X5D2D9_HUMAN Loading...

Ca++-dependent secretion activator 2 isoform A

AlphaFold DB , UniProt , Accession X5D2D9, Species HUMAN (Homo sapiens, Human), Gene CADPS2, Length 1,263 aa.

						>X5D2D9_HUMAN|X5D2D9|CADPS2
MLDPSSSEEESDEGLEEESRDVLVAAGSSQRAPPAPTREGRRDAPGRAGGGGAARSVSPSPSVLSEGRDEPQRQLDDEQERRIRLQLYVFVVRCIAYPFNAKQPTDMARRQQKLNKQQLQLLKERFQAFLNGETQIVADEAFCNAVRSYYEVFLKSDRVARMVQSGGCSANDFREVFKKNIEKRVRSLPEIDGLSKETVLSSWIAKYDAIYRGEEDLCKQPNRMALSAVSELILSKEQLYEMFQQILGIKKLEHQLLYNACQLDNADEQAAQIRRELDGRLQLADKMAKERKFPKFIAKDMENMYIEELRSSVNLLMANLESLPVSKGGPEFKLQKLKRSQNSAFLDIGDENEIQLSKSDVVLSFTLEIVIMEVQGLKSVAPNRIVYCTMEVEGEKLQTDQAEASRPQWGTQGDFTTTHPRPVVKVKLFTESTGVLALEDKELGRVILYPTSNSSKSAELHRMVVPKNSQDSDLKIKLAVRMDKPAHMKHSGYLYALGQKVWKRWKKRYFVLVQVSQYTFAMCSYREKKSEPQELMQLEGYTVDYTDPHPGLQGGCMFFNAVKEGDTVIFASDDEQDRILWVQAMYRATGQSYKPVPAIQTQKLNPKGGTLHADAQLSGKDADRFQKHGMDEFISANPCKLDHAFLFRILQRQTLDHRLNDSYSCLGWFSPGQVFVLDEYCARYGVRGCHRHLCYLAELMEHSENGAVIDPTLLHYSFAFCASHVHGNRPDGIGTVSVEEKERFEEIKERLSSLLENQISHFRYCFPFGRPEGALKATLSLLERVLMKDIATPIPAEEVKKVVRKCLEKAALINYTRLTEYAKIEGPAEKETETMNQASPARKLEEILHLAELCIEVLQQNEEHHAEGREAFAWWPDLLAEHAEKFWALFTVDMDTALEAQPQDSWDSFPLFQLLNNFLRNDTLLCNGKFHKHLQEIFVPLVVRYVDLMESSIAQSIHRGFEQETWQPVNNGSATSEDLFWKLDALQMFVFDLHWPEQEFAHHLEQRLKLMASDMLEACVKRTRTAFELKLQKASKTTDLRIPASVCTMFNVLVDAKKQSTKLCALDGGQEQQYHSKIDDLIDNSVKEIISLLVSKFVSVLEGVLSKLSRYDEGTFFSSILSFTVKAAAKYVDVPKPGMDLADTYIMFVRQNQDILREKVNEEMYIEKLFDQWYSSSMKVICVWLTDRLDLQLHIYQLKTLIKIVKKTYRDFRLQGVLEGTLNSKTYDTVHRRLTVEEATASVSEGGGLQGITMKDSDEEEEG
					

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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	30.9	Very low	28.5	Very low	233 Å²	233	141.5 Å²	141.5	100%	1.148	79%	0.786	S	S	*	*				0	93.7	0	-61	169.1	86	0	0	104.4
2	L	25.9	Very low	28	Very low	169 Å²	169	143.1 Å²	143.1	89%	0.885	79%	0.792	S	S	*	*				89.5	89	77.8	-80.6	175.7	0	0	0	111
3	D	29.5	Very low	27.6	Very low	147 Å²	147	146 Å²	146	79%	0.786	80%	0.796	S	S	*	*			trans	-49.5	162.6	148.6	-104.5	-49.3	0	0	0	112.3
4	P	43.4	Very low	27.3	Very low	114 Å²	114	140.4 Å²	140.4	74%	0.74	79%	0.789	S	S	*	*				-153.6	152.7	60.2	40.8	-19.6	0	0	0	121.1
5	S	27.3	Very low	27.1	Very low	100 Å²	100	141.9 Å²	141.9	70%	0.699	79%	0.793	S	S	*	*				33.9	135.5	124.1	-158.2	0	0	0	0	121.8
6	S	29.3	Very low	26.8	Very low	96 Å²	96	142.9 Å²	142.9	67%	0.671	79%	0.79	S	S	*	*				171.8	126.5	89.7	-152.2	0	0	0	0	118.1
7	S	29.1	Very low	26.6	Very low	87 Å²	87	144.6 Å²	144.6	61%	0.608	79%	0.791	S	S	*	*				71.8	151	129.9	64.1	0	0	0	0	127
8	E	24.5	Very low	26.4	Very low	167 Å²	167	145.3 Å²	145.3	78%	0.78	79%	0.787	S	S	*	*			trans	79.5	132.3	158.7	-69.9	158.7	-134.9	0	0	120.4
9	E	26.2	Very low	26.2	Very low	169 Å²	169	142.4 Å²	142.4	79%	0.79	78%	0.779	S	S	*	*			cis	-162.9	151.7	-19.9	-133.1	169	-149.3	0	0	114.6
10	E	24	Very low	26.1	Very low	167 Å²	167	146.1 Å²	146.1	78%	0.78	78%	0.781	S	S	*	*			trans	30.2	147	156.4	-76	-173	169.9	0	0	130.4
11	S	23.3	Very low	26	Very low	108 Å²	108	145 Å²	145	76%	0.755	78%	0.775	S	S	*	*			trans	86.3	91.1	138.4	59.4	0	0	0	0	125.1
12	D	22.6	Very low	25.7	Very low	160 Å²	160	139.3 Å²	139.3	86%	0.856	75%	0.753	S	S	*	*				44.6	162.6	106.6	-132.9	-10.8	0	0	0	126.2
13	E	23.5	Very low	25.6	Very low	181 Å²	181	138.5 Å²	138.5	85%	0.846	75%	0.749	S	S	*	*			trans	66.9	124.3	165	-63.9	-156.9	150.2	0	0	122.6
14	G	22.6	Very low	25.3	Very low	68 Å²	68	137.2 Å²	137.2	70%	0.701	75%	0.746	S	S	*	*				113.1	93.4	99.8	0	0	0	0	0	121.8
15	L	24.6	Very low	24.4	Very low	162 Å²	162	136.3 Å²	136.3	85%	0.848	75%	0.748	S	S	*	*			trans	73.7	157.6	133.7	-68.7	173.8	0	0	0	124.6
16	E	23	Very low	24.3	Very low	158 Å²	158	136.8 Å²	136.8	74%	0.738	76%	0.758	S	S	*	*			trans	76.3	91.5	151.1	-80.1	165.5	-142.8	0	0	123.5
17	E	23	Very low	24	Very low	173 Å²	173	135.9 Å²	135.9	81%	0.808	76%	0.764	S	S	*	*				74.3	136	114.8	-74	-155.6	147.3	0	0	125.3
18	E	23.5	Very low	23.7	Very low	157 Å²	157	136.8 Å²	136.8	73%	0.734	77%	0.77	S	S	*	*			trans	88.2	152.8	136.6	-88.8	-99.3	118.9	0	0	122.9
19	S	22	Very low	23.7	Very low	90 Å²	90	133 Å²	133	63%	0.629	76%	0.762	S	S	*	*			trans	66.1	78	161	-74.6	0	0	0	0	120.8
20	R	23.8	Very low	23.7	Very low	216 Å²	216	132.2 Å²	132.2	82%	0.815	76%	0.759	S	S	*	*				61.9	135	109.2	-89	-175.4	165.2	140.9	3.2	122.9
21	D	24.3	Very low	23.7	Very low	123 Å²	123	134.1 Å²	134.1	66%	0.658	76%	0.759	S	S	*	*				87.8	96.1	129.5	-66.6	-9.9	0	0	0	122.7
22	V	24.6	Very low	23.7	Very low	114 Å²	114	133.5 Å²	133.5	69%	0.691	76%	0.76	S	S	*	*				61.8	124.4	126.6	-157.7	0	0	0	0	119.4
23	L	24.4	Very low	24.9	Very low	151 Å²	151	131.5 Å²	131.5	79%	0.791	76%	0.756	S	S	*	*				174.5	119.9	113.4	-88.3	168.8	0	0	0	115.3
24	V	22.1	Very low	25.8	Very low	121 Å²	121	128.8 Å²	128.8	73%	0.733	75%	0.754	S	S	*	*			trans	54.2	87.3	130.9	-179.3	0	0	0	0	119.7
25	A	25	Very low	26	Very low	95 Å²	95	129.7 Å²	129.7	79%	0.785	76%	0.755	S	S	*	*				55.1	147.7	104.6	0	0	0	0	0	124.4
26	A	24.8	Very low	26.9	Very low	109 Å²	109	127.2 Å²	127.2	90%	0.901	75%	0.748	S	S	*	*			trans	104	130.3	135.4	0	0	0	0	0	121.3
27	G	22.6	Very low	27.2	Very low	77 Å²	77	125.8 Å²	125.8	79%	0.794	75%	0.751	S	S	*	*			trans	114.6	141.7	154.7	0	0	0	0	0	116.3
28	S	23.8	Very low	27.5	Very low	106 Å²	106	127 Å²	127	74%	0.741	75%	0.748	S	S	*	*			cis	-173.1	170.1	-27.2	64.5	0	0	0	0	109.8
29	S	23.4	Very low	27.6	Very low	88 Å²	88	126.9 Å²	126.9	62%	0.615	75%	0.747	S	S	*	*			trans	77.6	118.2	153.8	-55.3	0	0	0	0	119.1
30	Q	26	Very low	27.7	Very low	152 Å²	152	125.9 Å²	125.9	71%	0.71	75%	0.751	S	S	*	*				90	147.7	97	-76.3	-170.6	65.8	0	0	115.2
31	R	24.4	Very low	27.8	Very low	208 Å²	208	127.4 Å²	127.4	79%	0.785	76%	0.757	S	S	*	*			cis	-179	108.4	-8.6	165.6	-179.2	175.7	-177	-0.2	113.9
32	A	23.3	Very low	28	Very low	95 Å²	95	132 Å²	132	79%	0.785	77%	0.765	S	S	*	*			trans	51.3	-168.7	156	0	0	0	0	0	118.3
33	P	48.7	Very low	28.2	Very low	118 Å²	118	133.7 Å²	133.7	77%	0.766	77%	0.77	S	S	*	*			cis	-118.4	-147.7	-28.4	43.5	-26.7	0	0	0	109.8
34	P	40.9	Very low	28.3	Very low	123 Å²	123	130.9 Å²	130.9	80%	0.799	77%	0.768	S	S	*	*			cis	-130.9	-173.2	-14.3	41.5	-22.6	0	0	0	116
35	A	27.5	Very low	29.2	Very low	87 Å²	87	131.5 Å²	131.5	72%	0.719	78%	0.775	S	S	*	*			trans	-115	-177.2	173.3	0	0	0	0	0	112
36	P	44.3	Very low	29.2	Very low	110 Å²	110	130.6 Å²	130.6	71%	0.714	78%	0.775	S	S	*	*				-160.2	145.4	101.5	39.8	-20	0	0	0	119.8
37	T	28.9	Very low	29.3	Very low	129 Å²	129	137.4 Å²	137.4	79%	0.791	78%	0.777	S	S	*	*			trans	61.3	161.8	142.1	57.5	0	0	0	0	120.7
38	R	29.1	Very low	29.4	Very low	198 Å²	198	138.9 Å²	138.9	75%	0.747	78%	0.783	S	S	*	*			cis	-166.4	172.5	1.5	-117.4	169.7	110.7	137.9	11	106.7
39	E	25.3	Very low	29.4	Very low	155 Å²	155	137.8 Å²	137.8	72%	0.724	79%	0.788	S	S	*	*			cis	-164.4	164.1	-9.5	-169.5	157.9	-145.6	0	0	109.4
40	G	24.2	Very low	29.5	Very low	68 Å²	68	137.6 Å²	137.6	70%	0.701	80%	0.8	S	S	*	*			trans	172.5	142.8	168.4	0	0	0	0	0	113.2
41	R	27.2	Very low	29.4	Very low	248 Å²	248	134.5 Å²	134.5	94%	0.936	81%	0.809	S	S	*	*			trans	-164.8	168.5	-173.8	-134.5	-176.7	-172.2	-156.4	2.5	115.5
42	R	28.5	Very low	29.4	Very low	221 Å²	221	128.4 Å²	128.4	83%	0.834	81%	0.811	S	S	*	*			trans	85.3	151.5	173.2	-51.1	-168.2	-169.1	174	2.1	116.4
43	D	28.7	Very low	29.7	Very low	148 Å²	148	128.9 Å²	128.9	79%	0.791	82%	0.815	S	S	*	*			cis	-161.5	171.7	-30.2	-93.4	-38.4	0	0	0	109.1
44	A	25.1	Very low	28.9	Very low	92 Å²	92	128.3 Å²	128.3	76%	0.76	82%	0.82	S	S	*	*			trans	-90.2	-168.6	-171.9	0	0	0	0	0	113.6
45	P	41.3	Very low	28.3	Very low	134 Å²	134	133.7 Å²	133.7	87%	0.87	82%	0.824	S	S	*	*			cis	-141.8	180	3	44.1	-24.8	0	0	0	118
46	G	24.2	Very low	28.3	Very low	77 Å²	77	134.6 Å²	134.6	79%	0.794	83%	0.825	S	S	*	*			trans	-171.8	161.8	170.2	0	0	0	0	0	113.5
47	R	28.3	Very low	27.4	Very low	251 Å²	251	136.3 Å²	136.3	95%	0.947	83%	0.833	S	S	*	*			trans	-135.8	152.3	-171.5	-116.1	-173.1	178.3	-177	-1	114.3
48	A	24.9	Very low	27.4	Very low	109 Å²	109	135 Å²	135	90%	0.901	83%	0.83	S	S	*	*			trans	84.2	148.4	157.3	0	0	0	0	0	119.7
49	G	24.1	Very low	27.5	Very low	83 Å²	83	131.7 Å²	131.7	86%	0.856	83%	0.834	S	S	*	*			trans	121.7	132	-176.7	0	0	0	0	0	111.4
50	G	23.8	Very low	27.7	Very low	84 Å²	84	129 Å²	129	87%	0.866	83%	0.832	S	S	*	*			trans	-127.5	173.5	-176	0	0	0	0	0	113.9
51	G	24	Very low	28.2	Very low	87 Å²	87	132.1 Å²	132.1	90%	0.897	84%	0.84	S	S	*	*			trans	108	120.8	161.3	0	0	0	0	0	117.1
52	G	25.6	Very low	28.3	Very low	80 Å²	80	125.5 Å²	125.5	83%	0.825	83%	0.831	S	S	*	*			trans	97.8	173	145.2	0	0	0	0	0	119.1
53	A	29.3	Very low	29	Very low	105 Å²	105	120.1 Å²	120.1	87%	0.868	82%	0.823	S	S	*	*			trans	58.8	80	170	0	0	0	0	0	117.9
54	A	32.8	Very low	29.5	Very low	106 Å²	106	121.3 Å²	121.3	88%	0.876	83%	0.829	S	S	*	*			trans	-78.8	127.4	154.4	0	0	0	0	0	110.2
55	R	27.6	Very low	30.1	Very low	235 Å²	235	121.8 Å²	121.8	89%	0.887	83%	0.826	S	S	*	*			trans	-147.8	114.9	165.6	-119.9	-179.3	-177.7	174.4	0.5	111.6
56	S	27.1	Very low	29.9	Very low	107 Å²	107	120.8 Å²	120.8	75%	0.748	81%	0.81	S	S	*	*			trans	22.7	115.1	148.9	57.5	0	0	0	0	119.8
57	V	25.6	Very low	30.8	Very low	145 Å²	145	120.3 Å²	120.3	88%	0.879	81%	0.805	S	S	*	*			trans	-132	144.2	146.7	-179.3	0	0	0	0	108.4
58	S	27.9	Very low	31.6	Very low	102 Å²	102	118.9 Å²	118.9	71%	0.713	80%	0.799	S	S	*	*			trans	-62.1	148.7	-170.9	-42.8	0	0	0	0	114.7
59	P	31.9	Very low	32.6	Very low	128 Å²	128	117.7 Å²	117.7	83%	0.831	78%	0.778	S	S	*	*			trans	-72.9	136.2	161.6	31.7	-32.5	0	0	0	110.4
60	S	28.9	Very low	33.8	Very low	99 Å²	99	118.3 Å²	118.3	69%	0.692	76%	0.758	S	S	*	*			trans	-144.7	143.1	160.7	-74.9	0	0	0	0	107.8	S62	S60-S62 PolarHBondContact O-N 2.94Å
61	P	36.1	Very low	35.4	Very low	134 Å²	134	117.8 Å²	117.8	87%	0.87	74%	0.74	S	S	*	*			trans	-73.8	103.8	-152.8	26.9	-35.4	0	0	0	112.8
62	S	29.3	Very low	36.9	Very low	108 Å²	108	120.1 Å²	120.1	76%	0.755	73%	0.727	S	S	*	*			trans	-103.6	86	169.1	38.7	0	0	0	0	109.9	S60	S60-S62 PolarHBondContact O-N 2.94Å
63	V	42.8	Very low	38.6	Very low	109 Å²	109	122.7 Å²	122.7	66%	0.661	71%	0.712	S	S	*	*			trans	-53.7	148.1	163.5	-178.2	0	0	0	0	108.8
64	L	38.6	Very low	40.2	Very low	173 Å²	173	123.6 Å²	123.6	91%	0.906	70%	0.698	S	S	*	*	S	Bend	trans	104.8	32.9	-173.2	-57.8	168	0	0	0	116.6
65	S	37.3	Very low	41.8	Very low	101 Å²	101	124 Å²	124	71%	0.706	69%	0.685	S	S	*	*			trans	-138.5	17.6	163.4	-165.5	0	0	0	0	115.4
66	E	38.2	Very low	43.8	Very low	114 Å²	114	117.1 Å²	117.1	53%	0.533	67%	0.666	S	S	.	*			trans	-88.5	-36.3	-172.9	-69.7	169.5	119.8	0	0	113.8	R68 D69 E70	E66-R68 PolarHBondContact O-N 3.46Å; E66-D69 PolarHBondContact O-N 3.29Å; E66-E70 WeakPolarHBondContact O-CG 3.46Å; E66-E70 PolarHBondContact O-N 3.24Å
67	G	42.7	Very low	46.1	Very low	66 Å²	66	117.1 Å²	117.1	68%	0.68	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	33.7	-172.6	0	0	0	0	0	117.7
68	R	45.4	Very low	48.6	Very low	222 Å²	222	114.1 Å²	114.1	84%	0.838	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.2	-32.3	166.9	-79.3	-166.9	177.4	-172.5	0.3	114	E66	E66-R68 PolarHBondContact O-N 3.46Å
69	D	45.5	Very low	51	Low	83 Å²	83	115.1 Å²	115.1	44%	0.444	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-88	-25.1	178.8	-66.2	-0.5	0	0	0	112.5	E66 Q72 R73	E66-D69 PolarHBondContact O-N 3.29Å; D69-Q72 PolarHBondContact O-N 3.03Å; D69-R73 PolarHBondContact O-N 3.47Å; D69-R73 IonicContact OD2-CZ 2.8Å; D69-R73 IonicContact OD2-NH2 3.41Å; D69-R73 PolarHBondContact OD2-NH2 3.27Å
70	E	50	Low	53.4	Low	96 Å²	96	112 Å²	112	45%	0.449	60%	0.602	S	S	.	*	H	α-helix	trans	-43.9	-53	178.3	-80.5	178.8	141.8	0	0	115	E66 Q72 R73 Q74	E66-E70 WeakPolarHBondContact O-CG 3.46Å; E66-E70 PolarHBondContact O-N 3.24Å; E70-Q72 PolarHBondContact O-N 3.12Å; E70-R73 PolarHBondContact O-N 3.23Å; E70-Q74 WeakPolarHBondContact O-CB 3.38Å; E70-Q74 WeakPolarHBondContact O-CG 3.35Å; E70-Q74 PolarHBondContact O-N 3.38Å
71	P	57	Low	56	Low	74 Å²	74	112 Å²	112	48%	0.481	59%	0.587	S	S	.	*	H	α-helix	trans	-67	-25.9	-178.8	27.2	-36	0	0	0	112.9	L75	P71-L75 WeakPolarHBondContact O-CD1 3.39Å; P71-L75 VanDerWaalsContact O-CG 3.26Å; P71-L75 WeakPolarHBondContact O-CG 3.44Å; P71-L75 PolarHBondContact O-N 3.46Å
72	Q	55.2	Low	58.3	Low	135 Å²	135	111.2 Å²	111.2	63%	0.631	57%	0.566	S	S	*	*	H	α-helix	trans	-80	-42.9	178.2	-169.4	154.9	-17.8	0	0	111.1	D69 E70 Q74 L75 D76	D69-Q72 PolarHBondContact O-N 3.03Å; E70-Q72 PolarHBondContact O-N 3.12Å; Q72-Q74 VanDerWaalsContact C-N 3.3Å; Q72-Q74 PolarHBondContact O-N 2.72Å; Q72-L75 WeakPolarHBondContact O-CB 3.36Å; Q72-L75 PolarHBondContact O-N 3.42Å; Q72-L75 VanDerWaalsContact O-N 3.13Å; Q72-D76 PolarHBondContact O-N 3.1Å
73	R	61.6	Low	61	Low	135 Å²	135	107.9 Å²	107.9	51%	0.509	54%	0.54	S	S	.	.	H	α-helix	trans	-59.2	-40.9	171.5	-63.1	178.7	-162	173.3	9	111.7	D69 E70 L75 D76 D77	D69-R73 PolarHBondContact O-N 3.47Å; D69-R73 IonicContact OD2-CZ 2.8Å; D69-R73 IonicContact OD2-NH2 3.41Å; D69-R73 PolarHBondContact OD2-NH2 3.27Å; E70-R73 PolarHBondContact O-N 3.23Å; R73-L75 VanDerWaalsContact C-N 3.33Å; R73-L75 PolarHBondContact O-N 3.31Å; R73-D76 PolarHBondContact O-N 2.85Å; R73-D77 WeakPolarHBondContact O-CB 3.47Å; R73-D77 VanDerWaalsContact O-CG 3.25Å; R73-D77 PolarHBondContact O-N 2.85Å
74	Q	62.8	Low	63.2	Low	123 Å²	123	106.4 Å²	106.4	58%	0.575	52%	0.522	S	S	*	.	H	α-helix	trans	-63.7	-35	175.7	-73.1	168	26	0	0	113.2	E70 Q72 E78	E70-Q74 WeakPolarHBondContact O-CB 3.38Å; E70-Q74 WeakPolarHBondContact O-CG 3.35Å; E70-Q74 PolarHBondContact O-N 3.38Å; Q72-Q74 VanDerWaalsContact C-N 3.3Å; Q72-Q74 PolarHBondContact O-N 2.72Å; Q74-E78 WeakPolarHBondContact O-CB 3.29Å; Q74-E78 PolarHBondContact O-N 3.48Å
75	L	65.3	Low	65.6	Low	114 Å²	114	98.2 Å²	98.2	60%	0.597	48%	0.479	S	S	*	.	H	α-helix	trans	-70.7	-42.2	174	-74.8	166.1	0	0	0	111.7	P71 Q72 R73 E78 Q79	P71-L75 WeakPolarHBondContact O-CD1 3.39Å; P71-L75 VanDerWaalsContact O-CG 3.26Å; P71-L75 WeakPolarHBondContact O-CG 3.44Å; P71-L75 PolarHBondContact O-N 3.46Å; Q72-L75 WeakPolarHBondContact O-CB 3.36Å; Q72-L75 PolarHBondContact O-N 3.42Å; Q72-L75 VanDerWaalsContact O-N 3.13Å; R73-L75 VanDerWaalsContact C-N 3.33Å; R73-L75 PolarHBondContact O-N 3.31Å; L75-E78 PolarHBondContact O-N 3.3Å; L75-Q79 WeakPolarHBondContact O-CB 3.43Å; L75-Q79 PolarHBondContact O-N 2.72Å
76	D	70.8	Confident	68	Low	92 Å²	92	94.5 Å²	94.5	49%	0.492	45%	0.451	S	S	.	.	H	α-helix	trans	-64.1	-44.8	176.5	-65.9	-32.3	0	0	0	111	Q72 R73 E78 Q79 E80	Q72-D76 PolarHBondContact O-N 3.1Å; R73-D76 PolarHBondContact O-N 2.85Å; D76-E78 PolarHBondContact O-N 3.41Å; D76-Q79 PolarHBondContact O-N 3.45Å; D76-E80 PolarHBondContact O-N 3.13Å
77	D	76	Confident	70.5	Confident	106 Å²	106	89 Å²	89	57%	0.567	43%	0.425	S	S	*	.	H	α-helix	trans	-60.1	-42.2	174	-75.7	-27.5	0	0	0	112.1	R73 R81	R73-D77 WeakPolarHBondContact O-CB 3.47Å; R73-D77 VanDerWaalsContact O-CG 3.25Å; R73-D77 PolarHBondContact O-N 2.85Å; D77-R81 WeakPolarHBondContact O-CB 3.43Å; D77-R81 PolarHBondContact O-N 3.33Å
78	E	78	Confident	72.7	Confident	83 Å²	83	85.9 Å²	85.9	39%	0.388	39%	0.393	S	S	.	.	H	α-helix	trans	-68.6	-40.8	177.4	-156.9	-159.1	129.5	0	0	111.3	Q74 L75 D76 R81 R82	Q74-E78 WeakPolarHBondContact O-CB 3.29Å; Q74-E78 PolarHBondContact O-N 3.48Å; L75-E78 PolarHBondContact O-N 3.3Å; D76-E78 PolarHBondContact O-N 3.41Å; E78-R81 PolarHBondContact O-N 3.18Å; E78-R82 VanDerWaalsContact O-CG 3.32Å; E78-R82 WeakPolarHBondContact O-CG 3.46Å; E78-R82 PolarHBondContact O-N 3.23Å; E78-R82 IonicContact OE1-CZ 2.69Å; E78-R82 IonicContact OE1-NE 3.75Å; E78-R82 PolarHBondContact OE1-NE 3.49Å; E78-R82 IonicContact OE1-NH2 2.7Å; E78-R82 PolarHBondContact OE1-NH2 2.72Å
79	Q	78.1	Confident	74.8	Confident	122 Å²	122	75.3 Å²	75.3	57%	0.57	35%	0.353	S	S	*	.	H	α-helix	trans	-63.7	-42.6	176	-176.7	168.4	-52.9	0	0	111.3	L75 D76 R82 I83	L75-Q79 WeakPolarHBondContact O-CB 3.43Å; L75-Q79 PolarHBondContact O-N 2.72Å; D76-Q79 PolarHBondContact O-N 3.45Å; Q79-R82 PolarHBondContact O-N 2.94Å; Q79-I83 HydrophobicContact CG-CD1 4.24Å; Q79-I83 WeakPolarHBondContact O-CG1 3.4Å; Q79-I83 PolarHBondContact O-N 3.1Å
80	E	81.6	Confident	77	Confident	64 Å²	64	71.4 Å²	71.4	30%	0.299	33%	0.332	S	S	.	.	H	α-helix	trans	-65.6	-41.5	175.7	-144.2	-141.8	135.7	0	0	111.3	D76 R82 I83 R84 Q653	D76-E80 PolarHBondContact O-N 3.13Å; E80-R82 VanDerWaalsContact C-N 3.34Å; E80-R82 PolarHBondContact O-N 2.78Å; E80-I83 WeakPolarHBondContact O-CB 3.43Å; E80-I83 PolarHBondContact O-N 3.37Å; E80-I83 VanDerWaalsContact O-N 3.14Å; E80-R84 VanDerWaalsContact CD-NE 3.34Å; E80-R84 WeakPolarHBondContact O-CG 3.33Å; E80-R84 PolarHBondContact O-N 3.36Å; E80-R84 IonicContact OE1-CZ 3.73Å; E80-R84 IonicContact OE1-NE 2.74Å; E80-R84 PolarHBondContact OE1-NE 3.33Å; E80-R84 IonicContact OE1-NH2 3.25Å; E80-R84 PolarHBondContact OE1-NH2 3.26Å; E80-R84 IonicContact OE2-CZ 2.69Å; E80-R84 IonicContact OE2-NE 3.99Å; E80-R84 IonicContact OE2-NH2 2.75Å; E80-R84 PolarHBondContact OE2-NH2 3.03Å; E80-Q653 PolarHBondContact OE1-NE2 2.74Å
81	R	83	Confident	78.9	Confident	98 Å²	98	66.8 Å²	66.8	37%	0.37	31%	0.311	S	S	.	.	H	α-helix	trans	-59.9	-40.7	173.5	176.6	172	163.8	-86.5	-3.2	112.4	D77 E78 I83 R84 L85 E253	D77-R81 WeakPolarHBondContact O-CB 3.43Å; D77-R81 PolarHBondContact O-N 3.33Å; E78-R81 PolarHBondContact O-N 3.18Å; R81-I83 VanDerWaalsContact C-N 3.34Å; R81-R84 PolarHBondContact O-N 3.01Å; R81-L85 HydrophobicContact CG-CD1 4.08Å; R81-L85 WeakPolarHBondContact O-CB 3.24Å; R81-L85 WeakPolarHBondContact O-CG 3.39Å; R81-L85 PolarHBondContact O-N 2.91Å; R81-E253 IonicContact CZ-OE1 3.39Å; R81-E253 IonicContact NE-OE1 3.46Å; R81-E253 PolarHBondContact NE-OE1 2.98Å; R81-E253 IonicContact NH2-OE1 2.78Å; R81-E253 PolarHBondContact NH2-OE1 3.06Å
82	R	84.8	Confident	80.5	Confident	117 Å²	117	63.3 Å²	63.3	44%	0.442	29%	0.288	S	S	.	.	H	α-helix	trans	-61.6	-41.4	174.2	-72.4	172.1	-179.2	-126.2	9.9	111.3	E78 Q79 E80 L85 Q86 F633	E78-R82 VanDerWaalsContact O-CG 3.32Å; E78-R82 WeakPolarHBondContact O-CG 3.46Å; E78-R82 PolarHBondContact O-N 3.23Å; E78-R82 IonicContact OE1-CZ 2.69Å; E78-R82 IonicContact OE1-NE 3.75Å; E78-R82 PolarHBondContact OE1-NE 3.49Å; E78-R82 IonicContact OE1-NH2 2.7Å; E78-R82 PolarHBondContact OE1-NH2 2.72Å; Q79-R82 PolarHBondContact O-N 2.94Å; E80-R82 VanDerWaalsContact C-N 3.34Å; E80-R82 PolarHBondContact O-N 2.78Å; R82-L85 PolarHBondContact O-N 3.14Å; R82-Q86 WeakPolarHBondContact O-CB 3.39Å; R82-Q86 PolarHBondContact O-N 2.81Å; R82-F633 HydrophobicContact CB-CE1 4.21Å; R82-F633 HydrophobicContact CB-CZ 4.37Å; R82-F633 HydrophobicContact CG-CZ 4.22Å
83	I	86.9	Confident	82.1	Confident	38 Å²	38	57.5 Å²	57.5	20%	0.195	26%	0.26	C	S	.	.	H	α-helix	trans	-64.8	-46.8	176.1	-69.1	164.7	0	0	0	111.3	Q79 E80 R81 L85 Q86 L87 L646 I649	Q79-I83 HydrophobicContact CG-CD1 4.24Å; Q79-I83 WeakPolarHBondContact O-CG1 3.4Å; Q79-I83 PolarHBondContact O-N 3.1Å; E80-I83 WeakPolarHBondContact O-CB 3.43Å; E80-I83 PolarHBondContact O-N 3.37Å; E80-I83 VanDerWaalsContact O-N 3.14Å; R81-I83 VanDerWaalsContact C-N 3.34Å; I83-L85 PolarHBondContact O-N 3.45Å; I83-Q86 PolarHBondContact O-N 3.05Å; I83-L87 HydrophobicContact CG2-CD1 4.37Å; I83-L87 WeakPolarHBondContact O-CB 3.35Å; I83-L87 PolarHBondContact O-N 3.4Å; I83-L646 HydrophobicContact CG2-CD2 3.84Å; I83-I649 HydrophobicContact CG2-CD1 3.88Å
84	R	88.5	Confident	83.4	Confident	79 Å²	79	51.1 Å²	51.1	30%	0.298	24%	0.236	S	C	.	.	H	α-helix	trans	-60.5	-41.4	176.7	-66.8	179.2	-165	-178	6.9	112.1	E80 R81 L87 Y88 L247 I249	E80-R84 VanDerWaalsContact CD-NE 3.34Å; E80-R84 WeakPolarHBondContact O-CG 3.33Å; E80-R84 PolarHBondContact O-N 3.36Å; E80-R84 IonicContact OE1-CZ 3.73Å; E80-R84 IonicContact OE1-NE 2.74Å; E80-R84 PolarHBondContact OE1-NE 3.33Å; E80-R84 IonicContact OE1-NH2 3.25Å; E80-R84 PolarHBondContact OE1-NH2 3.26Å; E80-R84 IonicContact OE2-CZ 2.69Å; E80-R84 IonicContact OE2-NE 3.99Å; E80-R84 IonicContact OE2-NH2 2.75Å; E80-R84 PolarHBondContact OE2-NH2 3.03Å; R81-R84 PolarHBondContact O-N 3.01Å; R84-L87 WeakPolarHBondContact O-CB 3.39Å; R84-L87 PolarHBondContact O-N 3.15Å; R84-Y88 PolarHBondContact O-N 3.31Å; R84-L247 WeakPolarHBondContact CD-O 3.38Å; R84-I249 HydrophobicContact CB-CD1 4.23Å
85	L	87.9	Confident	84.7	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-63.4	-45.8	174.3	-77.2	166.2	0	0	0	112.1	R81 R82 I83 L87 Y88 V89 I249 E253 L257 M630 F633	R81-L85 HydrophobicContact CG-CD1 4.08Å; R81-L85 WeakPolarHBondContact O-CB 3.24Å; R81-L85 WeakPolarHBondContact O-CG 3.39Å; R81-L85 PolarHBondContact O-N 2.91Å; R82-L85 PolarHBondContact O-N 3.14Å; I83-L85 PolarHBondContact O-N 3.45Å; L85-L87 VanDerWaalsContact C-N 3.32Å; L85-L87 PolarHBondContact O-N 3.12Å; L85-Y88 PolarHBondContact O-N 2.59Å; L85-Y88 VanDerWaalsContact O-N 3.17Å; L85-V89 PolarHBondContact O-N 3.33Å; L85-V89 VanDerWaalsContact O-N 3.16Å; L85-I249 HydrophobicContact CD2-CD1 4.15Å; L85-I249 HydrophobicContact CD2-CG2 4.5Å; L85-I249 HydrophobicContact CG-CD1 4.45Å; L85-E253 HydrophobicContact CD2-CB 4.15Å; L85-L257 HydrophobicContact CD2-CD1 4.15Å; L85-M630 HydrophobicContact CD1-CE 4.28Å; L85-M630 HydrophobicContact CD2-CE 4.16Å; L85-M630 HydrophobicContact CD2-SD 4.43Å; L85-F633 HydrophobicContact CB-CE1 4.4Å; L85-F633 HydrophobicContact CB-CE2 4.43Å; L85-F633 HydrophobicContact CB-CZ 4.37Å; L85-F633 HydrophobicContact CD1-CE2 4.2Å; L85-F633 HydrophobicContact CD1-CZ 4.3Å
86	Q	88.4	Confident	85.6	Confident	22 Å²	22	39.9 Å²	39.9	10%	0.103	18%	0.181	C	C	.	.	H	α-helix	trans	-63.4	-38.2	177.6	-173.2	60.8	87.1	0	0	112.2	R82 I83 F90 F633 A636 L641	R82-Q86 WeakPolarHBondContact O-CB 3.39Å; R82-Q86 PolarHBondContact O-N 2.81Å; I83-Q86 PolarHBondContact O-N 3.05Å; Q86-F90 HydrophobicContact CG-CE2 3.84Å; Q86-F90 HydrophobicContact CG-CZ 4.33Å; Q86-F90 VanDerWaalsContact O-CD2 3.24Å; Q86-F90 WeakPolarHBondContact O-CD2 3.34Å; Q86-F633 HydrophobicContact CB-CD1 3.99Å; Q86-F633 PolarHBondContact NE2-O 2.71Å; Q86-A636 VanDerWaalsContact OE1-CB 3.3Å; Q86-L641 HydrophobicContact CG-CD1 4.14Å
87	L	89.8	Confident	86.2	Confident	0 Å²	0	36 Å²	36	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-61.3	-45	171.1	-92	171.8	0	0	0	112.1	I83 R84 L85 V89 F90 V91 L247 L646 I649 L650 Y680	I83-L87 HydrophobicContact CG2-CD1 4.37Å; I83-L87 WeakPolarHBondContact O-CB 3.35Å; I83-L87 PolarHBondContact O-N 3.4Å; R84-L87 WeakPolarHBondContact O-CB 3.39Å; R84-L87 PolarHBondContact O-N 3.15Å; L85-L87 VanDerWaalsContact C-N 3.32Å; L85-L87 PolarHBondContact O-N 3.12Å; L87-V89 VanDerWaalsContact C-N 3.3Å; L87-V89 PolarHBondContact O-N 2.68Å; L87-F90 PolarHBondContact O-N 3.38Å; L87-F90 VanDerWaalsContact O-N 3.12Å; L87-V91 PolarHBondContact O-N 3.22Å; L87-L247 HydrophobicContact CB-CD1 4.17Å; L87-L646 HydrophobicContact CD2-CB 3.91Å; L87-L646 HydrophobicContact CG-CB 4.38Å; L87-L646 HydrophobicContact CG-CD2 4.27Å; L87-I649 HydrophobicContact CD1-CB 4.16Å; L87-I649 HydrophobicContact CD1-CG2 3.98Å; L87-L650 HydrophobicContact CD1-CB 4.34Å; L87-L650 HydrophobicContact CD2-CB 4.01Å; L87-L650 HydrophobicContact CD2-CD2 4.39Å; L87-Y680 HydrophobicContact CD2-CE2 4.15Å
88	Y	90.9	Very high	86.7	Confident	0 Å²	0	33 Å²	33	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.2	-37.4	-179.2	-163.3	-105.9	0	0	0	112.2	R84 L85 F90 V91 V92 Y240 F243 Q244 L247 I249 H254 L257	R84-Y88 PolarHBondContact O-N 3.31Å; L85-Y88 PolarHBondContact O-N 2.59Å; L85-Y88 VanDerWaalsContact O-N 3.17Å; Y88-F90 VanDerWaalsContact C-N 3.33Å; Y88-F90 PolarHBondContact O-N 3.33Å; Y88-V91 PolarHBondContact O-N 3.11Å; Y88-V92 HydrophobicContact CD1-CG2 3.63Å; Y88-V92 HydrophobicContact CE1-CG2 3.28Å; Y88-V92 HydrophobicContact CE2-CG2 4.35Å; Y88-V92 HydrophobicContact CG-CG2 4.3Å; Y88-V92 WeakPolarHBondContact O-CB 3.49Å; Y88-V92 VanDerWaalsContact O-CG2 3.26Å; Y88-V92 WeakPolarHBondContact O-CG2 3.45Å; Y88-V92 PolarHBondContact O-N 2.81Å; Y88-Y240 PolarHBondContact OH-O 3.11Å; Y88-Y240 VanDerWaalsContact OH-O 3.13Å; Y88-F243 HydrophobicContact CE2-CB 4.3Å; Y88-Q244 HydrophobicContact CE2-CB 4.2Å; Y88-L247 HydrophobicContact CD2-CB 4.48Å; Y88-L247 HydrophobicContact CD2-CD1 3.94Å; Y88-I249 HydrophobicContact CD1-CG1 4.42Å; Y88-I249 HydrophobicContact CD1-CG2 4.27Å; Y88-I249 HydrophobicContact CD2-CG1 3.79Å; Y88-I249 HydrophobicContact CE1-CG2 4.5Å; Y88-I249 HydrophobicContact CE2-CG1 4.44Å; Y88-I249 HydrophobicContact CG-CG1 3.81Å; Y88-I249 HydrophobicContact CG-CG2 4.48Å; Y88-H254 HydrophobicContact CE1-CB 4.21Å; Y88-H254 AromaticContact CE1-ND1 3.7Å; Y88-H254 AromaticContact CZ-ND1 3.66Å; Y88-H254 PolarHBondContact OH-ND1 2.97Å; Y88-L257 HydrophobicContact CD1-CD1 4.03Å
89	V	89.5	Confident	87	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-57.1	-44.8	173.9	174.1	0	0	0	0	111.9	L85 L87 R93 L257 F633	L85-V89 PolarHBondContact O-N 3.33Å; L85-V89 VanDerWaalsContact O-N 3.16Å; L87-V89 VanDerWaalsContact C-N 3.3Å; L87-V89 PolarHBondContact O-N 2.68Å; V89-R93 WeakPolarHBondContact O-CG 3.23Å; V89-R93 PolarHBondContact O-N 3.38Å; V89-R93 VanDerWaalsContact O-N 3.12Å; V89-L257 HydrophobicContact CG2-CD1 3.96Å; V89-L257 HydrophobicContact CG2-CD2 3.87Å; V89-L257 HydrophobicContact CG2-CG 4.41Å; V89-F633 HydrophobicContact CG2-CB 3.92Å
90	F	90.6	Very high	87.4	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-70.7	-40.9	179.6	-61.3	-44.1	0	0	0	112.4	Q86 L87 Y88 V92 R93 C94 P638 L641 H643 L646 Y680 Y684	Q86-F90 HydrophobicContact CG-CE2 3.84Å; Q86-F90 HydrophobicContact CG-CZ 4.33Å; Q86-F90 VanDerWaalsContact O-CD2 3.24Å; Q86-F90 WeakPolarHBondContact O-CD2 3.34Å; L87-F90 PolarHBondContact O-N 3.38Å; L87-F90 VanDerWaalsContact O-N 3.12Å; Y88-F90 VanDerWaalsContact C-N 3.33Å; Y88-F90 PolarHBondContact O-N 3.33Å; F90-V92 PolarHBondContact O-N 3.41Å; F90-R93 PolarHBondContact O-N 3.18Å; F90-C94 PolarHBondContact O-N 2.91Å; F90-C94 VanDerWaalsContact O-N 3.11Å; F90-C94 PolarHBondContact O-SG 3.19Å; F90-P638 HydrophobicContact CE1-CB 4.22Å; F90-P638 HydrophobicContact CE1-CG 3.98Å; F90-L641 HydrophobicContact CE2-CD1 3.75Å; F90-L641 HydrophobicContact CZ-CD1 3.58Å; F90-H643 AromaticContact CD2-CE1 3.9Å; F90-H643 AromaticContact CE2-CE1 3.84Å; F90-L646 HydrophobicContact CE2-CD1 4.44Å; F90-Y680 HydrophobicContact CB-CD2 4.28Å; F90-Y680 HydrophobicContact CB-CE2 3.69Å; F90-Y684 HydrophobicContact CB-CE2 3.77Å; F90-Y684 HydrophobicContact CD1-CE1 4.13Å; F90-Y684 HydrophobicContact CD1-CE2 4.37Å; F90-Y684 AromaticContact CD1-CZ 3.79Å; F90-Y684 HydrophobicContact CG-CE2 4.25Å
91	V	90.9	Very high	87.4	Confident	0 Å²	0	24.4 Å²	24.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-60.6	-44.1	173.7	168.4	0	0	0	0	111.5	L87 Y88 R93 C94 I95 F243 L247 L650 V676	L87-V91 PolarHBondContact O-N 3.22Å; Y88-V91 PolarHBondContact O-N 3.11Å; V91-R93 VanDerWaalsContact C-N 3.33Å; V91-R93 PolarHBondContact O-N 3.17Å; V91-C94 WeakPolarHBondContact O-CB 3.41Å; V91-C94 PolarHBondContact O-N 2.82Å; V91-I95 HydrophobicContact CG1-CD1 3.82Å; V91-I95 WeakPolarHBondContact O-CG1 3.41Å; V91-I95 PolarHBondContact O-N 2.98Å; V91-F243 HydrophobicContact CG1-CB 3.68Å; V91-F243 HydrophobicContact CG1-CD1 3.9Å; V91-F243 HydrophobicContact CG1-CD2 4.21Å; V91-F243 HydrophobicContact CG1-CG 3.65Å; V91-L247 HydrophobicContact CG2-CD1 4.34Å; V91-L650 HydrophobicContact CG2-CD1 3.89Å; V91-L650 HydrophobicContact CG2-CD2 3.9Å; V91-V676 HydrophobicContact CG1-CG1 3.95Å
92	V	89.6	Confident	87.4	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-60	-42.2	176	165.6	0	0	0	0	111.1	Y88 F90 C94 I95 A96 Y240 C261	Y88-V92 HydrophobicContact CD1-CG2 3.63Å; Y88-V92 HydrophobicContact CE1-CG2 3.28Å; Y88-V92 HydrophobicContact CE2-CG2 4.35Å; Y88-V92 HydrophobicContact CG-CG2 4.3Å; Y88-V92 WeakPolarHBondContact O-CB 3.49Å; Y88-V92 VanDerWaalsContact O-CG2 3.26Å; Y88-V92 WeakPolarHBondContact O-CG2 3.45Å; Y88-V92 PolarHBondContact O-N 2.81Å; F90-V92 PolarHBondContact O-N 3.41Å; V92-C94 VanDerWaalsContact C-N 3.34Å; V92-C94 PolarHBondContact O-N 2.84Å; V92-I95 PolarHBondContact O-N 2.75Å; V92-A96 WeakPolarHBondContact O-CB 3.46Å; V92-A96 PolarHBondContact O-N 3.03Å; V92-Y240 HydrophobicContact CB-CE1 4.22Å; V92-Y240 HydrophobicContact CG1-CE1 3.96Å; V92-Y240 HydrophobicContact CG2-CD1 4.17Å; V92-Y240 HydrophobicContact CG2-CE1 4.08Å; V92-C261 HydrophobicContact CG1-CB 3.56Å
93	R	88.6	Confident	87.1	Confident	14 Å²	14	24.5 Å²	24.5	5%	0.053	12%	0.117	C	C	.	.	H	α-helix	trans	-63	-36.7	176.2	-70.5	179.9	-165.7	-174.7	10.1	113.2	V89 F90 V91 Y97 E276 I634 R683	V89-R93 WeakPolarHBondContact O-CG 3.23Å; V89-R93 PolarHBondContact O-N 3.38Å; V89-R93 VanDerWaalsContact O-N 3.12Å; F90-R93 PolarHBondContact O-N 3.18Å; V91-R93 VanDerWaalsContact C-N 3.33Å; V91-R93 PolarHBondContact O-N 3.17Å; R93-Y97 WeakPolarHBondContact CG-OH 3.26Å; R93-Y97 PolarHBondContact O-N 3.11Å; R93-E276 IonicContact CZ-OE1 2.7Å; R93-E276 IonicContact NH1-OE1 3.82Å; R93-E276 PolarHBondContact NH1-OE1 3.07Å; R93-I634 PolarHBondContact NH2-O 2.76Å; R93-R683 PolarHBondContact O-NH1 3.49Å
94	C	89.7	Confident	86.5	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-66.8	-38.1	174.4	-70	0	0	0	0	112.6	F90 V91 V92 P98 E679	F90-C94 PolarHBondContact O-N 2.91Å; F90-C94 VanDerWaalsContact O-N 3.11Å; F90-C94 PolarHBondContact O-SG 3.19Å; V91-C94 WeakPolarHBondContact O-CB 3.41Å; V91-C94 PolarHBondContact O-N 2.82Å; V92-C94 VanDerWaalsContact C-N 3.34Å; V92-C94 PolarHBondContact O-N 2.84Å; C94-P98 WeakPolarHBondContact O-CB 3.37Å; C94-E679 HydrophobicContact CB-CB 4.17Å; C94-E679 HydrophobicContact CB-CG 3.83Å
95	I	89.1	Confident	85.5	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-76.6	-37.6	177.7	-60.6	162.7	0	0	0	111.4	V91 V92 K236 L239 Y240 F243 V676	V91-I95 HydrophobicContact CG1-CD1 3.82Å; V91-I95 WeakPolarHBondContact O-CG1 3.41Å; V91-I95 PolarHBondContact O-N 2.98Å; V92-I95 PolarHBondContact O-N 2.75Å; I95-K236 HydrophobicContact CG2-CB 4.07Å; I95-K236 HydrophobicContact CG2-CG 4.17Å; I95-K236 WeakPolarHBondContact O-CD 3.46Å; I95-K236 WeakPolarHBondContact O-CE 3.19Å; I95-L239 HydrophobicContact CD1-CB 3.98Å; I95-L239 HydrophobicContact CG1-CB 4.17Å; I95-L239 HydrophobicContact CG2-CB 3.98Å; I95-L239 HydrophobicContact CG2-CD1 4.33Å; I95-Y240 HydrophobicContact CB-CD1 4.1Å; I95-Y240 HydrophobicContact CB-CE1 3.6Å; I95-Y240 HydrophobicContact CD1-CD1 3.82Å; I95-Y240 HydrophobicContact CD1-CE1 4.15Å; I95-Y240 HydrophobicContact CG1-CE1 4.49Å; I95-Y240 HydrophobicContact CG2-CD1 3.88Å; I95-Y240 HydrophobicContact CG2-CD2 4.13Å; I95-Y240 HydrophobicContact CG2-CE1 3.55Å; I95-Y240 HydrophobicContact CG2-CE2 3.81Å; I95-Y240 HydrophobicContact CG2-CG 4.16Å; I95-F243 HydrophobicContact CD1-CD2 4.26Å; I95-V676 HydrophobicContact CD1-CG2 4.29Å; I95-V676 HydrophobicContact CG1-CG2 3.76Å
96	A	84.3	Confident	84.1	Confident	1 Å²	1	33.5 Å²	33.5	1%	0.008	18%	0.178	C	C	.	.	H	α-helix	trans	-64.4	-48.4	-175.6	0	0	0	0	0	112.5	V92 K236 Y240	V92-A96 WeakPolarHBondContact O-CB 3.46Å; V92-A96 PolarHBondContact O-N 3.03Å; A96-K236 PolarHBondContact O-NZ 3.37Å; A96-Y240 VanDerWaalsContact CA-OH 3.23Å; A96-Y240 WeakPolarHBondContact CA-OH 3.31Å; A96-Y240 WeakPolarHBondContact CB-OH 3.36Å; A96-Y240 PolarHBondContact N-OH 3.36Å
97	Y	84.8	Confident	82.7	Confident	9 Å²	9	34.4 Å²	34.4	4%	0.035	18%	0.182	C	C	.	.	S	Bend	trans	-144.1	74.8	-177.9	46.4	-85	0	0	0	111.3	R93 L263 Q269 Q272 I273 R683	R93-Y97 WeakPolarHBondContact CG-OH 3.26Å; R93-Y97 PolarHBondContact O-N 3.11Å; Y97-L263 HydrophobicContact CE1-CD1 4.29Å; Y97-Q269 HydrophobicContact CD1-CG 4.13Å; Y97-Q269 HydrophobicContact CD2-CB 4.12Å; Y97-Q269 HydrophobicContact CG-CB 3.96Å; Y97-Q269 HydrophobicContact CG-CG 3.9Å; Y97-Q272 HydrophobicContact CE2-CB 4.33Å; Y97-Q272 HydrophobicContact CE2-CG 4.13Å; Y97-Q272 WeakPolarHBondContact OH-CG 3.29Å; Y97-I273 HydrophobicContact CD2-CD1 3.76Å; Y97-I273 HydrophobicContact CD2-CG1 3.77Å; Y97-I273 HydrophobicContact CE2-CD1 4.31Å; Y97-I273 HydrophobicContact CE2-CG1 3.8Å; Y97-R683 VanDerWaalsContact CE2-NH1 3.28Å; Y97-R683 PolarHBondContact OH-NH2 2.83Å; Y97-R683 VanDerWaalsContact OH-NH2 3.09Å
98	P	84.9	Confident	80.9	Confident	45 Å²	45	38.4 Å²	38.4	29%	0.292	22%	0.216	S	C	.	.			trans	-71.8	148.8	175	31.2	-37	0	0	0	111.7	C94 F675 E679	C94-P98 WeakPolarHBondContact O-CB 3.37Å; P98-F675 HydrophobicContact CB-CE2 3.98Å; P98-F675 HydrophobicContact CB-CZ 3.65Å; P98-F675 HydrophobicContact CG-CZ 3.89Å; P98-E679 VanDerWaalsContact CA-OE1 3.27Å; P98-E679 WeakPolarHBondContact CA-OE1 3.28Å; P98-E679 HydrophobicContact CB-CG 4.4Å
99	F	85.2	Confident	79.2	Confident	15 Å²	15	47.6 Å²	47.6	7%	0.066	25%	0.25	C	S	.	.			trans	-140.2	-17.1	-177.7	70.7	-78.9	0	0	0	115.3	I273 L277 L316 L320 L323 E679 R683	F99-I273 HydrophobicContact CB-CD1 4.1Å; F99-I273 HydrophobicContact CD1-CD1 3.48Å; F99-I273 VanDerWaalsContact CD1-CD1 3.48Å; F99-I273 HydrophobicContact CD1-CG1 4.19Å; F99-I273 HydrophobicContact CD1-CG2 4.09Å; F99-I273 HydrophobicContact CD2-CG2 4.48Å; F99-I273 HydrophobicContact CE1-CD1 4.08Å; F99-I273 HydrophobicContact CE1-CG1 4.3Å; F99-I273 HydrophobicContact CE1-CG2 3.66Å; F99-I273 HydrophobicContact CE2-CG2 4.09Å; F99-I273 HydrophobicContact CG-CD1 3.89Å; F99-I273 HydrophobicContact CG-CG2 4.48Å; F99-I273 HydrophobicContact CZ-CG2 3.66Å; F99-L277 HydrophobicContact CE2-CD1 4.45Å; F99-L316 HydrophobicContact CE2-CB 4.02Å; F99-L316 HydrophobicContact CE2-CD2 3.92Å; F99-L316 WeakPolarHBondContact CE2-O 3.43Å; F99-L316 HydrophobicContact CZ-CB 4.5Å; F99-L316 HydrophobicContact CZ-CD2 4.17Å; F99-L320 HydrophobicContact CB-CD1 3.36Å; F99-L320 HydrophobicContact CD1-CD1 4.47Å; F99-L320 HydrophobicContact CD2-CB 3.96Å; F99-L320 HydrophobicContact CD2-CD1 3.79Å; F99-L320 HydrophobicContact CD2-CG 4.42Å; F99-L320 HydrophobicContact CG-CD1 3.64Å; F99-L323 HydrophobicContact CB-CD1 4.3Å; F99-E679 WeakPolarHBondContact CD1-OE1 3.31Å; F99-E679 PolarHBondContact N-OE1 2.89Å; F99-R683 HydrophobicContact CE1-CB 4.33Å; F99-R683 HydrophobicContact CE1-CG 4.2Å
100	N	85.9	Confident	77.9	Confident	55 Å²	55	50.5 Å²	50.5	29%	0.294	26%	0.261	S	S	.	.	S	Bend	trans	-111.3	-53.3	-175.8	-179	82.2	0	0	0	113	L316 N319 E679 A682	N100-L316 HydrophobicContact CB-CD2 3.99Å; N100-L316 WeakPolarHBondContact OD1-CD2 3.29Å; N100-N319 PolarHBondContact OD1-ND2 3.24Å; N100-E679 WeakPolarHBondContact CB-OE2 3.49Å; N100-E679 PolarHBondContact N-OE1 3.38Å; N100-E679 PolarHBondContact N-OE2 2.99Å; N100-A682 HydrophobicContact CB-CB 4.34Å; N100-A682 WeakPolarHBondContact ND2-CB 3.4Å
101	A	83.1	Confident	76.7	Confident	17 Å²	17	54.8 Å²	54.8	14%	0.14	28%	0.281	C	S	.	.			trans	-83	162.8	-176.7	0	0	0	0	0	113.3	F675 D678 E679	A101-F675 HydrophobicContact CB-CD2 3.72Å; A101-F675 HydrophobicContact CB-CE2 4.06Å; A101-D678 HydrophobicContact CB-CB 3.99Å; A101-E679 HydrophobicContact CB-CB 4.11Å; A101-E679 WeakPolarHBondContact CB-OE2 3.33Å; A101-E679 PolarHBondContact N-OE2 2.69Å
102	K	82	Confident	75.7	Confident	182 Å²	182	60.2 Å²	60.2	79%	0.791	31%	0.306	S	S	*	.			trans	-138.6	150.2	171.9	-64	176.1	-174.3	168.2	0	108.7	P104	K102-P104 WeakPolarHBondContact O-CD 3.39Å
103	Q	78.2	Confident	75.1	Confident	36 Å²	36	61.6 Å²	61.6	17%	0.168	31%	0.312	C	S	.	.			trans	-68.1	125.5	175.9	-70.7	-175.9	61.1	0	0	110.1	T105 L234 F675	Q103-T105 PolarHBondContact O-N 2.92Å; Q103-L234 PolarHBondContact NE2-O 2.95Å; Q103-F675 HydrophobicContact CB-CB 4.5Å; Q103-F675 HydrophobicContact CG-CB 3.66Å; Q103-F675 HydrophobicContact CG-CD1 3.89Å; Q103-F675 HydrophobicContact CG-CD2 4.26Å; Q103-F675 HydrophobicContact CG-CG 3.66Å
104	P	75.5	Confident	74.7	Confident	44 Å²	44	61 Å²	61	29%	0.286	31%	0.311	S	S	.	.			trans	-75.1	121.9	-177.9	28.9	-34.4	0	0	0	111.4	K102 D106 M107 P671 V674	K102-P104 WeakPolarHBondContact O-CD 3.39Å; P104-D106 VanDerWaalsContact C-N 3.33Å; P104-D106 PolarHBondContact O-N 2.87Å; P104-M107 HydrophobicContact CB-CG 4.45Å; P104-M107 HydrophobicContact CG-CG 4.18Å; P104-M107 HydrophobicContact CG-SD 3.99Å; P104-P671 HydrophobicContact CG-CB 4.08Å; P104-V674 HydrophobicContact CG-CG1 4.4Å
105	T	66.5	Low	74.3	Confident	102 Å²	102	64.4 Å²	64.4	63%	0.626	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-4.3	-176.8	53.6	0	0	0	0	114.6	Q103 I233	Q103-T105 PolarHBondContact O-N 2.92Å; T105-I233 HydrophobicContact CG2-CD1 4.11Å; T105-I233 HydrophobicContact CG2-CG1 4.35Å
106	D	58.1	Low	74	Confident	161 Å²	161	71.3 Å²	71.3	86%	0.861	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	22.1	-171.1	-159	29	0	0	0	113	P104	P104-D106 VanDerWaalsContact C-N 3.33Å; P104-D106 PolarHBondContact O-N 2.87Å
107	M	59.8	Low	74	Confident	40 Å²	40	79.2 Å²	79.2	20%	0.197	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-90.3	122.1	174.4	-58.4	-162.5	86.5	0	0	110	P104 W668 P671 V674	P104-M107 HydrophobicContact CB-CG 4.45Å; P104-M107 HydrophobicContact CG-CG 4.18Å; P104-M107 HydrophobicContact CG-SD 3.99Å; M107-W668 HydrophobicContact CE-CE3 4.21Å; M107-P671 HydrophobicContact CB-CG 4.08Å; M107-P671 HydrophobicContact CG-CG 4.13Å; M107-P671 HydrophobicContact SD-CB 4.4Å; M107-P671 HydrophobicContact SD-CG 3.83Å; M107-V674 HydrophobicContact SD-CG2 4.46Å
108	A	51.9	Low	73.9	Confident	85 Å²	85	81.8 Å²	81.8	70%	0.702	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-58	150.9	-172.9	0	0	0	0	0	114.3	R110	A108-R110 PolarHBondContact O-N 3.22Å
109	R	54.4	Low	73.9	Confident	193 Å²	193	80.1 Å²	80.1	73%	0.728	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-57.8	131.7	177.1	-71.2	-176.8	176.4	176.3	-0.4	110.8
110	R	62.8	Low	74	Confident	60 Å²	60	83.8 Å²	83.8	23%	0.226	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-95.9	146.7	-176.7	-57	-177.9	-173.6	-150.7	-5.2	110.1	A108 W668 F669	A108-R110 PolarHBondContact O-N 3.22Å; R110-W668 PolarHBondContact NH1-O 2.96Å; R110-F669 PolarHBondContact NH1-O 3.13Å; R110-F669 PolarHBondContact NH2-O 2.77Å
111	Q	65.6	Low	74	Confident	90 Å²	90	84.9 Å²	84.9	42%	0.421	42%	0.419	S	S	.	.			trans	-107.7	148.1	-179.5	-69.7	169	-24.3	0	0	109.6	K113 S169 N171 S664	Q111-K113 PolarHBondContact O-N 3.02Å; Q111-S169 PolarHBondContact OE1-OG 3.19Å; Q111-N171 VanDerWaalsContact OE1-CB 3.24Å; Q111-S664 PolarHBondContact O-N 3.22Å
112	Q	69.2	Low	74.2	Confident	114 Å²	114	84.3 Å²	84.3	53%	0.533	41%	0.414	S	S	.	.	B	Isolated β-bridge	trans	-61.5	132.2	-179.5	-165.9	175.4	3.8	0	0	110.1	S169 S662	Q112-S169 WeakPolarHBondContact O-CA 3.26Å; Q112-S662 WeakPolarHBondContact CG-O 3.48Å
113	K	78.7	Confident	74.6	Confident	29 Å²	29	77.4 Å²	77.4	13%	0.126	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-71.2	135	175.9	168.8	171.5	151.6	-168.7	0	108.9	Q111 Q118 L659 D661 S662	Q111-K113 PolarHBondContact O-N 3.02Å; K113-Q118 PolarHBondContact O-OE1 2.87Å; K113-L659 PolarHBondContact NZ-O 3.01Å; K113-D661 PolarHBondContact NZ-O 3.35Å; K113-S662 WeakPolarHBondContact CB-O 3.37Å; K113-S662 PolarHBondContact N-O 3.33Å
114	L	78.8	Confident	75.1	Confident	3 Å²	3	80.2 Å²	80.2	2%	0.016	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-77.5	127.3	172.4	-78.4	170.2	0	0	0	109.9	Q118 V163 C168 F173	L114-Q118 HydrophobicContact CD2-CB 4Å; L114-V163 HydrophobicContact CB-CG2 4.42Å; L114-C168 PolarHBondContact N-O 2.82Å; L114-C168 VanDerWaalsContact N-O 3.15Å; L114-F173 HydrophobicContact CD1-CD1 4.07Å; L114-F173 HydrophobicContact CD1-CD2 3.47Å; L114-F173 VanDerWaalsContact CD1-CD2 3.47Å; L114-F173 HydrophobicContact CD1-CE1 4.04Å; L114-F173 HydrophobicContact CD1-CE2 3.44Å; L114-F173 VanDerWaalsContact CD1-CE2 3.44Å; L114-F173 HydrophobicContact CD1-CG 3.81Å; L114-F173 HydrophobicContact CD1-CZ 3.73Å
115	N	80.8	Confident	75.7	Confident	70 Å²	70	80.6 Å²	80.6	37%	0.374	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-97.3	159.8	173.6	-73.5	-24.7	0	0	0	111.4	Q117 Q118 L119	N115-Q117 PolarHBondContact O-N 3.05Å; N115-Q117 VanDerWaalsContact O-N 3.12Å; N115-Q118 WeakPolarHBondContact O-CB 3.48Å; N115-Q118 PolarHBondContact O-N 3.42Å; N115-L119 PolarHBondContact O-N 2.99Å
116	K	83.7	Confident	76.8	Confident	147 Å²	147	75.7 Å²	75.7	64%	0.639	36%	0.362	S	S	*	.	H	α-helix	trans	-52.4	-37.7	-178.5	-174.1	177.8	178.2	179.6	0	113.8	Q120	K116-Q120 PolarHBondContact O-N 2.94Å; K116-Q120 VanDerWaalsContact O-N 3.17Å
117	Q	83.6	Confident	78.3	Confident	167 Å²	167	72.2 Å²	72.2	78%	0.78	34%	0.341	S	S	*	.	H	α-helix	trans	-66.6	-39.5	175.9	-71.1	170.1	-31.7	0	0	112.6	N115 Q120 L121	N115-Q117 PolarHBondContact O-N 3.05Å; N115-Q117 VanDerWaalsContact O-N 3.12Å; Q117-Q120 PolarHBondContact O-N 3.14Å; Q117-L121 PolarHBondContact O-N 3.32Å
118	Q	82.4	Confident	79.6	Confident	62 Å²	62	71.2 Å²	71.2	29%	0.29	34%	0.339	S	S	.	.	H	α-helix	trans	-70.4	-35.8	177.9	-67.3	167.9	-44.4	0	0	111.7	K113 L114 N115 Q120 L122	K113-Q118 PolarHBondContact O-OE1 2.87Å; L114-Q118 HydrophobicContact CD2-CB 4Å; N115-Q118 WeakPolarHBondContact O-CB 3.48Å; N115-Q118 PolarHBondContact O-N 3.42Å; Q118-Q120 VanDerWaalsContact C-N 3.31Å; Q118-Q120 PolarHBondContact O-N 3.21Å; Q118-L122 VanDerWaalsContact O-CB 3.26Å; Q118-L122 WeakPolarHBondContact O-CB 3.38Å; Q118-L122 PolarHBondContact O-N 2.79Å
119	L	86	Confident	81.3	Confident	10 Å²	10	67.7 Å²	67.7	5%	0.052	31%	0.308	C	S	.	.	H	α-helix	trans	-60.8	-41.2	170.9	175.7	66.4	0	0	0	111.6	N115 L122 K123 V159 A160 V163 F173	N115-L119 PolarHBondContact O-N 2.99Å; L119-L122 PolarHBondContact O-N 2.82Å; L119-K123 WeakPolarHBondContact O-CG 3.28Å; L119-K123 PolarHBondContact O-N 3.36Å; L119-V159 HydrophobicContact CD1-CG1 4.44Å; L119-A160 HydrophobicContact CD2-CB 4.39Å; L119-V163 HydrophobicContact CB-CG1 4.1Å; L119-V163 HydrophobicContact CB-CG2 4.4Å; L119-V163 HydrophobicContact CD1-CG2 4.46Å; L119-V163 HydrophobicContact CD2-CB 4.18Å; L119-V163 HydrophobicContact CD2-CG1 4.23Å; L119-V163 HydrophobicContact CD2-CG2 4.05Å; L119-F173 HydrophobicContact CD1-CE1 3.76Å; L119-F173 HydrophobicContact CD1-CZ 3.95Å
120	Q	86.4	Confident	82.9	Confident	93 Å²	93	60.5 Å²	60.5	44%	0.435	28%	0.284	S	S	.	.	H	α-helix	trans	-66.7	-48.6	179.1	-176	57.2	32.6	0	0	111.5	K116 Q117 Q118 L122 K123 E124	K116-Q120 PolarHBondContact O-N 2.94Å; K116-Q120 VanDerWaalsContact O-N 3.17Å; Q117-Q120 PolarHBondContact O-N 3.14Å; Q118-Q120 VanDerWaalsContact C-N 3.31Å; Q118-Q120 PolarHBondContact O-N 3.21Å; Q120-L122 PolarHBondContact O-N 3.25Å; Q120-K123 WeakPolarHBondContact O-CB 3.39Å; Q120-K123 PolarHBondContact O-N 3.15Å; Q120-K123 VanDerWaalsContact O-N 3.09Å; Q120-E124 WeakPolarHBondContact CG-OE1 3.41Å; Q120-E124 PolarHBondContact NE2-OE1 2.85Å; Q120-E124 PolarHBondContact O-N 2.83Å
121	L	87.3	Confident	84.1	Confident	77 Å²	77	62.5 Å²	62.5	40%	0.403	30%	0.299	S	S	.	.	H	α-helix	trans	-57.9	-36.1	173.4	-179.4	63.5	0	0	0	112.4	Q117 E124 R125	Q117-L121 PolarHBondContact O-N 3.32Å; L121-E124 PolarHBondContact O-N 3.49Å; L121-R125 WeakPolarHBondContact O-CB 3.4Å; L121-R125 VanDerWaalsContact O-CG 3.29Å; L121-R125 WeakPolarHBondContact O-CG 3.38Å; L121-R125 PolarHBondContact O-N 2.84Å
122	L	87.1	Confident	84.9	Confident	6 Å²	6	61 Å²	61	3%	0.031	31%	0.308	C	S	.	.	H	α-helix	trans	-69.4	-38.6	176.4	-172.1	65.3	0	0	0	112.2	Q118 L119 Q120 F126 L154 F173 Y211	Q118-L122 VanDerWaalsContact O-CB 3.26Å; Q118-L122 WeakPolarHBondContact O-CB 3.38Å; Q118-L122 PolarHBondContact O-N 2.79Å; L119-L122 PolarHBondContact O-N 2.82Å; Q120-L122 PolarHBondContact O-N 3.25Å; L122-F126 HydrophobicContact CD1-CD2 3.79Å; L122-F126 HydrophobicContact CD1-CE2 3.58Å; L122-F126 HydrophobicContact CG-CD2 4.14Å; L122-F126 HydrophobicContact CG-CE2 4.24Å; L122-F126 VanDerWaalsContact O-CD2 3.31Å; L122-F126 WeakPolarHBondContact O-CD2 3.49Å; L122-F126 PolarHBondContact O-N 3.16Å; L122-L154 HydrophobicContact CD2-CD2 3.99Å; L122-L154 HydrophobicContact CG-CD2 4.47Å; L122-F173 HydrophobicContact CD2-CD1 3.58Å; L122-F173 HydrophobicContact CD2-CE1 3.89Å; L122-Y211 HydrophobicContact CD1-CD2 3.53Å; L122-Y211 HydrophobicContact CD1-CE2 3.94Å; L122-Y211 HydrophobicContact CD1-CG 4.24Å; L122-Y211 HydrophobicContact CD2-CD2 4.27Å; L122-Y211 HydrophobicContact CD2-CE2 4.07Å
123	K	89.1	Confident	85.5	Confident	37 Å²	37	62 Å²	62	16%	0.161	31%	0.313	C	S	.	.	H	α-helix	trans	-59.7	-47.5	171.6	-74.8	178.4	172.5	-168.9	0	110.9	L119 Q120 F126 Q127 Y150 L154	L119-K123 WeakPolarHBondContact O-CG 3.28Å; L119-K123 PolarHBondContact O-N 3.36Å; Q120-K123 WeakPolarHBondContact O-CB 3.39Å; Q120-K123 PolarHBondContact O-N 3.15Å; Q120-K123 VanDerWaalsContact O-N 3.09Å; K123-F126 PolarHBondContact O-N 3.27Å; K123-Q127 WeakPolarHBondContact O-CB 3.31Å; K123-Q127 PolarHBondContact O-N 2.87Å; K123-Y150 HydrophobicContact CB-CE2 4.25Å; K123-Y150 WeakPolarHBondContact O-CE2 3.2Å; K123-L154 WeakPolarHBondContact CE-O 3.37Å; K123-L154 HydrophobicContact CG-CB 4.44Å; K123-L154 PolarHBondContact NZ-O 3Å
124	E	89.2	Confident	85.6	Confident	94 Å²	94	62.4 Å²	62.4	44%	0.439	32%	0.318	S	S	.	.	H	α-helix	trans	-60.8	-45.9	179.5	-72.4	154.2	-171	0	0	111.5	Q120 L121 F126 Q127 A128	Q120-E124 WeakPolarHBondContact CG-OE1 3.41Å; Q120-E124 PolarHBondContact NE2-OE1 2.85Å; Q120-E124 PolarHBondContact O-N 2.83Å; L121-E124 PolarHBondContact O-N 3.49Å; E124-F126 PolarHBondContact O-N 3.42Å; E124-Q127 PolarHBondContact O-N 3.15Å; E124-A128 WeakPolarHBondContact O-CB 3.48Å; E124-A128 PolarHBondContact O-N 3.37Å
125	R	88.8	Confident	85.5	Confident	52 Å²	52	70 Å²	70	20%	0.196	35%	0.353	C	S	.	.	H	α-helix	trans	-61.8	-40.6	176	-73.1	170.7	176.5	-159	-10.1	113.5	L121 F129 Y211 R212 E215	L121-R125 WeakPolarHBondContact O-CB 3.4Å; L121-R125 VanDerWaalsContact O-CG 3.29Å; L121-R125 WeakPolarHBondContact O-CG 3.38Å; L121-R125 PolarHBondContact O-N 2.84Å; R125-F129 PolarHBondContact O-N 3.1Å; R125-Y211 PolarHBondContact NH1-O 3.07Å; R125-R212 PolarHBondContact NH1-O 3.5Å; R125-R212 PolarHBondContact NH2-O 3.34Å; R125-E215 IonicContact NH2-OE2 3.45Å; R125-E215 PolarHBondContact NH2-OE2 2.88Å
126	F	89.4	Confident	85.6	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-71	-33.2	176.4	-88.5	-112	0	0	0	112.4	L122 K123 E124 L130 V146 Y149 Y150 L154 Y207 I210	L122-F126 HydrophobicContact CD1-CD2 3.79Å; L122-F126 HydrophobicContact CD1-CE2 3.58Å; L122-F126 HydrophobicContact CG-CD2 4.14Å; L122-F126 HydrophobicContact CG-CE2 4.24Å; L122-F126 VanDerWaalsContact O-CD2 3.31Å; L122-F126 WeakPolarHBondContact O-CD2 3.49Å; L122-F126 PolarHBondContact O-N 3.16Å; K123-F126 PolarHBondContact O-N 3.27Å; E124-F126 PolarHBondContact O-N 3.42Å; F126-L130 WeakPolarHBondContact O-CG 3.41Å; F126-L130 PolarHBondContact O-N 3.06Å; F126-L130 VanDerWaalsContact O-N 3.13Å; F126-V146 HydrophobicContact CD1-CG1 3.73Å; F126-V146 HydrophobicContact CE1-CG1 4.03Å; F126-Y149 HydrophobicContact CD1-CD1 4.02Å; F126-Y149 HydrophobicContact CD1-CE1 4.24Å; F126-Y149 AromaticContact CE1-CD1 3.63Å; F126-Y149 HydrophobicContact CE1-CD1 3.63Å; F126-Y149 AromaticContact CE1-CE1 3.67Å; F126-Y149 HydrophobicContact CE1-CE1 3.67Å; F126-Y149 HydrophobicContact CZ-CD1 4.46Å; F126-Y149 HydrophobicContact CZ-CE1 4.07Å; F126-Y150 HydrophobicContact CB-CD2 3.83Å; F126-Y150 HydrophobicContact CB-CE2 4.48Å; F126-L154 HydrophobicContact CB-CD1 3.89Å; F126-L154 HydrophobicContact CD1-CD1 3.69Å; F126-L154 HydrophobicContact CD2-CD1 4.13Å; F126-L154 HydrophobicContact CE1-CD1 4.33Å; F126-L154 HydrophobicContact CG-CD1 3.6Å; F126-Y207 HydrophobicContact CE1-CD2 4.18Å; F126-Y207 HydrophobicContact CE1-CE2 4.23Å; F126-Y207 HydrophobicContact CE2-CE2 4.47Å; F126-Y207 AromaticContact CZ-CD2 3.63Å; F126-Y207 HydrophobicContact CZ-CD2 3.63Å; F126-Y207 AromaticContact CZ-CE2 3.55Å; F126-Y207 HydrophobicContact CZ-CE2 3.55Å; F126-I210 HydrophobicContact CD1-CG2 4.48Å; F126-I210 HydrophobicContact CD2-CG2 3.47Å; F126-I210 VanDerWaalsContact CD2-CG2 3.47Å; F126-I210 HydrophobicContact CE1-CG2 4.46Å; F126-I210 HydrophobicContact CE2-CB 4.06Å; F126-I210 HydrophobicContact CE2-CG2 3.44Å; F126-I210 VanDerWaalsContact CE2-CG2 3.44Å; F126-I210 HydrophobicContact CG-CG2 4Å; F126-I210 HydrophobicContact CZ-CB 4.27Å; F126-I210 HydrophobicContact CZ-CG2 3.96Å
127	Q	89.4	Confident	85.3	Confident	87 Å²	87	67.6 Å²	67.6	41%	0.407	35%	0.351	S	S	.	.	H	α-helix	trans	-72	-42.5	176.3	-170.7	169.1	-6.5	0	0	111.9	K123 E124 F129 L130 N131 Y150	K123-Q127 WeakPolarHBondContact O-CB 3.31Å; K123-Q127 PolarHBondContact O-N 2.87Å; E124-Q127 PolarHBondContact O-N 3.15Å; Q127-F129 VanDerWaalsContact C-N 3.3Å; Q127-F129 PolarHBondContact O-N 2.81Å; Q127-L130 CarbonylContact O-C 3.58Å; Q127-L130 PolarHBondContact O-N 2.99Å; Q127-N131 VanDerWaalsContact O-CG 3.27Å; Q127-N131 PolarHBondContact O-N 3.3Å; Q127-N131 PolarHBondContact O-OD1 3.5Å; Q127-Y150 HydrophobicContact CB-CE2 4.09Å; Q127-Y150 PolarHBondContact OE1-OH 3.32Å
128	A	87.1	Confident	85.2	Confident	20 Å²	20	61.6 Å²	61.6	17%	0.165	33%	0.33	C	S	.	.	H	α-helix	trans	-58	-41.5	173.1	0	0	0	0	0	112	E124 N131 G132 E133 T134	E124-A128 WeakPolarHBondContact O-CB 3.48Å; E124-A128 PolarHBondContact O-N 3.37Å; A128-N131 PolarHBondContact O-N 3.38Å; A128-G132 PolarHBondContact O-N 2.84Å; A128-E133 HydrophobicContact CB-CB 4.18Å; A128-E133 WeakPolarHBondContact CB-OE2 3.34Å; A128-E133 WeakPolarHBondContact O-CB 3.23Å; A128-E133 PolarHBondContact O-N 3.21Å; A128-T134 HydrophobicContact CB-CG2 4.33Å
129	F	88.8	Confident	85.2	Confident	11 Å²	11	61.5 Å²	61.5	5%	0.048	33%	0.332	C	S	.	.	H	α-helix	trans	-60.1	-45.6	171.7	170.1	-90.9	0	0	0	112.2	R125 Q127 N131 G132 T134 I136 A138 F142 V146 I210	R125-F129 PolarHBondContact O-N 3.1Å; Q127-F129 VanDerWaalsContact C-N 3.3Å; Q127-F129 PolarHBondContact O-N 2.81Å; F129-N131 VanDerWaalsContact C-N 3.29Å; F129-N131 PolarHBondContact O-N 3.37Å; F129-G132 PolarHBondContact O-N 3.23Å; F129-G132 VanDerWaalsContact O-N 3.08Å; F129-T134 HydrophobicContact CB-CG2 4.25Å; F129-T134 WeakPolarHBondContact CD2-OG1 3.27Å; F129-I136 HydrophobicContact CD2-CB 4.17Å; F129-I136 HydrophobicContact CD2-CG2 4.44Å; F129-I136 HydrophobicContact CE2-CB 4.12Å; F129-I136 HydrophobicContact CE2-CG2 4.04Å; F129-A138 HydrophobicContact CE2-CB 3.97Å; F129-A138 HydrophobicContact CZ-CB 3.66Å; F129-F142 HydrophobicContact CE1-CD1 4.47Å; F129-F142 HydrophobicContact CE1-CE1 4.21Å; F129-F142 HydrophobicContact CE2-CE1 4.11Å; F129-F142 AromaticContact CZ-CD1 3.78Å; F129-F142 HydrophobicContact CZ-CD1 3.78Å; F129-F142 AromaticContact CZ-CE1 3.58Å; F129-F142 HydrophobicContact CZ-CE1 3.58Å; F129-V146 HydrophobicContact CD1-CB 4.34Å; F129-V146 HydrophobicContact CD1-CG1 3.68Å; F129-V146 HydrophobicContact CE1-CB 3.91Å; F129-V146 HydrophobicContact CE1-CG1 3.78Å; F129-V146 HydrophobicContact CE1-CG2 4.01Å; F129-I210 HydrophobicContact CB-CD1 4.34Å; F129-I210 HydrophobicContact CB-CG1 4.38Å; F129-I210 HydrophobicContact CB-CG2 4.25Å; F129-I210 HydrophobicContact CD1-CD1 3.96Å; F129-I210 HydrophobicContact CD2-CD1 3.72Å; F129-I210 HydrophobicContact CD2-CG1 3.93Å; F129-I210 HydrophobicContact CE1-CD1 4.24Å; F129-I210 HydrophobicContact CE2-CD1 4.02Å; F129-I210 HydrophobicContact CG-CD1 3.71Å; F129-I210 HydrophobicContact CG-CG1 4.11Å; F129-I210 HydrophobicContact CZ-CD1 4.27Å
130	L	87.8	Confident	85.1	Confident	41 Å²	41	68.2 Å²	68.2	22%	0.215	36%	0.363	C	S	.	.	H	α-helix	trans	-68.1	-25.7	178.9	-71.4	170.5	0	0	0	113.6	F126 Q127 G132 V146 R147 Y150	F126-L130 WeakPolarHBondContact O-CG 3.41Å; F126-L130 PolarHBondContact O-N 3.06Å; F126-L130 VanDerWaalsContact O-N 3.13Å; Q127-L130 CarbonylContact O-C 3.58Å; Q127-L130 PolarHBondContact O-N 2.99Å; L130-G132 VanDerWaalsContact C-N 3.31Å; L130-V146 HydrophobicContact CD2-CB 4.45Å; L130-V146 HydrophobicContact CD2-CG1 4.15Å; L130-V146 HydrophobicContact CG-CG1 4.31Å; L130-R147 HydrophobicContact CD1-CB 4.45Å; L130-R147 HydrophobicContact CD1-CG 4.45Å; L130-R147 HydrophobicContact CD2-CB 3.88Å; L130-R147 HydrophobicContact CD2-CG 4.42Å; L130-Y150 HydrophobicContact CD1-CD1 4.08Å; L130-Y150 HydrophobicContact CD1-CG 3.98Å
131	N	87	Confident	85	Confident	102 Å²	102	65.6 Å²	65.6	55%	0.545	36%	0.357	S	S	.	.	H	α-helix	trans	-78.1	-13.5	172.1	-68.5	-4.5	0	0	0	113.1	Q127 A128 F129 E133	Q127-N131 VanDerWaalsContact O-CG 3.27Å; Q127-N131 PolarHBondContact O-N 3.3Å; Q127-N131 PolarHBondContact O-OD1 3.5Å; A128-N131 PolarHBondContact O-N 3.38Å; F129-N131 VanDerWaalsContact C-N 3.29Å; F129-N131 PolarHBondContact O-N 3.37Å; N131-E133 HydrophobicContact CB-CG 3.9Å; N131-E133 WeakPolarHBondContact CB-OE1 3.37Å; N131-E133 PolarHBondContact ND2-OE1 3.43Å
132	G	82.5	Confident	84.9	Confident	60 Å²	60	61.9 Å²	61.9	62%	0.619	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.8	17	-175	0	0	0	0	0	114.9	A128 F129 L130 T134	A128-G132 PolarHBondContact O-N 2.84Å; F129-G132 PolarHBondContact O-N 3.23Å; F129-G132 VanDerWaalsContact O-N 3.08Å; L130-G132 VanDerWaalsContact C-N 3.31Å; G132-T134 VanDerWaalsContact C-N 3.33Å; G132-T134 PolarHBondContact O-N 2.79Å
133	E	81.3	Confident	84.9	Confident	134 Å²	134	63.3 Å²	63.3	63%	0.626	35%	0.347	S	S	*	.			trans	-79.8	-11.6	-176.8	-63.1	165.4	-154.8	0	0	113.5	A128 N131	A128-E133 HydrophobicContact CB-CB 4.18Å; A128-E133 WeakPolarHBondContact CB-OE2 3.34Å; A128-E133 WeakPolarHBondContact O-CB 3.23Å; A128-E133 PolarHBondContact O-N 3.21Å; N131-E133 HydrophobicContact CB-CG 3.9Å; N131-E133 WeakPolarHBondContact CB-OE1 3.37Å; N131-E133 PolarHBondContact ND2-OE1 3.43Å
134	T	81.6	Confident	84.8	Confident	37 Å²	37	64.4 Å²	64.4	23%	0.227	36%	0.355	C	S	.	.	S	Bend	trans	-106.8	147.2	-176.1	64	0	0	0	0	112.7	A128 F129 G132 I136	A128-T134 HydrophobicContact CB-CG2 4.33Å; F129-T134 HydrophobicContact CB-CG2 4.25Å; F129-T134 WeakPolarHBondContact CD2-OG1 3.27Å; G132-T134 VanDerWaalsContact C-N 3.33Å; G132-T134 PolarHBondContact O-N 2.79Å; T134-I136 PolarHBondContact O-N 3.1Å
135	Q	77.2	Confident	84.6	Confident	164 Å²	164	59.9 Å²	59.9	77%	0.766	33%	0.334	S	S	*	.			trans	-76.3	20.5	-178	-58.8	179.7	57.4	0	0	114.9	V137 E214	Q135-V137 PolarHBondContact O-N 3.46Å; Q135-E214 PolarHBondContact N-OE1 3.03Å; Q135-E214 PolarHBondContact NE2-OE2 3Å; Q135-E214 VanDerWaalsContact NE2-OE2 3.16Å
136	I	81.9	Confident	84.6	Confident	38 Å²	38	57.4 Å²	57.4	20%	0.195	33%	0.325	C	S	.	.			trans	-90.5	106	-171.2	-60.4	175.1	0	0	0	110.5	F129 T134 A138 K206 A209 I210	F129-I136 HydrophobicContact CD2-CB 4.17Å; F129-I136 HydrophobicContact CD2-CG2 4.44Å; F129-I136 HydrophobicContact CE2-CB 4.12Å; F129-I136 HydrophobicContact CE2-CG2 4.04Å; T134-I136 PolarHBondContact O-N 3.1Å; I136-A138 PolarHBondContact O-N 3.47Å; I136-A138 VanDerWaalsContact O-N 3.09Å; I136-K206 HydrophobicContact CG2-CB 4.38Å; I136-K206 HydrophobicContact CG2-CG 4.43Å; I136-A209 HydrophobicContact CD1-CB 4.01Å; I136-I210 HydrophobicContact CD1-CB 4.35Å; I136-I210 HydrophobicContact CD1-CG1 3.56Å
137	V	76.6	Confident	84.5	Confident	127 Å²	127	63 Å²	63	77%	0.77	35%	0.346	S	S	*	.			trans	-62.2	111.8	-178.9	-177.2	0	0	0	0	111.6	Q135 K206	Q135-V137 PolarHBondContact O-N 3.46Å; V137-K206 VanDerWaalsContact O-CE 3.26Å; V137-K206 WeakPolarHBondContact O-CE 3.36Å; V137-K206 PolarHBondContact O-NZ 3.19Å
138	A	81.7	Confident	84.3	Confident	42 Å²	42	60.2 Å²	60.2	35%	0.347	34%	0.336	S	S	.	.			trans	-117.6	148.6	-175.7	0	0	0	0	0	112.4	F129 I136 F142 C143	F129-A138 HydrophobicContact CE2-CB 3.97Å; F129-A138 HydrophobicContact CZ-CB 3.66Å; I136-A138 PolarHBondContact O-N 3.47Å; I136-A138 VanDerWaalsContact O-N 3.09Å; A138-F142 HydrophobicContact CB-CD1 3.94Å; A138-C143 WeakPolarHBondContact CB-SG 3.46Å
139	D	83.6	Confident	84.3	Confident	60 Å²	60	59.3 Å²	59.3	32%	0.321	33%	0.328	S	S	.	.			trans	-97	156.4	167.5	51.8	89.4	0	0	0	109.3	A141 F142 C143 W203 K206	D139-A141 VanDerWaalsContact C-N 3.27Å; D139-A141 PolarHBondContact O-N 2.98Å; D139-F142 WeakPolarHBondContact O-CB 3.43Å; D139-F142 PolarHBondContact O-N 3.47Å; D139-F142 VanDerWaalsContact O-N 3.13Å; D139-F142 VanDerWaalsContact OD1-CB 3.27Å; D139-F142 WeakPolarHBondContact OD1-CB 3.29Å; D139-F142 PolarHBondContact OD1-N 3.09Å; D139-C143 PolarHBondContact O-N 2.94Å; D139-W203 WeakPolarHBondContact OD1-CZ2 3.09Å; D139-W203 PolarHBondContact OD1-NE1 2.72Å; D139-W203 PolarHBondContact OD2-NE1 3.22Å; D139-K206 IonicContact OD2-NZ 2.76Å; D139-K206 PolarHBondContact OD2-NZ 3.33Å
140	E	83.6	Confident	84.3	Confident	151 Å²	151	59.6 Å²	59.6	71%	0.706	33%	0.329	S	S	*	.	H	α-helix	trans	-60.5	-36.9	-174.3	-167.3	-172.7	158.5	0	0	112.5	C143 N144	E140-C143 PolarHBondContact O-N 2.95Å; E140-N144 WeakPolarHBondContact O-CB 3.46Å; E140-N144 VanDerWaalsContact O-CG 3.24Å; E140-N144 PolarHBondContact O-N 3.39Å; E140-N144 PolarHBondContact O-ND2 3.23Å
141	A	83.4	Confident	84.1	Confident	37 Å²	37	61.8 Å²	61.8	31%	0.306	34%	0.338	S	S	.	.	H	α-helix	trans	-63.5	-41.9	176.9	0	0	0	0	0	111.9	D139 N144 A145 W203	D139-A141 VanDerWaalsContact C-N 3.27Å; D139-A141 PolarHBondContact O-N 2.98Å; A141-N144 PolarHBondContact O-N 3.16Å; A141-A145 WeakPolarHBondContact O-CB 3.02Å; A141-A145 PolarHBondContact O-N 2.6Å; A141-W203 HydrophobicContact CB-CH2 3.84Å; A141-W203 HydrophobicContact CB-CZ2 3.77Å
142	F	86.9	Confident	83.8	Confident	0 Å²	0	59.4 Å²	59.4	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-63.8	-45	171.3	-176.4	-107.8	0	0	0	112.1	F129 A138 D139 N144 A145 V146 F177 W203 K206 I210	F129-F142 HydrophobicContact CE1-CD1 4.47Å; F129-F142 HydrophobicContact CE1-CE1 4.21Å; F129-F142 HydrophobicContact CE2-CE1 4.11Å; F129-F142 AromaticContact CZ-CD1 3.78Å; F129-F142 HydrophobicContact CZ-CD1 3.78Å; F129-F142 AromaticContact CZ-CE1 3.58Å; F129-F142 HydrophobicContact CZ-CE1 3.58Å; A138-F142 HydrophobicContact CB-CD1 3.94Å; D139-F142 WeakPolarHBondContact O-CB 3.43Å; D139-F142 PolarHBondContact O-N 3.47Å; D139-F142 VanDerWaalsContact O-N 3.13Å; D139-F142 VanDerWaalsContact OD1-CB 3.27Å; D139-F142 WeakPolarHBondContact OD1-CB 3.29Å; D139-F142 PolarHBondContact OD1-N 3.09Å; F142-N144 VanDerWaalsContact C-N 3.32Å; F142-N144 PolarHBondContact O-N 3.41Å; F142-A145 PolarHBondContact O-N 2.84Å; F142-A145 VanDerWaalsContact O-N 3.17Å; F142-V146 HydrophobicContact CD1-CG2 4.1Å; F142-V146 HydrophobicContact CD2-CG2 4.31Å; F142-V146 HydrophobicContact CE1-CG2 3.69Å; F142-V146 HydrophobicContact CE2-CG2 3.93Å; F142-V146 HydrophobicContact CG-CG2 4.4Å; F142-V146 HydrophobicContact CZ-CG2 3.59Å; F142-V146 WeakPolarHBondContact O-CG2 3.35Å; F142-V146 PolarHBondContact O-N 2.98Å; F142-F177 HydrophobicContact CD2-CZ 4.46Å; F142-F177 HydrophobicContact CE2-CE1 4.18Å; F142-F177 AromaticContact CE2-CZ 3.74Å; F142-F177 HydrophobicContact CE2-CZ 3.74Å; F142-F177 HydrophobicContact CZ-CZ 4.4Å; F142-W203 HydrophobicContact CB-CD2 4.24Å; F142-W203 HydrophobicContact CB-CZ2 4.06Å; F142-W203 HydrophobicContact CD2-CB 3.76Å; F142-W203 AromaticContact CD2-CD1 3.77Å; F142-W203 AromaticContact CD2-CD2 3.65Å; F142-W203 HydrophobicContact CD2-CD2 3.65Å; F142-W203 HydrophobicContact CD2-CE3 4.13Å; F142-W203 AromaticContact CD2-CG 3.47Å; F142-W203 HydrophobicContact CD2-CG 3.47Å; F142-W203 VanDerWaalsContact CD2-CG 3.47Å; F142-W203 HydrophobicContact CE2-CB 3.85Å; F142-W203 HydrophobicContact CE2-CG 4.08Å; F142-W203 WeakPolarHBondContact CE2-O 3.34Å; F142-W203 HydrophobicContact CG-CD2 4.42Å; F142-W203 HydrophobicContact CG-CG 4.35Å; F142-K206 HydrophobicContact CD1-CD 3.88Å; F142-K206 HydrophobicContact CD2-CD 4.42Å; F142-K206 HydrophobicContact CE1-CB 3.71Å; F142-K206 HydrophobicContact CE1-CD 3.82Å; F142-K206 HydrophobicContact CE1-CG 4.4Å; F142-K206 HydrophobicContact CE2-CB 3.94Å; F142-K206 HydrophobicContact CE2-CD 4.36Å; F142-K206 HydrophobicContact CG-CD 4.2Å; F142-K206 HydrophobicContact CZ-CB 3.33Å; F142-K206 HydrophobicContact CZ-CD 4.07Å; F142-K206 HydrophobicContact CZ-CG 4.34Å; F142-I210 HydrophobicContact CE1-CD1 4.14Å; F142-I210 HydrophobicContact CZ-CD1 4.14Å
143	C	86.3	Confident	84	Confident	35 Å²	35	56.8 Å²	56.8	24%	0.236	30%	0.299	C	S	.	.	H	α-helix	trans	-58.5	-42.8	176.1	-71.3	0	0	0	0	112.1	A138 D139 E140 V146 R147	A138-C143 WeakPolarHBondContact CB-SG 3.46Å; D139-C143 PolarHBondContact O-N 2.94Å; E140-C143 PolarHBondContact O-N 2.95Å; C143-V146 PolarHBondContact O-N 2.86Å; C143-R147 WeakPolarHBondContact O-CB 3.1Å; C143-R147 PolarHBondContact O-N 3.05Å
144	N	85.9	Confident	84.2	Confident	60 Å²	60	50.4 Å²	50.4	32%	0.321	27%	0.269	S	S	.	.	H	α-helix	trans	-69	-32.9	177.7	-68.9	-18.8	0	0	0	112.1	E140 A141 F142 R147 S148	E140-N144 WeakPolarHBondContact O-CB 3.46Å; E140-N144 VanDerWaalsContact O-CG 3.24Å; E140-N144 PolarHBondContact O-N 3.39Å; E140-N144 PolarHBondContact O-ND2 3.23Å; A141-N144 PolarHBondContact O-N 3.16Å; F142-N144 VanDerWaalsContact C-N 3.32Å; F142-N144 PolarHBondContact O-N 3.41Å; N144-R147 PolarHBondContact OD1-NH1 2.72Å; N144-S148 PolarHBondContact O-N 2.87Å; N144-S148 VanDerWaalsContact O-N 3.14Å
145	A	86.5	Confident	84.3	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-69.2	-43.6	171.4	0	0	0	0	0	112.8	A141 F142 S148 Y149 I181 W203	A141-A145 WeakPolarHBondContact O-CB 3.02Å; A141-A145 PolarHBondContact O-N 2.6Å; F142-A145 PolarHBondContact O-N 2.84Å; F142-A145 VanDerWaalsContact O-N 3.17Å; A145-S148 PolarHBondContact O-N 3.42Å; A145-Y149 PolarHBondContact O-N 3.47Å; A145-I181 HydrophobicContact CB-CG2 3.89Å; A145-W203 HydrophobicContact CB-CZ3 4.1Å
146	V	88.6	Confident	84.7	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-65	-39.7	176.4	175.2	0	0	0	0	111.1	F126 F129 L130 F142 C143 Y149 Y150 F177 I210	F126-V146 HydrophobicContact CD1-CG1 3.73Å; F126-V146 HydrophobicContact CE1-CG1 4.03Å; F129-V146 HydrophobicContact CD1-CB 4.34Å; F129-V146 HydrophobicContact CD1-CG1 3.68Å; F129-V146 HydrophobicContact CE1-CB 3.91Å; F129-V146 HydrophobicContact CE1-CG1 3.78Å; F129-V146 HydrophobicContact CE1-CG2 4.01Å; L130-V146 HydrophobicContact CD2-CB 4.45Å; L130-V146 HydrophobicContact CD2-CG1 4.15Å; L130-V146 HydrophobicContact CG-CG1 4.31Å; F142-V146 HydrophobicContact CD1-CG2 4.1Å; F142-V146 HydrophobicContact CD2-CG2 4.31Å; F142-V146 HydrophobicContact CE1-CG2 3.69Å; F142-V146 HydrophobicContact CE2-CG2 3.93Å; F142-V146 HydrophobicContact CG-CG2 4.4Å; F142-V146 HydrophobicContact CZ-CG2 3.59Å; F142-V146 WeakPolarHBondContact O-CG2 3.35Å; F142-V146 PolarHBondContact O-N 2.98Å; C143-V146 PolarHBondContact O-N 2.86Å; V146-Y149 PolarHBondContact O-N 3.09Å; V146-Y150 WeakPolarHBondContact O-CB 3.22Å; V146-Y150 PolarHBondContact O-N 3.41Å; V146-F177 HydrophobicContact CG2-CE2 4.05Å; V146-F177 HydrophobicContact CG2-CZ 4.07Å; V146-I210 HydrophobicContact CG2-CD1 4.46Å
147	R	87.6	Confident	84.7	Confident	117 Å²	117	50.2 Å²	50.2	44%	0.442	27%	0.27	S	S	.	.	H	α-helix	trans	-61.1	-47.5	174.6	-164.8	-178.8	-60.9	111.7	4	111.4	L130 C143 N144 Y149 Y150 E151	L130-R147 HydrophobicContact CD1-CB 4.45Å; L130-R147 HydrophobicContact CD1-CG 4.45Å; L130-R147 HydrophobicContact CD2-CB 3.88Å; L130-R147 HydrophobicContact CD2-CG 4.42Å; C143-R147 WeakPolarHBondContact O-CB 3.1Å; C143-R147 PolarHBondContact O-N 3.05Å; N144-R147 PolarHBondContact OD1-NH1 2.72Å; R147-Y149 PolarHBondContact O-N 2.69Å; R147-Y150 PolarHBondContact O-N 2.7Å; R147-E151 WeakPolarHBondContact O-CG 3.4Å; R147-E151 PolarHBondContact O-N 3.38Å
148	S	84.5	Confident	85	Confident	29 Å²	29	45.5 Å²	45.5	20%	0.203	24%	0.238	C	C	.	.	H	α-helix	trans	-60.3	-42.6	175.6	173.2	0	0	0	0	112.6	N144 A145 V152 R184	N144-S148 PolarHBondContact O-N 2.87Å; N144-S148 VanDerWaalsContact O-N 3.14Å; A145-S148 PolarHBondContact O-N 3.42Å; S148-V152 VanDerWaalsContact O-CB 3.28Å; S148-V152 WeakPolarHBondContact O-CB 3.38Å; S148-V152 WeakPolarHBondContact O-CG2 3.44Å; S148-V152 PolarHBondContact O-N 2.9Å; S148-R184 PolarHBondContact OG-NH2 3.23Å
149	Y	87.7	Confident	85.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-65.5	-36.7	175.8	175.5	-105.5	0	0	0	112.9	F126 A145 V146 R147 F153 L154 F173 V176 F177 Y207	F126-Y149 HydrophobicContact CD1-CD1 4.02Å; F126-Y149 HydrophobicContact CD1-CE1 4.24Å; F126-Y149 AromaticContact CE1-CD1 3.63Å; F126-Y149 HydrophobicContact CE1-CD1 3.63Å; F126-Y149 AromaticContact CE1-CE1 3.67Å; F126-Y149 HydrophobicContact CE1-CE1 3.67Å; F126-Y149 HydrophobicContact CZ-CD1 4.46Å; F126-Y149 HydrophobicContact CZ-CE1 4.07Å; A145-Y149 PolarHBondContact O-N 3.47Å; V146-Y149 PolarHBondContact O-N 3.09Å; R147-Y149 PolarHBondContact O-N 2.69Å; Y149-F153 HydrophobicContact CD2-CB 3.9Å; Y149-F153 AromaticContact CD2-CD1 3.98Å; Y149-F153 HydrophobicContact CD2-CD1 3.98Å; Y149-F153 HydrophobicContact CD2-CG 4.17Å; Y149-F153 HydrophobicContact CE1-CD1 4.46Å; Y149-F153 HydrophobicContact CE2-CB 4.05Å; Y149-F153 AromaticContact CE2-CD1 3.24Å; Y149-F153 HydrophobicContact CE2-CD1 3.24Å; Y149-F153 AromaticContact CE2-CE1 3.82Å; Y149-F153 HydrophobicContact CE2-CE1 3.82Å; Y149-F153 AromaticContact CE2-CG 3.79Å; Y149-F153 HydrophobicContact CE2-CG 3.79Å; Y149-F153 AromaticContact CZ-CD1 3.54Å; Y149-F153 AromaticContact CZ-CE1 3.91Å; Y149-F153 WeakPolarHBondContact O-CA 3.15Å; Y149-F153 WeakPolarHBondContact O-CB 3.24Å; Y149-F153 PolarHBondContact O-N 2.9Å; Y149-F153 VanDerWaalsContact O-N 3.12Å; Y149-F153 WeakPolarHBondContact OH-CE1 3.37Å; Y149-L154 HydrophobicContact CD1-CD1 3.97Å; Y149-L154 HydrophobicContact CD1-CG 4.02Å; Y149-L154 HydrophobicContact CE1-CD1 3.71Å; Y149-L154 HydrophobicContact CE1-CD2 3.86Å; Y149-L154 HydrophobicContact CE1-CG 3.65Å; Y149-L154 PolarHBondContact O-N 3.36Å; Y149-F173 WeakPolarHBondContact OH-CB 3.5Å; Y149-F173 PolarHBondContact OH-O 2.93Å; Y149-V176 HydrophobicContact CE2-CG1 4.34Å; Y149-F177 AromaticContact CD1-CD2 3.83Å; Y149-F177 HydrophobicContact CD1-CD2 3.83Å; Y149-F177 HydrophobicContact CD2-CB 4.03Å; Y149-F177 AromaticContact CD2-CD2 3.88Å; Y149-F177 HydrophobicContact CD2-CD2 3.88Å; Y149-F177 HydrophobicContact CD2-CG 4.47Å; Y149-F177 HydrophobicContact CE1-CB 4.46Å; Y149-F177 HydrophobicContact CE1-CD2 4.31Å; Y149-F177 HydrophobicContact CE2-CB 3.76Å; Y149-F177 HydrophobicContact CE2-CD2 4.37Å; Y149-F177 HydrophobicContact CG-CB 4.49Å; Y149-F177 AromaticContact CG-CD2 3.58Å; Y149-F177 HydrophobicContact CG-CD2 3.58Å; Y149-F177 HydrophobicContact CG-CE2 4.35Å; Y149-Y207 AromaticContact CE1-CE2 3.86Å; Y149-Y207 HydrophobicContact CE1-CE2 3.86Å
150	Y	87.4	Confident	85.1	Confident	17 Å²	17	41.4 Å²	41.4	7%	0.067	21%	0.213	C	C	.	.	I	π-helix	trans	-66.9	-47.2	177.1	176.2	-95.4	0	0	0	112.2	K123 F126 Q127 L130 V146 R147 L154 K155	K123-Y150 HydrophobicContact CB-CE2 4.25Å; K123-Y150 WeakPolarHBondContact O-CE2 3.2Å; F126-Y150 HydrophobicContact CB-CD2 3.83Å; F126-Y150 HydrophobicContact CB-CE2 4.48Å; Q127-Y150 HydrophobicContact CB-CE2 4.09Å; Q127-Y150 PolarHBondContact OE1-OH 3.32Å; L130-Y150 HydrophobicContact CD1-CD1 4.08Å; L130-Y150 HydrophobicContact CD1-CG 3.98Å; V146-Y150 WeakPolarHBondContact O-CB 3.22Å; V146-Y150 PolarHBondContact O-N 3.41Å; R147-Y150 PolarHBondContact O-N 2.7Å; Y150-L154 HydrophobicContact CD2-CB 4.42Å; Y150-L154 HydrophobicContact CD2-CD1 4.04Å; Y150-L154 PolarHBondContact O-N 3Å; Y150-K155 HydrophobicContact CD1-CD 4.13Å; Y150-K155 HydrophobicContact CE1-CD 3.72Å; Y150-K155 VanDerWaalsContact CE1-CE 3.46Å; Y150-K155 HydrophobicContact CE1-CG 4.27Å; Y150-K155 WeakPolarHBondContact O-CB 3.41Å; Y150-K155 PolarHBondContact O-N 3.41Å
151	E	83.4	Confident	85	Confident	88 Å²	88	40 Å²	40	41%	0.411	20%	0.201	S	C	.	.	I	π-helix	trans	-70.6	-56.2	178.2	-61.9	-56.8	141.8	0	0	112.5	R147 K155	R147-E151 WeakPolarHBondContact O-CG 3.4Å; R147-E151 PolarHBondContact O-N 3.38Å; E151-K155 WeakPolarHBondContact O-CB 3.32Å; E151-K155 IonicContact OE1-NZ 2.72Å; E151-K155 PolarHBondContact OE1-NZ 3.17Å; E151-K155 WeakPolarHBondContact OE2-CD 3.34Å; E151-K155 WeakPolarHBondContact OE2-CE 3.3Å; E151-K155 IonicContact OE2-NZ 3.45Å; E151-K155 PolarHBondContact OE2-NZ 3.46Å
152	V	81.1	Confident	84.9	Confident	52 Å²	52	38.6 Å²	38.6	32%	0.315	19%	0.188	S	C	.	.	I	π-helix	trans	-74.7	-35.2	-170.7	-177.8	0	0	0	0	112.5	S148 F768	S148-V152 VanDerWaalsContact O-CB 3.28Å; S148-V152 WeakPolarHBondContact O-CB 3.38Å; S148-V152 WeakPolarHBondContact O-CG2 3.44Å; S148-V152 PolarHBondContact O-N 2.9Å; V152-F768 HydrophobicContact CG1-CE1 4.34Å; V152-F768 WeakPolarHBondContact O-CZ 3.42Å
153	F	86.3	Confident	84.7	Confident	5 Å²	5	38.8 Å²	38.8	2%	0.022	19%	0.189	C	C	.	.	I	π-helix	trans	-106.8	-63.3	-175.8	-178.6	-97.5	0	0	0	113.1	Y149 K155 S156 V159 F173 V176 F768	Y149-F153 HydrophobicContact CD2-CB 3.9Å; Y149-F153 AromaticContact CD2-CD1 3.98Å; Y149-F153 HydrophobicContact CD2-CD1 3.98Å; Y149-F153 HydrophobicContact CD2-CG 4.17Å; Y149-F153 HydrophobicContact CE1-CD1 4.46Å; Y149-F153 HydrophobicContact CE2-CB 4.05Å; Y149-F153 AromaticContact CE2-CD1 3.24Å; Y149-F153 HydrophobicContact CE2-CD1 3.24Å; Y149-F153 AromaticContact CE2-CE1 3.82Å; Y149-F153 HydrophobicContact CE2-CE1 3.82Å; Y149-F153 AromaticContact CE2-CG 3.79Å; Y149-F153 HydrophobicContact CE2-CG 3.79Å; Y149-F153 AromaticContact CZ-CD1 3.54Å; Y149-F153 AromaticContact CZ-CE1 3.91Å; Y149-F153 WeakPolarHBondContact O-CA 3.15Å; Y149-F153 WeakPolarHBondContact O-CB 3.24Å; Y149-F153 PolarHBondContact O-N 2.9Å; Y149-F153 VanDerWaalsContact O-N 3.12Å; Y149-F153 WeakPolarHBondContact OH-CE1 3.37Å; F153-K155 PolarHBondContact O-N 2.93Å; F153-S156 VanDerWaalsContact O-CB 3.29Å; F153-S156 WeakPolarHBondContact O-CB 3.3Å; F153-S156 PolarHBondContact O-N 2.94Å; F153-S156 VanDerWaalsContact O-N 3.09Å; F153-V159 HydrophobicContact CD1-CG2 4.37Å; F153-V159 HydrophobicContact CD2-CG2 3.59Å; F153-V159 HydrophobicContact CE1-CG1 4.22Å; F153-V159 HydrophobicContact CE1-CG2 4.26Å; F153-V159 HydrophobicContact CE2-CG2 3.44Å; F153-V159 VanDerWaalsContact CE2-CG2 3.44Å; F153-V159 HydrophobicContact CG-CG2 4.07Å; F153-V159 HydrophobicContact CZ-CG1 4.12Å; F153-V159 HydrophobicContact CZ-CG2 3.81Å; F153-V159 VanDerWaalsContact O-CG2 3.28Å; F153-V159 WeakPolarHBondContact O-CG2 3.44Å; F153-F173 HydrophobicContact CE1-CB 4.39Å; F153-F173 AromaticContact CE1-CD1 3.66Å; F153-F173 HydrophobicContact CE1-CD1 3.66Å; F153-F173 HydrophobicContact CE1-CD2 4.14Å; F153-F173 AromaticContact CE1-CE1 3.86Å; F153-F173 HydrophobicContact CE1-CE1 3.86Å; F153-F173 HydrophobicContact CE1-CE2 4.3Å; F153-F173 AromaticContact CE1-CG 3.8Å; F153-F173 HydrophobicContact CE1-CG 3.8Å; F153-F173 HydrophobicContact CE1-CZ 4.17Å; F153-F173 HydrophobicContact CZ-CD1 4.41Å; F153-F173 HydrophobicContact CZ-CD2 4.09Å; F153-F173 HydrophobicContact CZ-CE2 4.2Å; F153-F173 HydrophobicContact CZ-CG 4.19Å; F153-F173 HydrophobicContact CZ-CZ 4.42Å; F153-V176 HydrophobicContact CD2-CG1 3.63Å; F153-V176 HydrophobicContact CE2-CB 4.12Å; F153-V176 HydrophobicContact CE2-CG1 3.7Å; F153-V176 HydrophobicContact CE2-CG2 4.08Å; F153-V176 HydrophobicContact CG-CG1 4.1Å; F153-V176 HydrophobicContact CZ-CB 4.25Å; F153-V176 HydrophobicContact CZ-CG1 4.22Å; F153-V176 HydrophobicContact CZ-CG2 4.35Å; F153-F768 HydrophobicContact CB-CZ 4.49Å; F153-F768 HydrophobicContact CD2-CB 4.37Å; F153-F768 AromaticContact CD2-CD1 3.93Å; F153-F768 HydrophobicContact CD2-CD1 3.93Å; F153-F768 AromaticContact CD2-CD2 3.49Å; F153-F768 HydrophobicContact CD2-CD2 3.49Å; F153-F768 VanDerWaalsContact CD2-CD2 3.49Å; F153-F768 HydrophobicContact CD2-CE1 4.06Å; F153-F768 AromaticContact CD2-CE2 3.64Å; F153-F768 HydrophobicContact CD2-CE2 3.64Å; F153-F768 AromaticContact CD2-CG 3.66Å; F153-F768 HydrophobicContact CD2-CG 3.66Å; F153-F768 AromaticContact CD2-CZ 3.92Å; F153-F768 HydrophobicContact CD2-CZ 3.92Å; F153-F768 HydrophobicContact CE2-CB 4.2Å; F153-F768 AromaticContact CE2-CD2 3.62Å; F153-F768 HydrophobicContact CE2-CD2 3.62Å; F153-F768 HydrophobicContact CE2-CE2 4.14Å; F153-F768 AromaticContact CE2-CG 3.88Å; F153-F768 HydrophobicContact CE2-CG 3.88Å
154	L	85.9	Confident	84.3	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.206	C	C	.	.	I	π-helix	trans	-63.3	-41.6	-170.9	-67.1	177.6	0	0	0	112.8	L122 K123 F126 Y149 Y150 S156 F173	L122-L154 HydrophobicContact CD2-CD2 3.99Å; L122-L154 HydrophobicContact CG-CD2 4.47Å; K123-L154 WeakPolarHBondContact CE-O 3.37Å; K123-L154 HydrophobicContact CG-CB 4.44Å; K123-L154 PolarHBondContact NZ-O 3Å; F126-L154 HydrophobicContact CB-CD1 3.89Å; F126-L154 HydrophobicContact CD1-CD1 3.69Å; F126-L154 HydrophobicContact CD2-CD1 4.13Å; F126-L154 HydrophobicContact CE1-CD1 4.33Å; F126-L154 HydrophobicContact CG-CD1 3.6Å; Y149-L154 HydrophobicContact CD1-CD1 3.97Å; Y149-L154 HydrophobicContact CD1-CG 4.02Å; Y149-L154 HydrophobicContact CE1-CD1 3.71Å; Y149-L154 HydrophobicContact CE1-CD2 3.86Å; Y149-L154 HydrophobicContact CE1-CG 3.65Å; Y149-L154 PolarHBondContact O-N 3.36Å; Y150-L154 HydrophobicContact CD2-CB 4.42Å; Y150-L154 HydrophobicContact CD2-CD1 4.04Å; Y150-L154 PolarHBondContact O-N 3Å; L154-S156 VanDerWaalsContact C-N 3.29Å; L154-S156 PolarHBondContact O-N 3.32Å; L154-F173 HydrophobicContact CD2-CD1 3.77Å; L154-F173 HydrophobicContact CD2-CE1 3.68Å
155	K	85.4	Confident	83.7	Confident	91 Å²	91	41.7 Å²	41.7	40%	0.396	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-24.7	176.2	-90.9	167.2	156.4	179.7	0	113.6	Y150 E151 F153	Y150-K155 HydrophobicContact CD1-CD 4.13Å; Y150-K155 HydrophobicContact CE1-CD 3.72Å; Y150-K155 VanDerWaalsContact CE1-CE 3.46Å; Y150-K155 HydrophobicContact CE1-CG 4.27Å; Y150-K155 WeakPolarHBondContact O-CB 3.41Å; Y150-K155 PolarHBondContact O-N 3.41Å; E151-K155 WeakPolarHBondContact O-CB 3.32Å; E151-K155 IonicContact OE1-NZ 2.72Å; E151-K155 PolarHBondContact OE1-NZ 3.17Å; E151-K155 WeakPolarHBondContact OE2-CD 3.34Å; E151-K155 WeakPolarHBondContact OE2-CE 3.3Å; E151-K155 IonicContact OE2-NZ 3.45Å; E151-K155 PolarHBondContact OE2-NZ 3.46Å; F153-K155 PolarHBondContact O-N 2.93Å
156	S	83.6	Confident	82.9	Confident	24 Å²	24	42 Å²	42	17%	0.168	21%	0.205	C	C	.	.			trans	-61.9	130.2	-168.8	-163.6	0	0	0	0	115.1	F153 L154 R158 V159 A160	F153-S156 VanDerWaalsContact O-CB 3.29Å; F153-S156 WeakPolarHBondContact O-CB 3.3Å; F153-S156 PolarHBondContact O-N 2.94Å; F153-S156 VanDerWaalsContact O-N 3.09Å; L154-S156 VanDerWaalsContact C-N 3.29Å; L154-S156 PolarHBondContact O-N 3.32Å; S156-R158 PolarHBondContact O-N 2.91Å; S156-V159 PolarHBondContact O-N 3.41Å; S156-A160 PolarHBondContact O-N 2.94Å
157	D	82.1	Confident	81.8	Confident	119 Å²	119	42.1 Å²	42.1	64%	0.636	21%	0.206	S	C	*	.	H	α-helix	trans	-58.4	-19.4	172.1	-83.3	-24.1	0	0	0	114.5	R161	D157-R161 WeakPolarHBondContact O-CB 3.26Å; D157-R161 PolarHBondContact O-N 3.18Å; D157-R161 VanDerWaalsContact O-N 3.15Å; D157-R161 PolarHBondContact O-NE 2.99Å
158	R	82.9	Confident	81.2	Confident	28 Å²	28	36.6 Å²	36.6	11%	0.106	19%	0.185	C	C	.	.	H	α-helix	trans	-66.7	-47.5	171.8	-67.2	-172.6	-77	178.6	-6.3	110.7	S156 R161 M162 R763 Y764 P767 F768	S156-R158 PolarHBondContact O-N 2.91Å; R158-R161 PolarHBondContact O-N 2.92Å; R158-M162 PolarHBondContact O-N 3.26Å; R158-R763 WeakPolarHBondContact CD-O 3.45Å; R158-Y764 HydrophobicContact CG-CD1 3.92Å; R158-Y764 HydrophobicContact CG-CE1 3.94Å; R158-P767 HydrophobicContact CB-CB 3.86Å; R158-F768 HydrophobicContact CB-CE2 4.43Å
159	V	84.4	Confident	80.9	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-70.8	-41	177.2	-179.6	0	0	0	0	110.7	L119 F153 S156 R161 M162 V163 F173 F768	L119-V159 HydrophobicContact CD1-CG1 4.44Å; F153-V159 HydrophobicContact CD1-CG2 4.37Å; F153-V159 HydrophobicContact CD2-CG2 3.59Å; F153-V159 HydrophobicContact CE1-CG1 4.22Å; F153-V159 HydrophobicContact CE1-CG2 4.26Å; F153-V159 HydrophobicContact CE2-CG2 3.44Å; F153-V159 VanDerWaalsContact CE2-CG2 3.44Å; F153-V159 HydrophobicContact CG-CG2 4.07Å; F153-V159 HydrophobicContact CZ-CG1 4.12Å; F153-V159 HydrophobicContact CZ-CG2 3.81Å; F153-V159 VanDerWaalsContact O-CG2 3.28Å; F153-V159 WeakPolarHBondContact O-CG2 3.44Å; S156-V159 PolarHBondContact O-N 3.41Å; V159-R161 VanDerWaalsContact C-N 3.26Å; V159-R161 PolarHBondContact O-N 3.36Å; V159-M162 HydrophobicContact CG1-CE 4.33Å; V159-M162 PolarHBondContact O-N 3.27Å; V159-M162 VanDerWaalsContact O-N 3.15Å; V159-V163 HydrophobicContact CG1-CG2 4.41Å; V159-V163 WeakPolarHBondContact O-CG2 3.4Å; V159-V163 PolarHBondContact O-N 2.99Å; V159-F173 HydrophobicContact CG1-CE1 4.04Å; V159-F173 HydrophobicContact CG1-CE2 4Å; V159-F173 HydrophobicContact CG1-CZ 3.36Å; V159-F768 HydrophobicContact CG2-CD2 4.06Å; V159-F768 HydrophobicContact CG2-CE2 3.72Å
160	A	83.7	Confident	80.4	Confident	16 Å²	16	36.8 Å²	36.8	13%	0.132	19%	0.188	C	C	.	.	H	α-helix	trans	-58.2	-37.6	176.2	0	0	0	0	0	112.6	L119 S156 Q164	L119-A160 HydrophobicContact CD2-CB 4.39Å; S156-A160 PolarHBondContact O-N 2.94Å; A160-Q164 VanDerWaalsContact O-CG 3.28Å; A160-Q164 WeakPolarHBondContact O-CG 3.25Å; A160-Q164 PolarHBondContact O-N 3.49Å; A160-Q164 PolarHBondContact O-NE2 3.39Å
161	R	81.5	Confident	80.1	Confident	122 Å²	122	38.7 Å²	38.7	46%	0.46	20%	0.2	S	C	.	.	H	α-helix	trans	-73	-41.8	172.8	-81.6	-179.2	-79	-172	-12.1	113.2	D157 R158 V159 V163 Q164 S165	D157-R161 WeakPolarHBondContact O-CB 3.26Å; D157-R161 PolarHBondContact O-N 3.18Å; D157-R161 VanDerWaalsContact O-N 3.15Å; D157-R161 PolarHBondContact O-NE 2.99Å; R158-R161 PolarHBondContact O-N 2.92Å; V159-R161 VanDerWaalsContact C-N 3.26Å; V159-R161 PolarHBondContact O-N 3.36Å; R161-V163 VanDerWaalsContact C-N 3.27Å; R161-V163 PolarHBondContact O-N 3.38Å; R161-Q164 PolarHBondContact O-N 2.89Å; R161-Q164 VanDerWaalsContact O-N 3.08Å; R161-S165 PolarHBondContact O-N 2.96Å; R161-S165 PolarHBondContact O-OG 3.22Å; R161-S165 VanDerWaalsContact O-OG 3.09Å
162	M	81.3	Confident	80	Confident	7 Å²	7	35.7 Å²	35.7	3%	0.034	19%	0.186	C	C	.	.	H	α-helix	trans	-59.8	-35.9	176.1	-176.2	177.1	58	0	0	113	R158 V159 S165 G166 G167 C168 F173 P767 R770	R158-M162 PolarHBondContact O-N 3.26Å; V159-M162 HydrophobicContact CG1-CE 4.33Å; V159-M162 PolarHBondContact O-N 3.27Å; V159-M162 VanDerWaalsContact O-N 3.15Å; M162-S165 WeakPolarHBondContact CA-OG 3.41Å; M162-S165 PolarHBondContact O-OG 2.97Å; M162-S165 VanDerWaalsContact O-OG 3.12Å; M162-G166 PolarHBondContact O-N 2.71Å; M162-G167 PolarHBondContact O-N 3.49Å; M162-C168 HydrophobicContact CE-CB 3.75Å; M162-C168 HydrophobicContact CG-CB 3.87Å; M162-C168 HydrophobicContact SD-CB 3.87Å; M162-F173 HydrophobicContact CE-CE2 4.37Å; M162-P767 HydrophobicContact CB-CG 4.11Å; M162-P767 HydrophobicContact CE-CG 4.41Å; M162-P767 HydrophobicContact CG-CG 4.36Å; M162-P767 HydrophobicContact SD-CG 3.74Å; M162-R770 HydrophobicContact SD-CB 4.05Å
163	V	82.4	Confident	80.3	Confident	4 Å²	4	33.2 Å²	33.2	2%	0.024	17%	0.171	C	C	.	.	H	α-helix	trans	-68.4	-41.8	172.5	167.2	0	0	0	0	111.3	L114 L119 V159 R161 G166 C168 F173	L114-V163 HydrophobicContact CB-CG2 4.42Å; L119-V163 HydrophobicContact CB-CG1 4.1Å; L119-V163 HydrophobicContact CB-CG2 4.4Å; L119-V163 HydrophobicContact CD1-CG2 4.46Å; L119-V163 HydrophobicContact CD2-CB 4.18Å; L119-V163 HydrophobicContact CD2-CG1 4.23Å; L119-V163 HydrophobicContact CD2-CG2 4.05Å; V159-V163 HydrophobicContact CG1-CG2 4.41Å; V159-V163 WeakPolarHBondContact O-CG2 3.4Å; V159-V163 PolarHBondContact O-N 2.99Å; R161-V163 VanDerWaalsContact C-N 3.27Å; R161-V163 PolarHBondContact O-N 3.38Å; V163-G166 PolarHBondContact O-N 2.96Å; V163-C168 WeakPolarHBondContact CG2-SG 3.29Å; V163-F173 HydrophobicContact CG2-CE2 4.23Å; V163-F173 HydrophobicContact CG2-CZ 3.84Å
164	Q	78.9	Confident	80.3	Confident	124 Å²	124	36.1 Å²	36.1	58%	0.579	18%	0.182	S	C	*	.	H	α-helix	trans	-66.2	-37.7	177.6	-74.7	166.5	65.4	0	0	112.8	A160 R161 G166	A160-Q164 VanDerWaalsContact O-CG 3.28Å; A160-Q164 WeakPolarHBondContact O-CG 3.25Å; A160-Q164 PolarHBondContact O-N 3.49Å; A160-Q164 PolarHBondContact O-NE2 3.39Å; R161-Q164 PolarHBondContact O-N 2.89Å; R161-Q164 VanDerWaalsContact O-N 3.08Å; Q164-G166 PolarHBondContact O-N 3.38Å
165	S	72.6	Confident	80.3	Confident	32 Å²	32	37.8 Å²	37.8	22%	0.224	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.7	-2.9	174.9	58.8	0	0	0	0	114.1	R161 M162 G167 G706 V708	R161-S165 PolarHBondContact O-N 2.96Å; R161-S165 PolarHBondContact O-OG 3.22Å; R161-S165 VanDerWaalsContact O-OG 3.09Å; M162-S165 WeakPolarHBondContact CA-OG 3.41Å; M162-S165 PolarHBondContact O-OG 2.97Å; M162-S165 VanDerWaalsContact O-OG 3.12Å; S165-G167 VanDerWaalsContact C-N 3.29Å; S165-G167 PolarHBondContact O-N 3.27Å; S165-G706 WeakPolarHBondContact CB-O 3.28Å; S165-V708 WeakPolarHBondContact OG-CG2 3.49Å
166	G	69	Low	80.2	Confident	8 Å²	8	33.9 Å²	33.9	8%	0.082	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.9	16.6	176.6	0	0	0	0	0	115.3	M162 V163 Q164 C168	M162-G166 PolarHBondContact O-N 2.71Å; V163-G166 PolarHBondContact O-N 2.96Å; Q164-G166 PolarHBondContact O-N 3.38Å; G166-C168 VanDerWaalsContact C-N 3.32Å; G166-C168 PolarHBondContact O-N 3.44Å
167	G	66.9	Low	80.4	Confident	2 Å²	2	32.8 Å²	32.8	2%	0.021	17%	0.166	C	C	.	.			trans	-79.3	-4.2	-172.3	0	0	0	0	0	116	M162 S165	M162-G167 PolarHBondContact O-N 3.49Å; S165-G167 VanDerWaalsContact C-N 3.29Å; S165-G167 PolarHBondContact O-N 3.27Å
168	C	73.8	Confident	80.7	Confident	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.147	C	C	.	.			trans	-132.6	147.8	-171.1	58.8	0	0	0	0	114.3	L114 M162 V163 G166 D172 F173	L114-C168 PolarHBondContact N-O 2.82Å; L114-C168 VanDerWaalsContact N-O 3.15Å; M162-C168 HydrophobicContact CE-CB 3.75Å; M162-C168 HydrophobicContact CG-CB 3.87Å; M162-C168 HydrophobicContact SD-CB 3.87Å; V163-C168 WeakPolarHBondContact CG2-SG 3.29Å; G166-C168 VanDerWaalsContact C-N 3.32Å; G166-C168 PolarHBondContact O-N 3.44Å; C168-D172 HydrophobicContact CB-CB 4.45Å; C168-F173 HydrophobicContact CB-CE2 4.19Å
169	S	79	Confident	80.6	Confident	2 Å²	2	31.4 Å²	31.4	1%	0.014	16%	0.155	C	C	.	.	B	Isolated β-bridge	trans	-106.4	170.8	174.6	73	0	0	0	0	112.6	Q111 Q112 N171 D172	Q111-S169 PolarHBondContact OE1-OG 3.19Å; Q112-S169 WeakPolarHBondContact O-CA 3.26Å; S169-N171 PolarHBondContact O-N 3.02Å; S169-N171 PolarHBondContact OG-N 2.96Å; S169-N171 VanDerWaalsContact OG-N 3.15Å; S169-D172 WeakPolarHBondContact CB-OD2 3.26Å; S169-D172 PolarHBondContact N-OD2 3.39Å; S169-D172 PolarHBondContact O-N 3.25Å; S169-D172 PolarHBondContact OG-N 3.37Å; S169-D172 PolarHBondContact OG-OD2 2.86Å
170	A	78	Confident	80.5	Confident	32 Å²	32	33.2 Å²	33.2	26%	0.264	17%	0.165	S	C	.	.	H	α-helix	trans	-54.9	-30.6	167.2	0	0	0	0	0	113.7	R174 Y211	A170-R174 PolarHBondContact O-N 2.97Å; A170-Y211 HydrophobicContact CB-CE1 4.45Å; A170-Y211 HydrophobicContact CB-CE2 4.29Å; A170-Y211 WeakPolarHBondContact CB-OH 3.41Å
171	N	80.5	Confident	80.6	Confident	57 Å²	57	32.4 Å²	32.4	31%	0.305	16%	0.158	S	C	.	.	H	α-helix	trans	-79.4	-31.9	-177.7	-168.4	79.4	0	0	0	112.3	Q111 S169 F173 R174 E175	Q111-N171 VanDerWaalsContact OE1-CB 3.24Å; S169-N171 PolarHBondContact O-N 3.02Å; S169-N171 PolarHBondContact OG-N 2.96Å; S169-N171 VanDerWaalsContact OG-N 3.15Å; N171-F173 VanDerWaalsContact C-N 3.31Å; N171-F173 PolarHBondContact O-N 2.9Å; N171-R174 WeakPolarHBondContact O-CB 3.42Å; N171-R174 PolarHBondContact O-N 3.21Å; N171-E175 WeakPolarHBondContact O-CG 3.44Å; N171-E175 PolarHBondContact O-N 3.27Å
172	D	81.7	Confident	80.7	Confident	24 Å²	24	29 Å²	29	13%	0.128	15%	0.148	C	C	.	.	H	α-helix	trans	-62	-42.2	174.8	-64.7	-70.5	0	0	0	111	C168 S169 E175 V176 R770	C168-D172 HydrophobicContact CB-CB 4.45Å; S169-D172 WeakPolarHBondContact CB-OD2 3.26Å; S169-D172 PolarHBondContact N-OD2 3.39Å; S169-D172 PolarHBondContact O-N 3.25Å; S169-D172 PolarHBondContact OG-N 3.37Å; S169-D172 PolarHBondContact OG-OD2 2.86Å; D172-E175 PolarHBondContact O-N 3.42Å; D172-V176 VanDerWaalsContact O-CG2 3.3Å; D172-V176 WeakPolarHBondContact O-CG2 3.48Å; D172-V176 PolarHBondContact O-N 3.36Å; D172-R770 HydrophobicContact CB-CG 4.45Å; D172-R770 WeakPolarHBondContact OD1-CD 3.08Å; D172-R770 IonicContact OD1-NH1 3.22Å
173	F	86.8	Confident	80.1	Confident	0 Å²	0	32 Å²	32	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-60.2	-47	174.4	-82.8	-128.5	0	0	0	111	L114 L119 L122 Y149 F153 L154 V159 M162 V163 C168 N171 V176 F177	L114-F173 HydrophobicContact CD1-CD1 4.07Å; L114-F173 HydrophobicContact CD1-CD2 3.47Å; L114-F173 VanDerWaalsContact CD1-CD2 3.47Å; L114-F173 HydrophobicContact CD1-CE1 4.04Å; L114-F173 HydrophobicContact CD1-CE2 3.44Å; L114-F173 VanDerWaalsContact CD1-CE2 3.44Å; L114-F173 HydrophobicContact CD1-CG 3.81Å; L114-F173 HydrophobicContact CD1-CZ 3.73Å; L119-F173 HydrophobicContact CD1-CE1 3.76Å; L119-F173 HydrophobicContact CD1-CZ 3.95Å; L122-F173 HydrophobicContact CD2-CD1 3.58Å; L122-F173 HydrophobicContact CD2-CE1 3.89Å; Y149-F173 WeakPolarHBondContact OH-CB 3.5Å; Y149-F173 PolarHBondContact OH-O 2.93Å; F153-F173 HydrophobicContact CE1-CB 4.39Å; F153-F173 AromaticContact CE1-CD1 3.66Å; F153-F173 HydrophobicContact CE1-CD1 3.66Å; F153-F173 HydrophobicContact CE1-CD2 4.14Å; F153-F173 AromaticContact CE1-CE1 3.86Å; F153-F173 HydrophobicContact CE1-CE1 3.86Å; F153-F173 HydrophobicContact CE1-CE2 4.3Å; F153-F173 AromaticContact CE1-CG 3.8Å; F153-F173 HydrophobicContact CE1-CG 3.8Å; F153-F173 HydrophobicContact CE1-CZ 4.17Å; F153-F173 HydrophobicContact CZ-CD1 4.41Å; F153-F173 HydrophobicContact CZ-CD2 4.09Å; F153-F173 HydrophobicContact CZ-CE2 4.2Å; F153-F173 HydrophobicContact CZ-CG 4.19Å; F153-F173 HydrophobicContact CZ-CZ 4.42Å; L154-F173 HydrophobicContact CD2-CD1 3.77Å; L154-F173 HydrophobicContact CD2-CE1 3.68Å; V159-F173 HydrophobicContact CG1-CE1 4.04Å; V159-F173 HydrophobicContact CG1-CE2 4Å; V159-F173 HydrophobicContact CG1-CZ 3.36Å; M162-F173 HydrophobicContact CE-CE2 4.37Å; V163-F173 HydrophobicContact CG2-CE2 4.23Å; V163-F173 HydrophobicContact CG2-CZ 3.84Å; C168-F173 HydrophobicContact CB-CE2 4.19Å; N171-F173 VanDerWaalsContact C-N 3.31Å; N171-F173 PolarHBondContact O-N 2.9Å; F173-V176 PolarHBondContact O-N 3.47Å; F173-F177 PolarHBondContact O-N 3.21Å
174	R	86.3	Confident	79.9	Confident	67 Å²	67	35.9 Å²	35.9	25%	0.253	17%	0.174	S	C	.	.	H	α-helix	trans	-60.9	-44.5	178	-173	-178.5	-172	-89	9.4	113	A170 N171 F177 K178 I204 Y207 D208	A170-R174 PolarHBondContact O-N 2.97Å; N171-R174 WeakPolarHBondContact O-CB 3.42Å; N171-R174 PolarHBondContact O-N 3.21Å; R174-F177 PolarHBondContact O-N 3.48Å; R174-K178 WeakPolarHBondContact O-CB 3.37Å; R174-K178 PolarHBondContact O-N 2.99Å; R174-I204 VanDerWaalsContact CZ-CG2 3.43Å; R174-Y207 HydrophobicContact CB-CD1 4.45Å; R174-Y207 HydrophobicContact CB-CE1 3.71Å; R174-Y207 HydrophobicContact CG-CD1 4Å; R174-Y207 HydrophobicContact CG-CE1 3.74Å; R174-Y207 PolarHBondContact N-OH 3.18Å; R174-D208 WeakPolarHBondContact CD-OD1 3.25Å; R174-D208 IonicContact CZ-OD1 2.75Å; R174-D208 IonicContact CZ-OD2 2.58Å; R174-D208 IonicContact NE-OD1 3.18Å; R174-D208 PolarHBondContact NE-OD1 3.42Å; R174-D208 IonicContact NE-OD2 3.23Å; R174-D208 PolarHBondContact NE-OD2 2.99Å; R174-D208 VanDerWaalsContact NE-OD2 3.17Å; R174-D208 IonicContact NH2-OD1 3.85Å; R174-D208 IonicContact NH2-OD2 2.76Å; R174-D208 PolarHBondContact NH2-OD2 2.92Å
175	E	84.9	Confident	80	Confident	35 Å²	35	30.2 Å²	30.2	16%	0.164	15%	0.148	C	C	.	.	H	α-helix	trans	-77.5	-21.3	179.7	-64.6	-64.5	117.1	0	0	112.7	N171 D172 K178 K179	N171-E175 WeakPolarHBondContact O-CG 3.44Å; N171-E175 PolarHBondContact O-N 3.27Å; D172-E175 PolarHBondContact O-N 3.42Å; E175-K178 IonicContact OE1-NZ 2.97Å; E175-K178 VanDerWaalsContact OE2-CD 3.29Å; E175-K178 WeakPolarHBondContact OE2-CD 3.45Å; E175-K178 IonicContact OE2-NZ 3.18Å; E175-K178 PolarHBondContact OE2-NZ 2.97Å; E175-K179 PolarHBondContact O-N 3.18Å; E175-K179 VanDerWaalsContact O-N 3.11Å
176	V	84.9	Confident	80.1	Confident	9 Å²	9	35.3 Å²	35.3	6%	0.055	16%	0.163	C	C	.	.	H	α-helix	trans	-72.2	-44.2	165.6	172.9	0	0	0	0	111.1	Y149 F153 D172 F173 K178 K179 N180 F768 R770	Y149-V176 HydrophobicContact CE2-CG1 4.34Å; F153-V176 HydrophobicContact CD2-CG1 3.63Å; F153-V176 HydrophobicContact CE2-CB 4.12Å; F153-V176 HydrophobicContact CE2-CG1 3.7Å; F153-V176 HydrophobicContact CE2-CG2 4.08Å; F153-V176 HydrophobicContact CG-CG1 4.1Å; F153-V176 HydrophobicContact CZ-CB 4.25Å; F153-V176 HydrophobicContact CZ-CG1 4.22Å; F153-V176 HydrophobicContact CZ-CG2 4.35Å; D172-V176 VanDerWaalsContact O-CG2 3.3Å; D172-V176 WeakPolarHBondContact O-CG2 3.48Å; D172-V176 PolarHBondContact O-N 3.36Å; F173-V176 PolarHBondContact O-N 3.47Å; V176-K178 VanDerWaalsContact C-N 3.29Å; V176-K178 PolarHBondContact O-N 3.38Å; V176-K179 PolarHBondContact O-N 2.84Å; V176-N180 PolarHBondContact O-N 2.83Å; V176-N180 VanDerWaalsContact O-N 3.12Å; V176-F768 HydrophobicContact CG1-CB 4.38Å; V176-F768 HydrophobicContact CG2-CB 4.23Å; V176-R770 HydrophobicContact CG2-CG 3.88Å
177	F	87.8	Confident	80.1	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-56.9	-46.4	172.8	179.8	-105.6	0	0	0	111	F142 V146 Y149 F173 R174 K179 N180 I181 I204 Y207	F142-F177 HydrophobicContact CD2-CZ 4.46Å; F142-F177 HydrophobicContact CE2-CE1 4.18Å; F142-F177 AromaticContact CE2-CZ 3.74Å; F142-F177 HydrophobicContact CE2-CZ 3.74Å; F142-F177 HydrophobicContact CZ-CZ 4.4Å; V146-F177 HydrophobicContact CG2-CE2 4.05Å; V146-F177 HydrophobicContact CG2-CZ 4.07Å; Y149-F177 AromaticContact CD1-CD2 3.83Å; Y149-F177 HydrophobicContact CD1-CD2 3.83Å; Y149-F177 HydrophobicContact CD2-CB 4.03Å; Y149-F177 AromaticContact CD2-CD2 3.88Å; Y149-F177 HydrophobicContact CD2-CD2 3.88Å; Y149-F177 HydrophobicContact CD2-CG 4.47Å; Y149-F177 HydrophobicContact CE1-CB 4.46Å; Y149-F177 HydrophobicContact CE1-CD2 4.31Å; Y149-F177 HydrophobicContact CE2-CB 3.76Å; Y149-F177 HydrophobicContact CE2-CD2 4.37Å; Y149-F177 HydrophobicContact CG-CB 4.49Å; Y149-F177 AromaticContact CG-CD2 3.58Å; Y149-F177 HydrophobicContact CG-CD2 3.58Å; Y149-F177 HydrophobicContact CG-CE2 4.35Å; F173-F177 PolarHBondContact O-N 3.21Å; R174-F177 PolarHBondContact O-N 3.48Å; F177-K179 PolarHBondContact O-N 2.86Å; F177-N180 WeakPolarHBondContact O-CB 3.47Å; F177-N180 PolarHBondContact O-N 3.04Å; F177-I181 HydrophobicContact CD1-CD1 4.29Å; F177-I181 HydrophobicContact CE1-CD1 3.89Å; F177-I181 HydrophobicContact CE1-CG1 4.47Å; F177-I181 HydrophobicContact CE1-CG2 3.96Å; F177-I181 HydrophobicContact CE2-CG2 3.98Å; F177-I181 HydrophobicContact CZ-CG2 3.67Å; F177-I181 WeakPolarHBondContact O-CG1 3.49Å; F177-I181 PolarHBondContact O-N 3Å; F177-I204 HydrophobicContact CD1-CD1 4.03Å; F177-I204 HydrophobicContact CE1-CD1 4.49Å; F177-Y207 HydrophobicContact CB-CD2 3.77Å; F177-Y207 HydrophobicContact CB-CE2 3.7Å; F177-Y207 AromaticContact CD1-CD2 3.35Å; F177-Y207 HydrophobicContact CD1-CD2 3.35Å; F177-Y207 HydrophobicContact CD1-CE2 4.19Å; F177-Y207 AromaticContact CD1-CG 3.66Å; F177-Y207 HydrophobicContact CD1-CG 3.66Å; F177-Y207 AromaticContact CD2-CD2 3.97Å; F177-Y207 HydrophobicContact CD2-CD2 3.97Å; F177-Y207 HydrophobicContact CD2-CE2 4.42Å; F177-Y207 AromaticContact CE1-CD2 3.9Å; F177-Y207 HydrophobicContact CE1-CD2 3.9Å; F177-Y207 HydrophobicContact CE1-CG 4.07Å; F177-Y207 HydrophobicContact CE2-CD2 4.44Å; F177-Y207 AromaticContact CG-CD2 3.39Å; F177-Y207 HydrophobicContact CG-CD2 3.39Å; F177-Y207 AromaticContact CG-CE2 3.85Å; F177-Y207 HydrophobicContact CG-CE2 3.85Å; F177-Y207 HydrophobicContact CG-CG 4.17Å; F177-Y207 HydrophobicContact CZ-CD2 4.4Å
