE2 3.79Å; F405-W409 HydrophobicContact CD2-CH2 4.23Å; F405-W409 AromaticContact CD2-CZ2 3.67Å; F405-W409 HydrophobicContact CD2-CZ2 3.67Å; F405-W409 AromaticContact CE2-CH2 3.98Å; F405-W409 HydrophobicContact CE2-CH2 3.98Å; F405-W409 AromaticContact CE2-CZ2 3.9Å; F405-W409 HydrophobicContact CE2-CZ2 3.9Å; F405-W409 HydrophobicContact CE2-CZ3 4.46Å; F405-W409 VanDerWaalsContact O-CD1 3.24Å; L406-W409 HydrophobicContact CD2-CE3 4.36Å; L406-W409 PolarHBondContact O-N 3.46Å; L406-W409 VanDerWaalsContact O-N 3.14Å; Q407-W409 VanDerWaalsContact C-N 3.34Å; Q407-W409 PolarHBondContact O-N 2.91Å; W409-R413 HydrophobicContact CB-CB 4.29Å; W409-R413 HydrophobicContact CD2-CB 4.49Å; W409-R413 HydrophobicContact CE3-CB 4.06Å; W409-K414 HydrophobicContact CB-CG 4.07Å; W409-K414 WeakPolarHBondContact O-CE 3.16Å; W409-K414 PolarHBondContact O-NZ 3.35Å; W409-L417 HydrophobicContact CE3-CD2 4.49Å; W409-L417 HydrophobicContact CH2-CD2 4.44Å; W409-L417 HydrophobicContact CZ3-CB 4.1Å; W409-L417 HydrophobicContact CZ3-CD1 4.46Å; W409-L417 HydrophobicContact CZ3-CD2 3.8Å; W409-L417 HydrophobicContact CZ3-CG 4.34Å
410	S	84.5	Confident	81.2	Confident	62 Å²	62	73.5 Å²	73.5	43%	0.434	40%	0.404	S	S	.	.			trans	-64.7	152.9	170.9	65	0	0	0	0	111.2	I412 R413 K414	S410-I412 PolarHBondContact O-N 2.93Å; S410-R413 PolarHBondContact O-N 2.81Å; S410-K414 PolarHBondContact O-N 2.99Å
411	L	81.4	Confident	81.4	Confident	102 Å²	102	74.3 Å²	74.3	53%	0.534	41%	0.409	S	S	.	.	H	α-helix	trans	-54.7	-38.9	-179.3	-176.4	146.8	0	0	0	112.2	R413 K414 I415	L411-R413 PolarHBondContact O-N 3.32Å; L411-K414 WeakPolarHBondContact O-CB 3.46Å; L411-K414 PolarHBondContact O-N 2.99Å; L411-I415 HydrophobicContact CD2-CD1 3.41Å; L411-I415 VanDerWaalsContact CD2-CD1 3.41Å; L411-I415 HydrophobicContact CD2-CG1 4.19Å; L411-I415 HydrophobicContact CG-CD1 4.29Å; L411-I415 WeakPolarHBondContact O-CG1 3.4Å; L411-I415 PolarHBondContact O-N 3.45Å
412	I	85.2	Confident	82	Confident	138 Å²	138	73.3 Å²	73.3	71%	0.708	40%	0.401	S	S	*	.	H	α-helix	trans	-62.5	-41.9	176.8	-61.9	163.7	0	0	0	111.5	S410 I415 G416	S410-I412 PolarHBondContact O-N 2.93Å; I412-I415 PolarHBondContact O-N 3.41Å; I412-G416 PolarHBondContact O-N 3.02Å
413	R	87.9	Confident	82.4	Confident	168 Å²	168	73.8 Å²	73.8	63%	0.634	41%	0.411	S	S	*	.	H	α-helix	trans	-68.3	-37.4	176.9	-72.2	-179.5	179.8	179	1.1	111.7	W409 S410 L411 G416 L417	W409-R413 HydrophobicContact CB-CB 4.29Å; W409-R413 HydrophobicContact CD2-CB 4.49Å; W409-R413 HydrophobicContact CE3-CB 4.06Å; S410-R413 PolarHBondContact O-N 2.81Å; L411-R413 PolarHBondContact O-N 3.32Å; R413-G416 PolarHBondContact O-N 2.97Å; R413-L417 WeakPolarHBondContact O-CB 3.41Å; R413-L417 PolarHBondContact O-N 3.34Å
414	K	84.9	Confident	82.8	Confident	63 Å²	63	77.3 Å²	77.3	27%	0.274	43%	0.429	S	S	.	.	H	α-helix	trans	-62.4	-46.7	174.2	-68.1	172.9	175.2	171	0	111.4	Y399 L406 W409 S410 L411 L417 S418	Y399-K414 PolarHBondContact OH-NZ 2.65Å; L406-K414 WeakPolarHBondContact O-CE 3.47Å; L406-K414 PolarHBondContact O-NZ 3.48Å; W409-K414 HydrophobicContact CB-CG 4.07Å; W409-K414 WeakPolarHBondContact O-CE 3.16Å; W409-K414 PolarHBondContact O-NZ 3.35Å; S410-K414 PolarHBondContact O-N 2.99Å; L411-K414 WeakPolarHBondContact O-CB 3.46Å; L411-K414 PolarHBondContact O-N 2.99Å; K414-L417 PolarHBondContact O-N 2.91Å; K414-S418 PolarHBondContact O-N 2.81Å
415	I	83.9	Confident	83.2	Confident	78 Å²	78	75.6 Å²	75.6	40%	0.4	41%	0.414	S	S	.	.	H	α-helix	trans	-62.8	-45.5	175.4	-68.8	178.6	0	0	0	110.4	L411 I412 L417 S418 I419	L411-I415 HydrophobicContact CD2-CD1 3.41Å; L411-I415 VanDerWaalsContact CD2-CD1 3.41Å; L411-I415 HydrophobicContact CD2-CG1 4.19Å; L411-I415 HydrophobicContact CG-CD1 4.29Å; L411-I415 WeakPolarHBondContact O-CG1 3.4Å; L411-I415 PolarHBondContact O-N 3.45Å; I412-I415 PolarHBondContact O-N 3.41Å; I415-L417 VanDerWaalsContact C-N 3.31Å; I415-L417 PolarHBondContact O-N 2.93Å; I415-S418 WeakPolarHBondContact O-CB 3.27Å; I415-S418 PolarHBondContact O-N 3.06Å; I415-S418 VanDerWaalsContact O-N 3.09Å; I415-I419 HydrophobicContact CG2-CD1 3.71Å; I415-I419 HydrophobicContact CG2-CG1 4.27Å; I415-I419 WeakPolarHBondContact O-CG1 3.41Å; I415-I419 PolarHBondContact O-N 2.88Å
416	G	86.2	Confident	83.4	Confident	38 Å²	38	73.3 Å²	73.3	39%	0.392	41%	0.409	S	S	.	.	H	α-helix	trans	-57.3	-42.5	176.5	0	0	0	0	0	112.8	I412 R413 I419 A420	I412-G416 PolarHBondContact O-N 3.02Å; R413-G416 PolarHBondContact O-N 2.97Å; G416-I419 PolarHBondContact O-N 3.4Å; G416-A420 WeakPolarHBondContact O-CB 3.39Å; G416-A420 PolarHBondContact O-N 2.78Å
417	L	85	Confident	83.6	Confident	71 Å²	71	76.5 Å²	76.5	37%	0.372	43%	0.425	S	S	.	.	H	α-helix	trans	-64.4	-42.6	173.9	-178.5	68	0	0	0	112	L406 W409 R413 K414 I415 A420 A421	L406-L417 HydrophobicContact CD2-CD2 3.59Å; W409-L417 HydrophobicContact CE3-CD2 4.49Å; W409-L417 HydrophobicContact CH2-CD2 4.44Å; W409-L417 HydrophobicContact CZ3-CB 4.1Å; W409-L417 HydrophobicContact CZ3-CD1 4.46Å; W409-L417 HydrophobicContact CZ3-CD2 3.8Å; W409-L417 HydrophobicContact CZ3-CG 4.34Å; R413-L417 WeakPolarHBondContact O-CB 3.41Å; R413-L417 PolarHBondContact O-N 3.34Å; K414-L417 PolarHBondContact O-N 2.91Å; I415-L417 VanDerWaalsContact C-N 3.31Å; I415-L417 PolarHBondContact O-N 2.93Å; L417-A420 PolarHBondContact O-N 3.22Å; L417-A421 VanDerWaalsContact O-CB 3.28Å; L417-A421 WeakPolarHBondContact O-CB 3.25Å; L417-A421 PolarHBondContact O-N 2.79Å
418	S	81.3	Confident	83.7	Confident	38 Å²	38	75 Å²	75	27%	0.266	42%	0.417	S	S	.	.	H	α-helix	trans	-60	-46.7	177.6	-168.6	0	0	0	0	111.5	K414 I415 A420 A421 T422 V456	K414-S418 PolarHBondContact O-N 2.81Å; I415-S418 WeakPolarHBondContact O-CB 3.27Å; I415-S418 PolarHBondContact O-N 3.06Å; I415-S418 VanDerWaalsContact O-N 3.09Å; S418-A420 PolarHBondContact O-N 3.3Å; S418-A421 PolarHBondContact O-N 3.29Å; S418-T422 PolarHBondContact O-N 3.2Å; S418-T422 VanDerWaalsContact O-N 3.08Å; S418-T422 PolarHBondContact O-OG1 2.91Å; S418-T422 VanDerWaalsContact O-OG1 3.08Å; S418-V456 WeakPolarHBondContact OG-CG2 3.42Å
419	I	84.1	Confident	83.9	Confident	115 Å²	115	70.3 Å²	70.3	59%	0.59	39%	0.385	S	S	*	.	H	α-helix	trans	-62.7	-43.8	176.6	-65.7	169.5	0	0	0	110.9	I415 G416 A421 T422	I415-I419 HydrophobicContact CG2-CD1 3.71Å; I415-I419 HydrophobicContact CG2-CG1 4.27Å; I415-I419 WeakPolarHBondContact O-CG1 3.41Å; I415-I419 PolarHBondContact O-N 2.88Å; G416-I419 PolarHBondContact O-N 3.4Å; I419-A421 VanDerWaalsContact C-N 3.27Å; I419-A421 PolarHBondContact O-N 3.2Å; I419-T422 WeakPolarHBondContact O-CB 3.33Å; I419-T422 PolarHBondContact O-N 2.9Å; I419-T422 PolarHBondContact O-OG1 3.37Å
420	A	85.5	Confident	83.8	Confident	60 Å²	60	70 Å²	70	50%	0.496	39%	0.389	S	S	.	.	H	α-helix	trans	-65.7	-30.3	176.8	0	0	0	0	0	112.7	G416 L417 S418 P423	G416-A420 WeakPolarHBondContact O-CB 3.39Å; G416-A420 PolarHBondContact O-N 2.78Å; L417-A420 PolarHBondContact O-N 3.22Å; S418-A420 PolarHBondContact O-N 3.3Å; A420-P423 WeakPolarHBondContact O-CD 3.27Å
421	A	83.3	Confident	83.7	Confident	32 Å²	32	69.6 Å²	69.6	26%	0.264	38%	0.381	S	S	.	.	H	α-helix	trans	-78.7	-21.4	177.7	0	0	0	0	0	113.4	L417 S418 I419 L424 L425	L417-A421 VanDerWaalsContact O-CB 3.28Å; L417-A421 WeakPolarHBondContact O-CB 3.25Å; L417-A421 PolarHBondContact O-N 2.79Å; S418-A421 PolarHBondContact O-N 3.29Å; I419-A421 VanDerWaalsContact C-N 3.27Å; I419-A421 PolarHBondContact O-N 3.2Å; A421-L424 CarbonylContact O-C 3.59Å; A421-L424 WeakPolarHBondContact O-CA 3.17Å; A421-L424 PolarHBondContact O-N 3.28Å; A421-L425 PolarHBondContact O-N 3.22Å
422	T	83	Confident	83.7	Confident	35 Å²	35	66.2 Å²	66.2	22%	0.215	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-48.4	-53.4	179.1	-56.9	0	0	0	0	114.4	S418 I419 L424 L425 V456 L460	S418-T422 PolarHBondContact O-N 3.2Å; S418-T422 VanDerWaalsContact O-N 3.08Å; S418-T422 PolarHBondContact O-OG1 2.91Å; S418-T422 VanDerWaalsContact O-OG1 3.08Å; I419-T422 WeakPolarHBondContact O-CB 3.33Å; I419-T422 PolarHBondContact O-N 2.9Å; I419-T422 PolarHBondContact O-OG1 3.37Å; T422-L424 PolarHBondContact O-N 2.75Å; T422-L425 VanDerWaalsContact O-CB 3.28Å; T422-L425 WeakPolarHBondContact O-CB 3.35Å; T422-L425 PolarHBondContact O-N 3.12Å; T422-V456 HydrophobicContact CG2-CG1 3.88Å; T422-V456 WeakPolarHBondContact OG1-CG1 3.37Å; T422-L460 HydrophobicContact CG2-CD1 3.79Å; T422-L460 HydrophobicContact CG2-CD2 3.61Å; T422-L460 HydrophobicContact CG2-CG 3.88Å
423	P	82.5	Confident	83.4	Confident	93 Å²	93	60.9 Å²	60.9	60%	0.604	33%	0.334	S	S	*	.	G	3₁₀ helix	trans	-68	-23.8	178.2	26.8	-35.7	0	0	0	113.3	A420 P426	A420-P423 WeakPolarHBondContact O-CD 3.27Å; P423-P426 WeakPolarHBondContact O-CD 3.46Å
424	L	83.9	Confident	83.1	Confident	79 Å²	79	58.9 Å²	58.9	41%	0.414	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-87	-12	180	-59.7	175.7	0	0	0	112.8	A421 T422 L427 F428	A421-L424 CarbonylContact O-C 3.59Å; A421-L424 WeakPolarHBondContact O-CA 3.17Å; A421-L424 PolarHBondContact O-N 3.28Å; T422-L424 PolarHBondContact O-N 2.75Å; L424-L427 HydrophobicContact CD2-CD1 4.15Å; L424-L427 WeakPolarHBondContact O-CB 3.29Å; L424-L427 PolarHBondContact O-N 3.43Å; L424-F428 HydrophobicContact CB-CD2 4.06Å; L424-F428 HydrophobicContact CB-CE2 3.47Å; L424-F428 VanDerWaalsContact CB-CE2 3.47Å; L424-F428 HydrophobicContact CB-CZ 3.78Å; L424-F428 HydrophobicContact CD1-CE2 4.37Å; L424-F428 HydrophobicContact CD1-CZ 4.07Å; L424-F428 WeakPolarHBondContact O-CD2 3.37Å; L424-F428 PolarHBondContact O-N 3.39Å
425	L	83.4	Confident	82.9	Confident	12 Å²	12	60.6 Å²	60.6	6%	0.063	35%	0.346	C	S	.	.	H	α-helix	trans	-51.3	-49.2	179.7	-172.7	67.2	0	0	0	114.6	A421 T422 L427 F428 C429 T453 V456 L460 P826	A421-L425 PolarHBondContact O-N 3.22Å; T422-L425 VanDerWaalsContact O-CB 3.28Å; T422-L425 WeakPolarHBondContact O-CB 3.35Å; T422-L425 PolarHBondContact O-N 3.12Å; L425-L427 VanDerWaalsContact C-N 3.26Å; L425-L427 PolarHBondContact O-N 3.38Å; L425-F428 PolarHBondContact O-N 3.1Å; L425-C429 PolarHBondContact O-N 3.33Å; L425-C429 PolarHBondContact O-SG 2.77Å; L425-T453 HydrophobicContact CD1-CG2 3.69Å; L425-V456 HydrophobicContact CD2-CG1 4.1Å; L425-L460 HydrophobicContact CD2-CD1 4.46Å; L425-P826 HydrophobicContact CD1-CG 4.3Å; L425-P826 HydrophobicContact CD2-CG 4.49Å
426	P	82.2	Confident	82.5	Confident	51 Å²	51	59.6 Å²	59.6	33%	0.331	35%	0.345	S	S	.	.	H	α-helix	trans	-58.2	-39.1	176.6	21.1	-33.8	0	0	0	112.3	P423 C429 L430 F829	P423-P426 WeakPolarHBondContact O-CD 3.46Å; P426-C429 PolarHBondContact O-N 2.86Å; P426-L430 WeakPolarHBondContact O-CG 3.24Å; P426-L430 PolarHBondContact O-N 3.08Å; P426-F829 HydrophobicContact CB-CE1 4.46Å; P426-F829 HydrophobicContact CB-CE2 4.19Å; P426-F829 HydrophobicContact CB-CZ 3.65Å
427	L	84.2	Confident	82	Confident	95 Å²	95	63.6 Å²	63.6	50%	0.497	36%	0.362	S	S	.	.	H	α-helix	trans	-67.1	-43.5	178.8	-64.3	172.3	0	0	0	111.3	L424 L425 C429 L430 I431	L424-L427 HydrophobicContact CD2-CD1 4.15Å; L424-L427 WeakPolarHBondContact O-CB 3.29Å; L424-L427 PolarHBondContact O-N 3.43Å; L425-L427 VanDerWaalsContact C-N 3.26Å; L425-L427 PolarHBondContact O-N 3.38Å; L427-C429 VanDerWaalsContact C-N 3.33Å; L427-C429 PolarHBondContact O-N 3.4Å; L427-L430 PolarHBondContact O-N 3.43Å; L427-I431 VanDerWaalsContact O-CG1 3.28Å; L427-I431 WeakPolarHBondContact O-CG1 3.27Å; L427-I431 PolarHBondContact O-N 2.76Å
428	F	83.7	Confident	81.8	Confident	60 Å²	60	61.8 Å²	61.8	26%	0.263	36%	0.355	S	S	.	.	H	α-helix	trans	-62.8	-39.9	176.2	-63.3	-40.8	0	0	0	112.3	L424 L425 I431 Y432 I440 M444	L424-F428 HydrophobicContact CB-CD2 4.06Å; L424-F428 HydrophobicContact CB-CE2 3.47Å; L424-F428 VanDerWaalsContact CB-CE2 3.47Å; L424-F428 HydrophobicContact CB-CZ 3.78Å; L424-F428 HydrophobicContact CD1-CE2 4.37Å; L424-F428 HydrophobicContact CD1-CZ 4.07Å; L424-F428 WeakPolarHBondContact O-CD2 3.37Å; L424-F428 PolarHBondContact O-N 3.39Å; L425-F428 PolarHBondContact O-N 3.1Å; F428-I431 PolarHBondContact O-N 3.22Å; F428-Y432 PolarHBondContact O-N 2.89Å; F428-I440 HydrophobicContact CD1-CG2 3.93Å; F428-I440 HydrophobicContact CE1-CG2 4.46Å; F428-M444 HydrophobicContact CB-CE 4.45Å; F428-M444 HydrophobicContact CB-SD 3.74Å; F428-M444 VanDerWaalsContact O-SD 3.38Å
429	C	81.8	Confident	81.8	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-63.9	-42.2	175.7	-63.8	0	0	0	0	111.8	L425 P426 L427 Y432 I433 L825 F829	L425-C429 PolarHBondContact O-N 3.33Å; L425-C429 PolarHBondContact O-SG 2.77Å; P426-C429 PolarHBondContact O-N 2.86Å; L427-C429 VanDerWaalsContact C-N 3.33Å; L427-C429 PolarHBondContact O-N 3.4Å; C429-Y432 PolarHBondContact O-N 2.96Å; C429-I433 VanDerWaalsContact O-CG1 3.32Å; C429-I433 WeakPolarHBondContact O-CG1 3.24Å; C429-I433 PolarHBondContact O-N 3.38Å; C429-I433 VanDerWaalsContact O-N 3.11Å; C429-L825 HydrophobicContact CB-CD2 4.29Å; C429-F829 HydrophobicContact CB-CB 4.21Å; C429-F829 HydrophobicContact CB-CD2 3.84Å; C429-F829 HydrophobicContact CB-CE2 4.42Å; C429-F829 HydrophobicContact CB-CG 3.92Å
430	L	81.6	Confident	81.6	Confident	79 Å²	79	63.9 Å²	63.9	41%	0.414	36%	0.364	S	S	.	.	H	α-helix	trans	-63.9	-43.3	175.4	-72.6	170.1	0	0	0	112	P426 L427 Y432 I433 I434	P426-L430 WeakPolarHBondContact O-CG 3.24Å; P426-L430 PolarHBondContact O-N 3.08Å; L427-L430 PolarHBondContact O-N 3.43Å; L430-Y432 VanDerWaalsContact C-N 3.29Å; L430-Y432 PolarHBondContact O-N 3.26Å; L430-I433 PolarHBondContact O-N 3.33Å; L430-I433 VanDerWaalsContact O-N 3.16Å; L430-I434 WeakPolarHBondContact O-CG1 3.45Å; L430-I434 PolarHBondContact O-N 2.85Å
431	I	82.9	Confident	81.2	Confident	54 Å²	54	61 Å²	61	28%	0.277	34%	0.34	S	S	.	.	H	α-helix	trans	-60.3	-40.6	175.8	-69	165.2	0	0	0	110.8	L427 F428 I433 L435 I440	L427-I431 VanDerWaalsContact O-CG1 3.28Å; L427-I431 WeakPolarHBondContact O-CG1 3.27Å; L427-I431 PolarHBondContact O-N 2.76Å; F428-I431 PolarHBondContact O-N 3.22Å; I431-I433 VanDerWaalsContact C-N 3.33Å; I431-I433 PolarHBondContact O-N 2.65Å; I431-L435 CarbonylContact O-C 3.57Å; I431-L435 WeakPolarHBondContact O-CA 3.41Å; I431-L435 PolarHBondContact O-N 3.39Å; I431-I440 HydrophobicContact CD1-CD1 4.43Å; I431-I440 HydrophobicContact CG2-CB 4.45Å; I431-I440 HydrophobicContact CG2-CG2 4.46Å
432	Y	81.3	Confident	80.9	Confident	31 Å²	31	65.6 Å²	65.6	12%	0.122	35%	0.351	C	S	.	.	H	α-helix	trans	-63.4	-37.8	176.7	-178.1	-95.5	0	0	0	112.7	F428 C429 L430 A441 M444 R445 T824 L825	F428-Y432 PolarHBondContact O-N 2.89Å; C429-Y432 PolarHBondContact O-N 2.96Å; L430-Y432 VanDerWaalsContact C-N 3.29Å; L430-Y432 PolarHBondContact O-N 3.26Å; Y432-A441 HydrophobicContact CD2-CB 3.86Å; Y432-M444 HydrophobicContact CD2-CB 4.32Å; Y432-R445 HydrophobicContact CE2-CG 3.97Å; Y432-T824 WeakPolarHBondContact CE1-OG1 3.39Å; Y432-T824 VanDerWaalsContact CZ-OG1 3.27Å; Y432-T824 WeakPolarHBondContact OH-CB 3.45Å; Y432-T824 WeakPolarHBondContact OH-CG2 3.35Å; Y432-T824 PolarHBondContact OH-OG1 2.87Å; Y432-L825 HydrophobicContact CD1-CD2 3.76Å; Y432-L825 HydrophobicContact CD1-CG 4.15Å; Y432-L825 HydrophobicContact CE1-CD2 4.4Å; Y432-L825 HydrophobicContact CE1-CG 4.31Å
433	I	79.6	Confident	80.8	Confident	26 Å²	26	65.8 Å²	65.8	13%	0.133	35%	0.353	C	S	.	.	H	α-helix	trans	-71.6	-42.7	179.3	-66.9	166.1	0	0	0	111.4	C429 L430 I431 L825 I832	C429-I433 VanDerWaalsContact O-CG1 3.32Å; C429-I433 WeakPolarHBondContact O-CG1 3.24Å; C429-I433 PolarHBondContact O-N 3.38Å; C429-I433 VanDerWaalsContact O-N 3.11Å; L430-I433 PolarHBondContact O-N 3.33Å; L430-I433 VanDerWaalsContact O-N 3.16Å; I431-I433 VanDerWaalsContact C-N 3.33Å; I431-I433 PolarHBondContact O-N 2.65Å; I433-L825 HydrophobicContact CD1-CD1 4.42Å; I433-L825 HydrophobicContact CD1-CD2 4.33Å; I433-L825 HydrophobicContact CG1-CD1 4.25Å; I433-L825 HydrophobicContact CG1-CD2 4.18Å; I433-I832 HydrophobicContact CD1-CG2 4.44Å
434	I	81.6	Confident	80.6	Confident	126 Å²	126	62 Å²	62	65%	0.646	33%	0.328	S	S	*	.	H	α-helix	trans	-83.3	-43.3	-174.8	-57.8	169.7	0	0	0	111.7	L430 P436	L430-I434 WeakPolarHBondContact O-CG1 3.45Å; L430-I434 PolarHBondContact O-N 2.85Å; I434-P436 WeakPolarHBondContact O-CD 3.31Å
435	L	80.5	Confident	80.3	Confident	99 Å²	99	62.8 Å²	62.8	52%	0.518	33%	0.325	S	S	.	.			trans	-126.8	75.1	-171.4	-68.2	169.6	0	0	0	111.2	I431 T437 S438 A441	I431-L435 CarbonylContact O-C 3.57Å; I431-L435 WeakPolarHBondContact O-CA 3.41Å; I431-L435 PolarHBondContact O-N 3.39Å; L435-T437 PolarHBondContact O-N 3.29Å; L435-T437 VanDerWaalsContact O-N 3.13Å; L435-S438 PolarHBondContact O-N 3.23Å; L435-S438 PolarHBondContact O-OG 3.21Å; L435-A441 WeakPolarHBondContact O-CB 3.3Å
436	P	74.6	Confident	80.2	Confident	58 Å²	58	62.8 Å²	62.8	38%	0.377	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.8	-177	25.4	-34.4	0	0	0	113.1	I434 A441 R445	I434-P436 WeakPolarHBondContact O-CD 3.31Å; P436-A441 VanDerWaalsContact O-CB 3.31Å; P436-A441 WeakPolarHBondContact O-CB 3.37Å; P436-R445 PolarHBondContact O-NH1 3.1Å; P436-R445 PolarHBondContact O-NH2 2.66Å
437	T	75.5	Confident	80.4	Confident	122 Å²	122	61.1 Å²	61.1	75%	0.748	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-8.4	-176.4	52	0	0	0	0	114	L435	L435-T437 PolarHBondContact O-N 3.29Å; L435-T437 VanDerWaalsContact O-N 3.13Å
438	S	81.4	Confident	80.4	Confident	32 Å²	32	57 Å²	57	22%	0.224	30%	0.295	C	S	.	.	S	Bend	trans	-63.2	154.9	-179	66	0	0	0	0	112.9	L435 I440 A441 R442	L435-S438 PolarHBondContact O-N 3.23Å; L435-S438 PolarHBondContact O-OG 3.21Å; S438-I440 PolarHBondContact O-N 3.4Å; S438-A441 PolarHBondContact O-N 3.43Å; S438-A441 VanDerWaalsContact O-N 3.1Å; S438-A441 VanDerWaalsContact OG-CB 3.24Å; S438-A441 WeakPolarHBondContact OG-CB 3.43Å; S438-A441 PolarHBondContact OG-N 3.34Å; S438-A441 VanDerWaalsContact OG-N 3.12Å; S438-R442 PolarHBondContact O-N 3.14Å
439	N	80.4	Confident	80.5	Confident	121 Å²	121	55 Å²	55	65%	0.647	29%	0.289	S	S	*	.	H	α-helix	trans	-59.1	-36.7	175.6	-67.8	-17.7	0	0	0	111.7	R442 S443	N439-R442 PolarHBondContact O-N 3.47Å; N439-S443 PolarHBondContact O-N 3.07Å
440	I	80.4	Confident	80.7	Confident	76 Å²	76	55.4 Å²	55.4	39%	0.39	29%	0.291	S	S	.	.	H	α-helix	trans	-63.5	-45.6	175	-60.5	172	0	0	0	110.2	F428 I431 S438 R442 S443 M444	F428-I440 HydrophobicContact CD1-CG2 3.93Å; F428-I440 HydrophobicContact CE1-CG2 4.46Å; I431-I440 HydrophobicContact CD1-CD1 4.43Å; I431-I440 HydrophobicContact CG2-CB 4.45Å; I431-I440 HydrophobicContact CG2-CG2 4.46Å; S438-I440 PolarHBondContact O-N 3.4Å; I440-R442 VanDerWaalsContact C-N 3.31Å; I440-R442 PolarHBondContact O-N 2.75Å; I440-S443 WeakPolarHBondContact O-CB 2.76Å; I440-S443 PolarHBondContact O-N 2.94Å; I440-S443 VanDerWaalsContact O-N 3.13Å; I440-M444 PolarHBondContact O-N 3.4Å
441	A	77.2	Confident	81	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-64.5	-34.7	176	0	0	0	0	0	112.3	Y432 L435 P436 S438 M444 R445	Y432-A441 HydrophobicContact CD2-CB 3.86Å; L435-A441 WeakPolarHBondContact O-CB 3.3Å; P436-A441 VanDerWaalsContact O-CB 3.31Å; P436-A441 WeakPolarHBondContact O-CB 3.37Å; S438-A441 PolarHBondContact O-N 3.43Å; S438-A441 VanDerWaalsContact O-N 3.1Å; S438-A441 VanDerWaalsContact OG-CB 3.24Å; S438-A441 WeakPolarHBondContact OG-CB 3.43Å; S438-A441 PolarHBondContact OG-N 3.34Å; S438-A441 VanDerWaalsContact OG-N 3.12Å; A441-M444 PolarHBondContact O-N 3.3Å; A441-R445 WeakPolarHBondContact O-CG 3.38Å; A441-R445 PolarHBondContact O-N 3.3Å; A441-R445 PolarHBondContact O-NH1 2.96Å
442	R	77.5	Confident	81.2	Confident	128 Å²	128	52.2 Å²	52.2	48%	0.483	28%	0.28	S	S	.	.	H	α-helix	trans	-66.1	-40	171.1	-171.9	179.8	-79.1	160.3	-0.6	111.6	E402 S438 N439 I440 R445	E402-R442 HydrophobicContact CG-CG 4.39Å; S438-R442 PolarHBondContact O-N 3.14Å; N439-R442 PolarHBondContact O-N 3.47Å; I440-R442 VanDerWaalsContact C-N 3.31Å; I440-R442 PolarHBondContact O-N 2.75Å; R442-R445 PolarHBondContact O-N 3.24Å
443	S	79.7	Confident	81.5	Confident	39 Å²	39	51.6 Å²	51.6	27%	0.273	28%	0.279	S	S	.	.	H	α-helix	trans	-62.5	-41.6	174.2	-170.4	0	0	0	0	112	N439 I440 R445 C446 A449	N439-S443 PolarHBondContact O-N 3.07Å; I440-S443 WeakPolarHBondContact O-CB 2.76Å; I440-S443 PolarHBondContact O-N 2.94Å; I440-S443 VanDerWaalsContact O-N 3.13Å; S443-R445 VanDerWaalsContact C-N 3.27Å; S443-R445 PolarHBondContact O-N 2.99Å; S443-C446 WeakPolarHBondContact O-CB 3.49Å; S443-C446 PolarHBondContact O-N 3.09Å; S443-C446 VanDerWaalsContact O-N 3.12Å; S443-A449 WeakPolarHBondContact O-CB 3.36Å
444	M	78.7	Confident	81.9	Confident	13 Å²	13	52.1 Å²	52.1	6%	0.064	28%	0.281	C	S	.	.	H	α-helix	trans	-68.2	-21.8	177.1	-73.9	-170.1	73.7	0	0	113.9	F428 Y432 I440 A441 C446 K450 T453	F428-M444 HydrophobicContact CB-CE 4.45Å; F428-M444 HydrophobicContact CB-SD 3.74Å; F428-M444 VanDerWaalsContact O-SD 3.38Å; Y432-M444 HydrophobicContact CD2-CB 4.32Å; I440-M444 PolarHBondContact O-N 3.4Å; A441-M444 PolarHBondContact O-N 3.3Å; M444-C446 PolarHBondContact O-N 3.47Å; M444-K450 WeakPolarHBondContact O-CG 3.39Å; M444-T453 HydrophobicContact CE-CG2 4.32Å
445	R	79.1	Confident	82.2	Confident	96 Å²	96	46.8 Å²	46.8	36%	0.362	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-16.2	172.6	-71.3	179.7	-171.9	102.4	-2.9	113	Y432 P436 A441 R442 S443 K450	Y432-R445 HydrophobicContact CE2-CG 3.97Å; P436-R445 PolarHBondContact O-NH1 3.1Å; P436-R445 PolarHBondContact O-NH2 2.66Å; A441-R445 WeakPolarHBondContact O-CG 3.38Å; A441-R445 PolarHBondContact O-N 3.3Å; A441-R445 PolarHBondContact O-NH1 2.96Å; R442-R445 PolarHBondContact O-N 3.24Å; S443-R445 VanDerWaalsContact C-N 3.27Å; S443-R445 PolarHBondContact O-N 2.99Å; R445-K450 WeakPolarHBondContact O-CE 3.39Å
446	C	80	Confident	82.6	Confident	12 Å²	12	42.7 Å²	42.7	8%	0.081	23%	0.234	C	C	.	.	S	Bend	trans	-63.8	134.5	176.6	-175.3	0	0	0	0	110.3	W398 Y399 T403 S443 M444 A448 A449 K450	W398-C446 PolarHBondContact O-SG 2.93Å; Y399-C446 PolarHBondContact O-SG 3.29Å; T403-C446 HydrophobicContact CG2-CB 4.14Å; S443-C446 WeakPolarHBondContact O-CB 3.49Å; S443-C446 PolarHBondContact O-N 3.09Å; S443-C446 VanDerWaalsContact O-N 3.12Å; M444-C446 PolarHBondContact O-N 3.47Å; C446-A448 VanDerWaalsContact C-N 3.32Å; C446-A448 PolarHBondContact O-N 3.26Å; C446-A449 HydrophobicContact CB-CB 4.25Å; C446-A449 PolarHBondContact O-N 3.41Å; C446-A449 VanDerWaalsContact O-N 3.07Å; C446-K450 PolarHBondContact O-N 3.32Å
447	P	86.2	Confident	83.4	Confident	16 Å²	16	40.1 Å²	40.1	10%	0.104	22%	0.217	C	C	.	.	H	α-helix	trans	-54.8	-42.8	-178.2	-26.8	35	0	0	0	113.7	W398 A449 K450 F451 I819	W398-P447 HydrophobicContact CD2-CB 4.25Å; W398-P447 HydrophobicContact CE3-CB 3.57Å; W398-P447 HydrophobicContact CZ3-CB 3.74Å; P447-A449 VanDerWaalsContact C-N 3.33Å; P447-A449 PolarHBondContact O-N 2.97Å; P447-K450 WeakPolarHBondContact O-CB 3.42Å; P447-K450 PolarHBondContact O-N 3.45Å; P447-F451 PolarHBondContact O-N 3.45Å; P447-I819 HydrophobicContact CB-CG1 3.99Å; P447-I819 HydrophobicContact CG-CB 4.48Å; P447-I819 HydrophobicContact CG-CG1 3.83Å
448	A	85.9	Confident	84	Confident	9 Å²	9	35.4 Å²	35.4	7%	0.074	19%	0.186	C	C	.	.	H	α-helix	trans	-59.6	-41.6	176.6	0	0	0	0	0	112.8	W398 Y399 C446 A452	W398-A448 HydrophobicContact CD2-CB 4.47Å; W398-A448 HydrophobicContact CG-CB 4.35Å; W398-A448 VanDerWaalsContact O-CB 3.26Å; W398-A448 WeakPolarHBondContact O-CB 3.18Å; W398-A448 PolarHBondContact O-N 2.98Å; Y399-A448 HydrophobicContact CD1-CB 4.19Å; C446-A448 VanDerWaalsContact C-N 3.32Å; C446-A448 PolarHBondContact O-N 3.26Å; A448-A452 WeakPolarHBondContact O-CB 3.49Å; A448-A452 PolarHBondContact O-N 3Å
449	A	83.9	Confident	84.5	Confident	17 Å²	17	38.2 Å²	38.2	14%	0.14	20%	0.195	C	C	.	.	H	α-helix	trans	-69.3	-43.2	177.8	0	0	0	0	0	111.3	S443 C446 P447 F451 A452 T453	S443-A449 WeakPolarHBondContact O-CB 3.36Å; C446-A449 HydrophobicContact CB-CB 4.25Å; C446-A449 PolarHBondContact O-N 3.41Å; C446-A449 VanDerWaalsContact O-N 3.07Å; P447-A449 VanDerWaalsContact C-N 3.33Å; P447-A449 PolarHBondContact O-N 2.97Å; A449-F451 PolarHBondContact O-N 3.37Å; A449-A452 PolarHBondContact O-N 2.96Å; A449-T453 VanDerWaalsContact O-CG2 3.29Å; A449-T453 WeakPolarHBondContact O-CG2 3.29Å; A449-T453 PolarHBondContact O-N 3.28Å; A449-T453 PolarHBondContact O-OG1 2.93Å
450	K	86.6	Confident	84.9	Confident	9 Å²	9	35.2 Å²	35.2	4%	0.039	18%	0.178	C	C	.	.	H	α-helix	trans	-53.7	-53.9	172.7	-65.8	179.4	-170	169.8	0	110.2	M444 R445 C446 P447 A452 T453 H454 Y818 T824	M444-K450 WeakPolarHBondContact O-CG 3.39Å; R445-K450 WeakPolarHBondContact O-CE 3.39Å; C446-K450 PolarHBondContact O-N 3.32Å; P447-K450 WeakPolarHBondContact O-CB 3.42Å; P447-K450 PolarHBondContact O-N 3.45Å; K450-A452 PolarHBondContact O-N 2.71Å; K450-T453 PolarHBondContact O-N 2.89Å; K450-T453 PolarHBondContact O-OG1 3.27Å; K450-H454 PolarHBondContact O-CD2 3.16Å; K450-H454 PolarHBondContact O-N 3.45Å; K450-Y818 HydrophobicContact CB-CD1 4.14Å; K450-Y818 WeakPolarHBondContact CD-O 3.45Å; K450-Y818 PolarHBondContact NZ-O 3.3Å; K450-T824 HydrophobicContact CD-CG2 4.4Å
451	F	88.6	Confident	85.4	Confident	26 Å²	26	31.7 Å²	31.7	11%	0.114	16%	0.16	C	C	.	.	H	α-helix	trans	-56.2	-50.8	179.1	175.5	-106.4	0	0	0	112	W398 P447 A449 T453 H454 V455 L646 A649 L814 Y818	W398-F451 HydrophobicContact CH2-CB 3.62Å; W398-F451 HydrophobicContact CH2-CD2 4.47Å; W398-F451 AromaticContact CH2-CG 3.99Å; W398-F451 HydrophobicContact CH2-CG 3.99Å; W398-F451 HydrophobicContact CZ2-CB 3.59Å; W398-F451 AromaticContact CZ2-CD1 3.97Å; W398-F451 HydrophobicContact CZ2-CD1 3.97Å; W398-F451 AromaticContact CZ2-CG 3.81Å; W398-F451 HydrophobicContact CZ2-CG 3.81Å; P447-F451 PolarHBondContact O-N 3.45Å; A449-F451 PolarHBondContact O-N 3.37Å; F451-T453 VanDerWaalsContact C-N 3.32Å; F451-T453 PolarHBondContact O-N 2.96Å; F451-H454 PolarHBondContact O-N 3.4Å; F451-V455 HydrophobicContact CD1-CG2 4.23Å; F451-V455 HydrophobicContact CD2-CG2 4.08Å; F451-V455 HydrophobicContact CE1-CG2 3.84Å; F451-V455 HydrophobicContact CE2-CG2 3.68Å; F451-V455 HydrophobicContact CG-CG2 4.35Å; F451-V455 HydrophobicContact CZ-CG2 3.55Å; F451-V455 VanDerWaalsContact O-CG2 3.29Å; F451-V455 WeakPolarHBondContact O-CG2 3.41Å; F451-V455 PolarHBondContact O-N 2.92Å; F451-L646 HydrophobicContact CE2-CD2 4Å; F451-L646 HydrophobicContact CZ-CD2 4.34Å; F451-A649 HydrophobicContact CE1-CB 3.92Å; F451-A649 HydrophobicContact CE2-CB 4.33Å; F451-A649 HydrophobicContact CZ-CB 3.45Å; F451-A649 VanDerWaalsContact CZ-CB 3.45Å; F451-L814 HydrophobicContact CE2-CD2 4.1Å; F451-L814 HydrophobicContact CZ-CD2 4.49Å; F451-Y818 HydrophobicContact CB-CD1 4.37Å; F451-Y818 HydrophobicContact CB-CD2 4.36Å; F451-Y818 HydrophobicContact CB-CE1 4.43Å; F451-Y818 HydrophobicContact CB-CE2 4.45Å; F451-Y818 HydrophobicContact CB-CG 4.34Å; F451-Y818 HydrophobicContact CD2-CD2 4.12Å; F451-Y818 HydrophobicContact CD2-CE1 4.4Å; F451-Y818 AromaticContact CD2-CE2 3.52Å; F451-Y818 HydrophobicContact CD2-CE2 3.52Å; F451-Y818 AromaticContact CD2-CZ 3.67Å; F451-Y818 HydrophobicContact CE2-CE2 4.27Å; F451-Y818 HydrophobicContact CG-CE2 4.44Å
452	A	86.9	Confident	86.1	Confident	40 Å²	40	32.1 Å²	32.1	33%	0.331	16%	0.163	S	C	.	.	H	α-helix	trans	-58	-43.5	179.4	0	0	0	0	0	112.2	A448 A449 K450 V455 V456	A448-A452 WeakPolarHBondContact O-CB 3.49Å; A448-A452 PolarHBondContact O-N 3Å; A449-A452 PolarHBondContact O-N 2.96Å; K450-A452 PolarHBondContact O-N 2.71Å; A452-V455 PolarHBondContact O-N 3.2Å; A452-V456 VanDerWaalsContact O-CG2 3.3Å; A452-V456 WeakPolarHBondContact O-CG2 3.32Å; A452-V456 PolarHBondContact O-N 3.48Å
453	T	86.6	Confident	86.7	Confident	19 Å²	19	31.2 Å²	31.2	12%	0.117	17%	0.166	C	C	.	.	H	α-helix	trans	-66.6	-38.1	178.8	59.1	0	0	0	0	113.2	L425 M444 A449 K450 F451 S457	L425-T453 HydrophobicContact CD1-CG2 3.69Å; M444-T453 HydrophobicContact CE-CG2 4.32Å; A449-T453 VanDerWaalsContact O-CG2 3.29Å; A449-T453 WeakPolarHBondContact O-CG2 3.29Å; A449-T453 PolarHBondContact O-N 3.28Å; A449-T453 PolarHBondContact O-OG1 2.93Å; K450-T453 PolarHBondContact O-N 2.89Å; K450-T453 PolarHBondContact O-OG1 3.27Å; F451-T453 VanDerWaalsContact C-N 3.32Å; F451-T453 PolarHBondContact O-N 2.96Å; T453-S457 WeakPolarHBondContact O-CB 3.5Å; T453-S457 PolarHBondContact O-N 3.29Å
454	H	87.8	Confident	87.1	Confident	36 Å²	36	31.2 Å²	31.2	17%	0.167	16%	0.163	C	C	.	.	H	α-helix	trans	-66.4	-39.7	173.5	-82.9	-77.7	0	0	0	112.1	K450 F451 S457 H458 Y818 S823 L825	K450-H454 PolarHBondContact O-CD2 3.16Å; K450-H454 PolarHBondContact O-N 3.45Å; F451-H454 PolarHBondContact O-N 3.4Å; H454-S457 WeakPolarHBondContact O-CB 3.5Å; H454-S457 PolarHBondContact O-N 3.43Å; H454-H458 PolarHBondContact O-N 2.99Å; H454-Y818 HydrophobicContact CB-CE1 4.31Å; H454-Y818 AromaticContact CD2-CE1 3.82Å; H454-S823 PolarHBondContact NE2-O 3.44Å; H454-L825 PolarHBondContact CE1-O 3.47Å
455	V	89.1	Confident	87.7	Confident	15 Å²	15	30.6 Å²	30.6	9%	0.091	16%	0.16	C	C	.	.	H	α-helix	trans	-64.2	-47.8	176.1	170.3	0	0	0	0	111.4	F451 A452 S457 H458 F459 L646	F451-V455 HydrophobicContact CD1-CG2 4.23Å; F451-V455 HydrophobicContact CD2-CG2 4.08Å; F451-V455 HydrophobicContact CE1-CG2 3.84Å; F451-V455 HydrophobicContact CE2-CG2 3.68Å; F451-V455 HydrophobicContact CG-CG2 4.35Å; F451-V455 HydrophobicContact CZ-CG2 3.55Å; F451-V455 VanDerWaalsContact O-CG2 3.29Å; F451-V455 WeakPolarHBondContact O-CG2 3.41Å; F451-V455 PolarHBondContact O-N 2.92Å; A452-V455 PolarHBondContact O-N 3.2Å; V455-S457 VanDerWaalsContact C-N 3.3Å; V455-S457 PolarHBondContact O-N 3.5Å; V455-H458 PolarHBondContact O-N 3.25Å; V455-H458 VanDerWaalsContact O-N 3.17Å; V455-F459 HydrophobicContact CG1-CD2 3.68Å; V455-F459 HydrophobicContact CG1-CE2 3.57Å; V455-F459 VanDerWaalsContact O-CD2 3.29Å; V455-F459 WeakPolarHBondContact O-CD2 3.42Å; V455-F459 PolarHBondContact O-N 2.89Å; V455-L646 HydrophobicContact CG1-CD1 4.16Å; V455-L646 HydrophobicContact CG2-CD1 4.07Å; V455-L646 HydrophobicContact CG2-CD2 3.77Å
456	V	89.5	Confident	88.1	Confident	13 Å²	13	27.3 Å²	27.3	8%	0.079	15%	0.153	C	C	.	.	H	α-helix	trans	-60.3	-43.2	177.2	171.7	0	0	0	0	110.8	S418 T422 L425 A452 H458 F459 L460	S418-V456 WeakPolarHBondContact OG-CG2 3.42Å; T422-V456 HydrophobicContact CG2-CG1 3.88Å; T422-V456 WeakPolarHBondContact OG1-CG1 3.37Å; L425-V456 HydrophobicContact CD2-CG1 4.1Å; A452-V456 VanDerWaalsContact O-CG2 3.3Å; A452-V456 WeakPolarHBondContact O-CG2 3.32Å; A452-V456 PolarHBondContact O-N 3.48Å; V456-H458 PolarHBondContact O-N 3Å; V456-F459 PolarHBondContact O-N 3.14Å; V456-L460 HydrophobicContact CG1-CD1 4.2Å; V456-L460 HydrophobicContact CG1-CG 4.47Å; V456-L460 WeakPolarHBondContact O-CB 3.04Å; V456-L460 WeakPolarHBondContact O-CG 3.48Å; V456-L460 PolarHBondContact O-N 3.04Å
457	S	89.7	Confident	88.3	Confident	4 Å²	4	29.1 Å²	29.1	3%	0.028	17%	0.169	C	C	.	.	H	α-helix	trans	-57.3	-47.5	173.3	158.7	0	0	0	0	112	T453 H454 V455 F459 L460 F461 W518 V827	T453-S457 WeakPolarHBondContact O-CB 3.5Å; T453-S457 PolarHBondContact O-N 3.29Å; H454-S457 WeakPolarHBondContact O-CB 3.5Å; H454-S457 PolarHBondContact O-N 3.43Å; V455-S457 VanDerWaalsContact C-N 3.3Å; V455-S457 PolarHBondContact O-N 3.5Å; S457-F459 PolarHBondContact O-N 3.3Å; S457-L460 PolarHBondContact O-N 3.2Å; S457-F461 PolarHBondContact O-N 3.5Å; S457-W518 WeakPolarHBondContact O-CZ2 3.18Å; S457-W518 WeakPolarHBondContact OG-CZ2 3.3Å; S457-V827 WeakPolarHBondContact CB-O 3.15Å; S457-V827 PolarHBondContact OG-O 3.38Å
458	H	89.5	Confident	88.1	Confident	23 Å²	23	29.3 Å²	29.3	11%	0.106	17%	0.172	C	C	.	.	H	α-helix	trans	-61.7	-43.2	178.7	-175	56.3	0	0	0	112.7	H454 V455 V456 F461 L462	H454-H458 PolarHBondContact O-N 2.99Å; V455-H458 PolarHBondContact O-N 3.25Å; V455-H458 VanDerWaalsContact O-N 3.17Å; V456-H458 PolarHBondContact O-N 3Å; H458-F461 WeakPolarHBondContact O-CB 3.32Å; H458-F461 PolarHBondContact O-N 3.35Å; H458-L462 WeakPolarHBondContact O-CG 3.5Å; H458-L462 PolarHBondContact O-N 3Å
459	F	90.4	Very high	87.8	Confident	90 Å²	90	32.1 Å²	32.1	40%	0.395	19%	0.188	S	C	.	.	H	α-helix	trans	-65.9	-38.3	175.9	-79.3	-66.6	0	0	0	112.8	V455 V456 S457 F461 L462 I463 T643 L646	V455-F459 HydrophobicContact CG1-CD2 3.68Å; V455-F459 HydrophobicContact CG1-CE2 3.57Å; V455-F459 VanDerWaalsContact O-CD2 3.29Å; V455-F459 WeakPolarHBondContact O-CD2 3.42Å; V455-F459 PolarHBondContact O-N 2.89Å; V456-F459 PolarHBondContact O-N 3.14Å; S457-F459 PolarHBondContact O-N 3.3Å; F459-F461 VanDerWaalsContact C-N 3.29Å; F459-F461 PolarHBondContact O-N 2.91Å; F459-L462 HydrophobicContact CD1-CD1 4.46Å; F459-L462 PolarHBondContact O-N 3.22Å; F459-I463 VanDerWaalsContact O-CG1 3.27Å; F459-I463 WeakPolarHBondContact O-CG1 3.42Å; F459-I463 PolarHBondContact O-N 2.99Å; F459-T643 HydrophobicContact CE1-CG2 4.16Å; F459-T643 HydrophobicContact CZ-CG2 4.11Å; F459-L646 HydrophobicContact CE2-CD1 4.31Å
460	L	90.1	Very high	87.4	Confident	58 Å²	58	38 Å²	38	30%	0.304	21%	0.211	S	C	.	.	H	α-helix	trans	-60.9	-39.1	172.7	-77.4	176.1	0	0	0	112.1	T422 L425 V456 S457 I463 L464 W518	T422-L460 HydrophobicContact CG2-CD1 3.79Å; T422-L460 HydrophobicContact CG2-CD2 3.61Å; T422-L460 HydrophobicContact CG2-CG 3.88Å; L425-L460 HydrophobicContact CD2-CD1 4.46Å; V456-L460 HydrophobicContact CG1-CD1 4.2Å; V456-L460 HydrophobicContact CG1-CG 4.47Å; V456-L460 WeakPolarHBondContact O-CB 3.04Å; V456-L460 WeakPolarHBondContact O-CG 3.48Å; V456-L460 PolarHBondContact O-N 3.04Å; S457-L460 PolarHBondContact O-N 3.2Å; L460-I463 PolarHBondContact O-N 2.99Å; L460-L464 WeakPolarHBondContact O-CB 3.1Å; L460-L464 PolarHBondContact O-N 3.26Å; L460-W518 HydrophobicContact CB-CH2 3.91Å; L460-W518 HydrophobicContact CB-CZ2 4.36Å
461	F	91.1	Very high	86.4	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.009	24%	0.242	C	C	.	.	H	α-helix	trans	-62	-45.4	173.9	176.1	-114	0	0	0	112.1	S457 H458 F459 L464 L465 I515 W518 L522 Y554 S639	S457-F461 PolarHBondContact O-N 3.5Å; H458-F461 WeakPolarHBondContact O-CB 3.32Å; H458-F461 PolarHBondContact O-N 3.35Å; F459-F461 VanDerWaalsContact C-N 3.29Å; F459-F461 PolarHBondContact O-N 2.91Å; F461-L464 WeakPolarHBondContact O-CB 3.33Å; F461-L464 PolarHBondContact O-N 2.91Å; F461-L465 HydrophobicContact CD1-CD1 4.11Å; F461-L465 HydrophobicContact CE1-CD1 3.62Å; F461-L465 HydrophobicContact CE1-CG 4.37Å; F461-L465 HydrophobicContact CE2-CD1 4.32Å; F461-L465 HydrophobicContact CE2-CD2 4.3Å; F461-L465 HydrophobicContact CE2-CG 4.24Å; F461-L465 HydrophobicContact CZ-CD1 3.73Å; F461-L465 HydrophobicContact CZ-CD2 4.25Å; F461-L465 HydrophobicContact CZ-CG 4.13Å; F461-L465 WeakPolarHBondContact O-CG 3.48Å; F461-L465 PolarHBondContact O-N 3.45Å; F461-I515 HydrophobicContact CE2-CG2 4.23Å; F461-W518 HydrophobicContact CB-CD2 4.18Å; F461-W518 HydrophobicContact CB-CG 4.35Å; F461-W518 HydrophobicContact CB-CZ2 4.13Å; F461-W518 HydrophobicContact CD2-CB 3.83Å; F461-W518 AromaticContact CD2-CD1 3.49Å; F461-W518 VanDerWaalsContact CD2-CD1 3.49Å; F461-W518 HydrophobicContact CD2-CD2 4Å; F461-W518 AromaticContact CD2-CG 3.49Å; F461-W518 HydrophobicContact CD2-CG 3.49Å; F461-W518 VanDerWaalsContact CD2-CG 3.49Å; F461-W518 HydrophobicContact CE2-CB 4Å; F461-W518 HydrophobicContact CE2-CG 4.11Å; F461-W518 AromaticContact CG-CD1 3.8Å; F461-W518 HydrophobicContact CG-CG 4.19Å; F461-W518 AromaticContact CG-NE1 3.96Å; F461-L522 HydrophobicContact CE1-CD1 4.43Å; F461-L522 HydrophobicContact CZ-CD1 4.48Å; F461-Y554 HydrophobicContact CZ-CE2 4.12Å; F461-S639 WeakPolarHBondContact CE1-OG 2.99Å
462	L	91.7	Very high	84.9	Confident	10 Å²	10	50.9 Å²	50.9	5%	0.052	27%	0.267	C	S	.	.	H	α-helix	trans	-64.7	-39.9	177	-65.2	179.2	0	0	0	112.5	H458 F459 L464 L465 A466 F640 T643	H458-L462 WeakPolarHBondContact O-CG 3.5Å; H458-L462 PolarHBondContact O-N 3Å; F459-L462 HydrophobicContact CD1-CD1 4.46Å; F459-L462 PolarHBondContact O-N 3.22Å; L462-L464 VanDerWaalsContact C-N 3.32Å; L462-L464 PolarHBondContact O-N 3.31Å; L462-L465 HydrophobicContact CD2-CD1 4.38Å; L462-L465 PolarHBondContact O-N 3.47Å; L462-A466 PolarHBondContact O-N 3.47Å; L462-F640 HydrophobicContact CB-CD1 4.47Å; L462-F640 HydrophobicContact CB-CE1 3.9Å; L462-F640 HydrophobicContact CB-CZ 4.39Å; L462-F640 HydrophobicContact CD1-CD1 4.12Å; L462-F640 HydrophobicContact CD1-CE1 4.32Å; L462-F640 HydrophobicContact CD2-CD1 3.93Å; L462-F640 HydrophobicContact CD2-CE1 4.04Å; L462-F640 HydrophobicContact CD2-CG 4.23Å; L462-F640 HydrophobicContact CD2-CZ 4.41Å; L462-F640 HydrophobicContact CG-CD1 4.4Å; L462-F640 HydrophobicContact CG-CE1 4.3Å; L462-T643 WeakPolarHBondContact CD1-OG1 3.38Å
463	I	89.7	Confident	83.1	Confident	108 Å²	108	56.5 Å²	56.5	55%	0.554	29%	0.286	S	S	*	.	H	α-helix	trans	-63	-40.7	174.2	-68.3	164.6	0	0	0	110.4	F459 L460 A466 A467	F459-I463 VanDerWaalsContact O-CG1 3.27Å; F459-I463 WeakPolarHBondContact O-CG1 3.42Å; F459-I463 PolarHBondContact O-N 2.99Å; L460-I463 PolarHBondContact O-N 2.99Å; I463-A466 PolarHBondContact O-N 3.33Å; I463-A467 WeakPolarHBondContact O-CB 3.38Å; I463-A467 PolarHBondContact O-N 3.37Å
464	L	89.2	Confident	81.2	Confident	39 Å²	39	63.9 Å²	63.9	20%	0.204	32%	0.319	C	S	.	.	H	α-helix	trans	-64.3	-40.7	176.7	-173	69.1	0	0	0	111.9	L460 F461 L462 A467 A468 V511 C514 I515 W518	L460-L464 WeakPolarHBondContact O-CB 3.1Å; L460-L464 PolarHBondContact O-N 3.26Å; F461-L464 WeakPolarHBondContact O-CB 3.33Å; F461-L464 PolarHBondContact O-N 2.91Å; L462-L464 VanDerWaalsContact C-N 3.32Å; L462-L464 PolarHBondContact O-N 3.31Å; L464-A467 PolarHBondContact O-N 3.47Å; L464-A468 WeakPolarHBondContact O-CB 3.36Å; L464-A468 PolarHBondContact O-N 3.18Å; L464-V511 HydrophobicContact CD1-CG1 3.88Å; L464-V511 HydrophobicContact CG-CG1 4.34Å; L464-C514 HydrophobicContact CD2-CB 3.97Å; L464-I515 HydrophobicContact CD2-CG1 3.69Å; L464-I515 HydrophobicContact CG-CG1 3.95Å; L464-W518 HydrophobicContact CD2-CE3 4.45Å
465	L	90.5	Very high	79.3	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.005	35%	0.347	C	S	.	.	H	α-helix	trans	-62.6	-45.3	173.9	-70.3	176.8	0	0	0	111.6	F461 L462 A468 T469 I515 Y554 F632	F461-L465 HydrophobicContact CD1-CD1 4.11Å; F461-L465 HydrophobicContact CE1-CD1 3.62Å; F461-L465 HydrophobicContact CE1-CG 4.37Å; F461-L465 HydrophobicContact CE2-CD1 4.32Å; F461-L465 HydrophobicContact CE2-CD2 4.3Å; F461-L465 HydrophobicContact CE2-CG 4.24Å; F461-L465 HydrophobicContact CZ-CD1 3.73Å; F461-L465 HydrophobicContact CZ-CD2 4.25Å; F461-L465 HydrophobicContact CZ-CG 4.13Å; F461-L465 WeakPolarHBondContact O-CG 3.48Å; F461-L465 PolarHBondContact O-N 3.45Å; L462-L465 HydrophobicContact CD2-CD1 4.38Å; L462-L465 PolarHBondContact O-N 3.47Å; L465-A468 WeakPolarHBondContact O-CB 3.32Å; L465-A468 PolarHBondContact O-N 3.4Å; L465-T469 PolarHBondContact O-N 2.78Å; L465-I515 HydrophobicContact CD2-CD1 4.05Å; L465-I515 HydrophobicContact CD2-CG1 4.35Å; L465-I515 HydrophobicContact CD2-CG2 4.1Å; L465-Y554 WeakPolarHBondContact CD1-OH 3.34Å; L465-F632 HydrophobicContact CD2-CE2 4.46Å; L465-F632 HydrophobicContact CD2-CZ 4.14Å
466	A	87.4	Confident	77	Confident	26 Å²	26	75.9 Å²	75.9	22%	0.215	37%	0.373	C	S	.	.	H	α-helix	trans	-64.5	-40.4	176.6	0	0	0	0	0	112.2	L462 I463 A468 T469 F470	L462-A466 PolarHBondContact O-N 3.47Å; I463-A466 PolarHBondContact O-N 3.33Å; A466-A468 VanDerWaalsContact C-N 3.27Å; A466-A468 PolarHBondContact O-N 2.66Å; A466-T469 PolarHBondContact O-N 2.88Å; A466-T469 PolarHBondContact O-OG1 2.8Å; A466-F470 HydrophobicContact CB-CE2 4.26Å; A466-F470 WeakPolarHBondContact O-CD2 3.49Å; A466-F470 PolarHBondContact O-N 3Å
467	A	84.4	Confident	74.7	Confident	51 Å²	51	83.2 Å²	83.2	42%	0.421	41%	0.412	S	S	.	.	H	α-helix	trans	-63.7	-34.9	175.3	0	0	0	0	0	112	I463 L464 T469 R471	I463-A467 WeakPolarHBondContact O-CB 3.38Å; I463-A467 PolarHBondContact O-N 3.37Å; L464-A467 PolarHBondContact O-N 3.47Å; A467-T469 VanDerWaalsContact C-N 3.32Å; A467-R471 PolarHBondContact O-N 2.88Å
468	A	80.8	Confident	72.4	Confident	20 Å²	20	87 Å²	87	17%	0.165	44%	0.443	C	S	.	.	H	α-helix	trans	-66.4	-32.6	175.2	0	0	0	0	0	112.5	L464 L465 A466 V511 I515	L464-A468 WeakPolarHBondContact O-CB 3.36Å; L464-A468 PolarHBondContact O-N 3.18Å; L465-A468 WeakPolarHBondContact O-CB 3.32Å; L465-A468 PolarHBondContact O-N 3.4Å; A466-A468 VanDerWaalsContact C-N 3.27Å; A466-A468 PolarHBondContact O-N 2.66Å; A468-V511 HydrophobicContact CB-CG1 3.91Å; A468-I515 HydrophobicContact CB-CD1 3.94Å
469	T	80.7	Confident	70.1	Confident	67 Å²	67	93 Å²	93	41%	0.411	48%	0.475	S	S	.	.	H	α-helix	trans	-75.7	-43.8	176.1	54.3	0	0	0	0	112.4	L465 A466 A467 R471 L472	L465-T469 PolarHBondContact O-N 2.78Å; A466-T469 PolarHBondContact O-N 2.88Å; A466-T469 PolarHBondContact O-OG1 2.8Å; A467-T469 VanDerWaalsContact C-N 3.32Å; T469-R471 VanDerWaalsContact C-N 3.29Å; T469-R471 PolarHBondContact O-N 3.1Å; T469-L472 PolarHBondContact O-N 2.9Å
470	F	74.1	Confident	67.8	Low	141 Å²	141	92 Å²	92	62%	0.618	47%	0.474	S	S	*	.	H	α-helix	trans	-67	-27.5	-177.7	-71.4	-60.5	0	0	0	113.8	A466 L472 E473	A466-F470 HydrophobicContact CB-CE2 4.26Å; A466-F470 WeakPolarHBondContact O-CD2 3.49Å; A466-F470 PolarHBondContact O-N 3Å; F470-L472 PolarHBondContact O-N 3.01Å; F470-L472 VanDerWaalsContact O-N 3.16Å; F470-E473 PolarHBondContact O-N 2.99Å
471	R	66.3	Low	65.7	Low	185 Å²	185	93.7 Å²	93.7	70%	0.698	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-14.9	178.5	-163.3	179	175.9	114.5	3.4	113.3	A467 T469	A467-R471 PolarHBondContact O-N 2.88Å; T469-R471 VanDerWaalsContact C-N 3.29Å; T469-R471 PolarHBondContact O-N 3.1Å
472	L	56.4	Low	63.7	Low	120 Å²	120	102.7 Å²	102.7	63%	0.628	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-19.3	-179.9	-76.3	153.5	0	0	0	113.5	T469 F470 E474	T469-L472 PolarHBondContact O-N 2.9Å; F470-L472 PolarHBondContact O-N 3.01Å; F470-L472 VanDerWaalsContact O-N 3.16Å; L472-E474 PolarHBondContact O-N 2.92Å
473	E	50.4	Low	61.4	Low	158 Å²	158	110.9 Å²	110.9	74%	0.738	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-76.5	-13.7	-174.2	-83.8	179.6	156.2	0	0	114.9	F470 N475	F470-E473 PolarHBondContact O-N 2.99Å; E473-N475 VanDerWaalsContact C-N 3.33Å; E473-N475 PolarHBondContact O-N 3.32Å
474	E	47.1	Very low	59	Low	175 Å²	175	109.9 Å²	109.9	82%	0.818	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-78.3	0.9	-175.7	-79.8	-175.5	160	0	0	115.9	L472	L472-E474 PolarHBondContact O-N 2.92Å
475	N	46.7	Very low	56.7	Low	141 Å²	141	116.8 Å²	116.8	75%	0.754	59%	0.593	S	S	*	*	G	3₁₀ helix	trans	-129.5	13	-169	-79.2	-30.3	0	0	0	118	E473	E473-N475 VanDerWaalsContact C-N 3.33Å; E473-N475 PolarHBondContact O-N 3.32Å
476	Y	42.4	Very low	54.4	Low	161 Å²	161	120 Å²	120	63%	0.631	63%	0.626	S	S	*	*			trans	-118.8	62.4	-177.8	-81.6	-81.5	0	0	0	114.1	A478	Y476-A478 PolarHBondContact O-N 2.87Å
477	D	39.4	Very low	52.3	Low	168 Å²	168	123.8 Å²	123.8	90%	0.898	65%	0.647	S	S	*	*			trans	-83.7	95.5	159.5	-88.3	-16	0	0	0	110	L479	D477-L479 PolarHBondContact O-N 3.43Å
478	A	41.3	Very low	50.7	Low	82 Å²	82	124.1 Å²	124.1	68%	0.678	66%	0.656	S	S	*	*			trans	-83.1	87.8	174.8	0	0	0	0	0	111.4	Y476	Y476-A478 PolarHBondContact O-N 2.87Å
479	L	41.5	Very low	49.6	Very low	149 Å²	149	128.1 Å²	128.1	78%	0.78	67%	0.674	S	S	*	*			trans	-164.8	39	163.7	-150.6	94.5	0	0	0	115.1	D477	D477-L479 PolarHBondContact O-N 3.43Å
480	L	42.9	Very low	48.4	Very low	71 Å²	71	128.5 Å²	128.5	37%	0.372	67%	0.671	S	S	.	*			trans	-143.4	16.1	-171.6	-104.4	166.8	0	0	0	117.1	M484	L480-M484 HydrophobicContact CD1-CE 3.81Å; L480-M484 HydrophobicContact CD2-CB 4.06Å; L480-M484 HydrophobicContact CD2-CE 3.13Å; L480-M484 HydrophobicContact CD2-CG 3.29Å; L480-M484 HydrophobicContact CD2-SD 3.51Å; L480-M484 VanDerWaalsContact CD2-SD 3.51Å; L480-M484 HydrophobicContact CG-CE 4Å
481	D	46.7	Very low	47.9	Very low	92 Å²	92	128.7 Å²	128.7	49%	0.492	67%	0.674	S	S	.	*	S	Bend	trans	-94.7	1.6	-179.7	-94.7	-40.4	0	0	0	115.3	K499	D481-K499 IonicContact OD2-NZ 3.16Å; D481-K499 PolarHBondContact OD2-NZ 3.47Å
482	E	48.9	Very low	47.6	Very low	191 Å²	191	121.7 Å²	121.7	89%	0.893	65%	0.652	S	S	*	*	S	Bend	trans	-126.8	-4.5	-178.1	-122.5	177.9	162.8	0	0	115.6
483	Q	41.7	Very low	47.8	Very low	183 Å²	183	117.2 Å²	117.2	86%	0.855	63%	0.629	S	S	*	*	S	Bend	trans	-130.7	10.6	-174.1	-89.2	-176.9	-28.4	0	0	116.9
484	M	40.1	Very low	48.5	Very low	87 Å²	87	115.3 Å²	115.3	43%	0.429	62%	0.615	S	S	.	*			trans	-117.8	36.1	179.9	-76.2	-148.1	-56.4	0	0	116.2	L480 G486 T492	L480-M484 HydrophobicContact CD1-CE 3.81Å; L480-M484 HydrophobicContact CD2-CB 4.06Å; L480-M484 HydrophobicContact CD2-CE 3.13Å; L480-M484 HydrophobicContact CD2-CG 3.29Å; L480-M484 HydrophobicContact CD2-SD 3.51Å; L480-M484 VanDerWaalsContact CD2-SD 3.51Å; L480-M484 HydrophobicContact CG-CE 4Å; M484-G486 VanDerWaalsContact C-N 3.3Å; M484-G486 PolarHBondContact O-N 3.35Å; M484-G486 VanDerWaalsContact O-N 3.08Å; M484-T492 HydrophobicContact CE-CG2 4.05Å
485	L	40.4	Very low	49.2	Very low	183 Å²	183	112.3 Å²	112.3	96%	0.958	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	87.1	151.3	-86.9	122.5	0	0	0	108.6
486	G	43.4	Very low	50	Low	68 Å²	68	108 Å²	108	70%	0.701	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	171.7	-14.8	169.9	0	0	0	0	0	122.1	M484	M484-G486 VanDerWaalsContact C-N 3.3Å; M484-G486 PolarHBondContact O-N 3.35Å; M484-G486 VanDerWaalsContact O-N 3.08Å
487	T	42.7	Very low	51.1	Low	107 Å²	107	101 Å²	101	66%	0.656	55%	0.548	S	S	*	.			trans	-145.1	123.5	-179.2	46.7	0	0	0	0	112.3	D489	T487-D489 PolarHBondContact O-N 3.5Å
488	G	51.7	Low	52.2	Low	58 Å²	58	99.3 Å²	99.3	60%	0.598	53%	0.534	S	S	*	.			trans	-89	70.8	-166.6	0	0	0	0	0	115
489	D	56.5	Low	53.1	Low	104 Å²	104	99.7 Å²	99.7	56%	0.556	52%	0.521	S	S	*	.			trans	-87.5	126.6	168.9	-72.1	-18.9	0	0	0	110.7	T487 E491 T492 I493	T487-D489 PolarHBondContact O-N 3.5Å; D489-E491 PolarHBondContact O-N 3.17Å; D489-E491 VanDerWaalsContact O-N 3.15Å; D489-T492 HydrophobicContact CB-CG2 4.08Å; D489-T492 PolarHBondContact O-N 2.76Å; D489-T492 VanDerWaalsContact O-N 3.13Å; D489-T492 PolarHBondContact O-OG1 2.84Å; D489-I493 PolarHBondContact O-N 3.44Å
490	E	57	Low	54.1	Low	74 Å²	74	94.3 Å²	94.3	35%	0.346	49%	0.493	S	S	.	.	H	α-helix	trans	-57.6	-31.2	-179	-161.2	-172.2	158.5	0	0	112.2	R494	E490-R494 WeakPolarHBondContact O-CG 3.44Å; E490-R494 PolarHBondContact O-N 3.45Å; E490-R494 IonicContact OE1-CZ 3.73Å; E490-R494 IonicContact OE1-NE 2.89Å; E490-R494 IonicContact OE1-NH2 3.78Å; E490-R494 PolarHBondContact OE1-NH2 2.88Å
491	E	61.8	Low	55.1	Low	146 Å²	146	91.2 Å²	91.2	68%	0.682	48%	0.476	S	S	*	.	H	α-helix	trans	-70.2	-39.8	177.6	-68.4	-172.7	167.3	0	0	113	D489 I493 R494 Q495	D489-E491 PolarHBondContact O-N 3.17Å; D489-E491 VanDerWaalsContact O-N 3.15Å; E491-I493 VanDerWaalsContact C-N 3.28Å; E491-I493 PolarHBondContact O-N 3.43Å; E491-R494 PolarHBondContact O-N 2.98Å; E491-Q495 WeakPolarHBondContact O-CB 3.45Å; E491-Q495 VanDerWaalsContact O-CG 3.27Å; E491-Q495 WeakPolarHBondContact O-CG 2.96Å; E491-Q495 PolarHBondContact O-N 3.27Å
492	T	61.3	Low	56.2	Low	37 Å²	37	87.6 Å²	87.6	23%	0.227	46%	0.456	C	S	.	.	H	α-helix	trans	-67.9	-34.2	179.9	56.8	0	0	0	0	110.7	M484 D489 Q495 W496	M484-T492 HydrophobicContact CE-CG2 4.05Å; D489-T492 HydrophobicContact CB-CG2 4.08Å; D489-T492 PolarHBondContact O-N 2.76Å; D489-T492 VanDerWaalsContact O-N 3.13Å; D489-T492 PolarHBondContact O-OG1 2.84Å; T492-Q495 PolarHBondContact O-N 3.13Å; T492-W496 WeakPolarHBondContact O-CB 3.21Å; T492-W496 PolarHBondContact O-N 3.03Å
493	I	60.8	Low	56.7	Low	27 Å²	27	80.6 Å²	80.6	14%	0.138	43%	0.427	C	S	.	.	H	α-helix	trans	-78.4	-35	177.9	-66.6	166.8	0	0	0	111.2	D489 E491 Q495 W496 V497 L585 S590	D489-I493 PolarHBondContact O-N 3.44Å; E491-I493 VanDerWaalsContact C-N 3.28Å; E491-I493 PolarHBondContact O-N 3.43Å; I493-Q495 VanDerWaalsContact C-N 3.32Å; I493-Q495 PolarHBondContact O-N 2.95Å; I493-W496 PolarHBondContact O-N 3.14Å; I493-V497 HydrophobicContact CG2-CG2 4.38Å; I493-V497 WeakPolarHBondContact O-CB 3.21Å; I493-V497 VanDerWaalsContact O-CG2 3.24Å; I493-V497 WeakPolarHBondContact O-CG2 3.38Å; I493-V497 PolarHBondContact O-N 2.95Å; I493-L585 HydrophobicContact CG2-CD2 4.13Å; I493-S590 WeakPolarHBondContact CD1-OG 3.32Å
494	R	63.7	Low	57.6	Low	118 Å²	118	72.9 Å²	72.9	45%	0.445	39%	0.393	S	S	.	.	H	α-helix	trans	-61.1	-40.8	168.1	-77.1	-178.6	-174.2	179.8	3.8	112	E490 E491 V497 Q498 L585	E490-R494 WeakPolarHBondContact O-CG 3.44Å; E490-R494 PolarHBondContact O-N 3.45Å; E490-R494 IonicContact OE1-CZ 3.73Å; E490-R494 IonicContact OE1-NE 2.89Å; E490-R494 IonicContact OE1-NH2 3.78Å; E490-R494 PolarHBondContact OE1-NH2 2.88Å; E491-R494 PolarHBondContact O-N 2.98Å; R494-V497 PolarHBondContact O-N 3.09Å; R494-Q498 WeakPolarHBondContact O-CB 3.45Å; R494-Q498 VanDerWaalsContact O-CG 3.27Å; R494-Q498 WeakPolarHBondContact O-CG 3.18Å; R494-Q498 PolarHBondContact O-N 3.36Å; R494-L585 HydrophobicContact CG-CD1 3.95Å; R494-L585 HydrophobicContact CG-CD2 3.85Å
495	Q	62.8	Low	58.6	Low	111 Å²	111	78.3 Å²	78.3	52%	0.519	41%	0.414	S	S	.	.	H	α-helix	trans	-65.1	-44.1	174.3	-73.7	171.8	-0.3	0	0	111.5	E491 T492 I493 V497 Q498 K499	E491-Q495 WeakPolarHBondContact O-CB 3.45Å; E491-Q495 VanDerWaalsContact O-CG 3.27Å; E491-Q495 WeakPolarHBondContact O-CG 2.96Å; E491-Q495 PolarHBondContact O-N 3.27Å; T492-Q495 PolarHBondContact O-N 3.13Å; I493-Q495 VanDerWaalsContact C-N 3.32Å; I493-Q495 PolarHBondContact O-N 2.95Å; Q495-V497 PolarHBondContact O-N 2.93Å; Q495-Q498 PolarHBondContact O-N 3.39Å; Q495-K499 WeakPolarHBondContact O-CB 3.34Å; Q495-K499 PolarHBondContact O-N 3.08Å
496	W	63.7	Low	59.5	Low	52 Å²	52	72.5 Å²	72.5	20%	0.197	39%	0.392	C	S	.	.	H	α-helix	trans	-61.5	-43.8	175.9	-175.4	91.6	0	0	0	112	T492 I493 K499 N500 V593 H594 V597	T492-W496 WeakPolarHBondContact O-CB 3.21Å; T492-W496 PolarHBondContact O-N 3.03Å; I493-W496 PolarHBondContact O-N 3.14Å; W496-K499 PolarHBondContact O-N 2.87Å; W496-N500 HydrophobicContact CD2-CB 4.45Å; W496-N500 HydrophobicContact CH2-CB 4.24Å; W496-N500 HydrophobicContact CZ2-CB 4.13Å; W496-N500 WeakPolarHBondContact CZ2-ND2 3.26Å; W496-N500 HydrophobicContact CZ3-CB 4.45Å; W496-N500 PolarHBondContact NE1-ND2 3.02Å; W496-N500 WeakPolarHBondContact O-CB 3.5Å; W496-N500 PolarHBondContact O-N 2.74Å; W496-V593 HydrophobicContact CZ3-CG1 4.35Å; W496-H594 AromaticContact CE2-CD2 3.6Å; W496-H594 HydrophobicContact CH2-CB 4.32Å; W496-H594 AromaticContact CH2-CD2 3.61Å; W496-H594 AromaticContact CZ2-CD2 3.11Å; W496-H594 WeakPolarHBondContact CZ2-CD2 3.26Å; W496-H594 AromaticContact CZ2-NE2 3.65Å; W496-V597 HydrophobicContact CH2-CB 4.1Å; W496-V597 HydrophobicContact CH2-CG1 4.17Å; W496-V597 HydrophobicContact CH2-CG2 4.38Å; W496-V597 HydrophobicContact CZ3-CB 4.39Å; W496-V597 HydrophobicContact CZ3-CG2 4.17Å
497	V	64.6	Low	60.6	Low	13 Å²	13	70 Å²	70	8%	0.079	36%	0.363	C	S	.	.	H	α-helix	trans	-59.5	-48.9	173.2	165.2	0	0	0	0	110.1	I493 R494 Q495 K499 N500 F501 V581 V593	I493-V497 HydrophobicContact CG2-CG2 4.38Å; I493-V497 WeakPolarHBondContact O-CB 3.21Å; I493-V497 VanDerWaalsContact O-CG2 3.24Å; I493-V497 WeakPolarHBondContact O-CG2 3.38Å; I493-V497 PolarHBondContact O-N 2.95Å; R494-V497 PolarHBondContact O-N 3.09Å; Q495-V497 PolarHBondContact O-N 2.93Å; V497-K499 PolarHBondContact O-N 3.4Å; V497-N500 PolarHBondContact O-N 3.05Å; V497-F501 HydrophobicContact CG1-CB 4.11Å; V497-F501 HydrophobicContact CG1-CD1 4.28Å; V497-F501 WeakPolarHBondContact O-CA 3.12Å; V497-F501 WeakPolarHBondContact O-CB 3.49Å; V497-F501 PolarHBondContact O-N 3.08Å; V497-F501 VanDerWaalsContact O-O 3.08Å; V497-V581 HydrophobicContact CB-CG1 4.46Å; V497-V581 HydrophobicContact CG1-CG1 3.62Å; V497-V581 HydrophobicContact CG2-CG1 3.96Å; V497-V593 HydrophobicContact CG2-CG1 3.53Å
498	Q	62.5	Low	62.1	Low	133 Å²	133	68 Å²	68	62%	0.621	35%	0.348	S	S	*	.	H	α-helix	trans	-61.7	-29.7	178.3	-74.8	174	-3.1	0	0	113	R494 Q495	R494-Q498 WeakPolarHBondContact O-CB 3.45Å; R494-Q498 VanDerWaalsContact O-CG 3.27Å; R494-Q498 WeakPolarHBondContact O-CG 3.18Å; R494-Q498 PolarHBondContact O-N 3.36Å; Q495-Q498 PolarHBondContact O-N 3.39Å
499	K	60.4	Low	63.4	Low	89 Å²	89	68 Å²	68	39%	0.387	34%	0.336	S	S	.	.	H	α-helix	trans	-81	-34.9	-180	-166.2	-175.9	-179	-161.7	0	113.5	D481 Q495 W496 V497 A614	D481-K499 IonicContact OD2-NZ 3.16Å; D481-K499 PolarHBondContact OD2-NZ 3.47Å; Q495-K499 WeakPolarHBondContact O-CB 3.34Å; Q495-K499 PolarHBondContact O-N 3.08Å; W496-K499 PolarHBondContact O-N 2.87Å; V497-K499 PolarHBondContact O-N 3.4Å; K499-A614 WeakPolarHBondContact O-CB 3.36Å
500	N	62.3	Low	64.6	Low	36 Å²	36	70.8 Å²	70.8	19%	0.193	35%	0.345	C	S	.	.	H	α-helix	trans	-109.6	-24.9	-172.1	-73.2	-44.2	0	0	0	114.5	W496 V497 A614	W496-N500 HydrophobicContact CD2-CB 4.45Å; W496-N500 HydrophobicContact CH2-CB 4.24Å; W496-N500 HydrophobicContact CZ2-CB 4.13Å; W496-N500 WeakPolarHBondContact CZ2-ND2 3.26Å; W496-N500 HydrophobicContact CZ3-CB 4.45Å; W496-N500 PolarHBondContact NE1-ND2 3.02Å; W496-N500 WeakPolarHBondContact O-CB 3.5Å; W496-N500 PolarHBondContact O-N 2.74Å; V497-N500 PolarHBondContact O-N 3.05Å; N500-A614 VanDerWaalsContact C-CB 3.43Å; N500-A614 WeakPolarHBondContact O-CB 3.22Å; N500-A614 PolarHBondContact O-N 3.09Å
501	F	64	Low	66	Low	6 Å²	6	69 Å²	69	3%	0.026	34%	0.339	C	S	.	.	B	Isolated β-bridge	trans	-106.7	126.6	176.6	176.4	-99.6	0	0	0	110.2	V497 P503 A577 W600 I612	V497-F501 HydrophobicContact CG1-CB 4.11Å; V497-F501 HydrophobicContact CG1-CD1 4.28Å; V497-F501 WeakPolarHBondContact O-CA 3.12Å; V497-F501 WeakPolarHBondContact O-CB 3.49Å; V497-F501 PolarHBondContact O-N 3.08Å; V497-F501 VanDerWaalsContact O-O 3.08Å; F501-P503 WeakPolarHBondContact O-CD 3.47Å; F501-A577 HydrophobicContact CE2-CB 3.43Å; F501-A577 VanDerWaalsContact CE2-CB 3.43Å; F501-A577 HydrophobicContact CZ-CB 3.57Å; F501-W600 HydrophobicContact CD2-CZ3 4.09Å; F501-W600 AromaticContact CE2-CZ3 3.96Å; F501-W600 HydrophobicContact CE2-CZ3 3.96Å; F501-I612 HydrophobicContact CD2-CG2 3.58Å; F501-I612 HydrophobicContact CE2-CG2 3.61Å
502	R	69.5	Low	67.1	Low	16 Å²	16	63.8 Å²	63.8	6%	0.06	32%	0.315	C	S	.	.			trans	-83.4	104.3	-178.3	-174	-179.4	-179.7	159.4	7.5	110.1	V568 F611 I612 A614 E625	R502-V568 HydrophobicContact CG-CG1 4.15Å; R502-V568 VanDerWaalsContact CZ-CG2 3.46Å; R502-F611 WeakPolarHBondContact CD-O 3.29Å; R502-I612 PolarHBondContact N-O 3.41Å; R502-I612 VanDerWaalsContact N-O 3.07Å; R502-A614 HydrophobicContact CB-CB 4.18Å; R502-E625 IonicContact CZ-OE2 2.73Å; R502-E625 IonicContact NH1-OE2 2.76Å; R502-E625 PolarHBondContact NH1-OE2 2.92Å; R502-E625 IonicContact NH2-OE1 2.91Å; R502-E625 PolarHBondContact NH2-OE1 3.25Å; R502-E625 IonicContact NH2-OE2 3.44Å; R502-E625 PolarHBondContact NH2-OE2 3.05Å
503	P	60.4	Low	68.3	Low	45 Å²	45	66.4 Å²	66.4	29%	0.292	33%	0.327	S	S	.	.			trans	-78	138.4	-177.4	19.6	-8.8	0	0	0	110.6	F501 K505 A506	F501-P503 WeakPolarHBondContact O-CD 3.47Å; P503-K505 PolarHBondContact O-N 3.41Å; P503-A506 HydrophobicContact CG-CB 3.97Å; P503-A506 PolarHBondContact O-N 3.41Å
504	S	60.5	Low	69.5	Low	21 Å²	21	68.1 Å²	68.1	15%	0.147	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-13.5	-179.1	-45.5	0	0	0	0	114.5	D572	S504-D572 VanDerWaalsContact OG-CB 3.29Å; S504-D572 WeakPolarHBondContact OG-CB 3.21Å; S504-D572 VanDerWaalsContact OG-CG 3.27Å; S504-D572 PolarHBondContact OG-OD2 3.41Å
505	K	59.7	Low	70.8	Confident	201 Å²	201	62.5 Å²	62.5	87%	0.874	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	-7.1	178.5	-66.6	-175.3	-179.7	178.2	0	114.2	P503	P503-K505 PolarHBondContact O-N 3.41Å
506	A	60.6	Low	72.1	Confident	60 Å²	60	60.1 Å²	60.1	50%	0.496	31%	0.312	S	S	.	.	S	Bend	trans	-88.2	-16.7	-171.7	0	0	0	0	0	114.9	P503	P503-A506 HydrophobicContact CG-CB 3.97Å; P503-A506 PolarHBondContact O-N 3.41Å
507	I	65.4	Low	73.3	Confident	16 Å²	16	62 Å²	62	8%	0.082	33%	0.325	C	S	.	.	S	Bend	trans	-78.6	-40.4	-166.2	-57.6	169.4	0	0	0	112.2	Q512 D565 V568	I507-Q512 PolarHBondContact O-OE1 3.46Å; I507-D565 HydrophobicContact CB-CB 4.46Å; I507-D565 HydrophobicContact CD1-CB 4.2Å; I507-D565 HydrophobicContact CG2-CB 4.19Å; I507-V568 HydrophobicContact CD1-CB 3.83Å; I507-V568 HydrophobicContact CD1-CG1 3.95Å; I507-V568 HydrophobicContact CD1-CG2 3.87Å
508	I	75.3	Confident	74.6	Confident	66 Å²	66	62.8 Å²	62.8	34%	0.338	33%	0.327	S	S	.	.	S	Bend	trans	-114.6	100.8	-177.7	-57.2	178.2	0	0	0	110.1	Q512 I513 D565	I508-Q512 VanDerWaalsContact CA-OE1 3.28Å; I508-I513 HydrophobicContact CG2-CD1 4.17Å; I508-I513 HydrophobicContact CG2-CG1 3.65Å; I508-D565 HydrophobicContact CD1-CB 4.45Å
509	T	78.6	Confident	76	Confident	56 Å²	56	56.8 Å²	56.8	34%	0.344	30%	0.299	S	S	.	.			trans	-79.6	157.5	176.5	64.5	0	0	0	0	111.8	V511 Q512 I513	T509-V511 PolarHBondContact O-N 3.09Å; T509-Q512 WeakPolarHBondContact O-CB 3.29Å; T509-Q512 PolarHBondContact O-N 2.95Å; T509-Q512 WeakPolarHBondContact OG1-CG 3.27Å; T509-Q512 PolarHBondContact OG1-N 3.42Å; T509-Q512 PolarHBondContact OG1-OE1 3.1Å; T509-I513 PolarHBondContact O-N 3.18Å; T509-I513 VanDerWaalsContact O-N 3.08Å
510	H	82.6	Confident	77.5	Confident	163 Å²	163	54.3 Å²	54.3	76%	0.755	30%	0.296	S	S	*	.	H	α-helix	trans	-55.4	-35.4	173.6	-68.9	-65.5	0	0	0	112.7	I513 C514	H510-I513 PolarHBondContact O-N 3.39Å; H510-C514 PolarHBondContact O-N 3.3Å; H510-C514 PolarHBondContact O-SG 2.87Å
511	V	85.3	Confident	78.7	Confident	37 Å²	37	52.6 Å²	52.6	22%	0.224	29%	0.287	C	S	.	.	H	α-helix	trans	-64.5	-43.3	176.7	-179.5	0	0	0	0	110.9	L464 A468 T509 I513 C514 I515	L464-V511 HydrophobicContact CD1-CG1 3.88Å; L464-V511 HydrophobicContact CG-CG1 4.34Å; A468-V511 HydrophobicContact CB-CG1 3.91Å; T509-V511 PolarHBondContact O-N 3.09Å; V511-I513 VanDerWaalsContact C-N 3.34Å; V511-I513 PolarHBondContact O-N 2.99Å; V511-C514 WeakPolarHBondContact O-CB 3.41Å; V511-C514 PolarHBondContact O-N 2.59Å; V511-I515 HydrophobicContact CG1-CD1 4.22Å; V511-I515 WeakPolarHBondContact O-CG1 3.31Å; V511-I515 PolarHBondContact O-N 3.14Å
512	Q	85.2	Confident	80	Confident	37 Å²	37	53.1 Å²	53.1	17%	0.173	29%	0.29	C	S	.	.	H	α-helix	trans	-64.7	-36.8	176.4	-73.8	165.7	-19.7	0	0	112.3	I507 I508 T509 C514 I515 V516 Y558	I507-Q512 PolarHBondContact O-OE1 3.46Å; I508-Q512 VanDerWaalsContact CA-OE1 3.28Å; T509-Q512 WeakPolarHBondContact O-CB 3.29Å; T509-Q512 PolarHBondContact O-N 2.95Å; T509-Q512 WeakPolarHBondContact OG1-CG 3.27Å; T509-Q512 PolarHBondContact OG1-N 3.42Å; T509-Q512 PolarHBondContact OG1-OE1 3.1Å; Q512-C514 VanDerWaalsContact C-N 3.29Å; Q512-C514 PolarHBondContact O-N 3.41Å; Q512-I515 PolarHBondContact O-N 2.92Å; Q512-I515 VanDerWaalsContact O-N 3.12Å; Q512-V516 WeakPolarHBondContact O-CG2 3.1Å; Q512-V516 PolarHBondContact O-N 2.81Å; Q512-Y558 HydrophobicContact CB-CE1 4.32Å
513	I	86	Confident	81	Confident	92 Å²	92	55.2 Å²	55.2	47%	0.472	30%	0.302	S	S	.	.	H	α-helix	trans	-59.3	-42.4	173.7	-63.7	171.8	0	0	0	110.5	I508 T509 H510 V511 I515 V516 L517	I508-I513 HydrophobicContact CG2-CD1 4.17Å; I508-I513 HydrophobicContact CG2-CG1 3.65Å; T509-I513 PolarHBondContact O-N 3.18Å; T509-I513 VanDerWaalsContact O-N 3.08Å; H510-I513 PolarHBondContact O-N 3.39Å; V511-I513 VanDerWaalsContact C-N 3.34Å; V511-I513 PolarHBondContact O-N 2.99Å; I513-I515 PolarHBondContact O-N 2.84Å; I513-V516 PolarHBondContact O-N 3.25Å; I513-L517 PolarHBondContact O-N 2.73Å
514	C	87.5	Confident	82.3	Confident	63 Å²	63	56.8 Å²	56.8	43%	0.426	31%	0.307	S	S	.	.	H	α-helix	trans	-62.7	-40.2	174.4	-64.4	0	0	0	0	112.4	L464 H510 V511 Q512 L517 W518	L464-C514 HydrophobicContact CD2-CB 3.97Å; H510-C514 PolarHBondContact O-N 3.3Å; H510-C514 PolarHBondContact O-SG 2.87Å; V511-C514 WeakPolarHBondContact O-CB 3.41Å; V511-C514 PolarHBondContact O-N 2.59Å; Q512-C514 VanDerWaalsContact C-N 3.29Å; Q512-C514 PolarHBondContact O-N 3.41Å; C514-L517 PolarHBondContact O-N 2.84Å; C514-W518 PolarHBondContact O-N 3.24Å; C514-W518 VanDerWaalsContact O-N 3.09Å
515	I	90.4	Very high	83.5	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-64.6	-45	176.7	-64.9	164.6	0	0	0	110.6	F461 L464 L465 A468 V511 Q512 I513 L517 W518 V519 Y558	F461-I515 HydrophobicContact CE2-CG2 4.23Å; L464-I515 HydrophobicContact CD2-CG1 3.69Å; L464-I515 HydrophobicContact CG-CG1 3.95Å; L465-I515 HydrophobicContact CD2-CD1 4.05Å; L465-I515 HydrophobicContact CD2-CG1 4.35Å; L465-I515 HydrophobicContact CD2-CG2 4.1Å; A468-I515 HydrophobicContact CB-CD1 3.94Å; V511-I515 HydrophobicContact CG1-CD1 4.22Å; V511-I515 WeakPolarHBondContact O-CG1 3.31Å; V511-I515 PolarHBondContact O-N 3.14Å; Q512-I515 PolarHBondContact O-N 2.92Å; Q512-I515 VanDerWaalsContact O-N 3.12Å; I513-I515 PolarHBondContact O-N 2.84Å; I515-L517 VanDerWaalsContact C-N 3.32Å; I515-L517 PolarHBondContact O-N 3.01Å; I515-W518 WeakPolarHBondContact O-CA 3.29Å; I515-W518 WeakPolarHBondContact O-CB 3.16Å; I515-W518 PolarHBondContact O-N 2.99Å; I515-V519 HydrophobicContact CG2-CG2 4.23Å; I515-V519 WeakPolarHBondContact O-CG2 3.32Å; I515-V519 PolarHBondContact O-N 3.4Å; I515-Y558 WeakPolarHBondContact CB-OH 3.49Å; I515-Y558 HydrophobicContact CG2-CE2 3.99Å; I515-Y558 WeakPolarHBondContact CG2-OH 3.36Å
516	V	89.6	Confident	84.8	Confident	60 Å²	60	48.1 Å²	48.1	36%	0.364	27%	0.272	S	S	.	.	H	α-helix	trans	-59.2	-43.3	177.5	171.7	0	0	0	0	111	Q512 I513 W518 V519 A520 Y558	Q512-V516 WeakPolarHBondContact O-CG2 3.1Å; Q512-V516 PolarHBondContact O-N 2.81Å; I513-V516 PolarHBondContact O-N 3.25Å; V516-W518 VanDerWaalsContact C-N 3.27Å; V516-W518 PolarHBondContact O-N 3.45Å; V516-V519 PolarHBondContact O-N 3.41Å; V516-A520 WeakPolarHBondContact O-CB 3.21Å; V516-A520 PolarHBondContact O-N 2.91Å; V516-Y558 HydrophobicContact CG2-CD1 3.47Å; V516-Y558 VanDerWaalsContact CG2-CD1 3.47Å; V516-Y558 HydrophobicContact CG2-CD2 3.93Å; V516-Y558 HydrophobicContact CG2-CE1 3.49Å; V516-Y558 VanDerWaalsContact CG2-CE1 3.49Å; V516-Y558 HydrophobicContact CG2-CE2 3.95Å; V516-Y558 HydrophobicContact CG2-CG 3.72Å
517	L	89.4	Confident	86	Confident	91 Å²	91	49.5 Å²	49.5	48%	0.476	27%	0.27	S	S	.	.	H	α-helix	trans	-60.9	-38	175.3	-173	70.7	0	0	0	111.9	I513 C514 I515 G521 P828 V831	I513-L517 PolarHBondContact O-N 2.73Å; C514-L517 PolarHBondContact O-N 2.84Å; I515-L517 VanDerWaalsContact C-N 3.32Å; I515-L517 PolarHBondContact O-N 3.01Å; L517-G521 PolarHBondContact O-N 3.01Å; L517-P828 HydrophobicContact CD2-CB 4.26Å; L517-P828 HydrophobicContact CG-CB 4.23Å; L517-V831 HydrophobicContact CD1-CG2 4.49Å
518	W	91.8	Very high	86.9	Confident	30 Å²	30	52.6 Å²	52.6	11%	0.114	28%	0.283	C	S	.	.	H	α-helix	trans	-67.3	-46.7	176.3	-141.6	-71.3	0	0	0	112.3	S457 L460 F461 L464 C514 I515 V516 A520 G521 L522 V827 P828	S457-W518 WeakPolarHBondContact O-CZ2 3.18Å; S457-W518 WeakPolarHBondContact OG-CZ2 3.3Å; L460-W518 HydrophobicContact CB-CH2 3.91Å; L460-W518 HydrophobicContact CB-CZ2 4.36Å; F461-W518 HydrophobicContact CB-CD2 4.18Å; F461-W518 HydrophobicContact CB-CG 4.35Å; F461-W518 HydrophobicContact CB-CZ2 4.13Å; F461-W518 HydrophobicContact CD2-CB 3.83Å; F461-W518 AromaticContact CD2-CD1 3.49Å; F461-W518 VanDerWaalsContact CD2-CD1 3.49Å; F461-W518 HydrophobicContact CD2-CD2 4Å; F461-W518 AromaticContact CD2-CG 3.49Å; F461-W518 HydrophobicContact CD2-CG 3.49Å; F461-W518 VanDerWaalsContact CD2-CG 3.49Å; F461-W518 HydrophobicContact CE2-CB 4Å; F461-W518 HydrophobicContact CE2-CG 4.11Å; F461-W518 AromaticContact CG-CD1 3.8Å; F461-W518 HydrophobicContact CG-CG 4.19Å; F461-W518 AromaticContact CG-NE1 3.96Å; L464-W518 HydrophobicContact CD2-CE3 4.45Å; C514-W518 PolarHBondContact O-N 3.24Å; C514-W518 VanDerWaalsContact O-N 3.09Å; I515-W518 WeakPolarHBondContact O-CA 3.29Å; I515-W518 WeakPolarHBondContact O-CB 3.16Å; I515-W518 PolarHBondContact O-N 2.99Å; V516-W518 VanDerWaalsContact C-N 3.27Å; V516-W518 PolarHBondContact O-N 3.45Å; W518-A520 VanDerWaalsContact C-N 3.29Å; W518-A520 PolarHBondContact O-N 3.2Å; W518-G521 PolarHBondContact O-N 3.44Å; W518-G521 VanDerWaalsContact O-N 3.14Å; W518-L522 PolarHBondContact O-N 3.09Å; W518-V827 HydrophobicContact CD2-CG1 4.38Å; W518-V827 HydrophobicContact CG-CG1 3.84Å; W518-V827 VanDerWaalsContact CZ2-O 3.32Å; W518-V827 WeakPolarHBondContact CZ2-O 3.49Å; W518-V827 WeakPolarHBondContact O-CG1 3.5Å; W518-P828 HydrophobicContact CD2-CB 4.4Å; W518-P828 HydrophobicContact CD2-CG 4.47Å; W518-P828 HydrophobicContact CE3-CB 4.32Å; W518-P828 HydrophobicContact CE3-CG 4.06Å; W518-P828 HydrophobicContact CH2-CG 4.5Å; W518-P828 HydrophobicContact CZ3-CG 4.09Å
519	V	92.4	Very high	87.3	Confident	7 Å²	7	53 Å²	53	4%	0.042	28%	0.283	C	S	.	.	H	α-helix	trans	-60.8	-40.8	176.9	173.5	0	0	0	0	110.4	I515 V516 G521 L522 L523 L551 Y554 I555	I515-V519 HydrophobicContact CG2-CG2 4.23Å; I515-V519 WeakPolarHBondContact O-CG2 3.32Å; I515-V519 PolarHBondContact O-N 3.4Å; V516-V519 PolarHBondContact O-N 3.41Å; V519-G521 PolarHBondContact O-N 3.18Å; V519-L522 PolarHBondContact O-N 2.96Å; V519-L523 WeakPolarHBondContact O-CB 3.43Å; V519-L523 PolarHBondContact O-N 3.32Å; V519-L551 HydrophobicContact CG1-CD2 4.16Å; V519-Y554 HydrophobicContact CG2-CD2 4.12Å; V519-Y554 HydrophobicContact CG2-CG 4.08Å; V519-I555 HydrophobicContact CG1-CG1 4.35Å
520	A	90.3	Very high	87.7	Confident	38 Å²	38	52.6 Å²	52.6	31%	0.314	28%	0.278	S	S	.	.	H	α-helix	trans	-61.9	-41.8	174.2	0	0	0	0	0	112.3	V516 W518 L523 L524	V516-A520 WeakPolarHBondContact O-CB 3.21Å; V516-A520 PolarHBondContact O-N 2.91Å; W518-A520 VanDerWaalsContact C-N 3.29Å; W518-A520 PolarHBondContact O-N 3.2Å; A520-L523 PolarHBondContact O-N 3.36Å; A520-L524 WeakPolarHBondContact O-CG 3.45Å; A520-L524 PolarHBondContact O-N 2.66Å
521	G	89.1	Confident	87.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-68.8	-33.4	176.4	0	0	0	0	0	113.9	L517 W518 V519 A525	L517-G521 PolarHBondContact O-N 3.01Å; W518-G521 PolarHBondContact O-N 3.44Å; W518-G521 VanDerWaalsContact O-N 3.14Å; V519-G521 PolarHBondContact O-N 3.18Å; G521-A525 PolarHBondContact O-N 2.85Å
522	L	90	Very high	87.5	Confident	17 Å²	17	58.2 Å²	58.2	9%	0.089	29%	0.294	C	S	.	.	H	α-helix	trans	-66.5	-43.5	170.1	-73	170.1	0	0	0	111.3	F461 W518 V519 L524 A525 D526 L551 V827	F461-L522 HydrophobicContact CE1-CD1 4.43Å; F461-L522 HydrophobicContact CZ-CD1 4.48Å; W518-L522 PolarHBondContact O-N 3.09Å; V519-L522 PolarHBondContact O-N 2.96Å; L522-L524 PolarHBondContact O-N 3.39Å; L522-A525 WeakPolarHBondContact O-CB 3.26Å; L522-A525 PolarHBondContact O-N 2.98Å; L522-A525 VanDerWaalsContact O-N 3.14Å; L522-D526 PolarHBondContact O-N 3.35Å; L522-L551 HydrophobicContact CB-CD2 3.78Å; L522-L551 HydrophobicContact CD1-CD2 4.45Å; L522-V827 HydrophobicContact CD2-CG2 3.97Å; L522-V827 HydrophobicContact CG-CG1 4.17Å; L522-V827 HydrophobicContact CG-CG2 4.31Å
523	L	90.9	Very high	87.1	Confident	60 Å²	60	58.5 Å²	58.5	31%	0.314	30%	0.303	S	S	.	.	H	α-helix	trans	-59.2	-45.5	177.1	179.8	66.2	0	0	0	111.8	V519 A520 A525 D526 I527 I555	V519-L523 WeakPolarHBondContact O-CB 3.43Å; V519-L523 PolarHBondContact O-N 3.32Å; A520-L523 PolarHBondContact O-N 3.36Å; L523-A525 VanDerWaalsContact C-N 3.29Å; L523-A525 PolarHBondContact O-N 2.94Å; L523-D526 PolarHBondContact O-N 3.18Å; L523-I527 HydrophobicContact CD1-CD1 4.17Å; L523-I527 HydrophobicContact CD1-CG1 4.4Å; L523-I527 HydrophobicContact CD2-CD1 4.49Å; L523-I527 HydrophobicContact CG-CD1 3.87Å; L523-I527 HydrophobicContact CG-CG1 4.49Å; L523-I527 VanDerWaalsContact O-CG1 3.27Å; L523-I527 WeakPolarHBondContact O-CG1 3.26Å; L523-I527 PolarHBondContact O-N 3.36Å; L523-I555 HydrophobicContact CD1-CD1 3.94Å; L523-I555 HydrophobicContact CD2-CD1 3.87Å; L523-I555 HydrophobicContact CG-CD1 4.41Å
524	L	87.4	Confident	87	Confident	78 Å²	78	55.7 Å²	55.7	41%	0.408	30%	0.297	S	S	.	.	H	α-helix	trans	-63.5	-35.1	176.4	-72	175.3	0	0	0	112.6	A520 L522 K528 V831	A520-L524 WeakPolarHBondContact O-CG 3.45Å; A520-L524 PolarHBondContact O-N 2.66Å; L522-L524 PolarHBondContact O-N 3.39Å; L524-K528 WeakPolarHBondContact O-CB 3.48Å; L524-K528 PolarHBondContact O-N 3.33Å; L524-V831 HydrophobicContact CD1-CB 4.43Å; L524-V831 HydrophobicContact CD1-CG1 4.46Å; L524-V831 HydrophobicContact CD1-CG2 4.17Å
525	A	85.3	Confident	86.9	Confident	22 Å²	22	59.3 Å²	59.3	18%	0.182	31%	0.306	C	S	.	.	H	α-helix	trans	-65.8	-44.4	175.6	0	0	0	0	0	111.4	G521 L522 L523 K528 H529	G521-A525 PolarHBondContact O-N 2.85Å; L522-A525 WeakPolarHBondContact O-CB 3.26Å; L522-A525 PolarHBondContact O-N 2.98Å; L522-A525 VanDerWaalsContact O-N 3.14Å; L523-A525 VanDerWaalsContact C-N 3.29Å; L523-A525 PolarHBondContact O-N 2.94Å; A525-K528 WeakPolarHBondContact O-CB 3.15Å; A525-K528 PolarHBondContact O-N 2.92Å; A525-H529 PolarHBondContact O-N 3.4Å
526	D	87.5	Confident	86.8	Confident	18 Å²	18	65.8 Å²	65.8	10%	0.096	33%	0.33	C	S	.	.	H	α-helix	trans	-69.5	-39.6	179.1	-76.9	8.5	0	0	0	111.7	L522 L523 K528 H529 I530 Y538 L551	L522-D526 PolarHBondContact O-N 3.35Å; L523-D526 PolarHBondContact O-N 3.18Å; D526-K528 VanDerWaalsContact C-N 3.31Å; D526-K528 PolarHBondContact O-N 2.84Å; D526-H529 WeakPolarHBondContact O-CB 3.41Å; D526-H529 PolarHBondContact O-N 3.22Å; D526-H529 VanDerWaalsContact O-N 3.14Å; D526-I530 VanDerWaalsContact O-CG1 3.29Å; D526-I530 WeakPolarHBondContact O-CG1 3.35Å; D526-I530 PolarHBondContact O-N 3.06Å; D526-Y538 PolarHBondContact OD2-OH 3.09Å; D526-L551 HydrophobicContact CB-CD1 4.09Å; D526-L551 WeakPolarHBondContact OD2-CD1 3.38Å
527	I	87.1	Confident	86.5	Confident	89 Å²	89	66.6 Å²	66.6	46%	0.456	34%	0.338	S	S	.	.	H	α-helix	trans	-58.8	-44.1	172.6	-69.9	167.8	0	0	0	110.6	L523 H529 I530 Y531	L523-I527 HydrophobicContact CD1-CD1 4.17Å; L523-I527 HydrophobicContact CD1-CG1 4.4Å; L523-I527 HydrophobicContact CD2-CD1 4.49Å; L523-I527 HydrophobicContact CG-CD1 3.87Å; L523-I527 HydrophobicContact CG-CG1 4.49Å; L523-I527 VanDerWaalsContact O-CG1 3.27Å; L523-I527 WeakPolarHBondContact O-CG1 3.26Å; L523-I527 PolarHBondContact O-N 3.36Å; I527-H529 VanDerWaalsContact C-N 3.32Å; I527-H529 PolarHBondContact O-N 3.01Å; I527-I530 PolarHBondContact O-N 3.33Å; I527-Y531 WeakPolarHBondContact O-CB 3.32Å; I527-Y531 PolarHBondContact O-N 3.19Å
528	K	83.9	Confident	86.2	Confident	80 Å²	80	62.5 Å²	62.5	35%	0.348	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-42	176.3	-173.3	-177.2	177.3	-171.3	0	111.1	L524 A525 D526 Y531 F532	L524-K528 WeakPolarHBondContact O-CB 3.48Å; L524-K528 PolarHBondContact O-N 3.33Å; A525-K528 WeakPolarHBondContact O-CB 3.15Å; A525-K528 PolarHBondContact O-N 2.92Å; D526-K528 VanDerWaalsContact C-N 3.31Å; D526-K528 PolarHBondContact O-N 2.84Å; K528-Y531 PolarHBondContact O-N 2.78Å; K528-F532 HydrophobicContact CD-CE2 4.24Å; K528-F532 HydrophobicContact CG-CD2 3.8Å; K528-F532 HydrophobicContact CG-CE2 3.63Å; K528-F532 WeakPolarHBondContact O-CD2 3.45Å; K528-F532 PolarHBondContact O-N 3.02Å; K528-F532 VanDerWaalsContact O-N 3.16Å
529	H	82.8	Confident	86	Confident	75 Å²	75	64.7 Å²	64.7	35%	0.347	33%	0.329	S	S	.	.	H	α-helix	trans	-64	-43.8	177.7	-173.3	-108.1	0	0	0	111.8	A525 D526 I527 Y531 F532 A533 Y538	A525-H529 PolarHBondContact O-N 3.4Å; D526-H529 WeakPolarHBondContact O-CB 3.41Å; D526-H529 PolarHBondContact O-N 3.22Å; D526-H529 VanDerWaalsContact O-N 3.14Å; I527-H529 VanDerWaalsContact C-N 3.32Å; I527-H529 PolarHBondContact O-N 3.01Å; H529-Y531 VanDerWaalsContact C-N 3.3Å; H529-Y531 PolarHBondContact O-N 3.34Å; H529-F532 PolarHBondContact O-N 3.24Å; H529-A533 VanDerWaalsContact O-CB 3.32Å; H529-A533 WeakPolarHBondContact O-CB 3.36Å; H529-A533 PolarHBondContact O-N 3.33Å; H529-Y538 HydrophobicContact CB-CE2 4.5Å; H529-Y538 AromaticContact CE1-CD2 3.9Å; H529-Y538 AromaticContact ND1-CD2 3.2Å; H529-Y538 WeakPolarHBondContact ND1-CD2 3.28Å; H529-Y538 AromaticContact ND1-CE2 3.35Å; H529-Y538 VanDerWaalsContact ND1-CE2 3.35Å; H529-Y538 WeakPolarHBondContact ND1-CE2 3.38Å
530	I	87.4	Confident	85.6	Confident	47 Å²	47	69.2 Å²	69.2	24%	0.241	36%	0.361	C	S	.	.	H	α-helix	trans	-59.4	-41.6	174.7	-67.4	163.6	0	0	0	111.1	D526 I527 G534 F535 Y538	D526-I530 VanDerWaalsContact O-CG1 3.29Å; D526-I530 WeakPolarHBondContact O-CG1 3.35Å; D526-I530 PolarHBondContact O-N 3.06Å; I527-I530 PolarHBondContact O-N 3.33Å; I530-G534 CarbonylContact O-C 3.58Å; I530-G534 WeakPolarHBondContact O-CA 3.11Å; I530-G534 PolarHBondContact O-N 2.94Å; I530-F535 HydrophobicContact CG2-CD2 4.35Å; I530-Y538 HydrophobicContact CD1-CD1 4.3Å; I530-Y538 HydrophobicContact CD1-CD2 4.43Å; I530-Y538 HydrophobicContact CD1-CE1 4.15Å; I530-Y538 HydrophobicContact CD1-CE2 4.28Å; I530-Y538 HydrophobicContact CD1-CG 4.45Å; I530-Y538 HydrophobicContact CG1-CD1 3.94Å; I530-Y538 HydrophobicContact CG1-CD2 3.44Å; I530-Y538 VanDerWaalsContact CG1-CD2 3.44Å; I530-Y538 HydrophobicContact CG1-CE1 4.13Å; I530-Y538 HydrophobicContact CG1-CE2 3.66Å; I530-Y538 HydrophobicContact CG1-CG 3.61Å
531	Y	83.7	Confident	85.3	Confident	169 Å²	169	70.6 Å²	70.6	66%	0.663	36%	0.363	S	S	*	.	H	α-helix	trans	-63.2	-42.1	179.7	-177.3	-97.9	0	0	0	112.9	I527 K528 H529	I527-Y531 WeakPolarHBondContact O-CB 3.32Å; I527-Y531 PolarHBondContact O-N 3.19Å; K528-Y531 PolarHBondContact O-N 2.78Å; H529-Y531 VanDerWaalsContact C-N 3.3Å; H529-Y531 PolarHBondContact O-N 3.34Å
532	F	79.7	Confident	85.1	Confident	149 Å²	149	74 Å²	74	65%	0.654	39%	0.391	S	S	*	.	H	α-helix	trans	-84.2	-38.4	-178.2	-74.2	-68	0	0	0	114.2	K528 H529	K528-F532 HydrophobicContact CD-CE2 4.24Å; K528-F532 HydrophobicContact CG-CD2 3.8Å; K528-F532 HydrophobicContact CG-CE2 3.63Å; K528-F532 WeakPolarHBondContact O-CD2 3.45Å; K528-F532 PolarHBondContact O-N 3.02Å; K528-F532 VanDerWaalsContact O-N 3.16Å; H529-F532 PolarHBondContact O-N 3.24Å
533	A	76.8	Confident	84.9	Confident	44 Å²	44	77 Å²	77	36%	0.364	40%	0.401	S	S	.	.	H	α-helix	trans	-83.2	-23	-178.1	0	0	0	0	0	112.9	H529	H529-A533 VanDerWaalsContact O-CB 3.32Å; H529-A533 WeakPolarHBondContact O-CB 3.36Å; H529-A533 PolarHBondContact O-N 3.33Å
534	G	83.5	Confident	84.8	Confident	32 Å²	32	75.1 Å²	75.1	33%	0.33	39%	0.392	S	S	.	.			trans	83.9	150.8	-168.9	0	0	0	0	0	112.5	I530 R536 S537 Y538	I530-G534 CarbonylContact O-C 3.58Å; I530-G534 WeakPolarHBondContact O-CA 3.11Å; I530-G534 PolarHBondContact O-N 2.94Å; G534-R536 PolarHBondContact O-N 3.43Å; G534-S537 PolarHBondContact O-N 2.91Å; G534-Y538 PolarHBondContact O-N 3.21Å; G534-Y538 VanDerWaalsContact O-N 3.13Å
535	F	86.4	Confident	84.8	Confident	140 Å²	140	75.2 Å²	75.2	61%	0.614	39%	0.392	S	S	*	.	H	α-helix	trans	-64.1	-40.4	-173.2	-176.5	-107.8	0	0	0	113.8	I530 Y538 I539	I530-F535 HydrophobicContact CG2-CD2 4.35Å; F535-Y538 WeakPolarHBondContact O-CB 3.48Å; F535-Y538 PolarHBondContact O-N 3.48Å; F535-I539 HydrophobicContact CD1-CD1 4.12Å; F535-I539 HydrophobicContact CD2-CD1 4.33Å; F535-I539 HydrophobicContact CE1-CD1 3.44Å; F535-I539 VanDerWaalsContact CE1-CD1 3.44Å; F535-I539 HydrophobicContact CE2-CD1 3.69Å; F535-I539 HydrophobicContact CE2-CG1 4.39Å; F535-I539 HydrophobicContact CZ-CD1 3.21Å; F535-I539 HydrophobicContact CZ-CG1 4.33Å; F535-I539 PolarHBondContact O-N 3.41Å; F535-I539 VanDerWaalsContact O-N 3.16Å
536	R	87.3	Confident	85.1	Confident	136 Å²	136	77 Å²	77	51%	0.513	40%	0.398	S	S	.	.	H	α-helix	trans	-64.3	-46.8	-179.7	-174	178	-179.9	160	6	111.7	I39 G534 Y538 I539 C540	I39-R536 PolarHBondContact O-NH1 3.15Å; G534-R536 PolarHBondContact O-N 3.43Å; R536-Y538 VanDerWaalsContact C-N 3.26Å; R536-Y538 PolarHBondContact O-N 3.32Å; R536-I539 PolarHBondContact O-N 2.8Å; R536-C540 PolarHBondContact O-N 3.35Å; R536-C540 PolarHBondContact O-SG 2.91Å
537	S	83.1	Confident	85.2	Confident	77 Å²	77	76.9 Å²	76.9	54%	0.538	40%	0.398	S	S	.	.	H	α-helix	trans	-63.9	-35.5	177.6	-176	0	0	0	0	111.6	G534	G534-S537 PolarHBondContact O-N 2.91Å
538	Y	84.7	Confident	85.4	Confident	5 Å²	5	78.3 Å²	78.3	2%	0.02	40%	0.401	C	S	.	.	H	α-helix	trans	-60.6	-51.4	176.7	-172.1	-90.4	0	0	0	112.7	D526 H529 I530 G534 F535 R536 N541 N544 F548	D526-Y538 PolarHBondContact OD2-OH 3.09Å; H529-Y538 HydrophobicContact CB-CE2 4.5Å; H529-Y538 AromaticContact CE1-CD2 3.9Å; H529-Y538 AromaticContact ND1-CD2 3.2Å; H529-Y538 WeakPolarHBondContact ND1-CD2 3.28Å; H529-Y538 AromaticContact ND1-CE2 3.35Å; H529-Y538 VanDerWaalsContact ND1-CE2 3.35Å; H529-Y538 WeakPolarHBondContact ND1-CE2 3.38Å; I530-Y538 HydrophobicContact CD1-CD1 4.3Å; I530-Y538 HydrophobicContact CD1-CD2 4.43Å; I530-Y538 HydrophobicContact CD1-CE1 4.15Å; I530-Y538 HydrophobicContact CD1-CE2 4.28Å; I530-Y538 HydrophobicContact CD1-CG 4.45Å; I530-Y538 HydrophobicContact CG1-CD1 3.94Å; I530-Y538 HydrophobicContact CG1-CD2 3.44Å; I530-Y538 VanDerWaalsContact CG1-CD2 3.44Å; I530-Y538 HydrophobicContact CG1-CE1 4.13Å; I530-Y538 HydrophobicContact CG1-CE2 3.66Å; I530-Y538 HydrophobicContact CG1-CG 3.61Å; G534-Y538 PolarHBondContact O-N 3.21Å; G534-Y538 VanDerWaalsContact O-N 3.13Å; F535-Y538 WeakPolarHBondContact O-CB 3.48Å; F535-Y538 PolarHBondContact O-N 3.48Å; R536-Y538 VanDerWaalsContact C-N 3.26Å; R536-Y538 PolarHBondContact O-N 3.32Å; Y538-N541 PolarHBondContact O-N 3.48Å; Y538-N544 HydrophobicContact CD1-CB 4.1Å; Y538-N544 HydrophobicContact CD2-CB 4.09Å; Y538-N544 HydrophobicContact CE1-CB 3.83Å; Y538-N544 HydrophobicContact CE2-CB 3.83Å; Y538-N544 HydrophobicContact CG-CB 4.21Å; Y538-N544 VanDerWaalsContact O-CB 3.23Å; Y538-N544 WeakPolarHBondContact O-CB 3.34Å; Y538-N544 PolarHBondContact O-ND2 3.31Å; Y538-N544 PolarHBondContact OH-O 2.96Å; Y538-F548 HydrophobicContact CE1-CB 4.4Å
539	I	87	Confident	85.7	Confident	75 Å²	75	77.1 Å²	77.1	39%	0.385	40%	0.402	S	S	.	.	H	α-helix	trans	-70.6	-31.1	-175.5	-70.9	-179	0	0	0	112.8	F535 R536 N541	F535-I539 HydrophobicContact CD1-CD1 4.12Å; F535-I539 HydrophobicContact CD2-CD1 4.33Å; F535-I539 HydrophobicContact CE1-CD1 3.44Å; F535-I539 VanDerWaalsContact CE1-CD1 3.44Å; F535-I539 HydrophobicContact CE2-CD1 3.69Å; F535-I539 HydrophobicContact CE2-CG1 4.39Å; F535-I539 HydrophobicContact CZ-CD1 3.21Å; F535-I539 HydrophobicContact CZ-CG1 4.33Å; F535-I539 PolarHBondContact O-N 3.41Å; F535-I539 VanDerWaalsContact O-N 3.16Å; R536-I539 PolarHBondContact O-N 2.8Å; I539-N541 PolarHBondContact O-N 2.99Å
540	C	83.4	Confident	86.2	Confident	103 Å²	103	73.8 Å²	73.8	70%	0.696	39%	0.387	S	S	*	.	H	α-helix	trans	-62.9	-21.4	178.4	-70.6	0	0	0	0	113.3	R536	R536-C540 PolarHBondContact O-N 3.35Å; R536-C540 PolarHBondContact O-SG 2.91Å
541	N	84.4	Confident	86.5	Confident	67 Å²	67	71.7 Å²	71.7	36%	0.358	38%	0.376	S	S	.	.	S	Bend	trans	-89.4	116.7	175.8	-174.8	-6.4	0	0	0	111.1	Y538 I539 Y543 N544 L545	Y538-N541 PolarHBondContact O-N 3.48Å; I539-N541 PolarHBondContact O-N 2.99Å; N541-Y543 PolarHBondContact O-N 3.41Å; N541-Y543 PolarHBondContact OD1-N 3.31Å; N541-Y543 VanDerWaalsContact OD1-N 3.15Å; N541-N544 HydrophobicContact CB-CB 4.17Å; N541-N544 WeakPolarHBondContact O-CB 3.41Å; N541-N544 PolarHBondContact O-N 3.29Å; N541-L545 PolarHBondContact O-N 3.02Å; N541-L545 VanDerWaalsContact O-N 3.09Å
542	A	85.2	Confident	87	Confident	72 Å²	72	66.3 Å²	66.3	60%	0.595	36%	0.363	S	S	*	.	H	α-helix	trans	-55.6	-35.1	-179.6	0	0	0	0	0	113.6	L545 L546	A542-L545 PolarHBondContact O-N 2.86Å; A542-L546 WeakPolarHBondContact O-CB 3.22Å; A542-L546 PolarHBondContact O-N 2.96Å
543	Y	85.9	Confident	87.7	Confident	78 Å²	78	62 Å²	62	31%	0.306	35%	0.346	S	S	.	.	H	α-helix	trans	-69.1	-35.9	177.9	-70.4	-77.6	0	0	0	112.7	N541 L546 N547 Y645 Q657	N541-Y543 PolarHBondContact O-N 3.41Å; N541-Y543 PolarHBondContact OD1-N 3.31Å; N541-Y543 VanDerWaalsContact OD1-N 3.15Å; Y543-L546 PolarHBondContact O-N 2.99Å; Y543-N547 VanDerWaalsContact O-CG 3.31Å; Y543-N547 PolarHBondContact O-N 3.43Å; Y543-N547 PolarHBondContact O-ND2 3.25Å; Y543-Y645 HydrophobicContact CD1-CD2 4.39Å; Y543-Y645 HydrophobicContact CG-CD2 4.34Å; Y543-Q657 PolarHBondContact OH-NE2 3.47Å
544	N	87.9	Confident	88.5	Confident	22 Å²	22	60 Å²	60	12%	0.118	33%	0.329	C	S	.	.	H	α-helix	trans	-71.1	-37.6	177.1	-71.2	-15.5	0	0	0	111.1	Y538 N541 N547 F548	Y538-N544 HydrophobicContact CD1-CB 4.1Å; Y538-N544 HydrophobicContact CD2-CB 4.09Å; Y538-N544 HydrophobicContact CE1-CB 3.83Å; Y538-N544 HydrophobicContact CE2-CB 3.83Å; Y538-N544 HydrophobicContact CG-CB 4.21Å; Y538-N544 VanDerWaalsContact O-CB 3.23Å; Y538-N544 WeakPolarHBondContact O-CB 3.34Å; Y538-N544 PolarHBondContact O-ND2 3.31Å; Y538-N544 PolarHBondContact OH-O 2.96Å; N541-N544 HydrophobicContact CB-CB 4.17Å; N541-N544 WeakPolarHBondContact O-CB 3.41Å; N541-N544 PolarHBondContact O-N 3.29Å; N544-N547 PolarHBondContact O-N 3.49Å; N544-F548 PolarHBondContact O-N 3.04Å
545	L	88.7	Confident	89	Confident	79 Å²	79	61.5 Å²	61.5	41%	0.414	33%	0.329	S	S	.	.	H	α-helix	trans	-62.7	-44.5	171.6	-176.9	64.3	0	0	0	111.1	N541 A542 N547 F548 C549	N541-L545 PolarHBondContact O-N 3.02Å; N541-L545 VanDerWaalsContact O-N 3.09Å; A542-L545 PolarHBondContact O-N 2.86Å; L545-N547 VanDerWaalsContact C-N 3.35Å; L545-N547 PolarHBondContact O-N 2.91Å; L545-F548 WeakPolarHBondContact O-CB 3.38Å; L545-F548 PolarHBondContact O-N 3.44Å; L545-C549 PolarHBondContact O-N 3.1Å; L545-C549 PolarHBondContact O-SG 2.9Å; L545-C549 VanDerWaalsContact O-SG 3.39Å
546	L	90.1	Very high	89.4	Confident	59 Å²	59	55.7 Å²	55.7	31%	0.309	31%	0.308	S	S	.	.	H	α-helix	trans	-61	-41.8	175.3	-178.2	142.4	0	0	0	111.8	A542 Y543 F548 C549 I550 V638 R642	A542-L546 WeakPolarHBondContact O-CB 3.22Å; A542-L546 PolarHBondContact O-N 2.96Å; Y543-L546 PolarHBondContact O-N 2.99Å; L546-F548 PolarHBondContact O-N 3.42Å; L546-C549 PolarHBondContact O-N 2.98Å; L546-I550 HydrophobicContact CD2-CD1 3.49Å; L546-I550 VanDerWaalsContact CD2-CD1 3.49Å; L546-I550 HydrophobicContact CD2-CG1 4.32Å; L546-I550 HydrophobicContact CG-CD1 4.37Å; L546-I550 VanDerWaalsContact O-CG1 3.3Å; L546-I550 WeakPolarHBondContact O-CG1 3.46Å; L546-I550 PolarHBondContact O-N 3.09Å; L546-V638 HydrophobicContact CD1-CG1 4.11Å; L546-V638 HydrophobicContact CD2-CG1 4.06Å; L546-V638 HydrophobicContact CG-CG1 3.93Å; L546-R642 HydrophobicContact CD2-CB 4.45Å
547	N	89.7	Confident	89.7	Confident	16 Å²	16	49.2 Å²	49.2	9%	0.086	28%	0.283	C	S	.	.	H	α-helix	trans	-61.5	-42.2	173.6	-72.8	-26.7	0	0	0	112.3	Y543 N544 L545 C549 I550 L551 R642	Y543-N547 VanDerWaalsContact O-CG 3.31Å; Y543-N547 PolarHBondContact O-N 3.43Å; Y543-N547 PolarHBondContact O-ND2 3.25Å; N544-N547 PolarHBondContact O-N 3.49Å; L545-N547 VanDerWaalsContact C-N 3.35Å; L545-N547 PolarHBondContact O-N 2.91Å; N547-C549 PolarHBondContact O-N 3.23Å; N547-I550 PolarHBondContact O-N 3.04Å; N547-L551 WeakPolarHBondContact O-CB 3.44Å; N547-L551 WeakPolarHBondContact O-CG 3.34Å; N547-L551 PolarHBondContact O-N 3.48Å; N547-R642 WeakPolarHBondContact OD1-CD 3.29Å; N547-R642 PolarHBondContact OD1-NE 3.37Å; N547-R642 VanDerWaalsContact OD1-NE 3.09Å; N547-R642 PolarHBondContact OD1-NH1 2.94Å
548	F	91	Very high	90.1	Very high	120 Å²	120	46.4 Å²	46.4	53%	0.526	26%	0.261	S	S	.	.	H	α-helix	trans	-60.8	-43.1	175.3	177.7	-97.8	0	0	0	111.9	Y538 N544 L545 L546 L551 S552	Y538-F548 HydrophobicContact CE1-CB 4.4Å; N544-F548 PolarHBondContact O-N 3.04Å; L545-F548 WeakPolarHBondContact O-CB 3.38Å; L545-F548 PolarHBondContact O-N 3.44Å; L546-F548 PolarHBondContact O-N 3.42Å; F548-L551 PolarHBondContact O-N 3.17Å; F548-S552 WeakPolarHBondContact O-CB 3.34Å; F548-S552 PolarHBondContact O-N 3.23Å; F548-S552 PolarHBondContact O-OG 3.03Å
549	C	91.7	Very high	90.5	Very high	55 Å²	55	49.4 Å²	49.4	37%	0.372	28%	0.28	S	S	.	.	H	α-helix	trans	-63.3	-42.6	174.8	-68.5	0	0	0	0	112.7	L545 L546 N547 S552 M553	L545-C549 PolarHBondContact O-N 3.1Å; L545-C549 PolarHBondContact O-SG 2.9Å; L545-C549 VanDerWaalsContact O-SG 3.39Å; L546-C549 PolarHBondContact O-N 2.98Å; N547-C549 PolarHBondContact O-N 3.23Å; C549-S552 PolarHBondContact O-OG 3.48Å; C549-M553 VanDerWaalsContact O-CG 3.3Å; C549-M553 WeakPolarHBondContact O-CG 3.29Å; C549-M553 PolarHBondContact O-N 3.29Å
550	I	93.6	Very high	90.7	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.021	27%	0.272	C	S	.	.	H	α-helix	trans	-61.4	-49	176.2	-66.9	164.4	0	0	0	110.2	L546 N547 M553 Y554 V638 R642	L546-I550 HydrophobicContact CD2-CD1 3.49Å; L546-I550 VanDerWaalsContact CD2-CD1 3.49Å; L546-I550 HydrophobicContact CD2-CG1 4.32Å; L546-I550 HydrophobicContact CG-CD1 4.37Å; L546-I550 VanDerWaalsContact O-CG1 3.3Å; L546-I550 WeakPolarHBondContact O-CG1 3.46Å; L546-I550 PolarHBondContact O-N 3.09Å; N547-I550 PolarHBondContact O-N 3.04Å; I550-M553 PolarHBondContact O-N 3.37Å; I550-Y554 HydrophobicContact CG2-CD2 3.53Å; I550-Y554 HydrophobicContact CG2-CE2 3.27Å; I550-Y554 WeakPolarHBondContact O-CD2 3.26Å; I550-Y554 PolarHBondContact O-N 3.41Å; I550-V638 HydrophobicContact CD1-CB 4.43Å; I550-V638 HydrophobicContact CD1-CG1 3.79Å; I550-V638 HydrophobicContact CG1-CB 3.92Å; I550-V638 HydrophobicContact CG1-CG1 3.46Å; I550-V638 VanDerWaalsContact CG1-CG1 3.46Å; I550-R642 HydrophobicContact CD1-CB 4.17Å
551	L	92.7	Very high	91	Very high	4 Å²	4	43.8 Å²	43.8	2%	0.021	24%	0.242	C	C	.	.	H	α-helix	trans	-66.2	-39.8	-177.8	-72.3	176.1	0	0	0	112	V519 L522 D526 N547 F548 M553 Y554 I555	V519-L551 HydrophobicContact CG1-CD2 4.16Å; L522-L551 HydrophobicContact CB-CD2 3.78Å; L522-L551 HydrophobicContact CD1-CD2 4.45Å; D526-L551 HydrophobicContact CB-CD1 4.09Å; D526-L551 WeakPolarHBondContact OD2-CD1 3.38Å; N547-L551 WeakPolarHBondContact O-CB 3.44Å; N547-L551 WeakPolarHBondContact O-CG 3.34Å; N547-L551 PolarHBondContact O-N 3.48Å; F548-L551 PolarHBondContact O-N 3.17Å; L551-M553 VanDerWaalsContact C-N 3.32Å; L551-M553 PolarHBondContact O-N 3.47Å; L551-Y554 PolarHBondContact O-N 3.45Å; L551-I555 WeakPolarHBondContact O-CB 3.5Å; L551-I555 WeakPolarHBondContact O-CD1 3.26Å; L551-I555 WeakPolarHBondContact O-CG1 3.35Å; L551-I555 PolarHBondContact O-N 3.22Å
552	S	93.9	Very high	91.2	Very high	55 Å²	55	45.4 Å²	45.4	39%	0.385	25%	0.25	S	C	.	.	H	α-helix	trans	-64	-38.4	176.1	69.8	0	0	0	0	111.7	F548 C549 G556	F548-S552 WeakPolarHBondContact O-CB 3.34Å; F548-S552 PolarHBondContact O-N 3.23Å; F548-S552 PolarHBondContact O-OG 3.03Å; C549-S552 PolarHBondContact O-OG 3.48Å; S552-G556 PolarHBondContact O-N 3.32Å
553	M	94.3	Very high	91.5	Very high	60 Å²	60	45.2 Å²	45.2	30%	0.296	24%	0.238	S	C	.	.	H	α-helix	trans	-66.9	-42.8	174.3	-71.7	-179.2	175.8	0	0	112.6	C549 I550 L551 G556 S557 M631 V634 A635	C549-M553 VanDerWaalsContact O-CG 3.3Å; C549-M553 WeakPolarHBondContact O-CG 3.29Å; C549-M553 PolarHBondContact O-N 3.29Å; I550-M553 PolarHBondContact O-N 3.37Å; L551-M553 VanDerWaalsContact C-N 3.32Å; L551-M553 PolarHBondContact O-N 3.47Å; M553-G556 PolarHBondContact O-N 3.25Å; M553-S557 VanDerWaalsContact O-CB 3.31Å; M553-S557 WeakPolarHBondContact O-CB 3.15Å; M553-S557 PolarHBondContact O-N 2.86Å; M553-M631 HydrophobicContact CB-CE 4.43Å; M553-M631 HydrophobicContact CG-CE 4.43Å; M553-V634 HydrophobicContact CE-CG1 4Å; M553-V634 HydrophobicContact SD-CB 4.3Å; M553-V634 HydrophobicContact SD-CG1 3.72Å; M553-A635 HydrophobicContact CB-CB 3.84Å
554	Y	94	Very high	91.6	Very high	1 Å²	1	41.5 Å²	41.5	0%	0.004	22%	0.224	C	C	.	.	H	α-helix	trans	-64.5	-45	175.8	-77.9	-49.6	0	0	0	112.4	F461 L465 V519 I550 L551 S557 Y558 F632 A635 N636 S639	F461-Y554 HydrophobicContact CZ-CE2 4.12Å; L465-Y554 WeakPolarHBondContact CD1-OH 3.34Å; V519-Y554 HydrophobicContact CG2-CD2 4.12Å; V519-Y554 HydrophobicContact CG2-CG 4.08Å; I550-Y554 HydrophobicContact CG2-CD2 3.53Å; I550-Y554 HydrophobicContact CG2-CE2 3.27Å; I550-Y554 WeakPolarHBondContact O-CD2 3.26Å; I550-Y554 PolarHBondContact O-N 3.41Å; L551-Y554 PolarHBondContact O-N 3.45Å; Y554-S557 PolarHBondContact O-N 3.33Å; Y554-Y558 VanDerWaalsContact O-CD2 3.24Å; Y554-Y558 WeakPolarHBondContact O-CD2 3.49Å; Y554-Y558 PolarHBondContact O-N 2.96Å; Y554-F632 HydrophobicContact CD1-CD2 4.03Å; Y554-F632 HydrophobicContact CD1-CE2 4.19Å; Y554-F632 HydrophobicContact CE1-CD2 4.03Å; Y554-F632 AromaticContact CE1-CE2 3.95Å; Y554-F632 HydrophobicContact CE1-CE2 3.95Å; Y554-A635 HydrophobicContact CD1-CB 3.68Å; Y554-A635 HydrophobicContact CD2-CB 4.35Å; Y554-A635 HydrophobicContact CE1-CB 3.5Å; Y554-A635 VanDerWaalsContact CE1-CB 3.5Å; Y554-A635 HydrophobicContact CE2-CB 4.21Å; Y554-A635 HydrophobicContact CG-CB 4.09Å; Y554-A635 PolarHBondContact OH-O 3.05Å; Y554-N636 WeakPolarHBondContact CE1-OD1 3.46Å; Y554-N636 PolarHBondContact OH-OD1 3.4Å; Y554-S639 WeakPolarHBondContact OH-CB 3.33Å; Y554-S639 PolarHBondContact OH-OG 3.43Å
555	I	94	Very high	91.5	Very high	64 Å²	64	41.1 Å²	41.1	33%	0.328	22%	0.221	S	C	.	.	H	α-helix	trans	-63.8	-46.6	177.5	-66.1	164.5	0	0	0	109.6	V519 L523 L551 S557 Y558 T559	V519-I555 HydrophobicContact CG1-CG1 4.35Å; L523-I555 HydrophobicContact CD1-CD1 3.94Å; L523-I555 HydrophobicContact CD2-CD1 3.87Å; L523-I555 HydrophobicContact CG-CD1 4.41Å; L551-I555 WeakPolarHBondContact O-CB 3.5Å; L551-I555 WeakPolarHBondContact O-CD1 3.26Å; L551-I555 WeakPolarHBondContact O-CG1 3.35Å; L551-I555 PolarHBondContact O-N 3.22Å; I555-S557 PolarHBondContact O-N 3.34Å; I555-Y558 PolarHBondContact O-N 2.92Å; I555-T559 HydrophobicContact CG2-CG2 4.08Å; I555-T559 WeakPolarHBondContact O-CB 3.45Å; I555-T559 VanDerWaalsContact O-CG2 3.23Å; I555-T559 WeakPolarHBondContact O-CG2 3.4Å; I555-T559 PolarHBondContact O-N 3.14Å; I555-T559 PolarHBondContact O-OG1 3.47Å; I555-T559 VanDerWaalsContact O-OG1 3.11Å
556	G	94.4	Very high	91.4	Very high	17 Å²	17	46 Å²	46	18%	0.175	23%	0.234	C	C	.	.	H	α-helix	trans	-54.9	-49.5	174.9	0	0	0	0	0	112.3	S552 M553 Y558 T559 L560	S552-G556 PolarHBondContact O-N 3.32Å; M553-G556 PolarHBondContact O-N 3.25Å; G556-Y558 PolarHBondContact O-N 2.79Å; G556-T559 WeakPolarHBondContact CA-OG1 3.42Å; G556-T559 PolarHBondContact O-N 3.13Å; G556-T559 PolarHBondContact O-OG1 3.16Å; G556-L560 WeakPolarHBondContact O-CG 3.32Å; G556-L560 PolarHBondContact O-N 3.3Å
557	S	93.3	Very high	91.3	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-57.9	-49.9	176.4	171.5	0	0	0	0	112.5	M553 Y554 I555 L560 R561 S628 F632	M553-S557 VanDerWaalsContact O-CB 3.31Å; M553-S557 WeakPolarHBondContact O-CB 3.15Å; M553-S557 PolarHBondContact O-N 2.86Å; Y554-S557 PolarHBondContact O-N 3.33Å; I555-S557 PolarHBondContact O-N 3.34Å; S557-L560 PolarHBondContact O-N 2.63Å; S557-R561 PolarHBondContact O-N 2.91Å; S557-S628 VanDerWaalsContact C-OG 3.29Å; S557-S628 WeakPolarHBondContact CA-OG 3.34Å; S557-S628 PolarHBondContact O-OG 3.23Å; S557-S628 PolarHBondContact OG-O 3.29Å; S557-S628 PolarHBondContact OG-OG 3.21Å; S557-F632 WeakPolarHBondContact OG-CB 3.38Å
558	Y	91.6	Very high	91	Very high	19 Å²	19	47.4 Å²	47.4	8%	0.075	24%	0.235	C	C	.	.	H	α-helix	trans	-71.3	-32.6	-178.5	-78.8	-66	0	0	0	113.3	Q512 I515 V516 Y554 I555 G556 R561 I562 F632	Q512-Y558 HydrophobicContact CB-CE1 4.32Å; I515-Y558 WeakPolarHBondContact CB-OH 3.49Å; I515-Y558 HydrophobicContact CG2-CE2 3.99Å; I515-Y558 WeakPolarHBondContact CG2-OH 3.36Å; V516-Y558 HydrophobicContact CG2-CD1 3.47Å; V516-Y558 VanDerWaalsContact CG2-CD1 3.47Å; V516-Y558 HydrophobicContact CG2-CD2 3.93Å; V516-Y558 HydrophobicContact CG2-CE1 3.49Å; V516-Y558 VanDerWaalsContact CG2-CE1 3.49Å; V516-Y558 HydrophobicContact CG2-CE2 3.95Å; V516-Y558 HydrophobicContact CG2-CG 3.72Å; Y554-Y558 VanDerWaalsContact O-CD2 3.24Å; Y554-Y558 WeakPolarHBondContact O-CD2 3.49Å; Y554-Y558 PolarHBondContact O-N 2.96Å; I555-Y558 PolarHBondContact O-N 2.92Å; G556-Y558 PolarHBondContact O-N 2.79Å; Y558-R561 PolarHBondContact O-N 3.1Å; Y558-I562 WeakPolarHBondContact O-CD1 3.32Å; Y558-I562 VanDerWaalsContact O-CG1 3.24Å; Y558-I562 WeakPolarHBondContact O-CG1 3.2Å; Y558-I562 PolarHBondContact O-N 3.37Å; Y558-F632 HydrophobicContact CE2-CE2 4.33Å
559	T	93.1	Very high	90.7	Very high	67 Å²	67	47.8 Å²	47.8	41%	0.411	23%	0.233	S	C	.	.	H	α-helix	trans	-62.8	-45.2	172.7	56.8	0	0	0	0	111.3	I555 G556 I562 I563	I555-T559 HydrophobicContact CG2-CG2 4.08Å; I555-T559 WeakPolarHBondContact O-CB 3.45Å; I555-T559 VanDerWaalsContact O-CG2 3.23Å; I555-T559 WeakPolarHBondContact O-CG2 3.4Å; I555-T559 PolarHBondContact O-N 3.14Å; I555-T559 PolarHBondContact O-OG1 3.47Å; I555-T559 VanDerWaalsContact O-OG1 3.11Å; G556-T559 WeakPolarHBondContact CA-OG1 3.42Å; G556-T559 PolarHBondContact O-N 3.13Å; G556-T559 PolarHBondContact O-OG1 3.16Å; T559-I562 PolarHBondContact O-N 3.04Å; T559-I563 VanDerWaalsContact O-CG1 3.28Å; T559-I563 WeakPolarHBondContact O-CG1 3.49Å; T559-I563 PolarHBondContact O-N 3.16Å
560	L	92.4	Very high	90.4	Very high	41 Å²	41	49.7 Å²	49.7	22%	0.215	24%	0.236	C	C	.	.	H	α-helix	trans	-60.9	-44.7	174.3	-70.1	173	0	0	0	111.6	G556 S557 I562 I563 V564 P624 V627 M631	G556-L560 WeakPolarHBondContact O-CG 3.32Å; G556-L560 PolarHBondContact O-N 3.3Å; S557-L560 PolarHBondContact O-N 2.63Å; L560-I562 PolarHBondContact O-N 3.49Å; L560-I563 PolarHBondContact O-N 2.64Å; L560-V564 WeakPolarHBondContact O-CG2 3.31Å; L560-V564 PolarHBondContact O-N 2.88Å; L560-P624 HydrophobicContact CD2-CB 4.01Å; L560-V627 HydrophobicContact CD1-CB 4.21Å; L560-V627 HydrophobicContact CD1-CG1 3.82Å; L560-M631 HydrophobicContact CD1-SD 4.23Å
561	R	89.5	Confident	89.9	Confident	20 Å²	20	49.7 Å²	49.7	8%	0.075	24%	0.237	C	C	.	.	H	α-helix	trans	-60.4	-39.8	175.7	-84.9	166.7	-176.3	173.2	1.9	113.2	S557 Y558 V564 D565 S628 D629	S557-R561 PolarHBondContact O-N 2.91Å; Y558-R561 PolarHBondContact O-N 3.1Å; R561-V564 PolarHBondContact O-N 3.25Å; R561-D565 WeakPolarHBondContact O-CB 3.39Å; R561-D565 PolarHBondContact O-N 3.06Å; R561-S628 WeakPolarHBondContact CG-OG 3.35Å; R561-S628 PolarHBondContact NE-OG 2.95Å; R561-D629 IonicContact CZ-OD1 2.69Å; R561-D629 IonicContact NE-OD1 2.92Å; R561-D629 IonicContact NH2-OD1 3.37Å; R561-D629 PolarHBondContact NH2-OD1 3.1Å
562	I	89.1	Confident	89.3	Confident	100 Å²	100	50.5 Å²	50.5	51%	0.513	24%	0.241	S	C	.	.	H	α-helix	trans	-67.4	-39.5	176.6	-68.8	164.4	0	0	0	110.8	Y558 T559 L560 D565 R566	Y558-I562 WeakPolarHBondContact O-CD1 3.32Å; Y558-I562 VanDerWaalsContact O-CG1 3.24Å; Y558-I562 WeakPolarHBondContact O-CG1 3.2Å; Y558-I562 PolarHBondContact O-N 3.37Å; T559-I562 PolarHBondContact O-N 3.04Å; L560-I562 PolarHBondContact O-N 3.49Å; I562-D565 PolarHBondContact O-N 2.96Å; I562-R566 PolarHBondContact O-N 3.36Å
563	I	90.6	Very high	88.9	Confident	68 Å²	68	54.3 Å²	54.3	35%	0.349	26%	0.256	S	S	.	.	H	α-helix	trans	-62.7	-45.8	174.7	-68.3	164.4	0	0	0	110.2	T559 L560 R566 W567	T559-I563 VanDerWaalsContact O-CG1 3.28Å; T559-I563 WeakPolarHBondContact O-CG1 3.49Å; T559-I563 PolarHBondContact O-N 3.16Å; L560-I563 PolarHBondContact O-N 2.64Å; I563-R566 WeakPolarHBondContact O-CB 3.44Å; I563-R566 PolarHBondContact O-N 2.99Å; I563-W567 HydrophobicContact CG2-CD2 3.86Å; I563-W567 HydrophobicContact CG2-CE3 4.17Å; I563-W567 HydrophobicContact CG2-CH2 3.91Å; I563-W567 HydrophobicContact CG2-CZ2 3.52Å; I563-W567 HydrophobicContact CG2-CZ3 4.23Å; I563-W567 PolarHBondContact O-N 3.45Å
564	V	87.6	Confident	88.4	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-62.6	-44.2	176.7	-178.5	0	0	0	0	111	L560 R561 R566 W567 V568 P624 E625	L560-V564 WeakPolarHBondContact O-CG2 3.31Å; L560-V564 PolarHBondContact O-N 2.88Å; R561-V564 PolarHBondContact O-N 3.25Å; V564-R566 VanDerWaalsContact C-N 3.26Å; V564-R566 PolarHBondContact O-N 3.13Å; V564-W567 PolarHBondContact O-N 3.5Å; V564-W567 VanDerWaalsContact O-N 3.16Å; V564-V568 HydrophobicContact CG1-CG2 3.99Å; V564-V568 WeakPolarHBondContact O-CB 3.44Å; V564-V568 WeakPolarHBondContact O-CG2 3.45Å; V564-V568 PolarHBondContact O-N 3.43Å; V564-P624 HydrophobicContact CG2-CB 3.81Å; V564-P624 HydrophobicContact CG2-CG 3.6Å; V564-E625 HydrophobicContact CG1-CB 4.44Å; V564-E625 HydrophobicContact CG2-CB 4.28Å
565	D	85.5	Confident	87.7	Confident	13 Å²	13	57 Å²	57	7%	0.07	27%	0.266	C	S	.	.	H	α-helix	trans	-57.8	-40.9	175.5	-175	56.9	0	0	0	111.6	I507 I508 R561 I562 R569	I507-D565 HydrophobicContact CB-CB 4.46Å; I507-D565 HydrophobicContact CD1-CB 4.2Å; I507-D565 HydrophobicContact CG2-CB 4.19Å; I508-D565 HydrophobicContact CD1-CB 4.45Å; R561-D565 WeakPolarHBondContact O-CB 3.39Å; R561-D565 PolarHBondContact O-N 3.06Å; I562-D565 PolarHBondContact O-N 2.96Å; D565-R569 WeakPolarHBondContact O-CB 3.46Å; D565-R569 WeakPolarHBondContact O-CG 3.32Å; D565-R569 PolarHBondContact O-N 3.32Å; D565-R569 IonicContact OD1-NE 3.85Å; D565-R569 PolarHBondContact OD1-NE 2.84Å; D565-R569 IonicContact OD1-NH2 2.82Å; D565-R569 IonicContact OD2-CZ 3.8Å; D565-R569 VanDerWaalsContact OD2-CZ 3.22Å; D565-R569 IonicContact OD2-NE 3.68Å; D565-R569 PolarHBondContact OD2-NE 3.46Å; D565-R569 IonicContact OD2-NH2 3.79Å; D565-R569 PolarHBondContact OD2-NH2 2.89Å
566	R	87.3	Confident	87.2	Confident	181 Å²	181	57.5 Å²	57.5	68%	0.683	27%	0.27	S	S	*	.	H	α-helix	trans	-63.1	-47.2	174.7	-177.5	179.3	174.2	167.3	-0.4	112.1	I562 I563 V564 R569 E570	I562-R566 PolarHBondContact O-N 3.36Å; I563-R566 WeakPolarHBondContact O-CB 3.44Å; I563-R566 PolarHBondContact O-N 2.99Å; V564-R566 VanDerWaalsContact C-N 3.26Å; V564-R566 PolarHBondContact O-N 3.13Å; R566-R569 PolarHBondContact O-N 3.19Å; R566-E570 WeakPolarHBondContact O-CB 3.44Å; R566-E570 PolarHBondContact O-N 3.49Å
567	W	87.7	Confident	86.2	Confident	102 Å²	102	56.7 Å²	56.7	39%	0.386	26%	0.262	S	S	.	.	H	α-helix	trans	-65.9	-39.6	-180	-66.5	-16.2	0	0	0	112.4	I563 V564 E570 S571 F611 P624	I563-W567 HydrophobicContact CG2-CD2 3.86Å; I563-W567 HydrophobicContact CG2-CE3 4.17Å; I563-W567 HydrophobicContact CG2-CH2 3.91Å; I563-W567 HydrophobicContact CG2-CZ2 3.52Å; I563-W567 HydrophobicContact CG2-CZ3 4.23Å; I563-W567 PolarHBondContact O-N 3.45Å; V564-W567 PolarHBondContact O-N 3.5Å; V564-W567 VanDerWaalsContact O-N 3.16Å; W567-E570 PolarHBondContact O-N 2.97Å; W567-S571 PolarHBondContact O-N 2.84Å; W567-S571 PolarHBondContact O-OG 3.4Å; W567-F611 HydrophobicContact CB-CD1 4.44Å; W567-F611 HydrophobicContact CB-CD2 4.28Å; W567-F611 HydrophobicContact CB-CE1 4.46Å; W567-F611 HydrophobicContact CB-CE2 4.3Å; W567-F611 HydrophobicContact CB-CG 4.36Å; W567-F611 HydrophobicContact CB-CZ 4.4Å; W567-F611 HydrophobicContact CD2-CZ 4.1Å; W567-F611 AromaticContact CE3-CE1 3.57Å; W567-F611 HydrophobicContact CE3-CE1 3.57Å; W567-F611 HydrophobicContact CE3-CE2 4.13Å; W567-F611 AromaticContact CE3-CZ 3.32Å; W567-F611 HydrophobicContact CE3-CZ 3.32Å; W567-F611 HydrophobicContact CZ3-CE1 4.2Å; W567-F611 AromaticContact CZ3-CZ 3.82Å; W567-F611 HydrophobicContact CZ3-CZ 3.82Å; W567-P624 HydrophobicContact CE3-CG 4.33Å; W567-P624 HydrophobicContact CZ3-CG 3.79Å