178	K	87.1	Confident	80.4	Confident	57 Å²	57	42 Å²	42	25%	0.248	20%	0.203	C	C	.	.	H	α-helix	trans	-54.1	-49.3	174.9	-174	-177.6	152.9	-161.7	0	113	R174 E175 V176 N180 I181 E182 I204	R174-K178 WeakPolarHBondContact O-CB 3.37Å; R174-K178 PolarHBondContact O-N 2.99Å; E175-K178 IonicContact OE1-NZ 2.97Å; E175-K178 VanDerWaalsContact OE2-CD 3.29Å; E175-K178 WeakPolarHBondContact OE2-CD 3.45Å; E175-K178 IonicContact OE2-NZ 3.18Å; E175-K178 PolarHBondContact OE2-NZ 2.97Å; V176-K178 VanDerWaalsContact C-N 3.29Å; V176-K178 PolarHBondContact O-N 3.38Å; K178-N180 VanDerWaalsContact C-N 3.35Å; K178-N180 PolarHBondContact O-N 2.78Å; K178-I181 VanDerWaalsContact O-CG1 3.22Å; K178-I181 WeakPolarHBondContact O-CG1 3.4Å; K178-I181 PolarHBondContact O-N 2.98Å; K178-E182 VanDerWaalsContact CE-OE1 3.24Å; K178-E182 WeakPolarHBondContact CE-OE1 3.4Å; K178-E182 HydrophobicContact CG-CG 4.48Å; K178-E182 WeakPolarHBondContact O-CG 3.17Å; K178-E182 PolarHBondContact O-N 3.09Å; K178-I204 HydrophobicContact CB-CD1 3.72Å; K178-I204 HydrophobicContact CG-CD1 4.04Å
179	K	80.6	Confident	80.4	Confident	62 Å²	62	46.8 Å²	46.8	27%	0.27	24%	0.235	S	C	.	.	H	α-helix	trans	-58	-44.2	176.3	-84.4	-172	169.1	-169.5	0	112.6	E175 V176 F177 I181 E182 E870	E175-K179 PolarHBondContact O-N 3.18Å; E175-K179 VanDerWaalsContact O-N 3.11Å; V176-K179 PolarHBondContact O-N 2.84Å; F177-K179 PolarHBondContact O-N 2.86Å; K179-I181 PolarHBondContact O-N 3.2Å; K179-E182 PolarHBondContact O-N 3.02Å; K179-E870 IonicContact NZ-OE1 2.77Å; K179-E870 PolarHBondContact NZ-OE1 2.85Å
180	N	82.8	Confident	79.8	Confident	37 Å²	37	55 Å²	55	20%	0.198	27%	0.273	C	S	.	.	H	α-helix	trans	-60.3	-45.1	177.7	-174.1	-31.4	0	0	0	111.2	V176 F177 K178 R184	V176-N180 PolarHBondContact O-N 2.83Å; V176-N180 VanDerWaalsContact O-N 3.12Å; F177-N180 WeakPolarHBondContact O-CB 3.47Å; F177-N180 PolarHBondContact O-N 3.04Å; K178-N180 VanDerWaalsContact C-N 3.35Å; K178-N180 PolarHBondContact O-N 2.78Å; N180-R184 PolarHBondContact OD1-NE 3.45Å
181	I	86.3	Confident	79.4	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-75.6	-27.9	179.1	63.2	166.7	0	0	0	114.2	A145 F177 K178 K179 K183 R184 V185 L200 W203 I204	A145-I181 HydrophobicContact CB-CG2 3.89Å; F177-I181 HydrophobicContact CD1-CD1 4.29Å; F177-I181 HydrophobicContact CE1-CD1 3.89Å; F177-I181 HydrophobicContact CE1-CG1 4.47Å; F177-I181 HydrophobicContact CE1-CG2 3.96Å; F177-I181 HydrophobicContact CE2-CG2 3.98Å; F177-I181 HydrophobicContact CZ-CG2 3.67Å; F177-I181 WeakPolarHBondContact O-CG1 3.49Å; F177-I181 PolarHBondContact O-N 3Å; K178-I181 VanDerWaalsContact O-CG1 3.22Å; K178-I181 WeakPolarHBondContact O-CG1 3.4Å; K178-I181 PolarHBondContact O-N 2.98Å; K179-I181 PolarHBondContact O-N 3.2Å; I181-K183 VanDerWaalsContact C-N 3.35Å; I181-K183 PolarHBondContact O-N 3.15Å; I181-R184 PolarHBondContact O-N 3.25Å; I181-V185 WeakPolarHBondContact O-CB 3.33Å; I181-V185 VanDerWaalsContact O-CG2 3.31Å; I181-V185 WeakPolarHBondContact O-CG2 3.39Å; I181-V185 PolarHBondContact O-N 3.13Å; I181-L200 HydrophobicContact CD1-CD1 3.64Å; I181-L200 HydrophobicContact CG1-CD1 3.65Å; I181-W203 HydrophobicContact CB-CE3 3.72Å; I181-W203 HydrophobicContact CB-CZ3 4.04Å; I181-W203 HydrophobicContact CD1-CB 3.76Å; I181-W203 HydrophobicContact CD1-CE3 4.16Å; I181-W203 HydrophobicContact CG2-CE3 3.67Å; I181-W203 HydrophobicContact CG2-CZ3 3.97Å; I181-I204 HydrophobicContact CD1-CD1 3.91Å; I181-I204 HydrophobicContact CD1-CG1 4.01Å
182	E	82.3	Confident	78.4	Confident	51 Å²	51	63.8 Å²	63.8	24%	0.238	31%	0.314	C	S	.	.	H	α-helix	trans	-57.7	-44.9	179.2	-88.3	-171.3	-142.8	0	0	112.2	K178 K179 R186 L200	K178-E182 VanDerWaalsContact CE-OE1 3.24Å; K178-E182 WeakPolarHBondContact CE-OE1 3.4Å; K178-E182 HydrophobicContact CG-CG 4.48Å; K178-E182 WeakPolarHBondContact O-CG 3.17Å; K178-E182 PolarHBondContact O-N 3.09Å; K179-E182 PolarHBondContact O-N 3.02Å; E182-R186 VanDerWaalsContact O-CG 3.24Å; E182-R186 WeakPolarHBondContact O-CG 3.1Å; E182-R186 PolarHBondContact O-N 3.01Å; E182-R186 IonicContact OE2-CZ 3.82Å; E182-R186 IonicContact OE2-NH2 3.85Å; E182-R186 PolarHBondContact OE2-NH2 3.27Å; E182-L200 HydrophobicContact CB-CD1 4.47Å; E182-L200 HydrophobicContact CG-CD1 3.67Å; E182-L200 HydrophobicContact CG-CD2 3.91Å; E182-L200 HydrophobicContact CG-CG 4.47Å
183	K	69.5	Low	77.7	Confident	70 Å²	70	66.9 Å²	66.9	30%	0.304	35%	0.352	S	S	.	.	H	α-helix	trans	-66.2	-46	176.6	-72.5	-170.6	176.7	-167.5	0	111.9	I181 V185 R186 S187 E863 E867	I181-K183 VanDerWaalsContact C-N 3.35Å; I181-K183 PolarHBondContact O-N 3.15Å; K183-V185 VanDerWaalsContact C-N 3.33Å; K183-V185 PolarHBondContact O-N 3.33Å; K183-R186 WeakPolarHBondContact O-CB 3.34Å; K183-R186 PolarHBondContact O-N 2.84Å; K183-R186 VanDerWaalsContact O-N 3.16Å; K183-S187 PolarHBondContact O-N 3.45Å; K183-S187 PolarHBondContact O-OG 2.99Å; K183-E863 WeakPolarHBondContact CD-OE1 3.46Å; K183-E863 VanDerWaalsContact CE-OE1 3.28Å; K183-E863 WeakPolarHBondContact CE-OE1 3.43Å; K183-E863 IonicContact NZ-OE1 2.73Å; K183-E863 PolarHBondContact NZ-OE1 2.89Å; K183-E867 WeakPolarHBondContact CE-OE2 3.45Å; K183-E867 IonicContact NZ-OE2 2.87Å; K183-E867 PolarHBondContact NZ-OE2 3.4Å
184	R	78.2	Confident	77.2	Confident	84 Å²	84	71.2 Å²	71.2	32%	0.317	38%	0.375	S	S	.	.	H	α-helix	trans	-55.7	-46.6	177.1	-65	176.2	-174.7	-96.7	-13.6	111.8	S148 N180 I181 S187 L188	S148-R184 PolarHBondContact OG-NH2 3.23Å; N180-R184 PolarHBondContact OD1-NE 3.45Å; I181-R184 PolarHBondContact O-N 3.25Å; R184-S187 WeakPolarHBondContact CA-OG 3.24Å; R184-S187 PolarHBondContact O-N 3.02Å; R184-S187 PolarHBondContact O-OG 3.41Å; R184-L188 PolarHBondContact O-N 3.36Å; R184-L188 VanDerWaalsContact O-N 3.13Å
185	V	80.9	Confident	77	Confident	5 Å²	5	70.8 Å²	70.8	3%	0.03	38%	0.382	C	S	.	.	H	α-helix	trans	-71	-30.8	180	175.3	0	0	0	0	112.3	I181 K183 L188 K196 V199 W203	I181-V185 WeakPolarHBondContact O-CB 3.33Å; I181-V185 VanDerWaalsContact O-CG2 3.31Å; I181-V185 WeakPolarHBondContact O-CG2 3.39Å; I181-V185 PolarHBondContact O-N 3.13Å; K183-V185 VanDerWaalsContact C-N 3.33Å; K183-V185 PolarHBondContact O-N 3.33Å; V185-L188 HydrophobicContact CG2-CD1 4.44Å; V185-L188 PolarHBondContact O-N 3.01Å; V185-K196 HydrophobicContact CG1-CB 3.94Å; V185-K196 HydrophobicContact CG1-CG 4.23Å; V185-K196 WeakPolarHBondContact CG1-O 3.35Å; V185-K196 WeakPolarHBondContact O-CD 3.42Å; V185-K196 WeakPolarHBondContact O-CE 3.48Å; V185-V199 HydrophobicContact CG1-CB 4.16Å; V185-V199 HydrophobicContact CG1-CG1 4.11Å; V185-V199 HydrophobicContact CG2-CG1 4.02Å; V185-W203 HydrophobicContact CG2-CD2 4.37Å; V185-W203 HydrophobicContact CG2-CE3 3.81Å; V185-W203 HydrophobicContact CG2-CH2 4.13Å; V185-W203 HydrophobicContact CG2-CZ3 3.67Å
186	R	74.6	Confident	76.8	Confident	139 Å²	139	72.6 Å²	72.6	53%	0.525	39%	0.389	S	S	.	.	H	α-helix	trans	-61.9	-44.1	169.1	-71.6	170.4	-154.1	175.6	9	111.2	E182 K183 L188 K196	E182-R186 VanDerWaalsContact O-CG 3.24Å; E182-R186 WeakPolarHBondContact O-CG 3.1Å; E182-R186 PolarHBondContact O-N 3.01Å; E182-R186 IonicContact OE2-CZ 3.82Å; E182-R186 IonicContact OE2-NH2 3.85Å; E182-R186 PolarHBondContact OE2-NH2 3.27Å; K183-R186 WeakPolarHBondContact O-CB 3.34Å; K183-R186 PolarHBondContact O-N 2.84Å; K183-R186 VanDerWaalsContact O-N 3.16Å; R186-L188 VanDerWaalsContact C-N 3.35Å; R186-L188 PolarHBondContact O-N 2.74Å; R186-K196 PolarHBondContact O-NZ 2.96Å
187	S	70	Confident	76.8	Confident	97 Å²	97	79.5 Å²	79.5	68%	0.678	42%	0.421	S	S	*	.	H	α-helix	trans	-75.2	-10.7	179.5	52.6	0	0	0	0	115.8	K183 R184	K183-S187 PolarHBondContact O-N 3.45Å; K183-S187 PolarHBondContact O-OG 2.99Å; R184-S187 WeakPolarHBondContact CA-OG 3.24Å; R184-S187 PolarHBondContact O-N 3.02Å; R184-S187 PolarHBondContact O-OG 3.41Å
188	L	73.4	Confident	76.6	Confident	53 Å²	53	82.9 Å²	82.9	28%	0.277	44%	0.442	S	S	.	.	S	Bend	trans	-65.8	145.3	174.1	-73.7	176.2	0	0	0	111.2	R184 V185 R186 K196 W203	R184-L188 PolarHBondContact O-N 3.36Å; R184-L188 VanDerWaalsContact O-N 3.13Å; V185-L188 HydrophobicContact CG2-CD1 4.44Å; V185-L188 PolarHBondContact O-N 3.01Å; R186-L188 VanDerWaalsContact C-N 3.35Å; R186-L188 PolarHBondContact O-N 2.74Å; L188-K196 VanDerWaalsContact O-CE 3.28Å; L188-K196 WeakPolarHBondContact O-CE 3.43Å; L188-K196 PolarHBondContact O-NZ 3.26Å; L188-W203 HydrophobicContact CD1-CH2 4.44Å
189	P	73	Confident	76.5	Confident	102 Å²	102	81.4 Å²	81.4	66%	0.662	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-52.9	153.1	165.8	-24.2	34.3	0	0	0	111.6
190	E	65.5	Low	76.8	Confident	173 Å²	173	79.9 Å²	79.9	81%	0.808	43%	0.432	S	S	*	.	P	Polyproline II helix	trans	-75.7	128.4	174	-55.9	-159.9	145.4	0	0	109.5
191	I	71.5	Confident	77	Confident	102 Å²	102	81.9 Å²	81.9	52%	0.523	45%	0.449	S	S	.	.	B	Isolated β-bridge	trans	-107.4	122.6	-177.6	-60.5	172.2	0	0	0	107.3	G193 L194	I191-G193 PolarHBondContact O-N 3.04Å; I191-G193 VanDerWaalsContact O-N 3.17Å; I191-L194 HydrophobicContact CB-CB 4.41Å; I191-L194 HydrophobicContact CG2-CB 4.4Å; I191-L194 PolarHBondContact O-N 3.07Å
192	D	58.6	Low	77.1	Confident	172 Å²	172	84.4 Å²	84.4	92%	0.92	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.7	121.6	-178.3	-85	-44	0	0	0	111.9
193	G	66.9	Low	77.5	Confident	90 Å²	90	82.3 Å²	82.3	93%	0.928	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.3	-1.9	178.4	0	0	0	0	0	116.7	I191	I191-G193 PolarHBondContact O-N 3.04Å; I191-G193 VanDerWaalsContact O-N 3.17Å
194	L	76.2	Confident	78.5	Confident	90 Å²	90	79.7 Å²	79.7	47%	0.471	45%	0.446	S	S	.	.	B	Isolated β-bridge	trans	-119.9	110.8	-178.8	-100.9	163.7	0	0	0	112.5	I191 T198 V199	I191-L194 HydrophobicContact CB-CB 4.41Å; I191-L194 HydrophobicContact CG2-CB 4.4Å; I191-L194 PolarHBondContact O-N 3.07Å; L194-T198 HydrophobicContact CD2-CG2 3.9Å; L194-V199 HydrophobicContact CD2-CG2 4.34Å
195	S	81.9	Confident	78.9	Confident	59 Å²	59	78.4 Å²	78.4	41%	0.413	45%	0.453	S	S	.	.			trans	-73.5	144.8	177	78.3	0	0	0	0	112	E197 T198 V199	S195-E197 PolarHBondContact O-N 3.25Å; S195-T198 WeakPolarHBondContact O-CA 3.29Å; S195-T198 WeakPolarHBondContact O-CB 3.3Å; S195-T198 PolarHBondContact O-N 2.94Å; S195-T198 PolarHBondContact OG-N 2.92Å; S195-T198 PolarHBondContact OG-OG1 3.34Å; S195-V199 PolarHBondContact O-N 3.31Å; S195-V199 VanDerWaalsContact O-N 3.09Å
196	K	81.9	Confident	79.3	Confident	72 Å²	72	79.8 Å²	79.8	31%	0.313	46%	0.459	S	S	.	.	H	α-helix	trans	-58	-31.3	177.9	-72.9	-179.8	171.9	-179.8	0	112.6	V185 R186 L188 L200	V185-K196 HydrophobicContact CG1-CB 3.94Å; V185-K196 HydrophobicContact CG1-CG 4.23Å; V185-K196 WeakPolarHBondContact CG1-O 3.35Å; V185-K196 WeakPolarHBondContact O-CD 3.42Å; V185-K196 WeakPolarHBondContact O-CE 3.48Å; R186-K196 PolarHBondContact O-NZ 2.96Å; L188-K196 VanDerWaalsContact O-CE 3.28Å; L188-K196 WeakPolarHBondContact O-CE 3.43Å; L188-K196 PolarHBondContact O-NZ 3.26Å; K196-L200 WeakPolarHBondContact O-CB 2.98Å; K196-L200 PolarHBondContact O-N 2.89Å
197	E	83.1	Confident	80.1	Confident	154 Å²	154	73.3 Å²	73.3	72%	0.72	43%	0.434	S	S	*	.	H	α-helix	trans	-68.1	-34	171.8	-62.3	-175.1	160.7	0	0	113.5	S195 S201	S195-E197 PolarHBondContact O-N 3.25Å; E197-S201 WeakPolarHBondContact O-CB 3.11Å; E197-S201 PolarHBondContact O-N 3.43Å; E197-S201 PolarHBondContact O-OG 2.85Å
198	T	84.9	Confident	80.9	Confident	72 Å²	72	70.3 Å²	70.3	44%	0.442	41%	0.411	S	S	.	.	H	α-helix	trans	-69.9	-41.7	175.8	-56	0	0	0	0	110.7	L194 S195 S201 S202	L194-T198 HydrophobicContact CD2-CG2 3.9Å; S195-T198 WeakPolarHBondContact O-CA 3.29Å; S195-T198 WeakPolarHBondContact O-CB 3.3Å; S195-T198 PolarHBondContact O-N 2.94Å; S195-T198 PolarHBondContact OG-N 2.92Å; S195-T198 PolarHBondContact OG-OG1 3.34Å; T198-S201 PolarHBondContact O-N 2.69Å; T198-S202 VanDerWaalsContact O-CB 3.32Å; T198-S202 WeakPolarHBondContact O-CB 3.21Å; T198-S202 PolarHBondContact O-N 2.69Å
199	V	84.6	Confident	81.5	Confident	25 Å²	25	69.3 Å²	69.3	15%	0.152	41%	0.41	C	S	.	.	H	α-helix	trans	-60.6	-49.5	173.5	178.3	0	0	0	0	110.4	V185 L194 S195 S201 S202 W203	V185-V199 HydrophobicContact CG1-CB 4.16Å; V185-V199 HydrophobicContact CG1-CG1 4.11Å; V185-V199 HydrophobicContact CG2-CG1 4.02Å; L194-V199 HydrophobicContact CD2-CG2 4.34Å; S195-V199 PolarHBondContact O-N 3.31Å; S195-V199 VanDerWaalsContact O-N 3.09Å; V199-S201 VanDerWaalsContact C-N 3.35Å; V199-S201 PolarHBondContact O-N 2.78Å; V199-S202 WeakPolarHBondContact O-CB 3.38Å; V199-S202 PolarHBondContact O-N 2.99Å; V199-W203 HydrophobicContact CG1-CD2 4.36Å; V199-W203 HydrophobicContact CG1-CZ2 4.43Å; V199-W203 PolarHBondContact O-N 3.02Å
200	L	86.5	Confident	82.2	Confident	31 Å²	31	64.6 Å²	64.6	16%	0.162	38%	0.38	C	S	.	.	H	α-helix	trans	-55.5	-48.4	176.1	-172.4	73.7	0	0	0	111.8	I181 E182 K196 S202 W203 I204	I181-L200 HydrophobicContact CD1-CD1 3.64Å; I181-L200 HydrophobicContact CG1-CD1 3.65Å; E182-L200 HydrophobicContact CB-CD1 4.47Å; E182-L200 HydrophobicContact CG-CD1 3.67Å; E182-L200 HydrophobicContact CG-CD2 3.91Å; E182-L200 HydrophobicContact CG-CG 4.47Å; K196-L200 WeakPolarHBondContact O-CB 2.98Å; K196-L200 PolarHBondContact O-N 2.89Å; L200-S202 PolarHBondContact O-N 3.49Å; L200-W203 PolarHBondContact O-N 3.14Å; L200-I204 VanDerWaalsContact O-CG1 3.3Å; L200-I204 WeakPolarHBondContact O-CG1 3.48Å; L200-I204 PolarHBondContact O-N 3.44Å
201	S	87.4	Confident	83.1	Confident	78 Å²	78	59.4 Å²	59.4	55%	0.545	35%	0.353	S	S	.	.	H	α-helix	trans	-64.3	-38.8	179.8	-58.8	0	0	0	0	112.6	E197 T198 V199 I204 A205	E197-S201 WeakPolarHBondContact O-CB 3.11Å; E197-S201 PolarHBondContact O-N 3.43Å; E197-S201 PolarHBondContact O-OG 2.85Å; T198-S201 PolarHBondContact O-N 2.69Å; V199-S201 VanDerWaalsContact C-N 3.35Å; V199-S201 PolarHBondContact O-N 2.78Å; S201-I204 PolarHBondContact O-N 3.01Å; S201-A205 PolarHBondContact O-N 3.38Å
202	S	88.4	Confident	83.6	Confident	54 Å²	54	60.9 Å²	60.9	38%	0.378	35%	0.352	S	S	.	.	H	α-helix	trans	-63.8	-47.8	175.1	179.1	0	0	0	0	111.8	T198 V199 L200 I204 A205 K206	T198-S202 VanDerWaalsContact O-CB 3.32Å; T198-S202 WeakPolarHBondContact O-CB 3.21Å; T198-S202 PolarHBondContact O-N 2.69Å; V199-S202 WeakPolarHBondContact O-CB 3.38Å; V199-S202 PolarHBondContact O-N 2.99Å; L200-S202 PolarHBondContact O-N 3.49Å; S202-I204 VanDerWaalsContact C-N 3.32Å; S202-I204 PolarHBondContact O-N 2.99Å; S202-A205 WeakPolarHBondContact O-CB 3.32Å; S202-A205 PolarHBondContact O-N 2.73Å; S202-A205 VanDerWaalsContact O-N 3.13Å; S202-K206 WeakPolarHBondContact O-CG 3.36Å; S202-K206 PolarHBondContact O-N 2.73Å
203	W	90.5	Very high	84.2	Confident	7 Å²	7	53.7 Å²	53.7	3%	0.027	32%	0.318	C	S	.	.	H	α-helix	trans	-63.6	-36.3	177.4	-74.9	13.2	0	0	0	112.5	D139 A141 F142 A145 I181 V185 L188 V199 L200 K206 Y207	D139-W203 WeakPolarHBondContact OD1-CZ2 3.09Å; D139-W203 PolarHBondContact OD1-NE1 2.72Å; D139-W203 PolarHBondContact OD2-NE1 3.22Å; A141-W203 HydrophobicContact CB-CH2 3.84Å; A141-W203 HydrophobicContact CB-CZ2 3.77Å; F142-W203 HydrophobicContact CB-CD2 4.24Å; F142-W203 HydrophobicContact CB-CZ2 4.06Å; F142-W203 HydrophobicContact CD2-CB 3.76Å; F142-W203 AromaticContact CD2-CD1 3.77Å; F142-W203 AromaticContact CD2-CD2 3.65Å; F142-W203 HydrophobicContact CD2-CD2 3.65Å; F142-W203 HydrophobicContact CD2-CE3 4.13Å; F142-W203 AromaticContact CD2-CG 3.47Å; F142-W203 HydrophobicContact CD2-CG 3.47Å; F142-W203 VanDerWaalsContact CD2-CG 3.47Å; F142-W203 HydrophobicContact CE2-CB 3.85Å; F142-W203 HydrophobicContact CE2-CG 4.08Å; F142-W203 WeakPolarHBondContact CE2-O 3.34Å; F142-W203 HydrophobicContact CG-CD2 4.42Å; F142-W203 HydrophobicContact CG-CG 4.35Å; A145-W203 HydrophobicContact CB-CZ3 4.1Å; I181-W203 HydrophobicContact CB-CE3 3.72Å; I181-W203 HydrophobicContact CB-CZ3 4.04Å; I181-W203 HydrophobicContact CD1-CB 3.76Å; I181-W203 HydrophobicContact CD1-CE3 4.16Å; I181-W203 HydrophobicContact CG2-CE3 3.67Å; I181-W203 HydrophobicContact CG2-CZ3 3.97Å; V185-W203 HydrophobicContact CG2-CD2 4.37Å; V185-W203 HydrophobicContact CG2-CE3 3.81Å; V185-W203 HydrophobicContact CG2-CH2 4.13Å; V185-W203 HydrophobicContact CG2-CZ3 3.67Å; L188-W203 HydrophobicContact CD1-CH2 4.44Å; V199-W203 HydrophobicContact CG1-CD2 4.36Å; V199-W203 HydrophobicContact CG1-CZ2 4.43Å; V199-W203 PolarHBondContact O-N 3.02Å; L200-W203 PolarHBondContact O-N 3.14Å; W203-K206 PolarHBondContact O-N 3.39Å; W203-Y207 PolarHBondContact O-N 2.95Å
204	I	90.6	Very high	83.7	Confident	15 Å²	15	53.4 Å²	53.4	8%	0.077	29%	0.293	C	S	.	.	H	α-helix	trans	-66.5	-39.4	171.6	-68.8	-65.6	0	0	0	111.9	R174 F177 K178 I181 L200 S201 S202 K206 Y207 D208	R174-I204 VanDerWaalsContact CZ-CG2 3.43Å; F177-I204 HydrophobicContact CD1-CD1 4.03Å; F177-I204 HydrophobicContact CE1-CD1 4.49Å; K178-I204 HydrophobicContact CB-CD1 3.72Å; K178-I204 HydrophobicContact CG-CD1 4.04Å; I181-I204 HydrophobicContact CD1-CD1 3.91Å; I181-I204 HydrophobicContact CD1-CG1 4.01Å; L200-I204 VanDerWaalsContact O-CG1 3.3Å; L200-I204 WeakPolarHBondContact O-CG1 3.48Å; L200-I204 PolarHBondContact O-N 3.44Å; S201-I204 PolarHBondContact O-N 3.01Å; S202-I204 VanDerWaalsContact C-N 3.32Å; S202-I204 PolarHBondContact O-N 2.99Å; I204-K206 VanDerWaalsContact C-N 3.33Å; I204-K206 PolarHBondContact O-N 3.07Å; I204-Y207 WeakPolarHBondContact O-CB 3.35Å; I204-Y207 PolarHBondContact O-N 2.73Å; I204-D208 WeakPolarHBondContact O-CB 3.48Å; I204-D208 PolarHBondContact O-N 3.01Å
205	A	87.6	Confident	82.3	Confident	56 Å²	56	56.4 Å²	56.4	46%	0.463	30%	0.304	S	S	.	.	H	α-helix	trans	-64.5	-36.5	174.7	0	0	0	0	0	112.5	S201 S202 D208 A209	S201-A205 PolarHBondContact O-N 3.38Å; S202-A205 WeakPolarHBondContact O-CB 3.32Å; S202-A205 PolarHBondContact O-N 2.73Å; S202-A205 VanDerWaalsContact O-N 3.13Å; A205-D208 PolarHBondContact O-N 2.77Å; A205-A209 PolarHBondContact O-N 3.18Å; A205-A209 VanDerWaalsContact O-N 3.12Å
206	K	89.3	Confident	80.5	Confident	35 Å²	35	57.3 Å²	57.3	15%	0.152	31%	0.305	C	S	.	.	H	α-helix	trans	-65	-45.1	171.4	-65.4	-178.8	-167.3	-168.9	0	111.6	I136 V137 D139 F142 S202 W203 I204 D208 A209 I210	I136-K206 HydrophobicContact CG2-CB 4.38Å; I136-K206 HydrophobicContact CG2-CG 4.43Å; V137-K206 VanDerWaalsContact O-CE 3.26Å; V137-K206 WeakPolarHBondContact O-CE 3.36Å; V137-K206 PolarHBondContact O-NZ 3.19Å; D139-K206 IonicContact OD2-NZ 2.76Å; D139-K206 PolarHBondContact OD2-NZ 3.33Å; F142-K206 HydrophobicContact CD1-CD 3.88Å; F142-K206 HydrophobicContact CD2-CD 4.42Å; F142-K206 HydrophobicContact CE1-CB 3.71Å; F142-K206 HydrophobicContact CE1-CD 3.82Å; F142-K206 HydrophobicContact CE1-CG 4.4Å; F142-K206 HydrophobicContact CE2-CB 3.94Å; F142-K206 HydrophobicContact CE2-CD 4.36Å; F142-K206 HydrophobicContact CG-CD 4.2Å; F142-K206 HydrophobicContact CZ-CB 3.33Å; F142-K206 HydrophobicContact CZ-CD 4.07Å; F142-K206 HydrophobicContact CZ-CG 4.34Å; S202-K206 WeakPolarHBondContact O-CG 3.36Å; S202-K206 PolarHBondContact O-N 2.73Å; W203-K206 PolarHBondContact O-N 3.39Å; I204-K206 VanDerWaalsContact C-N 3.33Å; I204-K206 PolarHBondContact O-N 3.07Å; K206-D208 VanDerWaalsContact C-N 3.35Å; K206-D208 PolarHBondContact O-N 2.95Å; K206-A209 WeakPolarHBondContact O-CB 3.23Å; K206-A209 PolarHBondContact O-N 3.03Å; K206-A209 VanDerWaalsContact O-N 3.12Å; K206-I210 WeakPolarHBondContact O-CG1 3.46Å; K206-I210 PolarHBondContact O-N 3.41Å
207	Y	89.4	Confident	78.6	Confident	2 Å²	2	61 Å²	61	1%	0.008	33%	0.327	C	S	.	.	H	α-helix	trans	-55.6	-48.4	172.4	171.1	-81.1	0	0	0	111.7	F126 Y149 R174 F177 W203 I204 A209 I210 Y211	F126-Y207 HydrophobicContact CE1-CD2 4.18Å; F126-Y207 HydrophobicContact CE1-CE2 4.23Å; F126-Y207 HydrophobicContact CE2-CE2 4.47Å; F126-Y207 AromaticContact CZ-CD2 3.63Å; F126-Y207 HydrophobicContact CZ-CD2 3.63Å; F126-Y207 AromaticContact CZ-CE2 3.55Å; F126-Y207 HydrophobicContact CZ-CE2 3.55Å; Y149-Y207 AromaticContact CE1-CE2 3.86Å; Y149-Y207 HydrophobicContact CE1-CE2 3.86Å; R174-Y207 HydrophobicContact CB-CD1 4.45Å; R174-Y207 HydrophobicContact CB-CE1 3.71Å; R174-Y207 HydrophobicContact CG-CD1 4Å; R174-Y207 HydrophobicContact CG-CE1 3.74Å; R174-Y207 PolarHBondContact N-OH 3.18Å; F177-Y207 HydrophobicContact CB-CD2 3.77Å; F177-Y207 HydrophobicContact CB-CE2 3.7Å; F177-Y207 AromaticContact CD1-CD2 3.35Å; F177-Y207 HydrophobicContact CD1-CD2 3.35Å; F177-Y207 HydrophobicContact CD1-CE2 4.19Å; F177-Y207 AromaticContact CD1-CG 3.66Å; F177-Y207 HydrophobicContact CD1-CG 3.66Å; F177-Y207 AromaticContact CD2-CD2 3.97Å; F177-Y207 HydrophobicContact CD2-CD2 3.97Å; F177-Y207 HydrophobicContact CD2-CE2 4.42Å; F177-Y207 AromaticContact CE1-CD2 3.9Å; F177-Y207 HydrophobicContact CE1-CD2 3.9Å; F177-Y207 HydrophobicContact CE1-CG 4.07Å; F177-Y207 HydrophobicContact CE2-CD2 4.44Å; F177-Y207 AromaticContact CG-CD2 3.39Å; F177-Y207 HydrophobicContact CG-CD2 3.39Å; F177-Y207 AromaticContact CG-CE2 3.85Å; F177-Y207 HydrophobicContact CG-CE2 3.85Å; F177-Y207 HydrophobicContact CG-CG 4.17Å; F177-Y207 HydrophobicContact CZ-CD2 4.4Å; W203-Y207 PolarHBondContact O-N 2.95Å; I204-Y207 WeakPolarHBondContact O-CB 3.35Å; I204-Y207 PolarHBondContact O-N 2.73Å; Y207-A209 PolarHBondContact O-N 2.89Å; Y207-I210 PolarHBondContact O-N 2.84Å; Y207-Y211 HydrophobicContact CE1-CD2 4.29Å; Y207-Y211 WeakPolarHBondContact O-CB 3.39Å; Y207-Y211 PolarHBondContact O-N 3.31Å
208	D	88.1	Confident	76.5	Confident	34 Å²	34	59.4 Å²	59.4	18%	0.182	33%	0.332	C	S	.	.	H	α-helix	trans	-63.1	-25.5	-179.9	-75.5	-24.8	0	0	0	111.7	R174 I204 A205 K206 R212	R174-D208 WeakPolarHBondContact CD-OD1 3.25Å; R174-D208 IonicContact CZ-OD1 2.75Å; R174-D208 IonicContact CZ-OD2 2.58Å; R174-D208 IonicContact NE-OD1 3.18Å; R174-D208 PolarHBondContact NE-OD1 3.42Å; R174-D208 IonicContact NE-OD2 3.23Å; R174-D208 PolarHBondContact NE-OD2 2.99Å; R174-D208 VanDerWaalsContact NE-OD2 3.17Å; R174-D208 IonicContact NH2-OD1 3.85Å; R174-D208 IonicContact NH2-OD2 2.76Å; R174-D208 PolarHBondContact NH2-OD2 2.92Å; I204-D208 WeakPolarHBondContact O-CB 3.48Å; I204-D208 PolarHBondContact O-N 3.01Å; A205-D208 PolarHBondContact O-N 2.77Å; K206-D208 VanDerWaalsContact C-N 3.35Å; K206-D208 PolarHBondContact O-N 2.95Å; D208-R212 WeakPolarHBondContact O-CG 3.44Å; D208-R212 PolarHBondContact O-N 3.21Å; D208-R212 PolarHBondContact O-NE 2.84Å; D208-R212 PolarHBondContact O-NH1 3.15Å; D208-R212 PolarHBondContact O-NH2 3.33Å
209	A	86.4	Confident	74.4	Confident	33 Å²	33	63 Å²	63	27%	0.273	34%	0.341	S	S	.	.	H	α-helix	trans	-75.8	-48.7	171.7	0	0	0	0	0	112.8	I136 A205 K206 Y207 Y211 R212 G213	I136-A209 HydrophobicContact CD1-CB 4.01Å; A205-A209 PolarHBondContact O-N 3.18Å; A205-A209 VanDerWaalsContact O-N 3.12Å; K206-A209 WeakPolarHBondContact O-CB 3.23Å; K206-A209 PolarHBondContact O-N 3.03Å; K206-A209 VanDerWaalsContact O-N 3.12Å; Y207-A209 PolarHBondContact O-N 2.89Å; A209-Y211 VanDerWaalsContact C-N 3.25Å; A209-Y211 PolarHBondContact O-N 3.36Å; A209-R212 PolarHBondContact O-N 2.92Å; A209-R212 VanDerWaalsContact O-N 3.15Å; A209-G213 PolarHBondContact O-N 3.1Å
210	I	86.9	Confident	71.8	Confident	3 Å²	3	69.8 Å²	69.8	2%	0.015	37%	0.371	C	S	.	.	H	α-helix	trans	-57.7	-41.8	175.6	-57.9	164.4	0	0	0	110.2	F126 F129 I136 F142 V146 K206 Y207 R212 G213	F126-I210 HydrophobicContact CD1-CG2 4.48Å; F126-I210 HydrophobicContact CD2-CG2 3.47Å; F126-I210 VanDerWaalsContact CD2-CG2 3.47Å; F126-I210 HydrophobicContact CE1-CG2 4.46Å; F126-I210 HydrophobicContact CE2-CB 4.06Å; F126-I210 HydrophobicContact CE2-CG2 3.44Å; F126-I210 VanDerWaalsContact CE2-CG2 3.44Å; F126-I210 HydrophobicContact CG-CG2 4Å; F126-I210 HydrophobicContact CZ-CB 4.27Å; F126-I210 HydrophobicContact CZ-CG2 3.96Å; F129-I210 HydrophobicContact CB-CD1 4.34Å; F129-I210 HydrophobicContact CB-CG1 4.38Å; F129-I210 HydrophobicContact CB-CG2 4.25Å; F129-I210 HydrophobicContact CD1-CD1 3.96Å; F129-I210 HydrophobicContact CD2-CD1 3.72Å; F129-I210 HydrophobicContact CD2-CG1 3.93Å; F129-I210 HydrophobicContact CE1-CD1 4.24Å; F129-I210 HydrophobicContact CE2-CD1 4.02Å; F129-I210 HydrophobicContact CG-CD1 3.71Å; F129-I210 HydrophobicContact CG-CG1 4.11Å; F129-I210 HydrophobicContact CZ-CD1 4.27Å; I136-I210 HydrophobicContact CD1-CB 4.35Å; I136-I210 HydrophobicContact CD1-CG1 3.56Å; F142-I210 HydrophobicContact CE1-CD1 4.14Å; F142-I210 HydrophobicContact CZ-CD1 4.14Å; V146-I210 HydrophobicContact CG2-CD1 4.46Å; K206-I210 WeakPolarHBondContact O-CG1 3.46Å; K206-I210 PolarHBondContact O-N 3.41Å; Y207-I210 PolarHBondContact O-N 2.84Å; I210-R212 PolarHBondContact O-N 3.47Å; I210-G213 PolarHBondContact O-N 2.85Å
211	Y	84.4	Confident	69.3	Low	63 Å²	63	75 Å²	75	25%	0.247	41%	0.407	C	S	.	.	H	α-helix	trans	-59.6	-43	177.8	-173.3	-81.4	0	0	0	112.3	L122 R125 A170 Y207 A209	L122-Y211 HydrophobicContact CD1-CD2 3.53Å; L122-Y211 HydrophobicContact CD1-CE2 3.94Å; L122-Y211 HydrophobicContact CD1-CG 4.24Å; L122-Y211 HydrophobicContact CD2-CD2 4.27Å; L122-Y211 HydrophobicContact CD2-CE2 4.07Å; R125-Y211 PolarHBondContact NH1-O 3.07Å; A170-Y211 HydrophobicContact CB-CE1 4.45Å; A170-Y211 HydrophobicContact CB-CE2 4.29Å; A170-Y211 WeakPolarHBondContact CB-OH 3.41Å; Y207-Y211 HydrophobicContact CE1-CD2 4.29Å; Y207-Y211 WeakPolarHBondContact O-CB 3.39Å; Y207-Y211 PolarHBondContact O-N 3.31Å; A209-Y211 VanDerWaalsContact C-N 3.25Å; A209-Y211 PolarHBondContact O-N 3.36Å
212	R	81.9	Confident	66.7	Low	134 Å²	134	77 Å²	77	51%	0.506	41%	0.412	S	S	.	.	H	α-helix	trans	-73.3	-35.7	179	-77.6	-175	-67.8	-90.6	-3.7	113.7	R125 D208 A209 I210	R125-R212 PolarHBondContact NH1-O 3.5Å; R125-R212 PolarHBondContact NH2-O 3.34Å; D208-R212 WeakPolarHBondContact O-CG 3.44Å; D208-R212 PolarHBondContact O-N 3.21Å; D208-R212 PolarHBondContact O-NE 2.84Å; D208-R212 PolarHBondContact O-NH1 3.15Å; D208-R212 PolarHBondContact O-NH2 3.33Å; A209-R212 PolarHBondContact O-N 2.92Å; A209-R212 VanDerWaalsContact O-N 3.15Å; I210-R212 PolarHBondContact O-N 3.47Å
213	G	71.3	Confident	64.2	Low	21 Å²	21	83.9 Å²	83.9	22%	0.216	43%	0.429	C	S	.	.			trans	71.6	170.1	-172.1	0	0	0	0	0	113.1	A209 I210 E215	A209-G213 PolarHBondContact O-N 3.1Å; I210-G213 PolarHBondContact O-N 2.85Å; G213-E215 PolarHBondContact O-N 3.18Å
214	E	55.7	Low	61.5	Low	83 Å²	83	91.6 Å²	91.6	39%	0.388	47%	0.468	S	S	.	.	G	3₁₀ helix	trans	-75.6	-21.4	-172.7	-59.4	-166.5	-179.9	0	0	113.5	Q135 D216 L217	Q135-E214 PolarHBondContact N-OE1 3.03Å; Q135-E214 PolarHBondContact NE2-OE2 3Å; Q135-E214 VanDerWaalsContact NE2-OE2 3.16Å; E214-D216 PolarHBondContact O-N 2.77Å; E214-L217 PolarHBondContact O-N 3.1Å
215	E	47	Very low	58.8	Low	153 Å²	153	95 Å²	95	72%	0.715	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-61.6	-33.5	-174.8	-63.4	178.3	108.1	0	0	115.1	R125 G213	R125-E215 IonicContact NH2-OE2 3.45Å; R125-E215 PolarHBondContact NH2-OE2 2.88Å; G213-E215 PolarHBondContact O-N 3.18Å
216	D	44.8	Very low	56.2	Low	78 Å²	78	98.4 Å²	98.4	42%	0.417	51%	0.508	S	S	.	.	G	3₁₀ helix	trans	-86.4	-2.8	-174.4	-97.1	-25.8	0	0	0	114.1	E214 C218 K219	E214-D216 PolarHBondContact O-N 2.77Å; D216-C218 PolarHBondContact O-N 2.76Å; D216-C218 VanDerWaalsContact O-N 3.08Å; D216-K219 PolarHBondContact O-N 2.89Å; D216-K219 IonicContact OD1-NZ 2.68Å; D216-K219 PolarHBondContact OD1-NZ 3.26Å
217	L	41.8	Very low	53.8	Low	150 Å²	150	100.2 Å²	100.2	79%	0.785	53%	0.525	S	S	*	.	G	3₁₀ helix	trans	-60.2	-19.4	175.5	-73.1	169.9	0	0	0	113.4	E214	E214-L217 PolarHBondContact O-N 3.1Å
218	C	39	Very low	51.4	Low	121 Å²	121	101.6 Å²	101.6	82%	0.818	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-77.5	-16.9	177.2	-165.2	0	0	0	0	113.7	D216	D216-C218 PolarHBondContact O-N 2.76Å; D216-C218 VanDerWaalsContact O-N 3.08Å
219	K	40.1	Very low	49	Very low	148 Å²	148	104.5 Å²	104.5	64%	0.643	56%	0.556	S	S	*	*	S	Bend	trans	-103.5	120.9	-175.5	-65.1	176.3	-158.7	133.4	0	111.5	D216	D216-K219 PolarHBondContact O-N 2.89Å; D216-K219 IonicContact OD1-NZ 2.68Å; D216-K219 PolarHBondContact OD1-NZ 3.26Å
220	Q	31	Very low	46.9	Very low	166 Å²	166	106.2 Å²	106.2	78%	0.776	57%	0.566	S	S	*	*			trans	-54.5	151.4	166.9	-74.7	-173.2	-11.1	0	0	111.3	N222	Q220-N222 VanDerWaalsContact C-N 3.25Å; Q220-N222 PolarHBondContact O-N 2.91Å
221	P	34.4	Very low	45.2	Very low	141 Å²	141	109.9 Å²	109.9	92%	0.916	58%	0.583	S	S	*	*			trans	-69	78.6	179.1	29.3	-36.3	0	0	0	111.6	R223	P221-R223 PolarHBondContact O-N 3.03Å
222	N	32.4	Very low	44	Very low	121 Å²	121	109.5 Å²	109.5	65%	0.647	59%	0.585	S	S	*	*			trans	-89.7	112.2	-163.6	-151.2	-14.5	0	0	0	111.7	Q220 M224	Q220-N222 VanDerWaalsContact C-N 3.25Å; Q220-N222 PolarHBondContact O-N 2.91Å; N222-M224 VanDerWaalsContact C-N 3.27Å; N222-M224 PolarHBondContact O-N 2.93Å
223	R	36.2	Very low	43.4	Very low	197 Å²	197	108.1 Å²	108.1	74%	0.743	59%	0.586	S	S	*	*	S	Bend	trans	57.2	-3.7	162.4	-80.1	-176.2	162.6	-173.8	-4.1	121	P221 A225 L226	P221-R223 PolarHBondContact O-N 3.03Å; R223-A225 PolarHBondContact O-N 3.32Å; R223-L226 HydrophobicContact CG-CD1 4.49Å; R223-L226 PolarHBondContact O-N 3.34Å
224	M	33.7	Very low	43.7	Very low	169 Å²	169	108.7 Å²	108.7	83%	0.833	58%	0.584	S	S	*	*	H	α-helix	trans	-49.4	-36.6	-179.4	-81	-171.4	158.5	0	0	114.6	N222 L226 S227	N222-M224 VanDerWaalsContact C-N 3.27Å; N222-M224 PolarHBondContact O-N 2.93Å; M224-L226 PolarHBondContact O-N 3.3Å; M224-S227 PolarHBondContact O-N 3.18Å
225	A	33.1	Very low	45	Very low	88 Å²	88	106.9 Å²	106.9	73%	0.727	58%	0.581	S	S	*	*	H	α-helix	trans	-62	-23.6	179.1	0	0	0	0	0	114.9	R223	R223-A225 PolarHBondContact O-N 3.32Å
226	L	33	Very low	46.8	Very low	126 Å²	126	104.3 Å²	104.3	66%	0.66	57%	0.567	S	S	*	*	H	α-helix	trans	-88.5	-27.8	178.8	-73.6	166.5	0	0	0	112.9	R223 M224 A228 V229	R223-L226 HydrophobicContact CG-CD1 4.49Å; R223-L226 PolarHBondContact O-N 3.34Å; M224-L226 PolarHBondContact O-N 3.3Å; L226-A228 VanDerWaalsContact C-N 3.34Å; L226-A228 PolarHBondContact O-N 2.82Å; L226-V229 PolarHBondContact O-N 3.38Å
227	S	39.6	Very low	48.8	Very low	74 Å²	74	107.2 Å²	107.2	52%	0.517	58%	0.578	S	S	.	*	H	α-helix	trans	-66.2	-37.5	178.7	-157.7	0	0	0	0	111.8	M224 V229 S230	M224-S227 PolarHBondContact O-N 3.18Å; S227-V229 PolarHBondContact O-N 3.08Å; S227-S230 PolarHBondContact O-N 3.13Å
228	A	38.1	Very low	50.8	Low	30 Å²	30	103.5 Å²	103.5	25%	0.248	56%	0.557	C	S	.	*	H	α-helix	trans	-66.2	-4.8	-177	0	0	0	0	0	115.2	L226	L226-A228 VanDerWaalsContact C-N 3.34Å; L226-A228 PolarHBondContact O-N 2.82Å
229	V	38.6	Very low	53.2	Low	95 Å²	95	97.9 Å²	97.9	58%	0.576	52%	0.518	S	S	*	.	H	α-helix	trans	-95.6	-27.7	170.3	-177.3	0	0	0	0	111.3	L226 S227 E231 L232	L226-V229 PolarHBondContact O-N 3.38Å; S227-V229 PolarHBondContact O-N 3.08Å; V229-E231 VanDerWaalsContact C-N 3.3Å; V229-E231 PolarHBondContact O-N 3.06Å; V229-L232 PolarHBondContact O-N 3.2Å
230	S	42.6	Very low	55.5	Low	69 Å²	69	91 Å²	91	48%	0.483	49%	0.489	S	S	.	.	H	α-helix	trans	-79.2	-7	-176.7	-165.1	0	0	0	0	114.5	S227	S227-S230 PolarHBondContact O-N 3.13Å
231	E	50.4	Low	58.3	Low	81 Å²	81	88.5 Å²	88.5	38%	0.379	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.1	-14.2	175.5	-64.5	-175.6	153.8	0	0	113.3	V229 Y663	V229-E231 VanDerWaalsContact C-N 3.3Å; V229-E231 PolarHBondContact O-N 3.06Å; E231-Y663 WeakPolarHBondContact OE1-CE2 3.46Å; E231-Y663 PolarHBondContact OE1-OH 2.67Å
232	L	58.7	Low	60.9	Low	55 Å²	55	83 Å²	83	29%	0.288	44%	0.439	S	S	.	.	S	Bend	trans	-78.1	-27.7	-175.4	-84.6	158.8	0	0	0	113.7	V229	V229-L232 PolarHBondContact O-N 3.2Å
233	I	69.1	Low	63.6	Low	105 Å²	105	77.2 Å²	77.2	54%	0.538	41%	0.408	S	S	.	.	S	Bend	trans	-137.3	105.9	174.6	-55.7	178.3	0	0	0	107.7	T105	T105-I233 HydrophobicContact CG2-CD1 4.11Å; T105-I233 HydrophobicContact CG2-CG1 4.35Å
234	L	77.9	Confident	66.3	Low	32 Å²	32	69.1 Å²	69.1	17%	0.168	38%	0.379	C	S	.	.			trans	-77	142.5	178.7	-63.3	-180	0	0	0	111.2	Q103 Q238 L239 M242	Q103-L234 PolarHBondContact NE2-O 2.95Å; L234-Q238 HydrophobicContact CB-CB 4.18Å; L234-Q238 HydrophobicContact CD2-CB 4.38Å; L234-L239 HydrophobicContact CB-CD2 4Å; L234-L239 HydrophobicContact CB-CG 4.09Å; L234-L239 HydrophobicContact CD1-CD2 3.97Å; L234-M242 HydrophobicContact CD1-CE 4.38Å; L234-M242 HydrophobicContact CD1-SD 4.21Å
235	S	83.7	Confident	68.9	Low	45 Å²	45	67.1 Å²	67.1	32%	0.315	37%	0.367	S	S	.	.			trans	-67.8	162.2	171.1	89.2	0	0	0	0	111.3	E237 Q238 L239	S235-E237 PolarHBondContact O-N 3.28Å; S235-E237 PolarHBondContact OG-N 2.84Å; S235-Q238 PolarHBondContact O-N 3.35Å; S235-Q238 PolarHBondContact OG-N 3.08Å; S235-Q238 VanDerWaalsContact OG-N 3.15Å; S235-L239 WeakPolarHBondContact O-CG 3.34Å; S235-L239 PolarHBondContact O-N 3.3Å
236	K	84.6	Confident	71.6	Confident	99 Å²	99	63.6 Å²	63.6	43%	0.43	34%	0.336	S	S	.	.	H	α-helix	trans	-58.8	-37.9	174.3	-73.1	-171.8	176.8	-178.6	0	111.9	I95 A96 L239 Y240	I95-K236 HydrophobicContact CG2-CB 4.07Å; I95-K236 HydrophobicContact CG2-CG 4.17Å; I95-K236 WeakPolarHBondContact O-CD 3.46Å; I95-K236 WeakPolarHBondContact O-CE 3.19Å; A96-K236 PolarHBondContact O-NZ 3.37Å; K236-L239 PolarHBondContact O-N 2.89Å; K236-Y240 HydrophobicContact CB-CD2 4.49Å; K236-Y240 HydrophobicContact CB-CE2 4.15Å; K236-Y240 WeakPolarHBondContact O-CD2 3.27Å; K236-Y240 PolarHBondContact O-N 3.36Å
237	E	86.2	Confident	74.2	Confident	139 Å²	139	57.6 Å²	57.6	65%	0.65	31%	0.305	S	S	*	.	H	α-helix	trans	-62.4	-48.9	177.6	-64.5	153.8	170.6	0	0	110.7	S235 L239 Y240 E241	S235-E237 PolarHBondContact O-N 3.28Å; S235-E237 PolarHBondContact OG-N 2.84Å; E237-L239 VanDerWaalsContact C-N 3.31Å; E237-L239 PolarHBondContact O-N 3.4Å; E237-Y240 PolarHBondContact O-N 3.32Å; E237-Y240 VanDerWaalsContact O-N 3.1Å; E237-E241 PolarHBondContact O-N 2.88Å
238	Q	85.6	Confident	76.5	Confident	72 Å²	72	56.5 Å²	56.5	34%	0.336	31%	0.305	S	S	.	.	H	α-helix	trans	-60.6	-37.9	175.6	-69.2	172.3	-43	0	0	112.4	L234 S235 M242	L234-Q238 HydrophobicContact CB-CB 4.18Å; L234-Q238 HydrophobicContact CD2-CB 4.38Å; S235-Q238 PolarHBondContact O-N 3.35Å; S235-Q238 PolarHBondContact OG-N 3.08Å; S235-Q238 VanDerWaalsContact OG-N 3.15Å; Q238-M242 VanDerWaalsContact O-CB 3.22Å; Q238-M242 WeakPolarHBondContact O-CB 3.37Å; Q238-M242 PolarHBondContact O-N 2.94Å
239	L	87.6	Confident	79	Confident	3 Å²	3	55.6 Å²	55.6	2%	0.016	30%	0.296	C	S	.	.	H	α-helix	trans	-65.9	-40.8	173.9	-68.2	174.4	0	0	0	112.2	I95 L234 S235 K236 E237 M242 F243 F675 V676	I95-L239 HydrophobicContact CD1-CB 3.98Å; I95-L239 HydrophobicContact CG1-CB 4.17Å; I95-L239 HydrophobicContact CG2-CB 3.98Å; I95-L239 HydrophobicContact CG2-CD1 4.33Å; L234-L239 HydrophobicContact CB-CD2 4Å; L234-L239 HydrophobicContact CB-CG 4.09Å; L234-L239 HydrophobicContact CD1-CD2 3.97Å; S235-L239 WeakPolarHBondContact O-CG 3.34Å; S235-L239 PolarHBondContact O-N 3.3Å; K236-L239 PolarHBondContact O-N 2.89Å; E237-L239 VanDerWaalsContact C-N 3.31Å; E237-L239 PolarHBondContact O-N 3.4Å; L239-M242 HydrophobicContact CD2-CE 3.87Å; L239-F243 PolarHBondContact O-N 3.43Å; L239-F675 HydrophobicContact CD1-CD1 3.88Å; L239-F675 HydrophobicContact CD1-CE1 3.71Å; L239-V676 HydrophobicContact CD2-CG2 4.4Å
240	Y	89.9	Confident	81.3	Confident	5 Å²	5	57.5 Å²	57.5	2%	0.02	30%	0.297	C	S	.	.	H	α-helix	trans	-64.5	-45.1	176.3	-71.8	-55.5	0	0	0	112	Y88 V92 I95 A96 K236 E237 Q244 Y258 Q262	Y88-Y240 PolarHBondContact OH-O 3.11Å; Y88-Y240 VanDerWaalsContact OH-O 3.13Å; V92-Y240 HydrophobicContact CB-CE1 4.22Å; V92-Y240 HydrophobicContact CG1-CE1 3.96Å; V92-Y240 HydrophobicContact CG2-CD1 4.17Å; V92-Y240 HydrophobicContact CG2-CE1 4.08Å; I95-Y240 HydrophobicContact CB-CD1 4.1Å; I95-Y240 HydrophobicContact CB-CE1 3.6Å; I95-Y240 HydrophobicContact CD1-CD1 3.82Å; I95-Y240 HydrophobicContact CD1-CE1 4.15Å; I95-Y240 HydrophobicContact CG1-CE1 4.49Å; I95-Y240 HydrophobicContact CG2-CD1 3.88Å; I95-Y240 HydrophobicContact CG2-CD2 4.13Å; I95-Y240 HydrophobicContact CG2-CE1 3.55Å; I95-Y240 HydrophobicContact CG2-CE2 3.81Å; I95-Y240 HydrophobicContact CG2-CG 4.16Å; A96-Y240 VanDerWaalsContact CA-OH 3.23Å; A96-Y240 WeakPolarHBondContact CA-OH 3.31Å; A96-Y240 WeakPolarHBondContact CB-OH 3.36Å; A96-Y240 PolarHBondContact N-OH 3.36Å; K236-Y240 HydrophobicContact CB-CD2 4.49Å; K236-Y240 HydrophobicContact CB-CE2 4.15Å; K236-Y240 WeakPolarHBondContact O-CD2 3.27Å; K236-Y240 PolarHBondContact O-N 3.36Å; E237-Y240 PolarHBondContact O-N 3.32Å; E237-Y240 VanDerWaalsContact O-N 3.1Å; Y240-Q244 WeakPolarHBondContact O-CB 3.4Å; Y240-Q244 PolarHBondContact O-N 2.88Å; Y240-Y258 HydrophobicContact CD2-CD2 4.08Å; Y240-Y258 AromaticContact CD2-CE2 3.77Å; Y240-Y258 HydrophobicContact CD2-CE2 3.77Å; Y240-Y258 HydrophobicContact CE1-CD2 4.35Å; Y240-Y258 AromaticContact CE2-CD2 3.86Å; Y240-Y258 HydrophobicContact CE2-CD2 3.86Å; Y240-Y258 AromaticContact CE2-CE2 3.41Å; Y240-Y258 HydrophobicContact CE2-CE2 3.41Å; Y240-Y258 VanDerWaalsContact CE2-CE2 3.41Å; Y240-Y258 HydrophobicContact CG-CD2 4.43Å; Y240-Y258 AromaticContact CZ-CD2 3.96Å; Y240-Y258 AromaticContact CZ-CE2 3.9Å; Y240-Q262 PolarHBondContact OH-NE2 3.34Å
241	E	88.5	Confident	83.3	Confident	112 Å²	112	62 Å²	62	52%	0.523	31%	0.308	S	S	.	.	H	α-helix	trans	-63.4	-46.1	176.9	-69.8	-172.2	143.5	0	0	111.6	E237 Q244 Q245	E237-E241 PolarHBondContact O-N 2.88Å; E241-Q244 WeakPolarHBondContact O-CB 3.3Å; E241-Q244 PolarHBondContact O-N 3.4Å; E241-Q245 WeakPolarHBondContact O-CG 3.36Å; E241-Q245 PolarHBondContact O-N 2.89Å
242	M	89.1	Confident	84.8	Confident	26 Å²	26	63.4 Å²	63.4	13%	0.128	32%	0.317	C	S	.	.	H	α-helix	trans	-60	-48.9	177.9	-177.6	-177.5	68.3	0	0	111.5	L234 Q238 L239 Q244 Q245 I246 Q673	L234-M242 HydrophobicContact CD1-CE 4.38Å; L234-M242 HydrophobicContact CD1-SD 4.21Å; Q238-M242 VanDerWaalsContact O-CB 3.22Å; Q238-M242 WeakPolarHBondContact O-CB 3.37Å; Q238-M242 PolarHBondContact O-N 2.94Å; L239-M242 HydrophobicContact CD2-CE 3.87Å; M242-Q244 VanDerWaalsContact C-N 3.32Å; M242-Q244 PolarHBondContact O-N 2.9Å; M242-Q245 PolarHBondContact O-N 2.89Å; M242-I246 HydrophobicContact CG-CD1 3.88Å; M242-I246 VanDerWaalsContact O-CG1 3.28Å; M242-I246 WeakPolarHBondContact O-CG1 3.22Å; M242-I246 PolarHBondContact O-N 3.48Å; M242-Q673 HydrophobicContact CE-CG 3.65Å; M242-Q673 HydrophobicContact SD-CG 3.85Å
243	F	90.6	Very high	86	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-73.5	-22.6	177.9	-84	-78.6	0	0	0	113.7	Y88 V91 I95 L239 I246 L247 L650 V676	Y88-F243 HydrophobicContact CE2-CB 4.3Å; V91-F243 HydrophobicContact CG1-CB 3.68Å; V91-F243 HydrophobicContact CG1-CD1 3.9Å; V91-F243 HydrophobicContact CG1-CD2 4.21Å; V91-F243 HydrophobicContact CG1-CG 3.65Å; I95-F243 HydrophobicContact CD1-CD2 4.26Å; L239-F243 PolarHBondContact O-N 3.43Å; F243-I246 HydrophobicContact CD1-CB 4.43Å; F243-I246 HydrophobicContact CD1-CD1 3.85Å; F243-I246 HydrophobicContact CD1-CG2 4.45Å; F243-I246 HydrophobicContact CE1-CD1 3.9Å; F243-I246 HydrophobicContact CG-CD1 4.23Å; F243-I246 HydrophobicContact CZ-CD1 4.3Å; F243-L247 WeakPolarHBondContact O-CB 3.39Å; F243-L247 PolarHBondContact O-N 2.67Å; F243-L247 VanDerWaalsContact O-N 3.14Å; F243-L650 HydrophobicContact CD1-CD1 4.26Å; F243-L650 HydrophobicContact CE1-CD1 4.07Å; F243-V676 HydrophobicContact CD2-CB 4.32Å; F243-V676 HydrophobicContact CD2-CG1 4.11Å; F243-V676 HydrophobicContact CD2-CG2 4.15Å; F243-V676 HydrophobicContact CE1-CG1 4.16Å; F243-V676 HydrophobicContact CE2-CB 3.46Å; F243-V676 VanDerWaalsContact CE2-CB 3.46Å; F243-V676 HydrophobicContact CE2-CG1 3.59Å; F243-V676 HydrophobicContact CE2-CG2 3.59Å; F243-V676 HydrophobicContact CZ-CB 3.68Å; F243-V676 HydrophobicContact CZ-CG1 3.62Å; F243-V676 HydrophobicContact CZ-CG2 4.33Å
244	Q	90.9	Very high	86.9	Confident	26 Å²	26	58.1 Å²	58.1	12%	0.121	29%	0.289	C	S	.	.	H	α-helix	trans	-65.5	-42.5	169.7	-170.4	-160.2	-25	0	0	110.4	Y88 Y240 E241 M242 G248 I249 H254	Y88-Q244 HydrophobicContact CE2-CB 4.2Å; Y240-Q244 WeakPolarHBondContact O-CB 3.4Å; Y240-Q244 PolarHBondContact O-N 2.88Å; E241-Q244 WeakPolarHBondContact O-CB 3.3Å; E241-Q244 PolarHBondContact O-N 3.4Å; M242-Q244 VanDerWaalsContact C-N 3.32Å; M242-Q244 PolarHBondContact O-N 2.9Å; Q244-G248 PolarHBondContact O-N 3.38Å; Q244-G248 VanDerWaalsContact O-N 3.09Å; Q244-I249 HydrophobicContact CG-CB 3.92Å; Q244-I249 HydrophobicContact CG-CG2 4.48Å; Q244-I249 VanDerWaalsContact CG-O 3.23Å; Q244-I249 WeakPolarHBondContact CG-O 3.45Å; Q244-I249 PolarHBondContact NE2-O 2.92Å; Q244-I249 PolarHBondContact O-N 3.06Å; Q244-H254 HydrophobicContact CG-CB 4.13Å
245	Q	88.9	Confident	87.1	Confident	127 Å²	127	62.1 Å²	62.1	59%	0.593	31%	0.307	S	S	*	.	H	α-helix	trans	-67.2	-49.3	176.4	-68.3	171.5	28.5	0	0	111.4	E241 M242 L247 G248	E241-Q245 WeakPolarHBondContact O-CG 3.36Å; E241-Q245 PolarHBondContact O-N 2.89Å; M242-Q245 PolarHBondContact O-N 2.89Å; Q245-L247 VanDerWaalsContact C-N 3.31Å; Q245-L247 PolarHBondContact O-N 3.07Å; Q245-G248 PolarHBondContact O-N 3.2Å; Q245-G248 VanDerWaalsContact O-N 3.13Å
246	I	89.3	Confident	87	Confident	14 Å²	14	61.2 Å²	61.2	7%	0.072	30%	0.298	C	S	.	.	H	α-helix	trans	-52.8	-45.8	177.3	-70.6	163.3	0	0	0	112.1	M242 F243 Q653 T654 H657	M242-I246 HydrophobicContact CG-CD1 3.88Å; M242-I246 VanDerWaalsContact O-CG1 3.28Å; M242-I246 WeakPolarHBondContact O-CG1 3.22Å; M242-I246 PolarHBondContact O-N 3.48Å; F243-I246 HydrophobicContact CD1-CB 4.43Å; F243-I246 HydrophobicContact CD1-CD1 3.85Å; F243-I246 HydrophobicContact CD1-CG2 4.45Å; F243-I246 HydrophobicContact CE1-CD1 3.9Å; F243-I246 HydrophobicContact CG-CD1 4.23Å; F243-I246 HydrophobicContact CZ-CD1 4.3Å; I246-Q653 HydrophobicContact CG2-CB 4.08Å; I246-T654 HydrophobicContact CD1-CG2 4.24Å; I246-H657 HydrophobicContact CG1-CB 3.77Å
247	L	89.6	Confident	86.9	Confident	1 Å²	1	56.5 Å²	56.5	1%	0.005	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93	4.2	-176.6	-63.5	178.7	0	0	0	113.6	R84 L87 Y88 V91 F243 Q245 I249 L650	R84-L247 WeakPolarHBondContact CD-O 3.38Å; L87-L247 HydrophobicContact CB-CD1 4.17Å; Y88-L247 HydrophobicContact CD2-CB 4.48Å; Y88-L247 HydrophobicContact CD2-CD1 3.94Å; V91-L247 HydrophobicContact CG2-CD1 4.34Å; F243-L247 WeakPolarHBondContact O-CB 3.39Å; F243-L247 PolarHBondContact O-N 2.67Å; F243-L247 VanDerWaalsContact O-N 3.14Å; Q245-L247 VanDerWaalsContact C-N 3.31Å; Q245-L247 PolarHBondContact O-N 3.07Å; L247-I249 VanDerWaalsContact C-N 3.31Å; L247-I249 HydrophobicContact CB-CD1 4.22Å; L247-I249 HydrophobicContact CB-CG1 3.86Å; L247-I249 WeakPolarHBondContact O-CD1 3.41Å; L247-I249 PolarHBondContact O-N 3.49Å; L247-L650 HydrophobicContact CD1-CD1 4.09Å; L247-L650 HydrophobicContact CD2-CD1 3.99Å; L247-L650 HydrophobicContact CG-CD1 4.37Å
248	G	87.6	Confident	86.8	Confident	51 Å²	51	53.3 Å²	53.3	53%	0.526	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	27.7	176.1	0	0	0	0	0	115.3	Q244 Q245	Q244-G248 PolarHBondContact O-N 3.38Å; Q244-G248 VanDerWaalsContact O-N 3.09Å; Q245-G248 PolarHBondContact O-N 3.2Å; Q245-G248 VanDerWaalsContact O-N 3.13Å
249	I	89.3	Confident	86.6	Confident	11 Å²	11	54.6 Å²	54.6	6%	0.056	27%	0.269	C	S	.	.			trans	-81.4	137.1	-171.5	-54.7	-58	0	0	0	110.8	R84 L85 Y88 Q244 L247 E253 H254	R84-I249 HydrophobicContact CB-CD1 4.23Å; L85-I249 HydrophobicContact CD2-CD1 4.15Å; L85-I249 HydrophobicContact CD2-CG2 4.5Å; L85-I249 HydrophobicContact CG-CD1 4.45Å; Y88-I249 HydrophobicContact CD1-CG1 4.42Å; Y88-I249 HydrophobicContact CD1-CG2 4.27Å; Y88-I249 HydrophobicContact CD2-CG1 3.79Å; Y88-I249 HydrophobicContact CE1-CG2 4.5Å; Y88-I249 HydrophobicContact CE2-CG1 4.44Å; Y88-I249 HydrophobicContact CG-CG1 3.81Å; Y88-I249 HydrophobicContact CG-CG2 4.48Å; Q244-I249 HydrophobicContact CG-CB 3.92Å; Q244-I249 HydrophobicContact CG-CG2 4.48Å; Q244-I249 VanDerWaalsContact CG-O 3.23Å; Q244-I249 WeakPolarHBondContact CG-O 3.45Å; Q244-I249 PolarHBondContact NE2-O 2.92Å; Q244-I249 PolarHBondContact O-N 3.06Å; L247-I249 VanDerWaalsContact C-N 3.31Å; L247-I249 HydrophobicContact CB-CD1 4.22Å; L247-I249 HydrophobicContact CB-CG1 3.86Å; L247-I249 WeakPolarHBondContact O-CD1 3.41Å; L247-I249 PolarHBondContact O-N 3.49Å; I249-E253 HydrophobicContact CG2-CB 3.79Å; I249-H254 HydrophobicContact CG2-CB 4.37Å
250	K	87.2	Confident	86.2	Confident	134 Å²	134	56.3 Å²	56.3	58%	0.583	28%	0.284	S	S	*	.			trans	-74.8	147.8	-179.2	-58.1	173.6	-174.3	175.6	0	110.6	L252 E253 H254	K250-L252 PolarHBondContact O-N 3.33Å; K250-L252 VanDerWaalsContact O-N 3.12Å; K250-E253 HydrophobicContact CB-CB 4.46Å; K250-E253 HydrophobicContact CB-CG 4.02Å; K250-E253 VanDerWaalsContact CB-OE2 3.27Å; K250-E253 WeakPolarHBondContact CB-OE2 3.39Å; K250-E253 WeakPolarHBondContact CG-OE2 3.44Å; K250-E253 PolarHBondContact N-OE2 2.82Å; K250-E253 WeakPolarHBondContact O-CA 3.17Å; K250-E253 WeakPolarHBondContact O-CB 3.39Å; K250-E253 PolarHBondContact O-N 3.25Å; K250-H254 PolarHBondContact O-N 3Å
251	K	84.8	Confident	85.7	Confident	164 Å²	164	56.4 Å²	56.4	71%	0.713	29%	0.285	S	S	*	.	H	α-helix	trans	-54	-37	-177.7	-70	-170.2	175.4	-167.2	0	113.6	Q255	K251-Q255 WeakPolarHBondContact O-CB 3.32Å; K251-Q255 PolarHBondContact O-N 3.38Å
252	L	82.7	Confident	85.1	Confident	110 Å²	110	53.6 Å²	53.6	58%	0.576	27%	0.272	S	S	*	.	H	α-helix	trans	-67.2	-40.5	174.9	-177.5	65.6	0	0	0	112.8	K250 Q255 L256	K250-L252 PolarHBondContact O-N 3.33Å; K250-L252 VanDerWaalsContact O-N 3.12Å; L252-Q255 PolarHBondContact O-N 2.96Å; L252-L256 WeakPolarHBondContact O-CG 3.41Å; L252-L256 PolarHBondContact O-N 3.35Å; L252-L256 VanDerWaalsContact O-N 3.11Å
253	E	84.1	Confident	84.5	Confident	17 Å²	17	54.7 Å²	54.7	8%	0.079	28%	0.278	C	S	.	.	H	α-helix	trans	-67.7	-44.8	178.5	-60.7	168	155.3	0	0	109.9	R81 L85 I249 K250 Q255 L256 L257 M630	R81-E253 IonicContact CZ-OE1 3.39Å; R81-E253 IonicContact NE-OE1 3.46Å; R81-E253 PolarHBondContact NE-OE1 2.98Å; R81-E253 IonicContact NH2-OE1 2.78Å; R81-E253 PolarHBondContact NH2-OE1 3.06Å; L85-E253 HydrophobicContact CD2-CB 4.15Å; I249-E253 HydrophobicContact CG2-CB 3.79Å; K250-E253 HydrophobicContact CB-CB 4.46Å; K250-E253 HydrophobicContact CB-CG 4.02Å; K250-E253 VanDerWaalsContact CB-OE2 3.27Å; K250-E253 WeakPolarHBondContact CB-OE2 3.39Å; K250-E253 WeakPolarHBondContact CG-OE2 3.44Å; K250-E253 PolarHBondContact N-OE2 2.82Å; K250-E253 WeakPolarHBondContact O-CA 3.17Å; K250-E253 WeakPolarHBondContact O-CB 3.39Å; K250-E253 PolarHBondContact O-N 3.25Å; E253-Q255 PolarHBondContact O-N 2.67Å; E253-L256 PolarHBondContact O-N 2.86Å; E253-L257 WeakPolarHBondContact O-CG 3.42Å; E253-L257 PolarHBondContact O-N 3.42Å; E253-L257 VanDerWaalsContact O-N 3.08Å; E253-M630 HydrophobicContact CB-CE 4.21Å; E253-M630 HydrophobicContact CG-CE 3.91Å
254	H	85.9	Confident	83.2	Confident	33 Å²	33	62.6 Å²	62.6	15%	0.153	32%	0.321	C	S	.	.	H	α-helix	trans	-53.7	-52.3	170.2	161	75.9	0	0	0	111.5	Y88 Q244 I249 K250 L256 L257 Y258	Y88-H254 HydrophobicContact CE1-CB 4.21Å; Y88-H254 AromaticContact CE1-ND1 3.7Å; Y88-H254 AromaticContact CZ-ND1 3.66Å; Y88-H254 PolarHBondContact OH-ND1 2.97Å; Q244-H254 HydrophobicContact CG-CB 4.13Å; I249-H254 HydrophobicContact CG2-CB 4.37Å; K250-H254 PolarHBondContact O-N 3Å; H254-L256 VanDerWaalsContact C-N 3.33Å; H254-L256 PolarHBondContact O-N 2.85Å; H254-L257 PolarHBondContact O-N 2.97Å; H254-Y258 AromaticContact CE1-CD2 3.86Å; H254-Y258 WeakPolarHBondContact O-CB 3.4Å; H254-Y258 PolarHBondContact O-N 3.49Å
255	Q	82.8	Confident	82.3	Confident	116 Å²	116	64 Å²	64	54%	0.542	33%	0.329	S	S	.	.	H	α-helix	trans	-66.7	-33.5	-173.1	-166.3	168.7	23.5	0	0	113	K251 L252 E253 N259	K251-Q255 WeakPolarHBondContact O-CB 3.32Å; K251-Q255 PolarHBondContact O-N 3.38Å; L252-Q255 PolarHBondContact O-N 2.96Å; E253-Q255 PolarHBondContact O-N 2.67Å; Q255-N259 WeakPolarHBondContact O-CB 3.46Å; Q255-N259 PolarHBondContact O-N 2.88Å; Q255-N259 VanDerWaalsContact O-N 3.14Å; Q255-N259 PolarHBondContact O-ND2 2.92Å
256	L	82.3	Confident	81.2	Confident	25 Å²	25	61 Å²	61	13%	0.131	33%	0.325	C	S	.	.	H	α-helix	trans	-64.2	-51.2	170.9	-71.2	170.6	0	0	0	111.2	L252 E253 H254 N259 A260 F625 H628 M630	L252-L256 WeakPolarHBondContact O-CG 3.41Å; L252-L256 PolarHBondContact O-N 3.35Å; L252-L256 VanDerWaalsContact O-N 3.11Å; E253-L256 PolarHBondContact O-N 2.86Å; H254-L256 VanDerWaalsContact C-N 3.33Å; H254-L256 PolarHBondContact O-N 2.85Å; L256-N259 PolarHBondContact O-N 3.49Å; L256-A260 WeakPolarHBondContact O-CB 3.34Å; L256-A260 PolarHBondContact O-N 2.86Å; L256-A260 VanDerWaalsContact O-N 3.12Å; L256-F625 HydrophobicContact CB-CE1 3.89Å; L256-F625 HydrophobicContact CD2-CD1 4.13Å; L256-F625 HydrophobicContact CD2-CE1 3.72Å; L256-F625 HydrophobicContact CD2-CE2 4.45Å; L256-F625 HydrophobicContact CD2-CZ 3.89Å; L256-F625 HydrophobicContact CG-CE1 4.41Å; L256-F625 WeakPolarHBondContact O-CE1 3.48Å; L256-H628 HydrophobicContact CD1-CB 4.32Å; L256-M630 HydrophobicContact CD1-CG 4.34Å
257	L	83.2	Confident	80.2	Confident	0 Å²	0	61.7 Å²	61.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-68.9	-35.1	-177.2	-64.2	179.6	0	0	0	112.7	L85 Y88 V89 E253 H254 A260 C261 M630 I634	L85-L257 HydrophobicContact CD2-CD1 4.15Å; Y88-L257 HydrophobicContact CD1-CD1 4.03Å; V89-L257 HydrophobicContact CG2-CD1 3.96Å; V89-L257 HydrophobicContact CG2-CD2 3.87Å; V89-L257 HydrophobicContact CG2-CG 4.41Å; E253-L257 WeakPolarHBondContact O-CG 3.42Å; E253-L257 PolarHBondContact O-N 3.42Å; E253-L257 VanDerWaalsContact O-N 3.08Å; H254-L257 PolarHBondContact O-N 2.97Å; L257-A260 PolarHBondContact O-N 2.87Å; L257-C261 VanDerWaalsContact O-CB 3.26Å; L257-C261 WeakPolarHBondContact O-CB 3.39Å; L257-C261 PolarHBondContact O-N 3.37Å; L257-C261 PolarHBondContact O-SG 2.7Å; L257-M630 HydrophobicContact CD2-CB 4.25Å; L257-M630 HydrophobicContact CD2-CG 4.49Å; L257-M630 HydrophobicContact CD2-SD 4.09Å; L257-M630 HydrophobicContact CG-SD 4.44Å; L257-I634 HydrophobicContact CD2-CD1 3.95Å; L257-I634 HydrophobicContact CD2-CG1 3.85Å
258	Y	82.8	Confident	79.3	Confident	72 Å²	72	64.6 Å²	64.6	28%	0.282	34%	0.343	S	S	.	.	H	α-helix	trans	-59.9	-55.9	172.5	176.3	-86.9	0	0	0	110.7	Y240 H254 A260 C261 Q262	Y240-Y258 HydrophobicContact CD2-CD2 4.08Å; Y240-Y258 AromaticContact CD2-CE2 3.77Å; Y240-Y258 HydrophobicContact CD2-CE2 3.77Å; Y240-Y258 HydrophobicContact CE1-CD2 4.35Å; Y240-Y258 AromaticContact CE2-CD2 3.86Å; Y240-Y258 HydrophobicContact CE2-CD2 3.86Å; Y240-Y258 AromaticContact CE2-CE2 3.41Å; Y240-Y258 HydrophobicContact CE2-CE2 3.41Å; Y240-Y258 VanDerWaalsContact CE2-CE2 3.41Å; Y240-Y258 HydrophobicContact CG-CD2 4.43Å; Y240-Y258 AromaticContact CZ-CD2 3.96Å; Y240-Y258 AromaticContact CZ-CE2 3.9Å; H254-Y258 AromaticContact CE1-CD2 3.86Å; H254-Y258 WeakPolarHBondContact O-CB 3.4Å; H254-Y258 PolarHBondContact O-N 3.49Å; Y258-A260 PolarHBondContact O-N 2.87Å; Y258-C261 PolarHBondContact O-N 2.98Å; Y258-C261 VanDerWaalsContact O-N 3.14Å; Y258-Q262 HydrophobicContact CD1-CG 4.19Å; Y258-Q262 HydrophobicContact CD2-CG 4.41Å; Y258-Q262 HydrophobicContact CE1-CG 3.97Å; Y258-Q262 HydrophobicContact CE2-CG 4.23Å; Y258-Q262 HydrophobicContact CG-CG 4.39Å; Y258-Q262 VanDerWaalsContact CZ-NE2 3.3Å; Y258-Q262 VanDerWaalsContact O-CG 3.29Å; Y258-Q262 WeakPolarHBondContact O-CG 3.48Å; Y258-Q262 PolarHBondContact O-N 3.44Å; Y258-Q262 PolarHBondContact OH-NE2 2.72Å
259	N	82	Confident	78.9	Confident	99 Å²	99	64.5 Å²	64.5	53%	0.529	33%	0.329	S	S	.	.	H	α-helix	trans	-59.5	-32.6	-179.7	-74.1	-5.5	0	0	0	112.5	Q255 L256	Q255-N259 WeakPolarHBondContact O-CB 3.46Å; Q255-N259 PolarHBondContact O-N 2.88Å; Q255-N259 VanDerWaalsContact O-N 3.14Å; Q255-N259 PolarHBondContact O-ND2 2.92Å; L256-N259 PolarHBondContact O-N 3.49Å
260	A	77.8	Confident	78.2	Confident	40 Å²	40	65 Å²	65	33%	0.331	33%	0.334	S	S	.	.	H	α-helix	trans	-84.4	-18.3	179.8	0	0	0	0	0	114.8	L256 L257 Y258 F625 I634	L256-A260 WeakPolarHBondContact O-CB 3.34Å; L256-A260 PolarHBondContact O-N 2.86Å; L256-A260 VanDerWaalsContact O-N 3.12Å; L257-A260 PolarHBondContact O-N 2.87Å; Y258-A260 PolarHBondContact O-N 2.87Å; A260-F625 HydrophobicContact CB-CE1 4.08Å; A260-F625 HydrophobicContact CB-CZ 4.36Å; A260-I634 HydrophobicContact CB-CD1 3.59Å; A260-I634 HydrophobicContact CB-CG1 4.39Å
261	C	80.6	Confident	77.6	Confident	7 Å²	7	59.2 Å²	59.2	5%	0.047	31%	0.312	C	S	.	.	H	α-helix	trans	-105.6	-11.8	-178.5	-68.2	0	0	0	0	114.2	V92 L257 Y258	V92-C261 HydrophobicContact CG1-CB 3.56Å; L257-C261 VanDerWaalsContact O-CB 3.26Å; L257-C261 WeakPolarHBondContact O-CB 3.39Å; L257-C261 PolarHBondContact O-N 3.37Å; L257-C261 PolarHBondContact O-SG 2.7Å; Y258-C261 PolarHBondContact O-N 2.98Å; Y258-C261 VanDerWaalsContact O-N 3.14Å
262	Q	75.9	Confident	77.3	Confident	52 Å²	52	53.1 Å²	53.1	24%	0.243	29%	0.286	C	S	.	.			trans	-72.8	141.6	171.3	-71.5	-75.1	17.6	0	0	110.9	Y240 Y258	Y240-Q262 PolarHBondContact OH-NE2 3.34Å; Y258-Q262 HydrophobicContact CD1-CG 4.19Å; Y258-Q262 HydrophobicContact CD2-CG 4.41Å; Y258-Q262 HydrophobicContact CE1-CG 3.97Å; Y258-Q262 HydrophobicContact CE2-CG 4.23Å; Y258-Q262 HydrophobicContact CG-CG 4.39Å; Y258-Q262 VanDerWaalsContact CZ-NE2 3.3Å; Y258-Q262 VanDerWaalsContact O-CG 3.29Å; Y258-Q262 WeakPolarHBondContact O-CG 3.48Å; Y258-Q262 PolarHBondContact O-N 3.44Å; Y258-Q262 PolarHBondContact OH-NE2 2.72Å
263	L	76	Confident	77.3	Confident	49 Å²	49	48.1 Å²	48.1	26%	0.257	26%	0.259	S	S	.	.			trans	-135.8	111.6	178.8	-67.6	173.7	0	0	0	107.9	Y97 N265 Q269 Q272	Y97-L263 HydrophobicContact CE1-CD1 4.29Å; L263-N265 VanDerWaalsContact C-N 3.27Å; L263-N265 PolarHBondContact O-N 3.15Å; L263-Q269 HydrophobicContact CB-CG 3.87Å; L263-Q269 PolarHBondContact O-NE2 2.91Å; L263-Q272 HydrophobicContact CD1-CB 4.01Å; L263-Q272 HydrophobicContact CD1-CG 4.43Å
264	D	63.5	Low	77.1	Confident	167 Å²	167	48.9 Å²	48.9	89%	0.893	26%	0.262	S	S	*	.	S	Bend	trans	-70.4	-22.4	-171.5	-60.5	-47.7	0	0	0	113.7
265	N	72.3	Confident	76.9	Confident	56 Å²	56	50.8 Å²	50.8	30%	0.299	27%	0.268	S	S	.	.			trans	-100.1	126.2	-178.7	-175.7	6.6	0	0	0	112.4	L263 D267 E268 Q269	L263-N265 VanDerWaalsContact C-N 3.27Å; L263-N265 PolarHBondContact O-N 3.15Å; N265-D267 VanDerWaalsContact C-N 3.28Å; N265-D267 PolarHBondContact O-N 3.31Å; N265-D267 PolarHBondContact OD1-N 2.83Å; N265-E268 HydrophobicContact CB-CB 4.28Å; N265-E268 HydrophobicContact CB-CG 4.05Å; N265-E268 PolarHBondContact O-N 3.38Å; N265-Q269 PolarHBondContact O-N 2.73Å
266	A	66.6	Low	76.9	Confident	62 Å²	62	45.8 Å²	45.8	51%	0.512	24%	0.244	S	C	.	.	H	α-helix	trans	-58.3	-34.4	174.9	0	0	0	0	0	113.5	E268 Q269 A270	A266-E268 PolarHBondContact O-N 3.5Å; A266-Q269 PolarHBondContact O-N 3.28Å; A266-A270 WeakPolarHBondContact O-CB 3.26Å; A266-A270 PolarHBondContact O-N 2.89Å
267	D	66.4	Low	77.1	Confident	30 Å²	30	44.7 Å²	44.7	16%	0.16	24%	0.239	C	C	.	.	H	α-helix	trans	-62.4	-33.3	174.7	-64.1	-46.2	0	0	0	111.5	N265 A271 K489 Q514	N265-D267 VanDerWaalsContact C-N 3.28Å; N265-D267 PolarHBondContact O-N 3.31Å; N265-D267 PolarHBondContact OD1-N 2.83Å; D267-A271 VanDerWaalsContact O-CB 3.3Å; D267-A271 WeakPolarHBondContact O-CB 3.39Å; D267-A271 PolarHBondContact O-N 3.16Å; D267-K489 IonicContact OD1-NZ 3.67Å; D267-K489 PolarHBondContact OD1-NZ 3.3Å; D267-K489 WeakPolarHBondContact OD2-CE 3.4Å; D267-K489 IonicContact OD2-NZ 3.56Å; D267-K489 PolarHBondContact OD2-NZ 2.86Å; D267-Q514 PolarHBondContact OD1-NE2 2.97Å
268	E	72.1	Confident	77.1	Confident	61 Å²	61	47.5 Å²	47.5	29%	0.285	25%	0.253	S	S	.	.	H	α-helix	trans	-82.3	-36	-178.3	-64.1	-174.1	132.9	0	0	111.9	N265 A266 A271 Q272 R587	N265-E268 HydrophobicContact CB-CB 4.28Å; N265-E268 HydrophobicContact CB-CG 4.05Å; N265-E268 PolarHBondContact O-N 3.38Å; A266-E268 PolarHBondContact O-N 3.5Å; E268-A271 PolarHBondContact O-N 2.97Å; E268-Q272 WeakPolarHBondContact O-CB 3.34Å; E268-Q272 PolarHBondContact O-N 3.48Å; E268-R587 HydrophobicContact CG-CG 4.49Å; E268-R587 IonicContact OE1-CZ 2.77Å; E268-R587 IonicContact OE1-NE 2.65Å; E268-R587 PolarHBondContact OE1-NE 3.16Å; E268-R587 IonicContact OE1-NH2 3.4Å; E268-R587 PolarHBondContact OE1-NH2 3.39Å; E268-R587 IonicContact OE2-NH2 2.91Å
269	Q	77.7	Confident	77.1	Confident	49 Å²	49	44.8 Å²	44.8	23%	0.229	25%	0.248	C	C	.	.	H	α-helix	trans	-57	-49	167.2	-65	173	12	0	0	110.7	Y97 L263 N265 A266 Q272 I273	Y97-Q269 HydrophobicContact CD1-CG 4.13Å; Y97-Q269 HydrophobicContact CD2-CB 4.12Å; Y97-Q269 HydrophobicContact CG-CB 3.96Å; Y97-Q269 HydrophobicContact CG-CG 3.9Å; L263-Q269 HydrophobicContact CB-CG 3.87Å; L263-Q269 PolarHBondContact O-NE2 2.91Å; N265-Q269 PolarHBondContact O-N 2.73Å; A266-Q269 PolarHBondContact O-N 3.28Å; Q269-Q272 PolarHBondContact O-N 2.84Å; Q269-I273 WeakPolarHBondContact O-CG1 3.32Å; Q269-I273 PolarHBondContact O-N 2.69Å
270	A	75.4	Confident	77.2	Confident	21 Å²	21	41.4 Å²	41.4	17%	0.174	23%	0.227	C	C	.	.	H	α-helix	trans	-66.9	-36.4	177.8	0	0	0	0	0	112.8	A266 R274	A266-A270 WeakPolarHBondContact O-CB 3.26Å; A266-A270 PolarHBondContact O-N 2.89Å; A270-R274 WeakPolarHBondContact O-CB 3.36Å; A270-R274 VanDerWaalsContact O-CG 3.29Å; A270-R274 WeakPolarHBondContact O-CG 3.48Å; A270-R274 PolarHBondContact O-N 3.33Å; A270-R274 PolarHBondContact O-NE 3.49Å
271	A	74.4	Confident	77.6	Confident	13 Å²	13	41.9 Å²	41.9	11%	0.107	22%	0.224	C	C	.	.	H	α-helix	trans	-66.3	-35.2	171.8	0	0	0	0	0	112.5	D267 E268 R275	D267-A271 VanDerWaalsContact O-CB 3.3Å; D267-A271 WeakPolarHBondContact O-CB 3.39Å; D267-A271 PolarHBondContact O-N 3.16Å; E268-A271 PolarHBondContact O-N 2.97Å; A271-R275 WeakPolarHBondContact O-CG 3.46Å; A271-R275 PolarHBondContact O-N 2.75Å
272	Q	79.6	Confident	77.7	Confident	37 Å²	37	46.6 Å²	46.6	17%	0.173	25%	0.246	C	C	.	.	H	α-helix	trans	-67.5	-46.3	175.9	-178.5	56.5	26	0	0	111.9	Y97 L263 E268 Q269 R275 E276	Y97-Q272 HydrophobicContact CE2-CB 4.33Å; Y97-Q272 HydrophobicContact CE2-CG 4.13Å; Y97-Q272 WeakPolarHBondContact OH-CG 3.29Å; L263-Q272 HydrophobicContact CD1-CB 4.01Å; L263-Q272 HydrophobicContact CD1-CG 4.43Å; E268-Q272 WeakPolarHBondContact O-CB 3.34Å; E268-Q272 PolarHBondContact O-N 3.48Å; Q269-Q272 PolarHBondContact O-N 2.84Å; Q272-R275 PolarHBondContact O-N 2.78Å; Q272-E276 PolarHBondContact NE2-OE1 3.41Å; Q272-E276 PolarHBondContact O-N 3.46Å
273	I	82.5	Confident	78.1	Confident	4 Å²	4	47.5 Å²	47.5	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-63.1	-45.3	176.5	-61.8	163.4	0	0	0	110.6	Y97 F99 Q269 R275 E276 L277 L320	Y97-I273 HydrophobicContact CD2-CD1 3.76Å; Y97-I273 HydrophobicContact CD2-CG1 3.77Å; Y97-I273 HydrophobicContact CE2-CD1 4.31Å; Y97-I273 HydrophobicContact CE2-CG1 3.8Å; F99-I273 HydrophobicContact CB-CD1 4.1Å; F99-I273 HydrophobicContact CD1-CD1 3.48Å; F99-I273 VanDerWaalsContact CD1-CD1 3.48Å; F99-I273 HydrophobicContact CD1-CG1 4.19Å; F99-I273 HydrophobicContact CD1-CG2 4.09Å; F99-I273 HydrophobicContact CD2-CG2 4.48Å; F99-I273 HydrophobicContact CE1-CD1 4.08Å; F99-I273 HydrophobicContact CE1-CG1 4.3Å; F99-I273 HydrophobicContact CE1-CG2 3.66Å; F99-I273 HydrophobicContact CE2-CG2 4.09Å; F99-I273 HydrophobicContact CG-CD1 3.89Å; F99-I273 HydrophobicContact CG-CG2 4.48Å; F99-I273 HydrophobicContact CZ-CG2 3.66Å; Q269-I273 WeakPolarHBondContact O-CG1 3.32Å; Q269-I273 PolarHBondContact O-N 2.69Å; I273-R275 VanDerWaalsContact C-N 3.28Å; I273-R275 PolarHBondContact O-N 2.98Å; I273-E276 PolarHBondContact O-N 2.92Å; I273-L277 HydrophobicContact CG2-CD1 3.84Å; I273-L277 HydrophobicContact CG2-CG 4.05Å; I273-L277 WeakPolarHBondContact O-CG 3.34Å; I273-L277 PolarHBondContact O-N 2.95Å; I273-L320 HydrophobicContact CB-CD1 4.44Å; I273-L320 HydrophobicContact CB-CD2 3.79Å; I273-L320 HydrophobicContact CD1-CD1 3.53Å; I273-L320 HydrophobicContact CD1-CD2 4.41Å; I273-L320 HydrophobicContact CG2-CD1 4.37Å; I273-L320 HydrophobicContact CG2-CD2 3.68Å
274	R	79.4	Confident	78.5	Confident	33 Å²	33	45.3 Å²	45.3	13%	0.125	24%	0.241	C	C	.	.	H	α-helix	trans	-52.9	-43.2	177.4	-81.5	-176.6	-73.7	166.3	3	112.5	A270 L277 D278 L320 Y518 R587	A270-R274 WeakPolarHBondContact O-CB 3.36Å; A270-R274 VanDerWaalsContact O-CG 3.29Å; A270-R274 WeakPolarHBondContact O-CG 3.48Å; A270-R274 PolarHBondContact O-N 3.33Å; A270-R274 PolarHBondContact O-NE 3.49Å; R274-L277 PolarHBondContact O-N 3.47Å; R274-D278 WeakPolarHBondContact O-CB 3.39Å; R274-D278 PolarHBondContact O-N 3.5Å; R274-L320 HydrophobicContact CG-CD2 4.23Å; R274-Y518 HydrophobicContact CG-CE1 4Å; R274-R587 PolarHBondContact NH2-O 2.81Å
275	R	80.6	Confident	79.5	Confident	74 Å²	74	39.6 Å²	39.6	28%	0.279	21%	0.21	S	C	.	.	H	α-helix	trans	-70	-31.6	177.5	-66.4	-174.3	-56.3	160.6	-0.7	113.8	A271 Q272 I273 G279 Y586 G590 Q591 S592	A271-R275 WeakPolarHBondContact O-CG 3.46Å; A271-R275 PolarHBondContact O-N 2.75Å; Q272-R275 PolarHBondContact O-N 2.78Å; I273-R275 VanDerWaalsContact C-N 3.28Å; I273-R275 PolarHBondContact O-N 2.98Å; R275-G279 PolarHBondContact O-N 2.94Å; R275-G279 VanDerWaalsContact O-N 3.14Å; R275-Y586 PolarHBondContact NH1-OH 2.83Å; R275-Y586 VanDerWaalsContact NH1-OH 3.11Å; R275-G590 WeakPolarHBondContact CG-O 3.33Å; R275-Q591 WeakPolarHBondContact CD-O 3.32Å; R275-S592 WeakPolarHBondContact CD-O 3.4Å; R275-S592 PolarHBondContact NH1-O 2.98Å
276	E	84.7	Confident	80.1	Confident	11 Å²	11	42.3 Å²	42.3	5%	0.051	22%	0.219	C	C	.	.	H	α-helix	trans	-72.8	-33.4	173.6	-69.4	-179.1	-169	0	0	111.8	R93 Q272 I273 R280 P638 R683 Y684	R93-E276 IonicContact CZ-OE1 2.7Å; R93-E276 IonicContact NH1-OE1 3.82Å; R93-E276 PolarHBondContact NH1-OE1 3.07Å; Q272-E276 PolarHBondContact NE2-OE1 3.41Å; Q272-E276 PolarHBondContact O-N 3.46Å; I273-E276 PolarHBondContact O-N 2.92Å; E276-R280 PolarHBondContact O-N 2.82Å; E276-P638 HydrophobicContact CG-CG 4.28Å; E276-R683 VanDerWaalsContact CD-NH2 3.33Å; E276-R683 IonicContact OE1-NH2 3.76Å; E276-R683 PolarHBondContact OE1-NH2 2.73Å; E276-R683 IonicContact OE2-CZ 2.84Å; E276-R683 VanDerWaalsContact OE2-CZ 3.22Å; E276-R683 IonicContact OE2-NE 2.7Å; E276-R683 PolarHBondContact OE2-NE 2.92Å; E276-R683 IonicContact OE2-NH2 2.64Å; E276-R683 PolarHBondContact OE2-NH2 3.04Å; E276-Y684 PolarHBondContact OE2-OH 3.04Å
277	L	85.5	Confident	80.9	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.01	20%	0.204	C	C	.	.	H	α-helix	trans	-75.3	-43.5	174.7	-67.8	-179.7	0	0	0	113	F99 I273 R274 G279 R280 L281 V313 L316 M317	F99-L277 HydrophobicContact CE2-CD1 4.45Å; I273-L277 HydrophobicContact CG2-CD1 3.84Å; I273-L277 HydrophobicContact CG2-CG 4.05Å; I273-L277 WeakPolarHBondContact O-CG 3.34Å; I273-L277 PolarHBondContact O-N 2.95Å; R274-L277 PolarHBondContact O-N 3.47Å; L277-G279 VanDerWaalsContact C-N 3.33Å; L277-G279 PolarHBondContact O-N 3.26Å; L277-R280 WeakPolarHBondContact O-CB 3.25Å; L277-R280 PolarHBondContact O-N 3.43Å; L277-R280 VanDerWaalsContact O-N 3.1Å; L277-L281 PolarHBondContact O-N 3.48Å; L277-V313 HydrophobicContact CB-CG1 4.18Å; L277-L316 HydrophobicContact CD1-CB 4.01Å; L277-L316 HydrophobicContact CD2-CB 3.97Å; L277-L316 HydrophobicContact CD2-CD1 4.08Å; L277-M317 HydrophobicContact CB-CG 4.48Å; L277-M317 HydrophobicContact CD1-CG 3.77Å
278	D	82.3	Confident	81.7	Confident	58 Å²	58	41.6 Å²	41.6	31%	0.31	21%	0.211	S	C	.	.	H	α-helix	trans	-60.2	-41.7	173.7	172.7	52.3	0	0	0	111.5	R274 R280 L281 Q282	R274-D278 WeakPolarHBondContact O-CB 3.39Å; R274-D278 PolarHBondContact O-N 3.5Å; D278-R280 PolarHBondContact O-N 3.25Å; D278-L281 WeakPolarHBondContact O-CB 3.35Å; D278-L281 PolarHBondContact O-N 3.07Å; D278-Q282 WeakPolarHBondContact O-CG 3.42Å; D278-Q282 PolarHBondContact O-N 3.31Å; D278-Q282 PolarHBondContact OD1-NE2 3.16Å; D278-Q282 PolarHBondContact OD2-NE2 3.08Å
279	G	83.3	Confident	82.3	Confident	16 Å²	16	46.3 Å²	46.3	17%	0.165	23%	0.231	C	C	.	.	H	α-helix	trans	-57.2	-35.5	172.8	0	0	0	0	0	113.7	R275 L277 L283	R275-G279 PolarHBondContact O-N 2.94Å; R275-G279 VanDerWaalsContact O-N 3.14Å; L277-G279 VanDerWaalsContact C-N 3.33Å; L277-G279 PolarHBondContact O-N 3.26Å; G279-L283 WeakPolarHBondContact O-CB 3.43Å; G279-L283 PolarHBondContact O-N 3.28Å; G279-L283 VanDerWaalsContact O-N 3.13Å
280	R	85.1	Confident	82.6	Confident	27 Å²	27	48.2 Å²	48.2	10%	0.102	24%	0.239	C	C	.	.	H	α-helix	trans	-71.7	-38.3	173.3	-73.5	175.4	55.7	-167.8	-6.9	112.2	E276 L277 D278 L283 A284 V313 A682 R683	E276-R280 PolarHBondContact O-N 2.82Å; L277-R280 WeakPolarHBondContact O-CB 3.25Å; L277-R280 PolarHBondContact O-N 3.43Å; L277-R280 VanDerWaalsContact O-N 3.1Å; D278-R280 PolarHBondContact O-N 3.25Å; R280-L283 PolarHBondContact O-N 2.98Å; R280-A284 PolarHBondContact O-N 3.25Å; R280-V313 HydrophobicContact CB-CG2 4.04Å; R280-A682 PolarHBondContact NH1-O 2.71Å; R280-R683 VanDerWaalsContact NH1-C 3.3Å; R280-R683 PolarHBondContact NH1-O 3.33Å
281	L	84.9	Confident	82.7	Confident	50 Å²	50	57.1 Å²	57.1	26%	0.262	27%	0.268	S	S	.	.	H	α-helix	trans	-63.3	-47.1	175.8	-163.8	75.2	0	0	0	111	L277 D278 L283 A284 D285 R310 V313	L277-L281 PolarHBondContact O-N 3.48Å; D278-L281 WeakPolarHBondContact O-CB 3.35Å; D278-L281 PolarHBondContact O-N 3.07Å; L281-L283 VanDerWaalsContact C-N 3.27Å; L281-L283 PolarHBondContact O-N 2.95Å; L281-A284 PolarHBondContact O-N 2.98Å; L281-D285 PolarHBondContact O-N 2.9Å; L281-R310 HydrophobicContact CD1-CG 4.01Å; L281-V313 HydrophobicContact CB-CG1 4.47Å; L281-V313 HydrophobicContact CD1-CG1 4.33Å
282	Q	84.1	Confident	82.7	Confident	107 Å²	107	63 Å²	63	50%	0.5	29%	0.291	S	S	.	.	H	α-helix	trans	-59.2	-36.5	174.1	-68	179.6	28.5	0	0	112.5	D278 K286	D278-Q282 WeakPolarHBondContact O-CG 3.42Å; D278-Q282 PolarHBondContact O-N 3.31Å; D278-Q282 PolarHBondContact OD1-NE2 3.16Å; D278-Q282 PolarHBondContact OD2-NE2 3.08Å; Q282-K286 VanDerWaalsContact O-CB 3.3Å; Q282-K286 WeakPolarHBondContact O-CB 3.26Å; Q282-K286 PolarHBondContact O-N 3.07Å
283	L	83.3	Confident	82.6	Confident	71 Å²	71	63.3 Å²	63.3	37%	0.372	29%	0.292	S	S	.	.	H	α-helix	trans	-68.5	-42	175.6	-175.9	62.3	0	0	0	112	G279 R280 L281 K286 M287	G279-L283 WeakPolarHBondContact O-CB 3.43Å; G279-L283 PolarHBondContact O-N 3.28Å; G279-L283 VanDerWaalsContact O-N 3.13Å; R280-L283 PolarHBondContact O-N 2.98Å; L281-L283 VanDerWaalsContact C-N 3.27Å; L281-L283 PolarHBondContact O-N 2.95Å; L283-K286 PolarHBondContact O-N 3.21Å; L283-M287 HydrophobicContact CG-CE 4.36Å; L283-M287 WeakPolarHBondContact O-CG 3.45Å; L283-M287 PolarHBondContact O-N 3.21Å
284	A	84.9	Confident	82.4	Confident	3 Å²	3	65.9 Å²	65.9	3%	0.025	31%	0.309	C	S	.	.	H	α-helix	trans	-61.9	-45.5	174.3	0	0	0	0	0	111.7	R280 L281 K286 M287 A288 L309	R280-A284 PolarHBondContact O-N 3.25Å; L281-A284 PolarHBondContact O-N 2.98Å; A284-K286 VanDerWaalsContact C-N 3.3Å; A284-K286 PolarHBondContact O-N 3.27Å; A284-M287 PolarHBondContact O-N 2.78Å; A284-A288 PolarHBondContact O-N 3.11Å; A284-L309 HydrophobicContact CB-CB 4.29Å; A284-L309 HydrophobicContact CB-CD1 4.23Å
285	D	84.8	Confident	82.6	Confident	46 Å²	46	72.4 Å²	72.4	25%	0.246	34%	0.339	C	S	.	.	H	α-helix	trans	-61.2	-37.1	174.2	-93.2	22.6	0	0	0	112.8	L281 K289 R310	L281-D285 PolarHBondContact O-N 2.9Å; D285-K289 WeakPolarHBondContact O-CB 3.42Å; D285-K289 WeakPolarHBondContact O-CD 3.35Å; D285-K289 WeakPolarHBondContact O-CG 3.28Å; D285-K289 PolarHBondContact O-N 3.47Å; D285-K289 IonicContact OD2-NZ 3.48Å; D285-R310 IonicContact OD1-CZ 3.68Å; D285-R310 IonicContact OD1-NE 3.32Å; D285-R310 PolarHBondContact OD1-NE 3.15Å; D285-R310 IonicContact OD1-NH2 3.49Å; D285-R310 PolarHBondContact OD1-NH2 3.26Å
286	K	84.1	Confident	82.8	Confident	114 Å²	114	69.8 Å²	69.8	50%	0.496	33%	0.329	S	S	.	.	H	α-helix	trans	-67	-42.9	174.4	-174.7	179.8	177.6	-176.9	0	111.7	Q282 L283 A284 A288 K289 E290	Q282-K286 VanDerWaalsContact O-CB 3.3Å; Q282-K286 WeakPolarHBondContact O-CB 3.26Å; Q282-K286 PolarHBondContact O-N 3.07Å; L283-K286 PolarHBondContact O-N 3.21Å; A284-K286 VanDerWaalsContact C-N 3.3Å; A284-K286 PolarHBondContact O-N 3.27Å; K286-A288 VanDerWaalsContact C-N 3.35Å; K286-K289 PolarHBondContact O-N 2.97Å; K286-E290 WeakPolarHBondContact CE-OE1 3.23Å; K286-E290 HydrophobicContact CG-CG 4.35Å; K286-E290 IonicContact NZ-OE1 2.83Å; K286-E290 WeakPolarHBondContact O-CB 3.34Å; K286-E290 PolarHBondContact O-N 2.93Å
287	M	83.5	Confident	82.7	Confident	41 Å²	41	73.3 Å²	73.3	20%	0.202	35%	0.348	C	S	.	.	H	α-helix	trans	-61.8	-42.6	175.3	-71.7	-174.7	-65.8	0	0	111.5	L283 A284 K289 E290 R291 K292 I306 L309	L283-M287 HydrophobicContact CG-CE 4.36Å; L283-M287 WeakPolarHBondContact O-CG 3.45Å; L283-M287 PolarHBondContact O-N 3.21Å; A284-M287 PolarHBondContact O-N 2.78Å; M287-K289 PolarHBondContact O-N 3.43Å; M287-E290 PolarHBondContact O-N 3.33Å; M287-R291 WeakPolarHBondContact O-CA 3.31Å; M287-R291 PolarHBondContact O-N 3.27Å; M287-K292 PolarHBondContact O-N 2.96Å; M287-I306 HydrophobicContact CB-CD1 4.14Å; M287-L309 HydrophobicContact CE-CD1 3.6Å
288	A	83.7	Confident	82.4	Confident	36 Å²	36	75 Å²	75	30%	0.298	36%	0.361	S	S	.	.	H	α-helix	trans	-61.3	-42	174.4	0	0	0	0	0	112.9	A284 K286 I306	A284-A288 PolarHBondContact O-N 3.11Å; K286-A288 VanDerWaalsContact C-N 3.35Å; A288-I306 HydrophobicContact CB-CD1 4.49Å; A288-I306 HydrophobicContact CB-CG1 4.21Å; A288-I306 HydrophobicContact CB-CG2 4.21Å
289	K	83.4	Confident	82.2	Confident	160 Å²	160	80.5 Å²	80.5	70%	0.696	38%	0.383	S	S	*	.	H	α-helix	trans	-70.9	-39.9	178.2	-72.7	162.6	-173.2	161.9	0	112.9	D285 K286 M287	D285-K289 WeakPolarHBondContact O-CB 3.42Å; D285-K289 WeakPolarHBondContact O-CD 3.35Å; D285-K289 WeakPolarHBondContact O-CG 3.28Å; D285-K289 PolarHBondContact O-N 3.47Å; D285-K289 IonicContact OD2-NZ 3.48Å; K286-K289 PolarHBondContact O-N 2.97Å; M287-K289 PolarHBondContact O-N 3.43Å
290	E	84.4	Confident	82	Confident	88 Å²	88	84.1 Å²	84.1	41%	0.411	40%	0.398	S	S	.	.	H	α-helix	trans	-85.3	-9.8	179.9	-67.6	-171.3	-169.1	0	0	114	K286 M287 K292	K286-E290 WeakPolarHBondContact CE-OE1 3.23Å; K286-E290 HydrophobicContact CG-CG 4.35Å; K286-E290 IonicContact NZ-OE1 2.83Å; K286-E290 WeakPolarHBondContact O-CB 3.34Å; K286-E290 PolarHBondContact O-N 2.93Å; M287-E290 PolarHBondContact O-N 3.33Å; E290-K292 HydrophobicContact CB-CD 4.14Å; E290-K292 HydrophobicContact CB-CG 4.14Å; E290-K292 PolarHBondContact O-N 2.87Å; E290-K292 WeakPolarHBondContact OE2-CD 3.4Å; E290-K292 VanDerWaalsContact OE2-CE 3.28Å; E290-K292 WeakPolarHBondContact OE2-CE 3.31Å; E290-K292 IonicContact OE2-NZ 2.82Å; E290-K292 PolarHBondContact OE2-NZ 2.93Å
291	R	77.6	Confident	81.9	Confident	209 Å²	209	84.4 Å²	84.4	79%	0.789	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	38.8	-172.6	-62	-173.3	176.7	-170.3	-2	113.6	M287 F293	M287-R291 WeakPolarHBondContact O-CA 3.31Å; M287-R291 PolarHBondContact O-N 3.27Å; R291-F293 HydrophobicContact CB-CE2 4.06Å; R291-F293 HydrophobicContact CB-CZ 4.5Å; R291-F293 HydrophobicContact CG-CE2 4.35Å
292	K	74.6	Confident	81.8	Confident	135 Å²	135	85.1 Å²	85.1	59%	0.587	40%	0.403	S	S	*	.			trans	-102	94.1	175.9	-70.1	177.2	-171.3	163.3	0	108.8	M287 E290	M287-K292 PolarHBondContact O-N 2.96Å; E290-K292 HydrophobicContact CB-CD 4.14Å; E290-K292 HydrophobicContact CB-CG 4.14Å; E290-K292 PolarHBondContact O-N 2.87Å; E290-K292 WeakPolarHBondContact OE2-CD 3.4Å; E290-K292 VanDerWaalsContact OE2-CE 3.28Å; E290-K292 WeakPolarHBondContact OE2-CE 3.31Å; E290-K292 IonicContact OE2-NZ 2.82Å; E290-K292 PolarHBondContact OE2-NZ 2.93Å
293	F	77.5	Confident	81.6	Confident	44 Å²	44	85.1 Å²	85.1	19%	0.193	41%	0.407	C	S	.	.			trans	-113.2	154.7	-178.6	-51.4	-58.9	0	0	0	110.9	R291 F296 E302 I306	R291-F293 HydrophobicContact CB-CE2 4.06Å; R291-F293 HydrophobicContact CB-CZ 4.5Å; R291-F293 HydrophobicContact CG-CE2 4.35Å; F293-F296 HydrophobicContact CB-CE2 4.24Å; F293-E302 HydrophobicContact CB-CG 4.43Å; F293-E302 HydrophobicContact CD2-CB 3.82Å; F293-E302 HydrophobicContact CD2-CG 3.94Å; F293-E302 WeakPolarHBondContact CD2-OE2 3.42Å; F293-E302 HydrophobicContact CE2-CB 4.07Å; F293-E302 HydrophobicContact CG-CB 4.28Å; F293-E302 HydrophobicContact CG-CG 4.39Å; F293-I306 HydrophobicContact CD1-CD1 4.43Å; F293-I306 HydrophobicContact CE1-CD1 4Å; F293-I306 HydrophobicContact CE1-CG1 3.91Å
294	P	78.9	Confident	81.6	Confident	58 Å²	58	84.6 Å²	84.6	38%	0.377	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-53.8	157.1	157.9	-22.6	33.9	0	0	0	111.2	F296 Y305	P294-F296 HydrophobicContact CB-CE2 4.06Å; P294-F296 HydrophobicContact CB-CZ 4.02Å; P294-F296 HydrophobicContact CG-CE2 4.29Å; P294-F296 HydrophobicContact CG-CZ 4.11Å; P294-F296 WeakPolarHBondContact O-CD2 3.4Å; P294-F296 WeakPolarHBondContact O-CE2 3.26Å; P294-F296 PolarHBondContact O-N 3.23Å; P294-Y305 HydrophobicContact CG-CE1 4.24Å
295	K	82.5	Confident	81.6	Confident	171 Å²	171	85.8 Å²	85.8	74%	0.743	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-73.6	119.4	172	-66.8	178.8	-177.3	172.7	0	109.3	S737 V738	K295-S737 CarbonylContact O-C 3.54Å; K295-S737 VanDerWaalsContact O-CA 3.26Å; K295-S737 WeakPolarHBondContact O-CA 3.23Å; K295-S737 WeakPolarHBondContact O-CB 3.27Å; K295-V738 HydrophobicContact CB-CB 4.2Å; K295-V738 HydrophobicContact CB-CG2 3.98Å; K295-V738 PolarHBondContact O-N 3.25Å
296	F	86.1	Confident	81.6	Confident	19 Å²	19	84 Å²	84	8%	0.083	40%	0.397	C	S	.	.	B	Isolated β-bridge	trans	-101.7	160.1	174.3	-65.2	-79.8	0	0	0	112.2	F293 P294 A298 M301 E302 Y305 V736	F293-F296 HydrophobicContact CB-CE2 4.24Å; P294-F296 HydrophobicContact CB-CE2 4.06Å; P294-F296 HydrophobicContact CB-CZ 4.02Å; P294-F296 HydrophobicContact CG-CE2 4.29Å; P294-F296 HydrophobicContact CG-CZ 4.11Å; P294-F296 WeakPolarHBondContact O-CD2 3.4Å; P294-F296 WeakPolarHBondContact O-CE2 3.26Å; P294-F296 PolarHBondContact O-N 3.23Å; F296-A298 VanDerWaalsContact C-N 3.29Å; F296-A298 PolarHBondContact O-N 3.06Å; F296-M301 HydrophobicContact CB-CB 3.78Å; F296-M301 HydrophobicContact CB-SD 4.31Å; F296-M301 HydrophobicContact CD1-CB 4.12Å; F296-M301 HydrophobicContact CG-CB 3.93Å; F296-E302 HydrophobicContact CD2-CG 4.04Å; F296-Y305 HydrophobicContact CE1-CD2 4.2Å; F296-Y305 HydrophobicContact CE1-CG 4.21Å; F296-Y305 HydrophobicContact CE2-CD1 4.07Å; F296-Y305 HydrophobicContact CE2-CG 4.05Å; F296-Y305 AromaticContact CZ-CD1 3.7Å; F296-Y305 HydrophobicContact CZ-CD1 3.7Å; F296-Y305 AromaticContact CZ-CD2 3.73Å; F296-Y305 HydrophobicContact CZ-CD2 3.73Å; F296-Y305 HydrophobicContact CZ-CE1 4.27Å; F296-Y305 HydrophobicContact CZ-CE2 4.32Å; F296-Y305 AromaticContact CZ-CG 3.4Å; F296-Y305 HydrophobicContact CZ-CG 3.4Å; F296-V736 WeakPolarHBondContact CD1-O 3.09Å
297	I	81.3	Confident	81.7	Confident	85 Å²	85	83.6 Å²	83.6	44%	0.436	40%	0.397	S	S	.	.	S	Bend	trans	-64	-35.8	178.3	-63.9	177.3	0	0	0	111.5	M301 V736 K741	I297-M301 HydrophobicContact CB-SD 4.42Å; I297-V736 HydrophobicContact CD1-CB 3.88Å; I297-V736 HydrophobicContact CD1-CG1 3.62Å; I297-V736 HydrophobicContact CG1-CB 4.48Å; I297-V736 HydrophobicContact CG1-CG1 4.44Å; I297-V736 PolarHBondContact N-O 3.45Å; I297-V736 VanDerWaalsContact N-O 3.14Å; I297-K741 HydrophobicContact CD1-CB 4.19Å; I297-K741 HydrophobicContact CD1-CD 3.75Å
298	A	80.9	Confident	81.7	Confident	36 Å²	36	83.5 Å²	83.5	30%	0.298	40%	0.396	S	S	.	.	S	Bend	trans	-134.1	149.1	178.7	0	0	0	0	0	110.9	F296 D300 M301	F296-A298 VanDerWaalsContact C-N 3.29Å; F296-A298 PolarHBondContact O-N 3.06Å; A298-D300 WeakPolarHBondContact CB-OD1 3.2Å; A298-D300 PolarHBondContact O-N 3.49Å; A298-M301 HydrophobicContact CB-CE 4.39Å; A298-M301 HydrophobicContact CB-CG 4.37Å; A298-M301 HydrophobicContact CB-SD 4.42Å; A298-M301 VanDerWaalsContact O-CB 3.28Å; A298-M301 WeakPolarHBondContact O-CB 3.3Å; A298-M301 PolarHBondContact O-N 2.93Å
299	K	76.9	Confident	81.8	Confident	174 Å²	174	83.1 Å²	83.1	76%	0.757	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-25.5	-168	-67.7	-172.8	175.4	-177	0	114.4	M301 E302	K299-M301 PolarHBondContact O-N 3.44Å; K299-E302 WeakPolarHBondContact O-CB 3.48Å; K299-E302 PolarHBondContact O-N 2.86Å
300	D	79.8	Confident	82	Confident	93 Å²	93	80.2 Å²	80.2	50%	0.497	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-29.6	170.5	54.2	-51.5	0	0	0	112.2	A298 E302 N303 M304	A298-D300 WeakPolarHBondContact CB-OD1 3.2Å; A298-D300 PolarHBondContact O-N 3.49Å; D300-E302 PolarHBondContact O-N 3.4Å; D300-N303 PolarHBondContact O-N 3.06Å; D300-M304 HydrophobicContact CB-CE 4.22Å; D300-M304 PolarHBondContact O-N 2.98Å; D300-M304 VanDerWaalsContact OD2-CE 3.29Å; D300-M304 WeakPolarHBondContact OD2-CE 3.3Å
301	M	82.3	Confident	82	Confident	32 Å²	32	79.5 Å²	79.5	16%	0.158	38%	0.379	C	S	.	.	H	α-helix	trans	-64.6	-22.2	175.5	-59.5	-179.6	172.8	0	0	113.5	F296 I297 A298 K299 N303 M304 Y305 T735	F296-M301 HydrophobicContact CB-CB 3.78Å; F296-M301 HydrophobicContact CB-SD 4.31Å; F296-M301 HydrophobicContact CD1-CB 4.12Å; F296-M301 HydrophobicContact CG-CB 3.93Å; I297-M301 HydrophobicContact CB-SD 4.42Å; A298-M301 HydrophobicContact CB-CE 4.39Å; A298-M301 HydrophobicContact CB-CG 4.37Å; A298-M301 HydrophobicContact CB-SD 4.42Å; A298-M301 VanDerWaalsContact O-CB 3.28Å; A298-M301 WeakPolarHBondContact O-CB 3.3Å; A298-M301 PolarHBondContact O-N 2.93Å; K299-M301 PolarHBondContact O-N 3.44Å; M301-N303 VanDerWaalsContact C-N 3.3Å; M301-N303 PolarHBondContact O-N 2.75Å; M301-M304 HydrophobicContact CB-CE 4.44Å; M301-M304 HydrophobicContact CG-CE 3.95Å; M301-M304 PolarHBondContact O-N 3Å; M301-Y305 VanDerWaalsContact O-CB 3.29Å; M301-Y305 WeakPolarHBondContact O-CB 3.48Å; M301-Y305 PolarHBondContact O-N 3.44Å; M301-T735 HydrophobicContact CB-CG2 4.07Å; M301-T735 WeakPolarHBondContact O-CG2 3.32Å
302	E	82.4	Confident	82.4	Confident	65 Å²	65	71.9 Å²	71.9	30%	0.304	36%	0.358	S	S	.	.	H	α-helix	trans	-60.8	-39.5	176.9	-66.9	174.2	-153.9	0	0	111.7	F293 F296 K299 D300	F293-E302 HydrophobicContact CB-CG 4.43Å; F293-E302 HydrophobicContact CD2-CB 3.82Å; F293-E302 HydrophobicContact CD2-CG 3.94Å; F293-E302 WeakPolarHBondContact CD2-OE2 3.42Å; F293-E302 HydrophobicContact CE2-CB 4.07Å; F293-E302 HydrophobicContact CG-CB 4.28Å; F293-E302 HydrophobicContact CG-CG 4.39Å; F296-E302 HydrophobicContact CD2-CG 4.04Å; K299-E302 WeakPolarHBondContact O-CB 3.48Å; K299-E302 PolarHBondContact O-N 2.86Å; D300-E302 PolarHBondContact O-N 3.4Å
303	N	80.9	Confident	82.9	Confident	108 Å²	108	65.7 Å²	65.7	58%	0.578	33%	0.331	S	S	*	.	H	α-helix	trans	-77.9	-46.1	176.5	-66.7	-36.1	0	0	0	111.2	D300 M301 Y305 I306 E307	D300-N303 PolarHBondContact O-N 3.06Å; M301-N303 VanDerWaalsContact C-N 3.3Å; M301-N303 PolarHBondContact O-N 2.75Å; N303-Y305 PolarHBondContact O-N 3.48Å; N303-Y305 VanDerWaalsContact O-N 3.11Å; N303-I306 PolarHBondContact O-N 2.86Å; N303-E307 PolarHBondContact O-N 3.07Å
304	M	82.9	Confident	83.3	Confident	59 Å²	59	67.5 Å²	67.5	29%	0.291	34%	0.343	S	S	.	.	H	α-helix	trans	-59.1	-25	177.8	-67.1	-171.3	-77.9	0	0	112.3	D300 M301 E307 E308 I733 T735	D300-M304 HydrophobicContact CB-CE 4.22Å; D300-M304 PolarHBondContact O-N 2.98Å; D300-M304 VanDerWaalsContact OD2-CE 3.29Å; D300-M304 WeakPolarHBondContact OD2-CE 3.3Å; M301-M304 HydrophobicContact CB-CE 4.44Å; M301-M304 HydrophobicContact CG-CE 3.95Å; M301-M304 PolarHBondContact O-N 3Å; M304-E307 PolarHBondContact O-N 2.84Å; M304-E308 WeakPolarHBondContact O-CB 3.46Å; M304-E308 PolarHBondContact O-N 2.69Å; M304-I733 HydrophobicContact CB-CG2 4.4Å; M304-T735 HydrophobicContact CB-CG2 3.73Å
305	Y	84.6	Confident	83.6	Confident	28 Å²	28	69.7 Å²	69.7	11%	0.11	35%	0.351	C	S	.	.	H	α-helix	trans	-70.7	-38.1	176.6	178.4	-118.7	0	0	0	112.4	P294 F296 M301 N303 E307 E308 L309	P294-Y305 HydrophobicContact CG-CE1 4.24Å; F296-Y305 HydrophobicContact CE1-CD2 4.2Å; F296-Y305 HydrophobicContact CE1-CG 4.21Å; F296-Y305 HydrophobicContact CE2-CD1 4.07Å; F296-Y305 HydrophobicContact CE2-CG 4.05Å; F296-Y305 AromaticContact CZ-CD1 3.7Å; F296-Y305 HydrophobicContact CZ-CD1 3.7Å; F296-Y305 AromaticContact CZ-CD2 3.73Å; F296-Y305 HydrophobicContact CZ-CD2 3.73Å; F296-Y305 HydrophobicContact CZ-CE1 4.27Å; F296-Y305 HydrophobicContact CZ-CE2 4.32Å; F296-Y305 AromaticContact CZ-CG 3.4Å; F296-Y305 HydrophobicContact CZ-CG 3.4Å; M301-Y305 VanDerWaalsContact O-CB 3.29Å; M301-Y305 WeakPolarHBondContact O-CB 3.48Å; M301-Y305 PolarHBondContact O-N 3.44Å; N303-Y305 PolarHBondContact O-N 3.48Å; N303-Y305 VanDerWaalsContact O-N 3.11Å; Y305-E307 VanDerWaalsContact C-N 3.3Å; Y305-E308 PolarHBondContact O-N 3.27Å; Y305-L309 HydrophobicContact CD1-CD1 4.17Å; Y305-L309 HydrophobicContact CD2-CG 4.5Å; Y305-L309 HydrophobicContact CE1-CD1 3.65Å; Y305-L309 HydrophobicContact CE1-CG 4.36Å; Y305-L309 HydrophobicContact CE2-CD1 4.26Å; Y305-L309 HydrophobicContact CE2-CD2 4.33Å; Y305-L309 HydrophobicContact CE2-CG 4.09Å; Y305-L309 WeakPolarHBondContact O-CB 3.48Å; Y305-L309 WeakPolarHBondContact O-CG 3.38Å; Y305-L309 PolarHBondContact O-N 3.07Å
306	I	85.5	Confident	83.8	Confident	8 Å²	8	61.8 Å²	61.8	4%	0.041	32%	0.317	C	S	.	.	H	α-helix	trans	-68.9	-33.8	173.9	-60.6	-55.7	0	0	0	110.5	M287 A288 F293 N303 L309 R310	M287-I306 HydrophobicContact CB-CD1 4.14Å; A288-I306 HydrophobicContact CB-CD1 4.49Å; A288-I306 HydrophobicContact CB-CG1 4.21Å; A288-I306 HydrophobicContact CB-CG2 4.21Å; F293-I306 HydrophobicContact CD1-CD1 4.43Å; F293-I306 HydrophobicContact CE1-CD1 4Å; F293-I306 HydrophobicContact CE1-CG1 3.91Å; N303-I306 PolarHBondContact O-N 2.86Å; I306-L309 HydrophobicContact CD1-CD1 4.39Å; I306-R310 WeakPolarHBondContact O-CB 3.38Å; I306-R310 VanDerWaalsContact O-CG 3.24Å; I306-R310 WeakPolarHBondContact O-CG 3.41Å; I306-R310 PolarHBondContact O-N 2.58Å
307	E	84.8	Confident	83.6	Confident	107 Å²	107	63.5 Å²	63.5	50%	0.5	33%	0.326	S	S	.	.	H	α-helix	trans	-69.9	-41.7	172.8	-66.2	172.3	178.7	0	0	112.1	N303 M304 Y305 L309 R310 S311	N303-E307 PolarHBondContact O-N 3.07Å; M304-E307 PolarHBondContact O-N 2.84Å; Y305-E307 VanDerWaalsContact C-N 3.3Å; E307-L309 PolarHBondContact O-N 3.15Å; E307-R310 PolarHBondContact O-N 2.83Å; E307-S311 WeakPolarHBondContact O-CB 3.22Å; E307-S311 PolarHBondContact O-N 3.44Å
308	E	84.9	Confident	83.5	Confident	39 Å²	39	61.7 Å²	61.7	18%	0.182	32%	0.323	C	S	.	.	H	α-helix	trans	-57.9	-46.6	172.2	-173.9	-178.5	141.8	0	0	110.8	M304 Y305 S312 R687 T735	M304-E308 WeakPolarHBondContact O-CB 3.46Å; M304-E308 PolarHBondContact O-N 2.69Å; Y305-E308 PolarHBondContact O-N 3.27Å; E308-S312 VanDerWaalsContact O-CB 3.28Å; E308-S312 WeakPolarHBondContact O-CB 3.15Å; E308-S312 PolarHBondContact O-N 3.32Å; E308-R687 IonicContact OE1-CZ 3.98Å; E308-R687 IonicContact OE1-NE 2.93Å; E308-R687 PolarHBondContact OE1-NE 3.06Å; E308-R687 IonicContact OE1-NH2 3.22Å; E308-R687 PolarHBondContact OE1-NH2 3.34Å; E308-R687 IonicContact OE2-NH2 2.93Å; E308-T735 WeakPolarHBondContact OE2-CB 3.39Å; E308-T735 PolarHBondContact OE2-N 3.43Å; E308-T735 PolarHBondContact OE2-OG1 3.36Å
309	L	85.4	Confident	83.5	Confident	28 Å²	28	62.2 Å²	62.2	15%	0.147	32%	0.321	C	S	.	.	H	α-helix	trans	-64.4	-47.3	176.6	-74.3	178	0	0	0	112.9	A284 M287 Y305 I306 E307 S312 V313	A284-L309 HydrophobicContact CB-CB 4.29Å; A284-L309 HydrophobicContact CB-CD1 4.23Å; M287-L309 HydrophobicContact CE-CD1 3.6Å; Y305-L309 HydrophobicContact CD1-CD1 4.17Å; Y305-L309 HydrophobicContact CD2-CG 4.5Å; Y305-L309 HydrophobicContact CE1-CD1 3.65Å; Y305-L309 HydrophobicContact CE1-CG 4.36Å; Y305-L309 HydrophobicContact CE2-CD1 4.26Å; Y305-L309 HydrophobicContact CE2-CD2 4.33Å; Y305-L309 HydrophobicContact CE2-CG 4.09Å; Y305-L309 WeakPolarHBondContact O-CB 3.48Å; Y305-L309 WeakPolarHBondContact O-CG 3.38Å; Y305-L309 PolarHBondContact O-N 3.07Å; I306-L309 HydrophobicContact CD1-CD1 4.39Å; E307-L309 PolarHBondContact O-N 3.15Å; L309-S312 PolarHBondContact O-N 3.36Å; L309-V313 WeakPolarHBondContact O-CG2 3.38Å; L309-V313 PolarHBondContact O-N 2.92Å
310	R	87	Confident	83.7	Confident	98 Å²	98	54.1 Å²	54.1	37%	0.37	29%	0.286	S	S	.	.	H	α-helix	trans	-63.9	-44.6	178	-75.9	170.3	171.8	174.1	-5.9	111.4	L281 D285 I306 E307 S312 V313 N314	L281-R310 HydrophobicContact CD1-CG 4.01Å; D285-R310 IonicContact OD1-CZ 3.68Å; D285-R310 IonicContact OD1-NE 3.32Å; D285-R310 PolarHBondContact OD1-NE 3.15Å; D285-R310 IonicContact OD1-NH2 3.49Å; D285-R310 PolarHBondContact OD1-NH2 3.26Å; I306-R310 WeakPolarHBondContact O-CB 3.38Å; I306-R310 VanDerWaalsContact O-CG 3.24Å; I306-R310 WeakPolarHBondContact O-CG 3.41Å; I306-R310 PolarHBondContact O-N 2.58Å; E307-R310 PolarHBondContact O-N 2.83Å; R310-S312 PolarHBondContact O-N 3.17Å; R310-V313 PolarHBondContact O-N 3.25Å; R310-N314 WeakPolarHBondContact O-CB 3.24Å; R310-N314 PolarHBondContact O-N 2.83Å; R310-N314 PolarHBondContact O-ND2 2.93Å; R310-N314 PolarHBondContact O-OD1 3.08Å
311	S	85.2	Confident	83.3	Confident	74 Å²	74	54.7 Å²	54.7	52%	0.517	29%	0.285	S	S	.	.	H	α-helix	trans	-61.1	-43.9	176.6	-173	0	0	0	0	111.6	E307 V313 N314 L315	E307-S311 WeakPolarHBondContact O-CB 3.22Å; E307-S311 PolarHBondContact O-N 3.44Å; S311-V313 PolarHBondContact O-N 3.2Å; S311-N314 PolarHBondContact O-N 3.06Å; S311-L315 WeakPolarHBondContact O-CB 3.36Å; S311-L315 PolarHBondContact O-N 3.21Å
312	S	85.9	Confident	82.7	Confident	49 Å²	49	57.4 Å²	57.4	34%	0.343	31%	0.307	S	S	.	.	H	α-helix	trans	-58.4	-47.3	173.4	175.3	0	0	0	0	112.4	E308 L309 R310 L315 L316	E308-S312 VanDerWaalsContact O-CB 3.28Å; E308-S312 WeakPolarHBondContact O-CB 3.15Å; E308-S312 PolarHBondContact O-N 3.32Å; L309-S312 PolarHBondContact O-N 3.36Å; R310-S312 PolarHBondContact O-N 3.17Å; S312-L315 PolarHBondContact O-N 3.42Å; S312-L316 WeakPolarHBondContact O-CD1 3.29Å; S312-L316 VanDerWaalsContact O-CG 3.24Å; S312-L316 WeakPolarHBondContact O-CG 3.25Å; S312-L316 PolarHBondContact O-N 2.91Å; S312-L316 VanDerWaalsContact O-N 3.09Å
313	V	86.1	Confident	81.9	Confident	4 Å²	4	57.6 Å²	57.6	2%	0.024	31%	0.31	C	S	.	.	H	α-helix	trans	-65.8	-40.8	177.8	172.9	0	0	0	0	111.3	L277 R280 L281 L309 R310 S311 L316 M317	L277-V313 HydrophobicContact CB-CG1 4.18Å; R280-V313 HydrophobicContact CB-CG2 4.04Å; L281-V313 HydrophobicContact CB-CG1 4.47Å; L281-V313 HydrophobicContact CD1-CG1 4.33Å; L309-V313 WeakPolarHBondContact O-CG2 3.38Å; L309-V313 PolarHBondContact O-N 2.92Å; R310-V313 PolarHBondContact O-N 3.25Å; S311-V313 PolarHBondContact O-N 3.2Å; V313-L316 PolarHBondContact O-N 3.5Å; V313-M317 HydrophobicContact CG1-CE 4.34Å; V313-M317 WeakPolarHBondContact O-CG 3.42Å; V313-M317 PolarHBondContact O-N 3.25Å
314	N	84.9	Confident	80.7	Confident	83 Å²	83	57.1 Å²	57.1	44%	0.444	31%	0.313	S	S	.	.	H	α-helix	trans	-64.9	-39.3	177.7	-69.6	-9.9	0	0	0	112.5	R310 S311 L316 M317 A318	R310-N314 WeakPolarHBondContact O-CB 3.24Å; R310-N314 PolarHBondContact O-N 2.83Å; R310-N314 PolarHBondContact O-ND2 2.93Å; R310-N314 PolarHBondContact O-OD1 3.08Å; S311-N314 PolarHBondContact O-N 3.06Å; N314-L316 VanDerWaalsContact C-N 3.34Å; N314-M317 PolarHBondContact O-N 3.32Å; N314-M317 WeakPolarHBondContact OD1-CE 3.46Å; N314-A318 WeakPolarHBondContact O-CB 3.39Å; N314-A318 PolarHBondContact O-N 2.97Å
315	L	85.9	Confident	79.2	Confident	103 Å²	103	56.9 Å²	56.9	54%	0.539	32%	0.315	S	S	.	.	H	α-helix	trans	-64.6	-38.2	173.2	179.2	61.3	0	0	0	111.7	S311 S312 A318 N319	S311-L315 WeakPolarHBondContact O-CB 3.36Å; S311-L315 PolarHBondContact O-N 3.21Å; S312-L315 PolarHBondContact O-N 3.42Å; L315-A318 PolarHBondContact O-N 3.44Å; L315-N319 WeakPolarHBondContact O-CB 3.33Å; L315-N319 VanDerWaalsContact O-CG 3.29Å; L315-N319 PolarHBondContact O-N 3.42Å
316	L	86.3	Confident	77.4	Confident	6 Å²	6	58.3 Å²	58.3	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-68.9	-36.8	176.7	-70.3	166	0	0	0	112.3	F99 N100 L277 S312 V313 N314 L320 A682	F99-L316 HydrophobicContact CE2-CB 4.02Å; F99-L316 HydrophobicContact CE2-CD2 3.92Å; F99-L316 WeakPolarHBondContact CE2-O 3.43Å; F99-L316 HydrophobicContact CZ-CB 4.5Å; F99-L316 HydrophobicContact CZ-CD2 4.17Å; N100-L316 HydrophobicContact CB-CD2 3.99Å; N100-L316 WeakPolarHBondContact OD1-CD2 3.29Å; L277-L316 HydrophobicContact CD1-CB 4.01Å; L277-L316 HydrophobicContact CD2-CB 3.97Å; L277-L316 HydrophobicContact CD2-CD1 4.08Å; S312-L316 WeakPolarHBondContact O-CD1 3.29Å; S312-L316 VanDerWaalsContact O-CG 3.24Å; S312-L316 WeakPolarHBondContact O-CG 3.25Å; S312-L316 PolarHBondContact O-N 2.91Å; S312-L316 VanDerWaalsContact O-N 3.09Å; V313-L316 PolarHBondContact O-N 3.5Å; N314-L316 VanDerWaalsContact C-N 3.34Å; L316-L320 WeakPolarHBondContact O-CB 3.12Å; L316-L320 PolarHBondContact O-N 2.94Å; L316-L320 VanDerWaalsContact O-N 3.12Å; L316-A682 WeakPolarHBondContact CD1-O 3.49Å; L316-A682 HydrophobicContact CD2-CB 3.97Å
317	M	81.1	Confident	75.1	Confident	55 Å²	55	68.3 Å²	68.3	27%	0.271	37%	0.372	S	S	.	.	H	α-helix	trans	-62.1	-53	168.2	-67.4	-169.7	-63.3	0	0	110.2	L277 V313 N314 N319 L320 E321	L277-M317 HydrophobicContact CB-CG 4.48Å; L277-M317 HydrophobicContact CD1-CG 3.77Å; V313-M317 HydrophobicContact CG1-CE 4.34Å; V313-M317 WeakPolarHBondContact O-CG 3.42Å; V313-M317 PolarHBondContact O-N 3.25Å; N314-M317 PolarHBondContact O-N 3.32Å; N314-M317 WeakPolarHBondContact OD1-CE 3.46Å; M317-N319 VanDerWaalsContact C-N 3.28Å; M317-N319 PolarHBondContact O-N 3.38Å; M317-L320 CarbonylContact O-C 3.59Å; M317-L320 WeakPolarHBondContact O-CA 3.38Å; M317-L320 WeakPolarHBondContact O-CB 3.34Å; M317-L320 PolarHBondContact O-N 2.99Å; M317-E321 WeakPolarHBondContact O-CG 3.4Å; M317-E321 PolarHBondContact O-N 3.03Å
318	A	79.1	Confident	72.6	Confident	46 Å²	46	66.4 Å²	66.4	38%	0.38	38%	0.381	S	S	.	.	H	α-helix	trans	-54.2	-39	178.2	0	0	0	0	0	113.8	N314 L315 E321 S322	N314-A318 WeakPolarHBondContact O-CB 3.39Å; N314-A318 PolarHBondContact O-N 2.97Å; L315-A318 PolarHBondContact O-N 3.44Å; A318-E321 PolarHBondContact O-N 2.83Å; A318-E321 VanDerWaalsContact O-N 3.16Å; A318-S322 PolarHBondContact O-N 3.03Å; A318-S322 VanDerWaalsContact O-N 3.11Å
319	N	82.4	Confident	70.3	Confident	47 Å²	47	67.8 Å²	67.8	25%	0.251	41%	0.406	S	S	.	.	H	α-helix	trans	-66.5	-41.1	174.3	-74	-11.4	0	0	0	111.4	N100 L315 M317 E321 S322	N100-N319 PolarHBondContact OD1-ND2 3.24Å; L315-N319 WeakPolarHBondContact O-CB 3.33Å; L315-N319 VanDerWaalsContact O-CG 3.29Å; L315-N319 PolarHBondContact O-N 3.42Å; M317-N319 VanDerWaalsContact C-N 3.28Å; M317-N319 PolarHBondContact O-N 3.38Å; N319-E321 PolarHBondContact O-N 2.97Å; N319-S322 WeakPolarHBondContact O-CB 3.49Å; N319-S322 PolarHBondContact O-N 2.99Å; N319-S322 VanDerWaalsContact O-N 3.14Å; N319-S322 PolarHBondContact O-OG 2.98Å
320	L	80.9	Confident	67.9	Low	5 Å²	5	72.7 Å²	72.7	3%	0.026	44%	0.439	C	S	.	.	H	α-helix	trans	-67.7	-19.7	171.4	-161.1	71.9	0	0	0	112.9	F99 I273 R274 L316 M317 L323 Q517 Y518	F99-L320 HydrophobicContact CB-CD1 3.36Å; F99-L320 HydrophobicContact CD1-CD1 4.47Å; F99-L320 HydrophobicContact CD2-CB 3.96Å; F99-L320 HydrophobicContact CD2-CD1 3.79Å; F99-L320 HydrophobicContact CD2-CG 4.42Å; F99-L320 HydrophobicContact CG-CD1 3.64Å; I273-L320 HydrophobicContact CB-CD1 4.44Å; I273-L320 HydrophobicContact CB-CD2 3.79Å; I273-L320 HydrophobicContact CD1-CD1 3.53Å; I273-L320 HydrophobicContact CD1-CD2 4.41Å; I273-L320 HydrophobicContact CG2-CD1 4.37Å; I273-L320 HydrophobicContact CG2-CD2 3.68Å; R274-L320 HydrophobicContact CG-CD2 4.23Å; L316-L320 WeakPolarHBondContact O-CB 3.12Å; L316-L320 PolarHBondContact O-N 2.94Å; L316-L320 VanDerWaalsContact O-N 3.12Å; M317-L320 CarbonylContact O-C 3.59Å; M317-L320 WeakPolarHBondContact O-CA 3.38Å; M317-L320 WeakPolarHBondContact O-CB 3.34Å; M317-L320 PolarHBondContact O-N 2.99Å; L320-L323 HydrophobicContact CD1-CD1 4.01Å; L320-Q517 PolarHBondContact O-OE1 3.37Å; L320-Y518 WeakPolarHBondContact CB-OH 3.33Å; L320-Y518 WeakPolarHBondContact CD2-OH 3.34Å; L320-Y518 WeakPolarHBondContact CG-OH 3.41Å; L320-Y518 PolarHBondContact O-OH 2.97Å
321	E	70.4	Confident	65.3	Low	104 Å²	104	75.7 Å²	75.7	49%	0.486	46%	0.457	S	S	.	.	H	α-helix	trans	-83.4	-15.1	170.2	-42.1	-158.4	146.1	0	0	114.2	M317 A318 N319 L323 Q517 Y518	M317-E321 WeakPolarHBondContact O-CG 3.4Å; M317-E321 PolarHBondContact O-N 3.03Å; A318-E321 PolarHBondContact O-N 2.83Å; A318-E321 VanDerWaalsContact O-N 3.16Å; N319-E321 PolarHBondContact O-N 2.97Å; E321-L323 VanDerWaalsContact C-N 3.26Å; E321-L323 PolarHBondContact O-N 3.5Å; E321-Q517 PolarHBondContact O-OE1 2.66Å; E321-Y518 VanDerWaalsContact CA-CE2 3.47Å; E321-Y518 HydrophobicContact CB-CD2 3.94Å; E321-Y518 HydrophobicContact CB-CE2 3.71Å; E321-Y518 HydrophobicContact CG-CD1 4.31Å; E321-Y518 HydrophobicContact CG-CD2 3.58Å; E321-Y518 HydrophobicContact CG-CE1 4.1Å; E321-Y518 HydrophobicContact CG-CE2 3.48Å; E321-Y518 VanDerWaalsContact CG-CE2 3.48Å; E321-Y518 HydrophobicContact CG-CG 4.1Å
322	S	70.3	Confident	63	Low	89 Å²	89	80.4 Å²	80.4	62%	0.622	47%	0.469	S	S	*	.	S	Bend	trans	-81.5	-4.7	-178.8	77.8	0	0	0	0	113.9	A318 N319	A318-S322 PolarHBondContact O-N 3.03Å; A318-S322 VanDerWaalsContact O-N 3.11Å; N319-S322 WeakPolarHBondContact O-CB 3.49Å; N319-S322 PolarHBondContact O-N 2.99Å; N319-S322 VanDerWaalsContact O-N 3.14Å; N319-S322 PolarHBondContact O-OG 2.98Å
323	L	65.3	Low	60.4	Low	70 Å²	70	86 Å²	86	37%	0.366	49%	0.487	S	S	.	.	S	Bend	trans	-82.6	146.7	-173.5	-64.6	174.1	0	0	0	111.5	F99 L320 E321 Q517	F99-L323 HydrophobicContact CB-CD1 4.3Å; L320-L323 HydrophobicContact CD1-CD1 4.01Å; E321-L323 VanDerWaalsContact C-N 3.26Å; E321-L323 PolarHBondContact O-N 3.5Å; L323-Q517 PolarHBondContact O-NE2 2.83Å; L323-Q517 VanDerWaalsContact O-NE2 3.11Å; L323-Q517 PolarHBondContact O-OE1 2.87Å; L323-Q517 VanDerWaalsContact O-OE1 3.1Å
324	P	55.4	Low	58.1	Low	98 Å²	98	92.1 Å²	92.1	64%	0.636	52%	0.519	S	S	*	.			trans	-74.1	134.3	177.2	29.2	-33.6	0	0	0	111.5	S326	P324-S326 VanDerWaalsContact C-N 3.29Å; P324-S326 PolarHBondContact O-N 3.01Å
325	V	51.6	Low	55.7	Low	54 Å²	54	96.9 Å²	96.9	33%	0.327	54%	0.539	S	S	.	.	S	Bend	trans	-60.3	-34.3	-177.7	-178.5	0	0	0	0	113.2	Q514 Q517	V325-Q514 VanDerWaalsContact CG1-OE1 3.31Å; V325-Q517 HydrophobicContact CG2-CG 3.65Å
326	S	46.3	Very low	53.1	Low	58 Å²	58	101.1 Å²	101.1	41%	0.406	55%	0.552	S	S	.	*			trans	-143.6	139.9	-170.3	-61.7	0	0	0	0	112	P324	P324-S326 VanDerWaalsContact C-N 3.29Å; P324-S326 PolarHBondContact O-N 3.01Å
327	K	37.3	Very low	50.6	Low	218 Å²	218	108 Å²	108	95%	0.948	59%	0.589	S	S	*	*	S	Bend	trans	-103	5.1	166.8	-89.3	-166.5	174.9	-174.2	0	114.2
328	G	33.8	Very low	48.1	Very low	66 Å²	66	115.1 Å²	115.1	68%	0.68	62%	0.618	S	S	*	*	S	Bend	trans	-124.2	109.5	-179.5	0	0	0	0	0	112.3
329	G	36	Very low	46	Very low	68 Å²	68	123.7 Å²	123.7	70%	0.701	64%	0.64	S	S	*	*	S	Bend	trans	136.4	143.7	175.7	0	0	0	0	0	112.7
330	P	34.3	Very low	43.3	Very low	131 Å²	131	126.5 Å²	126.5	85%	0.851	66%	0.664	S	S	*	*	S	Bend	trans	-67.3	155.4	174.8	29	-34.4	0	0	0	111.9	F332	P330-F332 PolarHBondContact O-N 3.23Å
331	E	32.9	Very low	41.1	Very low	161 Å²	161	134.9 Å²	134.9	75%	0.752	70%	0.703	S	S	*	*			trans	-56.6	101.5	-167.3	-62.4	-171.6	154.9	0	0	114.9	K333	E331-K333 PolarHBondContact O-N 3.12Å; E331-K333 WeakPolarHBondContact OE2-CE 2.91Å; E331-K333 IonicContact OE2-NZ 2.81Å
332	F	36.9	Very low	38.9	Very low	173 Å²	173	137.6 Å²	137.6	76%	0.759	72%	0.721	S	S	*	*			trans	-76.9	101.7	160.8	-137.8	-93	0	0	0	108.9	P330 L334	P330-F332 PolarHBondContact O-N 3.23Å; F332-L334 VanDerWaalsContact C-N 3.26Å; F332-L334 PolarHBondContact O-N 3.45Å
333	K	32.4	Very low	37	Very low	168 Å²	168	139.5 Å²	139.5	73%	0.73	73%	0.734	S	S	*	*			trans	-71.7	80.4	179.3	-76.4	177.5	179.2	165	0	111.1	E331 Q335	E331-K333 PolarHBondContact O-N 3.12Å; E331-K333 WeakPolarHBondContact OE2-CE 2.91Å; E331-K333 IonicContact OE2-NZ 2.81Å; K333-Q335 PolarHBondContact O-N 2.93Å
334	L	37.6	Very low	35.2	Very low	131 Å²	131	140.6 Å²	140.6	69%	0.686	75%	0.753	S	S	*	*			trans	-53.5	114	166.5	-150.3	163.3	0	0	0	107.5	F332 K336	F332-L334 VanDerWaalsContact C-N 3.26Å; F332-L334 PolarHBondContact O-N 3.45Å; L334-K336 PolarHBondContact O-N 3.39Å
335	Q	33.7	Very low	33.8	Very low	184 Å²	184	144.8 Å²	144.8	86%	0.86	76%	0.762	S	S	*	*			trans	-66	112.7	-163.4	-160.9	174.7	32.4	0	0	109	K333 L337	K333-Q335 PolarHBondContact O-N 2.93Å; Q335-L337 PolarHBondContact O-N 3.1Å
336	K	31.5	Very low	33.3	Very low	191 Å²	191	148.8 Å²	148.8	83%	0.83	78%	0.781	S	S	*	*			trans	-41.1	112.2	-165.9	-78.4	-172.2	175.3	-175.4	0	112.3	L334 K338	L334-K336 PolarHBondContact O-N 3.39Å; K336-K338 PolarHBondContact O-N 3.27Å
337	L	33.5	Very low	32.3	Very low	152 Å²	152	153.5 Å²	153.5	80%	0.796	80%	0.801	S	S	*	*			trans	-56.9	110.3	163.3	-143.5	87.8	0	0	0	106.8	Q335 R339	Q335-L337 PolarHBondContact O-N 3.1Å; L337-R339 PolarHBondContact O-N 3.05Å
338	K	29.5	Very low	32.4	Very low	203 Å²	203	150.9 Å²	150.9	88%	0.883	80%	0.796	S	S	*	*			trans	-74.3	73.7	179.8	-82.8	-171.7	172.7	-176.8	0	109.9	K336 S340	K336-K338 PolarHBondContact O-N 3.27Å; K338-S340 VanDerWaalsContact C-N 3.28Å; K338-S340 PolarHBondContact O-N 3.16Å
339	R	34.1	Very low	32.3	Very low	226 Å²	226	151 Å²	151	85%	0.853	80%	0.797	S	S	*	*			trans	-63.2	96.6	156.7	-118.4	-179.3	176	167.1	-0.1	106.4	L337 Q341	L337-R339 PolarHBondContact O-N 3.05Å; R339-Q341 PolarHBondContact O-N 3.4Å
340	S	26.1	Very low	32	Very low	106 Å²	106	154.7 Å²	154.7	74%	0.741	80%	0.801	S	S	*	*			trans	-65	122.3	175.7	-166.1	0	0	0	0	108	K338 N342	K338-S340 VanDerWaalsContact C-N 3.28Å; K338-S340 PolarHBondContact O-N 3.16Å; S340-N342 PolarHBondContact O-N 3.35Å
341	Q	33.3	Very low	32	Very low	182 Å²	182	157.9 Å²	157.9	85%	0.85	80%	0.804	S	S	*	*			trans	-66.9	124.8	163	-70.8	176.3	-45.6	0	0	107.8	R339	R339-Q341 PolarHBondContact O-N 3.4Å
342	N	26	Very low	31.9	Very low	161 Å²	161	156.6 Å²	156.6	86%	0.861	80%	0.802	S	S	*	*			trans	-162.1	123.5	150.3	-99.3	-17.2	0	0	0	107.2	S340	S340-N342 PolarHBondContact O-N 3.35Å
343	S	30.2	Very low	32	Very low	128 Å²	128	155.2 Å²	155.2	90%	0.895	80%	0.798	S	S	*	*			trans	-107.4	97.3	-174	50.1	0	0	0	0	110.2
344	A	27.6	Very low	32.6	Very low	93 Å²	93	154.6 Å²	154.6	77%	0.769	80%	0.802	S	S	*	*			trans	-157.4	126.3	166.6	0	0	0	0	0	111.9
345	F	25.9	Very low	33.6	Very low	186 Å²	186	155.6 Å²	155.6	82%	0.816	80%	0.803	S	S	*	*			trans	56	113.6	138.4	-150.5	-100.9	0	0	0	120.5
346	L	40.5	Very low	35.1	Very low	139 Å²	139	148.4 Å²	148.4	73%	0.728	77%	0.77	S	S	*	*			trans	23.9	115.3	150.4	-60.8	175.6	0	0	0	119.5
347	D	24.5	Very low	36.9	Very low	157 Å²	157	141.4 Å²	141.4	84%	0.84	75%	0.745	S	S	*	*				-145.3	162.7	128.8	-149.9	-12	0	0	0	110.4
348	I	39.4	Very low	38.8	Very low	163 Å²	163	138.3 Å²	138.3	84%	0.836	73%	0.725	S	S	*	*			trans	-122.8	114	-177.9	-65.1	177.4	0	0	0	109.6
349	G	31.9	Very low	40.6	Very low	68 Å²	68	132.5 Å²	132.5	70%	0.701	71%	0.71	S	S	*	*			trans	115.5	143.4	-170.4	0	0	0	0	0	110.1
350	D	29.9	Very low	42.3	Very low	146 Å²	146	125.4 Å²	125.4	78%	0.781	69%	0.689	S	S	*	*			cis	-133.9	146.3	12.1	-145.2	-3	0	0	0	110.2	N352	D350-N352 PolarHBondContact O-N 2.96Å
351	E	33.7	Very low	44.5	Very low	197 Å²	197	120.4 Å²	120.4	92%	0.921	65%	0.654	S	S	*	*			trans	-75	94.3	175.6	-78.3	-166.4	169.4	0	0	110.8
352	N	31.5	Very low	46.6	Very low	134 Å²	134	114.9 Å²	114.9	72%	0.717	63%	0.633	S	S	*	*			trans	-110.7	108.8	160.7	-80	-88.3	0	0	0	109.3	D350 I354	D350-N352 PolarHBondContact O-N 2.96Å; N352-I354 PolarHBondContact O-N 3.36Å
353	E	39.7	Very low	49.3	Very low	144 Å²	144	107.6 Å²	107.6	67%	0.673	59%	0.594	S	S	*	*			trans	-49	134.2	170.1	-68.5	-177.9	132	0	0	110.1	Q355	E353-Q355 HydrophobicContact CB-CG 4.26Å; E353-Q355 PolarHBondContact O-N 3.04Å
354	I	45.7	Very low	51.8	Low	156 Å²	156	104 Å²	104	80%	0.8	57%	0.568	S	S	*	*			trans	-73.5	81.4	173.2	-57.3	174.5	0	0	0	108.1	N352 L356	N352-I354 PolarHBondContact O-N 3.36Å; I354-L356 PolarHBondContact O-N 2.95Å
355	Q	57.4	Low	54.5	Low	152 Å²	152	99.7 Å²	99.7	71%	0.71	53%	0.533	S	S	*	.	P	Polyproline II helix	trans	-68	119.5	-178.9	-68.2	-171	-1.6	0	0	110.7	E353 S357	E353-Q355 HydrophobicContact CB-CG 4.26Å; E353-Q355 PolarHBondContact O-N 3.04Å; Q355-S357 PolarHBondContact O-N 3.43Å
356	L	65.4	Low	57.4	Low	33 Å²	33	94.2 Å²	94.2	17%	0.173	51%	0.514	C	S	.	.	P	Polyproline II helix	trans	-49.4	128.1	176.3	-70.9	172.6	0	0	0	112.4	I354 V515 T519 A521 Q537	I354-L356 PolarHBondContact O-N 2.95Å; L356-V515 HydrophobicContact CD2-CB 4.37Å; L356-V515 HydrophobicContact CD2-CG1 3.87Å; L356-T519 HydrophobicContact CD1-CG2 3.84Å; L356-T519 HydrophobicContact CD2-CG2 3.92Å; L356-T519 HydrophobicContact CG-CG2 4.14Å; L356-A521 HydrophobicContact CD1-CB 3.95Å; L356-Q537 HydrophobicContact CD1-CB 4.18Å; L356-Q537 HydrophobicContact CD1-CG 4.23Å
357	S	70	Confident	59.7	Low	44 Å²	44	87.7 Å²	87.7	31%	0.308	48%	0.48	S	S	.	.	P	Polyproline II helix	trans	-78.4	156.9	171.6	83	0	0	0	0	110.7	Q355 S359 D360	Q355-S357 PolarHBondContact O-N 3.43Å; S357-S359 PolarHBondContact O-N 2.8Å; S357-S359 PolarHBondContact OG-OG 3.02Å; S357-D360 WeakPolarHBondContact CA-OD2 3.24Å; S357-D360 VanDerWaalsContact CB-OD2 3.23Å; S357-D360 WeakPolarHBondContact CB-OD2 3.41Å; S357-D360 PolarHBondContact N-OD2 2.96Å; S357-D360 PolarHBondContact O-N 3.13Å; S357-D360 VanDerWaalsContact O-N 3.16Å; S357-D360 PolarHBondContact OG-N 2.88Å; S357-D360 PolarHBondContact OG-OD1 3.35Å; S357-D360 PolarHBondContact OG-OD2 3.25Å
358	K	71.9	Confident	62.7	Low	86 Å²	86	81.9 Å²	81.9	37%	0.374	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-66.6	-24.5	177.9	-66.5	-169.4	167.9	-149.1	0	113.3	D360 P532 Q533 L535	K358-D360 VanDerWaalsContact C-N 3.34Å; K358-P532 PolarHBondContact NZ-O 3.16Å; K358-Q533 PolarHBondContact NZ-O 3.16Å; K358-L535 HydrophobicContact CG-CD2 4.13Å
359	S	68.6	Low	65.1	Low	81 Å²	81	74.1 Å²	74.1	57%	0.566	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-66.6	-30.7	173.4	17.9	0	0	0	0	113.2	S357 V361 V362	S357-S359 PolarHBondContact O-N 2.8Å; S357-S359 PolarHBondContact OG-OG 3.02Å; S359-V361 PolarHBondContact O-N 3.08Å; S359-V361 VanDerWaalsContact O-N 3.14Å; S359-V362 PolarHBondContact O-N 3.19Å
360	D	68.6	Low	67.8	Low	77 Å²	77	72.2 Å²	72.2	41%	0.412	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-72.6	-6.2	-177.9	-52.4	-43.7	0	0	0	112.9	S357 K358 V515	S357-D360 WeakPolarHBondContact CA-OD2 3.24Å; S357-D360 VanDerWaalsContact CB-OD2 3.23Å; S357-D360 WeakPolarHBondContact CB-OD2 3.41Å; S357-D360 PolarHBondContact N-OD2 2.96Å; S357-D360 PolarHBondContact O-N 3.13Å; S357-D360 VanDerWaalsContact O-N 3.16Å; S357-D360 PolarHBondContact OG-N 2.88Å; S357-D360 PolarHBondContact OG-OD1 3.35Å; S357-D360 PolarHBondContact OG-OD2 3.25Å; K358-D360 VanDerWaalsContact C-N 3.34Å; D360-V515 HydrophobicContact CB-CG1 3.88Å; D360-V515 WeakPolarHBondContact O-CG1 3.39Å
361	V	72.4	Confident	70.6	Confident	1 Å²	1	65.3 Å²	65.3	1%	0.006	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-121.4	25.8	-177.4	-150.2	0	0	0	0	112.8	S359 V513 V515 C523 Y525 P532 L535	S359-V361 PolarHBondContact O-N 3.08Å; S359-V361 VanDerWaalsContact O-N 3.14Å; V361-V513 HydrophobicContact CG1-CB 3.65Å; V361-V513 HydrophobicContact CG1-CG1 3.69Å; V361-V513 HydrophobicContact CG1-CG2 3.72Å; V361-V515 HydrophobicContact CG1-CG2 4.43Å; V361-V515 HydrophobicContact CG2-CG2 4.14Å; V361-C523 HydrophobicContact CG1-CB 4.32Å; V361-Y525 VanDerWaalsContact CG1-OH 3.3Å; V361-Y525 WeakPolarHBondContact CG1-OH 3.45Å; V361-Y525 PolarHBondContact O-OH 3.29Å; V361-P532 HydrophobicContact CB-CG 4.39Å; V361-L535 HydrophobicContact CG2-CD2 4.37Å
362	V	78.7	Confident	73.3	Confident	66 Å²	66	59.5 Å²	59.5	40%	0.4	32%	0.32	S	S	.	.			trans	-80.8	122.7	170	179	0	0	0	0	109.2	S359 T418	S359-V362 PolarHBondContact O-N 3.19Å; V362-T418 HydrophobicContact CG1-CG2 4.24Å
363	L	81.4	Confident	76	Confident	8 Å²	8	54.8 Å²	54.8	4%	0.042	29%	0.293	C	S	.	.			trans	-97	155.9	176	-66.4	172.3	0	0	0	110.2	F365 T418 P420 H487 M488 V511 V513	L363-F365 HydrophobicContact CB-CD2 4.32Å; L363-F365 HydrophobicContact CB-CE2 3.47Å; L363-F365 VanDerWaalsContact CB-CE2 3.47Å; L363-F365 HydrophobicContact CB-CZ 3.68Å; L363-F365 HydrophobicContact CD1-CE2 4.35Å; L363-F365 HydrophobicContact CD1-CZ 3.74Å; L363-F365 HydrophobicContact CG-CZ 4.38Å; L363-T418 CarbonylContact O-C 3.56Å; L363-T418 WeakPolarHBondContact O-CA 3.34Å; L363-T418 WeakPolarHBondContact O-CB 3.45Å; L363-P420 HydrophobicContact CD1-CG 4.44Å; L363-H487 HydrophobicContact CD2-CB 3.99Å; L363-M488 HydrophobicContact CD1-CB 4.15Å; L363-M488 HydrophobicContact CD1-CG 4.33Å; L363-M488 HydrophobicContact CD1-SD 3.86Å; L363-M488 HydrophobicContact CD2-CB 4.42Å; L363-V511 HydrophobicContact CD1-CG1 4.01Å; L363-V513 HydrophobicContact CD1-CG2 3.99Å; L363-V513 HydrophobicContact CD2-CG1 4.05Å; L363-V513 HydrophobicContact CD2-CG2 4.41Å; L363-V513 HydrophobicContact CG-CG2 4.42Å
364	S	82.3	Confident	78.4	Confident	52 Å²	52	48.4 Å²	48.4	36%	0.364	26%	0.264	S	S	.	.			trans	-124.9	133.9	171.8	-174.4	0	0	0	0	109.7	P485	S364-P485 WeakPolarHBondContact O-CG 3.02Å
365	F	85.7	Confident	80.3	Confident	4 Å²	4	44.7 Å²	44.7	2%	0.018	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	141	-172	-55.3	-99.5	0	0	0	111.1	L363 T416 T417 P420 M482 P485 M488	L363-F365 HydrophobicContact CB-CD2 4.32Å; L363-F365 HydrophobicContact CB-CE2 3.47Å; L363-F365 VanDerWaalsContact CB-CE2 3.47Å; L363-F365 HydrophobicContact CB-CZ 3.68Å; L363-F365 HydrophobicContact CD1-CE2 4.35Å; L363-F365 HydrophobicContact CD1-CZ 3.74Å; L363-F365 HydrophobicContact CG-CZ 4.38Å; F365-T416 WeakPolarHBondContact O-CA 3.41Å; F365-T417 HydrophobicContact CB-CG2 3.87Å; F365-T417 HydrophobicContact CD2-CG2 4.38Å; F365-T417 HydrophobicContact CG-CG2 4.5Å; F365-T417 PolarHBondContact N-O 3.44Å; F365-T417 PolarHBondContact O-N 3.24Å; F365-P420 HydrophobicContact CE2-CB 4.09Å; F365-P420 HydrophobicContact CE2-CG 3.84Å; F365-P420 HydrophobicContact CZ-CB 3.77Å; F365-P420 HydrophobicContact CZ-CG 3.86Å; F365-M482 HydrophobicContact CB-CE 3.96Å; F365-M482 HydrophobicContact CD1-CE 3.44Å; F365-M482 VanDerWaalsContact CD1-CE 3.44Å; F365-M482 HydrophobicContact CD1-CG 4.39Å; F365-M482 HydrophobicContact CD2-CE 4.02Å; F365-M482 HydrophobicContact CE1-CE 3.8Å; F365-M482 HydrophobicContact CE2-CE 4.36Å; F365-M482 HydrophobicContact CG-CE 3.56Å; F365-M482 HydrophobicContact CZ-CE 4.27Å; F365-P485 VanDerWaalsContact CD1-CD 3.49Å; F365-P485 HydrophobicContact CD1-CG 3.44Å; F365-P485 VanDerWaalsContact CD1-CG 3.44Å; F365-P485 VanDerWaalsContact CE1-CD 3.47Å; F365-P485 HydrophobicContact CE1-CG 3.58Å; F365-P485 HydrophobicContact CG-CG 4Å; F365-P485 HydrophobicContact CZ-CG 4.2Å; F365-M488 HydrophobicContact CE1-CE 4.25Å; F365-M488 HydrophobicContact CE1-SD 3.48Å; F365-M488 WeakPolarHBondContact CE1-SD 3.46Å; F365-M488 HydrophobicContact CZ-SD 3.84Å
366	T	86.3	Confident	81.4	Confident	71 Å²	71	39.3 Å²	39.3	44%	0.436	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	139.6	163.4	42.7	0	0	0	0	110.6	T416 M482 D483	T366-T416 HydrophobicContact CG2-CG2 4.48Å; T366-M482 WeakPolarHBondContact O-CA 2.9Å; T366-D483 PolarHBondContact O-N 2.83Å; T366-D483 VanDerWaalsContact O-N 3.1Å; T366-D483 PolarHBondContact OG1-OD2 3.23Å
367	L	87.7	Confident	82.2	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	116.3	176.6	-80.7	168.7	0	0	0	109.2	V392 D414 F415 T417 P422 P450 V480 R481 M482	L367-V392 HydrophobicContact CD1-CG1 3.84Å; L367-D414 CarbonylContact O-C 3.53Å; L367-D414 WeakPolarHBondContact O-CA 3.48Å; L367-F415 HydrophobicContact CB-CB 4.13Å; L367-F415 PolarHBondContact N-O 2.95Å; L367-F415 PolarHBondContact O-N 2.96Å; L367-T417 HydrophobicContact CD1-CG2 3.6Å; L367-T417 HydrophobicContact CG-CG2 4.12Å; L367-P422 HydrophobicContact CD1-CB 4.25Å; L367-P422 HydrophobicContact CD1-CG 3.97Å; L367-P422 HydrophobicContact CD2-CG 4.43Å; L367-P450 HydrophobicContact CD2-CB 4.4Å; L367-P450 HydrophobicContact CD2-CG 3.81Å; L367-V480 HydrophobicContact CD2-CG1 4.26Å; L367-R481 WeakPolarHBondContact CA-O 3.31Å; L367-M482 HydrophobicContact CD2-CB 3.68Å; L367-M482 HydrophobicContact CD2-CG 3.71Å; L367-M482 HydrophobicContact CD2-SD 4.19Å; L367-M482 HydrophobicContact CG-CG 4.45Å
368	E	87.9	Confident	82.6	Confident	35 Å²	35	44.8 Å²	44.8	16%	0.164	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	120	171.7	178.3	-157.5	155.7	0	0	108.1	V370 Q412 V480 R481	E368-V370 HydrophobicContact CG-CG2 4.12Å; E368-V370 WeakPolarHBondContact OE1-CG2 3.4Å; E368-Q412 HydrophobicContact CG-CG 3.93Å; E368-V480 WeakPolarHBondContact O-CA 3.28Å; E368-R481 HydrophobicContact CB-CB 4.26Å; E368-R481 PolarHBondContact N-O 3.18Å; E368-R481 PolarHBondContact O-N 3.4Å; E368-R481 IonicContact OE1-CZ 2.71Å; E368-R481 IonicContact OE1-NH1 3.21Å; E368-R481 PolarHBondContact OE1-NH1 3.18Å; E368-R481 WeakPolarHBondContact OE2-CD 2.93Å; E368-R481 IonicContact OE2-CZ 2.67Å; E368-R481 IonicContact OE2-NE 3.68Å; E368-R481 IonicContact OE2-NH1 3.36Å; E368-R481 PolarHBondContact OE2-NH1 3.33Å
369	I	89.7	Confident	82.6	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	121.3	175.7	-60	162.6	0	0	0	108.8	M390 V392 Q412 G413 F415 V424 A479 V480	I369-M390 HydrophobicContact CB-SD 3.86Å; I369-M390 HydrophobicContact CG2-CG 4.09Å; I369-M390 HydrophobicContact CG2-SD 3.51Å; I369-M390 VanDerWaalsContact CG2-SD 3.51Å; I369-V392 HydrophobicContact CD1-CG2 3.67Å; I369-Q412 CarbonylContact O-C 3.6Å; I369-Q412 WeakPolarHBondContact O-CA 3.21Å; I369-G413 PolarHBondContact N-O 3.21Å; I369-G413 PolarHBondContact O-N 2.94Å; I369-F415 HydrophobicContact CD1-CD2 3.82Å; I369-F415 HydrophobicContact CD1-CE2 3.75Å; I369-V424 HydrophobicContact CD1-CB 4.35Å; I369-V424 HydrophobicContact CD1-CG1 3.48Å; I369-V424 VanDerWaalsContact CD1-CG1 3.48Å; I369-V424 HydrophobicContact CD1-CG2 3.9Å; I369-V424 HydrophobicContact CG1-CG1 4.33Å; I369-A479 WeakPolarHBondContact CA-O 3.42Å; I369-V480 HydrophobicContact CG1-CG1 4.02Å; I369-V480 HydrophobicContact CG1-CG2 4.26Å; I369-V480 HydrophobicContact CG2-CG2 4.44Å
370	V	88.9	Confident	83.1	Confident	29 Å²	29	39.5 Å²	39.5	18%	0.176	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	116.1	179	-176.5	0	0	0	0	109.5	E368 Q412 L478 A479	E368-V370 HydrophobicContact CG-CG2 4.12Å; E368-V370 WeakPolarHBondContact OE1-CG2 3.4Å; V370-Q412 HydrophobicContact CG2-CB 4.1Å; V370-Q412 HydrophobicContact CG2-CG 4.04Å; V370-L478 CarbonylContact O-C 3.53Å; V370-L478 WeakPolarHBondContact O-CA 3.22Å; V370-L478 VanDerWaalsContact O-CB 3.28Å; V370-L478 WeakPolarHBondContact O-CB 3.21Å; V370-A479 PolarHBondContact N-O 2.88Å; V370-A479 PolarHBondContact O-N 3.22Å
371	I	89.8	Confident	83.4	Confident	0 Å²	0	38.2 Å²	38.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	125.9	176.2	-64.4	175.9	0	0	0	108.9	C388 M390 T399 W409 T411 V426 I476 L478	I371-C388 HydrophobicContact CD1-CB 3.65Å; I371-C388 HydrophobicContact CG2-CB 4.45Å; I371-M390 HydrophobicContact CD1-CG 3.53Å; I371-M390 HydrophobicContact CD1-SD 3.88Å; I371-M390 HydrophobicContact CG1-CG 4.33Å; I371-M390 HydrophobicContact CG1-SD 4.14Å; I371-T399 HydrophobicContact CB-CG2 4.28Å; I371-T399 HydrophobicContact CD1-CG2 3.84Å; I371-W409 HydrophobicContact CG2-CB 4.42Å; I371-W409 HydrophobicContact CG2-CD2 4.39Å; I371-W409 HydrophobicContact CG2-CE3 3.87Å; I371-W409 CarbonylContact O-C 3.55Å; I371-W409 WeakPolarHBondContact O-CB 3.08Å; I371-T411 PolarHBondContact N-O 3.07Å; I371-V426 HydrophobicContact CD1-CG1 3.5Å; I371-V426 VanDerWaalsContact CD1-CG1 3.5Å; I371-V426 HydrophobicContact CD1-CG2 4.36Å; I371-V426 HydrophobicContact CG1-CG1 4.43Å; I371-I476 HydrophobicContact CG2-CD1 4.09Å; I371-I476 HydrophobicContact CG2-CG1 4.44Å; I371-L478 HydrophobicContact CG1-CB 4.24Å
372	M	88.8	Confident	83.6	Confident	76 Å²	76	42.3 Å²	42.3	37%	0.374	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	-50.4	-176.3	-56.5	-164.8	85.1	0	0	113.4	Q408 W409 A458 K477	M372-Q408 CarbonylContact O-C 3.56Å; M372-Q408 WeakPolarHBondContact O-CA 3.47Å; M372-W409 WeakPolarHBondContact CA-O 3.28Å; M372-W409 PolarHBondContact O-N 3.33Å; M372-A458 HydrophobicContact CG-CB 4.25Å; M372-A458 HydrophobicContact SD-CB 3.35Å; M372-A458 WeakPolarHBondContact SD-CB 3.22Å; M372-K477 HydrophobicContact CB-CB 4.35Å; M372-K477 HydrophobicContact CB-CD 4.28Å; M372-K477 HydrophobicContact CB-CG 4.23Å; M372-K477 WeakPolarHBondContact CB-O 3.35Å; M372-K477 PolarHBondContact N-O 3.07Å; M372-K477 HydrophobicContact SD-CD 4.13Å; M372-K477 HydrophobicContact SD-CG 4.28Å
373	E	89.8	Confident	83.7	Confident	35 Å²	35	45.5 Å²	45.5	16%	0.164	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.2	158.7	-176.3	56.4	179.4	-165	0	0	112.9	Q375 P407 Q408 I476 K477	E373-Q375 PolarHBondContact OE1-NE2 3.43Å; E373-P407 CarbonylContact C-O 3.47Å; E373-P407 VanDerWaalsContact CA-O 3.3Å; E373-P407 WeakPolarHBondContact CA-O 3.34Å; E373-Q408 HydrophobicContact CB-CB 4.39Å; E373-Q408 HydrophobicContact CB-CG 3.92Å; E373-Q408 PolarHBondContact OE2-NE2 3.45Å; E373-I476 CarbonylContact O-C 3.55Å; E373-I476 WeakPolarHBondContact O-CA 3.28Å; E373-K477 HydrophobicContact CG-CB 3.7Å; E373-K477 HydrophobicContact CG-CD 3.97Å; E373-K477 HydrophobicContact CG-CG 4.47Å; E373-K477 PolarHBondContact N-O 3.1Å; E373-K477 PolarHBondContact O-N 3.17Å
374	V	89.3	Confident	83.8	Confident	10 Å²	10	49.2 Å²	49.2	6%	0.061	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	138.5	166.7	161.7	0	0	0	0	109.8	L377 P407 W409 L428 M463 L474 K475 I476	V374-L377 HydrophobicContact CG1-CB 4.29Å; V374-P407 HydrophobicContact CB-CB 4.27Å; V374-P407 HydrophobicContact CB-CG 4.15Å; V374-P407 HydrophobicContact CG1-CG 4.45Å; V374-P407 PolarHBondContact N-O 3.31Å; V374-P407 WeakPolarHBondContact O-CG 3.28Å; V374-W409 HydrophobicContact CB-CZ3 4.09Å; V374-W409 HydrophobicContact CG2-CH2 4.31Å; V374-W409 HydrophobicContact CG2-CZ3 3.8Å; V374-L428 HydrophobicContact CG1-CD2 4.01Å; V374-L428 HydrophobicContact CG2-CD1 4.34Å; V374-L428 HydrophobicContact CG2-CD2 4.22Å; V374-M463 HydrophobicContact CG2-SD 4.41Å; V374-L474 HydrophobicContact CG1-CD1 3.61Å; V374-L474 HydrophobicContact CG1-CG 4.38Å; V374-K475 CarbonylContact C-O 3.13Å; V374-K475 WeakPolarHBondContact CA-O 3.32Å; V374-I476 HydrophobicContact CG2-CB 4Å; V374-I476 HydrophobicContact CG2-CD1 4.05Å; V374-I476 HydrophobicContact CG2-CG1 3.82Å
375	Q	85.8	Confident	84	Confident	78 Å²	78	49 Å²	49	36%	0.364	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	142.8	177.9	-60.2	-175.8	1.4	0	0	110	E373 L460 K475	E373-Q375 PolarHBondContact OE1-NE2 3.43Å; Q375-L460 HydrophobicContact CG-CD2 4.43Å; Q375-K475 HydrophobicContact CB-CB 4.49Å; Q375-K475 PolarHBondContact N-O 3.1Å; Q375-K475 PolarHBondContact O-N 3Å
376	G	80.3	Confident	84.2	Confident	39 Å²	39	48.9 Å²	48.9	40%	0.402	27%	0.268	S	S	.	.			trans	88.1	8.7	174.6	0	0	0	0	0	116.5
377	L	82.7	Confident	84.4	Confident	28 Å²	28	46.5 Å²	46.5	15%	0.147	25%	0.252	C	S	.	.			trans	-68.5	124.6	174	-178.6	66.2	0	0	0	111.2	V374 V380 V386 A404 P407 L443 L474	V374-L377 HydrophobicContact CG1-CB 4.29Å; L377-V380 HydrophobicContact CD1-CB 4.45Å; L377-V380 HydrophobicContact CD1-CG2 4.24Å; L377-V386 HydrophobicContact CD2-CG1 4.18Å; L377-A404 HydrophobicContact CD2-CB 3.93Å; L377-P407 HydrophobicContact CD2-CG 4.49Å; L377-L443 HydrophobicContact CD1-CD1 3.93Å; L377-L474 HydrophobicContact CB-CD1 3.96Å; L377-L474 HydrophobicContact CD1-CD1 4.31Å
378	K	77.1	Confident	84.5	Confident	163 Å²	163	46.4 Å²	46.4	71%	0.709	25%	0.251	S	S	*	.			trans	-140.5	-21.1	179.7	-60.9	177.9	-177.7	176.3	0	113.9	V380 D471	K378-V380 PolarHBondContact O-N 3.3Å; K378-V380 VanDerWaalsContact O-N 3.09Å; K378-D471 VanDerWaalsContact CA-OD1 3.3Å; K378-D471 WeakPolarHBondContact CA-OD1 3.37Å; K378-D471 WeakPolarHBondContact CB-OD1 3.46Å; K378-D471 PolarHBondContact N-OD1 2.72Å
379	S	72.2	Confident	84.6	Confident	34 Å²	34	44.8 Å²	44.8	24%	0.238	24%	0.244	C	C	.	.	S	Bend	trans	-73	5.3	-177.4	71.1	0	0	0	0	115.5	S469 D471	S379-S469 PolarHBondContact OG-OG 2.4Å; S379-D471 WeakPolarHBondContact CB-OD2 3.46Å; S379-D471 PolarHBondContact N-OD1 2.82Å; S379-D471 PolarHBondContact N-OD2 3.05Å; S379-D471 PolarHBondContact OG-OD2 3.45Å
380	V	79	Confident	84.7	Confident	23 Å²	23	44.8 Å²	44.8	14%	0.139	24%	0.244	C	C	.	.	S	Bend	trans	-133.7	138.2	-171.9	175.8	0	0	0	0	109.2	L377 K378 R384 A404 T430 L443	L377-V380 HydrophobicContact CD1-CB 4.45Å; L377-V380 HydrophobicContact CD1-CG2 4.24Å; K378-V380 PolarHBondContact O-N 3.3Å; K378-V380 VanDerWaalsContact O-N 3.09Å; V380-R384 HydrophobicContact CG1-CB 3.41Å; V380-R384 VanDerWaalsContact CG1-CB 3.41Å; V380-R384 HydrophobicContact CG1-CG 3.78Å; V380-A404 HydrophobicContact CB-CB 4.38Å; V380-A404 HydrophobicContact CG1-CB 3.75Å; V380-T430 HydrophobicContact CG2-CG2 4.22Å; V380-L443 HydrophobicContact CG2-CD1 3.89Å; V380-L443 HydrophobicContact CG2-CD2 3.7Å; V380-L443 HydrophobicContact CG2-CG 4.47Å
381	A	76.1	Confident	84.7	Confident	49 Å²	49	45 Å²	45	41%	0.405	24%	0.242	S	C	.	.			trans	-65.8	143.1	180	0	0	0	0	0	111.4	N383 R384	A381-N383 PolarHBondContact O-N 2.91Å; A381-R384 HydrophobicContact CB-CG 4.19Å; A381-R384 WeakPolarHBondContact O-CB 3.35Å; A381-R384 PolarHBondContact O-N 3.46Å
382	P	75.9	Confident	84.6	Confident	88 Å²	88	45.1 Å²	45.1	57%	0.571	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.1	-31.5	-170	-27.8	35.4	0	0	0	115.3	R384 S405	P382-R384 VanDerWaalsContact C-N 3.33Å; P382-R384 PolarHBondContact O-N 3.18Å; P382-S405 WeakPolarHBondContact O-CB 3.35Å; P382-S405 PolarHBondContact O-N 2.86Å
383	N	80.7	Confident	84.1	Confident	132 Å²	132	45.3 Å²	45.3	71%	0.706	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.2	11	-178.8	69.7	-42.1	0	0	0	114.4	A381	A381-N383 PolarHBondContact O-N 2.91Å
384	R	84.8	Confident	83.4	Confident	86 Å²	86	46.7 Å²	46.7	33%	0.325	27%	0.267	S	S	.	.	S	Bend	trans	-84.3	147.4	173.1	-78.3	-94.6	173.8	175.3	-11.3	110.7	V380 A381 P382 A404 E431 T433	V380-R384 HydrophobicContact CG1-CB 3.41Å; V380-R384 VanDerWaalsContact CG1-CB 3.41Å; V380-R384 HydrophobicContact CG1-CG 3.78Å; A381-R384 HydrophobicContact CB-CG 4.19Å; A381-R384 WeakPolarHBondContact O-CB 3.35Å; A381-R384 PolarHBondContact O-N 3.46Å; P382-R384 VanDerWaalsContact C-N 3.33Å; P382-R384 PolarHBondContact O-N 3.18Å; R384-A404 HydrophobicContact CB-CB 4.41Å; R384-A404 WeakPolarHBondContact O-CB 3.34Å; R384-A404 PolarHBondContact O-N 3.47Å; R384-E431 PolarHBondContact NH1-O 2.82Å; R384-T433 PolarHBondContact NH1-OG1 2.85Å; R384-T433 PolarHBondContact NH2-OG1 3.27Å
385	I	85.6	Confident	83.1	Confident	49 Å²	49	51 Å²	51	25%	0.251	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	139.1	169.2	-69.6	174.7	0	0	0	110.7	Q401 A402 T430 E431	I385-Q401 HydrophobicContact CG2-CB 3.62Å; I385-Q401 HydrophobicContact CG2-CG 3.6Å; I385-A402 CarbonylContact C-O 3.49Å; I385-A402 WeakPolarHBondContact CA-O 3.31Å; I385-T430 WeakPolarHBondContact O-CA 3.29Å; I385-T430 PolarHBondContact O-OG1 2.93Å; I385-E431 HydrophobicContact CB-CB 4.21Å; I385-E431 HydrophobicContact CG2-CB 4.37Å; I385-E431 PolarHBondContact O-N 3.09Å; I385-E431 VanDerWaalsContact O-N 3.16Å
386	V	89.4	Confident	83.1	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	151.6	170.5	-68.3	0	0	0	0	110.5	L377 A402 A404 P407 W409 L428 F429 L443	L377-V386 HydrophobicContact CD2-CG1 4.18Å; V386-A402 WeakPolarHBondContact CG2-O 3.39Å; V386-A402 PolarHBondContact N-O 3.24Å; V386-A402 PolarHBondContact O-N 2.88Å; V386-A404 HydrophobicContact CG1-CB 4.2Å; V386-P407 HydrophobicContact CG2-CB 3.93Å; V386-W409 HydrophobicContact CG2-CH2 4.29Å; V386-W409 HydrophobicContact CG2-CZ2 4.16Å; V386-L428 HydrophobicContact CB-CD1 4.24Å; V386-F429 VanDerWaalsContact CA-O 3.23Å; V386-F429 WeakPolarHBondContact CA-O 3.23Å; V386-F429 WeakPolarHBondContact CB-O 3.49Å; V386-L443 HydrophobicContact CG1-CD1 4.01Å
387	Y	90.2	Very high	83.4	Confident	21 Å²	21	54 Å²	54	8%	0.082	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	155.6	175.1	62	-93	0	0	0	110.4	T389 Q398 F429 D440	Y387-T389 HydrophobicContact CD2-CG2 3.84Å; Y387-T389 HydrophobicContact CE2-CG2 3.69Å; Y387-Q398 VanDerWaalsContact CD2-CD 3.45Å; Y387-Q398 HydrophobicContact CD2-CG 3.8Å; Y387-Q398 HydrophobicContact CE2-CG 4.29Å; Y387-Q398 HydrophobicContact CG-CG 4.48Å; Y387-F429 HydrophobicContact CD1-CB 4.44Å; Y387-F429 HydrophobicContact CD2-CB 4.21Å; Y387-F429 HydrophobicContact CE1-CB 4Å; Y387-F429 HydrophobicContact CE2-CB 3.75Å; Y387-F429 AromaticContact CE2-CD2 3.94Å; Y387-F429 HydrophobicContact CE2-CD2 3.94Å; Y387-F429 HydrophobicContact CE2-CG 4.06Å; Y387-F429 PolarHBondContact N-O 2.81Å; Y387-F429 VanDerWaalsContact N-O 3.13Å; Y387-F429 PolarHBondContact O-N 3.32Å; Y387-D440 VanDerWaalsContact CE1-OD2 3.28Å; Y387-D440 WeakPolarHBondContact CE1-OD2 3.49Å; Y387-D440 WeakPolarHBondContact OH-CB 3.29Å; Y387-D440 PolarHBondContact OH-OD2 2.7Å
388	C	91.1	Very high	83.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	155.3	172.7	-68.7	0	0	0	0	111.1	I371 T399 V426 K427	I371-C388 HydrophobicContact CD1-CB 3.65Å; I371-C388 HydrophobicContact CG2-CB 4.45Å; C388-T399 HydrophobicContact CB-CG2 3.77Å; C388-T399 PolarHBondContact N-OG1 2.88Å; C388-T399 PolarHBondContact O-N 2.81Å; C388-T399 PolarHBondContact O-OG1 2.69Å; C388-V426 HydrophobicContact CB-CG1 4.31Å; C388-K427 CarbonylContact C-O 3.49Å; C388-K427 VanDerWaalsContact CA-O 3.25Å; C388-K427 WeakPolarHBondContact CA-O 3.39Å
389	T	89.7	Confident	84.1	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	132.7	170	72.5	0	0	0	0	110.6	Y387 K396 L397 Q398 V426 K427 F429	Y387-T389 HydrophobicContact CD2-CG2 3.84Å; Y387-T389 HydrophobicContact CE2-CG2 3.69Å; T389-K396 VanDerWaalsContact CG2-CE 3.46Å; T389-K396 WeakPolarHBondContact OG1-CE 3.42Å; T389-L397 CarbonylContact C-O 3.57Å; T389-L397 VanDerWaalsContact CA-O 3.26Å; T389-L397 WeakPolarHBondContact CA-O 3.12Å; T389-L397 WeakPolarHBondContact CB-O 3.29Å; T389-Q398 HydrophobicContact CG2-CB 4.18Å; T389-Q398 HydrophobicContact CG2-CG 4.2Å; T389-V426 WeakPolarHBondContact O-CA 3.18Å; T389-K427 PolarHBondContact N-O 3.33Å; T389-K427 PolarHBondContact O-N 3.18Å; T389-F429 HydrophobicContact CG2-CD2 4.01Å; T389-F429 HydrophobicContact CG2-CE2 4.08Å
390	M	91.2	Very high	84.7	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	119	179.4	-61.5	173.1	-69.3	0	0	108.3	I369 I371 K396 L397 F415 V426	I369-M390 HydrophobicContact CB-SD 3.86Å; I369-M390 HydrophobicContact CG2-CG 4.09Å; I369-M390 HydrophobicContact CG2-SD 3.51Å; I369-M390 VanDerWaalsContact CG2-SD 3.51Å; I371-M390 HydrophobicContact CD1-CG 3.53Å; I371-M390 HydrophobicContact CD1-SD 3.88Å; I371-M390 HydrophobicContact CG1-CG 4.33Å; I371-M390 HydrophobicContact CG1-SD 4.14Å; M390-K396 CarbonylContact O-C 3.53Å; M390-K396 VanDerWaalsContact O-CA 3.3Å; M390-K396 WeakPolarHBondContact O-CA 3.35Å; M390-L397 HydrophobicContact CE-CB 3.95Å; M390-L397 PolarHBondContact N-O 3.03Å; M390-L397 PolarHBondContact O-N 3.35Å; M390-F415 HydrophobicContact CB-CE2 3.99Å; M390-F415 HydrophobicContact CB-CZ 3.75Å; M390-V426 HydrophobicContact CG-CG2 4.19Å
391	E	89.6	Confident	85	Confident	32 Å²	32	57.2 Å²	57.2	15%	0.15	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	113.9	-176.6	-174.8	-164.7	137.6	0	0	109.3	E395 K425 K427	E391-E395 CarbonylContact C-O 3.42Å; E391-E395 WeakPolarHBondContact CA-O 3.39Å; E391-K425 HydrophobicContact CB-CB 4.27Å; E391-K425 PolarHBondContact N-O 3.43Å; E391-K425 PolarHBondContact O-N 3.24Å; E391-K425 WeakPolarHBondContact OE1-CD 3.26Å; E391-K425 WeakPolarHBondContact OE1-CE 3.28Å; E391-K425 IonicContact OE1-NZ 3.59Å; E391-K425 PolarHBondContact OE1-NZ 3.15Å; E391-K427 IonicContact OE2-NZ 3.09Å; E391-K427 PolarHBondContact OE2-NZ 2.96Å
392	V	87.6	Confident	85.5	Confident	3 Å²	3	55.6 Å²	55.6	2%	0.018	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	106.9	-179.6	-176.7	0	0	0	0	107.9	L367 I369 G394 E395 F415 V424	L367-V392 HydrophobicContact CD1-CG1 3.84Å; I369-V392 HydrophobicContact CD1-CG2 3.67Å; V392-G394 PolarHBondContact O-N 3.45Å; V392-E395 PolarHBondContact N-O 2.78Å; V392-E395 PolarHBondContact O-N 3.41Å; V392-F415 HydrophobicContact CB-CB 4.25Å; V392-F415 HydrophobicContact CB-CD1 3.54Å; V392-F415 HydrophobicContact CB-CD2 4.49Å; V392-F415 HydrophobicContact CB-CE1 3.87Å; V392-F415 HydrophobicContact CB-CG 3.87Å; V392-F415 HydrophobicContact CB-CZ 4.47Å; V392-F415 HydrophobicContact CG1-CB 4.19Å; V392-F415 HydrophobicContact CG1-CD1 4.34Å; V392-F415 HydrophobicContact CG1-CG 4.35Å; V392-F415 HydrophobicContact CG2-CB 4.29Å; V392-F415 HydrophobicContact CG2-CD1 3.68Å; V392-F415 HydrophobicContact CG2-CD2 3.78Å; V392-F415 HydrophobicContact CG2-CE1 3.78Å; V392-F415 HydrophobicContact CG2-CE2 3.89Å; V392-F415 HydrophobicContact CG2-CG 3.66Å; V392-F415 HydrophobicContact CG2-CZ 3.88Å; V392-V424 HydrophobicContact CG2-CG1 4.48Å; V392-V424 HydrophobicContact CG2-CG2 4.13Å
393	E	78.1	Confident	86	Confident	80 Å²	80	56.7 Å²	56.7	37%	0.374	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.5	2.4	169.9	-47	-158.1	134.8	0	0	117.2	T417 H419 P422	E393-T417 WeakPolarHBondContact OE2-CB 3.35Å; E393-T417 PolarHBondContact OE2-OG1 2.97Å; E393-H419 IonicContact OE1-CE1 3.54Å; E393-H419 IonicContact OE1-CG 2.78Å; E393-H419 IonicContact OE1-ND1 3.18Å; E393-H419 PolarHBondContact OE1-ND1 2.73Å; E393-H419 IonicContact OE2-CE1 3.42Å; E393-H419 IonicContact OE2-CG 2.72Å; E393-H419 IonicContact OE2-ND1 3.53Å; E393-H419 PolarHBondContact OE2-ND1 2.98Å; E393-P422 VanDerWaalsContact OE1-CA 3.3Å; E393-P422 WeakPolarHBondContact OE1-CA 3.45Å; E393-P422 WeakPolarHBondContact OE1-CB 3.44Å
394	G	75.7	Confident	86.1	Confident	64 Å²	64	51 Å²	51	66%	0.66	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	137.1	-27.9	179.1	0	0	0	0	0	111.7	V392	V392-G394 PolarHBondContact O-N 3.45Å
395	E	82.1	Confident	85.8	Confident	101 Å²	101	50 Å²	50	47%	0.472	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	136.3	171.2	-169.9	165.8	-143.7	0	0	110	E391 V392 F415	E391-E395 CarbonylContact C-O 3.42Å; E391-E395 WeakPolarHBondContact CA-O 3.39Å; V392-E395 PolarHBondContact N-O 2.78Å; V392-E395 PolarHBondContact O-N 3.41Å; E395-F415 HydrophobicContact CB-CD1 4.1Å; E395-F415 HydrophobicContact CB-CE1 4.17Å; E395-F415 HydrophobicContact CG-CD1 3.91Å; E395-F415 HydrophobicContact CG-CE1 3.91Å; E395-F415 WeakPolarHBondContact OE2-CD1 3.33Å
396	K	85.8	Confident	85.7	Confident	116 Å²	116	55.9 Å²	55.9	50%	0.504	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	114.9	-175.9	-174.7	-166.6	173.5	-162.8	0	110.5	T389 M390	T389-K396 VanDerWaalsContact CG2-CE 3.46Å; T389-K396 WeakPolarHBondContact OG1-CE 3.42Å; M390-K396 CarbonylContact O-C 3.53Å; M390-K396 VanDerWaalsContact O-CA 3.3Å; M390-K396 WeakPolarHBondContact O-CA 3.35Å
397	L	86.7	Confident	85.4	Confident	65 Å²	65	56.5 Å²	56.5	34%	0.34	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	158.7	168.9	-62.5	179.1	0	0	0	110.4	T389 M390 F415	T389-L397 CarbonylContact C-O 3.57Å; T389-L397 VanDerWaalsContact CA-O 3.26Å; T389-L397 WeakPolarHBondContact CA-O 3.12Å; T389-L397 WeakPolarHBondContact CB-O 3.29Å; M390-L397 HydrophobicContact CE-CB 3.95Å; M390-L397 PolarHBondContact N-O 3.03Å; M390-L397 PolarHBondContact O-N 3.35Å; L397-F415 HydrophobicContact CB-CE1 4.48Å; L397-F415 HydrophobicContact CB-CZ 3.86Å; L397-F415 HydrophobicContact CD1-CD2 4.5Å; L397-F415 HydrophobicContact CD1-CE1 4.06Å; L397-F415 HydrophobicContact CD1-CE2 3.86Å; L397-F415 HydrophobicContact CD1-CZ 3.63Å; L397-F415 HydrophobicContact CG-CE1 3.91Å; L397-F415 HydrophobicContact CG-CE2 4.39Å; L397-F415 HydrophobicContact CG-CZ 3.67Å
398	Q	86.1	Confident	85.1	Confident	94 Å²	94	59.4 Å²	59.4	44%	0.439	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	141.6	-177.3	171.8	161.5	-27.5	0	0	109.9	Y387 T389	Y387-Q398 VanDerWaalsContact CD2-CD 3.45Å; Y387-Q398 HydrophobicContact CD2-CG 3.8Å; Y387-Q398 HydrophobicContact CE2-CG 4.29Å; Y387-Q398 HydrophobicContact CG-CG 4.48Å; T389-Q398 HydrophobicContact CG2-CB 4.18Å; T389-Q398 HydrophobicContact CG2-CG 4.2Å
399	T	87.7	Confident	84.9	Confident	4 Å²	4	60.6 Å²	60.6	3%	0.025	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-80.5	163.4	172.5	69.7	0	0	0	0	110.8	I371 C388 W409	I371-T399 HydrophobicContact CB-CG2 4.28Å; I371-T399 HydrophobicContact CD1-CG2 3.84Å; C388-T399 HydrophobicContact CB-CG2 3.77Å; C388-T399 PolarHBondContact N-OG1 2.88Å; C388-T399 PolarHBondContact O-N 2.81Å; C388-T399 PolarHBondContact O-OG1 2.69Å; T399-W409 HydrophobicContact CG2-CG 4.49Å; T399-W409 PolarHBondContact OG1-NE1 3.49Å
400	D	85.8	Confident	84.5	Confident	108 Å²	108	63.8 Å²	63.8	58%	0.578	34%	0.342	S	S	*	.	P	Polyproline II helix	trans	-55.9	157.6	170.8	-51.6	-82.3	0	0	0	112.2	W409 T411	D400-W409 PolarHBondContact O-NE1 3.15Å; D400-T411 PolarHBondContact OD2-OG1 2.71Å
401	Q	85.9	Confident	84.2	Confident	109 Å²	109	65 Å²	65	51%	0.509	35%	0.35	S	S	.	.	P	Polyproline II helix	trans	-74.9	128.6	174.5	-74.5	-172.6	-28.9	0	0	110.3	I385 E431	I385-Q401 HydrophobicContact CG2-CB 3.62Å; I385-Q401 HydrophobicContact CG2-CG 3.6Å; Q401-E431 PolarHBondContact NE2-OE1 2.88Å
402	A	86.4	Confident	84	Confident	14 Å²	14	68.2 Å²	68.2	12%	0.116	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	155.8	177.3	0	0	0	0	0	111.1	I385 V386 W409	I385-A402 CarbonylContact C-O 3.49Å; I385-A402 WeakPolarHBondContact CA-O 3.31Å; V386-A402 WeakPolarHBondContact CG2-O 3.39Å; V386-A402 PolarHBondContact N-O 3.24Å; V386-A402 PolarHBondContact O-N 2.88Å; A402-W409 HydrophobicContact CB-CZ2 3.99Å
403	E	85.8	Confident	83.9	Confident	112 Å²	112	68.1 Å²	68.1	52%	0.523	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	142.9	172.8	-71.2	-170.9	-172.8	0	0	111.8	S405 R406	E403-S405 VanDerWaalsContact CB-OG 3.23Å; E403-S405 WeakPolarHBondContact CB-OG 3.48Å; E403-S405 PolarHBondContact O-N 2.81Å; E403-S405 PolarHBondContact OE2-OG 3.41Å; E403-R406 CarbonylContact O-C 3.6Å; E403-R406 PolarHBondContact O-N 3.09Å
404	A	82.4	Confident	84.4	Confident	13 Å²	13	69.1 Å²	69.1	11%	0.107	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-19.2	170.9	0	0	0	0	0	113.1	L377 V380 R384 V386 R406	L377-A404 HydrophobicContact CD2-CB 3.93Å; V380-A404 HydrophobicContact CB-CB 4.38Å; V380-A404 HydrophobicContact CG1-CB 3.75Å; R384-A404 HydrophobicContact CB-CB 4.41Å; R384-A404 WeakPolarHBondContact O-CB 3.34Å; R384-A404 PolarHBondContact O-N 3.47Å; V386-A404 HydrophobicContact CG1-CB 4.2Å; A404-R406 VanDerWaalsContact C-N 3.29Å
405	S	78.9	Confident	85	Confident	65 Å²	65	66.3 Å²	66.3	46%	0.455	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-33	170	70.6	0	0	0	0	113	P382 E403	P382-S405 WeakPolarHBondContact O-CB 3.35Å; P382-S405 PolarHBondContact O-N 2.86Å; E403-S405 VanDerWaalsContact CB-OG 3.23Å; E403-S405 WeakPolarHBondContact CB-OG 3.48Å; E403-S405 PolarHBondContact O-N 2.81Å; E403-S405 PolarHBondContact OE2-OG 3.41Å
406	R	83.7	Confident	85.1	Confident	172 Å²	172	66.1 Å²	66.1	65%	0.649	35%	0.347	S	S	*	.	S	Bend	trans	-152.9	71.2	-174.6	-168.9	179	175.4	175.2	-2	110.9	E403 A404 Q408	E403-R406 CarbonylContact O-C 3.6Å; E403-R406 PolarHBondContact O-N 3.09Å; A404-R406 VanDerWaalsContact C-N 3.29Å; R406-Q408 VanDerWaalsContact C-N 3.28Å; R406-Q408 HydrophobicContact CG-CG 4.12Å; R406-Q408 PolarHBondContact O-N 3.23Å
407	P	82.3	Confident	85.1	Confident	13 Å²	13	60.8 Å²	60.8	8%	0.084	33%	0.325	C	S	.	.			trans	-77.2	78	-177.3	32.4	-36.2	0	0	0	111	E373 V374 L377 V386 W409	E373-P407 CarbonylContact C-O 3.47Å; E373-P407 VanDerWaalsContact CA-O 3.3Å; E373-P407 WeakPolarHBondContact CA-O 3.34Å; V374-P407 HydrophobicContact CB-CB 4.27Å; V374-P407 HydrophobicContact CB-CG 4.15Å; V374-P407 HydrophobicContact CG1-CG 4.45Å; V374-P407 PolarHBondContact N-O 3.31Å; V374-P407 WeakPolarHBondContact O-CG 3.28Å; L377-P407 HydrophobicContact CD2-CG 4.49Å; V386-P407 HydrophobicContact CG2-CB 3.93Å; P407-W409 HydrophobicContact CB-CH2 3.65Å; P407-W409 HydrophobicContact CB-CZ2 4.38Å; P407-W409 HydrophobicContact CB-CZ3 3.95Å; P407-W409 WeakPolarHBondContact O-CZ3 3.16Å
408	Q	84.4	Confident	85	Confident	82 Å²	82	60.5 Å²	60.5	38%	0.383	33%	0.326	S	S	.	.	B	Isolated β-bridge	trans	-120.5	141.3	176.6	-57.9	-168.9	-60.5	0	0	109.7	M372 E373 R406	M372-Q408 CarbonylContact O-C 3.56Å; M372-Q408 WeakPolarHBondContact O-CA 3.47Å; E373-Q408 HydrophobicContact CB-CB 4.39Å; E373-Q408 HydrophobicContact CB-CG 3.92Å; E373-Q408 PolarHBondContact OE2-NE2 3.45Å; R406-Q408 VanDerWaalsContact C-N 3.28Å; R406-Q408 HydrophobicContact CG-CG 4.12Å; R406-Q408 PolarHBondContact O-N 3.23Å
409	W	87.3	Confident	84.9	Confident	24 Å²	24	57.7 Å²	57.7	9%	0.091	31%	0.312	C	S	.	.			trans	-135.8	162	-177	-64.1	-81.8	0	0	0	110.5	I371 M372 V374 V386 T399 D400 A402 P407 L428	I371-W409 HydrophobicContact CG2-CB 4.42Å; I371-W409 HydrophobicContact CG2-CD2 4.39Å; I371-W409 HydrophobicContact CG2-CE3 3.87Å; I371-W409 CarbonylContact O-C 3.55Å; I371-W409 WeakPolarHBondContact O-CB 3.08Å; M372-W409 WeakPolarHBondContact CA-O 3.28Å; M372-W409 PolarHBondContact O-N 3.33Å; V374-W409 HydrophobicContact CB-CZ3 4.09Å; V374-W409 HydrophobicContact CG2-CH2 4.31Å; V374-W409 HydrophobicContact CG2-CZ3 3.8Å; V386-W409 HydrophobicContact CG2-CH2 4.29Å; V386-W409 HydrophobicContact CG2-CZ2 4.16Å; T399-W409 HydrophobicContact CG2-CG 4.49Å; T399-W409 PolarHBondContact OG1-NE1 3.49Å; D400-W409 PolarHBondContact O-NE1 3.15Å; A402-W409 HydrophobicContact CB-CZ2 3.99Å; P407-W409 HydrophobicContact CB-CH2 3.65Å; P407-W409 HydrophobicContact CB-CZ2 4.38Å; P407-W409 HydrophobicContact CB-CZ3 3.95Å; P407-W409 WeakPolarHBondContact O-CZ3 3.16Å; W409-L428 HydrophobicContact CH2-CD1 3.78Å; W409-L428 HydrophobicContact CZ2-CD1 4.44Å
410	G	80.6	Confident	84.7	Confident	67 Å²	67	57.5 Å²	57.5	69%	0.691	31%	0.311	S	S	*	.			trans	-124.6	9.8	167	0	0	0	0	0	112.7	Q412	G410-Q412 PolarHBondContact O-N 3.33Å
411	T	84.9	Confident	84.7	Confident	28 Å²	28	53.6 Å²	53.6	17%	0.172	29%	0.288	C	S	.	.			trans	-71.9	122.7	-168.8	-31.8	0	0	0	0	111	I371 D400	I371-T411 PolarHBondContact N-O 3.07Å; D400-T411 PolarHBondContact OD2-OG1 2.71Å
412	Q	85.1	Confident	84.7	Confident	99 Å²	99	48.4 Å²	48.4	46%	0.463	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	136.9	169.2	179.1	177.8	-26.9	0	0	109.2	E368 I369 V370 G410 D414	E368-Q412 HydrophobicContact CG-CG 3.93Å; I369-Q412 CarbonylContact O-C 3.6Å; I369-Q412 WeakPolarHBondContact O-CA 3.21Å; V370-Q412 HydrophobicContact CG2-CB 4.1Å; V370-Q412 HydrophobicContact CG2-CG 4.04Å; G410-Q412 PolarHBondContact O-N 3.33Å; Q412-D414 PolarHBondContact NE2-OD1 2.91Å; Q412-D414 PolarHBondContact NE2-OD2 3.47Å; Q412-D414 VanDerWaalsContact NE2-OD2 3.15Å
413	G	86.6	Confident	84.7	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	115.9	169.3	0	0	0	0	0	109.8	I369 F415	I369-G413 PolarHBondContact N-O 3.21Å; I369-G413 PolarHBondContact O-N 2.94Å; G413-F415 WeakPolarHBondContact O-CD2 3.35Å
414	D	87.7	Confident	84.8	Confident	100 Å²	100	42.8 Å²	42.8	54%	0.535	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	130.2	176.1	-61.5	-34.3	0	0	0	109.7	L367 Q412	L367-D414 CarbonylContact O-C 3.53Å; L367-D414 WeakPolarHBondContact O-CA 3.48Å; Q412-D414 PolarHBondContact NE2-OD1 2.91Å; Q412-D414 PolarHBondContact NE2-OD2 3.47Å; Q412-D414 VanDerWaalsContact NE2-OD2 3.15Å
415	F	87.9	Confident	85.2	Confident	5 Å²	5	45.4 Å²	45.4	2%	0.022	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	158.4	-178.2	-61.9	-97.6	0	0	0	110.4	L367 I369 M390 V392 E395 L397 G413	L367-F415 HydrophobicContact CB-CB 4.13Å; L367-F415 PolarHBondContact N-O 2.95Å; L367-F415 PolarHBondContact O-N 2.96Å; I369-F415 HydrophobicContact CD1-CD2 3.82Å; I369-F415 HydrophobicContact CD1-CE2 3.75Å; M390-F415 HydrophobicContact CB-CE2 3.99Å; M390-F415 HydrophobicContact CB-CZ 3.75Å; V392-F415 HydrophobicContact CB-CB 4.25Å; V392-F415 HydrophobicContact CB-CD1 3.54Å; V392-F415 HydrophobicContact CB-CD2 4.49Å; V392-F415 HydrophobicContact CB-CE1 3.87Å; V392-F415 HydrophobicContact CB-CG 3.87Å; V392-F415 HydrophobicContact CB-CZ 4.47Å; V392-F415 HydrophobicContact CG1-CB 4.19Å; V392-F415 HydrophobicContact CG1-CD1 4.34Å; V392-F415 HydrophobicContact CG1-CG 4.35Å; V392-F415 HydrophobicContact CG2-CB 4.29Å; V392-F415 HydrophobicContact CG2-CD1 3.68Å; V392-F415 HydrophobicContact CG2-CD2 3.78Å; V392-F415 HydrophobicContact CG2-CE1 3.78Å; V392-F415 HydrophobicContact CG2-CE2 3.89Å; V392-F415 HydrophobicContact CG2-CG 3.66Å; V392-F415 HydrophobicContact CG2-CZ 3.88Å; E395-F415 HydrophobicContact CB-CD1 4.1Å; E395-F415 HydrophobicContact CB-CE1 4.17Å; E395-F415 HydrophobicContact CG-CD1 3.91Å; E395-F415 HydrophobicContact CG-CE1 3.91Å; E395-F415 WeakPolarHBondContact OE2-CD1 3.33Å; L397-F415 HydrophobicContact CB-CE1 4.48Å; L397-F415 HydrophobicContact CB-CZ 3.86Å; L397-F415 HydrophobicContact CD1-CD2 4.5Å; L397-F415 HydrophobicContact CD1-CE1 4.06Å; L397-F415 HydrophobicContact CD1-CE2 3.86Å; L397-F415 HydrophobicContact CD1-CZ 3.63Å; L397-F415 HydrophobicContact CG-CE1 3.91Å; L397-F415 HydrophobicContact CG-CE2 4.39Å; L397-F415 HydrophobicContact CG-CZ 3.67Å; G413-F415 WeakPolarHBondContact O-CD2 3.35Å
416	T	85.1	Confident	85.8	Confident	98 Å²	98	42.3 Å²	42.3	60%	0.601	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-120.1	140.3	169.7	61.7	0	0	0	0	110.9	F365 T366	F365-T416 WeakPolarHBondContact O-CA 3.41Å; T366-T416 HydrophobicContact CG2-CG2 4.48Å
417	T	85.6	Confident	86.1	Confident	4 Å²	4	36.3 Å²	36.3	3%	0.025	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	151	179.5	176.6	0	0	0	0	111.1	F365 L367 E393 H419 P422	F365-T417 HydrophobicContact CB-CG2 3.87Å; F365-T417 HydrophobicContact CD2-CG2 4.38Å; F365-T417 HydrophobicContact CG-CG2 4.5Å; F365-T417 PolarHBondContact N-O 3.44Å; F365-T417 PolarHBondContact O-N 3.24Å; L367-T417 HydrophobicContact CD1-CG2 3.6Å; L367-T417 HydrophobicContact CG-CG2 4.12Å; E393-T417 WeakPolarHBondContact OE2-CB 3.35Å; E393-T417 PolarHBondContact OE2-OG1 2.97Å; T417-H419 PolarHBondContact OG1-N 2.62Å; T417-P422 HydrophobicContact CG2-CB 4.02Å; T417-P422 HydrophobicContact CG2-CG 4.16Å
418	T	84.8	Confident	86.5	Confident	59 Å²	59	35.7 Å²	35.7	36%	0.362	20%	0.198	S	C	.	.	S	Bend	trans	-100.9	4.8	169.7	57.5	0	0	0	0	113.4	V362 L363 S530	V362-T418 HydrophobicContact CG1-CG2 4.24Å; L363-T418 CarbonylContact O-C 3.56Å; L363-T418 WeakPolarHBondContact O-CA 3.34Å; L363-T418 WeakPolarHBondContact O-CB 3.45Å; T418-S530 WeakPolarHBondContact O-CA 3.39Å
419	H	84.6	Confident	86.7	Confident	34 Å²	34	33 Å²	33	16%	0.157	19%	0.185	C	C	.	.			trans	-98	120.4	-178.2	-65.5	166.9	0	0	0	110.9	E393 T417 R421 P422 S530	E393-H419 IonicContact OE1-CE1 3.54Å; E393-H419 IonicContact OE1-CG 2.78Å; E393-H419 IonicContact OE1-ND1 3.18Å; E393-H419 PolarHBondContact OE1-ND1 2.73Å; E393-H419 IonicContact OE2-CE1 3.42Å; E393-H419 IonicContact OE2-CG 2.72Å; E393-H419 IonicContact OE2-ND1 3.53Å; E393-H419 PolarHBondContact OE2-ND1 2.98Å; T417-H419 PolarHBondContact OG1-N 2.62Å; H419-R421 PolarHBondContact O-N 2.63Å; H419-P422 HydrophobicContact CB-CB 4.34Å; H419-P422 WeakPolarHBondContact O-CD 3.38Å; H419-S530 PolarHBondContact CD2-N 3.47Å; H419-S530 PolarHBondContact NE2-N 3.18Å
420	P	82.7	Confident	86.7	Confident	1 Å²	1	32.4 Å²	32.4	1%	0.006	18%	0.184	C	C	.	.	S	Bend	trans	-65.5	-9	174.3	-23.4	35.2	0	0	0	114.9	L363 F365 Y509 V511 Y525	L363-P420 HydrophobicContact CD1-CG 4.44Å; F365-P420 HydrophobicContact CE2-CB 4.09Å; F365-P420 HydrophobicContact CE2-CG 3.84Å; F365-P420 HydrophobicContact CZ-CB 3.77Å; F365-P420 HydrophobicContact CZ-CG 3.86Å; P420-Y509 HydrophobicContact CB-CE1 4.46Å; P420-V511 HydrophobicContact CB-CG2 4.32Å; P420-Y525 HydrophobicContact CB-CG 4.37Å; P420-Y525 HydrophobicContact CG-CD1 3.68Å; P420-Y525 HydrophobicContact CG-CD2 4.32Å; P420-Y525 HydrophobicContact CG-CE1 3.8Å; P420-Y525 HydrophobicContact CG-CE2 4.44Å; P420-Y525 HydrophobicContact CG-CG 3.94Å
421	R	85	Confident	86.7	Confident	25 Å²	25	32.3 Å²	32.3	9%	0.094	17%	0.166	C	C	.	.	S	Bend	trans	-138.7	80.2	169.1	-71.4	-166.9	61.7	-139.6	-11.5	109	H419 Y493 Y509 E527 K528	H419-R421 PolarHBondContact O-N 2.63Å; R421-Y493 PolarHBondContact NE-OH 2.82Å; R421-Y493 PolarHBondContact NH1-OH 3.14Å; R421-Y509 HydrophobicContact CG-CD1 3.83Å; R421-Y509 HydrophobicContact CG-CE1 3.99Å; R421-Y509 HydrophobicContact CG-CG 4.19Å; R421-E527 VanDerWaalsContact CZ-CG 3.43Å; R421-E527 IonicContact CZ-OE1 3.37Å; R421-E527 VanDerWaalsContact NH1-CG 3.32Å; R421-E527 IonicContact NH1-OE1 2.69Å; R421-E527 PolarHBondContact NH1-OE1 3.43Å; R421-E527 IonicContact NH2-OE1 3.95Å; R421-E527 PolarHBondContact NH2-OE1 3.17Å; R421-K528 PolarHBondContact O-N 1.82Å
422	P	86.2	Confident	86.1	Confident	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.			trans	-77	174.4	-179.4	35.9	-35.2	0	0	0	110	L367 E393 T417 H419 P450 M482	L367-P422 HydrophobicContact CD1-CB 4.25Å; L367-P422 HydrophobicContact CD1-CG 3.97Å; L367-P422 HydrophobicContact CD2-CG 4.43Å; E393-P422 VanDerWaalsContact OE1-CA 3.3Å; E393-P422 WeakPolarHBondContact OE1-CA 3.45Å; E393-P422 WeakPolarHBondContact OE1-CB 3.44Å; T417-P422 HydrophobicContact CG2-CB 4.02Å; T417-P422 HydrophobicContact CG2-CG 4.16Å; H419-P422 HydrophobicContact CB-CB 4.34Å; H419-P422 WeakPolarHBondContact O-CD 3.38Å; P422-P450 HydrophobicContact CG-CG 3.86Å; P422-M482 HydrophobicContact CG-CE 4.02Å; P422-M482 HydrophobicContact CG-SD 4.17Å
423	V	86.8	Confident	84.9	Confident	8 Å²	8	32.9 Å²	32.9	5%	0.048	18%	0.178	C	C	.	.			trans	-127.4	104.5	178.2	-174.1	0	0	0	0	110.6	K425 I447 Y449 K528	V423-K425 HydrophobicContact CG1-CG 4.39Å; V423-I447 HydrophobicContact CG1-CG2 3.6Å; V423-Y449 HydrophobicContact CB-CE1 4.4Å; V423-Y449 HydrophobicContact CG1-CE1 4.07Å; V423-Y449 HydrophobicContact CG2-CD1 3.79Å; V423-Y449 HydrophobicContact CG2-CE1 3.55Å; V423-K528 HydrophobicContact CG2-CD 4.28Å; V423-K528 HydrophobicContact CG2-CG 3.67Å
424	V	88.6	Confident	83.6	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	127.7	174.8	177.5	0	0	0	0	108.3	I369 V392 V426 I447 L448 P450 V480	I369-V424 HydrophobicContact CD1-CB 4.35Å; I369-V424 HydrophobicContact CD1-CG1 3.48Å; I369-V424 VanDerWaalsContact CD1-CG1 3.48Å; I369-V424 HydrophobicContact CD1-CG2 3.9Å; I369-V424 HydrophobicContact CG1-CG1 4.33Å; V392-V424 HydrophobicContact CG2-CG1 4.48Å; V392-V424 HydrophobicContact CG2-CG2 4.13Å; V424-V426 HydrophobicContact CG1-CG2 4.23Å; V424-I447 CarbonylContact O-C 3.58Å; V424-I447 WeakPolarHBondContact O-CA 3.23Å; V424-L448 HydrophobicContact CB-CB 4.37Å; V424-L448 PolarHBondContact N-O 3.47Å; V424-L448 PolarHBondContact O-N 3.15Å; V424-P450 HydrophobicContact CG2-CG 3.97Å; V424-V480 HydrophobicContact CG2-CG1 4.37Å
425	K	90.3	Very high	82	Confident	68 Å²	68	37.3 Å²	37.3	30%	0.296	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	129.5	171	-42.7	171.7	-158.6	153.6	0	108.2	E391 V423 V446 I447	E391-K425 HydrophobicContact CB-CB 4.27Å; E391-K425 PolarHBondContact N-O 3.43Å; E391-K425 PolarHBondContact O-N 3.24Å; E391-K425 WeakPolarHBondContact OE1-CD 3.26Å; E391-K425 WeakPolarHBondContact OE1-CE 3.28Å; E391-K425 IonicContact OE1-NZ 3.59Å; E391-K425 PolarHBondContact OE1-NZ 3.15Å; V423-K425 HydrophobicContact CG1-CG 4.39Å; K425-V446 WeakPolarHBondContact CA-O 3.35Å; K425-I447 HydrophobicContact CB-CG1 4.47Å; K425-I447 HydrophobicContact CG-CG1 4.26Å; K425-I447 HydrophobicContact CG-CG2 4.45Å
426	V	90.9	Very high	80.6	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.006	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	126.1	172.1	179.5	0	0	0	0	108.7	I371 C388 T389 M390 V424 R445 V446 I476 L478	I371-V426 HydrophobicContact CD1-CG1 3.5Å; I371-V426 VanDerWaalsContact CD1-CG1 3.5Å; I371-V426 HydrophobicContact CD1-CG2 4.36Å; I371-V426 HydrophobicContact CG1-CG1 4.43Å; C388-V426 HydrophobicContact CB-CG1 4.31Å; T389-V426 WeakPolarHBondContact O-CA 3.18Å; M390-V426 HydrophobicContact CG-CG2 4.19Å; V424-V426 HydrophobicContact CG1-CG2 4.23Å; V426-R445 CarbonylContact O-C 3.58Å; V426-R445 VanDerWaalsContact O-CA 3.24Å; V426-R445 WeakPolarHBondContact O-CA 3.29Å; V426-V446 HydrophobicContact CB-CG1 3.77Å; V426-V446 PolarHBondContact N-O 3.48Å; V426-V446 PolarHBondContact O-N 2.83Å; V426-I476 HydrophobicContact CG1-CD1 3.72Å; V426-L478 HydrophobicContact CB-CD2 4.36Å; V426-L478 HydrophobicContact CG1-CD2 4.49Å; V426-L478 HydrophobicContact CG2-CD2 4.11Å
427	K	91.5	Very high	79.3	Confident	46 Å²	46	43 Å²	43	20%	0.2	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	137.3	-178.4	-67	164.2	173.1	161	0	109.4	C388 T389 E391 F429 R445	C388-K427 CarbonylContact C-O 3.49Å; C388-K427 VanDerWaalsContact CA-O 3.25Å; C388-K427 WeakPolarHBondContact CA-O 3.39Å; T389-K427 PolarHBondContact N-O 3.33Å; T389-K427 PolarHBondContact O-N 3.18Å; E391-K427 IonicContact OE2-NZ 3.09Å; E391-K427 PolarHBondContact OE2-NZ 2.96Å; K427-F429 HydrophobicContact CB-CD2 4.2Å; K427-F429 HydrophobicContact CB-CE2 3.5Å; K427-F429 HydrophobicContact CB-CZ 4.13Å; K427-F429 HydrophobicContact CD-CE2 4.08Å; K427-F429 HydrophobicContact CD-CZ 4.07Å; K427-F429 HydrophobicContact CG-CE2 4.44Å; K427-R445 HydrophobicContact CG-CB 3.89Å
428	L	89.6	Confident	78	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	132.7	172.9	176.1	71.5	0	0	0	109.3	V374 V386 W409 L443 G444 M463 L474	V374-L428 HydrophobicContact CG1-CD2 4.01Å; V374-L428 HydrophobicContact CG2-CD1 4.34Å; V374-L428 HydrophobicContact CG2-CD2 4.22Å; V386-L428 HydrophobicContact CB-CD1 4.24Å; W409-L428 HydrophobicContact CH2-CD1 3.78Å; W409-L428 HydrophobicContact CZ2-CD1 4.44Å; L428-L443 HydrophobicContact CB-CB 4.5Å; L428-L443 HydrophobicContact CD2-CB 4.02Å; L428-L443 HydrophobicContact CD2-CD1 3.98Å; L428-L443 HydrophobicContact CG-CB 4.14Å; L428-L443 HydrophobicContact CG-CD1 4.03Å; L428-L443 PolarHBondContact O-N 2.89Å; L428-G444 PolarHBondContact N-O 2.64Å; L428-M463 HydrophobicContact CB-CE 3.92Å; L428-M463 HydrophobicContact CB-SD 4.41Å; L428-L474 HydrophobicContact CD2-CD2 4.1Å
429	F	88.4	Confident	77.3	Confident	26 Å²	26	56.7 Å²	56.7	11%	0.114	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	160.2	179.1	-70.3	-88.1	0	0	0	111.6	V386 Y387 T389 K427 D440 K441 E442	V386-F429 VanDerWaalsContact CA-O 3.23Å; V386-F429 WeakPolarHBondContact CA-O 3.23Å; V386-F429 WeakPolarHBondContact CB-O 3.49Å; Y387-F429 HydrophobicContact CD1-CB 4.44Å; Y387-F429 HydrophobicContact CD2-CB 4.21Å; Y387-F429 HydrophobicContact CE1-CB 4Å; Y387-F429 HydrophobicContact CE2-CB 3.75Å; Y387-F429 AromaticContact CE2-CD2 3.94Å; Y387-F429 HydrophobicContact CE2-CD2 3.94Å; Y387-F429 HydrophobicContact CE2-CG 4.06Å; Y387-F429 PolarHBondContact N-O 2.81Å; Y387-F429 VanDerWaalsContact N-O 3.13Å; Y387-F429 PolarHBondContact O-N 3.32Å; T389-F429 HydrophobicContact CG2-CD2 4.01Å; T389-F429 HydrophobicContact CG2-CE2 4.08Å; K427-F429 HydrophobicContact CB-CD2 4.2Å; K427-F429 HydrophobicContact CB-CE2 3.5Å; K427-F429 HydrophobicContact CB-CZ 4.13Å; K427-F429 HydrophobicContact CD-CE2 4.08Å; K427-F429 HydrophobicContact CD-CZ 4.07Å; K427-F429 HydrophobicContact CG-CE2 4.44Å; F429-D440 HydrophobicContact CB-CB 4.39Å; F429-D440 HydrophobicContact CD1-CB 4.1Å; F429-K441 WeakPolarHBondContact CA-O 3.39Å; F429-E442 HydrophobicContact CD1-CB 4.27Å; F429-E442 HydrophobicContact CE1-CB 3.85Å; F429-E442 HydrophobicContact CZ-CB 4.37Å
430	T	87.3	Confident	77.1	Confident	10 Å²	10	57 Å²	57	6%	0.061	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	143.6	163.8	-173.4	0	0	0	0	111	V380 I385 K441 L443	V380-T430 HydrophobicContact CG2-CG2 4.22Å; I385-T430 WeakPolarHBondContact O-CA 3.29Å; I385-T430 PolarHBondContact O-OG1 2.93Å; T430-K441 HydrophobicContact CG2-CB 4.13Å; T430-K441 PolarHBondContact N-O 3.39Å; T430-K441 PolarHBondContact O-N 3.09Å; T430-L443 HydrophobicContact CG2-CD1 4.15Å; T430-L443 HydrophobicContact CG2-CD2 3.87Å; T430-L443 HydrophobicContact CG2-CG 4.12Å
431	E	80.8	Confident	77.2	Confident	66 Å²	66	63 Å²	63	31%	0.308	34%	0.342	S	S	.	.			trans	-67.8	131.7	-174.1	-169.3	178	-118.6	0	0	112.7	R384 I385 Q401 T433 D440	R384-E431 PolarHBondContact NH1-O 2.82Å; I385-E431 HydrophobicContact CB-CB 4.21Å; I385-E431 HydrophobicContact CG2-CB 4.37Å; I385-E431 PolarHBondContact O-N 3.09Å; I385-E431 VanDerWaalsContact O-N 3.16Å; Q401-E431 PolarHBondContact NE2-OE1 2.88Å; E431-T433 PolarHBondContact O-N 3.1Å; E431-D440 WeakPolarHBondContact CA-OD1 3.38Å
432	S	73.5	Confident	77.2	Confident	42 Å²	42	64.1 Å²	64.1	29%	0.294	35%	0.349	S	S	.	.			trans	-91.7	83.2	-173.8	55.1	0	0	0	0	112.3	G434 D440	S432-G434 PolarHBondContact O-N 3.26Å; S432-D440 VanDerWaalsContact CB-OD1 3.29Å; S432-D440 WeakPolarHBondContact CB-OD1 3.4Å; S432-D440 PolarHBondContact N-OD1 3.48Å; S432-D440 PolarHBondContact OG-OD1 2.96Å
433	T	58.7	Low	77.2	Confident	96 Å²	96	64.3 Å²	64.3	59%	0.589	35%	0.349	S	S	*	.			trans	-64.5	35.4	179.8	70.3	0	0	0	0	116.1	R384 E431	R384-T433 PolarHBondContact NH1-OG1 2.85Å; R384-T433 PolarHBondContact NH2-OG1 3.27Å; E431-T433 PolarHBondContact O-N 3.1Å
434	G	59.9	Low	77.2	Confident	40 Å²	40	63.9 Å²	63.9	41%	0.412	35%	0.347	S	S	.	.	S	Bend	trans	-127.6	128.2	-177.3	0	0	0	0	0	111.3	S432 L436 A437	S432-G434 PolarHBondContact O-N 3.26Å; G434-L436 PolarHBondContact O-N 3.19Å; G434-A437 WeakPolarHBondContact O-CB 3.47Å; G434-A437 PolarHBondContact O-N 3.03Å
435	V	54.7	Low	77.2	Confident	155 Å²	155	69.1 Å²	69.1	94%	0.939	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-4.8	-172.7	-170.9	0	0	0	0	114.4
436	L	57.2	Low	77.3	Confident	171 Å²	171	66.3 Å²	66.3	90%	0.895	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.4	10.8	178.2	-62.6	173.7	0	0	0	113.3	G434	G434-L436 PolarHBondContact O-N 3.19Å
437	A	58.3	Low	77.2	Confident	51 Å²	51	69.8 Å²	69.8	42%	0.421	37%	0.373	S	S	.	.			trans	-83.3	126.6	173.1	0	0	0	0	0	110.2	G434	G434-A437 WeakPolarHBondContact O-CB 3.47Å; G434-A437 PolarHBondContact O-N 3.03Å
438	L	58.7	Low	77	Confident	178 Å²	178	68.8 Å²	68.8	93%	0.932	37%	0.37	S	S	*	.			trans	-98.4	-17.2	179.8	-72.3	167	0	0	0	113.4
439	E	69.9	Low	76.8	Confident	172 Å²	172	73.9 Å²	73.9	80%	0.804	39%	0.39	S	S	*	.	S	Bend	trans	-144.2	144.9	179.2	-65	-172.2	162.1	0	0	110.6
440	D	81.1	Confident	76.6	Confident	41 Å²	41	73 Å²	73	22%	0.219	39%	0.387	C	S	.	.			trans	-73.8	154.3	174.1	-80.4	-25.3	0	0	0	112.8	Y387 F429 E431 S432 E442	Y387-D440 VanDerWaalsContact CE1-OD2 3.28Å; Y387-D440 WeakPolarHBondContact CE1-OD2 3.49Å; Y387-D440 WeakPolarHBondContact OH-CB 3.29Å; Y387-D440 PolarHBondContact OH-OD2 2.7Å; F429-D440 HydrophobicContact CB-CB 4.39Å; F429-D440 HydrophobicContact CD1-CB 4.1Å; E431-D440 WeakPolarHBondContact CA-OD1 3.38Å; S432-D440 VanDerWaalsContact CB-OD1 3.29Å; S432-D440 WeakPolarHBondContact CB-OD1 3.4Å; S432-D440 PolarHBondContact N-OD1 3.48Å; S432-D440 PolarHBondContact OG-OD1 2.96Å; D440-E442 PolarHBondContact O-N 3.48Å
441	K	83.6	Confident	76.3	Confident	126 Å²	126	73.5 Å²	73.5	55%	0.548	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	113.2	-171.5	-175.8	-174.5	175.8	-167.5	0	111.9	F429 T430 L443	F429-K441 WeakPolarHBondContact CA-O 3.39Å; T430-K441 HydrophobicContact CG2-CB 4.13Å; T430-K441 PolarHBondContact N-O 3.39Å; T430-K441 PolarHBondContact O-N 3.09Å; K441-L443 HydrophobicContact CD-CD2 4.49Å; K441-L443 PolarHBondContact O-N 3.48Å
442	E	86.1	Confident	76.1	Confident	50 Å²	50	71.3 Å²	71.3	23%	0.234	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	119.5	168.4	-172.9	177.2	115.5	0	0	109.3	F429 D440 R445	F429-E442 HydrophobicContact CD1-CB 4.27Å; F429-E442 HydrophobicContact CE1-CB 3.85Å; F429-E442 HydrophobicContact CZ-CB 4.37Å; D440-E442 PolarHBondContact O-N 3.48Å; E442-R445 WeakPolarHBondContact OE1-CD 3.36Å; E442-R445 IonicContact OE1-CZ 2.87Å; E442-R445 IonicContact OE1-NH1 3.85Å; E442-R445 PolarHBondContact OE1-NH1 3.39Å; E442-R445 VanDerWaalsContact OE1-NH1 3.09Å
443	L	85	Confident	76	Confident	3 Å²	3	73.9 Å²	73.9	2%	0.016	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	-31.4	177.3	-64.9	176.8	0	0	0	112	L377 V380 V386 L428 T430 K441 P466	L377-L443 HydrophobicContact CD1-CD1 3.93Å; V380-L443 HydrophobicContact CG2-CD1 3.89Å; V380-L443 HydrophobicContact CG2-CD2 3.7Å; V380-L443 HydrophobicContact CG2-CG 4.47Å; V386-L443 HydrophobicContact CG1-CD1 4.01Å; L428-L443 HydrophobicContact CB-CB 4.5Å; L428-L443 HydrophobicContact CD2-CB 4.02Å; L428-L443 HydrophobicContact CD2-CD1 3.98Å; L428-L443 HydrophobicContact CG-CB 4.14Å; L428-L443 HydrophobicContact CG-CD1 4.03Å; L428-L443 PolarHBondContact O-N 2.89Å; T430-L443 HydrophobicContact CG2-CD1 4.15Å; T430-L443 HydrophobicContact CG2-CD2 3.87Å; T430-L443 HydrophobicContact CG2-CG 4.12Å; K441-L443 HydrophobicContact CD-CD2 4.49Å; K441-L443 PolarHBondContact O-N 3.48Å; L443-P466 WeakPolarHBondContact O-CD 3.46Å
444	G	86.6	Confident	76.6	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.6	165.2	176.5	0	0	0	0	0	112	L428 M463 V464	L428-G444 PolarHBondContact N-O 2.64Å; G444-M463 WeakPolarHBondContact O-CE 3.36Å; G444-V464 CarbonylContact C-O 3.39Å; G444-V464 VanDerWaalsContact CA-O 3.25Å; G444-V464 WeakPolarHBondContact CA-O 3.41Å
445	R	90.3	Very high	77	Confident	109 Å²	109	72.3 Å²	72.3	41%	0.411	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	151.9	-178.1	65.8	177.6	-178.2	-128.1	9.1	113.7	V426 K427 E442 V464	V426-R445 CarbonylContact O-C 3.58Å; V426-R445 VanDerWaalsContact O-CA 3.24Å; V426-R445 WeakPolarHBondContact O-CA 3.29Å; K427-R445 HydrophobicContact CG-CB 3.89Å; E442-R445 WeakPolarHBondContact OE1-CD 3.36Å; E442-R445 IonicContact OE1-CZ 2.87Å; E442-R445 IonicContact OE1-NH1 3.85Å; E442-R445 PolarHBondContact OE1-NH1 3.39Å; E442-R445 VanDerWaalsContact OE1-NH1 3.09Å; R445-V464 HydrophobicContact CG-CB 4.38Å; R445-V464 PolarHBondContact N-O 3.39Å; R445-V464 PolarHBondContact O-N 3.13Å
446	V	90.9	Very high	77.8	Confident	10 Å²	10	70.1 Å²	70.1	6%	0.061	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	148.6	169.2	63.5	0	0	0	0	109.4	K425 V426 L448 H461 I476 L478	K425-V446 WeakPolarHBondContact CA-O 3.35Å; V426-V446 HydrophobicContact CB-CG1 3.77Å; V426-V446 PolarHBondContact N-O 3.48Å; V426-V446 PolarHBondContact O-N 2.83Å; V446-L448 HydrophobicContact CG2-CD2 3.73Å; V446-L448 HydrophobicContact CG2-CG 4.05Å; V446-H461 HydrophobicContact CG2-CB 3.97Å; V446-I476 HydrophobicContact CB-CG2 4.38Å; V446-I476 HydrophobicContact CG1-CG2 3.81Å; V446-L478 HydrophobicContact CG1-CD2 4.28Å
447	I	88.9	Confident	78.8	Confident	74 Å²	74	65.4 Å²	65.4	38%	0.379	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	125.8	177	-57	178.8	0	0	0	107.7	V423 V424 K425 Y449	V423-I447 HydrophobicContact CG1-CG2 3.6Å; V424-I447 CarbonylContact O-C 3.58Å; V424-I447 WeakPolarHBondContact O-CA 3.23Å; K425-I447 HydrophobicContact CB-CG1 4.47Å; K425-I447 HydrophobicContact CG-CG1 4.26Å; K425-I447 HydrophobicContact CG-CG2 4.45Å; I447-Y449 HydrophobicContact CG2-CE2 4.1Å
448	L	87	Confident	79.9	Confident	25 Å²	25	64.6 Å²	64.6	13%	0.131	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	150.2	-173	-56	176.4	0	0	0	110.8	V424 V446 H461 L478 V480	V424-L448 HydrophobicContact CB-CB 4.37Å; V424-L448 PolarHBondContact N-O 3.47Å; V424-L448 PolarHBondContact O-N 3.15Å; V446-L448 HydrophobicContact CG2-CD2 3.73Å; V446-L448 HydrophobicContact CG2-CG 4.05Å; L448-H461 WeakPolarHBondContact CD2-CD2 3.48Å; L448-L478 HydrophobicContact CD1-CD1 3.71Å; L448-L478 HydrophobicContact CD1-CD2 4.45Å; L448-V480 HydrophobicContact CD1-CG2 3.89Å
449	Y	85.2	Confident	81.2	Confident	106 Å²	106	60.3 Å²	60.3	42%	0.416	31%	0.306	S	S	.	.			trans	-126.3	75.6	-177.8	-59.3	-90.2	0	0	0	108.5	V423 I447	V423-Y449 HydrophobicContact CB-CE1 4.4Å; V423-Y449 HydrophobicContact CG1-CE1 4.07Å; V423-Y449 HydrophobicContact CG2-CD1 3.79Å; V423-Y449 HydrophobicContact CG2-CE1 3.55Å; I447-Y449 HydrophobicContact CG2-CE2 4.1Å
450	P	84.6	Confident	81.9	Confident	7 Å²	7	56.5 Å²	56.5	5%	0.045	29%	0.291	C	S	.	.			trans	-66.5	161.5	-177.7	31.8	-37.4	0	0	0	111.4	L367 P422 V424 V480 M482	L367-P450 HydrophobicContact CD2-CB 4.4Å; L367-P450 HydrophobicContact CD2-CG 3.81Å; P422-P450 HydrophobicContact CG-CG 3.86Å; V424-P450 HydrophobicContact CG2-CG 3.97Å; P450-V480 HydrophobicContact CB-CB 4.46Å; P450-V480 HydrophobicContact CB-CG1 3.66Å; P450-V480 HydrophobicContact CG-CG1 3.85Å; P450-M482 HydrophobicContact CB-CB 4.41Å; P450-M482 HydrophobicContact CB-SD 4.36Å; P450-M482 HydrophobicContact CG-SD 4.38Å
451	T	81.1	Confident	82.2	Confident	22 Å²	22	56.8 Å²	56.8	14%	0.135	29%	0.291	C	S	.	.			trans	-142	163.4	174.5	62.6	0	0	0	0	109.1	N453 S454 Y509	T451-N453 PolarHBondContact O-N 3.2Å; T451-S454 PolarHBondContact N-OG 3.06Å; T451-S454 VanDerWaalsContact O-CB 3.26Å; T451-S454 WeakPolarHBondContact O-CB 2.92Å; T451-S454 PolarHBondContact O-N 2.88Å; T451-S454 PolarHBondContact O-OG 3.01Å; T451-S454 PolarHBondContact OG1-N 3.02Å; T451-S454 PolarHBondContact OG1-OG 3.43Å; T451-Y509 HydrophobicContact CG2-CE2 4.21Å
452	S	76.8	Confident	82.4	Confident	20 Å²	20	58.5 Å²	58.5	14%	0.14	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-15.4	174.5	55.2	0	0	0	0	114.9	M488 S491	S452-M488 WeakPolarHBondContact OG-CE 3.48Å; S452-S491 PolarHBondContact OG-OG 3.34Å
453	N	72.3	Confident	82.5	Confident	96 Å²	96	56.6 Å²	56.6	51%	0.513	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	6.7	-179.1	-53.2	10.9	0	0	0	111.6	T451 S491	T451-N453 PolarHBondContact O-N 3.2Å; N453-S491 PolarHBondContact ND2-O 3.15Å
454	S	71.5	Confident	82.5	Confident	44 Å²	44	61 Å²	61	31%	0.308	31%	0.312	S	S	.	.	S	Bend	trans	-71.8	152.7	179.1	-68.8	0	0	0	0	112.3	T451 K456	T451-S454 PolarHBondContact N-OG 3.06Å; T451-S454 VanDerWaalsContact O-CB 3.26Å; T451-S454 WeakPolarHBondContact O-CB 2.92Å; T451-S454 PolarHBondContact O-N 2.88Å; T451-S454 PolarHBondContact O-OG 3.01Å; T451-S454 PolarHBondContact OG1-N 3.02Å; T451-S454 PolarHBondContact OG1-OG 3.43Å; S454-K456 PolarHBondContact O-N 2.86Å
455	S	68.6	Low	82.4	Confident	58 Å²	58	62.8 Å²	62.8	41%	0.406	32%	0.323	S	S	.	.			trans	-54.3	129.2	176.9	-175.4	0	0	0	0	112	S457 E459	S455-S457 PolarHBondContact OG-OG 2.73Å; S455-E459 WeakPolarHBondContact CB-OE1 3.48Å; S455-E459 PolarHBondContact OG-OE1 2.57Å
456	K	71.3	Confident	81.9	Confident	110 Å²	110	60.5 Å²	60.5	48%	0.478	32%	0.322	S	S	.	.			trans	-88.2	2	178.9	-66.9	-154.3	168	-157.8	0	113.9	S454 R481 D483	S454-K456 PolarHBondContact O-N 2.86Å; K456-R481 HydrophobicContact CB-CG 4Å; K456-R481 HydrophobicContact CD-CG 4.24Å; K456-R481 HydrophobicContact CG-CG 3.99Å; K456-R481 PolarHBondContact O-NE 2.91Å; K456-R481 VanDerWaalsContact O-NE 3.09Å; K456-D483 IonicContact NZ-OD1 2.67Å; K456-D483 PolarHBondContact NZ-OD1 3.02Å
457	S	78.2	Confident	80.9	Confident	71 Å²	71	70 Å²	70	50%	0.497	36%	0.363	S	S	.	.	S	Bend	trans	-93.3	163.6	176.4	62.3	0	0	0	0	112	S455	S455-S457 PolarHBondContact OG-OG 2.73Å
458	A	81	Confident	79.6	Confident	34 Å²	34	74.3 Å²	74.3	28%	0.281	39%	0.386	S	S	.	.			trans	-85.7	121.8	-179.9	0	0	0	0	0	111.6	M372 K477 L478 A479	M372-A458 HydrophobicContact CG-CB 4.25Å; M372-A458 HydrophobicContact SD-CB 3.35Å; M372-A458 WeakPolarHBondContact SD-CB 3.22Å; A458-K477 HydrophobicContact CB-CG 4.39Å; A458-L478 CarbonylContact C-O 3.57Å; A458-L478 WeakPolarHBondContact CA-O 3.46Å; A458-A479 HydrophobicContact CB-CB 4.08Å
459	E	84.8	Confident	78.7	Confident	88 Å²	88	75 Å²	75	41%	0.411	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	149.4	-172.2	-70.2	178	-164.9	0	0	112.1	S455 H461 K477 L478	S455-E459 WeakPolarHBondContact CB-OE1 3.48Å; S455-E459 PolarHBondContact OG-OE1 2.57Å; E459-H461 PolarHBondContact O-N 3.19Å; E459-H461 PolarHBondContact O-ND1 2.86Å; E459-K477 WeakPolarHBondContact O-CA 3.43Å; E459-L478 PolarHBondContact N-O 3.24Å; E459-L478 PolarHBondContact O-N 3Å; E459-L478 VanDerWaalsContact O-N 3.15Å
460	L	86.1	Confident	77.8	Confident	92 Å²	92	77.6 Å²	77.6	48%	0.482	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	101.8	-178	-91.5	163.1	0	0	0	110.8	Q375 K475 K477	Q375-L460 HydrophobicContact CG-CD2 4.43Å; L460-K475 HydrophobicContact CD2-CB 4.17Å; L460-K477 HydrophobicContact CD2-CB 3.8Å; L460-K477 HydrophobicContact CD2-CG 4.48Å; L460-K477 HydrophobicContact CG-CB 4.13Å; L460-K477 HydrophobicContact CG-CG 4.28Å
461	H	86.9	Confident	77.4	Confident	47 Å²	47	77.5 Å²	77.5	22%	0.218	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	134.9	-178.7	-60.6	83.3	0	0	0	111.1	V446 L448 E459 K475 I476	V446-H461 HydrophobicContact CG2-CB 3.97Å; L448-H461 WeakPolarHBondContact CD2-CD2 3.48Å; E459-H461 PolarHBondContact O-N 3.19Å; E459-H461 PolarHBondContact O-ND1 2.86Å; H461-K475 CarbonylContact O-C 3.59Å; H461-K475 VanDerWaalsContact O-CA 3.29Å; H461-K475 WeakPolarHBondContact O-CA 3.05Å; H461-I476 HydrophobicContact CB-CG2 4.22Å; H461-I476 PolarHBondContact N-O 2.91Å; H461-I476 PolarHBondContact O-N 3.45Å
462	R	87.8	Confident	76.7	Confident	163 Å²	163	81.2 Å²	81.2	62%	0.615	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.6	131.3	174.4	-167.2	178.9	-175	-164	0.3	110.5	S472 D473 K475	R462-S472 PolarHBondContact NH2-O 3.13Å; R462-D473 IonicContact NE-OD1 3.64Å; R462-K475 HydrophobicContact CB-CG 4.45Å
463	M	87.6	Confident	76.8	Confident	9 Å²	9	83.7 Å²	83.7	4%	0.044	45%	0.447	C	S	.	.	P	Polyproline II helix	trans	-85.8	145.4	177.8	-55.6	-168.7	89.3	0	0	111.2	V374 L428 G444 L474 I476	V374-M463 HydrophobicContact CG2-SD 4.41Å; L428-M463 HydrophobicContact CB-CE 3.92Å; L428-M463 HydrophobicContact CB-SD 4.41Å; G444-M463 WeakPolarHBondContact O-CE 3.36Å; M463-L474 HydrophobicContact CB-CB 4.33Å; M463-L474 HydrophobicContact CB-CD2 4.08Å; M463-L474 HydrophobicContact CB-CG 4.23Å; M463-L474 HydrophobicContact CG-CD2 4.37Å; M463-L474 HydrophobicContact CG-CG 4.31Å; M463-L474 PolarHBondContact N-O 3.49Å; M463-L474 HydrophobicContact SD-CD2 3.69Å; M463-L474 HydrophobicContact SD-CG 3.89Å; M463-I476 HydrophobicContact CE-CB 4.34Å; M463-I476 HydrophobicContact CE-CD1 4.2Å; M463-I476 HydrophobicContact CE-CG2 4.17Å; M463-I476 HydrophobicContact CG-CB 4.05Å; M463-I476 HydrophobicContact CG-CG2 3.72Å; M463-I476 HydrophobicContact SD-CB 3.86Å; M463-I476 HydrophobicContact SD-CG2 4.05Å
464	V	86.4	Confident	77.5	Confident	95 Å²	95	79.2 Å²	79.2	58%	0.576	42%	0.423	S	S	*	.	B	Isolated β-bridge	trans	-83.4	118.3	167.7	-177.7	0	0	0	0	108	G444 R445	G444-V464 CarbonylContact C-O 3.39Å; G444-V464 VanDerWaalsContact CA-O 3.25Å; G444-V464 WeakPolarHBondContact CA-O 3.41Å; R445-V464 HydrophobicContact CG-CB 4.38Å; R445-V464 PolarHBondContact N-O 3.39Å; R445-V464 PolarHBondContact O-N 3.13Å
465	V	84.1	Confident	78.3	Confident	39 Å²	39	80.1 Å²	80.1	24%	0.236	42%	0.421	C	S	.	.			trans	-105.7	144.9	-173.3	177.5	0	0	0	0	110.5	D471 L474	V465-D471 HydrophobicContact CG1-CB 4.42Å; V465-D471 WeakPolarHBondContact CG1-O 3.43Å; V465-D471 WeakPolarHBondContact CG2-O 3.36Å; V465-L474 HydrophobicContact CG2-CB 3.7Å; V465-L474 HydrophobicContact CG2-CD2 3.86Å; V465-L474 HydrophobicContact CG2-CG 4.45Å
466	P	78.2	Confident	79.3	Confident	60 Å²	60	77.4 Å²	77.4	39%	0.39	40%	0.402	S	S	.	.			trans	-59.4	146.1	175.2	-25.2	35.6	0	0	0	113.5	L443 N468 S469	L443-P466 WeakPolarHBondContact O-CD 3.46Å; P466-N468 PolarHBondContact O-N 2.89Å; P466-S469 PolarHBondContact O-N 2.98Å; P466-S469 VanDerWaalsContact O-N 3.14Å
467	K	71.4	Confident	80.2	Confident	211 Å²	211	75.1 Å²	75.1	92%	0.917	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-14.2	-170.8	-67.6	-173.9	176.7	-177.4	0	116.6
468	N	62.1	Low	80.8	Confident	163 Å²	163	71.8 Å²	71.8	87%	0.872	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	19.1	-175.4	-61.4	14.1	0	0	0	112.8	P466	P466-N468 PolarHBondContact O-N 2.89Å
469	S	68	Low	81.2	Confident	40 Å²	40	70.5 Å²	70.5	28%	0.28	36%	0.358	S	S	.	.			trans	-91	159.3	176.4	-167.9	0	0	0	0	112.9	S379 P466 D471	S379-S469 PolarHBondContact OG-OG 2.4Å; P466-S469 PolarHBondContact O-N 2.98Å; P466-S469 VanDerWaalsContact O-N 3.14Å; S469-D471 PolarHBondContact OG-N 3.09Å
470	Q	65.5	Low	81.3	Confident	161 Å²	161	67 Å²	67	75%	0.752	34%	0.342	S	S	*	.	S	Bend	trans	-84.9	-10.2	168.7	-64.7	-175.3	-7.3	0	0	112.8	S472	Q470-S472 PolarHBondContact O-N 3.38Å
471	D	75.2	Confident	81.3	Confident	5 Å²	5	66.7 Å²	66.7	3%	0.027	34%	0.335	C	S	.	.			trans	-88.4	88.1	-174.2	-58.5	-34.1	0	0	0	112.2	K378 S379 V465 S469 L474	K378-D471 VanDerWaalsContact CA-OD1 3.3Å; K378-D471 WeakPolarHBondContact CA-OD1 3.37Å; K378-D471 WeakPolarHBondContact CB-OD1 3.46Å; K378-D471 PolarHBondContact N-OD1 2.72Å; S379-D471 WeakPolarHBondContact CB-OD2 3.46Å; S379-D471 PolarHBondContact N-OD1 2.82Å; S379-D471 PolarHBondContact N-OD2 3.05Å; S379-D471 PolarHBondContact OG-OD2 3.45Å; V465-D471 HydrophobicContact CG1-CB 4.42Å; V465-D471 WeakPolarHBondContact CG1-O 3.43Å; V465-D471 WeakPolarHBondContact CG2-O 3.36Å; S469-D471 PolarHBondContact OG-N 3.09Å; D471-L474 HydrophobicContact CB-CB 4.34Å
472	S	66.5	Low	81.3	Confident	99 Å²	99	64.6 Å²	64.6	69%	0.692	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-13.8	-176.2	55.2	0	0	0	0	115.4	R462 Q470	R462-S472 PolarHBondContact NH2-O 3.13Å; Q470-S472 PolarHBondContact O-N 3.38Å
473	D	79.4	Confident	81	Confident	73 Å²	73	59.8 Å²	59.8	39%	0.39	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-136.9	39.7	-178.1	-165.9	38.2	0	0	0	112.9	R462 K475	R462-D473 IonicContact NE-OD1 3.64Å; D473-K475 PolarHBondContact O-N 3.2Å; D473-K475 WeakPolarHBondContact OD1-CE 3.46Å; D473-K475 IonicContact OD1-NZ 3.06Å; D473-K475 PolarHBondContact OD1-NZ 3.41Å; D473-K475 IonicContact OD2-NZ 2.64Å; D473-K475 PolarHBondContact OD2-NZ 3.31Å
474	L	86.5	Confident	80.8	Confident	1 Å²	1	64.7 Å²	64.7	1%	0.005	33%	0.333	C	S	.	.			trans	-63.6	128.7	175.3	-168.1	70.7	0	0	0	110.8	V374 L377 L428 M463 V465 D471	V374-L474 HydrophobicContact CG1-CD1 3.61Å; V374-L474 HydrophobicContact CG1-CG 4.38Å; L377-L474 HydrophobicContact CB-CD1 3.96Å; L377-L474 HydrophobicContact CD1-CD1 4.31Å; L428-L474 HydrophobicContact CD2-CD2 4.1Å; M463-L474 HydrophobicContact CB-CB 4.33Å; M463-L474 HydrophobicContact CB-CD2 4.08Å; M463-L474 HydrophobicContact CB-CG 4.23Å; M463-L474 HydrophobicContact CG-CD2 4.37Å; M463-L474 HydrophobicContact CG-CG 4.31Å; M463-L474 PolarHBondContact N-O 3.49Å; M463-L474 HydrophobicContact SD-CD2 3.69Å; M463-L474 HydrophobicContact SD-CG 3.89Å; V465-L474 HydrophobicContact CG2-CB 3.7Å; V465-L474 HydrophobicContact CG2-CD2 3.86Å; V465-L474 HydrophobicContact CG2-CG 4.45Å; D471-L474 HydrophobicContact CB-CB 4.34Å
475	K	88.9	Confident	80.5	Confident	64 Å²	64	61.1 Å²	61.1	28%	0.278	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	149.3	-179.5	-73.8	157.6	179.9	154.9	0	110.6	V374 Q375 L460 H461 R462 D473	V374-K475 CarbonylContact C-O 3.13Å; V374-K475 WeakPolarHBondContact CA-O 3.32Å; Q375-K475 HydrophobicContact CB-CB 4.49Å; Q375-K475 PolarHBondContact N-O 3.1Å; Q375-K475 PolarHBondContact O-N 3Å; L460-K475 HydrophobicContact CD2-CB 4.17Å; H461-K475 CarbonylContact O-C 3.59Å; H461-K475 VanDerWaalsContact O-CA 3.29Å; H461-K475 WeakPolarHBondContact O-CA 3.05Å; R462-K475 HydrophobicContact CB-CG 4.45Å; D473-K475 PolarHBondContact O-N 3.2Å; D473-K475 WeakPolarHBondContact OD1-CE 3.46Å; D473-K475 IonicContact OD1-NZ 3.06Å; D473-K475 PolarHBondContact OD1-NZ 3.41Å; D473-K475 IonicContact OD2-NZ 2.64Å; D473-K475 PolarHBondContact OD2-NZ 3.31Å
476	I	89.8	Confident	79.9	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	129.5	175.5	-172	168.3	0	0	0	109.6	I371 E373 V374 V426 V446 H461 M463 L478	I371-I476 HydrophobicContact CG2-CD1 4.09Å; I371-I476 HydrophobicContact CG2-CG1 4.44Å; E373-I476 CarbonylContact O-C 3.55Å; E373-I476 WeakPolarHBondContact O-CA 3.28Å; V374-I476 HydrophobicContact CG2-CB 4Å; V374-I476 HydrophobicContact CG2-CD1 4.05Å; V374-I476 HydrophobicContact CG2-CG1 3.82Å; V426-I476 HydrophobicContact CG1-CD1 3.72Å; V446-I476 HydrophobicContact CB-CG2 4.38Å; V446-I476 HydrophobicContact CG1-CG2 3.81Å; H461-I476 HydrophobicContact CB-CG2 4.22Å; H461-I476 PolarHBondContact N-O 2.91Å; H461-I476 PolarHBondContact O-N 3.45Å; M463-I476 HydrophobicContact CE-CB 4.34Å; M463-I476 HydrophobicContact CE-CD1 4.2Å; M463-I476 HydrophobicContact CE-CG2 4.17Å; M463-I476 HydrophobicContact CG-CB 4.05Å; M463-I476 HydrophobicContact CG-CG2 3.72Å; M463-I476 HydrophobicContact SD-CB 3.86Å; M463-I476 HydrophobicContact SD-CG2 4.05Å; I476-L478 HydrophobicContact CD1-CD2 4.13Å; I476-L478 HydrophobicContact CG1-CD2 4.17Å; I476-L478 HydrophobicContact CG2-CD2 4.05Å
477	K	90.7	Very high	79.9	Confident	63 Å²	63	62.5 Å²	62.5	27%	0.274	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	118.9	174.6	-172.4	-178.6	179.8	-175.7	0	108.7	M372 E373 A458 E459 L460	M372-K477 HydrophobicContact CB-CB 4.35Å; M372-K477 HydrophobicContact CB-CD 4.28Å; M372-K477 HydrophobicContact CB-CG 4.23Å; M372-K477 WeakPolarHBondContact CB-O 3.35Å; M372-K477 PolarHBondContact N-O 3.07Å; M372-K477 HydrophobicContact SD-CD 4.13Å; M372-K477 HydrophobicContact SD-CG 4.28Å; E373-K477 HydrophobicContact CG-CB 3.7Å; E373-K477 HydrophobicContact CG-CD 3.97Å; E373-K477 HydrophobicContact CG-CG 4.47Å; E373-K477 PolarHBondContact N-O 3.1Å; E373-K477 PolarHBondContact O-N 3.17Å; A458-K477 HydrophobicContact CB-CG 4.39Å; E459-K477 WeakPolarHBondContact O-CA 3.43Å; L460-K477 HydrophobicContact CD2-CB 3.8Å; L460-K477 HydrophobicContact CD2-CG 4.48Å; L460-K477 HydrophobicContact CG-CB 4.13Å; L460-K477 HydrophobicContact CG-CG 4.28Å
478	L	90.5	Very high	80.5	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	156.8	179.6	67	85.7	0	0	0	110.9	V370 I371 V426 V446 L448 A458 E459 I476 V480	V370-L478 CarbonylContact O-C 3.53Å; V370-L478 WeakPolarHBondContact O-CA 3.22Å; V370-L478 VanDerWaalsContact O-CB 3.28Å; V370-L478 WeakPolarHBondContact O-CB 3.21Å; I371-L478 HydrophobicContact CG1-CB 4.24Å; V426-L478 HydrophobicContact CB-CD2 4.36Å; V426-L478 HydrophobicContact CG1-CD2 4.49Å; V426-L478 HydrophobicContact CG2-CD2 4.11Å; V446-L478 HydrophobicContact CG1-CD2 4.28Å; L448-L478 HydrophobicContact CD1-CD1 3.71Å; L448-L478 HydrophobicContact CD1-CD2 4.45Å; A458-L478 CarbonylContact C-O 3.57Å; A458-L478 WeakPolarHBondContact CA-O 3.46Å; E459-L478 PolarHBondContact N-O 3.24Å; E459-L478 PolarHBondContact O-N 3Å; E459-L478 VanDerWaalsContact O-N 3.15Å; I476-L478 HydrophobicContact CD1-CD2 4.13Å; I476-L478 HydrophobicContact CG1-CD2 4.17Å; I476-L478 HydrophobicContact CG2-CD2 4.05Å; L478-V480 HydrophobicContact CD1-CG2 3.46Å; L478-V480 VanDerWaalsContact CD1-CG2 3.46Å
479	A	88.3	Confident	81.6	Confident	7 Å²	7	47 Å²	47	6%	0.058	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	144.8	167	0	0	0	0	0	109.8	I369 V370 A458	I369-A479 WeakPolarHBondContact CA-O 3.42Å; V370-A479 PolarHBondContact N-O 2.88Å; V370-A479 PolarHBondContact O-N 3.22Å; A458-A479 HydrophobicContact CB-CB 4.08Å
480	V	87.8	Confident	82.5	Confident	14 Å²	14	46.1 Å²	46.1	9%	0.085	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	114.5	164.9	-174.3	0	0	0	0	107.8	L367 E368 I369 V424 L448 P450 L478	L367-V480 HydrophobicContact CD2-CG1 4.26Å; E368-V480 WeakPolarHBondContact O-CA 3.28Å; I369-V480 HydrophobicContact CG1-CG1 4.02Å; I369-V480 HydrophobicContact CG1-CG2 4.26Å; I369-V480 HydrophobicContact CG2-CG2 4.44Å; V424-V480 HydrophobicContact CG2-CG1 4.37Å; L448-V480 HydrophobicContact CD1-CG2 3.89Å; P450-V480 HydrophobicContact CB-CB 4.46Å; P450-V480 HydrophobicContact CB-CG1 3.66Å; P450-V480 HydrophobicContact CG-CG1 3.85Å; L478-V480 HydrophobicContact CD1-CG2 3.46Å; L478-V480 VanDerWaalsContact CD1-CG2 3.46Å
481	R	85.4	Confident	83.6	Confident	86 Å²	86	38.5 Å²	38.5	33%	0.325	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	138.4	174.6	-63.3	155.3	172.8	177.2	6.3	108.4	L367 E368 K456	L367-R481 WeakPolarHBondContact CA-O 3.31Å; E368-R481 HydrophobicContact CB-CB 4.26Å; E368-R481 PolarHBondContact N-O 3.18Å; E368-R481 PolarHBondContact O-N 3.4Å; E368-R481 IonicContact OE1-CZ 2.71Å; E368-R481 IonicContact OE1-NH1 3.21Å; E368-R481 PolarHBondContact OE1-NH1 3.18Å; E368-R481 WeakPolarHBondContact OE2-CD 2.93Å; E368-R481 IonicContact OE2-CZ 2.67Å; E368-R481 IonicContact OE2-NE 3.68Å; E368-R481 IonicContact OE2-NH1 3.36Å; E368-R481 PolarHBondContact OE2-NH1 3.33Å; K456-R481 HydrophobicContact CB-CG 4Å; K456-R481 HydrophobicContact CD-CG 4.24Å; K456-R481 HydrophobicContact CG-CG 3.99Å; K456-R481 PolarHBondContact O-NE 2.91Å; K456-R481 VanDerWaalsContact O-NE 3.09Å
482	M	86.8	Confident	84.2	Confident	4 Å²	4	38.6 Å²	38.6	2%	0.02	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	114.9	177.6	-174.3	176.3	-178.3	0	0	106.7	F365 T366 L367 P422 P450	F365-M482 HydrophobicContact CB-CE 3.96Å; F365-M482 HydrophobicContact CD1-CE 3.44Å; F365-M482 VanDerWaalsContact CD1-CE 3.44Å; F365-M482 HydrophobicContact CD1-CG 4.39Å; F365-M482 HydrophobicContact CD2-CE 4.02Å; F365-M482 HydrophobicContact CE1-CE 3.8Å; F365-M482 HydrophobicContact CE2-CE 4.36Å; F365-M482 HydrophobicContact CG-CE 3.56Å; F365-M482 HydrophobicContact CZ-CE 4.27Å; T366-M482 WeakPolarHBondContact O-CA 2.9Å; L367-M482 HydrophobicContact CD2-CB 3.68Å; L367-M482 HydrophobicContact CD2-CG 3.71Å; L367-M482 HydrophobicContact CD2-SD 4.19Å; L367-M482 HydrophobicContact CG-CG 4.45Å; P422-M482 HydrophobicContact CG-CE 4.02Å; P422-M482 HydrophobicContact CG-SD 4.17Å; P450-M482 HydrophobicContact CB-CB 4.41Å; P450-M482 HydrophobicContact CB-SD 4.36Å; P450-M482 HydrophobicContact CG-SD 4.38Å
483	D	82.4	Confident	85.2	Confident	62 Å²	62	38.3 Å²	38.3	33%	0.332	19%	0.187	S	C	.	.			trans	-80.4	148.8	-177	-66.3	-50.4	0	0	0	112	T366 K456 P485	T366-D483 PolarHBondContact O-N 2.83Å; T366-D483 VanDerWaalsContact O-N 3.1Å; T366-D483 PolarHBondContact OG1-OD2 3.23Å; K456-D483 IonicContact NZ-OD1 2.67Å; K456-D483 PolarHBondContact NZ-OD1 3.02Å; D483-P485 WeakPolarHBondContact O-CD 3.33Å
484	K	82.6	Confident	85.7	Confident	111 Å²	111	34.8 Å²	34.8	48%	0.483	17%	0.169	S	C	.	.			trans	-84.6	115.4	-177.8	-177.7	-179.7	171	-176.6	0	109.4	M488 K489	K484-M488 WeakPolarHBondContact CE-O 3.39Å; K484-M488 HydrophobicContact CG-CG 4.4Å; K484-K489 WeakPolarHBondContact CE-O 3.28Å; K484-K489 PolarHBondContact NZ-O 3.33Å
485	P	80.6	Confident	85.9	Confident	21 Å²	21	36.9 Å²	36.9	14%	0.136	18%	0.177	C	C	.	.			trans	-66.2	148.3	-180	-20.3	34.2	0	0	0	111.4	S364 F365 D483 H487 M488	S364-P485 WeakPolarHBondContact O-CG 3.02Å; F365-P485 VanDerWaalsContact CD1-CD 3.49Å; F365-P485 HydrophobicContact CD1-CG 3.44Å; F365-P485 VanDerWaalsContact CD1-CG 3.44Å; F365-P485 VanDerWaalsContact CE1-CD 3.47Å; F365-P485 HydrophobicContact CE1-CG 3.58Å; F365-P485 HydrophobicContact CG-CG 4Å; F365-P485 HydrophobicContact CZ-CG 4.2Å; D483-P485 WeakPolarHBondContact O-CD 3.33Å; P485-H487 PolarHBondContact O-N 3.14Å; P485-H487 VanDerWaalsContact O-N 3.15Å; P485-M488 HydrophobicContact CB-CB 4.42Å; P485-M488 WeakPolarHBondContact O-CB 3.24Å; P485-M488 PolarHBondContact O-N 3.5Å
486	A	72.1	Confident	85.9	Confident	55 Å²	55	33.9 Å²	33.9	46%	0.455	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-33.1	-176.8	0	0	0	0	0	114	M488	A486-M488 VanDerWaalsContact C-N 3.25Å; A486-M488 PolarHBondContact O-N 3.16Å
487	H	77.1	Confident	85.9	Confident	73 Å²	73	36.6 Å²	36.6	34%	0.338	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-16.4	176.6	-63.5	-84	0	0	0	113.7	L363 P485 V513 Q514	L363-H487 HydrophobicContact CD2-CB 3.99Å; P485-H487 PolarHBondContact O-N 3.14Å; P485-H487 VanDerWaalsContact O-N 3.15Å; H487-V513 HydrophobicContact CB-CG1 4.45Å; H487-V513 CarbonylContact O-C 3.51Å; H487-V513 WeakPolarHBondContact O-CA 3.37Å; H487-Q514 PolarHBondContact ND1-O 3.2Å; H487-Q514 PolarHBondContact O-N 3.47Å
488	M	84.7	Confident	85.7	Confident	3 Å²	3	34 Å²	34	2%	0.015	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	98.6	-176.4	176.5	166.2	170.5	0	0	109.7	L363 F365 S452 K484 P485 A486 S491 V511	L363-M488 HydrophobicContact CD1-CB 4.15Å; L363-M488 HydrophobicContact CD1-CG 4.33Å; L363-M488 HydrophobicContact CD1-SD 3.86Å; L363-M488 HydrophobicContact CD2-CB 4.42Å; F365-M488 HydrophobicContact CE1-CE 4.25Å; F365-M488 HydrophobicContact CE1-SD 3.48Å; F365-M488 WeakPolarHBondContact CE1-SD 3.46Å; F365-M488 HydrophobicContact CZ-SD 3.84Å; S452-M488 WeakPolarHBondContact OG-CE 3.48Å; K484-M488 WeakPolarHBondContact CE-O 3.39Å; K484-M488 HydrophobicContact CG-CG 4.4Å; P485-M488 HydrophobicContact CB-CB 4.42Å; P485-M488 WeakPolarHBondContact O-CB 3.24Å; P485-M488 PolarHBondContact O-N 3.5Å; A486-M488 VanDerWaalsContact C-N 3.25Å; A486-M488 PolarHBondContact O-N 3.16Å; M488-S491 VanDerWaalsContact CE-CB 3.41Å; M488-S491 WeakPolarHBondContact CE-OG 3.38Å; M488-V511 HydrophobicContact CB-CG1 4.44Å; M488-V511 HydrophobicContact CE-CG1 3.92Å; M488-V511 HydrophobicContact CE-CG2 4.36Å; M488-V511 HydrophobicContact CG-CG1 3.54Å; M488-V511 HydrophobicContact SD-CG1 3.84Å
489	K	84.9	Confident	85.3	Confident	45 Å²	45	39.7 Å²	39.7	20%	0.196	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	-42.8	-174.2	-61.7	-60.7	-177.7	179.5	0	112.6	D267 K484 L512 Q514 F520	D267-K489 IonicContact OD1-NZ 3.67Å; D267-K489 PolarHBondContact OD1-NZ 3.3Å; D267-K489 WeakPolarHBondContact OD2-CE 3.4Å; D267-K489 IonicContact OD2-NZ 3.56Å; D267-K489 PolarHBondContact OD2-NZ 2.86Å; K484-K489 WeakPolarHBondContact CE-O 3.28Å; K484-K489 PolarHBondContact NZ-O 3.33Å; K489-L512 HydrophobicContact CB-CD2 4.1Å; K489-L512 HydrophobicContact CB-CG 4.16Å; K489-L512 PolarHBondContact N-O 3.04Å; K489-Q514 VanDerWaalsContact CE-CD 3.42Å; K489-Q514 HydrophobicContact CG-CB 4.33Å; K489-F520 HydrophobicContact CG-CD1 4.45Å; K489-F520 HydrophobicContact CG-CE1 4.06Å
490	H	86.6	Confident	85	Confident	22 Å²	22	45.3 Å²	45.3	10%	0.102	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	158.1	178.5	-167.6	83.3	0	0	0	111.6	V511 L512 W581 A584	H490-V511 WeakPolarHBondContact O-CA 3.47Å; H490-L512 HydrophobicContact CB-CB 4.48Å; H490-L512 PolarHBondContact O-N 3.18Å; H490-W581 AromaticContact CD2-CD2 3.4Å; H490-W581 AromaticContact CD2-CE2 3.38Å; H490-W581 AromaticContact CD2-CE3 3.62Å; H490-W581 AromaticContact CD2-CG 3.99Å; H490-W581 AromaticContact CD2-CH2 3.87Å; H490-W581 AromaticContact CD2-CZ2 3.67Å; H490-W581 AromaticContact CD2-CZ3 3.83Å; H490-W581 AromaticContact CD2-NE1 3.85Å; H490-W581 AromaticContact NE2-CD1 3.87Å; H490-W581 AromaticContact NE2-CD2 3.87Å; H490-W581 AromaticContact NE2-CE2 3.65Å; H490-W581 AromaticContact NE2-NE1 3.61Å; H490-A584 HydrophobicContact CB-CB 3.67Å
491	S	88.8	Confident	84.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.3	152.7	176.7	59.7	0	0	0	0	113.4	S452 N453 M488 Y509 F510	S452-S491 PolarHBondContact OG-OG 3.34Å; N453-S491 PolarHBondContact ND2-O 3.15Å; M488-S491 VanDerWaalsContact CE-CB 3.41Å; M488-S491 WeakPolarHBondContact CE-OG 3.38Å; S491-Y509 PolarHBondContact OG-OH 2.88Å; S491-F510 WeakPolarHBondContact CA-O 3.25Å; S491-F510 WeakPolarHBondContact CB-O 3.26Å
492	G	88.1	Confident	85	Confident	8 Å²	8	42.1 Å²	42.1	8%	0.082	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	175.1	-169.1	-176	0	0	0	0	0	111.5	Y509 F510	G492-Y509 WeakPolarHBondContact O-CD2 3.35Å; G492-F510 PolarHBondContact N-O 2.92Å; G492-F510 VanDerWaalsContact N-O 3.08Å; G492-F510 PolarHBondContact O-N 3.42Å