568	V	83.7	Confident	85.4	Confident	3 Å²	3	58.6 Å²	58.6	2%	0.018	27%	0.273	C	S	.	.	H	α-helix	trans	-66.5	-39.9	176.6	174	0	0	0	0	111.2	R502 I507 V564 S571 D572 F611	R502-V568 HydrophobicContact CG-CG1 4.15Å; R502-V568 VanDerWaalsContact CZ-CG2 3.46Å; I507-V568 HydrophobicContact CD1-CB 3.83Å; I507-V568 HydrophobicContact CD1-CG1 3.95Å; I507-V568 HydrophobicContact CD1-CG2 3.87Å; V564-V568 HydrophobicContact CG1-CG2 3.99Å; V564-V568 WeakPolarHBondContact O-CB 3.44Å; V564-V568 WeakPolarHBondContact O-CG2 3.45Å; V564-V568 PolarHBondContact O-N 3.43Å; V568-S571 PolarHBondContact O-N 3.42Å; V568-D572 WeakPolarHBondContact O-CB 3.38Å; V568-D572 PolarHBondContact O-N 2.87Å; V568-F611 HydrophobicContact CG2-CB 4.24Å
569	R	83.9	Confident	84.7	Confident	128 Å²	128	61.6 Å²	61.6	48%	0.483	29%	0.293	S	S	.	.	H	α-helix	trans	-64.2	-40.8	172.8	-74.1	173.5	-169.3	-136.9	11.2	112.2	D565 R566 S571 D572 L573	D565-R569 WeakPolarHBondContact O-CB 3.46Å; D565-R569 WeakPolarHBondContact O-CG 3.32Å; D565-R569 PolarHBondContact O-N 3.32Å; D565-R569 IonicContact OD1-NE 3.85Å; D565-R569 PolarHBondContact OD1-NE 2.84Å; D565-R569 IonicContact OD1-NH2 2.82Å; D565-R569 IonicContact OD2-CZ 3.8Å; D565-R569 VanDerWaalsContact OD2-CZ 3.22Å; D565-R569 IonicContact OD2-NE 3.68Å; D565-R569 PolarHBondContact OD2-NE 3.46Å; D565-R569 IonicContact OD2-NH2 3.79Å; D565-R569 PolarHBondContact OD2-NH2 2.89Å; R566-R569 PolarHBondContact O-N 3.19Å; R569-S571 VanDerWaalsContact C-N 3.34Å; R569-D572 PolarHBondContact O-N 3.07Å; R569-L573 WeakPolarHBondContact O-CB 3.48Å; R569-L573 VanDerWaalsContact O-CG 3.23Å; R569-L573 WeakPolarHBondContact O-CG 3.47Å; R569-L573 PolarHBondContact O-N 3.31Å
570	E	85.5	Confident	84	Confident	96 Å²	96	62 Å²	62	45%	0.449	29%	0.291	S	S	.	.	H	α-helix	trans	-63.9	-41.3	177.4	-170.8	175.6	164.1	0	0	111.5	R566 W567 F574	R566-E570 WeakPolarHBondContact O-CB 3.44Å; R566-E570 PolarHBondContact O-N 3.49Å; W567-E570 PolarHBondContact O-N 2.97Å; E570-F574 WeakPolarHBondContact O-CB 3.13Å; E570-F574 PolarHBondContact O-N 3.25Å
571	S	83.6	Confident	83.1	Confident	4 Å²	4	60.2 Å²	60.2	3%	0.028	28%	0.282	C	S	.	.	H	α-helix	trans	-66.7	-43.7	173.2	-68.5	0	0	0	0	112.7	W567 V568 R569 L573 F574 F575 K608	W567-S571 PolarHBondContact O-N 2.84Å; W567-S571 PolarHBondContact O-OG 3.4Å; V568-S571 PolarHBondContact O-N 3.42Å; R569-S571 VanDerWaalsContact C-N 3.34Å; S571-L573 VanDerWaalsContact C-N 3.33Å; S571-L573 PolarHBondContact O-N 3.08Å; S571-F574 PolarHBondContact O-N 3.31Å; S571-F575 WeakPolarHBondContact O-CD2 3.37Å; S571-F575 PolarHBondContact O-N 3.5Å; S571-F575 VanDerWaalsContact O-N 3.15Å; S571-K608 VanDerWaalsContact CB-O 3.27Å; S571-K608 WeakPolarHBondContact CB-O 3.49Å; S571-K608 WeakPolarHBondContact OG-CA 3.35Å; S571-K608 PolarHBondContact OG-O 2.88Å
572	D	81.5	Confident	82.4	Confident	21 Å²	21	63.2 Å²	63.2	11%	0.112	30%	0.299	C	S	.	.	H	α-helix	trans	-60.9	-42	176.9	-177	60.1	0	0	0	111.7	S504 V568 R569 N576 A577 T578	S504-D572 VanDerWaalsContact OG-CB 3.29Å; S504-D572 WeakPolarHBondContact OG-CB 3.21Å; S504-D572 VanDerWaalsContact OG-CG 3.27Å; S504-D572 PolarHBondContact OG-OD2 3.41Å; V568-D572 WeakPolarHBondContact O-CB 3.38Å; V568-D572 PolarHBondContact O-N 2.87Å; R569-D572 PolarHBondContact O-N 3.07Å; D572-N576 CarbonylContact O-C 3.57Å; D572-N576 WeakPolarHBondContact O-CA 3.37Å; D572-N576 PolarHBondContact O-N 3.42Å; D572-A577 PolarHBondContact O-N 3.19Å; D572-T578 VanDerWaalsContact CG-OG1 3.22Å; D572-T578 WeakPolarHBondContact OD1-CB 3.46Å; D572-T578 PolarHBondContact OD1-N 2.88Å; D572-T578 PolarHBondContact OD1-OG1 3.34Å; D572-T578 PolarHBondContact OD2-OG1 3.08Å
573	L	84.1	Confident	81.9	Confident	134 Å²	134	64.3 Å²	64.3	70%	0.702	30%	0.3	S	S	*	.	H	α-helix	trans	-64.9	-39.5	174.8	-74.8	169.1	0	0	0	112.3	R569 S571 N576	R569-L573 WeakPolarHBondContact O-CB 3.48Å; R569-L573 VanDerWaalsContact O-CG 3.23Å; R569-L573 WeakPolarHBondContact O-CG 3.47Å; R569-L573 PolarHBondContact O-N 3.31Å; S571-L573 VanDerWaalsContact C-N 3.33Å; S571-L573 PolarHBondContact O-N 3.08Å; L573-N576 PolarHBondContact O-N 3.26Å
574	F	83.7	Confident	81.1	Confident	92 Å²	92	62.2 Å²	62.2	40%	0.404	29%	0.29	S	S	.	.	H	α-helix	trans	-65.2	-41.8	-178.5	-176.9	-99.4	0	0	0	112.7	E570 S571 H605 K608	E570-F574 WeakPolarHBondContact O-CB 3.13Å; E570-F574 PolarHBondContact O-N 3.25Å; S571-F574 PolarHBondContact O-N 3.31Å; F574-H605 HydrophobicContact CE1-CB 4.43Å; F574-H605 AromaticContact CE1-CD2 3.84Å; F574-H605 AromaticContact CZ-CD2 3.72Å; F574-K608 HydrophobicContact CB-CD 3.95Å; F574-K608 HydrophobicContact CD1-CB 4.41Å; F574-K608 HydrophobicContact CD1-CD 3.62Å; F574-K608 HydrophobicContact CD2-CD 3.79Å; F574-K608 HydrophobicContact CE1-CD 4Å; F574-K608 HydrophobicContact CE2-CD 4.14Å; F574-K608 HydrophobicContact CG-CD 3.49Å; F574-K608 VanDerWaalsContact CG-CD 3.49Å; F574-K608 HydrophobicContact CZ-CD 4.23Å
575	F	79.3	Confident	80.3	Confident	25 Å²	25	62.7 Å²	62.7	11%	0.11	29%	0.292	C	S	.	.	H	α-helix	trans	-90.4	-6	177.2	-69.9	-81.5	0	0	0	113.2	S571 A577 Q580 W600 S603 K608 I612	S571-F575 WeakPolarHBondContact O-CD2 3.37Å; S571-F575 PolarHBondContact O-N 3.5Å; S571-F575 VanDerWaalsContact O-N 3.15Å; F575-A577 HydrophobicContact CB-CB 4Å; F575-A577 PolarHBondContact O-N 3.17Å; F575-Q580 PolarHBondContact O-NE2 2.85Å; F575-W600 HydrophobicContact CD1-CB 4.44Å; F575-W600 AromaticContact CD1-CD1 3.54Å; F575-W600 HydrophobicContact CD1-CD2 4.47Å; F575-W600 AromaticContact CD1-CG 3.93Å; F575-W600 HydrophobicContact CD1-CG 3.93Å; F575-W600 AromaticContact CD1-NE1 3.86Å; F575-W600 HydrophobicContact CE1-CB 4.35Å; F575-W600 AromaticContact CE1-CD1 3.95Å; F575-W600 HydrophobicContact CE1-CG 4.27Å; F575-W600 HydrophobicContact CG-CG 4.45Å; F575-S603 WeakPolarHBondContact CZ-OG 3.32Å; F575-K608 HydrophobicContact CE2-CB 3.91Å; F575-I612 HydrophobicContact CB-CD1 4.07Å; F575-I612 HydrophobicContact CD2-CD1 3.15Å; F575-I612 HydrophobicContact CE2-CD1 3.72Å; F575-I612 HydrophobicContact CG-CD1 3.83Å
576	N	83.1	Confident	79.7	Confident	76 Å²	76	69.8 Å²	69.8	41%	0.406	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	47	39.8	-166.7	-164.3	13.8	0	0	0	111.6	D572 L573 T579 Q580	D572-N576 CarbonylContact O-C 3.57Å; D572-N576 WeakPolarHBondContact O-CA 3.37Å; D572-N576 PolarHBondContact O-N 3.42Å; L573-N576 PolarHBondContact O-N 3.26Å; N576-T579 PolarHBondContact O-N 2.88Å; N576-T579 WeakPolarHBondContact OD1-CB 3.28Å; N576-T579 PolarHBondContact OD1-OG1 3.11Å; N576-Q580 WeakPolarHBondContact O-CG 3.07Å; N576-Q580 PolarHBondContact O-N 3.25Å
577	A	75.1	Confident	79	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-68.9	-47.9	-158.1	0	0	0	0	0	111.9	F501 D572 F575 T579 Q580 V581 W600 I612	F501-A577 HydrophobicContact CE2-CB 3.43Å; F501-A577 VanDerWaalsContact CE2-CB 3.43Å; F501-A577 HydrophobicContact CZ-CB 3.57Å; D572-A577 PolarHBondContact O-N 3.19Å; F575-A577 HydrophobicContact CB-CB 4Å; F575-A577 PolarHBondContact O-N 3.17Å; A577-T579 VanDerWaalsContact C-N 3.3Å; A577-T579 PolarHBondContact O-N 3.47Å; A577-Q580 PolarHBondContact O-N 3.07Å; A577-V581 WeakPolarHBondContact O-CB 3.37Å; A577-V581 VanDerWaalsContact O-CG2 3.26Å; A577-V581 WeakPolarHBondContact O-CG2 3.2Å; A577-V581 PolarHBondContact O-N 3.32Å; A577-W600 HydrophobicContact CB-CE3 4.29Å; A577-W600 HydrophobicContact CB-CH2 3.32Å; A577-W600 HydrophobicContact CB-CZ2 4Å; A577-W600 HydrophobicContact CB-CZ3 3.51Å; A577-I612 HydrophobicContact CB-CD1 4.47Å
578	T	75.4	Confident	78	Confident	39 Å²	39	64.2 Å²	64.2	24%	0.239	32%	0.318	C	S	.	.	H	α-helix	trans	-59.1	-39.6	177.8	-62.6	0	0	0	0	112.2	D572 N582	D572-T578 VanDerWaalsContact CG-OG1 3.22Å; D572-T578 WeakPolarHBondContact OD1-CB 3.46Å; D572-T578 PolarHBondContact OD1-N 2.88Å; D572-T578 PolarHBondContact OD1-OG1 3.34Å; D572-T578 PolarHBondContact OD2-OG1 3.08Å; T578-N582 WeakPolarHBondContact CG2-ND2 3.33Å; T578-N582 WeakPolarHBondContact O-CB 3.3Å; T578-N582 VanDerWaalsContact O-CG 3.26Å; T578-N582 PolarHBondContact O-N 2.93Å; T578-N582 PolarHBondContact O-ND2 3.37Å
579	T	77.4	Confident	77.2	Confident	82 Å²	82	68.1 Å²	68.1	50%	0.503	34%	0.339	S	S	.	.	H	α-helix	trans	-69.9	-43.7	179.3	-45.1	0	0	0	0	111.2	N576 A577 N582 F583	N576-T579 PolarHBondContact O-N 2.88Å; N576-T579 WeakPolarHBondContact OD1-CB 3.28Å; N576-T579 PolarHBondContact OD1-OG1 3.11Å; A577-T579 VanDerWaalsContact C-N 3.3Å; A577-T579 PolarHBondContact O-N 3.47Å; T579-N582 PolarHBondContact O-N 3.42Å; T579-F583 VanDerWaalsContact O-CB 3.27Å; T579-F583 WeakPolarHBondContact O-CB 3.48Å; T579-F583 PolarHBondContact O-N 2.99Å
580	Q	77.9	Confident	76.3	Confident	76 Å²	76	62.5 Å²	62.5	36%	0.355	32%	0.32	S	S	.	.	H	α-helix	trans	-65.8	-42.4	178.6	-71.2	-178.1	9.6	0	0	111.9	F575 N576 A577 F583 L584 M596 W600	F575-Q580 PolarHBondContact O-NE2 2.85Å; N576-Q580 WeakPolarHBondContact O-CG 3.07Å; N576-Q580 PolarHBondContact O-N 3.25Å; A577-Q580 PolarHBondContact O-N 3.07Å; Q580-F583 PolarHBondContact O-N 2.85Å; Q580-L584 WeakPolarHBondContact O-CB 3.28Å; Q580-L584 WeakPolarHBondContact O-CG 3.37Å; Q580-L584 PolarHBondContact O-N 3.09Å; Q580-M596 HydrophobicContact CB-CE 4.31Å; Q580-M596 HydrophobicContact CB-SD 3.95Å; Q580-W600 HydrophobicContact CB-CZ2 4.49Å
581	V	74.5	Confident	75.4	Confident	4 Å²	4	64.7 Å²	64.7	2%	0.024	33%	0.333	C	S	.	.	H	α-helix	trans	-63	-46.9	175.6	173.7	0	0	0	0	110.8	V497 A577 F583 L584 L585 V593 M596 W600	V497-V581 HydrophobicContact CB-CG1 4.46Å; V497-V581 HydrophobicContact CG1-CG1 3.62Å; V497-V581 HydrophobicContact CG2-CG1 3.96Å; A577-V581 WeakPolarHBondContact O-CB 3.37Å; A577-V581 VanDerWaalsContact O-CG2 3.26Å; A577-V581 WeakPolarHBondContact O-CG2 3.2Å; A577-V581 PolarHBondContact O-N 3.32Å; V581-F583 VanDerWaalsContact C-N 3.31Å; V581-F583 PolarHBondContact O-N 3.49Å; V581-L584 PolarHBondContact O-N 3.17Å; V581-L585 HydrophobicContact CG1-CD1 3.93Å; V581-L585 HydrophobicContact CG1-CG 4.41Å; V581-L585 WeakPolarHBondContact O-CB 3.37Å; V581-L585 VanDerWaalsContact O-CG 3.28Å; V581-L585 WeakPolarHBondContact O-CG 3.47Å; V581-L585 PolarHBondContact O-N 2.6Å; V581-V593 HydrophobicContact CG1-CG1 4.42Å; V581-M596 HydrophobicContact CG2-CE 3.52Å; V581-W600 HydrophobicContact CG2-CH2 3.95Å; V581-W600 HydrophobicContact CG2-CZ3 4.18Å
582	N	74.6	Confident	74.8	Confident	82 Å²	82	68.2 Å²	68.2	44%	0.439	35%	0.351	S	S	.	.	H	α-helix	trans	-63	-37.1	177	-75.5	-41.5	0	0	0	112.3	T578 T579 L585 Q586	T578-N582 WeakPolarHBondContact CG2-ND2 3.33Å; T578-N582 WeakPolarHBondContact O-CB 3.3Å; T578-N582 VanDerWaalsContact O-CG 3.26Å; T578-N582 PolarHBondContact O-N 2.93Å; T578-N582 PolarHBondContact O-ND2 3.37Å; T579-N582 PolarHBondContact O-N 3.42Å; N582-L585 PolarHBondContact O-N 3.42Å; N582-Q586 WeakPolarHBondContact O-CB 3.46Å; N582-Q586 VanDerWaalsContact O-CG 3.27Å; N582-Q586 WeakPolarHBondContact O-CG 3.19Å; N582-Q586 PolarHBondContact O-N 2.93Å
583	F	78.6	Confident	74.2	Confident	124 Å²	124	67.2 Å²	67.2	54%	0.544	35%	0.346	S	S	.	.	H	α-helix	trans	-65.5	-42.6	175.2	178.7	-97.8	0	0	0	112.1	T579 Q580 V581 Q586 T587	T579-F583 VanDerWaalsContact O-CB 3.27Å; T579-F583 WeakPolarHBondContact O-CB 3.48Å; T579-F583 PolarHBondContact O-N 2.99Å; Q580-F583 PolarHBondContact O-N 2.85Å; V581-F583 VanDerWaalsContact C-N 3.31Å; V581-F583 PolarHBondContact O-N 3.49Å; F583-Q586 PolarHBondContact O-N 3.16Å; F583-T587 HydrophobicContact CD1-CG2 4.46Å; F583-T587 HydrophobicContact CE1-CG2 4.05Å; F583-T587 HydrophobicContact CE2-CG2 4.1Å; F583-T587 HydrophobicContact CZ-CG2 3.85Å; F583-T587 WeakPolarHBondContact O-CB 3.42Å; F583-T587 WeakPolarHBondContact O-CG2 3.45Å; F583-T587 PolarHBondContact O-N 3.18Å; F583-T587 PolarHBondContact O-OG1 3.32Å
584	L	73.6	Confident	73.5	Confident	23 Å²	23	64.8 Å²	64.8	12%	0.12	33%	0.331	C	S	.	.	H	α-helix	trans	-67.6	-36.4	176.8	-72.2	175.5	0	0	0	112.6	Q580 V581 T587 N588 N589 L592 V593 M596	Q580-L584 WeakPolarHBondContact O-CB 3.28Å; Q580-L584 WeakPolarHBondContact O-CG 3.37Å; Q580-L584 PolarHBondContact O-N 3.09Å; V581-L584 PolarHBondContact O-N 3.17Å; L584-T587 WeakPolarHBondContact CA-OG1 3.46Å; L584-T587 PolarHBondContact O-N 3.06Å; L584-T587 PolarHBondContact O-OG1 3.15Å; L584-N588 PolarHBondContact O-N 3.36Å; L584-N589 HydrophobicContact CD2-CB 4.38Å; L584-N589 PolarHBondContact O-N 2.98Å; L584-L592 HydrophobicContact CD1-CB 4.46Å; L584-L592 HydrophobicContact CD2-CB 4.36Å; L584-L592 HydrophobicContact CD2-CD1 4.46Å; L584-V593 HydrophobicContact CB-CG2 3.72Å; L584-V593 HydrophobicContact CD1-CG2 3.99Å; L584-M596 HydrophobicContact CD1-CE 3.71Å; L584-M596 HydrophobicContact CD1-SD 3.67Å
585	L	69.7	Low	72.9	Confident	12 Å²	12	65.5 Å²	65.5	6%	0.063	34%	0.335	C	S	.	.	H	α-helix	trans	-64.9	-43.3	172.3	-72	170.4	0	0	0	111.2	I493 R494 V581 N582 T587 N588	I493-L585 HydrophobicContact CG2-CD2 4.13Å; R494-L585 HydrophobicContact CG-CD1 3.95Å; R494-L585 HydrophobicContact CG-CD2 3.85Å; V581-L585 HydrophobicContact CG1-CD1 3.93Å; V581-L585 HydrophobicContact CG1-CG 4.41Å; V581-L585 WeakPolarHBondContact O-CB 3.37Å; V581-L585 VanDerWaalsContact O-CG 3.28Å; V581-L585 WeakPolarHBondContact O-CG 3.47Å; V581-L585 PolarHBondContact O-N 2.6Å; N582-L585 PolarHBondContact O-N 3.42Å; L585-T587 VanDerWaalsContact C-N 3.34Å; L585-T587 PolarHBondContact O-N 2.59Å; L585-N588 PolarHBondContact O-N 2.54Å
586	Q	73.3	Confident	72.8	Confident	161 Å²	161	65.5 Å²	65.5	75%	0.752	34%	0.336	S	S	*	.	H	α-helix	trans	-67.9	-30.4	177.3	-75.8	177	-2.2	0	0	113.6	N582 F583 N588	N582-Q586 WeakPolarHBondContact O-CB 3.46Å; N582-Q586 VanDerWaalsContact O-CG 3.27Å; N582-Q586 WeakPolarHBondContact O-CG 3.19Å; N582-Q586 PolarHBondContact O-N 2.93Å; F583-Q586 PolarHBondContact O-N 3.16Å; Q586-N588 VanDerWaalsContact C-N 3.28Å; Q586-N588 PolarHBondContact O-N 3Å
587	T	74	Confident	72.3	Confident	56 Å²	56	62.5 Å²	62.5	34%	0.344	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	8	179.4	49.4	0	0	0	0	113.5	F583 L584 L585 N589	F583-T587 HydrophobicContact CD1-CG2 4.46Å; F583-T587 HydrophobicContact CE1-CG2 4.05Å; F583-T587 HydrophobicContact CE2-CG2 4.1Å; F583-T587 HydrophobicContact CZ-CG2 3.85Å; F583-T587 WeakPolarHBondContact O-CB 3.42Å; F583-T587 WeakPolarHBondContact O-CG2 3.45Å; F583-T587 PolarHBondContact O-N 3.18Å; F583-T587 PolarHBondContact O-OG1 3.32Å; L584-T587 WeakPolarHBondContact CA-OG1 3.46Å; L584-T587 PolarHBondContact O-N 3.06Å; L584-T587 PolarHBondContact O-OG1 3.15Å; L585-T587 VanDerWaalsContact C-N 3.34Å; L585-T587 PolarHBondContact O-N 2.59Å; T587-N589 PolarHBondContact O-N 2.92Å; T587-N589 VanDerWaalsContact O-N 3.11Å
588	N	65	Low	72.2	Confident	110 Å²	110	66.7 Å²	66.7	59%	0.588	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	19.4	179.7	-143.9	9.4	0	0	0	114.6	L584 L585 Q586 S590	L584-N588 PolarHBondContact O-N 3.36Å; L585-N588 PolarHBondContact O-N 2.54Å; Q586-N588 VanDerWaalsContact C-N 3.28Å; Q586-N588 PolarHBondContact O-N 3Å; N588-S590 VanDerWaalsContact C-N 3.33Å; N588-S590 PolarHBondContact O-N 3.45Å
589	N	68.6	Low	72.3	Confident	85 Å²	85	69.3 Å²	69.3	46%	0.455	35%	0.352	S	S	.	.			trans	-98.4	55.7	179.3	-77.1	-29.7	0	0	0	110.8	L584 T587 I591 L592	L584-N589 HydrophobicContact CD2-CB 4.38Å; L584-N589 PolarHBondContact O-N 2.98Å; T587-N589 PolarHBondContact O-N 2.92Å; T587-N589 VanDerWaalsContact O-N 3.11Å; N589-I591 VanDerWaalsContact C-N 3.3Å; N589-I591 PolarHBondContact O-N 2.88Å; N589-L592 HydrophobicContact CB-CD1 4.03Å; N589-L592 PolarHBondContact O-N 3.48Å
590	S	64.1	Low	72.2	Confident	11 Å²	11	66.4 Å²	66.4	8%	0.077	33%	0.332	C	S	.	.	H	α-helix	trans	-68.6	-25.8	-167.9	63.2	0	0	0	0	113.5	I493 N588 L592 V593	I493-S590 WeakPolarHBondContact CD1-OG 3.32Å; N588-S590 VanDerWaalsContact C-N 3.33Å; N588-S590 PolarHBondContact O-N 3.45Å; S590-L592 PolarHBondContact O-N 3.29Å; S590-V593 WeakPolarHBondContact O-CB 3.11Å; S590-V593 WeakPolarHBondContact O-CG2 3.27Å; S590-V593 PolarHBondContact O-N 3.34Å
591	I	66.5	Low	71.9	Confident	141 Å²	141	65 Å²	65	72%	0.723	33%	0.329	S	S	*	.	H	α-helix	trans	-65.3	-36.2	175.2	-61.3	166	0	0	0	112	N589 V593 H594	N589-I591 VanDerWaalsContact C-N 3.3Å; N589-I591 PolarHBondContact O-N 2.88Å; I591-V593 PolarHBondContact O-N 3.19Å; I591-H594 PolarHBondContact O-N 3.14Å
592	L	70.8	Confident	71.8	Confident	78 Å²	78	72.2 Å²	72.2	41%	0.408	36%	0.362	S	S	.	.	H	α-helix	trans	-67.4	-20.5	-179.2	-68.7	176.2	0	0	0	112.4	L584 N589 S590 H594 Q595 M596	L584-L592 HydrophobicContact CD1-CB 4.46Å; L584-L592 HydrophobicContact CD2-CB 4.36Å; L584-L592 HydrophobicContact CD2-CD1 4.46Å; N589-L592 HydrophobicContact CB-CD1 4.03Å; N589-L592 PolarHBondContact O-N 3.48Å; S590-L592 PolarHBondContact O-N 3.29Å; L592-H594 VanDerWaalsContact C-N 3.35Å; L592-H594 PolarHBondContact O-N 2.9Å; L592-Q595 PolarHBondContact O-N 2.98Å; L592-M596 VanDerWaalsContact O-CB 3.25Å; L592-M596 WeakPolarHBondContact O-CB 3.33Å; L592-M596 PolarHBondContact O-N 3.41Å
593	V	69.8	Low	71.7	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.006	35%	0.351	C	S	.	.	H	α-helix	trans	-63.4	-42.3	178.2	-177.5	0	0	0	0	110.9	W496 V497 V581 L584 S590 I591 M596 V597	W496-V593 HydrophobicContact CZ3-CG1 4.35Å; V497-V593 HydrophobicContact CG2-CG1 3.53Å; V581-V593 HydrophobicContact CG1-CG1 4.42Å; L584-V593 HydrophobicContact CB-CG2 3.72Å; L584-V593 HydrophobicContact CD1-CG2 3.99Å; S590-V593 WeakPolarHBondContact O-CB 3.11Å; S590-V593 WeakPolarHBondContact O-CG2 3.27Å; S590-V593 PolarHBondContact O-N 3.34Å; I591-V593 PolarHBondContact O-N 3.19Å; V593-M596 PolarHBondContact O-N 3.21Å; V593-V597 HydrophobicContact CG1-CG2 4.43Å; V593-V597 WeakPolarHBondContact O-CG2 3.33Å; V593-V597 PolarHBondContact O-N 3.39Å
594	H	68	Low	71.4	Confident	83 Å²	83	70 Å²	70	38%	0.384	37%	0.367	S	S	.	.	H	α-helix	trans	-62.7	-46.7	178.4	-170.7	-84.9	0	0	0	111.3	W496 I591 L592 M596 V597 Q598	W496-H594 AromaticContact CE2-CD2 3.6Å; W496-H594 HydrophobicContact CH2-CB 4.32Å; W496-H594 AromaticContact CH2-CD2 3.61Å; W496-H594 AromaticContact CZ2-CD2 3.11Å; W496-H594 WeakPolarHBondContact CZ2-CD2 3.26Å; W496-H594 AromaticContact CZ2-NE2 3.65Å; I591-H594 PolarHBondContact O-N 3.14Å; L592-H594 VanDerWaalsContact C-N 3.35Å; L592-H594 PolarHBondContact O-N 2.9Å; H594-M596 VanDerWaalsContact C-N 3.35Å; H594-M596 PolarHBondContact O-N 2.86Å; H594-V597 PolarHBondContact O-N 3.17Å; H594-Q598 VanDerWaalsContact CE1-CD 3.44Å; H594-Q598 PolarHBondContact CE1-NE2 3.34Å; H594-Q598 WeakPolarHBondContact O-CB 3.47Å; H594-Q598 WeakPolarHBondContact O-CG 3.43Å; H594-Q598 PolarHBondContact O-N 3.25Å
595	Q	72.7	Confident	71.5	Confident	107 Å²	107	73.9 Å²	73.9	50%	0.5	38%	0.384	S	S	.	.	H	α-helix	trans	-64.2	-40.1	178.4	-170.4	177.5	0.8	0	0	111.7	L592 Q598 N599	L592-Q595 PolarHBondContact O-N 2.98Å; Q595-Q598 PolarHBondContact O-N 3.43Å; Q595-N599 WeakPolarHBondContact O-CB 3.47Å; Q595-N599 PolarHBondContact O-N 3.16Å; Q595-N599 PolarHBondContact O-ND2 3.4Å; Q595-N599 PolarHBondContact O-OD1 3.25Å
596	M	76.4	Confident	71.8	Confident	25 Å²	25	78.6 Å²	78.6	12%	0.123	41%	0.406	C	S	.	.	H	α-helix	trans	-64.6	-46.2	177.6	-176.2	-177.1	67.2	0	0	112	Q580 V581 L584 L592 V593 H594 Q598 N599 W600	Q580-M596 HydrophobicContact CB-CE 4.31Å; Q580-M596 HydrophobicContact CB-SD 3.95Å; V581-M596 HydrophobicContact CG2-CE 3.52Å; L584-M596 HydrophobicContact CD1-CE 3.71Å; L584-M596 HydrophobicContact CD1-SD 3.67Å; L592-M596 VanDerWaalsContact O-CB 3.25Å; L592-M596 WeakPolarHBondContact O-CB 3.33Å; L592-M596 PolarHBondContact O-N 3.41Å; V593-M596 PolarHBondContact O-N 3.21Å; H594-M596 VanDerWaalsContact C-N 3.35Å; H594-M596 PolarHBondContact O-N 2.86Å; M596-Q598 VanDerWaalsContact C-N 3.33Å; M596-Q598 PolarHBondContact O-N 3.34Å; M596-N599 WeakPolarHBondContact O-CB 3.4Å; M596-N599 PolarHBondContact O-N 3.4Å; M596-W600 HydrophobicContact CE-CH2 3.24Å; M596-W600 HydrophobicContact CE-CZ2 3.54Å; M596-W600 HydrophobicContact CE-CZ3 3.93Å; M596-W600 HydrophobicContact CG-CD2 4.3Å; M596-W600 HydrophobicContact CG-CH2 4.16Å; M596-W600 HydrophobicContact CG-CZ2 3.57Å; M596-W600 PolarHBondContact O-N 3.47Å; M596-W600 HydrophobicContact SD-CH2 3.83Å; M596-W600 HydrophobicContact SD-CZ2 3.42Å; M596-W600 WeakPolarHBondContact SD-CZ2 3.22Å
597	V	72.7	Confident	71.9	Confident	13 Å²	13	77.2 Å²	77.2	8%	0.079	40%	0.403	C	S	.	.	H	α-helix	trans	-63.4	-41.6	177	172.7	0	0	0	0	110.6	W496 V593 H594 N599 W600 T601	W496-V597 HydrophobicContact CH2-CB 4.1Å; W496-V597 HydrophobicContact CH2-CG1 4.17Å; W496-V597 HydrophobicContact CH2-CG2 4.38Å; W496-V597 HydrophobicContact CZ3-CB 4.39Å; W496-V597 HydrophobicContact CZ3-CG2 4.17Å; V593-V597 HydrophobicContact CG1-CG2 4.43Å; V593-V597 WeakPolarHBondContact O-CG2 3.33Å; V593-V597 PolarHBondContact O-N 3.39Å; H594-V597 PolarHBondContact O-N 3.17Å; V597-N599 VanDerWaalsContact C-N 3.34Å; V597-N599 PolarHBondContact O-N 3.44Å; V597-W600 HydrophobicContact CG2-CE3 4.12Å; V597-W600 HydrophobicContact CG2-CZ3 4.09Å; V597-W600 PolarHBondContact O-N 3.44Å; V597-T601 WeakPolarHBondContact O-CG2 3.43Å; V597-T601 PolarHBondContact O-N 3.03Å; V597-T601 PolarHBondContact O-OG1 3.38Å
598	Q	72.5	Confident	72.1	Confident	88 Å²	88	77.5 Å²	77.5	41%	0.411	40%	0.4	S	S	.	.	H	α-helix	trans	-58.5	-45.1	173.2	-76.7	-175.5	-31.6	0	0	112	H594 Q595 M596 W600 T601 Q602	H594-Q598 VanDerWaalsContact CE1-CD 3.44Å; H594-Q598 PolarHBondContact CE1-NE2 3.34Å; H594-Q598 WeakPolarHBondContact O-CB 3.47Å; H594-Q598 WeakPolarHBondContact O-CG 3.43Å; H594-Q598 PolarHBondContact O-N 3.25Å; Q595-Q598 PolarHBondContact O-N 3.43Å; M596-Q598 VanDerWaalsContact C-N 3.33Å; M596-Q598 PolarHBondContact O-N 3.34Å; Q598-W600 VanDerWaalsContact C-N 3.29Å; Q598-W600 PolarHBondContact O-N 2.85Å; Q598-T601 WeakPolarHBondContact CA-OG1 3.4Å; Q598-T601 PolarHBondContact O-N 3.4Å; Q598-T601 VanDerWaalsContact O-N 3.17Å; Q598-T601 PolarHBondContact O-OG1 2.95Å; Q598-Q602 PolarHBondContact O-N 3.49Å
599	N	77.2	Confident	72.6	Confident	93 Å²	93	72.4 Å²	72.4	50%	0.497	37%	0.373	S	S	.	.	H	α-helix	trans	-60.3	-37.8	176.4	-70.1	-12.6	0	0	0	112.3	Q595 M596 V597 Q602 S603	Q595-N599 WeakPolarHBondContact O-CB 3.47Å; Q595-N599 PolarHBondContact O-N 3.16Å; Q595-N599 PolarHBondContact O-ND2 3.4Å; Q595-N599 PolarHBondContact O-OD1 3.25Å; M596-N599 WeakPolarHBondContact O-CB 3.4Å; M596-N599 PolarHBondContact O-N 3.4Å; V597-N599 VanDerWaalsContact C-N 3.34Å; V597-N599 PolarHBondContact O-N 3.44Å; N599-Q602 PolarHBondContact O-N 3.37Å; N599-S603 PolarHBondContact O-N 3.3Å; N599-S603 VanDerWaalsContact O-N 3.16Å
600	W	75.8	Confident	73.2	Confident	22 Å²	22	69.9 Å²	69.9	8%	0.083	36%	0.358	C	S	.	.	H	α-helix	trans	-66.9	-43.4	174.8	-62.5	-21.4	0	0	0	112.1	F501 F575 A577 Q580 V581 M596 V597 Q598 Q602 S603 S609 I612	F501-W600 HydrophobicContact CD2-CZ3 4.09Å; F501-W600 AromaticContact CE2-CZ3 3.96Å; F501-W600 HydrophobicContact CE2-CZ3 3.96Å; F575-W600 HydrophobicContact CD1-CB 4.44Å; F575-W600 AromaticContact CD1-CD1 3.54Å; F575-W600 HydrophobicContact CD1-CD2 4.47Å; F575-W600 AromaticContact CD1-CG 3.93Å; F575-W600 HydrophobicContact CD1-CG 3.93Å; F575-W600 AromaticContact CD1-NE1 3.86Å; F575-W600 HydrophobicContact CE1-CB 4.35Å; F575-W600 AromaticContact CE1-CD1 3.95Å; F575-W600 HydrophobicContact CE1-CG 4.27Å; F575-W600 HydrophobicContact CG-CG 4.45Å; A577-W600 HydrophobicContact CB-CE3 4.29Å; A577-W600 HydrophobicContact CB-CH2 3.32Å; A577-W600 HydrophobicContact CB-CZ2 4Å; A577-W600 HydrophobicContact CB-CZ3 3.51Å; Q580-W600 HydrophobicContact CB-CZ2 4.49Å; V581-W600 HydrophobicContact CG2-CH2 3.95Å; V581-W600 HydrophobicContact CG2-CZ3 4.18Å; M596-W600 HydrophobicContact CE-CH2 3.24Å; M596-W600 HydrophobicContact CE-CZ2 3.54Å; M596-W600 HydrophobicContact CE-CZ3 3.93Å; M596-W600 HydrophobicContact CG-CD2 4.3Å; M596-W600 HydrophobicContact CG-CH2 4.16Å; M596-W600 HydrophobicContact CG-CZ2 3.57Å; M596-W600 PolarHBondContact O-N 3.47Å; M596-W600 HydrophobicContact SD-CH2 3.83Å; M596-W600 HydrophobicContact SD-CZ2 3.42Å; M596-W600 WeakPolarHBondContact SD-CZ2 3.22Å; V597-W600 HydrophobicContact CG2-CE3 4.12Å; V597-W600 HydrophobicContact CG2-CZ3 4.09Å; V597-W600 PolarHBondContact O-N 3.44Å; Q598-W600 VanDerWaalsContact C-N 3.29Å; Q598-W600 PolarHBondContact O-N 2.85Å; W600-Q602 PolarHBondContact O-N 3.19Å; W600-S603 VanDerWaalsContact O-CB 3.31Å; W600-S603 WeakPolarHBondContact O-CB 3.44Å; W600-S603 PolarHBondContact O-N 2.67Å; W600-S603 VanDerWaalsContact O-N 3.12Å; W600-S603 PolarHBondContact O-OG 3.25Å; W600-S609 WeakPolarHBondContact O-CB 3.42Å; W600-I612 HydrophobicContact CE3-CG2 4.24Å
601	T	71	Confident	74	Confident	46 Å²	46	71 Å²	71	28%	0.282	36%	0.361	S	S	.	.	H	α-helix	trans	-63.4	-28.7	178.1	59.1	0	0	0	0	113.2	V597 Q598 T613	V597-T601 WeakPolarHBondContact O-CG2 3.43Å; V597-T601 PolarHBondContact O-N 3.03Å; V597-T601 PolarHBondContact O-OG1 3.38Å; Q598-T601 WeakPolarHBondContact CA-OG1 3.4Å; Q598-T601 PolarHBondContact O-N 3.4Å; Q598-T601 VanDerWaalsContact O-N 3.17Å; Q598-T601 PolarHBondContact O-OG1 2.95Å; T601-T613 HydrophobicContact CG2-CG2 3.61Å
602	Q	73.4	Confident	74.5	Confident	156 Å²	156	64.6 Å²	64.6	73%	0.729	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.3	3.9	177.6	-65.2	-180	1.1	0	0	113.6	Q598 N599 W600	Q598-Q602 PolarHBondContact O-N 3.49Å; N599-Q602 PolarHBondContact O-N 3.37Å; W600-Q602 PolarHBondContact O-N 3.19Å
603	S	72.9	Confident	74.6	Confident	30 Å²	30	61.9 Å²	61.9	21%	0.21	32%	0.315	C	S	.	.	S	Bend	trans	-66.1	152.3	-179.4	67.8	0	0	0	0	112.1	F575 N599 W600 H605	F575-S603 WeakPolarHBondContact CZ-OG 3.32Å; N599-S603 PolarHBondContact O-N 3.3Å; N599-S603 VanDerWaalsContact O-N 3.16Å; W600-S603 VanDerWaalsContact O-CB 3.31Å; W600-S603 WeakPolarHBondContact O-CB 3.44Å; W600-S603 PolarHBondContact O-N 2.67Å; W600-S603 VanDerWaalsContact O-N 3.12Å; W600-S603 PolarHBondContact O-OG 3.25Å; S603-H605 PolarHBondContact O-N 3.27Å
604	C	72.2	Confident	74.7	Confident	129 Å²	129	62.7 Å²	62.7	87%	0.872	32%	0.322	S	S	*	.	S	Bend	trans	-59.9	-18.6	178.8	-173.4	0	0	0	0	113.1	H606	C604-H606 PolarHBondContact O-N 3.39Å
605	H	76	Confident	74.9	Confident	104 Å²	104	60.3 Å²	60.3	48%	0.481	31%	0.314	S	S	.	.			trans	-93.8	66.1	-179.9	-60.8	-62.3	0	0	0	112	F574 S603 D607 K608 S609	F574-H605 HydrophobicContact CE1-CB 4.43Å; F574-H605 AromaticContact CE1-CD2 3.84Å; F574-H605 AromaticContact CZ-CD2 3.72Å; S603-H605 PolarHBondContact O-N 3.27Å; H605-D607 PolarHBondContact O-N 2.93Å; H605-D607 VanDerWaalsContact O-N 3.17Å; H605-K608 PolarHBondContact O-N 3.1Å; H605-K608 VanDerWaalsContact O-N 3.07Å; H605-S609 PolarHBondContact O-N 2.94Å; H605-S609 PolarHBondContact O-OG 3.06Å
606	H	73.9	Confident	75.1	Confident	111 Å²	111	60.7 Å²	60.7	51%	0.514	31%	0.311	S	S	.	.	H	α-helix	trans	-53.4	-36.9	-178.7	-171.3	-73.7	0	0	0	113	C604 K608 S609 Y610	C604-H606 PolarHBondContact O-N 3.39Å; H606-K608 VanDerWaalsContact C-N 3.3Å; H606-K608 PolarHBondContact O-N 3.46Å; H606-S609 WeakPolarHBondContact CA-OG 3.27Å; H606-S609 PolarHBondContact O-N 3.02Å; H606-S609 PolarHBondContact O-OG 3.38Å; H606-Y610 VanDerWaalsContact O-CB 3.23Å; H606-Y610 WeakPolarHBondContact O-CB 3.06Å; H606-Y610 PolarHBondContact O-N 3.01Å
607	D	77.1	Confident	75.1	Confident	132 Å²	132	69.2 Å²	69.2	71%	0.706	35%	0.348	S	S	*	.	H	α-helix	trans	-62.2	-36.7	-179.5	-61.8	-16.6	0	0	0	112.6	H605 F611	H605-D607 PolarHBondContact O-N 2.93Å; H605-D607 VanDerWaalsContact O-N 3.17Å; D607-F611 WeakPolarHBondContact O-CD2 3.23Å; D607-F611 WeakPolarHBondContact O-CE2 3.47Å
608	K	77.8	Confident	75.3	Confident	62 Å²	62	77.2 Å²	77.2	27%	0.27	38%	0.377	S	S	.	.	H	α-helix	trans	-86.9	-37	179.8	-65.5	-171.4	178.3	-174.2	0	112	S571 F574 F575 H605 H606 Y610	S571-K608 VanDerWaalsContact CB-O 3.27Å; S571-K608 WeakPolarHBondContact CB-O 3.49Å; S571-K608 WeakPolarHBondContact OG-CA 3.35Å; S571-K608 PolarHBondContact OG-O 2.88Å; F574-K608 HydrophobicContact CB-CD 3.95Å; F574-K608 HydrophobicContact CD1-CB 4.41Å; F574-K608 HydrophobicContact CD1-CD 3.62Å; F574-K608 HydrophobicContact CD2-CD 3.79Å; F574-K608 HydrophobicContact CE1-CD 4Å; F574-K608 HydrophobicContact CE2-CD 4.14Å; F574-K608 HydrophobicContact CG-CD 3.49Å; F574-K608 VanDerWaalsContact CG-CD 3.49Å; F574-K608 HydrophobicContact CZ-CD 4.23Å; F575-K608 HydrophobicContact CE2-CB 3.91Å; H605-K608 PolarHBondContact O-N 3.1Å; H605-K608 VanDerWaalsContact O-N 3.07Å; H606-K608 VanDerWaalsContact C-N 3.3Å; H606-K608 PolarHBondContact O-N 3.46Å; K608-Y610 VanDerWaalsContact C-N 3.33Å
609	S	75.9	Confident	75.9	Confident	4 Å²	4	74.3 Å²	74.3	3%	0.028	36%	0.362	C	S	.	.	H	α-helix	trans	-68.9	-31.8	179.6	66.4	0	0	0	0	112.5	W600 H605 H606 F611 I612	W600-S609 WeakPolarHBondContact O-CB 3.42Å; H605-S609 PolarHBondContact O-N 2.94Å; H605-S609 PolarHBondContact O-OG 3.06Å; H606-S609 WeakPolarHBondContact CA-OG 3.27Å; H606-S609 PolarHBondContact O-N 3.02Å; H606-S609 PolarHBondContact O-OG 3.38Å; S609-F611 PolarHBondContact O-N 3.35Å; S609-I612 WeakPolarHBondContact O-CB 3.42Å; S609-I612 PolarHBondContact O-N 3.44Å; S609-I612 VanDerWaalsContact O-N 3.14Å
610	Y	81.5	Confident	76.3	Confident	32 Å²	32	75.7 Å²	75.7	13%	0.125	36%	0.364	C	S	.	.	H	α-helix	trans	-53.5	-49.8	176.8	175.1	-98.9	0	0	0	112.2	H606 K608 I612 T613 W619 K620 D623	H606-Y610 VanDerWaalsContact O-CB 3.23Å; H606-Y610 WeakPolarHBondContact O-CB 3.06Å; H606-Y610 PolarHBondContact O-N 3.01Å; K608-Y610 VanDerWaalsContact C-N 3.33Å; Y610-I612 PolarHBondContact O-N 3.42Å; Y610-T613 PolarHBondContact O-N 3.15Å; Y610-T613 PolarHBondContact O-OG1 3.04Å; Y610-W619 WeakPolarHBondContact OH-CA 3.3Å; Y610-W619 WeakPolarHBondContact OH-CB 3.36Å; Y610-K620 HydrophobicContact CE2-CG 4.31Å; Y610-K620 PolarHBondContact OH-N 3.29Å; Y610-D623 WeakPolarHBondContact CE1-OD2 3.39Å; Y610-D623 PolarHBondContact OH-OD2 3.36Å
611	F	79.5	Confident	76.8	Confident	35 Å²	35	84.7 Å²	84.7	15%	0.154	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-12	-178.1	-65	-66.4	0	0	0	114.9	R502 W567 V568 D607 S609	R502-F611 WeakPolarHBondContact CD-O 3.29Å; W567-F611 HydrophobicContact CB-CD1 4.44Å; W567-F611 HydrophobicContact CB-CD2 4.28Å; W567-F611 HydrophobicContact CB-CE1 4.46Å; W567-F611 HydrophobicContact CB-CE2 4.3Å; W567-F611 HydrophobicContact CB-CG 4.36Å; W567-F611 HydrophobicContact CB-CZ 4.4Å; W567-F611 HydrophobicContact CD2-CZ 4.1Å; W567-F611 AromaticContact CE3-CE1 3.57Å; W567-F611 HydrophobicContact CE3-CE1 3.57Å; W567-F611 HydrophobicContact CE3-CE2 4.13Å; W567-F611 AromaticContact CE3-CZ 3.32Å; W567-F611 HydrophobicContact CE3-CZ 3.32Å; W567-F611 HydrophobicContact CZ3-CE1 4.2Å; W567-F611 AromaticContact CZ3-CZ 3.82Å; W567-F611 HydrophobicContact CZ3-CZ 3.82Å; V568-F611 HydrophobicContact CG2-CB 4.24Å; D607-F611 WeakPolarHBondContact O-CD2 3.23Å; D607-F611 WeakPolarHBondContact O-CE2 3.47Å; S609-F611 PolarHBondContact O-N 3.35Å
612	I	76.9	Confident	77.6	Confident	5 Å²	5	87 Å²	87	3%	0.026	41%	0.41	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-27.7	175.8	-74.4	175	0	0	0	111.7	F501 R502 F575 A577 W600 S609 Y610 A614	F501-I612 HydrophobicContact CD2-CG2 3.58Å; F501-I612 HydrophobicContact CE2-CG2 3.61Å; R502-I612 PolarHBondContact N-O 3.41Å; R502-I612 VanDerWaalsContact N-O 3.07Å; F575-I612 HydrophobicContact CB-CD1 4.07Å; F575-I612 HydrophobicContact CD2-CD1 3.15Å; F575-I612 HydrophobicContact CE2-CD1 3.72Å; F575-I612 HydrophobicContact CG-CD1 3.83Å; A577-I612 HydrophobicContact CB-CD1 4.47Å; W600-I612 HydrophobicContact CE3-CG2 4.24Å; S609-I612 WeakPolarHBondContact O-CB 3.42Å; S609-I612 PolarHBondContact O-N 3.44Å; S609-I612 VanDerWaalsContact O-N 3.14Å; Y610-I612 PolarHBondContact O-N 3.42Å; I612-A614 PolarHBondContact O-N 3.43Å
613	T	74.4	Confident	78.3	Confident	21 Å²	21	79.8 Å²	79.8	13%	0.129	38%	0.376	C	S	.	.	B	Isolated β-bridge	trans	-72.1	119	-178.3	62.1	0	0	0	0	111.4	T601 Y610 W619	T601-T613 HydrophobicContact CG2-CG2 3.61Å; Y610-T613 PolarHBondContact O-N 3.15Å; Y610-T613 PolarHBondContact O-OG1 3.04Å; T613-W619 PolarHBondContact O-NE1 3.15Å
614	A	70.5	Confident	79.1	Confident	19 Å²	19	79.4 Å²	79.4	16%	0.157	37%	0.373	C	S	.	.			trans	-81.1	-18.3	-177.8	0	0	0	0	0	114.1	K499 N500 R502 I612 R616	K499-A614 WeakPolarHBondContact O-CB 3.36Å; N500-A614 VanDerWaalsContact C-CB 3.43Å; N500-A614 WeakPolarHBondContact O-CB 3.22Å; N500-A614 PolarHBondContact O-N 3.09Å; R502-A614 HydrophobicContact CB-CB 4.18Å; I612-A614 PolarHBondContact O-N 3.43Å; A614-R616 PolarHBondContact O-N 3.32Å; A614-R616 VanDerWaalsContact O-N 3.12Å
615	S	73.1	Confident	79.8	Confident	32 Å²	32	74.5 Å²	74.5	22%	0.224	34%	0.337	C	S	.	.			trans	-72.6	108	-174.5	-176.4	0	0	0	0	112	F617 R618 W619	S615-F617 PolarHBondContact O-N 3.3Å; S615-F617 VanDerWaalsContact O-N 3.14Å; S615-R618 PolarHBondContact O-N 3.3Å; S615-W619 PolarHBondContact O-NE1 3.15Å
616	R	76.5	Confident	80.4	Confident	115 Å²	115	72.2 Å²	72.2	43%	0.434	33%	0.328	S	S	.	.	G	3₁₀ helix	trans	-54.2	-29.7	177.2	-68.3	-176.6	170.7	-155.4	-15	113.8	A614 R618 W619 D629	A614-R616 PolarHBondContact O-N 3.32Å; A614-R616 VanDerWaalsContact O-N 3.12Å; R616-R618 PolarHBondContact O-N 3.26Å; R616-W619 HydrophobicContact CB-CD2 4.45Å; R616-W619 HydrophobicContact CB-CE3 4.34Å; R616-W619 HydrophobicContact CG-CD2 4.32Å; R616-W619 HydrophobicContact CG-CE3 3.96Å; R616-W619 HydrophobicContact CG-CH2 3.79Å; R616-W619 HydrophobicContact CG-CZ2 4.15Å; R616-W619 HydrophobicContact CG-CZ3 3.69Å; R616-W619 WeakPolarHBondContact O-CB 3.39Å; R616-W619 PolarHBondContact O-N 3.03Å; R616-D629 IonicContact CZ-OD2 3.16Å; R616-D629 IonicContact NH1-OD2 3.77Å; R616-D629 IonicContact NH2-OD2 2.7Å; R616-D629 PolarHBondContact NH2-OD2 3.04Å
617	F	76.6	Confident	81.3	Confident	205 Å²	205	69.8 Å²	69.8	90%	0.899	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-67.2	-18.9	177.9	-67.3	-74.6	0	0	0	113.8	S615	S615-F617 PolarHBondContact O-N 3.3Å; S615-F617 VanDerWaalsContact O-N 3.14Å
618	R	77.5	Confident	82	Confident	180 Å²	180	63.5 Å²	63.5	68%	0.679	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-97.1	-4.5	177.2	-64.4	-173.7	179	177.5	1.3	113.1	S615 R616	S615-R618 PolarHBondContact O-N 3.3Å; R616-R618 PolarHBondContact O-N 3.26Å
619	W	83.6	Confident	82.6	Confident	28 Å²	28	62.6 Å²	62.6	11%	0.106	29%	0.285	C	S	.	.	S	Bend	trans	-75.8	149.7	179.2	-62.2	-5.7	0	0	0	110.6	Y610 T613 S615 R616 D623 E625 I626	Y610-W619 WeakPolarHBondContact OH-CA 3.3Å; Y610-W619 WeakPolarHBondContact OH-CB 3.36Å; T613-W619 PolarHBondContact O-NE1 3.15Å; S615-W619 PolarHBondContact O-NE1 3.15Å; R616-W619 HydrophobicContact CB-CD2 4.45Å; R616-W619 HydrophobicContact CB-CE3 4.34Å; R616-W619 HydrophobicContact CG-CD2 4.32Å; R616-W619 HydrophobicContact CG-CE3 3.96Å; R616-W619 HydrophobicContact CG-CH2 3.79Å; R616-W619 HydrophobicContact CG-CZ2 4.15Å; R616-W619 HydrophobicContact CG-CZ3 3.69Å; R616-W619 WeakPolarHBondContact O-CB 3.39Å; R616-W619 PolarHBondContact O-N 3.03Å; W619-D623 HydrophobicContact CB-CB 4.31Å; W619-E625 HydrophobicContact CH2-CG 4.36Å; W619-E625 WeakPolarHBondContact CH2-OE2 3.29Å; W619-E625 HydrophobicContact CZ3-CB 4.1Å; W619-E625 VanDerWaalsContact CZ3-CD 3.46Å; W619-E625 HydrophobicContact CZ3-CG 3.96Å; W619-E625 VanDerWaalsContact CZ3-OE2 3.29Å; W619-E625 WeakPolarHBondContact CZ3-OE2 3.45Å; W619-I626 HydrophobicContact CB-CD1 4.07Å; W619-I626 HydrophobicContact CE3-CD1 4.1Å; W619-I626 HydrophobicContact CE3-CG1 3.94Å; W619-I626 HydrophobicContact CZ3-CG1 4.49Å
620	K	85.9	Confident	83.4	Confident	122 Å²	122	66.5 Å²	66.5	53%	0.53	31%	0.309	S	S	.	.			trans	-71.8	154.9	173.2	-61.3	-179	176.7	176.2	0	110	Y610 D622 D623	Y610-K620 HydrophobicContact CE2-CG 4.31Å; Y610-K620 PolarHBondContact OH-N 3.29Å; K620-D622 WeakPolarHBondContact CB-OD1 3.49Å; K620-D622 PolarHBondContact O-N 2.97Å; K620-D623 VanDerWaalsContact O-CB 3.29Å; K620-D623 WeakPolarHBondContact O-CB 3.17Å; K620-D623 PolarHBondContact O-N 3.28Å; K620-D623 VanDerWaalsContact O-N 3.11Å
621	Y	86	Confident	83.9	Confident	211 Å²	211	67.5 Å²	67.5	83%	0.827	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-22.1	-179.7	64.6	-92.8	0	0	0	113.4
622	D	87.7	Confident	84.5	Confident	94 Å²	94	67 Å²	67	50%	0.503	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	11.7	177.9	64	-26.9	0	0	0	112.9	K620	K620-D622 WeakPolarHBondContact CB-OD1 3.49Å; K620-D622 PolarHBondContact O-N 2.97Å
623	D	88.8	Confident	85.2	Confident	5 Å²	5	69.2 Å²	69.2	3%	0.027	33%	0.332	C	S	.	.			trans	-58.8	127.6	176.6	-168.1	-81.7	0	0	0	110.9	Y610 W619 K620 E625 I626 V627	Y610-D623 WeakPolarHBondContact CE1-OD2 3.39Å; Y610-D623 PolarHBondContact OH-OD2 3.36Å; W619-D623 HydrophobicContact CB-CB 4.31Å; K620-D623 VanDerWaalsContact O-CB 3.29Å; K620-D623 WeakPolarHBondContact O-CB 3.17Å; K620-D623 PolarHBondContact O-N 3.28Å; K620-D623 VanDerWaalsContact O-N 3.11Å; D623-E625 PolarHBondContact O-N 3.04Å; D623-E625 VanDerWaalsContact O-N 3.1Å; D623-E625 VanDerWaalsContact OD1-CB 3.26Å; D623-E625 WeakPolarHBondContact OD1-CB 3.35Å; D623-E625 PolarHBondContact OD1-N 3.31Å; D623-I626 HydrophobicContact CB-CB 4.5Å; D623-I626 HydrophobicContact CB-CD1 4.11Å; D623-I626 HydrophobicContact CB-CG1 4.28Å; D623-I626 PolarHBondContact O-N 3.26Å; D623-V627 PolarHBondContact O-N 3.43Å
624	P	90.1	Very high	86.1	Confident	22 Å²	22	71.3 Å²	71.3	14%	0.143	35%	0.345	C	S	.	.	H	α-helix	trans	-60.9	-23.5	-175.5	22	-33.3	0	0	0	113.7	L560 V564 W567 S628	L560-P624 HydrophobicContact CD2-CB 4.01Å; V564-P624 HydrophobicContact CG2-CB 3.81Å; V564-P624 HydrophobicContact CG2-CG 3.6Å; W567-P624 HydrophobicContact CE3-CG 4.33Å; W567-P624 HydrophobicContact CZ3-CG 3.79Å; P624-S628 WeakPolarHBondContact O-CB 3.43Å; P624-S628 PolarHBondContact O-N 3.38Å
625	E	86.9	Confident	87.2	Confident	26 Å²	26	70.4 Å²	70.4	12%	0.121	34%	0.338	C	S	.	.	H	α-helix	trans	-73	-40.2	174.2	-173.9	173.5	-177.5	0	0	112.2	R502 V564 W619 D623 S628 D629	R502-E625 IonicContact CZ-OE2 2.73Å; R502-E625 IonicContact NH1-OE2 2.76Å; R502-E625 PolarHBondContact NH1-OE2 2.92Å; R502-E625 IonicContact NH2-OE1 2.91Å; R502-E625 PolarHBondContact NH2-OE1 3.25Å; R502-E625 IonicContact NH2-OE2 3.44Å; R502-E625 PolarHBondContact NH2-OE2 3.05Å; V564-E625 HydrophobicContact CG1-CB 4.44Å; V564-E625 HydrophobicContact CG2-CB 4.28Å; W619-E625 HydrophobicContact CH2-CG 4.36Å; W619-E625 WeakPolarHBondContact CH2-OE2 3.29Å; W619-E625 HydrophobicContact CZ3-CB 4.1Å; W619-E625 VanDerWaalsContact CZ3-CD 3.46Å; W619-E625 HydrophobicContact CZ3-CG 3.96Å; W619-E625 VanDerWaalsContact CZ3-OE2 3.29Å; W619-E625 WeakPolarHBondContact CZ3-OE2 3.45Å; D623-E625 PolarHBondContact O-N 3.04Å; D623-E625 VanDerWaalsContact O-N 3.1Å; D623-E625 VanDerWaalsContact OD1-CB 3.26Å; D623-E625 WeakPolarHBondContact OD1-CB 3.35Å; D623-E625 PolarHBondContact OD1-N 3.31Å; E625-S628 WeakPolarHBondContact O-CB 3.37Å; E625-S628 PolarHBondContact O-N 2.91Å; E625-D629 WeakPolarHBondContact O-CB 3.47Å; E625-D629 PolarHBondContact O-N 3.44Å
626	I	89.2	Confident	88.1	Confident	55 Å²	55	69.6 Å²	69.6	28%	0.282	33%	0.331	S	S	.	.	H	α-helix	trans	-64.3	-46.5	175	-66.7	172.2	0	0	0	109.5	W619 D623 S628 D629 V630	W619-I626 HydrophobicContact CB-CD1 4.07Å; W619-I626 HydrophobicContact CE3-CD1 4.1Å; W619-I626 HydrophobicContact CE3-CG1 3.94Å; W619-I626 HydrophobicContact CZ3-CG1 4.49Å; D623-I626 HydrophobicContact CB-CB 4.5Å; D623-I626 HydrophobicContact CB-CD1 4.11Å; D623-I626 HydrophobicContact CB-CG1 4.28Å; D623-I626 PolarHBondContact O-N 3.26Å; I626-S628 VanDerWaalsContact C-N 3.28Å; I626-S628 PolarHBondContact O-N 3.44Å; I626-D629 PolarHBondContact O-N 3.23Å; I626-V630 HydrophobicContact CG2-CG2 4.47Å; I626-V630 WeakPolarHBondContact O-CG2 3.4Å; I626-V630 PolarHBondContact O-N 3.13Å
627	V	92.6	Very high	88.9	Confident	61 Å²	61	69.1 Å²	69.1	37%	0.37	34%	0.34	S	S	.	.	H	α-helix	trans	-59.4	-42.4	176.2	178.6	0	0	0	0	110.5	L560 D623 V630 M631	L560-V627 HydrophobicContact CD1-CB 4.21Å; L560-V627 HydrophobicContact CD1-CG1 3.82Å; D623-V627 PolarHBondContact O-N 3.43Å; V627-V630 PolarHBondContact O-N 3.34Å; V627-M631 HydrophobicContact CG1-SD 4.24Å; V627-M631 WeakPolarHBondContact O-CB 3.17Å; V627-M631 WeakPolarHBondContact O-CG 3.26Å; V627-M631 PolarHBondContact O-N 2.93Å
628	S	91.4	Very high	89.6	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.1	-43.9	175.7	-179.8	0	0	0	0	113	S557 R561 P624 E625 I626 M631 F632	S557-S628 VanDerWaalsContact C-OG 3.29Å; S557-S628 WeakPolarHBondContact CA-OG 3.34Å; S557-S628 PolarHBondContact O-OG 3.23Å; S557-S628 PolarHBondContact OG-O 3.29Å; S557-S628 PolarHBondContact OG-OG 3.21Å; R561-S628 WeakPolarHBondContact CG-OG 3.35Å; R561-S628 PolarHBondContact NE-OG 2.95Å; P624-S628 WeakPolarHBondContact O-CB 3.43Å; P624-S628 PolarHBondContact O-N 3.38Å; E625-S628 WeakPolarHBondContact O-CB 3.37Å; E625-S628 PolarHBondContact O-N 2.91Å; I626-S628 VanDerWaalsContact C-N 3.28Å; I626-S628 PolarHBondContact O-N 3.44Å; S628-M631 PolarHBondContact O-N 3.05Å; S628-F632 VanDerWaalsContact O-CB 3.27Å; S628-F632 WeakPolarHBondContact O-CB 3.32Å; S628-F632 PolarHBondContact O-N 3.19Å
629	D	89.2	Confident	90.2	Very high	42 Å²	42	52.8 Å²	52.8	23%	0.225	28%	0.277	C	S	.	.	H	α-helix	trans	-66.2	-39.4	179.1	-81.8	-4.6	0	0	0	111.3	R561 R616 E625 I626 F632 A633	R561-D629 IonicContact CZ-OD1 2.69Å; R561-D629 IonicContact NE-OD1 2.92Å; R561-D629 IonicContact NH2-OD1 3.37Å; R561-D629 PolarHBondContact NH2-OD1 3.1Å; R616-D629 IonicContact CZ-OD2 3.16Å; R616-D629 IonicContact NH1-OD2 3.77Å; R616-D629 IonicContact NH2-OD2 2.7Å; R616-D629 PolarHBondContact NH2-OD2 3.04Å; E625-D629 WeakPolarHBondContact O-CB 3.47Å; E625-D629 PolarHBondContact O-N 3.44Å; I626-D629 PolarHBondContact O-N 3.23Å; D629-F632 PolarHBondContact O-N 3.18Å; D629-A633 WeakPolarHBondContact O-CB 3.38Å; D629-A633 PolarHBondContact O-N 3.39Å
630	V	92.7	Very high	90.6	Very high	86 Å²	86	56 Å²	56	52%	0.521	29%	0.292	S	S	.	.	H	α-helix	trans	-63.4	-49	173.6	172.8	0	0	0	0	110.8	I626 V627 F632 A633 V634	I626-V630 HydrophobicContact CG2-CG2 4.47Å; I626-V630 WeakPolarHBondContact O-CG2 3.4Å; I626-V630 PolarHBondContact O-N 3.13Å; V627-V630 PolarHBondContact O-N 3.34Å; V630-F632 VanDerWaalsContact C-N 3.3Å; V630-F632 PolarHBondContact O-N 2.95Å; V630-A633 PolarHBondContact O-N 3Å; V630-V634 WeakPolarHBondContact O-CG2 3.39Å; V630-V634 PolarHBondContact O-N 3.27Å
631	M	93.6	Very high	90.8	Very high	53 Å²	53	52.7 Å²	52.7	26%	0.261	29%	0.288	S	S	.	.	H	α-helix	trans	-60.6	-40.5	176.9	-72.3	-177.3	71.7	0	0	111.8	M553 L560 V627 S628 A635	M553-M631 HydrophobicContact CB-CE 4.43Å; M553-M631 HydrophobicContact CG-CE 4.43Å; L560-M631 HydrophobicContact CD1-SD 4.23Å; V627-M631 HydrophobicContact CG1-SD 4.24Å; V627-M631 WeakPolarHBondContact O-CB 3.17Å; V627-M631 WeakPolarHBondContact O-CG 3.26Å; V627-M631 PolarHBondContact O-N 2.93Å; S628-M631 PolarHBondContact O-N 3.05Å; M631-A635 VanDerWaalsContact O-CB 3.25Å; M631-A635 WeakPolarHBondContact O-CB 3.48Å; M631-A635 PolarHBondContact O-N 3.43Å
632	F	92	Very high	91	Very high	24 Å²	24	44.9 Å²	44.9	11%	0.105	26%	0.257	C	S	.	.	H	α-helix	trans	-64.2	-44.3	176.4	-172.1	-110.1	0	0	0	112.1	L465 Y554 S557 Y558 S628 D629 V630 A635 N636	L465-F632 HydrophobicContact CD2-CE2 4.46Å; L465-F632 HydrophobicContact CD2-CZ 4.14Å; Y554-F632 HydrophobicContact CD1-CD2 4.03Å; Y554-F632 HydrophobicContact CD1-CE2 4.19Å; Y554-F632 HydrophobicContact CE1-CD2 4.03Å; Y554-F632 AromaticContact CE1-CE2 3.95Å; Y554-F632 HydrophobicContact CE1-CE2 3.95Å; S557-F632 WeakPolarHBondContact OG-CB 3.38Å; Y558-F632 HydrophobicContact CE2-CE2 4.33Å; S628-F632 VanDerWaalsContact O-CB 3.27Å; S628-F632 WeakPolarHBondContact O-CB 3.32Å; S628-F632 PolarHBondContact O-N 3.19Å; D629-F632 PolarHBondContact O-N 3.18Å; V630-F632 VanDerWaalsContact C-N 3.3Å; V630-F632 PolarHBondContact O-N 2.95Å; F632-A635 PolarHBondContact O-N 2.79Å; F632-N636 WeakPolarHBondContact CD1-ND2 3.42Å; F632-N636 WeakPolarHBondContact CE1-ND2 3.47Å; F632-N636 PolarHBondContact O-N 2.88Å; F632-N636 PolarHBondContact O-ND2 3.38Å; F632-N636 PolarHBondContact O-OD1 3.49Å
633	A	91.8	Very high	91	Very high	53 Å²	53	42.2 Å²	42.2	44%	0.438	24%	0.244	S	C	.	.	H	α-helix	trans	-63.3	-46	178.9	0	0	0	0	0	111.6	D629 V630 N636 V637	D629-A633 WeakPolarHBondContact O-CB 3.38Å; D629-A633 PolarHBondContact O-N 3.39Å; V630-A633 PolarHBondContact O-N 3Å; A633-N636 PolarHBondContact O-N 3.4Å; A633-V637 PolarHBondContact O-N 3.04Å
634	V	93.5	Very high	90.9	Very high	65 Å²	65	44.9 Å²	44.9	39%	0.394	26%	0.26	S	S	.	.	H	α-helix	trans	-62.1	-45.6	175.3	176.8	0	0	0	0	110.5	M553 V630 N636 V637 V638	M553-V634 HydrophobicContact CE-CG1 4Å; M553-V634 HydrophobicContact SD-CB 4.3Å; M553-V634 HydrophobicContact SD-CG1 3.72Å; V630-V634 WeakPolarHBondContact O-CG2 3.39Å; V630-V634 PolarHBondContact O-N 3.27Å; V634-N636 VanDerWaalsContact C-N 3.3Å; V634-N636 PolarHBondContact O-N 3.19Å; V634-V637 PolarHBondContact O-N 3.06Å; V634-V638 HydrophobicContact CG1-CG2 4.44Å; V634-V638 WeakPolarHBondContact O-CG2 3.4Å; V634-V638 PolarHBondContact O-N 3.46Å; V634-V638 VanDerWaalsContact O-N 3.11Å
635	A	92.9	Very high	90.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-59.8	-38.9	177.8	0	0	0	0	0	112.6	M553 Y554 M631 F632 V638 S639	M553-A635 HydrophobicContact CB-CB 3.84Å; Y554-A635 HydrophobicContact CD1-CB 3.68Å; Y554-A635 HydrophobicContact CD2-CB 4.35Å; Y554-A635 HydrophobicContact CE1-CB 3.5Å; Y554-A635 VanDerWaalsContact CE1-CB 3.5Å; Y554-A635 HydrophobicContact CE2-CB 4.21Å; Y554-A635 HydrophobicContact CG-CB 4.09Å; Y554-A635 PolarHBondContact OH-O 3.05Å; M631-A635 VanDerWaalsContact O-CB 3.25Å; M631-A635 WeakPolarHBondContact O-CB 3.48Å; M631-A635 PolarHBondContact O-N 3.43Å; F632-A635 PolarHBondContact O-N 2.79Å; A635-V638 PolarHBondContact O-N 2.94Å; A635-S639 WeakPolarHBondContact O-CB 3.37Å; A635-S639 PolarHBondContact O-N 3.09Å
636	N	92.2	Very high	90.8	Very high	15 Å²	15	46.6 Å²	46.6	8%	0.08	26%	0.264	C	S	.	.	H	α-helix	trans	-62	-47.2	176.7	-70.5	-19.9	0	0	0	111.5	Y554 F632 A633 V634 V638 S639 F640	Y554-N636 WeakPolarHBondContact CE1-OD1 3.46Å; Y554-N636 PolarHBondContact OH-OD1 3.4Å; F632-N636 WeakPolarHBondContact CD1-ND2 3.42Å; F632-N636 WeakPolarHBondContact CE1-ND2 3.47Å; F632-N636 PolarHBondContact O-N 2.88Å; F632-N636 PolarHBondContact O-ND2 3.38Å; F632-N636 PolarHBondContact O-OD1 3.49Å; A633-N636 PolarHBondContact O-N 3.4Å; V634-N636 VanDerWaalsContact C-N 3.3Å; V634-N636 PolarHBondContact O-N 3.19Å; N636-V638 PolarHBondContact O-N 3.2Å; N636-S639 WeakPolarHBondContact O-CB 3.47Å; N636-S639 PolarHBondContact O-N 3.38Å; N636-F640 WeakPolarHBondContact O-CD2 3.45Å; N636-F640 PolarHBondContact O-N 3.33Å
637	V	92.7	Very high	90.8	Very high	104 Å²	104	45.9 Å²	45.9	63%	0.63	26%	0.26	S	S	*	.	H	α-helix	trans	-58.9	-49	178.3	174.2	0	0	0	0	110.9	A633 V634 S639 F640 A641	A633-V637 PolarHBondContact O-N 3.04Å; V634-V637 PolarHBondContact O-N 3.06Å; V637-S639 VanDerWaalsContact C-N 3.28Å; V637-S639 PolarHBondContact O-N 3.41Å; V637-F640 PolarHBondContact O-N 3.42Å; V637-A641 PolarHBondContact O-N 3.09Å; V637-A641 VanDerWaalsContact O-N 3.07Å
638	V	92.1	Very high	90.7	Very high	41 Å²	41	43.6 Å²	43.6	25%	0.248	25%	0.247	C	C	.	.	H	α-helix	trans	-67.1	-32.6	179.7	-172.4	0	0	0	0	110.9	L546 I550 V634 A635 N636 A641 R642	L546-V638 HydrophobicContact CD1-CG1 4.11Å; L546-V638 HydrophobicContact CD2-CG1 4.06Å; L546-V638 HydrophobicContact CG-CG1 3.93Å; I550-V638 HydrophobicContact CD1-CB 4.43Å; I550-V638 HydrophobicContact CD1-CG1 3.79Å; I550-V638 HydrophobicContact CG1-CB 3.92Å; I550-V638 HydrophobicContact CG1-CG1 3.46Å; I550-V638 VanDerWaalsContact CG1-CG1 3.46Å; V634-V638 HydrophobicContact CG1-CG2 4.44Å; V634-V638 WeakPolarHBondContact O-CG2 3.4Å; V634-V638 PolarHBondContact O-N 3.46Å; V634-V638 VanDerWaalsContact O-N 3.11Å; A635-V638 PolarHBondContact O-N 2.94Å; N636-V638 PolarHBondContact O-N 3.2Å; V638-A641 WeakPolarHBondContact O-CB 3.5Å; V638-A641 PolarHBondContact O-N 3.37Å; V638-R642 PolarHBondContact O-N 3.46Å