493	Y	87.7	Confident	85	Confident	92 Å²	92	48.7 Å²	48.7	36%	0.361	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	116.9	175	-71.6	-88.6	0	0	0	111.3	R421 K507 R508 Y509	R421-Y493 PolarHBondContact NE-OH 2.82Å; R421-Y493 PolarHBondContact NH1-OH 3.14Å; Y493-K507 HydrophobicContact CD1-CG 4.4Å; Y493-R508 WeakPolarHBondContact CA-O 3.32Å; Y493-Y509 HydrophobicContact CD1-CD2 4.08Å; Y493-Y509 AromaticContact CD2-CD2 3.91Å; Y493-Y509 HydrophobicContact CD2-CD2 3.91Å; Y493-Y509 HydrophobicContact CD2-CE2 4.39Å; Y493-Y509 AromaticContact CE1-CD2 3.92Å; Y493-Y509 HydrophobicContact CE1-CD2 3.92Å; Y493-Y509 HydrophobicContact CE1-CG 4.37Å; Y493-Y509 AromaticContact CE2-CD2 3.74Å; Y493-Y509 HydrophobicContact CE2-CD2 3.74Å; Y493-Y509 HydrophobicContact CE2-CE2 4.18Å; Y493-Y509 HydrophobicContact CG-CD2 4.08Å; Y493-Y509 AromaticContact CZ-CD2 3.75Å
494	L	89.6	Confident	85.2	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	150.5	173.5	-64.1	172.6	0	0	0	111	K507 R508 F510 M522 F559 F570 A571 W581	L494-K507 WeakPolarHBondContact O-CA 3.23Å; L494-R508 PolarHBondContact N-O 2.99Å; L494-R508 PolarHBondContact O-N 3.12Å; L494-F510 HydrophobicContact CB-CD2 3.71Å; L494-F510 HydrophobicContact CB-CE2 4Å; L494-F510 HydrophobicContact CD1-CD2 4.49Å; L494-F510 HydrophobicContact CG-CD2 4.45Å; L494-M522 HydrophobicContact CD1-CE 3.66Å; L494-F559 HydrophobicContact CD1-CE1 4.45Å; L494-F559 HydrophobicContact CD1-CZ 3.82Å; L494-F559 HydrophobicContact CD2-CE1 4Å; L494-F559 HydrophobicContact CD2-CZ 4.19Å; L494-F570 HydrophobicContact CB-CD1 4.43Å; L494-F570 HydrophobicContact CD1-CB 4.44Å; L494-F570 HydrophobicContact CD1-CD1 3.87Å; L494-F570 HydrophobicContact CD1-CG 4.41Å; L494-A571 WeakPolarHBondContact CA-O 3.1Å; L494-W581 HydrophobicContact CD1-CD2 3.73Å; L494-W581 HydrophobicContact CD1-CE3 4.13Å; L494-W581 HydrophobicContact CD1-CG 4.13Å; L494-W581 HydrophobicContact CD1-CH2 4.3Å; L494-W581 HydrophobicContact CD1-CZ2 3.89Å; L494-W581 HydrophobicContact CD1-CZ3 4.42Å; L494-W581 HydrophobicContact CD2-CG 4.26Å; L494-W581 HydrophobicContact CG-CD2 4.35Å; L494-W581 HydrophobicContact CG-CZ2 4.1Å
495	Y	89.9	Confident	85.5	Confident	45 Å²	45	52.7 Å²	52.7	18%	0.176	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	143.5	154	-64	-104	0	0	0	108.5	W505 K507 F570 A571	Y495-W505 HydrophobicContact CD1-CD2 4.42Å; Y495-W505 AromaticContact CD1-CE2 3.84Å; Y495-W505 HydrophobicContact CD1-CZ2 4.28Å; Y495-W505 AromaticContact CD1-NE1 3.52Å; Y495-W505 AromaticContact CG-CE2 3.99Å; Y495-W505 AromaticContact CG-CZ2 3.99Å; Y495-W505 HydrophobicContact CG-CZ2 3.99Å; Y495-K507 HydrophobicContact CD1-CB 4.07Å; Y495-K507 HydrophobicContact CD2-CB 4.28Å; Y495-K507 HydrophobicContact CD2-CD 4.45Å; Y495-K507 HydrophobicContact CD2-CG 4.27Å; Y495-K507 HydrophobicContact CE1-CB 3.83Å; Y495-K507 HydrophobicContact CE2-CB 4.03Å; Y495-K507 HydrophobicContact CE2-CD 3.72Å; Y495-K507 HydrophobicContact CE2-CG 3.99Å; Y495-K507 HydrophobicContact CG-CB 4.28Å; Y495-F570 CarbonylContact O-C 3.48Å; Y495-F570 VanDerWaalsContact O-CA 3.28Å; Y495-F570 WeakPolarHBondContact O-CA 3.41Å; Y495-A571 PolarHBondContact N-O 3.18Å; Y495-A571 PolarHBondContact O-N 3.4Å
496	A	90.4	Very high	85.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	143.3	177.9	0	0	0	0	0	111.8	W502 W505 R508 F510 I569 F570	A496-W502 HydrophobicContact CB-CB 4.26Å; A496-W502 HydrophobicContact CB-CG 4.38Å; A496-W505 VanDerWaalsContact C-CE3 3.49Å; A496-W505 WeakPolarHBondContact O-CA 3.37Å; A496-R508 PolarHBondContact O-NH1 2.94Å; A496-F510 HydrophobicContact CB-CE2 3.89Å; A496-F510 HydrophobicContact CB-CZ 3.5Å; A496-F510 VanDerWaalsContact CB-CZ 3.5Å; A496-I569 VanDerWaalsContact CA-O 3.31Å; A496-I569 WeakPolarHBondContact CA-O 3.29Å; A496-F570 HydrophobicContact CB-CD1 3.71Å; A496-F570 HydrophobicContact CB-CE1 3.79Å
497	L	89	Confident	86.6	Confident	58 Å²	58	59.5 Å²	59.5	30%	0.304	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	122.2	169	174.2	66.2	0	0	0	109.1	W502 W505 L552 V568 I569	L497-W502 WeakPolarHBondContact CA-O 3.34Å; L497-W505 HydrophobicContact CB-CE3 3.71Å; L497-W505 HydrophobicContact CB-CZ3 4.33Å; L497-L552 HydrophobicContact CD2-CD2 4.34Å; L497-V568 CarbonylContact O-C 3.6Å; L497-V568 WeakPolarHBondContact O-CA 3.42Å; L497-I569 PolarHBondContact N-O 3.42Å; L497-I569 PolarHBondContact O-N 2.86Å
498	G	86.1	Confident	87.3	Confident	7 Å²	7	57.6 Å²	57.6	7%	0.072	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	166.7	177.1	0	0	0	0	0	113.1	V501 W502 T567	G498-V501 CarbonylContact C-O 3.35Å; G498-V501 WeakPolarHBondContact CA-O 3.46Å; G498-V501 PolarHBondContact N-O 3.1Å; G498-W502 PolarHBondContact N-O 2.64Å; G498-T567 WeakPolarHBondContact CA-O 3.43Å
499	Q	82.8	Confident	87.5	Confident	120 Å²	120	57.8 Å²	57.8	56%	0.561	25%	0.252	S	S	*	.	S	Bend	trans	-80.7	-49.2	-177.1	-51.7	-175	12.3	0	0	111.8	K503 D566	Q499-K503 WeakPolarHBondContact O-CE 3.13Å; Q499-D566 WeakPolarHBondContact CB-OD1 3.36Å
500	K	82.5	Confident	87.8	Confident	125 Å²	125	55.6 Å²	55.6	54%	0.543	24%	0.243	S	C	.	.	S	Bend	trans	-83.7	-44.9	176.1	-62.1	178.2	-155.1	159	0	112.1	K503 D566	K500-K503 WeakPolarHBondContact O-CE 3.34Å; K500-D566 VanDerWaalsContact CB-OD2 3.28Å; K500-D566 WeakPolarHBondContact CB-OD2 3.39Å; K500-D566 WeakPolarHBondContact CD-OD2 3.41Å; K500-D566 VanDerWaalsContact CE-OD2 3.26Å; K500-D566 WeakPolarHBondContact CE-OD2 3.5Å; K500-D566 WeakPolarHBondContact CG-OD2 3.3Å; K500-D566 IonicContact NZ-OD2 3.29Å
501	V	83.3	Confident	87.9	Confident	33 Å²	33	54.6 Å²	54.6	20%	0.2	24%	0.238	C	C	.	.	S	Bend	trans	-116.5	156.8	-177.4	-69.6	0	0	0	0	112.3	G498 K503 M536 V568	G498-V501 CarbonylContact C-O 3.35Å; G498-V501 WeakPolarHBondContact CA-O 3.46Å; G498-V501 PolarHBondContact N-O 3.1Å; V501-K503 VanDerWaalsContact C-N 3.35Å; V501-K503 PolarHBondContact O-N 3.3Å; V501-M536 HydrophobicContact CG2-CB 4.18Å; V501-M536 HydrophobicContact CG2-CG 4.17Å; V501-M536 HydrophobicContact CG2-SD 3.69Å; V501-V568 HydrophobicContact CG2-CG2 4.24Å
502	W	89.9	Confident	88	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	24%	0.238	C	C	.	.			trans	53.1	44.2	178.7	-54.8	-58	0	0	0	114.6	A496 L497 G498 R504 R508 F510 M522 S524 E534 M536 V568 F570	A496-W502 HydrophobicContact CB-CB 4.26Å; A496-W502 HydrophobicContact CB-CG 4.38Å; L497-W502 WeakPolarHBondContact CA-O 3.34Å; G498-W502 PolarHBondContact N-O 2.64Å; W502-R504 PolarHBondContact O-N 3.42Å; W502-R508 VanDerWaalsContact CD1-NE 3.31Å; W502-F510 AromaticContact CD2-CE1 3.95Å; W502-F510 HydrophobicContact CD2-CE1 3.95Å; W502-F510 HydrophobicContact CD2-CZ 4.01Å; W502-F510 AromaticContact CE2-CE1 3.5Å; W502-F510 VanDerWaalsContact CE2-CE1 3.5Å; W502-F510 AromaticContact CE2-CZ 3.88Å; W502-F510 HydrophobicContact CE3-CE1 4.27Å; W502-F510 HydrophobicContact CG-CZ 4.34Å; W502-F510 AromaticContact CH2-CE1 3.85Å; W502-F510 HydrophobicContact CH2-CE1 3.85Å; W502-F510 HydrophobicContact CZ2-CD1 4.33Å; W502-F510 AromaticContact CZ2-CE1 3.49Å; W502-F510 HydrophobicContact CZ2-CE1 3.49Å; W502-F510 VanDerWaalsContact CZ2-CE1 3.49Å; W502-F510 HydrophobicContact CZ2-CZ 4.33Å; W502-F510 HydrophobicContact CZ3-CE1 4.22Å; W502-F510 AromaticContact NE1-CE1 3.89Å; W502-F510 AromaticContact NE1-CZ 3.96Å; W502-M522 HydrophobicContact CH2-CB 4.26Å; W502-M522 HydrophobicContact CH2-CG 3.94Å; W502-M522 VanDerWaalsContact CH2-O 3.3Å; W502-M522 WeakPolarHBondContact CH2-O 3.26Å; W502-M522 HydrophobicContact CZ3-CG 4.45Å; W502-S524 PolarHBondContact NE1-OG 3.01Å; W502-E534 VanDerWaalsContact CA-OE1 3.26Å; W502-E534 WeakPolarHBondContact CA-OE1 3.4Å; W502-E534 HydrophobicContact CZ2-CB 4.47Å; W502-E534 PolarHBondContact N-OE1 2.92Å; W502-E534 VanDerWaalsContact NE1-CB 3.33Å; W502-M536 HydrophobicContact CH2-CB 3.48Å; W502-M536 VanDerWaalsContact CH2-CB 3.48Å; W502-M536 HydrophobicContact CZ3-CB 3.72Å; W502-M536 HydrophobicContact CZ3-CE 4.19Å; W502-M536 HydrophobicContact CZ3-CG 4.42Å; W502-M536 HydrophobicContact CZ3-SD 3.83Å; W502-V568 HydrophobicContact CE3-CG1 3.95Å; W502-V568 HydrophobicContact CZ3-CG1 4.35Å; W502-F570 HydrophobicContact CE3-CZ 4.45Å; W502-F570 HydrophobicContact CZ3-CE1 4.41Å; W502-F570 HydrophobicContact CZ3-CZ 4.09Å
503	K	86.6	Confident	87.9	Confident	142 Å²	142	54.4 Å²	54.4	62%	0.617	24%	0.235	S	C	*	.			trans	-62.8	17.3	-175.6	-50.6	-168.7	-175.7	-161.3	0	116.7	Q499 K500 V501	Q499-K503 WeakPolarHBondContact O-CE 3.13Å; K500-K503 WeakPolarHBondContact O-CE 3.34Å; V501-K503 VanDerWaalsContact C-N 3.35Å; V501-K503 PolarHBondContact O-N 3.3Å
504	R	85.7	Confident	87.6	Confident	206 Å²	206	50.3 Å²	50.3	78%	0.777	22%	0.219	S	C	*	.	S	Bend	trans	-147.1	126.5	175.1	-65.1	-172.9	-176.9	-176.6	1.1	109.4	W502 K506 R508	W502-R504 PolarHBondContact O-N 3.42Å; R504-K506 PolarHBondContact O-N 2.81Å; R504-K506 VanDerWaalsContact O-N 3.14Å; R504-R508 PolarHBondContact O-NH1 3.32Å; R504-R508 PolarHBondContact O-NH2 2.85Å
505	W	88.9	Confident	86.8	Confident	51 Å²	51	51.8 Å²	51.8	19%	0.193	23%	0.228	C	C	.	.			trans	-59.4	112.8	171.6	-170.2	-113.6	0	0	0	109.9	Y495 A496 L497 L552 Q553 G554 F558 I569 A571	Y495-W505 HydrophobicContact CD1-CD2 4.42Å; Y495-W505 AromaticContact CD1-CE2 3.84Å; Y495-W505 HydrophobicContact CD1-CZ2 4.28Å; Y495-W505 AromaticContact CD1-NE1 3.52Å; Y495-W505 AromaticContact CG-CE2 3.99Å; Y495-W505 AromaticContact CG-CZ2 3.99Å; Y495-W505 HydrophobicContact CG-CZ2 3.99Å; A496-W505 VanDerWaalsContact C-CE3 3.49Å; A496-W505 WeakPolarHBondContact O-CA 3.37Å; L497-W505 HydrophobicContact CB-CE3 3.71Å; L497-W505 HydrophobicContact CB-CZ3 4.33Å; W505-L552 HydrophobicContact CB-CD2 4.09Å; W505-L552 HydrophobicContact CD2-CB 4.34Å; W505-L552 HydrophobicContact CD2-CD1 4.08Å; W505-L552 HydrophobicContact CD2-CD2 4.03Å; W505-L552 HydrophobicContact CD2-CG 4.38Å; W505-L552 HydrophobicContact CE3-CD1 4Å; W505-L552 HydrophobicContact CG-CD2 3.89Å; W505-L552 HydrophobicContact CH2-CD1 3.98Å; W505-L552 HydrophobicContact CZ2-CB 4.04Å; W505-L552 HydrophobicContact CZ2-CD1 4.08Å; W505-L552 HydrophobicContact CZ3-CD1 3.96Å; W505-Q553 PolarHBondContact NE1-O 3.05Å; W505-G554 WeakPolarHBondContact CZ2-O 3.43Å; W505-G554 PolarHBondContact NE1-O 2.89Å; W505-F558 HydrophobicContact CH2-CD1 4.3Å; W505-F558 AromaticContact CH2-CE1 3.73Å; W505-F558 HydrophobicContact CH2-CE1 3.73Å; W505-F558 AromaticContact CZ2-CE1 3.86Å; W505-F558 HydrophobicContact CZ2-CE1 3.86Å; W505-F558 HydrophobicContact CZ2-CZ 4.27Å; W505-I569 HydrophobicContact CZ3-CG2 4.42Å; W505-A571 HydrophobicContact CH2-CB 3.64Å; W505-A571 HydrophobicContact CZ2-CB 3.98Å
506	K	87.4	Confident	85.6	Confident	140 Å²	140	51.8 Å²	51.8	61%	0.609	24%	0.235	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-161.8	136.1	178.4	-173.5	178.7	177.1	177.5	0	109.7	R504 R508	R504-K506 PolarHBondContact O-N 2.81Å; R504-K506 VanDerWaalsContact O-N 3.14Å; K506-R508 PolarHBondContact O-N 3.41Å; K506-R508 PolarHBondContact O-NH1 3.28Å
507	K	88.9	Confident	83.9	Confident	80 Å²	80	53.6 Å²	53.6	35%	0.348	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	123.1	169	-162.5	168.6	-176.4	168.6	0	110.2	Y493 L494 Y495 D573	Y493-K507 HydrophobicContact CD1-CG 4.4Å; L494-K507 WeakPolarHBondContact O-CA 3.23Å; Y495-K507 HydrophobicContact CD1-CB 4.07Å; Y495-K507 HydrophobicContact CD2-CB 4.28Å; Y495-K507 HydrophobicContact CD2-CD 4.45Å; Y495-K507 HydrophobicContact CD2-CG 4.27Å; Y495-K507 HydrophobicContact CE1-CB 3.83Å; Y495-K507 HydrophobicContact CE2-CB 4.03Å; Y495-K507 HydrophobicContact CE2-CD 3.72Å; Y495-K507 HydrophobicContact CE2-CG 3.99Å; Y495-K507 HydrophobicContact CG-CB 4.28Å; K507-D573 IonicContact NZ-OD2 2.62Å; K507-D573 PolarHBondContact NZ-OD2 3.21Å
508	R	90.8	Very high	82.3	Confident	32 Å²	32	52.6 Å²	52.6	12%	0.121	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	159.4	176.9	-62.7	168.3	176.4	88.4	-18	108.5	Y493 L494 A496 W502 R504 K506 F510 E534	Y493-R508 WeakPolarHBondContact CA-O 3.32Å; L494-R508 PolarHBondContact N-O 2.99Å; L494-R508 PolarHBondContact O-N 3.12Å; A496-R508 PolarHBondContact O-NH1 2.94Å; W502-R508 VanDerWaalsContact CD1-NE 3.31Å; R504-R508 PolarHBondContact O-NH1 3.32Å; R504-R508 PolarHBondContact O-NH2 2.85Å; K506-R508 PolarHBondContact O-N 3.41Å; K506-R508 PolarHBondContact O-NH1 3.28Å; R508-F510 HydrophobicContact CB-CD2 4.05Å; R508-F510 HydrophobicContact CB-CE2 3.66Å; R508-F510 HydrophobicContact CB-CZ 4.31Å; R508-F510 HydrophobicContact CG-CE2 4.45Å; R508-E534 IonicContact CZ-OE2 3.94Å; R508-E534 IonicContact NE-OE2 2.78Å; R508-E534 PolarHBondContact NE-OE2 2.86Å; R508-E534 IonicContact NH2-OE1 2.75Å; R508-E534 IonicContact NH2-OE2 2.82Å; R508-E534 PolarHBondContact NH2-OE2 3.41Å
509	Y	89.1	Confident	81.6	Confident	7 Å²	7	53.5 Å²	53.5	3%	0.027	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	123	167.8	-168.8	-106.6	0	0	0	108.7	P420 R421 T451 S491 G492 Y493 V511 S524 Y525	P420-Y509 HydrophobicContact CB-CE1 4.46Å; R421-Y509 HydrophobicContact CG-CD1 3.83Å; R421-Y509 HydrophobicContact CG-CE1 3.99Å; R421-Y509 HydrophobicContact CG-CG 4.19Å; T451-Y509 HydrophobicContact CG2-CE2 4.21Å; S491-Y509 PolarHBondContact OG-OH 2.88Å; G492-Y509 WeakPolarHBondContact O-CD2 3.35Å; Y493-Y509 HydrophobicContact CD1-CD2 4.08Å; Y493-Y509 AromaticContact CD2-CD2 3.91Å; Y493-Y509 HydrophobicContact CD2-CD2 3.91Å; Y493-Y509 HydrophobicContact CD2-CE2 4.39Å; Y493-Y509 AromaticContact CE1-CD2 3.92Å; Y493-Y509 HydrophobicContact CE1-CD2 3.92Å; Y493-Y509 HydrophobicContact CE1-CG 4.37Å; Y493-Y509 AromaticContact CE2-CD2 3.74Å; Y493-Y509 HydrophobicContact CE2-CD2 3.74Å; Y493-Y509 HydrophobicContact CE2-CE2 4.18Å; Y493-Y509 HydrophobicContact CG-CD2 4.08Å; Y493-Y509 AromaticContact CZ-CD2 3.75Å; Y509-V511 HydrophobicContact CD1-CG2 4.08Å; Y509-V511 HydrophobicContact CE1-CG2 3.73Å; Y509-S524 WeakPolarHBondContact O-CA 3.5Å; Y509-Y525 PolarHBondContact O-N 3.4Å
510	F	91	Very high	81.7	Confident	0 Å²	0	48 Å²	48	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	145	-177.5	-80.3	-88.7	0	0	0	110.7	S491 G492 L494 A496 W502 R508 M522 C523 F570 W581	S491-F510 WeakPolarHBondContact CA-O 3.25Å; S491-F510 WeakPolarHBondContact CB-O 3.26Å; G492-F510 PolarHBondContact N-O 2.92Å; G492-F510 VanDerWaalsContact N-O 3.08Å; G492-F510 PolarHBondContact O-N 3.42Å; L494-F510 HydrophobicContact CB-CD2 3.71Å; L494-F510 HydrophobicContact CB-CE2 4Å; L494-F510 HydrophobicContact CD1-CD2 4.49Å; L494-F510 HydrophobicContact CG-CD2 4.45Å; A496-F510 HydrophobicContact CB-CE2 3.89Å; A496-F510 HydrophobicContact CB-CZ 3.5Å; A496-F510 VanDerWaalsContact CB-CZ 3.5Å; W502-F510 AromaticContact CD2-CE1 3.95Å; W502-F510 HydrophobicContact CD2-CE1 3.95Å; W502-F510 HydrophobicContact CD2-CZ 4.01Å; W502-F510 AromaticContact CE2-CE1 3.5Å; W502-F510 VanDerWaalsContact CE2-CE1 3.5Å; W502-F510 AromaticContact CE2-CZ 3.88Å; W502-F510 HydrophobicContact CE3-CE1 4.27Å; W502-F510 HydrophobicContact CG-CZ 4.34Å; W502-F510 AromaticContact CH2-CE1 3.85Å; W502-F510 HydrophobicContact CH2-CE1 3.85Å; W502-F510 HydrophobicContact CZ2-CD1 4.33Å; W502-F510 AromaticContact CZ2-CE1 3.49Å; W502-F510 HydrophobicContact CZ2-CE1 3.49Å; W502-F510 VanDerWaalsContact CZ2-CE1 3.49Å; W502-F510 HydrophobicContact CZ2-CZ 4.33Å; W502-F510 HydrophobicContact CZ3-CE1 4.22Å; W502-F510 AromaticContact NE1-CE1 3.89Å; W502-F510 AromaticContact NE1-CZ 3.96Å; R508-F510 HydrophobicContact CB-CD2 4.05Å; R508-F510 HydrophobicContact CB-CE2 3.66Å; R508-F510 HydrophobicContact CB-CZ 4.31Å; R508-F510 HydrophobicContact CG-CE2 4.45Å; F510-M522 HydrophobicContact CB-CE 3.88Å; F510-M522 HydrophobicContact CB-SD 4.16Å; F510-M522 HydrophobicContact CD1-CE 3.58Å; F510-M522 HydrophobicContact CD1-CG 3.96Å; F510-M522 HydrophobicContact CD1-SD 3.75Å; F510-M522 HydrophobicContact CE1-CE 4.26Å; F510-M522 HydrophobicContact CE1-CG 4.29Å; F510-M522 HydrophobicContact CG-CE 3.87Å; F510-M522 HydrophobicContact CG-SD 4.35Å; F510-C523 CarbonylContact C-O 3.53Å; F510-C523 WeakPolarHBondContact CA-O 3.33Å; F510-F570 HydrophobicContact CE1-CE1 4.02Å; F510-F570 HydrophobicContact CZ-CE1 4.1Å; F510-W581 HydrophobicContact CB-CH2 3.67Å; F510-W581 HydrophobicContact CB-CZ2 4.01Å
511	V	90.2	Very high	81.9	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	128.5	173.4	-171.4	0	0	0	0	108.2	L363 P420 M488 H490 Y509 V513 C523 Y525	L363-V511 HydrophobicContact CD1-CG1 4.01Å; P420-V511 HydrophobicContact CB-CG2 4.32Å; M488-V511 HydrophobicContact CB-CG1 4.44Å; M488-V511 HydrophobicContact CE-CG1 3.92Å; M488-V511 HydrophobicContact CE-CG2 4.36Å; M488-V511 HydrophobicContact CG-CG1 3.54Å; M488-V511 HydrophobicContact SD-CG1 3.84Å; H490-V511 WeakPolarHBondContact O-CA 3.47Å; Y509-V511 HydrophobicContact CD1-CG2 4.08Å; Y509-V511 HydrophobicContact CE1-CG2 3.73Å; V511-V513 HydrophobicContact CB-CG2 4.32Å; V511-V513 HydrophobicContact CG1-CG2 3.76Å; V511-C523 PolarHBondContact N-O 2.89Å; V511-C523 PolarHBondContact O-N 3.3Å; V511-Y525 HydrophobicContact CB-CD2 4.16Å; V511-Y525 HydrophobicContact CB-CE2 3.85Å; V511-Y525 HydrophobicContact CG2-CD2 3.77Å; V511-Y525 HydrophobicContact CG2-CE2 3.92Å
512	L	89.8	Confident	82.2	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	114.2	170.4	176.8	62	0	0	0	108.7	K489 H490 F520 L538 W581 A584 M585 A588	K489-L512 HydrophobicContact CB-CD2 4.1Å; K489-L512 HydrophobicContact CB-CG 4.16Å; K489-L512 PolarHBondContact N-O 3.04Å; H490-L512 HydrophobicContact CB-CB 4.48Å; H490-L512 PolarHBondContact O-N 3.18Å; L512-F520 HydrophobicContact CD1-CB 4.37Å; L512-L538 HydrophobicContact CD1-CD1 3.5Å; L512-W581 HydrophobicContact CB-CZ3 4.2Å; L512-A584 HydrophobicContact CD2-CB 3.86Å; L512-A584 WeakPolarHBondContact CD2-O 3.26Å; L512-M585 HydrophobicContact CD2-CG 4.25Å; L512-A588 HydrophobicContact CD1-CB 4.2Å; L512-A588 HydrophobicContact CD2-CB 4.18Å
513	V	86.4	Confident	82.3	Confident	4 Å²	4	40.5 Å²	40.5	2%	0.024	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	134.8	-175.2	-176	0	0	0	0	110.9	V361 L363 H487 V511 V515 F520 A521	V361-V513 HydrophobicContact CG1-CB 3.65Å; V361-V513 HydrophobicContact CG1-CG1 3.69Å; V361-V513 HydrophobicContact CG1-CG2 3.72Å; L363-V513 HydrophobicContact CD1-CG2 3.99Å; L363-V513 HydrophobicContact CD2-CG1 4.05Å; L363-V513 HydrophobicContact CD2-CG2 4.41Å; L363-V513 HydrophobicContact CG-CG2 4.42Å; H487-V513 HydrophobicContact CB-CG1 4.45Å; H487-V513 CarbonylContact O-C 3.51Å; H487-V513 WeakPolarHBondContact O-CA 3.37Å; V511-V513 HydrophobicContact CB-CG2 4.32Å; V511-V513 HydrophobicContact CG1-CG2 3.76Å; V513-V515 HydrophobicContact CG1-CG2 4.28Å; V513-F520 CarbonylContact O-C 3.58Å; V513-F520 WeakPolarHBondContact O-CA 3.3Å; V513-A521 PolarHBondContact N-O 2.86Å; V513-A521 PolarHBondContact O-N 3.49Å
514	Q	81	Confident	82.4	Confident	6 Å²	6	33.8 Å²	33.8	3%	0.028	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	103	169.4	-175.3	176.9	39.6	0	0	108.7	D267 V325 H487 K489 S516 F520	D267-Q514 PolarHBondContact OD1-NE2 2.97Å; V325-Q514 VanDerWaalsContact CG1-OE1 3.31Å; H487-Q514 PolarHBondContact ND1-O 3.2Å; H487-Q514 PolarHBondContact O-N 3.47Å; K489-Q514 VanDerWaalsContact CE-CD 3.42Å; K489-Q514 HydrophobicContact CG-CB 4.33Å; Q514-S516 WeakPolarHBondContact CG-O 3.29Å; Q514-F520 HydrophobicContact CB-CD1 3.92Å; Q514-F520 HydrophobicContact CB-CE1 3.69Å; Q514-F520 HydrophobicContact CB-CZ 4.46Å; Q514-F520 HydrophobicContact CG-CD1 4.18Å; Q514-F520 HydrophobicContact CG-CE1 3.67Å; Q514-F520 HydrophobicContact CG-CZ 3.95Å
515	V	72.5	Confident	82.5	Confident	32 Å²	32	24.4 Å²	24.4	19%	0.194	12%	0.115	C	C	.	.	S	Bend	trans	-85.1	-43	-177.5	-178.2	0	0	0	0	110.8	L356 D360 V361 V513 T519 A521	L356-V515 HydrophobicContact CD2-CB 4.37Å; L356-V515 HydrophobicContact CD2-CG1 3.87Å; D360-V515 HydrophobicContact CB-CG1 3.88Å; D360-V515 WeakPolarHBondContact O-CG1 3.39Å; V361-V515 HydrophobicContact CG1-CG2 4.43Å; V361-V515 HydrophobicContact CG2-CG2 4.14Å; V513-V515 HydrophobicContact CG1-CG2 4.28Å; V515-T519 PolarHBondContact N-O 3.34Å; V515-A521 HydrophobicContact CG2-CB 4.11Å
516	S	65.1	Low	82.2	Confident	45 Å²	45	28.8 Å²	28.8	32%	0.315	13%	0.131	S	C	.	.	S	Bend	trans	-125.1	178.8	164.5	84.9	0	0	0	0	108.7	Q514 Y518 T519	Q514-S516 WeakPolarHBondContact CG-O 3.29Å; S516-Y518 PolarHBondContact O-N 2.81Å; S516-Y518 VanDerWaalsContact O-N 3.13Å; S516-Y518 PolarHBondContact OG-N 3.11Å; S516-Y518 VanDerWaalsContact OG-N 3.17Å; S516-T519 PolarHBondContact N-O 3.25Å; S516-T519 VanDerWaalsContact OG-CB 3.25Å; S516-T519 WeakPolarHBondContact OG-CB 3.11Å; S516-T519 PolarHBondContact OG-N 3.5Å; S516-T519 PolarHBondContact OG-OG1 2.92Å
517	Q	54.3	Low	81.9	Confident	37 Å²	37	26.4 Å²	26.4	17%	0.173	12%	0.122	C	C	.	.	S	Bend	trans	-57.7	-26.1	174.3	-78.7	-168.4	-49.4	0	0	113.6	L320 E321 L323 V325 F520	L320-Q517 PolarHBondContact O-OE1 3.37Å; E321-Q517 PolarHBondContact O-OE1 2.66Å; L323-Q517 PolarHBondContact O-NE2 2.83Å; L323-Q517 VanDerWaalsContact O-NE2 3.11Å; L323-Q517 PolarHBondContact O-OE1 2.87Å; L323-Q517 VanDerWaalsContact O-OE1 3.1Å; V325-Q517 HydrophobicContact CG2-CG 3.65Å; Q517-F520 WeakPolarHBondContact O-CE2 3.39Å
518	Y	56.6	Low	81.3	Confident	37 Å²	37	28.7 Å²	28.7	15%	0.145	13%	0.132	C	C	.	.	S	Bend	trans	-111.6	-32.8	-171.8	-67.3	-101.3	0	0	0	111.5	R274 L320 E321 S516 F520	R274-Y518 HydrophobicContact CG-CE1 4Å; L320-Y518 WeakPolarHBondContact CB-OH 3.33Å; L320-Y518 WeakPolarHBondContact CD2-OH 3.34Å; L320-Y518 WeakPolarHBondContact CG-OH 3.41Å; L320-Y518 PolarHBondContact O-OH 2.97Å; E321-Y518 VanDerWaalsContact CA-CE2 3.47Å; E321-Y518 HydrophobicContact CB-CD2 3.94Å; E321-Y518 HydrophobicContact CB-CE2 3.71Å; E321-Y518 HydrophobicContact CG-CD1 4.31Å; E321-Y518 HydrophobicContact CG-CD2 3.58Å; E321-Y518 HydrophobicContact CG-CE1 4.1Å; E321-Y518 HydrophobicContact CG-CE2 3.48Å; E321-Y518 VanDerWaalsContact CG-CE2 3.48Å; E321-Y518 HydrophobicContact CG-CG 4.1Å; S516-Y518 PolarHBondContact O-N 2.81Å; S516-Y518 VanDerWaalsContact O-N 3.13Å; S516-Y518 PolarHBondContact OG-N 3.11Å; S516-Y518 VanDerWaalsContact OG-N 3.17Å; Y518-F520 WeakPolarHBondContact O-CD2 3.32Å; Y518-F520 PolarHBondContact O-N 2.85Å
519	T	71.4	Confident	80.8	Confident	26 Å²	26	32.8 Å²	32.8	16%	0.16	15%	0.151	C	C	.	.			trans	-89.7	96.4	-174.8	-40.5	0	0	0	0	110.1	L356 V515 S516 Q537	L356-T519 HydrophobicContact CD1-CG2 3.84Å; L356-T519 HydrophobicContact CD2-CG2 3.92Å; L356-T519 HydrophobicContact CG-CG2 4.14Å; V515-T519 PolarHBondContact N-O 3.34Å; S516-T519 PolarHBondContact N-O 3.25Å; S516-T519 VanDerWaalsContact OG-CB 3.25Å; S516-T519 WeakPolarHBondContact OG-CB 3.11Å; S516-T519 PolarHBondContact OG-N 3.5Å; S516-T519 PolarHBondContact OG-OG1 2.92Å; T519-Q537 HydrophobicContact CG2-CG 3.98Å
520	F	84.3	Confident	80.3	Confident	6 Å²	6	34.1 Å²	34.1	3%	0.026	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	135.9	171.4	-65.6	-95	0	0	0	110.7	K489 L512 V513 Q514 Q517 Y518 L538 A588	K489-F520 HydrophobicContact CG-CD1 4.45Å; K489-F520 HydrophobicContact CG-CE1 4.06Å; L512-F520 HydrophobicContact CD1-CB 4.37Å; V513-F520 CarbonylContact O-C 3.58Å; V513-F520 WeakPolarHBondContact O-CA 3.3Å; Q514-F520 HydrophobicContact CB-CD1 3.92Å; Q514-F520 HydrophobicContact CB-CE1 3.69Å; Q514-F520 HydrophobicContact CB-CZ 4.46Å; Q514-F520 HydrophobicContact CG-CD1 4.18Å; Q514-F520 HydrophobicContact CG-CE1 3.67Å; Q514-F520 HydrophobicContact CG-CZ 3.95Å; Q517-F520 WeakPolarHBondContact O-CE2 3.39Å; Y518-F520 WeakPolarHBondContact O-CD2 3.32Å; Y518-F520 PolarHBondContact O-N 2.85Å; F520-L538 HydrophobicContact CB-CB 4.47Å; F520-L538 HydrophobicContact CB-CD1 4.44Å; F520-L538 PolarHBondContact O-N 2.99Å; F520-A588 HydrophobicContact CB-CB 3.69Å; F520-A588 HydrophobicContact CD1-CB 3.63Å; F520-A588 HydrophobicContact CD2-CB 3.95Å; F520-A588 WeakPolarHBondContact CD2-O 3.5Å; F520-A588 HydrophobicContact CE1-CB 4.21Å; F520-A588 HydrophobicContact CG-CB 3.48Å; F520-A588 VanDerWaalsContact CG-CB 3.48Å
521	A	86.6	Confident	79.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	127.3	179.3	0	0	0	0	0	111	L356 V513 V515 C523 M536	L356-A521 HydrophobicContact CD1-CB 3.95Å; V513-A521 PolarHBondContact N-O 2.86Å; V513-A521 PolarHBondContact O-N 3.49Å; V515-A521 HydrophobicContact CG2-CB 4.11Å; A521-C523 VanDerWaalsContact CB-SG 3.6Å; A521-M536 CarbonylContact C-O 3.29Å; A521-M536 WeakPolarHBondContact CA-O 3.29Å
522	M	90.7	Very high	79.6	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	113.5	169.4	-179.2	57	150.6	0	0	108.3	L494 W502 F510 L535 M536 L538 F570 W581 M585	L494-M522 HydrophobicContact CD1-CE 3.66Å; W502-M522 HydrophobicContact CH2-CB 4.26Å; W502-M522 HydrophobicContact CH2-CG 3.94Å; W502-M522 VanDerWaalsContact CH2-O 3.3Å; W502-M522 WeakPolarHBondContact CH2-O 3.26Å; W502-M522 HydrophobicContact CZ3-CG 4.45Å; F510-M522 HydrophobicContact CB-CE 3.88Å; F510-M522 HydrophobicContact CB-SD 4.16Å; F510-M522 HydrophobicContact CD1-CE 3.58Å; F510-M522 HydrophobicContact CD1-CG 3.96Å; F510-M522 HydrophobicContact CD1-SD 3.75Å; F510-M522 HydrophobicContact CE1-CE 4.26Å; F510-M522 HydrophobicContact CE1-CG 4.29Å; F510-M522 HydrophobicContact CG-CE 3.87Å; F510-M522 HydrophobicContact CG-SD 4.35Å; M522-L535 CarbonylContact O-C 3.49Å; M522-L535 WeakPolarHBondContact O-CA 3.32Å; M522-M536 PolarHBondContact N-O 2.93Å; M522-M536 PolarHBondContact O-N 3.4Å; M522-L538 HydrophobicContact CB-CD1 4.48Å; M522-L538 HydrophobicContact CB-CD2 3.94Å; M522-L538 HydrophobicContact CB-CG 4.3Å; M522-F570 HydrophobicContact CE-CD1 4.3Å; M522-F570 HydrophobicContact CE-CE1 3.76Å; M522-F570 HydrophobicContact CE-CZ 4.14Å; M522-F570 HydrophobicContact CG-CE1 4.47Å; M522-F570 HydrophobicContact CG-CZ 4.24Å; M522-W581 HydrophobicContact CE-CE3 3.97Å; M522-W581 HydrophobicContact CE-CH2 3.88Å; M522-W581 HydrophobicContact CE-CZ3 3.47Å; M522-W581 VanDerWaalsContact CE-CZ3 3.47Å; M522-W581 HydrophobicContact SD-CH2 4.21Å; M522-W581 HydrophobicContact SD-CZ3 3.78Å; M522-M585 HydrophobicContact CE-SD 4.12Å
523	C	90.1	Very high	79.3	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	135.1	-164.3	-71.9	0	0	0	0	111.8	V361 F510 V511 A521 Y525 P532 L535	V361-C523 HydrophobicContact CG1-CB 4.32Å; F510-C523 CarbonylContact C-O 3.53Å; F510-C523 WeakPolarHBondContact CA-O 3.33Å; V511-C523 PolarHBondContact N-O 2.89Å; V511-C523 PolarHBondContact O-N 3.3Å; A521-C523 VanDerWaalsContact CB-SG 3.6Å; C523-Y525 HydrophobicContact CB-CD2 4.38Å; C523-Y525 HydrophobicContact CB-CE2 3.5Å; C523-Y525 VanDerWaalsContact CB-CE2 3.5Å; C523-P532 HydrophobicContact CB-CB 4.04Å; C523-L535 WeakPolarHBondContact SG-CB 3.48Å
524	S	90.1	Very high	79.2	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.007	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	123.9	-176.1	64.3	0	0	0	0	111.9	W502 Y509 P532 Q533 E534	W502-S524 PolarHBondContact NE1-OG 3.01Å; Y509-S524 WeakPolarHBondContact O-CA 3.5Å; S524-P532 CarbonylContact O-C 3.36Å; S524-P532 WeakPolarHBondContact O-CA 3.34Å; S524-Q533 PolarHBondContact O-N 2.82Å; S524-E534 PolarHBondContact N-O 2.86Å; S524-E534 WeakPolarHBondContact OG-CB 3.43Å; S524-E534 PolarHBondContact OG-N 3.35Å; S524-E534 PolarHBondContact OG-O 2.75Å
525	Y	86.9	Confident	79.5	Confident	9 Å²	9	45.7 Å²	45.7	4%	0.035	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	158.6	-170.6	-66.4	-96.1	0	0	0	112.6	V361 P420 Y509 V511 C523 S530 P532	V361-Y525 VanDerWaalsContact CG1-OH 3.3Å; V361-Y525 WeakPolarHBondContact CG1-OH 3.45Å; V361-Y525 PolarHBondContact O-OH 3.29Å; P420-Y525 HydrophobicContact CB-CG 4.37Å; P420-Y525 HydrophobicContact CG-CD1 3.68Å; P420-Y525 HydrophobicContact CG-CD2 4.32Å; P420-Y525 HydrophobicContact CG-CE1 3.8Å; P420-Y525 HydrophobicContact CG-CE2 4.44Å; P420-Y525 HydrophobicContact CG-CG 3.94Å; Y509-Y525 PolarHBondContact O-N 3.4Å; V511-Y525 HydrophobicContact CB-CD2 4.16Å; V511-Y525 HydrophobicContact CB-CE2 3.85Å; V511-Y525 HydrophobicContact CG2-CD2 3.77Å; V511-Y525 HydrophobicContact CG2-CE2 3.92Å; C523-Y525 HydrophobicContact CB-CD2 4.38Å; C523-Y525 HydrophobicContact CB-CE2 3.5Å; C523-Y525 VanDerWaalsContact CB-CE2 3.5Å; Y525-S530 WeakPolarHBondContact CE1-O 3.41Å; Y525-P532 HydrophobicContact CD1-CB 4.35Å; Y525-P532 HydrophobicContact CE1-CB 3.97Å; Y525-P532 HydrophobicContact CE1-CG 4.41Å; Y525-P532 HydrophobicContact CE2-CB 4.3Å
526	R	83.6	Confident	80.3	Confident	142 Å²	142	44.5 Å²	44.5	54%	0.536	21%	0.209	S	C	.	.			trans	-113.8	160.7	170.3	-68.6	-166.9	-176.5	-173.8	5.3	110.3
527	E	80.9	Confident	81.2	Confident	91 Å²	91	45.1 Å²	45.1	43%	0.425	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.8	140.7	168.8	-70.3	154.2	-152	0	0	110.9	R421 K529	R421-E527 VanDerWaalsContact CZ-CG 3.43Å; R421-E527 IonicContact CZ-OE1 3.37Å; R421-E527 VanDerWaalsContact NH1-CG 3.32Å; R421-E527 IonicContact NH1-OE1 2.69Å; R421-E527 PolarHBondContact NH1-OE1 3.43Å; R421-E527 IonicContact NH2-OE1 3.95Å; R421-E527 PolarHBondContact NH2-OE1 3.17Å; E527-K529 VanDerWaalsContact C-N 3.3Å; E527-K529 PolarHBondContact O-N 3.33Å
528	K	76.2	Confident	82.6	Confident	128 Å²	128	43.5 Å²	43.5	56%	0.557	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	37.2	176.5	-50.4	170.7	-173.2	171.5	0	113.6	R421 V423	R421-K528 PolarHBondContact O-N 1.82Å; V423-K528 HydrophobicContact CG2-CD 4.28Å; V423-K528 HydrophobicContact CG2-CG 3.67Å
529	K	81	Confident	83.6	Confident	117 Å²	117	46.8 Å²	46.8	51%	0.509	22%	0.216	S	C	.	.			trans	-140.9	137.2	172.9	-74.6	-160.8	165.5	-124.8	0	111.9	E527	E527-K529 VanDerWaalsContact C-N 3.3Å; E527-K529 PolarHBondContact O-N 3.33Å
530	S	77.9	Confident	83.8	Confident	35 Å²	35	48.2 Å²	48.2	25%	0.245	24%	0.235	C	C	.	.	S	Bend	trans	-82.5	-36.4	173.6	46.9	0	0	0	0	112.3	T418 H419 Y525	T418-S530 WeakPolarHBondContact O-CA 3.39Å; H419-S530 PolarHBondContact CD2-N 3.47Å; H419-S530 PolarHBondContact NE2-N 3.18Å; Y525-S530 WeakPolarHBondContact CE1-O 3.41Å
531	E	80.5	Confident	83.7	Confident	97 Å²	97	48.8 Å²	48.8	45%	0.453	24%	0.238	S	C	.	.	S	Bend	trans	-83.1	144.5	179.7	-66.8	-179.4	-180	0	0	113.5
532	P	84.8	Confident	83.6	Confident	2 Å²	2	51 Å²	51	1%	0.013	25%	0.251	C	S	.	.			trans	-69.3	140.6	170.4	29.2	-34.4	0	0	0	112.3	K358 V361 C523 S524 Y525 L535	K358-P532 PolarHBondContact NZ-O 3.16Å; V361-P532 HydrophobicContact CB-CG 4.39Å; C523-P532 HydrophobicContact CB-CB 4.04Å; S524-P532 CarbonylContact O-C 3.36Å; S524-P532 WeakPolarHBondContact O-CA 3.34Å; Y525-P532 HydrophobicContact CD1-CB 4.35Å; Y525-P532 HydrophobicContact CE1-CB 3.97Å; Y525-P532 HydrophobicContact CE1-CG 4.41Å; Y525-P532 HydrophobicContact CE2-CB 4.3Å; P532-L535 HydrophobicContact CG-CB 4.45Å; P532-L535 HydrophobicContact CG-CD2 4.09Å
533	Q	83.8	Confident	83.6	Confident	73 Å²	73	51 Å²	51	34%	0.341	25%	0.251	S	S	.	.	S	Bend	trans	-69.3	-50.4	176	-169.3	-151	-65.3	0	0	111	K358 S524	K358-Q533 PolarHBondContact NZ-O 3.16Å; S524-Q533 PolarHBondContact O-N 2.82Å
534	E	85.4	Confident	83.4	Confident	43 Å²	43	53.2 Å²	53.2	20%	0.201	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	136.1	179.3	-59.4	168.5	87.6	0	0	106.5	W502 R508 S524	W502-E534 VanDerWaalsContact CA-OE1 3.26Å; W502-E534 WeakPolarHBondContact CA-OE1 3.4Å; W502-E534 HydrophobicContact CZ2-CB 4.47Å; W502-E534 PolarHBondContact N-OE1 2.92Å; W502-E534 VanDerWaalsContact NE1-CB 3.33Å; R508-E534 IonicContact CZ-OE2 3.94Å; R508-E534 IonicContact NE-OE2 2.78Å; R508-E534 PolarHBondContact NE-OE2 2.86Å; R508-E534 IonicContact NH2-OE1 2.75Å; R508-E534 IonicContact NH2-OE2 2.82Å; R508-E534 PolarHBondContact NH2-OE2 3.41Å; S524-E534 PolarHBondContact N-O 2.86Å; S524-E534 WeakPolarHBondContact OG-CB 3.43Å; S524-E534 PolarHBondContact OG-N 3.35Å; S524-E534 PolarHBondContact OG-O 2.75Å
535	L	87.3	Confident	83.3	Confident	38 Å²	38	54.9 Å²	54.9	20%	0.199	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	157.2	-180	67.1	81.5	0	0	0	111.1	K358 V361 M522 C523 P532	K358-L535 HydrophobicContact CG-CD2 4.13Å; V361-L535 HydrophobicContact CG2-CD2 4.37Å; M522-L535 CarbonylContact O-C 3.49Å; M522-L535 WeakPolarHBondContact O-CA 3.32Å; C523-L535 WeakPolarHBondContact SG-CB 3.48Å; P532-L535 HydrophobicContact CG-CB 4.45Å; P532-L535 HydrophobicContact CG-CD2 4.09Å
536	M	88.6	Confident	83.1	Confident	8 Å²	8	56 Å²	56	4%	0.039	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	122.5	176.7	-173.1	175.7	84	0	0	110.8	V501 W502 A521 M522 L538 Y541 A561 V568 F570	V501-M536 HydrophobicContact CG2-CB 4.18Å; V501-M536 HydrophobicContact CG2-CG 4.17Å; V501-M536 HydrophobicContact CG2-SD 3.69Å; W502-M536 HydrophobicContact CH2-CB 3.48Å; W502-M536 VanDerWaalsContact CH2-CB 3.48Å; W502-M536 HydrophobicContact CZ3-CB 3.72Å; W502-M536 HydrophobicContact CZ3-CE 4.19Å; W502-M536 HydrophobicContact CZ3-CG 4.42Å; W502-M536 HydrophobicContact CZ3-SD 3.83Å; A521-M536 CarbonylContact C-O 3.29Å; A521-M536 WeakPolarHBondContact CA-O 3.29Å; M522-M536 PolarHBondContact N-O 2.93Å; M522-M536 PolarHBondContact O-N 3.4Å; M536-L538 HydrophobicContact CE-CD2 3.48Å; M536-L538 VanDerWaalsContact CE-CD2 3.48Å; M536-Y541 HydrophobicContact CE-CE1 4.28Å; M536-Y541 HydrophobicContact CG-CE2 4.39Å; M536-Y541 HydrophobicContact SD-CE1 4.17Å; M536-A561 HydrophobicContact CE-CB 4.4Å; M536-V568 HydrophobicContact CE-CG2 4.23Å; M536-V568 HydrophobicContact SD-CB 4.46Å; M536-V568 HydrophobicContact SD-CG2 3.58Å; M536-V568 VanDerWaalsContact SD-CG2 3.58Å; M536-F570 HydrophobicContact CE-CZ 4.42Å
537	Q	84.4	Confident	82.9	Confident	58 Å²	58	55.4 Å²	55.4	27%	0.271	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	130.4	170.7	-173.5	164.9	-19.4	0	0	109.3	L356 T519 E539 Y541	L356-Q537 HydrophobicContact CD1-CB 4.18Å; L356-Q537 HydrophobicContact CD1-CG 4.23Å; T519-Q537 HydrophobicContact CG2-CG 3.98Å; Q537-E539 VanDerWaalsContact C-N 3.27Å; Q537-E539 HydrophobicContact CG-CB 3.94Å; Q537-E539 PolarHBondContact NE2-OE2 3.4Å; Q537-E539 PolarHBondContact O-N 2.66Å; Q537-Y541 WeakPolarHBondContact O-CD2 3.26Å; Q537-Y541 VanDerWaalsContact O-CE2 3.23Å; Q537-Y541 WeakPolarHBondContact O-CE2 3.31Å
538	L	83.5	Confident	82.5	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.01	29%	0.292	C	S	.	.			trans	-86.7	6.7	-175.4	-64	-173.4	0	0	0	114	L512 F520 M522 M536 G540 Y541 M585 A588 T589	L512-L538 HydrophobicContact CD1-CD1 3.5Å; F520-L538 HydrophobicContact CB-CB 4.47Å; F520-L538 HydrophobicContact CB-CD1 4.44Å; F520-L538 PolarHBondContact O-N 2.99Å; M522-L538 HydrophobicContact CB-CD1 4.48Å; M522-L538 HydrophobicContact CB-CD2 3.94Å; M522-L538 HydrophobicContact CB-CG 4.3Å; M536-L538 HydrophobicContact CE-CD2 3.48Å; M536-L538 VanDerWaalsContact CE-CD2 3.48Å; L538-G540 PolarHBondContact O-N 3.25Å; L538-Y541 PolarHBondContact O-N 3.36Å; L538-Y541 VanDerWaalsContact O-N 3.17Å; L538-M585 HydrophobicContact CD1-CE 4.21Å; L538-M585 HydrophobicContact CD1-CG 4.37Å; L538-M585 HydrophobicContact CD2-CE 4Å; L538-A588 HydrophobicContact CD1-CB 4.01Å; L538-T589 HydrophobicContact CB-CG2 4.22Å
539	E	78.7	Confident	82.3	Confident	107 Å²	107	53.8 Å²	53.8	50%	0.5	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	121.7	-176.3	-167.2	174.5	151.8	0	0	111.8	Q537 Y541 K563	Q537-E539 VanDerWaalsContact C-N 3.27Å; Q537-E539 HydrophobicContact CG-CB 3.94Å; Q537-E539 PolarHBondContact NE2-OE2 3.4Å; Q537-E539 PolarHBondContact O-N 2.66Å; E539-Y541 VanDerWaalsContact C-N 3.31Å; E539-K563 WeakPolarHBondContact O-CD 3.43Å; E539-K563 WeakPolarHBondContact O-CE 3.46Å; E539-K563 PolarHBondContact O-NZ 3.12Å
540	G	73.8	Confident	81.4	Confident	56 Å²	56	54.4 Å²	54.4	58%	0.577	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.2	12.7	-174.1	0	0	0	0	0	115	L538 K563	L538-G540 PolarHBondContact O-N 3.25Å; G540-K563 VanDerWaalsContact O-CG 3.32Å; G540-K563 WeakPolarHBondContact O-CG 3.48Å
541	Y	83.7	Confident	80.9	Confident	18 Å²	18	56.3 Å²	56.3	7%	0.071	33%	0.328	C	S	.	.			trans	-90.9	143.3	168.6	-74.9	-98.1	0	0	0	111.1	M536 Q537 L538 E539 A561 V562 K563 D566 T589	M536-Y541 HydrophobicContact CE-CE1 4.28Å; M536-Y541 HydrophobicContact CG-CE2 4.39Å; M536-Y541 HydrophobicContact SD-CE1 4.17Å; Q537-Y541 WeakPolarHBondContact O-CD2 3.26Å; Q537-Y541 VanDerWaalsContact O-CE2 3.23Å; Q537-Y541 WeakPolarHBondContact O-CE2 3.31Å; L538-Y541 PolarHBondContact O-N 3.36Å; L538-Y541 VanDerWaalsContact O-N 3.17Å; E539-Y541 VanDerWaalsContact C-N 3.31Å; Y541-A561 HydrophobicContact CD1-CB 4Å; Y541-V562 CarbonylContact C-O 3.58Å; Y541-V562 VanDerWaalsContact CA-O 3.23Å; Y541-V562 WeakPolarHBondContact CA-O 3.47Å; Y541-K563 HydrophobicContact CD1-CB 3.69Å; Y541-K563 HydrophobicContact CD2-CB 4.03Å; Y541-K563 HydrophobicContact CD2-CD 3.91Å; Y541-K563 HydrophobicContact CE1-CB 3.66Å; Y541-K563 HydrophobicContact CE2-CB 4.03Å; Y541-K563 HydrophobicContact CE2-CD 3.74Å; Y541-K563 HydrophobicContact CG-CB 3.88Å; Y541-D566 HydrophobicContact CE1-CB 4.48Å; Y541-D566 PolarHBondContact OH-OD2 3.49Å; Y541-T589 WeakPolarHBondContact O-CB 3.41Å; Y541-T589 WeakPolarHBondContact O-CG2 3.44Å
542	T	84.3	Confident	80.7	Confident	46 Å²	46	53.9 Å²	53.9	28%	0.282	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	157.9	158.9	66.3	0	0	0	0	110.3	A561 V562 Q591 Y593	T542-A561 CarbonylContact O-C 3.55Å; T542-A561 WeakPolarHBondContact O-CA 3.36Å; T542-V562 PolarHBondContact N-O 3.08Å; T542-V562 PolarHBondContact O-N 2.83Å; T542-Q591 HydrophobicContact CG2-CB 4.1Å; T542-Y593 HydrophobicContact CG2-CE1 4.31Å; T542-Y593 PolarHBondContact OG1-OH 2.9Å
543	V	89.2	Confident	79.9	Confident	0 Å²	0	62 Å²	62	0%	0	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	132.6	-177.8	176.6	0	0	0	0	109.2	F559 N560 A561 V582 M585 T589 Q591 P595	V543-F559 HydrophobicContact CG1-CD2 4.28Å; V543-N560 VanDerWaalsContact CA-O 3.3Å; V543-N560 WeakPolarHBondContact CA-O 3.15Å; V543-N560 WeakPolarHBondContact CG1-O 3.5Å; V543-A561 HydrophobicContact CG2-CB 4.21Å; V543-V582 HydrophobicContact CG1-CG1 4.17Å; V543-V582 HydrophobicContact CG1-CG2 4.35Å; V543-M585 HydrophobicContact CG1-CB 4.4Å; V543-M585 HydrophobicContact CG2-CB 3.92Å; V543-M585 HydrophobicContact CG2-CE 3.99Å; V543-T589 HydrophobicContact CG2-CG2 4.05Å; V543-Q591 PolarHBondContact O-NE2 2.87Å; V543-Q591 VanDerWaalsContact O-NE2 3.08Å; V543-P595 VanDerWaalsContact O-CG 3.25Å; V543-P595 WeakPolarHBondContact O-CG 3.33Å
544	D	87.2	Confident	79.1	Confident	47 Å²	47	60.1 Å²	60.1	25%	0.251	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	158.9	178.4	-87.9	-57.5	0	0	0	113.1	F559 N560 Y593	D544-F559 CarbonylContact O-C 3.57Å; D544-F559 VanDerWaalsContact O-CA 3.31Å; D544-F559 WeakPolarHBondContact O-CA 3.33Å; D544-F559 VanDerWaalsContact O-CB 3.3Å; D544-F559 WeakPolarHBondContact O-CB 3.45Å; D544-N560 PolarHBondContact N-O 3.28Å; D544-N560 PolarHBondContact N-OD1 3.43Å; D544-N560 PolarHBondContact O-N 3.38Å; D544-N560 PolarHBondContact O-OD1 2.99Å; D544-Y593 VanDerWaalsContact OD2-CE2 3.27Å; D544-Y593 WeakPolarHBondContact OD2-CE2 3.44Å; D544-Y593 PolarHBondContact OD2-OH 3.39Å
545	Y	87.8	Confident	78.5	Confident	35 Å²	35	58.7 Å²	58.7	14%	0.137	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	137.9	171.4	-65	-88.2	0	0	0	109.9	R578 V582 P595 V596 P597	Y545-R578 HydrophobicContact CD1-CG 4.24Å; Y545-R578 HydrophobicContact CE1-CG 4.01Å; Y545-V582 HydrophobicContact CD1-CG2 4.35Å; Y545-V582 HydrophobicContact CD2-CG1 4.34Å; Y545-V582 HydrophobicContact CE1-CB 4.26Å; Y545-V582 HydrophobicContact CE1-CG1 4.35Å; Y545-V582 HydrophobicContact CE1-CG2 3.99Å; Y545-V582 HydrophobicContact CE2-CB 4.44Å; Y545-V582 HydrophobicContact CE2-CG1 3.69Å; Y545-P595 HydrophobicContact CD2-CB 4.01Å; Y545-P595 HydrophobicContact CE2-CB 3.83Å; Y545-V596 VanDerWaalsContact CD2-C 3.4Å; Y545-V596 WeakPolarHBondContact CD2-O 3.34Å; Y545-P597 HydrophobicContact CD2-CG 4.43Å; Y545-P597 HydrophobicContact CE1-CB 4.37Å; Y545-P597 HydrophobicContact CE1-CG 4.16Å; Y545-P597 HydrophobicContact CE2-CB 4.37Å; Y545-P597 HydrophobicContact CE2-CG 3.83Å
546	T	83.2	Confident	77.9	Confident	34 Å²	34	60.5 Å²	60.5	21%	0.209	37%	0.367	C	S	.	.			trans	-130	153.9	-178.2	53.7	0	0	0	0	112.5	F558 F559 N560	T546-F558 PolarHBondContact N-O 2.73Å; T546-F559 VanDerWaalsContact OG1-CA 3.28Å; T546-F559 WeakPolarHBondContact OG1-CA 3.22Å; T546-F559 PolarHBondContact OG1-N 3.41Å; T546-N560 HydrophobicContact CG2-CB 3.85Å; T546-N560 VanDerWaalsContact CG2-CG 3.42Å
547	D	78.1	Confident	77.8	Confident	129 Å²	129	63.3 Å²	63.3	69%	0.69	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-70.3	150.3	174.7	-72.4	-53.4	0	0	0	112.1	H549	D547-H549 PolarHBondContact O-N 2.72Å
548	P	73.7	Confident	77.9	Confident	88 Å²	88	61 Å²	61	57%	0.571	37%	0.37	S	S	*	.	P	Polyproline II helix	trans	-57.2	124.5	179.7	-25.3	34.9	0	0	0	113.1	P550 F558	P548-P550 WeakPolarHBondContact O-CD 3.49Å; P548-F558 HydrophobicContact CB-CD2 3.96Å; P548-F558 HydrophobicContact CB-CE2 3.98Å; P548-F558 HydrophobicContact CG-CD2 4.32Å
549	H	72.5	Confident	78.3	Confident	96 Å²	96	60.9 Å²	60.9	44%	0.444	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-80	116.5	-175.9	-104.7	56.9	0	0	0	112.4	D547 G551 L552 F558	D547-H549 PolarHBondContact O-N 2.72Å; H549-G551 PolarHBondContact O-N 3.22Å; H549-G551 VanDerWaalsContact O-N 3.15Å; H549-L552 HydrophobicContact CB-CD1 3.94Å; H549-L552 HydrophobicContact CB-CG 4.35Å; H549-L552 PolarHBondContact O-N 3.04Å; H549-F558 HydrophobicContact CB-CE1 4.34Å
550	P	60.4	Low	78.8	Confident	130 Å²	130	57.2 Å²	57.2	84%	0.844	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	114.5	-178.9	27.7	-33.8	0	0	0	110.9	P548	P548-P550 WeakPolarHBondContact O-CD 3.49Å
551	G	67.4	Low	79.6	Confident	76 Å²	76	54.6 Å²	54.6	78%	0.784	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	122.3	-12.8	179.4	0	0	0	0	0	114.6	H549	H549-G551 PolarHBondContact O-N 3.22Å; H549-G551 VanDerWaalsContact O-N 3.15Å
552	L	78.1	Confident	79.7	Confident	45 Å²	45	56 Å²	56	24%	0.236	34%	0.337	C	S	.	.			trans	-92.4	129	172.1	-61.1	-179.5	0	0	0	110.1	L497 W505 H549 F558	L497-L552 HydrophobicContact CD2-CD2 4.34Å; W505-L552 HydrophobicContact CB-CD2 4.09Å; W505-L552 HydrophobicContact CD2-CB 4.34Å; W505-L552 HydrophobicContact CD2-CD1 4.08Å; W505-L552 HydrophobicContact CD2-CD2 4.03Å; W505-L552 HydrophobicContact CD2-CG 4.38Å; W505-L552 HydrophobicContact CE3-CD1 4Å; W505-L552 HydrophobicContact CG-CD2 3.89Å; W505-L552 HydrophobicContact CH2-CD1 3.98Å; W505-L552 HydrophobicContact CZ2-CB 4.04Å; W505-L552 HydrophobicContact CZ2-CD1 4.08Å; W505-L552 HydrophobicContact CZ3-CD1 3.96Å; H549-L552 HydrophobicContact CB-CD1 3.94Å; H549-L552 HydrophobicContact CB-CG 4.35Å; H549-L552 PolarHBondContact O-N 3.04Å; L552-F558 HydrophobicContact CB-CE1 4.43Å; L552-F558 HydrophobicContact CD1-CE1 4.14Å
553	Q	67.5	Low	79.7	Confident	174 Å²	174	57.2 Å²	57.2	81%	0.813	34%	0.338	S	S	*	.			trans	-107.4	133.7	177.7	-69.1	-175	-10.8	0	0	111	W505	W505-Q553 PolarHBondContact NE1-O 3.05Å
554	G	66.5	Low	79.1	Confident	33 Å²	33	66.3 Å²	66.3	34%	0.34	38%	0.38	S	S	.	.	S	Bend	trans	85.2	142.3	-173.5	0	0	0	0	0	112.5	W505	W505-G554 WeakPolarHBondContact CZ2-O 3.43Å; W505-G554 PolarHBondContact NE1-O 2.89Å
555	G	72.4	Confident	78.4	Confident	12 Å²	12	67.1 Å²	67.1	12%	0.124	40%	0.4	C	S	.	.			trans	80.5	129.4	-161.1	0	0	0	0	0	111.1	S572 D573	G555-S572 CarbonylContact C-O 3.55Å; G555-S572 WeakPolarHBondContact CA-O 3.31Å; G555-D573 WeakPolarHBondContact CA-OD1 3.47Å; G555-D573 PolarHBondContact N-OD1 3.35Å
556	C	76.1	Confident	78.3	Confident	77 Å²	77	65.6 Å²	65.6	52%	0.52	39%	0.394	S	S	.	.	S	Bend	trans	-104.1	-36	178.6	-65.1	0	0	0	0	112	S572	C556-S572 PolarHBondContact N-O 3.16Å
557	M	84.5	Confident	78.4	Confident	67 Å²	67	66 Å²	66	33%	0.33	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	116.5	-170.7	-54.7	-51.5	-171.2	0	0	110.1	A571 S572 E575 R578	M557-A571 VanDerWaalsContact O-CA 3.25Å; M557-A571 WeakPolarHBondContact O-CA 3.39Å; M557-S572 PolarHBondContact N-O 3.29Å; M557-S572 VanDerWaalsContact N-O 3.12Å; M557-S572 PolarHBondContact O-N 3.04Å; M557-E575 HydrophobicContact CE-CB 4.3Å; M557-E575 HydrophobicContact CG-CB 4.21Å; M557-E575 WeakPolarHBondContact CG-OE2 3.33Å; M557-R578 HydrophobicContact CB-CB 4.13Å
558	F	87.9	Confident	79	Confident	9 Å²	9	59.9 Å²	59.9	4%	0.039	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	148.7	-168.5	-70.1	-105.6	0	0	0	112.5	W505 T546 P548 H549 L552 I569 F570 A571 R578	W505-F558 HydrophobicContact CH2-CD1 4.3Å; W505-F558 AromaticContact CH2-CE1 3.73Å; W505-F558 HydrophobicContact CH2-CE1 3.73Å; W505-F558 AromaticContact CZ2-CE1 3.86Å; W505-F558 HydrophobicContact CZ2-CE1 3.86Å; W505-F558 HydrophobicContact CZ2-CZ 4.27Å; T546-F558 PolarHBondContact N-O 2.73Å; P548-F558 HydrophobicContact CB-CD2 3.96Å; P548-F558 HydrophobicContact CB-CE2 3.98Å; P548-F558 HydrophobicContact CG-CD2 4.32Å; H549-F558 HydrophobicContact CB-CE1 4.34Å; L552-F558 HydrophobicContact CB-CE1 4.43Å; L552-F558 HydrophobicContact CD1-CE1 4.14Å; F558-I569 HydrophobicContact CD1-CG2 4.05Å; F558-F570 WeakPolarHBondContact CA-O 3.25Å; F558-A571 HydrophobicContact CD1-CB 3.81Å; F558-A571 HydrophobicContact CD2-CB 4.26Å; F558-A571 HydrophobicContact CE1-CB 3.88Å; F558-A571 HydrophobicContact CE2-CB 4.32Å; F558-A571 HydrophobicContact CG-CB 4.01Å; F558-A571 HydrophobicContact CZ-CB 4.13Å; F558-R578 VanDerWaalsContact O-CD 3.27Å; F558-R578 WeakPolarHBondContact O-CD 3.3Å; F558-R578 PolarHBondContact O-NH1 2.88Å
559	F	91.3	Very high	79.7	Confident	0 Å²	0	57 Å²	57	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	165.2	169.2	64.7	-83.2	0	0	0	109.5	L494 V543 D544 T546 F570 R578 W581 V582 M585	L494-F559 HydrophobicContact CD1-CE1 4.45Å; L494-F559 HydrophobicContact CD1-CZ 3.82Å; L494-F559 HydrophobicContact CD2-CE1 4Å; L494-F559 HydrophobicContact CD2-CZ 4.19Å; V543-F559 HydrophobicContact CG1-CD2 4.28Å; D544-F559 CarbonylContact O-C 3.57Å; D544-F559 VanDerWaalsContact O-CA 3.31Å; D544-F559 WeakPolarHBondContact O-CA 3.33Å; D544-F559 VanDerWaalsContact O-CB 3.3Å; D544-F559 WeakPolarHBondContact O-CB 3.45Å; T546-F559 VanDerWaalsContact OG1-CA 3.28Å; T546-F559 WeakPolarHBondContact OG1-CA 3.22Å; T546-F559 PolarHBondContact OG1-N 3.41Å; F559-F570 HydrophobicContact CD1-CB 4.02Å; F559-F570 HydrophobicContact CD2-CB 3.97Å; F559-F570 HydrophobicContact CD2-CD2 4.23Å; F559-F570 HydrophobicContact CD2-CG 4.47Å; F559-F570 HydrophobicContact CE1-CB 3.65Å; F559-F570 HydrophobicContact CE2-CB 3.58Å; F559-F570 AromaticContact CE2-CD2 3.81Å; F559-F570 HydrophobicContact CE2-CD2 3.81Å; F559-F570 AromaticContact CE2-CG 3.86Å; F559-F570 HydrophobicContact CE2-CG 3.86Å; F559-F570 HydrophobicContact CG-CB 4.19Å; F559-F570 HydrophobicContact CZ-CB 3.42Å; F559-F570 VanDerWaalsContact CZ-CB 3.42Å; F559-F570 HydrophobicContact CZ-CD2 4.4Å; F559-F570 AromaticContact CZ-CG 3.97Å; F559-F570 HydrophobicContact CZ-CG 3.97Å; F559-F570 PolarHBondContact N-O 3.07Å; F559-F570 PolarHBondContact O-N 3.33Å; F559-R578 HydrophobicContact CD1-CG 3.91Å; F559-W581 HydrophobicContact CE1-CB 4.14Å; F559-W581 HydrophobicContact CE2-CB 4.4Å; F559-W581 HydrophobicContact CZ-CB 3.72Å; F559-W581 HydrophobicContact CZ-CG 4.18Å; F559-V582 HydrophobicContact CB-CG2 3.75Å; F559-V582 HydrophobicContact CD1-CG2 4.28Å; F559-V582 HydrophobicContact CD2-CG2 3.89Å; F559-V582 HydrophobicContact CG-CG2 3.74Å; F559-M585 HydrophobicContact CE2-SD 3.86Å
560	N	90.4	Very high	80.6	Confident	30 Å²	30	52.4 Å²	52.4	16%	0.16	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	165.1	177.1	68.4	-4.9	0	0	0	112.7	V543 D544 T546 V562 V568	V543-N560 VanDerWaalsContact CA-O 3.3Å; V543-N560 WeakPolarHBondContact CA-O 3.15Å; V543-N560 WeakPolarHBondContact CG1-O 3.5Å; D544-N560 PolarHBondContact N-O 3.28Å; D544-N560 PolarHBondContact N-OD1 3.43Å; D544-N560 PolarHBondContact O-N 3.38Å; D544-N560 PolarHBondContact O-OD1 2.99Å; T546-N560 HydrophobicContact CG2-CB 3.85Å; T546-N560 VanDerWaalsContact CG2-CG 3.42Å; N560-V562 WeakPolarHBondContact ND2-CG2 3.47Å; N560-V568 CarbonylContact C-O 3.59Å; N560-V568 VanDerWaalsContact CA-O 3.32Å; N560-V568 WeakPolarHBondContact CA-O 3.47Å
561	A	90.5	Very high	82	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	130.8	161.3	0	0	0	0	0	108.6	M536 Y541 T542 V543 T567 V568 F570 M585	M536-A561 HydrophobicContact CE-CB 4.4Å; Y541-A561 HydrophobicContact CD1-CB 4Å; T542-A561 CarbonylContact O-C 3.55Å; T542-A561 WeakPolarHBondContact O-CA 3.36Å; V543-A561 HydrophobicContact CG2-CB 4.21Å; A561-T567 WeakPolarHBondContact O-CA 3.41Å; A561-V568 PolarHBondContact N-O 3.43Å; A561-V568 PolarHBondContact O-N 3.48Å; A561-F570 HydrophobicContact CB-CE2 4.11Å; A561-M585 HydrophobicContact CB-CE 4.21Å
562	V	85.7	Confident	83	Confident	48 Å²	48	42.6 Å²	42.6	29%	0.291	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	133.3	-173.3	-175.6	0	0	0	0	110.3	Y541 T542 N560 T567	Y541-V562 CarbonylContact C-O 3.58Å; Y541-V562 VanDerWaalsContact CA-O 3.23Å; Y541-V562 WeakPolarHBondContact CA-O 3.47Å; T542-V562 PolarHBondContact N-O 3.08Å; T542-V562 PolarHBondContact O-N 2.83Å; N560-V562 WeakPolarHBondContact ND2-CG2 3.47Å; V562-T567 HydrophobicContact CG2-CG2 4.17Å
563	K	83.9	Confident	83.3	Confident	72 Å²	72	44 Å²	44	31%	0.313	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	162.3	168	179.6	165	-175.5	176.2	0	107.8	E539 G540 Y541 G565 D566	E539-K563 WeakPolarHBondContact O-CD 3.43Å; E539-K563 WeakPolarHBondContact O-CE 3.46Å; E539-K563 PolarHBondContact O-NZ 3.12Å; G540-K563 VanDerWaalsContact O-CG 3.32Å; G540-K563 WeakPolarHBondContact O-CG 3.48Å; Y541-K563 HydrophobicContact CD1-CB 3.69Å; Y541-K563 HydrophobicContact CD2-CB 4.03Å; Y541-K563 HydrophobicContact CD2-CD 3.91Å; Y541-K563 HydrophobicContact CE1-CB 3.66Å; Y541-K563 HydrophobicContact CE2-CB 4.03Å; Y541-K563 HydrophobicContact CE2-CD 3.74Å; Y541-K563 HydrophobicContact CG-CB 3.88Å; K563-G565 PolarHBondContact O-N 3.4Å; K563-D566 PolarHBondContact N-O 3.31Å; K563-D566 VanDerWaalsContact N-O 3.08Å; K563-D566 PolarHBondContact O-N 2.64Å
564	E	76.1	Confident	84.1	Confident	190 Å²	190	40.1 Å²	40.1	89%	0.888	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.9	117.2	176	-63	-166.6	157.5	0	0	110.9	D566	E564-D566 PolarHBondContact O-N 3.38Å
565	G	73.4	Confident	84.9	Confident	65 Å²	65	40.9 Å²	40.9	67%	0.67	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.1	18.8	-176.7	0	0	0	0	0	116.4	K563	K563-G565 PolarHBondContact O-N 3.4Å
566	D	83.9	Confident	85.4	Confident	3 Å²	3	45.9 Å²	45.9	2%	0.016	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	152.6	166.8	-151.7	-17.7	0	0	0	112.4	Q499 K500 Y541 K563 E564	Q499-D566 WeakPolarHBondContact CB-OD1 3.36Å; K500-D566 VanDerWaalsContact CB-OD2 3.28Å; K500-D566 WeakPolarHBondContact CB-OD2 3.39Å; K500-D566 WeakPolarHBondContact CD-OD2 3.41Å; K500-D566 VanDerWaalsContact CE-OD2 3.26Å; K500-D566 WeakPolarHBondContact CE-OD2 3.5Å; K500-D566 WeakPolarHBondContact CG-OD2 3.3Å; K500-D566 IonicContact NZ-OD2 3.29Å; Y541-D566 HydrophobicContact CE1-CB 4.48Å; Y541-D566 PolarHBondContact OH-OD2 3.49Å; K563-D566 PolarHBondContact N-O 3.31Å; K563-D566 VanDerWaalsContact N-O 3.08Å; K563-D566 PolarHBondContact O-N 2.64Å; E564-D566 PolarHBondContact O-N 3.38Å
567	T	86.5	Confident	85.8	Confident	42 Å²	42	44 Å²	44	26%	0.258	24%	0.237	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	130.4	176	-63.1	0	0	0	0	109.6	G498 A561 V562	G498-T567 WeakPolarHBondContact CA-O 3.43Å; A561-T567 WeakPolarHBondContact O-CA 3.41Å; V562-T567 HydrophobicContact CG2-CG2 4.17Å
568	V	89.8	Confident	85.9	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	119.9	175.8	-172.2	0	0	0	0	109	L497 V501 W502 M536 N560 A561 F570	L497-V568 CarbonylContact O-C 3.6Å; L497-V568 WeakPolarHBondContact O-CA 3.42Å; V501-V568 HydrophobicContact CG2-CG2 4.24Å; W502-V568 HydrophobicContact CE3-CG1 3.95Å; W502-V568 HydrophobicContact CZ3-CG1 4.35Å; M536-V568 HydrophobicContact CE-CG2 4.23Å; M536-V568 HydrophobicContact SD-CB 4.46Å; M536-V568 HydrophobicContact SD-CG2 3.58Å; M536-V568 VanDerWaalsContact SD-CG2 3.58Å; N560-V568 CarbonylContact C-O 3.59Å; N560-V568 VanDerWaalsContact CA-O 3.32Å; N560-V568 WeakPolarHBondContact CA-O 3.47Å; A561-V568 PolarHBondContact N-O 3.43Å; A561-V568 PolarHBondContact O-N 3.48Å; V568-F570 HydrophobicContact CB-CE2 3.94Å; V568-F570 HydrophobicContact CB-CZ 4.28Å; V568-F570 HydrophobicContact CG1-CD2 4.2Å; V568-F570 HydrophobicContact CG1-CE1 4.11Å; V568-F570 HydrophobicContact CG1-CE2 3.56Å; V568-F570 HydrophobicContact CG1-CZ 3.52Å
569	I	89.6	Confident	85.8	Confident	28 Å²	28	43.9 Å²	43.9	14%	0.144	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	132.5	175.3	-59.2	173.1	0	0	0	108	A496 L497 W505 F558	A496-I569 VanDerWaalsContact CA-O 3.31Å; A496-I569 WeakPolarHBondContact CA-O 3.29Å; L497-I569 PolarHBondContact N-O 3.42Å; L497-I569 PolarHBondContact O-N 2.86Å; W505-I569 HydrophobicContact CZ3-CG2 4.42Å; F558-I569 HydrophobicContact CD1-CG2 4.05Å
570	F	91.2	Very high	85.6	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	154.1	174.8	-64.1	-85.1	0	0	0	110.7	L494 Y495 A496 W502 F510 M522 M536 F558 F559 A561 V568 M585	L494-F570 HydrophobicContact CB-CD1 4.43Å; L494-F570 HydrophobicContact CD1-CB 4.44Å; L494-F570 HydrophobicContact CD1-CD1 3.87Å; L494-F570 HydrophobicContact CD1-CG 4.41Å; Y495-F570 CarbonylContact O-C 3.48Å; Y495-F570 VanDerWaalsContact O-CA 3.28Å; Y495-F570 WeakPolarHBondContact O-CA 3.41Å; A496-F570 HydrophobicContact CB-CD1 3.71Å; A496-F570 HydrophobicContact CB-CE1 3.79Å; W502-F570 HydrophobicContact CE3-CZ 4.45Å; W502-F570 HydrophobicContact CZ3-CE1 4.41Å; W502-F570 HydrophobicContact CZ3-CZ 4.09Å; F510-F570 HydrophobicContact CE1-CE1 4.02Å; F510-F570 HydrophobicContact CZ-CE1 4.1Å; M522-F570 HydrophobicContact CE-CD1 4.3Å; M522-F570 HydrophobicContact CE-CE1 3.76Å; M522-F570 HydrophobicContact CE-CZ 4.14Å; M522-F570 HydrophobicContact CG-CE1 4.47Å; M522-F570 HydrophobicContact CG-CZ 4.24Å; M536-F570 HydrophobicContact CE-CZ 4.42Å; F558-F570 WeakPolarHBondContact CA-O 3.25Å; F559-F570 HydrophobicContact CD1-CB 4.02Å; F559-F570 HydrophobicContact CD2-CB 3.97Å; F559-F570 HydrophobicContact CD2-CD2 4.23Å; F559-F570 HydrophobicContact CD2-CG 4.47Å; F559-F570 HydrophobicContact CE1-CB 3.65Å; F559-F570 HydrophobicContact CE2-CB 3.58Å; F559-F570 AromaticContact CE2-CD2 3.81Å; F559-F570 HydrophobicContact CE2-CD2 3.81Å; F559-F570 AromaticContact CE2-CG 3.86Å; F559-F570 HydrophobicContact CE2-CG 3.86Å; F559-F570 HydrophobicContact CG-CB 4.19Å; F559-F570 HydrophobicContact CZ-CB 3.42Å; F559-F570 VanDerWaalsContact CZ-CB 3.42Å; F559-F570 HydrophobicContact CZ-CD2 4.4Å; F559-F570 AromaticContact CZ-CG 3.97Å; F559-F570 HydrophobicContact CZ-CG 3.97Å; F559-F570 PolarHBondContact N-O 3.07Å; F559-F570 PolarHBondContact O-N 3.33Å; A561-F570 HydrophobicContact CB-CE2 4.11Å; V568-F570 HydrophobicContact CB-CE2 3.94Å; V568-F570 HydrophobicContact CB-CZ 4.28Å; V568-F570 HydrophobicContact CG1-CD2 4.2Å; V568-F570 HydrophobicContact CG1-CE1 4.11Å; V568-F570 HydrophobicContact CG1-CE2 3.56Å; V568-F570 HydrophobicContact CG1-CZ 3.52Å; F570-M585 HydrophobicContact CE2-CE 4.15Å
571	A	90.3	Very high	85.6	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	141.4	165.3	0	0	0	0	0	112.4	L494 Y495 W505 M557 F558	L494-A571 WeakPolarHBondContact CA-O 3.1Å; Y495-A571 PolarHBondContact N-O 3.18Å; Y495-A571 PolarHBondContact O-N 3.4Å; W505-A571 HydrophobicContact CH2-CB 3.64Å; W505-A571 HydrophobicContact CZ2-CB 3.98Å; M557-A571 VanDerWaalsContact O-CA 3.25Å; M557-A571 WeakPolarHBondContact O-CA 3.39Å; F558-A571 HydrophobicContact CD1-CB 3.81Å; F558-A571 HydrophobicContact CD2-CB 4.26Å; F558-A571 HydrophobicContact CE1-CB 3.88Å; F558-A571 HydrophobicContact CE2-CB 4.32Å; F558-A571 HydrophobicContact CG-CB 4.01Å; F558-A571 HydrophobicContact CZ-CB 4.13Å
572	S	88.2	Confident	85.5	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	164.4	168.4	58.2	0	0	0	0	110.5	G555 C556 M557 D574 D577 R578	G555-S572 CarbonylContact C-O 3.55Å; G555-S572 WeakPolarHBondContact CA-O 3.31Å; C556-S572 PolarHBondContact N-O 3.16Å; M557-S572 PolarHBondContact N-O 3.29Å; M557-S572 VanDerWaalsContact N-O 3.12Å; M557-S572 PolarHBondContact O-N 3.04Å; S572-D574 WeakPolarHBondContact CB-O 3.24Å; S572-D574 PolarHBondContact OG-O 3.19Å; S572-D577 WeakPolarHBondContact CB-OD2 3.41Å; S572-R578 WeakPolarHBondContact OG-CB 3.45Å; S572-R578 PolarHBondContact OG-N 2.83Å
573	D	84.6	Confident	85.4	Confident	73 Å²	73	47.3 Å²	47.3	39%	0.39	25%	0.249	S	C	.	.	S	Bend	trans	-86.4	-13.4	172.6	-62.3	-47.8	0	0	0	112.8	K507 G555	K507-D573 IonicContact NZ-OD2 2.62Å; K507-D573 PolarHBondContact NZ-OD2 3.21Å; G555-D573 WeakPolarHBondContact CA-OD1 3.47Å; G555-D573 PolarHBondContact N-OD1 3.35Å
574	D	84.2	Confident	85.4	Confident	94 Å²	94	44.5 Å²	44.5	50%	0.503	24%	0.239	S	C	.	.	S	Bend	trans	-128.8	145.9	-179.1	-173.2	-6	0	0	0	110.8	S572 Q576 D577 R578	S572-D574 WeakPolarHBondContact CB-O 3.24Å; S572-D574 PolarHBondContact OG-O 3.19Å; D574-Q576 PolarHBondContact OD1-N 3.42Å; D574-D577 HydrophobicContact CB-CB 4.2Å; D574-R578 PolarHBondContact O-N 3.06Å; D574-R578 VanDerWaalsContact O-N 3.14Å
575	E	81.8	Confident	86	Confident	49 Å²	49	35.4 Å²	35.4	23%	0.229	20%	0.197	C	C	.	.	H	α-helix	trans	-68.1	-39.2	174.5	-174.7	58.2	-140.6	0	0	112	M557 D577 R578 I579	M557-E575 HydrophobicContact CE-CB 4.3Å; M557-E575 HydrophobicContact CG-CB 4.21Å; M557-E575 WeakPolarHBondContact CG-OE2 3.33Å; E575-D577 VanDerWaalsContact C-N 3.29Å; E575-D577 PolarHBondContact O-N 2.68Å; E575-R578 WeakPolarHBondContact O-CB 3.49Å; E575-R578 PolarHBondContact O-N 2.93Å; E575-R578 VanDerWaalsContact O-N 3.11Å; E575-R578 IonicContact OE1-CZ 2.54Å; E575-R578 IonicContact OE1-NE 3.99Å; E575-R578 PolarHBondContact OE1-NE 2.95Å; E575-R578 IonicContact OE1-NH2 2.68Å; E575-R578 PolarHBondContact OE1-NH2 3.25Å; E575-R578 IonicContact OE2-CZ 3.56Å; E575-R578 VanDerWaalsContact OE2-CZ 3.25Å; E575-R578 IonicContact OE2-NE 3.89Å; E575-R578 PolarHBondContact OE2-NE 3.29Å; E575-R578 IonicContact OE2-NH2 3.77Å; E575-R578 PolarHBondContact OE2-NH2 3.05Å; E575-I579 HydrophobicContact CG-CD1 4.03Å; E575-I579 WeakPolarHBondContact O-CG1 3.3Å; E575-I579 PolarHBondContact O-N 3.42Å
576	Q	82.9	Confident	86.4	Confident	117 Å²	117	34.2 Å²	34.2	55%	0.547	17%	0.172	S	C	.	.	H	α-helix	trans	-66.2	-36.8	-178.8	-170.5	65.3	10	0	0	110.9	D574 L580	D574-Q576 PolarHBondContact OD1-N 3.42Å; Q576-L580 VanDerWaalsContact O-CG 3.3Å; Q576-L580 WeakPolarHBondContact O-CG 3.28Å; Q576-L580 PolarHBondContact O-N 3.4Å; Q576-L580 VanDerWaalsContact O-N 3.17Å
577	D	84.3	Confident	86.2	Confident	37 Å²	37	37.9 Å²	37.9	20%	0.198	19%	0.186	C	C	.	.	H	α-helix	trans	-64.9	-42.8	170.9	-167.7	61	0	0	0	111	S572 D574 E575 I579 L580 W581	S572-D577 WeakPolarHBondContact CB-OD2 3.41Å; D574-D577 HydrophobicContact CB-CB 4.2Å; E575-D577 VanDerWaalsContact C-N 3.29Å; E575-D577 PolarHBondContact O-N 2.68Å; D577-I579 PolarHBondContact O-N 3.07Å; D577-L580 PolarHBondContact O-N 3.45Å; D577-W581 PolarHBondContact O-N 3.39Å; D577-W581 PolarHBondContact OD2-NE1 2.99Å
578	R	87.4	Confident	85.9	Confident	33 Å²	33	36.1 Å²	36.1	13%	0.125	18%	0.175	C	C	.	.	H	α-helix	trans	-56	-49.3	174.7	-179.3	168.8	69.9	162.9	-1.5	111.8	Y545 M557 F558 F559 S572 D574 E575 L580 W581 V582	Y545-R578 HydrophobicContact CD1-CG 4.24Å; Y545-R578 HydrophobicContact CE1-CG 4.01Å; M557-R578 HydrophobicContact CB-CB 4.13Å; F558-R578 VanDerWaalsContact O-CD 3.27Å; F558-R578 WeakPolarHBondContact O-CD 3.3Å; F558-R578 PolarHBondContact O-NH1 2.88Å; F559-R578 HydrophobicContact CD1-CG 3.91Å; S572-R578 WeakPolarHBondContact OG-CB 3.45Å; S572-R578 PolarHBondContact OG-N 2.83Å; D574-R578 PolarHBondContact O-N 3.06Å; D574-R578 VanDerWaalsContact O-N 3.14Å; E575-R578 WeakPolarHBondContact O-CB 3.49Å; E575-R578 PolarHBondContact O-N 2.93Å; E575-R578 VanDerWaalsContact O-N 3.11Å; E575-R578 IonicContact OE1-CZ 2.54Å; E575-R578 IonicContact OE1-NE 3.99Å; E575-R578 PolarHBondContact OE1-NE 2.95Å; E575-R578 IonicContact OE1-NH2 2.68Å; E575-R578 PolarHBondContact OE1-NH2 3.25Å; E575-R578 IonicContact OE2-CZ 3.56Å; E575-R578 VanDerWaalsContact OE2-CZ 3.25Å; E575-R578 IonicContact OE2-NE 3.89Å; E575-R578 PolarHBondContact OE2-NE 3.29Å; E575-R578 IonicContact OE2-NH2 3.77Å; E575-R578 PolarHBondContact OE2-NH2 3.05Å; R578-L580 VanDerWaalsContact C-N 3.31Å; R578-L580 PolarHBondContact O-N 3.03Å; R578-W581 PolarHBondContact O-N 3.28Å; R578-V582 HydrophobicContact CG-CG2 4.16Å; R578-V582 WeakPolarHBondContact O-CG2 3.25Å; R578-V582 PolarHBondContact O-N 3.48Å
579	I	85.9	Confident	85.5	Confident	40 Å²	40	37.2 Å²	37.2	21%	0.205	18%	0.182	C	C	.	.	H	α-helix	trans	-61.6	-42.4	-178.2	-67.7	165.6	0	0	0	110.3	E575 D577 Q583	E575-I579 HydrophobicContact CG-CD1 4.03Å; E575-I579 WeakPolarHBondContact O-CG1 3.3Å; E575-I579 PolarHBondContact O-N 3.42Å; D577-I579 PolarHBondContact O-N 3.07Å; I579-Q583 HydrophobicContact CG2-CG 4.48Å; I579-Q583 VanDerWaalsContact CG2-NE2 3.31Å; I579-Q583 WeakPolarHBondContact O-CB 3.37Å; I579-Q583 VanDerWaalsContact O-CG 3.23Å; I579-Q583 WeakPolarHBondContact O-CG 3.21Å; I579-Q583 PolarHBondContact O-N 2.85Å
580	L	86.7	Confident	84.4	Confident	73 Å²	73	36.6 Å²	36.6	38%	0.382	18%	0.183	S	C	.	.	H	α-helix	trans	-65.5	-42.1	177.1	-69.7	168.8	0	0	0	112.3	Q576 D577 R578 A584	Q576-L580 VanDerWaalsContact O-CG 3.3Å; Q576-L580 WeakPolarHBondContact O-CG 3.28Å; Q576-L580 PolarHBondContact O-N 3.4Å; Q576-L580 VanDerWaalsContact O-N 3.17Å; D577-L580 PolarHBondContact O-N 3.45Å; R578-L580 VanDerWaalsContact C-N 3.31Å; R578-L580 PolarHBondContact O-N 3.03Å; L580-A584 VanDerWaalsContact O-CB 3.23Å; L580-A584 WeakPolarHBondContact O-CB 3.19Å; L580-A584 PolarHBondContact O-N 2.9Å
581	W	89.8	Confident	83.5	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.1	-49.4	174.7	-85.6	109.8	0	0	0	112.8	H490 L494 F510 L512 M522 F559 D577 R578 Q583 A584 M585	H490-W581 AromaticContact CD2-CD2 3.4Å; H490-W581 AromaticContact CD2-CE2 3.38Å; H490-W581 AromaticContact CD2-CE3 3.62Å; H490-W581 AromaticContact CD2-CG 3.99Å; H490-W581 AromaticContact CD2-CH2 3.87Å; H490-W581 AromaticContact CD2-CZ2 3.67Å; H490-W581 AromaticContact CD2-CZ3 3.83Å; H490-W581 AromaticContact CD2-NE1 3.85Å; H490-W581 AromaticContact NE2-CD1 3.87Å; H490-W581 AromaticContact NE2-CD2 3.87Å; H490-W581 AromaticContact NE2-CE2 3.65Å; H490-W581 AromaticContact NE2-NE1 3.61Å; L494-W581 HydrophobicContact CD1-CD2 3.73Å; L494-W581 HydrophobicContact CD1-CE3 4.13Å; L494-W581 HydrophobicContact CD1-CG 4.13Å; L494-W581 HydrophobicContact CD1-CH2 4.3Å; L494-W581 HydrophobicContact CD1-CZ2 3.89Å; L494-W581 HydrophobicContact CD1-CZ3 4.42Å; L494-W581 HydrophobicContact CD2-CG 4.26Å; L494-W581 HydrophobicContact CG-CD2 4.35Å; L494-W581 HydrophobicContact CG-CZ2 4.1Å; F510-W581 HydrophobicContact CB-CH2 3.67Å; F510-W581 HydrophobicContact CB-CZ2 4.01Å; L512-W581 HydrophobicContact CB-CZ3 4.2Å; M522-W581 HydrophobicContact CE-CE3 3.97Å; M522-W581 HydrophobicContact CE-CH2 3.88Å; M522-W581 HydrophobicContact CE-CZ3 3.47Å; M522-W581 VanDerWaalsContact CE-CZ3 3.47Å; M522-W581 HydrophobicContact SD-CH2 4.21Å; M522-W581 HydrophobicContact SD-CZ3 3.78Å; F559-W581 HydrophobicContact CE1-CB 4.14Å; F559-W581 HydrophobicContact CE2-CB 4.4Å; F559-W581 HydrophobicContact CZ-CB 3.72Å; F559-W581 HydrophobicContact CZ-CG 4.18Å; D577-W581 PolarHBondContact O-N 3.39Å; D577-W581 PolarHBondContact OD2-NE1 2.99Å; R578-W581 PolarHBondContact O-N 3.28Å; W581-Q583 VanDerWaalsContact C-N 3.35Å; W581-Q583 PolarHBondContact O-N 3.5Å; W581-A584 PolarHBondContact O-N 3.44Å; W581-M585 HydrophobicContact CE3-CG 4.49Å; W581-M585 HydrophobicContact CE3-SD 4.36Å; W581-M585 WeakPolarHBondContact O-CG 3.48Å; W581-M585 PolarHBondContact O-N 3.08Å
582	V	88.3	Confident	81.8	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.012	21%	0.208	C	C	.	.	H	α-helix	trans	-63.1	-41.8	180	172.5	0	0	0	0	110.6	V543 Y545 F559 R578 Y586 P595	V543-V582 HydrophobicContact CG1-CG1 4.17Å; V543-V582 HydrophobicContact CG1-CG2 4.35Å; Y545-V582 HydrophobicContact CD1-CG2 4.35Å; Y545-V582 HydrophobicContact CD2-CG1 4.34Å; Y545-V582 HydrophobicContact CE1-CB 4.26Å; Y545-V582 HydrophobicContact CE1-CG1 4.35Å; Y545-V582 HydrophobicContact CE1-CG2 3.99Å; Y545-V582 HydrophobicContact CE2-CB 4.44Å; Y545-V582 HydrophobicContact CE2-CG1 3.69Å; F559-V582 HydrophobicContact CB-CG2 3.75Å; F559-V582 HydrophobicContact CD1-CG2 4.28Å; F559-V582 HydrophobicContact CD2-CG2 3.89Å; F559-V582 HydrophobicContact CG-CG2 3.74Å; R578-V582 HydrophobicContact CG-CG2 4.16Å; R578-V582 WeakPolarHBondContact O-CG2 3.25Å; R578-V582 PolarHBondContact O-N 3.48Å; V582-Y586 WeakPolarHBondContact O-CB 3.39Å; V582-Y586 PolarHBondContact O-N 3.44Å; V582-P595 HydrophobicContact CG1-CB 3.77Å; V582-P595 HydrophobicContact CG1-CG 3.93Å
583	Q	84.4	Confident	80.9	Confident	76 Å²	76	45 Å²	45	36%	0.355	23%	0.226	S	C	.	.	H	α-helix	trans	-64.3	-40.6	174	-73.5	179.7	19.5	0	0	113	I579 W581 R587	I579-Q583 HydrophobicContact CG2-CG 4.48Å; I579-Q583 VanDerWaalsContact CG2-NE2 3.31Å; I579-Q583 WeakPolarHBondContact O-CB 3.37Å; I579-Q583 VanDerWaalsContact O-CG 3.23Å; I579-Q583 WeakPolarHBondContact O-CG 3.21Å; I579-Q583 PolarHBondContact O-N 2.85Å; W581-Q583 VanDerWaalsContact C-N 3.35Å; W581-Q583 PolarHBondContact O-N 3.5Å; Q583-R587 WeakPolarHBondContact O-CG 3.35Å; Q583-R587 PolarHBondContact O-N 2.9Å
584	A	84.9	Confident	80.3	Confident	12 Å²	12	48.5 Å²	48.5	10%	0.099	24%	0.238	C	C	.	.	H	α-helix	trans	-67.7	-42.9	179.3	0	0	0	0	0	111.8	H490 L512 L580 W581 A588	H490-A584 HydrophobicContact CB-CB 3.67Å; L512-A584 HydrophobicContact CD2-CB 3.86Å; L512-A584 WeakPolarHBondContact CD2-O 3.26Å; L580-A584 VanDerWaalsContact O-CB 3.23Å; L580-A584 WeakPolarHBondContact O-CB 3.19Å; L580-A584 PolarHBondContact O-N 2.9Å; W581-A584 PolarHBondContact O-N 3.44Å; A584-A588 PolarHBondContact O-N 3.47Å
585	M	87.2	Confident	80.1	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-72.7	-35	177.5	-65.5	-179.9	59.2	0	0	112.3	L512 M522 L538 V543 F559 A561 F570 W581 R587 A588 T589	L512-M585 HydrophobicContact CD2-CG 4.25Å; M522-M585 HydrophobicContact CE-SD 4.12Å; L538-M585 HydrophobicContact CD1-CE 4.21Å; L538-M585 HydrophobicContact CD1-CG 4.37Å; L538-M585 HydrophobicContact CD2-CE 4Å; V543-M585 HydrophobicContact CG1-CB 4.4Å; V543-M585 HydrophobicContact CG2-CB 3.92Å; V543-M585 HydrophobicContact CG2-CE 3.99Å; F559-M585 HydrophobicContact CE2-SD 3.86Å; A561-M585 HydrophobicContact CB-CE 4.21Å; F570-M585 HydrophobicContact CE2-CE 4.15Å; W581-M585 HydrophobicContact CE3-CG 4.49Å; W581-M585 HydrophobicContact CE3-SD 4.36Å; W581-M585 WeakPolarHBondContact O-CG 3.48Å; W581-M585 PolarHBondContact O-N 3.08Å; M585-R587 PolarHBondContact O-N 3.29Å; M585-A588 WeakPolarHBondContact O-CB 3.34Å; M585-A588 PolarHBondContact O-N 3.37Å; M585-A588 VanDerWaalsContact O-N 3.1Å; M585-T589 WeakPolarHBondContact O-CG2 3.5Å; M585-T589 PolarHBondContact O-N 3.33Å; M585-T589 PolarHBondContact O-OG1 3.06Å
586	Y	83.5	Confident	79.8	Confident	40 Å²	40	47.2 Å²	47.2	16%	0.157	24%	0.237	C	C	.	.	H	α-helix	trans	-57	-44.5	171.2	164.4	-106.5	0	0	0	112.9	R275 V582 A588 T589 G590 Q591 Y593 K594 P595	R275-Y586 PolarHBondContact NH1-OH 2.83Å; R275-Y586 VanDerWaalsContact NH1-OH 3.11Å; V582-Y586 WeakPolarHBondContact O-CB 3.39Å; V582-Y586 PolarHBondContact O-N 3.44Å; Y586-A588 VanDerWaalsContact C-N 3.28Å; Y586-A588 PolarHBondContact O-N 3.41Å; Y586-T589 PolarHBondContact O-OG1 2.9Å; Y586-G590 PolarHBondContact O-N 3.27Å; Y586-G590 VanDerWaalsContact O-N 3.09Å; Y586-Q591 HydrophobicContact CD2-CG 3.53Å; Y586-Q591 HydrophobicContact CE2-CG 3.85Å; Y586-Y593 WeakPolarHBondContact CE2-O 3.49Å; Y586-K594 HydrophobicContact CE1-CG 4.44Å; Y586-K594 HydrophobicContact CE2-CB 4.3Å; Y586-P595 HydrophobicContact CD2-CG 4.09Å; Y586-P595 HydrophobicContact CG-CG 4.38Å
587	R	78.9	Confident	79.1	Confident	80 Å²	80	44.1 Å²	44.1	30%	0.302	23%	0.226	S	C	.	.	H	α-helix	trans	-64.8	-32.9	174.5	-71.3	174.6	178.6	133.6	-8.5	112.6	E268 R274 Q583 M585	E268-R587 HydrophobicContact CG-CG 4.49Å; E268-R587 IonicContact OE1-CZ 2.77Å; E268-R587 IonicContact OE1-NE 2.65Å; E268-R587 PolarHBondContact OE1-NE 3.16Å; E268-R587 IonicContact OE1-NH2 3.4Å; E268-R587 PolarHBondContact OE1-NH2 3.39Å; E268-R587 IonicContact OE2-NH2 2.91Å; R274-R587 PolarHBondContact NH2-O 2.81Å; Q583-R587 WeakPolarHBondContact O-CG 3.35Å; Q583-R587 PolarHBondContact O-N 2.9Å; M585-R587 PolarHBondContact O-N 3.29Å
588	A	80.6	Confident	77.8	Confident	4 Å²	4	46.2 Å²	46.2	3%	0.033	25%	0.249	C	C	.	.	H	α-helix	trans	-74.9	-46.5	179.6	0	0	0	0	0	112.6	L512 F520 L538 A584 M585 Y586	L512-A588 HydrophobicContact CD1-CB 4.2Å; L512-A588 HydrophobicContact CD2-CB 4.18Å; F520-A588 HydrophobicContact CB-CB 3.69Å; F520-A588 HydrophobicContact CD1-CB 3.63Å; F520-A588 HydrophobicContact CD2-CB 3.95Å; F520-A588 WeakPolarHBondContact CD2-O 3.5Å; F520-A588 HydrophobicContact CE1-CB 4.21Å; F520-A588 HydrophobicContact CG-CB 3.48Å; F520-A588 VanDerWaalsContact CG-CB 3.48Å; L538-A588 HydrophobicContact CD1-CB 4.01Å; A584-A588 PolarHBondContact O-N 3.47Å; M585-A588 WeakPolarHBondContact O-CB 3.34Å; M585-A588 PolarHBondContact O-N 3.37Å; M585-A588 VanDerWaalsContact O-N 3.1Å; Y586-A588 VanDerWaalsContact C-N 3.28Å; Y586-A588 PolarHBondContact O-N 3.41Å
589	T	80.3	Confident	75.9	Confident	23 Å²	23	51.9 Å²	51.9	14%	0.141	28%	0.28	C	S	.	.	H	α-helix	trans	-69.3	-32.8	178.4	55.6	0	0	0	0	112.7	L538 Y541 V543 M585 Y586 Q591	L538-T589 HydrophobicContact CB-CG2 4.22Å; Y541-T589 WeakPolarHBondContact O-CB 3.41Å; Y541-T589 WeakPolarHBondContact O-CG2 3.44Å; V543-T589 HydrophobicContact CG2-CG2 4.05Å; M585-T589 WeakPolarHBondContact O-CG2 3.5Å; M585-T589 PolarHBondContact O-N 3.33Å; M585-T589 PolarHBondContact O-OG1 3.06Å; Y586-T589 PolarHBondContact O-OG1 2.9Å; T589-Q591 PolarHBondContact O-N 3.19Å; T589-Q591 PolarHBondContact OG1-OE1 3.34Å; T589-Q591 VanDerWaalsContact OG1-OE1 3.11Å
590	G	67.1	Low	73.8	Confident	16 Å²	16	58.7 Å²	58.7	17%	0.165	31%	0.311	C	S	.	.			trans	71.4	14.2	-178.3	0	0	0	0	0	114.2	R275 Y586	R275-G590 WeakPolarHBondContact CG-O 3.33Å; Y586-G590 PolarHBondContact O-N 3.27Å; Y586-G590 VanDerWaalsContact O-N 3.09Å
591	Q	71.8	Confident	71.3	Confident	14 Å²	14	61.7 Å²	61.7	7%	0.065	33%	0.332	C	S	.	.			trans	-52.3	145.7	-178.6	66.7	-171.1	71.8	0	0	112.9	R275 T542 V543 Y586 T589 Y593	R275-Q591 WeakPolarHBondContact CD-O 3.32Å; T542-Q591 HydrophobicContact CG2-CB 4.1Å; V543-Q591 PolarHBondContact O-NE2 2.87Å; V543-Q591 VanDerWaalsContact O-NE2 3.08Å; Y586-Q591 HydrophobicContact CD2-CG 3.53Å; Y586-Q591 HydrophobicContact CE2-CG 3.85Å; T589-Q591 PolarHBondContact O-N 3.19Å; T589-Q591 PolarHBondContact OG1-OE1 3.34Å; T589-Q591 VanDerWaalsContact OG1-OE1 3.11Å; Q591-Y593 WeakPolarHBondContact CG-O 3.3Å; Q591-Y593 PolarHBondContact NE2-O 3.15Å; Q591-Y593 PolarHBondContact O-N 2.91Å
592	S	55	Low	68.7	Low	65 Å²	65	70.8 Å²	70.8	46%	0.455	38%	0.375	S	S	.	.	S	Bend	trans	-61.7	-43.3	-171.2	56.1	0	0	0	0	113.8	R275	R275-S592 WeakPolarHBondContact CD-O 3.4Å; R275-S592 PolarHBondContact NH1-O 2.98Å
593	Y	68.7	Low	66.2	Low	98 Å²	98	80.3 Å²	80.3	38%	0.384	42%	0.416	S	S	.	.	S	Bend	trans	-97.9	140.9	-177.8	66.2	-85.8	0	0	0	112.7	T542 D544 Y586 Q591	T542-Y593 HydrophobicContact CG2-CE1 4.31Å; T542-Y593 PolarHBondContact OG1-OH 2.9Å; D544-Y593 VanDerWaalsContact OD2-CE2 3.27Å; D544-Y593 WeakPolarHBondContact OD2-CE2 3.44Å; D544-Y593 PolarHBondContact OD2-OH 3.39Å; Y586-Y593 WeakPolarHBondContact CE2-O 3.49Å; Q591-Y593 WeakPolarHBondContact CG-O 3.3Å; Q591-Y593 PolarHBondContact NE2-O 3.15Å; Q591-Y593 PolarHBondContact O-N 2.91Å
594	K	72.8	Confident	63.6	Low	146 Å²	146	84 Å²	84	64%	0.635	44%	0.438	S	S	*	.	P	Polyproline II helix	trans	-77.7	127.9	176.5	-175	177.5	178.3	179.1	0	110.1	Y586	Y586-K594 HydrophobicContact CE1-CG 4.44Å; Y586-K594 HydrophobicContact CE2-CB 4.3Å
595	P	80.4	Confident	61	Low	10 Å²	10	90.3 Å²	90.3	7%	0.065	47%	0.47	C	S	.	.	P	Polyproline II helix	trans	-63.1	135.1	174.9	-18.1	29.1	0	0	0	110.7	V543 Y545 V582 Y586	V543-P595 VanDerWaalsContact O-CG 3.25Å; V543-P595 WeakPolarHBondContact O-CG 3.33Å; Y545-P595 HydrophobicContact CD2-CB 4.01Å; Y545-P595 HydrophobicContact CE2-CB 3.83Å; V582-P595 HydrophobicContact CG1-CB 3.77Å; V582-P595 HydrophobicContact CG1-CG 3.93Å; Y586-P595 HydrophobicContact CD2-CG 4.09Å; Y586-P595 HydrophobicContact CG-CG 4.38Å
596	V	74.3	Confident	59.2	Low	106 Å²	106	95.1 Å²	95.1	64%	0.642	50%	0.501	S	S	*	.			trans	-115.4	127.7	180	-175.5	0	0	0	0	109.2	Y545 A598	Y545-V596 VanDerWaalsContact CD2-C 3.4Å; Y545-V596 WeakPolarHBondContact CD2-O 3.34Å; V596-A598 PolarHBondContact O-N 3.38Å
597	P	69.8	Low	56.6	Low	51 Å²	51	103.3 Å²	103.3	33%	0.331	54%	0.538	S	S	.	.			trans	-59.8	133.3	172.9	-19	29.4	0	0	0	110.6	Y545 I599	Y545-P597 HydrophobicContact CD2-CG 4.43Å; Y545-P597 HydrophobicContact CE1-CB 4.37Å; Y545-P597 HydrophobicContact CE1-CG 4.16Å; Y545-P597 HydrophobicContact CE2-CB 4.37Å; Y545-P597 HydrophobicContact CE2-CG 3.83Å; P597-I599 PolarHBondContact O-N 3.21Å
598	A	56.8	Low	54.3	Low	82 Å²	82	103.6 Å²	103.6	68%	0.678	57%	0.565	S	S	*	*			trans	-66.3	98.3	174.4	0	0	0	0	0	110.1	V596 Q600	V596-A598 PolarHBondContact O-N 3.38Å; A598-Q600 PolarHBondContact O-N 3.44Å
599	I	46.4	Very low	51.7	Low	152 Å²	152	107 Å²	107	78%	0.779	60%	0.601	S	S	*	*			trans	-63.8	116.7	174.4	-59.3	175.5	0	0	0	107.6	P597 T601	P597-I599 PolarHBondContact O-N 3.21Å; I599-T601 PolarHBondContact O-N 3.33Å
600	Q	42.4	Very low	49.6	Very low	183 Å²	183	112.2 Å²	112.2	86%	0.855	63%	0.633	S	S	*	*			trans	-59.5	114.5	175.5	-68.7	-173.7	5	0	0	109.5	A598 Q602	A598-Q600 PolarHBondContact O-N 3.44Å; Q600-Q602 PolarHBondContact O-N 3.19Å
601	T	33.8	Very low	48	Very low	135 Å²	135	118.2 Å²	118.2	83%	0.828	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-64.4	127.7	-176.2	19	0	0	0	0	110.9	I599 K603	I599-T601 PolarHBondContact O-N 3.33Å; T601-K603 PolarHBondContact O-N 3.05Å
602	Q	35.3	Very low	46.1	Very low	191 Å²	191	125.3 Å²	125.3	89%	0.893	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-58.5	129	-178.8	-68.5	176.7	-16	0	0	111	Q600	Q600-Q602 PolarHBondContact O-N 3.19Å
603	K	35.7	Very low	45.3	Very low	203 Å²	203	126.3 Å²	126.3	88%	0.883	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-76.3	135.3	163	-75.4	-177.5	178.2	176.1	0	109.8	T601	T601-K603 PolarHBondContact O-N 3.05Å
604	L	31.2	Very low	43.5	Very low	154 Å²	154	129.9 Å²	129.9	81%	0.806	73%	0.731	S	S	*	*			trans	-41.7	147.9	159.5	-60.8	139.2	0	0	0	110.7
605	N	30	Very low	41.7	Very low	143 Å²	143	127.8 Å²	127.8	77%	0.765	74%	0.741	S	S	*	*			cis	-155.7	-170	10.6	-131.4	1.9	0	0	0	110.3
606	P	49.6	Very low	39.5	Very low	102 Å²	102	134.7 Å²	134.7	66%	0.662	77%	0.772	S	S	*	*			trans	-93.9	157.8	-150.8	37.7	-40.5	0	0	0	116.9
607	K	28.8	Very low	37.7	Very low	212 Å²	212	138 Å²	138	92%	0.922	79%	0.785	S	S	*	*			trans	-161.3	157.5	132	-105.5	155.1	-173	177.2	0	110.3
608	G	29	Very low	36.1	Very low	85 Å²	85	141.3 Å²	141.3	88%	0.876	81%	0.81	S	S	*	*			trans	-81.1	155.4	-168.9	0	0	0	0	0	114.9
609	G	27.4	Very low	35	Very low	77 Å²	77	139.3 Å²	139.3	79%	0.794	80%	0.797	S	S	*	*			trans	176.9	114.9	173.1	0	0	0	0	0	110.3
610	T	35.8	Very low	34.5	Very low	132 Å²	132	139 Å²	139	81%	0.81	79%	0.79	S	S	*	*			trans	-71.8	149.8	172	45.4	0	0	0	0	111.2
611	L	33.3	Very low	34.5	Very low	142 Å²	142	135.6 Å²	135.6	74%	0.743	78%	0.778	S	S	*	*				176.5	154.3	113.6	-88.4	174.7	0	0	0	110.8
612	H	31.1	Very low	34.7	Very low	163 Å²	163	132.1 Å²	132.1	76%	0.755	76%	0.763	S	S	*	*			trans	23.1	122.7	170.5	-57.2	-71.5	0	0	0	120.5
613	A	39	Very low	34.9	Very low	85 Å²	85	128.3 Å²	128.3	70%	0.702	75%	0.749	S	S	*	*			cis	74.2	79.9	44.5	0	0	0	0	0	115
614	D	31.8	Very low	35.5	Very low	173 Å²	173	127.2 Å²	127.2	93%	0.925	74%	0.739	S	S	*	*			trans	-154.5	19.3	155.8	-120	-17.8	0	0	0	114.2
615	A	33.6	Very low	36.1	Very low	102 Å²	102	121.6 Å²	121.6	84%	0.843	71%	0.708	S	S	*	*			trans	-116.4	32.8	-171.7	0	0	0	0	0	113.9
616	Q	34.5	Very low	36.9	Very low	156 Å²	156	121.6 Å²	121.6	73%	0.729	70%	0.703	S	S	*	*			trans	-118.2	18.1	-163.6	-122.6	-177.3	18.3	0	0	116.6
617	L	36.3	Very low	36.9	Very low	174 Å²	174	125.3 Å²	125.3	91%	0.911	71%	0.709	S	S	*	*	S	Bend	trans	-105.2	-10.5	-179.9	-78.6	166.8	0	0	0	115.6
618	S	36.4	Very low	38.2	Very low	122 Å²	122	119.8 Å²	119.8	85%	0.853	69%	0.686	S	S	*	*	S	Bend	trans	-109.7	-2.2	-179.4	-169.8	0	0	0	0	115
619	G	34.1	Very low	39.8	Very low	39 Å²	39	117.7 Å²	117.7	40%	0.402	67%	0.665	S	S	.	*	S	Bend	trans	-105.4	-14.2	-172.9	0	0	0	0	0	116.3	D621 A622 D623	G619-D621 VanDerWaalsContact C-N 3.34Å; G619-D621 PolarHBondContact O-N 3.47Å; G619-A622 PolarHBondContact O-N 3.05Å; G619-D623 PolarHBondContact O-N 2.9Å
620	K	35.1	Very low	41.8	Very low	146 Å²	146	114.4 Å²	114.4	64%	0.635	63%	0.629	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69	-25.9	-166.6	-79.2	-174.4	176	176.4	0	115.1
621	D	42.1	Very low	43.4	Very low	112 Å²	112	111.6 Å²	111.6	60%	0.599	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	-43.6	178.3	-60.8	-64.1	0	0	0	111.5	G619 D623 R624 F625	G619-D621 VanDerWaalsContact C-N 3.34Å; G619-D621 PolarHBondContact O-N 3.47Å; D621-D623 PolarHBondContact O-N 3.32Å; D621-R624 WeakPolarHBondContact O-CA 3.38Å; D621-R624 VanDerWaalsContact O-CB 3.28Å; D621-R624 WeakPolarHBondContact O-CB 3.45Å; D621-R624 PolarHBondContact O-N 2.9Å; D621-F625 WeakPolarHBondContact O-CD2 3.47Å; D621-F625 PolarHBondContact O-N 3.27Å
622	A	39.5	Very low	45.5	Very low	62 Å²	62	110.8 Å²	110.8	51%	0.512	60%	0.602	S	S	.	*	H	α-helix	trans	-57.5	-44.5	179.3	0	0	0	0	0	112.7	G619 R624 F625 Q626	G619-A622 PolarHBondContact O-N 3.05Å; A622-R624 PolarHBondContact O-N 2.97Å; A622-R624 VanDerWaalsContact O-N 3.1Å; A622-F625 PolarHBondContact O-N 3.29Å; A622-Q626 PolarHBondContact O-N 2.9Å
623	D	39.8	Very low	47.7	Very low	111 Å²	111	104.1 Å²	104.1	59%	0.594	57%	0.57	S	S	*	*	H	α-helix	trans	-59.3	-20.1	174.2	-91.5	-2.8	0	0	0	113.7	G619 D621	G619-D623 PolarHBondContact O-N 2.9Å; D621-D623 PolarHBondContact O-N 3.32Å
624	R	46.4	Very low	49.6	Very low	179 Å²	179	101.7 Å²	101.7	68%	0.675	55%	0.545	S	S	*	.	H	α-helix	trans	-91.3	-31	179.6	-151.4	175.8	-172.6	-170.9	0.6	112.3	D621 A622 H628	D621-R624 WeakPolarHBondContact O-CA 3.38Å; D621-R624 VanDerWaalsContact O-CB 3.28Å; D621-R624 WeakPolarHBondContact O-CB 3.45Å; D621-R624 PolarHBondContact O-N 2.9Å; A622-R624 PolarHBondContact O-N 2.97Å; A622-R624 VanDerWaalsContact O-N 3.1Å; R624-H628 PolarHBondContact O-ND1 3.31Å
625	F	45.2	Very low	51.6	Low	36 Å²	36	98 Å²	98	16%	0.158	53%	0.533	C	S	.	.	H	α-helix	trans	-70.8	-45.4	174.3	-82.7	-87.1	0	0	0	112.3	L256 A260 D621 A622 K627 H628	L256-F625 HydrophobicContact CB-CE1 3.89Å; L256-F625 HydrophobicContact CD2-CD1 4.13Å; L256-F625 HydrophobicContact CD2-CE1 3.72Å; L256-F625 HydrophobicContact CD2-CE2 4.45Å; L256-F625 HydrophobicContact CD2-CZ 3.89Å; L256-F625 HydrophobicContact CG-CE1 4.41Å; L256-F625 WeakPolarHBondContact O-CE1 3.48Å; A260-F625 HydrophobicContact CB-CE1 4.08Å; A260-F625 HydrophobicContact CB-CZ 4.36Å; D621-F625 WeakPolarHBondContact O-CD2 3.47Å; D621-F625 PolarHBondContact O-N 3.27Å; A622-F625 PolarHBondContact O-N 3.29Å; F625-K627 PolarHBondContact O-N 3.49Å; F625-K627 VanDerWaalsContact O-N 3.12Å; F625-H628 PolarHBondContact O-N 3.33Å
626	Q	46.6	Very low	53.7	Low	143 Å²	143	94.3 Å²	94.3	67%	0.668	50%	0.502	S	S	*	.	G	3₁₀ helix	trans	-57.7	-31.5	-179	-73.7	-166.8	-15.8	0	0	113.7	A622 H628	A622-Q626 PolarHBondContact O-N 2.9Å; Q626-H628 PolarHBondContact O-N 3.42Å
627	K	49.5	Very low	55.6	Low	180 Å²	180	90.7 Å²	90.7	78%	0.783	49%	0.488	S	S	*	.	G	3₁₀ helix	trans	-71.5	-7.2	178.9	-70.3	-176.5	179.9	178.2	0	115.1	F625	F625-K627 PolarHBondContact O-N 3.49Å; F625-K627 VanDerWaalsContact O-N 3.12Å
628	H	56.1	Low	57.7	Low	96 Å²	96	83 Å²	83	44%	0.444	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-120.6	3.1	-175.1	-63.1	93.1	0	0	0	114.1	L256 R624 F625 Q626 M630	L256-H628 HydrophobicContact CD1-CB 4.32Å; R624-H628 PolarHBondContact O-ND1 3.31Å; F625-H628 PolarHBondContact O-N 3.33Å; Q626-H628 PolarHBondContact O-N 3.42Å; H628-M630 HydrophobicContact CB-CG 4.39Å; H628-M630 PolarHBondContact O-N 3.11Å
629	G	63.3	Low	59.7	Low	42 Å²	42	78.5 Å²	78.5	43%	0.433	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	69	8.8	175.6	0	0	0	0	0	115.9	D631	G629-D631 PolarHBondContact O-N 3.05Å
630	M	68.8	Low	61.9	Low	8 Å²	8	85 Å²	85	4%	0.039	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-20.7	-172.6	-67.6	-65.1	171.2	0	0	114.3	L85 E253 L256 L257 H628 E632 F633 I634	L85-M630 HydrophobicContact CD1-CE 4.28Å; L85-M630 HydrophobicContact CD2-CE 4.16Å; L85-M630 HydrophobicContact CD2-SD 4.43Å; E253-M630 HydrophobicContact CB-CE 4.21Å; E253-M630 HydrophobicContact CG-CE 3.91Å; L256-M630 HydrophobicContact CD1-CG 4.34Å; L257-M630 HydrophobicContact CD2-CB 4.25Å; L257-M630 HydrophobicContact CD2-CG 4.49Å; L257-M630 HydrophobicContact CD2-SD 4.09Å; L257-M630 HydrophobicContact CG-SD 4.44Å; H628-M630 HydrophobicContact CB-CG 4.39Å; H628-M630 PolarHBondContact O-N 3.11Å; M630-E632 PolarHBondContact O-N 2.69Å; M630-F633 PolarHBondContact O-N 3.05Å; M630-F633 HydrophobicContact SD-CD2 4.04Å; M630-F633 HydrophobicContact SD-CE2 4.26Å; M630-I634 HydrophobicContact CB-CD1 4.36Å; M630-I634 WeakPolarHBondContact O-CD1 3.36Å; M630-I634 WeakPolarHBondContact O-CG1 3.09Å; M630-I634 PolarHBondContact O-N 2.66Å
631	D	69.1	Low	64.2	Low	73 Å²	73	81.3 Å²	81.3	39%	0.39	42%	0.421	S	S	.	.	H	α-helix	trans	-58.5	-30.6	179.1	-80.7	-15.5	0	0	0	112.8	G629 I634 S635	G629-D631 PolarHBondContact O-N 3.05Å; D631-I634 PolarHBondContact O-N 3.24Å; D631-S635 VanDerWaalsContact O-CB 3.25Å; D631-S635 WeakPolarHBondContact O-CB 3.38Å; D631-S635 PolarHBondContact O-N 3.33Å; D631-S635 PolarHBondContact O-OG 3Å
632	E	76.9	Confident	66.3	Low	125 Å²	125	80.7 Å²	80.7	58%	0.584	42%	0.417	S	S	*	.	H	α-helix	trans	-60.8	-50.3	178.8	-171	175.9	176.7	0	0	111.1	M630 I634 S635 A636	M630-E632 PolarHBondContact O-N 2.69Å; E632-I634 VanDerWaalsContact C-N 3.33Å; E632-I634 PolarHBondContact O-N 2.71Å; E632-S635 PolarHBondContact O-OG 3.22Å; E632-A636 WeakPolarHBondContact O-CB 3.48Å; E632-A636 PolarHBondContact O-N 2.97Å
633	F	78.4	Confident	68.7	Low	22 Å²	22	78.6 Å²	78.6	10%	0.096	40%	0.397	C	S	.	.	H	α-helix	trans	-69.3	-29.9	-179	-50.5	-71.1	0	0	0	113.4	R82 L85 Q86 V89 M630	R82-F633 HydrophobicContact CB-CE1 4.21Å; R82-F633 HydrophobicContact CB-CZ 4.37Å; R82-F633 HydrophobicContact CG-CZ 4.22Å; L85-F633 HydrophobicContact CB-CE1 4.4Å; L85-F633 HydrophobicContact CB-CE2 4.43Å; L85-F633 HydrophobicContact CB-CZ 4.37Å; L85-F633 HydrophobicContact CD1-CE2 4.2Å; L85-F633 HydrophobicContact CD1-CZ 4.3Å; Q86-F633 HydrophobicContact CB-CD1 3.99Å; Q86-F633 PolarHBondContact NE2-O 2.71Å; V89-F633 HydrophobicContact CG2-CB 3.92Å; M630-F633 PolarHBondContact O-N 3.05Å; M630-F633 HydrophobicContact SD-CD2 4.04Å; M630-F633 HydrophobicContact SD-CE2 4.26Å
634	I	78.3	Confident	70.9	Confident	35 Å²	35	75 Å²	75	18%	0.179	38%	0.383	C	S	.	.	H	α-helix	trans	-78.3	-42.6	179.7	-61.4	158.8	0	0	0	110.6	R93 L257 A260 M630 D631 E632 A636	R93-I634 PolarHBondContact NH2-O 2.76Å; L257-I634 HydrophobicContact CD2-CD1 3.95Å; L257-I634 HydrophobicContact CD2-CG1 3.85Å; A260-I634 HydrophobicContact CB-CD1 3.59Å; A260-I634 HydrophobicContact CB-CG1 4.39Å; M630-I634 HydrophobicContact CB-CD1 4.36Å; M630-I634 WeakPolarHBondContact O-CD1 3.36Å; M630-I634 WeakPolarHBondContact O-CG1 3.09Å; M630-I634 PolarHBondContact O-N 2.66Å; D631-I634 PolarHBondContact O-N 3.24Å; E632-I634 VanDerWaalsContact C-N 3.33Å; E632-I634 PolarHBondContact O-N 2.71Å; I634-A636 VanDerWaalsContact C-N 3.35Å
635	S	72.6	Confident	73	Confident	96 Å²	96	71.8 Å²	71.8	67%	0.671	37%	0.374	S	S	*	.	H	α-helix	trans	-81.3	-11	-179.7	65	0	0	0	0	114.3	D631 E632 N637	D631-S635 VanDerWaalsContact O-CB 3.25Å; D631-S635 WeakPolarHBondContact O-CB 3.38Å; D631-S635 PolarHBondContact O-N 3.33Å; D631-S635 PolarHBondContact O-OG 3Å; E632-S635 PolarHBondContact O-OG 3.22Å; S635-N637 PolarHBondContact O-N 3.23Å
636	A	77.7	Confident	75.2	Confident	23 Å²	23	70.7 Å²	70.7	19%	0.19	37%	0.37	C	S	.	.			trans	-50.5	128.7	173.6	0	0	0	0	0	112.4	Q86 E632 I634 P638	Q86-A636 VanDerWaalsContact OE1-CB 3.3Å; E632-A636 WeakPolarHBondContact O-CB 3.48Å; E632-A636 PolarHBondContact O-N 2.97Å; I634-A636 VanDerWaalsContact C-N 3.35Å; A636-P638 WeakPolarHBondContact O-CD 3.24Å
637	N	75.5	Confident	77.4	Confident	80 Å²	80	63.9 Å²	63.9	43%	0.428	34%	0.338	S	S	.	.			trans	-80	117.8	176.2	-177.3	-35	0	0	0	109.4	S635 C639 K640	S635-N637 PolarHBondContact O-N 3.23Å; N637-C639 VanDerWaalsContact C-N 3.25Å; N637-C639 PolarHBondContact O-N 2.82Å; N637-C639 WeakPolarHBondContact OD1-CB 3.44Å; N637-C639 PolarHBondContact OD1-N 2.93Å; N637-K640 HydrophobicContact CB-CD 4.24Å; N637-K640 HydrophobicContact CB-CG 4.26Å; N637-K640 PolarHBondContact O-N 3.22Å
638	P	80.1	Confident	79.4	Confident	12 Å²	12	60.6 Å²	60.6	8%	0.078	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-57.6	-37.6	-177.5	-22.6	32.1	0	0	0	112.9	F90 E276 A636 K640 L641 H643 Y684	F90-P638 HydrophobicContact CE1-CB 4.22Å; F90-P638 HydrophobicContact CE1-CG 3.98Å; E276-P638 HydrophobicContact CG-CG 4.28Å; A636-P638 WeakPolarHBondContact O-CD 3.24Å; P638-K640 PolarHBondContact O-N 2.93Å; P638-L641 PolarHBondContact O-N 2.8Å; P638-L641 VanDerWaalsContact O-N 3.07Å; P638-H643 PolarHBondContact O-NE2 3.17Å; P638-Y684 HydrophobicContact CB-CD1 4.02Å; P638-Y684 HydrophobicContact CB-CE1 3.87Å; P638-Y684 HydrophobicContact CG-CE1 4.17Å
639	C	79.6	Confident	81	Confident	29 Å²	29	57.6 Å²	57.6	20%	0.196	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-71.5	8.7	-176	-56.7	0	0	0	0	114.2	N637	N637-C639 VanDerWaalsContact C-N 3.25Å; N637-C639 PolarHBondContact O-N 2.82Å; N637-C639 WeakPolarHBondContact OD1-CB 3.44Å; N637-C639 PolarHBondContact OD1-N 2.93Å
640	K	79.2	Confident	82.4	Confident	176 Å²	176	55.6 Å²	55.6	77%	0.765	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-113.1	-2.3	173.6	-64.2	-173.4	179.4	-179.7	0	113.7	N637 P638	N637-K640 HydrophobicContact CB-CD 4.24Å; N637-K640 HydrophobicContact CB-CG 4.26Å; N637-K640 PolarHBondContact O-N 3.22Å; P638-K640 PolarHBondContact O-N 2.93Å
641	L	83.9	Confident	83.6	Confident	67 Å²	67	55.3 Å²	55.3	35%	0.351	29%	0.285	S	S	.	.	S	Bend	trans	-110.7	147.4	-173.2	-65.6	169.2	0	0	0	111.5	Q86 F90 P638 H643 L646	Q86-L641 HydrophobicContact CG-CD1 4.14Å; F90-L641 HydrophobicContact CE2-CD1 3.75Å; F90-L641 HydrophobicContact CZ-CD1 3.58Å; P638-L641 PolarHBondContact O-N 2.8Å; P638-L641 VanDerWaalsContact O-N 3.07Å; L641-H643 PolarHBondContact O-N 2.89Å; L641-L646 HydrophobicContact CB-CD1 4.18Å
642	D	85.6	Confident	84.7	Confident	99 Å²	99	55.8 Å²	55.8	53%	0.529	28%	0.282	S	S	.	.			trans	-77.3	88.5	174.9	-175.4	-7.8	0	0	0	110.7	A644 F645 L646	D642-A644 PolarHBondContact O-N 3.04Å; D642-A644 WeakPolarHBondContact OD1-CA 3.43Å; D642-A644 VanDerWaalsContact OD1-CB 3.32Å; D642-A644 WeakPolarHBondContact OD1-CB 3.19Å; D642-A644 PolarHBondContact OD1-N 3.07Å; D642-F645 HydrophobicContact CB-CB 4.12Å; D642-F645 PolarHBondContact O-N 2.94Å; D642-F645 PolarHBondContact OD1-N 2.95Å; D642-F645 WeakPolarHBondContact OD2-CB 3.18Å; D642-L646 WeakPolarHBondContact O-CB 3.44Å; D642-L646 VanDerWaalsContact O-CG 3.25Å; D642-L646 WeakPolarHBondContact O-CG 3.46Å; D642-L646 PolarHBondContact O-N 3.21Å
643	H	89.4	Confident	85.3	Confident	18 Å²	18	51.2 Å²	51.2	8%	0.083	26%	0.26	C	S	.	.	H	α-helix	trans	-66.6	-17.1	174.6	-74.6	-75.4	0	0	0	113.8	F90 P638 L641 F647 Y680 Y684 V686	F90-H643 AromaticContact CD2-CE1 3.9Å; F90-H643 AromaticContact CE2-CE1 3.84Å; P638-H643 PolarHBondContact O-NE2 3.17Å; L641-H643 PolarHBondContact O-N 2.89Å; H643-F647 WeakPolarHBondContact O-CB 3.49Å; H643-F647 PolarHBondContact O-N 3.28Å; H643-Y680 HydrophobicContact CB-CE1 4.49Å; H643-Y680 AromaticContact ND1-CE1 3.9Å; H643-Y680 AromaticContact ND1-CZ 3.61Å; H643-Y680 PolarHBondContact ND1-OH 3.31Å; H643-Y684 AromaticContact CE1-CD1 3.46Å; H643-Y684 VanDerWaalsContact CE1-CD1 3.46Å; H643-Y684 WeakPolarHBondContact CE1-CD1 3.48Å; H643-Y684 AromaticContact CE1-CG 3.48Å; H643-Y684 VanDerWaalsContact CE1-CG 3.48Å; H643-Y684 AromaticContact ND1-CG 3.71Å; H643-Y684 AromaticContact NE2-CD1 3.56Å; H643-Y684 AromaticContact NE2-CG 3.91Å; H643-V686 HydrophobicContact CB-CG2 4.23Å
644	A	87.1	Confident	86	Confident	36 Å²	36	50.1 Å²	50.1	30%	0.298	26%	0.256	S	S	.	.	H	α-helix	trans	-77.4	-39.9	175.7	0	0	0	0	0	111.4	D642 R648 H690	D642-A644 PolarHBondContact O-N 3.04Å; D642-A644 WeakPolarHBondContact OD1-CA 3.43Å; D642-A644 VanDerWaalsContact OD1-CB 3.32Å; D642-A644 WeakPolarHBondContact OD1-CB 3.19Å; D642-A644 PolarHBondContact OD1-N 3.07Å; A644-R648 PolarHBondContact O-N 3.48Å; A644-H690 PolarHBondContact O-NE2 3.27Å
645	F	90	Very high	86.5	Confident	111 Å²	111	48.5 Å²	48.5	49%	0.487	25%	0.247	S	C	.	.	H	α-helix	trans	-66.9	-51.4	169.6	175.1	-102.2	0	0	0	111.8	D642 F647 R648 I649	D642-F645 HydrophobicContact CB-CB 4.12Å; D642-F645 PolarHBondContact O-N 2.94Å; D642-F645 PolarHBondContact OD1-N 2.95Å; D642-F645 WeakPolarHBondContact OD2-CB 3.18Å; F645-F647 VanDerWaalsContact C-N 3.31Å; F645-F647 PolarHBondContact O-N 3.32Å; F645-R648 PolarHBondContact O-N 3.25Å; F645-R648 VanDerWaalsContact O-N 3.11Å; F645-I649 HydrophobicContact CD1-CD1 4.28Å; F645-I649 HydrophobicContact CE1-CD1 3.62Å; F645-I649 HydrophobicContact CE2-CD1 4.41Å; F645-I649 HydrophobicContact CZ-CD1 3.7Å; F645-I649 PolarHBondContact O-N 2.84Å
646	L	90.6	Very high	87.4	Confident	13 Å²	13	46 Å²	46	7%	0.068	23%	0.227	C	C	.	.	H	α-helix	trans	-59.5	-41.3	-179.2	-68.4	173.6	0	0	0	111.8	I83 L87 F90 L641 D642 R648 I649 L650	I83-L646 HydrophobicContact CG2-CD2 3.84Å; L87-L646 HydrophobicContact CD2-CB 3.91Å; L87-L646 HydrophobicContact CG-CB 4.38Å; L87-L646 HydrophobicContact CG-CD2 4.27Å; F90-L646 HydrophobicContact CE2-CD1 4.44Å; L641-L646 HydrophobicContact CB-CD1 4.18Å; D642-L646 WeakPolarHBondContact O-CB 3.44Å; D642-L646 VanDerWaalsContact O-CG 3.25Å; D642-L646 WeakPolarHBondContact O-CG 3.46Å; D642-L646 PolarHBondContact O-N 3.21Å; L646-R648 VanDerWaalsContact C-N 3.34Å; L646-R648 PolarHBondContact O-N 3.25Å; L646-I649 PolarHBondContact O-N 2.88Å; L646-L650 PolarHBondContact O-N 3.35Å; L646-L650 VanDerWaalsContact O-N 3.11Å
647	F	93	Very high	87.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.2	-34.7	177.2	-178.8	-93.6	0	0	0	113.1	H643 F645 I649 L650 Q651 L677 Y680 C681 V686 R691	H643-F647 WeakPolarHBondContact O-CB 3.49Å; H643-F647 PolarHBondContact O-N 3.28Å; F645-F647 VanDerWaalsContact C-N 3.31Å; F645-F647 PolarHBondContact O-N 3.32Å; F647-I649 VanDerWaalsContact C-N 3.34Å; F647-I649 PolarHBondContact O-N 2.99Å; F647-L650 HydrophobicContact CD2-CD2 4.48Å; F647-L650 PolarHBondContact O-N 2.92Å; F647-Q651 HydrophobicContact CD1-CB 4.39Å; F647-Q651 HydrophobicContact CE1-CB 3.96Å; F647-Q651 HydrophobicContact CE1-CG 4.24Å; F647-Q651 HydrophobicContact CZ-CB 4.25Å; F647-Q651 HydrophobicContact CZ-CG 4.48Å; F647-Q651 VanDerWaalsContact O-CB 3.26Å; F647-Q651 WeakPolarHBondContact O-CB 3.26Å; F647-Q651 PolarHBondContact O-N 2.87Å; F647-L677 HydrophobicContact CE2-CB 4.18Å; F647-L677 HydrophobicContact CE2-CD2 3.64Å; F647-L677 HydrophobicContact CE2-CG 4.48Å; F647-L677 HydrophobicContact CZ-CB 4.43Å; F647-L677 HydrophobicContact CZ-CD2 4.09Å; F647-Y680 HydrophobicContact CB-CD1 4.48Å; F647-Y680 HydrophobicContact CB-CE1 4.04Å; F647-Y680 AromaticContact CD2-CD1 3.69Å; F647-Y680 HydrophobicContact CD2-CD1 3.69Å; F647-Y680 HydrophobicContact CD2-CE1 4.08Å; F647-Y680 HydrophobicContact CD2-CG 4.4Å; F647-C681 WeakPolarHBondContact CE2-SG 3.29Å; F647-C681 VanDerWaalsContact CZ-SG 3.51Å; F647-V686 HydrophobicContact CB-CG1 4.18Å; F647-V686 HydrophobicContact CB-CG2 3.95Å; F647-V686 HydrophobicContact CD1-CG1 3.98Å; F647-V686 HydrophobicContact CD2-CG2 4.48Å; F647-V686 HydrophobicContact CG-CG1 4.04Å; F647-V686 HydrophobicContact CG-CG2 4.21Å; F647-R691 HydrophobicContact CE1-CB 3.96Å; F647-R691 HydrophobicContact CE1-CG 3.76Å; F647-R691 HydrophobicContact CZ-CG 3.99Å
648	R	91.7	Very high	88.3	Confident	111 Å²	111	44.7 Å²	44.7	42%	0.419	21%	0.213	S	C	.	.	H	α-helix	trans	-60.5	-44.5	176.2	-176.6	-179.9	175.1	-168	-2.7	111.3	A644 F645 L646 Q651 R652 C694 E698	A644-R648 PolarHBondContact O-N 3.48Å; F645-R648 PolarHBondContact O-N 3.25Å; F645-R648 VanDerWaalsContact O-N 3.11Å; L646-R648 VanDerWaalsContact C-N 3.34Å; L646-R648 PolarHBondContact O-N 3.25Å; R648-Q651 PolarHBondContact O-N 3.07Å; R648-R652 WeakPolarHBondContact O-CB 3.42Å; R648-R652 PolarHBondContact O-N 3.27Å; R648-C694 HydrophobicContact CG-CB 4.31Å; R648-E698 IonicContact CZ-OE1 2.69Å; R648-E698 IonicContact NE-OE1 3.22Å; R648-E698 PolarHBondContact NE-OE1 3.29Å; R648-E698 IonicContact NH2-OE1 2.71Å; R648-E698 PolarHBondContact NH2-OE1 3.37Å
649	I	90.9	Very high	88.5	Confident	33 Å²	33	45.3 Å²	45.3	17%	0.169	22%	0.216	C	C	.	.	H	α-helix	trans	-62.1	-48.2	177.1	-62.5	173.8	0	0	0	110.4	I83 L87 F645 L646 F647 Q651 R652 Q653	I83-I649 HydrophobicContact CG2-CD1 3.88Å; L87-I649 HydrophobicContact CD1-CB 4.16Å; L87-I649 HydrophobicContact CD1-CG2 3.98Å; F645-I649 HydrophobicContact CD1-CD1 4.28Å; F645-I649 HydrophobicContact CE1-CD1 3.62Å; F645-I649 HydrophobicContact CE2-CD1 4.41Å; F645-I649 HydrophobicContact CZ-CD1 3.7Å; F645-I649 PolarHBondContact O-N 2.84Å; L646-I649 PolarHBondContact O-N 2.88Å; F647-I649 VanDerWaalsContact C-N 3.34Å; F647-I649 PolarHBondContact O-N 2.99Å; I649-Q651 VanDerWaalsContact C-N 3.33Å; I649-Q651 PolarHBondContact O-N 3.06Å; I649-R652 PolarHBondContact O-N 2.92Å; I649-Q653 HydrophobicContact CG2-CG 4.49Å; I649-Q653 WeakPolarHBondContact O-CB 3.16Å; I649-Q653 WeakPolarHBondContact O-CG 3.28Å; I649-Q653 PolarHBondContact O-N 3.41Å
650	L	92.6	Very high	88.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-58	-44.3	177	178.9	63	0	0	0	111.9	L87 V91 F243 L247 L646 F647 T654 L677 Y680	L87-L650 HydrophobicContact CD1-CB 4.34Å; L87-L650 HydrophobicContact CD2-CB 4.01Å; L87-L650 HydrophobicContact CD2-CD2 4.39Å; V91-L650 HydrophobicContact CG2-CD1 3.89Å; V91-L650 HydrophobicContact CG2-CD2 3.9Å; F243-L650 HydrophobicContact CD1-CD1 4.26Å; F243-L650 HydrophobicContact CE1-CD1 4.07Å; L247-L650 HydrophobicContact CD1-CD1 4.09Å; L247-L650 HydrophobicContact CD2-CD1 3.99Å; L247-L650 HydrophobicContact CG-CD1 4.37Å; L646-L650 PolarHBondContact O-N 3.35Å; L646-L650 VanDerWaalsContact O-N 3.11Å; F647-L650 HydrophobicContact CD2-CD2 4.48Å; F647-L650 PolarHBondContact O-N 2.92Å; L650-T654 VanDerWaalsContact O-CB 3.23Å; L650-T654 WeakPolarHBondContact O-CB 3.41Å; L650-T654 PolarHBondContact O-N 3.06Å; L650-T654 PolarHBondContact O-OG1 2.87Å; L650-L677 HydrophobicContact CD2-CD2 3.99Å; L650-L677 HydrophobicContact CG-CD2 3.93Å; L650-Y680 HydrophobicContact CD2-CD2 3.84Å; L650-Y680 HydrophobicContact CD2-CE2 4.06Å; L650-Y680 HydrophobicContact CD2-CG 4.19Å
651	Q	92.9	Very high	88.6	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.009	21%	0.214	C	C	.	.	H	α-helix	trans	-66.6	-44.1	-179.9	-173.8	176.2	34.1	0	0	112	F647 R648 I649 T654 L655 F669 R691	F647-Q651 HydrophobicContact CD1-CB 4.39Å; F647-Q651 HydrophobicContact CE1-CB 3.96Å; F647-Q651 HydrophobicContact CE1-CG 4.24Å; F647-Q651 HydrophobicContact CZ-CB 4.25Å; F647-Q651 HydrophobicContact CZ-CG 4.48Å; F647-Q651 VanDerWaalsContact O-CB 3.26Å; F647-Q651 WeakPolarHBondContact O-CB 3.26Å; F647-Q651 PolarHBondContact O-N 2.87Å; R648-Q651 PolarHBondContact O-N 3.07Å; I649-Q651 VanDerWaalsContact C-N 3.33Å; I649-Q651 PolarHBondContact O-N 3.06Å; Q651-T654 PolarHBondContact O-N 3.35Å; Q651-L655 WeakPolarHBondContact O-CB 3.35Å; Q651-L655 PolarHBondContact O-N 2.91Å; Q651-F669 HydrophobicContact CG-CZ 4.12Å; Q651-R691 PolarHBondContact NE2-O 3.46Å; Q651-R691 VanDerWaalsContact NE2-O 3.1Å; Q651-R691 PolarHBondContact OE1-O 3.47Å
652	R	92	Very high	88	Confident	84 Å²	84	43.9 Å²	43.9	32%	0.317	22%	0.22	S	C	.	.	H	α-helix	trans	-59.6	-57	174.8	-176	-179.6	-179.8	116.8	-1.3	110.6	R648 I649 T654 L655 D656 E698 E701	R648-R652 WeakPolarHBondContact O-CB 3.42Å; R648-R652 PolarHBondContact O-N 3.27Å; I649-R652 PolarHBondContact O-N 2.92Å; R652-T654 PolarHBondContact O-N 3.11Å; R652-L655 CarbonylContact O-C 3.57Å; R652-L655 WeakPolarHBondContact O-CA 3.29Å; R652-L655 WeakPolarHBondContact O-CB 3.34Å; R652-L655 PolarHBondContact O-N 2.96Å; R652-D656 PolarHBondContact O-N 2.93Å; R652-D656 VanDerWaalsContact O-OD1 3.13Å; R652-E698 HydrophobicContact CB-CG 4.42Å; R652-E698 WeakPolarHBondContact CD-OE2 3.5Å; R652-E698 WeakPolarHBondContact CG-OE2 3Å; R652-E698 IonicContact CZ-OE2 3.21Å; R652-E698 IonicContact NE-OE2 3.37Å; R652-E698 IonicContact NH1-OE2 2.66Å; R652-E698 PolarHBondContact NH1-OE2 2.85Å; R652-E701 IonicContact CZ-OE1 3.25Å; R652-E701 VanDerWaalsContact CZ-OE1 3.29Å; R652-E701 IonicContact NH1-OE1 2.71Å; R652-E701 PolarHBondContact NH1-OE1 2.81Å; R652-E701 IonicContact NH1-OE2 3.66Å; R652-E701 PolarHBondContact NH1-OE2 3.46Å; R652-E701 IonicContact NH2-OE1 3.19Å; R652-E701 PolarHBondContact NH2-OE1 3.18Å
653	Q	91.1	Very high	87.4	Confident	28 Å²	28	42.8 Å²	42.8	13%	0.131	21%	0.209	C	C	.	.	H	α-helix	trans	-59.7	-33.9	-179.8	-70.6	174	-18.6	0	0	112.5	E80 I246 I649 H657	E80-Q653 PolarHBondContact OE1-NE2 2.74Å; I246-Q653 HydrophobicContact CG2-CB 4.08Å; I649-Q653 HydrophobicContact CG2-CG 4.49Å; I649-Q653 WeakPolarHBondContact O-CB 3.16Å; I649-Q653 WeakPolarHBondContact O-CG 3.28Å; I649-Q653 PolarHBondContact O-N 3.41Å; Q653-H657 WeakPolarHBondContact O-CB 3.11Å; Q653-H657 PolarHBondContact O-N 3.05Å; Q653-H657 VanDerWaalsContact O-N 3.1Å
654	T	91.6	Very high	86.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67.4	-34.7	173.4	-57.2	0	0	0	0	112.5	I246 L650 Q651 R652 R658 F669 Q673 L677	I246-T654 HydrophobicContact CD1-CG2 4.24Å; L650-T654 VanDerWaalsContact O-CB 3.23Å; L650-T654 WeakPolarHBondContact O-CB 3.41Å; L650-T654 PolarHBondContact O-N 3.06Å; L650-T654 PolarHBondContact O-OG1 2.87Å; Q651-T654 PolarHBondContact O-N 3.35Å; R652-T654 PolarHBondContact O-N 3.11Å; T654-R658 VanDerWaalsContact O-CB 3.24Å; T654-R658 WeakPolarHBondContact O-CB 3.48Å; T654-R658 PolarHBondContact O-N 3.45Å; T654-R658 VanDerWaalsContact O-N 3.11Å; T654-F669 HydrophobicContact CG2-CD1 3.8Å; T654-F669 HydrophobicContact CG2-CE1 3.69Å; T654-Q673 HydrophobicContact CG2-CB 3.98Å; T654-Q673 HydrophobicContact CG2-CG 3.73Å; T654-Q673 VanDerWaalsContact CG2-NE2 3.31Å; T654-Q673 PolarHBondContact O-NE2 3.2Å; T654-L677 HydrophobicContact CG2-CD1 4.19Å
655	L	90.4	Very high	86	Confident	1 Å²	1	41.7 Å²	41.7	1%	0.005	20%	0.201	C	C	.	.	H	α-helix	trans	-75.8	-45	176.8	177.4	61.2	0	0	0	111.5	Q651 R652 H657 R658 L659 F669 Y695 E698 L699	Q651-L655 WeakPolarHBondContact O-CB 3.35Å; Q651-L655 PolarHBondContact O-N 2.91Å; R652-L655 CarbonylContact O-C 3.57Å; R652-L655 WeakPolarHBondContact O-CA 3.29Å; R652-L655 WeakPolarHBondContact O-CB 3.34Å; R652-L655 PolarHBondContact O-N 2.96Å; L655-H657 VanDerWaalsContact C-N 3.29Å; L655-H657 PolarHBondContact O-N 3.31Å; L655-R658 CarbonylContact O-C 3.58Å; L655-R658 WeakPolarHBondContact O-CA 3.48Å; L655-R658 WeakPolarHBondContact O-CB 3.44Å; L655-R658 PolarHBondContact O-N 3.14Å; L655-L659 HydrophobicContact CD1-CD1 3.96Å; L655-L659 HydrophobicContact CD1-CG 3.98Å; L655-L659 HydrophobicContact CG-CD1 3.95Å; L655-L659 HydrophobicContact CG-CG 4.4Å; L655-L659 WeakPolarHBondContact O-CG 3.36Å; L655-L659 PolarHBondContact O-N 3.21Å; L655-F669 HydrophobicContact CB-CE1 3.98Å; L655-F669 HydrophobicContact CB-CZ 4.27Å; L655-Y695 HydrophobicContact CD1-CE2 4.43Å; L655-Y695 HydrophobicContact CD2-CE2 4.43Å; L655-E698 HydrophobicContact CD2-CB 4.06Å; L655-L699 HydrophobicContact CD1-CD2 3.93Å; L655-L699 HydrophobicContact CD2-CD2 3.85Å; L655-L699 HydrophobicContact CD2-CG 4.2Å
656	D	89.9	Confident	85.5	Confident	44 Å²	44	37.8 Å²	37.8	24%	0.235	19%	0.185	C	C	.	.	H	α-helix	trans	-55.4	-46.9	176.1	-57.1	-11.8	0	0	0	110	R652 N660 H702	R652-D656 PolarHBondContact O-N 2.93Å; R652-D656 VanDerWaalsContact O-OD1 3.13Å; D656-N660 PolarHBondContact O-N 2.92Å; D656-N660 PolarHBondContact O-ND2 2.67Å; D656-H702 IonicContact OD1-CE1 3.33Å; D656-H702 PolarHBondContact OD1-CE1 3.34Å; D656-H702 IonicContact OD1-NE2 3.75Å
657	H	88.3	Confident	85.1	Confident	57 Å²	57	37.2 Å²	37.2	26%	0.264	18%	0.182	S	C	.	.	H	α-helix	trans	-63.3	-38.7	172.8	-177.1	-80.5	0	0	0	112.8	I246 Q653 L655 D661	I246-H657 HydrophobicContact CG1-CB 3.77Å; Q653-H657 WeakPolarHBondContact O-CB 3.11Å; Q653-H657 PolarHBondContact O-N 3.05Å; Q653-H657 VanDerWaalsContact O-N 3.1Å; L655-H657 VanDerWaalsContact C-N 3.29Å; L655-H657 PolarHBondContact O-N 3.31Å; H657-D661 PolarHBondContact O-N 2.64Å
658	R	84.9	Confident	84.7	Confident	17 Å²	17	41.2 Å²	41.2	6%	0.064	20%	0.197	C	C	.	.	H	α-helix	trans	-68.9	-34.5	-179	-174.7	64.8	-117.9	150.9	4.9	112.8	T654 L655 D661 Y663 C665 W668 F669	T654-R658 VanDerWaalsContact O-CB 3.24Å; T654-R658 WeakPolarHBondContact O-CB 3.48Å; T654-R658 PolarHBondContact O-N 3.45Å; T654-R658 VanDerWaalsContact O-N 3.11Å; L655-R658 CarbonylContact O-C 3.58Å; L655-R658 WeakPolarHBondContact O-CA 3.48Å; L655-R658 WeakPolarHBondContact O-CB 3.44Å; L655-R658 PolarHBondContact O-N 3.14Å; R658-D661 IonicContact CZ-OD2 3.94Å; R658-D661 IonicContact NH1-OD2 3.29Å; R658-D661 PolarHBondContact NH1-OD2 3.08Å; R658-D661 IonicContact NH2-OD2 3.71Å; R658-D661 PolarHBondContact NH2-OD2 2.88Å; R658-D661 WeakPolarHBondContact O-CB 3.22Å; R658-Y663 PolarHBondContact NH2-O 2.84Å; R658-C665 HydrophobicContact CG-CB 4.16Å; R658-C665 PolarHBondContact O-SG 3.37Å; R658-W668 VanDerWaalsContact CD-O 3.27Å; R658-W668 WeakPolarHBondContact CD-O 3.47Å; R658-W668 WeakPolarHBondContact CG-O 3.36Å; R658-W668 PolarHBondContact NE-O 3.46Å; R658-F669 HydrophobicContact CG-CD1 4.44Å
659	L	83.6	Confident	84.5	Confident	26 Å²	26	36.4 Å²	36.4	14%	0.136	18%	0.179	C	C	.	.	H	α-helix	trans	-77.7	-29.8	177.9	-69	169.9	0	0	0	112.7	K113 L655 D661 H702 I709	K113-L659 PolarHBondContact NZ-O 3.01Å; L655-L659 HydrophobicContact CD1-CD1 3.96Å; L655-L659 HydrophobicContact CD1-CG 3.98Å; L655-L659 HydrophobicContact CG-CD1 3.95Å; L655-L659 HydrophobicContact CG-CG 4.4Å; L655-L659 WeakPolarHBondContact O-CG 3.36Å; L655-L659 PolarHBondContact O-N 3.21Å; L659-D661 VanDerWaalsContact C-N 3.33Å; L659-H702 HydrophobicContact CD1-CB 4.07Å; L659-H702 WeakPolarHBondContact CD1-CD2 3.23Å; L659-I709 HydrophobicContact CD1-CD1 4.49Å; L659-I709 HydrophobicContact CD2-CD1 3.84Å
660	N	83.6	Confident	84.1	Confident	132 Å²	132	35.5 Å²	35.5	71%	0.706	18%	0.176	S	C	*	.	S	Bend	trans	-83	-4.3	175.1	-73.6	-64.8	0	0	0	114.2	D656	D656-N660 PolarHBondContact O-N 2.92Å; D656-N660 PolarHBondContact O-ND2 2.67Å
661	D	78.5	Confident	83.7	Confident	42 Å²	42	35.9 Å²	35.9	23%	0.225	18%	0.178	C	C	.	.	S	Bend	trans	-62.1	158.4	175.5	-168.9	15.7	0	0	0	112.7	K113 H657 R658 L659 Y663	K113-D661 PolarHBondContact NZ-O 3.35Å; H657-D661 PolarHBondContact O-N 2.64Å; R658-D661 IonicContact CZ-OD2 3.94Å; R658-D661 IonicContact NH1-OD2 3.29Å; R658-D661 PolarHBondContact NH1-OD2 3.08Å; R658-D661 IonicContact NH2-OD2 3.71Å; R658-D661 PolarHBondContact NH2-OD2 2.88Å; R658-D661 WeakPolarHBondContact O-CB 3.22Å; L659-D661 VanDerWaalsContact C-N 3.33Å; D661-Y663 PolarHBondContact O-N 2.81Å
662	S	70.3	Confident	83.3	Confident	67 Å²	67	35.8 Å²	35.8	47%	0.469	18%	0.178	S	C	.	.	S	Bend	trans	-76.6	-4.5	177.7	-61.6	0	0	0	0	113.9	Q112 K113	Q112-S662 WeakPolarHBondContact CG-O 3.48Å; K113-S662 WeakPolarHBondContact CB-O 3.37Å; K113-S662 PolarHBondContact N-O 3.33Å
663	Y	74	Confident	83.2	Confident	76 Å²	76	31.9 Å²	31.9	30%	0.298	16%	0.163	S	C	.	.	B	Isolated β-bridge	trans	-110.9	133.9	176.7	-66.8	-68.9	0	0	0	111.2	E231 R658 D661 C665	E231-Y663 WeakPolarHBondContact OE1-CE2 3.46Å; E231-Y663 PolarHBondContact OE1-OH 2.67Å; R658-Y663 PolarHBondContact NH2-O 2.84Å; D661-Y663 PolarHBondContact O-N 2.81Å; Y663-C665 PolarHBondContact O-N 3.09Å
664	S	73.4	Confident	83.1	Confident	20 Å²	20	31.8 Å²	31.8	14%	0.14	17%	0.165	C	C	.	.			trans	-61.4	124.6	175.6	-175.4	0	0	0	0	109.3	Q111	Q111-S664 PolarHBondContact O-N 3.22Å
665	C	72.4	Confident	83.1	Confident	11 Å²	11	32.5 Å²	32.5	7%	0.074	17%	0.168	C	C	.	.			trans	-123.2	-24.5	-174.1	68.1	0	0	0	0	113.6	R658 Y663 G667 W668	R658-C665 HydrophobicContact CG-CB 4.16Å; R658-C665 PolarHBondContact O-SG 3.37Å; Y663-C665 PolarHBondContact O-N 3.09Å; C665-G667 PolarHBondContact O-N 3.03Å; C665-W668 WeakPolarHBondContact O-CB 3.48Å; C665-W668 VanDerWaalsContact O-CD1 3.28Å; C665-W668 PolarHBondContact O-N 3.3Å
666	L	79.1	Confident	83.1	Confident	30 Å²	30	32.4 Å²	32.4	16%	0.157	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	32	-176.8	-46.5	-178.4	0	0	0	113.2	V708 D710 P771	L666-V708 HydrophobicContact CD2-CG1 4.04Å; L666-D710 HydrophobicContact CB-CB 3.75Å; L666-D710 HydrophobicContact CD1-CB 4.39Å; L666-D710 PolarHBondContact O-N 2.99Å; L666-P771 HydrophobicContact CD1-CB 3.92Å; L666-P771 HydrophobicContact CD1-CG 3.88Å; L666-P771 HydrophobicContact CD2-CG 4.22Å
667	G	82.6	Confident	83.2	Confident	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.4	-19.7	-174.6	0	0	0	0	0	115.9	C665 F669 Y695 L713	C665-G667 PolarHBondContact O-N 3.03Å; G667-F669 PolarHBondContact O-N 3.09Å; G667-Y695 PolarHBondContact O-OH 2.91Å; G667-Y695 VanDerWaalsContact O-OH 3.08Å; G667-L713 VanDerWaalsContact C-CD2 3.45Å
668	W	85.4	Confident	83.4	Confident	85 Å²	85	29.9 Å²	29.9	32%	0.322	16%	0.156	S	C	.	.	P	Polyproline II helix	trans	-66.1	117.4	-175.7	-69.1	95.8	0	0	0	113.1	M107 R110 R658 C665 D710 L713	M107-W668 HydrophobicContact CE-CE3 4.21Å; R110-W668 PolarHBondContact NH1-O 2.96Å; R658-W668 VanDerWaalsContact CD-O 3.27Å; R658-W668 WeakPolarHBondContact CD-O 3.47Å; R658-W668 WeakPolarHBondContact CG-O 3.36Å; R658-W668 PolarHBondContact NE-O 3.46Å; C665-W668 WeakPolarHBondContact O-CB 3.48Å; C665-W668 VanDerWaalsContact O-CD1 3.28Å; C665-W668 PolarHBondContact O-N 3.3Å; W668-D710 PolarHBondContact NE1-OD2 3.45Å; W668-L713 HydrophobicContact CD2-CB 4.46Å; W668-L713 HydrophobicContact CD2-CD1 3.9Å; W668-L713 HydrophobicContact CD2-CD2 4.35Å; W668-L713 HydrophobicContact CD2-CG 4.48Å; W668-L713 HydrophobicContact CE3-CD1 3.75Å; W668-L713 HydrophobicContact CG-CD2 4.28Å; W668-L713 HydrophobicContact CH2-CD1 3.98Å; W668-L713 HydrophobicContact CZ2-CB 3.93Å; W668-L713 HydrophobicContact CZ2-CD1 4.13Å; W668-L713 HydrophobicContact CZ3-CD1 3.79Å
669	F	87.2	Confident	83.7	Confident	9 Å²	9	29.1 Å²	29.1	4%	0.039	15%	0.153	C	C	.	.	P	Polyproline II helix	trans	-53.9	152.6	167.3	-64.7	-51.2	0	0	0	112.9	R110 Q651 T654 L655 R658 G667 Q673 V674 L677 Y695	R110-F669 PolarHBondContact NH1-O 3.13Å; R110-F669 PolarHBondContact NH2-O 2.77Å; Q651-F669 HydrophobicContact CG-CZ 4.12Å; T654-F669 HydrophobicContact CG2-CD1 3.8Å; T654-F669 HydrophobicContact CG2-CE1 3.69Å; L655-F669 HydrophobicContact CB-CE1 3.98Å; L655-F669 HydrophobicContact CB-CZ 4.27Å; R658-F669 HydrophobicContact CG-CD1 4.44Å; G667-F669 PolarHBondContact O-N 3.09Å; F669-Q673 HydrophobicContact CB-CB 3.99Å; F669-Q673 HydrophobicContact CD1-CB 4.44Å; F669-Q673 HydrophobicContact CG-CB 4.48Å; F669-V674 HydrophobicContact CB-CG2 3.7Å; F669-L677 HydrophobicContact CD1-CD1 4.48Å; F669-L677 HydrophobicContact CD2-CD1 4.01Å; F669-L677 HydrophobicContact CE1-CD1 4.34Å; F669-L677 HydrophobicContact CE2-CD1 3.85Å; F669-L677 HydrophobicContact CG-CD1 4.33Å; F669-L677 HydrophobicContact CZ-CD1 4.03Å; F669-Y695 HydrophobicContact CD2-CE1 4.5Å; F669-Y695 HydrophobicContact CD2-CE2 4.17Å; F669-Y695 AromaticContact CD2-CZ 3.8Å; F669-Y695 WeakPolarHBondContact CD2-OH 3.42Å; F669-Y695 HydrophobicContact CE1-CE2 4.4Å; F669-Y695 HydrophobicContact CE2-CD2 4.02Å; F669-Y695 HydrophobicContact CE2-CE1 4.09Å; F669-Y695 AromaticContact CE2-CE2 3.3Å; F669-Y695 HydrophobicContact CE2-CE2 3.3Å; F669-Y695 AromaticContact CE2-CZ 3.35Å; F669-Y695 WeakPolarHBondContact CE2-OH 3.38Å; F669-Y695 HydrophobicContact CZ-CD2 4.11Å; F669-Y695 AromaticContact CZ-CE2 3.45Å; F669-Y695 HydrophobicContact CZ-CE2 3.45Å; F669-Y695 VanDerWaalsContact CZ-CE2 3.45Å; F669-Y695 AromaticContact CZ-CZ 3.96Å
670	S	82.7	Confident	84.1	Confident	14 Å²	14	27.9 Å²	27.9	10%	0.098	15%	0.146	C	C	.	.	P	Polyproline II helix	trans	-76.3	161.1	173.1	75.1	0	0	0	0	112.1	G672 Q673 V674	S670-G672 PolarHBondContact O-N 3.18Å; S670-Q673 PolarHBondContact O-N 2.89Å; S670-Q673 WeakPolarHBondContact OG-CG 3.48Å; S670-Q673 PolarHBondContact OG-N 3.44Å; S670-V674 WeakPolarHBondContact O-CG2 3.34Å; S670-V674 PolarHBondContact O-N 3.07Å
671	P	83.4	Confident	84.5	Confident	9 Å²	9	22.2 Å²	22.2	6%	0.058	12%	0.117	C	C	.	.	H	α-helix	trans	-51.6	-40.4	176	-29	35.7	0	0	0	113.8	P104 M107 F675	P104-P671 HydrophobicContact CG-CB 4.08Å; M107-P671 HydrophobicContact CB-CG 4.08Å; M107-P671 HydrophobicContact CG-CG 4.13Å; M107-P671 HydrophobicContact SD-CB 4.4Å; M107-P671 HydrophobicContact SD-CG 3.83Å; P671-F675 VanDerWaalsContact O-CB 3.24Å; P671-F675 WeakPolarHBondContact O-CB 3.42Å; P671-F675 PolarHBondContact O-N 2.99Å
672	G	85.5	Confident	85	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-70.3	-36.9	176.4	0	0	0	0	0	114.3	S670 V676	S670-G672 PolarHBondContact O-N 3.18Å; G672-V676 WeakPolarHBondContact O-CG2 3.27Å; G672-V676 PolarHBondContact O-N 2.89Å; G672-V676 VanDerWaalsContact O-N 3.16Å
673	Q	89.4	Confident	85.9	Confident	1 Å²	1	18 Å²	18	1%	0.005	9%	0.092	C	C	.	.	H	α-helix	trans	-66.3	-46.9	173.4	-74	176.2	-38.6	0	0	111	M242 T654 F669 S670 F675 V676 L677	M242-Q673 HydrophobicContact CE-CG 3.65Å; M242-Q673 HydrophobicContact SD-CG 3.85Å; T654-Q673 HydrophobicContact CG2-CB 3.98Å; T654-Q673 HydrophobicContact CG2-CG 3.73Å; T654-Q673 VanDerWaalsContact CG2-NE2 3.31Å; T654-Q673 PolarHBondContact O-NE2 3.2Å; F669-Q673 HydrophobicContact CB-CB 3.99Å; F669-Q673 HydrophobicContact CD1-CB 4.44Å; F669-Q673 HydrophobicContact CG-CB 4.48Å; S670-Q673 PolarHBondContact O-N 2.89Å; S670-Q673 WeakPolarHBondContact OG-CG 3.48Å; S670-Q673 PolarHBondContact OG-N 3.44Å; Q673-F675 PolarHBondContact O-N 3.06Å; Q673-V676 PolarHBondContact O-N 3.29Å; Q673-L677 WeakPolarHBondContact O-CB 3.41Å; Q673-L677 VanDerWaalsContact O-CG 3.26Å; Q673-L677 WeakPolarHBondContact O-CG 3.18Å; Q673-L677 PolarHBondContact O-N 2.85Å
674	V	89.4	Confident	86.6	Confident	27 Å²	27	15.2 Å²	15.2	16%	0.164	8%	0.081	C	C	.	.	H	α-helix	trans	-56.5	-51.4	175.8	173.6	0	0	0	0	110.3	P104 M107 F669 S670 V676 L677 D678	P104-V674 HydrophobicContact CG-CG1 4.4Å; M107-V674 HydrophobicContact SD-CG2 4.46Å; F669-V674 HydrophobicContact CB-CG2 3.7Å; S670-V674 WeakPolarHBondContact O-CG2 3.34Å; S670-V674 PolarHBondContact O-N 3.07Å; V674-V676 PolarHBondContact O-N 3.33Å; V674-L677 PolarHBondContact O-N 3.27Å; V674-D678 WeakPolarHBondContact CG1-OD2 3.41Å; V674-D678 WeakPolarHBondContact O-CB 3.46Å; V674-D678 PolarHBondContact O-N 3.06Å
675	F	90.9	Very high	87.1	Confident	14 Å²	14	15.6 Å²	15.6	6%	0.061	9%	0.088	C	C	.	.	H	α-helix	trans	-53.7	-47.3	178.5	161.8	-108.8	0	0	0	113.8	P98 A101 Q103 L239 P671 Q673 E679	P98-F675 HydrophobicContact CB-CE2 3.98Å; P98-F675 HydrophobicContact CB-CZ 3.65Å; P98-F675 HydrophobicContact CG-CZ 3.89Å; A101-F675 HydrophobicContact CB-CD2 3.72Å; A101-F675 HydrophobicContact CB-CE2 4.06Å; Q103-F675 HydrophobicContact CB-CB 4.5Å; Q103-F675 HydrophobicContact CG-CB 3.66Å; Q103-F675 HydrophobicContact CG-CD1 3.89Å; Q103-F675 HydrophobicContact CG-CD2 4.26Å; Q103-F675 HydrophobicContact CG-CG 3.66Å; L239-F675 HydrophobicContact CD1-CD1 3.88Å; L239-F675 HydrophobicContact CD1-CE1 3.71Å; P671-F675 VanDerWaalsContact O-CB 3.24Å; P671-F675 WeakPolarHBondContact O-CB 3.42Å; P671-F675 PolarHBondContact O-N 2.99Å; Q673-F675 PolarHBondContact O-N 3.06Å; F675-E679 WeakPolarHBondContact O-CB 3.43Å; F675-E679 PolarHBondContact O-N 3.22Å
676	V	91.4	Very high	87.9	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-71.6	-38.7	179.9	172.7	0	0	0	0	111.9	V91 I95 L239 F243 G672 Q673 V674 Y680	V91-V676 HydrophobicContact CG1-CG1 3.95Å; I95-V676 HydrophobicContact CD1-CG2 4.29Å; I95-V676 HydrophobicContact CG1-CG2 3.76Å; L239-V676 HydrophobicContact CD2-CG2 4.4Å; F243-V676 HydrophobicContact CD2-CB 4.32Å; F243-V676 HydrophobicContact CD2-CG1 4.11Å; F243-V676 HydrophobicContact CD2-CG2 4.15Å; F243-V676 HydrophobicContact CE1-CG1 4.16Å; F243-V676 HydrophobicContact CE2-CB 3.46Å; F243-V676 VanDerWaalsContact CE2-CB 3.46Å; F243-V676 HydrophobicContact CE2-CG1 3.59Å; F243-V676 HydrophobicContact CE2-CG2 3.59Å; F243-V676 HydrophobicContact CZ-CB 3.68Å; F243-V676 HydrophobicContact CZ-CG1 3.62Å; F243-V676 HydrophobicContact CZ-CG2 4.33Å; G672-V676 WeakPolarHBondContact O-CG2 3.27Å; G672-V676 PolarHBondContact O-N 2.89Å; G672-V676 VanDerWaalsContact O-N 3.16Å; Q673-V676 PolarHBondContact O-N 3.29Å; V674-V676 PolarHBondContact O-N 3.33Å; V676-Y680 WeakPolarHBondContact O-CB 3.36Å; V676-Y680 PolarHBondContact O-N 3.2Å
677	L	91.9	Very high	88.2	Confident	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-66.5	-38.9	175.9	-68.2	173.5	0	0	0	111.8	F647 L650 T654 F669 Q673 V674 C681	F647-L677 HydrophobicContact CE2-CB 4.18Å; F647-L677 HydrophobicContact CE2-CD2 3.64Å; F647-L677 HydrophobicContact CE2-CG 4.48Å; F647-L677 HydrophobicContact CZ-CB 4.43Å; F647-L677 HydrophobicContact CZ-CD2 4.09Å; L650-L677 HydrophobicContact CD2-CD2 3.99Å; L650-L677 HydrophobicContact CG-CD2 3.93Å; T654-L677 HydrophobicContact CG2-CD1 4.19Å; F669-L677 HydrophobicContact CD1-CD1 4.48Å; F669-L677 HydrophobicContact CD2-CD1 4.01Å; F669-L677 HydrophobicContact CE1-CD1 4.34Å; F669-L677 HydrophobicContact CE2-CD1 3.85Å; F669-L677 HydrophobicContact CG-CD1 4.33Å; F669-L677 HydrophobicContact CZ-CD1 4.03Å; Q673-L677 WeakPolarHBondContact O-CB 3.41Å; Q673-L677 VanDerWaalsContact O-CG 3.26Å; Q673-L677 WeakPolarHBondContact O-CG 3.18Å; Q673-L677 PolarHBondContact O-N 2.85Å; V674-L677 PolarHBondContact O-N 3.27Å; L677-C681 WeakPolarHBondContact O-CB 3.28Å; L677-C681 PolarHBondContact O-N 3.01Å; L677-C681 PolarHBondContact O-SG 3.2Å
678	D	91.5	Very high	88.4	Confident	48 Å²	48	17.6 Å²	17.6	26%	0.257	10%	0.101	S	C	.	.	H	α-helix	trans	-65.1	-48.2	175.6	-72.1	-9.7	0	0	0	111.2	A101 V674 Y680 C681 A682 R691	A101-D678 HydrophobicContact CB-CB 3.99Å; V674-D678 WeakPolarHBondContact CG1-OD2 3.41Å; V674-D678 WeakPolarHBondContact O-CB 3.46Å; V674-D678 PolarHBondContact O-N 3.06Å; D678-Y680 VanDerWaalsContact C-N 3.33Å; D678-Y680 PolarHBondContact O-N 2.87Å; D678-C681 PolarHBondContact O-N 3.42Å; D678-A682 VanDerWaalsContact O-CB 3.28Å; D678-A682 WeakPolarHBondContact O-CB 3.42Å; D678-A682 PolarHBondContact O-N 3.24Å; D678-R691 IonicContact OD1-CZ 3.21Å; D678-R691 IonicContact OD1-NH1 2.67Å; D678-R691 PolarHBondContact OD1-NH1 3.31Å; D678-R691 IonicContact OD1-NH2 2.89Å; D678-R691 PolarHBondContact OD1-NH2 3.07Å
679	E	90.9	Very high	88.5	Confident	0 Å²	0	13.6 Å²	13.6	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-62.4	-39.6	177.5	-169.1	69.7	179.4	0	0	111.4	C94 P98 F99 N100 A101 F675 R683	C94-E679 HydrophobicContact CB-CB 4.17Å; C94-E679 HydrophobicContact CB-CG 3.83Å; P98-E679 VanDerWaalsContact CA-OE1 3.27Å; P98-E679 WeakPolarHBondContact CA-OE1 3.28Å; P98-E679 HydrophobicContact CB-CG 4.4Å; F99-E679 WeakPolarHBondContact CD1-OE1 3.31Å; F99-E679 PolarHBondContact N-OE1 2.89Å; N100-E679 WeakPolarHBondContact CB-OE2 3.49Å; N100-E679 PolarHBondContact N-OE1 3.38Å; N100-E679 PolarHBondContact N-OE2 2.99Å; A101-E679 HydrophobicContact CB-CB 4.11Å; A101-E679 WeakPolarHBondContact CB-OE2 3.33Å; A101-E679 PolarHBondContact N-OE2 2.69Å; F675-E679 WeakPolarHBondContact O-CB 3.43Å; F675-E679 PolarHBondContact O-N 3.22Å; E679-R683 WeakPolarHBondContact O-CB 2.9Å; E679-R683 PolarHBondContact O-N 3.42Å
680	Y	92.9	Very high	88.6	Confident	0 Å²	0	14.3 Å²	14.3	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-62.5	-50	173.9	-171.8	-71.6	0	0	0	111.3	L87 F90 H643 F647 L650 V676 D678 A682 R683 Y684 V686	L87-Y680 HydrophobicContact CD2-CE2 4.15Å; F90-Y680 HydrophobicContact CB-CD2 4.28Å; F90-Y680 HydrophobicContact CB-CE2 3.69Å; H643-Y680 HydrophobicContact CB-CE1 4.49Å; H643-Y680 AromaticContact ND1-CE1 3.9Å; H643-Y680 AromaticContact ND1-CZ 3.61Å; H643-Y680 PolarHBondContact ND1-OH 3.31Å; F647-Y680 HydrophobicContact CB-CD1 4.48Å; F647-Y680 HydrophobicContact CB-CE1 4.04Å; F647-Y680 AromaticContact CD2-CD1 3.69Å; F647-Y680 HydrophobicContact CD2-CD1 3.69Å; F647-Y680 HydrophobicContact CD2-CE1 4.08Å; F647-Y680 HydrophobicContact CD2-CG 4.4Å; L650-Y680 HydrophobicContact CD2-CD2 3.84Å; L650-Y680 HydrophobicContact CD2-CE2 4.06Å; L650-Y680 HydrophobicContact CD2-CG 4.19Å; V676-Y680 WeakPolarHBondContact O-CB 3.36Å; V676-Y680 PolarHBondContact O-N 3.2Å; D678-Y680 VanDerWaalsContact C-N 3.33Å; D678-Y680 PolarHBondContact O-N 2.87Å; Y680-A682 VanDerWaalsContact C-N 3.33Å; Y680-A682 PolarHBondContact O-N 3.12Å; Y680-R683 PolarHBondContact O-N 3.48Å; Y680-Y684 HydrophobicContact CD1-CD2 4.01Å; Y680-Y684 AromaticContact CD2-CD2 3.88Å; Y680-Y684 HydrophobicContact CD2-CD2 3.88Å; Y680-Y684 HydrophobicContact CD2-CE2 4.14Å; Y680-Y684 HydrophobicContact CE1-CD2 4.09Å; Y680-Y684 AromaticContact CE2-CD2 4Å; Y680-Y684 HydrophobicContact CE2-CD2 4Å; Y680-Y684 HydrophobicContact CE2-CE2 4.3Å; Y680-Y684 AromaticContact CG-CD2 3.89Å; Y680-Y684 HydrophobicContact CG-CD2 3.89Å; Y680-Y684 HydrophobicContact CG-CE2 4.49Å; Y680-Y684 WeakPolarHBondContact O-CB 3.45Å; Y680-Y684 WeakPolarHBondContact O-CD2 3.44Å; Y680-Y684 PolarHBondContact O-N 3.26Å; Y680-V686 HydrophobicContact CD1-CG2 4.17Å; Y680-V686 HydrophobicContact CE1-CG2 4.06Å
681	C	91.3	Very high	89	Confident	13 Å²	13	15.6 Å²	15.6	9%	0.088	9%	0.092	C	C	.	.	H	α-helix	trans	-59	-46.5	179.9	-70.9	0	0	0	0	111.4	F647 L677 D678 G685 V686	F647-C681 WeakPolarHBondContact CE2-SG 3.29Å; F647-C681 VanDerWaalsContact CZ-SG 3.51Å; L677-C681 WeakPolarHBondContact O-CB 3.28Å; L677-C681 PolarHBondContact O-N 3.01Å; L677-C681 PolarHBondContact O-SG 3.2Å; D678-C681 PolarHBondContact O-N 3.42Å; C681-G685 CarbonylContact O-C 3.58Å; C681-G685 WeakPolarHBondContact O-CA 3.4Å; C681-G685 PolarHBondContact O-N 3.47Å; C681-V686 HydrophobicContact CB-CB 4.17Å; C681-V686 PolarHBondContact O-N 2.9Å
682	A	88.4	Confident	89.4	Confident	19 Å²	19	16 Å²	16	16%	0.157	9%	0.093	C	C	.	.	H	α-helix	trans	-61.6	-55.8	177.9	0	0	0	0	0	111.6	N100 R280 L316 D678 Y680 Y684	N100-A682 HydrophobicContact CB-CB 4.34Å; N100-A682 WeakPolarHBondContact ND2-CB 3.4Å; R280-A682 PolarHBondContact NH1-O 2.71Å; L316-A682 WeakPolarHBondContact CD1-O 3.49Å; L316-A682 HydrophobicContact CD2-CB 3.97Å; D678-A682 VanDerWaalsContact O-CB 3.28Å; D678-A682 WeakPolarHBondContact O-CB 3.42Å; D678-A682 PolarHBondContact O-N 3.24Å; Y680-A682 VanDerWaalsContact C-N 3.33Å; Y680-A682 PolarHBondContact O-N 3.12Å; A682-Y684 PolarHBondContact O-N 3.37Å
683	R	89.1	Confident	89.7	Confident	3 Å²	3	16.1 Å²	16.1	1%	0.011	9%	0.094	C	C	.	.	H	α-helix	trans	-64.2	-39.6	-174.7	-174.1	172.7	178.5	159.5	-9.9	113.1	R93 Y97 F99 E276 R280 E679 Y680	R93-R683 PolarHBondContact O-NH1 3.49Å; Y97-R683 VanDerWaalsContact CE2-NH1 3.28Å; Y97-R683 PolarHBondContact OH-NH2 2.83Å; Y97-R683 VanDerWaalsContact OH-NH2 3.09Å; F99-R683 HydrophobicContact CE1-CB 4.33Å; F99-R683 HydrophobicContact CE1-CG 4.2Å; E276-R683 VanDerWaalsContact CD-NH2 3.33Å; E276-R683 IonicContact OE1-NH2 3.76Å; E276-R683 PolarHBondContact OE1-NH2 2.73Å; E276-R683 IonicContact OE2-CZ 2.84Å; E276-R683 VanDerWaalsContact OE2-CZ 3.22Å; E276-R683 IonicContact OE2-NE 2.7Å; E276-R683 PolarHBondContact OE2-NE 2.92Å; E276-R683 IonicContact OE2-NH2 2.64Å; E276-R683 PolarHBondContact OE2-NH2 3.04Å; R280-R683 VanDerWaalsContact NH1-C 3.3Å; R280-R683 PolarHBondContact NH1-O 3.33Å; E679-R683 WeakPolarHBondContact O-CB 2.9Å; E679-R683 PolarHBondContact O-N 3.42Å; Y680-R683 PolarHBondContact O-N 3.48Å
684	Y	89.1	Confident	89.8	Confident	17 Å²	17	16.4 Å²	16.4	7%	0.067	10%	0.096	C	C	.	.	H	α-helix	trans	-102	-4	-175.7	-59.7	-62.3	0	0	0	114.9	F90 E276 P638 H643 Y680 A682	F90-Y684 HydrophobicContact CB-CE2 3.77Å; F90-Y684 HydrophobicContact CD1-CE1 4.13Å; F90-Y684 HydrophobicContact CD1-CE2 4.37Å; F90-Y684 AromaticContact CD1-CZ 3.79Å; F90-Y684 HydrophobicContact CG-CE2 4.25Å; E276-Y684 PolarHBondContact OE2-OH 3.04Å; P638-Y684 HydrophobicContact CB-CD1 4.02Å; P638-Y684 HydrophobicContact CB-CE1 3.87Å; P638-Y684 HydrophobicContact CG-CE1 4.17Å; H643-Y684 AromaticContact CE1-CD1 3.46Å; H643-Y684 VanDerWaalsContact CE1-CD1 3.46Å; H643-Y684 WeakPolarHBondContact CE1-CD1 3.48Å; H643-Y684 AromaticContact CE1-CG 3.48Å; H643-Y684 VanDerWaalsContact CE1-CG 3.48Å; H643-Y684 AromaticContact ND1-CG 3.71Å; H643-Y684 AromaticContact NE2-CD1 3.56Å; H643-Y684 AromaticContact NE2-CG 3.91Å; Y680-Y684 HydrophobicContact CD1-CD2 4.01Å; Y680-Y684 AromaticContact CD2-CD2 3.88Å; Y680-Y684 HydrophobicContact CD2-CD2 3.88Å; Y680-Y684 HydrophobicContact CD2-CE2 4.14Å; Y680-Y684 HydrophobicContact CE1-CD2 4.09Å; Y680-Y684 AromaticContact CE2-CD2 4Å; Y680-Y684 HydrophobicContact CE2-CD2 4Å; Y680-Y684 HydrophobicContact CE2-CE2 4.3Å; Y680-Y684 AromaticContact CG-CD2 3.89Å; Y680-Y684 HydrophobicContact CG-CD2 3.89Å; Y680-Y684 HydrophobicContact CG-CE2 4.49Å; Y680-Y684 WeakPolarHBondContact O-CB 3.45Å; Y680-Y684 WeakPolarHBondContact O-CD2 3.44Å; Y680-Y684 PolarHBondContact O-N 3.26Å; A682-Y684 PolarHBondContact O-N 3.37Å
685	G	85.4	Confident	90	Very high	28 Å²	28	15.8 Å²	15.8	29%	0.289	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.4	28.3	170.4	0	0	0	0	0	115.3	C681 R687	C681-G685 CarbonylContact O-C 3.58Å; C681-G685 WeakPolarHBondContact O-CA 3.4Å; C681-G685 PolarHBondContact O-N 3.47Å; G685-R687 PolarHBondContact O-N 3.21Å
686	V	88.4	Confident	90.1	Very high	14 Å²	14	15.1 Å²	15.1	9%	0.085	9%	0.088	C	C	.	.			trans	-71.5	121	176.2	-173.6	0	0	0	0	109.3	H643 F647 Y680 C681	H643-V686 HydrophobicContact CB-CG2 4.23Å; F647-V686 HydrophobicContact CB-CG1 4.18Å; F647-V686 HydrophobicContact CB-CG2 3.95Å; F647-V686 HydrophobicContact CD1-CG1 3.98Å; F647-V686 HydrophobicContact CD2-CG2 4.48Å; F647-V686 HydrophobicContact CG-CG1 4.04Å; F647-V686 HydrophobicContact CG-CG2 4.21Å; Y680-V686 HydrophobicContact CD1-CG2 4.17Å; Y680-V686 HydrophobicContact CE1-CG2 4.06Å; C681-V686 HydrophobicContact CB-CB 4.17Å; C681-V686 PolarHBondContact O-N 2.9Å
687	R	85.9	Confident	90.1	Very high	43 Å²	43	16 Å²	16	16%	0.162	10%	0.095	C	C	.	.			trans	-69.4	134.9	-176.8	-62.6	-177.4	75.7	-136	-3.5	111.2	E308 G685 C689 H690 R691 T735 E740	E308-R687 IonicContact OE1-CZ 3.98Å; E308-R687 IonicContact OE1-NE 2.93Å; E308-R687 PolarHBondContact OE1-NE 3.06Å; E308-R687 IonicContact OE1-NH2 3.22Å; E308-R687 PolarHBondContact OE1-NH2 3.34Å; E308-R687 IonicContact OE2-NH2 2.93Å; G685-R687 PolarHBondContact O-N 3.21Å; R687-C689 VanDerWaalsContact C-N 3.27Å; R687-C689 PolarHBondContact O-N 2.9Å; R687-H690 PolarHBondContact O-N 2.93Å; R687-R691 PolarHBondContact O-N 3.11Å; R687-R691 VanDerWaalsContact O-N 3.15Å; R687-T735 PolarHBondContact NH2-O 2.95Å; R687-T735 PolarHBondContact NH2-OG1 3.3Å; R687-E740 IonicContact CZ-OE1 2.84Å; R687-E740 IonicContact CZ-OE2 3.89Å; R687-E740 IonicContact NH1-OE1 3.14Å; R687-E740 PolarHBondContact NH1-OE1 3.02Å; R687-E740 IonicContact NH1-OE2 2.88Å; R687-E740 PolarHBondContact NH1-OE2 2.84Å
688	G	86.5	Confident	90.2	Very high	26 Å²	26	16 Å²	16	27%	0.268	10%	0.095	S	C	.	.	H	α-helix	trans	-58.9	-32.7	-174.6	0	0	0	0	0	114.4	R691 H692	G688-R691 WeakPolarHBondContact O-CB 3.43Å; G688-R691 PolarHBondContact O-N 3.32Å; G688-H692 PolarHBondContact O-CD2 2.87Å; G688-H692 VanDerWaalsContact O-CD2 3.31Å; G688-H692 PolarHBondContact O-N 2.97Å; G688-H692 VanDerWaalsContact O-N 3.11Å
689	C	87.6	Confident	90.2	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-67	-51.3	177.5	-165.6	0	0	0	0	111.2	R687 R691 H692 L693 H724	R687-C689 VanDerWaalsContact C-N 3.27Å; R687-C689 PolarHBondContact O-N 2.9Å; C689-R691 VanDerWaalsContact C-N 3.26Å; C689-R691 PolarHBondContact O-N 3.06Å; C689-H692 PolarHBondContact O-N 3.3Å; C689-L693 WeakPolarHBondContact O-CG 3.47Å; C689-L693 PolarHBondContact O-N 3.29Å; C689-H724 HydrophobicContact CB-CB 4.37Å; C689-H724 WeakPolarHBondContact CB-CD2 3.33Å; C689-H724 PolarHBondContact SG-CD2 2.68Å
690	H	88.9	Confident	90.2	Very high	24 Å²	24	13.7 Å²	13.7	11%	0.111	8%	0.083	C	C	.	.	H	α-helix	trans	-52.4	-41.2	173.3	175.5	79.1	0	0	0	112.7	A644 R687 C694 R743	A644-H690 PolarHBondContact O-NE2 3.27Å; R687-H690 PolarHBondContact O-N 2.93Å; H690-C694 PolarHBondContact CE1-SG 3.23Å; H690-C694 WeakPolarHBondContact O-CB 3.46Å; H690-C694 PolarHBondContact O-N 2.98Å; H690-C694 PolarHBondContact O-SG 3.1Å; H690-R743 PolarHBondContact ND1-NH1 3.07Å; H690-R743 VanDerWaalsContact ND1-NH1 3.18Å
691	R	91.3	Very high	90.1	Very high	41 Å²	41	16.1 Å²	16.1	16%	0.155	9%	0.094	C	C	.	.	H	α-helix	trans	-57.8	-47.3	173.2	167.9	-178.6	-175.3	-173.6	8.5	112.9	F647 Q651 D678 R687 G688 C689 Y695	F647-R691 HydrophobicContact CE1-CB 3.96Å; F647-R691 HydrophobicContact CE1-CG 3.76Å; F647-R691 HydrophobicContact CZ-CG 3.99Å; Q651-R691 PolarHBondContact NE2-O 3.46Å; Q651-R691 VanDerWaalsContact NE2-O 3.1Å; Q651-R691 PolarHBondContact OE1-O 3.47Å; D678-R691 IonicContact OD1-CZ 3.21Å; D678-R691 IonicContact OD1-NH1 2.67Å; D678-R691 PolarHBondContact OD1-NH1 3.31Å; D678-R691 IonicContact OD1-NH2 2.89Å; D678-R691 PolarHBondContact OD1-NH2 3.07Å; R687-R691 PolarHBondContact O-N 3.11Å; R687-R691 VanDerWaalsContact O-N 3.15Å; G688-R691 WeakPolarHBondContact O-CB 3.43Å; G688-R691 PolarHBondContact O-N 3.32Å; C689-R691 VanDerWaalsContact C-N 3.26Å; C689-R691 PolarHBondContact O-N 3.06Å; R691-Y695 WeakPolarHBondContact O-CB 3.1Å; R691-Y695 PolarHBondContact O-N 2.94Å
692	H	92	Very high	90	Very high	17 Å²	17	17.3 Å²	17.3	8%	0.079	10%	0.098	C	C	.	.	H	α-helix	trans	-77.4	-32.4	-178.5	-78.4	-78.1	0	0	0	112.7	G688 C689 Y695 L696 Y716 S717 F720 C721	G688-H692 PolarHBondContact O-CD2 2.87Å; G688-H692 VanDerWaalsContact O-CD2 3.31Å; G688-H692 PolarHBondContact O-N 2.97Å; G688-H692 VanDerWaalsContact O-N 3.11Å; C689-H692 PolarHBondContact O-N 3.3Å; H692-Y695 PolarHBondContact O-N 3.14Å; H692-L696 WeakPolarHBondContact O-CB 3.46Å; H692-L696 VanDerWaalsContact O-CG 3.27Å; H692-L696 WeakPolarHBondContact O-CG 3.46Å; H692-L696 PolarHBondContact O-N 3.07Å; H692-Y716 AromaticContact CE1-CE1 3.83Å; H692-S717 WeakPolarHBondContact ND1-CB 3.46Å; H692-S717 PolarHBondContact ND1-OG 3.43Å; H692-S717 VanDerWaalsContact ND1-OG 3.08Å; H692-F720 HydrophobicContact CB-CD1 4.26Å; H692-F720 AromaticContact CD2-CD1 3.45Å; H692-F720 VanDerWaalsContact CD2-CD1 3.45Å; H692-F720 WeakPolarHBondContact CD2-CD1 3.38Å; H692-F720 AromaticContact CD2-CE1 3.82Å; H692-F720 AromaticContact CD2-CG 3.82Å; H692-F720 AromaticContact CG-CD1 3.99Å; H692-C721 WeakPolarHBondContact CB-SG 3.46Å
693	L	91.4	Very high	89.9	Confident	4 Å²	4	17.3 Å²	17.3	2%	0.021	10%	0.097	C	C	.	.	H	α-helix	trans	-64.1	-46.9	172.1	-67.5	173	0	0	0	111.1	C689 Y695 L696 A697 C721 E740 R743 F744 I747	C689-L693 WeakPolarHBondContact O-CG 3.47Å; C689-L693 PolarHBondContact O-N 3.29Å; L693-Y695 VanDerWaalsContact C-N 3.34Å; L693-Y695 PolarHBondContact O-N 3.45Å; L693-L696 PolarHBondContact O-N 2.91Å; L693-A697 PolarHBondContact O-N 3.38Å; L693-C721 HydrophobicContact CD2-CB 4.09Å; L693-E740 HydrophobicContact CD1-CB 4.18Å; L693-E740 HydrophobicContact CD1-CG 4.25Å; L693-R743 HydrophobicContact CD1-CB 4.37Å; L693-F744 HydrophobicContact CD2-CB 3.92Å; L693-F744 HydrophobicContact CD2-CD2 4.07Å; L693-I747 HydrophobicContact CB-CD1 4Å; L693-I747 HydrophobicContact CD2-CD1 3.89Å; L693-I747 VanDerWaalsContact O-CD1 3.27Å; L693-I747 WeakPolarHBondContact O-CD1 3.41Å
694	C	91.6	Very high	89.8	Confident	7 Å²	7	21.8 Å²	21.8	5%	0.047	12%	0.118	C	C	.	.	H	α-helix	trans	-58.6	-48	172.3	-68	0	0	0	0	110.5	R648 H690 L696 A697 E698	R648-C694 HydrophobicContact CG-CB 4.31Å; H690-C694 PolarHBondContact CE1-SG 3.23Å; H690-C694 WeakPolarHBondContact O-CB 3.46Å; H690-C694 PolarHBondContact O-N 2.98Å; H690-C694 PolarHBondContact O-SG 3.1Å; C694-L696 PolarHBondContact O-N 2.89Å; C694-A697 PolarHBondContact O-N 2.95Å; C694-A697 VanDerWaalsContact O-N 3.16Å; C694-E698 WeakPolarHBondContact O-CG 3.3Å; C694-E698 PolarHBondContact O-N 3.18Å
695	Y	92.8	Very high	89.6	Confident	13 Å²	13	27.2 Å²	27.2	5%	0.051	15%	0.149	C	C	.	.	H	α-helix	trans	-58.1	-45.8	-179.7	-159.4	-156.9	0	0	0	112.9	L655 G667 F669 R691 H692 L693 A697 E698 L699 L713	L655-Y695 HydrophobicContact CD1-CE2 4.43Å; L655-Y695 HydrophobicContact CD2-CE2 4.43Å; G667-Y695 PolarHBondContact O-OH 2.91Å; G667-Y695 VanDerWaalsContact O-OH 3.08Å; F669-Y695 HydrophobicContact CD2-CE1 4.5Å; F669-Y695 HydrophobicContact CD2-CE2 4.17Å; F669-Y695 AromaticContact CD2-CZ 3.8Å; F669-Y695 WeakPolarHBondContact CD2-OH 3.42Å; F669-Y695 HydrophobicContact CE1-CE2 4.4Å; F669-Y695 HydrophobicContact CE2-CD2 4.02Å; F669-Y695 HydrophobicContact CE2-CE1 4.09Å; F669-Y695 AromaticContact CE2-CE2 3.3Å; F669-Y695 HydrophobicContact CE2-CE2 3.3Å; F669-Y695 AromaticContact CE2-CZ 3.35Å; F669-Y695 WeakPolarHBondContact CE2-OH 3.38Å; F669-Y695 HydrophobicContact CZ-CD2 4.11Å; F669-Y695 AromaticContact CZ-CE2 3.45Å; F669-Y695 HydrophobicContact CZ-CE2 3.45Å; F669-Y695 VanDerWaalsContact CZ-CE2 3.45Å; F669-Y695 AromaticContact CZ-CZ 3.96Å; R691-Y695 WeakPolarHBondContact O-CB 3.1Å; R691-Y695 PolarHBondContact O-N 2.94Å; H692-Y695 PolarHBondContact O-N 3.14Å; L693-Y695 VanDerWaalsContact C-N 3.34Å; L693-Y695 PolarHBondContact O-N 3.45Å; Y695-A697 PolarHBondContact O-N 3.41Å; Y695-E698 PolarHBondContact O-N 3.34Å; Y695-L699 HydrophobicContact CD1-CD1 4.01Å; Y695-L699 HydrophobicContact CD2-CD1 3.77Å; Y695-L699 HydrophobicContact CD2-CD2 4.49Å; Y695-L699 HydrophobicContact CD2-CG 3.88Å; Y695-L699 HydrophobicContact CE1-CD1 4.02Å; Y695-L699 HydrophobicContact CE2-CD1 3.77Å; Y695-L699 HydrophobicContact CE2-CD2 4.04Å; Y695-L699 HydrophobicContact CE2-CG 3.91Å; Y695-L699 HydrophobicContact CG-CD1 3.89Å; Y695-L699 HydrophobicContact CG-CG 4.43Å; Y695-L699 VanDerWaalsContact O-CB 3.27Å; Y695-L699 WeakPolarHBondContact O-CB 3.24Å; Y695-L699 WeakPolarHBondContact O-CG 3.46Å; Y695-L699 PolarHBondContact O-N 2.92Å; Y695-L713 HydrophobicContact CE1-CD1 3.8Å; Y695-L713 HydrophobicContact CE1-CG 4.28Å
696	L	93.1	Very high	89.2	Confident	0 Å²	0	28 Å²	28	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-60.3	-44.7	176.4	-74.3	166.2	0	0	0	111.5	H692 L693 C694 L699 M700 L714 F718 I747	H692-L696 WeakPolarHBondContact O-CB 3.46Å; H692-L696 VanDerWaalsContact O-CG 3.27Å; H692-L696 WeakPolarHBondContact O-CG 3.46Å; H692-L696 PolarHBondContact O-N 3.07Å; L693-L696 PolarHBondContact O-N 2.91Å; C694-L696 PolarHBondContact O-N 2.89Å; L696-L699 PolarHBondContact O-N 2.93Å; L696-M700 WeakPolarHBondContact O-CB 3.48Å; L696-M700 VanDerWaalsContact O-CG 3.25Å; L696-M700 WeakPolarHBondContact O-CG 3.38Å; L696-M700 PolarHBondContact O-N 2.88Å; L696-L714 HydrophobicContact CD2-CD2 3.94Å; L696-F718 HydrophobicContact CD1-CB 4.34Å; L696-F718 HydrophobicContact CD2-CB 4.39Å; L696-I747 HydrophobicContact CB-CG2 4Å; L696-I747 HydrophobicContact CD1-CG2 4.04Å
697	A	92.9	Very high	89	Confident	18 Å²	18	28.5 Å²	28.5	15%	0.149	16%	0.162	C	C	.	.	H	α-helix	trans	-61.2	-48	178.8	0	0	0	0	0	112.5	L693 C694 Y695 M700 E701 I747	L693-A697 PolarHBondContact O-N 3.38Å; C694-A697 PolarHBondContact O-N 2.95Å; C694-A697 VanDerWaalsContact O-N 3.16Å; Y695-A697 PolarHBondContact O-N 3.41Å; A697-M700 PolarHBondContact O-N 3.02Å; A697-E701 WeakPolarHBondContact O-CB 3.28Å; A697-E701 PolarHBondContact O-N 3.2Å; A697-I747 HydrophobicContact CB-CD1 4.34Å
698	E	92.3	Very high	88.7	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-70.5	-33.8	179.8	-50.6	-65.7	146.8	0	0	112	R648 R652 L655 C694 Y695 H702	R648-E698 IonicContact CZ-OE1 2.69Å; R648-E698 IonicContact NE-OE1 3.22Å; R648-E698 PolarHBondContact NE-OE1 3.29Å; R648-E698 IonicContact NH2-OE1 2.71Å; R648-E698 PolarHBondContact NH2-OE1 3.37Å; R652-E698 HydrophobicContact CB-CG 4.42Å; R652-E698 WeakPolarHBondContact CD-OE2 3.5Å; R652-E698 WeakPolarHBondContact CG-OE2 3Å; R652-E698 IonicContact CZ-OE2 3.21Å; R652-E698 IonicContact NE-OE2 3.37Å; R652-E698 IonicContact NH1-OE2 2.66Å; R652-E698 PolarHBondContact NH1-OE2 2.85Å; L655-E698 HydrophobicContact CD2-CB 4.06Å; C694-E698 WeakPolarHBondContact O-CG 3.3Å; C694-E698 PolarHBondContact O-N 3.18Å; Y695-E698 PolarHBondContact O-N 3.34Å; E698-H702 PolarHBondContact O-N 3.24Å; E698-H702 VanDerWaalsContact O-N 3.1Å; E698-H702 PolarHBondContact O-ND1 3.39Å
699	L	92	Very high	88.8	Confident	0 Å²	0	27 Å²	27	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-69.1	-39	174.1	-72.8	169.9	0	0	0	112.2	L655 Y695 L696 H702 S703 I709 L713 L714	L655-L699 HydrophobicContact CD1-CD2 3.93Å; L655-L699 HydrophobicContact CD2-CD2 3.85Å; L655-L699 HydrophobicContact CD2-CG 4.2Å; Y695-L699 HydrophobicContact CD1-CD1 4.01Å; Y695-L699 HydrophobicContact CD2-CD1 3.77Å; Y695-L699 HydrophobicContact CD2-CD2 4.49Å; Y695-L699 HydrophobicContact CD2-CG 3.88Å; Y695-L699 HydrophobicContact CE1-CD1 4.02Å; Y695-L699 HydrophobicContact CE2-CD1 3.77Å; Y695-L699 HydrophobicContact CE2-CD2 4.04Å; Y695-L699 HydrophobicContact CE2-CG 3.91Å; Y695-L699 HydrophobicContact CG-CD1 3.89Å; Y695-L699 HydrophobicContact CG-CG 4.43Å; Y695-L699 VanDerWaalsContact O-CB 3.27Å; Y695-L699 WeakPolarHBondContact O-CB 3.24Å; Y695-L699 WeakPolarHBondContact O-CG 3.46Å; Y695-L699 PolarHBondContact O-N 2.92Å; L696-L699 PolarHBondContact O-N 2.93Å; L699-H702 PolarHBondContact O-N 3.2Å; L699-S703 WeakPolarHBondContact O-CB 3.31Å; L699-S703 PolarHBondContact O-N 3.46Å; L699-I709 HydrophobicContact CB-CG2 4.43Å; L699-I709 HydrophobicContact CD2-CD1 3.96Å; L699-I709 HydrophobicContact CD2-CG1 4.41Å; L699-I709 HydrophobicContact CD2-CG2 3.92Å; L699-L713 HydrophobicContact CD1-CD2 4.14Å; L699-L713 HydrophobicContact CD1-CG 4.13Å; L699-L713 HydrophobicContact CD2-CD2 4.26Å; L699-L714 HydrophobicContact CB-CD2 3.8Å; L699-L714 HydrophobicContact CD1-CD2 4.03Å
700	M	91.5	Very high	88.6	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-66.7	-43.2	173.9	-72.7	-173.2	-59	0	0	111.5	L696 A697 H702 S703 E704 I747 R750 L751 L754	L696-M700 WeakPolarHBondContact O-CB 3.48Å; L696-M700 VanDerWaalsContact O-CG 3.25Å; L696-M700 WeakPolarHBondContact O-CG 3.38Å; L696-M700 PolarHBondContact O-N 2.88Å; A697-M700 PolarHBondContact O-N 3.02Å; M700-H702 VanDerWaalsContact C-N 3.29Å; M700-H702 PolarHBondContact O-N 2.7Å; M700-S703 PolarHBondContact O-N 3.4Å; M700-S703 VanDerWaalsContact O-N 3.09Å; M700-E704 WeakPolarHBondContact O-CB 3.48Å; M700-E704 WeakPolarHBondContact O-CG 3.46Å; M700-E704 PolarHBondContact O-N 2.8Å; M700-I747 HydrophobicContact CE-CB 4.2Å; M700-I747 HydrophobicContact CE-CG1 3.98Å; M700-I747 HydrophobicContact CE-CG2 3.84Å; M700-R750 HydrophobicContact CE-CB 4.35Å; M700-R750 HydrophobicContact CE-CG 4.18Å; M700-R750 HydrophobicContact SD-CB 4.39Å; M700-R750 HydrophobicContact SD-CG 4.1Å; M700-L751 HydrophobicContact CG-CD1 4.43Å; M700-L751 HydrophobicContact SD-CB 3.7Å; M700-L751 HydrophobicContact SD-CD1 4.05Å; M700-L751 HydrophobicContact SD-CG 4.43Å; M700-L754 HydrophobicContact CB-CD2 4.15Å; M700-L754 HydrophobicContact CG-CD2 3.83Å
701	E	90.9	Very high	88.5	Confident	51 Å²	51	27.2 Å²	27.2	24%	0.238	15%	0.154	C	C	.	.	H	α-helix	trans	-57	-42.3	174.6	-174	176.7	138.3	0	0	111.3	R652 A697 N705	R652-E701 IonicContact CZ-OE1 3.25Å; R652-E701 VanDerWaalsContact CZ-OE1 3.29Å; R652-E701 IonicContact NH1-OE1 2.71Å; R652-E701 PolarHBondContact NH1-OE1 2.81Å; R652-E701 IonicContact NH1-OE2 3.66Å; R652-E701 PolarHBondContact NH1-OE2 3.46Å; R652-E701 IonicContact NH2-OE1 3.19Å; R652-E701 PolarHBondContact NH2-OE1 3.18Å; A697-E701 WeakPolarHBondContact O-CB 3.28Å; A697-E701 PolarHBondContact O-N 3.2Å; E701-N705 WeakPolarHBondContact O-CB 3.38Å; E701-N705 VanDerWaalsContact O-CG 3.3Å; E701-N705 PolarHBondContact O-N 2.75Å; E701-N705 VanDerWaalsContact O-N 3.07Å; E701-N705 PolarHBondContact O-ND2 3.06Å
702	H	88.1	Confident	88.3	Confident	37 Å²	37	28.5 Å²	28.5	17%	0.171	17%	0.167	C	C	.	.	H	α-helix	trans	-67	-39.1	173.6	-79.7	92.1	0	0	0	113.4	D656 L659 E698 L699 M700 N705 G706 A707 I709	D656-H702 IonicContact OD1-CE1 3.33Å; D656-H702 PolarHBondContact OD1-CE1 3.34Å; D656-H702 IonicContact OD1-NE2 3.75Å; L659-H702 HydrophobicContact CD1-CB 4.07Å; L659-H702 WeakPolarHBondContact CD1-CD2 3.23Å; E698-H702 PolarHBondContact O-N 3.24Å; E698-H702 VanDerWaalsContact O-N 3.1Å; E698-H702 PolarHBondContact O-ND1 3.39Å; L699-H702 PolarHBondContact O-N 3.2Å; M700-H702 VanDerWaalsContact C-N 3.29Å; M700-H702 PolarHBondContact O-N 2.7Å; H702-N705 CarbonylContact O-C 3.56Å; H702-N705 PolarHBondContact O-N 3.48Å; H702-G706 PolarHBondContact O-N 2.83Å; H702-A707 HydrophobicContact CB-CB 4.2Å; H702-A707 VanDerWaalsContact O-CB 3.28Å; H702-A707 WeakPolarHBondContact O-CB 3.22Å; H702-A707 PolarHBondContact O-N 3.37Å; H702-I709 HydrophobicContact CB-CD1 4.47Å
703	S	87.1	Confident	88.1	Confident	19 Å²	19	27.9 Å²	27.9	13%	0.133	16%	0.164	C	C	.	.	H	α-helix	trans	-69.4	-38.1	178.4	-169.9	0	0	0	0	113	L699 M700 N705 G706 A707 Q758	L699-S703 WeakPolarHBondContact O-CB 3.31Å; L699-S703 PolarHBondContact O-N 3.46Å; M700-S703 PolarHBondContact O-N 3.4Å; M700-S703 VanDerWaalsContact O-N 3.09Å; S703-N705 VanDerWaalsContact C-N 3.34Å; S703-G706 WeakPolarHBondContact O-CA 3.43Å; S703-G706 PolarHBondContact O-N 3.14Å; S703-A707 WeakPolarHBondContact CA-O 3.23Å; S703-Q758 PolarHBondContact OG-NE2 2.78Å
704	E	86.6	Confident	88	Confident	98 Å²	98	27.8 Å²	27.8	46%	0.458	16%	0.163	S	C	.	.	H	α-helix	trans	-65.8	-36.8	173.2	-71.7	165.6	-168.3	0	0	111.7	M700 G706 R750 L754	M700-E704 WeakPolarHBondContact O-CB 3.48Å; M700-E704 WeakPolarHBondContact O-CG 3.46Å; M700-E704 PolarHBondContact O-N 2.8Å; E704-G706 PolarHBondContact O-N 3Å; E704-R750 VanDerWaalsContact CD-NH2 3.33Å; E704-R750 IonicContact OE1-CZ 2.64Å; E704-R750 IonicContact OE1-NE 3.22Å; E704-R750 PolarHBondContact OE1-NE 3.42Å; E704-R750 IonicContact OE1-NH2 2.66Å; E704-R750 PolarHBondContact OE1-NH2 3.22Å; E704-R750 IonicContact OE2-CZ 2.72Å; E704-R750 IonicContact OE2-NE 2.66Å; E704-R750 PolarHBondContact OE2-NE 3Å; E704-R750 IonicContact OE2-NH2 2.83Å; E704-R750 PolarHBondContact OE2-NH2 3.45Å; E704-L754 HydrophobicContact CG-CD1 4.02Å
705	N	85.1	Confident	87.9	Confident	131 Å²	131	30 Å²	30	70%	0.701	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.6	3.2	170.1	-72.7	-45.4	0	0	0	113.8	E701 H702 S703	E701-N705 WeakPolarHBondContact O-CB 3.38Å; E701-N705 VanDerWaalsContact O-CG 3.3Å; E701-N705 PolarHBondContact O-N 2.75Å; E701-N705 VanDerWaalsContact O-N 3.07Å; E701-N705 PolarHBondContact O-ND2 3.06Å; H702-N705 CarbonylContact O-C 3.56Å; H702-N705 PolarHBondContact O-N 3.48Å; S703-N705 VanDerWaalsContact C-N 3.34Å
706	G	77.9	Confident	87.7	Confident	45 Å²	45	36 Å²	36	46%	0.464	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.1	6	171	0	0	0	0	0	116.3	S165 H702 S703 E704	S165-G706 WeakPolarHBondContact CB-O 3.28Å; H702-G706 PolarHBondContact O-N 2.83Å; S703-G706 WeakPolarHBondContact O-CA 3.43Å; S703-G706 PolarHBondContact O-N 3.14Å; E704-G706 PolarHBondContact O-N 3Å
707	A	83	Confident	87.6	Confident	23 Å²	23	36 Å²	36	19%	0.19	20%	0.196	C	C	.	.			trans	-72.1	144.5	171.2	0	0	0	0	0	111.2	H702 S703 I709	H702-A707 HydrophobicContact CB-CB 4.2Å; H702-A707 VanDerWaalsContact O-CB 3.28Å; H702-A707 WeakPolarHBondContact O-CB 3.22Å; H702-A707 PolarHBondContact O-N 3.37Å; S703-A707 WeakPolarHBondContact CA-O 3.23Å; A707-I709 PolarHBondContact O-N 3.49Å
708	V	81.3	Confident	87.5	Confident	27 Å²	27	35.2 Å²	35.2	16%	0.164	19%	0.19	C	C	.	.			trans	-87.4	114.9	177.2	178.5	0	0	0	0	109.5	S165 L666 P771	S165-V708 WeakPolarHBondContact OG-CG2 3.49Å; L666-V708 HydrophobicContact CD2-CG1 4.04Å; V708-P771 HydrophobicContact CG1-CG 3.79Å
709	I	86.6	Confident	87.3	Confident	10 Å²	10	36.1 Å²	36.1	5%	0.051	20%	0.197	C	C	.	.			trans	-109.3	141.9	176.5	-56.7	-57	0	0	0	108.8	L659 L699 H702 A707 P711 L714	L659-I709 HydrophobicContact CD1-CD1 4.49Å; L659-I709 HydrophobicContact CD2-CD1 3.84Å; L699-I709 HydrophobicContact CB-CG2 4.43Å; L699-I709 HydrophobicContact CD2-CD1 3.96Å; L699-I709 HydrophobicContact CD2-CG1 4.41Å; L699-I709 HydrophobicContact CD2-CG2 3.92Å; H702-I709 HydrophobicContact CB-CD1 4.47Å; A707-I709 PolarHBondContact O-N 3.49Å; I709-P711 VanDerWaalsContact O-CD 3.32Å; I709-P711 WeakPolarHBondContact O-CD 3.49Å; I709-L714 HydrophobicContact CG2-CD1 4.38Å; I709-L714 HydrophobicContact CG2-CD2 4.43Å; I709-L714 HydrophobicContact CG2-CG 4.13Å
710	D	84.9	Confident	87.1	Confident	27 Å²	27	39 Å²	39	14%	0.144	21%	0.21	C	C	.	.			trans	-68.8	119.1	175.6	179.4	0.6	0	0	0	110.6	L666 W668 T712 L713 L714	L666-D710 HydrophobicContact CB-CB 3.75Å; L666-D710 HydrophobicContact CD1-CB 4.39Å; L666-D710 PolarHBondContact O-N 2.99Å; W668-D710 PolarHBondContact NE1-OD2 3.45Å; D710-T712 PolarHBondContact O-N 2.91Å; D710-T712 VanDerWaalsContact O-N 3.14Å; D710-T712 WeakPolarHBondContact OD1-CA 3.42Å; D710-T712 WeakPolarHBondContact OD1-CB 3.43Å; D710-T712 PolarHBondContact OD1-N 3.33Å; D710-T712 PolarHBondContact OD1-OG1 3.43Å; D710-L713 HydrophobicContact CB-CB 4.23Å; D710-L713 WeakPolarHBondContact O-CB 3.47Å; D710-L713 PolarHBondContact O-N 3.46Å; D710-L714 PolarHBondContact O-N 3.48Å
711	P	85.9	Confident	87	Confident	2 Å²	2	39 Å²	39	1%	0.013	21%	0.21	C	C	.	.	H	α-helix	trans	-61.4	-22.3	177	-22.6	35.5	0	0	0	113.1	I709 L713 L714 H715 F766 A774 A777 T778	I709-P711 VanDerWaalsContact O-CD 3.32Å; I709-P711 WeakPolarHBondContact O-CD 3.49Å; P711-L713 VanDerWaalsContact C-N 3.33Å; P711-L714 PolarHBondContact O-N 2.84Å; P711-H715 VanDerWaalsContact O-CB 3.29Å; P711-H715 WeakPolarHBondContact O-CB 3.34Å; P711-H715 PolarHBondContact O-N 2.89Å; P711-F766 HydrophobicContact CG-CE1 4.3Å; P711-A774 HydrophobicContact CG-CB 4.12Å; P711-A777 HydrophobicContact CB-CB 3.92Å; P711-T778 VanDerWaalsContact CG-OG1 3.26Å; P711-T778 WeakPolarHBondContact CG-OG1 3.5Å
712	T	86.4	Confident	86.9	Confident	69 Å²	69	36.8 Å²	36.8	42%	0.423	20%	0.2	S	C	.	.	H	α-helix	trans	-65	-36.6	173.6	-39.6	0	0	0	0	111.9	D710 H715 Y716	D710-T712 PolarHBondContact O-N 2.91Å; D710-T712 VanDerWaalsContact O-N 3.14Å; D710-T712 WeakPolarHBondContact OD1-CA 3.42Å; D710-T712 WeakPolarHBondContact OD1-CB 3.43Å; D710-T712 PolarHBondContact OD1-N 3.33Å; D710-T712 PolarHBondContact OD1-OG1 3.43Å; T712-H715 PolarHBondContact O-N 3.21Å; T712-Y716 PolarHBondContact O-N 3.11Å
713	L	88.4	Confident	86.7	Confident	4 Å²	4	36 Å²	36	2%	0.021	20%	0.199	C	C	.	.	H	α-helix	trans	-71	-41.1	178	179.4	60.3	0	0	0	111.8	G667 W668 Y695 L699 D710 P711 S717	G667-L713 VanDerWaalsContact C-CD2 3.45Å; W668-L713 HydrophobicContact CD2-CB 4.46Å; W668-L713 HydrophobicContact CD2-CD1 3.9Å; W668-L713 HydrophobicContact CD2-CD2 4.35Å; W668-L713 HydrophobicContact CD2-CG 4.48Å; W668-L713 HydrophobicContact CE3-CD1 3.75Å; W668-L713 HydrophobicContact CG-CD2 4.28Å; W668-L713 HydrophobicContact CH2-CD1 3.98Å; W668-L713 HydrophobicContact CZ2-CB 3.93Å; W668-L713 HydrophobicContact CZ2-CD1 4.13Å; W668-L713 HydrophobicContact CZ3-CD1 3.79Å; Y695-L713 HydrophobicContact CE1-CD1 3.8Å; Y695-L713 HydrophobicContact CE1-CG 4.28Å; L699-L713 HydrophobicContact CD1-CD2 4.14Å; L699-L713 HydrophobicContact CD1-CG 4.13Å; L699-L713 HydrophobicContact CD2-CD2 4.26Å; D710-L713 HydrophobicContact CB-CB 4.23Å; D710-L713 WeakPolarHBondContact O-CB 3.47Å; D710-L713 PolarHBondContact O-N 3.46Å; P711-L713 VanDerWaalsContact C-N 3.33Å; L713-S717 PolarHBondContact O-N 2.85Å; L713-S717 PolarHBondContact O-OG 3Å
714	L	90.2	Very high	86.6	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-61.9	-45.9	170.3	-66.7	174.4	0	0	0	110.4	L696 L699 I709 D710 P711 S717 F718 L751 L781	L696-L714 HydrophobicContact CD2-CD2 3.94Å; L699-L714 HydrophobicContact CB-CD2 3.8Å; L699-L714 HydrophobicContact CD1-CD2 4.03Å; I709-L714 HydrophobicContact CG2-CD1 4.38Å; I709-L714 HydrophobicContact CG2-CD2 4.43Å; I709-L714 HydrophobicContact CG2-CG 4.13Å; D710-L714 PolarHBondContact O-N 3.48Å; P711-L714 PolarHBondContact O-N 2.84Å; L714-S717 PolarHBondContact O-N 3.04Å; L714-F718 VanDerWaalsContact O-CB 3.27Å; L714-F718 WeakPolarHBondContact O-CB 3.22Å; L714-F718 PolarHBondContact O-N 3.42Å; L714-L751 HydrophobicContact CD1-CD1 4.47Å; L714-L781 HydrophobicContact CB-CD2 3.64Å
715	H	89.2	Confident	86.5	Confident	55 Å²	55	31.3 Å²	31.3	26%	0.255	18%	0.176	S	C	.	.	H	α-helix	trans	-62.1	-44.1	179.2	175.4	-100.4	0	0	0	113.2	P711 T712 A719 L781 R784	P711-H715 VanDerWaalsContact O-CB 3.29Å; P711-H715 WeakPolarHBondContact O-CB 3.34Å; P711-H715 PolarHBondContact O-N 2.89Å; T712-H715 PolarHBondContact O-N 3.21Å; H715-A719 WeakPolarHBondContact O-CB 3.43Å; H715-A719 PolarHBondContact O-N 3.42Å; H715-L781 HydrophobicContact CB-CB 4.34Å; H715-L781 HydrophobicContact CB-CD1 3.95Å; H715-L781 HydrophobicContact CB-CD2 4.34Å; H715-L781 HydrophobicContact CB-CG 4.44Å; H715-R784 WeakPolarHBondContact NE2-CD 3.48Å
716	Y	89.1	Confident	86.3	Confident	138 Å²	138	27.4 Å²	27.4	54%	0.541	15%	0.154	S	C	.	.	H	α-helix	trans	-58.8	-49.3	174.8	176.6	-102.7	0	0	0	111.9	H692 T712 A719 F720	H692-Y716 AromaticContact CE1-CE1 3.83Å; T712-Y716 PolarHBondContact O-N 3.11Å; Y716-A719 PolarHBondContact O-N 3.08Å; Y716-F720 PolarHBondContact O-N 3.01Å; Y716-F720 VanDerWaalsContact O-N 3.09Å
717	S	90.2	Very high	85.8	Confident	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-68.4	-40.4	-178.6	-62.2	0	0	0	0	112.5	H692 L713 L714 F720 C721	H692-S717 WeakPolarHBondContact ND1-CB 3.46Å; H692-S717 PolarHBondContact ND1-OG 3.43Å; H692-S717 VanDerWaalsContact ND1-OG 3.08Å; L713-S717 PolarHBondContact O-N 2.85Å; L713-S717 PolarHBondContact O-OG 3Å; L714-S717 PolarHBondContact O-N 3.04Å; S717-F720 PolarHBondContact O-N 3.45Å; S717-C721 PolarHBondContact O-N 2.98Å
718	F	91.2	Very high	84.8	Confident	2 Å²	2	31 Å²	31	1%	0.009	17%	0.172	C	C	.	.	H	α-helix	trans	-65.4	-42.1	176	-177.3	-96	0	0	0	111.6	L696 L714 F720 C721 A722 F744 K748 L751 L781 R784 V785	L696-F718 HydrophobicContact CD1-CB 4.34Å; L696-F718 HydrophobicContact CD2-CB 4.39Å; L714-F718 VanDerWaalsContact O-CB 3.27Å; L714-F718 WeakPolarHBondContact O-CB 3.22Å; L714-F718 PolarHBondContact O-N 3.42Å; F718-F720 VanDerWaalsContact C-N 3.31Å; F718-F720 PolarHBondContact O-N 2.83Å; F718-C721 PolarHBondContact O-N 3.44Å; F718-A722 HydrophobicContact CE1-CB 4.45Å; F718-A722 WeakPolarHBondContact O-CB 3.34Å; F718-A722 PolarHBondContact O-N 3.18Å; F718-F744 AromaticContact CD2-CE2 3.99Å; F718-F744 HydrophobicContact CD2-CE2 3.99Å; F718-F744 AromaticContact CE2-CE2 3.53Å; F718-F744 HydrophobicContact CE2-CE2 3.53Å; F718-F744 AromaticContact CE2-CZ 3.81Å; F718-F744 HydrophobicContact CE2-CZ 3.81Å; F718-F744 HydrophobicContact CZ-CE2 4.02Å; F718-F744 AromaticContact CZ-CZ 3.84Å; F718-F744 HydrophobicContact CZ-CZ 3.84Å; F718-K748 HydrophobicContact CE2-CB 4.25Å; F718-K748 HydrophobicContact CE2-CG 4.16Å; F718-K748 HydrophobicContact CZ-CG 4.12Å; F718-L751 HydrophobicContact CB-CD2 4.31Å; F718-L751 HydrophobicContact CD2-CD2 3.72Å; F718-L751 HydrophobicContact CE2-CD2 4.31Å; F718-L751 HydrophobicContact CG-CD2 4.07Å; F718-L781 HydrophobicContact CB-CD1 4.22Å; F718-L781 HydrophobicContact CD1-CD1 4.16Å; F718-L781 HydrophobicContact CG-CD1 4.35Å; F718-R784 HydrophobicContact CE1-CG 4.45Å; F718-V785 HydrophobicContact CD1-CG2 4.01Å; F718-V785 HydrophobicContact CD2-CG2 4.37Å; F718-V785 HydrophobicContact CE1-CB 4.37Å; F718-V785 HydrophobicContact CE1-CG2 3.71Å; F718-V785 HydrophobicContact CE2-CG2 4.09Å; F718-V785 HydrophobicContact CG-CG2 4.34Å; F718-V785 HydrophobicContact CZ-CB 4.3Å; F718-V785 HydrophobicContact CZ-CG2 3.76Å
719	A	88.3	Confident	83.9	Confident	19 Å²	19	32.2 Å²	32.2	16%	0.157	17%	0.173	C	C	.	.	H	α-helix	trans	-62	-36.8	176	0	0	0	0	0	112.6	H715 Y716 S723	H715-A719 WeakPolarHBondContact O-CB 3.43Å; H715-A719 PolarHBondContact O-N 3.42Å; Y716-A719 PolarHBondContact O-N 3.08Å; A719-S723 VanDerWaalsContact O-CB 3.28Å; A719-S723 WeakPolarHBondContact O-CB 3.38Å; A719-S723 PolarHBondContact O-N 3Å
720	F	87.9	Confident	82.2	Confident	61 Å²	61	37.5 Å²	37.5	27%	0.268	21%	0.208	S	C	.	.	H	α-helix	trans	-65.9	-47.2	173.6	-174.1	-84	0	0	0	112	H692 Y716 S717 F718 S723 H724	H692-F720 HydrophobicContact CB-CD1 4.26Å; H692-F720 AromaticContact CD2-CD1 3.45Å; H692-F720 VanDerWaalsContact CD2-CD1 3.45Å; H692-F720 WeakPolarHBondContact CD2-CD1 3.38Å; H692-F720 AromaticContact CD2-CE1 3.82Å; H692-F720 AromaticContact CD2-CG 3.82Å; H692-F720 AromaticContact CG-CD1 3.99Å; Y716-F720 PolarHBondContact O-N 3.01Å; Y716-F720 VanDerWaalsContact O-N 3.09Å; S717-F720 PolarHBondContact O-N 3.45Å; F718-F720 VanDerWaalsContact C-N 3.31Å; F718-F720 PolarHBondContact O-N 2.83Å; F720-S723 PolarHBondContact O-N 3.05Å; F720-H724 PolarHBondContact O-N 3.07Å
721	C	88.9	Confident	80.8	Confident	0 Å²	0	41.9 Å²	41.9	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62	-45.1	176.7	-71.6	0	0	0	0	112.1	H692 L693 S717 F718 S723 H724 V725 F744	H692-C721 WeakPolarHBondContact CB-SG 3.46Å; L693-C721 HydrophobicContact CD2-CB 4.09Å; S717-C721 PolarHBondContact O-N 2.98Å; F718-C721 PolarHBondContact O-N 3.44Å; C721-S723 PolarHBondContact O-N 2.91Å; C721-H724 WeakPolarHBondContact O-CB 3.5Å; C721-H724 PolarHBondContact O-N 2.83Å; C721-V725 WeakPolarHBondContact O-CG2 3.36Å; C721-V725 PolarHBondContact O-N 3.41Å; C721-F744 HydrophobicContact CB-CD2 3.71Å; C721-F744 HydrophobicContact CB-CE2 3.8Å
722	A	87.6	Confident	79.2	Confident	4 Å²	4	45.1 Å²	45.1	3%	0.033	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-40.5	176	0	0	0	0	0	112.3	F718 H724 V725 H726 F744 I790	F718-A722 HydrophobicContact CE1-CB 4.45Å; F718-A722 WeakPolarHBondContact O-CB 3.34Å; F718-A722 PolarHBondContact O-N 3.18Å; A722-H724 VanDerWaalsContact C-N 3.27Å; A722-H724 PolarHBondContact O-N 3.16Å; A722-V725 PolarHBondContact O-N 2.83Å; A722-H726 VanDerWaalsContact O-CB 3.27Å; A722-H726 WeakPolarHBondContact O-CB 3.45Å; A722-H726 VanDerWaalsContact O-CG 3.32Å; A722-H726 PolarHBondContact O-N 3.14Å; A722-H726 PolarHBondContact O-ND1 2.83Å; A722-F744 HydrophobicContact CB-CE2 4.23Å; A722-F744 HydrophobicContact CB-CZ 3.8Å; A722-I790 HydrophobicContact CB-CD1 3.89Å; A722-I790 HydrophobicContact CB-CG1 4.49Å; A722-I790 WeakPolarHBondContact O-CD1 3.28Å
723	S	85.1	Confident	77.7	Confident	22 Å²	22	45.1 Å²	45.1	15%	0.154	26%	0.262	C	S	.	.	H	α-helix	trans	-60	-38.2	174.9	165.1	0	0	0	0	111.9	A719 F720 C721 G727 N728 I790	A719-S723 VanDerWaalsContact O-CB 3.28Å; A719-S723 WeakPolarHBondContact O-CB 3.38Å; A719-S723 PolarHBondContact O-N 3Å; F720-S723 PolarHBondContact O-N 3.05Å; C721-S723 PolarHBondContact O-N 2.91Å; S723-G727 PolarHBondContact O-N 3.01Å; S723-N728 CarbonylContact O-C 3.6Å; S723-N728 PolarHBondContact O-N 3.5Å; S723-N728 PolarHBondContact OG-O 3.07Å; S723-I790 VanDerWaalsContact CA-CD1 3.47Å; S723-I790 VanDerWaalsContact N-CD1 3.33Å
724	H	85	Confident	76.5	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.009	27%	0.274	C	S	.	.	H	α-helix	trans	-69.1	-55.6	174.5	-174.3	63.7	0	0	0	112.5	C689 F720 C721 A722 H726 G727 R729 T735 V736 E740	C689-H724 HydrophobicContact CB-CB 4.37Å; C689-H724 WeakPolarHBondContact CB-CD2 3.33Å; C689-H724 PolarHBondContact SG-CD2 2.68Å; F720-H724 PolarHBondContact O-N 3.07Å; C721-H724 WeakPolarHBondContact O-CB 3.5Å; C721-H724 PolarHBondContact O-N 2.83Å; A722-H724 VanDerWaalsContact C-N 3.27Å; A722-H724 PolarHBondContact O-N 3.16Å; H724-H726 VanDerWaalsContact C-N 3.34Å; H724-H726 PolarHBondContact O-N 3.46Å; H724-G727 PolarHBondContact O-N 3.02Å; H724-R729 PolarHBondContact ND1-NE 3.19Å; H724-R729 PolarHBondContact ND1-NH2 3.18Å; H724-T735 PolarHBondContact CE1-O 3.03Å; H724-T735 PolarHBondContact NE2-O 2.7Å; H724-V736 WeakPolarHBondContact O-CG2 3.27Å; H724-E740 IonicContact NE2-OE1 2.68Å; H724-E740 IonicContact NE2-OE2 3.32Å
725	V	84.3	Confident	76	Confident	16 Å²	16	46.1 Å²	46.1	10%	0.097	27%	0.274	C	S	.	.	H	α-helix	trans	-68.8	-30.9	-173.2	179.5	0	0	0	0	112.6	C721 A722 V736 K741 F744	C721-V725 WeakPolarHBondContact O-CG2 3.36Å; C721-V725 PolarHBondContact O-N 3.41Å; A722-V725 PolarHBondContact O-N 2.83Å; V725-V736 HydrophobicContact CG2-CG1 4.32Å; V725-K741 HydrophobicContact CG1-CB 4.25Å; V725-K741 HydrophobicContact CG1-CD 4.16Å; V725-K741 HydrophobicContact CG1-CG 3.94Å; V725-F744 HydrophobicContact CB-CD1 4.04Å; V725-F744 HydrophobicContact CB-CE1 4.36Å; V725-F744 HydrophobicContact CB-CG 4.45Å; V725-F744 HydrophobicContact CG1-CD1 3.94Å; V725-F744 HydrophobicContact CG1-CE1 4.43Å; V725-F744 HydrophobicContact CG2-CB 4Å; V725-F744 HydrophobicContact CG2-CD1 4.01Å; V725-F744 HydrophobicContact CG2-CG 3.93Å
726	H	80.6	Confident	75.8	Confident	49 Å²	49	43.7 Å²	43.7	23%	0.227	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	7	177.1	-53.2	154.7	0	0	0	113.9	A722 H724 N728 F744 I790	A722-H726 VanDerWaalsContact O-CB 3.27Å; A722-H726 WeakPolarHBondContact O-CB 3.45Å; A722-H726 VanDerWaalsContact O-CG 3.32Å; A722-H726 PolarHBondContact O-N 3.14Å; A722-H726 PolarHBondContact O-ND1 2.83Å; H724-H726 VanDerWaalsContact C-N 3.34Å; H724-H726 PolarHBondContact O-N 3.46Å; H726-N728 VanDerWaalsContact C-N 3.29Å; H726-N728 PolarHBondContact O-N 3.16Å; H726-F744 AromaticContact NE2-CE1 3.9Å; H726-I790 HydrophobicContact CB-CD1 4.42Å
727	G	67.9	Low	75.7	Confident	54 Å²	54	37.6 Å²	37.6	56%	0.557	24%	0.241	S	C	*	.	S	Bend	trans	78.4	-7.7	171.3	0	0	0	0	0	117.2	S723 H724 R729	S723-G727 PolarHBondContact O-N 3.01Å; H724-G727 PolarHBondContact O-N 3.02Å; G727-R729 VanDerWaalsContact C-N 3.32Å; G727-R729 PolarHBondContact O-N 3.5Å
728	N	61.4	Low	75.5	Confident	89 Å²	89	39.7 Å²	39.7	48%	0.476	25%	0.253	S	S	.	.			trans	-82.8	70.2	179	-77.7	-20.7	0	0	0	111.9	S723 H726 I790	S723-N728 CarbonylContact O-C 3.6Å; S723-N728 PolarHBondContact O-N 3.5Å; S723-N728 PolarHBondContact OG-O 3.07Å; H726-N728 VanDerWaalsContact C-N 3.29Å; H726-N728 PolarHBondContact O-N 3.16Å; N728-I790 HydrophobicContact CB-CG2 4.18Å; N728-I790 WeakPolarHBondContact ND2-CG2 2.95Å
729	R	62.7	Low	75.3	Confident	53 Å²	53	44.9 Å²	44.9	20%	0.2	28%	0.277	C	S	.	.			trans	-98.9	139.5	172.2	-94.9	-169.2	170.3	178.1	-4.5	112.5	H724 G727 D731	H724-R729 PolarHBondContact ND1-NE 3.19Å; H724-R729 PolarHBondContact ND1-NH2 3.18Å; G727-R729 VanDerWaalsContact C-N 3.32Å; G727-R729 PolarHBondContact O-N 3.5Å; R729-D731 PolarHBondContact O-N 3.23Å
730	P	51.3	Low	75.3	Confident	120 Å²	120	44.6 Å²	44.6	78%	0.779	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-29.4	169.3	-21.3	33.7	0	0	0	113.5	G732	P730-G732 PolarHBondContact O-N 3.47Å
731	D	55	Low	75.2	Confident	119 Å²	119	45.8 Å²	45.8	64%	0.636	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	7	-167.8	-42.7	-57	0	0	0	114.4	R729 I733	R729-D731 PolarHBondContact O-N 3.23Å; D731-I733 PolarHBondContact O-N 2.83Å
732	G	53.2	Low	75.3	Confident	71 Å²	71	52 Å²	52	73%	0.732	31%	0.307	S	S	*	.	S	Bend	trans	73.8	-21.6	169.4	0	0	0	0	0	117.5	P730	P730-G732 PolarHBondContact O-N 3.47Å
733	I	54.3	Low	75.4	Confident	68 Å²	68	55.8 Å²	55.8	35%	0.349	32%	0.32	S	S	.	.			trans	-125.9	131.1	176.5	-55.3	178.3	0	0	0	109.8	M304 D731	M304-I733 HydrophobicContact CB-CG2 4.4Å; D731-I733 PolarHBondContact O-N 2.83Å
734	G	63.5	Low	75.7	Confident	27 Å²	27	54.7 Å²	54.7	28%	0.278	31%	0.313	S	S	.	.			trans	-147	84	-175.8	0	0	0	0	0	112.4
735	T	80.1	Confident	76	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	33%	0.327	C	S	.	.			trans	-75.9	132.6	168.6	64.2	0	0	0	0	110.1	M301 M304 E308 R687 H724	M301-T735 HydrophobicContact CB-CG2 4.07Å; M301-T735 WeakPolarHBondContact O-CG2 3.32Å; M304-T735 HydrophobicContact CB-CG2 3.73Å; E308-T735 WeakPolarHBondContact OE2-CB 3.39Å; E308-T735 PolarHBondContact OE2-N 3.43Å; E308-T735 PolarHBondContact OE2-OG1 3.36Å; R687-T735 PolarHBondContact NH2-O 2.95Å; R687-T735 PolarHBondContact NH2-OG1 3.3Å; H724-T735 PolarHBondContact CE1-O 3.03Å; H724-T735 PolarHBondContact NE2-O 2.7Å
736	V	85.2	Confident	76.3	Confident	4 Å²	4	63.3 Å²	63.3	2%	0.024	35%	0.352	C	S	.	.			trans	-124.6	119.5	-178.7	-174.1	0	0	0	0	108.9	F296 I297 H724 V725	F296-V736 WeakPolarHBondContact CD1-O 3.09Å; I297-V736 HydrophobicContact CD1-CB 3.88Å; I297-V736 HydrophobicContact CD1-CG1 3.62Å; I297-V736 HydrophobicContact CG1-CB 4.48Å; I297-V736 HydrophobicContact CG1-CG1 4.44Å; I297-V736 PolarHBondContact N-O 3.45Å; I297-V736 VanDerWaalsContact N-O 3.14Å; H724-V736 WeakPolarHBondContact O-CG2 3.27Å; V725-V736 HydrophobicContact CG2-CG1 4.32Å
737	S	85.7	Confident	76.9	Confident	10 Å²	10	61.6 Å²	61.6	7%	0.07	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-76.8	154.1	176.2	68.6	0	0	0	0	111.5	K295 E739 E740 K741	K295-S737 CarbonylContact O-C 3.54Å; K295-S737 VanDerWaalsContact O-CA 3.26Å; K295-S737 WeakPolarHBondContact O-CA 3.23Å; K295-S737 WeakPolarHBondContact O-CB 3.27Å; S737-E739 PolarHBondContact O-N 3.49Å; S737-E740 WeakPolarHBondContact CB-OE2 3.33Å; S737-E740 PolarHBondContact N-OE2 2.64Å; S737-E740 PolarHBondContact O-N 3.44Å; S737-E740 WeakPolarHBondContact OG-CB 3.46Å; S737-E740 VanDerWaalsContact OG-CD 3.24Å; S737-E740 VanDerWaalsContact OG-CG 3.22Å; S737-E740 WeakPolarHBondContact OG-CG 3.49Å; S737-E740 PolarHBondContact OG-N 3.21Å; S737-E740 VanDerWaalsContact OG-N 3.09Å; S737-E740 PolarHBondContact OG-OE2 2.7Å; S737-K741 PolarHBondContact O-N 2.77Å; S737-K741 VanDerWaalsContact O-N 3.16Å
738	V	86.5	Confident	78.1	Confident	43 Å²	43	60.5 Å²	60.5	26%	0.261	32%	0.324	S	S	.	.	H	α-helix	trans	-59.6	-40.8	173.8	176.3	0	0	0	0	110.1	K295 K741 E742	K295-V738 HydrophobicContact CB-CB 4.2Å; K295-V738 HydrophobicContact CB-CG2 3.98Å; K295-V738 PolarHBondContact O-N 3.25Å; V738-K741 PolarHBondContact O-N 3.22Å; V738-E742 HydrophobicContact CG1-CG 4.21Å; V738-E742 WeakPolarHBondContact CG1-OE1 3.48Å; V738-E742 WeakPolarHBondContact O-CB 3.49Å; V738-E742 WeakPolarHBondContact O-CG 3.35Å; V738-E742 PolarHBondContact O-N 2.91Å
739	E	85.9	Confident	79.5	Confident	111 Å²	111	63.1 Å²	63.1	52%	0.519	33%	0.334	S	S	.	.	H	α-helix	trans	-66.2	-40	179.2	-179.8	170.9	-152.7	0	0	113.2	S737 K741 R743	S737-E739 PolarHBondContact O-N 3.49Å; E739-K741 VanDerWaalsContact C-N 3.3Å; E739-K741 PolarHBondContact O-N 3.4Å; E739-R743 WeakPolarHBondContact O-CB 3.49Å; E739-R743 VanDerWaalsContact O-CG 3.25Å; E739-R743 WeakPolarHBondContact O-CG 3.19Å; E739-R743 PolarHBondContact O-N 2.92Å; E739-R743 IonicContact OE1-CZ 3.51Å; E739-R743 IonicContact OE1-NE 3.89Å; E739-R743 IonicContact OE1-NH2 3.96Å; E739-R743 PolarHBondContact OE1-NH2 3.03Å
740	E	88.6	Confident	81	Confident	13 Å²	13	64.4 Å²	64.4	6%	0.061	34%	0.339	C	S	.	.	H	α-helix	trans	-64	-36.5	172.7	-76.6	160.4	140.6	0	0	111.8	R687 L693 H724 S737 F744	R687-E740 IonicContact CZ-OE1 2.84Å; R687-E740 IonicContact CZ-OE2 3.89Å; R687-E740 IonicContact NH1-OE1 3.14Å; R687-E740 PolarHBondContact NH1-OE1 3.02Å; R687-E740 IonicContact NH1-OE2 2.88Å; R687-E740 PolarHBondContact NH1-OE2 2.84Å; L693-E740 HydrophobicContact CD1-CB 4.18Å; L693-E740 HydrophobicContact CD1-CG 4.25Å; H724-E740 IonicContact NE2-OE1 2.68Å; H724-E740 IonicContact NE2-OE2 3.32Å; S737-E740 WeakPolarHBondContact CB-OE2 3.33Å; S737-E740 PolarHBondContact N-OE2 2.64Å; S737-E740 PolarHBondContact O-N 3.44Å; S737-E740 WeakPolarHBondContact OG-CB 3.46Å; S737-E740 VanDerWaalsContact OG-CD 3.24Å; S737-E740 VanDerWaalsContact OG-CG 3.22Å; S737-E740 WeakPolarHBondContact OG-CG 3.49Å; S737-E740 PolarHBondContact OG-N 3.21Å; S737-E740 VanDerWaalsContact OG-N 3.09Å; S737-E740 PolarHBondContact OG-OE2 2.7Å; E740-F744 WeakPolarHBondContact O-CB 3.49Å; E740-F744 PolarHBondContact O-N 3.24Å
741	K	87.4	Confident	82.9	Confident	87 Å²	87	58.7 Å²	58.7	38%	0.378	30%	0.302	S	S	.	.	H	α-helix	trans	-71	-47.7	176.2	-179.4	168.1	-179.5	173.7	0	112.2	I297 V725 S737 V738 E739 R743 F744 E745	I297-K741 HydrophobicContact CD1-CB 4.19Å; I297-K741 HydrophobicContact CD1-CD 3.75Å; V725-K741 HydrophobicContact CG1-CB 4.25Å; V725-K741 HydrophobicContact CG1-CD 4.16Å; V725-K741 HydrophobicContact CG1-CG 3.94Å; S737-K741 PolarHBondContact O-N 2.77Å; S737-K741 VanDerWaalsContact O-N 3.16Å; V738-K741 PolarHBondContact O-N 3.22Å; E739-K741 VanDerWaalsContact C-N 3.3Å; E739-K741 PolarHBondContact O-N 3.4Å; K741-R743 VanDerWaalsContact C-N 3.35Å; K741-R743 PolarHBondContact O-N 2.87Å; K741-F744 WeakPolarHBondContact O-CB 3.33Å; K741-F744 PolarHBondContact O-N 3.4Å; K741-F744 VanDerWaalsContact O-N 3.08Å; K741-E745 WeakPolarHBondContact CE-OE1 3.21Å; K741-E745 HydrophobicContact CG-CG 4.42Å; K741-E745 WeakPolarHBondContact O-CG 3.49Å; K741-E745 PolarHBondContact O-N 3.15Å
742	E	90.3	Very high	84.7	Confident	131 Å²	131	54.1 Å²	54.1	61%	0.612	28%	0.279	S	S	*	.	H	α-helix	trans	-58	-47.3	179	-74.1	170.7	167	0	0	110.8	V738 F744 E745 E746	V738-E742 HydrophobicContact CG1-CG 4.21Å; V738-E742 WeakPolarHBondContact CG1-OE1 3.48Å; V738-E742 WeakPolarHBondContact O-CB 3.49Å; V738-E742 WeakPolarHBondContact O-CG 3.35Å; V738-E742 PolarHBondContact O-N 2.91Å; E742-F744 VanDerWaalsContact C-N 3.33Å; E742-F744 PolarHBondContact O-N 2.92Å; E742-E745 PolarHBondContact O-N 3.05Å; E742-E746 PolarHBondContact O-N 3.15Å; E742-E746 VanDerWaalsContact O-N 3.11Å
743	R	89.9	Confident	86.6	Confident	82 Å²	82	54.6 Å²	54.6	31%	0.309	27%	0.271	S	S	.	.	H	α-helix	trans	-64.5	-32.6	173.8	-67.6	176.2	-174.8	-175.5	5.9	113.4	H690 L693 E739 K741 I747	H690-R743 PolarHBondContact ND1-NH1 3.07Å; H690-R743 VanDerWaalsContact ND1-NH1 3.18Å; L693-R743 HydrophobicContact CD1-CB 4.37Å; E739-R743 WeakPolarHBondContact O-CB 3.49Å; E739-R743 VanDerWaalsContact O-CG 3.25Å; E739-R743 WeakPolarHBondContact O-CG 3.19Å; E739-R743 PolarHBondContact O-N 2.92Å; E739-R743 IonicContact OE1-CZ 3.51Å; E739-R743 IonicContact OE1-NE 3.89Å; E739-R743 IonicContact OE1-NH2 3.96Å; E739-R743 PolarHBondContact OE1-NH2 3.03Å; K741-R743 VanDerWaalsContact C-N 3.35Å; K741-R743 PolarHBondContact O-N 2.87Å; R743-I747 VanDerWaalsContact O-CB 3.3Å; R743-I747 WeakPolarHBondContact O-CB 3.37Å; R743-I747 WeakPolarHBondContact O-CD1 3.48Å; R743-I747 VanDerWaalsContact O-CG1 3.28Å; R743-I747 WeakPolarHBondContact O-CG1 3.28Å; R743-I747 PolarHBondContact O-N 2.96Å
744	F	91.3	Very high	88.3	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-68	-44.4	177.1	173.9	-107.8	0	0	0	112.1	L693 F718 C721 A722 V725 H726 E740 K741 E742 I747 K748	L693-F744 HydrophobicContact CD2-CB 3.92Å; L693-F744 HydrophobicContact CD2-CD2 4.07Å; F718-F744 AromaticContact CD2-CE2 3.99Å; F718-F744 HydrophobicContact CD2-CE2 3.99Å; F718-F744 AromaticContact CE2-CE2 3.53Å; F718-F744 HydrophobicContact CE2-CE2 3.53Å; F718-F744 AromaticContact CE2-CZ 3.81Å; F718-F744 HydrophobicContact CE2-CZ 3.81Å; F718-F744 HydrophobicContact CZ-CE2 4.02Å; F718-F744 AromaticContact CZ-CZ 3.84Å; F718-F744 HydrophobicContact CZ-CZ 3.84Å; C721-F744 HydrophobicContact CB-CD2 3.71Å; C721-F744 HydrophobicContact CB-CE2 3.8Å; A722-F744 HydrophobicContact CB-CE2 4.23Å; A722-F744 HydrophobicContact CB-CZ 3.8Å; V725-F744 HydrophobicContact CB-CD1 4.04Å; V725-F744 HydrophobicContact CB-CE1 4.36Å; V725-F744 HydrophobicContact CB-CG 4.45Å; V725-F744 HydrophobicContact CG1-CD1 3.94Å; V725-F744 HydrophobicContact CG1-CE1 4.43Å; V725-F744 HydrophobicContact CG2-CB 4Å; V725-F744 HydrophobicContact CG2-CD1 4.01Å; V725-F744 HydrophobicContact CG2-CG 3.93Å; H726-F744 AromaticContact NE2-CE1 3.9Å; E740-F744 WeakPolarHBondContact O-CB 3.49Å; E740-F744 PolarHBondContact O-N 3.24Å; K741-F744 WeakPolarHBondContact O-CB 3.33Å; K741-F744 PolarHBondContact O-N 3.4Å; K741-F744 VanDerWaalsContact O-N 3.08Å; E742-F744 VanDerWaalsContact C-N 3.33Å; E742-F744 PolarHBondContact O-N 2.92Å; F744-I747 PolarHBondContact O-N 3.06Å; F744-K748 HydrophobicContact CE1-CD 4.43Å; F744-K748 VanDerWaalsContact O-CB 3.29Å; F744-K748 WeakPolarHBondContact O-CB 3.35Å; F744-K748 PolarHBondContact O-N 3.44Å
745	E	90.7	Very high	89.7	Confident	66 Å²	66	50.7 Å²	50.7	31%	0.308	24%	0.244	S	C	.	.	H	α-helix	trans	-68.3	-38.2	177.6	-54.2	-69.3	-175.2	0	0	111	K741 E742 I747 K748 E749	K741-E745 WeakPolarHBondContact CE-OE1 3.21Å; K741-E745 HydrophobicContact CG-CG 4.42Å; K741-E745 WeakPolarHBondContact O-CG 3.49Å; K741-E745 PolarHBondContact O-N 3.15Å; E742-E745 PolarHBondContact O-N 3.05Å; E745-I747 PolarHBondContact O-N 3.09Å; E745-K748 WeakPolarHBondContact O-CB 3.43Å; E745-K748 PolarHBondContact O-N 3.48Å; E745-K748 VanDerWaalsContact O-N 3.14Å; E745-K748 WeakPolarHBondContact OE2-CD 3.19Å; E745-E749 PolarHBondContact O-N 2.93Å
746	E	92	Very high	90.3	Very high	132 Å²	132	52.7 Å²	52.7	62%	0.617	25%	0.254	S	S	*	.	H	α-helix	trans	-57.8	-48.2	171.4	-176.2	-172.2	179.2	0	0	111.7	E742 K748 E749 R750	E742-E746 PolarHBondContact O-N 3.15Å; E742-E746 VanDerWaalsContact O-N 3.11Å; E746-K748 VanDerWaalsContact C-N 3.29Å; E746-K748 PolarHBondContact O-N 3.28Å; E746-E749 PolarHBondContact O-N 3Å; E746-R750 WeakPolarHBondContact O-CB 3.36Å; E746-R750 PolarHBondContact O-N 2.88Å
747	I	92.8	Very high	90.6	Very high	13 Å²	13	56.4 Å²	56.4	7%	0.067	27%	0.274	C	S	.	.	H	α-helix	trans	-63.4	-35.3	175.4	-77	167.6	0	0	0	111.4	L693 L696 A697 M700 R743 F744 E745 L751	L693-I747 HydrophobicContact CB-CD1 4Å; L693-I747 HydrophobicContact CD2-CD1 3.89Å; L693-I747 VanDerWaalsContact O-CD1 3.27Å; L693-I747 WeakPolarHBondContact O-CD1 3.41Å; L696-I747 HydrophobicContact CB-CG2 4Å; L696-I747 HydrophobicContact CD1-CG2 4.04Å; A697-I747 HydrophobicContact CB-CD1 4.34Å; M700-I747 HydrophobicContact CE-CB 4.2Å; M700-I747 HydrophobicContact CE-CG1 3.98Å; M700-I747 HydrophobicContact CE-CG2 3.84Å; R743-I747 VanDerWaalsContact O-CB 3.3Å; R743-I747 WeakPolarHBondContact O-CB 3.37Å; R743-I747 WeakPolarHBondContact O-CD1 3.48Å; R743-I747 VanDerWaalsContact O-CG1 3.28Å; R743-I747 WeakPolarHBondContact O-CG1 3.28Å; R743-I747 PolarHBondContact O-N 2.96Å; F744-I747 PolarHBondContact O-N 3.06Å; E745-I747 PolarHBondContact O-N 3.09Å; I747-L751 WeakPolarHBondContact O-CB 3.39Å; I747-L751 PolarHBondContact O-N 2.75Å
748	K	91.5	Very high	90.8	Very high	31 Å²	31	56.7 Å²	56.7	14%	0.135	27%	0.274	C	S	.	.	H	α-helix	trans	-66.6	-45.2	178.3	-172.1	-177.1	-174.1	178.5	0	111.9	F718 F744 E745 E746 S752 V785 M787	F718-K748 HydrophobicContact CE2-CB 4.25Å; F718-K748 HydrophobicContact CE2-CG 4.16Å; F718-K748 HydrophobicContact CZ-CG 4.12Å; F744-K748 HydrophobicContact CE1-CD 4.43Å; F744-K748 VanDerWaalsContact O-CB 3.29Å; F744-K748 WeakPolarHBondContact O-CB 3.35Å; F744-K748 PolarHBondContact O-N 3.44Å; E745-K748 WeakPolarHBondContact O-CB 3.43Å; E745-K748 PolarHBondContact O-N 3.48Å; E745-K748 VanDerWaalsContact O-N 3.14Å; E745-K748 WeakPolarHBondContact OE2-CD 3.19Å; E746-K748 VanDerWaalsContact C-N 3.29Å; E746-K748 PolarHBondContact O-N 3.28Å; K748-S752 WeakPolarHBondContact O-CB 3.5Å; K748-S752 PolarHBondContact O-N 3.36Å; K748-V785 WeakPolarHBondContact CE-O 3.49Å; K748-V785 HydrophobicContact CG-CG1 4.15Å; K748-M787 PolarHBondContact NZ-O 3.38Å
749	E	91.4	Very high	91	Very high	145 Å²	145	54.7 Å²	54.7	68%	0.678	26%	0.261	S	S	*	.	H	α-helix	trans	-67.7	-42.6	176.9	-69.3	-168.9	163.7	0	0	112.1	E745 E746 S752 S753	E745-E749 PolarHBondContact O-N 2.93Å; E746-E749 PolarHBondContact O-N 3Å; E749-S752 PolarHBondContact O-N 3.12Å; E749-S753 WeakPolarHBondContact O-CB 3.36Å; E749-S753 PolarHBondContact O-N 3.46Å; E749-S753 PolarHBondContact O-OG 3.45Å
750	R	93.6	Very high	91.2	Very high	79 Å²	79	49.6 Å²	49.6	30%	0.298	24%	0.238	S	C	.	.	H	α-helix	trans	-62.8	-45.9	174.5	-175.3	174.9	174.3	-164.9	0.5	111.7	M700 E704 E746 S753 L754	M700-R750 HydrophobicContact CE-CB 4.35Å; M700-R750 HydrophobicContact CE-CG 4.18Å; M700-R750 HydrophobicContact SD-CB 4.39Å; M700-R750 HydrophobicContact SD-CG 4.1Å; E704-R750 VanDerWaalsContact CD-NH2 3.33Å; E704-R750 IonicContact OE1-CZ 2.64Å; E704-R750 IonicContact OE1-NE 3.22Å; E704-R750 PolarHBondContact OE1-NE 3.42Å; E704-R750 IonicContact OE1-NH2 2.66Å; E704-R750 PolarHBondContact OE1-NH2 3.22Å; E704-R750 IonicContact OE2-CZ 2.72Å; E704-R750 IonicContact OE2-NE 2.66Å; E704-R750 PolarHBondContact OE2-NE 3Å; E704-R750 IonicContact OE2-NH2 2.83Å; E704-R750 PolarHBondContact OE2-NH2 3.45Å; E746-R750 WeakPolarHBondContact O-CB 3.36Å; E746-R750 PolarHBondContact O-N 2.88Å; R750-S753 WeakPolarHBondContact O-CB 3.48Å; R750-S753 PolarHBondContact O-N 2.98Å; R750-L754 WeakPolarHBondContact O-CB 3.28Å; R750-L754 PolarHBondContact O-N 3.21Å
751	L	92.9	Very high	91.3	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-63.8	-43.7	177.6	-177.4	57.6	0	0	0	111.5	M700 L714 F718 I747 S753 L754 L755 L781 V785	M700-L751 HydrophobicContact CG-CD1 4.43Å; M700-L751 HydrophobicContact SD-CB 3.7Å; M700-L751 HydrophobicContact SD-CD1 4.05Å; M700-L751 HydrophobicContact SD-CG 4.43Å; L714-L751 HydrophobicContact CD1-CD1 4.47Å; F718-L751 HydrophobicContact CB-CD2 4.31Å; F718-L751 HydrophobicContact CD2-CD2 3.72Å; F718-L751 HydrophobicContact CE2-CD2 4.31Å; F718-L751 HydrophobicContact CG-CD2 4.07Å; I747-L751 WeakPolarHBondContact O-CB 3.39Å; I747-L751 PolarHBondContact O-N 2.75Å; L751-S753 VanDerWaalsContact C-N 3.29Å; L751-S753 PolarHBondContact O-N 2.83Å; L751-L754 PolarHBondContact O-N 2.97Å; L751-L755 HydrophobicContact CD1-CD1 4.13Å; L751-L755 HydrophobicContact CD1-CD2 4.46Å; L751-L755 HydrophobicContact CD1-CG 4.1Å; L751-L755 HydrophobicContact CG-CD1 3.9Å; L751-L755 HydrophobicContact CG-CG 4.34Å; L751-L755 WeakPolarHBondContact O-CB 3.44Å; L751-L755 WeakPolarHBondContact O-CG 3.37Å; L751-L755 PolarHBondContact O-N 3.48Å; L751-L781 HydrophobicContact CD1-CD2 4.48Å; L751-L781 HydrophobicContact CD2-CD1 4.43Å; L751-L781 HydrophobicContact CD2-CD2 4.5Å; L751-V785 HydrophobicContact CD2-CG2 3.7Å; L751-V785 HydrophobicContact CG-CG2 4.08Å
752	S	92.1	Very high	91.4	Very high	24 Å²	24	46.9 Å²	46.9	17%	0.168	23%	0.227	C	C	.	.	H	α-helix	trans	-56.8	-44.3	174.5	-168.1	0	0	0	0	111.6	K748 E749 L755 E756	K748-S752 WeakPolarHBondContact O-CB 3.5Å; K748-S752 PolarHBondContact O-N 3.36Å; E749-S752 PolarHBondContact O-N 3.12Å; S752-L755 PolarHBondContact O-N 3.1Å; S752-E756 PolarHBondContact O-N 2.96Å
753	S	92.3	Very high	91.1	Very high	80 Å²	80	41.3 Å²	41.3	56%	0.559	20%	0.2	S	C	*	.	H	α-helix	trans	-64.4	-40.8	177.1	-56	0	0	0	0	112.6	E749 R750 L751 N757	E749-S753 WeakPolarHBondContact O-CB 3.36Å; E749-S753 PolarHBondContact O-N 3.46Å; E749-S753 PolarHBondContact O-OG 3.45Å; R750-S753 WeakPolarHBondContact O-CB 3.48Å; R750-S753 PolarHBondContact O-N 2.98Å; L751-S753 VanDerWaalsContact C-N 3.29Å; L751-S753 PolarHBondContact O-N 2.83Å; S753-N757 WeakPolarHBondContact O-CB 3.26Å; S753-N757 PolarHBondContact O-N 3.09Å
754	L	91.6	Very high	90.9	Very high	12 Å²	12	40.2 Å²	40.2	6%	0.063	20%	0.196	C	C	.	.	H	α-helix	trans	-64.6	-41.7	175.3	179.8	60.8	0	0	0	111.7	M700 E704 R750 L751 N757 Q758	M700-L754 HydrophobicContact CB-CD2 4.15Å; M700-L754 HydrophobicContact CG-CD2 3.83Å; E704-L754 HydrophobicContact CG-CD1 4.02Å; R750-L754 WeakPolarHBondContact O-CB 3.28Å; R750-L754 PolarHBondContact O-N 3.21Å; L751-L754 PolarHBondContact O-N 2.97Å; L754-N757 WeakPolarHBondContact O-CB 3.38Å; L754-N757 PolarHBondContact O-N 3.14Å; L754-Q758 HydrophobicContact CD1-CG 4.43Å; L754-Q758 WeakPolarHBondContact O-CG 3.21Å; L754-Q758 PolarHBondContact O-N 3.16Å
755	L	92.1	Very high	90.5	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-69.1	-44	177.7	-64.1	166.8	0	0	0	111.8	L751 S752 N757 Q758 I759 T778 L781 L782 V785	L751-L755 HydrophobicContact CD1-CD1 4.13Å; L751-L755 HydrophobicContact CD1-CD2 4.46Å; L751-L755 HydrophobicContact CD1-CG 4.1Å; L751-L755 HydrophobicContact CG-CD1 3.9Å; L751-L755 HydrophobicContact CG-CG 4.34Å; L751-L755 WeakPolarHBondContact O-CB 3.44Å; L751-L755 WeakPolarHBondContact O-CG 3.37Å; L751-L755 PolarHBondContact O-N 3.48Å; S752-L755 PolarHBondContact O-N 3.1Å; L755-N757 PolarHBondContact O-N 3.4Å; L755-Q758 PolarHBondContact O-N 3.5Å; L755-I759 WeakPolarHBondContact O-CB 3.3Å; L755-I759 WeakPolarHBondContact O-CD1 3.07Å; L755-I759 VanDerWaalsContact O-CG1 3.28Å; L755-I759 WeakPolarHBondContact O-CG1 3.29Å; L755-I759 PolarHBondContact O-N 3.48Å; L755-T778 HydrophobicContact CD2-CG2 3.57Å; L755-L781 HydrophobicContact CD1-CD2 4.38Å; L755-L781 HydrophobicContact CD1-CG 3.91Å; L755-L781 HydrophobicContact CD2-CD2 4.1Å; L755-L781 HydrophobicContact CD2-CG 4.32Å; L755-L782 HydrophobicContact CB-CD1 4.2Å; L755-L782 HydrophobicContact CD1-CB 4.35Å; L755-L782 HydrophobicContact CD1-CD1 4.43Å; L755-V785 HydrophobicContact CD1-CB 4.43Å; L755-V785 HydrophobicContact CD1-CG2 4.02Å
756	E	92.1	Very high	90.3	Very high	43 Å²	43	39.5 Å²	39.5	20%	0.201	20%	0.198	C	C	.	.	H	α-helix	trans	-54	-42.5	170.6	-86.7	-152.8	-150.4	0	0	110.6	S752 S760 V802 K805 K809	S752-E756 PolarHBondContact O-N 2.96Å; E756-S760 VanDerWaalsContact O-CB 3.28Å; E756-S760 WeakPolarHBondContact O-CB 3.36Å; E756-S760 PolarHBondContact O-N 2.97Å; E756-S760 PolarHBondContact O-OG 3.43Å; E756-V802 HydrophobicContact CG-CG1 4.09Å; E756-K805 IonicContact OE1-NZ 2.78Å; E756-K805 IonicContact OE2-NZ 2.73Å; E756-K809 IonicContact OE2-NZ 3.16Å; E756-K809 PolarHBondContact OE2-NZ 3.38Å
757	N	91.4	Very high	89.8	Confident	82 Å²	82	33.4 Å²	33.4	44%	0.439	17%	0.169	S	C	.	.	H	α-helix	trans	-68.8	-45	-180	-170.8	27.8	0	0	0	112.7	S753 L754 L755 I759 S760 H761	S753-N757 WeakPolarHBondContact O-CB 3.26Å; S753-N757 PolarHBondContact O-N 3.09Å; L754-N757 WeakPolarHBondContact O-CB 3.38Å; L754-N757 PolarHBondContact O-N 3.14Å; L755-N757 PolarHBondContact O-N 3.4Å; N757-I759 PolarHBondContact O-N 2.65Å; N757-S760 PolarHBondContact O-N 3.18Å; N757-H761 WeakPolarHBondContact O-CB 3.44Å; N757-H761 PolarHBondContact O-N 3.05Å; N757-H761 PolarHBondContact O-ND1 3.21Å; N757-H761 VanDerWaalsContact O-ND1 3.12Å; N757-H761 PolarHBondContact OD1-CE1 3.37Å; N757-H761 PolarHBondContact OD1-ND1 3.06Å
758	Q	89.9	Confident	89.3	Confident	16 Å²	16	33.1 Å²	33.1	8%	0.075	17%	0.167	C	C	.	.	H	α-helix	trans	-62.7	-38.9	177.1	-75	178.6	4.2	0	0	112.4	S703 L754 L755 H761 F762 C765 F766 T778	S703-Q758 PolarHBondContact OG-NE2 2.78Å; L754-Q758 HydrophobicContact CD1-CG 4.43Å; L754-Q758 WeakPolarHBondContact O-CG 3.21Å; L754-Q758 PolarHBondContact O-N 3.16Å; L755-Q758 PolarHBondContact O-N 3.5Å; Q758-H761 CarbonylContact O-C 3.59Å; Q758-H761 PolarHBondContact O-N 2.89Å; Q758-F762 WeakPolarHBondContact O-CA 2.95Å; Q758-F762 PolarHBondContact O-N 3.12Å; Q758-F762 VanDerWaalsContact O-N 3.11Å; Q758-C765 HydrophobicContact CB-CB 4.45Å; Q758-F766 HydrophobicContact CB-CE2 4.13Å; Q758-F766 HydrophobicContact CB-CZ 4.28Å; Q758-T778 HydrophobicContact CB-CG2 4.42Å
759	I	90.7	Very high	88.5	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-72	-40.9	175.8	-63.1	161	0	0	0	110.4	L755 N757 H761 F762 T778 L779 L782 C806	L755-I759 WeakPolarHBondContact O-CB 3.3Å; L755-I759 WeakPolarHBondContact O-CD1 3.07Å; L755-I759 VanDerWaalsContact O-CG1 3.28Å; L755-I759 WeakPolarHBondContact O-CG1 3.29Å; L755-I759 PolarHBondContact O-N 3.48Å; N757-I759 PolarHBondContact O-N 2.65Å; I759-H761 PolarHBondContact O-N 3.44Å; I759-F762 WeakPolarHBondContact O-CD1 3.37Å; I759-F762 PolarHBondContact O-N 3.19Å; I759-T778 HydrophobicContact CD1-CG2 4.33Å; I759-T778 HydrophobicContact CG1-CG2 4.01Å; I759-L779 HydrophobicContact CD1-CD2 3.81Å; I759-L779 HydrophobicContact CG1-CD2 4.25Å; I759-L782 HydrophobicContact CD1-CB 4.49Å; I759-L782 HydrophobicContact CD1-CD2 3.66Å; I759-C806 HydrophobicContact CB-CB 4.13Å; I759-C806 HydrophobicContact CG2-CB 3.65Å
760	S	91.4	Very high	88	Confident	4 Å²	4	25.6 Å²	25.6	3%	0.028	14%	0.136	C	C	.	.	H	α-helix	trans	-62.8	-22.7	174.9	-55.5	0	0	0	0	113	E756 N757 K809 A810	E756-S760 VanDerWaalsContact O-CB 3.28Å; E756-S760 WeakPolarHBondContact O-CB 3.36Å; E756-S760 PolarHBondContact O-N 2.97Å; E756-S760 PolarHBondContact O-OG 3.43Å; N757-S760 PolarHBondContact O-N 3.18Å; S760-K809 WeakPolarHBondContact OG-CD 3.14Å; S760-A810 WeakPolarHBondContact O-CA 3.28Å; S760-A810 VanDerWaalsContact O-CB 3.28Å; S760-A810 WeakPolarHBondContact O-CB 3.04Å
761	H	89.6	Confident	87.1	Confident	44 Å²	44	22.6 Å²	22.6	20%	0.204	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.6	28	178.8	-68.3	100.4	0	0	0	113.2	N757 Q758 I759 R763 Y764 C765	N757-H761 WeakPolarHBondContact O-CB 3.44Å; N757-H761 PolarHBondContact O-N 3.05Å; N757-H761 PolarHBondContact O-ND1 3.21Å; N757-H761 VanDerWaalsContact O-ND1 3.12Å; N757-H761 PolarHBondContact OD1-CE1 3.37Å; N757-H761 PolarHBondContact OD1-ND1 3.06Å; Q758-H761 CarbonylContact O-C 3.59Å; Q758-H761 PolarHBondContact O-N 2.89Å; I759-H761 PolarHBondContact O-N 3.44Å; H761-R763 VanDerWaalsContact C-N 3.28Å; H761-R763 PolarHBondContact O-N 3.14Å; H761-Y764 WeakPolarHBondContact O-CA 3.48Å; H761-Y764 PolarHBondContact O-N 3.45Å; H761-C765 PolarHBondContact O-N 3.39Å
762	F	88.8	Confident	86.2	Confident	0 Å²	0	29 Å²	29	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-50.5	-41	-168.7	70.4	-90.5	0	0	0	114.6	Q758 I759 Y764 C765 F766 L775 L807 A810 H865	Q758-F762 WeakPolarHBondContact O-CA 2.95Å; Q758-F762 PolarHBondContact O-N 3.12Å; Q758-F762 VanDerWaalsContact O-N 3.11Å; I759-F762 WeakPolarHBondContact O-CD1 3.37Å; I759-F762 PolarHBondContact O-N 3.19Å; F762-Y764 PolarHBondContact O-N 3.09Å; F762-Y764 VanDerWaalsContact O-N 3.14Å; F762-C765 PolarHBondContact O-N 3.34Å; F762-F766 PolarHBondContact O-N 2.84Å; F762-L775 HydrophobicContact CB-CD1 4.18Å; F762-L775 HydrophobicContact CB-CD2 4.19Å; F762-L807 HydrophobicContact CD1-CD2 4.39Å; F762-L807 HydrophobicContact CE1-CD2 4.06Å; F762-A810 HydrophobicContact CD1-CB 4.04Å; F762-A810 HydrophobicContact CE1-CB 3.82Å; F762-H865 AromaticContact CD2-CD2 3.57Å; F762-H865 AromaticContact CD2-CE1 3.91Å; F762-H865 AromaticContact CD2-CG 3.85Å; F762-H865 AromaticContact CD2-NE2 3.59Å; F762-H865 AromaticContact CE2-CD2 3.43Å; F762-H865 VanDerWaalsContact CE2-CD2 3.43Å; F762-H865 WeakPolarHBondContact CE2-CD2 3.28Å; F762-H865 AromaticContact CE2-CG 3.97Å; F762-H865 AromaticContact CE2-NE2 3.8Å
763	R	85.8	Confident	85.6	Confident	13 Å²	13	29.9 Å²	29.9	5%	0.049	17%	0.169	C	C	.	.	H	α-helix	trans	-62.2	-18.4	177.6	-57.4	-172.4	89.6	-144.1	8.9	114.6	R158 H761 N814 V857 Q860 N861	R158-R763 WeakPolarHBondContact CD-O 3.45Å; H761-R763 VanDerWaalsContact C-N 3.28Å; H761-R763 PolarHBondContact O-N 3.14Å; R763-N814 VanDerWaalsContact CD-CG 3.47Å; R763-N814 WeakPolarHBondContact CD-ND2 3.43Å; R763-N814 WeakPolarHBondContact CD-OD1 3.26Å; R763-V857 PolarHBondContact NH2-O 2.81Å; R763-Q860 VanDerWaalsContact NH2-OE1 3.15Å; R763-N861 VanDerWaalsContact CD-OD1 3.23Å; R763-N861 WeakPolarHBondContact CD-OD1 3.23Å; R763-N861 PolarHBondContact NE-OD1 3.42Å
764	Y	83.9	Confident	85.1	Confident	59 Å²	59	26.2 Å²	26.2	23%	0.231	14%	0.144	C	C	.	.	H	α-helix	trans	-110.1	-33	-178.6	-64.1	-81.2	0	0	0	112.8	R158 H761 F762 R817	R158-Y764 HydrophobicContact CG-CD1 3.92Å; R158-Y764 HydrophobicContact CG-CE1 3.94Å; H761-Y764 WeakPolarHBondContact O-CA 3.48Å; H761-Y764 PolarHBondContact O-N 3.45Å; F762-Y764 PolarHBondContact O-N 3.09Å; F762-Y764 VanDerWaalsContact O-N 3.14Å; Y764-R817 VanDerWaalsContact OH-CD 3.24Å; Y764-R817 WeakPolarHBondContact OH-CD 3.31Å