639	S	90.3	Very high	90.5	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.014	26%	0.257	C	S	.	.	H	α-helix	trans	-65.5	-36.4	174.1	-176.5	0	0	0	0	113.1	F461 Y554 A635 N636 V637 R642	F461-S639 WeakPolarHBondContact CE1-OG 2.99Å; Y554-S639 WeakPolarHBondContact OH-CB 3.33Å; Y554-S639 PolarHBondContact OH-OG 3.43Å; A635-S639 WeakPolarHBondContact O-CB 3.37Å; A635-S639 PolarHBondContact O-N 3.09Å; N636-S639 WeakPolarHBondContact O-CB 3.47Å; N636-S639 PolarHBondContact O-N 3.38Å; V637-S639 VanDerWaalsContact C-N 3.28Å; V637-S639 PolarHBondContact O-N 3.41Å; S639-R642 WeakPolarHBondContact O-CB 3.43Å; S639-R642 PolarHBondContact O-N 2.86Å
640	F	91.2	Very high	90.4	Very high	95 Å²	95	46.4 Å²	46.4	42%	0.417	26%	0.262	S	S	.	.	H	α-helix	trans	-67	-42.6	170.3	-81.5	-76.2	0	0	0	111.2	L462 N636 V637 R642 T643	L462-F640 HydrophobicContact CB-CD1 4.47Å; L462-F640 HydrophobicContact CB-CE1 3.9Å; L462-F640 HydrophobicContact CB-CZ 4.39Å; L462-F640 HydrophobicContact CD1-CD1 4.12Å; L462-F640 HydrophobicContact CD1-CE1 4.32Å; L462-F640 HydrophobicContact CD2-CD1 3.93Å; L462-F640 HydrophobicContact CD2-CE1 4.04Å; L462-F640 HydrophobicContact CD2-CG 4.23Å; L462-F640 HydrophobicContact CD2-CZ 4.41Å; L462-F640 HydrophobicContact CG-CD1 4.4Å; L462-F640 HydrophobicContact CG-CE1 4.3Å; N636-F640 WeakPolarHBondContact O-CD2 3.45Å; N636-F640 PolarHBondContact O-N 3.33Å; V637-F640 PolarHBondContact O-N 3.42Å; F640-R642 PolarHBondContact O-N 3.14Å; F640-T643 VanDerWaalsContact O-CB 3.27Å; F640-T643 WeakPolarHBondContact O-CB 3.27Å; F640-T643 PolarHBondContact O-N 3.39Å; F640-T643 VanDerWaalsContact O-N 3.09Å; F640-T643 PolarHBondContact O-OG1 3.18Å
641	A	89.6	Confident	90.2	Very high	53 Å²	53	49.5 Å²	49.5	44%	0.438	27%	0.271	S	S	.	.	H	α-helix	trans	-60.8	-30.3	176.8	0	0	0	0	0	112.9	V637 V638 T643 T644	V637-A641 PolarHBondContact O-N 3.09Å; V637-A641 VanDerWaalsContact O-N 3.07Å; V638-A641 WeakPolarHBondContact O-CB 3.5Å; V638-A641 PolarHBondContact O-N 3.37Å; A641-T643 PolarHBondContact O-N 3.04Å; A641-T643 VanDerWaalsContact O-N 3.13Å; A641-T644 VanDerWaalsContact O-CB 3.28Å; A641-T644 WeakPolarHBondContact O-CB 3.28Å; A641-T644 PolarHBondContact O-N 2.93Å; A641-T644 VanDerWaalsContact O-N 3.1Å; A641-T644 PolarHBondContact O-OG1 2.89Å
642	R	89.8	Confident	89.9	Confident	46 Å²	46	51.2 Å²	51.2	17%	0.174	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-57	-24	174.3	-175.4	-175.6	165.7	164.6	4.2	113.4	L546 N547 I550 V638 S639 F640 T644 Y645	L546-R642 HydrophobicContact CD2-CB 4.45Å; N547-R642 WeakPolarHBondContact OD1-CD 3.29Å; N547-R642 PolarHBondContact OD1-NE 3.37Å; N547-R642 VanDerWaalsContact OD1-NE 3.09Å; N547-R642 PolarHBondContact OD1-NH1 2.94Å; I550-R642 HydrophobicContact CD1-CB 4.17Å; V638-R642 PolarHBondContact O-N 3.46Å; S639-R642 WeakPolarHBondContact O-CB 3.43Å; S639-R642 PolarHBondContact O-N 2.86Å; F640-R642 PolarHBondContact O-N 3.14Å; R642-T644 PolarHBondContact O-N 3.45Å; R642-Y645 WeakPolarHBondContact O-CB 3.26Å; R642-Y645 PolarHBondContact O-N 3.49Å
643	T	87.8	Confident	89.8	Confident	39 Å²	39	53.8 Å²	53.8	24%	0.239	31%	0.308	C	S	.	.	G	3₁₀ helix	trans	-55	-26.2	175.3	-47.4	0	0	0	0	112.3	F459 L462 F640 A641 Y645 L646	F459-T643 HydrophobicContact CE1-CG2 4.16Å; F459-T643 HydrophobicContact CZ-CG2 4.11Å; L462-T643 WeakPolarHBondContact CD1-OG1 3.38Å; F640-T643 VanDerWaalsContact O-CB 3.27Å; F640-T643 WeakPolarHBondContact O-CB 3.27Å; F640-T643 PolarHBondContact O-N 3.39Å; F640-T643 VanDerWaalsContact O-N 3.09Å; F640-T643 PolarHBondContact O-OG1 3.18Å; A641-T643 PolarHBondContact O-N 3.04Å; A641-T643 VanDerWaalsContact O-N 3.13Å; T643-Y645 PolarHBondContact O-N 3.42Å; T643-Y645 VanDerWaalsContact O-N 3.13Å; T643-L646 WeakPolarHBondContact O-CB 3.2Å; T643-L646 PolarHBondContact O-N 3.19Å
644	T	88.2	Confident	89.8	Confident	60 Å²	60	51.3 Å²	51.3	37%	0.368	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-56.2	-26.3	174.5	-48.4	0	0	0	0	112.8	A641 R642 L646 M647 Q657	A641-T644 VanDerWaalsContact O-CB 3.28Å; A641-T644 WeakPolarHBondContact O-CB 3.28Å; A641-T644 PolarHBondContact O-N 2.93Å; A641-T644 VanDerWaalsContact O-N 3.1Å; A641-T644 PolarHBondContact O-OG1 2.89Å; R642-T644 PolarHBondContact O-N 3.45Å; T644-L646 PolarHBondContact O-N 2.96Å; T644-M647 VanDerWaalsContact O-CB 3.26Å; T644-M647 WeakPolarHBondContact O-CB 3.34Å; T644-M647 PolarHBondContact O-N 3.3Å; T644-Q657 HydrophobicContact CG2-CG 4.07Å; T644-Q657 PolarHBondContact O-NE2 3.47Å; T644-Q657 PolarHBondContact O-OE1 2.9Å
645	Y	86.5	Confident	89.8	Confident	71 Å²	71	49.8 Å²	49.8	28%	0.278	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-62.1	-25.2	173.9	177.7	-101	0	0	0	113.5	Y543 R642 T643 P648 L814	Y543-Y645 HydrophobicContact CD1-CD2 4.39Å; Y543-Y645 HydrophobicContact CG-CD2 4.34Å; R642-Y645 WeakPolarHBondContact O-CB 3.26Å; R642-Y645 PolarHBondContact O-N 3.49Å; T643-Y645 PolarHBondContact O-N 3.42Å; T643-Y645 VanDerWaalsContact O-N 3.13Å; Y645-P648 WeakPolarHBondContact O-CD 3.27Å; Y645-L814 HydrophobicContact CE1-CD1 3.61Å; Y645-L814 HydrophobicContact CE2-CD1 4.38Å; Y645-L814 WeakPolarHBondContact OH-CD1 3.3Å
646	L	87.8	Confident	89.6	Confident	13 Å²	13	54.6 Å²	54.6	7%	0.068	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-85.9	-15.8	179.7	-59.5	178.6	0	0	0	113	F451 V455 F459 T643 T644 A649	F451-L646 HydrophobicContact CE2-CD2 4Å; F451-L646 HydrophobicContact CZ-CD2 4.34Å; V455-L646 HydrophobicContact CG1-CD1 4.16Å; V455-L646 HydrophobicContact CG2-CD1 4.07Å; V455-L646 HydrophobicContact CG2-CD2 3.77Å; F459-L646 HydrophobicContact CE2-CD1 4.31Å; T643-L646 WeakPolarHBondContact O-CB 3.2Å; T643-L646 PolarHBondContact O-N 3.19Å; T644-L646 PolarHBondContact O-N 2.96Å; L646-A649 WeakPolarHBondContact O-CB 3.28Å; L646-A649 PolarHBondContact O-N 3.09Å; L646-A649 VanDerWaalsContact O-N 3.17Å
647	M	88.9	Confident	89.6	Confident	40 Å²	40	54.1 Å²	54.1	20%	0.197	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-61	-31.7	-175.7	-172	173.8	173.4	0	0	114.3	T644 A649 F650 L653 G654 L656 Q657	T644-M647 VanDerWaalsContact O-CB 3.26Å; T644-M647 WeakPolarHBondContact O-CB 3.34Å; T644-M647 PolarHBondContact O-N 3.3Å; M647-A649 PolarHBondContact O-N 3.47Å; M647-F650 PolarHBondContact O-N 3.4Å; M647-L653 HydrophobicContact CE-CB 3.81Å; M647-L653 HydrophobicContact CE-CD2 4.21Å; M647-L653 WeakPolarHBondContact CE-O 3.47Å; M647-L653 HydrophobicContact CG-CB 3.42Å; M647-L653 VanDerWaalsContact CG-CB 3.42Å; M647-L653 HydrophobicContact CG-CD1 4.34Å; M647-L653 HydrophobicContact CG-CG 4.46Å; M647-L653 HydrophobicContact SD-CB 4.32Å; M647-G654 WeakPolarHBondContact O-CA 3.42Å; M647-G654 PolarHBondContact O-N 3.48Å; M647-L656 HydrophobicContact CE-CB 4.06Å; M647-L656 HydrophobicContact CE-CD2 3.94Å; M647-L656 HydrophobicContact CE-CG 4.04Å; M647-Q657 HydrophobicContact CB-CB 4.49Å; M647-Q657 HydrophobicContact CE-CB 3.96Å; M647-Q657 HydrophobicContact CG-CB 3.97Å; M647-Q657 HydrophobicContact SD-CB 3.77Å; M647-Q657 HydrophobicContact SD-CG 4.19Å
648	P	90.5	Very high	89.4	Confident	14 Å²	14	50.4 Å²	50.4	9%	0.091	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-66.2	-20.2	176	-17.4	31.5	0	0	0	114	Y645 F650 Q657 W807	Y645-P648 WeakPolarHBondContact O-CD 3.27Å; P648-F650 VanDerWaalsContact C-N 3.26Å; P648-F650 PolarHBondContact O-N 3.18Å; P648-Q657 VanDerWaalsContact N-OE1 3.17Å; P648-W807 PolarHBondContact O-NE1 2.93Å
649	A	88.1	Confident	89.4	Confident	25 Å²	25	48.6 Å²	48.6	21%	0.207	27%	0.267	C	S	.	.	G	3₁₀ helix	trans	-71.2	-22.5	-179.8	0	0	0	0	0	112.9	F451 L646 M647 L814	F451-A649 HydrophobicContact CE1-CB 3.92Å; F451-A649 HydrophobicContact CE2-CB 4.33Å; F451-A649 HydrophobicContact CZ-CB 3.45Å; F451-A649 VanDerWaalsContact CZ-CB 3.45Å; L646-A649 WeakPolarHBondContact O-CB 3.28Å; L646-A649 PolarHBondContact O-N 3.09Å; L646-A649 VanDerWaalsContact O-N 3.17Å; M647-A649 PolarHBondContact O-N 3.47Å; A649-L814 HydrophobicContact CB-CD2 3.78Å
650	F	87	Confident	89.4	Confident	75 Å²	75	54.4 Å²	54.4	33%	0.329	29%	0.292	S	S	.	.	S	Bend	trans	-98.5	133	-177.5	-58.4	-69.4	0	0	0	110.9	M647 P648 A652 L653 G654	M647-F650 PolarHBondContact O-N 3.4Å; P648-F650 VanDerWaalsContact C-N 3.26Å; P648-F650 PolarHBondContact O-N 3.18Å; F650-A652 PolarHBondContact O-N 3.27Å; F650-L653 HydrophobicContact CB-CB 4.33Å; F650-L653 HydrophobicContact CD2-CD1 4.41Å; F650-L653 PolarHBondContact O-N 2.93Å; F650-G654 PolarHBondContact O-N 2.99Å
651	E	88.5	Confident	89.2	Confident	151 Å²	151	52.8 Å²	52.8	71%	0.706	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-38.7	-178	180	173.6	-170.6	0	0	113.9	P655 W807	E651-P655 WeakPolarHBondContact O-CD 3.48Å; E651-W807 VanDerWaalsContact CA-CZ2 3.46Å; E651-W807 HydrophobicContact CB-CH2 3.87Å; E651-W807 HydrophobicContact CB-CZ2 3.98Å; E651-W807 HydrophobicContact CG-CH2 3.71Å; E651-W807 HydrophobicContact CG-CZ2 4.3Å; E651-W807 HydrophobicContact CG-CZ3 4.39Å
652	A	86.9	Confident	89.2	Confident	90 Å²	90	54 Å²	54	74%	0.744	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-29.4	-179.7	0	0	0	0	0	113.6	F650	F650-A652 PolarHBondContact O-N 3.27Å
653	L	90.6	Very high	89.3	Confident	78 Å²	78	53.4 Å²	53.4	41%	0.408	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-24.9	-172.3	-60.6	176.7	0	0	0	113.1	M647 F650 L656 Q657	M647-L653 HydrophobicContact CE-CB 3.81Å; M647-L653 HydrophobicContact CE-CD2 4.21Å; M647-L653 WeakPolarHBondContact CE-O 3.47Å; M647-L653 HydrophobicContact CG-CB 3.42Å; M647-L653 VanDerWaalsContact CG-CB 3.42Å; M647-L653 HydrophobicContact CG-CD1 4.34Å; M647-L653 HydrophobicContact CG-CG 4.46Å; M647-L653 HydrophobicContact SD-CB 4.32Å; F650-L653 HydrophobicContact CB-CB 4.33Å; F650-L653 HydrophobicContact CD2-CD1 4.41Å; F650-L653 PolarHBondContact O-N 2.93Å; L653-L656 WeakPolarHBondContact O-CB 3.3Å; L653-L656 PolarHBondContact O-N 3.15Å; L653-Q657 PolarHBondContact O-N 2.94Å
654	G	91.4	Very high	89.4	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-59.9	-54.2	-177.1	0	0	0	0	0	113.7	M647 F650 L656 Q657 I658 W807	M647-G654 WeakPolarHBondContact O-CA 3.42Å; M647-G654 PolarHBondContact O-N 3.48Å; F650-G654 PolarHBondContact O-N 2.99Å; G654-L656 VanDerWaalsContact C-N 3.26Å; G654-L656 PolarHBondContact O-N 3.5Å; G654-Q657 PolarHBondContact O-N 3.31Å; G654-Q657 VanDerWaalsContact O-N 3.15Å; G654-I658 WeakPolarHBondContact O-CG1 3.36Å; G654-I658 PolarHBondContact O-N 3.48Å; G654-I658 VanDerWaalsContact O-N 3.15Å; G654-W807 VanDerWaalsContact CA-CD1 3.46Å
655	P	92.1	Very high	89.3	Confident	34 Å²	34	56 Å²	56	22%	0.221	30%	0.295	C	S	.	.	H	α-helix	trans	-55.5	-40.3	175.3	-27.8	37	0	0	0	113	E651 Q657 I658 S659 C803 W807	E651-P655 WeakPolarHBondContact O-CD 3.48Å; P655-Q657 PolarHBondContact O-N 2.94Å; P655-I658 PolarHBondContact O-N 3.27Å; P655-S659 PolarHBondContact O-N 2.72Å; P655-S659 PolarHBondContact O-OG 3.43Å; P655-C803 VanDerWaalsContact CB-SG 3.54Å; P655-C803 PolarHBondContact O-SG 3.42Å; P655-W807 HydrophobicContact CG-CB 4.06Å; P655-W807 HydrophobicContact CG-CD2 3.92Å; P655-W807 HydrophobicContact CG-CE3 4.15Å; P655-W807 HydrophobicContact CG-CG 3.85Å
656	L	90.4	Very high	89.4	Confident	100 Å²	100	54.2 Å²	54.2	52%	0.524	29%	0.29	S	S	.	.	H	α-helix	trans	-63.4	-37.9	178.4	-179.1	64.7	0	0	0	112.8	M647 L653 G654 S659 F660	M647-L656 HydrophobicContact CE-CB 4.06Å; M647-L656 HydrophobicContact CE-CD2 3.94Å; M647-L656 HydrophobicContact CE-CG 4.04Å; L653-L656 WeakPolarHBondContact O-CB 3.3Å; L653-L656 PolarHBondContact O-N 3.15Å; G654-L656 VanDerWaalsContact C-N 3.26Å; G654-L656 PolarHBondContact O-N 3.5Å; L656-S659 PolarHBondContact O-OG 2.9Å; L656-F660 WeakPolarHBondContact O-CB 3.45Å; L656-F660 PolarHBondContact O-N 3.44Å; L656-F660 VanDerWaalsContact O-N 3.13Å
657	Q	90.7	Very high	89.6	Confident	6 Å²	6	56.5 Å²	56.5	3%	0.028	30%	0.302	C	S	.	.	H	α-helix	trans	-69.3	-41.3	176.4	-175.6	-171.1	-2.7	0	0	112.1	Y543 T644 M647 P648 L653 G654 P655 F660 T661	Y543-Q657 PolarHBondContact OH-NE2 3.47Å; T644-Q657 HydrophobicContact CG2-CG 4.07Å; T644-Q657 PolarHBondContact O-NE2 3.47Å; T644-Q657 PolarHBondContact O-OE1 2.9Å; M647-Q657 HydrophobicContact CB-CB 4.49Å; M647-Q657 HydrophobicContact CE-CB 3.96Å; M647-Q657 HydrophobicContact CG-CB 3.97Å; M647-Q657 HydrophobicContact SD-CB 3.77Å; M647-Q657 HydrophobicContact SD-CG 4.19Å; P648-Q657 VanDerWaalsContact N-OE1 3.17Å; L653-Q657 PolarHBondContact O-N 2.94Å; G654-Q657 PolarHBondContact O-N 3.31Å; G654-Q657 VanDerWaalsContact O-N 3.15Å; P655-Q657 PolarHBondContact O-N 2.94Å; Q657-F660 PolarHBondContact O-N 3.5Å; Q657-T661 WeakPolarHBondContact O-CB 3.47Å; Q657-T661 PolarHBondContact O-N 2.97Å; Q657-T661 PolarHBondContact O-OG1 3.13Å
658	I	89.9	Confident	89.6	Confident	25 Å²	25	58.1 Å²	58.1	13%	0.128	32%	0.315	C	S	.	.	H	α-helix	trans	-64.8	-45.9	-178.8	-63.2	-57.7	0	0	0	110	G654 P655 F660 T661 R662 E806 A810	G654-I658 WeakPolarHBondContact O-CG1 3.36Å; G654-I658 PolarHBondContact O-N 3.48Å; G654-I658 VanDerWaalsContact O-N 3.15Å; P655-I658 PolarHBondContact O-N 3.27Å; I658-F660 PolarHBondContact O-N 3.23Å; I658-T661 PolarHBondContact O-N 3.01Å; I658-R662 PolarHBondContact O-N 3.46Å; I658-E806 HydrophobicContact CG2-CB 3.9Å; I658-E806 WeakPolarHBondContact CG2-OE2 3.42Å; I658-A810 HydrophobicContact CD1-CB 3.81Å
659	S	90.6	Very high	89.4	Confident	4 Å²	4	65.7 Å²	65.7	3%	0.028	34%	0.341	C	S	.	.	H	α-helix	trans	-60.8	-44.5	175.6	61.5	0	0	0	0	111.7	P655 L656 T661 R662 M663	P655-S659 PolarHBondContact O-N 2.72Å; P655-S659 PolarHBondContact O-OG 3.43Å; L656-S659 PolarHBondContact O-OG 2.9Å; S659-T661 PolarHBondContact O-N 3.15Å; S659-R662 PolarHBondContact O-N 3Å; S659-M663 WeakPolarHBondContact O-CB 3.44Å; S659-M663 VanDerWaalsContact O-CG 3.3Å; S659-M663 WeakPolarHBondContact O-CG 3.35Å; S659-M663 PolarHBondContact O-N 2.92Å
660	F	90.1	Very high	89.4	Confident	124 Å²	124	65.2 Å²	65.2	54%	0.544	33%	0.334	S	S	.	.	H	α-helix	trans	-58.5	-46.5	174.8	178.9	-102.2	0	0	0	112.8	L656 Q657 I658 R662 M663 L664	L656-F660 WeakPolarHBondContact O-CB 3.45Å; L656-F660 PolarHBondContact O-N 3.44Å; L656-F660 VanDerWaalsContact O-N 3.13Å; Q657-F660 PolarHBondContact O-N 3.5Å; I658-F660 PolarHBondContact O-N 3.23Å; F660-R662 VanDerWaalsContact C-N 3.32Å; F660-R662 PolarHBondContact O-N 2.87Å; F660-M663 PolarHBondContact O-N 3.39Å; F660-L664 HydrophobicContact CE1-CD1 4.23Å; F660-L664 HydrophobicContact CZ-CD1 4.4Å; F660-L664 WeakPolarHBondContact O-CB 3.42Å; F660-L664 PolarHBondContact O-N 3.3Å
661	T	88.2	Confident	89.5	Confident	61 Å²	61	65.5 Å²	65.5	37%	0.374	34%	0.338	S	S	.	.	H	α-helix	trans	-64.3	-38.2	-178.5	-54.9	0	0	0	0	111.5	Q657 I658 S659 L664	Q657-T661 WeakPolarHBondContact O-CB 3.47Å; Q657-T661 PolarHBondContact O-N 2.97Å; Q657-T661 PolarHBondContact O-OG1 3.13Å; I658-T661 PolarHBondContact O-N 3.01Å; S659-T661 PolarHBondContact O-N 3.15Å; T661-L664 WeakPolarHBondContact O-CB 3.42Å; T661-L664 PolarHBondContact O-N 3.11Å
662	R	88.9	Confident	89.6	Confident	79 Å²	79	63 Å²	63	30%	0.298	33%	0.332	S	S	.	.	H	α-helix	trans	-71.6	-44.5	177.3	-75.8	-166.5	161.1	-167.7	11.7	112.9	K382 I658 S659 F660 L664 T665 I799 E806	K382-R662 VanDerWaalsContact NZ-NH2 3.15Å; I658-R662 PolarHBondContact O-N 3.46Å; S659-R662 PolarHBondContact O-N 3Å; F660-R662 VanDerWaalsContact C-N 3.32Å; F660-R662 PolarHBondContact O-N 2.87Å; R662-L664 PolarHBondContact O-N 3.33Å; R662-T665 PolarHBondContact O-N 3.48Å; R662-T665 PolarHBondContact O-OG1 3.23Å; R662-I799 HydrophobicContact CB-CD1 3.5Å; R662-I799 HydrophobicContact CB-CG1 4.12Å; R662-I799 HydrophobicContact CB-CG2 4.38Å; R662-E806 WeakPolarHBondContact CD-OE2 3.36Å; R662-E806 IonicContact CZ-OE1 2.65Å; R662-E806 IonicContact CZ-OE2 2.76Å; R662-E806 IonicContact NE-OE1 3.64Å; R662-E806 IonicContact NE-OE2 2.6Å; R662-E806 PolarHBondContact NE-OE2 3.21Å; R662-E806 IonicContact NH1-OE1 3.51Å; R662-E806 PolarHBondContact NH1-OE1 2.93Å; R662-E806 IonicContact NH1-OE2 3.68Å; R662-E806 PolarHBondContact NH1-OE2 2.91Å; R662-E806 VanDerWaalsContact NH1-OE2 3.09Å; R662-E806 IonicContact NH2-OE1 3.33Å; R662-E806 PolarHBondContact NH2-OE1 2.88Å; R662-E806 IonicContact NH2-OE2 3.4Å; R662-E806 PolarHBondContact NH2-OE2 3.44Å
663	M	91.9	Very high	89.7	Confident	33 Å²	33	63.2 Å²	63.2	16%	0.163	32%	0.321	C	S	.	.	H	α-helix	trans	-58.7	-35.3	173.7	-70.9	-174.1	-64.3	0	0	111.7	S659 F660 T665 D666 I667 F796 I799	S659-M663 WeakPolarHBondContact O-CB 3.44Å; S659-M663 VanDerWaalsContact O-CG 3.3Å; S659-M663 WeakPolarHBondContact O-CG 3.35Å; S659-M663 PolarHBondContact O-N 2.92Å; F660-M663 PolarHBondContact O-N 3.39Å; M663-T665 PolarHBondContact O-N 3.46Å; M663-D666 PolarHBondContact O-N 3.5Å; M663-I667 WeakPolarHBondContact O-CG1 3.2Å; M663-I667 PolarHBondContact O-N 3.33Å; M663-F796 HydrophobicContact CE-CD2 4.18Å; M663-F796 HydrophobicContact SD-CB 3.97Å; M663-F796 HydrophobicContact SD-CD2 3.95Å; M663-F796 HydrophobicContact SD-CG 4.45Å; M663-I799 HydrophobicContact CG-CD1 3.9Å
664	L	89.7	Confident	89.7	Confident	81 Å²	81	60.1 Å²	60.1	42%	0.424	30%	0.304	S	S	.	.	H	α-helix	trans	-57.4	-36.5	175.9	-167.5	151	0	0	0	112	F660 T661 R662 D666 I667 T668	F660-L664 HydrophobicContact CE1-CD1 4.23Å; F660-L664 HydrophobicContact CZ-CD1 4.4Å; F660-L664 WeakPolarHBondContact O-CB 3.42Å; F660-L664 PolarHBondContact O-N 3.3Å; T661-L664 WeakPolarHBondContact O-CB 3.42Å; T661-L664 PolarHBondContact O-N 3.11Å; R662-L664 PolarHBondContact O-N 3.33Å; L664-D666 VanDerWaalsContact C-N 3.34Å; L664-D666 PolarHBondContact O-N 3.48Å; L664-I667 PolarHBondContact O-N 3.38Å; L664-T668 HydrophobicContact CD2-CG2 3.85Å; L664-T668 VanDerWaalsContact O-CG2 3.3Å; L664-T668 WeakPolarHBondContact O-CG2 3.37Å; L664-T668 PolarHBondContact O-N 3.2Å
665	T	86.7	Confident	89.7	Confident	71 Å²	71	63.2 Å²	63.2	44%	0.436	32%	0.32	S	S	.	.	H	α-helix	trans	-65.4	-35.6	176.7	67.9	0	0	0	0	112.7	R662 M663 T668 R669	R662-T665 PolarHBondContact O-N 3.48Å; R662-T665 PolarHBondContact O-OG1 3.23Å; M663-T665 PolarHBondContact O-N 3.46Å; T665-T668 PolarHBondContact O-N 3.26Å; T665-T668 PolarHBondContact O-OG1 3.13Å; T665-R669 PolarHBondContact O-N 2.82Å
666	D	88.9	Confident	89.8	Confident	34 Å²	34	67.1 Å²	67.1	18%	0.182	34%	0.338	C	S	.	.	H	α-helix	trans	-72.8	-39.9	174	-69.3	-28.4	0	0	0	111.8	M663 L664 T668 R669 F670 S795	M663-D666 PolarHBondContact O-N 3.5Å; L664-D666 VanDerWaalsContact C-N 3.34Å; L664-D666 PolarHBondContact O-N 3.48Å; D666-T668 VanDerWaalsContact C-N 3.28Å; D666-T668 PolarHBondContact O-N 2.76Å; D666-R669 WeakPolarHBondContact O-CB 3.39Å; D666-R669 PolarHBondContact O-N 2.84Å; D666-R669 VanDerWaalsContact O-N 3.12Å; D666-R669 IonicContact OD1-CZ 3.67Å; D666-R669 IonicContact OD1-NH1 3.72Å; D666-R669 PolarHBondContact OD1-NH1 3.41Å; D666-F670 PolarHBondContact O-N 3.35Å; D666-F670 VanDerWaalsContact O-N 3.12Å; D666-S795 WeakPolarHBondContact OD2-CB 3.49Å; D666-S795 PolarHBondContact OD2-OG 2.96Å
667	I	91.2	Very high	89.9	Confident	61 Å²	61	63.6 Å²	63.6	31%	0.313	32%	0.321	S	S	.	.	H	α-helix	trans	-59.4	-39.8	174	-63.4	168.2	0	0	0	110.6	M663 L664 R669 F670 M671 L788 M792	M663-I667 WeakPolarHBondContact O-CG1 3.2Å; M663-I667 PolarHBondContact O-N 3.33Å; L664-I667 PolarHBondContact O-N 3.38Å; I667-R669 VanDerWaalsContact C-N 3.31Å; I667-R669 PolarHBondContact O-N 2.76Å; I667-F670 CarbonylContact O-C 3.44Å; I667-F670 WeakPolarHBondContact O-CB 3.46Å; I667-F670 PolarHBondContact O-N 3.35Å; I667-F670 VanDerWaalsContact O-N 3.14Å; I667-M671 WeakPolarHBondContact O-CB 3.15Å; I667-M671 PolarHBondContact O-N 3.09Å; I667-L788 HydrophobicContact CG1-CD1 4.26Å; I667-M792 HydrophobicContact CD1-SD 3.89Å; I667-M792 HydrophobicContact CG1-CG 4.36Å; I667-M792 HydrophobicContact CG1-SD 4.23Å
668	T	88.1	Confident	90	Very high	75 Å²	75	63.6 Å²	63.6	46%	0.46	32%	0.321	S	S	.	.	H	α-helix	trans	-64	-34.5	177.5	60.2	0	0	0	0	113	L664 T665 D666 F670 M671	L664-T668 HydrophobicContact CD2-CG2 3.85Å; L664-T668 VanDerWaalsContact O-CG2 3.3Å; L664-T668 WeakPolarHBondContact O-CG2 3.37Å; L664-T668 PolarHBondContact O-N 3.2Å; T665-T668 PolarHBondContact O-N 3.26Å; T665-T668 PolarHBondContact O-OG1 3.13Å; D666-T668 VanDerWaalsContact C-N 3.28Å; D666-T668 PolarHBondContact O-N 2.76Å; T668-F670 VanDerWaalsContact C-N 3.34Å; T668-M671 PolarHBondContact O-N 3.42Å
669	R	86.7	Confident	90.1	Very high	172 Å²	172	67.5 Å²	67.5	65%	0.649	34%	0.337	S	S	*	.	H	α-helix	trans	-65.5	-40.5	173.2	-65.2	170.5	-180	156.9	-5.5	110.9	T665 D666 I667 V672	T665-R669 PolarHBondContact O-N 2.82Å; D666-R669 WeakPolarHBondContact O-CB 3.39Å; D666-R669 PolarHBondContact O-N 2.84Å; D666-R669 VanDerWaalsContact O-N 3.12Å; D666-R669 IonicContact OD1-CZ 3.67Å; D666-R669 IonicContact OD1-NH1 3.72Å; D666-R669 PolarHBondContact OD1-NH1 3.41Å; I667-R669 VanDerWaalsContact C-N 3.31Å; I667-R669 PolarHBondContact O-N 2.76Å; R669-V672 PolarHBondContact O-N 2.95Å
670	F	88.6	Confident	90.2	Very high	15 Å²	15	70.1 Å²	70.1	7%	0.066	36%	0.359	C	S	.	.	H	α-helix	trans	-69.2	-35	176.4	-166.1	-96.6	0	0	0	113	D666 I667 T668 V672 L673 Y674 L784 M787 L788 M791	D666-F670 PolarHBondContact O-N 3.35Å; D666-F670 VanDerWaalsContact O-N 3.12Å; I667-F670 CarbonylContact O-C 3.44Å; I667-F670 WeakPolarHBondContact O-CB 3.46Å; I667-F670 PolarHBondContact O-N 3.35Å; I667-F670 VanDerWaalsContact O-N 3.14Å; T668-F670 VanDerWaalsContact C-N 3.34Å; F670-V672 PolarHBondContact O-N 2.64Å; F670-V672 VanDerWaalsContact O-N 3.16Å; F670-L673 HydrophobicContact CD2-CD1 4.34Å; F670-L673 HydrophobicContact CE2-CD1 4.44Å; F670-L673 WeakPolarHBondContact O-CB 3.45Å; F670-L673 PolarHBondContact O-N 3.45Å; F670-Y674 PolarHBondContact O-N 2.97Å; F670-L784 HydrophobicContact CE1-CB 4.01Å; F670-L784 HydrophobicContact CE1-CD2 4.26Å; F670-L784 WeakPolarHBondContact CE1-O 3.49Å; F670-L784 HydrophobicContact CE2-CD2 4.4Å; F670-L784 HydrophobicContact CZ-CB 3.87Å; F670-L784 HydrophobicContact CZ-CD2 3.66Å; F670-L784 HydrophobicContact CZ-CG 4.35Å; F670-L784 WeakPolarHBondContact CZ-O 3.32Å; F670-M787 HydrophobicContact CE2-CB 4Å; F670-M787 HydrophobicContact CZ-CB 4.12Å; F670-L788 HydrophobicContact CB-CD1 4.22Å; F670-L788 HydrophobicContact CD1-CB 4.18Å; F670-L788 HydrophobicContact CD1-CD1 3.77Å; F670-L788 HydrophobicContact CD1-CG 4.38Å; F670-L788 HydrophobicContact CE1-CB 3.86Å; F670-L788 HydrophobicContact CE1-CD1 4.33Å; F670-L788 HydrophobicContact CE1-CG 4.5Å; F670-L788 HydrophobicContact CG-CD1 4Å; F670-L788 HydrophobicContact CZ-CB 4.19Å; F670-M791 HydrophobicContact CD2-CE 4.1Å; F670-M791 HydrophobicContact CD2-SD 4.46Å
671	M	88.6	Confident	90.4	Very high	82 Å²	82	65.7 Å²	65.7	40%	0.404	34%	0.34	S	S	.	.	H	α-helix	trans	-58.6	-28.5	177.7	-170	61.3	-178.3	0	0	112.5	I667 T668 Y674 L675	I667-M671 WeakPolarHBondContact O-CB 3.15Å; I667-M671 PolarHBondContact O-N 3.09Å; T668-M671 PolarHBondContact O-N 3.42Å; M671-Y674 HydrophobicContact CE-CD1 3.43Å; M671-Y674 VanDerWaalsContact CE-CD1 3.43Å; M671-Y674 HydrophobicContact CE-CE1 3.62Å; M671-Y674 PolarHBondContact O-N 2.97Å; M671-Y674 HydrophobicContact SD-CD1 3.49Å; M671-Y674 WeakPolarHBondContact SD-CD1 3.13Å; M671-Y674 HydrophobicContact SD-CE1 4.21Å; M671-Y674 HydrophobicContact SD-CG 4.15Å; M671-L675 HydrophobicContact CE-CD2 4.04Å; M671-L675 HydrophobicContact CE-CG 4.17Å; M671-L675 HydrophobicContact CG-CD1 4.38Å; M671-L675 HydrophobicContact CG-CG 4.4Å; M671-L675 WeakPolarHBondContact O-CB 3.34Å; M671-L675 WeakPolarHBondContact O-CG 3.43Å; M671-L675 PolarHBondContact O-N 3.48Å
672	V	91.3	Very high	90.6	Very high	97 Å²	97	63.5 Å²	63.5	59%	0.588	33%	0.325	S	S	*	.	H	α-helix	trans	-62	-42.2	173.9	179.4	0	0	0	0	111.5	R669 F670 L675 L676	R669-V672 PolarHBondContact O-N 2.95Å; F670-V672 PolarHBondContact O-N 2.64Å; F670-V672 VanDerWaalsContact O-N 3.16Å; V672-L675 PolarHBondContact O-N 3.19Å; V672-L676 PolarHBondContact O-N 2.83Å
673	L	89.6	Confident	90.7	Very high	95 Å²	95	63.1 Å²	63.1	50%	0.497	33%	0.332	S	S	.	.	H	α-helix	trans	-66.1	-42.4	176.2	-67.2	173.9	0	0	0	111.2	F670 L676 V677	F670-L673 HydrophobicContact CD2-CD1 4.34Å; F670-L673 HydrophobicContact CE2-CD1 4.44Å; F670-L673 WeakPolarHBondContact O-CB 3.45Å; F670-L673 PolarHBondContact O-N 3.45Å; L673-L676 PolarHBondContact O-N 2.94Å; L673-V677 WeakPolarHBondContact O-CG2 3.49Å; L673-V677 PolarHBondContact O-N 2.99Å; L673-V677 VanDerWaalsContact O-N 3.14Å
674	Y	90.8	Very high	90.8	Very high	13 Å²	13	63 Å²	63	5%	0.051	34%	0.339	C	S	.	.	H	α-helix	trans	-59.6	-47.5	175.1	168.1	-96.5	0	0	0	111.9	F670 M671 L676 V677 L678 M730 I780 L784	F670-Y674 PolarHBondContact O-N 2.97Å; M671-Y674 HydrophobicContact CE-CD1 3.43Å; M671-Y674 VanDerWaalsContact CE-CD1 3.43Å; M671-Y674 HydrophobicContact CE-CE1 3.62Å; M671-Y674 PolarHBondContact O-N 2.97Å; M671-Y674 HydrophobicContact SD-CD1 3.49Å; M671-Y674 WeakPolarHBondContact SD-CD1 3.13Å; M671-Y674 HydrophobicContact SD-CE1 4.21Å; M671-Y674 HydrophobicContact SD-CG 4.15Å; Y674-L676 VanDerWaalsContact C-N 3.32Å; Y674-L676 PolarHBondContact O-N 3.23Å; Y674-V677 PolarHBondContact O-N 3.5Å; Y674-L678 HydrophobicContact CE1-CD2 4.06Å; Y674-L678 WeakPolarHBondContact O-CB 3.36Å; Y674-L678 PolarHBondContact O-N 3.23Å; Y674-M730 HydrophobicContact CD2-SD 4.49Å; Y674-M730 HydrophobicContact CE2-SD 3.66Å; Y674-I780 HydrophobicContact CD2-CD1 4.48Å; Y674-I780 HydrophobicContact CE2-CD1 4.03Å; Y674-I780 HydrophobicContact CE2-CG2 4.5Å; Y674-L784 HydrophobicContact CD2-CD1 4.37Å
675	L	91.6	Very high	90.8	Very high	65 Å²	65	59.1 Å²	59.1	34%	0.34	32%	0.319	S	S	.	.	H	α-helix	trans	-62.8	-37.6	179.1	-72.7	175.2	0	0	0	112.1	M671 V672 L678 F679	M671-L675 HydrophobicContact CE-CD2 4.04Å; M671-L675 HydrophobicContact CE-CG 4.17Å; M671-L675 HydrophobicContact CG-CD1 4.38Å; M671-L675 HydrophobicContact CG-CG 4.4Å; M671-L675 WeakPolarHBondContact O-CB 3.34Å; M671-L675 WeakPolarHBondContact O-CG 3.43Å; M671-L675 PolarHBondContact O-N 3.48Å; V672-L675 PolarHBondContact O-N 3.19Å; L675-L678 HydrophobicContact CD2-CD2 4.22Å; L675-L678 PolarHBondContact O-N 3.07Å; L675-F679 HydrophobicContact CB-CD2 4.44Å; L675-F679 HydrophobicContact CB-CE2 4.38Å; L675-F679 WeakPolarHBondContact O-CB 3.21Å; L675-F679 WeakPolarHBondContact O-CD2 3.45Å; L675-F679 PolarHBondContact O-N 3.05Å
676	L	92.7	Very high	91	Very high	116 Å²	116	57.9 Å²	57.9	61%	0.607	31%	0.308	S	S	*	.	H	α-helix	trans	-60.1	-49.2	175.4	-172.1	163.3	0	0	0	111	V672 L673 Y674 F679 A680	V672-L676 PolarHBondContact O-N 2.83Å; L673-L676 PolarHBondContact O-N 2.94Å; Y674-L676 VanDerWaalsContact C-N 3.32Å; Y674-L676 PolarHBondContact O-N 3.23Å; L676-F679 PolarHBondContact O-N 3.49Å; L676-A680 WeakPolarHBondContact O-CB 3.43Å; L676-A680 PolarHBondContact O-N 3.28Å
677	V	93	Very high	91.1	Very high	26 Å²	26	61.1 Å²	61.1	16%	0.158	33%	0.325	C	S	.	.	H	α-helix	trans	-62.2	-45.7	176.7	175.6	0	0	0	0	110.4	L673 Y674 F679 A680 F681 I779 I780 L784	L673-V677 WeakPolarHBondContact O-CG2 3.49Å; L673-V677 PolarHBondContact O-N 2.99Å; L673-V677 VanDerWaalsContact O-N 3.14Å; Y674-V677 PolarHBondContact O-N 3.5Å; V677-F679 PolarHBondContact O-N 3.4Å; V677-A680 PolarHBondContact O-N 3.13Å; V677-F681 HydrophobicContact CG1-CD2 3.78Å; V677-F681 HydrophobicContact CG1-CE2 3.9Å; V677-F681 WeakPolarHBondContact O-CD2 3.47Å; V677-F681 PolarHBondContact O-N 2.94Å; V677-F681 VanDerWaalsContact O-N 3.08Å; V677-I779 HydrophobicContact CG1-CG2 4.02Å; V677-I779 HydrophobicContact CG2-CG2 4.43Å; V677-I780 HydrophobicContact CG1-CG1 4.4Å; V677-L784 HydrophobicContact CG2-CD1 4.48Å
678	L	92.4	Very high	91	Very high	6 Å²	6	60.1 Å²	60.1	3%	0.031	32%	0.32	C	S	.	.	H	α-helix	trans	-56.1	-49.1	178	-176	70.5	0	0	0	111.5	Y674 L675 M682 L723 L726 Y776	Y674-L678 HydrophobicContact CE1-CD2 4.06Å; Y674-L678 WeakPolarHBondContact O-CB 3.36Å; Y674-L678 PolarHBondContact O-N 3.23Å; L675-L678 HydrophobicContact CD2-CD2 4.22Å; L675-L678 PolarHBondContact O-N 3.07Å; L678-M682 WeakPolarHBondContact O-CB 3.3Å; L678-M682 PolarHBondContact O-N 3.26Å; L678-L723 HydrophobicContact CD2-CD1 3.89Å; L678-L723 HydrophobicContact CG-CD1 4.32Å; L678-L726 HydrophobicContact CD1-CB 3.7Å; L678-Y776 HydrophobicContact CD1-CE2 4.34Å; L678-Y776 VanDerWaalsContact CD1-OH 3.29Å; L678-Y776 WeakPolarHBondContact CD1-OH 3.24Å
679	F	92.4	Very high	91	Very high	107 Å²	107	56.6 Å²	56.6	47%	0.469	30%	0.298	S	S	.	.	H	α-helix	trans	-67	-39.1	179.3	-76.9	-58.8	0	0	0	112.9	L675 L676 V677 M682 V683	L675-F679 HydrophobicContact CB-CD2 4.44Å; L675-F679 HydrophobicContact CB-CE2 4.38Å; L675-F679 WeakPolarHBondContact O-CB 3.21Å; L675-F679 WeakPolarHBondContact O-CD2 3.45Å; L675-F679 PolarHBondContact O-N 3.05Å; L676-F679 PolarHBondContact O-N 3.49Å; V677-F679 PolarHBondContact O-N 3.4Å; F679-M682 HydrophobicContact CD1-CE 3.72Å; F679-M682 HydrophobicContact CD1-SD 4.03Å; F679-M682 HydrophobicContact CE1-CE 4.33Å; F679-M682 HydrophobicContact CE1-SD 4.34Å; F679-M682 PolarHBondContact O-N 3.08Å; F679-V683 WeakPolarHBondContact O-CG2 3.41Å; F679-V683 PolarHBondContact O-N 2.68Å
680	A	93.7	Very high	90.9	Very high	59 Å²	59	54.7 Å²	54.7	49%	0.488	29%	0.291	S	S	.	.	H	α-helix	trans	-60.4	-48.6	178.2	0	0	0	0	0	111.7	L676 V677 G684	L676-A680 WeakPolarHBondContact O-CB 3.43Å; L676-A680 PolarHBondContact O-N 3.28Å; V677-A680 PolarHBondContact O-N 3.13Å; A680-G684 PolarHBondContact O-N 2.81Å
681	F	92.9	Very high	90.8	Very high	32 Å²	32	60.1 Å²	60.1	14%	0.14	31%	0.312	C	S	.	.	H	α-helix	trans	-73.6	-31.2	177	-77.4	-85.4	0	0	0	112.8	V677 G684 L685 L772 V775 Y776 I779	V677-F681 HydrophobicContact CG1-CD2 3.78Å; V677-F681 HydrophobicContact CG1-CE2 3.9Å; V677-F681 WeakPolarHBondContact O-CD2 3.47Å; V677-F681 PolarHBondContact O-N 2.94Å; V677-F681 VanDerWaalsContact O-N 3.08Å; F681-G684 PolarHBondContact O-N 3.46Å; F681-L685 WeakPolarHBondContact O-CB 3.3Å; F681-L685 WeakPolarHBondContact O-CG 3.35Å; F681-L685 PolarHBondContact O-N 3.34Å; F681-L772 HydrophobicContact CE1-CD2 4.46Å; F681-L772 WeakPolarHBondContact CE1-O 3.5Å; F681-V775 HydrophobicContact CE1-CG1 4.36Å; F681-V775 HydrophobicContact CZ-CG1 3.97Å; F681-Y776 HydrophobicContact CB-CD2 3.57Å; F681-Y776 HydrophobicContact CB-CE2 4.09Å; F681-Y776 HydrophobicContact CB-CG 4.4Å; F681-Y776 HydrophobicContact CD1-CD2 4.19Å; F681-Y776 HydrophobicContact CD1-CG 4.44Å; F681-Y776 AromaticContact CD2-CD2 3.65Å; F681-Y776 HydrophobicContact CD2-CD2 3.65Å; F681-Y776 HydrophobicContact CE2-CD2 4.37Å; F681-Y776 AromaticContact CG-CD2 3.54Å; F681-Y776 HydrophobicContact CG-CD2 3.54Å; F681-Y776 HydrophobicContact CG-CE2 4.46Å; F681-Y776 HydrophobicContact CG-CG 4.21Å; F681-I779 HydrophobicContact CE2-CD1 3.89Å; F681-I779 HydrophobicContact CZ-CD1 3.84Å
682	M	92.5	Very high	90.4	Very high	14 Å²	14	58.3 Å²	58.3	7%	0.069	30%	0.301	C	S	.	.	H	α-helix	trans	-60.4	-48.8	173.2	-178.2	-155.3	70.8	0	0	111.3	L678 F679 H686 L719 T722 L723 L726	L678-M682 WeakPolarHBondContact O-CB 3.3Å; L678-M682 PolarHBondContact O-N 3.26Å; F679-M682 HydrophobicContact CD1-CE 3.72Å; F679-M682 HydrophobicContact CD1-SD 4.03Å; F679-M682 HydrophobicContact CE1-CE 4.33Å; F679-M682 HydrophobicContact CE1-SD 4.34Å; F679-M682 PolarHBondContact O-N 3.08Å; M682-H686 WeakPolarHBondContact O-CB 3.24Å; M682-H686 PolarHBondContact O-N 2.85Å; M682-L719 HydrophobicContact CE-CD1 3.46Å; M682-L719 VanDerWaalsContact CE-CD1 3.46Å; M682-L719 HydrophobicContact CE-CG 4.46Å; M682-L719 HydrophobicContact CG-CD1 4.27Å; M682-L719 HydrophobicContact SD-CD1 3.73Å; M682-L719 HydrophobicContact SD-CG 4.33Å; M682-T722 WeakPolarHBondContact CG-OG1 3.47Å; M682-L723 HydrophobicContact SD-CB 4.29Å; M682-L723 HydrophobicContact SD-CD1 4.06Å; M682-L726 HydrophobicContact CB-CD1 3.72Å; M682-L726 HydrophobicContact CG-CD1 4.39Å
683	V	92.3	Very high	89.8	Confident	71 Å²	71	53.7 Å²	53.7	43%	0.43	27%	0.273	S	S	.	.	H	α-helix	trans	-66.4	-42.9	176.4	175.8	0	0	0	0	110.6	F679 H686 N687	F679-V683 WeakPolarHBondContact O-CG2 3.41Å; F679-V683 PolarHBondContact O-N 2.68Å; V683-H686 PolarHBondContact O-N 3.03Å; V683-N687 VanDerWaalsContact O-CB 3.3Å; V683-N687 WeakPolarHBondContact O-CB 3.3Å; V683-N687 PolarHBondContact O-N 3.41Å; V683-N687 PolarHBondContact O-ND2 2.96Å
684	G	92.4	Very high	89.2	Confident	30 Å²	30	55 Å²	55	31%	0.309	28%	0.28	S	S	.	.	H	α-helix	trans	-59.8	-50.2	179	0	0	0	0	0	113.5	A680 F681 L688	A680-G684 PolarHBondContact O-N 2.81Å; F681-G684 PolarHBondContact O-N 3.46Å; G684-L688 PolarHBondContact O-N 3.12Å
685	L	90.5	Very high	88.6	Confident	1 Å²	1	58.2 Å²	58.2	1%	0.005	30%	0.296	C	S	.	.	H	α-helix	trans	-73.3	-36	179.2	-71.5	165.1	0	0	0	112.1	F681 L688 Y689 F716 L726 L772	F681-L685 WeakPolarHBondContact O-CB 3.3Å; F681-L685 WeakPolarHBondContact O-CG 3.35Å; F681-L685 PolarHBondContact O-N 3.34Å; L685-L688 PolarHBondContact O-N 3.05Å; L685-Y689 HydrophobicContact CD2-CD2 4.38Å; L685-Y689 HydrophobicContact CD2-CE2 3.99Å; L685-Y689 WeakPolarHBondContact O-CD2 3.23Å; L685-Y689 PolarHBondContact O-N 3.28Å; L685-F716 HydrophobicContact CB-CD1 4.27Å; L685-F716 HydrophobicContact CB-CE1 4.26Å; L685-F716 HydrophobicContact CD1-CE1 4.11Å; L685-F716 HydrophobicContact CD1-CZ 4.17Å; L685-L726 HydrophobicContact CD1-CD1 4.33Å; L685-L726 HydrophobicContact CD1-CD2 3.68Å; L685-L726 HydrophobicContact CD1-CG 4.43Å; L685-L772 HydrophobicContact CD2-CB 3.98Å; L685-L772 HydrophobicContact CD2-CD1 4.36Å
686	H	90.7	Very high	87.8	Confident	45 Å²	45	59.5 Å²	59.5	21%	0.208	31%	0.306	C	S	.	.	H	α-helix	trans	-60.5	-47	173.2	-175.2	51.9	0	0	0	111.2	M682 V683 L688 Y689 W690 T722	M682-H686 WeakPolarHBondContact O-CB 3.24Å; M682-H686 PolarHBondContact O-N 2.85Å; V683-H686 PolarHBondContact O-N 3.03Å; H686-L688 PolarHBondContact O-N 3.2Å; H686-Y689 PolarHBondContact O-N 3.16Å; H686-W690 VanDerWaalsContact O-CB 3.3Å; H686-W690 WeakPolarHBondContact O-CB 3.46Å; H686-W690 PolarHBondContact O-N 3.4Å; H686-T722 HydrophobicContact CB-CG2 3.8Å
687	N	90.8	Very high	86.8	Confident	102 Å²	102	55.6 Å²	55.6	55%	0.545	28%	0.284	S	S	.	.	H	α-helix	trans	-64.7	-25.8	178.2	-72.1	-9.3	0	0	0	113.1	V683 W690	V683-N687 VanDerWaalsContact O-CB 3.3Å; V683-N687 WeakPolarHBondContact O-CB 3.3Å; V683-N687 PolarHBondContact O-N 3.41Å; V683-N687 PolarHBondContact O-ND2 2.96Å; N687-W690 VanDerWaalsContact O-CD1 3.25Å
688	L	88.9	Confident	85.6	Confident	40 Å²	40	62 Å²	62	21%	0.209	31%	0.31	C	S	.	.	H	α-helix	trans	-76.9	-41.7	175.4	-173.7	66.5	0	0	0	112	G684 L685 H686 V765 V768 G769 L772	G684-L688 PolarHBondContact O-N 3.12Å; L685-L688 PolarHBondContact O-N 3.05Å; H686-L688 PolarHBondContact O-N 3.2Å; L688-V765 HydrophobicContact CD1-CG1 3.91Å; L688-V765 HydrophobicContact CD2-CG1 4.48Å; L688-V765 HydrophobicContact CG-CG1 3.9Å; L688-V768 HydrophobicContact CD1-CG1 4.29Å; L688-V768 HydrophobicContact CD2-CB 4.42Å; L688-V768 HydrophobicContact CD2-CG1 4.07Å; L688-G769 VanDerWaalsContact CD2-CA 3.47Å; L688-L772 HydrophobicContact CD2-CD1 4.24Å
689	Y	87.9	Confident	84.3	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-103.2	-9.2	-169.9	-72.6	-72.6	0	0	0	115.6	L685 H686 Y691 Y692 G693 T713 F716 I741 V765 G769	L685-Y689 HydrophobicContact CD2-CD2 4.38Å; L685-Y689 HydrophobicContact CD2-CE2 3.99Å; L685-Y689 WeakPolarHBondContact O-CD2 3.23Å; L685-Y689 PolarHBondContact O-N 3.28Å; H686-Y689 PolarHBondContact O-N 3.16Å; Y689-Y691 VanDerWaalsContact C-N 3.26Å; Y689-Y691 PolarHBondContact O-N 2.96Å; Y689-Y691 VanDerWaalsContact O-N 3.12Å; Y689-Y692 PolarHBondContact O-N 3.35Å; Y689-G693 PolarHBondContact O-N 3.48Å; Y689-T713 HydrophobicContact CD1-CG2 4.05Å; Y689-T713 HydrophobicContact CE1-CG2 4.42Å; Y689-F716 HydrophobicContact CD2-CB 4.23Å; Y689-F716 AromaticContact CD2-CD2 3.43Å; Y689-F716 HydrophobicContact CD2-CD2 3.43Å; Y689-F716 VanDerWaalsContact CD2-CD2 3.43Å; Y689-F716 HydrophobicContact CD2-CE2 4.05Å; Y689-F716 AromaticContact CD2-CG 4Å; Y689-F716 HydrophobicContact CD2-CG 4Å; Y689-F716 AromaticContact CE2-CD2 3.79Å; Y689-F716 HydrophobicContact CE2-CD2 3.79Å; Y689-F716 AromaticContact CE2-CE2 3.95Å; Y689-F716 HydrophobicContact CE2-CE2 3.95Å; Y689-F716 HydrophobicContact CG-CB 4.19Å; Y689-F716 AromaticContact CG-CD2 3.91Å; Y689-F716 HydrophobicContact CG-CD2 3.91Å; Y689-F716 HydrophobicContact CG-CG 4.4Å; Y689-I741 HydrophobicContact CD1-CG1 4.44Å; Y689-I741 HydrophobicContact CE1-CD1 4.35Å; Y689-I741 HydrophobicContact CE1-CG1 4.12Å; Y689-V765 HydrophobicContact CE1-CG1 4.37Å; Y689-G769 WeakPolarHBondContact OH-CA 3.36Å
690	W	86.1	Confident	83.1	Confident	133 Å²	133	65.9 Å²	65.9	50%	0.504	33%	0.326	S	S	.	.	H	α-helix	trans	-54.7	-38.6	-172.9	77.1	-79.5	0	0	0	113.8	H686 N687 G693 L694	H686-W690 VanDerWaalsContact O-CB 3.3Å; H686-W690 WeakPolarHBondContact O-CB 3.46Å; H686-W690 PolarHBondContact O-N 3.4Å; N687-W690 VanDerWaalsContact O-CD1 3.25Å; W690-G693 PolarHBondContact O-N 3.32Å; W690-L694 HydrophobicContact CE3-CD1 3.94Å; W690-L694 HydrophobicContact CZ3-CD1 3.95Å; W690-L694 PolarHBondContact O-N 2.89Å
691	Y	84.8	Confident	81.8	Confident	129 Å²	129	65.5 Å²	65.5	51%	0.506	32%	0.316	S	S	.	.	H	α-helix	trans	-66.9	-41.2	179.8	179.4	-99	0	0	0	111.9	Y689 Q695	Y689-Y691 VanDerWaalsContact C-N 3.26Å; Y689-Y691 PolarHBondContact O-N 2.96Å; Y689-Y691 VanDerWaalsContact O-N 3.12Å; Y691-Q695 PolarHBondContact OH-NE2 2.94Å
692	Y	82.1	Confident	80.4	Confident	44 Å²	44	72.1 Å²	72.1	17%	0.173	35%	0.347	C	S	.	.	H	α-helix	trans	-77.2	-25.6	179.2	-59.1	-75.3	0	0	0	112.5	Y689 L694 Q695 I741 T762 V765	Y689-Y692 PolarHBondContact O-N 3.35Å; Y692-L694 VanDerWaalsContact C-N 3.3Å; Y692-L694 PolarHBondContact O-N 2.89Å; Y692-Q695 PolarHBondContact O-N 3.44Å; Y692-I741 HydrophobicContact CD1-CD1 3.95Å; Y692-I741 HydrophobicContact CD1-CG1 4.47Å; Y692-I741 HydrophobicContact CD1-CG2 4.04Å; Y692-I741 HydrophobicContact CD2-CD1 3.79Å; Y692-I741 HydrophobicContact CE1-CD1 4.07Å; Y692-I741 HydrophobicContact CE2-CD1 3.94Å; Y692-I741 HydrophobicContact CG-CD1 3.79Å; Y692-I741 HydrophobicContact CG-CG1 4.22Å; Y692-I741 HydrophobicContact CG-CG2 4.45Å; Y692-T762 HydrophobicContact CE1-CG2 3.94Å; Y692-V765 HydrophobicContact CD2-CG1 4.23Å; Y692-V765 HydrophobicContact CE2-CB 4.26Å; Y692-V765 HydrophobicContact CE2-CG1 3.75Å; Y692-V765 HydrophobicContact CE2-CG2 4.01Å
693	G	77.8	Confident	79	Confident	0 Å²	0	75.8 Å²	75.8	0%	0	38%	0.38	C	S	.	.	H	α-helix	trans	-61.8	-36.6	171.9	0	0	0	0	0	113.2	Y689 W690 Q695 V711 T713	Y689-G693 PolarHBondContact O-N 3.48Å; W690-G693 PolarHBondContact O-N 3.32Å; G693-Q695 VanDerWaalsContact C-N 3.25Å; G693-Q695 PolarHBondContact O-N 3.06Å; G693-V711 VanDerWaalsContact O-CG1 3.29Å; G693-V711 WeakPolarHBondContact O-CG1 3.35Å; G693-T713 WeakPolarHBondContact CA-OG1 3.45Å; G693-T713 PolarHBondContact N-OG1 3.29Å
694	L	77.7	Confident	77.6	Confident	123 Å²	123	75.9 Å²	75.9	64%	0.644	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-12	179.7	-67.7	170.4	0	0	0	113.7	W690 Y692	W690-L694 HydrophobicContact CE3-CD1 3.94Å; W690-L694 HydrophobicContact CZ3-CD1 3.95Å; W690-L694 PolarHBondContact O-N 2.89Å; Y692-L694 VanDerWaalsContact C-N 3.3Å; Y692-L694 PolarHBondContact O-N 2.89Å
695	Q	77.2	Confident	76.2	Confident	80 Å²	80	80.3 Å²	80.3	37%	0.374	40%	0.397	S	S	.	.			trans	-88.6	116.3	-177.1	-67.7	-171.3	-11.7	0	0	111	Y691 Y692 G693 A712	Y691-Q695 PolarHBondContact OH-NE2 2.94Å; Y692-Q695 PolarHBondContact O-N 3.44Å; G693-Q695 VanDerWaalsContact C-N 3.25Å; G693-Q695 PolarHBondContact O-N 3.06Å; Q695-A712 HydrophobicContact CB-CB 4.2Å; Q695-A712 WeakPolarHBondContact O-CB 3.36Å; Q695-A712 PolarHBondContact O-N 3.35Å
696	T	74.5	Confident	74.9	Confident	92 Å²	92	83.4 Å²	83.4	56%	0.564	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111	133.7	171.6	60.6	0	0	0	0	110.2	L710 V711	T696-L710 WeakPolarHBondContact CA-O 3.49Å; T696-V711 HydrophobicContact CG2-CG2 4.22Å
697	F	71.7	Confident	73.6	Confident	33 Å²	33	85.8 Å²	85.8	15%	0.145	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	151.2	171.1	55.8	-88.3	0	0	0	110.4	I699 L710 A712 R742 P744	F697-I699 HydrophobicContact CD2-CD1 4.19Å; F697-I699 HydrophobicContact CD2-CG1 3.69Å; F697-I699 HydrophobicContact CE2-CD1 3.56Å; F697-I699 HydrophobicContact CE2-CG1 3.61Å; F697-L710 PolarHBondContact N-O 3.01Å; F697-L710 PolarHBondContact O-N 3.14Å; F697-A712 HydrophobicContact CD1-CB 4.34Å; F697-A712 HydrophobicContact CE1-CB 3.9Å; F697-R742 HydrophobicContact CE1-CB 4.07Å; F697-R742 WeakPolarHBondContact CE1-O 3.46Å; F697-R742 HydrophobicContact CZ-CB 3.62Å; F697-P744 HydrophobicContact CD2-CB 4.49Å
698	K	67.9	Low	72.3	Confident	161 Å²	161	85.2 Å²	85.2	70%	0.7	43%	0.428	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.6	116.8	-179	-67.8	179.8	-178.3	-178.7	0	108.4	Q708 T709	K698-Q708 WeakPolarHBondContact CA-O 3.43Å; K698-T709 HydrophobicContact CG-CG2 3.89Å
699	I	65.8	Low	71.2	Confident	59 Å²	59	88 Å²	88	30%	0.303	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	133.2	170.5	-51.5	-179.6	0	0	0	107.4	F697 Q708 L710	F697-I699 HydrophobicContact CD2-CD1 4.19Å; F697-I699 HydrophobicContact CD2-CG1 3.69Å; F697-I699 HydrophobicContact CE2-CD1 3.56Å; F697-I699 HydrophobicContact CE2-CG1 3.61Å; I699-Q708 PolarHBondContact N-O 2.76Å; I699-Q708 PolarHBondContact O-N 2.95Å; I699-L710 HydrophobicContact CB-CD1 4.24Å; I699-L710 HydrophobicContact CD1-CB 4.33Å; I699-L710 HydrophobicContact CD1-CD1 3.9Å; I699-L710 HydrophobicContact CD1-CD2 3.97Å; I699-L710 HydrophobicContact CD1-CG 4.28Å; I699-L710 HydrophobicContact CG1-CD1 4.11Å
700	Y	67.3	Low	70.2	Confident	135 Å²	135	89.8 Å²	89.8	53%	0.529	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	111.9	170.1	-171.6	-98.2	0	0	0	108.2	E702 N705 T707	Y700-E702 HydrophobicContact CD1-CG 4.19Å; Y700-E702 HydrophobicContact CE1-CG 4.35Å; Y700-E702 PolarHBondContact O-N 3.28Å; Y700-N705 PolarHBondContact OH-OD1 3.29Å; Y700-T707 HydrophobicContact CD2-CG2 4.01Å
701	D	65.8	Low	69.4	Low	51 Å²	51	84.6 Å²	84.6	27%	0.273	44%	0.439	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	105.6	176	-179	18	0	0	0	109.1	A703 T704 N705 T706	D701-A703 PolarHBondContact O-N 2.95Å; D701-A703 VanDerWaalsContact O-N 3.17Å; D701-A703 PolarHBondContact OD1-N 3.24Å; D701-T704 PolarHBondContact O-N 3.39Å; D701-T704 WeakPolarHBondContact OD2-CG2 3.48Å; D701-T704 PolarHBondContact OD2-OG1 3.42Å; D701-N705 PolarHBondContact O-N 2.82Å; D701-N705 VanDerWaalsContact O-N 3.14Å; D701-T706 PolarHBondContact N-O 2.96Å
702	E	63.4	Low	68.6	Low	172 Å²	172	78.6 Å²	78.6	80%	0.804	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-23.7	179.3	-69.8	-173.1	164.1	0	0	112.3	Y700	Y700-E702 HydrophobicContact CD1-CG 4.19Å; Y700-E702 HydrophobicContact CE1-CG 4.35Å; Y700-E702 PolarHBondContact O-N 3.28Å
703	A	62.6	Low	68.1	Low	91 Å²	91	76.6 Å²	76.6	75%	0.752	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-29.6	-178.7	0	0	0	0	0	113.6	D701	D701-A703 PolarHBondContact O-N 2.95Å; D701-A703 VanDerWaalsContact O-N 3.17Å; D701-A703 PolarHBondContact OD1-N 3.24Å
704	T	64.1	Low	67.8	Low	72 Å²	72	80.1 Å²	80.1	44%	0.442	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-4.2	-174.2	56.9	0	0	0	0	114	D701 T706	D701-T704 PolarHBondContact O-N 3.39Å; D701-T704 WeakPolarHBondContact OD2-CG2 3.48Å; D701-T704 PolarHBondContact OD2-OG1 3.42Å; T704-T706 WeakPolarHBondContact O-CG2 3.22Å; T704-T706 PolarHBondContact O-N 2.84Å; T704-T706 PolarHBondContact OG1-OG1 3.11Å
705	N	63.5	Low	67.5	Low	123 Å²	123	75.1 Å²	75.1	66%	0.658	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	24.7	-169.4	-84.6	-15.3	0	0	0	112.4	Y700 D701	Y700-N705 PolarHBondContact OH-OD1 3.29Å; D701-N705 PolarHBondContact O-N 2.82Å; D701-N705 VanDerWaalsContact O-N 3.14Å
706	T	62.4	Low	67.6	Low	67 Å²	67	71.3 Å²	71.3	41%	0.411	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	140.5	178.8	65.1	0	0	0	0	110.7	D701 T704 Q708	D701-T706 PolarHBondContact N-O 2.96Å; T704-T706 WeakPolarHBondContact O-CG2 3.22Å; T704-T706 PolarHBondContact O-N 2.84Å; T704-T706 PolarHBondContact OG1-OG1 3.11Å; T706-Q708 PolarHBondContact O-N 3.4Å
707	T	63.9	Low	67.7	Low	94 Å²	94	70.8 Å²	70.8	58%	0.577	37%	0.372	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.9	110.2	169.4	49.4	0	0	0	0	107.6	Y700	Y700-T707 HydrophobicContact CD2-CG2 4.01Å
708	Q	62.4	Low	68.2	Low	90 Å²	90	70 Å²	70	42%	0.421	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	123.9	175	-64.8	-173	16.9	0	0	108.7	K698 I699 T706 L710	K698-Q708 WeakPolarHBondContact CA-O 3.43Å; I699-Q708 PolarHBondContact N-O 2.76Å; I699-Q708 PolarHBondContact O-N 2.95Å; T706-Q708 PolarHBondContact O-N 3.4Å; Q708-L710 HydrophobicContact CB-CD1 3.54Å; Q708-L710 WeakPolarHBondContact O-CD1 3.36Å; Q708-L710 PolarHBondContact O-N 3.43Å
709	T	66.5	Low	69.1	Low	98 Å²	98	67 Å²	67	60%	0.601	36%	0.364	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79	106.8	169.4	48.6	0	0	0	0	108.2	K698	K698-T709 HydrophobicContact CG-CG2 3.89Å
710	L	67.1	Low	70.1	Confident	39 Å²	39	73.6 Å²	73.6	20%	0.204	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	140	175	-79.2	86.1	0	0	0	110.1	T696 F697 I699 Q708	T696-L710 WeakPolarHBondContact CA-O 3.49Å; F697-L710 PolarHBondContact N-O 3.01Å; F697-L710 PolarHBondContact O-N 3.14Å; I699-L710 HydrophobicContact CB-CD1 4.24Å; I699-L710 HydrophobicContact CD1-CB 4.33Å; I699-L710 HydrophobicContact CD1-CD1 3.9Å; I699-L710 HydrophobicContact CD1-CD2 3.97Å; I699-L710 HydrophobicContact CD1-CG 4.28Å; I699-L710 HydrophobicContact CG1-CD1 4.11Å; Q708-L710 HydrophobicContact CB-CD1 3.54Å; Q708-L710 WeakPolarHBondContact O-CD1 3.36Å; Q708-L710 PolarHBondContact O-N 3.43Å
711	V	69.8	Low	71	Confident	24 Å²	24	71 Å²	71	15%	0.145	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	140.4	172.7	-171.7	0	0	0	0	108.6	G693 T696 T713 E717	G693-V711 VanDerWaalsContact O-CG1 3.29Å; G693-V711 WeakPolarHBondContact O-CG1 3.35Å; T696-V711 HydrophobicContact CG2-CG2 4.22Å; V711-T713 WeakPolarHBondContact CG1-O 3.34Å; V711-T713 PolarHBondContact O-N 3.23Å; V711-E717 HydrophobicContact CG1-CG 4.21Å
712	A	66.7	Low	72.1	Confident	2 Å²	2	68.6 Å²	68.6	2%	0.017	37%	0.365	C	S	.	.	S	Bend	trans	-64.7	-29.6	-179.6	0	0	0	0	0	113	Q695 F697 I741 R742	Q695-A712 HydrophobicContact CB-CB 4.2Å; Q695-A712 WeakPolarHBondContact O-CB 3.36Å; Q695-A712 PolarHBondContact O-N 3.35Å; F697-A712 HydrophobicContact CD1-CB 4.34Å; F697-A712 HydrophobicContact CE1-CB 3.9Å; A712-I741 HydrophobicContact CB-CG2 4.34Å; A712-R742 PolarHBondContact O-N 3.5Å
713	T	72.6	Confident	73.4	Confident	3 Å²	3	63.7 Å²	63.7	2%	0.018	34%	0.344	C	S	.	.			trans	-135.3	106.6	170.8	52.9	0	0	0	0	109.9	Y689 G693 V711 M715 I741	Y689-T713 HydrophobicContact CD1-CG2 4.05Å; Y689-T713 HydrophobicContact CE1-CG2 4.42Å; G693-T713 WeakPolarHBondContact CA-OG1 3.45Å; G693-T713 PolarHBondContact N-OG1 3.29Å; V711-T713 WeakPolarHBondContact CG1-O 3.34Å; V711-T713 PolarHBondContact O-N 3.23Å; T713-M715 WeakPolarHBondContact CB-O 3.29Å; T713-M715 PolarHBondContact O-N 2.91Å; T713-I741 HydrophobicContact CG2-CB 4.26Å; T713-I741 HydrophobicContact CG2-CG1 3.67Å; T713-I741 HydrophobicContact CG2-CG2 4.46Å
714	E	70.5	Confident	74.6	Confident	74 Å²	74	66.2 Å²	66.2	35%	0.346	34%	0.335	S	S	.	.	S	Bend	trans	-66.3	-30.6	172.4	-75.8	177	-157.5	0	0	111.1	K738 R742	E714-K738 WeakPolarHBondContact OE2-CE 3.47Å; E714-K738 IonicContact OE2-NZ 2.72Å; E714-K738 PolarHBondContact OE2-NZ 3.34Å; E714-R742 IonicContact OE1-CZ 3.21Å; E714-R742 IonicContact OE1-NH1 2.69Å; E714-R742 PolarHBondContact OE1-NH1 3.24Å; E714-R742 IonicContact OE1-NH2 2.81Å; E714-R742 PolarHBondContact OE1-NH2 2.87Å; E714-R742 IonicContact OE2-NH2 3.96Å
715	M	71.8	Confident	75.8	Confident	17 Å²	17	63.3 Å²	63.3	8%	0.084	32%	0.318	C	S	.	.	S	Bend	trans	-88.9	129.2	174.8	-60	-164	169.7	0	0	108	T713 V734 K738	T713-M715 WeakPolarHBondContact CB-O 3.29Å; T713-M715 PolarHBondContact O-N 2.91Å; M715-V734 HydrophobicContact CE-CB 4.4Å; M715-V734 HydrophobicContact CE-CG1 3.35Å; M715-V734 HydrophobicContact SD-CG1 3.45Å; M715-V734 WeakPolarHBondContact SD-CG1 3.25Å; M715-K738 HydrophobicContact CE-CB 3.55Å; M715-K738 HydrophobicContact CE-CD 3.64Å; M715-K738 HydrophobicContact CE-CG 4.17Å; M715-K738 HydrophobicContact CG-CB 4.06Å; M715-K738 HydrophobicContact SD-CB 3.88Å
716	F	79.8	Confident	77	Confident	1 Å²	1	57.5 Å²	57.5	0%	0.004	29%	0.287	C	S	.	.	S	Bend	trans	80.3	12.2	174.8	-39.4	-65.3	0	0	0	117.7	L685 Y689 G718 T722 L726 L739 F773	L685-F716 HydrophobicContact CB-CD1 4.27Å; L685-F716 HydrophobicContact CB-CE1 4.26Å; L685-F716 HydrophobicContact CD1-CE1 4.11Å; L685-F716 HydrophobicContact CD1-CZ 4.17Å; Y689-F716 HydrophobicContact CD2-CB 4.23Å; Y689-F716 AromaticContact CD2-CD2 3.43Å; Y689-F716 HydrophobicContact CD2-CD2 3.43Å; Y689-F716 VanDerWaalsContact CD2-CD2 3.43Å; Y689-F716 HydrophobicContact CD2-CE2 4.05Å; Y689-F716 AromaticContact CD2-CG 4Å; Y689-F716 HydrophobicContact CD2-CG 4Å; Y689-F716 AromaticContact CE2-CD2 3.79Å; Y689-F716 HydrophobicContact CE2-CD2 3.79Å; Y689-F716 AromaticContact CE2-CE2 3.95Å; Y689-F716 HydrophobicContact CE2-CE2 3.95Å; Y689-F716 HydrophobicContact CG-CB 4.19Å; Y689-F716 AromaticContact CG-CD2 3.91Å; Y689-F716 HydrophobicContact CG-CD2 3.91Å; Y689-F716 HydrophobicContact CG-CG 4.4Å; F716-G718 PolarHBondContact O-N 2.92Å; F716-T722 VanDerWaalsContact CA-CG2 3.46Å; F716-T722 HydrophobicContact CB-CG2 3.62Å; F716-T722 HydrophobicContact CD1-CG2 3.76Å; F716-T722 HydrophobicContact CG-CG2 4.16Å; F716-L726 HydrophobicContact CE1-CG 4.37Å; F716-L739 HydrophobicContact CE2-CD1 3.6Å; F716-L739 HydrophobicContact CZ-CD1 4.04Å; F716-F773 HydrophobicContact CZ-CD2 4.5Å
717	E	76.8	Confident	78.3	Confident	80 Å²	80	58.1 Å²	58.1	37%	0.374	28%	0.284	S	S	.	.	S	Bend	trans	-54.4	-22.8	177.1	-178.2	175	177.1	0	0	114.5	V711	V711-E717 HydrophobicContact CG1-CG 4.21Å
718	G	82	Confident	79.5	Confident	18 Å²	18	57.5 Å²	57.5	19%	0.186	27%	0.271	C	S	.	.	S	Bend	trans	-167	171.1	171	0	0	0	0	0	111.9	F716 R720 H721 T722	F716-G718 PolarHBondContact O-N 2.92Å; G718-R720 PolarHBondContact O-N 3.37Å; G718-R720 VanDerWaalsContact O-N 3.1Å; G718-H721 CarbonylContact O-C 3.59Å; G718-H721 PolarHBondContact O-N 3.38Å; G718-T722 VanDerWaalsContact O-CG2 3.31Å; G718-T722 WeakPolarHBondContact O-CG2 3.37Å; G718-T722 PolarHBondContact O-N 2.98Å
719	L	86.4	Confident	80.7	Confident	96 Å²	96	53.2 Å²	53.2	50%	0.503	25%	0.251	S	S	.	.	H	α-helix	trans	-52.2	-37.6	-175.5	-169.7	72.3	0	0	0	114.1	M682 T722 L723	M682-L719 HydrophobicContact CE-CD1 3.46Å; M682-L719 VanDerWaalsContact CE-CD1 3.46Å; M682-L719 HydrophobicContact CE-CG 4.46Å; M682-L719 HydrophobicContact CG-CD1 4.27Å; M682-L719 HydrophobicContact SD-CD1 3.73Å; M682-L719 HydrophobicContact SD-CG 4.33Å; L719-T722 WeakPolarHBondContact CA-OG1 3.03Å; L719-T722 PolarHBondContact O-OG1 3.05Å; L719-L723 WeakPolarHBondContact O-CB 3.34Å; L719-L723 PolarHBondContact O-N 2.89Å; L719-L723 VanDerWaalsContact O-N 3.11Å
720	R	87.1	Confident	81.7	Confident	199 Å²	199	51.5 Å²	51.5	75%	0.751	24%	0.237	S	C	*	.	H	α-helix	trans	-70.1	-40.8	177.5	175.9	175.4	50.9	-167.1	-9.5	112.1	G718 Y724	G718-R720 PolarHBondContact O-N 3.37Å; G718-R720 VanDerWaalsContact O-N 3.1Å; R720-Y724 WeakPolarHBondContact O-CB 3.34Å; R720-Y724 PolarHBondContact O-N 3.49Å
721	H	85.8	Confident	82.6	Confident	80 Å²	80	55 Å²	55	37%	0.37	25%	0.251	S	S	.	.	H	α-helix	trans	-72.1	-36.6	178	-69.2	-83	0	0	0	111	G718 Y724 S725	G718-H721 CarbonylContact O-C 3.59Å; G718-H721 PolarHBondContact O-N 3.38Å; H721-Y724 PolarHBondContact O-N 2.91Å; H721-S725 WeakPolarHBondContact O-CB 3.43Å; H721-S725 PolarHBondContact O-N 2.92Å; H721-S725 PolarHBondContact O-OG 3.46Å; H721-S725 VanDerWaalsContact O-OG 3.1Å
722	T	89.3	Confident	83.3	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-61.4	-45.7	174.2	63.2	0	0	0	0	111	M682 H686 F716 G718 L719 S725 L726	M682-T722 WeakPolarHBondContact CG-OG1 3.47Å; H686-T722 HydrophobicContact CB-CG2 3.8Å; F716-T722 VanDerWaalsContact CA-CG2 3.46Å; F716-T722 HydrophobicContact CB-CG2 3.62Å; F716-T722 HydrophobicContact CD1-CG2 3.76Å; F716-T722 HydrophobicContact CG-CG2 4.16Å; G718-T722 VanDerWaalsContact O-CG2 3.31Å; G718-T722 WeakPolarHBondContact O-CG2 3.37Å; G718-T722 PolarHBondContact O-N 2.98Å; L719-T722 WeakPolarHBondContact CA-OG1 3.03Å; L719-T722 PolarHBondContact O-OG1 3.05Å; T722-S725 PolarHBondContact O-N 2.85Å; T722-L726 WeakPolarHBondContact O-CB 3.2Å; T722-L726 WeakPolarHBondContact O-CG 3.3Å; T722-L726 PolarHBondContact O-N 2.89Å
723	L	89.9	Confident	84.1	Confident	69 Å²	69	64.9 Å²	64.9	36%	0.361	31%	0.306	S	S	.	.	H	α-helix	trans	-61.7	-46.6	176.4	-175.5	71.3	0	0	0	111.6	L678 M682 L719 L726 F727	L678-L723 HydrophobicContact CD2-CD1 3.89Å; L678-L723 HydrophobicContact CG-CD1 4.32Å; M682-L723 HydrophobicContact SD-CB 4.29Å; M682-L723 HydrophobicContact SD-CD1 4.06Å; L719-L723 WeakPolarHBondContact O-CB 3.34Å; L719-L723 PolarHBondContact O-N 2.89Å; L719-L723 VanDerWaalsContact O-N 3.11Å; L723-L726 PolarHBondContact O-N 3.21Å; L723-F727 VanDerWaalsContact O-CB 3.26Å; L723-F727 WeakPolarHBondContact O-CB 3.43Å; L723-F727 PolarHBondContact O-N 2.88Å
724	Y	89	Confident	84.4	Confident	145 Å²	145	65.8 Å²	65.8	57%	0.569	31%	0.311	S	S	*	.	H	α-helix	trans	-60	-50.2	178.1	-179.3	-89	0	0	0	111.5	R720 H721 L726 F727 W728	R720-Y724 WeakPolarHBondContact O-CB 3.34Å; R720-Y724 PolarHBondContact O-N 3.49Å; H721-Y724 PolarHBondContact O-N 2.91Å; Y724-L726 PolarHBondContact O-N 3.34Å; Y724-F727 PolarHBondContact O-N 3.18Å; Y724-W728 AromaticContact CD1-CD1 3.71Å; Y724-W728 AromaticContact CD2-CD1 3.6Å; Y724-W728 AromaticContact CD2-NE1 3.48Å; Y724-W728 AromaticContact CE1-CD1 3.45Å; Y724-W728 VanDerWaalsContact CE1-CD1 3.45Å; Y724-W728 HydrophobicContact CE1-CG 4.39Å; Y724-W728 AromaticContact CE1-NE1 3.95Å; Y724-W728 AromaticContact CE2-CD1 3.37Å; Y724-W728 AromaticContact CE2-NE1 3Å; Y724-W728 AromaticContact CG-CD1 3.76Å; Y724-W728 AromaticContact CZ-CD1 3.27Å; Y724-W728 AromaticContact CZ-NE1 3.25Å; Y724-W728 VanDerWaalsContact CZ-NE1 3.25Å; Y724-W728 PolarHBondContact O-N 3.07Å
725	S	87.8	Confident	84.8	Confident	11 Å²	11	65.2 Å²	65.2	8%	0.077	32%	0.316	C	S	.	.	H	α-helix	trans	-61.5	-44.6	179.1	-64.9	0	0	0	0	111.5	H721 T722 S729 V734	H721-S725 WeakPolarHBondContact O-CB 3.43Å; H721-S725 PolarHBondContact O-N 2.92Å; H721-S725 PolarHBondContact O-OG 3.46Å; H721-S725 VanDerWaalsContact O-OG 3.1Å; T722-S725 PolarHBondContact O-N 2.85Å; S725-S729 VanDerWaalsContact O-CB 3.24Å; S725-S729 WeakPolarHBondContact O-CB 3.14Å; S725-S729 PolarHBondContact O-N 3.44Å; S725-S729 PolarHBondContact O-OG 3.18Å; S725-V734 WeakPolarHBondContact O-CG2 3.39Å
726	L	90.2	Very high	85	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-65.6	-44.1	178.3	-73.4	171	0	0	0	112.1	L678 M682 L685 F716 T722 L723 Y724 W728 S729 Y776	L678-L726 HydrophobicContact CD1-CB 3.7Å; M682-L726 HydrophobicContact CB-CD1 3.72Å; M682-L726 HydrophobicContact CG-CD1 4.39Å; L685-L726 HydrophobicContact CD1-CD1 4.33Å; L685-L726 HydrophobicContact CD1-CD2 3.68Å; L685-L726 HydrophobicContact CD1-CG 4.43Å; F716-L726 HydrophobicContact CE1-CG 4.37Å; T722-L726 WeakPolarHBondContact O-CB 3.2Å; T722-L726 WeakPolarHBondContact O-CG 3.3Å; T722-L726 PolarHBondContact O-N 2.89Å; L723-L726 PolarHBondContact O-N 3.21Å; Y724-L726 PolarHBondContact O-N 3.34Å; L726-W728 PolarHBondContact O-N 3.36Å; L726-S729 WeakPolarHBondContact CA-OG 3.39Å; L726-S729 PolarHBondContact O-N 3.06Å; L726-S729 PolarHBondContact O-OG 3.39Å; L726-Y776 HydrophobicContact CD2-CD1 3.99Å; L726-Y776 HydrophobicContact CD2-CD2 4.26Å; L726-Y776 HydrophobicContact CD2-CE1 3.75Å; L726-Y776 HydrophobicContact CD2-CE2 3.96Å; L726-Y776 HydrophobicContact CD2-CG 4.24Å; L726-Y776 PolarHBondContact O-OH 3.35Å
727	F	89.8	Confident	84.6	Confident	80 Å²	80	72.9 Å²	72.9	35%	0.351	36%	0.362	S	S	.	.	H	α-helix	trans	-57.7	-50.3	176.9	177.8	-99.3	0	0	0	112.3	L723 Y724 S729 M730 F731	L723-F727 VanDerWaalsContact O-CB 3.26Å; L723-F727 WeakPolarHBondContact O-CB 3.43Å; L723-F727 PolarHBondContact O-N 2.88Å; Y724-F727 PolarHBondContact O-N 3.18Å; F727-S729 VanDerWaalsContact C-N 3.28Å; F727-S729 PolarHBondContact O-N 3.34Å; F727-M730 WeakPolarHBondContact O-CB 3.36Å; F727-M730 PolarHBondContact O-N 3.33Å; F727-F731 HydrophobicContact CE1-CE2 4.3Å; F727-F731 HydrophobicContact CZ-CE2 4.1Å
728	W	89.2	Confident	84.4	Confident	82 Å²	82	72.7 Å²	72.7	31%	0.311	36%	0.36	S	S	.	.	H	α-helix	trans	-74	-18.2	-179.7	-71.4	111.3	0	0	0	114	Y724 L726 M730 F731 Q733 V734	Y724-W728 AromaticContact CD1-CD1 3.71Å; Y724-W728 AromaticContact CD2-CD1 3.6Å; Y724-W728 AromaticContact CD2-NE1 3.48Å; Y724-W728 AromaticContact CE1-CD1 3.45Å; Y724-W728 VanDerWaalsContact CE1-CD1 3.45Å; Y724-W728 HydrophobicContact CE1-CG 4.39Å; Y724-W728 AromaticContact CE1-NE1 3.95Å; Y724-W728 AromaticContact CE2-CD1 3.37Å; Y724-W728 AromaticContact CE2-NE1 3Å; Y724-W728 AromaticContact CG-CD1 3.76Å; Y724-W728 AromaticContact CZ-CD1 3.27Å; Y724-W728 AromaticContact CZ-NE1 3.25Å; Y724-W728 VanDerWaalsContact CZ-NE1 3.25Å; Y724-W728 PolarHBondContact O-N 3.07Å; L726-W728 PolarHBondContact O-N 3.36Å; W728-M730 VanDerWaalsContact C-N 3.27Å; W728-M730 PolarHBondContact O-N 3.32Å; W728-F731 HydrophobicContact CE3-CD2 4.02Å; W728-F731 HydrophobicContact CZ3-CD2 4.26Å; W728-F731 PolarHBondContact O-N 3.2Å; W728-Q733 PolarHBondContact O-N 3.23Å; W728-V734 HydrophobicContact CB-CG2 4.03Å
729	S	87.2	Confident	84.1	Confident	0 Å²	0	72 Å²	72	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-68.3	-27.3	174.3	73.1	0	0	0	0	112.6	S725 L726 F727 F731 S732 Y776 H777	S725-S729 VanDerWaalsContact O-CB 3.24Å; S725-S729 WeakPolarHBondContact O-CB 3.14Å; S725-S729 PolarHBondContact O-N 3.44Å; S725-S729 PolarHBondContact O-OG 3.18Å; L726-S729 WeakPolarHBondContact CA-OG 3.39Å; L726-S729 PolarHBondContact O-N 3.06Å; L726-S729 PolarHBondContact O-OG 3.39Å; F727-S729 VanDerWaalsContact C-N 3.28Å; F727-S729 PolarHBondContact O-N 3.34Å; S729-F731 PolarHBondContact O-N 2.89Å; S729-S732 PolarHBondContact O-N 3.19Å; S729-Y776 WeakPolarHBondContact OG-CE1 3.44Å; S729-H777 PolarHBondContact O-NE2 2.77Å
730	M	86.2	Confident	83.6	Confident	62 Å²	62	68.9 Å²	68.9	31%	0.305	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-33.1	170.6	178.2	178	173	0	0	112.6	Y674 F727 W728 S732 I780	Y674-M730 HydrophobicContact CD2-SD 4.49Å; Y674-M730 HydrophobicContact CE2-SD 3.66Å; F727-M730 WeakPolarHBondContact O-CB 3.36Å; F727-M730 PolarHBondContact O-N 3.33Å; W728-M730 VanDerWaalsContact C-N 3.27Å; W728-M730 PolarHBondContact O-N 3.32Å; M730-S732 VanDerWaalsContact C-N 3.35Å; M730-I780 HydrophobicContact CB-CG2 4.3Å; M730-I780 HydrophobicContact CG-CG2 3.82Å; M730-I780 HydrophobicContact SD-CG2 4.3Å
731	F	86.6	Confident	83.1	Confident	112 Å²	112	59.7 Å²	59.7	49%	0.491	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	11.8	178.2	-61.1	-72.7	0	0	0	113.2	F727 W728 S729 Q733	F727-F731 HydrophobicContact CE1-CE2 4.3Å; F727-F731 HydrophobicContact CZ-CE2 4.1Å; W728-F731 HydrophobicContact CE3-CD2 4.02Å; W728-F731 HydrophobicContact CZ3-CD2 4.26Å; W728-F731 PolarHBondContact O-N 3.2Å; S729-F731 PolarHBondContact O-N 2.89Å; F731-Q733 HydrophobicContact CB-CG 4.27Å; F731-Q733 PolarHBondContact O-N 3.2Å; F731-Q733 VanDerWaalsContact O-N 3.13Å
732	S	83.6	Confident	82.3	Confident	99 Å²	99	59 Å²	59	69%	0.692	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	25	-177.9	-169.9	0	0	0	0	114.2	S729 M730 V734	S729-S732 PolarHBondContact O-N 3.19Å; M730-S732 VanDerWaalsContact C-N 3.35Å; S732-V734 VanDerWaalsContact C-N 3.29Å
733	Q	83.9	Confident	81.3	Confident	134 Å²	134	61.3 Å²	61.3	63%	0.626	31%	0.307	S	S	*	.			trans	-86.4	0.1	177.9	-67.5	-165.2	-8.9	0	0	113.4	W728 F731	W728-Q733 PolarHBondContact O-N 3.23Å; F731-Q733 HydrophobicContact CB-CG 4.27Å; F731-Q733 PolarHBondContact O-N 3.2Å; F731-Q733 VanDerWaalsContact O-N 3.13Å
734	V	79.9	Confident	80	Confident	22 Å²	22	62.6 Å²	62.6	13%	0.133	32%	0.32	C	S	.	.	S	Bend	trans	-99.7	117.4	-176	175	0	0	0	0	109.5	M715 S725 W728 S732 I736 F773	M715-V734 HydrophobicContact CE-CB 4.4Å; M715-V734 HydrophobicContact CE-CG1 3.35Å; M715-V734 HydrophobicContact SD-CG1 3.45Å; M715-V734 WeakPolarHBondContact SD-CG1 3.25Å; S725-V734 WeakPolarHBondContact O-CG2 3.39Å; W728-V734 HydrophobicContact CB-CG2 4.03Å; S732-V734 VanDerWaalsContact C-N 3.29Å; V734-I736 PolarHBondContact O-N 3.24Å; V734-F773 HydrophobicContact CG1-CZ 4.06Å
735	S	77.5	Confident	78.4	Confident	63 Å²	63	62.9 Å²	62.9	44%	0.441	33%	0.331	S	S	.	.			trans	-73.2	122.6	-179.9	-48.5	0	0	0	0	111.5	S737 K738	S735-S737 PolarHBondContact O-N 2.9Å; S735-S737 VanDerWaalsContact O-N 3.17Å; S735-K738 PolarHBondContact O-N 3.31Å; S735-K738 VanDerWaalsContact O-N 3.11Å
736	I	77.8	Confident	76.8	Confident	101 Å²	101	66.1 Å²	66.1	52%	0.518	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-59.1	-27.3	177.2	-58.8	164.6	0	0	0	111.6	V734 K738 L739 M770	V734-I736 PolarHBondContact O-N 3.24Å; I736-K738 PolarHBondContact O-N 3.45Å; I736-K738 VanDerWaalsContact O-N 3.09Å; I736-L739 WeakPolarHBondContact O-CB 3.33Å; I736-L739 PolarHBondContact O-N 3.47Å; I736-L739 VanDerWaalsContact O-N 3.14Å; I736-M770 HydrophobicContact CG2-CE 3.92Å; I736-M770 HydrophobicContact CG2-SD 4.34Å
737	S	70.6	Confident	74.8	Confident	77 Å²	77	70.6 Å²	70.6	54%	0.538	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-62.7	-13.5	177.1	54.8	0	0	0	0	114.8	S735	S735-S737 PolarHBondContact O-N 2.9Å; S735-S737 VanDerWaalsContact O-N 3.17Å
738	K	73.1	Confident	72.8	Confident	77 Å²	77	74.1 Å²	74.1	34%	0.335	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-99	-3.6	178.5	-64.6	-176.3	172.5	-151.1	0	113.9	E714 M715 S735 I736	E714-K738 WeakPolarHBondContact OE2-CE 3.47Å; E714-K738 IonicContact OE2-NZ 2.72Å; E714-K738 PolarHBondContact OE2-NZ 3.34Å; M715-K738 HydrophobicContact CE-CB 3.55Å; M715-K738 HydrophobicContact CE-CD 3.64Å; M715-K738 HydrophobicContact CE-CG 4.17Å; M715-K738 HydrophobicContact CG-CB 4.06Å; M715-K738 HydrophobicContact SD-CB 3.88Å; S735-K738 PolarHBondContact O-N 3.31Å; S735-K738 VanDerWaalsContact O-N 3.11Å; I736-K738 PolarHBondContact O-N 3.45Å; I736-K738 VanDerWaalsContact O-N 3.09Å
739	L	75.6	Confident	70.8	Confident	3 Å²	3	75 Å²	75	2%	0.016	41%	0.407	C	S	.	.	S	Bend	trans	-72.4	-41.8	175.9	-149.2	87.7	0	0	0	114.6	F716 I736 M770 F773	F716-L739 HydrophobicContact CE2-CD1 3.6Å; F716-L739 HydrophobicContact CZ-CD1 4.04Å; I736-L739 WeakPolarHBondContact O-CB 3.33Å; I736-L739 PolarHBondContact O-N 3.47Å; I736-L739 VanDerWaalsContact O-N 3.14Å; L739-M770 HydrophobicContact CB-SD 4.04Å; L739-M770 HydrophobicContact CD2-CB 4.22Å; L739-M770 HydrophobicContact CD2-CG 3.69Å; L739-M770 HydrophobicContact CD2-SD 3.19Å; L739-M770 WeakPolarHBondContact CD2-SD 3.43Å; L739-M770 HydrophobicContact CG-SD 4.2Å; L739-F773 HydrophobicContact CD1-CD1 4.44Å; L739-F773 HydrophobicContact CD1-CD2 4.33Å; L739-F773 HydrophobicContact CD1-CG 4.2Å; L739-F773 HydrophobicContact CD2-CB 4.29Å
740	P	76	Confident	68.5	Low	30 Å²	30	82.3 Å²	82.3	20%	0.195	44%	0.439	C	S	.	.	S	Bend	trans	-67.6	140	-177.8	25.5	-32.3	0	0	0	111.1	R742	P740-R742 PolarHBondContact O-N 2.94Å
741	I	76.7	Confident	66.4	Low	6 Å²	6	87.9 Å²	87.9	3%	0.031	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-63.3	120.1	177.5	-63.8	157.8	0	0	0	109.1	Y689 Y692 A712 T713 T762 V765 D766	Y689-I741 HydrophobicContact CD1-CG1 4.44Å; Y689-I741 HydrophobicContact CE1-CD1 4.35Å; Y689-I741 HydrophobicContact CE1-CG1 4.12Å; Y692-I741 HydrophobicContact CD1-CD1 3.95Å; Y692-I741 HydrophobicContact CD1-CG1 4.47Å; Y692-I741 HydrophobicContact CD1-CG2 4.04Å; Y692-I741 HydrophobicContact CD2-CD1 3.79Å; Y692-I741 HydrophobicContact CE1-CD1 4.07Å; Y692-I741 HydrophobicContact CE2-CD1 3.94Å; Y692-I741 HydrophobicContact CG-CD1 3.79Å; Y692-I741 HydrophobicContact CG-CG1 4.22Å; Y692-I741 HydrophobicContact CG-CG2 4.45Å; A712-I741 HydrophobicContact CB-CG2 4.34Å; T713-I741 HydrophobicContact CG2-CB 4.26Å; T713-I741 HydrophobicContact CG2-CG1 3.67Å; T713-I741 HydrophobicContact CG2-CG2 4.46Å; I741-T762 HydrophobicContact CD1-CG2 4.22Å; I741-T762 HydrophobicContact CG2-CG2 4.43Å; I741-V765 HydrophobicContact CD1-CB 4.11Å; I741-V765 HydrophobicContact CD1-CG1 3.86Å; I741-D766 WeakPolarHBondContact CD1-OD1 3.2Å; I741-D766 VanDerWaalsContact CG1-OD1 3.29Å; I741-D766 WeakPolarHBondContact CG1-OD1 3.48Å; I741-D766 PolarHBondContact N-OD1 2.87Å
742	R	68.7	Low	64.1	Low	66 Å²	66	87.8 Å²	87.8	25%	0.249	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-72.6	133.9	176	-59.3	-176.9	176.4	140.1	-5.6	109.9	F697 A712 E714 P740	F697-R742 HydrophobicContact CE1-CB 4.07Å; F697-R742 WeakPolarHBondContact CE1-O 3.46Å; F697-R742 HydrophobicContact CZ-CB 3.62Å; A712-R742 PolarHBondContact O-N 3.5Å; E714-R742 IonicContact OE1-CZ 3.21Å; E714-R742 IonicContact OE1-NH1 2.69Å; E714-R742 PolarHBondContact OE1-NH1 3.24Å; E714-R742 IonicContact OE1-NH2 2.81Å; E714-R742 PolarHBondContact OE1-NH2 2.87Å; E714-R742 IonicContact OE2-NH2 3.96Å; P740-R742 PolarHBondContact O-N 2.94Å
743	K	67.8	Low	61.8	Low	49 Å²	49	91.6 Å²	91.6	21%	0.213	48%	0.479	C	S	.	.	P	Polyproline II helix	trans	-103.7	150.9	-179.2	-63.9	168.3	-171	158.1	0	110.4	D745 S760 T762	K743-D745 PolarHBondContact O-N 3.12Å; K743-S760 VanDerWaalsContact CE-CB 3.48Å; K743-S760 WeakPolarHBondContact CE-OG 3.31Å; K743-S760 PolarHBondContact NZ-OG 3.35Å; K743-T762 VanDerWaalsContact CE-OG1 3.27Å; K743-T762 WeakPolarHBondContact CE-OG1 3.27Å
744	P	61.9	Low	59.7	Low	96 Å²	96	89.2 Å²	89.2	62%	0.623	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-23.6	177.5	25.4	-33.3	0	0	0	113.5	F697	F697-P744 HydrophobicContact CD2-CB 4.49Å
745	D	56.8	Low	57.6	Low	151 Å²	151	96 Å²	96	81%	0.807	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-2.3	-168.6	-59.9	-25	0	0	0	115	K743	K743-D745 PolarHBondContact O-N 3.12Å
746	Q	52.9	Low	56.1	Low	79 Å²	79	99.7 Å²	99.7	37%	0.369	54%	0.536	S	S	.	.			trans	-131.1	97.4	-177.2	-72.3	-176.6	-19.5	0	0	111.2	E748 D757	Q746-E748 PolarHBondContact O-N 3.12Å; Q746-D757 PolarHBondContact NE2-OD2 3.45Å; Q746-D757 VanDerWaalsContact NE2-OD2 3.1Å
747	A	48.8	Very low	54.8	Low	94 Å²	94	99.1 Å²	99.1	78%	0.777	53%	0.534	S	S	*	.	S	Bend	trans	-79.7	-3.9	-175.2	0	0	0	0	0	115.5
748	E	47.5	Very low	53.9	Low	153 Å²	153	100.4 Å²	100.4	72%	0.715	54%	0.539	S	S	*	.			trans	-145.2	97.9	176.7	-74.6	-167.7	153	0	0	111.8	Q746 K750	Q746-E748 PolarHBondContact O-N 3.12Å; E748-K750 PolarHBondContact O-N 3.06Å
749	H	47.9	Very low	52.9	Low	100 Å²	100	104 Å²	104	46%	0.463	56%	0.562	S	S	.	*			trans	-75.7	75.9	161.4	-72.8	-55.2	0	0	0	109.7	Y751	H749-Y751 PolarHBondContact O-N 3.4Å
750	K	37.9	Very low	52.1	Low	155 Å²	155	104.7 Å²	104.7	67%	0.674	57%	0.567	S	S	*	*			trans	-76.5	114.4	156.5	-103.1	172.8	-178.2	155.4	0	107.3	E748 T752	E748-K750 PolarHBondContact O-N 3.06Å; K750-T752 PolarHBondContact O-N 2.71Å
751	Y	43.6	Very low	51.7	Low	179 Å²	179	109.1 Å²	109.1	70%	0.702	60%	0.595	S	S	*	*			trans	-63	88	162.9	-80.1	-93.4	0	0	0	108.1	H749	H749-Y751 PolarHBondContact O-N 3.4Å
752	T	37.1	Very low	51.6	Low	110 Å²	110	109.5 Å²	109.5	68%	0.675	60%	0.598	S	S	*	*			trans	-89.5	120.5	158.8	50.1	0	0	0	0	107.1	K750 G754	K750-T752 PolarHBondContact O-N 2.71Å; T752-G754 PolarHBondContact O-N 3.41Å
753	D	36	Very low	52	Low	179 Å²	179	108.4 Å²	108.4	96%	0.957	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-42.2	119.1	174.6	-80.7	-35.2	0	0	0	111.2
754	G	39	Very low	52.8	Low	84 Å²	84	111.9 Å²	111.9	87%	0.866	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	121.9	5	155.9	0	0	0	0	0	120.3	T752	T752-G754 PolarHBondContact O-N 3.41Å
755	M	35.4	Very low	53.9	Low	163 Å²	163	108.4 Å²	108.4	80%	0.803	60%	0.595	S	S	*	*			trans	-141.2	104.1	174.9	-150.8	151.5	109.9	0	0	112.7	D757	M755-D757 PolarHBondContact O-N 2.9Å
756	I	47.9	Very low	55.2	Low	141 Å²	141	102.4 Å²	102.4	72%	0.723	56%	0.563	S	S	*	*			trans	-72.7	107	164.2	-60	168.3	0	0	0	105.2	T758	I756-T758 VanDerWaalsContact C-N 3.3Å; I756-T758 HydrophobicContact CG2-CG2 4.06Å; I756-T758 PolarHBondContact O-N 3.34Å
757	D	49.4	Very low	56.8	Low	90 Å²	90	101.6 Å²	101.6	48%	0.481	57%	0.566	S	S	.	*			trans	-61.8	98	164.2	-98.2	-10.2	0	0	0	107.3	Q746 M755 D759	Q746-D757 PolarHBondContact NE2-OD2 3.45Å; Q746-D757 VanDerWaalsContact NE2-OD2 3.1Å; M755-D757 PolarHBondContact O-N 2.9Å; D757-D759 PolarHBondContact O-N 2.91Å
758	T	52.5	Low	58.8	Low	104 Å²	104	100.2 Å²	100.2	64%	0.638	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-8	-172.6	35.6	0	0	0	0	114.3	I756	I756-T758 VanDerWaalsContact C-N 3.3Å; I756-T758 HydrophobicContact CG2-CG2 4.06Å; I756-T758 PolarHBondContact O-N 3.34Å
759	D	51.2	Low	60.7	Low	153 Å²	153	92.9 Å²	92.9	82%	0.818	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.7	14.1	-159.6	-69.5	6.5	0	0	0	115.1	D757	D757-D759 PolarHBondContact O-N 2.91Å
760	S	59.7	Low	62.6	Low	17 Å²	17	91.7 Å²	91.7	12%	0.119	51%	0.509	C	S	.	.			trans	-94.7	136.6	175.1	70.2	0	0	0	0	113.3	K743 T762 T763	K743-S760 VanDerWaalsContact CE-CB 3.48Å; K743-S760 WeakPolarHBondContact CE-OG 3.31Å; K743-S760 PolarHBondContact NZ-OG 3.35Å; S760-T762 PolarHBondContact O-N 3.35Å; S760-T763 WeakPolarHBondContact O-CG2 3.44Å; S760-T763 PolarHBondContact O-N 3.32Å; S760-T763 VanDerWaalsContact O-N 3.13Å; S760-T763 PolarHBondContact O-OG1 3.47Å; S760-T763 WeakPolarHBondContact OG-CG2 3.39Å
761	P	66.1	Low	65.1	Low	122 Å²	122	88.7 Å²	88.7	79%	0.792	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-14.3	-179.8	25.9	-34.6	0	0	0	113.8
762	T	75.6	Confident	67.4	Low	14 Å²	14	83 Å²	83	9%	0.086	49%	0.485	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-9.9	179.8	62.9	0	0	0	0	114	Y692 I741 K743 S760 I764 V765 D766	Y692-T762 HydrophobicContact CE1-CG2 3.94Å; I741-T762 HydrophobicContact CD1-CG2 4.22Å; I741-T762 HydrophobicContact CG2-CG2 4.43Å; K743-T762 VanDerWaalsContact CE-OG1 3.27Å; K743-T762 WeakPolarHBondContact CE-OG1 3.27Å; S760-T762 PolarHBondContact O-N 3.35Å; T762-I764 PolarHBondContact O-N 2.93Å; T762-V765 PolarHBondContact O-N 3.11Å; T762-D766 PolarHBondContact O-N 3Å; T762-D766 PolarHBondContact OG1-OD2 2.87Å
763	T	76.8	Confident	70	Confident	44 Å²	44	78.4 Å²	78.4	27%	0.27	46%	0.456	S	S	.	.	H	α-helix	trans	-58.1	-35	-177.2	52	0	0	0	0	113	S760 S767	S760-T763 WeakPolarHBondContact O-CG2 3.44Å; S760-T763 PolarHBondContact O-N 3.32Å; S760-T763 VanDerWaalsContact O-N 3.13Å; S760-T763 PolarHBondContact O-OG1 3.47Å; S760-T763 WeakPolarHBondContact OG-CG2 3.39Å; T763-S767 VanDerWaalsContact O-CB 3.26Å; T763-S767 WeakPolarHBondContact O-CB 3.42Å; T763-S767 PolarHBondContact O-N 3.48Å; T763-S767 PolarHBondContact O-OG 3.4Å
764	I	84.1	Confident	72.5	Confident	121 Å²	121	72.7 Å²	72.7	62%	0.621	43%	0.434	S	S	*	.	H	α-helix	trans	-66.5	-43.6	177.1	-60.6	175.2	0	0	0	110.3	T762 S767 V768	T762-I764 PolarHBondContact O-N 2.93Å; I764-S767 WeakPolarHBondContact CA-OG 3.28Å; I764-S767 PolarHBondContact O-N 2.85Å; I764-S767 PolarHBondContact O-OG 3.41Å; I764-V768 WeakPolarHBondContact O-CB 3.39Å; I764-V768 VanDerWaalsContact O-CG2 3.25Å; I764-V768 WeakPolarHBondContact O-CG2 3.39Å; I764-V768 PolarHBondContact O-N 3.29Å
765	V	86.1	Confident	75.1	Confident	24 Å²	24	72 Å²	72	15%	0.145	41%	0.413	C	S	.	.	H	α-helix	trans	-67.4	-45.4	179	-178.9	0	0	0	0	110.5	L688 Y689 Y692 I741 T762 S767 V768 G769	L688-V765 HydrophobicContact CD1-CG1 3.91Å; L688-V765 HydrophobicContact CD2-CG1 4.48Å; L688-V765 HydrophobicContact CG-CG1 3.9Å; Y689-V765 HydrophobicContact CE1-CG1 4.37Å; Y692-V765 HydrophobicContact CD2-CG1 4.23Å; Y692-V765 HydrophobicContact CE2-CB 4.26Å; Y692-V765 HydrophobicContact CE2-CG1 3.75Å; Y692-V765 HydrophobicContact CE2-CG2 4.01Å; I741-V765 HydrophobicContact CD1-CB 4.11Å; I741-V765 HydrophobicContact CD1-CG1 3.86Å; T762-V765 PolarHBondContact O-N 3.11Å; V765-S767 PolarHBondContact O-N 2.87Å; V765-V768 PolarHBondContact O-N 2.92Å; V765-G769 PolarHBondContact O-N 2.86Å
766	D	84.1	Confident	77.8	Confident	24 Å²	24	64.3 Å²	64.3	13%	0.128	38%	0.375	C	S	.	.	H	α-helix	trans	-60.7	-44.4	177.2	-70.5	-40.1	0	0	0	111.4	I741 T762 G769 M770	I741-D766 WeakPolarHBondContact CD1-OD1 3.2Å; I741-D766 VanDerWaalsContact CG1-OD1 3.29Å; I741-D766 WeakPolarHBondContact CG1-OD1 3.48Å; I741-D766 PolarHBondContact N-OD1 2.87Å; T762-D766 PolarHBondContact O-N 3Å; T762-D766 PolarHBondContact OG1-OD2 2.87Å; D766-G769 PolarHBondContact O-N 3.43Å; D766-M770 WeakPolarHBondContact O-CB 3.31Å; D766-M770 WeakPolarHBondContact O-CG 3.46Å; D766-M770 PolarHBondContact O-N 3.39Å
767	S	85.2	Confident	79.8	Confident	63 Å²	63	59.7 Å²	59.7	44%	0.441	35%	0.35	S	S	.	.	H	α-helix	trans	-65.3	-45.7	178.4	60.3	0	0	0	0	112.6	T763 I764 V765 G769 M770 V771	T763-S767 VanDerWaalsContact O-CB 3.26Å; T763-S767 WeakPolarHBondContact O-CB 3.42Å; T763-S767 PolarHBondContact O-N 3.48Å; T763-S767 PolarHBondContact O-OG 3.4Å; I764-S767 WeakPolarHBondContact CA-OG 3.28Å; I764-S767 PolarHBondContact O-N 2.85Å; I764-S767 PolarHBondContact O-OG 3.41Å; V765-S767 PolarHBondContact O-N 2.87Å; S767-G769 VanDerWaalsContact C-N 3.32Å; S767-G769 PolarHBondContact O-N 3.36Å; S767-M770 PolarHBondContact O-N 3.06Å; S767-V771 VanDerWaalsContact O-CG2 3.28Å; S767-V771 WeakPolarHBondContact O-CG2 3.49Å; S767-V771 PolarHBondContact O-N 3.39Å
768	V	90.6	Very high	81.8	Confident	64 Å²	64	56.5 Å²	56.5	39%	0.388	34%	0.338	S	S	.	.	H	α-helix	trans	-62.7	-41.2	176	173.2	0	0	0	0	110.8	L688 I764 V765 V771 L772	L688-V768 HydrophobicContact CD1-CG1 4.29Å; L688-V768 HydrophobicContact CD2-CB 4.42Å; L688-V768 HydrophobicContact CD2-CG1 4.07Å; I764-V768 WeakPolarHBondContact O-CB 3.39Å; I764-V768 VanDerWaalsContact O-CG2 3.25Å; I764-V768 WeakPolarHBondContact O-CG2 3.39Å; I764-V768 PolarHBondContact O-N 3.29Å; V765-V768 PolarHBondContact O-N 2.92Å; V768-V771 PolarHBondContact O-N 3.46Å; V768-L772 HydrophobicContact CG1-CD1 3.99Å; V768-L772 HydrophobicContact CG1-CG 4.35Å; V768-L772 WeakPolarHBondContact O-CB 3.38Å; V768-L772 WeakPolarHBondContact O-CG 3.44Å; V768-L772 PolarHBondContact O-N 3.22Å
769	G	88.9	Confident	83.7	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-65.3	-44	177.7	0	0	0	0	0	113.1	L688 Y689 V765 D766 S767 V771 L772 F773	L688-G769 VanDerWaalsContact CD2-CA 3.47Å; Y689-G769 WeakPolarHBondContact OH-CA 3.36Å; V765-G769 PolarHBondContact O-N 2.86Å; D766-G769 PolarHBondContact O-N 3.43Å; S767-G769 VanDerWaalsContact C-N 3.32Å; S767-G769 PolarHBondContact O-N 3.36Å; G769-V771 VanDerWaalsContact C-N 3.34Å; G769-V771 PolarHBondContact O-N 2.79Å; G769-L772 PolarHBondContact O-N 2.98Å; G769-F773 VanDerWaalsContact O-CB 3.24Å; G769-F773 WeakPolarHBondContact O-CB 3.44Å; G769-F773 PolarHBondContact O-N 3Å
770	M	87.6	Confident	85.5	Confident	75 Å²	75	47 Å²	47	37%	0.369	28%	0.283	S	S	.	.	H	α-helix	trans	-59.7	-43.2	173.4	-72	-71.2	-68.2	0	0	111.6	I736 L739 D766 S767 A774	I736-M770 HydrophobicContact CG2-CE 3.92Å; I736-M770 HydrophobicContact CG2-SD 4.34Å; L739-M770 HydrophobicContact CB-SD 4.04Å; L739-M770 HydrophobicContact CD2-CB 4.22Å; L739-M770 HydrophobicContact CD2-CG 3.69Å; L739-M770 HydrophobicContact CD2-SD 3.19Å; L739-M770 WeakPolarHBondContact CD2-SD 3.43Å; L739-M770 HydrophobicContact CG-SD 4.2Å; D766-M770 WeakPolarHBondContact O-CB 3.31Å; D766-M770 WeakPolarHBondContact O-CG 3.46Å; D766-M770 PolarHBondContact O-N 3.39Å; S767-M770 PolarHBondContact O-N 3.06Å; M770-A774 VanDerWaalsContact O-CB 3.28Å; M770-A774 WeakPolarHBondContact O-CB 3.32Å; M770-A774 PolarHBondContact O-N 3.36Å
771	V	91.2	Very high	86.9	Confident	92 Å²	92	49.7 Å²	49.7	56%	0.558	30%	0.295	S	S	*	.	H	α-helix	trans	-66.1	-48.4	178.1	170.9	0	0	0	0	111.2	S767 V768 G769 F773 A774 V775	S767-V771 VanDerWaalsContact O-CG2 3.28Å; S767-V771 WeakPolarHBondContact O-CG2 3.49Å; S767-V771 PolarHBondContact O-N 3.39Å; V768-V771 PolarHBondContact O-N 3.46Å; G769-V771 VanDerWaalsContact C-N 3.34Å; G769-V771 PolarHBondContact O-N 2.79Å; V771-F773 VanDerWaalsContact C-N 3.3Å; V771-F773 PolarHBondContact O-N 3.33Å; V771-A774 PolarHBondContact O-N 2.91Å; V771-V775 HydrophobicContact CG1-CG2 4.42Å; V771-V775 VanDerWaalsContact O-CG2 3.32Å; V771-V775 WeakPolarHBondContact O-CG2 3.46Å; V771-V775 PolarHBondContact O-N 3.39Å
772	L	91.7	Very high	88	Confident	58 Å²	58	49 Å²	49	30%	0.304	28%	0.284	S	S	.	.	H	α-helix	trans	-60	-41.9	177.9	-75.4	174.5	0	0	0	111.8	F681 L685 L688 V768 G769 V775 Y776	F681-L772 HydrophobicContact CE1-CD2 4.46Å; F681-L772 WeakPolarHBondContact CE1-O 3.5Å; L685-L772 HydrophobicContact CD2-CB 3.98Å; L685-L772 HydrophobicContact CD2-CD1 4.36Å; L688-L772 HydrophobicContact CD2-CD1 4.24Å; V768-L772 HydrophobicContact CG1-CD1 3.99Å; V768-L772 HydrophobicContact CG1-CG 4.35Å; V768-L772 WeakPolarHBondContact O-CB 3.38Å; V768-L772 WeakPolarHBondContact O-CG 3.44Å; V768-L772 PolarHBondContact O-N 3.22Å; G769-L772 PolarHBondContact O-N 2.98Å; L772-V775 PolarHBondContact O-N 3.01Å; L772-Y776 WeakPolarHBondContact O-CB 3.27Å; L772-Y776 PolarHBondContact O-N 2.83Å
773	F	90	Very high	88.7	Confident	14 Å²	14	51.5 Å²	51.5	6%	0.061	30%	0.299	C	S	.	.	H	α-helix	trans	-67.3	-38.3	177.3	-171.1	-105.4	0	0	0	112.3	F716 V734 L739 G769 V771 Y776 H777	F716-F773 HydrophobicContact CZ-CD2 4.5Å; V734-F773 HydrophobicContact CG1-CZ 4.06Å; L739-F773 HydrophobicContact CD1-CD1 4.44Å; L739-F773 HydrophobicContact CD1-CD2 4.33Å; L739-F773 HydrophobicContact CD1-CG 4.2Å; L739-F773 HydrophobicContact CD2-CB 4.29Å; G769-F773 VanDerWaalsContact O-CB 3.24Å; G769-F773 WeakPolarHBondContact O-CB 3.44Å; G769-F773 PolarHBondContact O-N 3Å; V771-F773 VanDerWaalsContact C-N 3.3Å; V771-F773 PolarHBondContact O-N 3.33Å; F773-Y776 WeakPolarHBondContact O-CB 3.35Å; F773-Y776 PolarHBondContact O-N 2.99Å; F773-H777 AromaticContact CD1-CE1 3.81Å; F773-H777 AromaticContact CD1-ND1 3.81Å; F773-H777 AromaticContact CD2-CE1 3.97Å; F773-H777 AromaticContact CE1-CE1 3.24Å; F773-H777 WeakPolarHBondContact CE1-CE1 3.35Å; F773-H777 AromaticContact CE1-ND1 3.7Å; F773-H777 AromaticContact CE1-NE2 3.87Å; F773-H777 AromaticContact CE2-CE1 3.44Å; F773-H777 VanDerWaalsContact CE2-CE1 3.44Å; F773-H777 WeakPolarHBondContact CE2-CE1 3.38Å; F773-H777 AromaticContact CZ-CE1 3.05Å; F773-H777 WeakPolarHBondContact CZ-CE1 3.5Å; F773-H777 AromaticContact CZ-ND1 3.88Å; F773-H777 AromaticContact CZ-NE2 3.77Å; F773-H777 PolarHBondContact O-N 3.35Å; F773-H777 PolarHBondContact O-ND1 3.3Å
774	A	89.7	Confident	89.3	Confident	60 Å²	60	50.2 Å²	50.2	50%	0.496	29%	0.29	S	S	.	.	H	α-helix	trans	-65.9	-42.7	174.6	0	0	0	0	0	112.2	M770 V771 Y776 H777 G778	M770-A774 VanDerWaalsContact O-CB 3.28Å; M770-A774 WeakPolarHBondContact O-CB 3.32Å; M770-A774 PolarHBondContact O-N 3.36Å; V771-A774 PolarHBondContact O-N 2.91Å; A774-Y776 VanDerWaalsContact C-N 3.34Å; A774-Y776 PolarHBondContact O-N 2.95Å; A774-H777 PolarHBondContact O-N 2.86Å; A774-G778 PolarHBondContact O-N 3.41Å
775	V	92.9	Very high	89.6	Confident	70 Å²	70	46.8 Å²	46.8	42%	0.424	28%	0.275	S	S	.	.	H	α-helix	trans	-62.7	-42.3	174.9	173.8	0	0	0	0	110.6	F681 V771 L772 H777 G778 I779	F681-V775 HydrophobicContact CE1-CG1 4.36Å; F681-V775 HydrophobicContact CZ-CG1 3.97Å; V771-V775 HydrophobicContact CG1-CG2 4.42Å; V771-V775 VanDerWaalsContact O-CG2 3.32Å; V771-V775 WeakPolarHBondContact O-CG2 3.46Å; V771-V775 PolarHBondContact O-N 3.39Å; L772-V775 PolarHBondContact O-N 3.01Å; V775-H777 PolarHBondContact O-N 2.95Å; V775-G778 PolarHBondContact O-N 2.91Å; V775-I779 HydrophobicContact CG1-CD1 3.77Å; V775-I779 HydrophobicContact CG1-CG1 4.38Å; V775-I779 WeakPolarHBondContact O-CG1 3.5Å; V775-I779 PolarHBondContact O-N 2.9Å
776	Y	92.8	Very high	89.8	Confident	1 Å²	1	50.2 Å²	50.2	0%	0.004	29%	0.292	C	S	.	.	H	α-helix	trans	-57.1	-46.2	173.8	172.9	-94.8	0	0	0	112.3	L678 F681 L726 S729 L772 F773 A774 I779 I780	L678-Y776 HydrophobicContact CD1-CE2 4.34Å; L678-Y776 VanDerWaalsContact CD1-OH 3.29Å; L678-Y776 WeakPolarHBondContact CD1-OH 3.24Å; F681-Y776 HydrophobicContact CB-CD2 3.57Å; F681-Y776 HydrophobicContact CB-CE2 4.09Å; F681-Y776 HydrophobicContact CB-CG 4.4Å; F681-Y776 HydrophobicContact CD1-CD2 4.19Å; F681-Y776 HydrophobicContact CD1-CG 4.44Å; F681-Y776 AromaticContact CD2-CD2 3.65Å; F681-Y776 HydrophobicContact CD2-CD2 3.65Å; F681-Y776 HydrophobicContact CE2-CD2 4.37Å; F681-Y776 AromaticContact CG-CD2 3.54Å; F681-Y776 HydrophobicContact CG-CD2 3.54Å; F681-Y776 HydrophobicContact CG-CE2 4.46Å; F681-Y776 HydrophobicContact CG-CG 4.21Å; L726-Y776 HydrophobicContact CD2-CD1 3.99Å; L726-Y776 HydrophobicContact CD2-CD2 4.26Å; L726-Y776 HydrophobicContact CD2-CE1 3.75Å; L726-Y776 HydrophobicContact CD2-CE2 3.96Å; L726-Y776 HydrophobicContact CD2-CG 4.24Å; L726-Y776 PolarHBondContact O-OH 3.35Å; S729-Y776 WeakPolarHBondContact OG-CE1 3.44Å; L772-Y776 WeakPolarHBondContact O-CB 3.27Å; L772-Y776 PolarHBondContact O-N 2.83Å; F773-Y776 WeakPolarHBondContact O-CB 3.35Å; F773-Y776 PolarHBondContact O-N 2.99Å; A774-Y776 VanDerWaalsContact C-N 3.34Å; A774-Y776 PolarHBondContact O-N 2.95Å; Y776-I779 PolarHBondContact O-N 3.46Å; Y776-I780 HydrophobicContact CD1-CD1 4.13Å; Y776-I780 HydrophobicContact CD2-CD1 3.74Å; Y776-I780 HydrophobicContact CE1-CD1 3.51Å; Y776-I780 HydrophobicContact CE2-CD1 3.14Å; Y776-I780 HydrophobicContact CE2-CG1 4.29Å; Y776-I780 HydrophobicContact CG-CD1 4.23Å; Y776-I780 PolarHBondContact O-N 3.31Å; Y776-I780 WeakPolarHBondContact OH-CD1 3.36Å
777	H	90.3	Very high	90.1	Very high	43 Å²	43	54.2 Å²	54.2	20%	0.199	31%	0.312	C	S	.	.	H	α-helix	trans	-63.6	-42.7	176.7	-79.5	62.5	0	0	0	112.2	S729 F773 A774 V775 I780 I781	S729-H777 PolarHBondContact O-NE2 2.77Å; F773-H777 AromaticContact CD1-CE1 3.81Å; F773-H777 AromaticContact CD1-ND1 3.81Å; F773-H777 AromaticContact CD2-CE1 3.97Å; F773-H777 AromaticContact CE1-CE1 3.24Å; F773-H777 WeakPolarHBondContact CE1-CE1 3.35Å; F773-H777 AromaticContact CE1-ND1 3.7Å; F773-H777 AromaticContact CE1-NE2 3.87Å; F773-H777 AromaticContact CE2-CE1 3.44Å; F773-H777 VanDerWaalsContact CE2-CE1 3.44Å; F773-H777 WeakPolarHBondContact CE2-CE1 3.38Å; F773-H777 AromaticContact CZ-CE1 3.05Å; F773-H777 WeakPolarHBondContact CZ-CE1 3.5Å; F773-H777 AromaticContact CZ-ND1 3.88Å; F773-H777 AromaticContact CZ-NE2 3.77Å; F773-H777 PolarHBondContact O-N 3.35Å; F773-H777 PolarHBondContact O-ND1 3.3Å; A774-H777 PolarHBondContact O-N 2.86Å; V775-H777 PolarHBondContact O-N 2.95Å; H777-I780 PolarHBondContact O-N 2.92Å; H777-I781 WeakPolarHBondContact O-CB 3.42Å; H777-I781 PolarHBondContact O-N 3.46Å
778	G	90.2	Very high	90.5	Very high	23 Å²	23	53.2 Å²	53.2	24%	0.237	30%	0.301	C	S	.	.	I	π-helix	trans	-59.8	-46.4	175.9	0	0	0	0	0	112.1	A774 V775 I782 V783	A774-G778 PolarHBondContact O-N 3.41Å; V775-G778 PolarHBondContact O-N 2.91Å; G778-I782 WeakPolarHBondContact O-CA 3.44Å; G778-I782 WeakPolarHBondContact O-CB 3.39Å; G778-I782 PolarHBondContact O-N 2.89Å; G778-I782 VanDerWaalsContact O-N 3.08Å; G778-V783 PolarHBondContact O-N 3.13Å
779	I	92.1	Very high	90.5	Very high	55 Å²	55	54.2 Å²	54.2	28%	0.282	30%	0.303	S	S	.	.	I	π-helix	trans	-64.8	-47.3	179	-67	168.5	0	0	0	111	V677 F681 V775 Y776 V783 L784	V677-I779 HydrophobicContact CG1-CG2 4.02Å; V677-I779 HydrophobicContact CG2-CG2 4.43Å; F681-I779 HydrophobicContact CE2-CD1 3.89Å; F681-I779 HydrophobicContact CZ-CD1 3.84Å; V775-I779 HydrophobicContact CG1-CD1 3.77Å; V775-I779 HydrophobicContact CG1-CG1 4.38Å; V775-I779 WeakPolarHBondContact O-CG1 3.5Å; V775-I779 PolarHBondContact O-N 2.9Å; Y776-I779 PolarHBondContact O-N 3.46Å; I779-V783 WeakPolarHBondContact O-CA 3.44Å; I779-V783 VanDerWaalsContact O-CB 3.27Å; I779-V783 WeakPolarHBondContact O-CB 3.45Å; I779-V783 PolarHBondContact O-N 3.4Å; I779-L784 HydrophobicContact CG2-CG 4.48Å; I779-L784 PolarHBondContact O-N 2.99Å
780	I	90.7	Very high	90.7	Very high	2 Å²	2	57.2 Å²	57.2	1%	0.01	33%	0.328	C	S	.	.	I	π-helix	trans	-73	-52	-174.7	-71.8	178.4	0	0	0	112	Y674 V677 M730 Y776 H777 L784 V785	Y674-I780 HydrophobicContact CD2-CD1 4.48Å; Y674-I780 HydrophobicContact CE2-CD1 4.03Å; Y674-I780 HydrophobicContact CE2-CG2 4.5Å; V677-I780 HydrophobicContact CG1-CG1 4.4Å; M730-I780 HydrophobicContact CB-CG2 4.3Å; M730-I780 HydrophobicContact CG-CG2 3.82Å; M730-I780 HydrophobicContact SD-CG2 4.3Å; Y776-I780 HydrophobicContact CD1-CD1 4.13Å; Y776-I780 HydrophobicContact CD2-CD1 3.74Å; Y776-I780 HydrophobicContact CE1-CD1 3.51Å; Y776-I780 HydrophobicContact CE2-CD1 3.14Å; Y776-I780 HydrophobicContact CE2-CG1 4.29Å; Y776-I780 HydrophobicContact CG-CD1 4.23Å; Y776-I780 PolarHBondContact O-N 3.31Å; Y776-I780 WeakPolarHBondContact OH-CD1 3.36Å; H777-I780 PolarHBondContact O-N 2.92Å; I780-L784 HydrophobicContact CG1-CD1 4.16Å; I780-L784 WeakPolarHBondContact O-CB 3.32Å; I780-L784 PolarHBondContact O-N 2.9Å; I780-V785 WeakPolarHBondContact O-CG2 3.18Å; I780-V785 PolarHBondContact O-N 3.36Å; I780-V785 VanDerWaalsContact O-N 3.11Å
781	I	88	Confident	90.9	Very high	74 Å²	74	57.5 Å²	57.5	38%	0.379	33%	0.329	S	S	.	.	I	π-helix	trans	-79.9	-41.5	-170.8	-59.5	173.9	0	0	0	110.7	H777 V785	H777-I781 WeakPolarHBondContact O-CB 3.42Å; H777-I781 PolarHBondContact O-N 3.46Å; I781-V785 WeakPolarHBondContact O-CB 3.29Å
782	I	89.3	Confident	90.9	Very high	109 Å²	109	56.2 Å²	56.2	56%	0.559	32%	0.318	S	S	*	.	I	π-helix	trans	-87.6	-45.5	-175.3	-52.2	175.3	0	0	0	110.8	G778 N786	G778-I782 WeakPolarHBondContact O-CA 3.44Å; G778-I782 WeakPolarHBondContact O-CB 3.39Å; G778-I782 PolarHBondContact O-N 2.89Å; G778-I782 VanDerWaalsContact O-N 3.08Å; I782-N786 VanDerWaalsContact O-CB 3.3Å; I782-N786 WeakPolarHBondContact O-CB 3.42Å; I782-N786 VanDerWaalsContact O-CG 3.26Å; I782-N786 PolarHBondContact O-ND2 2.87Å
783	V	90.6	Very high	90.9	Very high	65 Å²	65	56.4 Å²	56.4	39%	0.394	32%	0.324	S	S	.	.	I	π-helix	trans	-85.5	-59.1	-174.9	-173.8	0	0	0	0	110.8	G778 I779 N786 M787	G778-V783 PolarHBondContact O-N 3.13Å; I779-V783 WeakPolarHBondContact O-CA 3.44Å; I779-V783 VanDerWaalsContact O-CB 3.27Å; I779-V783 WeakPolarHBondContact O-CB 3.45Å; I779-V783 PolarHBondContact O-N 3.4Å; V783-N786 PolarHBondContact O-N 3.42Å; V783-M787 HydrophobicContact CG1-CE 3.72Å; V783-M787 HydrophobicContact CG1-SD 3.94Å; V783-M787 WeakPolarHBondContact O-CB 3.19Å; V783-M787 WeakPolarHBondContact O-CG 3.11Å; V783-M787 PolarHBondContact O-N 2.8Å
784	L	90.2	Very high	91	Very high	17 Å²	17	62.1 Å²	62.1	9%	0.089	35%	0.351	C	S	.	.	I	π-helix	trans	-69.2	-43.4	-170.6	-65.9	-178.8	0	0	0	113.2	F670 Y674 V677 I779 I780 N786 M787 L788	F670-L784 HydrophobicContact CE1-CB 4.01Å; F670-L784 HydrophobicContact CE1-CD2 4.26Å; F670-L784 WeakPolarHBondContact CE1-O 3.49Å; F670-L784 HydrophobicContact CE2-CD2 4.4Å; F670-L784 HydrophobicContact CZ-CB 3.87Å; F670-L784 HydrophobicContact CZ-CD2 3.66Å; F670-L784 HydrophobicContact CZ-CG 4.35Å; F670-L784 WeakPolarHBondContact CZ-O 3.32Å; Y674-L784 HydrophobicContact CD2-CD1 4.37Å; V677-L784 HydrophobicContact CG2-CD1 4.48Å; I779-L784 HydrophobicContact CG2-CG 4.48Å; I779-L784 PolarHBondContact O-N 2.99Å; I780-L784 HydrophobicContact CG1-CD1 4.16Å; I780-L784 WeakPolarHBondContact O-CB 3.32Å; I780-L784 PolarHBondContact O-N 2.9Å; L784-N786 PolarHBondContact O-N 2.82Å; L784-M787 PolarHBondContact O-N 2.97Å; L784-L788 WeakPolarHBondContact O-CB 3.32Å; L784-L788 PolarHBondContact O-N 3.49Å
785	V	90	Very high	91.1	Very high	50 Å²	50	59.6 Å²	59.6	30%	0.303	33%	0.33	S	S	.	.	H	α-helix	trans	-64.4	-41.8	178.7	173.2	0	0	0	0	111.5	I780 I781 L788 I789	I780-V785 WeakPolarHBondContact O-CG2 3.18Å; I780-V785 PolarHBondContact O-N 3.36Å; I780-V785 VanDerWaalsContact O-N 3.11Å; I781-V785 WeakPolarHBondContact O-CB 3.29Å; V785-L788 PolarHBondContact O-N 3.19Å; V785-I789 HydrophobicContact CG1-CD1 3.82Å; V785-I789 HydrophobicContact CG1-CG1 4.42Å; V785-I789 VanDerWaalsContact O-CG1 3.3Å; V785-I789 WeakPolarHBondContact O-CG1 3.23Å; V785-I789 PolarHBondContact O-N 3.11Å
786	N	90.3	Very high	91.1	Very high	95 Å²	95	60.3 Å²	60.3	51%	0.508	33%	0.327	S	S	.	.	H	α-helix	trans	-66.4	-39.6	178	-73.9	-27.9	0	0	0	112.3	I782 V783 L784 I789 A790	I782-N786 VanDerWaalsContact O-CB 3.3Å; I782-N786 WeakPolarHBondContact O-CB 3.42Å; I782-N786 VanDerWaalsContact O-CG 3.26Å; I782-N786 PolarHBondContact O-ND2 2.87Å; V783-N786 PolarHBondContact O-N 3.42Å; L784-N786 PolarHBondContact O-N 2.82Å; N786-I789 PolarHBondContact O-N 3.43Å; N786-A790 PolarHBondContact O-N 3.32Å; N786-A790 VanDerWaalsContact O-N 3.11Å
787	M	91	Very high	91	Very high	109 Å²	109	66.7 Å²	66.7	54%	0.537	36%	0.357	S	S	.	.	H	α-helix	trans	-63.7	-40.4	172.8	-73.7	-176.5	175.3	0	0	112.1	F670 V783 L784 A790 M791	F670-M787 HydrophobicContact CE2-CB 4Å; F670-M787 HydrophobicContact CZ-CB 4.12Å; V783-M787 HydrophobicContact CG1-CE 3.72Å; V783-M787 HydrophobicContact CG1-SD 3.94Å; V783-M787 WeakPolarHBondContact O-CB 3.19Å; V783-M787 WeakPolarHBondContact O-CG 3.11Å; V783-M787 PolarHBondContact O-N 2.8Å; L784-M787 PolarHBondContact O-N 2.97Å; M787-A790 PolarHBondContact O-N 3.35Å; M787-M791 WeakPolarHBondContact O-CB 3.35Å; M787-M791 PolarHBondContact O-N 3.16Å
788	L	91.7	Very high	91	Very high	41 Å²	41	67.6 Å²	67.6	22%	0.215	37%	0.368	C	S	.	.	H	α-helix	trans	-63.7	-44.1	177.6	-178.3	63.4	0	0	0	111.8	I667 F670 L784 V785 M791 M792	I667-L788 HydrophobicContact CG1-CD1 4.26Å; F670-L788 HydrophobicContact CB-CD1 4.22Å; F670-L788 HydrophobicContact CD1-CB 4.18Å; F670-L788 HydrophobicContact CD1-CD1 3.77Å; F670-L788 HydrophobicContact CD1-CG 4.38Å; F670-L788 HydrophobicContact CE1-CB 3.86Å; F670-L788 HydrophobicContact CE1-CD1 4.33Å; F670-L788 HydrophobicContact CE1-CG 4.5Å; F670-L788 HydrophobicContact CG-CD1 4Å; F670-L788 HydrophobicContact CZ-CB 4.19Å; L784-L788 WeakPolarHBondContact O-CB 3.32Å; L784-L788 PolarHBondContact O-N 3.49Å; V785-L788 PolarHBondContact O-N 3.19Å; L788-M791 PolarHBondContact O-N 2.84Å; L788-M792 HydrophobicContact CD1-CG 4.33Å; L788-M792 HydrophobicContact CG-CE 4.39Å; L788-M792 HydrophobicContact CG-SD 4.49Å; L788-M792 WeakPolarHBondContact O-CB 3.34Å; L788-M792 WeakPolarHBondContact O-CG 3.4Å; L788-M792 PolarHBondContact O-N 3.39Å
789	I	92.3	Very high	90.9	Very high	86 Å²	86	67 Å²	67	44%	0.441	36%	0.359	S	S	.	.	H	α-helix	trans	-62.8	-44.1	177.8	-67.1	165.3	0	0	0	110.9	V785 N786 M792 S793	V785-I789 HydrophobicContact CG1-CD1 3.82Å; V785-I789 HydrophobicContact CG1-CG1 4.42Å; V785-I789 VanDerWaalsContact O-CG1 3.3Å; V785-I789 WeakPolarHBondContact O-CG1 3.23Å; V785-I789 PolarHBondContact O-N 3.11Å; N786-I789 PolarHBondContact O-N 3.43Å; I789-M792 PolarHBondContact O-N 3.47Å; I789-S793 PolarHBondContact O-N 2.96Å; I789-S793 VanDerWaalsContact O-N 3.07Å; I789-S793 PolarHBondContact O-OG 2.82Å
790	A	92.4	Very high	90.8	Very high	62 Å²	62	69.4 Å²	69.4	51%	0.512	37%	0.369	S	S	.	.	H	α-helix	trans	-62.3	-45.7	177.4	0	0	0	0	0	111.7	N786 M787 S793 H794	N786-A790 PolarHBondContact O-N 3.32Å; N786-A790 VanDerWaalsContact O-N 3.11Å; M787-A790 PolarHBondContact O-N 3.35Å; A790-S793 PolarHBondContact O-N 3.25Å; A790-H794 PolarHBondContact O-N 3.4Å
791	M	90.8	Very high	90.7	Very high	81 Å²	81	76 Å²	76	40%	0.399	40%	0.4	S	S	.	.	H	α-helix	trans	-63	-45.7	177.7	-174.1	179.9	-66.4	0	0	112	F670 M787 L788 S793 H794 S795	F670-M791 HydrophobicContact CD2-CE 4.1Å; F670-M791 HydrophobicContact CD2-SD 4.46Å; M787-M791 WeakPolarHBondContact O-CB 3.35Å; M787-M791 PolarHBondContact O-N 3.16Å; L788-M791 PolarHBondContact O-N 2.84Å; M791-S793 VanDerWaalsContact C-N 3.28Å; M791-S793 PolarHBondContact O-N 3.14Å; M791-H794 PolarHBondContact O-N 2.86Å; M791-S795 WeakPolarHBondContact O-CB 3.38Å; M791-S795 PolarHBondContact O-N 3.28Å; M791-S795 PolarHBondContact O-OG 3.16Å
792	M	92.3	Very high	90.7	Very high	65 Å²	65	76.2 Å²	76.2	32%	0.32	40%	0.402	S	S	.	.	H	α-helix	trans	-62.1	-35.5	177.9	-74.3	-168.1	-52	0	0	112.5	I667 L788 I789 F796	I667-M792 HydrophobicContact CD1-SD 3.89Å; I667-M792 HydrophobicContact CG1-CG 4.36Å; I667-M792 HydrophobicContact CG1-SD 4.23Å; L788-M792 HydrophobicContact CD1-CG 4.33Å; L788-M792 HydrophobicContact CG-CE 4.39Å; L788-M792 HydrophobicContact CG-SD 4.49Å; L788-M792 WeakPolarHBondContact O-CB 3.34Å; L788-M792 WeakPolarHBondContact O-CG 3.4Å; L788-M792 PolarHBondContact O-N 3.39Å; I789-M792 PolarHBondContact O-N 3.47Å; M792-F796 VanDerWaalsContact O-CB 3.28Å; M792-F796 WeakPolarHBondContact O-CB 3.26Å; M792-F796 PolarHBondContact O-N 3.47Å
793	S	92.3	Very high	90.7	Very high	62 Å²	62	71.2 Å²	71.2	43%	0.434	38%	0.377	S	S	.	.	H	α-helix	trans	-65.5	-47.9	177.9	-55.6	0	0	0	0	111.1	I789 A790 M791 F796 E797	I789-S793 PolarHBondContact O-N 2.96Å; I789-S793 VanDerWaalsContact O-N 3.07Å; I789-S793 PolarHBondContact O-OG 2.82Å; A790-S793 PolarHBondContact O-N 3.25Å; M791-S793 VanDerWaalsContact C-N 3.28Å; M791-S793 PolarHBondContact O-N 3.14Å; S793-F796 PolarHBondContact O-N 3.4Å; S793-E797 PolarHBondContact O-N 2.99Å; S793-E797 VanDerWaalsContact O-N 3.13Å
794	H	92	Very high	90.7	Very high	135 Å²	135	71.7 Å²	71.7	63%	0.625	38%	0.377	S	S	*	.	H	α-helix	trans	-62.8	-43.8	175.3	177.9	-84.7	0	0	0	112.2	A790 M791 F796 E797 S798	A790-H794 PolarHBondContact O-N 3.4Å; M791-H794 PolarHBondContact O-N 2.86Å; H794-F796 PolarHBondContact O-N 3.25Å; H794-E797 PolarHBondContact O-N 2.91Å; H794-S798 PolarHBondContact O-N 3.04Å
795	S	91.6	Very high	90.8	Very high	7 Å²	7	72.7 Å²	72.7	5%	0.049	38%	0.384	C	S	.	.	H	α-helix	trans	-61.2	-43.9	176	-68.5	0	0	0	0	111.5	D666 M791 E797 S798 I799	D666-S795 WeakPolarHBondContact OD2-CB 3.49Å; D666-S795 PolarHBondContact OD2-OG 2.96Å; M791-S795 WeakPolarHBondContact O-CB 3.38Å; M791-S795 PolarHBondContact O-N 3.28Å; M791-S795 PolarHBondContact O-OG 3.16Å; S795-E797 PolarHBondContact O-N 2.95Å; S795-S798 PolarHBondContact O-N 2.76Å; S795-S798 PolarHBondContact O-OG 2.99Å; S795-I799 VanDerWaalsContact O-CD1 3.26Å; S795-I799 WeakPolarHBondContact O-CD1 3.31Å; S795-I799 WeakPolarHBondContact O-CG1 3.13Å; S795-I799 PolarHBondContact O-N 3.38Å
796	F	91.9	Very high	90.9	Very high	85 Å²	85	70.9 Å²	70.9	37%	0.373	37%	0.372	S	S	.	.	H	α-helix	trans	-60.9	-45.1	179.3	-177.6	-99.4	0	0	0	112.5	M663 M792 S793 H794 I799 Q800	M663-F796 HydrophobicContact CE-CD2 4.18Å; M663-F796 HydrophobicContact SD-CB 3.97Å; M663-F796 HydrophobicContact SD-CD2 3.95Å; M663-F796 HydrophobicContact SD-CG 4.45Å; M792-F796 VanDerWaalsContact O-CB 3.28Å; M792-F796 WeakPolarHBondContact O-CB 3.26Å; M792-F796 PolarHBondContact O-N 3.47Å; S793-F796 PolarHBondContact O-N 3.4Å; H794-F796 PolarHBondContact O-N 3.25Å; F796-I799 PolarHBondContact O-N 2.66Å; F796-Q800 WeakPolarHBondContact O-CB 3.44Å; F796-Q800 PolarHBondContact O-N 3.4Å
797	E	92.2	Very high	91.1	Very high	134 Å²	134	67 Å²	67	63%	0.626	35%	0.35	S	S	*	.	H	α-helix	trans	-59.1	-48.3	177.2	-72.8	175.1	-176.8	0	0	111.7	S793 H794 S795 I799 Q800	S793-E797 PolarHBondContact O-N 2.99Å; S793-E797 VanDerWaalsContact O-N 3.13Å; H794-E797 PolarHBondContact O-N 2.91Å; S795-E797 PolarHBondContact O-N 2.95Å; E797-I799 VanDerWaalsContact C-N 3.33Å; E797-I799 PolarHBondContact O-N 3.29Å; E797-Q800 PolarHBondContact O-N 2.85Å
798	S	88.9	Confident	91.3	Very high	62 Å²	62	64 Å²	64	43%	0.434	33%	0.334	S	S	.	.	H	α-helix	trans	-63.8	-34.6	178.8	70.7	0	0	0	0	113.7	H794 S795	H794-S798 PolarHBondContact O-N 3.04Å; S795-S798 PolarHBondContact O-N 2.76Å; S795-S798 PolarHBondContact O-OG 2.99Å
799	I	89.1	Confident	91.4	Very high	10 Å²	10	62.7 Å²	62.7	5%	0.051	33%	0.327	C	S	.	.	H	α-helix	trans	-77.1	-31.3	179.9	-65.1	158.7	0	0	0	111	R662 M663 S795 F796 E797 E801 D802 C803	R662-I799 HydrophobicContact CB-CD1 3.5Å; R662-I799 HydrophobicContact CB-CG1 4.12Å; R662-I799 HydrophobicContact CB-CG2 4.38Å; M663-I799 HydrophobicContact CG-CD1 3.9Å; S795-I799 VanDerWaalsContact O-CD1 3.26Å; S795-I799 WeakPolarHBondContact O-CD1 3.31Å; S795-I799 WeakPolarHBondContact O-CG1 3.13Å; S795-I799 PolarHBondContact O-N 3.38Å; F796-I799 PolarHBondContact O-N 2.66Å; E797-I799 VanDerWaalsContact C-N 3.33Å; E797-I799 PolarHBondContact O-N 3.29Å; I799-E801 VanDerWaalsContact C-N 3.29Å; I799-E801 PolarHBondContact O-N 2.85Å; I799-D802 PolarHBondContact O-N 3.44Å; I799-C803 WeakPolarHBondContact O-CB 3.36Å; I799-C803 PolarHBondContact O-N 3.21Å; I799-C803 VanDerWaalsContact O-N 3.07Å
800	Q	88.9	Confident	91.3	Very high	107 Å²	107	59.4 Å²	59.4	50%	0.5	31%	0.313	S	S	.	.	H	α-helix	trans	-63.8	-33.3	-176.1	-172.3	68.2	4.5	0	0	112.4	F796 E797 D802 C803	F796-Q800 WeakPolarHBondContact O-CB 3.44Å; F796-Q800 PolarHBondContact O-N 3.4Å; E797-Q800 PolarHBondContact O-N 2.85Å; Q800-D802 VanDerWaalsContact C-N 3.33Å; Q800-D802 PolarHBondContact O-N 3.4Å; Q800-C803 PolarHBondContact O-N 2.92Å
801	E	88.5	Confident	91.4	Very high	140 Å²	140	58.2 Å²	58.2	65%	0.654	30%	0.295	S	S	*	.	H	α-helix	trans	-60.6	-39	178.4	-65.2	-173.8	164	0	0	112.4	I799 Q965	I799-E801 VanDerWaalsContact C-N 3.29Å; I799-E801 PolarHBondContact O-N 2.85Å; E801-Q965 PolarHBondContact OE1-NE2 2.9Å; E801-Q965 VanDerWaalsContact OE1-NE2 3.15Å
802	D	87.7	Confident	91.5	Very high	79 Å²	79	54.4 Å²	54.4	42%	0.422	28%	0.276	S	S	.	.	H	α-helix	trans	-102	1.4	-178.1	-76.1	-33.2	0	0	0	114.2	I799 Q800 D804 V805 E806	I799-D802 PolarHBondContact O-N 3.44Å; Q800-D802 VanDerWaalsContact C-N 3.33Å; Q800-D802 PolarHBondContact O-N 3.4Å; D802-D804 VanDerWaalsContact C-N 3.35Å; D802-D804 PolarHBondContact O-N 2.95Å; D802-V805 PolarHBondContact O-N 3.22Å; D802-E806 WeakPolarHBondContact O-CG 3.4Å; D802-E806 PolarHBondContact O-N 3.42Å; D802-E806 VanDerWaalsContact O-N 3.11Å
803	C	89.9	Confident	91.3	Very high	4 Å²	4	55 Å²	55	3%	0.027	28%	0.278	C	S	.	.	H	α-helix	trans	-60.5	-38.7	-168.3	-169.4	0	0	0	0	113.6	P655 I799 Q800 E806 W807	P655-C803 VanDerWaalsContact CB-SG 3.54Å; P655-C803 PolarHBondContact O-SG 3.42Å; I799-C803 WeakPolarHBondContact O-CB 3.36Å; I799-C803 PolarHBondContact O-N 3.21Å; I799-C803 VanDerWaalsContact O-N 3.07Å; Q800-C803 PolarHBondContact O-N 2.92Å; C803-E806 PolarHBondContact O-N 2.6Å; C803-W807 VanDerWaalsContact O-CB 3.28Å; C803-W807 WeakPolarHBondContact O-CB 3.42Å; C803-W807 PolarHBondContact O-N 3.39Å