765	C	84.1	Confident	84.9	Confident	44 Å²	44	26 Å²	26	30%	0.297	14%	0.143	S	C	.	.	H	α-helix	trans	-78.6	-29.6	174.9	-66.1	0	0	0	0	112.7	Q758 H761 F762	Q758-C765 HydrophobicContact CB-CB 4.45Å; H761-C765 PolarHBondContact O-N 3.39Å; F762-C765 PolarHBondContact O-N 3.34Å
766	F	85.4	Confident	84.6	Confident	8 Å²	8	29.5 Å²	29.5	4%	0.035	16%	0.158	C	C	.	.	S	Bend	trans	-131.8	54.7	-178.8	-49	-73.3	0	0	0	111.6	P711 Q758 F762 F768 G769 R770 A774 L775 T778 H865	P711-F766 HydrophobicContact CG-CE1 4.3Å; Q758-F766 HydrophobicContact CB-CE2 4.13Å; Q758-F766 HydrophobicContact CB-CZ 4.28Å; F762-F766 PolarHBondContact O-N 2.84Å; F766-F768 PolarHBondContact O-N 3.46Å; F766-G769 PolarHBondContact O-N 2.86Å; F766-R770 CarbonylContact C-O 3.32Å; F766-R770 VanDerWaalsContact CA-O 3.22Å; F766-R770 WeakPolarHBondContact CA-O 3.26Å; F766-A774 HydrophobicContact CD1-CB 3.69Å; F766-A774 HydrophobicContact CE1-CB 3.8Å; F766-L775 HydrophobicContact CB-CB 4.32Å; F766-L775 HydrophobicContact CD1-CB 4.48Å; F766-L775 HydrophobicContact CD2-CB 3.86Å; F766-L775 HydrophobicContact CD2-CD1 3.69Å; F766-L775 HydrophobicContact CD2-CG 4.24Å; F766-L775 HydrophobicContact CE2-CB 4.33Å; F766-L775 HydrophobicContact CE2-CD1 3.76Å; F766-L775 HydrophobicContact CG-CB 3.95Å; F766-T778 HydrophobicContact CE2-CG2 4.49Å; F766-T778 HydrophobicContact CZ-CG2 4.26Å; F766-T778 VanDerWaalsContact CZ-OG1 3.28Å; F766-T778 WeakPolarHBondContact CZ-OG1 3.23Å; F766-H865 PolarHBondContact O-CE1 3.38Å
767	P	83.3	Confident	84.3	Confident	4 Å²	4	28.4 Å²	28.4	3%	0.026	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-61.6	133.4	-168.6	29.5	-36.3	0	0	0	111.5	R158 M162 G769 R770	R158-P767 HydrophobicContact CB-CB 3.86Å; M162-P767 HydrophobicContact CB-CG 4.11Å; M162-P767 HydrophobicContact CE-CG 4.41Å; M162-P767 HydrophobicContact CG-CG 4.36Å; M162-P767 HydrophobicContact SD-CG 3.74Å; P767-G769 PolarHBondContact O-N 3.37Å; P767-R770 PolarHBondContact O-N 3.04Å; P767-R770 VanDerWaalsContact O-N 3.14Å
768	F	80.4	Confident	84.2	Confident	6 Å²	6	24.5 Å²	24.5	3%	0.026	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	55.7	29.7	-175.9	-52	-91.4	0	0	0	113.8	V152 F153 R158 V159 V176 F766 R770 H864	V152-F768 HydrophobicContact CG1-CE1 4.34Å; V152-F768 WeakPolarHBondContact O-CZ 3.42Å; F153-F768 HydrophobicContact CB-CZ 4.49Å; F153-F768 HydrophobicContact CD2-CB 4.37Å; F153-F768 AromaticContact CD2-CD1 3.93Å; F153-F768 HydrophobicContact CD2-CD1 3.93Å; F153-F768 AromaticContact CD2-CD2 3.49Å; F153-F768 HydrophobicContact CD2-CD2 3.49Å; F153-F768 VanDerWaalsContact CD2-CD2 3.49Å; F153-F768 HydrophobicContact CD2-CE1 4.06Å; F153-F768 AromaticContact CD2-CE2 3.64Å; F153-F768 HydrophobicContact CD2-CE2 3.64Å; F153-F768 AromaticContact CD2-CG 3.66Å; F153-F768 HydrophobicContact CD2-CG 3.66Å; F153-F768 AromaticContact CD2-CZ 3.92Å; F153-F768 HydrophobicContact CD2-CZ 3.92Å; F153-F768 HydrophobicContact CE2-CB 4.2Å; F153-F768 AromaticContact CE2-CD2 3.62Å; F153-F768 HydrophobicContact CE2-CD2 3.62Å; F153-F768 HydrophobicContact CE2-CE2 4.14Å; F153-F768 AromaticContact CE2-CG 3.88Å; F153-F768 HydrophobicContact CE2-CG 3.88Å; R158-F768 HydrophobicContact CB-CE2 4.43Å; V159-F768 HydrophobicContact CG2-CD2 4.06Å; V159-F768 HydrophobicContact CG2-CE2 3.72Å; V176-F768 HydrophobicContact CG1-CB 4.38Å; V176-F768 HydrophobicContact CG2-CB 4.23Å; F766-F768 PolarHBondContact O-N 3.46Å; F768-R770 VanDerWaalsContact C-N 3.31Å; F768-R770 PolarHBondContact O-N 3.06Å; F768-H864 AromaticContact CD1-CD2 3.57Å; F768-H864 AromaticContact CD1-NE2 3.53Å
769	G	76.1	Confident	84.1	Confident	12 Å²	12	24.3 Å²	24.3	12%	0.124	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	73.4	17.4	-179.9	0	0	0	0	0	114.5	F766 P767 P771 H864	F766-G769 PolarHBondContact O-N 2.86Å; P767-G769 PolarHBondContact O-N 3.37Å; G769-P771 CarbonylContact O-C 3.57Å; G769-H864 WeakPolarHBondContact CA-O 3.28Å
770	R	79.6	Confident	84	Confident	7 Å²	7	27 Å²	27	3%	0.026	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.4	142	-177.2	-60.9	-68.5	169.2	-169.1	-16.5	112	M162 D172 V176 F766 P767 F768 E772	M162-R770 HydrophobicContact SD-CB 4.05Å; D172-R770 HydrophobicContact CB-CG 4.45Å; D172-R770 WeakPolarHBondContact OD1-CD 3.08Å; D172-R770 IonicContact OD1-NH1 3.22Å; V176-R770 HydrophobicContact CG2-CG 3.88Å; F766-R770 CarbonylContact C-O 3.32Å; F766-R770 VanDerWaalsContact CA-O 3.22Å; F766-R770 WeakPolarHBondContact CA-O 3.26Å; P767-R770 PolarHBondContact O-N 3.04Å; P767-R770 VanDerWaalsContact O-N 3.14Å; F768-R770 VanDerWaalsContact C-N 3.31Å; F768-R770 PolarHBondContact O-N 3.06Å; R770-E772 IonicContact CZ-OE2 2.81Å; R770-E772 IonicContact NH1-OE2 2.76Å; R770-E772 PolarHBondContact NH1-OE2 3.34Å; R770-E772 IonicContact NH2-OE2 3.66Å; R770-E772 PolarHBondContact NH2-OE2 2.54Å
771	P	75.6	Confident	83.9	Confident	15 Å²	15	26.8 Å²	26.8	10%	0.097	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	cis	-63.2	151.7	-6.3	-20	33.2	0	0	0	112.9	L666 V708 G769 G773 A774	L666-P771 HydrophobicContact CD1-CB 3.92Å; L666-P771 HydrophobicContact CD1-CG 3.88Å; L666-P771 HydrophobicContact CD2-CG 4.22Å; V708-P771 HydrophobicContact CG1-CG 3.79Å; G769-P771 CarbonylContact O-C 3.57Å; P771-G773 PolarHBondContact O-N 3.15Å; P771-A774 HydrophobicContact CB-CB 4.24Å; P771-A774 WeakPolarHBondContact O-CB 3.41Å; P771-A774 PolarHBondContact O-N 3.38Å
772	E	75	Confident	83.9	Confident	134 Å²	134	24.7 Å²	24.7	63%	0.626	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	129.2	-169.2	-161.2	167.9	124.6	0	0	112.3	R770 A774	R770-E772 IonicContact CZ-OE2 2.81Å; R770-E772 IonicContact NH1-OE2 2.76Å; R770-E772 PolarHBondContact NH1-OE2 3.34Å; R770-E772 IonicContact NH2-OE2 3.66Å; R770-E772 PolarHBondContact NH2-OE2 2.54Å; E772-A774 PolarHBondContact O-N 3.02Å; E772-A774 VanDerWaalsContact O-N 3.15Å
773	G	77.8	Confident	83.9	Confident	43 Å²	43	28.6 Å²	28.6	44%	0.443	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	71.7	-3.9	-177.7	0	0	0	0	0	115.3	P771 L775 K776 A777	P771-G773 PolarHBondContact O-N 3.15Å; G773-L775 PolarHBondContact O-N 2.74Å; G773-K776 WeakPolarHBondContact O-CA 3.43Å; G773-K776 WeakPolarHBondContact O-CB 3.05Å; G773-K776 PolarHBondContact O-N 3.25Å; G773-A777 PolarHBondContact O-N 3.13Å
774	A	83	Confident	83.9	Confident	3 Å²	3	31.6 Å²	31.6	3%	0.025	17%	0.172	C	C	.	.	H	α-helix	trans	-56.7	-49.5	-175.8	0	0	0	0	0	112.3	P711 F766 P771 E772 K776 A777 T778	P711-A774 HydrophobicContact CG-CB 4.12Å; F766-A774 HydrophobicContact CD1-CB 3.69Å; F766-A774 HydrophobicContact CE1-CB 3.8Å; P771-A774 HydrophobicContact CB-CB 4.24Å; P771-A774 WeakPolarHBondContact O-CB 3.41Å; P771-A774 PolarHBondContact O-N 3.38Å; E772-A774 PolarHBondContact O-N 3.02Å; E772-A774 VanDerWaalsContact O-N 3.15Å; A774-K776 PolarHBondContact O-N 3.05Å; A774-A777 CarbonylContact O-C 3.59Å; A774-A777 WeakPolarHBondContact O-CA 3.27Å; A774-A777 WeakPolarHBondContact O-CB 3.2Å; A774-A777 PolarHBondContact O-N 3.39Å; A774-T778 PolarHBondContact O-N 3.26Å; A774-T778 PolarHBondContact O-OG1 3.47Å
775	L	86.6	Confident	84.1	Confident	8 Å²	8	28.9 Å²	28.9	4%	0.042	16%	0.162	C	C	.	.	H	α-helix	trans	-57.8	-32.4	176.8	179	60.3	0	0	0	113	F762 F766 G773 T778 L779 H865 A871 F872	F762-L775 HydrophobicContact CB-CD1 4.18Å; F762-L775 HydrophobicContact CB-CD2 4.19Å; F766-L775 HydrophobicContact CB-CB 4.32Å; F766-L775 HydrophobicContact CD1-CB 4.48Å; F766-L775 HydrophobicContact CD2-CB 3.86Å; F766-L775 HydrophobicContact CD2-CD1 3.69Å; F766-L775 HydrophobicContact CD2-CG 4.24Å; F766-L775 HydrophobicContact CE2-CB 4.33Å; F766-L775 HydrophobicContact CE2-CD1 3.76Å; F766-L775 HydrophobicContact CG-CB 3.95Å; G773-L775 PolarHBondContact O-N 2.74Å; L775-T778 WeakPolarHBondContact O-CB 3.48Å; L775-T778 PolarHBondContact O-N 3.37Å; L775-L779 WeakPolarHBondContact O-CG 3.49Å; L775-L779 PolarHBondContact O-N 3.17Å; L775-H865 HydrophobicContact CD2-CB 4.29Å; L775-A871 HydrophobicContact CB-CB 4.04Å; L775-A871 HydrophobicContact CD2-CB 3.83Å; L775-A871 HydrophobicContact CG-CB 3.63Å; L775-F872 HydrophobicContact CD2-CD2 4.49Å; L775-F872 HydrophobicContact CD2-CE2 3.9Å; L775-F872 HydrophobicContact CD2-CZ 4.49Å
776	K	86.1	Confident	84.2	Confident	74 Å²	74	29 Å²	29	32%	0.322	16%	0.159	S	C	.	.	H	α-helix	trans	-72.5	-40.1	176.1	-171.2	178.4	-173.7	172.8	0	111.6	G773 A774 T778 L779 S780 R869 A871	G773-K776 WeakPolarHBondContact O-CA 3.43Å; G773-K776 WeakPolarHBondContact O-CB 3.05Å; G773-K776 PolarHBondContact O-N 3.25Å; A774-K776 PolarHBondContact O-N 3.05Å; K776-T778 VanDerWaalsContact C-N 3.32Å; K776-L779 PolarHBondContact O-N 3.36Å; K776-S780 PolarHBondContact O-N 2.64Å; K776-R869 PolarHBondContact NZ-O 2.75Å; K776-A871 HydrophobicContact CB-CB 4.05Å
777	A	85.8	Confident	84.1	Confident	21 Å²	21	29.7 Å²	29.7	17%	0.174	16%	0.163	C	C	.	.	H	α-helix	trans	-64.7	-35.4	171	0	0	0	0	0	111.7	P711 G773 A774 S780 L781	P711-A777 HydrophobicContact CB-CB 3.92Å; G773-A777 PolarHBondContact O-N 3.13Å; A774-A777 CarbonylContact O-C 3.59Å; A774-A777 WeakPolarHBondContact O-CA 3.27Å; A774-A777 WeakPolarHBondContact O-CB 3.2Å; A774-A777 PolarHBondContact O-N 3.39Å; A777-S780 PolarHBondContact O-N 3.02Å; A777-L781 VanDerWaalsContact O-CB 3.23Å; A777-L781 WeakPolarHBondContact O-CB 3.36Å; A777-L781 PolarHBondContact O-N 2.68Å
778	T	89.3	Confident	83.6	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61	-44.5	171.9	-54.3	0	0	0	0	112.1	P711 L755 Q758 I759 F766 A774 L775 K776 L781 L782	P711-T778 VanDerWaalsContact CG-OG1 3.26Å; P711-T778 WeakPolarHBondContact CG-OG1 3.5Å; L755-T778 HydrophobicContact CD2-CG2 3.57Å; Q758-T778 HydrophobicContact CB-CG2 4.42Å; I759-T778 HydrophobicContact CD1-CG2 4.33Å; I759-T778 HydrophobicContact CG1-CG2 4.01Å; F766-T778 HydrophobicContact CE2-CG2 4.49Å; F766-T778 HydrophobicContact CZ-CG2 4.26Å; F766-T778 VanDerWaalsContact CZ-OG1 3.28Å; F766-T778 WeakPolarHBondContact CZ-OG1 3.23Å; A774-T778 PolarHBondContact O-N 3.26Å; A774-T778 PolarHBondContact O-OG1 3.47Å; L775-T778 WeakPolarHBondContact O-CB 3.48Å; L775-T778 PolarHBondContact O-N 3.37Å; K776-T778 VanDerWaalsContact C-N 3.32Å; T778-L781 PolarHBondContact O-N 3.16Å; T778-L782 PolarHBondContact O-N 3.47Å
779	L	88.4	Confident	83	Confident	12 Å²	12	40.2 Å²	40.2	6%	0.063	21%	0.211	C	C	.	.	H	α-helix	trans	-65.6	-43.9	175.9	-69.3	174.6	0	0	0	112.2	I759 L775 K776 L781 L782 E783 V803 A871 F872	I759-L779 HydrophobicContact CD1-CD2 3.81Å; I759-L779 HydrophobicContact CG1-CD2 4.25Å; L775-L779 WeakPolarHBondContact O-CG 3.49Å; L775-L779 PolarHBondContact O-N 3.17Å; K776-L779 PolarHBondContact O-N 3.36Å; L779-L781 VanDerWaalsContact C-N 3.32Å; L779-L781 PolarHBondContact O-N 3.27Å; L779-L782 WeakPolarHBondContact O-CB 3.01Å; L779-L782 PolarHBondContact O-N 3.41Å; L779-E783 PolarHBondContact O-N 3.46Å; L779-V803 HydrophobicContact CD2-CG1 4.25Å; L779-V803 HydrophobicContact CD2-CG2 3.79Å; L779-A871 HydrophobicContact CD1-CB 4.02Å; L779-F872 HydrophobicContact CD1-CD1 4.22Å; L779-F872 HydrophobicContact CD1-CE1 3.97Å; L779-F872 HydrophobicContact CD2-CE1 4.47Å
780	S	87.9	Confident	82.6	Confident	56 Å²	56	41.7 Å²	41.7	39%	0.392	22%	0.215	S	C	.	.	H	α-helix	trans	-66.7	-32.7	176.7	-173.7	0	0	0	0	112.6	K776 A777 R784	K776-S780 PolarHBondContact O-N 2.64Å; A777-S780 PolarHBondContact O-N 3.02Å; S780-R784 PolarHBondContact O-N 2.92Å
781	L	89.6	Confident	81.7	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-69.2	-40.8	171.3	-179.1	51.8	0	0	0	111.7	L714 H715 F718 L751 L755 A777 T778 L779 R784 V785	L714-L781 HydrophobicContact CB-CD2 3.64Å; H715-L781 HydrophobicContact CB-CB 4.34Å; H715-L781 HydrophobicContact CB-CD1 3.95Å; H715-L781 HydrophobicContact CB-CD2 4.34Å; H715-L781 HydrophobicContact CB-CG 4.44Å; F718-L781 HydrophobicContact CB-CD1 4.22Å; F718-L781 HydrophobicContact CD1-CD1 4.16Å; F718-L781 HydrophobicContact CG-CD1 4.35Å; L751-L781 HydrophobicContact CD1-CD2 4.48Å; L751-L781 HydrophobicContact CD2-CD1 4.43Å; L751-L781 HydrophobicContact CD2-CD2 4.5Å; L755-L781 HydrophobicContact CD1-CD2 4.38Å; L755-L781 HydrophobicContact CD1-CG 3.91Å; L755-L781 HydrophobicContact CD2-CD2 4.1Å; L755-L781 HydrophobicContact CD2-CG 4.32Å; A777-L781 VanDerWaalsContact O-CB 3.23Å; A777-L781 WeakPolarHBondContact O-CB 3.36Å; A777-L781 PolarHBondContact O-N 2.68Å; T778-L781 PolarHBondContact O-N 3.16Å; L779-L781 VanDerWaalsContact C-N 3.32Å; L779-L781 PolarHBondContact O-N 3.27Å; L781-R784 PolarHBondContact O-N 3.28Å; L781-V785 HydrophobicContact CD1-CG2 3.94Å; L781-V785 HydrophobicContact CG-CG2 4.3Å; L781-V785 WeakPolarHBondContact O-CB 3.47Å; L781-V785 VanDerWaalsContact O-CG2 3.28Å; L781-V785 WeakPolarHBondContact O-CG2 3.29Å; L781-V785 PolarHBondContact O-N 3.06Å
782	L	89.9	Confident	81.5	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.6	-47	174.6	-180	66.5	0	0	0	111.4	L755 I759 T778 L779 R784 V785 L786 V802 V803	L755-L782 HydrophobicContact CB-CD1 4.2Å; L755-L782 HydrophobicContact CD1-CB 4.35Å; L755-L782 HydrophobicContact CD1-CD1 4.43Å; I759-L782 HydrophobicContact CD1-CB 4.49Å; I759-L782 HydrophobicContact CD1-CD2 3.66Å; T778-L782 PolarHBondContact O-N 3.47Å; L779-L782 WeakPolarHBondContact O-CB 3.01Å; L779-L782 PolarHBondContact O-N 3.41Å; L782-R784 VanDerWaalsContact C-N 3.29Å; L782-R784 PolarHBondContact O-N 2.86Å; L782-V785 PolarHBondContact O-N 3.19Å; L782-L786 HydrophobicContact CD1-CD1 4.09Å; L782-L786 HydrophobicContact CD1-CG 4.12Å; L782-L786 HydrophobicContact CG-CD1 3.89Å; L782-L786 HydrophobicContact CG-CG 4.34Å; L782-L786 VanDerWaalsContact O-CG 3.27Å; L782-L786 WeakPolarHBondContact O-CG 3.28Å; L782-L786 PolarHBondContact O-N 3.09Å; L782-V802 HydrophobicContact CD2-CG1 4.04Å; L782-V803 HydrophobicContact CD2-CG2 4Å
783	E	87.5	Confident	81.3	Confident	82 Å²	82	46.5 Å²	46.5	38%	0.383	26%	0.264	S	S	.	.	H	α-helix	trans	-51.2	-49.2	173	175.2	180	-168.7	0	0	111.2	L779 V785 L786 M787 I794 V799	L779-E783 PolarHBondContact O-N 3.46Å; E783-V785 PolarHBondContact O-N 3.4Å; E783-L786 PolarHBondContact O-N 3.44Å; E783-M787 WeakPolarHBondContact O-CG 3.41Å; E783-M787 PolarHBondContact O-N 2.88Å; E783-I794 HydrophobicContact CG-CG2 3.93Å; E783-V799 HydrophobicContact CB-CG1 4.32Å; E783-V799 HydrophobicContact CB-CG2 4.23Å; E783-V799 HydrophobicContact CG-CG2 4.17Å
784	R	86.4	Confident	81.3	Confident	75 Å²	75	45.5 Å²	45.5	28%	0.283	25%	0.249	S	C	.	.	H	α-helix	trans	-70.4	-29.7	-179.4	-163.7	170.1	-172.1	81.1	-0.4	114.1	H715 F718 S780 L781 L782 M787	H715-R784 WeakPolarHBondContact NE2-CD 3.48Å; F718-R784 HydrophobicContact CE1-CG 4.45Å; S780-R784 PolarHBondContact O-N 2.92Å; L781-R784 PolarHBondContact O-N 3.28Å; L782-R784 VanDerWaalsContact C-N 3.29Å; L782-R784 PolarHBondContact O-N 2.86Å; R784-M787 HydrophobicContact CG-SD 4.13Å
785	V	88.5	Confident	81.3	Confident	3 Å²	3	49 Å²	49	2%	0.018	27%	0.271	C	S	.	.	H	α-helix	trans	-73.2	-35.3	175.2	166.8	0	0	0	0	111.4	F718 K748 L751 L755 L781 L782 E783 M787	F718-V785 HydrophobicContact CD1-CG2 4.01Å; F718-V785 HydrophobicContact CD2-CG2 4.37Å; F718-V785 HydrophobicContact CE1-CB 4.37Å; F718-V785 HydrophobicContact CE1-CG2 3.71Å; F718-V785 HydrophobicContact CE2-CG2 4.09Å; F718-V785 HydrophobicContact CG-CG2 4.34Å; F718-V785 HydrophobicContact CZ-CB 4.3Å; F718-V785 HydrophobicContact CZ-CG2 3.76Å; K748-V785 WeakPolarHBondContact CE-O 3.49Å; K748-V785 HydrophobicContact CG-CG1 4.15Å; L751-V785 HydrophobicContact CD2-CG2 3.7Å; L751-V785 HydrophobicContact CG-CG2 4.08Å; L755-V785 HydrophobicContact CD1-CB 4.43Å; L755-V785 HydrophobicContact CD1-CG2 4.02Å; L781-V785 HydrophobicContact CD1-CG2 3.94Å; L781-V785 HydrophobicContact CG-CG2 4.3Å; L781-V785 WeakPolarHBondContact O-CB 3.47Å; L781-V785 VanDerWaalsContact O-CG2 3.28Å; L781-V785 WeakPolarHBondContact O-CG2 3.29Å; L781-V785 PolarHBondContact O-N 3.06Å; L782-V785 PolarHBondContact O-N 3.19Å; E783-V785 PolarHBondContact O-N 3.4Å; V785-M787 VanDerWaalsContact C-N 3.27Å; V785-M787 PolarHBondContact O-N 3.36Å
786	L	85.8	Confident	81	Confident	46 Å²	46	51.2 Å²	51.2	24%	0.241	29%	0.29	C	S	.	.	H	α-helix	trans	-73.7	-14.8	177.6	-66.2	170.8	0	0	0	113.4	L782 E783 I794 V799 V802	L782-L786 HydrophobicContact CD1-CD1 4.09Å; L782-L786 HydrophobicContact CD1-CG 4.12Å; L782-L786 HydrophobicContact CG-CD1 3.89Å; L782-L786 HydrophobicContact CG-CG 4.34Å; L782-L786 VanDerWaalsContact O-CG 3.27Å; L782-L786 WeakPolarHBondContact O-CG 3.28Å; L782-L786 PolarHBondContact O-N 3.09Å; E783-L786 PolarHBondContact O-N 3.44Å; L786-I794 HydrophobicContact CB-CD1 3.51Å; L786-I794 HydrophobicContact CD1-CD1 4.42Å; L786-V799 HydrophobicContact CD1-CG2 4.36Å; L786-V802 HydrophobicContact CD1-CB 4.34Å; L786-V802 HydrophobicContact CD1-CG2 3.98Å; L786-V802 HydrophobicContact CD2-CG2 4.45Å
787	M	83.1	Confident	80.9	Confident	23 Å²	23	52.9 Å²	52.9	11%	0.113	30%	0.299	C	S	.	.			trans	-60.3	140.3	174.5	-65.1	178	80.6	0	0	112.4	K748 E783 R784 V785 D789 T792 I794	K748-M787 PolarHBondContact NZ-O 3.38Å; E783-M787 WeakPolarHBondContact O-CG 3.41Å; E783-M787 PolarHBondContact O-N 2.88Å; R784-M787 HydrophobicContact CG-SD 4.13Å; V785-M787 VanDerWaalsContact C-N 3.27Å; V785-M787 PolarHBondContact O-N 3.36Å; M787-D789 WeakPolarHBondContact CB-O 3.48Å; M787-D789 WeakPolarHBondContact CE-O 3.42Å; M787-T792 WeakPolarHBondContact CE-O 3.28Å; M787-I794 HydrophobicContact CG-CG2 4.36Å
788	K	73	Confident	80.9	Confident	176 Å²	176	56.6 Å²	56.6	77%	0.765	31%	0.313	S	S	*	.	S	Bend	trans	-83.6	-34.7	176.2	-68.6	177.5	-177.3	166.6	0	112.7
789	D	67.1	Low	80.8	Confident	55 Å²	55	56.8 Å²	56.8	29%	0.294	31%	0.314	S	S	.	.	S	Bend	trans	-146.4	-179.3	174.7	69.2	73.8	0	0	0	108.9	M787 A791 T792	M787-D789 WeakPolarHBondContact CB-O 3.48Å; M787-D789 WeakPolarHBondContact CE-O 3.42Å; D789-A791 WeakPolarHBondContact OD1-CA 3.45Å; D789-A791 WeakPolarHBondContact OD1-CB 3.5Å; D789-A791 PolarHBondContact OD1-N 3.4Å; D789-T792 PolarHBondContact OD1-N 3Å; D789-T792 PolarHBondContact OD1-OG1 2.8Å; D789-T792 WeakPolarHBondContact OD2-CB 3.48Å; D789-T792 PolarHBondContact OD2-OG1 2.82Å
790	I	67.7	Low	80.7	Confident	42 Å²	42	57.5 Å²	57.5	22%	0.215	32%	0.317	C	S	.	.	S	Bend	trans	-89.9	-18.5	-177.9	-82.3	170.2	0	0	0	114.2	A722 S723 H726 N728	A722-I790 HydrophobicContact CB-CD1 3.89Å; A722-I790 HydrophobicContact CB-CG1 4.49Å; A722-I790 WeakPolarHBondContact O-CD1 3.28Å; S723-I790 VanDerWaalsContact CA-CD1 3.47Å; S723-I790 VanDerWaalsContact N-CD1 3.33Å; H726-I790 HydrophobicContact CB-CD1 4.42Å; N728-I790 HydrophobicContact CB-CG2 4.18Å; N728-I790 WeakPolarHBondContact ND2-CG2 2.95Å
791	A	61.3	Low	80.8	Confident	77 Å²	77	62 Å²	62	64%	0.636	33%	0.329	S	S	*	.	S	Bend	trans	-86.9	-27.9	-178.6	0	0	0	0	0	112.7	D789 P793	D789-A791 WeakPolarHBondContact OD1-CA 3.45Å; D789-A791 WeakPolarHBondContact OD1-CB 3.5Å; D789-A791 PolarHBondContact OD1-N 3.4Å; A791-P793 WeakPolarHBondContact O-CD 3.4Å
792	T	71	Confident	80.8	Confident	82 Å²	82	63.3 Å²	63.3	50%	0.503	34%	0.337	S	S	.	.	S	Bend	trans	-98.6	98.3	-178.1	-46.6	0	0	0	0	110.7	M787 D789	M787-T792 WeakPolarHBondContact CE-O 3.28Å; D789-T792 PolarHBondContact OD1-N 3Å; D789-T792 PolarHBondContact OD1-OG1 2.8Å; D789-T792 WeakPolarHBondContact OD2-CB 3.48Å; D789-T792 PolarHBondContact OD2-OG1 2.82Å
793	P	71.6	Confident	80.8	Confident	98 Å²	98	63.3 Å²	63.3	64%	0.636	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-62.2	138.7	171.1	27.4	-34.3	0	0	0	110.6	A791	A791-P793 WeakPolarHBondContact O-CD 3.4Å
794	I	78.2	Confident	81	Confident	23 Å²	23	62.8 Å²	62.8	12%	0.118	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-70.6	140.2	176.5	-173.5	169.5	0	0	0	110.1	E783 L786 M787 A796 E798 V799	E783-I794 HydrophobicContact CG-CG2 3.93Å; L786-I794 HydrophobicContact CB-CD1 3.51Å; L786-I794 HydrophobicContact CD1-CD1 4.42Å; M787-I794 HydrophobicContact CG-CG2 4.36Å; I794-A796 PolarHBondContact O-N 2.88Å; I794-E798 HydrophobicContact CD1-CB 3.9Å; I794-E798 HydrophobicContact CG1-CB 3.93Å; I794-V799 HydrophobicContact CD1-CG2 4.17Å; I794-V799 HydrophobicContact CG1-CG2 4.35Å; I794-V799 HydrophobicContact CG2-CG2 3.58Å
795	P	82.3	Confident	81.2	Confident	75 Å²	75	64.1 Å²	64.1	49%	0.487	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-60.6	132	173.5	-22.8	34.1	0	0	0	111	E797 E798	P795-E797 PolarHBondContact O-N 2.83Å; P795-E798 HydrophobicContact CB-CG 4.39Å; P795-E798 HydrophobicContact CG-CG 4.5Å; P795-E798 WeakPolarHBondContact O-CB 3.25Å; P795-E798 PolarHBondContact O-N 3.27Å
796	A	80.6	Confident	81.4	Confident	55 Å²	55	64 Å²	64	46%	0.455	34%	0.339	S	S	.	.	H	α-helix	trans	-54.6	-32.8	-177	0	0	0	0	0	113.4	I794 E798 V799 K800	I794-A796 PolarHBondContact O-N 2.88Å; A796-E798 VanDerWaalsContact C-N 3.32Å; A796-E798 PolarHBondContact O-N 3.43Å; A796-V799 PolarHBondContact O-N 2.9Å; A796-K800 WeakPolarHBondContact O-CG 3.25Å; A796-K800 PolarHBondContact O-N 3.4Å
797	E	84.3	Confident	81.7	Confident	109 Å²	109	62 Å²	62	51%	0.509	33%	0.328	S	S	.	.	H	α-helix	trans	-67.6	-25	176.7	-67.7	-59.3	137.3	0	0	113.9	P795 K800 K801	P795-E797 PolarHBondContact O-N 2.83Å; E797-K800 WeakPolarHBondContact OE1-CD 3.27Å; E797-K800 VanDerWaalsContact OE1-CE 3.22Å; E797-K800 WeakPolarHBondContact OE1-CE 3.48Å; E797-K800 IonicContact OE1-NZ 2.68Å; E797-K800 PolarHBondContact OE1-NZ 3.26Å; E797-K801 VanDerWaalsContact O-CB 3.29Å; E797-K801 WeakPolarHBondContact O-CB 3.32Å; E797-K801 PolarHBondContact O-N 3.01Å
798	E	85.8	Confident	82.1	Confident	100 Å²	100	64.6 Å²	64.6	47%	0.467	34%	0.34	S	S	.	.	H	α-helix	trans	-71.5	-40.4	171	-66.6	-171.7	-171.4	0	0	111	I794 P795 A796 K801 V802	I794-E798 HydrophobicContact CD1-CB 3.9Å; I794-E798 HydrophobicContact CG1-CB 3.93Å; P795-E798 HydrophobicContact CB-CG 4.39Å; P795-E798 HydrophobicContact CG-CG 4.5Å; P795-E798 WeakPolarHBondContact O-CB 3.25Å; P795-E798 PolarHBondContact O-N 3.27Å; A796-E798 VanDerWaalsContact C-N 3.32Å; A796-E798 PolarHBondContact O-N 3.43Å; E798-K801 WeakPolarHBondContact O-CB 3.22Å; E798-K801 PolarHBondContact O-N 3.45Å; E798-V802 PolarHBondContact O-N 3.4Å
799	V	85.9	Confident	83	Confident	3 Å²	3	59.8 Å²	59.8	2%	0.018	32%	0.319	C	S	.	.	H	α-helix	trans	-65.7	-48.7	174.4	-173.6	0	0	0	0	110.4	E783 L786 I794 A796 K801 V802 V803 W875	E783-V799 HydrophobicContact CB-CG1 4.32Å; E783-V799 HydrophobicContact CB-CG2 4.23Å; E783-V799 HydrophobicContact CG-CG2 4.17Å; L786-V799 HydrophobicContact CD1-CG2 4.36Å; I794-V799 HydrophobicContact CD1-CG2 4.17Å; I794-V799 HydrophobicContact CG1-CG2 4.35Å; I794-V799 HydrophobicContact CG2-CG2 3.58Å; A796-V799 PolarHBondContact O-N 2.9Å; V799-K801 PolarHBondContact O-N 3.22Å; V799-V802 PolarHBondContact O-N 3.07Å; V799-V803 HydrophobicContact CG1-CG2 4.36Å; V799-V803 WeakPolarHBondContact O-CG2 3.39Å; V799-V803 PolarHBondContact O-N 3.4Å; V799-W875 HydrophobicContact CG1-CH2 3.95Å
800	K	87.1	Confident	84.2	Confident	28 Å²	28	57.1 Å²	57.1	12%	0.122	31%	0.305	C	S	.	.	H	α-helix	trans	-53.8	-39.8	173.4	-74	-162.5	-171.7	174.7	0	112	A796 E797 V802 V803 R804 W875 D877 L878	A796-K800 WeakPolarHBondContact O-CG 3.25Å; A796-K800 PolarHBondContact O-N 3.4Å; E797-K800 WeakPolarHBondContact OE1-CD 3.27Å; E797-K800 VanDerWaalsContact OE1-CE 3.22Å; E797-K800 WeakPolarHBondContact OE1-CE 3.48Å; E797-K800 IonicContact OE1-NZ 2.68Å; E797-K800 PolarHBondContact OE1-NZ 3.26Å; K800-V802 VanDerWaalsContact C-N 3.33Å; K800-V802 PolarHBondContact O-N 2.71Å; K800-V803 PolarHBondContact O-N 3.33Å; K800-R804 WeakPolarHBondContact O-CB 3.42Å; K800-R804 PolarHBondContact O-N 2.96Å; K800-W875 VanDerWaalsContact CE-CD1 3.44Å; K800-W875 HydrophobicContact CG-CD2 4.17Å; K800-W875 HydrophobicContact CG-CG 4.47Å; K800-W875 HydrophobicContact CG-CZ2 4.28Å; K800-D877 IonicContact NZ-OD2 2.62Å; K800-D877 PolarHBondContact NZ-OD2 3.43Å; K800-L878 HydrophobicContact CB-CD1 4.15Å; K800-L878 HydrophobicContact CD-CD1 4.41Å; K800-L878 HydrophobicContact CG-CD1 4.05Å
801	K	89.6	Confident	85.3	Confident	149 Å²	149	55.2 Å²	55.2	65%	0.648	30%	0.295	S	S	*	.	H	α-helix	trans	-63.2	-36.4	178.6	-177.8	178.7	178	-178.4	0	112.8	E797 E798 V799 K805	E797-K801 VanDerWaalsContact O-CB 3.29Å; E797-K801 WeakPolarHBondContact O-CB 3.32Å; E797-K801 PolarHBondContact O-N 3.01Å; E798-K801 WeakPolarHBondContact O-CB 3.22Å; E798-K801 PolarHBondContact O-N 3.45Å; V799-K801 PolarHBondContact O-N 3.22Å; K801-K805 PolarHBondContact O-N 2.78Å
802	V	90.1	Very high	86.7	Confident	28 Å²	28	56 Å²	56	17%	0.17	29%	0.288	C	S	.	.	H	α-helix	trans	-71.6	-46.2	172.9	-179.5	0	0	0	0	110.5	E756 L782 L786 E798 V799 K800 R804 K805 C806	E756-V802 HydrophobicContact CG-CG1 4.09Å; L782-V802 HydrophobicContact CD2-CG1 4.04Å; L786-V802 HydrophobicContact CD1-CB 4.34Å; L786-V802 HydrophobicContact CD1-CG2 3.98Å; L786-V802 HydrophobicContact CD2-CG2 4.45Å; E798-V802 PolarHBondContact O-N 3.4Å; V799-V802 PolarHBondContact O-N 3.07Å; K800-V802 VanDerWaalsContact C-N 3.33Å; K800-V802 PolarHBondContact O-N 2.71Å; V802-R804 PolarHBondContact O-N 3.21Å; V802-K805 WeakPolarHBondContact O-CB 3.34Å; V802-K805 PolarHBondContact O-N 2.93Å; V802-C806 PolarHBondContact O-N 3.38Å; V802-C806 PolarHBondContact O-SG 3.44Å; V802-C806 VanDerWaalsContact O-SG 3.37Å
803	V	89.9	Confident	87.6	Confident	0 Å²	0	54 Å²	54	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-62.2	-43.3	179.9	176.5	0	0	0	0	111.7	L779 L782 V799 K800 K805 C806 L807 F872 W875 L878	L779-V803 HydrophobicContact CD2-CG1 4.25Å; L779-V803 HydrophobicContact CD2-CG2 3.79Å; L782-V803 HydrophobicContact CD2-CG2 4Å; V799-V803 HydrophobicContact CG1-CG2 4.36Å; V799-V803 WeakPolarHBondContact O-CG2 3.39Å; V799-V803 PolarHBondContact O-N 3.4Å; K800-V803 PolarHBondContact O-N 3.33Å; V803-K805 PolarHBondContact O-N 2.99Å; V803-C806 CarbonylContact O-C 3.59Å; V803-C806 WeakPolarHBondContact O-CB 3.27Å; V803-C806 PolarHBondContact O-N 2.86Å; V803-C806 VanDerWaalsContact O-N 3.09Å; V803-L807 HydrophobicContact CG1-CD1 3.95Å; V803-L807 HydrophobicContact CG1-CG 4.38Å; V803-L807 WeakPolarHBondContact O-CG 3.44Å; V803-L807 PolarHBondContact O-N 2.69Å; V803-F872 HydrophobicContact CG1-CE1 4.01Å; V803-W875 HydrophobicContact CG2-CZ3 4.14Å; V803-L878 HydrophobicContact CB-CD1 4.2Å; V803-L878 HydrophobicContact CG1-CD1 3.91Å
804	R	90.8	Very high	88.5	Confident	71 Å²	71	49.4 Å²	49.4	27%	0.268	25%	0.245	S	C	.	.	H	α-helix	trans	-51.2	-52.3	171.4	176.5	-178.7	-78	124.2	-2.8	111.4	K800 V802 C806 L807 E808 L878 E881	K800-R804 WeakPolarHBondContact O-CB 3.42Å; K800-R804 PolarHBondContact O-N 2.96Å; V802-R804 PolarHBondContact O-N 3.21Å; R804-C806 VanDerWaalsContact C-N 3.28Å; R804-C806 PolarHBondContact O-N 3.37Å; R804-L807 CarbonylContact O-C 3.2Å; R804-L807 PolarHBondContact O-N 3.42Å; R804-L807 VanDerWaalsContact O-N 3.09Å; R804-E808 WeakPolarHBondContact O-CG 3.29Å; R804-E808 PolarHBondContact O-N 3.24Å; R804-L878 HydrophobicContact CB-CD2 4.02Å; R804-E881 WeakPolarHBondContact CD-OE2 3.22Å; R804-E881 WeakPolarHBondContact CG-OE2 3.46Å; R804-E881 IonicContact CZ-OE1 2.91Å; R804-E881 IonicContact CZ-OE2 3.93Å; R804-E881 IonicContact NE-OE1 3.77Å; R804-E881 PolarHBondContact NE-OE1 3.01Å; R804-E881 IonicContact NE-OE2 3.96Å; R804-E881 PolarHBondContact NE-OE2 3.48Å; R804-E881 IonicContact NH2-OE1 3.25Å; R804-E881 PolarHBondContact NH2-OE1 3.32Å; R804-E881 IonicContact NH2-OE2 2.92Å
805	K	92.1	Very high	89.1	Confident	104 Å²	104	49 Å²	49	45%	0.452	24%	0.242	S	C	.	.	H	α-helix	trans	-62	-33.5	178.1	-176.9	-167.8	171.4	-152.2	0	112.5	E756 K801 V802 V803 K809	E756-K805 IonicContact OE1-NZ 2.78Å; E756-K805 IonicContact OE2-NZ 2.73Å; K801-K805 PolarHBondContact O-N 2.78Å; V802-K805 WeakPolarHBondContact O-CB 3.34Å; V802-K805 PolarHBondContact O-N 2.93Å; V803-K805 PolarHBondContact O-N 2.99Å; K805-K809 WeakPolarHBondContact O-CG 3.27Å; K805-K809 PolarHBondContact O-N 2.86Å
806	C	92.7	Very high	89.4	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-72	-37.1	173.1	-65.1	0	0	0	0	112.3	I759 V802 V803 R804 K809 A810	I759-C806 HydrophobicContact CB-CB 4.13Å; I759-C806 HydrophobicContact CG2-CB 3.65Å; V802-C806 PolarHBondContact O-N 3.38Å; V802-C806 PolarHBondContact O-SG 3.44Å; V802-C806 VanDerWaalsContact O-SG 3.37Å; V803-C806 CarbonylContact O-C 3.59Å; V803-C806 WeakPolarHBondContact O-CB 3.27Å; V803-C806 PolarHBondContact O-N 2.86Å; V803-C806 VanDerWaalsContact O-N 3.09Å; R804-C806 VanDerWaalsContact C-N 3.28Å; R804-C806 PolarHBondContact O-N 3.37Å; C806-K809 WeakPolarHBondContact O-CB 3.47Å; C806-K809 PolarHBondContact O-N 3.12Å; C806-A810 WeakPolarHBondContact O-CB 3.24Å; C806-A810 PolarHBondContact O-N 3.08Å
807	L	91.2	Very high	89.6	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.016	23%	0.23	C	C	.	.	H	α-helix	trans	-71	-36.2	175.5	-71.9	171.1	0	0	0	112.3	F762 V803 R804 K809 A810 A811 F872 L878 H882	F762-L807 HydrophobicContact CD1-CD2 4.39Å; F762-L807 HydrophobicContact CE1-CD2 4.06Å; V803-L807 HydrophobicContact CG1-CD1 3.95Å; V803-L807 HydrophobicContact CG1-CG 4.38Å; V803-L807 WeakPolarHBondContact O-CG 3.44Å; V803-L807 PolarHBondContact O-N 2.69Å; R804-L807 CarbonylContact O-C 3.2Å; R804-L807 PolarHBondContact O-N 3.42Å; R804-L807 VanDerWaalsContact O-N 3.09Å; L807-K809 VanDerWaalsContact C-N 3.33Å; L807-K809 PolarHBondContact O-N 3.09Å; L807-A810 CarbonylContact O-C 3.56Å; L807-A810 PolarHBondContact O-N 3.26Å; L807-A810 VanDerWaalsContact O-N 3.08Å; L807-A811 PolarHBondContact O-N 3.42Å; L807-F872 HydrophobicContact CD1-CE1 4.13Å; L807-F872 HydrophobicContact CD1-CZ 4.45Å; L807-F872 HydrophobicContact CD2-CE1 4.44Å; L807-F872 HydrophobicContact CD2-CE2 4.44Å; L807-F872 HydrophobicContact CD2-CZ 3.94Å; L807-L878 HydrophobicContact CD1-CB 3.84Å; L807-H882 HydrophobicContact CB-CB 4.29Å; L807-H882 HydrophobicContact CD2-CB 4.48Å; L807-H882 PolarHBondContact O-CD2 3.21Å
808	E	91.4	Very high	89.7	Confident	78 Å²	78	45.3 Å²	45.3	36%	0.364	21%	0.209	S	C	.	.	H	α-helix	trans	-58.7	-43.2	170.4	-72	-177.7	119.8	0	0	111.7	R804 L812 K885	R804-E808 WeakPolarHBondContact O-CG 3.29Å; R804-E808 PolarHBondContact O-N 3.24Å; E808-L812 PolarHBondContact O-N 3.35Å; E808-K885 HydrophobicContact CG-CD 4.25Å; E808-K885 HydrophobicContact CG-CG 4.36Å; E808-K885 VanDerWaalsContact OE1-CE 3.29Å; E808-K885 WeakPolarHBondContact OE1-CE 3.45Å; E808-K885 IonicContact OE1-NZ 2.78Å; E808-K885 PolarHBondContact OE1-NZ 3.07Å
809	K	92.1	Very high	89.7	Confident	75 Å²	75	41.3 Å²	41.3	33%	0.326	19%	0.191	S	C	.	.	H	α-helix	trans	-63.3	-43.4	170.8	-64.3	166.4	-171.7	169	0	111.4	E756 S760 K805 C806 L807 A811 L812 I813	E756-K809 IonicContact OE2-NZ 3.16Å; E756-K809 PolarHBondContact OE2-NZ 3.38Å; S760-K809 WeakPolarHBondContact OG-CD 3.14Å; K805-K809 WeakPolarHBondContact O-CG 3.27Å; K805-K809 PolarHBondContact O-N 2.86Å; C806-K809 WeakPolarHBondContact O-CB 3.47Å; C806-K809 PolarHBondContact O-N 3.12Å; L807-K809 VanDerWaalsContact C-N 3.33Å; L807-K809 PolarHBondContact O-N 3.09Å; K809-A811 VanDerWaalsContact C-N 3.35Å; K809-A811 PolarHBondContact O-N 2.9Å; K809-L812 PolarHBondContact O-N 2.92Å; K809-I813 HydrophobicContact CB-CD1 4.32Å; K809-I813 WeakPolarHBondContact O-CD1 3.35Å; K809-I813 VanDerWaalsContact O-CG1 3.27Å; K809-I813 WeakPolarHBondContact O-CG1 3.41Å; K809-I813 PolarHBondContact O-N 3Å
810	A	91.9	Very high	89.6	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-65	-36.6	-177.7	0	0	0	0	0	112.4	S760 F762 C806 L807 I813 N814 H882	S760-A810 WeakPolarHBondContact O-CA 3.28Å; S760-A810 VanDerWaalsContact O-CB 3.28Å; S760-A810 WeakPolarHBondContact O-CB 3.04Å; F762-A810 HydrophobicContact CD1-CB 4.04Å; F762-A810 HydrophobicContact CE1-CB 3.82Å; C806-A810 WeakPolarHBondContact O-CB 3.24Å; C806-A810 PolarHBondContact O-N 3.08Å; L807-A810 CarbonylContact O-C 3.56Å; L807-A810 PolarHBondContact O-N 3.26Å; L807-A810 VanDerWaalsContact O-N 3.08Å; A810-I813 PolarHBondContact O-N 2.89Å; A810-N814 WeakPolarHBondContact O-CB 3.15Å; A810-N814 PolarHBondContact O-N 3.33Å; A810-N814 PolarHBondContact O-ND2 2.78Å; A810-N814 VanDerWaalsContact O-ND2 3.11Å; A810-H882 PolarHBondContact O-NE2 3.02Å
811	A	91.3	Very high	89.2	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.008	23%	0.229	C	C	.	.	H	α-helix	trans	-58	-50.3	173	0	0	0	0	0	110.6	L807 K809 N814 Y815 H882 K885 F886	L807-A811 PolarHBondContact O-N 3.42Å; K809-A811 VanDerWaalsContact C-N 3.35Å; K809-A811 PolarHBondContact O-N 2.9Å; A811-N814 PolarHBondContact O-N 2.89Å; A811-Y815 VanDerWaalsContact O-CB 3.3Å; A811-Y815 WeakPolarHBondContact O-CB 3.33Å; A811-Y815 PolarHBondContact O-N 3.4Å; A811-H882 WeakPolarHBondContact CA-NE2 3.46Å; A811-H882 PolarHBondContact N-NE2 3.49Å; A811-K885 HydrophobicContact CB-CB 3.93Å; A811-F886 HydrophobicContact CB-CB 4.19Å
812	L	91.5	Very high	88.8	Confident	93 Å²	93	44 Å²	44	49%	0.487	21%	0.205	S	C	.	.	H	α-helix	trans	-60.2	-50	175.7	-178.2	63	0	0	0	112.5	E808 K809 N814 Y815 T816 L889	E808-L812 PolarHBondContact O-N 3.35Å; K809-L812 PolarHBondContact O-N 2.92Å; L812-N814 VanDerWaalsContact C-N 3.34Å; L812-N814 PolarHBondContact O-N 3.39Å; L812-Y815 PolarHBondContact O-N 3.18Å; L812-T816 WeakPolarHBondContact O-CB 3.47Å; L812-T816 PolarHBondContact O-N 2.85Å; L812-T816 PolarHBondContact O-OG1 3.38Å; L812-T816 VanDerWaalsContact O-OG1 3.05Å; L812-L889 HydrophobicContact CB-CD1 4.26Å; L812-L889 HydrophobicContact CD1-CD1 3.97Å; L812-L889 HydrophobicContact CD1-CD2 4.21Å
813	I	90.1	Very high	88.1	Confident	40 Å²	40	49.1 Å²	49.1	21%	0.205	23%	0.225	C	C	.	.	H	α-helix	trans	-61.6	-41.6	-179.3	-66.8	158.9	0	0	0	111.6	K809 A810 R817	K809-I813 HydrophobicContact CB-CD1 4.32Å; K809-I813 WeakPolarHBondContact O-CD1 3.35Å; K809-I813 VanDerWaalsContact O-CG1 3.27Å; K809-I813 WeakPolarHBondContact O-CG1 3.41Å; K809-I813 PolarHBondContact O-N 3Å; A810-I813 PolarHBondContact O-N 2.89Å; I813-R817 WeakPolarHBondContact O-CB 3.43Å; I813-R817 WeakPolarHBondContact O-CG 3.45Å; I813-R817 PolarHBondContact O-N 3.47Å
814	N	89.3	Confident	86.9	Confident	3 Å²	3	56 Å²	56	2%	0.016	26%	0.26	C	S	.	.	H	α-helix	trans	-66.8	-44.3	177.5	-70.1	-24.7	0	0	0	111	R763 A810 A811 L812 L818 H882 F886	R763-N814 VanDerWaalsContact CD-CG 3.47Å; R763-N814 WeakPolarHBondContact CD-ND2 3.43Å; R763-N814 WeakPolarHBondContact CD-OD1 3.26Å; A810-N814 WeakPolarHBondContact O-CB 3.15Å; A810-N814 PolarHBondContact O-N 3.33Å; A810-N814 PolarHBondContact O-ND2 2.78Å; A810-N814 VanDerWaalsContact O-ND2 3.11Å; A811-N814 PolarHBondContact O-N 2.89Å; L812-N814 VanDerWaalsContact C-N 3.34Å; L812-N814 PolarHBondContact O-N 3.39Å; N814-L818 WeakPolarHBondContact O-CB 3.48Å; N814-L818 PolarHBondContact O-N 2.72Å; N814-H882 PolarHBondContact ND2-CE1 2.84Å; N814-H882 PolarHBondContact ND2-NE2 3.39Å; N814-F886 HydrophobicContact CB-CD2 4.26Å; N814-F886 HydrophobicContact CB-CE2 3.89Å
815	Y	90.9	Very high	85.5	Confident	15 Å²	15	57.8 Å²	57.8	6%	0.059	27%	0.272	C	S	.	.	H	α-helix	trans	-68.8	-47.2	-178.1	-176.6	-100.7	0	0	0	111.9	A811 L812 R817 L818 T819 F886 L889 F890 D893	A811-Y815 VanDerWaalsContact O-CB 3.3Å; A811-Y815 WeakPolarHBondContact O-CB 3.33Å; A811-Y815 PolarHBondContact O-N 3.4Å; L812-Y815 PolarHBondContact O-N 3.18Å; Y815-R817 VanDerWaalsContact C-N 3.34Å; Y815-R817 PolarHBondContact O-N 2.87Å; Y815-L818 WeakPolarHBondContact O-CB 3.45Å; Y815-L818 PolarHBondContact O-N 2.96Å; Y815-T819 HydrophobicContact CD1-CG2 4.22Å; Y815-T819 HydrophobicContact CE1-CG2 3.69Å; Y815-T819 HydrophobicContact CE2-CG2 4.05Å; Y815-T819 PolarHBondContact O-N 3.26Å; Y815-F886 HydrophobicContact CD2-CE1 4.3Å; Y815-F886 HydrophobicContact CD2-CE2 4.2Å; Y815-F886 HydrophobicContact CD2-CZ 4.05Å; Y815-F886 HydrophobicContact CG-CE2 4.5Å; Y815-L889 HydrophobicContact CD1-CB 3.59Å; Y815-L889 HydrophobicContact CD1-CD1 4.11Å; Y815-L889 HydrophobicContact CD1-CG 4.42Å; Y815-L889 HydrophobicContact CD2-CB 4.33Å; Y815-L889 HydrophobicContact CE1-CB 3.84Å; Y815-L889 HydrophobicContact CG-CB 3.86Å; Y815-L889 HydrophobicContact CG-CD1 4.13Å; Y815-F890 HydrophobicContact CE2-CB 3.83Å; Y815-F890 HydrophobicContact CE2-CD2 4.37Å; Y815-F890 WeakPolarHBondContact OH-CA 3.36Å; Y815-D893 PolarHBondContact OH-OD2 3.11Å
816	T	89.1	Confident	83.7	Confident	57 Å²	57	54 Å²	54	35%	0.35	26%	0.263	S	S	.	.	H	α-helix	trans	-56.1	-48.2	176.2	-57.5	0	0	0	0	111	L812 L818 T819 E820	L812-T816 WeakPolarHBondContact O-CB 3.47Å; L812-T816 PolarHBondContact O-N 2.85Å; L812-T816 PolarHBondContact O-OG1 3.38Å; L812-T816 VanDerWaalsContact O-OG1 3.05Å; T816-L818 VanDerWaalsContact C-N 3.29Å; T816-L818 PolarHBondContact O-N 3.17Å; T816-T819 PolarHBondContact O-N 2.98Å; T816-T819 PolarHBondContact O-OG1 2.88Å; T816-E820 WeakPolarHBondContact O-CG 3.35Å; T816-E820 PolarHBondContact O-N 3.28Å
817	R	85.4	Confident	81.5	Confident	89 Å²	89	59.3 Å²	59.3	34%	0.336	30%	0.297	S	S	.	.	H	α-helix	trans	-67.8	-26.4	177.7	-72.5	-174.8	178.2	165.2	6.6	114	Y764 I813 Y815 Y821	Y764-R817 VanDerWaalsContact OH-CD 3.24Å; Y764-R817 WeakPolarHBondContact OH-CD 3.31Å; I813-R817 WeakPolarHBondContact O-CB 3.43Å; I813-R817 WeakPolarHBondContact O-CG 3.45Å; I813-R817 PolarHBondContact O-N 3.47Å; Y815-R817 VanDerWaalsContact C-N 3.34Å; Y815-R817 PolarHBondContact O-N 2.87Å; R817-Y821 VanDerWaalsContact O-CB 3.3Å; R817-Y821 WeakPolarHBondContact O-CB 3.17Å; R817-Y821 PolarHBondContact O-N 3.19Å
818	L	86.6	Confident	79.2	Confident	14 Å²	14	64.1 Å²	64.1	7%	0.073	34%	0.338	C	S	.	.	H	α-helix	trans	-72	-43.7	173.6	-168	63.9	0	0	0	111.3	N814 Y815 T816 E820 Y821 A822 L850 L853 C854 V857 F886	N814-L818 WeakPolarHBondContact O-CB 3.48Å; N814-L818 PolarHBondContact O-N 2.72Å; Y815-L818 WeakPolarHBondContact O-CB 3.45Å; Y815-L818 PolarHBondContact O-N 2.96Å; T816-L818 VanDerWaalsContact C-N 3.29Å; T816-L818 PolarHBondContact O-N 3.17Å; L818-E820 VanDerWaalsContact C-N 3.33Å; L818-E820 PolarHBondContact O-N 3.4Å; L818-Y821 PolarHBondContact O-N 2.88Å; L818-Y821 VanDerWaalsContact O-N 3.17Å; L818-A822 WeakPolarHBondContact O-CB 3.32Å; L818-A822 PolarHBondContact O-N 3.01Å; L818-L850 HydrophobicContact CD2-CD1 4.38Å; L818-L850 HydrophobicContact CG-CD1 4.31Å; L818-L853 HydrophobicContact CD1-CB 3.98Å; L818-L853 HydrophobicContact CD2-CB 4.16Å; L818-L853 HydrophobicContact CG-CB 4.24Å; L818-C854 HydrophobicContact CD2-CB 4.4Å; L818-V857 HydrophobicContact CD1-CG2 3.65Å; L818-V857 HydrophobicContact CD2-CB 4.29Å; L818-V857 HydrophobicContact CD2-CG2 3.95Å; L818-V857 HydrophobicContact CG-CG2 4.38Å; L818-F886 HydrophobicContact CD2-CZ 3.87Å
819	T	85.1	Confident	76.8	Confident	16 Å²	16	67.1 Å²	67.1	10%	0.098	35%	0.351	C	S	.	.	H	α-helix	trans	-68.3	-30.6	175	65.8	0	0	0	0	112.7	Y815 T816 K823 L850	Y815-T819 HydrophobicContact CD1-CG2 4.22Å; Y815-T819 HydrophobicContact CE1-CG2 3.69Å; Y815-T819 HydrophobicContact CE2-CG2 4.05Å; Y815-T819 PolarHBondContact O-N 3.26Å; T816-T819 PolarHBondContact O-N 2.98Å; T816-T819 PolarHBondContact O-OG1 2.88Å; T819-K823 WeakPolarHBondContact O-CB 3.28Å; T819-K823 WeakPolarHBondContact O-CD 3.47Å; T819-K823 WeakPolarHBondContact O-CG 3.39Å; T819-K823 PolarHBondContact O-N 3.13Å; T819-L850 HydrophobicContact CG2-CD1 4.05Å; T819-L850 HydrophobicContact CG2-CD2 4.07Å
820	E	83.1	Confident	74.5	Confident	108 Å²	108	73.1 Å²	73.1	51%	0.505	38%	0.378	S	S	.	.	H	α-helix	trans	-63.4	-42.9	168.3	-74.1	172.2	166.6	0	0	111.3	T816 L818 I824	T816-E820 WeakPolarHBondContact O-CG 3.35Å; T816-E820 PolarHBondContact O-N 3.28Å; L818-E820 VanDerWaalsContact C-N 3.33Å; L818-E820 PolarHBondContact O-N 3.4Å; E820-I824 WeakPolarHBondContact O-CD1 3.29Å; E820-I824 WeakPolarHBondContact O-CG1 3.28Å
821	Y	79.9	Confident	72	Confident	111 Å²	111	80.9 Å²	80.9	44%	0.435	41%	0.414	S	S	.	.	H	α-helix	trans	-70	-45.3	-179.9	178.3	-96.8	0	0	0	112.9	R817 L818 K823 I824 E825 L853	R817-Y821 VanDerWaalsContact O-CB 3.3Å; R817-Y821 WeakPolarHBondContact O-CB 3.17Å; R817-Y821 PolarHBondContact O-N 3.19Å; L818-Y821 PolarHBondContact O-N 2.88Å; L818-Y821 VanDerWaalsContact O-N 3.17Å; Y821-K823 PolarHBondContact O-N 3.46Å; Y821-I824 WeakPolarHBondContact O-CA 3.29Å; Y821-I824 WeakPolarHBondContact O-CB 3.33Å; Y821-I824 PolarHBondContact O-N 3.34Å; Y821-E825 HydrophobicContact CE1-CB 4.31Å; Y821-E825 WeakPolarHBondContact CE1-OE2 3.5Å; Y821-E825 PolarHBondContact O-N 3.36Å; Y821-E825 PolarHBondContact OH-OE1 2.93Å; Y821-E825 PolarHBondContact OH-OE2 2.91Å; Y821-L853 HydrophobicContact CD1-CD1 4.49Å; Y821-L853 HydrophobicContact CE1-CD2 4.33Å
822	A	79.6	Confident	69.6	Low	17 Å²	17	88.2 Å²	88.2	14%	0.14	46%	0.459	C	S	.	.	H	α-helix	trans	-58.8	-34.1	176.1	0	0	0	0	0	112.4	L818 I824 G826 L850 L853	L818-A822 WeakPolarHBondContact O-CB 3.32Å; L818-A822 PolarHBondContact O-N 3.01Å; A822-I824 PolarHBondContact O-N 3.04Å; A822-G826 PolarHBondContact O-N 2.89Å; A822-L850 HydrophobicContact CB-CD1 4.2Å; A822-L853 HydrophobicContact CB-CD1 3.75Å
823	K	75.4	Confident	67.1	Low	137 Å²	137	89.9 Å²	89.9	60%	0.596	46%	0.464	S	S	*	.	H	α-helix	trans	-73.2	-4.4	174.3	-70.8	166.3	-169.6	162.8	0	114.2	T819 Y821	T819-K823 WeakPolarHBondContact O-CB 3.28Å; T819-K823 WeakPolarHBondContact O-CD 3.47Å; T819-K823 WeakPolarHBondContact O-CG 3.39Å; T819-K823 PolarHBondContact O-N 3.13Å; Y821-K823 PolarHBondContact O-N 3.46Å
824	I	66.5	Low	65.1	Low	143 Å²	143	92 Å²	92	73%	0.733	48%	0.479	S	S	*	.	H	α-helix	trans	-110.2	-34.8	176.9	-63.9	166.6	0	0	0	111.1	E820 Y821 A822	E820-I824 WeakPolarHBondContact O-CD1 3.29Å; E820-I824 WeakPolarHBondContact O-CG1 3.28Å; Y821-I824 WeakPolarHBondContact O-CA 3.29Å; Y821-I824 WeakPolarHBondContact O-CB 3.33Å; Y821-I824 PolarHBondContact O-N 3.34Å; A822-I824 PolarHBondContact O-N 3.04Å
825	E	60.6	Low	63.1	Low	109 Å²	109	97 Å²	97	51%	0.509	50%	0.504	S	S	.	.	H	α-helix	trans	-88.2	-22.2	178.1	-173.3	155.6	-120	0	0	113.8	Y821	Y821-E825 HydrophobicContact CE1-CB 4.31Å; Y821-E825 WeakPolarHBondContact CE1-OE2 3.5Å; Y821-E825 PolarHBondContact O-N 3.36Å; Y821-E825 PolarHBondContact OH-OE1 2.93Å; Y821-E825 PolarHBondContact OH-OE2 2.91Å
826	G	54.8	Low	61	Low	26 Å²	26	103.2 Å²	103.2	27%	0.268	54%	0.538	S	S	.	.	S	Bend	trans	-57.9	157.2	177.6	0	0	0	0	0	114.1	A822 A828	A822-G826 PolarHBondContact O-N 2.89Å; G826-A828 PolarHBondContact O-N 2.89Å
827	P	46.5	Very low	59.3	Low	111 Å²	111	106 Å²	106	72%	0.721	55%	0.547	S	S	*	.			trans	-54.8	113.9	-166.5	-28.1	35.7	0	0	0	114	E829	P827-E829 PolarHBondContact O-N 2.95Å
828	A	42.6	Very low	58.2	Low	104 Å²	104	103.1 Å²	103.1	86%	0.86	54%	0.542	S	S	*	.			trans	-75.7	48.2	-177	0	0	0	0	0	113.8	G826	G826-A828 PolarHBondContact O-N 2.89Å
829	E	40.8	Very low	57.8	Low	140 Å²	140	105.2 Å²	105.2	65%	0.654	56%	0.558	S	S	*	*			trans	-71.2	134.7	163.3	-67.7	-154.2	122.8	0	0	110.1	P827 E831 R842	P827-E829 PolarHBondContact O-N 2.95Å; E829-E831 PolarHBondContact O-N 3.31Å; E829-R842 IonicContact OE2-CZ 2.69Å; E829-R842 IonicContact OE2-NH2 2.73Å; E829-R842 PolarHBondContact OE2-NH2 3.24Å
830	K	43	Very low	57.5	Low	202 Å²	202	107 Å²	107	88%	0.878	57%	0.569	S	S	*	*	S	Bend	trans	-79.1	91	-167.7	-61.5	166.1	-176.1	164	0	112.1
831	E	40	Very low	57.5	Low	163 Å²	163	105 Å²	105	76%	0.762	57%	0.572	S	S	*	*			trans	-154.3	128.7	152.6	-116.1	140.1	-142.8	0	0	112.2	E829 E833	E829-E831 PolarHBondContact O-N 3.31Å; E831-E833 VanDerWaalsContact C-N 3.27Å; E831-E833 PolarHBondContact O-N 3.45Å
832	T	41.3	Very low	57.6	Low	155 Å²	155	105 Å²	105	95%	0.951	57%	0.571	S	S	*	*			trans	-93	51.7	-173.2	-40.4	0	0	0	0	111.1
833	E	38.8	Very low	57.8	Low	128 Å²	128	106.4 Å²	106.4	60%	0.598	57%	0.574	S	S	*	*			trans	-101.8	148.1	176.7	-62.6	-145	136	0	0	111.7	E831 Q837	E831-E833 VanDerWaalsContact C-N 3.27Å; E831-E833 PolarHBondContact O-N 3.45Å; E833-Q837 PolarHBondContact OE1-NE2 3.4Å; E833-Q837 PolarHBondContact OE2-NE2 3.26Å
834	T	47.9	Very low	58.4	Low	84 Å²	84	100.3 Å²	100.3	52%	0.515	55%	0.548	S	S	.	.			trans	-71.5	155.2	-172.1	61.2	0	0	0	0	112.7	N836 Q837	T834-N836 PolarHBondContact O-N 3.41Å; T834-Q837 PolarHBondContact O-N 2.92Å
835	M	46.7	Very low	59.3	Low	109 Å²	109	99.5 Å²	99.5	54%	0.537	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.5	-21.9	173.5	-83	169.3	67.3	0	0	114.5	Q837 K843	M835-Q837 VanDerWaalsContact C-N 3.27Å; M835-Q837 PolarHBondContact O-N 2.93Å; M835-K843 WeakPolarHBondContact O-CE 3.47Å; M835-K843 PolarHBondContact O-NZ 3.01Å
836	N	48.6	Very low	60.6	Low	145 Å²	145	98.5 Å²	98.5	78%	0.775	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-16.8	176.8	-67.1	-13.8	0	0	0	114	T834	T834-N836 PolarHBondContact O-N 3.41Å
837	Q	51.7	Low	62.3	Low	115 Å²	115	98 Å²	98	54%	0.537	53%	0.527	S	S	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-10.8	-177.4	-71.4	168.4	-88.3	0	0	114.4	E833 T834 M835	E833-Q837 PolarHBondContact OE1-NE2 3.4Å; E833-Q837 PolarHBondContact OE2-NE2 3.26Å; T834-Q837 PolarHBondContact O-N 2.92Å; M835-Q837 VanDerWaalsContact C-N 3.27Å; M835-Q837 PolarHBondContact O-N 2.93Å
838	A	62.4	Low	64.4	Low	28 Å²	28	94.9 Å²	94.9	23%	0.231	50%	0.504	C	S	.	.	S	Bend	trans	-60.1	143.3	175.2	0	0	0	0	0	111.8	K843	A838-K843 HydrophobicContact CB-CG 4Å; A838-K843 VanDerWaalsContact O-CE 3.24Å; A838-K843 WeakPolarHBondContact O-CE 3.16Å
839	S	77.8	Confident	66.5	Low	59 Å²	59	92.5 Å²	92.5	41%	0.413	48%	0.475	S	S	.	.			trans	-65.4	152.2	177.9	63.5	0	0	0	0	111.2	A841 R842 K843	S839-A841 PolarHBondContact O-N 3.02Å; S839-R842 PolarHBondContact O-N 3.26Å; S839-R842 VanDerWaalsContact O-N 3.13Å; S839-R842 PolarHBondContact OG-N 3.45Å; S839-K843 PolarHBondContact O-N 3.15Å
840	P	80.6	Confident	68.9	Low	52 Å²	52	86.3 Å²	86.3	34%	0.338	45%	0.447	S	S	.	.	H	α-helix	trans	-54	-38.8	178.5	-28.1	36	0	0	0	113.2	K843 L844 A900 Q901	P840-K843 PolarHBondContact O-N 3.43Å; P840-L844 PolarHBondContact O-N 3.11Å; P840-A900 WeakPolarHBondContact CB-O 3.28Å; P840-A900 WeakPolarHBondContact CG-O 2.86Å; P840-Q901 PolarHBondContact O-NE2 2.88Å; P840-Q901 PolarHBondContact O-OE1 3.17Å
841	A	81.6	Confident	71.2	Confident	67 Å²	67	76.7 Å²	76.7	55%	0.554	41%	0.405	S	S	*	.	H	α-helix	trans	-62.2	-47.8	175.9	0	0	0	0	0	113.2	S839 K843 L844 E845	S839-A841 PolarHBondContact O-N 3.02Å; A841-K843 VanDerWaalsContact C-N 3.34Å; A841-K843 PolarHBondContact O-N 3.24Å; A841-L844 PolarHBondContact O-N 3.08Å; A841-E845 PolarHBondContact O-N 3.49Å
842	R	83.1	Confident	73.6	Confident	111 Å²	111	73 Å²	73	42%	0.419	39%	0.388	S	S	.	.	H	α-helix	trans	-62.7	-40.2	176.1	-91.2	-169.6	178.5	162	-1.1	111.9	E829 S839 L844 E845 E846	E829-R842 IonicContact OE2-CZ 2.69Å; E829-R842 IonicContact OE2-NH2 2.73Å; E829-R842 PolarHBondContact OE2-NH2 3.24Å; S839-R842 PolarHBondContact O-N 3.26Å; S839-R842 VanDerWaalsContact O-N 3.13Å; S839-R842 PolarHBondContact OG-N 3.45Å; R842-L844 PolarHBondContact O-N 3.26Å; R842-E845 PolarHBondContact O-N 2.67Å; R842-E846 WeakPolarHBondContact O-CB 3.37Å; R842-E846 VanDerWaalsContact O-CG 3.26Å; R842-E846 WeakPolarHBondContact O-CG 3.5Å; R842-E846 PolarHBondContact O-N 2.82Å
843	K	84.3	Confident	75.9	Confident	46 Å²	46	66.5 Å²	66.5	20%	0.2	35%	0.347	C	S	.	.	H	α-helix	trans	-59.9	-35.7	175.3	-70	178.4	174.5	-177.5	0	112.7	M835 A838 S839 P840 A841 I847 A897 A900	M835-K843 WeakPolarHBondContact O-CE 3.47Å; M835-K843 PolarHBondContact O-NZ 3.01Å; A838-K843 HydrophobicContact CB-CG 4Å; A838-K843 VanDerWaalsContact O-CE 3.24Å; A838-K843 WeakPolarHBondContact O-CE 3.16Å; S839-K843 PolarHBondContact O-N 3.15Å; P840-K843 PolarHBondContact O-N 3.43Å; A841-K843 VanDerWaalsContact C-N 3.34Å; A841-K843 PolarHBondContact O-N 3.24Å; K843-I847 WeakPolarHBondContact O-CG1 3.42Å; K843-I847 PolarHBondContact O-N 2.82Å; K843-I847 VanDerWaalsContact O-N 3.1Å; K843-A897 HydrophobicContact CB-CB 4.47Å; K843-A900 HydrophobicContact CD-CB 4.32Å
844	L	87.1	Confident	78.4	Confident	9 Å²	9	60.4 Å²	60.4	5%	0.047	32%	0.318	C	S	.	.	H	α-helix	trans	-74.8	-38.3	178.8	-170.3	57.2	0	0	0	112	P840 A841 R842 I847 L848 L898 D907 L911	P840-L844 PolarHBondContact O-N 3.11Å; A841-L844 PolarHBondContact O-N 3.08Å; R842-L844 PolarHBondContact O-N 3.26Å; L844-I847 PolarHBondContact O-N 2.76Å; L844-L848 WeakPolarHBondContact O-CB 3.34Å; L844-L848 PolarHBondContact O-N 3.4Å; L844-L898 HydrophobicContact CD1-CD2 4.32Å; L844-D907 HydrophobicContact CD2-CB 3.84Å; L844-D907 WeakPolarHBondContact CD2-O 3.42Å; L844-L911 HydrophobicContact CD1-CD2 4.13Å
845	E	86.3	Confident	80.4	Confident	126 Å²	126	57.1 Å²	57.1	59%	0.589	30%	0.298	S	S	*	.	H	α-helix	trans	-63	-45.6	171.3	-173.2	176.7	-163.1	0	0	111.7	A841 R842 I847 L848 H849	A841-E845 PolarHBondContact O-N 3.49Å; R842-E845 PolarHBondContact O-N 2.67Å; E845-I847 VanDerWaalsContact C-N 3.34Å; E845-I847 PolarHBondContact O-N 2.7Å; E845-L848 PolarHBondContact O-N 3.19Å; E845-H849 PolarHBondContact O-N 3.02Å
846	E	86.9	Confident	82.3	Confident	88 Å²	88	56.7 Å²	56.7	41%	0.411	29%	0.294	S	S	.	.	H	α-helix	trans	-57.2	-43.1	173.8	-74.9	166.6	-148.4	0	0	112.1	R842 L850	R842-E846 WeakPolarHBondContact O-CB 3.37Å; R842-E846 VanDerWaalsContact O-CG 3.26Å; R842-E846 WeakPolarHBondContact O-CG 3.5Å; R842-E846 PolarHBondContact O-N 2.82Å; E846-L850 WeakPolarHBondContact O-CB 3.44Å; E846-L850 PolarHBondContact O-N 3.14Å
847	I	90.8	Very high	84.2	Confident	15 Å²	15	50.2 Å²	50.2	8%	0.077	26%	0.26	C	S	.	.	H	α-helix	trans	-75.3	-33.7	178	-70.1	-56.9	0	0	0	112.9	K843 L844 E845 L850 A851 F890 D893 M894 A897 L911	K843-I847 WeakPolarHBondContact O-CG1 3.42Å; K843-I847 PolarHBondContact O-N 2.82Å; K843-I847 VanDerWaalsContact O-N 3.1Å; L844-I847 PolarHBondContact O-N 2.76Å; E845-I847 VanDerWaalsContact C-N 3.34Å; E845-I847 PolarHBondContact O-N 2.7Å; I847-L850 HydrophobicContact CD1-CD2 4.06Å; I847-L850 PolarHBondContact O-N 2.71Å; I847-A851 WeakPolarHBondContact O-CB 3.33Å; I847-A851 PolarHBondContact O-N 2.9Å; I847-F890 HydrophobicContact CG2-CE2 4.16Å; I847-F890 HydrophobicContact CG2-CZ 3.8Å; I847-D893 HydrophobicContact CD1-CB 3.86Å; I847-M894 HydrophobicContact CG2-CB 4.47Å; I847-M894 HydrophobicContact CG2-CG 4.45Å; I847-A897 HydrophobicContact CB-CB 4.32Å; I847-A897 HydrophobicContact CG1-CB 3.55Å; I847-L911 HydrophobicContact CG2-CD1 4.3Å; I847-L911 HydrophobicContact CG2-CD2 3.81Å
848	L	89.6	Confident	85.9	Confident	47 Å²	47	45.4 Å²	45.4	25%	0.246	24%	0.238	C	C	.	.	H	α-helix	trans	-65.1	-46.4	174.3	-170.6	152.2	0	0	0	110.5	L844 E845 L850 A851 E852 P910 L914	L844-L848 WeakPolarHBondContact O-CB 3.34Å; L844-L848 PolarHBondContact O-N 3.4Å; E845-L848 PolarHBondContact O-N 3.19Å; L848-L850 VanDerWaalsContact C-N 3.34Å; L848-L850 PolarHBondContact O-N 3.21Å; L848-A851 WeakPolarHBondContact O-CB 3.47Å; L848-A851 PolarHBondContact O-N 3.5Å; L848-A851 VanDerWaalsContact O-N 3.07Å; L848-E852 HydrophobicContact CD2-CG 4.36Å; L848-E852 WeakPolarHBondContact O-CG 3.4Å; L848-E852 PolarHBondContact O-N 3.11Å; L848-P910 HydrophobicContact CD1-CB 4.03Å; L848-L914 HydrophobicContact CD2-CD2 4.43Å; L848-L914 HydrophobicContact CG-CD2 4.3Å
849	H	88.3	Confident	87	Confident	54 Å²	54	48.2 Å²	48.2	25%	0.25	25%	0.246	C	C	.	.	H	α-helix	trans	-63.6	-38.9	174.4	-176.3	48.8	0	0	0	112.4	E845 A851 E852 L853	E845-H849 PolarHBondContact O-N 3.02Å; H849-A851 VanDerWaalsContact C-N 3.28Å; H849-A851 PolarHBondContact O-N 3.48Å; H849-E852 IonicContact ND1-OE2 3.44Å; H849-E852 PolarHBondContact ND1-OE2 2.86Å; H849-E852 PolarHBondContact O-N 2.87Å; H849-L853 WeakPolarHBondContact O-CG 3.49Å; H849-L853 PolarHBondContact O-N 3.05Å
850	L	90.4	Very high	87.1	Confident	10 Å²	10	46.7 Å²	46.7	5%	0.052	23%	0.232	C	C	.	.	H	α-helix	trans	-62.6	-34.9	172	-177.6	61.5	0	0	0	112.1	L818 T819 A822 E846 I847 L848 C854 F890	L818-L850 HydrophobicContact CD2-CD1 4.38Å; L818-L850 HydrophobicContact CG-CD1 4.31Å; T819-L850 HydrophobicContact CG2-CD1 4.05Å; T819-L850 HydrophobicContact CG2-CD2 4.07Å; A822-L850 HydrophobicContact CB-CD1 4.2Å; E846-L850 WeakPolarHBondContact O-CB 3.44Å; E846-L850 PolarHBondContact O-N 3.14Å; I847-L850 HydrophobicContact CD1-CD2 4.06Å; I847-L850 PolarHBondContact O-N 2.71Å; L848-L850 VanDerWaalsContact C-N 3.34Å; L848-L850 PolarHBondContact O-N 3.21Å; L850-C854 WeakPolarHBondContact O-CB 3.35Å; L850-C854 PolarHBondContact O-N 3.29Å; L850-C854 PolarHBondContact O-SG 3.38Å; L850-F890 HydrophobicContact CB-CE2 4.35Å; L850-F890 HydrophobicContact CD2-CD2 4.1Å; L850-F890 HydrophobicContact CD2-CE2 4.17Å; L850-F890 HydrophobicContact CG-CD2 4.12Å; L850-F890 HydrophobicContact CG-CE2 4.04Å
851	A	91.4	Very high	87.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.2	-42.3	176.1	0	0	0	0	0	112.2	I847 L848 H849 C854 I855 F890 L911 L914 L915	I847-A851 WeakPolarHBondContact O-CB 3.33Å; I847-A851 PolarHBondContact O-N 2.9Å; L848-A851 WeakPolarHBondContact O-CB 3.47Å; L848-A851 PolarHBondContact O-N 3.5Å; L848-A851 VanDerWaalsContact O-N 3.07Å; H849-A851 VanDerWaalsContact C-N 3.28Å; H849-A851 PolarHBondContact O-N 3.48Å; A851-C854 WeakPolarHBondContact O-CB 3.46Å; A851-C854 PolarHBondContact O-N 2.74Å; A851-I855 WeakPolarHBondContact O-CG1 3.32Å; A851-I855 PolarHBondContact O-N 3.05Å; A851-F890 HydrophobicContact CB-CE2 4.08Å; A851-F890 HydrophobicContact CB-CZ 3.77Å; A851-L911 HydrophobicContact CB-CD1 3.74Å; A851-L914 HydrophobicContact CB-CD2 3.93Å; A851-L915 HydrophobicContact CB-CD2 4.06Å
852	E	90.6	Very high	87.2	Confident	86 Å²	86	46.6 Å²	46.6	40%	0.402	22%	0.216	S	C	.	.	H	α-helix	trans	-56.3	-52.4	172	-64.4	173.8	147	0	0	110.7	L848 H849 C854 I855 E856 L914	L848-E852 HydrophobicContact CD2-CG 4.36Å; L848-E852 WeakPolarHBondContact O-CG 3.4Å; L848-E852 PolarHBondContact O-N 3.11Å; H849-E852 IonicContact ND1-OE2 3.44Å; H849-E852 PolarHBondContact ND1-OE2 2.86Å; H849-E852 PolarHBondContact O-N 2.87Å; E852-C854 VanDerWaalsContact C-N 3.27Å; E852-C854 PolarHBondContact O-N 3.49Å; E852-I855 WeakPolarHBondContact O-CB 3.37Å; E852-I855 PolarHBondContact O-N 3.32Å; E852-I855 VanDerWaalsContact O-N 3.14Å; E852-E856 PolarHBondContact O-N 2.87Å; E852-L914 HydrophobicContact CG-CD2 3.79Å
853	L	88.8	Confident	86.9	Confident	17 Å²	17	44.5 Å²	44.5	9%	0.089	21%	0.211	C	C	.	.	H	α-helix	trans	-60.1	-35.2	176.9	-72.3	175.4	0	0	0	112.4	L818 Y821 A822 H849 V857	L818-L853 HydrophobicContact CD1-CB 3.98Å; L818-L853 HydrophobicContact CD2-CB 4.16Å; L818-L853 HydrophobicContact CG-CB 4.24Å; Y821-L853 HydrophobicContact CD1-CD1 4.49Å; Y821-L853 HydrophobicContact CE1-CD2 4.33Å; A822-L853 HydrophobicContact CB-CD1 3.75Å; H849-L853 WeakPolarHBondContact O-CG 3.49Å; H849-L853 PolarHBondContact O-N 3.05Å; L853-V857 VanDerWaalsContact O-CB 3.31Å; L853-V857 WeakPolarHBondContact O-CB 3.35Å; L853-V857 VanDerWaalsContact O-CG2 3.28Å; L853-V857 WeakPolarHBondContact O-CG2 3.5Å; L853-V857 PolarHBondContact O-N 3.27Å
854	C	91.4	Very high	86.5	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-66.2	-44.3	174.7	-76	0	0	0	0	111.6	L818 L850 A851 E852 V857 L858 F886 W887	L818-C854 HydrophobicContact CD2-CB 4.4Å; L850-C854 WeakPolarHBondContact O-CB 3.35Å; L850-C854 PolarHBondContact O-N 3.29Å; L850-C854 PolarHBondContact O-SG 3.38Å; A851-C854 WeakPolarHBondContact O-CB 3.46Å; A851-C854 PolarHBondContact O-N 2.74Å; E852-C854 VanDerWaalsContact C-N 3.27Å; E852-C854 PolarHBondContact O-N 3.49Å; C854-V857 PolarHBondContact O-N 3.31Å; C854-L858 WeakPolarHBondContact O-CG 3.37Å; C854-L858 PolarHBondContact O-N 2.92Å; C854-F886 HydrophobicContact CB-CE1 3.8Å; C854-W887 HydrophobicContact CB-CH2 3.7Å; C854-W887 HydrophobicContact CB-CZ3 3.8Å
855	I	90.1	Very high	86.2	Confident	16 Å²	16	43.2 Å²	43.2	8%	0.082	21%	0.205	C	C	.	.	H	α-helix	trans	-61.5	-50.3	176.3	-70.4	165.7	0	0	0	110.1	A851 E852 V857 L858 Q859 W887 L914 F918	A851-I855 WeakPolarHBondContact O-CG1 3.32Å; A851-I855 PolarHBondContact O-N 3.05Å; E852-I855 WeakPolarHBondContact O-CB 3.37Å; E852-I855 PolarHBondContact O-N 3.32Å; E852-I855 VanDerWaalsContact O-N 3.14Å; I855-V857 VanDerWaalsContact C-N 3.29Å; I855-V857 PolarHBondContact O-N 3.39Å; I855-L858 PolarHBondContact O-N 3.32Å; I855-Q859 HydrophobicContact CG2-CG 4.3Å; I855-Q859 VanDerWaalsContact CG2-NE2 3.34Å; I855-Q859 WeakPolarHBondContact O-CB 3.3Å; I855-Q859 WeakPolarHBondContact O-CG 3.16Å; I855-Q859 PolarHBondContact O-N 3.2Å; I855-W887 HydrophobicContact CG1-CH2 4Å; I855-W887 HydrophobicContact CG1-CZ2 4.21Å; I855-L914 HydrophobicContact CD1-CD1 3.77Å; I855-L914 HydrophobicContact CD1-CD2 4.41Å; I855-L914 HydrophobicContact CD1-CG 3.76Å; I855-F918 HydrophobicContact CD1-CB 3.89Å; I855-F918 HydrophobicContact CD1-CG 4.24Å; I855-F918 HydrophobicContact CG1-CB 4.09Å; I855-F918 HydrophobicContact CG1-CD1 3.97Å; I855-F918 HydrophobicContact CG1-CD2 4.37Å; I855-F918 HydrophobicContact CG1-CG 3.87Å; I855-F918 HydrophobicContact CG2-CD2 3.7Å; I855-F918 HydrophobicContact CG2-CE2 4.07Å; I855-F918 HydrophobicContact CG2-CG 4.07Å
856	E	86.3	Confident	85.3	Confident	100 Å²	100	38.1 Å²	38.1	47%	0.467	19%	0.185	S	C	.	.	H	α-helix	trans	-58	-41.3	176.6	-72.4	-160.1	170.4	0	0	112.3	E852 L858 Q860	E852-E856 PolarHBondContact O-N 2.87Å; E856-L858 PolarHBondContact O-N 3.11Å; E856-Q860 VanDerWaalsContact O-CB 3.31Å; E856-Q860 WeakPolarHBondContact O-CB 3.27Å; E856-Q860 VanDerWaalsContact O-CG 3.23Å; E856-Q860 WeakPolarHBondContact O-CG 3.47Å; E856-Q860 PolarHBondContact O-N 2.63Å
857	V	88	Confident	83.7	Confident	9 Å²	9	37.8 Å²	37.8	6%	0.055	18%	0.183	C	C	.	.	H	α-helix	trans	-64.3	-40	179.8	157.1	0	0	0	0	112.2	R763 L818 L853 C854 I855 N861 F886	R763-V857 PolarHBondContact NH2-O 2.81Å; L818-V857 HydrophobicContact CD1-CG2 3.65Å; L818-V857 HydrophobicContact CD2-CB 4.29Å; L818-V857 HydrophobicContact CD2-CG2 3.95Å; L818-V857 HydrophobicContact CG-CG2 4.38Å; L853-V857 VanDerWaalsContact O-CB 3.31Å; L853-V857 WeakPolarHBondContact O-CB 3.35Å; L853-V857 VanDerWaalsContact O-CG2 3.28Å; L853-V857 WeakPolarHBondContact O-CG2 3.5Å; L853-V857 PolarHBondContact O-N 3.27Å; C854-V857 PolarHBondContact O-N 3.31Å; I855-V857 VanDerWaalsContact C-N 3.29Å; I855-V857 PolarHBondContact O-N 3.39Å; V857-N861 PolarHBondContact O-N 3.2Å; V857-N861 PolarHBondContact O-ND2 2.94Å; V857-N861 PolarHBondContact O-OD1 3.39Å; V857-F886 HydrophobicContact CB-CZ 4.46Å; V857-F886 HydrophobicContact CG1-CE2 4.05Å; V857-F886 HydrophobicContact CG1-CZ 3.81Å
858	L	87.9	Confident	81.7	Confident	14 Å²	14	39.9 Å²	39.9	7%	0.073	21%	0.209	C	C	.	.	H	α-helix	trans	-74.5	-43.6	178.2	-68.9	177	0	0	0	111.8	C854 I855 E856 Q860 N861 E862 A883 F886 W887 F918	C854-L858 WeakPolarHBondContact O-CG 3.37Å; C854-L858 PolarHBondContact O-N 2.92Å; I855-L858 PolarHBondContact O-N 3.32Å; E856-L858 PolarHBondContact O-N 3.11Å; L858-Q860 PolarHBondContact O-N 3.37Å; L858-N861 WeakPolarHBondContact O-CA 3.4Å; L858-N861 WeakPolarHBondContact O-CB 3.28Å; L858-N861 PolarHBondContact O-N 3.24Å; L858-E862 PolarHBondContact O-N 3.44Å; L858-E862 VanDerWaalsContact O-N 3.1Å; L858-A883 HydrophobicContact CD1-CB 4.31Å; L858-A883 HydrophobicContact CD2-CB 4.07Å; L858-F886 HydrophobicContact CD1-CD1 4.03Å; L858-F886 HydrophobicContact CD1-CE1 4.41Å; L858-F886 HydrophobicContact CD2-CB 4.43Å; L858-F886 HydrophobicContact CD2-CD1 4.04Å; L858-F886 HydrophobicContact CD2-CE1 4.49Å; L858-F886 HydrophobicContact CD2-CG 4.19Å; L858-F886 HydrophobicContact CG-CD1 4.12Å; L858-F886 HydrophobicContact CG-CE1 4.26Å; L858-W887 HydrophobicContact CD1-CD2 4.35Å; L858-W887 VanDerWaalsContact CD1-CE2 3.47Å; L858-W887 HydrophobicContact CD1-CZ2 3.66Å; L858-W887 VanDerWaalsContact CD1-NE1 3.26Å; L858-F918 HydrophobicContact CB-CZ 4.32Å; L858-F918 HydrophobicContact CD1-CE1 4.34Å
859	Q	85.1	Confident	79.8	Confident	86 Å²	86	48.3 Å²	48.3	40%	0.402	24%	0.238	S	C	.	.	H	α-helix	trans	-55.9	-50.8	172.7	-72.1	177	-1.6	0	0	111	I855 N861 E862 E863 F918	I855-Q859 HydrophobicContact CG2-CG 4.3Å; I855-Q859 VanDerWaalsContact CG2-NE2 3.34Å; I855-Q859 WeakPolarHBondContact O-CB 3.3Å; I855-Q859 WeakPolarHBondContact O-CG 3.16Å; I855-Q859 PolarHBondContact O-N 3.2Å; Q859-N861 PolarHBondContact O-N 3.43Å; Q859-N861 VanDerWaalsContact O-N 3.07Å; Q859-E862 WeakPolarHBondContact O-CB 3.47Å; Q859-E862 PolarHBondContact O-N 3.38Å; Q859-E863 VanDerWaalsContact O-CG 3.22Å; Q859-E863 WeakPolarHBondContact O-CG 3.22Å; Q859-E863 PolarHBondContact O-N 2.93Å; Q859-F918 HydrophobicContact CG-CE2 3.84Å
860	Q	80.9	Confident	78.6	Confident	27 Å²	27	47.3 Å²	47.3	13%	0.126	23%	0.233	C	C	.	.	H	α-helix	trans	-57	-25.1	174.7	-76.3	175.2	33.2	0	0	113.8	R763 E856 L858 H864	R763-Q860 VanDerWaalsContact NH2-OE1 3.15Å; E856-Q860 VanDerWaalsContact O-CB 3.31Å; E856-Q860 WeakPolarHBondContact O-CB 3.27Å; E856-Q860 VanDerWaalsContact O-CG 3.23Å; E856-Q860 WeakPolarHBondContact O-CG 3.47Å; E856-Q860 PolarHBondContact O-N 2.63Å; L858-Q860 PolarHBondContact O-N 3.37Å; Q860-H864 WeakPolarHBondContact O-CB 3.33Å; Q860-H864 PolarHBondContact O-CD2 2.83Å
861	N	85	Confident	77.2	Confident	5 Å²	5	47.3 Å²	47.3	3%	0.027	23%	0.234	C	C	.	.	H	α-helix	trans	-76.9	-39.2	175.2	-64.1	-27.9	0	0	0	111.4	R763 V857 L858 Q859 H865 H882	R763-N861 VanDerWaalsContact CD-OD1 3.23Å; R763-N861 WeakPolarHBondContact CD-OD1 3.23Å; R763-N861 PolarHBondContact NE-OD1 3.42Å; V857-N861 PolarHBondContact O-N 3.2Å; V857-N861 PolarHBondContact O-ND2 2.94Å; V857-N861 PolarHBondContact O-OD1 3.39Å; L858-N861 WeakPolarHBondContact O-CA 3.4Å; L858-N861 WeakPolarHBondContact O-CB 3.28Å; L858-N861 PolarHBondContact O-N 3.24Å; Q859-N861 PolarHBondContact O-N 3.43Å; Q859-N861 VanDerWaalsContact O-N 3.07Å; N861-H865 WeakPolarHBondContact O-CB 3.37Å; N861-H865 PolarHBondContact O-N 3.13Å; N861-H882 PolarHBondContact ND2-CE1 3.09Å
862	E	79.2	Confident	76.4	Confident	112 Å²	112	47.4 Å²	47.4	52%	0.523	24%	0.235	S	C	.	.	H	α-helix	trans	-64.4	-50.5	174.4	-163	-177	-177.9	0	0	111	L858 Q859 H864 A866 E867	L858-E862 PolarHBondContact O-N 3.44Å; L858-E862 VanDerWaalsContact O-N 3.1Å; Q859-E862 WeakPolarHBondContact O-CB 3.47Å; Q859-E862 PolarHBondContact O-N 3.38Å; E862-H864 PolarHBondContact O-N 3.3Å; E862-H864 VanDerWaalsContact O-N 3.16Å; E862-A866 HydrophobicContact CB-CB 4.5Å; E862-A866 HydrophobicContact CG-CB 4.07Å; E862-A866 WeakPolarHBondContact O-CB 3.37Å; E862-A866 PolarHBondContact O-N 2.91Å; E862-E867 PolarHBondContact O-N 3.41Å
863	E	76.4	Confident	75.2	Confident	67 Å²	67	45.4 Å²	45.4	31%	0.313	23%	0.233	S	C	.	.	H	α-helix	trans	-63.1	-22.2	-175.9	-58.8	-139.5	124.8	0	0	115.4	K183 Q859	K183-E863 WeakPolarHBondContact CD-OE1 3.46Å; K183-E863 VanDerWaalsContact CE-OE1 3.28Å; K183-E863 WeakPolarHBondContact CE-OE1 3.43Å; K183-E863 IonicContact NZ-OE1 2.73Å; K183-E863 PolarHBondContact NZ-OE1 2.89Å; Q859-E863 VanDerWaalsContact O-CG 3.22Å; Q859-E863 WeakPolarHBondContact O-CG 3.22Å; Q859-E863 PolarHBondContact O-N 2.93Å
864	H	76	Confident	74.1	Confident	24 Å²	24	53.7 Å²	53.7	11%	0.111	26%	0.263	C	S	.	.	H	α-helix	trans	-129.7	-2.7	-168.3	-56.6	-19.1	0	0	0	114.4	F768 G769 Q860 E862 E870	F768-H864 AromaticContact CD1-CD2 3.57Å; F768-H864 AromaticContact CD1-NE2 3.53Å; G769-H864 WeakPolarHBondContact CA-O 3.28Å; Q860-H864 WeakPolarHBondContact O-CB 3.33Å; Q860-H864 PolarHBondContact O-CD2 2.83Å; E862-H864 PolarHBondContact O-N 3.3Å; E862-H864 VanDerWaalsContact O-N 3.16Å; H864-E870 VanDerWaalsContact O-OE2 3.12Å
865	H	79.9	Confident	73.4	Confident	4 Å²	4	56.1 Å²	56.1	2%	0.019	27%	0.272	C	S	.	.	H	α-helix	trans	-138.8	-14.2	175.7	-52.4	-67.9	0	0	0	114.7	F762 F766 L775 N861 E870 A871 F872	F762-H865 AromaticContact CD2-CD2 3.57Å; F762-H865 AromaticContact CD2-CE1 3.91Å; F762-H865 AromaticContact CD2-CG 3.85Å; F762-H865 AromaticContact CD2-NE2 3.59Å; F762-H865 AromaticContact CE2-CD2 3.43Å; F762-H865 VanDerWaalsContact CE2-CD2 3.43Å; F762-H865 WeakPolarHBondContact CE2-CD2 3.28Å; F762-H865 AromaticContact CE2-CG 3.97Å; F762-H865 AromaticContact CE2-NE2 3.8Å; F766-H865 PolarHBondContact O-CE1 3.38Å; L775-H865 HydrophobicContact CD2-CB 4.29Å; N861-H865 WeakPolarHBondContact O-CB 3.37Å; N861-H865 PolarHBondContact O-N 3.13Å; H865-E870 WeakPolarHBondContact CA-OE2 3.12Å; H865-E870 PolarHBondContact N-OE2 3.3Å; H865-A871 PolarHBondContact O-N 3.29Å; H865-F872 HydrophobicContact CB-CD2 3.99Å; H865-F872 HydrophobicContact CB-CE2 4.4Å; H865-F872 PolarHBondContact O-N 2.95Å
866	A	67.5	Low	72.9	Confident	20 Å²	20	58.6 Å²	58.6	17%	0.165	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.4	-41.6	-176.6	0	0	0	0	0	114.2	E862 A873 L879	E862-A866 HydrophobicContact CB-CB 4.5Å; E862-A866 HydrophobicContact CG-CB 4.07Å; E862-A866 WeakPolarHBondContact O-CB 3.37Å; E862-A866 PolarHBondContact O-N 2.91Å; A866-A873 WeakPolarHBondContact O-CA 3.31Å; A866-A873 VanDerWaalsContact O-CB 3.23Å; A866-A873 WeakPolarHBondContact O-CB 3.5Å; A866-L879 HydrophobicContact CB-CD1 3.46Å; A866-L879 VanDerWaalsContact CB-CD1 3.46Å
867	E	53.1	Low	72.7	Confident	80 Å²	80	56.6 Å²	56.6	37%	0.374	28%	0.282	S	S	.	.	S	Bend	trans	-73.6	136.5	-172.3	-162.7	-177.3	154.1	0	0	112.8	K183 E862 E870	K183-E867 WeakPolarHBondContact CE-OE2 3.45Å; K183-E867 IonicContact NZ-OE2 2.87Å; K183-E867 PolarHBondContact NZ-OE2 3.4Å; E862-E867 PolarHBondContact O-N 3.41Å; E867-E870 VanDerWaalsContact O-CG 3.26Å; E867-E870 WeakPolarHBondContact O-CG 3.45Å
868	G	50.2	Low	72.6	Confident	59 Å²	59	56.2 Å²	56.2	61%	0.608	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	82.8	157.9	0	0	0	0	0	118	E870	G868-E870 PolarHBondContact O-N 2.75Å
869	R	48.9	Very low	72.4	Confident	225 Å²	225	56.7 Å²	56.7	85%	0.849	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.1	-6.5	177.7	-50.3	-178.3	178.8	-172.2	1	116.3	K776	K776-R869 PolarHBondContact NZ-O 2.75Å
870	E	62.4	Low	72.5	Confident	33 Å²	33	53.6 Å²	53.6	15%	0.154	27%	0.271	C	S	.	.	S	Bend	trans	-71.7	-166.4	-176.2	-66.9	-170.2	165.1	0	0	114.5	K179 H864 H865 E867 G868	K179-E870 IonicContact NZ-OE1 2.77Å; K179-E870 PolarHBondContact NZ-OE1 2.85Å; H864-E870 VanDerWaalsContact O-OE2 3.12Å; H865-E870 WeakPolarHBondContact CA-OE2 3.12Å; H865-E870 PolarHBondContact N-OE2 3.3Å; E867-E870 VanDerWaalsContact O-CG 3.26Å; E867-E870 WeakPolarHBondContact O-CG 3.45Å; G868-E870 PolarHBondContact O-N 2.75Å
871	A	62.2	Low	72.8	Confident	10 Å²	10	55.3 Å²	55.3	8%	0.083	28%	0.279	C	S	.	.	S	Bend	trans	-74.7	-46.4	-162.6	0	0	0	0	0	113.7	L775 K776 L779 H865	L775-A871 HydrophobicContact CB-CB 4.04Å; L775-A871 HydrophobicContact CD2-CB 3.83Å; L775-A871 HydrophobicContact CG-CB 3.63Å; K776-A871 HydrophobicContact CB-CB 4.05Å; L779-A871 HydrophobicContact CD1-CB 4.02Å; H865-A871 PolarHBondContact O-N 3.29Å
872	F	73.4	Confident	73	Confident	1 Å²	1	55.3 Å²	55.3	0%	0.004	28%	0.279	C	S	.	.	S	Bend	trans	-95.2	-0.8	-177.7	-64.1	-62.5	0	0	0	114.1	L775 L779 V803 L807 H865 W874 W875 L879	L775-F872 HydrophobicContact CD2-CD2 4.49Å; L775-F872 HydrophobicContact CD2-CE2 3.9Å; L775-F872 HydrophobicContact CD2-CZ 4.49Å; L779-F872 HydrophobicContact CD1-CD1 4.22Å; L779-F872 HydrophobicContact CD1-CE1 3.97Å; L779-F872 HydrophobicContact CD2-CE1 4.47Å; V803-F872 HydrophobicContact CG1-CE1 4.01Å; L807-F872 HydrophobicContact CD1-CE1 4.13Å; L807-F872 HydrophobicContact CD1-CZ 4.45Å; L807-F872 HydrophobicContact CD2-CE1 4.44Å; L807-F872 HydrophobicContact CD2-CE2 4.44Å; L807-F872 HydrophobicContact CD2-CZ 3.94Å; H865-F872 HydrophobicContact CB-CD2 3.99Å; H865-F872 HydrophobicContact CB-CE2 4.4Å; H865-F872 PolarHBondContact O-N 2.95Å; F872-W874 PolarHBondContact O-N 2.72Å; F872-W875 CarbonylContact O-C 3.59Å; F872-W875 VanDerWaalsContact O-C 3.29Å; F872-W875 PolarHBondContact O-N 2.72Å; F872-L879 HydrophobicContact CB-CD1 3.44Å; F872-L879 VanDerWaalsContact CB-CD1 3.44Å; F872-L879 HydrophobicContact CB-CG 3.76Å; F872-L879 HydrophobicContact CD2-CD1 3.98Å; F872-L879 HydrophobicContact CD2-CD2 3.95Å; F872-L879 HydrophobicContact CD2-CG 4.09Å; F872-L879 HydrophobicContact CE2-CD2 4.36Å; F872-L879 HydrophobicContact CG-CD1 3.96Å; F872-L879 HydrophobicContact CG-CD2 4.24Å; F872-L879 HydrophobicContact CG-CG 3.93Å
873	A	66.7	Low	73.5	Confident	45 Å²	45	50.4 Å²	50.4	37%	0.372	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-13.3	175.1	0	0	0	0	0	114.7	A866	A866-A873 WeakPolarHBondContact O-CA 3.31Å; A866-A873 VanDerWaalsContact O-CB 3.23Å; A866-A873 WeakPolarHBondContact O-CB 3.5Å
874	W	65.3	Low	74.2	Confident	190 Å²	190	49 Å²	49	72%	0.72	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-17.2	-179	-66.1	52	0	0	0	112.5	F872	F872-W874 PolarHBondContact O-N 2.72Å
875	W	77.4	Confident	74.9	Confident	51 Å²	51	52.2 Å²	52.2	19%	0.193	27%	0.265	C	S	.	.			trans	-138	64.4	179.9	-60.8	-36.4	0	0	0	111.1	V799 K800 V803 F872 D877 L878	V799-W875 HydrophobicContact CG1-CH2 3.95Å; K800-W875 VanDerWaalsContact CE-CD1 3.44Å; K800-W875 HydrophobicContact CG-CD2 4.17Å; K800-W875 HydrophobicContact CG-CG 4.47Å; K800-W875 HydrophobicContact CG-CZ2 4.28Å; V803-W875 HydrophobicContact CG2-CZ3 4.14Å; F872-W875 CarbonylContact O-C 3.59Å; F872-W875 VanDerWaalsContact O-C 3.29Å; F872-W875 PolarHBondContact O-N 2.72Å; W875-D877 WeakPolarHBondContact CA-OD1 3.41Å; W875-D877 WeakPolarHBondContact CB-OD1 3.42Å; W875-D877 PolarHBondContact O-N 2.91Å; W875-L878 HydrophobicContact CB-CB 4.27Å; W875-L878 HydrophobicContact CB-CD1 3.93Å; W875-L878 HydrophobicContact CB-CG 4.06Å; W875-L878 HydrophobicContact CD2-CD1 4.11Å; W875-L878 HydrophobicContact CE3-CD1 3.89Å; W875-L878 HydrophobicContact CG-CD1 4.17Å; W875-L878 PolarHBondContact O-N 3.22Å; W875-L878 VanDerWaalsContact O-N 3.07Å
876	P	77.9	Confident	75.5	Confident	68 Å²	68	52 Å²	52	44%	0.442	26%	0.264	S	S	.	.	H	α-helix	trans	-63.7	-24.8	177.8	29.4	-36.1	0	0	0	112.2	L878 L879 A880 L924	P876-L878 VanDerWaalsContact C-N 3.25Å; P876-L878 PolarHBondContact O-N 3.12Å; P876-L879 PolarHBondContact O-N 3.17Å; P876-A880 PolarHBondContact O-N 2.92Å; P876-L924 HydrophobicContact CB-CD1 3.95Å
877	D	83.1	Confident	76.8	Confident	58 Å²	58	51 Å²	51	31%	0.31	26%	0.256	S	S	.	.	H	α-helix	trans	-52.8	-40.9	169.4	52.8	-37.6	0	0	0	112.3	K800 W875 E881	K800-D877 IonicContact NZ-OD2 2.62Å; K800-D877 PolarHBondContact NZ-OD2 3.43Å; W875-D877 WeakPolarHBondContact CA-OD1 3.41Å; W875-D877 WeakPolarHBondContact CB-OD1 3.42Å; W875-D877 PolarHBondContact O-N 2.91Å; D877-E881 WeakPolarHBondContact O-CG 3.43Å; D877-E881 PolarHBondContact O-N 3.04Å
878	L	85.5	Confident	78.6	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-76.4	-26.2	-179.3	-66.1	-177.3	0	0	0	113.7	K800 V803 R804 L807 W875 P876 H882	K800-L878 HydrophobicContact CB-CD1 4.15Å; K800-L878 HydrophobicContact CD-CD1 4.41Å; K800-L878 HydrophobicContact CG-CD1 4.05Å; V803-L878 HydrophobicContact CB-CD1 4.2Å; V803-L878 HydrophobicContact CG1-CD1 3.91Å; R804-L878 HydrophobicContact CB-CD2 4.02Å; L807-L878 HydrophobicContact CD1-CB 3.84Å; W875-L878 HydrophobicContact CB-CB 4.27Å; W875-L878 HydrophobicContact CB-CD1 3.93Å; W875-L878 HydrophobicContact CB-CG 4.06Å; W875-L878 HydrophobicContact CD2-CD1 4.11Å; W875-L878 HydrophobicContact CE3-CD1 3.89Å; W875-L878 HydrophobicContact CG-CD1 4.17Å; W875-L878 PolarHBondContact O-N 3.22Å; W875-L878 VanDerWaalsContact O-N 3.07Å; P876-L878 VanDerWaalsContact C-N 3.25Å; P876-L878 PolarHBondContact O-N 3.12Å; L878-H882 PolarHBondContact O-N 3.28Å
879	L	85	Confident	80.6	Confident	25 Å²	25	49.5 Å²	49.5	13%	0.131	24%	0.244	C	C	.	.	H	α-helix	trans	-80.3	-34.1	172.7	-81.6	-176.6	0	0	0	112.5	A866 F872 P876 E881 H882 A883	A866-L879 HydrophobicContact CB-CD1 3.46Å; A866-L879 VanDerWaalsContact CB-CD1 3.46Å; F872-L879 HydrophobicContact CB-CD1 3.44Å; F872-L879 VanDerWaalsContact CB-CD1 3.44Å; F872-L879 HydrophobicContact CB-CG 3.76Å; F872-L879 HydrophobicContact CD2-CD1 3.98Å; F872-L879 HydrophobicContact CD2-CD2 3.95Å; F872-L879 HydrophobicContact CD2-CG 4.09Å; F872-L879 HydrophobicContact CE2-CD2 4.36Å; F872-L879 HydrophobicContact CG-CD1 3.96Å; F872-L879 HydrophobicContact CG-CD2 4.24Å; F872-L879 HydrophobicContact CG-CG 3.93Å; P876-L879 PolarHBondContact O-N 3.17Å; L879-E881 VanDerWaalsContact C-N 3.32Å; L879-H882 HydrophobicContact CD2-CB 4.34Å; L879-H882 WeakPolarHBondContact O-CB 3.39Å; L879-H882 PolarHBondContact O-N 3.38Å; L879-A883 PolarHBondContact O-N 3.29Å
880	A	86.1	Confident	82.7	Confident	20 Å²	20	38.8 Å²	38.8	17%	0.165	20%	0.203	C	C	.	.	H	α-helix	trans	-61.3	-42.3	168.5	0	0	0	0	0	111.1	P876 H882 A883 E884 L924	P876-A880 PolarHBondContact O-N 2.92Å; A880-H882 PolarHBondContact O-N 2.92Å; A880-A883 PolarHBondContact O-N 2.99Å; A880-E884 WeakPolarHBondContact O-CB 3.5Å; A880-E884 WeakPolarHBondContact O-CG 3.43Å; A880-E884 PolarHBondContact O-N 2.97Å; A880-L924 HydrophobicContact CB-CB 3.84Å; A880-L924 HydrophobicContact CB-CD1 4.19Å
881	E	86.5	Confident	84.1	Confident	64 Å²	64	38 Å²	38	30%	0.299	20%	0.201	S	C	.	.	H	α-helix	trans	-61.8	-38.3	171.3	-77.9	-172.6	-138.7	0	0	113.2	R804 D877 L879 K885	R804-E881 WeakPolarHBondContact CD-OE2 3.22Å; R804-E881 WeakPolarHBondContact CG-OE2 3.46Å; R804-E881 IonicContact CZ-OE1 2.91Å; R804-E881 IonicContact CZ-OE2 3.93Å; R804-E881 IonicContact NE-OE1 3.77Å; R804-E881 PolarHBondContact NE-OE1 3.01Å; R804-E881 IonicContact NE-OE2 3.96Å; R804-E881 PolarHBondContact NE-OE2 3.48Å; R804-E881 IonicContact NH2-OE1 3.25Å; R804-E881 PolarHBondContact NH2-OE1 3.32Å; R804-E881 IonicContact NH2-OE2 2.92Å; D877-E881 WeakPolarHBondContact O-CG 3.43Å; D877-E881 PolarHBondContact O-N 3.04Å; L879-E881 VanDerWaalsContact C-N 3.32Å; E881-K885 WeakPolarHBondContact O-CB 3.26Å; E881-K885 WeakPolarHBondContact O-CG 3.2Å; E881-K885 PolarHBondContact O-N 2.88Å
882	H	90.6	Very high	85.4	Confident	4 Å²	4	41.9 Å²	41.9	2%	0.019	22%	0.223	C	C	.	.	H	α-helix	trans	-61.3	-47.7	173.6	173.1	-86.8	0	0	0	111.6	L807 A810 A811 N814 N861 L878 L879 A880 K885 F886	L807-H882 HydrophobicContact CB-CB 4.29Å; L807-H882 HydrophobicContact CD2-CB 4.48Å; L807-H882 PolarHBondContact O-CD2 3.21Å; A810-H882 PolarHBondContact O-NE2 3.02Å; A811-H882 WeakPolarHBondContact CA-NE2 3.46Å; A811-H882 PolarHBondContact N-NE2 3.49Å; N814-H882 PolarHBondContact ND2-CE1 2.84Å; N814-H882 PolarHBondContact ND2-NE2 3.39Å; N861-H882 PolarHBondContact ND2-CE1 3.09Å; L878-H882 PolarHBondContact O-N 3.28Å; L879-H882 HydrophobicContact CD2-CB 4.34Å; L879-H882 WeakPolarHBondContact O-CB 3.39Å; L879-H882 PolarHBondContact O-N 3.38Å; A880-H882 PolarHBondContact O-N 2.92Å; H882-K885 PolarHBondContact O-N 3Å; H882-F886 AromaticContact CE1-CD2 3.97Å; H882-F886 WeakPolarHBondContact O-CB 3.45Å; H882-F886 PolarHBondContact O-N 3.02Å
883	A	90.3	Very high	86.2	Confident	9 Å²	9	44.1 Å²	44.1	7%	0.074	24%	0.236	C	C	.	.	H	α-helix	trans	-67.8	-42.6	-178.9	0	0	0	0	0	112.2	L858 L879 A880 K885 F886 W887 L925	L858-A883 HydrophobicContact CD1-CB 4.31Å; L858-A883 HydrophobicContact CD2-CB 4.07Å; L879-A883 PolarHBondContact O-N 3.29Å; A880-A883 PolarHBondContact O-N 2.99Å; A883-K885 VanDerWaalsContact C-N 3.3Å; A883-K885 PolarHBondContact O-N 2.88Å; A883-F886 WeakPolarHBondContact O-CB 3.4Å; A883-F886 PolarHBondContact O-N 3.39Å; A883-F886 VanDerWaalsContact O-N 3.16Å; A883-W887 WeakPolarHBondContact O-CB 3.44Å; A883-W887 PolarHBondContact O-N 3.45Å; A883-L925 HydrophobicContact CB-CD1 3.79Å; A883-L925 HydrophobicContact CB-CD2 4.06Å
884	E	90.5	Very high	87.4	Confident	38 Å²	38	42 Å²	42	18%	0.178	22%	0.218	C	C	.	.	H	α-helix	trans	-60.1	-37.9	172.2	-77.4	-94.8	-125.2	0	0	112.1	A880 A888 L925 K929 F930	A880-E884 WeakPolarHBondContact O-CB 3.5Å; A880-E884 WeakPolarHBondContact O-CG 3.43Å; A880-E884 PolarHBondContact O-N 2.97Å; E884-A888 WeakPolarHBondContact O-CB 3.36Å; E884-A888 PolarHBondContact O-N 3.21Å; E884-L925 HydrophobicContact CG-CD2 3.84Å; E884-K929 PolarHBondContact OE1-N 3.45Å; E884-K929 PolarHBondContact OE2-N 2.9Å; E884-F930 PolarHBondContact OE2-N 3.32Å
885	K	91.2	Very high	88.6	Confident	91 Å²	91	34.8 Å²	34.8	40%	0.396	19%	0.193	S	C	.	.	H	α-helix	trans	-70	-34.1	175	-71.6	-83	175.9	158.2	0	112.7	E808 A811 E881 H882 A883 L889	E808-K885 HydrophobicContact CG-CD 4.25Å; E808-K885 HydrophobicContact CG-CG 4.36Å; E808-K885 VanDerWaalsContact OE1-CE 3.29Å; E808-K885 WeakPolarHBondContact OE1-CE 3.45Å; E808-K885 IonicContact OE1-NZ 2.78Å; E808-K885 PolarHBondContact OE1-NZ 3.07Å; A811-K885 HydrophobicContact CB-CB 3.93Å; E881-K885 WeakPolarHBondContact O-CB 3.26Å; E881-K885 WeakPolarHBondContact O-CG 3.2Å; E881-K885 PolarHBondContact O-N 2.88Å; H882-K885 PolarHBondContact O-N 3Å; A883-K885 VanDerWaalsContact C-N 3.3Å; A883-K885 PolarHBondContact O-N 2.88Å; K885-L889 WeakPolarHBondContact O-CG 3.33Å; K885-L889 PolarHBondContact O-N 3.21Å
886	F	92.3	Very high	89.2	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-70.8	-46.5	176.1	-175.8	-87.4	0	0	0	110.8	A811 N814 Y815 L818 C854 V857 L858 H882 A883 A888 L889 F890	A811-F886 HydrophobicContact CB-CB 4.19Å; N814-F886 HydrophobicContact CB-CD2 4.26Å; N814-F886 HydrophobicContact CB-CE2 3.89Å; Y815-F886 HydrophobicContact CD2-CE1 4.3Å; Y815-F886 HydrophobicContact CD2-CE2 4.2Å; Y815-F886 HydrophobicContact CD2-CZ 4.05Å; Y815-F886 HydrophobicContact CG-CE2 4.5Å; L818-F886 HydrophobicContact CD2-CZ 3.87Å; C854-F886 HydrophobicContact CB-CE1 3.8Å; V857-F886 HydrophobicContact CB-CZ 4.46Å; V857-F886 HydrophobicContact CG1-CE2 4.05Å; V857-F886 HydrophobicContact CG1-CZ 3.81Å; L858-F886 HydrophobicContact CD1-CD1 4.03Å; L858-F886 HydrophobicContact CD1-CE1 4.41Å; L858-F886 HydrophobicContact CD2-CB 4.43Å; L858-F886 HydrophobicContact CD2-CD1 4.04Å; L858-F886 HydrophobicContact CD2-CE1 4.49Å; L858-F886 HydrophobicContact CD2-CG 4.19Å; L858-F886 HydrophobicContact CG-CD1 4.12Å; L858-F886 HydrophobicContact CG-CE1 4.26Å; H882-F886 AromaticContact CE1-CD2 3.97Å; H882-F886 WeakPolarHBondContact O-CB 3.45Å; H882-F886 PolarHBondContact O-N 3.02Å; A883-F886 WeakPolarHBondContact O-CB 3.4Å; A883-F886 PolarHBondContact O-N 3.39Å; A883-F886 VanDerWaalsContact O-N 3.16Å; F886-A888 PolarHBondContact O-N 3.23Å; F886-L889 WeakPolarHBondContact O-CB 3.35Å; F886-L889 PolarHBondContact O-N 3.08Å; F886-L889 VanDerWaalsContact O-N 3.14Å; F886-F890 PolarHBondContact O-N 3.4Å
887	W	93.1	Very high	89.7	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-62.9	-39.1	174.2	-75.9	126.4	0	0	0	112.8	C854 I855 L858 A883 L889 F890 T891 L915 F918 F930	C854-W887 HydrophobicContact CB-CH2 3.7Å; C854-W887 HydrophobicContact CB-CZ3 3.8Å; I855-W887 HydrophobicContact CG1-CH2 4Å; I855-W887 HydrophobicContact CG1-CZ2 4.21Å; L858-W887 HydrophobicContact CD1-CD2 4.35Å; L858-W887 VanDerWaalsContact CD1-CE2 3.47Å; L858-W887 HydrophobicContact CD1-CZ2 3.66Å; L858-W887 VanDerWaalsContact CD1-NE1 3.26Å; A883-W887 WeakPolarHBondContact O-CB 3.44Å; A883-W887 PolarHBondContact O-N 3.45Å; W887-L889 PolarHBondContact O-N 3.33Å; W887-L889 VanDerWaalsContact O-N 3.16Å; W887-F890 HydrophobicContact CE3-CB 3.99Å; W887-F890 AromaticContact CE3-CD1 3.74Å; W887-F890 HydrophobicContact CE3-CD1 3.74Å; W887-F890 HydrophobicContact CE3-CE1 4.48Å; W887-F890 AromaticContact CE3-CG 3.95Å; W887-F890 HydrophobicContact CE3-CG 3.95Å; W887-F890 HydrophobicContact CZ3-CB 4.42Å; W887-F890 AromaticContact CZ3-CD1 3.79Å; W887-F890 HydrophobicContact CZ3-CD1 3.79Å; W887-F890 HydrophobicContact CZ3-CD2 4.49Å; W887-F890 HydrophobicContact CZ3-CE1 4.16Å; W887-F890 AromaticContact CZ3-CG 3.98Å; W887-F890 HydrophobicContact CZ3-CG 3.98Å; W887-F890 CarbonylContact O-C 3.6Å; W887-F890 WeakPolarHBondContact O-CA 3.2Å; W887-F890 WeakPolarHBondContact O-CB 3.5Å; W887-F890 PolarHBondContact O-N 3.13Å; W887-T891 PolarHBondContact O-N 2.92Å; W887-T891 PolarHBondContact O-OG1 3.04Å; W887-T891 VanDerWaalsContact O-OG1 3.04Å; W887-L915 HydrophobicContact CH2-CD2 3.58Å; W887-L915 HydrophobicContact CZ2-CD2 4.45Å; W887-L915 HydrophobicContact CZ3-CD2 3.62Å; W887-F918 AromaticContact CZ2-CD1 3.86Å; W887-F918 HydrophobicContact CZ2-CD1 3.86Å; W887-F918 AromaticContact CZ2-CE1 3.8Å; W887-F918 HydrophobicContact CZ2-CE1 3.8Å; W887-F930 HydrophobicContact CB-CB 3.75Å; W887-F930 HydrophobicContact CB-CD1 3.65Å; W887-F930 HydrophobicContact CB-CD2 4.01Å; W887-F930 HydrophobicContact CB-CE1 4.23Å; W887-F930 HydrophobicContact CB-CG 3.52Å; W887-F930 AromaticContact CD2-CD1 3.75Å; W887-F930 HydrophobicContact CD2-CD1 3.75Å; W887-F930 AromaticContact CD2-CE1 3.64Å; W887-F930 HydrophobicContact CD2-CE1 3.64Å; W887-F930 HydrophobicContact CD2-CZ 4.33Å; W887-F930 HydrophobicContact CE3-CD1 4.06Å; W887-F930 AromaticContact CE3-CE1 3.5Å; W887-F930 HydrophobicContact CE3-CE1 3.5Å; W887-F930 VanDerWaalsContact CE3-CE1 3.5Å; W887-F930 AromaticContact CE3-CZ 3.79Å; W887-F930 HydrophobicContact CE3-CZ 3.79Å; W887-F930 HydrophobicContact CG-CB 4.38Å; W887-F930 AromaticContact CG-CD1 3.57Å; W887-F930 HydrophobicContact CG-CD1 3.57Å; W887-F930 AromaticContact CG-CE1 3.98Å; W887-F930 HydrophobicContact CG-CE1 3.98Å; W887-F930 AromaticContact CG-CG 3.99Å; W887-F930 HydrophobicContact CG-CG 3.99Å; W887-F930 HydrophobicContact CZ3-CE1 4.12Å; W887-F930 HydrophobicContact CZ3-CZ 4.38Å
888	A	91.4	Very high	90	Very high	56 Å²	56	32 Å²	32	46%	0.463	18%	0.182	S	C	.	.	H	α-helix	trans	-64.7	-15.7	175.1	0	0	0	0	0	114.4	E884 F886	E884-A888 WeakPolarHBondContact O-CB 3.36Å; E884-A888 PolarHBondContact O-N 3.21Å; F886-A888 PolarHBondContact O-N 3.23Å
889	L	91.7	Very high	90.1	Very high	50 Å²	50	40.1 Å²	40.1	26%	0.262	22%	0.22	S	C	.	.	H	α-helix	trans	-82.8	-44.3	167.5	-64.6	167.7	0	0	0	110.5	L812 Y815 K885 F886 W887 T891 V892	L812-L889 HydrophobicContact CB-CD1 4.26Å; L812-L889 HydrophobicContact CD1-CD1 3.97Å; L812-L889 HydrophobicContact CD1-CD2 4.21Å; Y815-L889 HydrophobicContact CD1-CB 3.59Å; Y815-L889 HydrophobicContact CD1-CD1 4.11Å; Y815-L889 HydrophobicContact CD1-CG 4.42Å; Y815-L889 HydrophobicContact CD2-CB 4.33Å; Y815-L889 HydrophobicContact CE1-CB 3.84Å; Y815-L889 HydrophobicContact CG-CB 3.86Å; Y815-L889 HydrophobicContact CG-CD1 4.13Å; K885-L889 WeakPolarHBondContact O-CG 3.33Å; K885-L889 PolarHBondContact O-N 3.21Å; F886-L889 WeakPolarHBondContact O-CB 3.35Å; F886-L889 PolarHBondContact O-N 3.08Å; F886-L889 VanDerWaalsContact O-N 3.14Å; W887-L889 PolarHBondContact O-N 3.33Å; W887-L889 VanDerWaalsContact O-N 3.16Å; L889-T891 VanDerWaalsContact C-N 3.25Å; L889-T891 PolarHBondContact O-N 3.21Å; L889-V892 PolarHBondContact O-N 2.79Å
890	F	93.3	Very high	90.2	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-57.6	-35.5	173.6	176.7	-93.6	0	0	0	113	Y815 I847 L850 A851 F886 W887 V892 D893 M894 L911 L915 F930	Y815-F890 HydrophobicContact CE2-CB 3.83Å; Y815-F890 HydrophobicContact CE2-CD2 4.37Å; Y815-F890 WeakPolarHBondContact OH-CA 3.36Å; I847-F890 HydrophobicContact CG2-CE2 4.16Å; I847-F890 HydrophobicContact CG2-CZ 3.8Å; L850-F890 HydrophobicContact CB-CE2 4.35Å; L850-F890 HydrophobicContact CD2-CD2 4.1Å; L850-F890 HydrophobicContact CD2-CE2 4.17Å; L850-F890 HydrophobicContact CG-CD2 4.12Å; L850-F890 HydrophobicContact CG-CE2 4.04Å; A851-F890 HydrophobicContact CB-CE2 4.08Å; A851-F890 HydrophobicContact CB-CZ 3.77Å; F886-F890 PolarHBondContact O-N 3.4Å; W887-F890 HydrophobicContact CE3-CB 3.99Å; W887-F890 AromaticContact CE3-CD1 3.74Å; W887-F890 HydrophobicContact CE3-CD1 3.74Å; W887-F890 HydrophobicContact CE3-CE1 4.48Å; W887-F890 AromaticContact CE3-CG 3.95Å; W887-F890 HydrophobicContact CE3-CG 3.95Å; W887-F890 HydrophobicContact CZ3-CB 4.42Å; W887-F890 AromaticContact CZ3-CD1 3.79Å; W887-F890 HydrophobicContact CZ3-CD1 3.79Å; W887-F890 HydrophobicContact CZ3-CD2 4.49Å; W887-F890 HydrophobicContact CZ3-CE1 4.16Å; W887-F890 AromaticContact CZ3-CG 3.98Å; W887-F890 HydrophobicContact CZ3-CG 3.98Å; W887-F890 CarbonylContact O-C 3.6Å; W887-F890 WeakPolarHBondContact O-CA 3.2Å; W887-F890 WeakPolarHBondContact O-CB 3.5Å; W887-F890 PolarHBondContact O-N 3.13Å; F890-V892 PolarHBondContact O-N 3.23Å; F890-D893 PolarHBondContact O-N 3Å; F890-M894 HydrophobicContact CD1-CB 4.07Å; F890-M894 HydrophobicContact CD1-SD 4.39Å; F890-M894 HydrophobicContact CE1-CB 3.72Å; F890-M894 HydrophobicContact CE1-CG 3.89Å; F890-M894 HydrophobicContact CE1-SD 3.76Å; F890-M894 HydrophobicContact CZ-CB 4.18Å; F890-M894 HydrophobicContact CZ-CG 4.37Å; F890-M894 WeakPolarHBondContact O-CB 3.26Å; F890-M894 PolarHBondContact O-N 3.34Å; F890-L911 HydrophobicContact CZ-CD1 4.48Å; F890-L915 HydrophobicContact CE1-CD1 4.01Å; F890-L915 HydrophobicContact CE1-CD2 4.39Å; F890-F930 HydrophobicContact CD1-CE2 4.12Å; F890-F930 AromaticContact CD1-CZ 3.77Å; F890-F930 HydrophobicContact CD1-CZ 3.77Å; F890-F930 HydrophobicContact CE1-CZ 4.05Å
891	T	92.1	Very high	90.2	Very high	18 Å²	18	41 Å²	41	11%	0.11	23%	0.226	C	C	.	.	H	α-helix	trans	-49.3	-40.8	174.1	-58.7	0	0	0	0	113	W887 L889 M894 D895 F930 H933	W887-T891 PolarHBondContact O-N 2.92Å; W887-T891 PolarHBondContact O-OG1 3.04Å; W887-T891 VanDerWaalsContact O-OG1 3.04Å; L889-T891 VanDerWaalsContact C-N 3.25Å; L889-T891 PolarHBondContact O-N 3.21Å; T891-M894 PolarHBondContact O-N 3.42Å; T891-D895 WeakPolarHBondContact CG2-OD2 3.31Å; T891-D895 VanDerWaalsContact O-CB 3.28Å; T891-D895 WeakPolarHBondContact O-CB 3.45Å; T891-D895 PolarHBondContact O-N 3.45Å; T891-F930 VanDerWaalsContact OG1-CD2 3.29Å; T891-F930 WeakPolarHBondContact OG1-CD2 3.47Å; T891-F930 WeakPolarHBondContact OG1-CE2 3.39Å; T891-H933 VanDerWaalsContact CG2-NE2 3.28Å; T891-H933 WeakPolarHBondContact CG2-NE2 3.48Å
892	V	90.3	Very high	90	Very high	90 Å²	90	41.9 Å²	41.9	55%	0.545	24%	0.238	S	C	.	.	H	α-helix	trans	-66.7	-44.1	-175.6	-176.8	0	0	0	0	111.3	L889 F890 T896	L889-V892 PolarHBondContact O-N 2.79Å; F890-V892 PolarHBondContact O-N 3.23Å; V892-T896 WeakPolarHBondContact O-CB 3.44Å; V892-T896 PolarHBondContact O-N 2.88Å; V892-T896 PolarHBondContact O-OG1 3.45Å
893	D	89.6	Confident	89.1	Confident	49 Å²	49	48.5 Å²	48.5	26%	0.262	27%	0.269	S	S	.	.	H	α-helix	trans	-74.6	-34.8	178.4	-78	4.1	0	0	0	111	Y815 I847 F890 A897	Y815-D893 PolarHBondContact OH-OD2 3.11Å; I847-D893 HydrophobicContact CD1-CB 3.86Å; F890-D893 PolarHBondContact O-N 3Å; D893-A897 PolarHBondContact O-N 2.93Å; D893-A897 VanDerWaalsContact O-N 3.15Å
894	M	91.8	Very high	88.4	Confident	0 Å²	0	52 Å²	52	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-64	-55.2	174.8	-174.1	-167.9	76.2	0	0	112.3	I847 F890 T891 T896 A897 L898 L911 L915 F930 L934 I937	I847-M894 HydrophobicContact CG2-CB 4.47Å; I847-M894 HydrophobicContact CG2-CG 4.45Å; F890-M894 HydrophobicContact CD1-CB 4.07Å; F890-M894 HydrophobicContact CD1-SD 4.39Å; F890-M894 HydrophobicContact CE1-CB 3.72Å; F890-M894 HydrophobicContact CE1-CG 3.89Å; F890-M894 HydrophobicContact CE1-SD 3.76Å; F890-M894 HydrophobicContact CZ-CB 4.18Å; F890-M894 HydrophobicContact CZ-CG 4.37Å; F890-M894 WeakPolarHBondContact O-CB 3.26Å; F890-M894 PolarHBondContact O-N 3.34Å; T891-M894 PolarHBondContact O-N 3.42Å; M894-T896 VanDerWaalsContact C-N 3.28Å; M894-T896 PolarHBondContact O-N 3.36Å; M894-A897 PolarHBondContact O-N 3.43Å; M894-L898 HydrophobicContact CE-CD1 4.21Å; M894-L898 HydrophobicContact CG-CD1 3.9Å; M894-L898 HydrophobicContact CG-CG 4.46Å; M894-L898 WeakPolarHBondContact O-CG 3.32Å; M894-L898 PolarHBondContact O-N 3.33Å; M894-L898 HydrophobicContact SD-CD1 4.38Å; M894-L911 HydrophobicContact CG-CD2 4.22Å; M894-L915 HydrophobicContact SD-CD1 4.05Å; M894-F930 HydrophobicContact CE-CE2 4.23Å; M894-F930 HydrophobicContact SD-CE2 4.2Å; M894-F930 HydrophobicContact SD-CZ 4.14Å; M894-L934 HydrophobicContact CE-CD1 4.44Å; M894-L934 HydrophobicContact SD-CD1 4.13Å; M894-I937 HydrophobicContact CE-CD1 4.16Å
895	D	91.9	Very high	87.9	Confident	38 Å²	38	50.8 Å²	50.8	20%	0.203	28%	0.282	C	S	.	.	H	α-helix	trans	-59	-43.1	-179	-68.4	-1.6	0	0	0	109.9	T891 A897 L898 E899 H933 I937	T891-D895 WeakPolarHBondContact CG2-OD2 3.31Å; T891-D895 VanDerWaalsContact O-CB 3.28Å; T891-D895 WeakPolarHBondContact O-CB 3.45Å; T891-D895 PolarHBondContact O-N 3.45Å; D895-A897 VanDerWaalsContact C-N 3.3Å; D895-A897 PolarHBondContact O-N 3.01Å; D895-L898 PolarHBondContact O-N 3.11Å; D895-L898 VanDerWaalsContact O-N 3.17Å; D895-E899 WeakPolarHBondContact O-CB 3.37Å; D895-E899 WeakPolarHBondContact O-CG 3.43Å; D895-E899 PolarHBondContact O-N 3.43Å; D895-H933 VanDerWaalsContact CG-NE2 3.31Å; D895-H933 IonicContact OD1-CD2 2.66Å; D895-H933 IonicContact OD1-CE1 3Å; D895-H933 IonicContact OD1-NE2 3.47Å; D895-H933 PolarHBondContact OD1-NE2 3.21Å; D895-H933 IonicContact OD2-CE1 2.67Å; D895-H933 PolarHBondContact OD2-CE1 2.95Å; D895-H933 VanDerWaalsContact OD2-CE1 3.25Å; D895-H933 IonicContact OD2-NE2 3.15Å; D895-H933 PolarHBondContact OD2-NE2 2.92Å; D895-I937 VanDerWaalsContact OD1-CD1 3.23Å; D895-I937 WeakPolarHBondContact OD1-CD1 3.41Å
896	T	89.6	Confident	87.7	Confident	88 Å²	88	49.7 Å²	49.7	54%	0.54	28%	0.275	S	S	.	.	H	α-helix	trans	-59.6	-36.4	176	-59	0	0	0	0	112.8	V892 M894 A900	V892-T896 WeakPolarHBondContact O-CB 3.44Å; V892-T896 PolarHBondContact O-N 2.88Å; V892-T896 PolarHBondContact O-OG1 3.45Å; M894-T896 VanDerWaalsContact C-N 3.28Å; M894-T896 PolarHBondContact O-N 3.36Å; T896-A900 PolarHBondContact O-N 3.37Å
897	A	88.4	Confident	87.3	Confident	5 Å²	5	55 Å²	55	4%	0.041	30%	0.304	C	S	.	.	H	α-helix	trans	-79.3	-29.2	177.1	0	0	0	0	0	113.1	K843 I847 D893 M894 D895 Q901	K843-A897 HydrophobicContact CB-CB 4.47Å; I847-A897 HydrophobicContact CB-CB 4.32Å; I847-A897 HydrophobicContact CG1-CB 3.55Å; D893-A897 PolarHBondContact O-N 2.93Å; D893-A897 VanDerWaalsContact O-N 3.15Å; M894-A897 PolarHBondContact O-N 3.43Å; D895-A897 VanDerWaalsContact C-N 3.3Å; D895-A897 PolarHBondContact O-N 3.01Å; A897-Q901 WeakPolarHBondContact O-CG 3.49Å; A897-Q901 PolarHBondContact O-NE2 3.4Å