804	D	91.6	Very high	91.1	Very high	75 Å²	75	52.3 Å²	52.3	40%	0.401	26%	0.259	S	S	.	.	H	α-helix	trans	-68.5	-42.6	178.2	178.8	39.1	0	0	0	112.2	D802 E806 W807 K808	D802-D804 VanDerWaalsContact C-N 3.35Å; D802-D804 PolarHBondContact O-N 2.95Å; D804-E806 PolarHBondContact O-N 2.72Å; D804-W807 PolarHBondContact O-N 3.17Å; D804-K808 WeakPolarHBondContact O-CB 3.5Å; D804-K808 WeakPolarHBondContact O-CG 3.3Å; D804-K808 PolarHBondContact O-N 2.96Å; D804-K808 WeakPolarHBondContact OD1-CE 3.27Å; D804-K808 IonicContact OD1-NZ 3.52Å; D804-K808 PolarHBondContact OD1-NZ 3.4Å; D804-K808 WeakPolarHBondContact OD2-CE 3.34Å; D804-K808 IonicContact OD2-NZ 2.93Å; D804-K808 PolarHBondContact OD2-NZ 2.98Å
805	V	92.5	Very high	91	Very high	37 Å²	37	46.9 Å²	46.9	22%	0.224	23%	0.233	C	C	.	.	H	α-helix	trans	-59.8	-41.6	177.4	173	0	0	0	0	110.1	K382 K383 A386 D802 F809	K382-V805 HydrophobicContact CB-CG1 3.93Å; K383-V805 HydrophobicContact CG-CG1 4.28Å; A386-V805 HydrophobicContact CB-CB 4.23Å; A386-V805 HydrophobicContact CB-CG1 3.83Å; A386-V805 HydrophobicContact CB-CG2 4.43Å; D802-V805 PolarHBondContact O-N 3.22Å; V805-F809 WeakPolarHBondContact O-CB 3.43Å; V805-F809 PolarHBondContact O-N 3.44Å
806	E	91.7	Very high	90.7	Very high	12 Å²	12	47.4 Å²	47.4	6%	0.056	24%	0.235	C	C	.	.	H	α-helix	trans	-75.8	-39.1	-178.6	-68.6	171.6	-176.2	0	0	113.6	K382 I658 R662 D802 C803 D804 K808 F809 A810	K382-E806 HydrophobicContact CD-CG 4.28Å; I658-E806 HydrophobicContact CG2-CB 3.9Å; I658-E806 WeakPolarHBondContact CG2-OE2 3.42Å; R662-E806 WeakPolarHBondContact CD-OE2 3.36Å; R662-E806 IonicContact CZ-OE1 2.65Å; R662-E806 IonicContact CZ-OE2 2.76Å; R662-E806 IonicContact NE-OE1 3.64Å; R662-E806 IonicContact NE-OE2 2.6Å; R662-E806 PolarHBondContact NE-OE2 3.21Å; R662-E806 IonicContact NH1-OE1 3.51Å; R662-E806 PolarHBondContact NH1-OE1 2.93Å; R662-E806 IonicContact NH1-OE2 3.68Å; R662-E806 PolarHBondContact NH1-OE2 2.91Å; R662-E806 VanDerWaalsContact NH1-OE2 3.09Å; R662-E806 IonicContact NH2-OE1 3.33Å; R662-E806 PolarHBondContact NH2-OE1 2.88Å; R662-E806 IonicContact NH2-OE2 3.4Å; R662-E806 PolarHBondContact NH2-OE2 3.44Å; D802-E806 WeakPolarHBondContact O-CG 3.4Å; D802-E806 PolarHBondContact O-N 3.42Å; D802-E806 VanDerWaalsContact O-N 3.11Å; C803-E806 PolarHBondContact O-N 2.6Å; D804-E806 PolarHBondContact O-N 2.72Å; E806-K808 VanDerWaalsContact C-N 3.34Å; E806-F809 WeakPolarHBondContact O-CB 3.38Å; E806-F809 PolarHBondContact O-N 2.85Å; E806-A810 WeakPolarHBondContact O-CB 3.44Å; E806-A810 PolarHBondContact O-N 3.34Å
807	W	94.2	Very high	90.3	Very high	13 Å²	13	47.2 Å²	47.2	5%	0.049	24%	0.238	C	C	.	.	H	α-helix	trans	-59.8	-46.8	171.8	166.3	54.7	0	0	0	110.6	P648 E651 G654 P655 C803 D804 F809 A810 R811	P648-W807 PolarHBondContact O-NE1 2.93Å; E651-W807 VanDerWaalsContact CA-CZ2 3.46Å; E651-W807 HydrophobicContact CB-CH2 3.87Å; E651-W807 HydrophobicContact CB-CZ2 3.98Å; E651-W807 HydrophobicContact CG-CH2 3.71Å; E651-W807 HydrophobicContact CG-CZ2 4.3Å; E651-W807 HydrophobicContact CG-CZ3 4.39Å; G654-W807 VanDerWaalsContact CA-CD1 3.46Å; P655-W807 HydrophobicContact CG-CB 4.06Å; P655-W807 HydrophobicContact CG-CD2 3.92Å; P655-W807 HydrophobicContact CG-CE3 4.15Å; P655-W807 HydrophobicContact CG-CG 3.85Å; C803-W807 VanDerWaalsContact O-CB 3.28Å; C803-W807 WeakPolarHBondContact O-CB 3.42Å; C803-W807 PolarHBondContact O-N 3.39Å; D804-W807 PolarHBondContact O-N 3.17Å; W807-F809 VanDerWaalsContact C-N 3.31Å; W807-F809 PolarHBondContact O-N 3.27Å; W807-A810 PolarHBondContact O-N 2.93Å; W807-R811 WeakPolarHBondContact O-CB 3.18Å; W807-R811 PolarHBondContact O-N 3Å
808	K	94	Very high	89.9	Confident	47 Å²	47	42.5 Å²	42.5	20%	0.204	22%	0.215	C	C	.	.	H	α-helix	trans	-61.3	-38.9	176.1	-75	168.9	177.1	161.9	0	112.2	A386 D804 E806 T812	A386-K808 HydrophobicContact CB-CB 3.87Å; A386-K808 HydrophobicContact CB-CD 4.06Å; D804-K808 WeakPolarHBondContact O-CB 3.5Å; D804-K808 WeakPolarHBondContact O-CG 3.3Å; D804-K808 PolarHBondContact O-N 2.96Å; D804-K808 WeakPolarHBondContact OD1-CE 3.27Å; D804-K808 IonicContact OD1-NZ 3.52Å; D804-K808 PolarHBondContact OD1-NZ 3.4Å; D804-K808 WeakPolarHBondContact OD2-CE 3.34Å; D804-K808 IonicContact OD2-NZ 2.93Å; D804-K808 PolarHBondContact OD2-NZ 2.98Å; E806-K808 VanDerWaalsContact C-N 3.34Å; K808-T812 WeakPolarHBondContact O-CB 3.45Å; K808-T812 PolarHBondContact O-N 2.83Å; K808-T812 PolarHBondContact O-OG1 3.43Å
809	F	93.9	Very high	89.5	Confident	14 Å²	14	39.8 Å²	39.8	6%	0.061	20%	0.195	C	C	.	.	H	α-helix	trans	-62.6	-52.1	174	-179	-97.3	0	0	0	111.8	I377 K382 V385 V805 E806 W807 R811 T812 Q813	I377-F809 HydrophobicContact CG1-CE2 4.27Å; I377-F809 HydrophobicContact CG2-CZ 4.25Å; K382-F809 HydrophobicContact CB-CD2 4.31Å; K382-F809 HydrophobicContact CB-CG 4.44Å; K382-F809 HydrophobicContact CG-CB 4.38Å; K382-F809 HydrophobicContact CG-CD1 4.25Å; K382-F809 HydrophobicContact CG-CD2 3.98Å; K382-F809 HydrophobicContact CG-CE2 4.3Å; K382-F809 HydrophobicContact CG-CG 3.95Å; V385-F809 HydrophobicContact CB-CD2 4Å; V385-F809 HydrophobicContact CG1-CD2 4.21Å; V385-F809 HydrophobicContact CG2-CD2 4.06Å; V385-F809 HydrophobicContact CG2-CE2 4.22Å; V805-F809 WeakPolarHBondContact O-CB 3.43Å; V805-F809 PolarHBondContact O-N 3.44Å; E806-F809 WeakPolarHBondContact O-CB 3.38Å; E806-F809 PolarHBondContact O-N 2.85Å; W807-F809 VanDerWaalsContact C-N 3.31Å; W807-F809 PolarHBondContact O-N 3.27Å; F809-R811 VanDerWaalsContact C-N 3.34Å; F809-R811 PolarHBondContact O-N 3.15Å; F809-T812 WeakPolarHBondContact O-CB 3.23Å; F809-T812 PolarHBondContact O-N 3.4Å; F809-T812 VanDerWaalsContact O-N 3.09Å; F809-Q813 HydrophobicContact CD1-CG 4.44Å; F809-Q813 VanDerWaalsContact CE1-CD 3.45Å; F809-Q813 HydrophobicContact CE1-CG 4.16Å; F809-Q813 VanDerWaalsContact CE1-NE2 3.26Å; F809-Q813 HydrophobicContact CZ-CG 4.43Å; F809-Q813 PolarHBondContact O-N 2.84Å
810	A	91.5	Very high	88.6	Confident	17 Å²	17	41.3 Å²	41.3	14%	0.14	20%	0.204	C	C	.	.	H	α-helix	trans	-62.3	-39.1	178.4	0	0	0	0	0	112.4	I658 E806 W807 T812 Q813 L814	I658-A810 HydrophobicContact CD1-CB 3.81Å; E806-A810 WeakPolarHBondContact O-CB 3.44Å; E806-A810 PolarHBondContact O-N 3.34Å; W807-A810 PolarHBondContact O-N 2.93Å; A810-T812 VanDerWaalsContact C-N 3.32Å; A810-T812 PolarHBondContact O-N 3.26Å; A810-Q813 PolarHBondContact O-N 3.16Å; A810-L814 PolarHBondContact O-N 2.97Å
811	R	93.5	Very high	87.1	Confident	36 Å²	36	41 Å²	41	14%	0.136	21%	0.206	C	C	.	.	H	α-helix	trans	-60.7	-42.2	172.7	-176.3	-179.2	74.6	-173.3	5.1	111.4	W807 F809 L814 W815	W807-R811 WeakPolarHBondContact O-CB 3.18Å; W807-R811 PolarHBondContact O-N 3Å; F809-R811 VanDerWaalsContact C-N 3.34Å; F809-R811 PolarHBondContact O-N 3.15Å; R811-L814 WeakPolarHBondContact O-CB 3.3Å; R811-L814 PolarHBondContact O-N 3.05Å; R811-W815 HydrophobicContact CG-CD2 4.3Å; R811-W815 HydrophobicContact CG-CZ2 3.93Å; R811-W815 VanDerWaalsContact O-CG 3.31Å; R811-W815 PolarHBondContact O-N 3.42Å
812	T	92.4	Very high	85.6	Confident	1 Å²	1	35.8 Å²	35.8	1%	0.006	19%	0.189	C	C	.	.	H	α-helix	trans	-67.1	-40.2	178.3	-55.5	0	0	0	0	111.6	I377 V385 Q391 L394 K808 F809 A810 L814 W815 L816	I377-T812 HydrophobicContact CD1-CG2 4.2Å; V385-T812 HydrophobicContact CG1-CG2 3.68Å; Q391-T812 PolarHBondContact NE2-OG1 2.95Å; L394-T812 HydrophobicContact CD1-CG2 3.49Å; L394-T812 VanDerWaalsContact CD1-CG2 3.49Å; L394-T812 HydrophobicContact CD2-CG2 4.47Å; K808-T812 WeakPolarHBondContact O-CB 3.45Å; K808-T812 PolarHBondContact O-N 2.83Å; K808-T812 PolarHBondContact O-OG1 3.43Å; F809-T812 WeakPolarHBondContact O-CB 3.23Å; F809-T812 PolarHBondContact O-N 3.4Å; F809-T812 VanDerWaalsContact O-N 3.09Å; A810-T812 VanDerWaalsContact C-N 3.32Å; A810-T812 PolarHBondContact O-N 3.26Å; T812-L814 VanDerWaalsContact C-N 3.33Å; T812-L814 PolarHBondContact O-N 3.46Å; T812-W815 PolarHBondContact O-N 2.85Å; T812-L816 WeakPolarHBondContact O-CB 3.4Å; T812-L816 PolarHBondContact O-N 3.41Å
813	Q	89.4	Confident	84.3	Confident	77 Å²	77	33.4 Å²	33.4	36%	0.36	18%	0.178	S	C	.	.	H	α-helix	trans	-59.3	-44.4	172.6	-71.1	-177.3	-40.6	0	0	111.5	I377 F809 A810 W815 L816 N817	I377-Q813 HydrophobicContact CG2-CG 3.82Å; F809-Q813 HydrophobicContact CD1-CG 4.44Å; F809-Q813 VanDerWaalsContact CE1-CD 3.45Å; F809-Q813 HydrophobicContact CE1-CG 4.16Å; F809-Q813 VanDerWaalsContact CE1-NE2 3.26Å; F809-Q813 HydrophobicContact CZ-CG 4.43Å; F809-Q813 PolarHBondContact O-N 2.84Å; A810-Q813 PolarHBondContact O-N 3.16Å; Q813-W815 VanDerWaalsContact C-N 3.35Å; Q813-W815 PolarHBondContact O-N 2.95Å; Q813-L816 PolarHBondContact O-N 3.46Å; Q813-N817 PolarHBondContact O-N 3Å; Q813-N817 PolarHBondContact O-ND2 3.46Å
814	L	88.3	Confident	83.4	Confident	7 Å²	7	34.5 Å²	34.5	4%	0.037	19%	0.185	C	C	.	.	H	α-helix	trans	-60.1	-44.9	174.2	179.6	66.7	0	0	0	111.3	F451 Y645 A649 A810 R811 T812 N817 Y818	F451-L814 HydrophobicContact CE2-CD2 4.1Å; F451-L814 HydrophobicContact CZ-CD2 4.49Å; Y645-L814 HydrophobicContact CE1-CD1 3.61Å; Y645-L814 HydrophobicContact CE2-CD1 4.38Å; Y645-L814 WeakPolarHBondContact OH-CD1 3.3Å; A649-L814 HydrophobicContact CB-CD2 3.78Å; A810-L814 PolarHBondContact O-N 2.97Å; R811-L814 WeakPolarHBondContact O-CB 3.3Å; R811-L814 PolarHBondContact O-N 3.05Å; T812-L814 VanDerWaalsContact C-N 3.33Å; T812-L814 PolarHBondContact O-N 3.46Å; L814-N817 PolarHBondContact O-N 3.49Å; L814-Y818 HydrophobicContact CD1-CE2 3.93Å; L814-Y818 HydrophobicContact CG-CE2 4.4Å; L814-Y818 VanDerWaalsContact O-CD2 3.26Å; L814-Y818 WeakPolarHBondContact O-CD2 3.32Å
815	W	89.8	Confident	82.7	Confident	20 Å²	20	31.4 Å²	31.4	8%	0.076	17%	0.168	C	C	.	.	H	α-helix	trans	-65.2	-42.1	-179.2	-71.6	1.2	0	0	0	113	L394 W398 R811 T812 Q813 N817 Y818 I819	L394-W815 HydrophobicContact CB-CE3 4.2Å; L394-W815 HydrophobicContact CB-CZ3 4.14Å; W398-W815 HydrophobicContact CB-CE3 4.31Å; W398-W815 HydrophobicContact CB-CZ3 4.41Å; W398-W815 AromaticContact CD2-CD1 3.96Å; W398-W815 AromaticContact CD2-CD2 3.93Å; W398-W815 HydrophobicContact CD2-CD2 3.93Å; W398-W815 AromaticContact CD2-CG 3.91Å; W398-W815 HydrophobicContact CD2-CG 3.91Å; W398-W815 AromaticContact CE2-CD1 3.96Å; W398-W815 AromaticContact CE2-NE1 3.8Å; W398-W815 HydrophobicContact CE3-CB 3.63Å; W398-W815 AromaticContact CE3-CD1 3.74Å; W398-W815 AromaticContact CE3-CD2 3.92Å; W398-W815 HydrophobicContact CE3-CD2 3.92Å; W398-W815 AromaticContact CE3-CG 3.48Å; W398-W815 HydrophobicContact CE3-CG 3.48Å; W398-W815 VanDerWaalsContact CE3-CG 3.48Å; W398-W815 HydrophobicContact CG-CD2 4.23Å; W398-W815 HydrophobicContact CG-CE3 4.46Å; W398-W815 HydrophobicContact CG-CZ2 4.46Å; W398-W815 HydrophobicContact CH2-CB 4.4Å; W398-W815 AromaticContact CH2-CD1 3.52Å; W398-W815 HydrophobicContact CH2-CG 4.06Å; W398-W815 AromaticContact CZ2-CD1 3.75Å; W398-W815 HydrophobicContact CZ2-CG 4.45Å; W398-W815 AromaticContact CZ2-NE1 3.86Å; W398-W815 VanDerWaalsContact CZ3-CA 3.43Å; W398-W815 HydrophobicContact CZ3-CB 3.58Å; W398-W815 AromaticContact CZ3-CD1 3.53Å; W398-W815 HydrophobicContact CZ3-CD2 4.45Å; W398-W815 AromaticContact CZ3-CG 3.58Å; W398-W815 HydrophobicContact CZ3-CG 3.58Å; R811-W815 HydrophobicContact CG-CD2 4.3Å; R811-W815 HydrophobicContact CG-CZ2 3.93Å; R811-W815 VanDerWaalsContact O-CG 3.31Å; R811-W815 PolarHBondContact O-N 3.42Å; T812-W815 PolarHBondContact O-N 2.85Å; Q813-W815 VanDerWaalsContact C-N 3.35Å; Q813-W815 PolarHBondContact O-N 2.95Å; W815-N817 PolarHBondContact O-N 3.23Å; W815-Y818 PolarHBondContact O-N 3.25Å; W815-I819 HydrophobicContact CB-CD1 4.31Å; W815-I819 WeakPolarHBondContact O-CG1 3.47Å; W815-I819 PolarHBondContact O-N 3.39Å
816	L	85.6	Confident	82.2	Confident	18 Å²	18	29.6 Å²	29.6	9%	0.094	16%	0.158	C	C	.	.	H	α-helix	trans	-58.2	-37.7	-178.2	-172	66.9	0	0	0	111.7	L370 R374 I377 T812 Q813 Y818 I819 D820	L370-L816 HydrophobicContact CD2-CD1 3.9Å; R374-L816 HydrophobicContact CG-CD1 4.33Å; R374-L816 HydrophobicContact CG-CD2 3.89Å; I377-L816 HydrophobicContact CD1-CD2 3.73Å; T812-L816 WeakPolarHBondContact O-CB 3.4Å; T812-L816 PolarHBondContact O-N 3.41Å; Q813-L816 PolarHBondContact O-N 3.46Å; L816-Y818 PolarHBondContact O-N 2.92Å; L816-I819 PolarHBondContact O-N 2.86Å; L816-D820 WeakPolarHBondContact O-CB 3.44Å; L816-D820 VanDerWaalsContact O-CG 3.3Å; L816-D820 PolarHBondContact O-N 3.49Å
817	N	81.9	Confident	81.8	Confident	82 Å²	82	29.4 Å²	29.4	44%	0.439	16%	0.157	S	C	.	.	H	α-helix	trans	-58.8	-30.2	176	-66.3	-21.1	0	0	0	113.5	Q813 L814 W815	Q813-N817 PolarHBondContact O-N 3Å; Q813-N817 PolarHBondContact O-ND2 3.46Å; L814-N817 PolarHBondContact O-N 3.49Å; W815-N817 PolarHBondContact O-N 3.23Å
818	Y	84.2	Confident	81	Confident	34 Å²	34	29.8 Å²	29.8	13%	0.133	16%	0.161	C	C	.	.	H	α-helix	trans	-95.6	-23.3	178.2	-64.9	-82.8	0	0	0	113.7	W398 K450 F451 H454 L814 W815 L816	W398-Y818 HydrophobicContact CH2-CD2 4.02Å; W398-Y818 HydrophobicContact CH2-CG 4.31Å; W398-Y818 HydrophobicContact CZ3-CD2 4.41Å; K450-Y818 HydrophobicContact CB-CD1 4.14Å; K450-Y818 WeakPolarHBondContact CD-O 3.45Å; K450-Y818 PolarHBondContact NZ-O 3.3Å; F451-Y818 HydrophobicContact CB-CD1 4.37Å; F451-Y818 HydrophobicContact CB-CD2 4.36Å; F451-Y818 HydrophobicContact CB-CE1 4.43Å; F451-Y818 HydrophobicContact CB-CE2 4.45Å; F451-Y818 HydrophobicContact CB-CG 4.34Å; F451-Y818 HydrophobicContact CD2-CD2 4.12Å; F451-Y818 HydrophobicContact CD2-CE1 4.4Å; F451-Y818 AromaticContact CD2-CE2 3.52Å; F451-Y818 HydrophobicContact CD2-CE2 3.52Å; F451-Y818 AromaticContact CD2-CZ 3.67Å; F451-Y818 HydrophobicContact CE2-CE2 4.27Å; F451-Y818 HydrophobicContact CG-CE2 4.44Å; H454-Y818 HydrophobicContact CB-CE1 4.31Å; H454-Y818 AromaticContact CD2-CE1 3.82Å; L814-Y818 HydrophobicContact CD1-CE2 3.93Å; L814-Y818 HydrophobicContact CG-CE2 4.4Å; L814-Y818 VanDerWaalsContact O-CD2 3.26Å; L814-Y818 WeakPolarHBondContact O-CD2 3.32Å; W815-Y818 PolarHBondContact O-N 3.25Å; L816-Y818 PolarHBondContact O-N 2.92Å
819	I	81.5	Confident	80.3	Confident	5 Å²	5	29.6 Å²	29.6	3%	0.026	16%	0.161	C	C	.	.	H	α-helix	trans	-69.7	-41.9	172.8	-68.5	168.7	0	0	0	110	L370 L394 I397 W398 P447 W815 L816 S862	L370-I819 HydrophobicContact CD2-CG2 4.46Å; L394-I819 HydrophobicContact CD2-CD1 4.42Å; I397-I819 HydrophobicContact CG2-CD1 3.88Å; I397-I819 HydrophobicContact CG2-CG1 4.01Å; I397-I819 HydrophobicContact CG2-CG2 4.04Å; W398-I819 HydrophobicContact CE3-CG1 4.42Å; P447-I819 HydrophobicContact CB-CG1 3.99Å; P447-I819 HydrophobicContact CG-CB 4.48Å; P447-I819 HydrophobicContact CG-CG1 3.83Å; W815-I819 HydrophobicContact CB-CD1 4.31Å; W815-I819 WeakPolarHBondContact O-CG1 3.47Å; W815-I819 PolarHBondContact O-N 3.39Å; L816-I819 PolarHBondContact O-N 2.86Å; I819-S862 PolarHBondContact O-OG 3.02Å
820	D	69.6	Low	79.6	Confident	43 Å²	43	30.6 Å²	30.6	23%	0.23	17%	0.166	C	C	.	.	S	Bend	trans	-64.5	169.6	173.1	-67.2	-4.9	0	0	0	110.2	R374 L816 G822	R374-D820 IonicContact CZ-OD1 3.09Å; R374-D820 IonicContact CZ-OD2 3.77Å; R374-D820 IonicContact NE-OD1 2.6Å; R374-D820 IonicContact NE-OD2 3.01Å; R374-D820 PolarHBondContact NE-OD2 3.32Å; R374-D820 IonicContact NH2-OD1 2.98Å; R374-D820 PolarHBondContact NH2-OD1 2.85Å; R374-D820 IonicContact NH2-OD2 2.83Å; R374-D820 PolarHBondContact NH2-OD2 2.84Å; L816-D820 WeakPolarHBondContact O-CB 3.44Å; L816-D820 VanDerWaalsContact O-CG 3.3Å; L816-D820 PolarHBondContact O-N 3.49Å; D820-G822 PolarHBondContact O-N 3.4Å
821	N	56.6	Low	78.9	Confident	101 Å²	101	32.3 Å²	32.3	54%	0.54	18%	0.175	S	C	.	.	S	Bend	trans	-70.5	50.2	-177	-71.9	-35	0	0	0	113
822	G	58.5	Low	77.9	Confident	30 Å²	30	34.4 Å²	34.4	31%	0.309	19%	0.188	S	C	.	.			trans	-61.2	159.3	168.4	0	0	0	0	0	112.1	D820 T824	D820-G822 PolarHBondContact O-N 3.4Å; G822-T824 PolarHBondContact O-N 3.47Å
823	S	60.4	Low	76.6	Confident	28 Å²	28	37.9 Å²	37.9	20%	0.196	21%	0.211	C	C	.	.			trans	-54.8	111.3	173.8	37.4	0	0	0	0	110	H454 L825	H454-S823 PolarHBondContact NE2-O 3.44Å; S823-L825 PolarHBondContact O-N 2.85Å
824	T	70	Confident	75.5	Confident	28 Å²	28	36.1 Å²	36.1	17%	0.172	21%	0.205	C	C	.	.	S	Bend	trans	-67.4	-18.9	176.1	50.2	0	0	0	0	112.3	Y432 K450 G822	Y432-T824 WeakPolarHBondContact CE1-OG1 3.39Å; Y432-T824 VanDerWaalsContact CZ-OG1 3.27Å; Y432-T824 WeakPolarHBondContact OH-CB 3.45Å; Y432-T824 WeakPolarHBondContact OH-CG2 3.35Å; Y432-T824 PolarHBondContact OH-OG1 2.87Å; K450-T824 HydrophobicContact CD-CG2 4.4Å; G822-T824 PolarHBondContact O-N 3.47Å
825	L	78.1	Confident	74.4	Confident	9 Å²	9	40.1 Å²	40.1	5%	0.047	23%	0.232	C	C	.	.	S	Bend	trans	-97	127.5	-178	-70.5	166.7	0	0	0	110.4	C429 Y432 I433 H454 S823 T834	C429-L825 HydrophobicContact CB-CD2 4.29Å; Y432-L825 HydrophobicContact CD1-CD2 3.76Å; Y432-L825 HydrophobicContact CD1-CG 4.15Å; Y432-L825 HydrophobicContact CE1-CD2 4.4Å; Y432-L825 HydrophobicContact CE1-CG 4.31Å; I433-L825 HydrophobicContact CD1-CD1 4.42Å; I433-L825 HydrophobicContact CD1-CD2 4.33Å; I433-L825 HydrophobicContact CG1-CD1 4.25Å; I433-L825 HydrophobicContact CG1-CD2 4.18Å; H454-L825 PolarHBondContact CE1-O 3.47Å; S823-L825 PolarHBondContact O-N 2.85Å; L825-T834 HydrophobicContact CD1-CG2 4.17Å
826	P	82	Confident	73.3	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-71.2	156.4	172.2	31.5	-35.2	0	0	0	111.1	L425 F829 N830	L425-P826 HydrophobicContact CD1-CG 4.3Å; L425-P826 HydrophobicContact CD2-CG 4.49Å; P826-F829 PolarHBondContact O-N 3.49Å; P826-N830 PolarHBondContact O-N 3.27Å
827	V	82.1	Confident	72.5	Confident	7 Å²	7	47.4 Å²	47.4	4%	0.042	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.3	138.2	169.4	-175.7	0	0	0	0	108.4	S457 W518 L522	S457-V827 WeakPolarHBondContact CB-O 3.15Å; S457-V827 PolarHBondContact OG-O 3.38Å; W518-V827 HydrophobicContact CD2-CG1 4.38Å; W518-V827 HydrophobicContact CG-CG1 3.84Å; W518-V827 VanDerWaalsContact CZ2-O 3.32Å; W518-V827 WeakPolarHBondContact CZ2-O 3.49Å; W518-V827 WeakPolarHBondContact O-CG1 3.5Å; L522-V827 HydrophobicContact CD2-CG2 3.97Å; L522-V827 HydrophobicContact CG-CG1 4.17Å; L522-V827 HydrophobicContact CG-CG2 4.31Å
828	P	77.4	Confident	71.8	Confident	21 Å²	21	46.1 Å²	46.1	14%	0.136	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	cis	-88.2	-7.6	9.7	35.4	-36.2	0	0	0	115.2	L517 W518 N830 V831	L517-P828 HydrophobicContact CD2-CB 4.26Å; L517-P828 HydrophobicContact CG-CB 4.23Å; W518-P828 HydrophobicContact CD2-CB 4.4Å; W518-P828 HydrophobicContact CD2-CG 4.47Å; W518-P828 HydrophobicContact CE3-CB 4.32Å; W518-P828 HydrophobicContact CE3-CG 4.06Å; W518-P828 HydrophobicContact CH2-CG 4.5Å; W518-P828 HydrophobicContact CZ3-CG 4.09Å; P828-N830 PolarHBondContact O-N 2.91Å; P828-N830 VanDerWaalsContact O-N 3.09Å; P828-V831 WeakPolarHBondContact O-CG2 3.27Å; P828-V831 PolarHBondContact O-N 2.9Å
829	F	80.7	Confident	71.1	Confident	44 Å²	44	46.2 Å²	46.2	19%	0.193	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-68	-13.3	-172.2	-60.4	-68.2	0	0	0	114.5	P426 C429 P826 V831 I832	P426-F829 HydrophobicContact CB-CE1 4.46Å; P426-F829 HydrophobicContact CB-CE2 4.19Å; P426-F829 HydrophobicContact CB-CZ 3.65Å; C429-F829 HydrophobicContact CB-CB 4.21Å; C429-F829 HydrophobicContact CB-CD2 3.84Å; C429-F829 HydrophobicContact CB-CE2 4.42Å; C429-F829 HydrophobicContact CB-CG 3.92Å; P826-F829 PolarHBondContact O-N 3.49Å; F829-V831 PolarHBondContact O-N 3.46Å; F829-I832 PolarHBondContact O-N 3.3Å; F829-I832 VanDerWaalsContact O-N 3.17Å
830	N	79	Confident	70.4	Confident	34 Å²	34	49.3 Å²	49.3	18%	0.182	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-61.8	-19.2	172.2	-169.7	41.7	0	0	0	113.8	P826 P828 I832	P826-N830 PolarHBondContact O-N 3.27Å; P828-N830 PolarHBondContact O-N 2.91Å; P828-N830 VanDerWaalsContact O-N 3.09Å; N830-I832 VanDerWaalsContact C-N 3.26Å; N830-I832 PolarHBondContact O-N 3.21Å
831	V	76.2	Confident	70.4	Confident	53 Å²	53	49.6 Å²	49.6	32%	0.321	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-68	-27.9	175.6	-179.4	0	0	0	0	111.5	L517 L524 P828 F829 P833	L517-V831 HydrophobicContact CD1-CG2 4.49Å; L524-V831 HydrophobicContact CD1-CB 4.43Å; L524-V831 HydrophobicContact CD1-CG1 4.46Å; L524-V831 HydrophobicContact CD1-CG2 4.17Å; P828-V831 WeakPolarHBondContact O-CG2 3.27Å; P828-V831 PolarHBondContact O-N 2.9Å; F829-V831 PolarHBondContact O-N 3.46Å; V831-P833 WeakPolarHBondContact O-CD 3.45Å
832	I	73.1	Confident	71.3	Confident	81 Å²	81	50.6 Å²	50.6	42%	0.415	30%	0.303	S	S	.	.	S	Bend	trans	-83.8	109.5	-178.9	-56.2	174.3	0	0	0	108.3	I433 F829 N830 T834	I433-I832 HydrophobicContact CD1-CG2 4.44Å; F829-I832 PolarHBondContact O-N 3.3Å; F829-I832 VanDerWaalsContact O-N 3.17Å; N830-I832 VanDerWaalsContact C-N 3.26Å; N830-I832 PolarHBondContact O-N 3.21Å; I832-T834 PolarHBondContact O-N 2.81Å
833	P	65.5	Low	72.1	Confident	74 Å²	74	55.4 Å²	55.4	48%	0.481	32%	0.316	S	S	.	.			trans	-68.9	133.8	-179.1	30.1	-35	0	0	0	109.8	V831 V838	V831-P833 WeakPolarHBondContact O-CD 3.45Å; P833-V838 HydrophobicContact CB-CG2 3.55Å; P833-V838 HydrophobicContact CG-CG2 3.5Å; P833-V838 VanDerWaalsContact CG-CG2 3.5Å
834	T	65.8	Low	72.5	Confident	40 Å²	40	59.7 Å²	59.7	25%	0.245	33%	0.331	C	S	.	.			trans	-60.5	146.4	172.5	57.8	0	0	0	0	109.6	L825 I832 H836 S837 V838	L825-T834 HydrophobicContact CD1-CG2 4.17Å; I832-T834 PolarHBondContact O-N 2.81Å; T834-H836 PolarHBondContact O-N 2.88Å; T834-S837 CarbonylContact O-C 3.6Å; T834-S837 WeakPolarHBondContact O-CA 3.49Å; T834-S837 WeakPolarHBondContact O-CB 3.5Å; T834-S837 PolarHBondContact O-N 2.79Å; T834-S837 VanDerWaalsContact OG1-CB 3.27Å; T834-S837 WeakPolarHBondContact OG1-CB 3.34Å; T834-S837 PolarHBondContact OG1-N 3.42Å; T834-V838 PolarHBondContact O-N 3.29Å
835	P	65.1	Low	72.7	Confident	90 Å²	90	63.6 Å²	63.6	58%	0.584	35%	0.348	S	S	*	.	H	α-helix	trans	-53.9	-34.4	179.6	-25.2	32.1	0	0	0	112.6	V838 A839	P835-V838 PolarHBondContact O-N 3.43Å; P835-A839 WeakPolarHBondContact O-CB 3.46Å; P835-A839 PolarHBondContact O-N 2.9Å
836	H	67.2	Low	72.6	Confident	132 Å²	132	71.6 Å²	71.6	61%	0.611	38%	0.378	S	S	*	.	H	α-helix	trans	-66.8	-40.9	173.7	-172.5	-87.2	0	0	0	112.7	T834 V838 A839 N840	T834-H836 PolarHBondContact O-N 2.88Å; H836-V838 VanDerWaalsContact C-N 3.35Å; H836-A839 PolarHBondContact O-N 2.9Å; H836-N840 PolarHBondContact CE1-ND2 3.32Å; H836-N840 WeakPolarHBondContact O-CB 3.02Å; H836-N840 PolarHBondContact O-N 3.49Å
837	S	67.7	Low	72	Confident	60 Å²	60	75 Å²	75	42%	0.42	40%	0.396	S	S	.	.	H	α-helix	trans	-65.7	-37.7	173.6	-168	0	0	0	0	111.9	T834 N840 A841	T834-S837 CarbonylContact O-C 3.6Å; T834-S837 WeakPolarHBondContact O-CA 3.49Å; T834-S837 WeakPolarHBondContact O-CB 3.5Å; T834-S837 PolarHBondContact O-N 2.79Å; T834-S837 VanDerWaalsContact OG1-CB 3.27Å; T834-S837 WeakPolarHBondContact OG1-CB 3.34Å; T834-S837 PolarHBondContact OG1-N 3.42Å; S837-N840 PolarHBondContact O-N 3.5Å; S837-A841 WeakPolarHBondContact O-CB 3.29Å; S837-A841 PolarHBondContact O-N 3.26Å
838	V	67.1	Low	71.4	Confident	54 Å²	54	79.2 Å²	79.2	33%	0.327	42%	0.417	S	S	.	.	H	α-helix	trans	-66.4	-43	174.5	-174.1	0	0	0	0	110.1	P833 T834 P835 H836 N840 A841 M842	P833-V838 HydrophobicContact CB-CG2 3.55Å; P833-V838 HydrophobicContact CG-CG2 3.5Å; P833-V838 VanDerWaalsContact CG-CG2 3.5Å; T834-V838 PolarHBondContact O-N 3.29Å; P835-V838 PolarHBondContact O-N 3.43Å; H836-V838 VanDerWaalsContact C-N 3.35Å; V838-N840 PolarHBondContact O-N 2.65Å; V838-A841 PolarHBondContact O-N 3.26Å; V838-M842 HydrophobicContact CG1-CE 3.97Å; V838-M842 HydrophobicContact CG1-CG 4.4Å; V838-M842 HydrophobicContact CG1-SD 4.39Å; V838-M842 WeakPolarHBondContact O-CB 3.27Å; V838-M842 VanDerWaalsContact O-CG 3.29Å; V838-M842 WeakPolarHBondContact O-CG 3.41Å; V838-M842 PolarHBondContact O-N 3.11Å
839	A	70.6	Confident	71.1	Confident	36 Å²	36	86.5 Å²	86.5	30%	0.298	45%	0.447	S	S	.	.	H	α-helix	trans	-62.5	-42.1	175.9	0	0	0	0	0	112.3	P835 H836 M842 K843	P835-A839 WeakPolarHBondContact O-CB 3.46Å; P835-A839 PolarHBondContact O-N 2.9Å; H836-A839 PolarHBondContact O-N 2.9Å; A839-M842 PolarHBondContact O-N 3.4Å; A839-K843 WeakPolarHBondContact O-CB 3.33Å; A839-K843 WeakPolarHBondContact O-CG 3.19Å; A839-K843 PolarHBondContact O-N 3.03Å
840	N	65.9	Low	70	Confident	70 Å²	70	91.2 Å²	91.2	37%	0.374	47%	0.468	S	S	.	.	H	α-helix	trans	-69.9	-36.9	175.3	-77.6	2	0	0	0	112.3	H836 S837 V838 K843 F844	H836-N840 PolarHBondContact CE1-ND2 3.32Å; H836-N840 WeakPolarHBondContact O-CB 3.02Å; H836-N840 PolarHBondContact O-N 3.49Å; S837-N840 PolarHBondContact O-N 3.5Å; V838-N840 PolarHBondContact O-N 2.65Å; N840-K843 PolarHBondContact O-N 3.34Å; N840-F844 VanDerWaalsContact O-CB 3.24Å; N840-F844 WeakPolarHBondContact O-CB 3.26Å; N840-F844 PolarHBondContact O-N 2.94Å
841	A	70.7	Confident	68.5	Low	50 Å²	50	97.4 Å²	97.4	41%	0.413	50%	0.501	S	S	.	.	H	α-helix	trans	-66.9	-39.2	173.6	0	0	0	0	0	111.2	S837 V838 F844 M845	S837-A841 WeakPolarHBondContact O-CB 3.29Å; S837-A841 PolarHBondContact O-N 3.26Å; V838-A841 PolarHBondContact O-N 3.26Å; A841-F844 PolarHBondContact O-N 3.44Å; A841-M845 WeakPolarHBondContact O-CB 3.33Å; A841-M845 VanDerWaalsContact O-CG 3.27Å; A841-M845 WeakPolarHBondContact O-CG 3.08Å; A841-M845 PolarHBondContact O-N 2.89Å
842	M	74.6	Confident	67	Low	121 Å²	121	102.3 Å²	102.3	60%	0.596	52%	0.52	S	S	*	.	H	α-helix	trans	-65.4	-40.7	172.7	-74.3	-172.7	-64.1	0	0	111.4	V838 A839 R846	V838-M842 HydrophobicContact CG1-CE 3.97Å; V838-M842 HydrophobicContact CG1-CG 4.4Å; V838-M842 HydrophobicContact CG1-SD 4.39Å; V838-M842 WeakPolarHBondContact O-CB 3.27Å; V838-M842 VanDerWaalsContact O-CG 3.29Å; V838-M842 WeakPolarHBondContact O-CG 3.41Å; V838-M842 PolarHBondContact O-N 3.11Å; A839-M842 PolarHBondContact O-N 3.4Å; M842-R846 VanDerWaalsContact O-CB 3.24Å; M842-R846 WeakPolarHBondContact O-CB 3.27Å; M842-R846 PolarHBondContact O-N 3.45Å
843	K	74.3	Confident	65.4	Low	132 Å²	132	105.5 Å²	105.5	57%	0.574	54%	0.543	S	S	*	.	H	α-helix	trans	-62.7	-43.3	171	-75.8	177.3	-178.2	179.4	0	111.5	A839 N840 R846 N847	A839-K843 WeakPolarHBondContact O-CB 3.33Å; A839-K843 WeakPolarHBondContact O-CG 3.19Å; A839-K843 PolarHBondContact O-N 3.03Å; N840-K843 PolarHBondContact O-N 3.34Å; K843-R846 CarbonylContact O-C 3.5Å; K843-R846 PolarHBondContact O-N 3.14Å; K843-N847 WeakPolarHBondContact O-CB 3.13Å; K843-N847 PolarHBondContact O-N 3.34Å; K843-N847 PolarHBondContact O-OD1 3.49Å; K843-N847 VanDerWaalsContact O-OD1 3.12Å
844	F	68.6	Low	63.9	Low	118 Å²	118	104.4 Å²	104.4	52%	0.518	55%	0.545	S	S	.	.	H	α-helix	trans	-64.4	-44.8	178.2	-177.2	-106.6	0	0	0	111.6	N840 A841 R846 N847 I848	N840-F844 VanDerWaalsContact O-CB 3.24Å; N840-F844 WeakPolarHBondContact O-CB 3.26Å; N840-F844 PolarHBondContact O-N 2.94Å; A841-F844 PolarHBondContact O-N 3.44Å; F844-R846 VanDerWaalsContact C-N 3.28Å; F844-R846 PolarHBondContact O-N 3.07Å; F844-N847 CarbonylContact O-C 3.37Å; F844-N847 PolarHBondContact O-N 3.38Å; F844-I848 HydrophobicContact CD1-CD1 3.74Å; F844-I848 HydrophobicContact CD1-CG1 4.44Å; F844-I848 HydrophobicContact CE1-CD1 3.23Å; F844-I848 HydrophobicContact CE1-CG1 4.16Å; F844-I848 HydrophobicContact CE2-CD1 4.35Å; F844-I848 HydrophobicContact CG-CD1 4.49Å; F844-I848 HydrophobicContact CZ-CD1 3.59Å; F844-I848 HydrophobicContact CZ-CG1 4.19Å; F844-I848 WeakPolarHBondContact O-CG1 3.45Å; F844-I848 PolarHBondContact O-N 3.07Å
845	M	74.3	Confident	62.3	Low	109 Å²	109	111.6 Å²	111.6	54%	0.537	57%	0.573	S	S	.	*	H	α-helix	trans	-61.3	-38.4	172.4	-72.4	-65	-70.2	0	0	111.3	A841 I848 F849	A841-M845 WeakPolarHBondContact O-CB 3.33Å; A841-M845 VanDerWaalsContact O-CG 3.27Å; A841-M845 WeakPolarHBondContact O-CG 3.08Å; A841-M845 PolarHBondContact O-N 2.89Å; M845-I848 PolarHBondContact O-N 2.88Å; M845-F849 WeakPolarHBondContact O-CD2 3.45Å; M845-F849 PolarHBondContact O-N 3.02Å; M845-F849 VanDerWaalsContact O-N 3.1Å
846	R	76.4	Confident	60.8	Low	178 Å²	178	112.9 Å²	112.9	67%	0.672	58%	0.579	S	S	*	*	H	α-helix	trans	-70.3	-33.2	176.4	-157.3	174.4	-169	168.7	1.8	112.8	M842 K843 F844 F849 K850	M842-R846 VanDerWaalsContact O-CB 3.24Å; M842-R846 WeakPolarHBondContact O-CB 3.27Å; M842-R846 PolarHBondContact O-N 3.45Å; K843-R846 CarbonylContact O-C 3.5Å; K843-R846 PolarHBondContact O-N 3.14Å; F844-R846 VanDerWaalsContact C-N 3.28Å; F844-R846 PolarHBondContact O-N 3.07Å; R846-F849 CarbonylContact O-C 3.56Å; R846-F849 PolarHBondContact O-N 3.37Å; R846-K850 WeakPolarHBondContact O-CB 3.26Å; R846-K850 PolarHBondContact O-N 2.92Å
847	N	68.9	Low	59	Low	72 Å²	72	111.2 Å²	111.2	39%	0.385	58%	0.583	S	S	.	*	H	α-helix	trans	-80.4	-23	175.1	-68.5	9.4	0	0	0	112.3	K843 F844 F849 K850	K843-N847 WeakPolarHBondContact O-CB 3.13Å; K843-N847 PolarHBondContact O-N 3.34Å; K843-N847 PolarHBondContact O-OD1 3.49Å; K843-N847 VanDerWaalsContact O-OD1 3.12Å; F844-N847 CarbonylContact O-C 3.37Å; F844-N847 PolarHBondContact O-N 3.38Å; N847-F849 VanDerWaalsContact C-N 3.33Å; N847-K850 CarbonylContact C-O 3.54Å; N847-K850 CarbonylContact O-C 3.53Å
848	I	70.2	Confident	57.3	Low	94 Å²	94	110.9 Å²	110.9	48%	0.482	59%	0.589	S	S	.	*	H	α-helix	trans	-71.2	-35.2	166.6	-75.5	177	0	0	0	109.8	F844 M845	F844-I848 HydrophobicContact CD1-CD1 3.74Å; F844-I848 HydrophobicContact CD1-CG1 4.44Å; F844-I848 HydrophobicContact CE1-CD1 3.23Å; F844-I848 HydrophobicContact CE1-CG1 4.16Å; F844-I848 HydrophobicContact CE2-CD1 4.35Å; F844-I848 HydrophobicContact CG-CD1 4.49Å; F844-I848 HydrophobicContact CZ-CD1 3.59Å; F844-I848 HydrophobicContact CZ-CG1 4.19Å; F844-I848 WeakPolarHBondContact O-CG1 3.45Å; F844-I848 PolarHBondContact O-N 3.07Å; M845-I848 PolarHBondContact O-N 2.88Å
849	F	71.3	Confident	55.6	Low	174 Å²	174	114.2 Å²	114.2	76%	0.763	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.5	-9.4	176.7	-94	-83.3	0	0	0	114.7	M845 R846 N847	M845-F849 WeakPolarHBondContact O-CD2 3.45Å; M845-F849 PolarHBondContact O-N 3.02Å; M845-F849 VanDerWaalsContact O-N 3.1Å; R846-F849 CarbonylContact O-C 3.56Å; R846-F849 PolarHBondContact O-N 3.37Å; N847-F849 VanDerWaalsContact C-N 3.33Å
850	K	58	Low	53.8	Low	143 Å²	143	116.3 Å²	116.3	62%	0.622	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.7	104.8	173	-79	-173.6	168.7	-165.2	0	107.1	R846 N847 E852	R846-K850 WeakPolarHBondContact O-CB 3.26Å; R846-K850 PolarHBondContact O-N 2.92Å; N847-K850 CarbonylContact C-O 3.54Å; N847-K850 CarbonylContact O-C 3.53Å; K850-E852 PolarHBondContact O-N 3.32Å
851	D	47.3	Very low	52.9	Low	164 Å²	164	122.2 Å²	122.2	88%	0.877	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.7	61.1	-178.1	-79.9	-35.1	0	0	0	115.6
852	E	44.9	Very low	51.9	Low	156 Å²	156	122 Å²	122	73%	0.729	62%	0.623	S	S	*	*			trans	-124.8	94.5	167.5	-77	-172	171.5	0	0	107	K850 G854	K850-E852 PolarHBondContact O-N 3.32Å; E852-G854 PolarHBondContact O-N 2.88Å
853	V	39.4	Very low	50.8	Low	149 Å²	149	117.1 Å²	117.1	90%	0.903	60%	0.599	S	S	*	*			trans	-71	67	167.2	-170.2	0	0	0	0	108.1	F855	V853-F855 PolarHBondContact O-N 3.27Å
854	G	34.1	Very low	49.8	Very low	50 Å²	50	113.8 Å²	113.8	52%	0.515	59%	0.588	S	S	.	*			trans	-77.3	100.5	164.7	0	0	0	0	0	108.1	E852 V856	E852-G854 PolarHBondContact O-N 2.88Å; G854-V856 PolarHBondContact O-N 3.04Å
855	F	32.7	Very low	49.2	Very low	191 Å²	191	111.2 Å²	111.2	84%	0.838	58%	0.577	S	S	*	*			trans	-58.9	99.8	169.6	-170	-96.2	0	0	0	108.2	V853 S857	V853-F855 PolarHBondContact O-N 3.27Å; F855-S857 PolarHBondContact O-N 3.33Å
856	V	33.1	Very low	48.5	Very low	118 Å²	118	107 Å²	107	72%	0.715	56%	0.557	S	S	*	*			trans	-67.8	101	174.3	176.1	0	0	0	0	106.8	G854 G858	G854-V856 PolarHBondContact O-N 3.04Å; V856-G858 VanDerWaalsContact C-N 3.29Å; V856-G858 PolarHBondContact O-N 3.34Å
857	S	29.8	Very low	47.8	Very low	97 Å²	97	101.1 Å²	101.1	68%	0.678	54%	0.536	S	S	*	.			trans	-61.3	96	165.4	-170.1	0	0	0	0	107.9	F855 N859	F855-S857 PolarHBondContact O-N 3.33Å; S857-N859 PolarHBondContact O-N 2.64Å
858	G	31.9	Very low	47.5	Very low	53 Å²	53	100.7 Å²	100.7	55%	0.546	54%	0.536	S	S	.	.			trans	-74.3	103.6	-177.3	0	0	0	0	0	110.4	V856 I860	V856-G858 VanDerWaalsContact C-N 3.29Å; V856-G858 PolarHBondContact O-N 3.34Å; G858-I860 PolarHBondContact O-N 2.86Å
859	N	30.1	Very low	47.2	Very low	124 Å²	124	103.4 Å²	103.4	66%	0.663	54%	0.54	S	S	*	.			trans	-9.9	95.5	163.6	-80.7	-33.3	0	0	0	115.2	S857 R861	S857-N859 PolarHBondContact O-N 2.64Å; N859-R861 PolarHBondContact O-N 2.7Å; N859-R861 VanDerWaalsContact O-N 3.13Å
860	I	34.3	Very low	46.9	Very low	80 Å²	80	97.4 Å²	97.4	41%	0.41	51%	0.513	S	S	.	.			trans	-74.3	95.8	165	-60.6	164.5	0	0	0	106.3	G858	G858-I860 PolarHBondContact O-N 2.86Å
861	R	45.8	Very low	47.3	Very low	193 Å²	193	94.4 Å²	94.4	73%	0.728	50%	0.503	S	S	*	.			trans	-125.6	7.8	-177.4	-102.9	-176.6	174.7	169.6	0.4	114.3	N859	N859-R861 PolarHBondContact O-N 2.7Å; N859-R861 VanDerWaalsContact O-N 3.13Å
862	S	49.7	Very low	48.3	Very low	46 Å²	46	92 Å²	92	32%	0.322	49%	0.485	S	S	.	.	S	Bend	trans	-87.3	-13.9	-173.9	79	0	0	0	0	115.1	I819	I819-S862 PolarHBondContact O-OG 3.02Å
863	T	52	Low	49.4	Very low	18 Å²	18	87.7 Å²	87.7	11%	0.11	47%	0.47	C	S	.	.	S	Bend	trans	-107.9	-6.7	-172.4	52.5	0	0	0	0	114.4	P369 F865	P369-T863 WeakPolarHBondContact CD-OG1 3.29Å; P369-T863 HydrophobicContact CG-CG2 3.86Å; P369-T863 WeakPolarHBondContact CG-OG1 3.16Å; T863-F865 PolarHBondContact O-N 3.1Å
864	D	52.3	Low	50.9	Low	63 Å²	63	81.8 Å²	81.8	34%	0.337	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-3.6	178.5	-76.9	-24.6	0	0	0	114	V866 K867 V868	D864-V866 VanDerWaalsContact C-N 3.31Å; D864-V866 PolarHBondContact O-N 2.67Å; D864-K867 PolarHBondContact O-N 2.93Å; D864-V868 HydrophobicContact CB-CG2 4.11Å; D864-V868 VanDerWaalsContact O-CB 3.3Å; D864-V868 WeakPolarHBondContact O-CB 3.38Å; D864-V868 WeakPolarHBondContact O-CG2 3.18Å; D864-V868 PolarHBondContact O-N 3.06Å
865	F	57.1	Low	52.8	Low	63 Å²	63	87 Å²	87	28%	0.276	44%	0.442	S	S	.	.	H	α-helix	trans	-62.2	-34.9	-174.1	80.7	-81.5	0	0	0	113	I397 T863 R869	I397-F865 HydrophobicContact CB-CE1 3.93Å; I397-F865 HydrophobicContact CB-CZ 3.68Å; I397-F865 HydrophobicContact CG1-CE1 3.69Å; I397-F865 HydrophobicContact CG1-CZ 3.41Å; I397-F865 VanDerWaalsContact CG1-CZ 3.41Å; I397-F865 HydrophobicContact CG2-CE1 3.66Å; I397-F865 HydrophobicContact CG2-CZ 3.94Å; T863-F865 PolarHBondContact O-N 3.1Å; F865-R869 WeakPolarHBondContact O-CB 3.44Å; F865-R869 PolarHBondContact O-N 3.22Å
866	V	59.8	Low	54.9	Low	21 Å²	21	84.5 Å²	84.5	13%	0.127	44%	0.437	C	S	.	.	H	α-helix	trans	-68.9	-47.3	175.5	-173.7	0	0	0	0	110.1	I397 D864 R869 R870	I397-V866 HydrophobicContact CG1-CG2 4.5Å; D864-V866 VanDerWaalsContact C-N 3.31Å; D864-V866 PolarHBondContact O-N 2.67Å; V866-R869 WeakPolarHBondContact O-CB 3.47Å; V866-R869 PolarHBondContact O-N 3.03Å; V866-R870 PolarHBondContact O-N 3.34Å
867	K	62.1	Low	57.1	Low	54 Å²	54	85.9 Å²	85.9	24%	0.235	43%	0.434	C	S	.	.	H	α-helix	trans	-60.7	-51.1	179	-68.7	-176.4	-178.4	174.1	0	110.5	E353 D864 R869 R870 D871	E353-K867 WeakPolarHBondContact OE1-CE 3.37Å; D864-K867 PolarHBondContact O-N 2.93Å; K867-R869 PolarHBondContact O-N 2.89Å; K867-R870 CarbonylContact O-C 3.59Å; K867-R870 WeakPolarHBondContact O-CA 3.27Å; K867-R870 WeakPolarHBondContact O-CB 3.38Å; K867-R870 PolarHBondContact O-N 3.42Å; K867-D871 WeakPolarHBondContact O-CB 3.17Å; K867-D871 PolarHBondContact O-N 2.81Å
868	V	62.2	Low	58.7	Low	64 Å²	64	88.4 Å²	88.4	39%	0.388	44%	0.44	S	S	.	.	H	α-helix	trans	-57.4	-36	175.7	172.9	0	0	0	0	111.8	D864 K872	D864-V868 HydrophobicContact CB-CG2 4.11Å; D864-V868 VanDerWaalsContact O-CB 3.3Å; D864-V868 WeakPolarHBondContact O-CB 3.38Å; D864-V868 WeakPolarHBondContact O-CG2 3.18Å; D864-V868 PolarHBondContact O-N 3.06Å; V868-K872 HydrophobicContact CG1-CD 4.31Å; V868-K872 HydrophobicContact CG1-CG 4.48Å; V868-K872 VanDerWaalsContact O-CB 3.29Å; V868-K872 WeakPolarHBondContact O-CB 3.44Å; V868-K872 WeakPolarHBondContact O-CG 3.48Å; V868-K872 PolarHBondContact O-N 2.85Å
869	R	63.3	Low	60.6	Low	150 Å²	150	90.3 Å²	90.3	57%	0.566	44%	0.437	S	S	*	.	H	α-helix	trans	-68.3	-45.6	174.7	-174.2	-176.4	-179	97.7	-0.2	111.3	F865 V866 K867 D871 K872 V873	F865-R869 WeakPolarHBondContact O-CB 3.44Å; F865-R869 PolarHBondContact O-N 3.22Å; V866-R869 WeakPolarHBondContact O-CB 3.47Å; V866-R869 PolarHBondContact O-N 3.03Å; K867-R869 PolarHBondContact O-N 2.89Å; R869-D871 VanDerWaalsContact C-N 3.35Å; R869-K872 PolarHBondContact O-N 2.87Å; R869-V873 WeakPolarHBondContact O-CG2 3.24Å; R869-V873 PolarHBondContact O-N 2.94Å
870	R	64.5	Low	62	Low	49 Å²	49	91.4 Å²	91.4	19%	0.185	45%	0.448	C	S	.	.	H	α-helix	trans	-59.8	-50	176.3	-162.7	-179.1	-77.9	130.8	-6	109	T349 E353 V866 K867 K872 V873 V874	T349-R870 PolarHBondContact OG1-NH2 3.15Å; E353-R870 IonicContact OE2-CZ 3.04Å; E353-R870 IonicContact OE2-NH1 3.55Å; E353-R870 PolarHBondContact OE2-NH1 3.2Å; E353-R870 IonicContact OE2-NH2 2.78Å; V866-R870 PolarHBondContact O-N 3.34Å; K867-R870 CarbonylContact O-C 3.59Å; K867-R870 WeakPolarHBondContact O-CA 3.27Å; K867-R870 WeakPolarHBondContact O-CB 3.38Å; K867-R870 PolarHBondContact O-N 3.42Å; R870-K872 VanDerWaalsContact C-N 3.32Å; R870-K872 PolarHBondContact O-N 2.81Å; R870-V873 PolarHBondContact O-N 3.44Å; R870-V873 VanDerWaalsContact O-N 3.09Å; R870-V874 HydrophobicContact CG-CG2 4.47Å; R870-V874 WeakPolarHBondContact O-CB 3.32Å; R870-V874 WeakPolarHBondContact O-CG2 3.5Å; R870-V874 PolarHBondContact O-N 3.39Å
871	D	66.2	Low	63.2	Low	79 Å²	79	91.3 Å²	91.3	42%	0.422	45%	0.448	S	S	.	.	H	α-helix	trans	-61.2	-36.6	178.3	-60.4	-14.5	0	0	0	112.7	K867 R869 V874 K875	K867-D871 WeakPolarHBondContact O-CB 3.17Å; K867-D871 PolarHBondContact O-N 2.81Å; R869-D871 VanDerWaalsContact C-N 3.35Å; D871-V874 PolarHBondContact O-N 2.82Å; D871-K875 VanDerWaalsContact O-CB 3.31Å; D871-K875 WeakPolarHBondContact O-CB 3.46Å; D871-K875 VanDerWaalsContact O-CG 3.22Å; D871-K875 WeakPolarHBondContact O-CG 3.38Å; D871-K875 PolarHBondContact O-N 2.79Å
872	K	68.3	Low	63.9	Low	115 Å²	115	90.4 Å²	90.4	50%	0.5	45%	0.452	S	S	.	.	H	α-helix	trans	-63.8	-47.8	172.2	-82.4	177.5	-179.8	-171.4	0	111.7	V868 R869 R870 V874 K875 D876	V868-K872 HydrophobicContact CG1-CD 4.31Å; V868-K872 HydrophobicContact CG1-CG 4.48Å; V868-K872 VanDerWaalsContact O-CB 3.29Å; V868-K872 WeakPolarHBondContact O-CB 3.44Å; V868-K872 WeakPolarHBondContact O-CG 3.48Å; V868-K872 PolarHBondContact O-N 2.85Å; R869-K872 PolarHBondContact O-N 2.87Å; R870-K872 VanDerWaalsContact C-N 3.32Å; R870-K872 PolarHBondContact O-N 2.81Å; K872-V874 VanDerWaalsContact C-N 3.25Å; K872-V874 PolarHBondContact O-N 2.8Å; K872-K875 PolarHBondContact O-N 3.42Å; K872-D876 VanDerWaalsContact O-CB 3.28Å; K872-D876 WeakPolarHBondContact O-CB 3.33Å; K872-D876 PolarHBondContact O-N 3.17Å
873	V	69.3	Low	64.4	Low	65 Å²	65	97 Å²	97	39%	0.394	48%	0.478	S	S	.	.	H	α-helix	trans	-65.2	-34.6	178	174.8	0	0	0	0	111.2	R869 R870 K877	R869-V873 WeakPolarHBondContact O-CG2 3.24Å; R869-V873 PolarHBondContact O-N 2.94Å; R870-V873 PolarHBondContact O-N 3.44Å; R870-V873 VanDerWaalsContact O-N 3.09Å; V873-K877 HydrophobicContact CG1-CD 4.06Å; V873-K877 VanDerWaalsContact O-CB 3.28Å; V873-K877 WeakPolarHBondContact O-CB 3.48Å; V873-K877 WeakPolarHBondContact O-CG 3.44Å; V873-K877 PolarHBondContact O-N 2.95Å
874	V	69.8	Low	65	Low	25 Å²	25	98.3 Å²	98.3	15%	0.152	49%	0.486	C	S	.	.	H	α-helix	trans	-66.8	-44.5	177	170.8	0	0	0	0	111	R870 D871 K872 K877 D878 L879 I881	R870-V874 HydrophobicContact CG-CG2 4.47Å; R870-V874 WeakPolarHBondContact O-CB 3.32Å; R870-V874 WeakPolarHBondContact O-CG2 3.5Å; R870-V874 PolarHBondContact O-N 3.39Å; D871-V874 PolarHBondContact O-N 2.82Å; K872-V874 VanDerWaalsContact C-N 3.25Å; K872-V874 PolarHBondContact O-N 2.8Å; V874-K877 PolarHBondContact O-N 3.42Å; V874-D878 WeakPolarHBondContact O-CA 3.5Å; V874-D878 PolarHBondContact O-N 3.42Å; V874-L879 HydrophobicContact CG1-CB 4.31Å; V874-L879 WeakPolarHBondContact CG1-O 3.31Å; V874-L879 PolarHBondContact O-N 2.98Å; V874-I881 HydrophobicContact CB-CD1 4.46Å; V874-I881 HydrophobicContact CG1-CD1 4.4Å; V874-I881 HydrophobicContact CG1-CG1 4.16Å; V874-I881 HydrophobicContact CG2-CD1 3.19Å; V874-I881 HydrophobicContact CG2-CG1 3.8Å
875	K	74.4	Confident	66	Low	160 Å²	160	97.5 Å²	97.5	70%	0.696	49%	0.485	S	S	*	.	H	α-helix	trans	-68	-39.6	173.8	-73.9	176.4	-179	-175.7	0	112.5	D871 K872 K877	D871-K875 VanDerWaalsContact O-CB 3.31Å; D871-K875 WeakPolarHBondContact O-CB 3.46Å; D871-K875 VanDerWaalsContact O-CG 3.22Å; D871-K875 WeakPolarHBondContact O-CG 3.38Å; D871-K875 PolarHBondContact O-N 2.79Å; K872-K875 PolarHBondContact O-N 3.42Å; K875-K877 PolarHBondContact O-N 2.85Å
876	D	78	Confident	66.9	Low	137 Å²	137	95.8 Å²	95.8	73%	0.733	48%	0.478	S	S	*	.	H	α-helix	trans	-70.5	-22	179.4	-71.7	-10.8	0	0	0	112.2	K872	K872-D876 VanDerWaalsContact O-CB 3.28Å; K872-D876 WeakPolarHBondContact O-CB 3.33Å; K872-D876 PolarHBondContact O-N 3.17Å
877	K	77.8	Confident	67.9	Low	148 Å²	148	97.8 Å²	97.8	64%	0.643	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	8.1	-178.6	-65.8	-172.8	174.4	-173.4	0	114.2	V873 V874 K875 L879	V873-K877 HydrophobicContact CG1-CD 4.06Å; V873-K877 VanDerWaalsContact O-CB 3.28Å; V873-K877 WeakPolarHBondContact O-CB 3.48Å; V873-K877 WeakPolarHBondContact O-CG 3.44Å; V873-K877 PolarHBondContact O-N 2.95Å; V874-K877 PolarHBondContact O-N 3.42Å; K875-K877 PolarHBondContact O-N 2.85Å; K877-L879 HydrophobicContact CB-CD1 3.76Å; K877-L879 HydrophobicContact CB-CG 3.9Å; K877-L879 HydrophobicContact CD-CD1 4.18Å; K877-L879 PolarHBondContact O-N 2.77Å; K877-L879 VanDerWaalsContact O-N 3.15Å
878	D	63.1	Low	69	Low	150 Å²	150	98.4 Å²	98.4	80%	0.802	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.4	42.8	-176.3	-69.3	-34.4	0	0	0	114	V874	V874-D878 WeakPolarHBondContact O-CA 3.5Å; V874-D878 PolarHBondContact O-N 3.42Å
879	L	73.2	Confident	70.1	Confident	92 Å²	92	95.8 Å²	95.8	48%	0.482	48%	0.482	S	S	.	.			trans	-84.4	125.4	179.6	-68.8	161.1	0	0	0	109.8	V874 K877 I881	V874-L879 HydrophobicContact CG1-CB 4.31Å; V874-L879 WeakPolarHBondContact CG1-O 3.31Å; V874-L879 PolarHBondContact O-N 2.98Å; K877-L879 HydrophobicContact CB-CD1 3.76Å; K877-L879 HydrophobicContact CB-CG 3.9Å; K877-L879 HydrophobicContact CD-CD1 4.18Å; K877-L879 PolarHBondContact O-N 2.77Å; K877-L879 VanDerWaalsContact O-N 3.15Å; L879-I881 PolarHBondContact O-N 2.98Å
880	T	58.5	Low	71.3	Confident	147 Å²	147	88.9 Å²	88.9	90%	0.902	46%	0.456	S	S	*	.			trans	-81.6	97.7	168.4	53.6	0	0	0	0	109.2
881	I	60.7	Low	72.4	Confident	79 Å²	79	92.1 Å²	92.1	41%	0.405	47%	0.473	S	S	.	.			trans	-85.8	115.6	171.9	-60.5	-164.9	0	0	0	108.7	V874 L879 E883	V874-I881 HydrophobicContact CB-CD1 4.46Å; V874-I881 HydrophobicContact CG1-CD1 4.4Å; V874-I881 HydrophobicContact CG1-CG1 4.16Å; V874-I881 HydrophobicContact CG2-CD1 3.19Å; V874-I881 HydrophobicContact CG2-CG1 3.8Å; L879-I881 PolarHBondContact O-N 2.98Å; I881-E883 PolarHBondContact O-N 3.04Å
882	Q	60.4	Low	73.6	Confident	173 Å²	173	93.6 Å²	93.6	81%	0.808	47%	0.473	S	S	*	.			trans	-71.9	116.5	163.5	-167.8	171.4	11.8	0	0	107.7	T884	Q882-T884 PolarHBondContact O-N 3.26Å
883	E	59.1	Low	74.7	Confident	186 Å²	186	88.1 Å²	88.1	87%	0.869	45%	0.45	S	S	*	.			trans	-62.2	103.7	173	-68	-170.2	163.5	0	0	108.2	I881 S885	I881-E883 PolarHBondContact O-N 3.04Å; E883-S885 PolarHBondContact O-N 3.06Å
884	T	65.8	Low	75.8	Confident	45 Å²	45	86 Å²	86	28%	0.276	44%	0.436	S	S	.	.			trans	-68.2	127.5	175.7	51.1	0	0	0	0	108.4	Q882 I889	Q882-T884 PolarHBondContact O-N 3.26Å; T884-I889 WeakPolarHBondContact OG1-CD1 3.36Å
885	S	72.7	Confident	76.8	Confident	46 Å²	46	91.7 Å²	91.7	32%	0.322	46%	0.455	S	S	.	.			trans	-61.3	148.9	176.4	73.7	0	0	0	0	110	E883 S887 D888 I889	E883-S885 PolarHBondContact O-N 3.06Å; S885-S887 PolarHBondContact O-N 3.46Å; S885-S887 PolarHBondContact OG-OG 2.93Å; S885-D888 PolarHBondContact N-OD2 3.39Å; S885-D888 PolarHBondContact O-N 3.26Å; S885-D888 PolarHBondContact OG-N 2.78Å; S885-D888 PolarHBondContact OG-OD1 3.43Å; S885-D888 PolarHBondContact OG-OD2 2.82Å; S885-I889 PolarHBondContact O-N 3.47Å; S885-I889 VanDerWaalsContact O-N 3.16Å
886	H	75.8	Confident	77.8	Confident	27 Å²	27	86.6 Å²	86.6	13%	0.125	43%	0.431	C	S	.	.	H	α-helix	trans	-56.2	-38	177.9	174	-88.8	0	0	0	111.5	D302 A354 F359 R372 D888 I889 M890	D302-H886 IonicContact OD2-CE1 3.13Å; A354-H886 PolarHBondContact O-CD2 3.12Å; A354-H886 PolarHBondContact O-NE2 3.25Å; F359-H886 HydrophobicContact CE2-CB 3.61Å; F359-H886 AromaticContact CE2-CG 3.72Å; F359-H886 HydrophobicContact CZ-CB 3.77Å; R372-H886 PolarHBondContact NH2-CE1 2.87Å; R372-H886 PolarHBondContact NH2-NE2 3.01Å; R372-H886 VanDerWaalsContact NH2-NE2 3.14Å; H886-D888 PolarHBondContact O-N 2.85Å; H886-I889 PolarHBondContact O-N 3.3Å; H886-M890 WeakPolarHBondContact O-CB 3.48Å; H886-M890 PolarHBondContact O-N 2.84Å
887	S	80.9	Confident	78.5	Confident	63 Å²	63	80.4 Å²	80.4	44%	0.441	40%	0.398	S	S	.	.	H	α-helix	trans	-59.8	-42.4	174.5	42.4	0	0	0	0	112.5	S885 I889 M890 Q891	S885-S887 PolarHBondContact O-N 3.46Å; S885-S887 PolarHBondContact OG-OG 2.93Å; S887-I889 VanDerWaalsContact C-N 3.33Å; S887-I889 PolarHBondContact O-N 2.9Å; S887-M890 PolarHBondContact O-N 3.42Å; S887-Q891 WeakPolarHBondContact O-CB 3.33Å; S887-Q891 WeakPolarHBondContact O-CG 3.32Å; S887-Q891 PolarHBondContact O-N 2.84Å
888	D	85.1	Confident	79.2	Confident	66 Å²	66	74.5 Å²	74.5	35%	0.353	37%	0.373	S	S	.	.	H	α-helix	trans	-66	-38.8	178.7	-60.5	-31.9	0	0	0	111.5	S885 H886 R892	S885-D888 PolarHBondContact N-OD2 3.39Å; S885-D888 PolarHBondContact O-N 3.26Å; S885-D888 PolarHBondContact OG-N 2.78Å; S885-D888 PolarHBondContact OG-OD1 3.43Å; S885-D888 PolarHBondContact OG-OD2 2.82Å; H886-D888 PolarHBondContact O-N 2.85Å; D888-R892 WeakPolarHBondContact O-CG 3.24Å; D888-R892 PolarHBondContact O-N 3.4Å; D888-R892 VanDerWaalsContact O-N 3.07Å
889	I	86.2	Confident	80.5	Confident	9 Å²	9	73.6 Å²	73.6	5%	0.046	36%	0.362	C	S	.	.	H	α-helix	trans	-63.9	-45.8	175.8	-62.1	172.4	0	0	0	109.7	E351 A354 T884 S885 H886 S887 R892 L893	E351-I889 HydrophobicContact CB-CG2 4.2Å; E351-I889 HydrophobicContact CG-CG2 4.1Å; A354-I889 HydrophobicContact CB-CB 4.23Å; A354-I889 HydrophobicContact CB-CD1 3.63Å; A354-I889 HydrophobicContact CB-CG2 3.78Å; T884-I889 WeakPolarHBondContact OG1-CD1 3.36Å; S885-I889 PolarHBondContact O-N 3.47Å; S885-I889 VanDerWaalsContact O-N 3.16Å; H886-I889 PolarHBondContact O-N 3.3Å; S887-I889 VanDerWaalsContact C-N 3.33Å; S887-I889 PolarHBondContact O-N 2.9Å; I889-R892 WeakPolarHBondContact O-CB 3.42Å; I889-R892 PolarHBondContact O-N 3.16Å; I889-L893 HydrophobicContact CG2-CD1 4.31Å; I889-L893 WeakPolarHBondContact O-CG 3.42Å; I889-L893 PolarHBondContact O-N 2.93Å
890	M	86.5	Confident	81.4	Confident	5 Å²	5	72 Å²	72	3%	0.025	35%	0.352	C	S	.	.	H	α-helix	trans	-64.7	-43.9	-179.2	-165.4	55.6	74.5	0	0	111.9	D302 P303 I304 H886 S887 R892 L893 V894	D302-M890 WeakPolarHBondContact OD1-CE 3.37Å; P303-M890 HydrophobicContact CG-CG 4.05Å; P303-M890 HydrophobicContact CG-SD 3.65Å; I304-M890 HydrophobicContact CD1-CE 4.14Å; I304-M890 HydrophobicContact CG1-CE 4.39Å; H886-M890 WeakPolarHBondContact O-CB 3.48Å; H886-M890 PolarHBondContact O-N 2.84Å; S887-M890 PolarHBondContact O-N 3.42Å; M890-R892 VanDerWaalsContact C-N 3.29Å; M890-R892 PolarHBondContact O-N 3.28Å; M890-L893 PolarHBondContact O-N 3.33Å; M890-L893 VanDerWaalsContact O-N 3.12Å; M890-L893 HydrophobicContact SD-CD1 4.45Å; M890-V894 WeakPolarHBondContact O-CG2 3.35Å; M890-V894 PolarHBondContact O-N 3.48Å
891	Q	89.1	Confident	82.7	Confident	117 Å²	117	65.2 Å²	65.2	55%	0.547	31%	0.31	S	S	.	.	H	α-helix	trans	-59.7	-38	174.3	-74.5	-178.9	2.5	0	0	112.5	S887 R895	S887-Q891 WeakPolarHBondContact O-CB 3.33Å; S887-Q891 WeakPolarHBondContact O-CG 3.32Å; S887-Q891 PolarHBondContact O-N 2.84Å; Q891-R895 VanDerWaalsContact O-CB 3.3Å; Q891-R895 WeakPolarHBondContact O-CB 2.9Å; Q891-R895 PolarHBondContact O-N 3.21Å
892	R	90.2	Very high	84	Confident	110 Å²	110	64.6 Å²	64.6	42%	0.415	31%	0.305	S	S	.	.	H	α-helix	trans	-65.5	-40.7	174.8	-71.6	168.5	-167.9	176.9	4.8	111.9	D888 I889 M890 R896	D888-R892 WeakPolarHBondContact O-CG 3.24Å; D888-R892 PolarHBondContact O-N 3.4Å; D888-R892 VanDerWaalsContact O-N 3.07Å; I889-R892 WeakPolarHBondContact O-CB 3.42Å; I889-R892 PolarHBondContact O-N 3.16Å; M890-R892 VanDerWaalsContact C-N 3.29Å; M890-R892 PolarHBondContact O-N 3.28Å; R892-R896 VanDerWaalsContact O-CG 3.31Å; R892-R896 WeakPolarHBondContact O-CG 3.27Å; R892-R896 PolarHBondContact O-N 3.02Å
893	L	91.6	Very high	85.3	Confident	1 Å²	1	64.8 Å²	64.8	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-66.4	-47.3	177.1	-70.1	173.8	0	0	0	111.3	L345 V355 I889 M890 R895 R896 Y897	L345-L893 HydrophobicContact CB-CD2 4.37Å; V355-L893 HydrophobicContact CG2-CD1 3.56Å; I889-L893 HydrophobicContact CG2-CD1 4.31Å; I889-L893 WeakPolarHBondContact O-CG 3.42Å; I889-L893 PolarHBondContact O-N 2.93Å; M890-L893 PolarHBondContact O-N 3.33Å; M890-L893 VanDerWaalsContact O-N 3.12Å; M890-L893 HydrophobicContact SD-CD1 4.45Å; L893-R895 VanDerWaalsContact C-N 3.34Å; L893-R895 PolarHBondContact O-N 2.89Å; L893-R896 WeakPolarHBondContact O-CB 3.25Å; L893-R896 PolarHBondContact O-N 3.28Å; L893-Y897 PolarHBondContact O-N 3.46Å
894	V	92	Very high	86.5	Confident	19 Å²	19	59.5 Å²	59.5	12%	0.115	27%	0.274	C	S	.	.	H	α-helix	trans	-57.4	-46.6	175.2	168.7	0	0	0	0	110.9	A297 P303 M890 R896 Y897 L898	A297-V894 HydrophobicContact CB-CG1 4.22Å; A297-V894 VanDerWaalsContact O-CG1 3.31Å; A297-V894 WeakPolarHBondContact O-CG1 3.44Å; P303-V894 HydrophobicContact CG-CG2 3.94Å; M890-V894 WeakPolarHBondContact O-CG2 3.35Å; M890-V894 PolarHBondContact O-N 3.48Å; V894-R896 PolarHBondContact O-N 2.77Å; V894-Y897 WeakPolarHBondContact O-CA 3.45Å; V894-Y897 WeakPolarHBondContact O-CB 3.48Å; V894-Y897 PolarHBondContact O-N 3.18Å; V894-L898 HydrophobicContact CG1-CD1 3.95Å; V894-L898 HydrophobicContact CG1-CG 4.31Å; V894-L898 WeakPolarHBondContact O-CG 3.43Å; V894-L898 PolarHBondContact O-N 3.44Å
895	R	92.8	Very high	87.2	Confident	145 Å²	145	59.4 Å²	59.4	55%	0.547	27%	0.272	S	S	.	.	H	α-helix	trans	-60.2	-44.5	177.2	-174.9	178.9	-67	133.7	1.7	112	Q891 L893 Y897 L898 F899	Q891-R895 VanDerWaalsContact O-CB 3.3Å; Q891-R895 WeakPolarHBondContact O-CB 2.9Å; Q891-R895 PolarHBondContact O-N 3.21Å; L893-R895 VanDerWaalsContact C-N 3.34Å; L893-R895 PolarHBondContact O-N 2.89Å; R895-Y897 PolarHBondContact O-N 3.02Å; R895-L898 PolarHBondContact O-N 2.77Å; R895-F899 HydrophobicContact CG-CD2 3.83Å; R895-F899 HydrophobicContact CG-CE2 3.49Å; R895-F899 VanDerWaalsContact CG-CE2 3.49Å; R895-F899 WeakPolarHBondContact O-CD2 3.37Å; R895-F899 PolarHBondContact O-N 3.27Å; R895-F899 VanDerWaalsContact O-N 3.13Å
896	R	93.9	Very high	87.5	Confident	53 Å²	53	61.3 Å²	61.3	20%	0.2	28%	0.278	C	S	.	.	H	α-helix	trans	-61.7	-34.8	174.8	-72.2	176.4	-166.2	163.6	12.7	111.9	L345 E351 R892 L893 V894 K900	L345-R896 HydrophobicContact CD1-CB 4.35Å; L345-R896 HydrophobicContact CD2-CB 4.37Å; L345-R896 PolarHBondContact O-NH1 3.48Å; E351-R896 VanDerWaalsContact CD-NH1 3.34Å; E351-R896 IonicContact OE1-CZ 3.52Å; E351-R896 IonicContact OE1-NH1 3.69Å; E351-R896 PolarHBondContact OE1-NH1 2.92Å; E351-R896 VanDerWaalsContact OE1-NH1 3.13Å; E351-R896 IonicContact OE1-NH2 2.76Å; E351-R896 PolarHBondContact OE1-NH2 2.73Å; E351-R896 IonicContact OE2-CZ 3.19Å; E351-R896 IonicContact OE2-NH1 3.91Å; E351-R896 PolarHBondContact OE2-NH1 2.77Å; E351-R896 IonicContact OE2-NH2 3.53Å; R892-R896 VanDerWaalsContact O-CG 3.31Å; R892-R896 WeakPolarHBondContact O-CG 3.27Å; R892-R896 PolarHBondContact O-N 3.02Å; L893-R896 WeakPolarHBondContact O-CB 3.25Å; L893-R896 PolarHBondContact O-N 3.28Å; V894-R896 PolarHBondContact O-N 2.77Å; R896-K900 WeakPolarHBondContact O-CB 3.04Å; R896-K900 PolarHBondContact O-N 2.91Å
897	Y	93.2	Very high	87.7	Confident	8 Å²	8	63.6 Å²	63.6	3%	0.031	29%	0.291	C	S	.	.	H	α-helix	trans	-68.6	-48.4	177.2	-176.2	-114	0	0	0	112.8	P293 A297 F338 E341 M342 L345 L893 V894 R895 F899 K900 M901	P293-Y897 HydrophobicContact CB-CE1 3.98Å; P293-Y897 VanDerWaalsContact CB-OH 3.3Å; P293-Y897 WeakPolarHBondContact CB-OH 3.28Å; A297-Y897 HydrophobicContact CB-CD1 4.22Å; F338-Y897 HydrophobicContact CD2-CD1 4.45Å; F338-Y897 AromaticContact CD2-CE1 3.69Å; F338-Y897 HydrophobicContact CD2-CE1 3.69Å; F338-Y897 HydrophobicContact CD2-CE2 4.32Å; F338-Y897 AromaticContact CD2-CZ 3.6Å; F338-Y897 AromaticContact CE2-CD1 3.87Å; F338-Y897 HydrophobicContact CE2-CD1 3.87Å; F338-Y897 AromaticContact CE2-CE1 3.49Å; F338-Y897 HydrophobicContact CE2-CE1 3.49Å; F338-Y897 VanDerWaalsContact CE2-CE1 3.49Å; F338-Y897 AromaticContact CE2-CZ 3.88Å; E341-Y897 HydrophobicContact CB-CE2 3.96Å; E341-Y897 WeakPolarHBondContact OE2-CE2 3.18Å; E341-Y897 PolarHBondContact OE2-OH 2.91Å; M342-Y897 HydrophobicContact CE-CD1 3.61Å; M342-Y897 HydrophobicContact CE-CD2 2.97Å; M342-Y897 HydrophobicContact CE-CE1 4.09Å; M342-Y897 HydrophobicContact CE-CE2 3.5Å; M342-Y897 HydrophobicContact CE-CG 3Å; M342-Y897 HydrophobicContact SD-CG 4.29Å; L345-Y897 VanDerWaalsContact CD1-CA 3.47Å; L345-Y897 HydrophobicContact CD1-CD2 3.8Å; L345-Y897 HydrophobicContact CD1-CG 4.24Å; L893-Y897 PolarHBondContact O-N 3.46Å; V894-Y897 WeakPolarHBondContact O-CA 3.45Å; V894-Y897 WeakPolarHBondContact O-CB 3.48Å; V894-Y897 PolarHBondContact O-N 3.18Å; R895-Y897 PolarHBondContact O-N 3.02Å; Y897-F899 VanDerWaalsContact C-N 3.28Å; Y897-F899 PolarHBondContact O-N 3.2Å; Y897-K900 CarbonylContact O-C 3.42Å; Y897-K900 WeakPolarHBondContact O-CA 3.29Å; Y897-K900 WeakPolarHBondContact O-CB 3.21Å; Y897-K900 PolarHBondContact O-N 3.33Å; Y897-M901 HydrophobicContact CE1-SD 4.37Å; Y897-M901 PolarHBondContact O-N 3.08Å
898	L	91.6	Very high	87.4	Confident	24 Å²	24	66.3 Å²	66.3	13%	0.126	30%	0.295	C	S	.	.	H	α-helix	trans	-58.7	-43.4	178.7	-66.4	172.2	0	0	0	110.7	H242 A297 L298 V894 R895 K900 M901 E902	H242-L898 HydrophobicContact CB-CD2 3.82Å; A297-L898 HydrophobicContact CB-CD2 4.28Å; L298-L898 HydrophobicContact CD2-CD1 3.68Å; L298-L898 HydrophobicContact CD2-CD2 4.42Å; L298-L898 HydrophobicContact CG-CD1 4.5Å; L298-L898 HydrophobicContact CG-CD2 4.4Å; V894-L898 HydrophobicContact CG1-CD1 3.95Å; V894-L898 HydrophobicContact CG1-CG 4.31Å; V894-L898 WeakPolarHBondContact O-CG 3.43Å; V894-L898 PolarHBondContact O-N 3.44Å; R895-L898 PolarHBondContact O-N 2.77Å; L898-K900 VanDerWaalsContact C-N 3.33Å; L898-K900 PolarHBondContact O-N 3.24Å; L898-M901 PolarHBondContact O-N 3.15Å; L898-E902 WeakPolarHBondContact O-CB 3.45Å; L898-E902 PolarHBondContact O-N 3.37Å
899	F	91.4	Very high	86.5	Confident	130 Å²	130	66.6 Å²	66.6	57%	0.57	30%	0.297	S	S	*	.	H	α-helix	trans	-63.8	-34.1	173.3	-77.1	-55.1	0	0	0	113.9	R895 Y897 R903	R895-F899 HydrophobicContact CG-CD2 3.83Å; R895-F899 HydrophobicContact CG-CE2 3.49Å; R895-F899 VanDerWaalsContact CG-CE2 3.49Å; R895-F899 WeakPolarHBondContact O-CD2 3.37Å; R895-F899 PolarHBondContact O-N 3.27Å; R895-F899 VanDerWaalsContact O-N 3.13Å; Y897-F899 VanDerWaalsContact C-N 3.28Å; Y897-F899 PolarHBondContact O-N 3.2Å; F899-R903 PolarHBondContact O-N 2.98Å
900	K	91.4	Very high	85.3	Confident	59 Å²	59	71.9 Å²	71.9	26%	0.257	32%	0.319	S	S	.	.	H	α-helix	trans	-67	-45.3	174.3	178.1	-172.5	164.3	-168.1	0	110.1	L345 R896 Y897 L898 R903 E904	L345-K900 HydrophobicContact CD2-CD 4.16Å; R896-K900 WeakPolarHBondContact O-CB 3.04Å; R896-K900 PolarHBondContact O-N 2.91Å; Y897-K900 CarbonylContact O-C 3.42Å; Y897-K900 WeakPolarHBondContact O-CA 3.29Å; Y897-K900 WeakPolarHBondContact O-CB 3.21Å; Y897-K900 PolarHBondContact O-N 3.33Å; L898-K900 VanDerWaalsContact C-N 3.33Å; L898-K900 PolarHBondContact O-N 3.24Å; K900-R903 PolarHBondContact O-N 3.36Å; K900-E904 WeakPolarHBondContact CE-OE1 3.45Å; K900-E904 IonicContact NZ-OE1 3.57Å; K900-E904 WeakPolarHBondContact O-CG 3.27Å; K900-E904 PolarHBondContact O-N 3.45Å
901	M	87.3	Confident	84	Confident	5 Å²	5	80.9 Å²	80.9	3%	0.025	35%	0.354	C	S	.	.	H	α-helix	trans	-65.5	-41.1	-178.2	-164.4	-175.2	77.9	0	0	112	N240 H242 A294 Y897 L898 E904 N905	N240-M901 PolarHBondContact ND2-SD 2.91Å; N240-M901 VanDerWaalsContact ND2-SD 3.36Å; N240-M901 WeakPolarHBondContact O-CE 3.46Å; H242-M901 HydrophobicContact CB-CE 3.48Å; H242-M901 VanDerWaalsContact CB-CE 3.48Å; A294-M901 HydrophobicContact CB-CE 4.17Å; A294-M901 HydrophobicContact CB-SD 4.45Å; Y897-M901 HydrophobicContact CE1-SD 4.37Å; Y897-M901 PolarHBondContact O-N 3.08Å; L898-M901 PolarHBondContact O-N 3.15Å; M901-E904 PolarHBondContact O-N 2.91Å; M901-N905 PolarHBondContact O-N 3.42Å
902	E	87.1	Confident	82.4	Confident	66 Å²	66	82.6 Å²	82.6	31%	0.308	36%	0.36	S	S	.	.	H	α-helix	trans	-58.9	-49.5	173.9	-168.6	178.4	175.9	0	0	110.9	H242 L898 E904 N905 D906	H242-E902 IonicContact CE1-OE2 3.54Å; L898-E902 WeakPolarHBondContact O-CB 3.45Å; L898-E902 PolarHBondContact O-N 3.37Å; E902-E904 VanDerWaalsContact C-N 3.32Å; E902-E904 PolarHBondContact O-N 3.32Å; E902-N905 WeakPolarHBondContact O-CB 3.27Å; E902-N905 PolarHBondContact O-N 3.39Å; E902-D906 PolarHBondContact O-N 3.34Å
903	R	87.1	Confident	80.3	Confident	176 Å²	176	83 Å²	83	66%	0.664	37%	0.367	S	S	*	.	H	α-helix	trans	-59.7	-40	175.9	-176	-179.9	-69.1	175.7	-4	113	F899 K900 N905 D906 D907	F899-R903 PolarHBondContact O-N 2.98Å; K900-R903 PolarHBondContact O-N 3.36Å; R903-N905 VanDerWaalsContact C-N 3.28Å; R903-N905 PolarHBondContact O-N 3.46Å; R903-D906 PolarHBondContact O-N 3.01Å; R903-D907 WeakPolarHBondContact O-CB 3.49Å; R903-D907 PolarHBondContact O-N 3.47Å
904	E	84.7	Confident	77.8	Confident	75 Å²	75	90 Å²	90	35%	0.35	40%	0.403	S	S	.	.	H	α-helix	trans	-68.1	-28	177	-75.9	179	-178.1	0	0	112.9	K900 M901 E902 K908	K900-E904 WeakPolarHBondContact CE-OE1 3.45Å; K900-E904 IonicContact NZ-OE1 3.57Å; K900-E904 WeakPolarHBondContact O-CG 3.27Å; K900-E904 PolarHBondContact O-N 3.45Å; M901-E904 PolarHBondContact O-N 2.91Å; E902-E904 VanDerWaalsContact C-N 3.32Å; E902-E904 PolarHBondContact O-N 3.32Å; E904-K908 VanDerWaalsContact O-CG 3.31Å; E904-K908 WeakPolarHBondContact O-CG 3.49Å; E904-K908 PolarHBondContact O-N 3.2Å
905	N	80.4	Confident	75.2	Confident	44 Å²	44	94.5 Å²	94.5	24%	0.235	43%	0.433	C	S	.	.	H	α-helix	trans	-74.6	-46.1	172.6	-70.5	-17.7	0	0	0	110.5	M901 E902 R903 D907 K908 D909	M901-N905 PolarHBondContact O-N 3.42Å; E902-N905 WeakPolarHBondContact O-CB 3.27Å; E902-N905 PolarHBondContact O-N 3.39Å; R903-N905 VanDerWaalsContact C-N 3.28Å; R903-N905 PolarHBondContact O-N 3.46Å; N905-D907 PolarHBondContact O-N 3.31Å; N905-K908 WeakPolarHBondContact O-CB 3.4Å; N905-K908 PolarHBondContact O-N 2.92Å; N905-D909 PolarHBondContact O-N 3.23Å
906	D	80.1	Confident	72.7	Confident	86 Å²	86	94.4 Å²	94.4	46%	0.46	43%	0.433	S	S	.	.	H	α-helix	trans	-56	-40	175.6	-64.2	-19.6	0	0	0	112.3	E902 R903 K908 D909 K910	E902-D906 PolarHBondContact O-N 3.34Å; R903-D906 PolarHBondContact O-N 3.01Å; D906-K908 VanDerWaalsContact C-N 3.33Å; D906-D909 PolarHBondContact O-N 3.5Å; D906-K910 WeakPolarHBondContact O-CG 3.13Å; D906-K910 PolarHBondContact O-N 2.8Å
907	D	78.7	Confident	70.2	Confident	74 Å²	74	95.9 Å²	95.9	40%	0.396	45%	0.448	S	S	.	.	H	α-helix	trans	-70.1	-29.2	178.3	-74.5	-24	0	0	0	112.3	R903 N905 K910 Y911	R903-D907 WeakPolarHBondContact O-CB 3.49Å; R903-D907 PolarHBondContact O-N 3.47Å; N905-D907 PolarHBondContact O-N 3.31Å; D907-K910 IonicContact OD1-NZ 2.74Å; D907-Y911 WeakPolarHBondContact O-CD2 3.35Å
908	K	74.3	Confident	67.3	Low	121 Å²	121	105.2 Å²	105.2	53%	0.526	48%	0.484	S	S	.	.	H	α-helix	trans	-74.8	-38.5	174.2	-73.6	168.6	-170.2	162.8	0	111.9	E904 N905 D906 Y911	E904-K908 VanDerWaalsContact O-CG 3.31Å; E904-K908 WeakPolarHBondContact O-CG 3.49Å; E904-K908 PolarHBondContact O-N 3.2Å; N905-K908 WeakPolarHBondContact O-CB 3.4Å; N905-K908 PolarHBondContact O-N 2.92Å; D906-K908 VanDerWaalsContact C-N 3.33Å; K908-Y911 PolarHBondContact O-N 2.88Å
909	D	66.9	Low	64.9	Low	71 Å²	71	108.4 Å²	108.4	38%	0.38	50%	0.504	S	S	.	.	H	α-helix	trans	-70.7	-33.7	-177	-67.4	-28.4	0	0	0	111.7	N905 D906 Y911 K912 E913	N905-D909 PolarHBondContact O-N 3.23Å; D906-D909 PolarHBondContact O-N 3.5Å; D909-Y911 PolarHBondContact O-N 2.84Å; D909-Y911 VanDerWaalsContact O-N 3.08Å; D909-K912 PolarHBondContact O-N 3.24Å; D909-K912 IonicContact OD1-NZ 2.78Å; D909-E913 PolarHBondContact O-N 3.49Å; D909-E913 VanDerWaalsContact O-N 3.13Å
910	K	61.8	Low	62.7	Low	121 Å²	121	106.9 Å²	106.9	53%	0.526	50%	0.498	S	S	.	.	H	α-helix	trans	-53	-32	170.2	-79.1	175.3	-170.9	157.5	0	114.2	D906 D907 L914	D906-K910 WeakPolarHBondContact O-CG 3.13Å; D906-K910 PolarHBondContact O-N 2.8Å; D907-K910 IonicContact OD1-NZ 2.74Å; K910-L914 WeakPolarHBondContact O-CD1 3.35Å
911	Y	58.1	Low	60.4	Low	193 Å²	193	108.7 Å²	108.7	76%	0.757	51%	0.511	S	S	*	.	H	α-helix	trans	-82.6	-21.7	177.9	-71.8	-77.2	0	0	0	113.3	D907 K908 D909	D907-Y911 WeakPolarHBondContact O-CD2 3.35Å; K908-Y911 PolarHBondContact O-N 2.88Å; D909-Y911 PolarHBondContact O-N 2.84Å; D909-Y911 VanDerWaalsContact O-N 3.08Å
912	K	55.4	Low	58.3	Low	153 Å²	153	114.6 Å²	114.6	67%	0.665	54%	0.54	S	S	*	.	H	α-helix	trans	-80.5	-31.9	176.2	-71.3	179.2	-176.2	164.6	0	112.5	D909 L914 P915	D909-K912 PolarHBondContact O-N 3.24Å; D909-K912 IonicContact OD1-NZ 2.78Å; K912-L914 PolarHBondContact O-N 3.35Å; K912-P915 VanDerWaalsContact O-CD 3.31Å; K912-P915 WeakPolarHBondContact O-CD 3.41Å
913	E	45.7	Very low	56.5	Low	120 Å²	120	115.4 Å²	115.4	56%	0.561	55%	0.55	S	S	*	.	S	Bend	trans	-68.8	-13.5	-179.7	-71.3	-177.3	166.2	0	0	113.9	D909 Y916 V917	D909-E913 PolarHBondContact O-N 3.49Å; D909-E913 VanDerWaalsContact O-N 3.13Å; E913-Y916 PolarHBondContact O-N 2.84Å; E913-V917 HydrophobicContact CB-CG2 4.18Å; E913-V917 WeakPolarHBondContact O-CG2 3.24Å
914	L	39.5	Very low	54.6	Low	146 Å²	146	108.9 Å²	108.9	76%	0.764	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	8.4	-169.1	-106.4	131.3	0	0	0	118.3	K910 K912	K910-L914 WeakPolarHBondContact O-CD1 3.35Å; K912-L914 PolarHBondContact O-N 3.35Å
915	P	38.1	Very low	52.8	Low	114 Å²	114	110.6 Å²	110.6	74%	0.74	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	-0	155.7	8.6	14.6	0	0	0	116.7	K912	K912-P915 VanDerWaalsContact O-CD 3.31Å; K912-P915 WeakPolarHBondContact O-CD 3.41Å
916	Y	39.8	Very low	51.2	Low	143 Å²	143	114.6 Å²	114.6	56%	0.561	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.8	-27.7	-173.3	-151.1	-112.8	0	0	0	114	E913 R918 T919 E920	E913-Y916 PolarHBondContact O-N 2.84Å; Y916-R918 PolarHBondContact O-N 3.28Å; Y916-T919 PolarHBondContact O-OG1 3.08Å; Y916-E920 HydrophobicContact CE1-CG 4.29Å; Y916-E920 WeakPolarHBondContact CE1-OE1 3.35Å; Y916-E920 VanDerWaalsContact CE1-OE2 3.26Å; Y916-E920 WeakPolarHBondContact CE1-OE2 3.26Å; Y916-E920 PolarHBondContact OH-OE1 3.48Å
917	V	41	Very low	49.8	Very low	84 Å²	84	116.4 Å²	116.4	51%	0.509	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.8	11	-173.5	-178.3	0	0	0	0	114.2	E913	E913-V917 HydrophobicContact CB-CG2 4.18Å; E913-V917 WeakPolarHBondContact O-CG2 3.24Å
918	R	33.8	Very low	48.5	Very low	205 Å²	205	115.7 Å²	115.7	77%	0.774	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.8	-14.5	179.6	-138.8	-178.7	-152.1	147.1	6.3	115.3	Y916	Y916-R918 PolarHBondContact O-N 3.28Å
919	T	40.9	Very low	47.2	Very low	90 Å²	90	117.7 Å²	117.7	55%	0.552	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-37.7	-175.1	29.5	0	0	0	0	112.8	Y916 M922 T923	Y916-T919 PolarHBondContact O-OG1 3.08Å; T919-M922 PolarHBondContact O-N 3.38Å; T919-T923 PolarHBondContact O-N 2.76Å; T919-T923 PolarHBondContact O-OG1 3.11Å
920	E	44	Very low	46.5	Very low	98 Å²	98	119.5 Å²	119.5	46%	0.458	60%	0.596	S	S	.	*	H	α-helix	trans	-82.9	-35.4	-174	-61	-175.8	158.7	0	0	112.6	Y916 M922 T923 G924	Y916-E920 HydrophobicContact CE1-CG 4.29Å; Y916-E920 WeakPolarHBondContact CE1-OE1 3.35Å; Y916-E920 VanDerWaalsContact CE1-OE2 3.26Å; Y916-E920 WeakPolarHBondContact CE1-OE2 3.26Å; Y916-E920 PolarHBondContact OH-OE1 3.48Å; E920-M922 PolarHBondContact O-N 3.31Å; E920-T923 PolarHBondContact O-N 3.41Å; E920-T923 PolarHBondContact O-OG1 3.41Å; E920-T923 VanDerWaalsContact O-OG1 3.05Å; E920-G924 PolarHBondContact O-N 3.27Å
921	D	43.4	Very low	45.8	Very low	97 Å²	97	120.7 Å²	120.7	52%	0.519	61%	0.608	S	S	.	*	H	α-helix	trans	-68.7	-19.9	172	-72.1	-13.5	0	0	0	112.6	N925	D921-N925 VanDerWaalsContact O-CB 3.24Å; D921-N925 WeakPolarHBondContact O-CB 3.37Å; D921-N925 VanDerWaalsContact O-CG 3.28Å; D921-N925 PolarHBondContact O-ND2 3.19Å
922	M	44	Very low	45.4	Very low	130 Å²	130	115.2 Å²	115.2	64%	0.64	60%	0.603	S	S	*	*	H	α-helix	trans	-83.1	-36.3	173.4	-77.1	-147.6	-166.3	0	0	112.2	T919 E920 M926	T919-M922 PolarHBondContact O-N 3.38Å; E920-M922 PolarHBondContact O-N 3.31Å; M922-M926 WeakPolarHBondContact O-CB 3.29Å; M922-M926 PolarHBondContact O-N 2.91Å
923	T	49.7	Very low	44.8	Very low	82 Å²	82	117.8 Å²	117.8	50%	0.503	61%	0.61	S	S	.	*	H	α-helix	trans	-75.2	-44.1	179	46.9	0	0	0	0	111.9	T919 E920 N925 M926 E927	T919-T923 PolarHBondContact O-N 2.76Å; T919-T923 PolarHBondContact O-OG1 3.11Å; E920-T923 PolarHBondContact O-N 3.41Å; E920-T923 PolarHBondContact O-OG1 3.41Å; E920-T923 VanDerWaalsContact O-OG1 3.05Å; T923-N925 PolarHBondContact O-N 2.94Å; T923-M926 PolarHBondContact O-N 3.27Å; T923-E927 WeakPolarHBondContact O-CB 3.46Å; T923-E927 PolarHBondContact O-N 3.41Å
924	G	47.3	Very low	44.3	Very low	40 Å²	40	115.3 Å²	115.3	41%	0.412	62%	0.616	S	S	.	*	H	α-helix	trans	-65.9	-36.6	176.9	0	0	0	0	0	113.2	E920 A928	E920-G924 PolarHBondContact O-N 3.27Å; G924-A928 VanDerWaalsContact O-CB 3.25Å; G924-A928 WeakPolarHBondContact O-CB 3.28Å; G924-A928 PolarHBondContact O-N 3.47Å
925	N	46.6	Very low	44.2	Very low	111 Å²	111	116.1 Å²	116.1	59%	0.594	62%	0.622	S	S	*	*	H	α-helix	trans	-72.9	-31.5	172.8	-77.6	-41.1	0	0	0	112.5	D921 T923 F929	D921-N925 VanDerWaalsContact O-CB 3.24Å; D921-N925 WeakPolarHBondContact O-CB 3.37Å; D921-N925 VanDerWaalsContact O-CG 3.28Å; D921-N925 PolarHBondContact O-ND2 3.19Å; T923-N925 PolarHBondContact O-N 2.94Å; N925-F929 VanDerWaalsContact O-CB 3.3Å; N925-F929 WeakPolarHBondContact O-CB 3.36Å; N925-F929 PolarHBondContact O-N 3.32Å
926	M	46.5	Very low	44	Very low	127 Å²	127	116 Å²	116	63%	0.626	62%	0.621	S	S	*	*	H	α-helix	trans	-75.1	-37.7	178.2	-168.6	157.6	-178	0	0	111.8	M922 T923 F929 L930	M922-M926 WeakPolarHBondContact O-CB 3.29Å; M922-M926 PolarHBondContact O-N 2.91Å; T923-M926 PolarHBondContact O-N 3.27Å; M926-F929 PolarHBondContact O-N 2.76Å; M926-L930 HydrophobicContact CG-CD1 4Å; M926-L930 VanDerWaalsContact O-CB 3.3Å; M926-L930 WeakPolarHBondContact O-CB 3.36Å; M926-L930 WeakPolarHBondContact O-CD1 3.46Å; M926-L930 WeakPolarHBondContact O-CG 3.42Å; M926-L930 PolarHBondContact O-N 2.91Å
927	E	51.1	Low	43.5	Very low	125 Å²	125	116.4 Å²	116.4	58%	0.584	63%	0.633	S	S	*	*	H	α-helix	trans	-70.7	-38	173.2	-75	178.5	168.3	0	0	112.3	T923 F929 L930 N931	T923-E927 WeakPolarHBondContact O-CB 3.46Å; T923-E927 PolarHBondContact O-N 3.41Å; E927-F929 VanDerWaalsContact C-N 3.33Å; E927-F929 PolarHBondContact O-N 3.35Å; E927-L930 PolarHBondContact O-N 3.12Å; E927-N931 VanDerWaalsContact O-CB 3.26Å; E927-N931 WeakPolarHBondContact O-CB 3.2Å; E927-N931 VanDerWaalsContact O-CG 3.28Å; E927-N931 PolarHBondContact O-N 2.99Å; E927-N931 PolarHBondContact O-ND2 3.45Å
928	A	51.2	Low	43.1	Very low	59 Å²	59	121.4 Å²	121.4	49%	0.488	65%	0.651	S	S	.	*	H	α-helix	trans	-66.2	-34.1	170.9	0	0	0	0	0	112.4	G924 A932	G924-A928 VanDerWaalsContact O-CB 3.25Å; G924-A928 WeakPolarHBondContact O-CB 3.28Å; G924-A928 PolarHBondContact O-N 3.47Å; A928-A932 WeakPolarHBondContact O-CB 3.32Å; A928-A932 PolarHBondContact O-N 3.14Å
929	F	46.8	Very low	42.8	Very low	162 Å²	162	118.2 Å²	118.2	71%	0.711	65%	0.654	S	S	*	*	H	α-helix	trans	-71.2	-37.1	173.7	-133.6	-91.9	0	0	0	112.4	N925 M926 E927	N925-F929 VanDerWaalsContact O-CB 3.3Å; N925-F929 WeakPolarHBondContact O-CB 3.36Å; N925-F929 PolarHBondContact O-N 3.32Å; M926-F929 PolarHBondContact O-N 2.76Å; E927-F929 VanDerWaalsContact C-N 3.33Å; E927-F929 PolarHBondContact O-N 3.35Å
930	L	51.1	Low	42.4	Very low	109 Å²	109	119.3 Å²	119.3	57%	0.571	66%	0.66	S	S	*	*	H	α-helix	trans	-74.7	-36.9	178.6	-75.8	163.2	0	0	0	112	M926 E927 A932 Y933	M926-L930 HydrophobicContact CG-CD1 4Å; M926-L930 VanDerWaalsContact O-CB 3.3Å; M926-L930 WeakPolarHBondContact O-CB 3.36Å; M926-L930 WeakPolarHBondContact O-CD1 3.46Å; M926-L930 WeakPolarHBondContact O-CG 3.42Å; M926-L930 PolarHBondContact O-N 2.91Å; E927-L930 PolarHBondContact O-N 3.12Å; L930-A932 VanDerWaalsContact C-N 3.33Å; L930-A932 PolarHBondContact O-N 3.22Å; L930-Y933 CarbonylContact O-C 3.52Å; L930-Y933 PolarHBondContact O-N 3.28Å
931	N	48.8	Very low	41.6	Very low	147 Å²	147	123.3 Å²	123.3	79%	0.786	68%	0.679	S	S	*	*	H	α-helix	trans	-75	-19.2	176.6	-73.4	-20.7	0	0	0	113.6	E927	E927-N931 VanDerWaalsContact O-CB 3.26Å; E927-N931 WeakPolarHBondContact O-CB 3.2Å; E927-N931 VanDerWaalsContact O-CG 3.28Å; E927-N931 PolarHBondContact O-N 2.99Å; E927-N931 PolarHBondContact O-ND2 3.45Å
932	A	49.7	Very low	41.2	Very low	78 Å²	78	127.8 Å²	127.8	65%	0.645	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-11.2	174.8	0	0	0	0	0	113.8	A928 L930	A928-A932 WeakPolarHBondContact O-CB 3.32Å; A928-A932 PolarHBondContact O-N 3.14Å; L930-A932 VanDerWaalsContact C-N 3.33Å; L930-A932 PolarHBondContact O-N 3.22Å
933	Y	41.5	Very low	40.6	Very low	206 Å²	206	125.7 Å²	125.7	81%	0.808	70%	0.697	S	S	*	*	S	Bend	trans	-142.7	79	-176.5	-103.7	-88.7	0	0	0	110.7	L930	L930-Y933 CarbonylContact O-C 3.52Å; L930-Y933 PolarHBondContact O-N 3.28Å
934	G	36.3	Very low	39.5	Very low	68 Å²	68	129.7 Å²	129.7	70%	0.701	72%	0.716	S	S	*	*			trans	175.4	96.5	171.4	0	0	0	0	0	115.5
935	D	37.7	Very low	38.8	Very low	163 Å²	163	132.7 Å²	132.7	87%	0.872	74%	0.737	S	S	*	*			trans	-53.6	140.2	167.5	-101.8	-38.4	0	0	0	112.1	N937	D935-N937 PolarHBondContact O-N 3Å; D935-N937 VanDerWaalsContact O-N 3.14Å
936	P	32.2	Very low	38	Very low	111 Å²	111	136.4 Å²	136.4	72%	0.721	75%	0.751	S	S	*	*	S	Bend	trans	-87.3	86.9	-177.7	34.4	-29.6	0	0	0	109.2
937	N	30.4	Very low	37.2	Very low	152 Å²	152	140 Å²	140	81%	0.813	77%	0.766	S	S	*	*			trans	-172.5	76.8	164.3	-89.6	-35.7	0	0	0	111.2	D935	D935-N937 PolarHBondContact O-N 3Å; D935-N937 VanDerWaalsContact O-N 3.14Å
938	Q	33.3	Very low	36.2	Very low	190 Å²	190	143.4 Å²	143.4	89%	0.888	78%	0.779	S	S	*	*			trans	-167.3	104.2	148.3	-109.9	159.6	39.2	0	0	112.3
939	T	26.7	Very low	35.6	Very low	138 Å²	138	145.7 Å²	145.7	85%	0.847	79%	0.789	S	S	*	*			trans	-57.6	123.2	162.4	46.9	0	0	0	0	111.5
940	V	32.5	Very low	34.9	Very low	113 Å²	113	143.6 Å²	143.6	69%	0.685	79%	0.792	S	S	*	*			trans	-144.3	115.3	154.6	-174.8	0	0	0	0	110.1	F942	V940-F942 HydrophobicContact CG1-CD2 3.79Å; V940-F942 HydrophobicContact CG1-CE2 3.44Å; V940-F942 VanDerWaalsContact CG1-CE2 3.44Å; V940-F942 HydrophobicContact CG1-CZ 4.41Å
941	Q	27.1	Very low	33.8	Very low	182 Å²	182	143.4 Å²	143.4	85%	0.85	80%	0.799	S	S	*	*			trans	-71.8	136.9	168.9	-66.4	167.4	-55.7	0	0	111
942	F	33.7	Very low	33	Very low	190 Å²	190	143.3 Å²	143.3	83%	0.833	80%	0.804	S	S	*	*			trans	-158.9	101.6	148	-72.5	-70	0	0	0	106.3	V940	V940-F942 HydrophobicContact CG1-CD2 3.79Å; V940-F942 HydrophobicContact CG1-CE2 3.44Å; V940-F942 VanDerWaalsContact CG1-CE2 3.44Å; V940-F942 HydrophobicContact CG1-CZ 4.41Å
943	A	32.7	Very low	32	Very low	86 Å²	86	145.3 Å²	145.3	71%	0.711	81%	0.808	S	S	*	*				65.5	98.9	74	0	0	0	0	0	113.9
944	D	26.8	Very low	31.3	Very low	166 Å²	166	140 Å²	140	89%	0.888	81%	0.806	S	S	*	*			trans	28.3	119.6	145.1	-49.1	-26.1	0	0	0	120.1
945	A	33.2	Very low	31	Very low	103 Å²	103	143.7 Å²	143.7	85%	0.851	82%	0.816	S	S	*	*			trans	-157.7	111.9	145.6	0	0	0	0	0	110.9
946	E	27.8	Very low	30.4	Very low	190 Å²	190	139.6 Å²	139.6	89%	0.888	81%	0.811	S	S	*	*			trans	-64.5	137.2	163.6	-61.7	175.9	145.5	0	0	110.5
947	E	30.9	Very low	30.2	Very low	201 Å²	201	137.4 Å²	137.4	94%	0.939	81%	0.809	S	S	*	*			trans	-152.7	120.4	151.5	-118.1	175	-168.3	0	0	110.8
948	F	28.9	Very low	29.9	Very low	198 Å²	198	140 Å²	140	87%	0.868	81%	0.813	S	S	*	*			trans	-90.4	175	178.2	-110.1	-64.3	0	0	0	110.3
949	P	39.3	Very low	29.6	Very low	106 Å²	106	137.5 Å²	137.5	69%	0.688	81%	0.811	S	S	*	*				-100.2	-155.7	-126.3	41.9	-27.3	0	0	0	113.8
950	P	33	Very low	29.5	Very low	119 Å²	119	136.2 Å²	136.2	77%	0.773	80%	0.803	S	S	*	*				-139	154.6	114.8	35	-20.9	0	0	0	116.1
951	S	26.5	Very low	29.3	Very low	105 Å²	105	141.9 Å²	141.9	73%	0.734	81%	0.814	S	S	*	*			trans	-54.9	143	169.1	42.4	0	0	0	0	114.4
952	V	32.3	Very low	29.2	Very low	145 Å²	145	141.2 Å²	141.2	88%	0.879	81%	0.811	S	S	*	*			trans	-118.2	112.6	150.7	-180	0	0	0	0	108.9
953	T	30.2	Very low	28.7	Very low	119 Å²	119	139.1 Å²	139.1	73%	0.73	81%	0.809	S	S	*	*			trans	-42.1	139.1	174.7	39.6	0	0	0	0	117.9
954	A	26.7	Very low	28.6	Very low	94 Å²	94	140.5 Å²	140.5	78%	0.777	81%	0.81	S	S	*	*			trans	-19.7	131.6	150.6	0	0	0	0	0	118
955	V	30.1	Very low	28.6	Very low	147 Å²	147	139.4 Å²	139.4	89%	0.891	80%	0.8	S	S	*	*			trans	-131.4	111.8	137.7	178.1	0	0	0	0	107.4
956	G	25.1	Very low	28.2	Very low	76 Å²	76	142 Å²	142	78%	0.784	80%	0.799	S	S	*	*			trans	-68.2	139.6	173.6	0	0	0	0	0	111.5
957	G	27	Very low	28.2	Very low	66 Å²	66	137.1 Å²	137.1	68%	0.68	78%	0.784	S	S	*	*			trans	-157.3	104.2	172.4	0	0	0	0	0	108.9	T959	G957-T959 PolarHBondContact O-N 2.89Å; G957-T959 VanDerWaalsContact O-N 3.15Å
958	K	23.5	Very low	28.2	Very low	206 Å²	206	137.7 Å²	137.7	90%	0.896	78%	0.779	S	S	*	*			trans	-48.4	114.6	173.2	-67	168.3	174.4	175.5	0	109.8	T960	K958-T960 PolarHBondContact O-N 3.43Å
959	T	26.8	Very low	28	Very low	138 Å²	138	136.8 Å²	136.8	85%	0.847	78%	0.777	S	S	*	*			trans	-89	90.1	163.6	48.3	0	0	0	0	108.4	G957	G957-T959 PolarHBondContact O-N 2.89Å; G957-T959 VanDerWaalsContact O-N 3.15Å
960	T	26.3	Very low	27.4	Very low	110 Å²	110	138.7 Å²	138.7	68%	0.675	78%	0.781	S	S	*	*			trans	-46.9	133	157.4	-19.6	0	0	0	0	109.3	K958 E962	K958-T960 PolarHBondContact O-N 3.43Å; T960-E962 PolarHBondContact O-N 2.86Å; T960-E962 VanDerWaalsContact O-N 3.11Å
961	Y	26.3	Very low	27.1	Very low	232 Å²	232	137.5 Å²	137.5	91%	0.91	78%	0.775	S	S	*	*			trans	-57.6	107.5	160.4	-80.5	-98.2	0	0	0	108.2
962	E	25.7	Very low	27.3	Very low	168 Å²	168	139.8 Å²	139.8	79%	0.785	79%	0.785	S	S	*	*			trans	-153.1	119.8	164.6	-113.7	168.8	-159.3	0	0	110.3	T960	T960-E962 PolarHBondContact O-N 2.86Å; T960-E962 VanDerWaalsContact O-N 3.11Å
963	N	24.2	Very low	27	Very low	147 Å²	147	141.3 Å²	141.3	79%	0.786	78%	0.782	S	S	*	*			trans	-57.2	140.7	170.5	-164	12.2	0	0	0	110.1
964	P	29.6	Very low	27.1	Very low	115 Å²	115	141.7 Å²	141.7	75%	0.747	79%	0.79	S	S	*	*			trans	-135.3	129.1	140.7	22.7	-3	0	0	0	113
965	Q	28.2	Very low	27.3	Very low	142 Å²	142	141.1 Å²	141.1	66%	0.664	79%	0.793	S	S	*	*			trans	-44.9	147	161.1	-67.1	155.2	-45.1	0	0	112.4	E801	E801-Q965 PolarHBondContact OE1-NE2 2.9Å; E801-Q965 VanDerWaalsContact OE1-NE2 3.15Å
966	N	24.5	Very low	27.3	Very low	157 Å²	157	138.6 Å²	138.6	84%	0.84	79%	0.788	S	S	*	*			trans	7.5	140.7	157.9	-78.1	-22.8	0	0	0	118.5
967	P	28	Very low	27.8	Very low	88 Å²	88	140.1 Å²	140.1	57%	0.571	78%	0.783	S	S	*	*				-156.7	166.1	103.7	34.6	-13.3	0	0	0	117.9
968	Y	30.2	Very low	27.8	Very low	214 Å²	214	142.7 Å²	142.7	84%	0.839	79%	0.786	S	S	*	*			trans	81.2	123.4	157.3	-51.3	-57.8	0	0	0	117
969	Q	25	Very low	28.2	Very low	178 Å²	178	141 Å²	141	83%	0.832	79%	0.785	S	S	*	*			cis	41.2	88.1	44.6	-86.5	-164.9	-2.3	0	0	114.3
970	L	26.3	Very low	28.3	Very low	147 Å²	147	141.2 Å²	141.2	77%	0.77	78%	0.781	S	S	*	*				167.7	131.8	104	-133.9	82.8	0	0	0	113.1
971	S	26.2	Very low	28.5	Very low	93 Å²	93	142.4 Å²	142.4	65%	0.65	79%	0.788	S	S	*	*			trans	60.8	121.4	139.4	66.9	0	0	0	0	122.5
972	V	30.9	Very low	28.7	Very low	153 Å²	153	138.5 Å²	138.5	93%	0.927	78%	0.783	S	S	*	*			trans	-130.4	133.4	136.7	177.9	0	0	0	0	109
973	Q	27.2	Very low	29	Very low	178 Å²	178	139.2 Å²	139.2	83%	0.832	79%	0.787	S	S	*	*			trans	-75.8	149.8	-174.1	-65.5	161.8	-31.4	0	0	113.1
974	S	31.8	Very low	29.2	Very low	127 Å²	127	137 Å²	137	89%	0.888	78%	0.783	S	S	*	*				176.2	140	128.7	41	0	0	0	0	112.7
975	G	30.9	Very low	29	Very low	81 Å²	81	137.1 Å²	137.1	84%	0.835	79%	0.786	S	S	*	*			trans	104.5	85.7	150.9	0	0	0	0	0	119
976	A	29.4	Very low	28.8	Very low	95 Å²	95	136.4 Å²	136.4	79%	0.785	80%	0.795	S	S	*	*			trans	-66	-179.1	162.4	0	0	0	0	0	112.1
977	P	34.9	Very low	28.9	Very low	107 Å²	107	138.7 Å²	138.7	70%	0.695	80%	0.798	S	S	*	*			cis	-145.8	162.4	13.4	43.1	-22.3	0	0	0	119
978	T	27.8	Very low	28.8	Very low	120 Å²	120	144.9 Å²	144.9	74%	0.736	81%	0.81	S	S	*	*			trans	44.7	122.2	140.9	57.2	0	0	0	0	121.6
979	I	32.4	Very low	28.5	Very low	172 Å²	172	142 Å²	142	88%	0.882	81%	0.809	S	S	*	*				-158.9	133.9	118.8	-91.2	147.6	0	0	0	109.2
980	N	28.5	Very low	28.7	Very low	141 Å²	141	142.2 Å²	142.2	75%	0.754	81%	0.806	S	S	*	*			trans	-67.9	143.6	-174.8	-67.3	-44.1	0	0	0	114.5
981	T	31.5	Very low	28.6	Very low	135 Å²	135	143.7 Å²	143.7	83%	0.828	81%	0.807	S	S	*	*			trans	-161.5	102.1	133.3	39.1	0	0	0	0	111.9
982	N	29.2	Very low	28.7	Very low	150 Å²	150	148.6 Å²	148.6	80%	0.802	82%	0.819	S	S	*	*			trans	32.5	117.7	132	-62.2	-22.4	0	0	0	121.3
983	Q	31.5	Very low	28.4	Very low	183 Å²	183	146.4 Å²	146.4	86%	0.855	81%	0.807	S	S	*	*				151.2	90.2	125.2	-83	178.8	9.5	0	0	109.7
984	S	29.4	Very low	28.5	Very low	102 Å²	102	149.4 Å²	149.4	71%	0.713	81%	0.812	S	S	*	*				64.2	102.1	82.2	74.6	0	0	0	0	115.9
985	S	24.7	Very low	28.2	Very low	116 Å²	116	147.9 Å²	147.9	81%	0.811	80%	0.801	S	S	*	*				51	117.9	129.2	-63.7	0	0	0	0	120.6
986	C	24.9	Very low	28	Very low	127 Å²	127	150.9 Å²	150.9	86%	0.858	80%	0.803	S	S	*	*				-163.3	106	120.4	-108.8	0	0	0	0	113.8
987	K	25.9	Very low	27.9	Very low	205 Å²	205	149.7 Å²	149.7	89%	0.891	80%	0.8	S	S	*	*			trans	-55.9	136.5	150	-69.4	171.9	174.8	174.3	0	109.1
988	R	25.8	Very low	27.6	Very low	218 Å²	218	154.9 Å²	154.9	82%	0.823	81%	0.806	S	S	*	*			trans	-142.7	84.8	157.4	-131.8	174.8	-172.4	-179.4	4.3	111.6
989	L	25.1	Very low	27.4	Very low	155 Å²	155	159.1 Å²	159.1	81%	0.812	81%	0.808	S	S	*	*			trans	-56.9	129.9	146.8	-115.5	85	0	0	0	108.1
990	K	27.6	Very low	27	Very low	181 Å²	181	156.2 Å²	156.2	79%	0.787	80%	0.802	S	S	*	*			trans	-119.1	100.9	156.9	-100.9	-175.2	174.3	-176.6	0	108.5
991	K	25.1	Very low	26.8	Very low	179 Å²	179	154 Å²	154	78%	0.778	80%	0.798	S	S	*	*			trans	-59.2	132.4	154.6	-90	173.4	168.7	175.6	0	108.4
992	Q	28.6	Very low	26.6	Very low	195 Å²	195	153 Å²	153	91%	0.911	80%	0.796	S	S	*	*			trans	-122.2	104.5	148.2	-104.7	178.1	-16	0	0	107.7
993	T	24.8	Very low	26.4	Very low	108 Å²	108	150.3 Å²	150.3	66%	0.663	79%	0.789	S	S	*	*			trans	-69.2	128.5	163.6	32.4	0	0	0	0	109.9
994	Y	28.6	Very low	26.2	Very low	240 Å²	240	148.7 Å²	148.7	94%	0.941	79%	0.792	S	S	*	*			trans	-132	115.5	139.8	-97.1	-83.1	0	0	0	108.1
995	S	25.3	Very low	26.1	Very low	95 Å²	95	146.9 Å²	146.9	66%	0.664	79%	0.789	S	S	*	*			trans	-100.8	173	176.7	50.3	0	0	0	0	110.4
996	V	27.5	Very low	26.2	Very low	144 Å²	144	148.8 Å²	148.8	87%	0.873	79%	0.79	S	S	*	*			trans	88.1	116.9	170.5	-165.6	0	0	0	0	111.4
997	G	27.7	Very low	26.3	Very low	70 Å²	70	150.4 Å²	150.4	72%	0.722	79%	0.787	S	S	*	*			cis	144.2	148.5	28.8	0	0	0	0	0	103.3
998	R	27.2	Very low	26.3	Very low	217 Å²	217	145.9 Å²	145.9	82%	0.819	78%	0.776	S	S	*	*			cis	-171.8	142.8	28	-106.9	177.9	-174.8	178.7	1.7	105.8
999	R	23.8	Very low	26.5	Very low	208 Å²	208	143.8 Å²	143.8	79%	0.785	78%	0.78	S	S	*	*				42.4	120.3	127.9	-72	-173.7	-149.1	177.6	4.8	118.4
1000	C	24.2	Very low	26.6	Very low	112 Å²	112	139.7 Å²	139.7	76%	0.757	78%	0.775	S	S	*	*				120.5	146.7	86.2	-96.2	0	0	0	0	105.4
1001	S	24.7	Very low	26.5	Very low	94 Å²	94	135 Å²	135	66%	0.657	78%	0.778	S	S	*	*			cis	174	162.7	-7.3	32.3	0	0	0	0	104.7
1002	S	26.5	Very low	26.7	Very low	113 Å²	113	131.6 Å²	131.6	79%	0.79	78%	0.783	S	S	*	*			trans	69.4	147.2	160	74.7	0	0	0	0	116.9
1003	S	25.8	Very low	26.8	Very low	95 Å²	95	126 Å²	126	66%	0.664	78%	0.778	S	S	*	*			cis	175.3	142.8	-10.9	51.7	0	0	0	0	105.4
1004	V	26.9	Very low	26.8	Very low	149 Å²	149	127.3 Å²	127.3	90%	0.903	79%	0.79	S	S	*	*			trans	68	126.7	138.2	177.8	0	0	0	0	118.7
1005	G	28.2	Very low	26.9	Very low	63 Å²	63	123.7 Å²	123.7	65%	0.649	79%	0.786	S	S	*	*			trans	133.2	92.2	134	0	0	0	0	0	116.4
1006	N	26.2	Very low	27.2	Very low	156 Å²	156	125.7 Å²	125.7	83%	0.834	79%	0.789	S	S	*	*			trans	13.3	140.6	131	-69.3	-5.1	0	0	0	117.3
1007	M	27.4	Very low	27.2	Very low	162 Å²	162	123 Å²	123	80%	0.798	79%	0.79	S	S	*	*				-177.3	132.6	54.7	-137.7	159.7	77.3	0	0	109.8
1008	T	25.9	Very low	27.3	Very low	110 Å²	110	123.1 Å²	123.1	68%	0.675	79%	0.791	S	S	*	*			trans	24.2	140.2	138.9	61	0	0	0	0	122.5
1009	I	28.8	Very low	27.5	Very low	173 Å²	173	119.5 Å²	119.5	89%	0.887	79%	0.787	S	S	*	*			trans	147.7	123.2	135	-73	152.1	0	0	0	105.4
1010	G	27.5	Very low	27.9	Very low	70 Å²	70	116.8 Å²	116.8	72%	0.722	79%	0.788	S	S	*	*			cis	170.1	147.9	4.1	0	0	0	0	0	107.3
1011	G	25.7	Very low	28.6	Very low	81 Å²	81	117.5 Å²	117.5	84%	0.835	78%	0.784	S	S	*	*			trans	67	99.5	152.5	0	0	0	0	0	119.7
1012	A	29.4	Very low	29.5	Very low	109 Å²	109	120.2 Å²	120.2	90%	0.901	79%	0.786	S	S	*	*				169.3	136.5	126	0	0	0	0	0	111.3
1013	G	30.4	Very low	30.5	Very low	78 Å²	78	118.5 Å²	118.5	80%	0.804	77%	0.768	S	S	*	*			trans	99.2	68.7	151.3	0	0	0	0	0	117.1	L1015	G1013-L1015 PolarHBondContact O-N 3.33Å
1014	C	24.6	Very low	31.8	Very low	134 Å²	134	119.1 Å²	119.1	91%	0.905	77%	0.769	S	S	*	*			trans	-60.5	107.8	169.8	-166.3	0	0	0	0	111.7
1015	L	30.4	Very low	33.3	Very low	164 Å²	164	118.2 Å²	118.2	86%	0.859	76%	0.755	S	S	*	*			trans	-173.6	121.5	160.2	-93.2	166.7	0	0	0	106.4	G1013	G1013-L1015 PolarHBondContact O-N 3.33Å
1016	L	33.2	Very low	35	Very low	138 Å²	138	116.8 Å²	116.8	72%	0.723	73%	0.732	S	S	*	*			trans	99.9	25.3	-176.5	-55	166.1	0	0	0	118.2	G1018	L1016-G1018 PolarHBondContact O-N 2.97Å
1017	G	26.9	Very low	36.9	Very low	87 Å²	87	113.3 Å²	113.3	90%	0.897	71%	0.714	S	S	*	*			trans	-83.8	110.1	165.6	0	0	0	0	0	111.8
1018	G	29.1	Very low	38.9	Very low	72 Å²	72	107.6 Å²	107.6	74%	0.742	69%	0.693	S	S	*	*			trans	161.5	-5.5	163.3	0	0	0	0	0	120.8	L1016 N1020	L1016-G1018 PolarHBondContact O-N 2.97Å; G1018-N1020 VanDerWaalsContact C-N 3.34Å; G1018-N1020 PolarHBondContact O-N 2.77Å
1019	L	32	Very low	40.8	Very low	141 Å²	141	104.1 Å²	104.1	74%	0.738	67%	0.669	S	S	*	*			trans	-95.5	52.3	178	-80.3	162	0	0	0	112.6	L1021	L1019-L1021 PolarHBondContact O-N 3.18Å; L1019-L1021 VanDerWaalsContact O-N 3.13Å
1020	N	33.1	Very low	42.8	Very low	152 Å²	152	100 Å²	100	81%	0.813	65%	0.647	S	S	*	*			trans	-78	85.3	152.3	-100	-45.1	0	0	0	106.8	G1018 Q1022	G1018-N1020 VanDerWaalsContact C-N 3.34Å; G1018-N1020 PolarHBondContact O-N 2.77Å; N1020-Q1022 PolarHBondContact O-N 3.11Å
1021	L	38.4	Very low	45.2	Very low	126 Å²	126	104.6 Å²	104.6	66%	0.66	64%	0.642	S	S	*	*			trans	-72.4	68.5	167.7	-157.9	85.9	0	0	0	108.2	L1019 L1023	L1019-L1021 PolarHBondContact O-N 3.18Å; L1019-L1021 VanDerWaalsContact O-N 3.13Å; L1021-L1023 HydrophobicContact CD2-CD1 3.83Å; L1021-L1023 HydrophobicContact CD2-CG 4.49Å; L1021-L1023 HydrophobicContact CG-CD1 4.33Å; L1021-L1023 PolarHBondContact O-N 3.23Å
1022	Q	42.7	Very low	47.3	Very low	151 Å²	151	105.7 Å²	105.7	71%	0.706	63%	0.627	S	S	*	*			trans	-70.3	90.4	168.3	-161.6	164.9	-5.2	0	0	105	N1020 P1024	N1020-Q1022 PolarHBondContact O-N 3.11Å; Q1022-P1024 WeakPolarHBondContact O-CD 3.41Å
1023	L	48.4	Very low	49.5	Very low	77 Å²	77	103.2 Å²	103.2	40%	0.403	60%	0.597	S	S	.	*			trans	-54.8	111.5	178.8	-90.3	96.7	0	0	0	107.6	L1021 Q1025 L1026	L1021-L1023 HydrophobicContact CD2-CD1 3.83Å; L1021-L1023 HydrophobicContact CD2-CG 4.49Å; L1021-L1023 HydrophobicContact CG-CD1 4.33Å; L1021-L1023 PolarHBondContact O-N 3.23Å; L1023-Q1025 HydrophobicContact CD2-CB 4.43Å; L1023-Q1025 PolarHBondContact O-N 2.97Å; L1023-L1026 PolarHBondContact O-N 3.17Å
1024	P	53.3	Low	51.8	Low	108 Å²	108	107 Å²	107	70%	0.701	59%	0.591	S	S	*	*	H	α-helix	trans	-61.2	-12.4	174.2	25	-32.1	0	0	0	111.4	Q1022 A1028	Q1022-P1024 WeakPolarHBondContact O-CD 3.41Å; P1024-A1028 PolarHBondContact O-N 3.02Å
1025	Q	57.1	Low	54.4	Low	131 Å²	131	105.1 Å²	105.1	61%	0.612	57%	0.571	S	S	*	*	H	α-helix	trans	-72.7	-27.1	175.2	-58.4	-148	-21.3	0	0	114.1	L1023 A1028 I1029	L1023-Q1025 HydrophobicContact CD2-CB 4.43Å; L1023-Q1025 PolarHBondContact O-N 2.97Å; Q1025-A1028 PolarHBondContact O-N 3.14Å; Q1025-I1029 WeakPolarHBondContact O-CB 3.5Å; Q1025-I1029 WeakPolarHBondContact O-CD1 3.43Å; Q1025-I1029 WeakPolarHBondContact O-CG1 3.13Å; Q1025-I1029 PolarHBondContact O-N 3.35Å
1026	L	64.3	Low	56.4	Low	32 Å²	32	99.9 Å²	99.9	17%	0.168	54%	0.543	C	S	.	.	H	α-helix	trans	-69.2	-40.6	177.5	-169	69.9	0	0	0	110.8	L1023 A1028 I1029 Q1030 V1084	L1023-L1026 PolarHBondContact O-N 3.17Å; L1026-A1028 VanDerWaalsContact C-N 3.32Å; L1026-A1028 PolarHBondContact O-N 3.39Å; L1026-I1029 PolarHBondContact O-N 2.99Å; L1026-Q1030 WeakPolarHBondContact O-CB 3.34Å; L1026-Q1030 WeakPolarHBondContact O-CG 3.42Å; L1026-Q1030 PolarHBondContact O-N 3.17Å; L1026-V1084 HydrophobicContact CD1-CG1 4.1Å
1027	D	66.8	Low	58.4	Low	83 Å²	83	95.7 Å²	95.7	44%	0.444	52%	0.522	S	S	.	.	H	α-helix	trans	-62.1	-40.4	172.8	-87.7	3.9	0	0	0	111.5	Q1030 R1031	D1027-Q1030 PolarHBondContact O-N 3.23Å; D1027-R1031 WeakPolarHBondContact O-CB 3.49Å; D1027-R1031 VanDerWaalsContact O-CG 3.24Å; D1027-R1031 WeakPolarHBondContact O-CG 3.39Å; D1027-R1031 PolarHBondContact O-N 2.78Å
1028	A	69.6	Low	60.9	Low	43 Å²	43	97.4 Å²	97.4	36%	0.355	51%	0.508	S	S	.	.	H	α-helix	trans	-65	-41.9	176	0	0	0	0	0	112	P1024 Q1025 L1026 R1031 M1032	P1024-A1028 PolarHBondContact O-N 3.02Å; Q1025-A1028 PolarHBondContact O-N 3.14Å; L1026-A1028 VanDerWaalsContact C-N 3.32Å; L1026-A1028 PolarHBondContact O-N 3.39Å; A1028-R1031 PolarHBondContact O-N 3.47Å; A1028-M1032 PolarHBondContact O-N 3.07Å
1029	I	65.4	Low	63.1	Low	36 Å²	36	102.1 Å²	102.1	19%	0.185	50%	0.503	C	S	.	.	H	α-helix	trans	-66.7	-42.1	176.8	-67.5	163.7	0	0	0	110.8	Q1025 L1026 R1031 M1032 Q1033 L1077 V1081	Q1025-I1029 WeakPolarHBondContact O-CB 3.5Å; Q1025-I1029 WeakPolarHBondContact O-CD1 3.43Å; Q1025-I1029 WeakPolarHBondContact O-CG1 3.13Å; Q1025-I1029 PolarHBondContact O-N 3.35Å; L1026-I1029 PolarHBondContact O-N 2.99Å; I1029-R1031 VanDerWaalsContact C-N 3.35Å; I1029-R1031 PolarHBondContact O-N 3.26Å; I1029-M1032 HydrophobicContact CG1-CE 4.32Å; I1029-M1032 PolarHBondContact O-N 3.38Å; I1029-Q1033 WeakPolarHBondContact O-CB 3.34Å; I1029-Q1033 PolarHBondContact O-N 2.8Å; I1029-L1077 HydrophobicContact CG2-CD2 4.45Å; I1029-V1081 HydrophobicContact CG2-CG2 3.65Å
1030	Q	71.2	Confident	65	Low	87 Å²	87	97 Å²	97	41%	0.407	48%	0.477	S	S	.	.	H	α-helix	trans	-65.6	-36.7	175.6	-73.9	-177.4	1.9	0	0	112.2	L1026 D1027 Q1033 K1034	L1026-Q1030 WeakPolarHBondContact O-CB 3.34Å; L1026-Q1030 WeakPolarHBondContact O-CG 3.42Å; L1026-Q1030 PolarHBondContact O-N 3.17Å; D1027-Q1030 PolarHBondContact O-N 3.23Å; Q1030-Q1033 PolarHBondContact O-N 3.32Å; Q1030-K1034 PolarHBondContact O-N 3.49Å
1031	R	76.3	Confident	67.2	Low	167 Å²	167	95.7 Å²	95.7	63%	0.63	47%	0.465	S	S	*	.	H	α-helix	trans	-64.8	-44.5	171.7	-74.4	178.1	-152.8	-162	7.2	111.4	D1027 A1028 I1029 Q1033 K1034 I1035	D1027-R1031 WeakPolarHBondContact O-CB 3.49Å; D1027-R1031 VanDerWaalsContact O-CG 3.24Å; D1027-R1031 WeakPolarHBondContact O-CG 3.39Å; D1027-R1031 PolarHBondContact O-N 2.78Å; A1028-R1031 PolarHBondContact O-N 3.47Å; I1029-R1031 VanDerWaalsContact C-N 3.35Å; I1029-R1031 PolarHBondContact O-N 3.26Å; R1031-Q1033 VanDerWaalsContact C-N 3.3Å; R1031-Q1033 PolarHBondContact O-N 2.68Å; R1031-K1034 PolarHBondContact O-N 3.15Å; R1031-I1035 VanDerWaalsContact O-CG1 3.3Å; R1031-I1035 WeakPolarHBondContact O-CG1 3.49Å; R1031-I1035 PolarHBondContact O-N 2.74Å
1032	M	70.5	Confident	69.1	Low	104 Å²	104	94.2 Å²	94.2	51%	0.512	46%	0.458	S	S	.	.	H	α-helix	trans	-59.8	-41.5	174.2	-86.5	-171.8	-75.4	0	0	111.8	A1028 I1029 K1034 I1035 L1036	A1028-M1032 PolarHBondContact O-N 3.07Å; I1029-M1032 HydrophobicContact CG1-CE 4.32Å; I1029-M1032 PolarHBondContact O-N 3.38Å; M1032-K1034 PolarHBondContact O-N 2.65Å; M1032-I1035 PolarHBondContact O-N 3.48Å; M1032-L1036 WeakPolarHBondContact O-CB 3.5Å; M1032-L1036 PolarHBondContact O-N 3.24Å
1033	Q	75	Confident	70.3	Confident	57 Å²	57	90 Å²	90	27%	0.266	44%	0.44	S	S	.	.	H	α-helix	trans	-60.2	-45.7	175.3	-173.5	178.9	-15.1	0	0	111.4	I1029 Q1030 R1031 I1035 L1036 D1037	I1029-Q1033 WeakPolarHBondContact O-CB 3.34Å; I1029-Q1033 PolarHBondContact O-N 2.8Å; Q1030-Q1033 PolarHBondContact O-N 3.32Å; R1031-Q1033 VanDerWaalsContact C-N 3.3Å; R1031-Q1033 PolarHBondContact O-N 2.68Å; Q1033-I1035 PolarHBondContact O-N 2.93Å; Q1033-L1036 PolarHBondContact O-N 2.65Å; Q1033-D1037 PolarHBondContact O-N 2.98Å
1034	K	79.3	Confident	71.3	Confident	158 Å²	158	91 Å²	91	69%	0.687	44%	0.443	S	S	*	.	H	α-helix	trans	-62.1	-39.9	175.1	-76.4	-177.7	178.3	178.6	0	112.9	Q1030 R1031 M1032 D1037 M1038	Q1030-K1034 PolarHBondContact O-N 3.49Å; R1031-K1034 PolarHBondContact O-N 3.15Å; M1032-K1034 PolarHBondContact O-N 2.65Å; K1034-D1037 PolarHBondContact O-N 3.48Å; K1034-M1038 WeakPolarHBondContact O-CB 3.37Å; K1034-M1038 PolarHBondContact O-N 3Å
1035	I	78.9	Confident	72.2	Confident	93 Å²	93	88.3 Å²	88.3	48%	0.477	43%	0.43	S	S	.	.	H	α-helix	trans	-65.1	-41.9	177.3	-68.7	164.7	0	0	0	110.6	R1031 M1032 Q1033 M1038 R1039	R1031-I1035 VanDerWaalsContact O-CG1 3.3Å; R1031-I1035 WeakPolarHBondContact O-CG1 3.49Å; R1031-I1035 PolarHBondContact O-N 2.74Å; M1032-I1035 PolarHBondContact O-N 3.48Å; Q1033-I1035 PolarHBondContact O-N 2.93Å; I1035-M1038 PolarHBondContact O-N 2.68Å; I1035-R1039 WeakPolarHBondContact O-CB 3.5Å; I1035-R1039 WeakPolarHBondContact O-CG 3.13Å; I1035-R1039 PolarHBondContact O-N 3.43Å
1036	L	73.6	Confident	72.7	Confident	54 Å²	54	87.5 Å²	87.5	28%	0.283	43%	0.426	S	S	.	.	H	α-helix	trans	-63.6	-44	174.9	-95.2	146	0	0	0	111.9	M1032 Q1033 M1038 R1039 L1040 I1070 L1077	M1032-L1036 WeakPolarHBondContact O-CB 3.5Å; M1032-L1036 PolarHBondContact O-N 3.24Å; Q1033-L1036 PolarHBondContact O-N 2.65Å; L1036-M1038 VanDerWaalsContact C-N 3.33Å; L1036-M1038 PolarHBondContact O-N 2.8Å; L1036-R1039 PolarHBondContact O-N 3.09Å; L1036-L1040 WeakPolarHBondContact O-CB 3.23Å; L1036-L1040 PolarHBondContact O-N 2.81Å; L1036-I1070 HydrophobicContact CD2-CG2 4.21Å; L1036-L1077 HydrophobicContact CD1-CD1 3.82Å
1037	D	75	Confident	72.7	Confident	50 Å²	50	86.2 Å²	86.2	27%	0.267	42%	0.42	S	S	.	.	H	α-helix	trans	-62.3	-40.8	176.3	-74.8	-19.7	0	0	0	111.3	Q1033 K1034 L1040 Q1041 Q1074	Q1033-D1037 PolarHBondContact O-N 2.98Å; K1034-D1037 PolarHBondContact O-N 3.48Å; D1037-L1040 PolarHBondContact O-N 3.44Å; D1037-Q1041 WeakPolarHBondContact O-CG 3.04Å; D1037-Q1041 PolarHBondContact O-N 2.82Å; D1037-Q1074 PolarHBondContact OD1-NE2 2.98Å
1038	M	79	Confident	72.6	Confident	123 Å²	123	86.7 Å²	86.7	61%	0.606	42%	0.422	S	S	*	.	H	α-helix	trans	-67.4	-39.7	177	-166	179.7	163.7	0	0	112.1	K1034 I1035 L1036 Q1041 N1042	K1034-M1038 WeakPolarHBondContact O-CB 3.37Å; K1034-M1038 PolarHBondContact O-N 3Å; I1035-M1038 PolarHBondContact O-N 2.68Å; L1036-M1038 VanDerWaalsContact C-N 3.33Å; L1036-M1038 PolarHBondContact O-N 2.8Å; M1038-Q1041 PolarHBondContact O-N 3.13Å; M1038-N1042 PolarHBondContact O-N 2.79Å
1039	R	74.8	Confident	72.4	Confident	172 Å²	172	91.7 Å²	91.7	65%	0.649	44%	0.438	S	S	*	.	H	α-helix	trans	-65.7	-39.1	173.2	-77.7	-176.4	176.2	-173.7	-0.5	112.1	I1035 L1036 N1042 L1043	I1035-R1039 WeakPolarHBondContact O-CB 3.5Å; I1035-R1039 WeakPolarHBondContact O-CG 3.13Å; I1035-R1039 PolarHBondContact O-N 3.43Å; L1036-R1039 PolarHBondContact O-N 3.09Å; R1039-N1042 PolarHBondContact O-N 3.47Å; R1039-L1043 WeakPolarHBondContact O-CB 3.5Å; R1039-L1043 WeakPolarHBondContact O-CG 3.41Å; R1039-L1043 PolarHBondContact O-N 3.28Å
1040	L	72.5	Confident	72.2	Confident	34 Å²	34	94 Å²	94	18%	0.178	45%	0.451	C	S	.	.	H	α-helix	trans	-64.9	-42.5	176.7	-174.4	67.7	0	0	0	111.2	L1036 D1037 L1043 Q1044 I1070	L1036-L1040 WeakPolarHBondContact O-CB 3.23Å; L1036-L1040 PolarHBondContact O-N 2.81Å; D1037-L1040 PolarHBondContact O-N 3.44Å; L1040-L1043 PolarHBondContact O-N 3.47Å; L1040-Q1044 WeakPolarHBondContact O-CG 3.27Å; L1040-Q1044 PolarHBondContact O-N 3.5Å; L1040-I1070 HydrophobicContact CD1-CB 4.49Å; L1040-I1070 HydrophobicContact CD1-CG2 3.91Å
1041	Q	78.6	Confident	71.6	Confident	124 Å²	124	94.6 Å²	94.6	58%	0.579	46%	0.456	S	S	*	.	H	α-helix	trans	-63.1	-41.9	174.7	-75.2	177.6	1	0	0	112.3	D1037 M1038 Q1044 A1045	D1037-Q1041 WeakPolarHBondContact O-CG 3.04Å; D1037-Q1041 PolarHBondContact O-N 2.82Å; M1038-Q1041 PolarHBondContact O-N 3.13Å; Q1041-Q1044 WeakPolarHBondContact O-CB 3.31Å; Q1041-Q1044 PolarHBondContact O-N 3.31Å; Q1041-A1045 PolarHBondContact O-N 2.76Å
1042	N	79	Confident	70.8	Confident	95 Å²	95	97 Å²	97	51%	0.508	47%	0.467	S	S	.	.	H	α-helix	trans	-63.8	-41.5	175.4	-82	-14.6	0	0	0	112.3	M1038 R1039 Q1044 A1045 Q1046	M1038-N1042 PolarHBondContact O-N 2.79Å; R1039-N1042 PolarHBondContact O-N 3.47Å; N1042-Q1044 VanDerWaalsContact C-N 3.33Å; N1042-A1045 PolarHBondContact O-N 3.25Å; N1042-Q1046 WeakPolarHBondContact O-CG 3Å; N1042-Q1046 PolarHBondContact O-N 3.36Å
1043	L	67.7	Low	70.2	Confident	63 Å²	63	95 Å²	95	33%	0.33	47%	0.468	S	S	.	.	H	α-helix	trans	-67	-34	174.5	-76.3	168.2	0	0	0	112.1	R1039 L1040 S1047 I1070	R1039-L1043 WeakPolarHBondContact O-CB 3.5Å; R1039-L1043 WeakPolarHBondContact O-CG 3.41Å; R1039-L1043 PolarHBondContact O-N 3.28Å; L1040-L1043 PolarHBondContact O-N 3.47Å; L1043-S1047 WeakPolarHBondContact O-CB 3.39Å; L1043-S1047 PolarHBondContact O-N 2.77Å; L1043-S1047 PolarHBondContact O-OG 3.3Å; L1043-I1070 HydrophobicContact CD1-CD1 3.92Å
1044	Q	70.1	Confident	69.1	Low	97 Å²	97	98.8 Å²	98.8	45%	0.453	50%	0.5	S	S	.	.	H	α-helix	trans	-62.8	-49.7	171.9	-78.2	175.6	-47.8	0	0	110.7	L1040 Q1041 N1042 Q1046 S1047 D1048	L1040-Q1044 WeakPolarHBondContact O-CG 3.27Å; L1040-Q1044 PolarHBondContact O-N 3.5Å; Q1041-Q1044 WeakPolarHBondContact O-CB 3.31Å; Q1041-Q1044 PolarHBondContact O-N 3.31Å; N1042-Q1044 VanDerWaalsContact C-N 3.33Å; Q1044-Q1046 PolarHBondContact O-N 2.77Å; Q1044-S1047 PolarHBondContact O-N 2.74Å; Q1044-S1047 VanDerWaalsContact O-N 3.14Å; Q1044-S1047 PolarHBondContact O-OG 3.4Å; Q1044-D1048 PolarHBondContact O-N 2.96Å
1045	A	70.6	Confident	68	Low	52 Å²	52	94 Å²	94	43%	0.43	50%	0.495	S	S	.	.	H	α-helix	trans	-60.5	-43.5	178.1	0	0	0	0	0	112.7	Q1041 N1042 S1047 D1048 Q1049	Q1041-A1045 PolarHBondContact O-N 2.76Å; N1042-A1045 PolarHBondContact O-N 3.25Å; A1045-S1047 VanDerWaalsContact C-N 3.35Å; A1045-D1048 PolarHBondContact O-N 2.93Å; A1045-Q1049 PolarHBondContact O-N 3.28Å
1046	Q	67.6	Low	67.4	Low	113 Å²	113	94.8 Å²	94.8	53%	0.528	50%	0.5	S	S	.	.	H	α-helix	trans	-66.7	-35.8	175.3	-76.6	-175.9	-23.8	0	0	112.3	N1042 Q1044 D1048 Q1049 L1050	N1042-Q1046 WeakPolarHBondContact O-CG 3Å; N1042-Q1046 PolarHBondContact O-N 3.36Å; Q1044-Q1046 PolarHBondContact O-N 2.77Å; Q1046-D1048 VanDerWaalsContact C-N 3.35Å; Q1046-Q1049 PolarHBondContact O-N 3.47Å; Q1046-L1050 WeakPolarHBondContact O-CG 3.29Å; Q1046-L1050 PolarHBondContact O-N 3.36Å
1047	S	64.5	Low	67	Low	5 Å²	5	96 Å²	96	4%	0.035	52%	0.519	C	S	.	.	H	α-helix	trans	-70.3	-32	177.5	76.5	0	0	0	0	113.1	L1043 Q1044 A1045 Q1049 L1050 N1051 R1067	L1043-S1047 WeakPolarHBondContact O-CB 3.39Å; L1043-S1047 PolarHBondContact O-N 2.77Å; L1043-S1047 PolarHBondContact O-OG 3.3Å; Q1044-S1047 PolarHBondContact O-N 2.74Å; Q1044-S1047 VanDerWaalsContact O-N 3.14Å; Q1044-S1047 PolarHBondContact O-OG 3.4Å; A1045-S1047 VanDerWaalsContact C-N 3.35Å; S1047-Q1049 VanDerWaalsContact C-N 3.31Å; S1047-L1050 PolarHBondContact O-N 3.13Å; S1047-N1051 VanDerWaalsContact O-CG 3.28Å; S1047-N1051 PolarHBondContact O-N 2.79Å; S1047-N1051 PolarHBondContact O-ND2 3.24Å; S1047-R1067 PolarHBondContact OG-NH2 3.49Å
1048	D	65.9	Low	66.7	Low	94 Å²	94	102.4 Å²	102.4	50%	0.503	54%	0.539	S	S	.	.	H	α-helix	trans	-70.8	-31.2	175.3	-70	-23.6	0	0	0	111.3	Q1044 A1045 Q1046 Y1052	Q1044-D1048 PolarHBondContact O-N 2.96Å; A1045-D1048 PolarHBondContact O-N 2.93Å; Q1046-D1048 VanDerWaalsContact C-N 3.35Å; D1048-Y1052 VanDerWaalsContact O-CD2 3.3Å; D1048-Y1052 WeakPolarHBondContact O-CD2 3.39Å
1049	Q	64.9	Low	66.1	Low	147 Å²	147	99.9 Å²	99.9	69%	0.687	53%	0.527	S	S	*	.	H	α-helix	trans	-68.7	-39.7	169.2	-69.5	-179.9	-12.5	0	0	112.2	A1045 Q1046 S1047 N1051 Y1052	A1045-Q1049 PolarHBondContact O-N 3.28Å; Q1046-Q1049 PolarHBondContact O-N 3.47Å; S1047-Q1049 VanDerWaalsContact C-N 3.31Å; Q1049-N1051 VanDerWaalsContact C-N 3.33Å; Q1049-N1051 PolarHBondContact O-N 3.13Å; Q1049-Y1052 PolarHBondContact O-N 3.38Å
1050	L	60.4	Low	65.8	Low	86 Å²	86	98.6 Å²	98.6	45%	0.45	53%	0.526	S	S	.	.	H	α-helix	trans	-71.9	-23.8	177.6	-76.6	162.9	0	0	0	113.4	Q1046 S1047 Y1052 A1053 I1063	Q1046-L1050 WeakPolarHBondContact O-CG 3.29Å; Q1046-L1050 PolarHBondContact O-N 3.36Å; S1047-L1050 PolarHBondContact O-N 3.13Å; L1050-Y1052 PolarHBondContact O-N 2.94Å; L1050-A1053 PolarHBondContact O-N 3.22Å; L1050-I1063 HydrophobicContact CD1-CD1 3.96Å
1051	N	59.9	Low	65.9	Low	98 Å²	98	103.6 Å²	103.6	52%	0.524	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-17.3	175.2	-78.9	-34.4	0	0	0	113.4	S1047 Q1049	S1047-N1051 VanDerWaalsContact O-CG 3.28Å; S1047-N1051 PolarHBondContact O-N 2.79Å; S1047-N1051 PolarHBondContact O-ND2 3.24Å; Q1049-N1051 VanDerWaalsContact C-N 3.33Å; Q1049-N1051 PolarHBondContact O-N 3.13Å