898	L	88.2	Confident	87.1	Confident	25 Å²	25	55.3 Å²	55.3	13%	0.131	31%	0.306	C	S	.	.	H	α-helix	trans	-75.7	-42.1	175.3	-68.7	174	0	0	0	111.7	L844 M894 D895 A900 Q901 L911 I937 F938	L844-L898 HydrophobicContact CD1-CD2 4.32Å; M894-L898 HydrophobicContact CE-CD1 4.21Å; M894-L898 HydrophobicContact CG-CD1 3.9Å; M894-L898 HydrophobicContact CG-CG 4.46Å; M894-L898 WeakPolarHBondContact O-CG 3.32Å; M894-L898 PolarHBondContact O-N 3.33Å; M894-L898 HydrophobicContact SD-CD1 4.38Å; D895-L898 PolarHBondContact O-N 3.11Å; D895-L898 VanDerWaalsContact O-N 3.17Å; L898-A900 PolarHBondContact O-N 2.83Å; L898-Q901 WeakPolarHBondContact O-CB 3.46Å; L898-Q901 PolarHBondContact O-N 2.83Å; L898-L911 HydrophobicContact CD2-CD2 4.49Å; L898-I937 HydrophobicContact CD1-CG2 4.04Å; L898-F938 HydrophobicContact CD1-CE2 3.91Å; L898-F938 HydrophobicContact CD1-CZ 4.23Å; L898-F938 HydrophobicContact CD2-CZ 4.1Å
899	E	87.8	Confident	87	Confident	172 Å²	172	53 Å²	53	80%	0.804	29%	0.285	S	S	*	.	H	α-helix	trans	-60.2	-25.8	171.8	-75.1	-169.8	168.4	0	0	112.8	D895 Q901	D895-E899 WeakPolarHBondContact O-CB 3.37Å; D895-E899 WeakPolarHBondContact O-CG 3.43Å; D895-E899 PolarHBondContact O-N 3.43Å; E899-Q901 VanDerWaalsContact C-N 3.31Å
900	A	87.1	Confident	87	Confident	36 Å²	36	53.4 Å²	53.4	30%	0.298	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-9.3	176.7	0	0	0	0	0	114.2	P840 K843 T896 L898	P840-A900 WeakPolarHBondContact CB-O 3.28Å; P840-A900 WeakPolarHBondContact CG-O 2.86Å; K843-A900 HydrophobicContact CD-CB 4.32Å; T896-A900 PolarHBondContact O-N 3.37Å; L898-A900 PolarHBondContact O-N 2.83Å
901	Q	85.8	Confident	86.8	Confident	28 Å²	28	53.4 Å²	53.4	13%	0.131	29%	0.291	C	S	.	.	S	Bend	trans	-82	152	-178.9	-56.2	-49.9	-42	0	0	112.9	P840 A897 L898 E899	P840-Q901 PolarHBondContact O-NE2 2.88Å; P840-Q901 PolarHBondContact O-OE1 3.17Å; A897-Q901 WeakPolarHBondContact O-CG 3.49Å; A897-Q901 PolarHBondContact O-NE2 3.4Å; L898-Q901 WeakPolarHBondContact O-CB 3.46Å; L898-Q901 PolarHBondContact O-N 2.83Å; E899-Q901 VanDerWaalsContact C-N 3.31Å
902	P	82.8	Confident	86.8	Confident	83 Å²	83	52.6 Å²	52.6	54%	0.539	29%	0.286	S	S	.	.			trans	-58.3	143.6	166.1	-21.3	32.8	0	0	0	111.8	D904 S905	P902-D904 PolarHBondContact O-N 2.87Å; P902-S905 WeakPolarHBondContact O-CB 3.4Å; P902-S905 PolarHBondContact O-N 2.94Å
903	Q	72.3	Confident	86.8	Confident	142 Å²	142	50.6 Å²	50.6	66%	0.664	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-13.2	-178.9	-67	-165.9	0.2	0	0	115.7	R944	Q903-R944 VanDerWaalsContact O-CZ 3.32Å; Q903-R944 PolarHBondContact O-NE 2.86Å
904	D	75.1	Confident	86.9	Confident	83 Å²	83	50.8 Å²	50.8	44%	0.444	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123.5	27.2	178.4	-57.6	-73.1	0	0	0	111.1	P902 W906 R944	P902-D904 PolarHBondContact O-N 2.87Å; D904-W906 HydrophobicContact CB-CZ2 4.29Å; D904-W906 PolarHBondContact O-NE1 3.11Å; D904-R944 IonicContact OD1-CZ 3.35Å; D904-R944 IonicContact OD1-NE 2.71Å; D904-R944 PolarHBondContact OD1-NE 3.14Å; D904-R944 IonicContact OD1-NH2 3.64Å; D904-R944 PolarHBondContact OD1-NH2 3.5Å; D904-R944 IonicContact OD2-CZ 3.21Å; D904-R944 IonicContact OD2-NH2 2.91Å; D904-R944 PolarHBondContact OD2-NH2 3.29Å
905	S	81.2	Confident	86.8	Confident	13 Å²	13	50.8 Å²	50.8	9%	0.091	27%	0.271	C	S	.	.			trans	-86.4	136.9	164.9	164.7	0	0	0	0	109.9	P902 D907	P902-S905 WeakPolarHBondContact O-CB 3.4Å; P902-S905 PolarHBondContact O-N 2.94Å; S905-D907 PolarHBondContact OG-N 3.24Å; S905-D907 PolarHBondContact OG-OD2 3.4Å
906	W	85.4	Confident	86.8	Confident	67 Å²	67	49 Å²	49	25%	0.254	26%	0.262	S	S	.	.			trans	-112.6	2.7	179.3	-47.7	116.3	0	0	0	111.9	D904 S908 F909 R944 Y945 L948	D904-W906 HydrophobicContact CB-CZ2 4.29Å; D904-W906 PolarHBondContact O-NE1 3.11Å; W906-S908 PolarHBondContact O-N 2.82Å; W906-S908 VanDerWaalsContact O-N 3.08Å; W906-F909 HydrophobicContact CB-CD2 3.9Å; W906-F909 HydrophobicContact CB-CE2 3.81Å; W906-F909 HydrophobicContact CD2-CE2 4.17Å; W906-F909 AromaticContact CE3-CE2 3.59Å; W906-F909 HydrophobicContact CE3-CE2 3.59Å; W906-F909 AromaticContact CE3-CZ 3.85Å; W906-F909 HydrophobicContact CE3-CZ 3.85Å; W906-F909 HydrophobicContact CG-CE2 4.28Å; W906-F909 HydrophobicContact CZ3-CZ 4.41Å; W906-F909 WeakPolarHBondContact O-CD2 3.41Å; W906-F909 PolarHBondContact O-N 3.15Å; W906-R944 HydrophobicContact CH2-CB 4.32Å; W906-R944 HydrophobicContact CH2-CG 4.05Å; W906-Y945 AromaticContact CD2-CD2 3.55Å; W906-Y945 HydrophobicContact CD2-CD2 3.55Å; W906-Y945 HydrophobicContact CD2-CE2 4.23Å; W906-Y945 HydrophobicContact CD2-CG 4.38Å; W906-Y945 AromaticContact CE2-CD2 3.68Å; W906-Y945 AromaticContact CE3-CD2 3.91Å; W906-Y945 HydrophobicContact CE3-CD2 3.91Å; W906-Y945 HydrophobicContact CE3-CG 4.29Å; W906-Y945 AromaticContact CG-CD2 3.9Å; W906-Y945 HydrophobicContact CG-CD2 3.9Å; W906-Y945 HydrophobicContact CG-CE2 4.1Å; W906-Y945 HydrophobicContact CH2-CD2 4.44Å; W906-Y945 HydrophobicContact CZ2-CD2 4.15Å; W906-Y945 HydrophobicContact CZ3-CD2 4.33Å; W906-Y945 HydrophobicContact CZ3-CG 4.5Å; W906-L948 HydrophobicContact CH2-CD1 4.05Å; W906-L948 HydrophobicContact CZ2-CD1 3.71Å
907	D	84.8	Confident	86.8	Confident	113 Å²	113	47.3 Å²	47.3	60%	0.604	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-9.5	-172.9	-49	-74.9	0	0	0	112.4	L844 S905 P910	L844-D907 HydrophobicContact CD2-CB 3.84Å; L844-D907 WeakPolarHBondContact CD2-O 3.42Å; S905-D907 PolarHBondContact OG-N 3.24Å; S905-D907 PolarHBondContact OG-OD2 3.4Å; D907-P910 WeakPolarHBondContact O-CD 3.41Å
908	S	88.4	Confident	86.7	Confident	5 Å²	5	48.4 Å²	48.4	4%	0.035	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-11.8	179.7	58.7	0	0	0	0	114.5	W906 L911 F912 F938	W906-S908 PolarHBondContact O-N 2.82Å; W906-S908 VanDerWaalsContact O-N 3.08Å; S908-L911 WeakPolarHBondContact O-CB 3.43Å; S908-L911 PolarHBondContact O-N 3.41Å; S908-L911 VanDerWaalsContact O-N 3.15Å; S908-F912 PolarHBondContact O-N 3Å; S908-F938 WeakPolarHBondContact O-CE1 3.34Å
909	F	90.5	Very high	86.7	Confident	7 Å²	7	47.3 Å²	47.3	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-60.4	-35.7	176.9	-68	-53.6	0	0	0	114.5	W906 L911 F912 Q913 F938 L941 V942 Y945 F989 L993	W906-F909 HydrophobicContact CB-CD2 3.9Å; W906-F909 HydrophobicContact CB-CE2 3.81Å; W906-F909 HydrophobicContact CD2-CE2 4.17Å; W906-F909 AromaticContact CE3-CE2 3.59Å; W906-F909 HydrophobicContact CE3-CE2 3.59Å; W906-F909 AromaticContact CE3-CZ 3.85Å; W906-F909 HydrophobicContact CE3-CZ 3.85Å; W906-F909 HydrophobicContact CG-CE2 4.28Å; W906-F909 HydrophobicContact CZ3-CZ 4.41Å; W906-F909 WeakPolarHBondContact O-CD2 3.41Å; W906-F909 PolarHBondContact O-N 3.15Å; F909-L911 VanDerWaalsContact C-N 3.28Å; F909-L911 PolarHBondContact O-N 3.41Å; F909-F912 WeakPolarHBondContact O-CB 3.36Å; F909-F912 PolarHBondContact O-N 3.01Å; F909-Q913 WeakPolarHBondContact O-CG 3.47Å; F909-Q913 PolarHBondContact O-N 2.95Å; F909-F938 HydrophobicContact CD1-CD1 4.01Å; F909-F938 HydrophobicContact CD1-CE1 4.22Å; F909-F938 HydrophobicContact CE1-CD1 4.16Å; F909-L941 HydrophobicContact CE1-CB 4.26Å; F909-L941 HydrophobicContact CZ-CB 4.37Å; F909-V942 HydrophobicContact CD1-CG2 4.5Å; F909-V942 HydrophobicContact CE1-CG2 3.68Å; F909-V942 HydrophobicContact CZ-CG2 4.35Å; F909-Y945 HydrophobicContact CE2-CD2 4.45Å; F909-Y945 HydrophobicContact CE2-CG 4.21Å; F909-Y945 HydrophobicContact CZ-CG 4.47Å; F909-F989 HydrophobicContact CB-CE2 4.09Å; F909-F989 HydrophobicContact CB-CZ 4.4Å; F909-F989 HydrophobicContact CD1-CZ 4.02Å; F909-F989 AromaticContact CD2-CE2 3.67Å; F909-F989 HydrophobicContact CD2-CE2 3.67Å; F909-F989 AromaticContact CD2-CZ 3.47Å; F909-F989 HydrophobicContact CD2-CZ 3.47Å; F909-F989 VanDerWaalsContact CD2-CZ 3.47Å; F909-F989 HydrophobicContact CE1-CZ 4.13Å; F909-F989 HydrophobicContact CE2-CE1 4.46Å; F909-F989 HydrophobicContact CE2-CE2 4.19Å; F909-F989 AromaticContact CE2-CZ 3.56Å; F909-F989 HydrophobicContact CE2-CZ 3.56Å; F909-F989 AromaticContact CG-CE2 3.88Å; F909-F989 HydrophobicContact CG-CE2 3.88Å; F909-F989 AromaticContact CG-CZ 3.72Å; F909-F989 HydrophobicContact CG-CZ 3.72Å; F909-F989 AromaticContact CZ-CZ 3.91Å; F909-F989 HydrophobicContact CZ-CZ 3.91Å; F909-L993 HydrophobicContact CB-CD2 4.47Å; F909-L993 HydrophobicContact CD1-CD2 4.17Å
910	P	90.5	Very high	86.6	Confident	59 Å²	59	43.8 Å²	43.8	38%	0.383	23%	0.227	S	C	.	.	H	α-helix	trans	-58.5	-35.5	172.3	-27.4	36.7	0	0	0	113.9	L848 D907 Q913 L914	L848-P910 HydrophobicContact CD1-CB 4.03Å; D907-P910 WeakPolarHBondContact O-CD 3.41Å; P910-Q913 PolarHBondContact O-N 2.86Å; P910-L914 WeakPolarHBondContact O-CB 3.49Å; P910-L914 PolarHBondContact O-N 2.84Å
911	L	90.4	Very high	86.3	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-66.4	-42.8	175.4	177.1	64.2	0	0	0	111.1	L844 I847 A851 F890 M894 L898 S908 F909 L914 L915	L844-L911 HydrophobicContact CD1-CD2 4.13Å; I847-L911 HydrophobicContact CG2-CD1 4.3Å; I847-L911 HydrophobicContact CG2-CD2 3.81Å; A851-L911 HydrophobicContact CB-CD1 3.74Å; F890-L911 HydrophobicContact CZ-CD1 4.48Å; M894-L911 HydrophobicContact CG-CD2 4.22Å; L898-L911 HydrophobicContact CD2-CD2 4.49Å; S908-L911 WeakPolarHBondContact O-CB 3.43Å; S908-L911 PolarHBondContact O-N 3.41Å; S908-L911 VanDerWaalsContact O-N 3.15Å; F909-L911 VanDerWaalsContact C-N 3.28Å; F909-L911 PolarHBondContact O-N 3.41Å; L911-L914 PolarHBondContact O-N 3.22Å; L911-L915 HydrophobicContact CD1-CD1 3.88Å; L911-L915 HydrophobicContact CD1-CG 4.26Å; L911-L915 HydrophobicContact CG-CD1 4.05Å; L911-L915 WeakPolarHBondContact O-CB 3.46Å; L911-L915 WeakPolarHBondContact O-CG 3.07Å; L911-L915 PolarHBondContact O-N 3.32Å; L911-L915 VanDerWaalsContact O-N 3.08Å
912	F	91.1	Very high	86	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.2	-46.2	172.2	176.8	-91.1	0	0	0	111.7	S908 F909 L914 L915 N916 L934 F938 L993 W995	S908-F912 PolarHBondContact O-N 3Å; F909-F912 WeakPolarHBondContact O-CB 3.36Å; F909-F912 PolarHBondContact O-N 3.01Å; F912-L914 PolarHBondContact O-N 3.06Å; F912-L915 PolarHBondContact O-N 3.34Å; F912-N916 HydrophobicContact CD1-CB 4.4Å; F912-N916 HydrophobicContact CE1-CB 4.06Å; F912-N916 HydrophobicContact CZ-CB 4.16Å; F912-N916 WeakPolarHBondContact O-CB 3.26Å; F912-N916 PolarHBondContact O-N 3.1Å; F912-L934 HydrophobicContact CD2-CD1 4.08Å; F912-L934 HydrophobicContact CD2-CD2 4.12Å; F912-L934 HydrophobicContact CD2-CG 3.78Å; F912-L934 HydrophobicContact CE2-CD2 4.34Å; F912-L934 HydrophobicContact CE2-CG 4.06Å; F912-F938 HydrophobicContact CB-CD1 3.77Å; F912-F938 HydrophobicContact CB-CD2 4.17Å; F912-F938 HydrophobicContact CB-CE1 3.71Å; F912-F938 HydrophobicContact CB-CE2 4.11Å; F912-F938 HydrophobicContact CB-CG 4Å; F912-F938 HydrophobicContact CB-CZ 3.88Å; F912-F938 HydrophobicContact CD2-CB 3.66Å; F912-F938 HydrophobicContact CD2-CD1 4.14Å; F912-F938 AromaticContact CD2-CD2 3.68Å; F912-F938 HydrophobicContact CD2-CD2 3.68Å; F912-F938 HydrophobicContact CD2-CE2 4.35Å; F912-F938 AromaticContact CD2-CG 3.54Å; F912-F938 HydrophobicContact CD2-CG 3.54Å; F912-F938 HydrophobicContact CE2-CB 3.96Å; F912-F938 HydrophobicContact CE2-CG 4.34Å; F912-F938 HydrophobicContact CG-CB 4.33Å; F912-F938 HydrophobicContact CG-CD1 4.11Å; F912-F938 HydrophobicContact CG-CD2 4.33Å; F912-F938 AromaticContact CG-CG 3.99Å; F912-F938 HydrophobicContact CG-CG 3.99Å; F912-L993 HydrophobicContact CD1-CD2 3.89Å; F912-L993 HydrophobicContact CE1-CB 4.33Å; F912-L993 HydrophobicContact CE1-CD2 4.27Å; F912-L993 WeakPolarHBondContact CE1-O 3.27Å; F912-W995 AromaticContact CE1-CE3 3.93Å; F912-W995 HydrophobicContact CE1-CE3 3.93Å; F912-W995 AromaticContact CE1-CZ3 3.87Å; F912-W995 HydrophobicContact CE1-CZ3 3.87Å; F912-W995 HydrophobicContact CE2-CE3 4.43Å; F912-W995 AromaticContact CE2-CH2 3.94Å; F912-W995 HydrophobicContact CE2-CH2 3.94Å; F912-W995 AromaticContact CE2-CZ3 3.75Å; F912-W995 HydrophobicContact CE2-CZ3 3.75Å; F912-W995 HydrophobicContact CZ-CD2 4.32Å; F912-W995 AromaticContact CZ-CE3 3.55Å; F912-W995 HydrophobicContact CZ-CE3 3.55Å; F912-W995 AromaticContact CZ-CH2 3.86Å; F912-W995 HydrophobicContact CZ-CH2 3.86Å; F912-W995 AromaticContact CZ-CZ3 3.29Å; F912-W995 HydrophobicContact CZ-CZ3 3.29Å
913	Q	89.8	Confident	85.6	Confident	49 Å²	49	51.3 Å²	51.3	23%	0.229	26%	0.264	C	S	.	.	H	α-helix	trans	-61.5	-43	179.1	-73.8	177.7	-47.3	0	0	112.2	F909 P910 N917 D992 L993	F909-Q913 WeakPolarHBondContact O-CG 3.47Å; F909-Q913 PolarHBondContact O-N 2.95Å; P910-Q913 PolarHBondContact O-N 2.86Å; Q913-N917 WeakPolarHBondContact O-CB 3.41Å; Q913-N917 PolarHBondContact O-N 2.88Å; Q913-N917 PolarHBondContact O-ND2 3.08Å; Q913-D992 PolarHBondContact NE2-O 2.89Å; Q913-D992 VanDerWaalsContact NE2-O 3.15Å; Q913-L993 HydrophobicContact CG-CD2 4.1Å
914	L	91.4	Very high	85.9	Confident	52 Å²	52	49 Å²	49	27%	0.272	26%	0.255	S	S	.	.	H	α-helix	trans	-60.1	-52.2	176.4	176.4	62.6	0	0	0	111.4	L848 A851 E852 I855 P910 L911 F912 F918	L848-L914 HydrophobicContact CD2-CD2 4.43Å; L848-L914 HydrophobicContact CG-CD2 4.3Å; A851-L914 HydrophobicContact CB-CD2 3.93Å; E852-L914 HydrophobicContact CG-CD2 3.79Å; I855-L914 HydrophobicContact CD1-CD1 3.77Å; I855-L914 HydrophobicContact CD1-CD2 4.41Å; I855-L914 HydrophobicContact CD1-CG 3.76Å; P910-L914 WeakPolarHBondContact O-CB 3.49Å; P910-L914 PolarHBondContact O-N 2.84Å; L911-L914 PolarHBondContact O-N 3.22Å; F912-L914 PolarHBondContact O-N 3.06Å; L914-F918 PolarHBondContact O-N 3.26Å
915	L	91.3	Very high	86.3	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-68.4	-45.4	-177.8	-67.7	171.2	0	0	0	112.3	A851 W887 F890 M894 L911 F912 F918 L919 F930 L934	A851-L915 HydrophobicContact CB-CD2 4.06Å; W887-L915 HydrophobicContact CH2-CD2 3.58Å; W887-L915 HydrophobicContact CZ2-CD2 4.45Å; W887-L915 HydrophobicContact CZ3-CD2 3.62Å; F890-L915 HydrophobicContact CE1-CD1 4.01Å; F890-L915 HydrophobicContact CE1-CD2 4.39Å; M894-L915 HydrophobicContact SD-CD1 4.05Å; L911-L915 HydrophobicContact CD1-CD1 3.88Å; L911-L915 HydrophobicContact CD1-CG 4.26Å; L911-L915 HydrophobicContact CG-CD1 4.05Å; L911-L915 WeakPolarHBondContact O-CB 3.46Å; L911-L915 WeakPolarHBondContact O-CG 3.07Å; L911-L915 PolarHBondContact O-N 3.32Å; L911-L915 VanDerWaalsContact O-N 3.08Å; F912-L915 PolarHBondContact O-N 3.34Å; L915-F918 PolarHBondContact O-N 2.64Å; L915-L919 WeakPolarHBondContact O-CB 3.32Å; L915-L919 VanDerWaalsContact O-CG 3.24Å; L915-L919 WeakPolarHBondContact O-CG 3.39Å; L915-L919 PolarHBondContact O-N 3.24Å; L915-F930 HydrophobicContact CD1-CE1 4.48Å; L915-F930 HydrophobicContact CD1-CZ 4.14Å; L915-F930 HydrophobicContact CD2-CE1 4.32Å; L915-L934 HydrophobicContact CB-CD2 3.63Å; L915-L934 HydrophobicContact CD1-CD1 4.01Å; L915-L934 HydrophobicContact CD1-CD2 4.29Å
916	N	90.8	Very high	86.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-63.2	-43	178	-177.5	32.7	0	0	0	111.3	F912 F918 L919 R920 H931 L993 H994	F912-N916 HydrophobicContact CD1-CB 4.4Å; F912-N916 HydrophobicContact CE1-CB 4.06Å; F912-N916 HydrophobicContact CZ-CB 4.16Å; F912-N916 WeakPolarHBondContact O-CB 3.26Å; F912-N916 PolarHBondContact O-N 3.1Å; N916-F918 VanDerWaalsContact C-N 3.28Å; N916-F918 PolarHBondContact O-N 3.33Å; N916-L919 PolarHBondContact O-N 3.47Å; N916-R920 VanDerWaalsContact O-CB 3.28Å; N916-R920 WeakPolarHBondContact O-CB 3.36Å; N916-R920 WeakPolarHBondContact O-CD 3.48Å; N916-R920 WeakPolarHBondContact O-CG 3.48Å; N916-R920 PolarHBondContact O-N 3.4Å; N916-H931 PolarHBondContact OD1-NE2 2.86Å; N916-H931 VanDerWaalsContact OD1-NE2 3.16Å; N916-L993 PolarHBondContact ND2-O 3.2Å; N916-H994 PolarHBondContact ND2-O 3.15Å
917	N	89	Confident	86.4	Confident	53 Å²	53	46.9 Å²	46.9	28%	0.283	25%	0.251	S	S	.	.	H	α-helix	trans	-66.8	-26	177.7	-76.9	-48.9	0	0	0	113.8	Q913 R920 N921	Q913-N917 WeakPolarHBondContact O-CB 3.41Å; Q913-N917 PolarHBondContact O-N 2.88Å; Q913-N917 PolarHBondContact O-ND2 3.08Å; N917-R920 WeakPolarHBondContact OD1-CD 3.39Å; N917-R920 PolarHBondContact OD1-NH1 3.48Å; N917-R920 VanDerWaalsContact OD1-NH1 3.11Å; N917-N921 PolarHBondContact O-ND2 3.38Å
918	F	87.6	Confident	86.4	Confident	28 Å²	28	42.1 Å²	42.1	12%	0.123	23%	0.229	C	C	.	.	H	α-helix	trans	-73.1	-57.5	166.8	176.6	-112.7	0	0	0	111.4	I855 L858 Q859 W887 L914 L915 N916 R920 N921	I855-F918 HydrophobicContact CD1-CB 3.89Å; I855-F918 HydrophobicContact CD1-CG 4.24Å; I855-F918 HydrophobicContact CG1-CB 4.09Å; I855-F918 HydrophobicContact CG1-CD1 3.97Å; I855-F918 HydrophobicContact CG1-CD2 4.37Å; I855-F918 HydrophobicContact CG1-CG 3.87Å; I855-F918 HydrophobicContact CG2-CD2 3.7Å; I855-F918 HydrophobicContact CG2-CE2 4.07Å; I855-F918 HydrophobicContact CG2-CG 4.07Å; L858-F918 HydrophobicContact CB-CZ 4.32Å; L858-F918 HydrophobicContact CD1-CE1 4.34Å; Q859-F918 HydrophobicContact CG-CE2 3.84Å; W887-F918 AromaticContact CZ2-CD1 3.86Å; W887-F918 HydrophobicContact CZ2-CD1 3.86Å; W887-F918 AromaticContact CZ2-CE1 3.8Å; W887-F918 HydrophobicContact CZ2-CE1 3.8Å; L914-F918 PolarHBondContact O-N 3.26Å; L915-F918 PolarHBondContact O-N 2.64Å; N916-F918 VanDerWaalsContact C-N 3.28Å; N916-F918 PolarHBondContact O-N 3.33Å; F918-R920 VanDerWaalsContact C-N 3.34Å; F918-R920 PolarHBondContact O-N 3.34Å; F918-N921 PolarHBondContact O-N 2.94Å
919	L	88	Confident	86.4	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	26%	0.263	C	S	.	.	H	α-helix	trans	-65	-30.7	-170.6	-66.3	166.3	0	0	0	114	L915 N916 N921 D922 L925 C926 F930 H931 L934	L915-L919 WeakPolarHBondContact O-CB 3.32Å; L915-L919 VanDerWaalsContact O-CG 3.24Å; L915-L919 WeakPolarHBondContact O-CG 3.39Å; L915-L919 PolarHBondContact O-N 3.24Å; N916-L919 PolarHBondContact O-N 3.47Å; L919-N921 VanDerWaalsContact C-N 3.27Å; L919-N921 PolarHBondContact O-N 3.48Å; L919-D922 PolarHBondContact O-N 2.98Å; L919-L925 HydrophobicContact CD2-CB 3.93Å; L919-L925 HydrophobicContact CD2-CD1 4.25Å; L919-C926 WeakPolarHBondContact O-CA 3.4Å; L919-C926 WeakPolarHBondContact O-CB 3.35Å; L919-C926 PolarHBondContact O-N 3.42Å; L919-F930 HydrophobicContact CD1-CD1 3.76Å; L919-F930 HydrophobicContact CD1-CE1 3.91Å; L919-F930 HydrophobicContact CD2-CD1 4.37Å; L919-H931 HydrophobicContact CD1-CB 4.02Å; L919-L934 HydrophobicContact CD1-CD2 4.23Å
920	R	84.5	Confident	86.4	Confident	99 Å²	99	50 Å²	50	37%	0.374	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-21	178.4	73.8	-167.5	-74.6	-132.4	-3.7	114.1	N916 N917 F918 H994	N916-R920 VanDerWaalsContact O-CB 3.28Å; N916-R920 WeakPolarHBondContact O-CB 3.36Å; N916-R920 WeakPolarHBondContact O-CD 3.48Å; N916-R920 WeakPolarHBondContact O-CG 3.48Å; N916-R920 PolarHBondContact O-N 3.4Å; N917-R920 WeakPolarHBondContact OD1-CD 3.39Å; N917-R920 PolarHBondContact OD1-NH1 3.48Å; N917-R920 VanDerWaalsContact OD1-NH1 3.11Å; F918-R920 VanDerWaalsContact C-N 3.34Å; F918-R920 PolarHBondContact O-N 3.34Å; R920-H994 PolarHBondContact NH1-CD2 3.35Å
921	N	81	Confident	86.4	Confident	129 Å²	129	47.3 Å²	47.3	69%	0.69	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	-21	-179.6	-70.4	-28.1	0	0	0	112.3	N917 F918 L919	N917-N921 PolarHBondContact O-ND2 3.38Å; F918-N921 PolarHBondContact O-N 2.94Å; L919-N921 VanDerWaalsContact C-N 3.27Å; L919-N921 PolarHBondContact O-N 3.48Å
922	D	80	Confident	86.3	Confident	39 Å²	39	51.6 Å²	51.6	21%	0.209	26%	0.263	C	S	.	.			trans	-85.9	120.1	177.1	-176.4	-33.5	0	0	0	110.7	L919 L924 L925 C926	L919-D922 PolarHBondContact O-N 2.98Å; D922-L924 PolarHBondContact O-N 2.93Å; D922-L924 WeakPolarHBondContact OD1-CA 3.47Å; D922-L924 PolarHBondContact OD1-N 3.37Å; D922-L925 HydrophobicContact CB-CB 4.03Å; D922-L925 HydrophobicContact CB-CG 4.44Å; D922-L925 PolarHBondContact OD1-N 3.02Å; D922-L925 VanDerWaalsContact OD2-CD1 3.26Å; D922-L925 WeakPolarHBondContact OD2-CD1 3.5Å; D922-L925 VanDerWaalsContact OD2-CG 3.29Å; D922-L925 WeakPolarHBondContact OD2-CG 2.78Å; D922-C926 WeakPolarHBondContact O-CB 3.29Å; D922-C926 PolarHBondContact O-N 3.47Å
923	T	75.3	Confident	86.3	Confident	136 Å²	136	54.3 Å²	54.3	83%	0.834	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-12.1	-177.8	59.3	0	0	0	0	115.4
924	L	78.6	Confident	86.4	Confident	93 Å²	93	52 Å²	52	49%	0.487	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-25.8	-178.9	-59.1	173.9	0	0	0	112.7	P876 A880 D922	P876-L924 HydrophobicContact CB-CD1 3.95Å; A880-L924 HydrophobicContact CB-CB 3.84Å; A880-L924 HydrophobicContact CB-CD1 4.19Å; D922-L924 PolarHBondContact O-N 2.93Å; D922-L924 WeakPolarHBondContact OD1-CA 3.47Å; D922-L924 PolarHBondContact OD1-N 3.37Å
925	L	83.1	Confident	86.3	Confident	5 Å²	5	49.8 Å²	49.8	3%	0.026	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-18	175.6	-59.1	-178.4	0	0	0	114	A883 E884 L919 D922 N927 G928	A883-L925 HydrophobicContact CB-CD1 3.79Å; A883-L925 HydrophobicContact CB-CD2 4.06Å; E884-L925 HydrophobicContact CG-CD2 3.84Å; L919-L925 HydrophobicContact CD2-CB 3.93Å; L919-L925 HydrophobicContact CD2-CD1 4.25Å; D922-L925 HydrophobicContact CB-CB 4.03Å; D922-L925 HydrophobicContact CB-CG 4.44Å; D922-L925 PolarHBondContact OD1-N 3.02Å; D922-L925 VanDerWaalsContact OD2-CD1 3.26Å; D922-L925 WeakPolarHBondContact OD2-CD1 3.5Å; D922-L925 VanDerWaalsContact OD2-CG 3.29Å; D922-L925 WeakPolarHBondContact OD2-CG 2.78Å; L925-N927 PolarHBondContact O-N 3.2Å; L925-G928 PolarHBondContact O-N 2.71Å
926	C	84.4	Confident	86.2	Confident	47 Å²	47	56.5 Å²	56.5	32%	0.318	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	124.8	173.4	-173.6	0	0	0	0	110.8	L919 D922 G928	L919-C926 WeakPolarHBondContact O-CA 3.4Å; L919-C926 WeakPolarHBondContact O-CB 3.35Å; L919-C926 PolarHBondContact O-N 3.42Å; D922-C926 WeakPolarHBondContact O-CB 3.29Å; D922-C926 PolarHBondContact O-N 3.47Å; C926-G928 PolarHBondContact O-N 3.4Å
927	N	82.9	Confident	86.2	Confident	67 Å²	67	58.7 Å²	58.7	36%	0.358	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	22.3	-170.9	-59.8	-47.6	0	0	0	115.7	L925 H931 K932 Q935	L925-N927 PolarHBondContact O-N 3.2Å; N927-H931 PolarHBondContact N-ND1 3.09Å; N927-H931 VanDerWaalsContact N-ND1 3.16Å; N927-K932 WeakPolarHBondContact O-CE 3.39Å; N927-Q935 PolarHBondContact OD1-NE2 3.2Å
928	G	84.9	Confident	86.3	Confident	14 Å²	14	56.2 Å²	56.2	14%	0.144	28%	0.283	C	S	.	.			trans	-66	179.9	165.4	0	0	0	0	0	113.1	L925 C926 H931 K932	L925-G928 PolarHBondContact O-N 2.71Å; C926-G928 PolarHBondContact O-N 3.4Å; G928-H931 PolarHBondContact O-N 3.24Å; G928-K932 WeakPolarHBondContact O-CG 3.3Å; G928-K932 PolarHBondContact O-N 3.29Å
929	K	88.3	Confident	86.4	Confident	172 Å²	172	56.9 Å²	56.9	75%	0.748	29%	0.289	S	S	*	.	H	α-helix	trans	-64.2	-48.5	-173.8	-62.9	174.8	-175.5	170	0	112	E884 H931 K932 H933	E884-K929 PolarHBondContact OE1-N 3.45Å; E884-K929 PolarHBondContact OE2-N 2.9Å; K929-H931 VanDerWaalsContact C-N 3.3Å; K929-H931 PolarHBondContact O-N 3.4Å; K929-K932 PolarHBondContact O-N 2.99Å; K929-H933 PolarHBondContact O-N 2.95Å
930	F	90.9	Very high	86.5	Confident	6 Å²	6	60.3 Å²	60.3	3%	0.026	31%	0.311	C	S	.	.	H	α-helix	trans	-61.7	-41	175.9	176.9	-116.8	0	0	0	111.9	E884 W887 F890 T891 M894 L915 L919 K932 H933 L934	E884-F930 PolarHBondContact OE2-N 3.32Å; W887-F930 HydrophobicContact CB-CB 3.75Å; W887-F930 HydrophobicContact CB-CD1 3.65Å; W887-F930 HydrophobicContact CB-CD2 4.01Å; W887-F930 HydrophobicContact CB-CE1 4.23Å; W887-F930 HydrophobicContact CB-CG 3.52Å; W887-F930 AromaticContact CD2-CD1 3.75Å; W887-F930 HydrophobicContact CD2-CD1 3.75Å; W887-F930 AromaticContact CD2-CE1 3.64Å; W887-F930 HydrophobicContact CD2-CE1 3.64Å; W887-F930 HydrophobicContact CD2-CZ 4.33Å; W887-F930 HydrophobicContact CE3-CD1 4.06Å; W887-F930 AromaticContact CE3-CE1 3.5Å; W887-F930 HydrophobicContact CE3-CE1 3.5Å; W887-F930 VanDerWaalsContact CE3-CE1 3.5Å; W887-F930 AromaticContact CE3-CZ 3.79Å; W887-F930 HydrophobicContact CE3-CZ 3.79Å; W887-F930 HydrophobicContact CG-CB 4.38Å; W887-F930 AromaticContact CG-CD1 3.57Å; W887-F930 HydrophobicContact CG-CD1 3.57Å; W887-F930 AromaticContact CG-CE1 3.98Å; W887-F930 HydrophobicContact CG-CE1 3.98Å; W887-F930 AromaticContact CG-CG 3.99Å; W887-F930 HydrophobicContact CG-CG 3.99Å; W887-F930 HydrophobicContact CZ3-CE1 4.12Å; W887-F930 HydrophobicContact CZ3-CZ 4.38Å; F890-F930 HydrophobicContact CD1-CE2 4.12Å; F890-F930 AromaticContact CD1-CZ 3.77Å; F890-F930 HydrophobicContact CD1-CZ 3.77Å; F890-F930 HydrophobicContact CE1-CZ 4.05Å; T891-F930 VanDerWaalsContact OG1-CD2 3.29Å; T891-F930 WeakPolarHBondContact OG1-CD2 3.47Å; T891-F930 WeakPolarHBondContact OG1-CE2 3.39Å; M894-F930 HydrophobicContact CE-CE2 4.23Å; M894-F930 HydrophobicContact SD-CE2 4.2Å; M894-F930 HydrophobicContact SD-CZ 4.14Å; L915-F930 HydrophobicContact CD1-CE1 4.48Å; L915-F930 HydrophobicContact CD1-CZ 4.14Å; L915-F930 HydrophobicContact CD2-CE1 4.32Å; L919-F930 HydrophobicContact CD1-CD1 3.76Å; L919-F930 HydrophobicContact CD1-CE1 3.91Å; L919-F930 HydrophobicContact CD2-CD1 4.37Å; F930-K932 VanDerWaalsContact C-N 3.33Å; F930-K932 PolarHBondContact O-N 2.93Å; F930-H933 PolarHBondContact O-N 2.99Å; F930-L934 WeakPolarHBondContact O-CB 3.24Å; F930-L934 PolarHBondContact O-N 3.39Å
931	H	90.4	Very high	86.7	Confident	1 Å²	1	57.6 Å²	57.6	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-64.2	-38.6	-179.9	-163.3	174.1	0	0	0	111.6	N916 L919 N927 G928 K929 L934 Q935	N916-H931 PolarHBondContact OD1-NE2 2.86Å; N916-H931 VanDerWaalsContact OD1-NE2 3.16Å; L919-H931 HydrophobicContact CD1-CB 4.02Å; N927-H931 PolarHBondContact N-ND1 3.09Å; N927-H931 VanDerWaalsContact N-ND1 3.16Å; G928-H931 PolarHBondContact O-N 3.24Å; K929-H931 VanDerWaalsContact C-N 3.3Å; K929-H931 PolarHBondContact O-N 3.4Å; H931-L934 PolarHBondContact O-N 2.92Å; H931-Q935 PolarHBondContact CD2-NE2 3.05Å; H931-Q935 PolarHBondContact NE2-NE2 3.17Å; H931-Q935 WeakPolarHBondContact O-CG 3.43Å; H931-Q935 PolarHBondContact O-N 3.26Å; H931-Q935 PolarHBondContact O-NE2 2.76Å
932	K	89.3	Confident	87.2	Confident	91 Å²	91	51.5 Å²	51.5	40%	0.396	27%	0.272	S	S	.	.	H	α-helix	trans	-68.8	-41.6	174.1	-70.8	-171.1	175.5	-143.7	0	113.3	N927 G928 K929 F930 L934 Q935 E936	N927-K932 WeakPolarHBondContact O-CE 3.39Å; G928-K932 WeakPolarHBondContact O-CG 3.3Å; G928-K932 PolarHBondContact O-N 3.29Å; K929-K932 PolarHBondContact O-N 2.99Å; F930-K932 VanDerWaalsContact C-N 3.33Å; F930-K932 PolarHBondContact O-N 2.93Å; K932-L934 VanDerWaalsContact C-N 3.3Å; K932-L934 PolarHBondContact O-N 3.27Å; K932-Q935 WeakPolarHBondContact O-CB 3.34Å; K932-Q935 PolarHBondContact O-N 2.9Å; K932-Q935 VanDerWaalsContact O-N 3.12Å; K932-E936 WeakPolarHBondContact O-CB 3.34Å; K932-E936 WeakPolarHBondContact O-CG 3.45Å; K932-E936 PolarHBondContact O-N 2.95Å
933	H	91.4	Very high	87.6	Confident	58 Å²	58	51.6 Å²	51.6	27%	0.269	27%	0.273	S	S	.	.	H	α-helix	trans	-58.2	-42.6	173.1	-178	92.1	0	0	0	111.8	T891 D895 K929 F930 Q935 E936 I937	T891-H933 VanDerWaalsContact CG2-NE2 3.28Å; T891-H933 WeakPolarHBondContact CG2-NE2 3.48Å; D895-H933 VanDerWaalsContact CG-NE2 3.31Å; D895-H933 IonicContact OD1-CD2 2.66Å; D895-H933 IonicContact OD1-CE1 3Å; D895-H933 IonicContact OD1-NE2 3.47Å; D895-H933 PolarHBondContact OD1-NE2 3.21Å; D895-H933 IonicContact OD2-CE1 2.67Å; D895-H933 PolarHBondContact OD2-CE1 2.95Å; D895-H933 VanDerWaalsContact OD2-CE1 3.25Å; D895-H933 IonicContact OD2-NE2 3.15Å; D895-H933 PolarHBondContact OD2-NE2 2.92Å; K929-H933 PolarHBondContact O-N 2.95Å; F930-H933 PolarHBondContact O-N 2.99Å; H933-Q935 PolarHBondContact O-N 2.75Å; H933-E936 PolarHBondContact O-N 2.94Å; H933-I937 VanDerWaalsContact NE2-CD1 3.28Å; H933-I937 WeakPolarHBondContact NE2-CD1 3.39Å; H933-I937 PolarHBondContact O-N 3.49Å; H933-I937 VanDerWaalsContact O-N 3.1Å
934	L	90.9	Very high	88.3	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.6	-41.8	173.7	-178	69.4	0	0	0	112.2	M894 F912 L915 L919 F930 H931 K932 F938	M894-L934 HydrophobicContact CE-CD1 4.44Å; M894-L934 HydrophobicContact SD-CD1 4.13Å; F912-L934 HydrophobicContact CD2-CD1 4.08Å; F912-L934 HydrophobicContact CD2-CD2 4.12Å; F912-L934 HydrophobicContact CD2-CG 3.78Å; F912-L934 HydrophobicContact CE2-CD2 4.34Å; F912-L934 HydrophobicContact CE2-CG 4.06Å; L915-L934 HydrophobicContact CB-CD2 3.63Å; L915-L934 HydrophobicContact CD1-CD1 4.01Å; L915-L934 HydrophobicContact CD1-CD2 4.29Å; L919-L934 HydrophobicContact CD1-CD2 4.23Å; F930-L934 WeakPolarHBondContact O-CB 3.24Å; F930-L934 PolarHBondContact O-N 3.39Å; H931-L934 PolarHBondContact O-N 2.92Å; K932-L934 VanDerWaalsContact C-N 3.3Å; K932-L934 PolarHBondContact O-N 3.27Å; L934-F938 HydrophobicContact CD1-CD2 3.84Å; L934-F938 HydrophobicContact CD1-CE2 3.76Å; L934-F938 WeakPolarHBondContact O-CD2 3.28Å; L934-F938 PolarHBondContact O-N 2.67Å
935	Q	89.5	Confident	88.8	Confident	5 Å²	5	46.7 Å²	46.7	2%	0.023	23%	0.233	C	C	.	.	H	α-helix	trans	-63	-50.4	174.3	-67.8	159.5	24.5	0	0	111	N927 H931 K932 H933 I937 F938 V939 W995 P996	N927-Q935 PolarHBondContact OD1-NE2 3.2Å; H931-Q935 PolarHBondContact CD2-NE2 3.05Å; H931-Q935 PolarHBondContact NE2-NE2 3.17Å; H931-Q935 WeakPolarHBondContact O-CG 3.43Å; H931-Q935 PolarHBondContact O-N 3.26Å; H931-Q935 PolarHBondContact O-NE2 2.76Å; K932-Q935 WeakPolarHBondContact O-CB 3.34Å; K932-Q935 PolarHBondContact O-N 2.9Å; K932-Q935 VanDerWaalsContact O-N 3.12Å; H933-Q935 PolarHBondContact O-N 2.75Å; Q935-I937 VanDerWaalsContact C-N 3.29Å; Q935-I937 PolarHBondContact O-N 2.93Å; Q935-F938 PolarHBondContact O-N 3.41Å; Q935-F938 VanDerWaalsContact O-N 3.1Å; Q935-V939 WeakPolarHBondContact O-CG2 3.21Å; Q935-V939 PolarHBondContact O-N 2.81Å; Q935-W995 HydrophobicContact CB-CH2 4.48Å; Q935-W995 HydrophobicContact CB-CZ2 3.88Å; Q935-W995 HydrophobicContact CG-CZ2 4.09Å; Q935-P996 HydrophobicContact CG-CG 3.78Å
936	E	90.4	Very high	89.1	Confident	141 Å²	141	46.5 Å²	46.5	66%	0.659	23%	0.233	S	C	*	.	H	α-helix	trans	-57	-36.9	-178.7	-74.4	173.4	-151.8	0	0	112.9	K932 H933 P940	K932-E936 WeakPolarHBondContact O-CB 3.34Å; K932-E936 WeakPolarHBondContact O-CG 3.45Å; K932-E936 PolarHBondContact O-N 2.95Å; H933-E936 PolarHBondContact O-N 2.94Å; E936-P940 WeakPolarHBondContact O-CD 3.34Å
937	I	90.1	Very high	89.4	Confident	47 Å²	47	47.1 Å²	47.1	24%	0.241	23%	0.233	C	C	.	.	H	α-helix	trans	-71.6	-42.9	174.7	-71.4	176.2	0	0	0	112.3	M894 D895 L898 H933 Q935 P940	M894-I937 HydrophobicContact CE-CD1 4.16Å; D895-I937 VanDerWaalsContact OD1-CD1 3.23Å; D895-I937 WeakPolarHBondContact OD1-CD1 3.41Å; L898-I937 HydrophobicContact CD1-CG2 4.04Å; H933-I937 VanDerWaalsContact NE2-CD1 3.28Å; H933-I937 WeakPolarHBondContact NE2-CD1 3.39Å; H933-I937 PolarHBondContact O-N 3.49Å; H933-I937 VanDerWaalsContact O-N 3.1Å; Q935-I937 VanDerWaalsContact C-N 3.29Å; Q935-I937 PolarHBondContact O-N 2.93Å; I937-P940 WeakPolarHBondContact O-CD 3.35Å; I937-P940 WeakPolarHBondContact O-CG 3.24Å
938	F	90.4	Very high	89.7	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-86.5	-21.2	-172.2	-81.9	-92.8	0	0	0	114.6	L898 S908 F909 F912 L934 Q935 L941 V942 W995	L898-F938 HydrophobicContact CD1-CE2 3.91Å; L898-F938 HydrophobicContact CD1-CZ 4.23Å; L898-F938 HydrophobicContact CD2-CZ 4.1Å; S908-F938 WeakPolarHBondContact O-CE1 3.34Å; F909-F938 HydrophobicContact CD1-CD1 4.01Å; F909-F938 HydrophobicContact CD1-CE1 4.22Å; F909-F938 HydrophobicContact CE1-CD1 4.16Å; F912-F938 HydrophobicContact CB-CD1 3.77Å; F912-F938 HydrophobicContact CB-CD2 4.17Å; F912-F938 HydrophobicContact CB-CE1 3.71Å; F912-F938 HydrophobicContact CB-CE2 4.11Å; F912-F938 HydrophobicContact CB-CG 4Å; F912-F938 HydrophobicContact CB-CZ 3.88Å; F912-F938 HydrophobicContact CD2-CB 3.66Å; F912-F938 HydrophobicContact CD2-CD1 4.14Å; F912-F938 AromaticContact CD2-CD2 3.68Å; F912-F938 HydrophobicContact CD2-CD2 3.68Å; F912-F938 HydrophobicContact CD2-CE2 4.35Å; F912-F938 AromaticContact CD2-CG 3.54Å; F912-F938 HydrophobicContact CD2-CG 3.54Å; F912-F938 HydrophobicContact CE2-CB 3.96Å; F912-F938 HydrophobicContact CE2-CG 4.34Å; F912-F938 HydrophobicContact CG-CB 4.33Å; F912-F938 HydrophobicContact CG-CD1 4.11Å; F912-F938 HydrophobicContact CG-CD2 4.33Å; F912-F938 AromaticContact CG-CG 3.99Å; F912-F938 HydrophobicContact CG-CG 3.99Å; L934-F938 HydrophobicContact CD1-CD2 3.84Å; L934-F938 HydrophobicContact CD1-CE2 3.76Å; L934-F938 WeakPolarHBondContact O-CD2 3.28Å; L934-F938 PolarHBondContact O-N 2.67Å; Q935-F938 PolarHBondContact O-N 3.41Å; Q935-F938 VanDerWaalsContact O-N 3.1Å; F938-L941 HydrophobicContact CD1-CD1 3.93Å; F938-L941 HydrophobicContact CE1-CD1 4.06Å; F938-L941 HydrophobicContact CG-CD1 4.43Å; F938-L941 PolarHBondContact O-N 3.04Å; F938-L941 VanDerWaalsContact O-N 3.15Å; F938-V942 WeakPolarHBondContact O-CG2 3.47Å; F938-V942 PolarHBondContact O-N 2.79Å; F938-W995 HydrophobicContact CB-CH2 4.09Å; F938-W995 HydrophobicContact CB-CZ3 4.26Å
939	V	90.6	Very high	89.9	Confident	42 Å²	42	49 Å²	49	26%	0.255	24%	0.238	S	C	.	.	H	α-helix	trans	-47.6	-57	172	162.9	0	0	0	0	112.7	Q935 L941 V942 V943 W995 F1000	Q935-V939 WeakPolarHBondContact O-CG2 3.21Å; Q935-V939 PolarHBondContact O-N 2.81Å; V939-L941 VanDerWaalsContact C-N 3.28Å; V939-L941 PolarHBondContact O-N 3.48Å; V939-V942 PolarHBondContact O-N 3.3Å; V939-V943 WeakPolarHBondContact O-CG2 3.4Å; V939-V943 PolarHBondContact O-N 2.91Å; V939-W995 HydrophobicContact CG2-CH2 3.82Å; V939-W995 HydrophobicContact CG2-CZ2 3.45Å; V939-W995 VanDerWaalsContact CG2-CZ2 3.45Å; V939-F1000 HydrophobicContact CB-CZ 4.27Å; V939-F1000 HydrophobicContact CG1-CE2 3.91Å; V939-F1000 HydrophobicContact CG1-CZ 3.85Å; V939-F1000 HydrophobicContact CG2-CD1 4.41Å; V939-F1000 HydrophobicContact CG2-CE1 4.03Å; V939-F1000 HydrophobicContact CG2-CE2 4.4Å; V939-F1000 HydrophobicContact CG2-CZ 4.03Å
940	P	89.7	Confident	89.9	Confident	74 Å²	74	43.6 Å²	43.6	48%	0.481	22%	0.216	S	C	.	.	H	α-helix	trans	-66.1	-28.8	-178.2	25.6	-35.4	0	0	0	113.2	E936 I937 R944	E936-P940 WeakPolarHBondContact O-CD 3.34Å; I937-P940 WeakPolarHBondContact O-CD 3.35Å; I937-P940 WeakPolarHBondContact O-CG 3.24Å; P940-R944 VanDerWaalsContact O-CB 3.27Å; P940-R944 WeakPolarHBondContact O-CB 3.46Å; P940-R944 PolarHBondContact O-N 3.41Å
941	L	89.2	Confident	89.8	Confident	43 Å²	43	46.1 Å²	46.1	23%	0.225	23%	0.234	C	C	.	.	H	α-helix	trans	-69.8	-45.6	175.9	-63.1	177	0	0	0	111.4	F909 F938 V939 R944 Y945	F909-L941 HydrophobicContact CE1-CB 4.26Å; F909-L941 HydrophobicContact CZ-CB 4.37Å; F938-L941 HydrophobicContact CD1-CD1 3.93Å; F938-L941 HydrophobicContact CE1-CD1 4.06Å; F938-L941 HydrophobicContact CG-CD1 4.43Å; F938-L941 PolarHBondContact O-N 3.04Å; F938-L941 VanDerWaalsContact O-N 3.15Å; V939-L941 VanDerWaalsContact C-N 3.28Å; V939-L941 PolarHBondContact O-N 3.48Å; L941-R944 PolarHBondContact O-N 3.34Å; L941-Y945 WeakPolarHBondContact O-CB 3.14Å; L941-Y945 PolarHBondContact O-N 2.96Å
942	V	90.1	Very high	89.8	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-64.2	-42.1	176.7	177.9	0	0	0	0	111.1	F909 F938 V939 Y945 V946 L993 W995 L1004	F909-V942 HydrophobicContact CD1-CG2 4.5Å; F909-V942 HydrophobicContact CE1-CG2 3.68Å; F909-V942 HydrophobicContact CZ-CG2 4.35Å; F938-V942 WeakPolarHBondContact O-CG2 3.47Å; F938-V942 PolarHBondContact O-N 2.79Å; V939-V942 PolarHBondContact O-N 3.3Å; V942-Y945 PolarHBondContact O-N 3.26Å; V942-V946 WeakPolarHBondContact O-CG2 3.43Å; V942-V946 PolarHBondContact O-N 3.1Å; V942-L993 HydrophobicContact CG1-CD1 4.01Å; V942-L993 HydrophobicContact CG2-CD1 3.69Å; V942-W995 HydrophobicContact CG2-CZ3 4.04Å; V942-L1004 HydrophobicContact CG1-CD1 3.71Å; V942-L1004 HydrophobicContact CG1-CD2 4.15Å
943	V	89.3	Confident	89.7	Confident	41 Å²	41	44.7 Å²	44.7	25%	0.248	24%	0.236	C	C	.	.	H	α-helix	trans	-62.3	-49.1	175.8	175.1	0	0	0	0	111.1	V939 Y945 V946 D947 F1000	V939-V943 WeakPolarHBondContact O-CG2 3.4Å; V939-V943 PolarHBondContact O-N 2.91Å; V943-Y945 VanDerWaalsContact C-N 3.3Å; V943-Y945 PolarHBondContact O-N 3.45Å; V943-V946 PolarHBondContact O-N 3.36Å; V943-D947 PolarHBondContact O-N 3.26Å; V943-F1000 HydrophobicContact CG2-CE2 4.11Å; V943-F1000 HydrophobicContact CG2-CZ 3.9Å
944	R	89.4	Confident	89.5	Confident	83 Å²	83	43.9 Å²	43.9	31%	0.313	24%	0.239	S	C	.	.	H	α-helix	trans	-60.6	-38.2	178.3	-172.8	-176.4	177.6	140.3	-6.3	112.1	Q903 D904 W906 P940 L941 D947 L948	Q903-R944 VanDerWaalsContact O-CZ 3.32Å; Q903-R944 PolarHBondContact O-NE 2.86Å; D904-R944 IonicContact OD1-CZ 3.35Å; D904-R944 IonicContact OD1-NE 2.71Å; D904-R944 PolarHBondContact OD1-NE 3.14Å; D904-R944 IonicContact OD1-NH2 3.64Å; D904-R944 PolarHBondContact OD1-NH2 3.5Å; D904-R944 IonicContact OD2-CZ 3.21Å; D904-R944 IonicContact OD2-NH2 2.91Å; D904-R944 PolarHBondContact OD2-NH2 3.29Å; W906-R944 HydrophobicContact CH2-CB 4.32Å; W906-R944 HydrophobicContact CH2-CG 4.05Å; P940-R944 VanDerWaalsContact O-CB 3.27Å; P940-R944 WeakPolarHBondContact O-CB 3.46Å; P940-R944 PolarHBondContact O-N 3.41Å; L941-R944 PolarHBondContact O-N 3.34Å; R944-D947 PolarHBondContact O-N 3.02Å; R944-L948 HydrophobicContact CG-CD1 4Å; R944-L948 WeakPolarHBondContact O-CB 3.45Å; R944-L948 VanDerWaalsContact O-CG 3.28Å; R944-L948 WeakPolarHBondContact O-CG 3.37Å; R944-L948 PolarHBondContact O-N 3.41Å
945	Y	89.6	Confident	89.4	Confident	43 Å²	43	48.8 Å²	48.8	17%	0.169	26%	0.262	C	S	.	.	H	α-helix	trans	-62.8	-46.9	174.9	-177.8	-112.3	0	0	0	111.8	W906 F909 L941 V942 V943 L948 M949 L986 F989	W906-Y945 AromaticContact CD2-CD2 3.55Å; W906-Y945 HydrophobicContact CD2-CD2 3.55Å; W906-Y945 HydrophobicContact CD2-CE2 4.23Å; W906-Y945 HydrophobicContact CD2-CG 4.38Å; W906-Y945 AromaticContact CE2-CD2 3.68Å; W906-Y945 AromaticContact CE3-CD2 3.91Å; W906-Y945 HydrophobicContact CE3-CD2 3.91Å; W906-Y945 HydrophobicContact CE3-CG 4.29Å; W906-Y945 AromaticContact CG-CD2 3.9Å; W906-Y945 HydrophobicContact CG-CD2 3.9Å; W906-Y945 HydrophobicContact CG-CE2 4.1Å; W906-Y945 HydrophobicContact CH2-CD2 4.44Å; W906-Y945 HydrophobicContact CZ2-CD2 4.15Å; W906-Y945 HydrophobicContact CZ3-CD2 4.33Å; W906-Y945 HydrophobicContact CZ3-CG 4.5Å; F909-Y945 HydrophobicContact CE2-CD2 4.45Å; F909-Y945 HydrophobicContact CE2-CG 4.21Å; F909-Y945 HydrophobicContact CZ-CG 4.47Å; L941-Y945 WeakPolarHBondContact O-CB 3.14Å; L941-Y945 PolarHBondContact O-N 2.96Å; V942-Y945 PolarHBondContact O-N 3.26Å; V943-Y945 VanDerWaalsContact C-N 3.3Å; V943-Y945 PolarHBondContact O-N 3.45Å; Y945-L948 PolarHBondContact O-N 3.43Å; Y945-M949 HydrophobicContact CD1-CG 4.4Å; Y945-M949 HydrophobicContact CD2-CG 4.21Å; Y945-M949 HydrophobicContact CE1-CG 4.08Å; Y945-M949 HydrophobicContact CE2-CG 3.87Å; Y945-M949 HydrophobicContact CE2-SD 4.33Å; Y945-M949 HydrophobicContact CG-CG 4.48Å; Y945-M949 WeakPolarHBondContact O-CB 3.37Å; Y945-M949 VanDerWaalsContact O-CG 3.3Å; Y945-M949 WeakPolarHBondContact O-CG 3.32Å; Y945-M949 PolarHBondContact O-N 2.91Å; Y945-L986 HydrophobicContact CD1-CD1 3.98Å; Y945-L986 HydrophobicContact CE1-CD1 3.47Å; Y945-L986 VanDerWaalsContact CE1-CD1 3.47Å; Y945-F989 AromaticContact CD1-CD1 3.87Å; Y945-F989 HydrophobicContact CD1-CD1 3.87Å; Y945-F989 AromaticContact CD1-CE1 3.41Å; Y945-F989 HydrophobicContact CD1-CE1 3.41Å; Y945-F989 VanDerWaalsContact CD1-CE1 3.41Å; Y945-F989 HydrophobicContact CD1-CZ 4.05Å; Y945-F989 AromaticContact CE1-CD1 3.48Å; Y945-F989 HydrophobicContact CE1-CD1 3.48Å; Y945-F989 VanDerWaalsContact CE1-CD1 3.48Å; Y945-F989 AromaticContact CE1-CE1 3.46Å; Y945-F989 HydrophobicContact CE1-CE1 3.46Å; Y945-F989 VanDerWaalsContact CE1-CE1 3.46Å; Y945-F989 HydrophobicContact CE1-CG 4.1Å; Y945-F989 HydrophobicContact CE1-CZ 4.05Å; Y945-F989 HydrophobicContact CG-CE1 4.49Å
946	V	89.8	Confident	89.2	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.006	27%	0.271	C	S	.	.	H	α-helix	trans	-64.1	-43.2	176.6	173.9	0	0	0	0	111.4	V942 V943 L948 M949 E950 V990 L1008	V942-V946 WeakPolarHBondContact O-CG2 3.43Å; V942-V946 PolarHBondContact O-N 3.1Å; V943-V946 PolarHBondContact O-N 3.36Å; V946-L948 VanDerWaalsContact C-N 3.32Å; V946-L948 PolarHBondContact O-N 3.39Å; V946-M949 PolarHBondContact O-N 3.15Å; V946-E950 VanDerWaalsContact O-CB 3.24Å; V946-E950 WeakPolarHBondContact O-CB 3.48Å; V946-E950 PolarHBondContact O-N 3.41Å; V946-V990 HydrophobicContact CG2-CG2 4.46Å; V946-L1008 HydrophobicContact CG1-CD2 4.26Å; V946-L1008 HydrophobicContact CG2-CD2 4.46Å
947	D	89.6	Confident	89.1	Confident	61 Å²	61	43.5 Å²	43.5	33%	0.326	24%	0.241	S	C	.	.	H	α-helix	trans	-56.5	-43.6	175.9	-66.5	-22.2	0	0	0	112.4	V943 R944 S951 R1007	V943-D947 PolarHBondContact O-N 3.26Å; R944-D947 PolarHBondContact O-N 3.02Å; D947-S951 WeakPolarHBondContact O-CB 3.46Å; D947-S951 PolarHBondContact O-N 3.32Å; D947-S951 VanDerWaalsContact O-N 3.1Å; D947-S951 PolarHBondContact O-OG 3.25Å; D947-R1007 IonicContact OD1-CZ 2.68Å; D947-R1007 IonicContact OD1-NH1 3.88Å; D947-R1007 PolarHBondContact OD1-NH1 3.03Å; D947-R1007 IonicContact OD1-NH2 3.92Å; D947-R1007 PolarHBondContact OD1-NH2 3.39Å
948	L	89.3	Confident	88.8	Confident	79 Å²	79	45.7 Å²	45.7	41%	0.414	25%	0.25	S	C	.	.	H	α-helix	trans	-75.4	-37	-179.3	-71.7	170	0	0	0	112.1	W906 R944 Y945 V946 S951 S952	W906-L948 HydrophobicContact CH2-CD1 4.05Å; W906-L948 HydrophobicContact CZ2-CD1 3.71Å; R944-L948 HydrophobicContact CG-CD1 4Å; R944-L948 WeakPolarHBondContact O-CB 3.45Å; R944-L948 VanDerWaalsContact O-CG 3.28Å; R944-L948 WeakPolarHBondContact O-CG 3.37Å; R944-L948 PolarHBondContact O-N 3.41Å; Y945-L948 PolarHBondContact O-N 3.43Å; V946-L948 VanDerWaalsContact C-N 3.32Å; V946-L948 PolarHBondContact O-N 3.39Å; L948-S951 PolarHBondContact O-N 2.63Å; L948-S952 WeakPolarHBondContact O-CB 3.49Å; L948-S952 PolarHBondContact O-N 3.11Å
949	M	89.7	Confident	88.5	Confident	40 Å²	40	53.1 Å²	53.1	20%	0.197	28%	0.278	C	S	.	.	H	α-helix	trans	-68.5	-42.2	174.8	-74.7	-65.5	-72.4	0	0	111.9	Y945 V946 S951 S952 I953 L986	Y945-M949 HydrophobicContact CD1-CG 4.4Å; Y945-M949 HydrophobicContact CD2-CG 4.21Å; Y945-M949 HydrophobicContact CE1-CG 4.08Å; Y945-M949 HydrophobicContact CE2-CG 3.87Å; Y945-M949 HydrophobicContact CE2-SD 4.33Å; Y945-M949 HydrophobicContact CG-CG 4.48Å; Y945-M949 WeakPolarHBondContact O-CB 3.37Å; Y945-M949 VanDerWaalsContact O-CG 3.3Å; Y945-M949 WeakPolarHBondContact O-CG 3.32Å; Y945-M949 PolarHBondContact O-N 2.91Å; V946-M949 PolarHBondContact O-N 3.15Å; M949-S951 VanDerWaalsContact C-N 3.35Å; M949-S951 PolarHBondContact O-N 2.96Å; M949-S952 PolarHBondContact O-N 3.39Å; M949-I953 WeakPolarHBondContact O-CB 3.49Å; M949-I953 VanDerWaalsContact O-CG1 3.22Å; M949-I953 WeakPolarHBondContact O-CG1 3.29Å; M949-I953 PolarHBondContact O-N 2.97Å; M949-L986 HydrophobicContact CB-CD1 4.21Å; M949-L986 HydrophobicContact CB-CD2 3.84Å; M949-L986 HydrophobicContact CG-CD1 4.15Å
950	E	88.9	Confident	88.2	Confident	60 Å²	60	52 Å²	52	28%	0.28	28%	0.275	S	S	.	.	H	α-helix	trans	-54.8	-50.3	170.9	177.9	171.3	173.4	0	0	111	V946 S952 I953 A954 R1007 M1011 M1015	V946-E950 VanDerWaalsContact O-CB 3.24Å; V946-E950 WeakPolarHBondContact O-CB 3.48Å; V946-E950 PolarHBondContact O-N 3.41Å; E950-S952 VanDerWaalsContact C-N 3.35Å; E950-S952 PolarHBondContact O-N 3.21Å; E950-I953 PolarHBondContact O-N 2.94Å; E950-A954 WeakPolarHBondContact O-CB 3.45Å; E950-A954 PolarHBondContact O-N 2.7Å; E950-R1007 IonicContact OE2-CZ 3.22Å; E950-R1007 IonicContact OE2-NE 3.21Å; E950-R1007 PolarHBondContact OE2-NE 3.09Å; E950-R1007 IonicContact OE2-NH2 2.98Å; E950-R1007 PolarHBondContact OE2-NH2 3.12Å; E950-M1011 HydrophobicContact CB-CG 4.27Å; E950-M1011 HydrophobicContact CB-SD 3.61Å; E950-M1011 HydrophobicContact CG-CG 3.91Å; E950-M1011 HydrophobicContact CG-SD 3.94Å; E950-M1015 HydrophobicContact CG-CE 4.11Å
951	S	89.4	Confident	87.9	Confident	59 Å²	59	49.5 Å²	49.5	41%	0.413	26%	0.256	S	S	.	.	H	α-helix	trans	-62.9	-37.8	177.4	-61.6	0	0	0	0	113.2	D947 L948 M949 Q955	D947-S951 WeakPolarHBondContact O-CB 3.46Å; D947-S951 PolarHBondContact O-N 3.32Å; D947-S951 VanDerWaalsContact O-N 3.1Å; D947-S951 PolarHBondContact O-OG 3.25Å; L948-S951 PolarHBondContact O-N 2.63Å; M949-S951 VanDerWaalsContact C-N 3.35Å; M949-S951 PolarHBondContact O-N 2.96Å; S951-Q955 WeakPolarHBondContact O-CG 3.25Å; S951-Q955 PolarHBondContact O-N 2.98Å
952	S	89.1	Confident	87.4	Confident	61 Å²	61	54.1 Å²	54.1	43%	0.427	28%	0.277	S	S	.	.	H	α-helix	trans	-69.3	-47.5	179	-176.8	0	0	0	0	111.5	L948 M949 E950 Q955 S956	L948-S952 WeakPolarHBondContact O-CB 3.49Å; L948-S952 PolarHBondContact O-N 3.11Å; M949-S952 PolarHBondContact O-N 3.39Å; E950-S952 VanDerWaalsContact C-N 3.35Å; E950-S952 PolarHBondContact O-N 3.21Å; S952-Q955 PolarHBondContact O-N 3.39Å; S952-S956 WeakPolarHBondContact O-CB 3.48Å; S952-S956 PolarHBondContact O-N 2.66Å
953	I	88.4	Confident	87	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-62.2	-45.9	177.4	-67.7	166.9	0	0	0	110.2	M949 E950 Q955 S956 I957 L979 K982 L983 M1011 M1015	M949-I953 WeakPolarHBondContact O-CB 3.49Å; M949-I953 VanDerWaalsContact O-CG1 3.22Å; M949-I953 WeakPolarHBondContact O-CG1 3.29Å; M949-I953 PolarHBondContact O-N 2.97Å; E950-I953 PolarHBondContact O-N 2.94Å; I953-Q955 VanDerWaalsContact C-N 3.31Å; I953-Q955 PolarHBondContact O-N 2.91Å; I953-S956 WeakPolarHBondContact O-CB 3.45Å; I953-S956 PolarHBondContact O-N 2.89Å; I953-S956 VanDerWaalsContact O-N 3.1Å; I953-I957 HydrophobicContact CG2-CD1 4.12Å; I953-I957 WeakPolarHBondContact O-CG1 3.34Å; I953-I957 PolarHBondContact O-N 3.21Å; I953-L979 HydrophobicContact CG2-CD1 3.42Å; I953-L979 VanDerWaalsContact CG2-CD1 3.42Å; I953-K982 HydrophobicContact CD1-CB 4.06Å; I953-K982 HydrophobicContact CG1-CB 4.01Å; I953-K982 HydrophobicContact CG1-CD 4.32Å; I953-L983 HydrophobicContact CD1-CD2 4.16Å; I953-M1011 HydrophobicContact CD1-CE 4.41Å; I953-M1015 HydrophobicContact CG2-CB 4.48Å; I953-M1015 HydrophobicContact CG2-CG 3.86Å; I953-M1015 HydrophobicContact CG2-SD 4.05Å
954	A	87.1	Confident	86.8	Confident	40 Å²	40	60.9 Å²	60.9	33%	0.331	31%	0.306	S	S	.	.	H	α-helix	trans	-56.8	-42	176	0	0	0	0	0	112.9	E950 H958 M1015	E950-A954 WeakPolarHBondContact O-CB 3.45Å; E950-A954 PolarHBondContact O-N 2.7Å; A954-H958 PolarHBondContact O-N 3.12Å; A954-H958 VanDerWaalsContact O-N 3.09Å; A954-M1015 HydrophobicContact CB-CE 3.94Å; A954-M1015 HydrophobicContact CB-SD 4.19Å
955	Q	87.2	Confident	86.4	Confident	104 Å²	104	61.2 Å²	61.2	49%	0.486	32%	0.317	S	S	.	.	H	α-helix	trans	-71	-36.2	175.4	-73.2	-177.7	56.7	0	0	112.8	S951 S952 I953 H958 R959	S951-Q955 WeakPolarHBondContact O-CG 3.25Å; S951-Q955 PolarHBondContact O-N 2.98Å; S952-Q955 PolarHBondContact O-N 3.39Å; I953-Q955 VanDerWaalsContact C-N 3.31Å; I953-Q955 PolarHBondContact O-N 2.91Å; Q955-H958 PolarHBondContact O-N 3.39Å; Q955-R959 PolarHBondContact O-N 3.45Å
956	S	87	Confident	86.3	Confident	32 Å²	32	60.1 Å²	60.1	22%	0.224	31%	0.313	C	S	.	.	H	α-helix	trans	-58.7	-49.5	174.4	-146.6	0	0	0	0	110.5	S952 I953 H958 G960 D978 K982	S952-S956 WeakPolarHBondContact O-CB 3.48Å; S952-S956 PolarHBondContact O-N 2.66Å; I953-S956 WeakPolarHBondContact O-CB 3.45Å; I953-S956 PolarHBondContact O-N 2.89Å; I953-S956 VanDerWaalsContact O-N 3.1Å; S956-H958 PolarHBondContact O-N 3.2Å; S956-G960 WeakPolarHBondContact O-CA 3.23Å; S956-G960 PolarHBondContact O-N 3.02Å; S956-D978 PolarHBondContact OG-OD2 2.81Å; S956-K982 PolarHBondContact OG-NZ 3.19Å; S956-K982 VanDerWaalsContact OG-NZ 3.07Å
957	I	86.5	Confident	86	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.015	34%	0.342	C	S	.	.	H	α-helix	trans	-58.1	-50	174.8	-65.3	169.7	0	0	0	110.9	I953 F961 L979 M1015 A1018	I953-I957 HydrophobicContact CG2-CD1 4.12Å; I953-I957 WeakPolarHBondContact O-CG1 3.34Å; I953-I957 PolarHBondContact O-N 3.21Å; I957-F961 HydrophobicContact CG2-CD2 3.82Å; I957-F961 HydrophobicContact CG2-CE2 4.1Å; I957-F961 WeakPolarHBondContact O-CD2 3.47Å; I957-F961 PolarHBondContact O-N 2.94Å; I957-F961 VanDerWaalsContact O-N 3.15Å; I957-L979 HydrophobicContact CD1-CD1 3.7Å; I957-L979 HydrophobicContact CD1-CD2 3.97Å; I957-L979 HydrophobicContact CD1-CG 4.46Å; I957-L979 HydrophobicContact CG1-CD1 3.92Å; I957-L979 HydrophobicContact CG1-CD2 4.07Å; I957-L979 HydrophobicContact CG1-CG 4.47Å; I957-M1015 HydrophobicContact CD1-CB 3.73Å; I957-M1015 HydrophobicContact CD1-CG 4Å; I957-M1015 HydrophobicContact CD1-SD 3.5Å; I957-M1015 WeakPolarHBondContact CD1-SD 3.43Å; I957-A1018 HydrophobicContact CG2-CB 4.3Å
958	H	83.9	Confident	85.6	Confident	92 Å²	92	68 Å²	68	43%	0.426	36%	0.356	S	S	.	.	H	α-helix	trans	-64.2	-46.2	-173.7	-169.4	-15.1	0	0	0	112.4	A954 Q955 S956 E962	A954-H958 PolarHBondContact O-N 3.12Å; A954-H958 VanDerWaalsContact O-N 3.09Å; Q955-H958 PolarHBondContact O-N 3.39Å; S956-H958 PolarHBondContact O-N 3.2Å; H958-E962 IonicContact CE1-OE1 3.49Å; H958-E962 PolarHBondContact CE1-OE1 2.9Å; H958-E962 IonicContact ND1-OE1 3.33Å; H958-E962 PolarHBondContact ND1-OE1 3.12Å; H958-E962 WeakPolarHBondContact O-CG 3.49Å
959	R	84.4	Confident	85.1	Confident	157 Å²	157	67 Å²	67	59%	0.592	35%	0.352	S	S	*	.	H	α-helix	trans	-78.6	-37	-179.2	-67	-178	-178.9	163.5	6.3	112.5	Q955 E962 Q963	Q955-R959 PolarHBondContact O-N 3.45Å; R959-E962 PolarHBondContact O-N 2.93Å; R959-Q963 PolarHBondContact O-N 3.47Å
960	G	83.7	Confident	84.7	Confident	19 Å²	19	71.3 Å²	71.3	20%	0.196	38%	0.377	C	S	.	.	H	α-helix	trans	-60.2	-55.4	179.2	0	0	0	0	0	111.5	S956 E962 Q963 E964	S956-G960 WeakPolarHBondContact O-CA 3.23Å; S956-G960 PolarHBondContact O-N 3.02Å; G960-E962 PolarHBondContact O-N 3.21Å; G960-E962 VanDerWaalsContact O-N 3.16Å; G960-Q963 CarbonylContact O-C 3.4Å; G960-Q963 PolarHBondContact O-N 2.88Å; G960-E964 WeakPolarHBondContact O-CA 3.24Å; G960-E964 WeakPolarHBondContact O-CB 3.46Å; G960-E964 PolarHBondContact O-N 3.28Å
961	F	84.3	Confident	84.1	Confident	21 Å²	21	71.8 Å²	71.8	9%	0.092	38%	0.381	C	S	.	.	H	α-helix	trans	-67.6	-16.5	-178.5	-77	-65	0	0	0	114.8	I957 W966 T975 C1019 R1022	I957-F961 HydrophobicContact CG2-CD2 3.82Å; I957-F961 HydrophobicContact CG2-CE2 4.1Å; I957-F961 WeakPolarHBondContact O-CD2 3.47Å; I957-F961 PolarHBondContact O-N 2.94Å; I957-F961 VanDerWaalsContact O-N 3.15Å; F961-W966 AromaticContact CD1-CH2 3.56Å; F961-W966 HydrophobicContact CD1-CH2 3.56Å; F961-W966 AromaticContact CD1-CZ2 3.76Å; F961-W966 HydrophobicContact CD1-CZ2 3.76Å; F961-W966 HydrophobicContact CD1-CZ3 4.5Å; F961-W966 AromaticContact CE1-CH2 3.54Å; F961-W966 HydrophobicContact CE1-CH2 3.54Å; F961-W966 HydrophobicContact CE1-CZ2 4.21Å; F961-W966 HydrophobicContact CE1-CZ3 4.13Å; F961-T975 HydrophobicContact CD1-CG2 4.32Å; F961-T975 HydrophobicContact CD2-CG2 3.69Å; F961-T975 HydrophobicContact CE1-CG2 4.28Å; F961-T975 HydrophobicContact CE2-CG2 3.64Å; F961-T975 HydrophobicContact CG-CG2 4.03Å; F961-T975 HydrophobicContact CZ-CG2 3.94Å; F961-C1019 HydrophobicContact CE2-CB 4.21Å; F961-C1019 HydrophobicContact CZ-CB 4.4Å; F961-C1019 VanDerWaalsContact CZ-SG 3.54Å; F961-R1022 HydrophobicContact CB-CB 4.31Å; F961-R1022 HydrophobicContact CD2-CB 4.4Å; F961-R1022 HydrophobicContact CG-CB 4.22Å
962	E	79.3	Confident	83.9	Confident	139 Å²	139	69 Å²	69	65%	0.65	36%	0.362	S	S	*	.	H	α-helix	trans	-77.4	-30.5	169.9	-76.9	-179	167.3	0	0	113.1	H958 R959 G960	H958-E962 IonicContact CE1-OE1 3.49Å; H958-E962 PolarHBondContact CE1-OE1 2.9Å; H958-E962 IonicContact ND1-OE1 3.33Å; H958-E962 PolarHBondContact ND1-OE1 3.12Å; H958-E962 WeakPolarHBondContact O-CG 3.49Å; R959-E962 PolarHBondContact O-N 2.93Å; G960-E962 PolarHBondContact O-N 3.21Å; G960-E962 VanDerWaalsContact O-N 3.16Å
963	Q	81.6	Confident	83.8	Confident	158 Å²	158	66.1 Å²	66.1	74%	0.738	34%	0.342	S	S	*	.	H	α-helix	trans	-102.9	-4.6	-179	-59.3	-175.1	18.1	0	0	112.9	R959 G960 T965	R959-Q963 PolarHBondContact O-N 3.47Å; G960-Q963 CarbonylContact O-C 3.4Å; G960-Q963 PolarHBondContact O-N 2.88Å; Q963-T965 PolarHBondContact O-N 3.18Å
964	E	84.2	Confident	83.7	Confident	25 Å²	25	68.8 Å²	68.8	12%	0.117	36%	0.364	C	S	.	.			trans	-58.9	125.4	-173.4	-177.2	54.7	-89.4	0	0	111.8	G960 W966 S973 T975	G960-E964 WeakPolarHBondContact O-CA 3.24Å; G960-E964 WeakPolarHBondContact O-CB 3.46Å; G960-E964 PolarHBondContact O-N 3.28Å; E964-W966 HydrophobicContact CB-CZ2 4.32Å; E964-W966 HydrophobicContact CG-CD2 3.62Å; E964-W966 HydrophobicContact CG-CE3 4.12Å; E964-W966 HydrophobicContact CG-CG 3.86Å; E964-W966 HydrophobicContact CG-CH2 4.46Å; E964-W966 HydrophobicContact CG-CZ2 3.99Å; E964-W966 PolarHBondContact O-NE1 3.07Å; E964-W966 PolarHBondContact OE1-N 2.97Å; E964-S973 VanDerWaalsContact OE2-CB 3.27Å; E964-S973 WeakPolarHBondContact OE2-CB 3.18Å; E964-S973 PolarHBondContact OE2-OG 3.38Å; E964-T975 VanDerWaalsContact OE2-CB 3.31Å; E964-T975 WeakPolarHBondContact OE2-CB 3.38Å; E964-T975 PolarHBondContact OE2-N 3.47Å; E964-T975 PolarHBondContact OE2-OG1 3.13Å
965	T	81.3	Confident	83.7	Confident	91 Å²	91	67.6 Å²	67.6	56%	0.558	35%	0.352	S	S	*	.			trans	-85.7	-17.9	-179.6	66	0	0	0	0	112	Q963 Q967	Q963-T965 PolarHBondContact O-N 3.18Å; T965-Q967 VanDerWaalsContact C-N 3.3Å
966	W	87.4	Confident	83.7	Confident	20 Å²	20	62.6 Å²	62.6	8%	0.076	33%	0.329	C	S	.	.			trans	59	40.9	-177.8	-53.3	86.7	0	0	0	112.1	F961 E964 T1023 A1026 S1045 M1049 V1052	F961-W966 AromaticContact CD1-CH2 3.56Å; F961-W966 HydrophobicContact CD1-CH2 3.56Å; F961-W966 AromaticContact CD1-CZ2 3.76Å; F961-W966 HydrophobicContact CD1-CZ2 3.76Å; F961-W966 HydrophobicContact CD1-CZ3 4.5Å; F961-W966 AromaticContact CE1-CH2 3.54Å; F961-W966 HydrophobicContact CE1-CH2 3.54Å; F961-W966 HydrophobicContact CE1-CZ2 4.21Å; F961-W966 HydrophobicContact CE1-CZ3 4.13Å; E964-W966 HydrophobicContact CB-CZ2 4.32Å; E964-W966 HydrophobicContact CG-CD2 3.62Å; E964-W966 HydrophobicContact CG-CE3 4.12Å; E964-W966 HydrophobicContact CG-CG 3.86Å; E964-W966 HydrophobicContact CG-CH2 4.46Å; E964-W966 HydrophobicContact CG-CZ2 3.99Å; E964-W966 PolarHBondContact O-NE1 3.07Å; E964-W966 PolarHBondContact OE1-N 2.97Å; W966-T1023 HydrophobicContact CH2-CG2 4.05Å; W966-T1023 HydrophobicContact CZ3-CG2 3.92Å; W966-A1026 HydrophobicContact CH2-CB 4.23Å; W966-A1026 HydrophobicContact CZ2-CB 3.54Å; W966-S1045 WeakPolarHBondContact O-CA 3.41Å; W966-S1045 WeakPolarHBondContact O-CB 3.26Å; W966-M1049 HydrophobicContact CB-CE 4.35Å; W966-M1049 HydrophobicContact CD2-CE 3.46Å; W966-M1049 VanDerWaalsContact CD2-CE 3.46Å; W966-M1049 HydrophobicContact CD2-CG 3.75Å; W966-M1049 HydrophobicContact CE3-CB 4.33Å; W966-M1049 HydrophobicContact CE3-CE 4.08Å; W966-M1049 HydrophobicContact CE3-CG 3.32Å; W966-M1049 HydrophobicContact CG-CE 3.57Å; W966-M1049 HydrophobicContact CG-CG 4.44Å; W966-M1049 HydrophobicContact CH2-CG 4.25Å; W966-M1049 HydrophobicContact CZ2-CE 4.22Å; W966-M1049 HydrophobicContact CZ3-CB 4.39Å; W966-M1049 HydrophobicContact CZ3-CG 3.61Å; W966-V1052 HydrophobicContact CZ3-CG2 4.41Å
967	Q	84.3	Confident	83.8	Confident	133 Å²	133	63.1 Å²	63.1	62%	0.621	33%	0.328	S	S	*	.			trans	-79	143.1	161.3	-64.7	-175.5	27.1	0	0	109	T965 V969	T965-Q967 VanDerWaalsContact C-N 3.3Å; Q967-V969 PolarHBondContact O-N 2.78Å
968	P	80.7	Confident	83.8	Confident	94 Å²	94	65.4 Å²	65.4	61%	0.61	34%	0.34	S	S	*	.			trans	-67.9	128.2	178	28.3	-34	0	0	0	110.7
969	V	78.8	Confident	84	Confident	57 Å²	57	61.2 Å²	61.2	35%	0.345	32%	0.321	S	S	.	.	B	Isolated β-bridge	trans	-131.7	118.8	172.4	-179.4	0	0	0	0	106.5	Q967 N971 G972 A974 E977	Q967-V969 PolarHBondContact O-N 2.78Å; V969-N971 PolarHBondContact O-N 3.47Å; V969-N971 VanDerWaalsContact O-N 3.1Å; V969-G972 PolarHBondContact N-O 2.77Å; V969-G972 CarbonylContact O-C 3.57Å; V969-G972 PolarHBondContact O-N 3.17Å; V969-A974 HydrophobicContact CG2-CB 4.31Å; V969-E977 HydrophobicContact CG1-CG 4.38Å
970	N	80.4	Confident	84.3	Confident	132 Å²	132	54.2 Å²	54.2	71%	0.706	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.7	-111.1	-171.4	-52.4	-26.2	0	0	0	112.6	E977	N970-E977 HydrophobicContact CB-CG 4.49Å; N970-E977 WeakPolarHBondContact CB-OE1 3.42Å; N970-E977 VanDerWaalsContact CB-OE2 3.31Å; N970-E977 WeakPolarHBondContact CB-OE2 3.47Å; N970-E977 PolarHBondContact ND2-OE2 2.71Å
971	N	77.9	Confident	84.5	Confident	69 Å²	69	61.6 Å²	61.6	37%	0.369	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	-12.7	-179.1	-72.9	-10.7	0	0	0	113.2	V969 E977 N1051 D1055	V969-N971 PolarHBondContact O-N 3.47Å; V969-N971 VanDerWaalsContact O-N 3.1Å; N971-E977 PolarHBondContact N-OE1 3.43Å; N971-N1051 WeakPolarHBondContact O-CB 3.34Å; N971-D1055 HydrophobicContact CB-CB 4.06Å; N971-D1055 VanDerWaalsContact CB-OD1 3.3Å; N971-D1055 WeakPolarHBondContact CB-OD1 3.39Å; N971-D1055 PolarHBondContact ND2-OD1 2.76Å
972	G	83.9	Confident	84.8	Confident	2 Å²	2	62.6 Å²	62.6	2%	0.021	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-142.5	-130.1	-173.5	0	0	0	0	0	113.7	V969 E977 T1048	V969-G972 PolarHBondContact N-O 2.77Å; V969-G972 CarbonylContact O-C 3.57Å; V969-G972 PolarHBondContact O-N 3.17Å; G972-E977 PolarHBondContact N-OE1 3.46Å; G972-E977 VanDerWaalsContact N-OE1 3.14Å; G972-T1048 WeakPolarHBondContact O-CG2 3.46Å
973	S	87.3	Confident	85.2	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.291	C	S	.	.			trans	-119	165.4	175.6	83.1	0	0	0	0	110.6	E964 T975 S976 E977	E964-S973 VanDerWaalsContact OE2-CB 3.27Å; E964-S973 WeakPolarHBondContact OE2-CB 3.18Å; E964-S973 PolarHBondContact OE2-OG 3.38Å; S973-T975 PolarHBondContact O-N 2.95Å; S973-S976 PolarHBondContact N-OG 2.96Å; S973-S976 PolarHBondContact O-N 2.9Å; S973-S976 VanDerWaalsContact O-N 3.07Å; S973-S976 PolarHBondContact O-OG 3.13Å; S973-E977 VanDerWaalsContact O-CG 3.31Å; S973-E977 WeakPolarHBondContact O-CG 3.31Å; S973-E977 PolarHBondContact O-N 3.29Å
974	A	86.3	Confident	85.4	Confident	56 Å²	56	50.8 Å²	50.8	46%	0.463	27%	0.267	S	S	.	.	H	α-helix	trans	-53.4	-40.2	179	0	0	0	0	0	112.5	V969 D978	V969-A974 HydrophobicContact CG2-CB 4.31Å; A974-D978 VanDerWaalsContact O-CB 3.28Å; A974-D978 WeakPolarHBondContact O-CB 3.47Å; A974-D978 PolarHBondContact O-N 2.82Å
975	T	86.6	Confident	85.6	Confident	15 Å²	15	51.6 Å²	51.6	9%	0.092	28%	0.278	C	S	.	.	H	α-helix	trans	-70.7	-35.3	178.5	-47.8	0	0	0	0	113.3	F961 E964 S973 L979	F961-T975 HydrophobicContact CD1-CG2 4.32Å; F961-T975 HydrophobicContact CD2-CG2 3.69Å; F961-T975 HydrophobicContact CE1-CG2 4.28Å; F961-T975 HydrophobicContact CE2-CG2 3.64Å; F961-T975 HydrophobicContact CG-CG2 4.03Å; F961-T975 HydrophobicContact CZ-CG2 3.94Å; E964-T975 VanDerWaalsContact OE2-CB 3.31Å; E964-T975 WeakPolarHBondContact OE2-CB 3.38Å; E964-T975 PolarHBondContact OE2-N 3.47Å; E964-T975 PolarHBondContact OE2-OG1 3.13Å; S973-T975 PolarHBondContact O-N 2.95Å; T975-L979 WeakPolarHBondContact O-CB 3.45Å; T975-L979 PolarHBondContact O-N 2.97Å
976	S	88.3	Confident	86	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-76.2	-39.5	-179.7	65.6	0	0	0	0	112.4	S973 L979 F980	S973-S976 PolarHBondContact N-OG 2.96Å; S973-S976 PolarHBondContact O-N 2.9Å; S973-S976 VanDerWaalsContact O-N 3.07Å; S973-S976 PolarHBondContact O-OG 3.13Å; S976-L979 WeakPolarHBondContact O-CB 3.47Å; S976-L979 PolarHBondContact O-N 3.24Å; S976-F980 WeakPolarHBondContact O-CD2 3.27Å; S976-F980 VanDerWaalsContact O-CG 3.29Å; S976-F980 WeakPolarHBondContact O-CG 3.26Å; S976-F980 PolarHBondContact O-N 3.44Å
977	E	87.9	Confident	85.9	Confident	42 Å²	42	48.1 Å²	48.1	20%	0.196	26%	0.257	C	S	.	.	H	α-helix	trans	-65.9	-44.2	178.2	-63	-83.4	150	0	0	110.9	V969 N970 N971 G972 S973 L979 F980 W981	V969-E977 HydrophobicContact CG1-CG 4.38Å; N970-E977 HydrophobicContact CB-CG 4.49Å; N970-E977 WeakPolarHBondContact CB-OE1 3.42Å; N970-E977 VanDerWaalsContact CB-OE2 3.31Å; N970-E977 WeakPolarHBondContact CB-OE2 3.47Å; N970-E977 PolarHBondContact ND2-OE2 2.71Å; N971-E977 PolarHBondContact N-OE1 3.43Å; G972-E977 PolarHBondContact N-OE1 3.46Å; G972-E977 VanDerWaalsContact N-OE1 3.14Å; S973-E977 VanDerWaalsContact O-CG 3.31Å; S973-E977 WeakPolarHBondContact O-CG 3.31Å; S973-E977 PolarHBondContact O-N 3.29Å; E977-L979 VanDerWaalsContact C-N 3.32Å; E977-L979 PolarHBondContact O-N 3.36Å; E977-F980 PolarHBondContact O-N 2.96Å; E977-W981 WeakPolarHBondContact O-CB 3.4Å; E977-W981 PolarHBondContact O-N 2.89Å
978	D	87	Confident	86	Confident	52 Å²	52	46.1 Å²	46.1	28%	0.278	25%	0.248	S	C	.	.	H	α-helix	trans	-57.6	-41.6	172.3	173.7	70.8	0	0	0	112.4	S956 A974 K982	S956-D978 PolarHBondContact OG-OD2 2.81Å; A974-D978 VanDerWaalsContact O-CB 3.28Å; A974-D978 WeakPolarHBondContact O-CB 3.47Å; A974-D978 PolarHBondContact O-N 2.82Å; D978-K982 WeakPolarHBondContact O-CB 3.46Å; D978-K982 WeakPolarHBondContact O-CD 3.44Å; D978-K982 VanDerWaalsContact O-CG 3.29Å; D978-K982 WeakPolarHBondContact O-CG 3.33Å; D978-K982 PolarHBondContact O-N 2.76Å; D978-K982 WeakPolarHBondContact OD1-CE 3.32Å; D978-K982 IonicContact OD1-NZ 2.85Å; D978-K982 PolarHBondContact OD1-NZ 2.99Å; D978-K982 IonicContact OD2-NZ 3.19Å; D978-K982 PolarHBondContact OD2-NZ 3.34Å
979	L	89.3	Confident	86.4	Confident	3 Å²	3	43.3 Å²	43.3	2%	0.016	23%	0.227	C	C	.	.	H	α-helix	trans	-62.4	-54.1	176	170.8	59.4	0	0	0	111.9	I953 I957 T975 S976 E977 W981 K982 L983 M1015 C1019	I953-L979 HydrophobicContact CG2-CD1 3.42Å; I953-L979 VanDerWaalsContact CG2-CD1 3.42Å; I957-L979 HydrophobicContact CD1-CD1 3.7Å; I957-L979 HydrophobicContact CD1-CD2 3.97Å; I957-L979 HydrophobicContact CD1-CG 4.46Å; I957-L979 HydrophobicContact CG1-CD1 3.92Å; I957-L979 HydrophobicContact CG1-CD2 4.07Å; I957-L979 HydrophobicContact CG1-CG 4.47Å; T975-L979 WeakPolarHBondContact O-CB 3.45Å; T975-L979 PolarHBondContact O-N 2.97Å; S976-L979 WeakPolarHBondContact O-CB 3.47Å; S976-L979 PolarHBondContact O-N 3.24Å; E977-L979 VanDerWaalsContact C-N 3.32Å; E977-L979 PolarHBondContact O-N 3.36Å; L979-W981 VanDerWaalsContact C-N 3.33Å; L979-W981 PolarHBondContact O-N 3.49Å; L979-K982 PolarHBondContact O-N 3.44Å; L979-L983 HydrophobicContact CD1-CD1 3.82Å; L979-L983 HydrophobicContact CD1-CG 4.04Å; L979-L983 HydrophobicContact CG-CD1 4.13Å; L979-L983 WeakPolarHBondContact O-CG 3.36Å; L979-L983 PolarHBondContact O-N 3.29Å; L979-M1015 HydrophobicContact CD1-CB 4.09Å; L979-C1019 HydrophobicContact CD2-CB 3.78Å
980	F	89.2	Confident	86.8	Confident	11 Å²	11	41.4 Å²	41.4	5%	0.048	22%	0.215	C	C	.	.	H	α-helix	trans	-64.5	-40	-176.2	-59.7	-41	0	0	0	111.4	S976 E977 K982 L983 D984 L1016 D1055 A1056 Q1059 L1063	S976-F980 WeakPolarHBondContact O-CD2 3.27Å; S976-F980 VanDerWaalsContact O-CG 3.29Å; S976-F980 WeakPolarHBondContact O-CG 3.26Å; S976-F980 PolarHBondContact O-N 3.44Å; E977-F980 PolarHBondContact O-N 2.96Å; F980-K982 PolarHBondContact O-N 2.91Å; F980-L983 PolarHBondContact O-N 3.13Å; F980-D984 WeakPolarHBondContact O-CB 3.47Å; F980-D984 PolarHBondContact O-N 2.87Å; F980-L1016 HydrophobicContact CD1-CD1 4.27Å; F980-L1016 HydrophobicContact CE1-CD1 3.93Å; F980-L1016 HydrophobicContact CE1-CG 4.16Å; F980-D1055 HydrophobicContact CE2-CB 4.5Å; F980-A1056 HydrophobicContact CZ-CB 3.93Å; F980-Q1059 HydrophobicContact CB-CG 4.26Å; F980-Q1059 HydrophobicContact CD1-CB 3.99Å; F980-Q1059 HydrophobicContact CD1-CG 3.91Å; F980-Q1059 HydrophobicContact CD2-CG 3.7Å; F980-Q1059 HydrophobicContact CE1-CB 4.09Å; F980-Q1059 HydrophobicContact CE1-CG 4.13Å; F980-Q1059 HydrophobicContact CE2-CG 3.92Å; F980-Q1059 HydrophobicContact CG-CB 4.29Å; F980-Q1059 HydrophobicContact CG-CG 3.71Å; F980-Q1059 HydrophobicContact CZ-CB 4.45Å; F980-Q1059 HydrophobicContact CZ-CG 4.14Å; F980-L1063 HydrophobicContact CD1-CD1 4.39Å
981	W	89.4	Confident	87	Confident	174 Å²	174	41.8 Å²	41.8	66%	0.659	21%	0.211	S	C	*	.	H	α-helix	trans	-61.2	-43.2	174.2	178.1	74	0	0	0	112.7	E977 L979 D984 A985	E977-W981 WeakPolarHBondContact O-CB 3.4Å; E977-W981 PolarHBondContact O-N 2.89Å; L979-W981 VanDerWaalsContact C-N 3.33Å; L979-W981 PolarHBondContact O-N 3.49Å; W981-D984 PolarHBondContact O-N 2.99Å; W981-A985 VanDerWaalsContact O-CB 3.26Å; W981-A985 WeakPolarHBondContact O-CB 3.3Å; W981-A985 PolarHBondContact O-N 3.38Å
982	K	89.5	Confident	87.4	Confident	42 Å²	42	41.6 Å²	41.6	18%	0.183	21%	0.21	C	C	.	.	H	α-helix	trans	-65	-38	177.2	-78.6	168.4	176.2	158.8	0	113.3	I953 S956 D978 L979 F980 L986	I953-K982 HydrophobicContact CD1-CB 4.06Å; I953-K982 HydrophobicContact CG1-CB 4.01Å; I953-K982 HydrophobicContact CG1-CD 4.32Å; S956-K982 PolarHBondContact OG-NZ 3.19Å; S956-K982 VanDerWaalsContact OG-NZ 3.07Å; D978-K982 WeakPolarHBondContact O-CB 3.46Å; D978-K982 WeakPolarHBondContact O-CD 3.44Å; D978-K982 VanDerWaalsContact O-CG 3.29Å; D978-K982 WeakPolarHBondContact O-CG 3.33Å; D978-K982 PolarHBondContact O-N 2.76Å; D978-K982 WeakPolarHBondContact OD1-CE 3.32Å; D978-K982 IonicContact OD1-NZ 2.85Å; D978-K982 PolarHBondContact OD1-NZ 2.99Å; D978-K982 IonicContact OD2-NZ 3.19Å; D978-K982 PolarHBondContact OD2-NZ 3.34Å; L979-K982 PolarHBondContact O-N 3.44Å; F980-K982 PolarHBondContact O-N 2.91Å; K982-L986 WeakPolarHBondContact O-CB 3.47Å; K982-L986 PolarHBondContact O-N 2.94Å
983	L	88.9	Confident	87.5	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-67.5	-46	175.5	-69.9	172.9	0	0	0	111.3	I953 L979 F980 L986 Q987 M1011 A1012 M1015 L1016 L1063	I953-L983 HydrophobicContact CD1-CD2 4.16Å; L979-L983 HydrophobicContact CD1-CD1 3.82Å; L979-L983 HydrophobicContact CD1-CG 4.04Å; L979-L983 HydrophobicContact CG-CD1 4.13Å; L979-L983 WeakPolarHBondContact O-CG 3.36Å; L979-L983 PolarHBondContact O-N 3.29Å; F980-L983 PolarHBondContact O-N 3.13Å; L983-L986 PolarHBondContact O-N 2.78Å; L983-Q987 WeakPolarHBondContact O-CG 3.42Å; L983-Q987 PolarHBondContact O-N 3.37Å; L983-M1011 HydrophobicContact CD2-CE 3.48Å; L983-M1011 VanDerWaalsContact CD2-CE 3.48Å; L983-A1012 HydrophobicContact CD1-CB 4.34Å; L983-A1012 HydrophobicContact CD2-CB 4.27Å; L983-M1015 HydrophobicContact CD1-CB 4.33Å; L983-M1015 HydrophobicContact CD2-CG 4.49Å; L983-L1016 HydrophobicContact CD1-CD1 3.73Å; L983-L1063 HydrophobicContact CB-CD1 3.96Å; L983-L1063 HydrophobicContact CB-CD2 4.41Å; L983-L1063 HydrophobicContact CD1-CD1 4.06Å
984	D	85.9	Confident	87.4	Confident	47 Å²	47	44.3 Å²	44.3	25%	0.251	22%	0.222	S	C	.	.	H	α-helix	trans	-63.1	-45.8	179.7	-152.2	52.2	0	0	0	111.6	F980 W981 L986 Q987 M988 K1062 L1063	F980-D984 WeakPolarHBondContact O-CB 3.47Å; F980-D984 PolarHBondContact O-N 2.87Å; W981-D984 PolarHBondContact O-N 2.99Å; D984-L986 VanDerWaalsContact C-N 3.33Å; D984-L986 PolarHBondContact O-N 2.91Å; D984-Q987 PolarHBondContact O-N 3.28Å; D984-M988 WeakPolarHBondContact O-CG 3.12Å; D984-M988 PolarHBondContact O-N 3.01Å; D984-K1062 WeakPolarHBondContact OD1-CE 3.33Å; D984-K1062 IonicContact OD1-NZ 3.42Å; D984-K1062 PolarHBondContact OD1-NZ 3.04Å; D984-K1062 IonicContact OD2-NZ 3.17Å; D984-K1062 PolarHBondContact OD2-NZ 3.01Å; D984-L1063 HydrophobicContact CB-CD2 4.15Å; D984-L1063 WeakPolarHBondContact OD1-CD2 3.32Å
985	A	87.9	Confident	87.4	Confident	42 Å²	42	42.7 Å²	42.7	35%	0.347	20%	0.204	S	C	.	.	H	α-helix	trans	-62.5	-36.5	177.8	0	0	0	0	0	112.9	W981 F989	W981-A985 VanDerWaalsContact O-CB 3.26Å; W981-A985 WeakPolarHBondContact O-CB 3.3Å; W981-A985 PolarHBondContact O-N 3.38Å; A985-F989 WeakPolarHBondContact O-CB 3.28Å; A985-F989 PolarHBondContact O-N 2.85Å
986	L	89	Confident	87.2	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-72.9	-35.7	177.2	-174.5	63.2	0	0	0	112.4	Y945 M949 K982 L983 D984 F989 V990 L1008 M1011	Y945-L986 HydrophobicContact CD1-CD1 3.98Å; Y945-L986 HydrophobicContact CE1-CD1 3.47Å; Y945-L986 VanDerWaalsContact CE1-CD1 3.47Å; M949-L986 HydrophobicContact CB-CD1 4.21Å; M949-L986 HydrophobicContact CB-CD2 3.84Å; M949-L986 HydrophobicContact CG-CD1 4.15Å; K982-L986 WeakPolarHBondContact O-CB 3.47Å; K982-L986 PolarHBondContact O-N 2.94Å; L983-L986 PolarHBondContact O-N 2.78Å; D984-L986 VanDerWaalsContact C-N 3.33Å; D984-L986 PolarHBondContact O-N 2.91Å; L986-F989 HydrophobicContact CD1-CD1 4.3Å; L986-V990 PolarHBondContact O-N 2.71Å; L986-V990 VanDerWaalsContact O-N 3.16Å; L986-L1008 HydrophobicContact CD2-CD2 3.55Å; L986-L1008 HydrophobicContact CG-CD2 3.7Å; L986-M1011 HydrophobicContact CD2-CE 3.7Å; L986-M1011 HydrophobicContact CD2-SD 4.32Å
987	Q	86.3	Confident	87	Confident	37 Å²	37	47 Å²	47	17%	0.173	23%	0.226	C	C	.	.	H	α-helix	trans	-67.2	-44.7	173.8	-72.2	-175.1	-2.3	0	0	111.7	L983 D984 F989 V990 F991 L1008 L1063	L983-Q987 WeakPolarHBondContact O-CG 3.42Å; L983-Q987 PolarHBondContact O-N 3.37Å; D984-Q987 PolarHBondContact O-N 3.28Å; Q987-F989 PolarHBondContact O-N 3.41Å; Q987-V990 PolarHBondContact O-N 3.5Å; Q987-F991 WeakPolarHBondContact O-CB 3.4Å; Q987-F991 PolarHBondContact O-N 3.43Å; Q987-L1008 HydrophobicContact CG-CB 4.36Å; Q987-L1008 HydrophobicContact CG-CD1 4.33Å; Q987-L1063 PolarHBondContact NE2-O 2.92Å; Q987-L1063 PolarHBondContact OE1-O 3.12Å
988	M	86.5	Confident	86.7	Confident	91 Å²	91	53.2 Å²	53.2	45%	0.448	25%	0.254	S	S	.	.	H	α-helix	trans	-60.2	-44.6	173.4	-71.8	-55.2	-48.1	0	0	111.9	D984 V990 F991 D992	D984-M988 WeakPolarHBondContact O-CG 3.12Å; D984-M988 PolarHBondContact O-N 3.01Å; M988-V990 PolarHBondContact O-N 3.4Å; M988-F991 HydrophobicContact CE-CD1 4.44Å; M988-F991 WeakPolarHBondContact O-CB 3.4Å; M988-F991 PolarHBondContact O-N 3.49Å; M988-D992 WeakPolarHBondContact O-CB 3.36Å; M988-D992 VanDerWaalsContact O-CG 3.25Å; M988-D992 PolarHBondContact O-N 3.09Å
989	F	88.4	Confident	86.6	Confident	36 Å²	36	59.2 Å²	59.2	16%	0.158	28%	0.281	C	S	.	.	H	α-helix	trans	-55.5	-50.1	176.4	167.1	-98.3	0	0	0	112.7	F909 Y945 A985 L986 Q987 F991 D992 L993	F909-F989 HydrophobicContact CB-CE2 4.09Å; F909-F989 HydrophobicContact CB-CZ 4.4Å; F909-F989 HydrophobicContact CD1-CZ 4.02Å; F909-F989 AromaticContact CD2-CE2 3.67Å; F909-F989 HydrophobicContact CD2-CE2 3.67Å; F909-F989 AromaticContact CD2-CZ 3.47Å; F909-F989 HydrophobicContact CD2-CZ 3.47Å; F909-F989 VanDerWaalsContact CD2-CZ 3.47Å; F909-F989 HydrophobicContact CE1-CZ 4.13Å; F909-F989 HydrophobicContact CE2-CE1 4.46Å; F909-F989 HydrophobicContact CE2-CE2 4.19Å; F909-F989 AromaticContact CE2-CZ 3.56Å; F909-F989 HydrophobicContact CE2-CZ 3.56Å; F909-F989 AromaticContact CG-CE2 3.88Å; F909-F989 HydrophobicContact CG-CE2 3.88Å; F909-F989 AromaticContact CG-CZ 3.72Å; F909-F989 HydrophobicContact CG-CZ 3.72Å; F909-F989 AromaticContact CZ-CZ 3.91Å; F909-F989 HydrophobicContact CZ-CZ 3.91Å; Y945-F989 AromaticContact CD1-CD1 3.87Å; Y945-F989 HydrophobicContact CD1-CD1 3.87Å; Y945-F989 AromaticContact CD1-CE1 3.41Å; Y945-F989 HydrophobicContact CD1-CE1 3.41Å; Y945-F989 VanDerWaalsContact CD1-CE1 3.41Å; Y945-F989 HydrophobicContact CD1-CZ 4.05Å; Y945-F989 AromaticContact CE1-CD1 3.48Å; Y945-F989 HydrophobicContact CE1-CD1 3.48Å; Y945-F989 VanDerWaalsContact CE1-CD1 3.48Å; Y945-F989 AromaticContact CE1-CE1 3.46Å; Y945-F989 HydrophobicContact CE1-CE1 3.46Å; Y945-F989 VanDerWaalsContact CE1-CE1 3.46Å; Y945-F989 HydrophobicContact CE1-CG 4.1Å; Y945-F989 HydrophobicContact CE1-CZ 4.05Å; Y945-F989 HydrophobicContact CG-CE1 4.49Å; A985-F989 WeakPolarHBondContact O-CB 3.28Å; A985-F989 PolarHBondContact O-N 2.85Å; L986-F989 HydrophobicContact CD1-CD1 4.3Å; Q987-F989 PolarHBondContact O-N 3.41Å; F989-F991 VanDerWaalsContact C-N 3.33Å; F989-F991 PolarHBondContact O-N 3.46Å; F989-D992 PolarHBondContact O-N 3.46Å; F989-L993 HydrophobicContact CE1-CD1 3.81Å; F989-L993 HydrophobicContact CE1-CG 4.33Å; F989-L993 HydrophobicContact CE2-CD2 4.21Å; F989-L993 HydrophobicContact CE2-CG 4.43Å; F989-L993 HydrophobicContact CZ-CD1 3.9Å; F989-L993 HydrophobicContact CZ-CD2 4.05Å; F989-L993 HydrophobicContact CZ-CG 4.12Å; F989-L993 WeakPolarHBondContact O-CG 3.35Å; F989-L993 PolarHBondContact O-N 2.96Å; F989-L993 VanDerWaalsContact O-N 3.12Å
990	V	86.8	Confident	86.4	Confident	17 Å²	17	60.5 Å²	60.5	10%	0.103	29%	0.286	C	S	.	.	H	α-helix	trans	-69	-31.1	179.6	163.9	0	0	0	0	112.5	V946 L986 Q987 M988 L1004 L1008	V946-V990 HydrophobicContact CG2-CG2 4.46Å; L986-V990 PolarHBondContact O-N 2.71Å; L986-V990 VanDerWaalsContact O-N 3.16Å; Q987-V990 PolarHBondContact O-N 3.5Å; M988-V990 PolarHBondContact O-N 3.4Å; V990-L1004 HydrophobicContact CG1-CB 4.03Å; V990-L1004 HydrophobicContact CG1-CD1 4.15Å; V990-L1008 HydrophobicContact CB-CD1 3.65Å; V990-L1008 HydrophobicContact CG1-CD1 3.84Å; V990-L1008 HydrophobicContact CG2-CD1 3.81Å
991	F	85.1	Confident	86.2	Confident	139 Å²	139	61.4 Å²	61.4	61%	0.61	30%	0.296	S	S	*	.	H	α-helix	trans	-64.3	-47.6	171.4	-176.2	-93.4	0	0	0	111.5	Q987 M988 F989 L993 H994	Q987-F991 WeakPolarHBondContact O-CB 3.4Å; Q987-F991 PolarHBondContact O-N 3.43Å; M988-F991 HydrophobicContact CE-CD1 4.44Å; M988-F991 WeakPolarHBondContact O-CB 3.4Å; M988-F991 PolarHBondContact O-N 3.49Å; F989-F991 VanDerWaalsContact C-N 3.33Å; F989-F991 PolarHBondContact O-N 3.46Å; F991-L993 VanDerWaalsContact C-N 3.26Å; F991-L993 PolarHBondContact O-N 3.42Å; F991-H994 PolarHBondContact O-N 3.25Å
992	D	85.7	Confident	86	Confident	65 Å²	65	57.6 Å²	57.6	35%	0.348	29%	0.285	S	S	.	.	H	α-helix	trans	-68.9	-19.2	-178.2	-68.5	-24.9	0	0	0	113.4	Q913 M988 F989 H994	Q913-D992 PolarHBondContact NE2-O 2.89Å; Q913-D992 VanDerWaalsContact NE2-O 3.15Å; M988-D992 WeakPolarHBondContact O-CB 3.36Å; M988-D992 VanDerWaalsContact O-CG 3.25Å; M988-D992 PolarHBondContact O-N 3.09Å; F989-D992 PolarHBondContact O-N 3.46Å; D992-H994 PolarHBondContact O-N 2.68Å; D992-H994 PolarHBondContact O-ND1 2.8Å
993	L	86.3	Confident	85.9	Confident	1 Å²	1	60 Å²	60	1%	0.005	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-24.6	167	-70.8	178.4	0	0	0	112.6	F909 F912 Q913 N916 V942 F989 F991 W995	F909-L993 HydrophobicContact CB-CD2 4.47Å; F909-L993 HydrophobicContact CD1-CD2 4.17Å; F912-L993 HydrophobicContact CD1-CD2 3.89Å; F912-L993 HydrophobicContact CE1-CB 4.33Å; F912-L993 HydrophobicContact CE1-CD2 4.27Å; F912-L993 WeakPolarHBondContact CE1-O 3.27Å; Q913-L993 HydrophobicContact CG-CD2 4.1Å; N916-L993 PolarHBondContact ND2-O 3.2Å; V942-L993 HydrophobicContact CG1-CD1 4.01Å; V942-L993 HydrophobicContact CG2-CD1 3.69Å; F989-L993 HydrophobicContact CE1-CD1 3.81Å; F989-L993 HydrophobicContact CE1-CG 4.33Å; F989-L993 HydrophobicContact CE2-CD2 4.21Å; F989-L993 HydrophobicContact CE2-CG 4.43Å; F989-L993 HydrophobicContact CZ-CD1 3.9Å; F989-L993 HydrophobicContact CZ-CD2 4.05Å; F989-L993 HydrophobicContact CZ-CG 4.12Å; F989-L993 WeakPolarHBondContact O-CG 3.35Å; F989-L993 PolarHBondContact O-N 2.96Å; F989-L993 VanDerWaalsContact O-N 3.12Å; F991-L993 VanDerWaalsContact C-N 3.26Å; F991-L993 PolarHBondContact O-N 3.42Å; L993-W995 PolarHBondContact O-N 2.98Å
994	H	84.4	Confident	85.7	Confident	58 Å²	58	60 Å²	60	27%	0.269	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.8	49.6	178.4	-67.7	100.2	0	0	0	114	N916 R920 F991 D992	N916-H994 PolarHBondContact ND2-O 3.15Å; R920-H994 PolarHBondContact NH1-CD2 3.35Å; F991-H994 PolarHBondContact O-N 3.25Å; D992-H994 PolarHBondContact O-N 2.68Å; D992-H994 PolarHBondContact O-ND1 2.8Å
995	W	87.1	Confident	85.7	Confident	22 Å²	22	61.9 Å²	61.9	8%	0.083	30%	0.304	C	S	.	.			trans	-58.1	128	-167.4	-161.8	-85.9	0	0	0	113.2	F912 Q935 F938 V939 V942 L993 F1000 A1001	F912-W995 AromaticContact CE1-CE3 3.93Å; F912-W995 HydrophobicContact CE1-CE3 3.93Å; F912-W995 AromaticContact CE1-CZ3 3.87Å; F912-W995 HydrophobicContact CE1-CZ3 3.87Å; F912-W995 HydrophobicContact CE2-CE3 4.43Å; F912-W995 AromaticContact CE2-CH2 3.94Å; F912-W995 HydrophobicContact CE2-CH2 3.94Å; F912-W995 AromaticContact CE2-CZ3 3.75Å; F912-W995 HydrophobicContact CE2-CZ3 3.75Å; F912-W995 HydrophobicContact CZ-CD2 4.32Å; F912-W995 AromaticContact CZ-CE3 3.55Å; F912-W995 HydrophobicContact CZ-CE3 3.55Å; F912-W995 AromaticContact CZ-CH2 3.86Å; F912-W995 HydrophobicContact CZ-CH2 3.86Å; F912-W995 AromaticContact CZ-CZ3 3.29Å; F912-W995 HydrophobicContact CZ-CZ3 3.29Å; Q935-W995 HydrophobicContact CB-CH2 4.48Å; Q935-W995 HydrophobicContact CB-CZ2 3.88Å; Q935-W995 HydrophobicContact CG-CZ2 4.09Å; F938-W995 HydrophobicContact CB-CH2 4.09Å; F938-W995 HydrophobicContact CB-CZ3 4.26Å; V939-W995 HydrophobicContact CG2-CH2 3.82Å; V939-W995 HydrophobicContact CG2-CZ2 3.45Å; V939-W995 VanDerWaalsContact CG2-CZ2 3.45Å; V942-W995 HydrophobicContact CG2-CZ3 4.04Å; L993-W995 PolarHBondContact O-N 2.98Å; W995-F1000 AromaticContact CD1-CD1 3.67Å; W995-F1000 AromaticContact CD2-CD1 3.78Å; W995-F1000 HydrophobicContact CD2-CD1 3.78Å; W995-F1000 HydrophobicContact CD2-CE1 4.06Å; W995-F1000 AromaticContact CE2-CD1 3.52Å; W995-F1000 AromaticContact CE2-CE1 3.91Å; W995-F1000 HydrophobicContact CE3-CE1 4.36Å; W995-F1000 AromaticContact CG-CD1 3.94Å; W995-F1000 HydrophobicContact CG-CD1 3.94Å; W995-F1000 HydrophobicContact CH2-CE1 4.44Å; W995-F1000 HydrophobicContact CZ2-CD1 4.11Å; W995-F1000 HydrophobicContact CZ2-CE1 4.14Å; W995-F1000 AromaticContact NE1-CD1 3.41Å; W995-A1001 HydrophobicContact CB-CB 4.03Å
996	P	82.3	Confident	85.5	Confident	28 Å²	28	62.7 Å²	62.7	18%	0.182	30%	0.301	C	S	.	.	S	Bend	trans	-76.3	-31	-168.9	29.1	-37.6	0	0	0	114.5	Q935 Q998	Q935-P996 HydrophobicContact CG-CG 3.78Å; P996-Q998 PolarHBondContact O-N 3.49Å
997	E	83.6	Confident	85.4	Confident	79 Å²	79	65.5 Å²	65.5	37%	0.369	31%	0.311	S	S	.	.			trans	-83.4	111.5	176.3	-65.6	-167.8	133	0	0	110.9	E999 F1000 A1001	E997-E999 VanDerWaalsContact C-N 3.27Å; E997-E999 PolarHBondContact O-N 3.19Å; E997-F1000 HydrophobicContact CB-CB 4.45Å; E997-F1000 PolarHBondContact O-N 2.9Å; E997-A1001 WeakPolarHBondContact O-CB 3.44Å; E997-A1001 PolarHBondContact O-N 3.17Å
998	Q	81.6	Confident	85.4	Confident	172 Å²	172	64 Å²	64	80%	0.804	30%	0.304	S	S	*	.	H	α-helix	trans	-58.6	-35.2	-176.3	-69	-175.9	-16.8	0	0	113.5	P996 H1002	P996-Q998 PolarHBondContact O-N 3.49Å; Q998-H1002 VanDerWaalsContact O-CB 3.22Å; Q998-H1002 WeakPolarHBondContact O-CB 3.24Å; Q998-H1002 PolarHBondContact O-N 3.49Å
999	E	84.9	Confident	85.3	Confident	178 Å²	178	61 Å²	61	83%	0.832	29%	0.289	S	S	*	.	H	α-helix	trans	-64.7	-46.3	179.1	-62.7	-173.2	177.6	0	0	111.8	E997 H1003	E997-E999 VanDerWaalsContact C-N 3.27Å; E997-E999 PolarHBondContact O-N 3.19Å; E999-H1003 WeakPolarHBondContact O-CB 3.38Å; E999-H1003 PolarHBondContact O-N 3.16Å
1000	F	86.3	Confident	85.1	Confident	30 Å²	30	62.2 Å²	62.2	13%	0.132	30%	0.297	C	S	.	.	H	α-helix	trans	-74.3	-37.1	178.2	-173.5	-103.6	0	0	0	112.3	V939 V943 W995 E997 H1002 H1003 L1004	V939-F1000 HydrophobicContact CB-CZ 4.27Å; V939-F1000 HydrophobicContact CG1-CE2 3.91Å; V939-F1000 HydrophobicContact CG1-CZ 3.85Å; V939-F1000 HydrophobicContact CG2-CD1 4.41Å; V939-F1000 HydrophobicContact CG2-CE1 4.03Å; V939-F1000 HydrophobicContact CG2-CE2 4.4Å; V939-F1000 HydrophobicContact CG2-CZ 4.03Å; V943-F1000 HydrophobicContact CG2-CE2 4.11Å; V943-F1000 HydrophobicContact CG2-CZ 3.9Å; W995-F1000 AromaticContact CD1-CD1 3.67Å; W995-F1000 AromaticContact CD2-CD1 3.78Å; W995-F1000 HydrophobicContact CD2-CD1 3.78Å; W995-F1000 HydrophobicContact CD2-CE1 4.06Å; W995-F1000 AromaticContact CE2-CD1 3.52Å; W995-F1000 AromaticContact CE2-CE1 3.91Å; W995-F1000 HydrophobicContact CE3-CE1 4.36Å; W995-F1000 AromaticContact CG-CD1 3.94Å; W995-F1000 HydrophobicContact CG-CD1 3.94Å; W995-F1000 HydrophobicContact CH2-CE1 4.44Å; W995-F1000 HydrophobicContact CZ2-CD1 4.11Å; W995-F1000 HydrophobicContact CZ2-CE1 4.14Å; W995-F1000 AromaticContact NE1-CD1 3.41Å; E997-F1000 HydrophobicContact CB-CB 4.45Å; E997-F1000 PolarHBondContact O-N 2.9Å; F1000-H1002 PolarHBondContact O-N 3Å; F1000-H1003 PolarHBondContact O-N 3.16Å; F1000-L1004 HydrophobicContact CD1-CD1 3.87Å; F1000-L1004 HydrophobicContact CD1-CG 4.18Å; F1000-L1004 HydrophobicContact CE1-CD1 3.46Å; F1000-L1004 VanDerWaalsContact CE1-CD1 3.46Å; F1000-L1004 HydrophobicContact CE1-CD2 4.33Å; F1000-L1004 HydrophobicContact CE1-CG 3.88Å; F1000-L1004 HydrophobicContact CZ-CD1 4.07Å; F1000-L1004 HydrophobicContact CZ-CD2 4.1Å; F1000-L1004 HydrophobicContact CZ-CG 4.08Å; F1000-L1004 WeakPolarHBondContact O-CG 3.49Å; F1000-L1004 PolarHBondContact O-N 3.44Å
1001	A	85.3	Confident	85.1	Confident	30 Å²	30	61.8 Å²	61.8	25%	0.248	29%	0.294	C	S	.	.	H	α-helix	trans	-57.9	-48.3	173.7	0	0	0	0	0	111.4	W995 E997 L1004 E1005	W995-A1001 HydrophobicContact CB-CB 4.03Å; E997-A1001 WeakPolarHBondContact O-CB 3.44Å; E997-A1001 PolarHBondContact O-N 3.17Å; A1001-L1004 PolarHBondContact O-N 3.13Å; A1001-E1005 WeakPolarHBondContact O-CB 3.44Å; A1001-E1005 PolarHBondContact O-N 2.96Å
1002	H	83.9	Confident	85.3	Confident	93 Å²	93	55.1 Å²	55.1	43%	0.431	27%	0.265	S	S	.	.	H	α-helix	trans	-68.4	-37.4	178.2	-174.4	54	0	0	0	112.3	Q998 F1000 E1005 Q1006	Q998-H1002 VanDerWaalsContact O-CB 3.22Å; Q998-H1002 WeakPolarHBondContact O-CB 3.24Å; Q998-H1002 PolarHBondContact O-N 3.49Å; F1000-H1002 PolarHBondContact O-N 3Å; H1002-E1005 IonicContact ND1-OE2 2.7Å; H1002-E1005 PolarHBondContact ND1-OE2 2.98Å; H1002-E1005 PolarHBondContact O-N 2.93Å; H1002-Q1006 VanDerWaalsContact O-CB 3.23Å; H1002-Q1006 WeakPolarHBondContact O-CB 3.49Å; H1002-Q1006 PolarHBondContact O-N 3.43Å
1003	H	86.9	Confident	85.3	Confident	92 Å²	92	52.5 Å²	52.5	43%	0.426	25%	0.251	S	S	.	.	H	α-helix	trans	-61.6	-42.5	172.8	170.6	-102.8	0	0	0	112.6	E999 F1000 R1007	E999-H1003 WeakPolarHBondContact O-CB 3.38Å; E999-H1003 PolarHBondContact O-N 3.16Å; F1000-H1003 PolarHBondContact O-N 3.16Å; H1003-R1007 WeakPolarHBondContact O-CB 3.24Å; H1003-R1007 PolarHBondContact O-N 3.09Å
1004	L	86.6	Confident	85.4	Confident	3 Å²	3	57 Å²	57	2%	0.016	28%	0.275	C	S	.	.	H	α-helix	trans	-63.8	-46.2	173.6	-73.3	178.9	0	0	0	111.6	V942 V990 F1000 A1001 R1007 L1008	V942-L1004 HydrophobicContact CG1-CD1 3.71Å; V942-L1004 HydrophobicContact CG1-CD2 4.15Å; V990-L1004 HydrophobicContact CG1-CB 4.03Å; V990-L1004 HydrophobicContact CG1-CD1 4.15Å; F1000-L1004 HydrophobicContact CD1-CD1 3.87Å; F1000-L1004 HydrophobicContact CD1-CG 4.18Å; F1000-L1004 HydrophobicContact CE1-CD1 3.46Å; F1000-L1004 VanDerWaalsContact CE1-CD1 3.46Å; F1000-L1004 HydrophobicContact CE1-CD2 4.33Å; F1000-L1004 HydrophobicContact CE1-CG 3.88Å; F1000-L1004 HydrophobicContact CZ-CD1 4.07Å; F1000-L1004 HydrophobicContact CZ-CD2 4.1Å; F1000-L1004 HydrophobicContact CZ-CG 4.08Å; F1000-L1004 WeakPolarHBondContact O-CG 3.49Å; F1000-L1004 PolarHBondContact O-N 3.44Å; A1001-L1004 PolarHBondContact O-N 3.13Å; L1004-R1007 PolarHBondContact O-N 3.14Å; L1004-L1008 WeakPolarHBondContact O-CG 3.47Å; L1004-L1008 PolarHBondContact O-N 3.3Å
1005	E	84.3	Confident	85.6	Confident	85 Å²	85	55.1 Å²	55.1	40%	0.397	27%	0.267	S	S	.	.	H	α-helix	trans	-59	-48.7	177.6	-177.2	-171.6	-160.6	0	0	112	A1001 H1002 R1007 L1008 K1009	A1001-E1005 WeakPolarHBondContact O-CB 3.44Å; A1001-E1005 PolarHBondContact O-N 2.96Å; H1002-E1005 IonicContact ND1-OE2 2.7Å; H1002-E1005 PolarHBondContact ND1-OE2 2.98Å; H1002-E1005 PolarHBondContact O-N 2.93Å; E1005-R1007 PolarHBondContact O-N 2.75Å; E1005-L1008 PolarHBondContact O-N 3.01Å; E1005-K1009 VanDerWaalsContact CD-NZ 3.27Å; E1005-K1009 HydrophobicContact CG-CD 4.13Å; E1005-K1009 VanDerWaalsContact CG-CE 3.45Å; E1005-K1009 VanDerWaalsContact O-CG 3.31Å; E1005-K1009 WeakPolarHBondContact O-CG 3.49Å; E1005-K1009 PolarHBondContact O-N 3.35Å; E1005-K1009 VanDerWaalsContact O-N 3.11Å; E1005-K1009 IonicContact OE1-NZ 3.42Å; E1005-K1009 PolarHBondContact OE1-NZ 2.63Å
1006	Q	83.7	Confident	85.7	Confident	60 Å²	60	54 Å²	54	28%	0.28	26%	0.263	S	S	.	.	H	α-helix	trans	-59.6	-45.6	176.2	-171.9	-167.4	43.9	0	0	110.8	H1002 K1009 L1010 E1071	H1002-Q1006 VanDerWaalsContact O-CB 3.23Å; H1002-Q1006 WeakPolarHBondContact O-CB 3.49Å; H1002-Q1006 PolarHBondContact O-N 3.43Å; Q1006-K1009 PolarHBondContact O-N 3Å; Q1006-L1010 HydrophobicContact CG-CD1 4.36Å; Q1006-L1010 WeakPolarHBondContact O-CG 3.44Å; Q1006-L1010 PolarHBondContact O-N 3.27Å; Q1006-E1071 PolarHBondContact NE2-OE1 2.99Å
1007	R	86.9	Confident	86	Confident	59 Å²	59	55.9 Å²	55.9	22%	0.223	27%	0.269	C	S	.	.	H	α-helix	trans	-61.8	-45.2	177.2	-177.1	175.7	177.8	-175.2	-0.3	112.2	D947 E950 H1003 L1004 E1005 K1009 L1010 M1011	D947-R1007 IonicContact OD1-CZ 2.68Å; D947-R1007 IonicContact OD1-NH1 3.88Å; D947-R1007 PolarHBondContact OD1-NH1 3.03Å; D947-R1007 IonicContact OD1-NH2 3.92Å; D947-R1007 PolarHBondContact OD1-NH2 3.39Å; E950-R1007 IonicContact OE2-CZ 3.22Å; E950-R1007 IonicContact OE2-NE 3.21Å; E950-R1007 PolarHBondContact OE2-NE 3.09Å; E950-R1007 IonicContact OE2-NH2 2.98Å; E950-R1007 PolarHBondContact OE2-NH2 3.12Å; H1003-R1007 WeakPolarHBondContact O-CB 3.24Å; H1003-R1007 PolarHBondContact O-N 3.09Å; L1004-R1007 PolarHBondContact O-N 3.14Å; E1005-R1007 PolarHBondContact O-N 2.75Å; R1007-K1009 VanDerWaalsContact C-N 3.27Å; R1007-K1009 PolarHBondContact O-N 3.47Å; R1007-L1010 PolarHBondContact O-N 3.34Å; R1007-M1011 WeakPolarHBondContact O-CB 3.41Å; R1007-M1011 PolarHBondContact O-N 3.45Å
1008	L	87.2	Confident	86.3	Confident	6 Å²	6	53.1 Å²	53.1	3%	0.031	26%	0.259	C	S	.	.	H	α-helix	trans	-62.4	-34.5	178.9	-74.3	176.7	0	0	0	112.7	V946 L986 Q987 V990 L1004 E1005 M1011 A1012	V946-L1008 HydrophobicContact CG1-CD2 4.26Å; V946-L1008 HydrophobicContact CG2-CD2 4.46Å; L986-L1008 HydrophobicContact CD2-CD2 3.55Å; L986-L1008 HydrophobicContact CG-CD2 3.7Å; Q987-L1008 HydrophobicContact CG-CB 4.36Å; Q987-L1008 HydrophobicContact CG-CD1 4.33Å; V990-L1008 HydrophobicContact CB-CD1 3.65Å; V990-L1008 HydrophobicContact CG1-CD1 3.84Å; V990-L1008 HydrophobicContact CG2-CD1 3.81Å; L1004-L1008 WeakPolarHBondContact O-CG 3.47Å; L1004-L1008 PolarHBondContact O-N 3.3Å; E1005-L1008 PolarHBondContact O-N 3.01Å; L1008-M1011 HydrophobicContact CD2-CE 4.09Å; L1008-A1012 WeakPolarHBondContact O-CB 3.42Å; L1008-A1012 PolarHBondContact O-N 3.23Å
1009	K	83.1	Confident	86.8	Confident	27 Å²	27	44.9 Å²	44.9	12%	0.117	22%	0.221	C	C	.	.	H	α-helix	trans	-77.2	-36.5	178.3	-67.4	171.2	-174.6	-179.1	0	112.4	E1005 Q1006 R1007 A1012 S1013 A1065 L1066	E1005-K1009 VanDerWaalsContact CD-NZ 3.27Å; E1005-K1009 HydrophobicContact CG-CD 4.13Å; E1005-K1009 VanDerWaalsContact CG-CE 3.45Å; E1005-K1009 VanDerWaalsContact O-CG 3.31Å; E1005-K1009 WeakPolarHBondContact O-CG 3.49Å; E1005-K1009 PolarHBondContact O-N 3.35Å; E1005-K1009 VanDerWaalsContact O-N 3.11Å; E1005-K1009 IonicContact OE1-NZ 3.42Å; E1005-K1009 PolarHBondContact OE1-NZ 2.63Å; Q1006-K1009 PolarHBondContact O-N 3Å; R1007-K1009 VanDerWaalsContact C-N 3.27Å; R1007-K1009 PolarHBondContact O-N 3.47Å; K1009-A1012 PolarHBondContact O-N 3.41Å; K1009-S1013 WeakPolarHBondContact O-CB 3.47Å; K1009-S1013 PolarHBondContact O-N 3.11Å; K1009-A1065 VanDerWaalsContact CE-O 3.31Å; K1009-A1065 WeakPolarHBondContact CE-O 3.28Å; K1009-A1065 PolarHBondContact NZ-O 3.28Å; K1009-L1066 HydrophobicContact CD-CD1 4.43Å; K1009-L1066 HydrophobicContact CD-CD2 3.71Å; K1009-L1066 HydrophobicContact CD-CG 3.81Å
1010	L	84.6	Confident	87.1	Confident	63 Å²	63	36.5 Å²	36.5	33%	0.33	18%	0.182	S	C	.	.	H	α-helix	trans	-62.4	-46.3	169.1	-71.9	171.2	0	0	0	111.2	Q1006 R1007 A1012 S1013 D1014 Y1074	Q1006-L1010 HydrophobicContact CG-CD1 4.36Å; Q1006-L1010 WeakPolarHBondContact O-CG 3.44Å; Q1006-L1010 PolarHBondContact O-N 3.27Å; R1007-L1010 PolarHBondContact O-N 3.34Å; L1010-A1012 PolarHBondContact O-N 3.31Å; L1010-S1013 WeakPolarHBondContact O-CB 3.45Å; L1010-S1013 PolarHBondContact O-N 3.2Å; L1010-D1014 PolarHBondContact O-N 2.95Å; L1010-Y1074 HydrophobicContact CD2-CD1 4.19Å; L1010-Y1074 HydrophobicContact CD2-CD2 4.25Å; L1010-Y1074 HydrophobicContact CD2-CE1 4.14Å; L1010-Y1074 HydrophobicContact CD2-CE2 4.19Å; L1010-Y1074 HydrophobicContact CD2-CG 4.25Å
1011	M	88.4	Confident	87.3	Confident	7 Å²	7	39.9 Å²	39.9	3%	0.034	20%	0.196	C	C	.	.	H	α-helix	trans	-59.6	-47.3	174.3	-174.8	-160.9	63.7	0	0	111.2	E950 I953 L983 L986 R1007 L1008 S1013 D1014 M1015	E950-M1011 HydrophobicContact CB-CG 4.27Å; E950-M1011 HydrophobicContact CB-SD 3.61Å; E950-M1011 HydrophobicContact CG-CG 3.91Å; E950-M1011 HydrophobicContact CG-SD 3.94Å; I953-M1011 HydrophobicContact CD1-CE 4.41Å; L983-M1011 HydrophobicContact CD2-CE 3.48Å; L983-M1011 VanDerWaalsContact CD2-CE 3.48Å; L986-M1011 HydrophobicContact CD2-CE 3.7Å; L986-M1011 HydrophobicContact CD2-SD 4.32Å; R1007-M1011 WeakPolarHBondContact O-CB 3.41Å; R1007-M1011 PolarHBondContact O-N 3.45Å; L1008-M1011 HydrophobicContact CD2-CE 4.09Å; M1011-S1013 VanDerWaalsContact C-N 3.33Å; M1011-S1013 PolarHBondContact O-N 3.25Å; M1011-D1014 PolarHBondContact O-N 3.49Å; M1011-M1015 HydrophobicContact CG-CE 3.96Å; M1011-M1015 HydrophobicContact CG-CG 4.3Å; M1011-M1015 WeakPolarHBondContact O-CB 3.36Å; M1011-M1015 WeakPolarHBondContact O-CG 3.39Å; M1011-M1015 PolarHBondContact O-N 3.03Å
1012	A	88	Confident	87.5	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.9	-44.6	176.6	0	0	0	0	0	112	L983 L1008 K1009 L1010 M1015 L1016 L1063	L983-A1012 HydrophobicContact CD1-CB 4.34Å; L983-A1012 HydrophobicContact CD2-CB 4.27Å; L1008-A1012 WeakPolarHBondContact O-CB 3.42Å; L1008-A1012 PolarHBondContact O-N 3.23Å; K1009-A1012 PolarHBondContact O-N 3.41Å; L1010-A1012 PolarHBondContact O-N 3.31Å; A1012-M1015 PolarHBondContact O-N 3.22Å; A1012-L1016 WeakPolarHBondContact O-CB 3.5Å; A1012-L1016 VanDerWaalsContact O-CD1 3.25Å; A1012-L1016 WeakPolarHBondContact O-CD1 3.44Å; A1012-L1016 PolarHBondContact O-N 2.94Å; A1012-L1063 HydrophobicContact CB-CB 4.35Å
1013	S	86.6	Confident	87.8	Confident	9 Å²	9	38.2 Å²	38.2	6%	0.063	18%	0.18	C	C	.	.	H	α-helix	trans	-53.8	-54.4	173.1	164	0	0	0	0	112.1	K1009 L1010 M1011 M1015 L1016 E1017 I1078	K1009-S1013 WeakPolarHBondContact O-CB 3.47Å; K1009-S1013 PolarHBondContact O-N 3.11Å; L1010-S1013 WeakPolarHBondContact O-CB 3.45Å; L1010-S1013 PolarHBondContact O-N 3.2Å; M1011-S1013 VanDerWaalsContact C-N 3.33Å; M1011-S1013 PolarHBondContact O-N 3.25Å; S1013-M1015 VanDerWaalsContact C-N 3.33Å; S1013-M1015 PolarHBondContact O-N 2.78Å; S1013-L1016 PolarHBondContact O-N 3.49Å; S1013-E1017 PolarHBondContact O-N 2.89Å; S1013-I1078 VanDerWaalsContact O-CD1 3.3Å; S1013-I1078 WeakPolarHBondContact O-CD1 3.38Å; S1013-I1078 WeakPolarHBondContact OG-CD1 3.39Å; S1013-I1078 WeakPolarHBondContact OG-CG1 3.09Å
1014	D	87.3	Confident	88	Confident	97 Å²	97	37 Å²	37	52%	0.519	17%	0.172	S	C	.	.	H	α-helix	trans	-64	-37.3	-177.6	-75.8	5.2	0	0	0	112.3	L1010 M1011 E1017 A1018	L1010-D1014 PolarHBondContact O-N 2.95Å; M1011-D1014 PolarHBondContact O-N 3.49Å; D1014-E1017 PolarHBondContact O-N 2.98Å; D1014-A1018 WeakPolarHBondContact O-CB 3.4Å; D1014-A1018 PolarHBondContact O-N 2.98Å