1052	Y	58.9	Low	65.6	Low	217 Å²	217	102.8 Å²	102.8	85%	0.851	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-11.5	172	-69.2	-80.7	0	0	0	113.8	D1048 Q1049 L1050	D1048-Y1052 VanDerWaalsContact O-CD2 3.3Å; D1048-Y1052 WeakPolarHBondContact O-CD2 3.39Å; Q1049-Y1052 PolarHBondContact O-N 3.38Å; L1050-Y1052 PolarHBondContact O-N 2.94Å
1053	A	57.9	Low	65.2	Low	64 Å²	64	100.4 Å²	100.4	53%	0.529	53%	0.532	S	S	.	.			trans	-99.1	103	178.3	0	0	0	0	0	110.3	L1050 G1055	L1050-A1053 PolarHBondContact O-N 3.22Å; A1053-G1055 PolarHBondContact O-N 3.45Å
1054	S	52.1	Low	65.3	Low	135 Å²	135	100.5 Å²	100.5	94%	0.944	54%	0.538	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	30.1	-171.6	68	0	0	0	0	115.9
1055	G	57.3	Low	65.6	Low	57 Å²	57	101.4 Å²	101.4	59%	0.588	54%	0.542	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-26.5	-157.3	0	0	0	0	0	119.4	A1053	A1053-G1055 PolarHBondContact O-N 3.45Å
1056	N	64.4	Low	65.8	Low	110 Å²	110	102.1 Å²	102.1	59%	0.588	54%	0.54	S	S	*	.			trans	-147.2	96.9	-168.2	-87.1	-36.3	0	0	0	114.2	R1058 I1059 K1060	N1056-R1058 VanDerWaalsContact C-N 3.25Å; N1056-R1058 PolarHBondContact O-N 2.65Å; N1056-I1059 HydrophobicContact CB-CB 4.14Å; N1056-I1059 HydrophobicContact CB-CD1 3.71Å; N1056-I1059 HydrophobicContact CB-CG1 3.89Å; N1056-I1059 PolarHBondContact O-N 3.42Å; N1056-K1060 PolarHBondContact O-N 3.27Å
1057	A	66.9	Low	66	Low	80 Å²	80	101.9 Å²	101.9	66%	0.661	54%	0.535	S	S	*	.	H	α-helix	trans	-59.6	-33.5	175.1	0	0	0	0	0	113.1	K1060 E1061	A1057-K1060 WeakPolarHBondContact O-CB 3.33Å; A1057-K1060 PolarHBondContact O-N 3Å; A1057-E1061 PolarHBondContact O-N 3.45Å; A1057-E1061 VanDerWaalsContact O-N 3.07Å
1058	R	67.2	Low	66.7	Low	185 Å²	185	107 Å²	107	70%	0.698	56%	0.558	S	S	*	*	H	α-helix	trans	-64.2	-43	179.3	-171.5	175.3	178	169.3	3.5	113	N1056 K1060 E1061 E1062	N1056-R1058 VanDerWaalsContact C-N 3.25Å; N1056-R1058 PolarHBondContact O-N 2.65Å; R1058-K1060 PolarHBondContact O-N 3.46Å; R1058-E1061 PolarHBondContact O-N 2.93Å; R1058-E1062 IonicContact NE-OE1 3.69Å; R1058-E1062 PolarHBondContact O-N 2.73Å
1059	I	68	Low	67.1	Low	69 Å²	69	107.1 Å²	107.1	35%	0.354	56%	0.558	S	S	.	*	H	α-helix	trans	-64.5	-35	176.3	-62.7	177	0	0	0	110.1	N1056 E1062 I1063	N1056-I1059 HydrophobicContact CB-CB 4.14Å; N1056-I1059 HydrophobicContact CB-CD1 3.71Å; N1056-I1059 HydrophobicContact CB-CG1 3.89Å; N1056-I1059 PolarHBondContact O-N 3.42Å; I1059-E1062 PolarHBondContact O-N 3.36Å; I1059-I1063 HydrophobicContact CG2-CD1 3.66Å; I1059-I1063 HydrophobicContact CG2-CG1 4.26Å; I1059-I1063 WeakPolarHBondContact O-CB 3.06Å; I1059-I1063 VanDerWaalsContact O-CG1 3.22Å; I1059-I1063 WeakPolarHBondContact O-CG1 3.38Å; I1059-I1063 PolarHBondContact O-N 3.02Å
1060	K	67.7	Low	67.7	Low	146 Å²	146	101.6 Å²	101.6	64%	0.635	53%	0.533	S	S	*	.	H	α-helix	trans	-66.2	-39.8	176.8	-162.8	175.5	-176.4	174.3	0	112.2	N1056 A1057 R1058 S1064	N1056-K1060 PolarHBondContact O-N 3.27Å; A1057-K1060 WeakPolarHBondContact O-CB 3.33Å; A1057-K1060 PolarHBondContact O-N 3Å; R1058-K1060 PolarHBondContact O-N 3.46Å; K1060-S1064 WeakPolarHBondContact O-CB 3.37Å; K1060-S1064 PolarHBondContact O-N 3.38Å
1061	E	74	Confident	68.4	Low	138 Å²	138	99.6 Å²	99.6	65%	0.645	53%	0.526	S	S	*	.	H	α-helix	trans	-66.4	-46.9	174.5	-76.5	-176.8	171.3	0	0	111.8	A1057 R1058 I1063 S1064 H1065	A1057-E1061 PolarHBondContact O-N 3.45Å; A1057-E1061 VanDerWaalsContact O-N 3.07Å; R1058-E1061 PolarHBondContact O-N 2.93Å; E1061-I1063 PolarHBondContact O-N 2.89Å; E1061-S1064 PolarHBondContact O-N 3.48Å; E1061-S1064 VanDerWaalsContact O-N 3.1Å; E1061-S1064 PolarHBondContact O-OG 2.88Å; E1061-H1065 PolarHBondContact O-N 3Å
1062	E	71.8	Confident	69.3	Low	107 Å²	107	99.9 Å²	99.9	50%	0.5	52%	0.524	S	S	.	.	H	α-helix	trans	-61.2	-45	178.4	-72.8	176.5	-174.8	0	0	111.8	R1058 I1059 S1064 H1065 V1066	R1058-E1062 IonicContact NE-OE1 3.69Å; R1058-E1062 PolarHBondContact O-N 2.73Å; I1059-E1062 PolarHBondContact O-N 3.36Å; E1062-S1064 VanDerWaalsContact C-N 3.29Å; E1062-S1064 PolarHBondContact O-N 3.44Å; E1062-H1065 PolarHBondContact O-N 3.34Å; E1062-V1066 VanDerWaalsContact O-CG2 3.3Å; E1062-V1066 WeakPolarHBondContact O-CG2 3.31Å; E1062-V1066 PolarHBondContact O-N 3.38Å
1063	I	70.5	Confident	70	Confident	46 Å²	46	91.9 Å²	91.9	24%	0.236	50%	0.5	C	S	.	.	H	α-helix	trans	-62.8	-37.3	175	-68.5	171.7	0	0	0	111	L1050 I1059 E1061 R1067	L1050-I1063 HydrophobicContact CD1-CD1 3.96Å; I1059-I1063 HydrophobicContact CG2-CD1 3.66Å; I1059-I1063 HydrophobicContact CG2-CG1 4.26Å; I1059-I1063 WeakPolarHBondContact O-CB 3.06Å; I1059-I1063 VanDerWaalsContact O-CG1 3.22Å; I1059-I1063 WeakPolarHBondContact O-CG1 3.38Å; I1059-I1063 PolarHBondContact O-N 3.02Å; E1061-I1063 PolarHBondContact O-N 2.89Å; I1063-R1067 WeakPolarHBondContact O-CG 3.36Å; I1063-R1067 PolarHBondContact O-N 3.22Å
1064	S	71	Confident	70.8	Confident	65 Å²	65	92.1 Å²	92.1	46%	0.455	49%	0.49	S	S	.	.	H	α-helix	trans	-66.9	-39	177.5	78.6	0	0	0	0	112.7	K1060 E1061 E1062 R1067 Q1068	K1060-S1064 WeakPolarHBondContact O-CB 3.37Å; K1060-S1064 PolarHBondContact O-N 3.38Å; E1061-S1064 PolarHBondContact O-N 3.48Å; E1061-S1064 VanDerWaalsContact O-N 3.1Å; E1061-S1064 PolarHBondContact O-OG 2.88Å; E1062-S1064 VanDerWaalsContact C-N 3.29Å; E1062-S1064 PolarHBondContact O-N 3.44Å; S1064-R1067 PolarHBondContact O-N 2.93Å; S1064-Q1068 PolarHBondContact O-N 3.49Å
1065	H	75.7	Confident	72.1	Confident	115 Å²	115	92 Å²	92	53%	0.532	47%	0.473	S	S	.	.	H	α-helix	trans	-68.1	-43.3	176.6	-171.4	-105.4	0	0	0	111.3	E1061 E1062 R1067 Q1068 L1069	E1061-H1065 PolarHBondContact O-N 3Å; E1062-H1065 PolarHBondContact O-N 3.34Å; H1065-R1067 VanDerWaalsContact C-N 3.34Å; H1065-R1067 PolarHBondContact O-N 3.31Å; H1065-Q1068 PolarHBondContact O-N 2.93Å; H1065-Q1068 VanDerWaalsContact O-N 3.15Å; H1065-L1069 PolarHBondContact O-N 3.47Å
1066	V	75.2	Confident	72.9	Confident	67 Å²	67	91.7 Å²	91.7	41%	0.406	47%	0.465	S	S	.	.	H	α-helix	trans	-61.6	-40.7	174.2	172.7	0	0	0	0	111.2	E1062 Q1068 L1069 I1070	E1062-V1066 VanDerWaalsContact O-CG2 3.3Å; E1062-V1066 WeakPolarHBondContact O-CG2 3.31Å; E1062-V1066 PolarHBondContact O-N 3.38Å; V1066-Q1068 VanDerWaalsContact C-N 3.33Å; V1066-Q1068 PolarHBondContact O-N 3.36Å; V1066-L1069 PolarHBondContact O-N 2.83Å; V1066-I1070 HydrophobicContact CG1-CD1 3.68Å; V1066-I1070 HydrophobicContact CG1-CG1 4.32Å; V1066-I1070 VanDerWaalsContact O-CG1 3.29Å; V1066-I1070 WeakPolarHBondContact O-CG1 3.43Å; V1066-I1070 PolarHBondContact O-N 2.78Å
1067	R	71.4	Confident	73.4	Confident	109 Å²	109	88.6 Å²	88.6	41%	0.411	45%	0.448	S	S	.	.	H	α-helix	trans	-60.9	-40.4	173.6	-79.7	-177.4	-166.3	167.3	1.7	112.5	S1047 I1063 S1064 H1065 I1070 S1071	S1047-R1067 PolarHBondContact OG-NH2 3.49Å; I1063-R1067 WeakPolarHBondContact O-CG 3.36Å; I1063-R1067 PolarHBondContact O-N 3.22Å; S1064-R1067 PolarHBondContact O-N 2.93Å; H1065-R1067 VanDerWaalsContact C-N 3.34Å; H1065-R1067 PolarHBondContact O-N 3.31Å; R1067-I1070 PolarHBondContact O-N 3.31Å; R1067-S1071 WeakPolarHBondContact O-CB 3.3Å; R1067-S1071 PolarHBondContact O-N 3.33Å
1068	Q	79.1	Confident	73.9	Confident	113 Å²	113	86.9 Å²	86.9	53%	0.528	43%	0.431	S	S	.	.	H	α-helix	trans	-65.2	-46.6	178.8	-172.3	176.7	-17.4	0	0	110.9	S1064 H1065 V1066 I1070 S1071 E1072	S1064-Q1068 PolarHBondContact O-N 3.49Å; H1065-Q1068 PolarHBondContact O-N 2.93Å; H1065-Q1068 VanDerWaalsContact O-N 3.15Å; V1066-Q1068 VanDerWaalsContact C-N 3.33Å; V1066-Q1068 PolarHBondContact O-N 3.36Å; Q1068-I1070 PolarHBondContact O-N 3.02Å; Q1068-S1071 PolarHBondContact O-N 2.92Å; Q1068-E1072 PolarHBondContact NE2-OE1 3.11Å; Q1068-E1072 WeakPolarHBondContact O-CG 3.33Å; Q1068-E1072 PolarHBondContact O-N 3.34Å
1069	L	76	Confident	74.5	Confident	96 Å²	96	82.1 Å²	82.1	50%	0.503	43%	0.425	S	S	.	.	H	α-helix	trans	-60	-42.8	175.8	-79.3	161.8	0	0	0	112.6	H1065 V1066 E1072 S1073	H1065-L1069 PolarHBondContact O-N 3.47Å; V1066-L1069 PolarHBondContact O-N 2.83Å; L1069-E1072 PolarHBondContact O-N 2.84Å; L1069-S1073 WeakPolarHBondContact O-CB 3.14Å; L1069-S1073 PolarHBondContact O-N 3.4Å; L1069-S1073 PolarHBondContact O-OG 2.94Å
1070	I	75.8	Confident	74.8	Confident	31 Å²	31	83 Å²	83	16%	0.159	43%	0.429	C	S	.	.	H	α-helix	trans	-67.9	-38.9	177	-64.2	169.9	0	0	0	110.8	L1036 L1040 L1043 V1066 R1067 Q1068 S1073 Q1074	L1036-I1070 HydrophobicContact CD2-CG2 4.21Å; L1040-I1070 HydrophobicContact CD1-CB 4.49Å; L1040-I1070 HydrophobicContact CD1-CG2 3.91Å; L1043-I1070 HydrophobicContact CD1-CD1 3.92Å; V1066-I1070 HydrophobicContact CG1-CD1 3.68Å; V1066-I1070 HydrophobicContact CG1-CG1 4.32Å; V1066-I1070 VanDerWaalsContact O-CG1 3.29Å; V1066-I1070 WeakPolarHBondContact O-CG1 3.43Å; V1066-I1070 PolarHBondContact O-N 2.78Å; R1067-I1070 PolarHBondContact O-N 3.31Å; Q1068-I1070 PolarHBondContact O-N 3.02Å; I1070-S1073 WeakPolarHBondContact CA-OG 3.09Å; I1070-S1073 PolarHBondContact O-N 2.88Å; I1070-S1073 PolarHBondContact O-OG 2.95Å; I1070-Q1074 WeakPolarHBondContact O-CB 3.3Å; I1070-Q1074 PolarHBondContact O-N 3.44Å
1071	S	75.2	Confident	75.2	Confident	43 Å²	43	77.2 Å²	77.2	30%	0.301	41%	0.407	S	S	.	.	H	α-helix	trans	-65.7	-40.1	176.4	-176.8	0	0	0	0	112.7	R1067 Q1068 Q1074 K1075	R1067-S1071 WeakPolarHBondContact O-CB 3.3Å; R1067-S1071 PolarHBondContact O-N 3.33Å; Q1068-S1071 PolarHBondContact O-N 2.92Å; S1071-Q1074 PolarHBondContact O-N 3.36Å; S1071-K1075 WeakPolarHBondContact O-CG 3.14Å; S1071-K1075 PolarHBondContact O-N 3.42Å
1072	E	78.4	Confident	75.4	Confident	105 Å²	105	77.1 Å²	77.1	49%	0.491	40%	0.404	S	S	.	.	H	α-helix	trans	-67.8	-42.7	177	-74.3	-178.6	-172	0	0	111.5	Q1068 L1069 Q1074 K1075 A1076	Q1068-E1072 PolarHBondContact NE2-OE1 3.11Å; Q1068-E1072 WeakPolarHBondContact O-CG 3.33Å; Q1068-E1072 PolarHBondContact O-N 3.34Å; L1069-E1072 PolarHBondContact O-N 2.84Å; E1072-Q1074 PolarHBondContact O-N 3.38Å; E1072-K1075 PolarHBondContact O-N 3.01Å; E1072-A1076 WeakPolarHBondContact O-CB 3.29Å; E1072-A1076 PolarHBondContact O-N 2.96Å
1073	S	74.3	Confident	75.6	Confident	48 Å²	48	73.9 Å²	73.9	34%	0.336	40%	0.395	S	S	.	.	H	α-helix	trans	-65.4	-37.2	174.8	59.8	0	0	0	0	112.6	L1069 I1070 A1076 L1077	L1069-S1073 WeakPolarHBondContact O-CB 3.14Å; L1069-S1073 PolarHBondContact O-N 3.4Å; L1069-S1073 PolarHBondContact O-OG 2.94Å; I1070-S1073 WeakPolarHBondContact CA-OG 3.09Å; I1070-S1073 PolarHBondContact O-N 2.88Å; I1070-S1073 PolarHBondContact O-OG 2.95Å; S1073-A1076 PolarHBondContact O-N 2.99Å; S1073-L1077 WeakPolarHBondContact O-CB 3.32Å; S1073-L1077 PolarHBondContact O-N 3.05Å
1074	Q	73.9	Confident	75.7	Confident	69 Å²	69	73.7 Å²	73.7	32%	0.322	40%	0.396	S	S	.	.	H	α-helix	trans	-64.5	-40.5	174.5	-165.2	-170.2	21.3	0	0	112	D1037 I1070 S1071 E1072 S1078	D1037-Q1074 PolarHBondContact OD1-NE2 2.98Å; I1070-Q1074 WeakPolarHBondContact O-CB 3.3Å; I1070-Q1074 PolarHBondContact O-N 3.44Å; S1071-Q1074 PolarHBondContact O-N 3.36Å; E1072-Q1074 PolarHBondContact O-N 3.38Å; Q1074-S1078 WeakPolarHBondContact O-CB 3.47Å; Q1074-S1078 PolarHBondContact O-N 3.48Å
1075	K	79.5	Confident	75.8	Confident	133 Å²	133	73 Å²	73	58%	0.578	39%	0.392	S	S	*	.	H	α-helix	trans	-64.9	-44	174.5	-74.3	170.8	-174.1	165.3	0	111.4	S1071 E1072 S1078 C1079	S1071-K1075 WeakPolarHBondContact O-CG 3.14Å; S1071-K1075 PolarHBondContact O-N 3.42Å; E1072-K1075 PolarHBondContact O-N 3.01Å; K1075-S1078 PolarHBondContact O-N 3.48Å; K1075-C1079 PolarHBondContact O-N 3.1Å; K1075-C1079 PolarHBondContact O-SG 2.73Å; K1075-C1079 VanDerWaalsContact O-SG 3.37Å
1076	A	75.3	Confident	75.9	Confident	51 Å²	51	73.8 Å²	73.8	42%	0.421	40%	0.396	S	S	.	.	H	α-helix	trans	-61.5	-48	176.9	0	0	0	0	0	111.2	E1072 S1073 S1078 C1079 I1080	E1072-A1076 WeakPolarHBondContact O-CB 3.29Å; E1072-A1076 PolarHBondContact O-N 2.96Å; S1073-A1076 PolarHBondContact O-N 2.99Å; A1076-S1078 PolarHBondContact O-N 3.2Å; A1076-C1079 WeakPolarHBondContact O-CB 3.35Å; A1076-C1079 PolarHBondContact O-N 3.3Å; A1076-I1080 VanDerWaalsContact O-CG1 3.29Å; A1076-I1080 WeakPolarHBondContact O-CG1 3.36Å; A1076-I1080 PolarHBondContact O-N 3.47Å
1077	L	74.9	Confident	75.7	Confident	45 Å²	45	75.8 Å²	75.8	24%	0.236	40%	0.402	C	S	.	.	H	α-helix	trans	-60.5	-43.1	175.6	-84.6	163.3	0	0	0	112.2	I1029 L1036 S1073 C1079 I1080 V1081	I1029-L1077 HydrophobicContact CG2-CD2 4.45Å; L1036-L1077 HydrophobicContact CD1-CD1 3.82Å; S1073-L1077 WeakPolarHBondContact O-CB 3.32Å; S1073-L1077 PolarHBondContact O-N 3.05Å; L1077-C1079 VanDerWaalsContact C-N 3.32Å; L1077-C1079 PolarHBondContact O-N 3.49Å; L1077-I1080 PolarHBondContact O-N 2.97Å; L1077-V1081 WeakPolarHBondContact O-CG2 3.41Å; L1077-V1081 PolarHBondContact O-N 3.17Å
1078	S	76.1	Confident	75.6	Confident	43 Å²	43	74 Å²	74	30%	0.301	40%	0.398	S	S	.	.	H	α-helix	trans	-62.5	-39.1	176.2	-174.4	0	0	0	0	112.2	Q1074 K1075 A1076 K1082	Q1074-S1078 WeakPolarHBondContact O-CB 3.47Å; Q1074-S1078 PolarHBondContact O-N 3.48Å; K1075-S1078 PolarHBondContact O-N 3.48Å; A1076-S1078 PolarHBondContact O-N 3.2Å; S1078-K1082 WeakPolarHBondContact O-CB 3.48Å; S1078-K1082 VanDerWaalsContact O-CG 3.31Å; S1078-K1082 WeakPolarHBondContact O-CG 3.03Å; S1078-K1082 PolarHBondContact O-N 3.19Å
1079	C	80.1	Confident	75.4	Confident	85 Å²	85	73.5 Å²	73.5	57%	0.574	40%	0.399	S	S	*	.	H	α-helix	trans	-64.9	-42.3	173.3	-74.3	0	0	0	0	111.8	K1075 A1076 L1077 K1082 A1083	K1075-C1079 PolarHBondContact O-N 3.1Å; K1075-C1079 PolarHBondContact O-SG 2.73Å; K1075-C1079 VanDerWaalsContact O-SG 3.37Å; A1076-C1079 WeakPolarHBondContact O-CB 3.35Å; A1076-C1079 PolarHBondContact O-N 3.3Å; L1077-C1079 VanDerWaalsContact C-N 3.32Å; L1077-C1079 PolarHBondContact O-N 3.49Å; C1079-K1082 PolarHBondContact O-N 3.35Å; C1079-A1083 WeakPolarHBondContact O-CB 3.2Å; C1079-A1083 PolarHBondContact O-N 3.05Å
1080	I	75.4	Confident	75.4	Confident	87 Å²	87	75.2 Å²	75.2	45%	0.446	40%	0.404	S	S	.	.	H	α-helix	trans	-62.6	-48.6	176.4	-68.1	164	0	0	0	110.2	A1076 L1077 K1082 A1083 V1084	A1076-I1080 VanDerWaalsContact O-CG1 3.29Å; A1076-I1080 WeakPolarHBondContact O-CG1 3.36Å; A1076-I1080 PolarHBondContact O-N 3.47Å; L1077-I1080 PolarHBondContact O-N 2.97Å; I1080-K1082 VanDerWaalsContact C-N 3.31Å; I1080-K1082 PolarHBondContact O-N 3.16Å; I1080-A1083 PolarHBondContact O-N 3.31Å; I1080-A1083 VanDerWaalsContact O-N 3.13Å; I1080-V1084 HydrophobicContact CG2-CG2 4.13Å; I1080-V1084 WeakPolarHBondContact O-CB 3.18Å; I1080-V1084 VanDerWaalsContact O-CG2 3.27Å; I1080-V1084 WeakPolarHBondContact O-CG2 3.4Å; I1080-V1084 PolarHBondContact O-N 2.77Å
1081	V	74.9	Confident	75.2	Confident	26 Å²	26	78.3 Å²	78.3	16%	0.158	43%	0.425	C	S	.	.	H	α-helix	trans	-60.2	-41.3	178.6	172	0	0	0	0	111.1	I1029 L1077 V1084 S1085	I1029-V1081 HydrophobicContact CG2-CG2 3.65Å; L1077-V1081 WeakPolarHBondContact O-CG2 3.41Å; L1077-V1081 PolarHBondContact O-N 3.17Å; V1081-V1084 PolarHBondContact O-N 2.72Å; V1081-S1085 VanDerWaalsContact O-CB 3.27Å; V1081-S1085 WeakPolarHBondContact O-CB 3.4Å; V1081-S1085 PolarHBondContact O-N 3.12Å
1082	K	78.8	Confident	75.1	Confident	135 Å²	135	80 Å²	80	59%	0.587	43%	0.433	S	S	*	.	H	α-helix	trans	-64.2	-42.8	174.3	-76	176.7	-177.2	178.1	0	112.5	S1078 C1079 I1080 S1085 Q1086	S1078-K1082 WeakPolarHBondContact O-CB 3.48Å; S1078-K1082 VanDerWaalsContact O-CG 3.31Å; S1078-K1082 WeakPolarHBondContact O-CG 3.03Å; S1078-K1082 PolarHBondContact O-N 3.19Å; C1079-K1082 PolarHBondContact O-N 3.35Å; I1080-K1082 VanDerWaalsContact C-N 3.31Å; I1080-K1082 PolarHBondContact O-N 3.16Å; K1082-S1085 PolarHBondContact O-N 3.45Å; K1082-Q1086 WeakPolarHBondContact O-CB 3.24Å; K1082-Q1086 WeakPolarHBondContact O-CG 3.33Å; K1082-Q1086 PolarHBondContact O-N 2.93Å
1083	A	75.6	Confident	74.9	Confident	39 Å²	39	80.6 Å²	80.6	32%	0.322	44%	0.436	S	S	.	.	H	α-helix	trans	-66.6	-40.6	178.4	0	0	0	0	0	111.7	C1079 I1080 Q1086 M1087	C1079-A1083 WeakPolarHBondContact O-CB 3.2Å; C1079-A1083 PolarHBondContact O-N 3.05Å; I1080-A1083 PolarHBondContact O-N 3.31Å; I1080-A1083 VanDerWaalsContact O-N 3.13Å; A1083-Q1086 PolarHBondContact O-N 3.46Å; A1083-M1087 HydrophobicContact CB-CE 4.47Å; A1083-M1087 WeakPolarHBondContact O-CB 3.36Å; A1083-M1087 PolarHBondContact O-N 3.46Å
1084	V	72.7	Confident	74.8	Confident	42 Å²	42	84.1 Å²	84.1	26%	0.255	45%	0.45	S	S	.	.	H	α-helix	trans	-66.9	-42.5	175.8	173.1	0	0	0	0	110.8	L1026 I1080 V1081 M1087 Q1088	L1026-V1084 HydrophobicContact CD1-CG1 4.1Å; I1080-V1084 HydrophobicContact CG2-CG2 4.13Å; I1080-V1084 WeakPolarHBondContact O-CB 3.18Å; I1080-V1084 VanDerWaalsContact O-CG2 3.27Å; I1080-V1084 WeakPolarHBondContact O-CG2 3.4Å; I1080-V1084 PolarHBondContact O-N 2.77Å; V1081-V1084 PolarHBondContact O-N 2.72Å; V1084-M1087 PolarHBondContact O-N 2.79Å; V1084-Q1088 WeakPolarHBondContact O-CB 3.35Å; V1084-Q1088 PolarHBondContact O-N 3.43Å
1085	S	73.9	Confident	74.6	Confident	52 Å²	52	83 Å²	83	36%	0.364	45%	0.447	S	S	.	.	H	α-helix	trans	-60.1	-44.5	172.7	151.8	0	0	0	0	111.8	V1081 K1082 Q1088 D1089	V1081-S1085 VanDerWaalsContact O-CB 3.27Å; V1081-S1085 WeakPolarHBondContact O-CB 3.4Å; V1081-S1085 PolarHBondContact O-N 3.12Å; K1082-S1085 PolarHBondContact O-N 3.45Å; S1085-Q1088 PolarHBondContact O-N 3.4Å; S1085-D1089 PolarHBondContact O-N 2.9Å
1086	Q	77	Confident	74.2	Confident	130 Å²	130	79.4 Å²	79.4	61%	0.607	44%	0.436	S	S	*	.	H	α-helix	trans	-64.2	-40.5	175.8	-79.4	-176.8	-30	0	0	112.2	K1082 A1083 Q1088 D1089 Q1090	K1082-Q1086 WeakPolarHBondContact O-CB 3.24Å; K1082-Q1086 WeakPolarHBondContact O-CG 3.33Å; K1082-Q1086 PolarHBondContact O-N 2.93Å; A1083-Q1086 PolarHBondContact O-N 3.46Å; Q1086-Q1088 VanDerWaalsContact C-N 3.31Å; Q1086-D1089 PolarHBondContact O-N 2.62Å; Q1086-Q1090 WeakPolarHBondContact O-CB 3.45Å; Q1086-Q1090 WeakPolarHBondContact O-CG 3.11Å; Q1086-Q1090 PolarHBondContact O-N 2.86Å
1087	M	71.1	Confident	74.1	Confident	110 Å²	110	80.9 Å²	80.9	54%	0.542	44%	0.437	S	S	.	.	H	α-helix	trans	-64.3	-38.8	173.7	-82.8	-171.7	-94.3	0	0	111.3	A1083 V1084 Q1090 V1091	A1083-M1087 HydrophobicContact CB-CE 4.47Å; A1083-M1087 WeakPolarHBondContact O-CB 3.36Å; A1083-M1087 PolarHBondContact O-N 3.46Å; V1084-M1087 PolarHBondContact O-N 2.79Å; M1087-Q1090 PolarHBondContact O-N 2.91Å; M1087-V1091 WeakPolarHBondContact O-CB 3.42Å; M1087-V1091 VanDerWaalsContact O-CG2 3.23Å; M1087-V1091 WeakPolarHBondContact O-CG2 3.4Å; M1087-V1091 PolarHBondContact O-N 3.5Å
1088	Q	70.6	Confident	73.7	Confident	70 Å²	70	83.3 Å²	83.3	33%	0.327	45%	0.448	S	S	.	.	H	α-helix	trans	-64.9	-44	176.8	-170.7	167.7	-7.5	0	0	111.2	V1084 S1085 Q1086 Q1090 V1091 V1092	V1084-Q1088 WeakPolarHBondContact O-CB 3.35Å; V1084-Q1088 PolarHBondContact O-N 3.43Å; S1085-Q1088 PolarHBondContact O-N 3.4Å; Q1086-Q1088 VanDerWaalsContact C-N 3.31Å; Q1088-Q1090 VanDerWaalsContact C-N 3.33Å; Q1088-Q1090 PolarHBondContact O-N 3.23Å; Q1088-V1091 PolarHBondContact O-N 2.77Å; Q1088-V1092 WeakPolarHBondContact O-CB 3.48Å; Q1088-V1092 VanDerWaalsContact O-CG2 3.27Å; Q1088-V1092 WeakPolarHBondContact O-CG2 3.36Å; Q1088-V1092 PolarHBondContact O-N 3.3Å
1089	D	74.6	Confident	73.3	Confident	103 Å²	103	85.2 Å²	85.2	55%	0.551	45%	0.452	S	S	*	.	H	α-helix	trans	-61.9	-41	173.8	-71.8	-22.3	0	0	0	111.5	S1085 Q1086 V1092 Q1093	S1085-D1089 PolarHBondContact O-N 2.9Å; Q1086-D1089 PolarHBondContact O-N 2.62Å; D1089-V1092 PolarHBondContact O-N 3.43Å; D1089-Q1093 VanDerWaalsContact O-CB 3.25Å; D1089-Q1093 WeakPolarHBondContact O-CB 3.06Å; D1089-Q1093 PolarHBondContact O-N 3.41Å
1090	Q	75.5	Confident	72.6	Confident	132 Å²	132	87.5 Å²	87.5	62%	0.617	45%	0.454	S	S	*	.	H	α-helix	trans	-66.4	-39.5	175.7	-77	-173	-10.1	0	0	112.6	Q1086 M1087 Q1088 Q1093 L1094	Q1086-Q1090 WeakPolarHBondContact O-CB 3.45Å; Q1086-Q1090 WeakPolarHBondContact O-CG 3.11Å; Q1086-Q1090 PolarHBondContact O-N 2.86Å; M1087-Q1090 PolarHBondContact O-N 2.91Å; Q1088-Q1090 VanDerWaalsContact C-N 3.33Å; Q1088-Q1090 PolarHBondContact O-N 3.23Å; Q1090-Q1093 PolarHBondContact O-N 3.5Å; Q1090-L1094 VanDerWaalsContact O-CB 3.28Å; Q1090-L1094 WeakPolarHBondContact O-CB 3.47Å; Q1090-L1094 PolarHBondContact O-N 3.46Å
1091	V	71.2	Confident	72	Confident	96 Å²	96	90.6 Å²	90.6	58%	0.582	46%	0.46	S	S	*	.	H	α-helix	trans	-69.1	-41.2	176.9	168.9	0	0	0	0	110.5	M1087 Q1088 Q1093 L1094 N1095	M1087-V1091 WeakPolarHBondContact O-CB 3.42Å; M1087-V1091 VanDerWaalsContact O-CG2 3.23Å; M1087-V1091 WeakPolarHBondContact O-CG2 3.4Å; M1087-V1091 PolarHBondContact O-N 3.5Å; Q1088-V1091 PolarHBondContact O-N 2.77Å; V1091-Q1093 VanDerWaalsContact C-N 3.34Å; V1091-L1094 PolarHBondContact O-N 3.4Å; V1091-N1095 VanDerWaalsContact O-CB 3.29Å; V1091-N1095 WeakPolarHBondContact O-CB 3.42Å; V1091-N1095 PolarHBondContact O-N 2.92Å
1092	V	73.7	Confident	71.4	Confident	79 Å²	79	92.3 Å²	92.3	48%	0.479	47%	0.468	S	S	.	.	H	α-helix	trans	-62.8	-44	173.7	171	0	0	0	0	110	Q1088 D1089 L1094 N1095 T1096	Q1088-V1092 WeakPolarHBondContact O-CB 3.48Å; Q1088-V1092 VanDerWaalsContact O-CG2 3.27Å; Q1088-V1092 WeakPolarHBondContact O-CG2 3.36Å; Q1088-V1092 PolarHBondContact O-N 3.3Å; D1089-V1092 PolarHBondContact O-N 3.43Å; V1092-L1094 VanDerWaalsContact C-N 3.33Å; V1092-L1094 PolarHBondContact O-N 3.08Å; V1092-N1095 PolarHBondContact O-N 3.23Å; V1092-T1096 HydrophobicContact CG1-CG2 4.4Å; V1092-T1096 WeakPolarHBondContact O-CG2 3.44Å; V1092-T1096 PolarHBondContact O-N 3.49Å; V1092-T1096 PolarHBondContact O-OG1 3Å; V1092-T1096 VanDerWaalsContact O-OG1 3.09Å
1093	Q	74.6	Confident	70.6	Confident	117 Å²	117	91.3 Å²	91.3	55%	0.547	47%	0.469	S	S	.	.	H	α-helix	trans	-64.6	-37.8	175.7	-168.7	177.7	10.1	0	0	112.1	D1089 Q1090 V1091 T1096 N1097	D1089-Q1093 VanDerWaalsContact O-CB 3.25Å; D1089-Q1093 WeakPolarHBondContact O-CB 3.06Å; D1089-Q1093 PolarHBondContact O-N 3.41Å; Q1090-Q1093 PolarHBondContact O-N 3.5Å; V1091-Q1093 VanDerWaalsContact C-N 3.34Å; Q1093-T1096 WeakPolarHBondContact CA-OG1 3.38Å; Q1093-T1096 PolarHBondContact O-OG1 2.95Å; Q1093-N1097 WeakPolarHBondContact O-CB 3.5Å; Q1093-N1097 PolarHBondContact O-N 2.9Å; Q1093-N1097 PolarHBondContact O-ND2 3.25Å; Q1093-N1097 PolarHBondContact O-OD1 3.27Å
1094	L	71.5	Confident	69.8	Low	122 Å²	122	91.5 Å²	91.5	64%	0.639	47%	0.47	S	S	*	.	H	α-helix	trans	-67.2	-41.5	175.2	-156.2	95.1	0	0	0	110.4	Q1090 V1091 V1092 N1097 M1098	Q1090-L1094 VanDerWaalsContact O-CB 3.28Å; Q1090-L1094 WeakPolarHBondContact O-CB 3.47Å; Q1090-L1094 PolarHBondContact O-N 3.46Å; V1091-L1094 PolarHBondContact O-N 3.4Å; V1092-L1094 VanDerWaalsContact C-N 3.33Å; V1092-L1094 PolarHBondContact O-N 3.08Å; L1094-N1097 PolarHBondContact O-N 2.84Å; L1094-M1098 WeakPolarHBondContact O-CB 3.33Å; L1094-M1098 PolarHBondContact O-N 3.1Å
1095	N	70.4	Confident	68.9	Low	46 Å²	46	95.3 Å²	95.3	25%	0.246	49%	0.485	C	S	.	.	H	α-helix	trans	-69.3	-40	179.3	-162.1	51.8	0	0	0	111.3	V1091 V1092 M1098 E1099	V1091-N1095 VanDerWaalsContact O-CB 3.29Å; V1091-N1095 WeakPolarHBondContact O-CB 3.42Å; V1091-N1095 PolarHBondContact O-N 2.92Å; V1092-N1095 PolarHBondContact O-N 3.23Å; N1095-M1098 CarbonylContact O-C 3.58Å; N1095-M1098 PolarHBondContact O-N 3.45Å; N1095-E1099 PolarHBondContact ND2-OE1 3.15Å; N1095-E1099 WeakPolarHBondContact O-CB 3.41Å; N1095-E1099 WeakPolarHBondContact O-CG 3.25Å; N1095-E1099 PolarHBondContact O-N 2.92Å
1096	T	70.1	Confident	67.9	Low	58 Å²	58	96.9 Å²	96.9	36%	0.356	50%	0.501	S	S	.	.	H	α-helix	trans	-68.6	-39.3	173.5	55.4	0	0	0	0	111.6	V1092 Q1093 M1098 E1099 Q1100	V1092-T1096 HydrophobicContact CG1-CG2 4.4Å; V1092-T1096 WeakPolarHBondContact O-CG2 3.44Å; V1092-T1096 PolarHBondContact O-N 3.49Å; V1092-T1096 PolarHBondContact O-OG1 3Å; V1092-T1096 VanDerWaalsContact O-OG1 3.09Å; Q1093-T1096 WeakPolarHBondContact CA-OG1 3.38Å; Q1093-T1096 PolarHBondContact O-OG1 2.95Å; T1096-M1098 VanDerWaalsContact C-N 3.28Å; T1096-M1098 PolarHBondContact O-N 3Å; T1096-E1099 PolarHBondContact O-N 3.24Å; T1096-Q1100 VanDerWaalsContact O-CB 3.3Å; T1096-Q1100 WeakPolarHBondContact O-CB 2.97Å; T1096-Q1100 VanDerWaalsContact O-CG 3.29Å; T1096-Q1100 WeakPolarHBondContact O-CG 3.33Å; T1096-Q1100 PolarHBondContact O-N 3.17Å
1097	N	74.2	Confident	66.5	Low	81 Å²	81	94.5 Å²	94.5	43%	0.433	50%	0.499	S	S	.	.	H	α-helix	trans	-63.3	-37.4	171.7	-72.8	-15.8	0	0	0	111.1	Q1093 L1094 W1101	Q1093-N1097 WeakPolarHBondContact O-CB 3.5Å; Q1093-N1097 PolarHBondContact O-N 2.9Å; Q1093-N1097 PolarHBondContact O-ND2 3.25Å; Q1093-N1097 PolarHBondContact O-OD1 3.27Å; L1094-N1097 PolarHBondContact O-N 2.84Å; N1097-W1101 WeakPolarHBondContact O-CB 3.47Å; N1097-W1101 PolarHBondContact O-N 3.37Å
1098	M	65.6	Low	65.1	Low	96 Å²	96	90.6 Å²	90.6	47%	0.473	49%	0.487	S	S	.	.	H	α-helix	trans	-72	-40.4	178	-161.6	176.9	83.7	0	0	111.2	L1094 N1095 T1096 W1101 I1102	L1094-M1098 WeakPolarHBondContact O-CB 3.33Å; L1094-M1098 PolarHBondContact O-N 3.1Å; N1095-M1098 CarbonylContact O-C 3.58Å; N1095-M1098 PolarHBondContact O-N 3.45Å; T1096-M1098 VanDerWaalsContact C-N 3.28Å; T1096-M1098 PolarHBondContact O-N 3Å; M1098-W1101 PolarHBondContact O-N 3.47Å; M1098-I1102 HydrophobicContact CE-CD1 4.22Å; M1098-I1102 HydrophobicContact CG-CD1 4.04Å; M1098-I1102 VanDerWaalsContact O-CB 3.3Å; M1098-I1102 WeakPolarHBondContact O-CB 3.31Å; M1098-I1102 WeakPolarHBondContact O-CD1 3.37Å; M1098-I1102 WeakPolarHBondContact O-CG1 3.43Å; M1098-I1102 PolarHBondContact O-N 3.11Å
1099	E	67.7	Low	63.4	Low	83 Å²	83	98.3 Å²	98.3	39%	0.388	51%	0.514	S	S	.	.	H	α-helix	trans	-63.5	-44	171.9	-77.5	175	-173.3	0	0	111.1	N1095 T1096 W1101 I1102 L1103	N1095-E1099 PolarHBondContact ND2-OE1 3.15Å; N1095-E1099 WeakPolarHBondContact O-CB 3.41Å; N1095-E1099 WeakPolarHBondContact O-CG 3.25Å; N1095-E1099 PolarHBondContact O-N 2.92Å; T1096-E1099 PolarHBondContact O-N 3.24Å; E1099-W1101 VanDerWaalsContact C-N 3.33Å; E1099-W1101 PolarHBondContact O-N 2.78Å; E1099-I1102 PolarHBondContact O-N 3.17Å; E1099-L1103 VanDerWaalsContact O-CB 3.25Å; E1099-L1103 WeakPolarHBondContact O-CB 3.25Å; E1099-L1103 WeakPolarHBondContact O-CG 3.16Å; E1099-L1103 PolarHBondContact O-N 3.14Å
1100	Q	65.3	Low	61.7	Low	133 Å²	133	101 Å²	101	62%	0.621	52%	0.523	S	S	*	.	H	α-helix	trans	-64.6	-38.3	173.7	-76.8	-173.1	-3.3	0	0	111.8	T1096 A1104	T1096-Q1100 VanDerWaalsContact O-CB 3.3Å; T1096-Q1100 WeakPolarHBondContact O-CB 2.97Å; T1096-Q1100 VanDerWaalsContact O-CG 3.29Å; T1096-Q1100 WeakPolarHBondContact O-CG 3.33Å; T1096-Q1100 PolarHBondContact O-N 3.17Å; Q1100-A1104 WeakPolarHBondContact O-CB 3.37Å; Q1100-A1104 PolarHBondContact O-N 2.81Å
1101	W	63.5	Low	60.1	Low	152 Å²	152	98.2 Å²	98.2	58%	0.576	51%	0.511	S	S	*	.	H	α-helix	trans	-68.4	-43.2	176.5	-172.3	84.4	0	0	0	110.9	N1097 M1098 E1099 A1104 Q1105	N1097-W1101 WeakPolarHBondContact O-CB 3.47Å; N1097-W1101 PolarHBondContact O-N 3.37Å; M1098-W1101 PolarHBondContact O-N 3.47Å; E1099-W1101 VanDerWaalsContact C-N 3.33Å; E1099-W1101 PolarHBondContact O-N 2.78Å; W1101-A1104 CarbonylContact O-C 3.53Å; W1101-A1104 PolarHBondContact O-N 2.76Å; W1101-Q1105 HydrophobicContact CH2-CG 4.46Å; W1101-Q1105 WeakPolarHBondContact O-CB 3.12Å; W1101-Q1105 PolarHBondContact O-N 3.09Å
1102	I	62.1	Low	58.3	Low	62 Å²	62	103 Å²	103	32%	0.318	52%	0.519	S	S	.	.	H	α-helix	trans	-64.1	-42.6	174.6	-70.8	165	0	0	0	110.6	M1098 E1099 Q1105 A1106	M1098-I1102 HydrophobicContact CE-CD1 4.22Å; M1098-I1102 HydrophobicContact CG-CD1 4.04Å; M1098-I1102 VanDerWaalsContact O-CB 3.3Å; M1098-I1102 WeakPolarHBondContact O-CB 3.31Å; M1098-I1102 WeakPolarHBondContact O-CD1 3.37Å; M1098-I1102 WeakPolarHBondContact O-CG1 3.43Å; M1098-I1102 PolarHBondContact O-N 3.11Å; E1099-I1102 PolarHBondContact O-N 3.17Å; I1102-Q1105 PolarHBondContact O-N 2.87Å; I1102-A1106 WeakPolarHBondContact O-CB 3.25Å; I1102-A1106 PolarHBondContact O-N 3.41Å
1103	L	62.5	Low	56.7	Low	115 Å²	115	102.9 Å²	102.9	60%	0.602	52%	0.519	S	S	*	.	H	α-helix	trans	-67.7	-36.9	175.4	-72.9	170.1	0	0	0	111.5	E1099 Q1105 A1106 S1107	E1099-L1103 VanDerWaalsContact O-CB 3.25Å; E1099-L1103 WeakPolarHBondContact O-CB 3.25Å; E1099-L1103 WeakPolarHBondContact O-CG 3.16Å; E1099-L1103 PolarHBondContact O-N 3.14Å; L1103-Q1105 VanDerWaalsContact C-N 3.35Å; L1103-A1106 PolarHBondContact O-N 3.47Å; L1103-S1107 VanDerWaalsContact O-CB 3.25Å; L1103-S1107 WeakPolarHBondContact O-CB 3.2Å; L1103-S1107 PolarHBondContact O-N 2.99Å; L1103-S1107 PolarHBondContact O-OG 3.37Å
1104	A	58.6	Low	55.1	Low	43 Å²	43	100.6 Å²	100.6	36%	0.355	51%	0.512	S	S	.	.	H	α-helix	trans	-66.7	-36.5	172.6	0	0	0	0	0	111.8	Q1100 W1101 G1108	Q1100-A1104 WeakPolarHBondContact O-CB 3.37Å; Q1100-A1104 PolarHBondContact O-N 2.81Å; W1101-A1104 CarbonylContact O-C 3.53Å; W1101-A1104 PolarHBondContact O-N 2.76Å; A1104-G1108 PolarHBondContact O-N 2.69Å
1105	Q	52.6	Low	53.4	Low	121 Å²	121	101.3 Å²	101.3	57%	0.565	51%	0.511	S	S	*	.	H	α-helix	trans	-72	-39	175.5	-134.9	76.8	-10.1	0	0	111.5	W1101 I1102 L1103	W1101-Q1105 HydrophobicContact CH2-CG 4.46Å; W1101-Q1105 WeakPolarHBondContact O-CB 3.12Å; W1101-Q1105 PolarHBondContact O-N 3.09Å; I1102-Q1105 PolarHBondContact O-N 2.87Å; L1103-Q1105 VanDerWaalsContact C-N 3.35Å
1106	A	52.6	Low	51.8	Low	85 Å²	85	105.5 Å²	105.5	70%	0.702	53%	0.53	S	S	*	.	H	α-helix	trans	-78.5	-23.8	-179	0	0	0	0	0	113.1	I1102 L1103	I1102-A1106 WeakPolarHBondContact O-CB 3.25Å; I1102-A1106 PolarHBondContact O-N 3.41Å; L1103-A1106 PolarHBondContact O-N 3.47Å
1107	S	48.9	Very low	50.5	Low	80 Å²	80	108.7 Å²	108.7	56%	0.559	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.9	8.5	175	61.7	0	0	0	0	113.9	L1103 R1109	L1103-S1107 VanDerWaalsContact O-CB 3.25Å; L1103-S1107 WeakPolarHBondContact O-CB 3.2Å; L1103-S1107 PolarHBondContact O-N 2.99Å; L1103-S1107 PolarHBondContact O-OG 3.37Å; S1107-R1109 PolarHBondContact O-N 3.4Å
1108	G	40.4	Very low	49	Very low	29 Å²	29	109.6 Å²	109.6	30%	0.299	54%	0.543	S	S	.	.			trans	-64.6	22.2	-171.4	0	0	0	0	0	118.8	A1104 E1110	A1104-G1108 PolarHBondContact O-N 2.69Å; G1108-E1110 PolarHBondContact O-N 3.43Å
1109	R	36	Very low	47.7	Very low	232 Å²	232	114.7 Å²	114.7	88%	0.875	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	112.7	157.2	-73.7	-179.8	-179.1	163.5	1.2	107	S1107	S1107-R1109 PolarHBondContact O-N 3.4Å
1110	E	38.2	Very low	46.4	Very low	159 Å²	159	117 Å²	117	74%	0.743	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	93.1	47	173.3	-51	-173.8	171.1	0	0	119.3	G1108 T1113	G1108-E1110 PolarHBondContact O-N 3.43Å; E1110-T1113 PolarHBondContact O-OG1 2.87Å
1111	I	41.4	Very low	45.5	Very low	74 Å²	74	113.4 Å²	113.4	38%	0.379	56%	0.555	S	S	.	*	H	α-helix	trans	-104.1	16.5	176	-57.7	176.9	0	0	0	113.8	F1115	I1111-F1115 HydrophobicContact CG2-CD2 3.57Å; I1111-F1115 HydrophobicContact CG2-CE2 3.97Å
1112	R	33.8	Very low	44.7	Very low	195 Å²	195	109.4 Å²	109.4	74%	0.736	55%	0.551	S	S	*	*	H	α-helix	trans	-89.8	-14.8	165.7	-102.6	-176.6	-177.8	-178.5	1.2	114.3
1113	T	41.3	Very low	44.2	Very low	78 Å²	78	110.1 Å²	110.1	48%	0.479	56%	0.558	S	S	.	*	H	α-helix	trans	-91.9	-37.5	171.6	46.1	0	0	0	0	110.8	E1110 M1116 E1117	E1110-T1113 PolarHBondContact O-OG1 2.87Å; T1113-M1116 PolarHBondContact O-N 3.46Å; T1113-E1117 WeakPolarHBondContact O-CA 3.44Å; T1113-E1117 WeakPolarHBondContact O-CB 3.24Å; T1113-E1117 PolarHBondContact O-N 3.46Å
1114	V	41	Very low	43.7	Very low	68 Å²	68	112.1 Å²	112.1	41%	0.412	56%	0.562	S	S	.	*	H	α-helix	trans	-72.2	-34.7	-174.1	-174.8	0	0	0	0	114.3	E1117 E1118	V1114-E1117 CarbonylContact O-C 3.59Å; V1114-E1118 HydrophobicContact CG1-CG 4.27Å; V1114-E1118 WeakPolarHBondContact O-CA 3.28Å; V1114-E1118 WeakPolarHBondContact O-CB 3.45Å; V1114-E1118 WeakPolarHBondContact O-CG 3.05Å; V1114-E1118 PolarHBondContact O-N 3.31Å
1115	F	35.6	Very low	43.5	Very low	138 Å²	138	113.3 Å²	113.3	61%	0.605	57%	0.567	S	S	*	*	H	α-helix	trans	-79.8	-26	176.2	-93.8	-83	0	0	0	114.3	I1111 R1119	I1111-F1115 HydrophobicContact CG2-CD2 3.57Å; I1111-F1115 HydrophobicContact CG2-CE2 3.97Å; F1115-R1119 WeakPolarHBondContact O-CB 3.45Å; F1115-R1119 PolarHBondContact O-N 3.36Å
1116	M	37.3	Very low	43.7	Very low	133 Å²	133	115.3 Å²	115.3	66%	0.655	57%	0.57	S	S	*	*	H	α-helix	trans	-79.2	-30.9	169.8	-109	-144.9	172	0	0	111.6	T1113 K1120	T1113-M1116 PolarHBondContact O-N 3.46Å; M1116-K1120 WeakPolarHBondContact O-CB 3.32Å; M1116-K1120 VanDerWaalsContact O-CG 3.31Å; M1116-K1120 WeakPolarHBondContact O-CG 3.4Å; M1116-K1120 PolarHBondContact O-N 2.89Å
1117	E	41.6	Very low	44.1	Very low	126 Å²	126	115.1 Å²	115.1	59%	0.589	56%	0.557	S	S	*	*	H	α-helix	trans	-81.2	-24.1	174.5	-156	139.1	-142.2	0	0	111.8	T1113 V1114 K1120 S1121	T1113-E1117 WeakPolarHBondContact O-CA 3.44Å; T1113-E1117 WeakPolarHBondContact O-CB 3.24Å; T1113-E1117 PolarHBondContact O-N 3.46Å; V1114-E1117 CarbonylContact O-C 3.59Å; E1117-K1120 CarbonylContact O-C 3.56Å; E1117-K1120 PolarHBondContact O-N 3.46Å; E1117-S1121 WeakPolarHBondContact O-CA 3.24Å; E1117-S1121 WeakPolarHBondContact O-CB 3.45Å; E1117-S1121 PolarHBondContact O-N 3.47Å; E1117-S1121 PolarHBondContact O-OG 3.46Å
1118	E	42.9	Very low	45	Very low	99 Å²	99	120.2 Å²	120.2	46%	0.463	56%	0.564	S	S	.	*	H	α-helix	trans	-79.4	-31.6	167.1	-85.2	-170.8	145.4	0	0	112.7	V1114 K1120 S1121 S1122	V1114-E1118 HydrophobicContact CG1-CG 4.27Å; V1114-E1118 WeakPolarHBondContact O-CA 3.28Å; V1114-E1118 WeakPolarHBondContact O-CB 3.45Å; V1114-E1118 WeakPolarHBondContact O-CG 3.05Å; V1114-E1118 PolarHBondContact O-N 3.31Å; E1118-K1120 VanDerWaalsContact C-N 3.33Å; E1118-S1121 WeakPolarHBondContact CA-OG 3.36Å; E1118-S1121 PolarHBondContact O-OG 2.9Å; E1118-S1122 WeakPolarHBondContact O-CA 3.31Å; E1118-S1122 WeakPolarHBondContact O-CB 3.37Å; E1118-S1122 PolarHBondContact O-N 3.12Å
1119	R	38.2	Very low	46.3	Very low	203 Å²	203	124.4 Å²	124.4	77%	0.766	58%	0.575	S	S	*	*	H	α-helix	trans	-69.1	-32.6	165.8	-85.7	-173.8	177.3	179.7	2.4	111.9	F1115 T1123	F1115-R1119 WeakPolarHBondContact O-CB 3.45Å; F1115-R1119 PolarHBondContact O-N 3.36Å; R1119-T1123 WeakPolarHBondContact O-CB 3.36Å; R1119-T1123 WeakPolarHBondContact O-CG2 3.48Å; R1119-T1123 PolarHBondContact O-N 3.03Å; R1119-T1123 VanDerWaalsContact O-N 3.16Å; R1119-T1123 PolarHBondContact O-OG1 2.89Å
1120	K	39.5	Very low	47.9	Very low	131 Å²	131	120.3 Å²	120.3	57%	0.57	56%	0.56	S	S	*	*	H	α-helix	trans	-78.5	-29	172.4	-74.8	176.2	-179.3	175	0	113.3	M1116 E1117 E1118 T1123 K1124	M1116-K1120 WeakPolarHBondContact O-CB 3.32Å; M1116-K1120 VanDerWaalsContact O-CG 3.31Å; M1116-K1120 WeakPolarHBondContact O-CG 3.4Å; M1116-K1120 PolarHBondContact O-N 2.89Å; E1117-K1120 CarbonylContact O-C 3.56Å; E1117-K1120 PolarHBondContact O-N 3.46Å; E1118-K1120 VanDerWaalsContact C-N 3.33Å; K1120-T1123 VanDerWaalsContact CA-OG1 3.29Å; K1120-T1123 WeakPolarHBondContact CA-OG1 3.45Å; K1120-T1123 PolarHBondContact O-OG1 2.9Å; K1120-K1124 VanDerWaalsContact O-CB 3.27Å; K1120-K1124 WeakPolarHBondContact O-CB 3.3Å; K1120-K1124 VanDerWaalsContact O-CG 3.31Å; K1120-K1124 WeakPolarHBondContact O-CG 3.3Å; K1120-K1124 PolarHBondContact O-N 2.88Å
1121	S	47.1	Very low	49.4	Very low	58 Å²	58	120.9 Å²	120.9	41%	0.406	56%	0.555	S	S	.	*	H	α-helix	trans	-85.4	-31.3	177.1	81.1	0	0	0	0	111.4	E1117 E1118 K1124 S1125	E1117-S1121 WeakPolarHBondContact O-CA 3.24Å; E1117-S1121 WeakPolarHBondContact O-CB 3.45Å; E1117-S1121 PolarHBondContact O-N 3.47Å; E1117-S1121 PolarHBondContact O-OG 3.46Å; E1118-S1121 WeakPolarHBondContact CA-OG 3.36Å; E1118-S1121 PolarHBondContact O-OG 2.9Å; S1121-K1124 CarbonylContact O-C 3.49Å; S1121-K1124 PolarHBondContact O-N 3.47Å; S1121-S1125 WeakPolarHBondContact O-CA 3.41Å; S1121-S1125 WeakPolarHBondContact O-CB 3.47Å; S1121-S1125 PolarHBondContact O-N 3.5Å
1122	S	46.2	Very low	51	Low	69 Å²	69	121 Å²	121	48%	0.483	56%	0.556	S	S	.	*	H	α-helix	trans	-68.4	-38.1	169	175.4	0	0	0	0	111.4	E1118 R1126	E1118-S1122 WeakPolarHBondContact O-CA 3.31Å; E1118-S1122 WeakPolarHBondContact O-CB 3.37Å; E1118-S1122 PolarHBondContact O-N 3.12Å; S1122-R1126 WeakPolarHBondContact O-CB 3.19Å; S1122-R1126 PolarHBondContact O-N 2.9Å
1123	T	52.2	Low	52.8	Low	76 Å²	76	119.6 Å²	119.6	47%	0.466	55%	0.551	S	S	.	*	H	α-helix	trans	-71.5	-42.3	170.7	43.2	0	0	0	0	112.2	R1119 K1120 S1125 R1126 D1127	R1119-T1123 WeakPolarHBondContact O-CB 3.36Å; R1119-T1123 WeakPolarHBondContact O-CG2 3.48Å; R1119-T1123 PolarHBondContact O-N 3.03Å; R1119-T1123 VanDerWaalsContact O-N 3.16Å; R1119-T1123 PolarHBondContact O-OG1 2.89Å; K1120-T1123 VanDerWaalsContact CA-OG1 3.29Å; K1120-T1123 WeakPolarHBondContact CA-OG1 3.45Å; K1120-T1123 PolarHBondContact O-OG1 2.9Å; T1123-S1125 VanDerWaalsContact C-N 3.32Å; T1123-S1125 PolarHBondContact O-N 3.28Å; T1123-R1126 PolarHBondContact O-N 3.25Å; T1123-D1127 WeakPolarHBondContact O-CB 3.38Å; T1123-D1127 PolarHBondContact O-N 3Å
1124	K	52.7	Low	54.3	Low	158 Å²	158	123.6 Å²	123.6	69%	0.687	56%	0.557	S	S	*	*	H	α-helix	trans	-64.2	-32.6	171.4	-81.4	179	177.3	177.2	0	113.3	K1120 S1121 R1128	K1120-K1124 VanDerWaalsContact O-CB 3.27Å; K1120-K1124 WeakPolarHBondContact O-CB 3.3Å; K1120-K1124 VanDerWaalsContact O-CG 3.31Å; K1120-K1124 WeakPolarHBondContact O-CG 3.3Å; K1120-K1124 PolarHBondContact O-N 2.88Å; S1121-K1124 CarbonylContact O-C 3.49Å; S1121-K1124 PolarHBondContact O-N 3.47Å; K1124-R1128 WeakPolarHBondContact O-CB 3.43Å; K1124-R1128 PolarHBondContact O-N 2.91Å
1125	S	54	Low	55.9	Low	68 Å²	68	125.2 Å²	125.2	48%	0.476	56%	0.561	S	S	.	*	H	α-helix	trans	-74.8	-42.3	176.4	-178.4	0	0	0	0	110.4	S1121 T1123 D1127 R1128 H1129	S1121-S1125 WeakPolarHBondContact O-CA 3.41Å; S1121-S1125 WeakPolarHBondContact O-CB 3.47Å; S1121-S1125 PolarHBondContact O-N 3.5Å; T1123-S1125 VanDerWaalsContact C-N 3.32Å; T1123-S1125 PolarHBondContact O-N 3.28Å; S1125-D1127 VanDerWaalsContact C-N 3.29Å; S1125-D1127 PolarHBondContact O-N 3.42Å; S1125-R1128 PolarHBondContact O-N 3.37Å; S1125-H1129 WeakPolarHBondContact O-CB 3.29Å; S1125-H1129 PolarHBondContact O-N 2.91Å
1126	R	56.9	Low	57.6	Low	163 Å²	163	125 Å²	125	62%	0.615	56%	0.556	S	S	*	*	H	α-helix	trans	-60.5	-37.7	169	-103.2	173.3	60.5	148.1	-6	112.4	S1122 T1123 R1130	S1122-R1126 WeakPolarHBondContact O-CB 3.19Å; S1122-R1126 PolarHBondContact O-N 2.9Å; T1123-R1126 PolarHBondContact O-N 3.25Å; R1126-R1130 WeakPolarHBondContact O-CB 3.42Å; R1126-R1130 WeakPolarHBondContact O-CG 3.38Å; R1126-R1130 PolarHBondContact O-N 2.92Å
1127	D	61.6	Low	59.4	Low	81 Å²	81	122.9 Å²	122.9	43%	0.433	55%	0.547	S	S	.	.	H	α-helix	trans	-75.6	-34.6	177.3	-78.7	-19.8	0	0	0	112.8	T1123 S1125 R1130 R1131	T1123-D1127 WeakPolarHBondContact O-CB 3.38Å; T1123-D1127 PolarHBondContact O-N 3Å; S1125-D1127 VanDerWaalsContact C-N 3.29Å; S1125-D1127 PolarHBondContact O-N 3.42Å; D1127-R1130 PolarHBondContact O-N 2.88Å; D1127-R1131 WeakPolarHBondContact O-CG 3.28Å; D1127-R1131 PolarHBondContact O-N 2.94Å
1128	R	66.5	Low	60.9	Low	187 Å²	187	124.8 Å²	124.8	71%	0.706	55%	0.549	S	S	*	.	H	α-helix	trans	-63.9	-47.4	167.5	-94.9	-172.3	-177	176.6	1.1	111.1	K1124 S1125 R1130 R1131 D1132	K1124-R1128 WeakPolarHBondContact O-CB 3.43Å; K1124-R1128 PolarHBondContact O-N 2.91Å; S1125-R1128 PolarHBondContact O-N 3.37Å; R1128-R1130 PolarHBondContact O-N 3.35Å; R1128-R1131 CarbonylContact O-C 3.59Å; R1128-R1131 WeakPolarHBondContact O-CA 3.42Å; R1128-R1131 PolarHBondContact O-N 3.01Å; R1128-D1132 PolarHBondContact O-N 3.49Å
1129	H	67.4	Low	62.5	Low	117 Å²	117	126.2 Å²	126.2	54%	0.542	56%	0.556	S	S	.	*	H	α-helix	trans	-63.2	-32.2	178.3	-127.4	-36.3	0	0	0	112.3	S1125 R1133	S1125-H1129 WeakPolarHBondContact O-CB 3.29Å; S1125-H1129 PolarHBondContact O-N 2.91Å; H1129-R1133 VanDerWaalsContact O-CB 3.31Å; H1129-R1133 WeakPolarHBondContact O-CB 3.16Å; H1129-R1133 PolarHBondContact O-N 2.96Å
1130	R	70	Confident	63.9	Low	145 Å²	145	125.1 Å²	125.1	55%	0.547	55%	0.552	S	S	.	*	H	α-helix	trans	-71.8	-37.3	170.5	-84.9	-179.6	167.9	-178.1	-4.8	112.9	R1126 D1127 R1128 R1134	R1126-R1130 WeakPolarHBondContact O-CB 3.42Å; R1126-R1130 WeakPolarHBondContact O-CG 3.38Å; R1126-R1130 PolarHBondContact O-N 2.92Å; D1127-R1130 PolarHBondContact O-N 2.88Å; R1128-R1130 PolarHBondContact O-N 3.35Å; R1130-R1134 WeakPolarHBondContact O-CG 3.44Å; R1130-R1134 PolarHBondContact O-N 2.72Å
1131	R	71	Confident	65.5	Low	172 Å²	172	123.4 Å²	123.4	65%	0.649	55%	0.549	S	S	*	.	H	α-helix	trans	-66.5	-49	172.8	-79.6	-173.2	-151.4	169.2	5.8	111.4	D1127 R1128 R1133 R1134 E1135	D1127-R1131 WeakPolarHBondContact O-CG 3.28Å; D1127-R1131 PolarHBondContact O-N 2.94Å; R1128-R1131 CarbonylContact O-C 3.59Å; R1128-R1131 WeakPolarHBondContact O-CA 3.42Å; R1128-R1131 PolarHBondContact O-N 3.01Å; R1131-R1133 PolarHBondContact O-N 3.3Å; R1131-R1134 CarbonylContact O-C 3.57Å; R1131-R1134 WeakPolarHBondContact O-CA 3.46Å; R1131-R1134 WeakPolarHBondContact O-CB 3.29Å; R1131-R1134 PolarHBondContact O-N 3.07Å; R1131-E1135 PolarHBondContact O-N 3.27Å
1132	D	73.5	Confident	66.7	Low	75 Å²	75	123.4 Å²	123.4	40%	0.401	55%	0.549	S	S	.	.	H	α-helix	trans	-62.2	-32.6	178	-68.6	2.1	0	0	0	111.9	R1128 R1136	R1128-D1132 PolarHBondContact O-N 3.49Å; D1132-R1136 WeakPolarHBondContact O-CB 3.26Å; D1132-R1136 WeakPolarHBondContact O-CG 3.5Å; D1132-R1136 PolarHBondContact O-N 3.44Å
1133	R	72.4	Confident	67.8	Low	167 Å²	167	126.8 Å²	126.8	63%	0.63	56%	0.555	S	S	*	*	H	α-helix	trans	-69.1	-43.3	172.1	-162.6	-177.1	-80.8	-162.6	-4.5	111	H1129 R1131 R1136 D1137	H1129-R1133 VanDerWaalsContact O-CB 3.31Å; H1129-R1133 WeakPolarHBondContact O-CB 3.16Å; H1129-R1133 PolarHBondContact O-N 2.96Å; R1131-R1133 PolarHBondContact O-N 3.3Å; R1133-R1136 PolarHBondContact O-N 2.76Å; R1133-D1137 WeakPolarHBondContact O-CB 3.39Å; R1133-D1137 PolarHBondContact O-N 3Å
1134	R	73.9	Confident	68.7	Low	161 Å²	161	126.6 Å²	126.6	61%	0.608	55%	0.553	S	S	*	*	H	α-helix	trans	-66.8	-33.6	175.5	-73.1	177.7	-173.3	-176	2	113.4	R1130 R1131 R1138	R1130-R1134 WeakPolarHBondContact O-CG 3.44Å; R1130-R1134 PolarHBondContact O-N 2.72Å; R1131-R1134 CarbonylContact O-C 3.57Å; R1131-R1134 WeakPolarHBondContact O-CA 3.46Å; R1131-R1134 WeakPolarHBondContact O-CB 3.29Å; R1131-R1134 PolarHBondContact O-N 3.07Å; R1134-R1138 WeakPolarHBondContact O-CB 3.47Å; R1134-R1138 VanDerWaalsContact O-CG 3.32Å; R1134-R1138 WeakPolarHBondContact O-CG 3.25Å; R1134-R1138 PolarHBondContact O-N 2.97Å
1135	E	74.7	Confident	69.5	Low	103 Å²	103	129.2 Å²	129.2	48%	0.481	56%	0.559	S	S	.	*	H	α-helix	trans	-71.7	-43.1	174.7	-101.2	159.6	-173.6	0	0	111	R1131 D1137 R1138 E1139	R1131-E1135 PolarHBondContact O-N 3.27Å; E1135-D1137 VanDerWaalsContact C-N 3.31Å; E1135-D1137 PolarHBondContact O-N 3.46Å; E1135-R1138 PolarHBondContact O-N 3.19Å; E1135-R1138 VanDerWaalsContact O-N 3.17Å; E1135-E1139 PolarHBondContact O-N 3.13Å
1136	R	69.8	Low	69.8	Low	132 Å²	132	133.9 Å²	133.9	50%	0.498	57%	0.573	S	S	.	*	H	α-helix	trans	-62	-37.7	170.2	-80.2	-171.4	-64.8	-126.2	-10.1	113	D1132 R1133 R1138 E1139 W1140	D1132-R1136 WeakPolarHBondContact O-CB 3.26Å; D1132-R1136 WeakPolarHBondContact O-CG 3.5Å; D1132-R1136 PolarHBondContact O-N 3.44Å; R1133-R1136 PolarHBondContact O-N 2.76Å; R1136-R1138 VanDerWaalsContact C-N 3.34Å; R1136-E1139 PolarHBondContact O-N 3.01Å; R1136-W1140 WeakPolarHBondContact O-CB 3.46Å; R1136-W1140 PolarHBondContact O-N 3.32Å
1137	D	75.4	Confident	69.4	Low	90 Å²	90	131.8 Å²	131.8	48%	0.481	59%	0.591	S	S	.	*	H	α-helix	trans	-67.5	-36	175.7	-67.4	-21.6	0	0	0	110.9	R1133 E1135 W1140 D1141	R1133-D1137 WeakPolarHBondContact O-CB 3.39Å; R1133-D1137 PolarHBondContact O-N 3Å; E1135-D1137 VanDerWaalsContact C-N 3.31Å; E1135-D1137 PolarHBondContact O-N 3.46Å; D1137-W1140 PolarHBondContact O-N 3.02Å; D1137-D1141 WeakPolarHBondContact O-CB 3.42Å; D1137-D1141 PolarHBondContact O-N 3.32Å
1138	R	74.2	Confident	69.8	Low	166 Å²	166	134.4 Å²	134.4	63%	0.626	60%	0.599	S	S	*	*	H	α-helix	trans	-70	-38.6	172.8	-76.4	179.2	-162.6	155.5	0.4	113.1	R1134 E1135 R1136 W1140 D1141 S1142	R1134-R1138 WeakPolarHBondContact O-CB 3.47Å; R1134-R1138 VanDerWaalsContact O-CG 3.32Å; R1134-R1138 WeakPolarHBondContact O-CG 3.25Å; R1134-R1138 PolarHBondContact O-N 2.97Å; E1135-R1138 PolarHBondContact O-N 3.19Å; E1135-R1138 VanDerWaalsContact O-N 3.17Å; R1136-R1138 VanDerWaalsContact C-N 3.34Å; R1138-W1140 VanDerWaalsContact C-N 3.32Å; R1138-D1141 PolarHBondContact O-N 3.17Å; R1138-S1142 WeakPolarHBondContact O-CB 3.46Å; R1138-S1142 PolarHBondContact O-N 3.25Å; R1138-S1142 PolarHBondContact O-OG 2.88Å
1139	E	75	Confident	70	Confident	129 Å²	129	131.6 Å²	131.6	60%	0.603	59%	0.593	S	S	*	*	H	α-helix	trans	-66.4	-37.5	172.9	-78.1	-177.7	164.1	0	0	110.5	E1135 R1136 S1142 F1143	E1135-E1139 PolarHBondContact O-N 3.13Å; R1136-E1139 PolarHBondContact O-N 3.01Å; E1139-S1142 WeakPolarHBondContact CA-OG 3.4Å; E1139-S1142 PolarHBondContact O-N 3.46Å; E1139-S1142 PolarHBondContact O-OG 3.15Å; E1139-F1143 VanDerWaalsContact O-CB 3.24Å; E1139-F1143 WeakPolarHBondContact O-CB 3.11Å; E1139-F1143 PolarHBondContact O-N 3.14Å
1140	W	68.5	Low	70.2	Confident	179 Å²	179	132.4 Å²	132.4	68%	0.678	60%	0.596	S	S	*	*	H	α-helix	trans	-65.9	-43.6	173	-128.2	98	0	0	0	111.1	R1136 D1137 R1138 S1142 F1143 V1144	R1136-W1140 WeakPolarHBondContact O-CB 3.46Å; R1136-W1140 PolarHBondContact O-N 3.32Å; D1137-W1140 PolarHBondContact O-N 3.02Å; R1138-W1140 VanDerWaalsContact C-N 3.32Å; W1140-S1142 VanDerWaalsContact C-N 3.32Å; W1140-S1142 PolarHBondContact O-N 3.18Å; W1140-F1143 PolarHBondContact O-N 2.84Å; W1140-V1144 HydrophobicContact CD2-CG2 4.37Å; W1140-V1144 HydrophobicContact CE3-CB 4.49Å; W1140-V1144 HydrophobicContact CE3-CG2 3.14Å; W1140-V1144 HydrophobicContact CH2-CG2 4.17Å; W1140-V1144 HydrophobicContact CZ3-CG2 3.02Å; W1140-V1144 WeakPolarHBondContact O-CB 3.5Å; W1140-V1144 VanDerWaalsContact O-CG2 3.26Å; W1140-V1144 WeakPolarHBondContact O-CG2 3.38Å; W1140-V1144 PolarHBondContact O-N 3.45Å
1141	D	73.7	Confident	70.2	Confident	96 Å²	96	131.6 Å²	131.6	51%	0.513	60%	0.599	S	S	.	*	H	α-helix	trans	-66	-32.3	175.5	-84.4	-12	0	0	0	112.5	D1137 R1138 R1145	D1137-D1141 WeakPolarHBondContact O-CB 3.42Å; D1137-D1141 PolarHBondContact O-N 3.32Å; R1138-D1141 PolarHBondContact O-N 3.17Å; D1141-R1145 VanDerWaalsContact O-CG 3.31Å; D1141-R1145 WeakPolarHBondContact O-CG 3.45Å; D1141-R1145 PolarHBondContact O-N 2.77Å; D1141-R1145 VanDerWaalsContact O-N 3.15Å
1142	S	72	Confident	70.1	Confident	57 Å²	57	129.1 Å²	129.1	40%	0.399	60%	0.596	S	S	.	*	H	α-helix	trans	-73.2	-40.1	172.3	70.1	0	0	0	0	111.1	R1138 E1139 W1140 V1144 R1145 E1146	R1138-S1142 WeakPolarHBondContact O-CB 3.46Å; R1138-S1142 PolarHBondContact O-N 3.25Å; R1138-S1142 PolarHBondContact O-OG 2.88Å; E1139-S1142 WeakPolarHBondContact CA-OG 3.4Å; E1139-S1142 PolarHBondContact O-N 3.46Å; E1139-S1142 PolarHBondContact O-OG 3.15Å; W1140-S1142 VanDerWaalsContact C-N 3.32Å; W1140-S1142 PolarHBondContact O-N 3.18Å; S1142-V1144 VanDerWaalsContact C-N 3.28Å; S1142-V1144 PolarHBondContact O-N 3.23Å; S1142-R1145 CarbonylContact O-C 3.5Å; S1142-R1145 PolarHBondContact O-N 3.25Å; S1142-E1146 PolarHBondContact O-N 3.3Å
1143	F	69.5	Low	69.9	Low	141 Å²	141	132.7 Å²	132.7	62%	0.618	61%	0.609	S	S	*	*	H	α-helix	trans	-65.7	-31.7	176.3	-149.7	-88.2	0	0	0	111.8	E1139 W1140 R1145 A1147	E1139-F1143 VanDerWaalsContact O-CB 3.24Å; E1139-F1143 WeakPolarHBondContact O-CB 3.11Å; E1139-F1143 PolarHBondContact O-N 3.14Å; W1140-F1143 PolarHBondContact O-N 2.84Å; F1143-R1145 VanDerWaalsContact C-N 3.35Å; F1143-A1147 WeakPolarHBondContact O-CB 3.27Å; F1143-A1147 PolarHBondContact O-N 3.1Å
1144	V	70.5	Confident	69.7	Low	71 Å²	71	130.3 Å²	130.3	43%	0.43	61%	0.607	S	S	.	*	H	α-helix	trans	-77.6	-18.1	172	172.7	0	0	0	0	113.3	W1140 S1142	W1140-V1144 HydrophobicContact CD2-CG2 4.37Å; W1140-V1144 HydrophobicContact CE3-CB 4.49Å; W1140-V1144 HydrophobicContact CE3-CG2 3.14Å; W1140-V1144 HydrophobicContact CH2-CG2 4.17Å; W1140-V1144 HydrophobicContact CZ3-CG2 3.02Å; W1140-V1144 WeakPolarHBondContact O-CB 3.5Å; W1140-V1144 VanDerWaalsContact O-CG2 3.26Å; W1140-V1144 WeakPolarHBondContact O-CG2 3.38Å; W1140-V1144 PolarHBondContact O-N 3.45Å; S1142-V1144 VanDerWaalsContact C-N 3.28Å; S1142-V1144 PolarHBondContact O-N 3.23Å
1145	R	68.6	Low	69.4	Low	213 Å²	213	127.9 Å²	127.9	80%	0.804	61%	0.607	S	S	*	*	H	α-helix	trans	-89.4	-23.8	171.1	-73.7	-178.9	-158.2	-165	6.1	112.5	D1141 S1142 F1143	D1141-R1145 VanDerWaalsContact O-CG 3.31Å; D1141-R1145 WeakPolarHBondContact O-CG 3.45Å; D1141-R1145 PolarHBondContact O-N 2.77Å; D1141-R1145 VanDerWaalsContact O-N 3.15Å; S1142-R1145 CarbonylContact O-C 3.5Å; S1142-R1145 PolarHBondContact O-N 3.25Å; F1143-R1145 VanDerWaalsContact C-N 3.35Å
1146	E	61.8	Low	69	Low	167 Å²	167	130 Å²	130	78%	0.78	62%	0.618	S	S	*	*	H	α-helix	trans	-87.9	-27.1	173.2	-79	-175.6	157	0	0	113.3	S1142	S1142-E1146 PolarHBondContact O-N 3.3Å
1147	A	48.6	Very low	68.9	Low	119 Å²	119	129.8 Å²	129.8	98%	0.983	63%	0.629	S	S	*	*			trans	-86.5	0	167.3	0	0	0	0	0	111.1	F1143	F1143-A1147 WeakPolarHBondContact O-CB 3.27Å; F1143-A1147 PolarHBondContact O-N 3.1Å

Retrieved 1,147 of 1,147 residues in 1738.6 ms (Link to these results)

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