1015	M	89.8	Confident	88.1	Confident	17 Å²	17	40.5 Å²	40.5	8%	0.084	19%	0.193	C	C	.	.	H	α-helix	trans	-70.7	-36.1	175.9	-62.7	-51.4	158.8	0	0	112.6	E950 I953 A954 I957 L979 L983 M1011 A1012 S1013 A1018 C1019	E950-M1015 HydrophobicContact CG-CE 4.11Å; I953-M1015 HydrophobicContact CG2-CB 4.48Å; I953-M1015 HydrophobicContact CG2-CG 3.86Å; I953-M1015 HydrophobicContact CG2-SD 4.05Å; A954-M1015 HydrophobicContact CB-CE 3.94Å; A954-M1015 HydrophobicContact CB-SD 4.19Å; I957-M1015 HydrophobicContact CD1-CB 3.73Å; I957-M1015 HydrophobicContact CD1-CG 4Å; I957-M1015 HydrophobicContact CD1-SD 3.5Å; I957-M1015 WeakPolarHBondContact CD1-SD 3.43Å; L979-M1015 HydrophobicContact CD1-CB 4.09Å; L983-M1015 HydrophobicContact CD1-CB 4.33Å; L983-M1015 HydrophobicContact CD2-CG 4.49Å; M1011-M1015 HydrophobicContact CG-CE 3.96Å; M1011-M1015 HydrophobicContact CG-CG 4.3Å; M1011-M1015 WeakPolarHBondContact O-CB 3.36Å; M1011-M1015 WeakPolarHBondContact O-CG 3.39Å; M1011-M1015 PolarHBondContact O-N 3.03Å; A1012-M1015 PolarHBondContact O-N 3.22Å; S1013-M1015 VanDerWaalsContact C-N 3.33Å; S1013-M1015 PolarHBondContact O-N 2.78Å; M1015-A1018 PolarHBondContact O-N 3.19Å; M1015-C1019 WeakPolarHBondContact O-CB 3.24Å; M1015-C1019 PolarHBondContact O-N 3.45Å
1016	L	89	Confident	88.4	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-66.2	-44.6	172	-97.7	69	0	0	0	111.1	F980 L983 A1012 S1013 A1018 C1019 V1020 L1063 I1078	F980-L1016 HydrophobicContact CD1-CD1 4.27Å; F980-L1016 HydrophobicContact CE1-CD1 3.93Å; F980-L1016 HydrophobicContact CE1-CG 4.16Å; L983-L1016 HydrophobicContact CD1-CD1 3.73Å; A1012-L1016 WeakPolarHBondContact O-CB 3.5Å; A1012-L1016 VanDerWaalsContact O-CD1 3.25Å; A1012-L1016 WeakPolarHBondContact O-CD1 3.44Å; A1012-L1016 PolarHBondContact O-N 2.94Å; S1013-L1016 PolarHBondContact O-N 3.49Å; L1016-A1018 VanDerWaalsContact C-N 3.31Å; L1016-A1018 PolarHBondContact O-N 2.78Å; L1016-C1019 WeakPolarHBondContact O-CB 3.5Å; L1016-C1019 PolarHBondContact O-N 3.4Å; L1016-C1019 VanDerWaalsContact O-N 3.17Å; L1016-V1020 VanDerWaalsContact O-CG2 3.3Å; L1016-V1020 WeakPolarHBondContact O-CG2 3.43Å; L1016-V1020 PolarHBondContact O-N 2.86Å; L1016-L1063 HydrophobicContact CD1-CD1 4.43Å; L1016-I1078 HydrophobicContact CD2-CG2 4.43Å
1017	E	89	Confident	88.7	Confident	66 Å²	66	34.6 Å²	34.6	31%	0.308	17%	0.17	S	C	.	.	H	α-helix	trans	-59.2	-43.9	175	-168.5	-173.1	103.4	0	0	111.2	S1013 D1014 C1019 V1020 K1021 I1078 L1081	S1013-E1017 PolarHBondContact O-N 2.89Å; D1014-E1017 PolarHBondContact O-N 2.98Å; E1017-C1019 VanDerWaalsContact C-N 3.3Å; E1017-C1019 PolarHBondContact O-N 3.25Å; E1017-V1020 PolarHBondContact O-N 3.36Å; E1017-K1021 VanDerWaalsContact CD-NZ 3.26Å; E1017-K1021 HydrophobicContact CG-CD 4Å; E1017-K1021 HydrophobicContact CG-CG 4.43Å; E1017-K1021 WeakPolarHBondContact O-CB 3.43Å; E1017-K1021 WeakPolarHBondContact O-CG 3.39Å; E1017-K1021 PolarHBondContact O-N 2.91Å; E1017-K1021 WeakPolarHBondContact OE1-CE 3.4Å; E1017-K1021 IonicContact OE1-NZ 3.7Å; E1017-K1021 PolarHBondContact OE1-NZ 3.16Å; E1017-K1021 IonicContact OE2-NZ 3.1Å; E1017-I1078 HydrophobicContact CB-CD1 3.92Å; E1017-L1081 HydrophobicContact CG-CD1 3.86Å; E1017-L1081 HydrophobicContact CG-CD2 4.2Å
1018	A	89.5	Confident	88.8	Confident	21 Å²	21	34.5 Å²	34.5	17%	0.174	17%	0.172	C	C	.	.	H	α-helix	trans	-61.9	-34.1	176.5	0	0	0	0	0	113.3	I957 D1014 M1015 L1016 R1022	I957-A1018 HydrophobicContact CG2-CB 4.3Å; D1014-A1018 WeakPolarHBondContact O-CB 3.4Å; D1014-A1018 PolarHBondContact O-N 2.98Å; M1015-A1018 PolarHBondContact O-N 3.19Å; L1016-A1018 VanDerWaalsContact C-N 3.31Å; L1016-A1018 PolarHBondContact O-N 2.78Å; A1018-R1022 WeakPolarHBondContact O-CD 3.27Å; A1018-R1022 VanDerWaalsContact O-CG 3.29Å; A1018-R1022 WeakPolarHBondContact O-CG 3.34Å; A1018-R1022 PolarHBondContact O-NH1 3.49Å
1019	C	90.7	Very high	88.8	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-71.8	-50.2	173.9	177	0	0	0	0	111.8	F961 L979 M1015 L1016 E1017 R1022 T1023	F961-C1019 HydrophobicContact CE2-CB 4.21Å; F961-C1019 HydrophobicContact CZ-CB 4.4Å; F961-C1019 VanDerWaalsContact CZ-SG 3.54Å; L979-C1019 HydrophobicContact CD2-CB 3.78Å; M1015-C1019 WeakPolarHBondContact O-CB 3.24Å; M1015-C1019 PolarHBondContact O-N 3.45Å; L1016-C1019 WeakPolarHBondContact O-CB 3.5Å; L1016-C1019 PolarHBondContact O-N 3.4Å; L1016-C1019 VanDerWaalsContact O-N 3.17Å; E1017-C1019 VanDerWaalsContact C-N 3.3Å; E1017-C1019 PolarHBondContact O-N 3.25Å; C1019-R1022 PolarHBondContact O-N 3.1Å; C1019-T1023 WeakPolarHBondContact O-CB 3.2Å; C1019-T1023 PolarHBondContact O-N 3.43Å; C1019-T1023 PolarHBondContact O-OG1 3.46Å
1020	V	91.3	Very high	89	Confident	1 Å²	1	41.1 Å²	41.1	1%	0.006	20%	0.204	C	C	.	.	H	α-helix	trans	-62.1	-48.2	-177.6	170.2	0	0	0	0	111.3	L1016 E1017 R1022 T1023 R1024 L1053 A1056 L1081 I1082	L1016-V1020 VanDerWaalsContact O-CG2 3.3Å; L1016-V1020 WeakPolarHBondContact O-CG2 3.43Å; L1016-V1020 PolarHBondContact O-N 2.86Å; E1017-V1020 PolarHBondContact O-N 3.36Å; V1020-R1022 PolarHBondContact O-N 2.76Å; V1020-T1023 PolarHBondContact O-N 3.31Å; V1020-R1024 WeakPolarHBondContact O-CB 3.44Å; V1020-R1024 PolarHBondContact O-N 2.91Å; V1020-L1053 HydrophobicContact CB-CD2 3.97Å; V1020-L1053 HydrophobicContact CG1-CD2 3.76Å; V1020-L1053 HydrophobicContact CG2-CD2 3.86Å; V1020-A1056 HydrophobicContact CG2-CB 4.24Å; V1020-L1081 HydrophobicContact CB-CD2 3.89Å; V1020-L1081 HydrophobicContact CG1-CD2 3.53Å; V1020-L1081 HydrophobicContact CG2-CD2 4.41Å; V1020-I1082 HydrophobicContact CG2-CD1 4.47Å; V1020-I1082 HydrophobicContact CG2-CG1 3.76Å
1021	K	90.4	Very high	89	Confident	101 Å²	101	38.9 Å²	38.9	44%	0.439	19%	0.192	S	C	.	.	H	α-helix	trans	-59.6	-43.8	178.9	-74.4	178.2	177	174.7	0	111.9	E1017 T1025	E1017-K1021 VanDerWaalsContact CD-NZ 3.26Å; E1017-K1021 HydrophobicContact CG-CD 4Å; E1017-K1021 HydrophobicContact CG-CG 4.43Å; E1017-K1021 WeakPolarHBondContact O-CB 3.43Å; E1017-K1021 WeakPolarHBondContact O-CG 3.39Å; E1017-K1021 PolarHBondContact O-N 2.91Å; E1017-K1021 WeakPolarHBondContact OE1-CE 3.4Å; E1017-K1021 IonicContact OE1-NZ 3.7Å; E1017-K1021 PolarHBondContact OE1-NZ 3.16Å; E1017-K1021 IonicContact OE2-NZ 3.1Å; K1021-T1025 PolarHBondContact O-N 3.2Å; K1021-T1025 PolarHBondContact O-OG1 2.88Å
1022	R	90	Very high	88.8	Confident	89 Å²	89	45.2 Å²	45.2	34%	0.336	22%	0.222	S	C	.	.	H	α-helix	trans	-66.8	-44.4	177.6	-74.5	176.9	177.7	78.6	-5.4	112.2	F961 A1018 C1019 V1020 R1024 T1025 A1026	F961-R1022 HydrophobicContact CB-CB 4.31Å; F961-R1022 HydrophobicContact CD2-CB 4.4Å; F961-R1022 HydrophobicContact CG-CB 4.22Å; A1018-R1022 WeakPolarHBondContact O-CD 3.27Å; A1018-R1022 VanDerWaalsContact O-CG 3.29Å; A1018-R1022 WeakPolarHBondContact O-CG 3.34Å; A1018-R1022 PolarHBondContact O-NH1 3.49Å; C1019-R1022 PolarHBondContact O-N 3.1Å; V1020-R1022 PolarHBondContact O-N 2.76Å; R1022-R1024 VanDerWaalsContact C-N 3.35Å; R1022-R1024 PolarHBondContact O-N 3.21Å; R1022-T1025 PolarHBondContact O-N 3.35Å; R1022-A1026 WeakPolarHBondContact O-CB 3.47Å; R1022-A1026 PolarHBondContact O-N 3.46Å
1023	T	90.8	Very high	88.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-60.4	-44.2	178.2	-60.6	0	0	0	0	111.6	W966 C1019 V1020 A1026 F1027 M1049 V1052 L1053	W966-T1023 HydrophobicContact CH2-CG2 4.05Å; W966-T1023 HydrophobicContact CZ3-CG2 3.92Å; C1019-T1023 WeakPolarHBondContact O-CB 3.2Å; C1019-T1023 PolarHBondContact O-N 3.43Å; C1019-T1023 PolarHBondContact O-OG1 3.46Å; V1020-T1023 PolarHBondContact O-N 3.31Å; T1023-A1026 PolarHBondContact O-N 3.02Å; T1023-F1027 WeakPolarHBondContact O-CB 3.49Å; T1023-F1027 PolarHBondContact O-N 3.46Å; T1023-M1049 HydrophobicContact CG2-CB 4.11Å; T1023-M1049 HydrophobicContact CG2-CG 4.48Å; T1023-M1049 VanDerWaalsContact CG2-O 3.26Å; T1023-M1049 WeakPolarHBondContact CG2-O 3.42Å; T1023-V1052 HydrophobicContact CG2-CB 4.15Å; T1023-V1052 HydrophobicContact CG2-CG1 4Å; T1023-L1053 HydrophobicContact CG2-CD1 4.42Å; T1023-L1053 HydrophobicContact CG2-CD2 3.95Å; T1023-L1053 HydrophobicContact CG2-CG 3.89Å
1024	R	90.4	Very high	88.2	Confident	65 Å²	65	54.3 Å²	54.3	25%	0.245	26%	0.264	C	S	.	.	H	α-helix	trans	-58.7	-50.6	172.2	177.1	-171.5	169.2	146.9	10.6	112.4	V1020 R1022 A1026 F1027 E1028 E1088 I1089	V1020-R1024 WeakPolarHBondContact O-CB 3.44Å; V1020-R1024 PolarHBondContact O-N 2.91Å; R1022-R1024 VanDerWaalsContact C-N 3.35Å; R1022-R1024 PolarHBondContact O-N 3.21Å; R1024-A1026 VanDerWaalsContact C-N 3.29Å; R1024-A1026 PolarHBondContact O-N 3.36Å; R1024-F1027 WeakPolarHBondContact O-CB 3.25Å; R1024-F1027 PolarHBondContact O-N 2.71Å; R1024-E1028 WeakPolarHBondContact CG-OE1 3.43Å; R1024-E1028 IonicContact CZ-OE1 3.56Å; R1024-E1028 IonicContact NE-OE1 2.72Å; R1024-E1028 PolarHBondContact NE-OE1 2.91Å; R1024-E1028 IonicContact NH2-OE1 2.72Å; R1024-E1028 PolarHBondContact NH2-OE1 2.92Å; R1024-E1028 PolarHBondContact O-N 2.89Å; R1024-E1088 IonicContact CZ-OE1 3.13Å; R1024-E1088 IonicContact CZ-OE2 3.45Å; R1024-E1088 IonicContact NH1-OE1 3.33Å; R1024-E1088 PolarHBondContact NH1-OE1 3.39Å; R1024-E1088 IonicContact NH1-OE2 3.52Å; R1024-E1088 PolarHBondContact NH1-OE2 2.86Å; R1024-E1088 IonicContact NH2-OE1 3.79Å; R1024-E1088 PolarHBondContact NH2-OE1 2.86Å; R1024-E1088 IonicContact NH2-OE2 2.59Å; R1024-I1089 HydrophobicContact CB-CD1 4.46Å
1025	T	89.8	Confident	87.7	Confident	77 Å²	77	52.3 Å²	52.3	47%	0.472	26%	0.258	S	S	.	.	H	α-helix	trans	-60.1	-40.3	179.5	-55.8	0	0	0	0	111.7	K1021 R1022 L1029	K1021-T1025 PolarHBondContact O-N 3.2Å; K1021-T1025 PolarHBondContact O-OG1 2.88Å; R1022-T1025 PolarHBondContact O-N 3.35Å; T1025-L1029 HydrophobicContact CG2-CD1 4.08Å; T1025-L1029 WeakPolarHBondContact O-CB 3.44Å; T1025-L1029 VanDerWaalsContact O-CG 3.29Å; T1025-L1029 WeakPolarHBondContact O-CG 3.34Å; T1025-L1029 PolarHBondContact O-N 2.8Å; T1025-L1029 VanDerWaalsContact O-N 3.1Å
1026	A	89.1	Confident	87.2	Confident	22 Å²	22	58 Å²	58	18%	0.182	28%	0.282	C	S	.	.	H	α-helix	trans	-65.6	-41.1	175.8	0	0	0	0	0	112.3	W966 R1022 T1023 R1024 L1029 K1030 M1049	W966-A1026 HydrophobicContact CH2-CB 4.23Å; W966-A1026 HydrophobicContact CZ2-CB 3.54Å; R1022-A1026 WeakPolarHBondContact O-CB 3.47Å; R1022-A1026 PolarHBondContact O-N 3.46Å; T1023-A1026 PolarHBondContact O-N 3.02Å; R1024-A1026 VanDerWaalsContact C-N 3.29Å; R1024-A1026 PolarHBondContact O-N 3.36Å; A1026-L1029 PolarHBondContact O-N 3.48Å; A1026-K1030 WeakPolarHBondContact O-CB 3.23Å; A1026-K1030 PolarHBondContact O-N 3.19Å; A1026-M1049 HydrophobicContact CB-CE 3.78Å
1027	F	90.3	Very high	86.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.6	-50.8	174	179	-78.6	0	0	0	111.8	T1023 R1024 L1029 K1030 L1031 V1046 M1049 I1089 L1092 L1093	T1023-F1027 WeakPolarHBondContact O-CB 3.49Å; T1023-F1027 PolarHBondContact O-N 3.46Å; R1024-F1027 WeakPolarHBondContact O-CB 3.25Å; R1024-F1027 PolarHBondContact O-N 2.71Å; F1027-L1029 PolarHBondContact O-N 3.28Å; F1027-K1030 PolarHBondContact O-N 3.41Å; F1027-K1030 VanDerWaalsContact O-N 3.16Å; F1027-L1031 HydrophobicContact CD1-CD2 4.49Å; F1027-L1031 HydrophobicContact CE1-CB 4.29Å; F1027-L1031 HydrophobicContact CE1-CD2 3.57Å; F1027-L1031 HydrophobicContact CZ-CD2 3.96Å; F1027-L1031 WeakPolarHBondContact O-CB 3.42Å; F1027-L1031 PolarHBondContact O-N 3.21Å; F1027-V1046 HydrophobicContact CD2-CG1 3.82Å; F1027-V1046 HydrophobicContact CE2-CG1 3.33Å; F1027-V1046 HydrophobicContact CZ-CG1 4.05Å; F1027-M1049 VanDerWaalsContact CA-SD 3.54Å; F1027-M1049 HydrophobicContact CB-CB 4.36Å; F1027-M1049 HydrophobicContact CB-SD 4Å; F1027-M1049 HydrophobicContact CD2-CB 4.11Å; F1027-M1049 HydrophobicContact CD2-SD 4.47Å; F1027-I1089 HydrophobicContact CB-CD1 4.32Å; F1027-I1089 HydrophobicContact CD1-CD1 4.31Å; F1027-I1089 HydrophobicContact CD1-CG1 3.7Å; F1027-I1089 HydrophobicContact CD2-CD1 4.41Å; F1027-I1089 HydrophobicContact CD2-CG1 4.36Å; F1027-I1089 HydrophobicContact CD2-CG2 4.16Å; F1027-I1089 HydrophobicContact CE1-CB 4.22Å; F1027-I1089 HydrophobicContact CE1-CG1 3.86Å; F1027-I1089 HydrophobicContact CE1-CG2 4.07Å; F1027-I1089 HydrophobicContact CE2-CG1 4.48Å; F1027-I1089 HydrophobicContact CE2-CG2 3.63Å; F1027-I1089 HydrophobicContact CG-CD1 4.11Å; F1027-I1089 HydrophobicContact CG-CG1 3.99Å; F1027-I1089 HydrophobicContact CZ-CB 4.26Å; F1027-I1089 HydrophobicContact CZ-CG1 4.27Å; F1027-I1089 HydrophobicContact CZ-CG2 3.6Å; F1027-L1092 HydrophobicContact CE1-CB 4.21Å; F1027-L1092 HydrophobicContact CE1-CD1 4.42Å; F1027-L1093 HydrophobicContact CZ-CB 4.47Å; F1027-L1093 HydrophobicContact CZ-CD1 4.13Å
1028	E	88.6	Confident	86.5	Confident	57 Å²	57	58 Å²	58	27%	0.266	29%	0.287	S	S	.	.	H	α-helix	trans	-57.7	-47.6	179.2	-73.1	179.1	-158.6	0	0	111.1	R1024 K1030 L1031 Q1032 L1092	R1024-E1028 WeakPolarHBondContact CG-OE1 3.43Å; R1024-E1028 IonicContact CZ-OE1 3.56Å; R1024-E1028 IonicContact NE-OE1 2.72Å; R1024-E1028 PolarHBondContact NE-OE1 2.91Å; R1024-E1028 IonicContact NH2-OE1 2.72Å; R1024-E1028 PolarHBondContact NH2-OE1 2.92Å; R1024-E1028 PolarHBondContact O-N 2.89Å; E1028-K1030 VanDerWaalsContact C-N 3.34Å; E1028-K1030 PolarHBondContact O-N 3.02Å; E1028-L1031 PolarHBondContact O-N 2.9Å; E1028-Q1032 WeakPolarHBondContact O-CB 3.35Å; E1028-Q1032 VanDerWaalsContact O-CG 3.24Å; E1028-Q1032 WeakPolarHBondContact O-CG 3.26Å; E1028-Q1032 PolarHBondContact O-N 3.12Å; E1028-L1092 HydrophobicContact CG-CD1 3.82Å
1029	L	87.8	Confident	86.1	Confident	86 Å²	86	62.4 Å²	62.4	45%	0.45	31%	0.307	S	S	.	.	H	α-helix	trans	-64.6	-32.5	177.5	-71.7	170.2	0	0	0	113.6	T1025 A1026 F1027 K1033	T1025-L1029 HydrophobicContact CG2-CD1 4.08Å; T1025-L1029 WeakPolarHBondContact O-CB 3.44Å; T1025-L1029 VanDerWaalsContact O-CG 3.29Å; T1025-L1029 WeakPolarHBondContact O-CG 3.34Å; T1025-L1029 PolarHBondContact O-N 2.8Å; T1025-L1029 VanDerWaalsContact O-N 3.1Å; A1026-L1029 PolarHBondContact O-N 3.48Å; F1027-L1029 PolarHBondContact O-N 3.28Å; L1029-K1033 WeakPolarHBondContact O-CD 3.22Å; L1029-K1033 WeakPolarHBondContact O-CG 3.36Å
1030	K	86.9	Confident	85.9	Confident	85 Å²	85	62.9 Å²	62.9	37%	0.37	31%	0.31	S	S	.	.	H	α-helix	trans	-74.8	-44.2	176.6	-160.4	83.6	174.2	-146.5	0	111	A1026 F1027 E1028 K1033 S1045 V1046 M1049	A1026-K1030 WeakPolarHBondContact O-CB 3.23Å; A1026-K1030 PolarHBondContact O-N 3.19Å; F1027-K1030 PolarHBondContact O-N 3.41Å; F1027-K1030 VanDerWaalsContact O-N 3.16Å; E1028-K1030 VanDerWaalsContact C-N 3.34Å; E1028-K1030 PolarHBondContact O-N 3.02Å; K1030-K1033 PolarHBondContact O-N 3.36Å; K1030-S1045 VanDerWaalsContact CE-OG 3.23Å; K1030-S1045 WeakPolarHBondContact CE-OG 3.19Å; K1030-S1045 PolarHBondContact NZ-OG 3.46Å; K1030-V1046 HydrophobicContact CB-CG2 4.38Å; K1030-V1046 HydrophobicContact CG-CG2 3.84Å; K1030-M1049 HydrophobicContact CB-CE 4.34Å; K1030-M1049 HydrophobicContact CB-SD 4.38Å
1031	L	86.1	Confident	85.7	Confident	17 Å²	17	66.4 Å²	66.4	9%	0.089	32%	0.323	C	S	.	.	H	α-helix	trans	-72.6	-34.1	-177.1	-173.5	62.3	0	0	0	112.5	F1027 E1028 K1033 A1034 L1092 L1093 K1096	F1027-L1031 HydrophobicContact CD1-CD2 4.49Å; F1027-L1031 HydrophobicContact CE1-CB 4.29Å; F1027-L1031 HydrophobicContact CE1-CD2 3.57Å; F1027-L1031 HydrophobicContact CZ-CD2 3.96Å; F1027-L1031 WeakPolarHBondContact O-CB 3.42Å; F1027-L1031 PolarHBondContact O-N 3.21Å; E1028-L1031 PolarHBondContact O-N 2.9Å; L1031-K1033 VanDerWaalsContact C-N 3.28Å; L1031-K1033 PolarHBondContact O-N 3.23Å; L1031-A1034 WeakPolarHBondContact O-CB 3.36Å; L1031-A1034 PolarHBondContact O-N 2.77Å; L1031-L1092 HydrophobicContact CD2-CB 3.94Å; L1031-L1093 HydrophobicContact CD1-CD1 3.86Å; L1031-L1093 HydrophobicContact CD2-CD1 4.2Å; L1031-K1096 HydrophobicContact CD1-CB 4.04Å; L1031-K1096 HydrophobicContact CD1-CD 4.18Å; L1031-K1096 HydrophobicContact CD1-CG 3.83Å; L1031-K1096 HydrophobicContact CD2-CB 4.41Å; L1031-K1096 HydrophobicContact CG-CB 4.39Å; L1031-K1096 HydrophobicContact CG-CD 4.32Å; L1031-K1096 HydrophobicContact CG-CG 4.39Å; L1031-K1096 PolarHBondContact O-NZ 3.03Å
1032	Q	82.8	Confident	85.6	Confident	139 Å²	139	62.1 Å²	62.1	65%	0.65	31%	0.305	S	S	*	.	H	α-helix	trans	-54.7	-45	171.3	-78.6	175.7	21.4	0	0	111.5	E1028 A1034 K1096	E1028-Q1032 WeakPolarHBondContact O-CB 3.35Å; E1028-Q1032 VanDerWaalsContact O-CG 3.24Å; E1028-Q1032 WeakPolarHBondContact O-CG 3.26Å; E1028-Q1032 PolarHBondContact O-N 3.12Å; Q1032-A1034 VanDerWaalsContact C-N 3.29Å; Q1032-A1034 PolarHBondContact O-N 3.43Å; Q1032-K1096 PolarHBondContact O-NZ 2.68Å
1033	K	81.5	Confident	85.4	Confident	178 Å²	178	60.5 Å²	60.5	77%	0.774	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-12.2	-178.1	-66	172.8	-174.6	175.5	0	114.9	L1029 K1030 L1031	L1029-K1033 WeakPolarHBondContact O-CD 3.22Å; L1029-K1033 WeakPolarHBondContact O-CG 3.36Å; K1030-K1033 PolarHBondContact O-N 3.36Å; L1031-K1033 VanDerWaalsContact C-N 3.28Å; L1031-K1033 PolarHBondContact O-N 3.23Å
1034	A	81.1	Confident	85.1	Confident	23 Å²	23	62.7 Å²	62.7	19%	0.19	32%	0.324	C	S	.	.	S	Bend	trans	-71.6	157.5	179.6	0	0	0	0	0	112.9	L1031 Q1032 L1040 K1096	L1031-A1034 WeakPolarHBondContact O-CB 3.36Å; L1031-A1034 PolarHBondContact O-N 2.77Å; Q1032-A1034 VanDerWaalsContact C-N 3.29Å; Q1032-A1034 PolarHBondContact O-N 3.43Å; A1034-L1040 HydrophobicContact CB-CD1 3.81Å; A1034-K1096 WeakPolarHBondContact O-CE 3.45Å; A1034-K1096 PolarHBondContact O-NZ 3.05Å
1035	S	76.6	Confident	85	Confident	54 Å²	54	60.2 Å²	60.2	38%	0.378	32%	0.316	S	S	.	.			trans	-62.3	162.8	178.2	-170	0	0	0	0	113.2	T1037 K1096	S1035-T1037 PolarHBondContact OG-N 3.08Å; S1035-T1037 PolarHBondContact OG-OG1 3.36Å; S1035-K1096 WeakPolarHBondContact O-CE 3.19Å
1036	K	79.9	Confident	84.9	Confident	138 Å²	138	56.8 Å²	56.8	60%	0.6	30%	0.295	S	S	*	.	S	Bend	trans	-113.1	15.6	165.6	-65.4	-168.9	174.5	-169.1	0	112.7
1037	T	81.7	Confident	84.9	Confident	56 Å²	56	55.9 Å²	55.9	34%	0.344	29%	0.288	S	S	.	.	S	Bend	trans	-97.4	166.5	176.4	63.7	0	0	0	0	111.7	S1035 D1039 L1040	S1035-T1037 PolarHBondContact OG-N 3.08Å; S1035-T1037 PolarHBondContact OG-OG1 3.36Å; T1037-D1039 WeakPolarHBondContact CB-OD2 3.38Å; T1037-D1039 PolarHBondContact O-N 3.3Å; T1037-D1039 VanDerWaalsContact O-N 3.09Å; T1037-D1039 PolarHBondContact OG1-OD2 2.8Å; T1037-L1040 WeakPolarHBondContact O-CB 3.49Å; T1037-L1040 PolarHBondContact O-N 3.38Å
1038	T	80.2	Confident	84.9	Confident	10 Å²	10	56.1 Å²	56.1	6%	0.061	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-12.4	172.9	40.5	0	0	0	0	113.8	R1041 V1100 V1104 T1144 Y1145 F1148	T1038-R1041 PolarHBondContact O-NH1 2.86Å; T1038-V1100 HydrophobicContact CG2-CG1 3.9Å; T1038-V1104 HydrophobicContact CG2-CG2 3.98Å; T1038-T1144 HydrophobicContact CG2-CG2 4.27Å; T1038-T1144 WeakPolarHBondContact OG1-CG2 3.36Å; T1038-Y1145 HydrophobicContact CG2-CD2 4.47Å; T1038-F1148 HydrophobicContact CG2-CB 4.36Å; T1038-F1148 WeakPolarHBondContact O-CB 3.44Å
1039	D	82.3	Confident	85	Confident	112 Å²	112	53.5 Å²	53.5	60%	0.599	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-5.9	174.9	-30.5	-72.2	0	0	0	111.9	T1037 R1041	T1037-D1039 WeakPolarHBondContact CB-OD2 3.38Å; T1037-D1039 PolarHBondContact O-N 3.3Å; T1037-D1039 VanDerWaalsContact O-N 3.09Å; T1037-D1039 PolarHBondContact OG1-OD2 2.8Å; D1039-R1041 PolarHBondContact O-N 3.35Å
1040	L	86.1	Confident	85.1	Confident	10 Å²	10	49.8 Å²	49.8	5%	0.052	26%	0.257	C	S	.	.			trans	-56.4	118.7	173.9	173	62.9	0	0	0	110.5	A1034 T1037 K1096 F1097 V1100 F1148 N1152	A1034-L1040 HydrophobicContact CB-CD1 3.81Å; T1037-L1040 WeakPolarHBondContact O-CB 3.49Å; T1037-L1040 PolarHBondContact O-N 3.38Å; L1040-K1096 HydrophobicContact CD2-CG 4Å; L1040-F1097 HydrophobicContact CD2-CD1 4.39Å; L1040-V1100 HydrophobicContact CD2-CG2 3.89Å; L1040-F1148 HydrophobicContact CB-CD2 4.38Å; L1040-F1148 HydrophobicContact CB-CE2 3.93Å; L1040-F1148 HydrophobicContact CD2-CE2 4.07Å; L1040-F1148 HydrophobicContact CG-CE2 4.16Å; L1040-F1148 WeakPolarHBondContact O-CD2 3.44Å; L1040-N1152 PolarHBondContact O-ND2 2.83Å
1041	R	87.4	Confident	85.3	Confident	76 Å²	76	46.2 Å²	46.2	29%	0.287	24%	0.242	S	C	.	.			trans	-119.8	137.9	163.9	-60	-62.5	173.2	-86.2	0.6	108.2	T1038 D1039 P1043 N1152 I1155	T1038-R1041 PolarHBondContact O-NH1 2.86Å; D1039-R1041 PolarHBondContact O-N 3.35Å; R1041-P1043 WeakPolarHBondContact O-CD 3.37Å; R1041-N1152 WeakPolarHBondContact CA-OD1 3.34Å; R1041-I1155 HydrophobicContact CB-CD1 4.15Å
1042	I	87.4	Confident	85.5	Confident	11 Å²	11	45.4 Å²	45.4	6%	0.056	24%	0.238	C	C	.	.			trans	-63.2	124.7	176.1	-74	175.8	0	0	0	109.6	V1046 L1093 F1097 N1152 I1155 L1156	I1042-V1046 HydrophobicContact CG2-CB 3.92Å; I1042-V1046 HydrophobicContact CG2-CG1 4.18Å; I1042-L1093 HydrophobicContact CD1-CD1 3.85Å; I1042-L1093 HydrophobicContact CD1-CD2 3.7Å; I1042-L1093 HydrophobicContact CD1-CG 4.06Å; I1042-L1093 HydrophobicContact CG1-CD1 4.34Å; I1042-F1097 HydrophobicContact CD1-CE1 3.75Å; I1042-F1097 HydrophobicContact CD1-CE2 4.41Å; I1042-F1097 HydrophobicContact CD1-CZ 3.38Å; I1042-F1097 HydrophobicContact CG1-CE1 4.1Å; I1042-F1097 HydrophobicContact CG1-CZ 4.22Å; I1042-N1152 PolarHBondContact N-OD1 3.13Å; I1042-I1155 HydrophobicContact CB-CG2 4.22Å; I1042-I1155 HydrophobicContact CG2-CG2 4.44Å; I1042-L1156 HydrophobicContact CD1-CD1 3.9Å; I1042-L1156 HydrophobicContact CD1-CD2 3.89Å; I1042-L1156 HydrophobicContact CD1-CG 3.89Å
1043	P	86.9	Confident	85.8	Confident	54 Å²	54	38.8 Å²	38.8	35%	0.351	21%	0.207	S	C	.	.			trans	-66.6	137.4	171.2	-16.7	30.2	0	0	0	110.2	R1041 S1045 V1046	R1041-P1043 WeakPolarHBondContact O-CD 3.37Å; P1043-S1045 PolarHBondContact O-N 2.93Å; P1043-V1046 HydrophobicContact CB-CG2 4.3Å; P1043-V1046 HydrophobicContact CG-CG2 4.22Å; P1043-V1046 VanDerWaalsContact O-CB 3.32Å; P1043-V1046 WeakPolarHBondContact O-CB 3.13Å; P1043-V1046 PolarHBondContact O-N 2.93Å
1044	A	84.9	Confident	86.1	Confident	47 Å²	47	30.6 Å²	30.6	39%	0.388	17%	0.172	S	C	.	.	H	α-helix	trans	-51.8	-34.9	-178.9	0	0	0	0	0	113.6	V1046 C1047 T1048 K1159	A1044-V1046 PolarHBondContact O-N 2.88Å; A1044-V1046 VanDerWaalsContact O-N 3.1Å; A1044-C1047 WeakPolarHBondContact O-CA 3.49Å; A1044-C1047 WeakPolarHBondContact O-CB 3.44Å; A1044-C1047 PolarHBondContact O-N 2.94Å; A1044-T1048 PolarHBondContact O-N 3.12Å; A1044-T1048 PolarHBondContact O-OG1 3.25Å; A1044-K1159 HydrophobicContact CB-CD 4.33Å
1045	S	86.7	Confident	86.4	Confident	12 Å²	12	29.8 Å²	29.8	8%	0.084	16%	0.164	C	C	.	.	H	α-helix	trans	-55.2	-28.3	174.6	60.2	0	0	0	0	114.6	W966 K1030 P1043 T1048 M1049	W966-S1045 WeakPolarHBondContact O-CA 3.41Å; W966-S1045 WeakPolarHBondContact O-CB 3.26Å; K1030-S1045 VanDerWaalsContact CE-OG 3.23Å; K1030-S1045 WeakPolarHBondContact CE-OG 3.19Å; K1030-S1045 PolarHBondContact NZ-OG 3.46Å; P1043-S1045 PolarHBondContact O-N 2.93Å; S1045-T1048 PolarHBondContact O-N 3.1Å; S1045-M1049 WeakPolarHBondContact O-CG 3.27Å; S1045-M1049 PolarHBondContact O-N 3.06Å
1046	V	88.4	Confident	87	Confident	5 Å²	5	27.2 Å²	27.2	3%	0.03	15%	0.146	C	C	.	.	H	α-helix	trans	-76.3	-34.5	178.9	179.1	0	0	0	0	110.4	F1027 K1030 I1042 P1043 A1044 F1050 L1093	F1027-V1046 HydrophobicContact CD2-CG1 3.82Å; F1027-V1046 HydrophobicContact CE2-CG1 3.33Å; F1027-V1046 HydrophobicContact CZ-CG1 4.05Å; K1030-V1046 HydrophobicContact CB-CG2 4.38Å; K1030-V1046 HydrophobicContact CG-CG2 3.84Å; I1042-V1046 HydrophobicContact CG2-CB 3.92Å; I1042-V1046 HydrophobicContact CG2-CG1 4.18Å; P1043-V1046 HydrophobicContact CB-CG2 4.3Å; P1043-V1046 HydrophobicContact CG-CG2 4.22Å; P1043-V1046 VanDerWaalsContact O-CB 3.32Å; P1043-V1046 WeakPolarHBondContact O-CB 3.13Å; P1043-V1046 PolarHBondContact O-N 2.93Å; A1044-V1046 PolarHBondContact O-N 2.88Å; A1044-V1046 VanDerWaalsContact O-N 3.1Å; V1046-F1050 PolarHBondContact O-N 3.19Å; V1046-F1050 VanDerWaalsContact O-N 3.13Å; V1046-L1093 HydrophobicContact CG1-CD1 4.27Å
1047	C	88.8	Confident	87.3	Confident	3 Å²	3	23 Å²	23	2%	0.02	13%	0.128	C	C	.	.	H	α-helix	trans	-67.8	-41.7	168.2	-54.7	0	0	0	0	110.7	A1044 M1049 F1050 N1051 K1159 V1160	A1044-C1047 WeakPolarHBondContact O-CA 3.49Å; A1044-C1047 WeakPolarHBondContact O-CB 3.44Å; A1044-C1047 PolarHBondContact O-N 2.94Å; C1047-M1049 PolarHBondContact O-N 3.43Å; C1047-F1050 WeakPolarHBondContact O-CA 3.2Å; C1047-F1050 VanDerWaalsContact O-CB 3.29Å; C1047-F1050 WeakPolarHBondContact O-CB 2.98Å; C1047-F1050 PolarHBondContact O-N 3.42Å; C1047-F1050 VanDerWaalsContact O-N 3.08Å; C1047-N1051 PolarHBondContact O-N 3.32Å; C1047-K1159 HydrophobicContact CB-CB 3.75Å; C1047-V1160 HydrophobicContact CB-CG2 4.21Å
1048	T	90	Very high	87.4	Confident	5 Å²	5	24.7 Å²	24.7	3%	0.031	13%	0.13	C	C	.	.	H	α-helix	trans	-58.4	-47.2	173.6	-54	0	0	0	0	111.9	G972 A1044 S1045 F1050 N1051 V1052	G972-T1048 WeakPolarHBondContact O-CG2 3.46Å; A1044-T1048 PolarHBondContact O-N 3.12Å; A1044-T1048 PolarHBondContact O-OG1 3.25Å; S1045-T1048 PolarHBondContact O-N 3.1Å; T1048-F1050 VanDerWaalsContact C-N 3.25Å; T1048-F1050 PolarHBondContact O-N 2.83Å; T1048-N1051 PolarHBondContact O-N 2.99Å; T1048-V1052 WeakPolarHBondContact O-CG2 3.33Å; T1048-V1052 PolarHBondContact O-N 3.14Å
1049	M	91.4	Very high	87.6	Confident	2 Å²	2	26.2 Å²	26.2	1%	0.01	14%	0.137	C	C	.	.	H	α-helix	trans	-58	-36.2	173.3	-71.7	158.8	176.3	0	0	112.7	W966 T1023 A1026 F1027 K1030 S1045 C1047	W966-M1049 HydrophobicContact CB-CE 4.35Å; W966-M1049 HydrophobicContact CD2-CE 3.46Å; W966-M1049 VanDerWaalsContact CD2-CE 3.46Å; W966-M1049 HydrophobicContact CD2-CG 3.75Å; W966-M1049 HydrophobicContact CE3-CB 4.33Å; W966-M1049 HydrophobicContact CE3-CE 4.08Å; W966-M1049 HydrophobicContact CE3-CG 3.32Å; W966-M1049 HydrophobicContact CG-CE 3.57Å; W966-M1049 HydrophobicContact CG-CG 4.44Å; W966-M1049 HydrophobicContact CH2-CG 4.25Å; W966-M1049 HydrophobicContact CZ2-CE 4.22Å; W966-M1049 HydrophobicContact CZ3-CB 4.39Å; W966-M1049 HydrophobicContact CZ3-CG 3.61Å; T1023-M1049 HydrophobicContact CG2-CB 4.11Å; T1023-M1049 HydrophobicContact CG2-CG 4.48Å; T1023-M1049 VanDerWaalsContact CG2-O 3.26Å; T1023-M1049 WeakPolarHBondContact CG2-O 3.42Å; A1026-M1049 HydrophobicContact CB-CE 3.78Å; F1027-M1049 VanDerWaalsContact CA-SD 3.54Å; F1027-M1049 HydrophobicContact CB-CB 4.36Å; F1027-M1049 HydrophobicContact CB-SD 4Å; F1027-M1049 HydrophobicContact CD2-CB 4.11Å; F1027-M1049 HydrophobicContact CD2-SD 4.47Å; K1030-M1049 HydrophobicContact CB-CE 4.34Å; K1030-M1049 HydrophobicContact CB-SD 4.38Å; S1045-M1049 WeakPolarHBondContact O-CG 3.27Å; S1045-M1049 PolarHBondContact O-N 3.06Å; C1047-M1049 PolarHBondContact O-N 3.43Å
1050	F	89.3	Confident	87.7	Confident	8 Å²	8	21 Å²	21	4%	0.035	11%	0.109	C	C	.	.	H	α-helix	trans	-66.9	-47.6	175.3	-160.5	-75.1	0	0	0	111.1	V1046 C1047 T1048 V1052 L1053 V1054 V1086 I1089 I1090 V1160 Y1165 L1169	V1046-F1050 PolarHBondContact O-N 3.19Å; V1046-F1050 VanDerWaalsContact O-N 3.13Å; C1047-F1050 WeakPolarHBondContact O-CA 3.2Å; C1047-F1050 VanDerWaalsContact O-CB 3.29Å; C1047-F1050 WeakPolarHBondContact O-CB 2.98Å; C1047-F1050 PolarHBondContact O-N 3.42Å; C1047-F1050 VanDerWaalsContact O-N 3.08Å; T1048-F1050 VanDerWaalsContact C-N 3.25Å; T1048-F1050 PolarHBondContact O-N 2.83Å; F1050-V1052 VanDerWaalsContact C-N 3.35Å; F1050-V1052 PolarHBondContact O-N 2.82Å; F1050-L1053 PolarHBondContact O-N 3.21Å; F1050-V1054 HydrophobicContact CD1-CG2 3.79Å; F1050-V1054 HydrophobicContact CE1-CG2 3.76Å; F1050-V1054 WeakPolarHBondContact O-CG2 3.44Å; F1050-V1054 PolarHBondContact O-N 3.38Å; F1050-V1054 VanDerWaalsContact O-N 3.15Å; F1050-V1086 HydrophobicContact CZ-CG1 4.06Å; F1050-I1089 HydrophobicContact CD2-CG2 3.52Å; F1050-I1089 HydrophobicContact CE2-CG2 3.71Å; F1050-I1090 HydrophobicContact CE2-CG1 3.8Å; F1050-I1090 HydrophobicContact CZ-CD1 4.24Å; F1050-I1090 HydrophobicContact CZ-CG1 3.87Å; F1050-V1160 HydrophobicContact CD1-CG1 3.73Å; F1050-V1160 HydrophobicContact CD1-CG2 4.48Å; F1050-V1160 HydrophobicContact CE1-CG1 3.92Å; F1050-Y1165 HydrophobicContact CE1-CG 4.23Å; F1050-Y1165 HydrophobicContact CZ-CG 4.48Å; F1050-L1169 HydrophobicContact CE2-CD1 4.43Å
1051	N	90.9	Very high	87.3	Confident	10 Å²	10	24.5 Å²	24.5	5%	0.053	13%	0.131	C	C	.	.	H	α-helix	trans	-65.3	-35.6	-179.1	-63.3	-19.3	0	0	0	112.5	N971 C1047 T1048 L1053 V1054 D1055 K1159 V1160 N1161	N971-N1051 WeakPolarHBondContact O-CB 3.34Å; C1047-N1051 PolarHBondContact O-N 3.32Å; T1048-N1051 PolarHBondContact O-N 2.99Å; N1051-L1053 VanDerWaalsContact C-N 3.27Å; N1051-L1053 PolarHBondContact O-N 3.03Å; N1051-V1054 PolarHBondContact O-N 3Å; N1051-V1054 VanDerWaalsContact O-N 3.13Å; N1051-D1055 PolarHBondContact O-N 2.89Å; N1051-K1159 PolarHBondContact ND2-O 3.21Å; N1051-V1160 VanDerWaalsContact OD1-CA 3.28Å; N1051-V1160 WeakPolarHBondContact OD1-CA 3.49Å; N1051-N1161 PolarHBondContact ND2-OD1 3.16Å; N1051-N1161 VanDerWaalsContact ND2-OD1 3.11Å; N1051-N1161 PolarHBondContact OD1-N 3.27Å
1052	V	91.1	Very high	86.9	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-56.2	-39.7	173.3	168.5	0	0	0	0	112	W966 T1023 T1048 F1050 A1056	W966-V1052 HydrophobicContact CZ3-CG2 4.41Å; T1023-V1052 HydrophobicContact CG2-CB 4.15Å; T1023-V1052 HydrophobicContact CG2-CG1 4Å; T1048-V1052 WeakPolarHBondContact O-CG2 3.33Å; T1048-V1052 PolarHBondContact O-N 3.14Å; F1050-V1052 VanDerWaalsContact C-N 3.35Å; F1050-V1052 PolarHBondContact O-N 2.82Å; V1052-A1056 VanDerWaalsContact O-CB 3.26Å; V1052-A1056 WeakPolarHBondContact O-CB 3.21Å; V1052-A1056 PolarHBondContact O-N 3.32Å
1053	L	89.8	Confident	86.4	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-75.2	-33.4	177.5	-62.7	-179.2	0	0	0	112.8	V1020 T1023 F1050 N1051 K1057 I1082 V1086 I1089	V1020-L1053 HydrophobicContact CB-CD2 3.97Å; V1020-L1053 HydrophobicContact CG1-CD2 3.76Å; V1020-L1053 HydrophobicContact CG2-CD2 3.86Å; T1023-L1053 HydrophobicContact CG2-CD1 4.42Å; T1023-L1053 HydrophobicContact CG2-CD2 3.95Å; T1023-L1053 HydrophobicContact CG2-CG 3.89Å; F1050-L1053 PolarHBondContact O-N 3.21Å; N1051-L1053 VanDerWaalsContact C-N 3.27Å; N1051-L1053 PolarHBondContact O-N 3.03Å; L1053-K1057 PolarHBondContact O-N 3.02Å; L1053-I1082 WeakPolarHBondContact O-CG2 3.22Å; L1053-V1086 HydrophobicContact CB-CG2 3.93Å; L1053-V1086 HydrophobicContact CD1-CG2 4.42Å; L1053-I1089 HydrophobicContact CD1-CD1 3.24Å
1054	V	87.6	Confident	85.7	Confident	6 Å²	6	23.5 Å²	23.5	4%	0.036	12%	0.124	C	C	.	.	H	α-helix	trans	-68.2	-43.1	175.5	167.1	0	0	0	0	111.1	F1050 N1051 K1057 K1058 E1162 Y1165	F1050-V1054 HydrophobicContact CD1-CG2 3.79Å; F1050-V1054 HydrophobicContact CE1-CG2 3.76Å; F1050-V1054 WeakPolarHBondContact O-CG2 3.44Å; F1050-V1054 PolarHBondContact O-N 3.38Å; F1050-V1054 VanDerWaalsContact O-N 3.15Å; N1051-V1054 PolarHBondContact O-N 3Å; N1051-V1054 VanDerWaalsContact O-N 3.13Å; V1054-K1057 WeakPolarHBondContact O-CB 3.47Å; V1054-K1057 PolarHBondContact O-N 2.81Å; V1054-K1058 PolarHBondContact O-N 2.88Å; V1054-E1162 HydrophobicContact CG1-CB 3.86Å; V1054-E1162 HydrophobicContact CG1-CG 3.28Å; V1054-Y1165 HydrophobicContact CG1-CE2 4.37Å; V1054-Y1165 HydrophobicContact CG2-CD2 3.82Å; V1054-Y1165 HydrophobicContact CG2-CE2 3.96Å
1055	D	87.4	Confident	84.6	Confident	5 Å²	5	23.5 Å²	23.5	3%	0.027	12%	0.124	C	C	.	.	H	α-helix	trans	-70.5	-38.7	175	-158.5	77.3	0	0	0	111.1	N971 F980 N1051 K1057 K1058 Q1059	N971-D1055 HydrophobicContact CB-CB 4.06Å; N971-D1055 VanDerWaalsContact CB-OD1 3.3Å; N971-D1055 WeakPolarHBondContact CB-OD1 3.39Å; N971-D1055 PolarHBondContact ND2-OD1 2.76Å; F980-D1055 HydrophobicContact CE2-CB 4.5Å; N1051-D1055 PolarHBondContact O-N 2.89Å; D1055-K1057 PolarHBondContact O-N 3.38Å; D1055-K1057 VanDerWaalsContact O-N 3.09Å; D1055-K1058 CarbonylContact O-C 3.59Å; D1055-K1058 WeakPolarHBondContact O-CA 3.37Å; D1055-K1058 WeakPolarHBondContact O-CB 3.43Å; D1055-K1058 PolarHBondContact O-N 3.5Å; D1055-Q1059 WeakPolarHBondContact O-CG 3.29Å; D1055-Q1059 PolarHBondContact O-N 3.39Å; D1055-Q1059 WeakPolarHBondContact OD2-CG 3.46Å; D1055-Q1059 PolarHBondContact OD2-NE2 3.25Å
1056	A	88.3	Confident	83.2	Confident	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-53.4	-32.9	171.1	0	0	0	0	0	113.2	F980 V1020 V1052 S1060 I1082	F980-A1056 HydrophobicContact CZ-CB 3.93Å; V1020-A1056 HydrophobicContact CG2-CB 4.24Å; V1052-A1056 VanDerWaalsContact O-CB 3.26Å; V1052-A1056 WeakPolarHBondContact O-CB 3.21Å; V1052-A1056 PolarHBondContact O-N 3.32Å; A1056-S1060 WeakPolarHBondContact O-CB 3.19Å; A1056-S1060 PolarHBondContact O-N 3.23Å; A1056-S1060 PolarHBondContact O-OG 3.09Å; A1056-I1082 HydrophobicContact CB-CD1 4.38Å
1057	K	86.6	Confident	81.3	Confident	51 Å²	51	32.8 Å²	32.8	22%	0.222	17%	0.172	C	C	.	.	H	α-helix	trans	-73.1	-27.4	172.9	-155.7	-177.9	-178.6	177	0	113.9	L1053 V1054 D1055 S1060 I1082 D1083 Y1165	L1053-K1057 PolarHBondContact O-N 3.02Å; V1054-K1057 WeakPolarHBondContact O-CB 3.47Å; V1054-K1057 PolarHBondContact O-N 2.81Å; D1055-K1057 PolarHBondContact O-N 3.38Å; D1055-K1057 VanDerWaalsContact O-N 3.09Å; K1057-S1060 PolarHBondContact O-OG 3.02Å; K1057-S1060 VanDerWaalsContact O-OG 3.09Å; K1057-I1082 HydrophobicContact CB-CG2 3.88Å; K1057-I1082 HydrophobicContact CD-CG2 4.44Å; K1057-I1082 HydrophobicContact CG-CG2 4.15Å; K1057-D1083 IonicContact NZ-OD1 3.83Å; K1057-D1083 PolarHBondContact NZ-OD1 2.86Å; K1057-D1083 IonicContact NZ-OD2 2.71Å; K1057-D1083 PolarHBondContact NZ-OD2 2.74Å; K1057-Y1165 WeakPolarHBondContact CD-OH 3.26Å
1058	K	84.4	Confident	79.4	Confident	90 Å²	90	33.7 Å²	33.7	39%	0.391	18%	0.182	S	C	.	.	H	α-helix	trans	-74.5	-42.6	171.8	-63.4	179.6	179.1	-177.8	0	110	V1054 D1055 T1061 E1162	V1054-K1058 PolarHBondContact O-N 2.88Å; D1055-K1058 CarbonylContact O-C 3.59Å; D1055-K1058 WeakPolarHBondContact O-CA 3.37Å; D1055-K1058 WeakPolarHBondContact O-CB 3.43Å; D1055-K1058 PolarHBondContact O-N 3.5Å; K1058-T1061 PolarHBondContact O-OG1 3.39Å; K1058-T1061 VanDerWaalsContact O-OG1 3.04Å; K1058-E1162 WeakPolarHBondContact CE-OE1 3.34Å; K1058-E1162 IonicContact NZ-OE1 2.77Å; K1058-E1162 PolarHBondContact NZ-OE1 2.75Å
1059	Q	83.9	Confident	77.4	Confident	43 Å²	43	37.1 Å²	37.1	20%	0.201	22%	0.218	C	C	.	.	H	α-helix	trans	-74.6	-28.8	-179.5	-50.5	-54.5	-14.8	0	0	113	F980 D1055 T1061 K1062 L1063	F980-Q1059 HydrophobicContact CB-CG 4.26Å; F980-Q1059 HydrophobicContact CD1-CB 3.99Å; F980-Q1059 HydrophobicContact CD1-CG 3.91Å; F980-Q1059 HydrophobicContact CD2-CG 3.7Å; F980-Q1059 HydrophobicContact CE1-CB 4.09Å; F980-Q1059 HydrophobicContact CE1-CG 4.13Å; F980-Q1059 HydrophobicContact CE2-CG 3.92Å; F980-Q1059 HydrophobicContact CG-CB 4.29Å; F980-Q1059 HydrophobicContact CG-CG 3.71Å; F980-Q1059 HydrophobicContact CZ-CB 4.45Å; F980-Q1059 HydrophobicContact CZ-CG 4.14Å; D1055-Q1059 WeakPolarHBondContact O-CG 3.29Å; D1055-Q1059 PolarHBondContact O-N 3.39Å; D1055-Q1059 WeakPolarHBondContact OD2-CG 3.46Å; D1055-Q1059 PolarHBondContact OD2-NE2 3.25Å; Q1059-T1061 PolarHBondContact O-N 3.49Å; Q1059-K1062 PolarHBondContact O-N 3.48Å; Q1059-L1063 HydrophobicContact CB-CD1 4.02Å; Q1059-L1063 WeakPolarHBondContact O-CB 3.32Å; Q1059-L1063 WeakPolarHBondContact O-CG 3.23Å; Q1059-L1063 PolarHBondContact O-N 2.79Å
1060	S	84.1	Confident	75.2	Confident	1 Å²	1	46 Å²	46	1%	0.007	26%	0.26	C	S	.	.	H	α-helix	trans	-59.1	-46.1	174.7	62.3	0	0	0	0	111.7	A1056 K1057 K1062 C1064 H1075 D1079	A1056-S1060 WeakPolarHBondContact O-CB 3.19Å; A1056-S1060 PolarHBondContact O-N 3.23Å; A1056-S1060 PolarHBondContact O-OG 3.09Å; K1057-S1060 PolarHBondContact O-OG 3.02Å; K1057-S1060 VanDerWaalsContact O-OG 3.09Å; S1060-K1062 VanDerWaalsContact C-N 3.26Å; S1060-K1062 PolarHBondContact O-N 3.01Å; S1060-C1064 WeakPolarHBondContact O-CB 3.27Å; S1060-C1064 PolarHBondContact O-N 2.86Å; S1060-C1064 VanDerWaalsContact O-N 3.15Å; S1060-H1075 PolarHBondContact O-CE1 3.23Å; S1060-D1079 WeakPolarHBondContact CB-OD1 3.45Å; S1060-D1079 PolarHBondContact OG-OD1 2.82Å
1061	T	77.6	Confident	73.4	Confident	85 Å²	85	47.5 Å²	47.5	52%	0.521	27%	0.267	S	S	.	.	H	α-helix	trans	-69	-22.3	179.8	65.3	0	0	0	0	113.4	K1058 Q1059	K1058-T1061 PolarHBondContact O-OG1 3.39Å; K1058-T1061 VanDerWaalsContact O-OG1 3.04Å; Q1059-T1061 PolarHBondContact O-N 3.49Å
1062	K	79.1	Confident	71.5	Confident	113 Å²	113	52.7 Å²	52.7	49%	0.491	29%	0.291	S	S	.	.	H	α-helix	trans	-83.9	-62.9	171.7	-169.1	-163.8	-177.8	-163.8	0	111.9	D984 Q1059 S1060 C1064	D984-K1062 WeakPolarHBondContact OD1-CE 3.33Å; D984-K1062 IonicContact OD1-NZ 3.42Å; D984-K1062 PolarHBondContact OD1-NZ 3.04Å; D984-K1062 IonicContact OD2-NZ 3.17Å; D984-K1062 PolarHBondContact OD2-NZ 3.01Å; Q1059-K1062 PolarHBondContact O-N 3.48Å; S1060-K1062 VanDerWaalsContact C-N 3.26Å; S1060-K1062 PolarHBondContact O-N 3.01Å; K1062-C1064 PolarHBondContact O-N 3.22Å
1063	L	76.8	Confident	69.8	Low	1 Å²	1	58.4 Å²	58.4	1%	0.005	32%	0.317	C	S	.	.	H	α-helix	trans	-73.9	-24.5	-165.5	-64.7	173.5	0	0	0	113.7	F980 L983 D984 Q987 A1012 L1016 Q1059	F980-L1063 HydrophobicContact CD1-CD1 4.39Å; L983-L1063 HydrophobicContact CB-CD1 3.96Å; L983-L1063 HydrophobicContact CB-CD2 4.41Å; L983-L1063 HydrophobicContact CD1-CD1 4.06Å; D984-L1063 HydrophobicContact CB-CD2 4.15Å; D984-L1063 WeakPolarHBondContact OD1-CD2 3.32Å; Q987-L1063 PolarHBondContact NE2-O 2.92Å; Q987-L1063 PolarHBondContact OE1-O 3.12Å; A1012-L1063 HydrophobicContact CB-CB 4.35Å; L1016-L1063 HydrophobicContact CD1-CD1 4.43Å; Q1059-L1063 HydrophobicContact CB-CD1 4.02Å; Q1059-L1063 WeakPolarHBondContact O-CB 3.32Å; Q1059-L1063 WeakPolarHBondContact O-CG 3.23Å; Q1059-L1063 PolarHBondContact O-N 2.79Å
1064	C	71.9	Confident	68.3	Low	6 Å²	6	63.3 Å²	63.3	4%	0.041	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-13.6	-176.7	-61.7	0	0	0	0	113.4	S1060 K1062 L1066 H1075	S1060-C1064 WeakPolarHBondContact O-CB 3.27Å; S1060-C1064 PolarHBondContact O-N 2.86Å; S1060-C1064 VanDerWaalsContact O-N 3.15Å; K1062-C1064 PolarHBondContact O-N 3.22Å; C1064-L1066 PolarHBondContact O-N 3.14Å; C1064-H1075 WeakPolarHBondContact CA-CE1 2.97Å; C1064-H1075 WeakPolarHBondContact CB-CE1 3.4Å; C1064-H1075 PolarHBondContact O-CE1 2.69Å; C1064-H1075 VanDerWaalsContact O-CE1 3.24Å; C1064-H1075 CovalentContact O-NE2 1.82Å; C1064-H1075 PolarHBondContact O-NE2 3.38Å
1065	A	62.9	Low	67.2	Low	47 Å²	47	64.6 Å²	64.6	39%	0.388	34%	0.342	S	S	.	.			trans	-48.4	126.2	-159.9	0	0	0	0	0	115.2	K1009 H1075	K1009-A1065 VanDerWaalsContact CE-O 3.31Å; K1009-A1065 WeakPolarHBondContact CE-O 3.28Å; K1009-A1065 PolarHBondContact NZ-O 3.28Å; A1065-H1075 WeakPolarHBondContact CA-CE1 3.49Å; A1065-H1075 WeakPolarHBondContact CA-NE2 3.48Å; A1065-H1075 PolarHBondContact N-CE1 3.47Å; A1065-H1075 PolarHBondContact N-NE2 3.16Å
1066	L	57.2	Low	66.1	Low	28 Å²	28	66.8 Å²	66.8	15%	0.147	36%	0.358	C	S	.	.			trans	-131.9	118.2	-177.7	-81.2	165	0	0	0	112.9	K1009 C1064 G1068 E1071 H1075	K1009-L1066 HydrophobicContact CD-CD1 4.43Å; K1009-L1066 HydrophobicContact CD-CD2 3.71Å; K1009-L1066 HydrophobicContact CD-CG 3.81Å; C1064-L1066 PolarHBondContact O-N 3.14Å; L1066-G1068 VanDerWaalsContact C-N 3.25Å; L1066-G1068 PolarHBondContact O-N 3.11Å; L1066-E1071 HydrophobicContact CD1-CB 3.88Å; L1066-H1075 PolarHBondContact N-NE2 3.11Å
1067	D	47.3	Very low	65.6	Low	184 Å²	184	71 Å²	71	98%	0.984	38%	0.376	S	S	*	.			trans	-77.8	71.7	166	-85.6	-38.9	0	0	0	110.6
1068	G	49.7	Very low	65.4	Low	22 Å²	22	68.8 Å²	68.8	23%	0.227	37%	0.367	C	S	.	.			trans	-159	114.7	-177.3	0	0	0	0	0	114.1	L1066 Q1070 E1071 Q1072	L1066-G1068 VanDerWaalsContact C-N 3.25Å; L1066-G1068 PolarHBondContact O-N 3.11Å; G1068-Q1070 PolarHBondContact O-N 3.41Å; G1068-Q1070 VanDerWaalsContact O-N 3.08Å; G1068-E1071 PolarHBondContact O-N 3.28Å; G1068-Q1072 PolarHBondContact O-N 2.84Å
1069	G	47.4	Very low	65.3	Low	77 Å²	77	66.3 Å²	66.3	79%	0.794	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-8.9	-174.3	0	0	0	0	0	116.6
1070	Q	46.3	Very low	65.4	Low	187 Å²	187	68.6 Å²	68.6	87%	0.874	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-17	170.6	-72.5	-173.5	-22.2	0	0	113.3	G1068	G1068-Q1070 PolarHBondContact O-N 3.41Å; G1068-Q1070 VanDerWaalsContact O-N 3.08Å
1071	E	50.2	Low	65.6	Low	40 Å²	40	70.4 Å²	70.4	19%	0.187	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.9	-9.2	-167	-52.8	-159.8	127.6	0	0	114.3	Q1006 L1066 G1068 Q1073 Y1074	Q1006-E1071 PolarHBondContact NE2-OE1 2.99Å; L1066-E1071 HydrophobicContact CD1-CB 3.88Å; G1068-E1071 PolarHBondContact O-N 3.28Å; E1071-Q1073 PolarHBondContact O-N 2.94Å; E1071-Y1074 PolarHBondContact O-N 3.23Å
1072	Q	51.8	Low	66	Low	120 Å²	120	66.4 Å²	66.4	56%	0.561	36%	0.356	S	S	*	.	H	α-helix	trans	-51.3	-15.4	163.2	-71.3	178.4	-11.7	0	0	113.6	G1068 Y1074 H1075 S1076	G1068-Q1072 PolarHBondContact O-N 2.84Å; Q1072-Y1074 VanDerWaalsContact C-N 3.25Å; Q1072-Y1074 PolarHBondContact O-N 3.02Å; Q1072-H1075 WeakPolarHBondContact O-CB 3.32Å; Q1072-H1075 PolarHBondContact O-N 3.12Å; Q1072-S1076 PolarHBondContact O-N 3.41Å; Q1072-S1076 VanDerWaalsContact O-N 3.16Å; Q1072-S1076 PolarHBondContact O-OG 3.19Å
1073	Q	55.8	Low	66.5	Low	119 Å²	119	63 Å²	63	56%	0.556	34%	0.343	S	S	*	.	H	α-helix	trans	-70.6	-9.9	175.6	-147.6	-155.8	58.7	0	0	114.7	E1071 K1077	E1071-Q1073 PolarHBondContact O-N 2.94Å; Q1073-K1077 WeakPolarHBondContact O-CD 3.4Å; Q1073-K1077 WeakPolarHBondContact O-CE 3.18Å; Q1073-K1077 WeakPolarHBondContact O-CG 3.34Å; Q1073-K1077 PolarHBondContact O-NZ 3.46Å
1074	Y	58.2	Low	67.1	Low	105 Å²	105	66.3 Å²	66.3	41%	0.412	36%	0.361	S	S	.	.	H	α-helix	trans	-91.9	-39.7	171	-68.3	-77.3	0	0	0	111.9	L1010 E1071 Q1072 S1076 K1077 I1078	L1010-Y1074 HydrophobicContact CD2-CD1 4.19Å; L1010-Y1074 HydrophobicContact CD2-CD2 4.25Å; L1010-Y1074 HydrophobicContact CD2-CE1 4.14Å; L1010-Y1074 HydrophobicContact CD2-CE2 4.19Å; L1010-Y1074 HydrophobicContact CD2-CG 4.25Å; E1071-Y1074 PolarHBondContact O-N 3.23Å; Q1072-Y1074 VanDerWaalsContact C-N 3.25Å; Q1072-Y1074 PolarHBondContact O-N 3.02Å; Y1074-S1076 PolarHBondContact O-N 2.98Å; Y1074-K1077 HydrophobicContact CD1-CD 4.4Å; Y1074-K1077 PolarHBondContact O-N 3.08Å; Y1074-I1078 PolarHBondContact O-N 3.36Å; Y1074-I1078 VanDerWaalsContact O-N 3.09Å
1075	H	63.3	Low	68	Low	32 Å²	32	66.3 Å²	66.3	15%	0.148	36%	0.361	C	S	.	.	H	α-helix	trans	-49.9	-56.7	167.9	-83.3	-82.3	0	0	0	112.3	S1060 C1064 A1065 L1066 Q1072 K1077 I1078 D1079	S1060-H1075 PolarHBondContact O-CE1 3.23Å; C1064-H1075 WeakPolarHBondContact CA-CE1 2.97Å; C1064-H1075 WeakPolarHBondContact CB-CE1 3.4Å; C1064-H1075 PolarHBondContact O-CE1 2.69Å; C1064-H1075 VanDerWaalsContact O-CE1 3.24Å; C1064-H1075 CovalentContact O-NE2 1.82Å; C1064-H1075 PolarHBondContact O-NE2 3.38Å; A1065-H1075 WeakPolarHBondContact CA-CE1 3.49Å; A1065-H1075 WeakPolarHBondContact CA-NE2 3.48Å; A1065-H1075 PolarHBondContact N-CE1 3.47Å; A1065-H1075 PolarHBondContact N-NE2 3.16Å; L1066-H1075 PolarHBondContact N-NE2 3.11Å; Q1072-H1075 WeakPolarHBondContact O-CB 3.32Å; Q1072-H1075 PolarHBondContact O-N 3.12Å; H1075-K1077 VanDerWaalsContact C-N 3.26Å; H1075-K1077 PolarHBondContact O-N 3.12Å; H1075-I1078 PolarHBondContact O-N 3.47Å; H1075-I1078 VanDerWaalsContact O-N 3.13Å; H1075-D1079 PolarHBondContact O-N 2.77Å
1076	S	66.1	Low	69.2	Low	52 Å²	52	64.3 Å²	64.3	36%	0.364	34%	0.344	S	S	.	.	H	α-helix	trans	-59.8	-37.3	-177.8	58.5	0	0	0	0	112.3	Q1072 Y1074 D1080	Q1072-S1076 PolarHBondContact O-N 3.41Å; Q1072-S1076 VanDerWaalsContact O-N 3.16Å; Q1072-S1076 PolarHBondContact O-OG 3.19Å; Y1074-S1076 PolarHBondContact O-N 2.98Å; S1076-D1080 WeakPolarHBondContact O-CB 3.38Å; S1076-D1080 VanDerWaalsContact O-CG 3.24Å; S1076-D1080 PolarHBondContact O-N 3.27Å
1077	K	76.3	Confident	70.8	Confident	88 Å²	88	68 Å²	68	38%	0.383	36%	0.359	S	S	.	.	H	α-helix	trans	-62.9	-45.6	175.5	-69.3	166.3	-164.4	142.8	0	112.4	Q1073 Y1074 H1075 L1081	Q1073-K1077 WeakPolarHBondContact O-CD 3.4Å; Q1073-K1077 WeakPolarHBondContact O-CE 3.18Å; Q1073-K1077 WeakPolarHBondContact O-CG 3.34Å; Q1073-K1077 PolarHBondContact O-NZ 3.46Å; Y1074-K1077 HydrophobicContact CD1-CD 4.4Å; Y1074-K1077 PolarHBondContact O-N 3.08Å; H1075-K1077 VanDerWaalsContact C-N 3.26Å; H1075-K1077 PolarHBondContact O-N 3.12Å; K1077-L1081 WeakPolarHBondContact O-CB 3.3Å; K1077-L1081 PolarHBondContact O-N 3.03Å
1078	I	82.9	Confident	72.8	Confident	4 Å²	4	62.9 Å²	62.9	2%	0.021	33%	0.329	C	S	.	.	H	α-helix	trans	-69.1	-47.6	179.9	-69.8	-66.6	0	0	0	110.8	S1013 L1016 E1017 Y1074 H1075 L1081 I1082	S1013-I1078 VanDerWaalsContact O-CD1 3.3Å; S1013-I1078 WeakPolarHBondContact O-CD1 3.38Å; S1013-I1078 WeakPolarHBondContact OG-CD1 3.39Å; S1013-I1078 WeakPolarHBondContact OG-CG1 3.09Å; L1016-I1078 HydrophobicContact CD2-CG2 4.43Å; E1017-I1078 HydrophobicContact CB-CD1 3.92Å; Y1074-I1078 PolarHBondContact O-N 3.36Å; Y1074-I1078 VanDerWaalsContact O-N 3.09Å; H1075-I1078 PolarHBondContact O-N 3.47Å; H1075-I1078 VanDerWaalsContact O-N 3.13Å; I1078-L1081 PolarHBondContact O-N 3.14Å; I1078-I1082 HydrophobicContact CG2-CD1 3.7Å; I1078-I1082 HydrophobicContact CG2-CG1 4.48Å; I1078-I1082 VanDerWaalsContact O-CG1 3.31Å; I1078-I1082 WeakPolarHBondContact O-CG1 3.42Å; I1078-I1082 PolarHBondContact O-N 3.48Å
1079	D	82.2	Confident	74.8	Confident	38 Å²	38	61.9 Å²	61.9	20%	0.203	32%	0.319	C	S	.	.	H	α-helix	trans	-68	-39	-179.3	-74.6	-14.4	0	0	0	112	S1060 H1075 I1082 D1083	S1060-D1079 WeakPolarHBondContact CB-OD1 3.45Å; S1060-D1079 PolarHBondContact OG-OD1 2.82Å; H1075-D1079 PolarHBondContact O-N 2.77Å; D1079-I1082 PolarHBondContact O-N 3.47Å; D1079-D1083 WeakPolarHBondContact O-CB 3.23Å; D1079-D1083 PolarHBondContact O-N 3.05Å
1080	D	85.8	Confident	76.8	Confident	92 Å²	92	58.6 Å²	58.6	49%	0.492	28%	0.283	S	S	.	.	H	α-helix	trans	-61.9	-42.2	170.5	-82.1	-35.7	0	0	0	111.1	S1076 D1083 N1084	S1076-D1080 WeakPolarHBondContact O-CB 3.38Å; S1076-D1080 VanDerWaalsContact O-CG 3.24Å; S1076-D1080 PolarHBondContact O-N 3.27Å; D1080-D1083 PolarHBondContact O-N 3.36Å; D1080-N1084 WeakPolarHBondContact O-CB 3.44Å; D1080-N1084 PolarHBondContact O-N 3.38Å; D1080-N1084 PolarHBondContact O-ND2 3.29Å
1081	L	87.8	Confident	79	Confident	39 Å²	39	52.3 Å²	52.3	20%	0.204	26%	0.26	C	S	.	.	H	α-helix	trans	-66	-38.4	179.2	175.6	138.6	0	0	0	112	E1017 V1020 K1077 I1078 S1085	E1017-L1081 HydrophobicContact CG-CD1 3.86Å; E1017-L1081 HydrophobicContact CG-CD2 4.2Å; V1020-L1081 HydrophobicContact CB-CD2 3.89Å; V1020-L1081 HydrophobicContact CG1-CD2 3.53Å; V1020-L1081 HydrophobicContact CG2-CD2 4.41Å; K1077-L1081 WeakPolarHBondContact O-CB 3.3Å; K1077-L1081 PolarHBondContact O-N 3.03Å; I1078-L1081 PolarHBondContact O-N 3.14Å; L1081-S1085 VanDerWaalsContact O-CB 3.26Å; L1081-S1085 WeakPolarHBondContact O-CB 3.45Å; L1081-S1085 PolarHBondContact O-N 3.02Å; L1081-S1085 PolarHBondContact O-OG 3.24Å
1082	I	87.9	Confident	80.9	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-68.4	-51.7	173.7	-66.1	162.7	0	0	0	110.2	V1020 L1053 A1056 K1057 I1078 D1079 N1084 S1085 V1086	V1020-I1082 HydrophobicContact CG2-CD1 4.47Å; V1020-I1082 HydrophobicContact CG2-CG1 3.76Å; L1053-I1082 WeakPolarHBondContact O-CG2 3.22Å; A1056-I1082 HydrophobicContact CB-CD1 4.38Å; K1057-I1082 HydrophobicContact CB-CG2 3.88Å; K1057-I1082 HydrophobicContact CD-CG2 4.44Å; K1057-I1082 HydrophobicContact CG-CG2 4.15Å; I1078-I1082 HydrophobicContact CG2-CD1 3.7Å; I1078-I1082 HydrophobicContact CG2-CG1 4.48Å; I1078-I1082 VanDerWaalsContact O-CG1 3.31Å; I1078-I1082 WeakPolarHBondContact O-CG1 3.42Å; I1078-I1082 PolarHBondContact O-N 3.48Å; D1079-I1082 PolarHBondContact O-N 3.47Å; I1082-N1084 VanDerWaalsContact C-N 3.3Å; I1082-N1084 PolarHBondContact O-N 3.18Å; I1082-S1085 PolarHBondContact O-N 2.94Å; I1082-S1085 VanDerWaalsContact O-N 3.15Å; I1082-V1086 HydrophobicContact CG2-CG2 4.35Å; I1082-V1086 WeakPolarHBondContact O-CG2 3.29Å; I1082-V1086 PolarHBondContact O-N 3.21Å
1083	D	88.4	Confident	82.7	Confident	40 Å²	40	48 Å²	48	21%	0.214	24%	0.242	C	C	.	.	H	α-helix	trans	-63.6	-35.4	-178.4	-101.5	-8.5	0	0	0	112.4	K1057 D1079 D1080 K1087	K1057-D1083 IonicContact NZ-OD1 3.83Å; K1057-D1083 PolarHBondContact NZ-OD1 2.86Å; K1057-D1083 IonicContact NZ-OD2 2.71Å; K1057-D1083 PolarHBondContact NZ-OD2 2.74Å; D1079-D1083 WeakPolarHBondContact O-CB 3.23Å; D1079-D1083 PolarHBondContact O-N 3.05Å; D1080-D1083 PolarHBondContact O-N 3.36Å; D1083-K1087 WeakPolarHBondContact O-CB 3.26Å; D1083-K1087 VanDerWaalsContact O-CD 3.27Å; D1083-K1087 WeakPolarHBondContact O-CD 3.1Å; D1083-K1087 VanDerWaalsContact O-CE 3.23Å; D1083-K1087 WeakPolarHBondContact O-CE 3.17Å; D1083-K1087 WeakPolarHBondContact O-CG 3.32Å; D1083-K1087 PolarHBondContact O-N 3.4Å
1084	N	89.5	Confident	84.5	Confident	72 Å²	72	42.5 Å²	42.5	39%	0.385	22%	0.216	S	C	.	.	H	α-helix	trans	-70	-43.3	173.8	-66.8	-30.2	0	0	0	111.3	D1080 I1082 V1086 K1087 E1088	D1080-N1084 WeakPolarHBondContact O-CB 3.44Å; D1080-N1084 PolarHBondContact O-N 3.38Å; D1080-N1084 PolarHBondContact O-ND2 3.29Å; I1082-N1084 VanDerWaalsContact C-N 3.3Å; I1082-N1084 PolarHBondContact O-N 3.18Å; N1084-V1086 VanDerWaalsContact C-N 3.32Å; N1084-V1086 PolarHBondContact O-N 3.15Å; N1084-K1087 PolarHBondContact O-N 3.28Å; N1084-K1087 PolarHBondContact OD1-NZ 3.33Å; N1084-E1088 WeakPolarHBondContact O-CB 3.01Å; N1084-E1088 WeakPolarHBondContact O-CG 3.28Å; N1084-E1088 PolarHBondContact O-N 3.05Å
1085	S	90.1	Very high	86	Confident	6 Å²	6	41.1 Å²	41.1	4%	0.042	22%	0.221	C	C	.	.	H	α-helix	trans	-59.2	-41.3	174.7	-62.1	0	0	0	0	112.3	L1081 I1082 I1089	L1081-S1085 VanDerWaalsContact O-CB 3.26Å; L1081-S1085 WeakPolarHBondContact O-CB 3.45Å; L1081-S1085 PolarHBondContact O-N 3.02Å; L1081-S1085 PolarHBondContact O-OG 3.24Å; I1082-S1085 PolarHBondContact O-N 2.94Å; I1082-S1085 VanDerWaalsContact O-N 3.15Å; S1085-I1089 VanDerWaalsContact O-CB 3.29Å; S1085-I1089 WeakPolarHBondContact O-CB 3.42Å; S1085-I1089 WeakPolarHBondContact O-CG1 3.37Å; S1085-I1089 PolarHBondContact O-N 3.45Å
1086	V	89.9	Confident	87.3	Confident	4 Å²	4	40.5 Å²	40.5	2%	0.024	22%	0.218	C	C	.	.	H	α-helix	trans	-67.7	-45	176	174.3	0	0	0	0	111.4	F1050 L1053 I1082 N1084 E1088 I1089 I1090 Y1165	F1050-V1086 HydrophobicContact CZ-CG1 4.06Å; L1053-V1086 HydrophobicContact CB-CG2 3.93Å; L1053-V1086 HydrophobicContact CD1-CG2 4.42Å; I1082-V1086 HydrophobicContact CG2-CG2 4.35Å; I1082-V1086 WeakPolarHBondContact O-CG2 3.29Å; I1082-V1086 PolarHBondContact O-N 3.21Å; N1084-V1086 VanDerWaalsContact C-N 3.32Å; N1084-V1086 PolarHBondContact O-N 3.15Å; V1086-E1088 VanDerWaalsContact C-N 3.32Å; V1086-E1088 PolarHBondContact O-N 3.11Å; V1086-I1089 PolarHBondContact O-N 2.85Å; V1086-I1090 HydrophobicContact CG1-CD1 3.88Å; V1086-I1090 HydrophobicContact CG1-CG1 4.38Å; V1086-I1090 VanDerWaalsContact O-CG1 3.26Å; V1086-I1090 WeakPolarHBondContact O-CG1 3.25Å; V1086-I1090 PolarHBondContact O-N 3.36Å; V1086-Y1165 HydrophobicContact CG1-CD1 3.66Å; V1086-Y1165 HydrophobicContact CG1-CE1 3.75Å; V1086-Y1165 HydrophobicContact CG1-CG 4.4Å
1087	K	89.9	Confident	88.5	Confident	107 Å²	107	38.1 Å²	38.1	47%	0.465	20%	0.201	S	C	.	.	H	α-helix	trans	-57.2	-44.2	174.2	-70.9	160.3	-148.5	159.1	0	111.8	D1083 N1084 S1091	D1083-K1087 WeakPolarHBondContact O-CB 3.26Å; D1083-K1087 VanDerWaalsContact O-CD 3.27Å; D1083-K1087 WeakPolarHBondContact O-CD 3.1Å; D1083-K1087 VanDerWaalsContact O-CE 3.23Å; D1083-K1087 WeakPolarHBondContact O-CE 3.17Å; D1083-K1087 WeakPolarHBondContact O-CG 3.32Å; D1083-K1087 PolarHBondContact O-N 3.4Å; N1084-K1087 PolarHBondContact O-N 3.28Å; N1084-K1087 PolarHBondContact OD1-NZ 3.33Å; K1087-S1091 WeakPolarHBondContact O-CB 3.33Å; K1087-S1091 PolarHBondContact O-N 2.69Å
1088	E	89.6	Confident	89.2	Confident	76 Å²	76	34.4 Å²	34.4	36%	0.355	19%	0.186	S	C	.	.	H	α-helix	trans	-65.9	-41.8	178.4	-72.4	174.7	96	0	0	111.6	R1024 N1084 V1086 S1091 L1092	R1024-E1088 IonicContact CZ-OE1 3.13Å; R1024-E1088 IonicContact CZ-OE2 3.45Å; R1024-E1088 IonicContact NH1-OE1 3.33Å; R1024-E1088 PolarHBondContact NH1-OE1 3.39Å; R1024-E1088 IonicContact NH1-OE2 3.52Å; R1024-E1088 PolarHBondContact NH1-OE2 2.86Å; R1024-E1088 IonicContact NH2-OE1 3.79Å; R1024-E1088 PolarHBondContact NH2-OE1 2.86Å; R1024-E1088 IonicContact NH2-OE2 2.59Å; N1084-E1088 WeakPolarHBondContact O-CB 3.01Å; N1084-E1088 WeakPolarHBondContact O-CG 3.28Å; N1084-E1088 PolarHBondContact O-N 3.05Å; V1086-E1088 VanDerWaalsContact C-N 3.32Å; V1086-E1088 PolarHBondContact O-N 3.11Å; E1088-S1091 WeakPolarHBondContact O-CB 3.25Å; E1088-S1091 PolarHBondContact O-N 3.43Å; E1088-L1092 WeakPolarHBondContact O-CB 3.37Å; E1088-L1092 VanDerWaalsContact O-CG 3.25Å; E1088-L1092 WeakPolarHBondContact O-CG 3.3Å; E1088-L1092 PolarHBondContact O-N 2.64Å
1089	I	90.5	Very high	89.5	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-64.4	-42.4	176.4	-85.5	167.8	0	0	0	112.6	R1024 F1027 F1050 L1053 S1085 V1086 L1092 L1093	R1024-I1089 HydrophobicContact CB-CD1 4.46Å; F1027-I1089 HydrophobicContact CB-CD1 4.32Å; F1027-I1089 HydrophobicContact CD1-CD1 4.31Å; F1027-I1089 HydrophobicContact CD1-CG1 3.7Å; F1027-I1089 HydrophobicContact CD2-CD1 4.41Å; F1027-I1089 HydrophobicContact CD2-CG1 4.36Å; F1027-I1089 HydrophobicContact CD2-CG2 4.16Å; F1027-I1089 HydrophobicContact CE1-CB 4.22Å; F1027-I1089 HydrophobicContact CE1-CG1 3.86Å; F1027-I1089 HydrophobicContact CE1-CG2 4.07Å; F1027-I1089 HydrophobicContact CE2-CG1 4.48Å; F1027-I1089 HydrophobicContact CE2-CG2 3.63Å; F1027-I1089 HydrophobicContact CG-CD1 4.11Å; F1027-I1089 HydrophobicContact CG-CG1 3.99Å; F1027-I1089 HydrophobicContact CZ-CB 4.26Å; F1027-I1089 HydrophobicContact CZ-CG1 4.27Å; F1027-I1089 HydrophobicContact CZ-CG2 3.6Å; F1050-I1089 HydrophobicContact CD2-CG2 3.52Å; F1050-I1089 HydrophobicContact CE2-CG2 3.71Å; L1053-I1089 HydrophobicContact CD1-CD1 3.24Å; S1085-I1089 VanDerWaalsContact O-CB 3.29Å; S1085-I1089 WeakPolarHBondContact O-CB 3.42Å; S1085-I1089 WeakPolarHBondContact O-CG1 3.37Å; S1085-I1089 PolarHBondContact O-N 3.45Å; V1086-I1089 PolarHBondContact O-N 2.85Å; I1089-L1092 PolarHBondContact O-N 3.36Å; I1089-L1093 WeakPolarHBondContact O-CB 3.34Å; I1089-L1093 PolarHBondContact O-N 3.22Å
1090	I	90.9	Very high	89.9	Confident	7 Å²	7	33.2 Å²	33.2	4%	0.036	18%	0.181	C	C	.	.	H	α-helix	trans	-58	-50.5	170.5	-67.4	167.6	0	0	0	109.6	F1050 V1086 L1092 L1093 V1094 Y1165 L1169	F1050-I1090 HydrophobicContact CE2-CG1 3.8Å; F1050-I1090 HydrophobicContact CZ-CD1 4.24Å; F1050-I1090 HydrophobicContact CZ-CG1 3.87Å; V1086-I1090 HydrophobicContact CG1-CD1 3.88Å; V1086-I1090 HydrophobicContact CG1-CG1 4.38Å; V1086-I1090 VanDerWaalsContact O-CG1 3.26Å; V1086-I1090 WeakPolarHBondContact O-CG1 3.25Å; V1086-I1090 PolarHBondContact O-N 3.36Å; I1090-L1092 PolarHBondContact O-N 3.09Å; I1090-L1093 PolarHBondContact O-N 2.92Å; I1090-V1094 HydrophobicContact CG2-CG2 4.32Å; I1090-V1094 WeakPolarHBondContact O-CB 3.12Å; I1090-V1094 VanDerWaalsContact O-CG2 3.3Å; I1090-V1094 WeakPolarHBondContact O-CG2 3.22Å; I1090-V1094 PolarHBondContact O-N 2.99Å; I1090-Y1165 HydrophobicContact CD1-CD1 4.37Å; I1090-L1169 HydrophobicContact CB-CD1 4.41Å; I1090-L1169 HydrophobicContact CG1-CB 4.5Å; I1090-L1169 HydrophobicContact CG1-CD1 4.18Å; I1090-L1169 HydrophobicContact CG2-CB 3.92Å; I1090-L1169 HydrophobicContact CG2-CD1 4.16Å; I1090-L1169 HydrophobicContact CG2-CG 3.98Å
1091	S	91.1	Very high	90	Very high	56 Å²	56	28.8 Å²	28.8	39%	0.392	16%	0.157	S	C	.	.	H	α-helix	trans	-61.4	-39.1	-179	-165.9	0	0	0	0	113.2	K1087 E1088 S1095	K1087-S1091 WeakPolarHBondContact O-CB 3.33Å; K1087-S1091 PolarHBondContact O-N 2.69Å; E1088-S1091 WeakPolarHBondContact O-CB 3.25Å; E1088-S1091 PolarHBondContact O-N 3.43Å; S1091-S1095 VanDerWaalsContact O-CB 3.26Å; S1091-S1095 WeakPolarHBondContact O-CB 3.45Å; S1091-S1095 PolarHBondContact O-N 3.08Å
1092	L	90.8	Very high	90.1	Very high	66 Å²	66	31.7 Å²	31.7	35%	0.346	17%	0.17	S	C	.	.	H	α-helix	trans	-65.8	-42.8	175.1	-75	167.6	0	0	0	111.9	F1027 E1028 L1031 E1088 I1089 I1090 S1095 K1096	F1027-L1092 HydrophobicContact CE1-CB 4.21Å; F1027-L1092 HydrophobicContact CE1-CD1 4.42Å; E1028-L1092 HydrophobicContact CG-CD1 3.82Å; L1031-L1092 HydrophobicContact CD2-CB 3.94Å; E1088-L1092 WeakPolarHBondContact O-CB 3.37Å; E1088-L1092 VanDerWaalsContact O-CG 3.25Å; E1088-L1092 WeakPolarHBondContact O-CG 3.3Å; E1088-L1092 PolarHBondContact O-N 2.64Å; I1089-L1092 PolarHBondContact O-N 3.36Å; I1090-L1092 PolarHBondContact O-N 3.09Å; L1092-S1095 PolarHBondContact O-N 2.85Å; L1092-K1096 PolarHBondContact O-N 3.17Å
1093	L	90.6	Very high	90	Very high	4 Å²	4	33 Å²	33	2%	0.021	18%	0.184	C	C	.	.	H	α-helix	trans	-66.5	-44.8	177.9	-157.4	73	0	0	0	111.3	F1027 L1031 I1042 V1046 I1089 I1090 K1096 F1097 L1156 L1169	F1027-L1093 HydrophobicContact CZ-CB 4.47Å; F1027-L1093 HydrophobicContact CZ-CD1 4.13Å; L1031-L1093 HydrophobicContact CD1-CD1 3.86Å; L1031-L1093 HydrophobicContact CD2-CD1 4.2Å; I1042-L1093 HydrophobicContact CD1-CD1 3.85Å; I1042-L1093 HydrophobicContact CD1-CD2 3.7Å; I1042-L1093 HydrophobicContact CD1-CG 4.06Å; I1042-L1093 HydrophobicContact CG1-CD1 4.34Å; V1046-L1093 HydrophobicContact CG1-CD1 4.27Å; I1089-L1093 WeakPolarHBondContact O-CB 3.34Å; I1089-L1093 PolarHBondContact O-N 3.22Å; I1090-L1093 PolarHBondContact O-N 2.92Å; L1093-K1096 WeakPolarHBondContact O-CB 3.41Å; L1093-K1096 PolarHBondContact O-N 2.89Å; L1093-F1097 HydrophobicContact CD2-CE2 4.24Å; L1093-F1097 HydrophobicContact CD2-CZ 4.37Å; L1093-F1097 HydrophobicContact CG-CE2 4.19Å; L1093-F1097 HydrophobicContact CG-CZ 4.32Å; L1093-F1097 WeakPolarHBondContact O-CG 3.45Å; L1093-F1097 PolarHBondContact O-N 3.32Å; L1093-L1156 HydrophobicContact CD2-CD1 4.2Å; L1093-L1156 HydrophobicContact CD2-CD2 4.08Å; L1093-L1169 HydrophobicContact CB-CD1 4.39Å; L1093-L1169 HydrophobicContact CD2-CD1 3.56Å; L1093-L1169 HydrophobicContact CD2-CD2 4.46Å
1094	V	91.9	Very high	89.8	Confident	3 Å²	3	31.1 Å²	31.1	2%	0.018	17%	0.174	C	C	.	.	H	α-helix	trans	-59.1	-46.8	173.4	170.6	0	0	0	0	111	I1090 K1096 F1097 V1098 L1169 Q1172 W1173	I1090-V1094 HydrophobicContact CG2-CG2 4.32Å; I1090-V1094 WeakPolarHBondContact O-CB 3.12Å; I1090-V1094 VanDerWaalsContact O-CG2 3.3Å; I1090-V1094 WeakPolarHBondContact O-CG2 3.22Å; I1090-V1094 PolarHBondContact O-N 2.99Å; V1094-K1096 VanDerWaalsContact C-N 3.29Å; V1094-K1096 PolarHBondContact O-N 2.93Å; V1094-F1097 PolarHBondContact O-N 2.8Å; V1094-V1098 HydrophobicContact CG1-CG2 4.12Å; V1094-V1098 WeakPolarHBondContact O-CB 3.42Å; V1094-V1098 VanDerWaalsContact O-CG2 3.26Å; V1094-V1098 WeakPolarHBondContact O-CG2 3.43Å; V1094-V1098 PolarHBondContact O-N 3.37Å; V1094-L1169 HydrophobicContact CG2-CG 4.35Å; V1094-Q1172 HydrophobicContact CG1-CG 4.25Å; V1094-Q1172 HydrophobicContact CG2-CB 4.18Å; V1094-Q1172 HydrophobicContact CG2-CG 4.19Å; V1094-W1173 HydrophobicContact CG2-CB 4.07Å
1095	S	90.8	Very high	89.7	Confident	75 Å²	75	27.9 Å²	27.9	52%	0.524	16%	0.156	S	C	.	.	H	α-helix	trans	-58.5	-40.9	175.9	180	0	0	0	0	111.9	S1091 L1092 V1098 S1099	S1091-S1095 VanDerWaalsContact O-CB 3.26Å; S1091-S1095 WeakPolarHBondContact O-CB 3.45Å; S1091-S1095 PolarHBondContact O-N 3.08Å; L1092-S1095 PolarHBondContact O-N 2.85Å; S1095-V1098 PolarHBondContact O-N 3.44Å; S1095-S1099 PolarHBondContact O-N 2.75Å
1096	K	89.9	Confident	89.4	Confident	20 Å²	20	31 Å²	31	9%	0.087	18%	0.178	C	C	.	.	H	α-helix	trans	-61.9	-48	175.1	-165.4	80.1	-178.4	-155	0	111.7	L1031 Q1032 A1034 S1035 L1040 L1092 L1093 V1094 S1099 V1100	L1031-K1096 HydrophobicContact CD1-CB 4.04Å; L1031-K1096 HydrophobicContact CD1-CD 4.18Å; L1031-K1096 HydrophobicContact CD1-CG 3.83Å; L1031-K1096 HydrophobicContact CD2-CB 4.41Å; L1031-K1096 HydrophobicContact CG-CB 4.39Å; L1031-K1096 HydrophobicContact CG-CD 4.32Å; L1031-K1096 HydrophobicContact CG-CG 4.39Å; L1031-K1096 PolarHBondContact O-NZ 3.03Å; Q1032-K1096 PolarHBondContact O-NZ 2.68Å; A1034-K1096 WeakPolarHBondContact O-CE 3.45Å; A1034-K1096 PolarHBondContact O-NZ 3.05Å; S1035-K1096 WeakPolarHBondContact O-CE 3.19Å; L1040-K1096 HydrophobicContact CD2-CG 4Å; L1092-K1096 PolarHBondContact O-N 3.17Å; L1093-K1096 WeakPolarHBondContact O-CB 3.41Å; L1093-K1096 PolarHBondContact O-N 2.89Å; V1094-K1096 VanDerWaalsContact C-N 3.29Å; V1094-K1096 PolarHBondContact O-N 2.93Å; K1096-S1099 PolarHBondContact O-N 3.29Å; K1096-S1099 PolarHBondContact O-OG 2.9Å; K1096-V1100 PolarHBondContact O-N 2.96Å
1097	F	92	Very high	89	Confident	1 Å²	1	35 Å²	35	0%	0.004	20%	0.195	C	C	.	.	H	α-helix	trans	-62.7	-44	177.8	-66.9	-34.7	0	0	0	112.7	L1040 I1042 L1093 V1094 S1099 V1100 L1101 F1148 N1152 L1156 L1169 W1173	L1040-F1097 HydrophobicContact CD2-CD1 4.39Å; I1042-F1097 HydrophobicContact CD1-CE1 3.75Å; I1042-F1097 HydrophobicContact CD1-CE2 4.41Å; I1042-F1097 HydrophobicContact CD1-CZ 3.38Å; I1042-F1097 HydrophobicContact CG1-CE1 4.1Å; I1042-F1097 HydrophobicContact CG1-CZ 4.22Å; L1093-F1097 HydrophobicContact CD2-CE2 4.24Å; L1093-F1097 HydrophobicContact CD2-CZ 4.37Å; L1093-F1097 HydrophobicContact CG-CE2 4.19Å; L1093-F1097 HydrophobicContact CG-CZ 4.32Å; L1093-F1097 WeakPolarHBondContact O-CG 3.45Å; L1093-F1097 PolarHBondContact O-N 3.32Å; V1094-F1097 PolarHBondContact O-N 2.8Å; F1097-S1099 VanDerWaalsContact C-N 3.26Å; F1097-S1099 PolarHBondContact O-N 3.17Å; F1097-V1100 WeakPolarHBondContact O-CB 3.22Å; F1097-V1100 PolarHBondContact O-N 2.8Å; F1097-L1101 PolarHBondContact O-N 2.81Å; F1097-F1148 HydrophobicContact CB-CZ 4.31Å; F1097-F1148 HydrophobicContact CD1-CE2 4.27Å; F1097-F1148 AromaticContact CD1-CZ 3.74Å; F1097-F1148 HydrophobicContact CD1-CZ 3.74Å; F1097-F1148 HydrophobicContact CE1-CZ 4.41Å; F1097-F1148 HydrophobicContact CG-CZ 4.38Å; F1097-N1152 HydrophobicContact CE1-CB 3.84Å; F1097-N1152 HydrophobicContact CZ-CB 3.84Å; F1097-L1156 HydrophobicContact CE2-CD1 3.99Å; F1097-L1156 HydrophobicContact CZ-CD1 3.88Å; F1097-L1169 HydrophobicContact CE2-CD2 4.24Å; F1097-W1173 HydrophobicContact CB-CD2 4.24Å; F1097-W1173 HydrophobicContact CB-CG 4.45Å; F1097-W1173 HydrophobicContact CB-CZ2 4Å; F1097-W1173 HydrophobicContact CD1-CH2 4.49Å; F1097-W1173 HydrophobicContact CD1-CZ2 4.27Å; F1097-W1173 AromaticContact CD2-CD2 3.33Å; F1097-W1173 HydrophobicContact CD2-CD2 3.33Å; F1097-W1173 AromaticContact CD2-CE2 3.46Å; F1097-W1173 VanDerWaalsContact CD2-CE2 3.46Å; F1097-W1173 AromaticContact CD2-CE3 3.53Å; F1097-W1173 HydrophobicContact CD2-CE3 3.53Å; F1097-W1173 AromaticContact CD2-CG 3.89Å; F1097-W1173 HydrophobicContact CD2-CG 3.89Å; F1097-W1173 AromaticContact CD2-CH2 3.96Å; F1097-W1173 HydrophobicContact CD2-CH2 3.96Å; F1097-W1173 AromaticContact CD2-CZ2 3.79Å; F1097-W1173 HydrophobicContact CD2-CZ2 3.79Å; F1097-W1173 AromaticContact CD2-CZ3 3.84Å; F1097-W1173 HydrophobicContact CD2-CZ3 3.84Å; F1097-W1173 AromaticContact CD2-NE1 3.98Å; F1097-W1173 HydrophobicContact CE1-CH2 4.34Å; F1097-W1173 AromaticContact CE2-CD2 3.77Å; F1097-W1173 HydrophobicContact CE2-CD2 3.77Å; F1097-W1173 AromaticContact CE2-CE3 3.41Å; F1097-W1173 HydrophobicContact CE2-CE3 3.41Å; F1097-W1173 VanDerWaalsContact CE2-CE3 3.41Å; F1097-W1173 AromaticContact CE2-CH2 3.8Å; F1097-W1173 HydrophobicContact CE2-CH2 3.8Å; F1097-W1173 HydrophobicContact CE2-CZ2 4.12Å; F1097-W1173 AromaticContact CE2-CZ3 3.42Å; F1097-W1173 HydrophobicContact CE2-CZ3 3.42Å; F1097-W1173 VanDerWaalsContact CE2-CZ3 3.42Å; F1097-W1173 HydrophobicContact CG-CD2 4.09Å; F1097-W1173 AromaticContact CG-CE2 3.71Å; F1097-W1173 HydrophobicContact CG-CH2 4.27Å; F1097-W1173 AromaticContact CG-CZ2 3.82Å; F1097-W1173 HydrophobicContact CG-CZ2 3.82Å; F1097-W1173 HydrophobicContact CZ-CE3 4.31Å; F1097-W1173 AromaticContact CZ-CH2 3.96Å; F1097-W1173 HydrophobicContact CZ-CH2 3.96Å; F1097-W1173 HydrophobicContact CZ-CZ2 4.46Å; F1097-W1173 AromaticContact CZ-CZ3 3.87Å; F1097-W1173 HydrophobicContact CZ-CZ3 3.87Å
1098	V	91.2	Very high	88.5	Confident	11 Å²	11	29.9 Å²	29.9	7%	0.067	17%	0.173	C	C	.	.	H	α-helix	trans	-61.4	-36	176.6	171	0	0	0	0	110.8	V1094 S1095 V1100 L1101 E1102 V1180	V1094-V1098 HydrophobicContact CG1-CG2 4.12Å; V1094-V1098 WeakPolarHBondContact O-CB 3.42Å; V1094-V1098 VanDerWaalsContact O-CG2 3.26Å; V1094-V1098 WeakPolarHBondContact O-CG2 3.43Å; V1094-V1098 PolarHBondContact O-N 3.37Å; S1095-V1098 PolarHBondContact O-N 3.44Å; V1098-V1100 PolarHBondContact O-N 3.28Å; V1098-L1101 CarbonylContact O-C 3.5Å; V1098-L1101 WeakPolarHBondContact O-CA 3.37Å; V1098-L1101 WeakPolarHBondContact O-CB 3.38Å; V1098-L1101 PolarHBondContact O-N 3.28Å; V1098-E1102 HydrophobicContact CG1-CG 4.37Å; V1098-E1102 WeakPolarHBondContact O-CG 3.42Å; V1098-E1102 PolarHBondContact O-N 2.81Å; V1098-V1180 HydrophobicContact CG1-CB 4.31Å; V1098-V1180 HydrophobicContact CG1-CG2 3.59Å
1099	S	89.3	Confident	88.1	Confident	14 Å²	14	27.7 Å²	27.7	10%	0.098	17%	0.166	C	C	.	.	H	α-helix	trans	-64.4	-20.2	174.7	79.9	0	0	0	0	114.5	S1095 K1096 F1097 E1102 G1103	S1095-S1099 PolarHBondContact O-N 2.75Å; K1096-S1099 PolarHBondContact O-N 3.29Å; K1096-S1099 PolarHBondContact O-OG 2.9Å; F1097-S1099 VanDerWaalsContact C-N 3.26Å; F1097-S1099 PolarHBondContact O-N 3.17Å; S1099-E1102 WeakPolarHBondContact CA-OE2 3.23Å; S1099-G1103 PolarHBondContact O-N 3.13Å; S1099-G1103 VanDerWaalsContact O-N 3.11Å
1100	V	89.8	Confident	87.4	Confident	2 Å²	2	35 Å²	35	1%	0.012	19%	0.194	C	C	.	.	H	α-helix	trans	-75.9	-39.2	170.5	-178.7	0	0	0	0	110.7	T1038 L1040 K1096 F1097 V1098 G1103 V1104 F1148	T1038-V1100 HydrophobicContact CG2-CG1 3.9Å; L1040-V1100 HydrophobicContact CD2-CG2 3.89Å; K1096-V1100 PolarHBondContact O-N 2.96Å; F1097-V1100 WeakPolarHBondContact O-CB 3.22Å; F1097-V1100 PolarHBondContact O-N 2.8Å; V1098-V1100 PolarHBondContact O-N 3.28Å; V1100-G1103 CarbonylContact O-C 3.52Å; V1100-G1103 PolarHBondContact O-N 3.1Å; V1100-V1104 PolarHBondContact O-N 3.45Å; V1100-F1148 HydrophobicContact CB-CE1 3.91Å; V1100-F1148 HydrophobicContact CB-CE2 4.39Å; V1100-F1148 HydrophobicContact CB-CZ 3.81Å; V1100-F1148 HydrophobicContact CG1-CD1 4.01Å; V1100-F1148 HydrophobicContact CG1-CD2 4.36Å; V1100-F1148 HydrophobicContact CG1-CE1 3.84Å; V1100-F1148 HydrophobicContact CG1-CE2 4.22Å; V1100-F1148 HydrophobicContact CG1-CG 4.27Å; V1100-F1148 HydrophobicContact CG1-CZ 3.96Å; V1100-F1148 HydrophobicContact CG2-CE1 4.4Å; V1100-F1148 HydrophobicContact CG2-CE2 4.08Å; V1100-F1148 HydrophobicContact CG2-CZ 3.78Å
1101	L	89.3	Confident	86.4	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.8	-42.9	173.2	178.4	58.4	0	0	0	111.6	F1097 V1098 G1103 V1104 L1105 Y1145 I1181	F1097-L1101 PolarHBondContact O-N 2.81Å; V1098-L1101 CarbonylContact O-C 3.5Å; V1098-L1101 WeakPolarHBondContact O-CA 3.37Å; V1098-L1101 WeakPolarHBondContact O-CB 3.38Å; V1098-L1101 PolarHBondContact O-N 3.28Å; L1101-G1103 VanDerWaalsContact C-N 3.27Å; L1101-G1103 PolarHBondContact O-N 3.35Å; L1101-V1104 CarbonylContact O-C 3.58Å; L1101-V1104 WeakPolarHBondContact O-CA 3.38Å; L1101-V1104 WeakPolarHBondContact O-CB 2.97Å; L1101-V1104 PolarHBondContact O-N 3.17Å; L1101-L1105 HydrophobicContact CD1-CD1 4.2Å; L1101-L1105 HydrophobicContact CD1-CG 4.22Å; L1101-L1105 HydrophobicContact CG-CD1 3.97Å; L1101-L1105 HydrophobicContact CG-CG 4.45Å; L1101-L1105 WeakPolarHBondContact O-CB 3.14Å; L1101-L1105 WeakPolarHBondContact O-CG 3.49Å; L1101-L1105 PolarHBondContact O-N 3.18Å; L1101-Y1145 HydrophobicContact CB-CE2 3.75Å; L1101-Y1145 HydrophobicContact CD1-CE1 4.09Å; L1101-Y1145 HydrophobicContact CD1-CE2 4.01Å; L1101-Y1145 HydrophobicContact CG-CE2 4.42Å; L1101-I1181 HydrophobicContact CD1-CD1 4.46Å; L1101-I1181 HydrophobicContact CD1-CG1 4.44Å; L1101-I1181 HydrophobicContact CD2-CD1 4.18Å; L1101-I1181 HydrophobicContact CD2-CG1 4.11Å
1102	E	88.3	Confident	85.7	Confident	99 Å²	99	36 Å²	36	46%	0.463	19%	0.191	S	C	.	.	H	α-helix	trans	-57.1	-41.4	170.6	-67.8	172.4	163.1	0	0	111.2	V1098 S1099 V1104 L1105 S1106 V1180	V1098-E1102 HydrophobicContact CG1-CG 4.37Å; V1098-E1102 WeakPolarHBondContact O-CG 3.42Å; V1098-E1102 PolarHBondContact O-N 2.81Å; S1099-E1102 WeakPolarHBondContact CA-OE2 3.23Å; E1102-V1104 VanDerWaalsContact C-N 3.3Å; E1102-V1104 PolarHBondContact O-N 2.97Å; E1102-L1105 PolarHBondContact O-N 3.48Å; E1102-S1106 VanDerWaalsContact O-CB 3.23Å; E1102-S1106 WeakPolarHBondContact O-CB 3.07Å; E1102-S1106 PolarHBondContact O-N 2.9Å; E1102-V1180 HydrophobicContact CG-CG1 3.86Å
1103	G	86.1	Confident	84.4	Confident	29 Å²	29	38.6 Å²	38.6	30%	0.299	20%	0.201	S	C	.	.	H	α-helix	trans	-65.5	-26.7	173.8	0	0	0	0	0	114.6	S1099 V1100 L1101 K1107	S1099-G1103 PolarHBondContact O-N 3.13Å; S1099-G1103 VanDerWaalsContact O-N 3.11Å; V1100-G1103 CarbonylContact O-C 3.52Å; V1100-G1103 PolarHBondContact O-N 3.1Å; L1101-G1103 VanDerWaalsContact C-N 3.27Å; L1101-G1103 PolarHBondContact O-N 3.35Å; G1103-K1107 WeakPolarHBondContact O-CG 3.48Å
1104	V	85.1	Confident	82.9	Confident	1 Å²	1	42.6 Å²	42.6	1%	0.006	24%	0.243	C	C	.	.	H	α-helix	trans	-76.4	-47.1	170.8	161.9	0	0	0	0	110.7	T1038 V1100 L1101 E1102 S1106 K1107 L1108 L1141 Y1145 I1204	T1038-V1104 HydrophobicContact CG2-CG2 3.98Å; V1100-V1104 PolarHBondContact O-N 3.45Å; L1101-V1104 CarbonylContact O-C 3.58Å; L1101-V1104 WeakPolarHBondContact O-CA 3.38Å; L1101-V1104 WeakPolarHBondContact O-CB 2.97Å; L1101-V1104 PolarHBondContact O-N 3.17Å; E1102-V1104 VanDerWaalsContact C-N 3.3Å; E1102-V1104 PolarHBondContact O-N 2.97Å; V1104-S1106 VanDerWaalsContact C-N 3.31Å; V1104-S1106 PolarHBondContact O-N 3.49Å; V1104-K1107 WeakPolarHBondContact O-CB 3.28Å; V1104-K1107 PolarHBondContact O-N 3.14Å; V1104-L1108 HydrophobicContact CG1-CD1 4.19Å; V1104-L1108 PolarHBondContact O-N 3.41Å; V1104-L1141 HydrophobicContact CG1-CD2 4.04Å; V1104-L1141 HydrophobicContact CG1-CG 3.96Å; V1104-L1141 HydrophobicContact CG2-CD1 4.21Å; V1104-Y1145 HydrophobicContact CG2-CD2 4.05Å; V1104-Y1145 HydrophobicContact CG2-CG 4.49Å; V1104-I1204 HydrophobicContact CG1-CD1 3.99Å
1105	L	86	Confident	81.3	Confident	3 Å²	3	44.4 Å²	44.4	2%	0.016	25%	0.254	C	S	.	.	H	α-helix	trans	-64.5	-32.4	178.3	-69	169.5	0	0	0	112.6	L1101 E1102 K1107 L1108 S1109 V1180 I1181 W1184 L1201	L1101-L1105 HydrophobicContact CD1-CD1 4.2Å; L1101-L1105 HydrophobicContact CD1-CG 4.22Å; L1101-L1105 HydrophobicContact CG-CD1 3.97Å; L1101-L1105 HydrophobicContact CG-CG 4.45Å; L1101-L1105 WeakPolarHBondContact O-CB 3.14Å; L1101-L1105 WeakPolarHBondContact O-CG 3.49Å; L1101-L1105 PolarHBondContact O-N 3.18Å; E1102-L1105 PolarHBondContact O-N 3.48Å; L1105-K1107 VanDerWaalsContact C-N 3.34Å; L1105-L1108 HydrophobicContact CD2-CD1 4.25Å; L1105-L1108 PolarHBondContact O-N 3.05Å; L1105-S1109 PolarHBondContact O-N 3.31Å; L1105-V1180 HydrophobicContact CD1-CG1 3.68Å; L1105-I1181 HydrophobicContact CD1-CG1 4.34Å; L1105-W1184 HydrophobicContact CB-CG 4.16Å; L1105-W1184 HydrophobicContact CD1-CB 4.19Å; L1105-W1184 HydrophobicContact CD1-CG 4.28Å; L1105-W1184 HydrophobicContact CD2-CD2 3.97Å; L1105-W1184 HydrophobicContact CD2-CE3 4.4Å; L1105-W1184 HydrophobicContact CD2-CG 4.02Å; L1105-W1184 HydrophobicContact CG-CG 4.39Å; L1105-W1184 PolarHBondContact O-NE1 3.1Å; L1105-L1201 HydrophobicContact CD2-CD2 3.68Å
1106	S	84.3	Confident	79.4	Confident	73 Å²	73	49.2 Å²	49.2	51%	0.51	27%	0.266	S	S	.	.	H	α-helix	trans	-73	-21.9	172.4	-178.1	0	0	0	0	113.6	E1102 V1104 S1109	E1102-S1106 VanDerWaalsContact O-CB 3.23Å; E1102-S1106 WeakPolarHBondContact O-CB 3.07Å; E1102-S1106 PolarHBondContact O-N 2.9Å; V1104-S1106 VanDerWaalsContact C-N 3.31Å; V1104-S1106 PolarHBondContact O-N 3.49Å; S1106-S1109 PolarHBondContact O-OG 2.77Å
1107	K	82	Confident	77.6	Confident	86 Å²	86	54.3 Å²	54.3	37%	0.374	29%	0.288	S	S	.	.	H	α-helix	trans	-76.9	-35.5	165.7	-68.3	166.4	-174.4	178.5	0	110.7	G1103 V1104 L1105 R1110 L1141	G1103-K1107 WeakPolarHBondContact O-CG 3.48Å; V1104-K1107 WeakPolarHBondContact O-CB 3.28Å; V1104-K1107 PolarHBondContact O-N 3.14Å; L1105-K1107 VanDerWaalsContact C-N 3.34Å; K1107-R1110 WeakPolarHBondContact O-CB 3.48Å; K1107-R1110 WeakPolarHBondContact O-CG 3.38Å; K1107-R1110 PolarHBondContact O-N 3.26Å; K1107-L1141 HydrophobicContact CB-CD2 3.99Å; K1107-L1141 HydrophobicContact CD-CD1 3.98Å
1108	L	79.8	Confident	75.5	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-71.4	-33.4	178.3	-70.9	168.6	0	0	0	113.5	V1104 L1105 R1110 Y1111 L1141 W1184 Y1196 Q1197 T1200 L1201	V1104-L1108 HydrophobicContact CG1-CD1 4.19Å; V1104-L1108 PolarHBondContact O-N 3.41Å; L1105-L1108 HydrophobicContact CD2-CD1 4.25Å; L1105-L1108 PolarHBondContact O-N 3.05Å; L1108-R1110 PolarHBondContact O-N 3.22Å; L1108-R1110 VanDerWaalsContact O-N 3.07Å; L1108-Y1111 WeakPolarHBondContact O-CD2 3.28Å; L1108-Y1111 PolarHBondContact O-N 3.42Å; L1108-Y1111 VanDerWaalsContact O-N 3.11Å; L1108-L1141 HydrophobicContact CD1-CD2 4.46Å; L1108-L1141 HydrophobicContact CD2-CD2 3.98Å; L1108-L1141 HydrophobicContact CG-CD2 3.85Å; L1108-W1184 HydrophobicContact CB-CZ2 4.09Å; L1108-Y1196 HydrophobicContact CD2-CD1 4.36Å; L1108-Y1196 HydrophobicContact CD2-CE1 4.19Å; L1108-Q1197 PolarHBondContact O-NE2 3.45Å; L1108-T1200 HydrophobicContact CD1-CG2 4Å; L1108-T1200 HydrophobicContact CD2-CG2 4.03Å; L1108-L1201 HydrophobicContact CD1-CD2 4.27Å; L1108-L1201 HydrophobicContact CD1-CG 4.47Å
1109	S	79.7	Confident	73.5	Confident	31 Å²	31	59 Å²	59	22%	0.217	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-65.4	-9.5	175.8	62.3	0	0	0	0	114.1	L1105 S1106 Y1111 D1112 R1188	L1105-S1109 PolarHBondContact O-N 3.31Å; S1106-S1109 PolarHBondContact O-OG 2.77Å; S1109-Y1111 PolarHBondContact O-N 2.99Å; S1109-D1112 WeakPolarHBondContact CA-OD2 3.23Å; S1109-D1112 VanDerWaalsContact CB-OD2 3.26Å; S1109-D1112 WeakPolarHBondContact CB-OD2 3.23Å; S1109-D1112 WeakPolarHBondContact O-CB 3.34Å; S1109-D1112 VanDerWaalsContact O-CG 3.22Å; S1109-D1112 PolarHBondContact O-N 3.31Å; S1109-R1188 VanDerWaalsContact CB-NH2 3.34Å
1110	R	76.3	Confident	71.7	Confident	153 Å²	153	62.5 Å²	62.5	58%	0.577	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-69.6	-8.6	171.3	-58.5	179.4	-179.8	-160.1	-3.1	113.7	K1107 L1108 T1115	K1107-R1110 WeakPolarHBondContact O-CB 3.48Å; K1107-R1110 WeakPolarHBondContact O-CG 3.38Å; K1107-R1110 PolarHBondContact O-N 3.26Å; L1108-R1110 PolarHBondContact O-N 3.22Å; L1108-R1110 VanDerWaalsContact O-N 3.07Å; R1110-T1115 PolarHBondContact O-OG1 3.15Å
1111	Y	71.4	Confident	69.8	Low	65 Å²	65	65.2 Å²	65.2	26%	0.255	35%	0.352	S	S	.	.	G	3₁₀ helix	trans	-106	3.2	177.5	-60.3	-96.2	0	0	0	112.4	L1108 S1109 L1121 H1194 Y1196	L1108-Y1111 WeakPolarHBondContact O-CD2 3.28Å; L1108-Y1111 PolarHBondContact O-N 3.42Å; L1108-Y1111 VanDerWaalsContact O-N 3.11Å; S1109-Y1111 PolarHBondContact O-N 2.99Å; Y1111-L1121 HydrophobicContact CD1-CD1 4.18Å; Y1111-L1121 HydrophobicContact CE1-CD1 3.79Å; Y1111-H1194 AromaticContact CD1-CE1 3.79Å; Y1111-H1194 AromaticContact CD1-ND1 3.71Å; Y1111-Y1196 HydrophobicContact CD1-CD1 4.25Å; Y1111-Y1196 HydrophobicContact CD2-CD1 4.16Å; Y1111-Y1196 AromaticContact CE1-CD1 3.88Å; Y1111-Y1196 HydrophobicContact CE1-CD1 3.88Å; Y1111-Y1196 HydrophobicContact CE1-CE1 4.43Å; Y1111-Y1196 AromaticContact CE2-CD1 3.81Å; Y1111-Y1196 HydrophobicContact CE2-CD1 3.81Å; Y1111-Y1196 AromaticContact CE2-CE1 3.85Å; Y1111-Y1196 HydrophobicContact CE2-CE1 3.85Å; Y1111-Y1196 HydrophobicContact CG-CD1 4.39Å; Y1111-Y1196 AromaticContact CZ-CD1 3.65Å; Y1111-Y1196 AromaticContact CZ-CE1 3.77Å
1112	D	75.4	Confident	67.7	Low	20 Å²	20	70.3 Å²	70.3	11%	0.107	39%	0.388	C	S	.	.	S	Bend	trans	-62.4	147.4	176.8	-64.1	-22.1	0	0	0	110.9	S1109 T1115 S1118 R1188 Q1197	S1109-D1112 WeakPolarHBondContact CA-OD2 3.23Å; S1109-D1112 VanDerWaalsContact CB-OD2 3.26Å; S1109-D1112 WeakPolarHBondContact CB-OD2 3.23Å; S1109-D1112 WeakPolarHBondContact O-CB 3.34Å; S1109-D1112 VanDerWaalsContact O-CG 3.22Å; S1109-D1112 PolarHBondContact O-N 3.31Å; D1112-T1115 HydrophobicContact CB-CG2 4.01Å; D1112-T1115 WeakPolarHBondContact O-CB 3.31Å; D1112-T1115 WeakPolarHBondContact O-CG2 3.38Å; D1112-T1115 PolarHBondContact O-N 3.08Å; D1112-T1115 PolarHBondContact O-OG1 3.24Å; D1112-S1118 PolarHBondContact O-OG 3.34Å; D1112-R1188 IonicContact OD1-CZ 2.81Å; D1112-R1188 IonicContact OD1-NE 3.47Å; D1112-R1188 PolarHBondContact OD1-NE 3.19Å; D1112-R1188 IonicContact OD1-NH2 3.96Å; D1112-R1188 IonicContact OD2-CZ 3.8Å; D1112-R1188 IonicContact OD2-NE 3.27Å; D1112-R1188 PolarHBondContact OD2-NE 3.27Å; D1112-R1188 VanDerWaalsContact OD2-NE 3.1Å; D1112-R1188 IonicContact OD2-NH2 2.72Å; D1112-R1188 PolarHBondContact OD2-NH2 3.08Å; D1112-Q1197 PolarHBondContact OD1-NE2 2.91Å
1113	E	62.7	Low	65.4	Low	121 Å²	121	74.4 Å²	74.4	57%	0.565	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	145.6	177.4	-61.3	-162.1	120.3	0	0	111.7	T1115	E1113-T1115 PolarHBondContact O-N 3.11Å
1114	G	59.8	Low	63.5	Low	87 Å²	87	75.3 Å²	75.3	90%	0.897	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.6	-8	-174.7	0	0	0	0	0	115.6
1115	T	58.9	Low	61.6	Low	41 Å²	41	81.4 Å²	81.4	25%	0.252	44%	0.441	S	S	.	.	S	Bend	trans	-74	152.4	172.5	65.5	0	0	0	0	112.7	R1110 D1112 E1113 F1117 S1118	R1110-T1115 PolarHBondContact O-OG1 3.15Å; D1112-T1115 HydrophobicContact CB-CG2 4.01Å; D1112-T1115 WeakPolarHBondContact O-CB 3.31Å; D1112-T1115 WeakPolarHBondContact O-CG2 3.38Å; D1112-T1115 PolarHBondContact O-N 3.08Å; D1112-T1115 PolarHBondContact O-OG1 3.24Å; E1113-T1115 PolarHBondContact O-N 3.11Å; T1115-F1117 PolarHBondContact O-N 2.87Å; T1115-S1118 PolarHBondContact O-N 3.44Å; T1115-S1118 PolarHBondContact O-OG 3.05Å; T1115-S1118 VanDerWaalsContact O-OG 3.12Å; T1115-S1118 PolarHBondContact OG1-OG 2.87Å
1116	F	51.3	Low	59.5	Low	177 Å²	177	91.5 Å²	91.5	78%	0.776	49%	0.485	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.1	-15.9	178.9	-114.5	-80.5	0	0	0	114.4	I1120	F1116-I1120 WeakPolarHBondContact O-CD1 3.45Å; F1116-I1120 WeakPolarHBondContact O-CG1 3.3Å
1117	F	50.6	Low	57.4	Low	126 Å²	126	92.4 Å²	92.4	55%	0.553	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.8	-31.8	-177.8	-74	-80.4	0	0	0	113.7	T1115 S1119 I1120 L1121	T1115-F1117 PolarHBondContact O-N 2.87Å; F1117-S1119 PolarHBondContact O-N 3.29Å; F1117-I1120 PolarHBondContact O-N 3.19Å; F1117-L1121 HydrophobicContact CB-CD1 4.38Å; F1117-L1121 WeakPolarHBondContact O-CB 3.48Å; F1117-L1121 WeakPolarHBondContact O-CG 3.23Å; F1117-L1121 PolarHBondContact O-N 3.45Å
1118	S	48.3	Very low	55.5	Low	30 Å²	30	91.2 Å²	91.2	21%	0.21	50%	0.504	C	S	.	.	H	α-helix	trans	-63.4	-42.5	-179	55.4	0	0	0	0	112	D1112 T1115 I1120 S1122	D1112-S1118 PolarHBondContact O-OG 3.34Å; T1115-S1118 PolarHBondContact O-N 3.44Å; T1115-S1118 PolarHBondContact O-OG 3.05Å; T1115-S1118 VanDerWaalsContact O-OG 3.12Å; T1115-S1118 PolarHBondContact OG1-OG 2.87Å; S1118-I1120 PolarHBondContact O-N 2.86Å; S1118-S1122 PolarHBondContact O-N 3.5Å; S1118-S1122 VanDerWaalsContact O-N 3.15Å
1119	S	49.1	Very low	53.6	Low	82 Å²	82	96.3 Å²	96.3	57%	0.573	55%	0.546	S	S	*	.	H	α-helix	trans	-68.1	-28.6	176.7	47.4	0	0	0	0	114.5	F1117	F1117-S1119 PolarHBondContact O-N 3.29Å
1120	I	50.8	Low	51.9	Low	86 Å²	86	103.1 Å²	103.1	44%	0.441	57%	0.571	S	S	.	*	H	α-helix	trans	-80.6	-45.4	175.7	-63.8	177.6	0	0	0	110.6	F1116 F1117 S1118 S1122 F1123 T1124	F1116-I1120 WeakPolarHBondContact O-CD1 3.45Å; F1116-I1120 WeakPolarHBondContact O-CG1 3.3Å; F1117-I1120 PolarHBondContact O-N 3.19Å; S1118-I1120 PolarHBondContact O-N 2.86Å; I1120-S1122 VanDerWaalsContact C-N 3.34Å; I1120-S1122 PolarHBondContact O-N 3.11Å; I1120-F1123 PolarHBondContact O-N 2.82Å; I1120-F1123 VanDerWaalsContact O-N 3.12Å; I1120-T1124 HydrophobicContact CG2-CG2 4.48Å; I1120-T1124 PolarHBondContact O-N 2.84Å; I1120-T1124 VanDerWaalsContact O-N 3.14Å; I1120-T1124 PolarHBondContact O-OG1 3.42Å
1121	L	50.9	Low	50.4	Low	59 Å²	59	105.9 Å²	105.9	31%	0.309	58%	0.583	S	S	.	*	H	α-helix	trans	-66.9	-31.7	-176.7	-76.6	164.8	0	0	0	113.2	Y1111 F1117 F1123 V1125	Y1111-L1121 HydrophobicContact CD1-CD1 4.18Å; Y1111-L1121 HydrophobicContact CE1-CD1 3.79Å; F1117-L1121 HydrophobicContact CB-CD1 4.38Å; F1117-L1121 WeakPolarHBondContact O-CB 3.48Å; F1117-L1121 WeakPolarHBondContact O-CG 3.23Å; F1117-L1121 PolarHBondContact O-N 3.45Å; L1121-F1123 PolarHBondContact O-N 3.1Å; L1121-V1125 WeakPolarHBondContact O-CG2 3.44Å
1122	S	45.7	Very low	48.7	Very low	108 Å²	108	108.2 Å²	108.2	76%	0.755	60%	0.604	S	S	*	*	H	α-helix	trans	-59.5	-32.4	172.5	-176.9	0	0	0	0	112.9	S1118 I1120	S1118-S1122 PolarHBondContact O-N 3.5Å; S1118-S1122 VanDerWaalsContact O-N 3.15Å; I1120-S1122 VanDerWaalsContact C-N 3.34Å; I1120-S1122 PolarHBondContact O-N 3.11Å
1123	F	40	Very low	47	Very low	184 Å²	184	115.2 Å²	115.2	81%	0.807	64%	0.641	S	S	*	*	H	α-helix	trans	-105.4	-21.5	-169.5	-149.7	-98.8	0	0	0	115.5	I1120 L1121	I1120-F1123 PolarHBondContact O-N 2.82Å; I1120-F1123 VanDerWaalsContact O-N 3.12Å; L1121-F1123 PolarHBondContact O-N 3.1Å
1124	T	44.9	Very low	45.8	Very low	49 Å²	49	113.5 Å²	113.5	30%	0.301	64%	0.639	S	S	.	*	H	α-helix	trans	-113.7	10.2	-166.2	62.9	0	0	0	0	117.8	I1120 K1126 A1127 A1128	I1120-T1124 HydrophobicContact CG2-CG2 4.48Å; I1120-T1124 PolarHBondContact O-N 2.84Å; I1120-T1124 VanDerWaalsContact O-N 3.14Å; I1120-T1124 PolarHBondContact O-OG1 3.42Å; T1124-K1126 PolarHBondContact O-N 2.84Å; T1124-A1127 PolarHBondContact O-N 3.29Å; T1124-A1128 PolarHBondContact O-N 2.88Å
1125	V	44.8	Very low	44.8	Very low	128 Å²	128	114.9 Å²	114.9	78%	0.776	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.8	-19.2	-179.6	172.6	0	0	0	0	114.2	L1121	L1121-V1125 WeakPolarHBondContact O-CG2 3.44Å
1126	K	41.8	Very low	43.6	Very low	216 Å²	216	121.7 Å²	121.7	94%	0.939	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.4	2.5	179.6	-83.2	-177.5	175	174.4	0	116.6	T1124	T1124-K1126 PolarHBondContact O-N 2.84Å
1127	A	41.9	Very low	43	Very low	91 Å²	91	120.1 Å²	120.1	75%	0.752	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-136.9	-30.2	-172.1	0	0	0	0	0	117.2	T1124 A1129	T1124-A1127 PolarHBondContact O-N 3.29Å; A1127-A1129 PolarHBondContact O-N 2.94Å
1128	A	41.2	Very low	42.8	Very low	62 Å²	62	117.6 Å²	117.6	51%	0.512	68%	0.676	S	S	.	*			trans	-86	4.1	-162.5	0	0	0	0	0	116.7	T1124 K1130	T1124-A1128 PolarHBondContact O-N 2.88Å; A1128-K1130 PolarHBondContact O-N 3.34Å
1129	A	40.7	Very low	42.9	Very low	107 Å²	107	123.8 Å²	123.8	88%	0.884	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.1	35	-165.1	0	0	0	0	0	116.5	A1127	A1127-A1129 PolarHBondContact O-N 2.94Å
1130	K	42.6	Very low	43.9	Very low	173 Å²	173	122 Å²	122	75%	0.752	69%	0.687	S	S	*	*	T	Hydrogen-bonded Turn	trans	-141.8	-12	-173.9	-141.1	178.3	-176.7	-179.9	0	118.7	A1128	A1128-K1130 PolarHBondContact O-N 3.34Å
1131	Y	45.3	Very low	45.2	Very low	212 Å²	212	119 Å²	119	83%	0.831	67%	0.672	S	S	*	*	S	Bend	trans	-140	5.4	-172.7	-73.6	-66.2	0	0	0	117.1
1132	V	36.9	Very low	46.6	Very low	113 Å²	113	116.2 Å²	116.2	69%	0.685	66%	0.657	S	S	*	*	S	Bend	trans	-137.2	140.4	169.3	-178.6	0	0	0	0	107.9	V1134	V1132-V1134 HydrophobicContact CB-CG2 4.1Å; V1132-V1134 HydrophobicContact CG1-CG2 3.95Å; V1132-V1134 PolarHBondContact O-N 3.37Å
1133	D	39.3	Very low	48.3	Very low	167 Å²	167	114.4 Å²	114.4	89%	0.893	64%	0.639	S	S	*	*			trans	-78.3	63.5	-179.7	-154	6.7	0	0	0	111.1
1134	V	38	Very low	50.4	Low	86 Å²	86	108 Å²	108	52%	0.521	62%	0.615	S	S	.	*	P	Polyproline II helix	trans	-75.3	126.9	174.8	-179	0	0	0	0	108	V1132 K1136	V1132-V1134 HydrophobicContact CB-CG2 4.1Å; V1132-V1134 HydrophobicContact CG1-CG2 3.95Å; V1132-V1134 PolarHBondContact O-N 3.37Å; V1134-K1136 PolarHBondContact O-N 2.84Å
1135	P	36.9	Very low	52.4	Low	116 Å²	116	105.7 Å²	105.7	75%	0.753	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-52.3	126.1	178.7	-28.5	35.6	0	0	0	111.8
1136	K	33.9	Very low	54.5	Low	183 Å²	183	99.9 Å²	99.9	80%	0.796	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-57.8	135.2	-177.9	-66.1	176.1	-178.6	173	0	110.2	V1134 G1138	V1134-K1136 PolarHBondContact O-N 2.84Å; K1136-G1138 PolarHBondContact O-N 2.6Å
1137	P	39.3	Very low	56.7	Low	144 Å²	144	94.6 Å²	94.6	94%	0.935	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	100.1	167.1	27.6	-32.5	0	0	0	108.2
1138	G	45.6	Very low	59.1	Low	74 Å²	74	90.2 Å²	90.2	76%	0.763	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	164.9	-17	-166.8	0	0	0	0	0	115.5	K1136	K1136-G1138 PolarHBondContact O-N 2.6Å
1139	M	52.1	Low	61.4	Low	159 Å²	159	87.3 Å²	87.3	78%	0.783	49%	0.485	S	S	*	.			trans	-93.7	117.3	155.5	-68.8	-175	-165.6	0	0	108.8
1140	D	70.1	Confident	63.8	Low	44 Å²	44	86.9 Å²	86.9	24%	0.235	46%	0.461	C	S	.	.			trans	-80.5	120	167.5	-169.2	-14.7	0	0	0	109.3	A1142 D1143 T1144 K1203	D1140-A1142 PolarHBondContact O-N 3.05Å; D1140-A1142 VanDerWaalsContact OD1-CB 3.32Å; D1140-A1142 WeakPolarHBondContact OD1-CB 3.31Å; D1140-A1142 PolarHBondContact OD1-N 3.42Å; D1140-D1143 HydrophobicContact CB-CB 4.15Å; D1140-D1143 PolarHBondContact O-N 3.28Å; D1140-T1144 PolarHBondContact O-N 3.02Å; D1140-T1144 VanDerWaalsContact O-N 3.08Å; D1140-T1144 PolarHBondContact O-OG1 3.34Å; D1140-K1203 WeakPolarHBondContact OD2-CD 3.32Å; D1140-K1203 WeakPolarHBondContact OD2-CE 3.44Å; D1140-K1203 IonicContact OD2-NZ 2.72Å; D1140-K1203 PolarHBondContact OD2-NZ 2.75Å
1141	L	77.2	Confident	66.1	Low	24 Å²	24	82.2 Å²	82.2	13%	0.126	44%	0.442	C	S	.	.	H	α-helix	trans	-66.3	-28	178.5	-172.2	63.5	0	0	0	111.4	V1104 K1107 L1108 Y1145 T1200	V1104-L1141 HydrophobicContact CG1-CD2 4.04Å; V1104-L1141 HydrophobicContact CG1-CG 3.96Å; V1104-L1141 HydrophobicContact CG2-CD1 4.21Å; K1107-L1141 HydrophobicContact CB-CD2 3.99Å; K1107-L1141 HydrophobicContact CD-CD1 3.98Å; L1108-L1141 HydrophobicContact CD1-CD2 4.46Å; L1108-L1141 HydrophobicContact CD2-CD2 3.98Å; L1108-L1141 HydrophobicContact CG-CD2 3.85Å; L1141-Y1145 PolarHBondContact O-N 3.05Å; L1141-T1200 HydrophobicContact CB-CG2 4.21Å
1142	A	79.6	Confident	68.3	Low	0 Å²	0	72.1 Å²	72.1	0%	0	40%	0.402	C	S	.	.	H	α-helix	trans	-67.6	-52.1	172	0	0	0	0	0	111.3	D1140 T1144 Y1145 I1146 T1200 K1203 I1204	D1140-A1142 PolarHBondContact O-N 3.05Å; D1140-A1142 VanDerWaalsContact OD1-CB 3.32Å; D1140-A1142 WeakPolarHBondContact OD1-CB 3.31Å; D1140-A1142 PolarHBondContact OD1-N 3.42Å; A1142-T1144 VanDerWaalsContact C-N 3.26Å; A1142-T1144 PolarHBondContact O-N 3.31Å; A1142-Y1145 CarbonylContact O-C 3.6Å; A1142-Y1145 PolarHBondContact O-N 3.17Å; A1142-I1146 HydrophobicContact CB-CD1 4.27Å; A1142-I1146 WeakPolarHBondContact O-CD1 3.43Å; A1142-I1146 VanDerWaalsContact O-CG1 3.23Å; A1142-I1146 WeakPolarHBondContact O-CG1 3.13Å; A1142-I1146 PolarHBondContact O-N 3.32Å; A1142-T1200 HydrophobicContact CB-CG2 3.87Å; A1142-K1203 HydrophobicContact CB-CB 3.96Å; A1142-K1203 HydrophobicContact CB-CD 3.86Å; A1142-K1203 HydrophobicContact CB-CG 3.84Å; A1142-I1204 HydrophobicContact CB-CD1 4.39Å; A1142-I1204 HydrophobicContact CB-CG1 3.75Å
1143	D	82.1	Confident	70.9	Confident	71 Å²	71	66.9 Å²	66.9	38%	0.38	37%	0.37	S	S	.	.	H	α-helix	trans	-60.6	-39.3	-179.7	-72.1	-35.5	0	0	0	111.5	D1140 Y1145 I1146 M1147 K1203	D1140-D1143 HydrophobicContact CB-CB 4.15Å; D1140-D1143 PolarHBondContact O-N 3.28Å; D1143-Y1145 VanDerWaalsContact C-N 3.29Å; D1143-Y1145 PolarHBondContact O-N 2.92Å; D1143-I1146 PolarHBondContact O-N 2.69Å; D1143-M1147 WeakPolarHBondContact O-CB 3.5Å; D1143-M1147 WeakPolarHBondContact O-CG 3.3Å; D1143-M1147 PolarHBondContact O-N 2.75Å; D1143-K1203 WeakPolarHBondContact OD1-CE 3.3Å; D1143-K1203 IonicContact OD1-NZ 2.7Å; D1143-K1203 PolarHBondContact OD1-NZ 3.4Å; D1143-K1203 IonicContact OD2-NZ 2.69Å; D1143-K1203 PolarHBondContact OD2-NZ 3.06Å
1144	T	84.4	Confident	73.3	Confident	48 Å²	48	62.9 Å²	62.9	29%	0.294	35%	0.349	S	S	.	.	H	α-helix	trans	-62.5	-36.6	176.9	-45.6	0	0	0	0	111.7	T1038 D1140 A1142 F1148	T1038-T1144 HydrophobicContact CG2-CG2 4.27Å; T1038-T1144 WeakPolarHBondContact OG1-CG2 3.36Å; D1140-T1144 PolarHBondContact O-N 3.02Å; D1140-T1144 VanDerWaalsContact O-N 3.08Å; D1140-T1144 PolarHBondContact O-OG1 3.34Å; A1142-T1144 VanDerWaalsContact C-N 3.26Å; A1142-T1144 PolarHBondContact O-N 3.31Å; T1144-F1148 PolarHBondContact O-N 3.36Å
1145	Y	87.8	Confident	75.8	Confident	1 Å²	1	60.4 Å²	60.4	0%	0.004	33%	0.332	C	S	.	.	H	α-helix	trans	-75.8	-38.4	174.1	-178.6	-99.6	0	0	0	113	T1038 L1101 V1104 L1141 A1142 D1143 F1148 V1149 I1204	T1038-Y1145 HydrophobicContact CG2-CD2 4.47Å; L1101-Y1145 HydrophobicContact CB-CE2 3.75Å; L1101-Y1145 HydrophobicContact CD1-CE1 4.09Å; L1101-Y1145 HydrophobicContact CD1-CE2 4.01Å; L1101-Y1145 HydrophobicContact CG-CE2 4.42Å; V1104-Y1145 HydrophobicContact CG2-CD2 4.05Å; V1104-Y1145 HydrophobicContact CG2-CG 4.49Å; L1141-Y1145 PolarHBondContact O-N 3.05Å; A1142-Y1145 CarbonylContact O-C 3.6Å; A1142-Y1145 PolarHBondContact O-N 3.17Å; D1143-Y1145 VanDerWaalsContact C-N 3.29Å; D1143-Y1145 PolarHBondContact O-N 2.92Å; Y1145-F1148 AromaticContact CD2-CD1 3.77Å; Y1145-F1148 HydrophobicContact CD2-CD1 3.77Å; Y1145-F1148 HydrophobicContact CD2-CE1 4.32Å; Y1145-F1148 AromaticContact CE2-CD1 3.64Å; Y1145-F1148 HydrophobicContact CE2-CD1 3.64Å; Y1145-F1148 AromaticContact CE2-CE1 3.76Å; Y1145-F1148 HydrophobicContact CE2-CE1 3.76Å; Y1145-F1148 VanDerWaalsContact O-CB 3.29Å; Y1145-F1148 WeakPolarHBondContact O-CB 3.18Å; Y1145-F1148 PolarHBondContact O-N 3.28Å; Y1145-V1149 HydrophobicContact CD1-CG2 4.11Å; Y1145-V1149 HydrophobicContact CE1-CG2 3.54Å; Y1145-V1149 HydrophobicContact CE2-CG2 4.33Å; Y1145-V1149 WeakPolarHBondContact O-CG2 3.37Å; Y1145-V1149 PolarHBondContact O-N 2.85Å; Y1145-I1204 HydrophobicContact CD1-CD1 4.25Å; Y1145-I1204 HydrophobicContact CD1-CG1 4.16Å; Y1145-I1204 HydrophobicContact CD1-CG2 3.93Å; Y1145-I1204 HydrophobicContact CE1-CG2 4Å
1146	I	88.3	Confident	78.3	Confident	7 Å²	7	55.1 Å²	55.1	4%	0.036	30%	0.298	C	S	.	.	H	α-helix	trans	-66.6	-40.9	178.3	-67.1	156.4	0	0	0	110.7	A1142 D1143 F1148 V1149 R1150 K1203 K1207	A1142-I1146 HydrophobicContact CB-CD1 4.27Å; A1142-I1146 WeakPolarHBondContact O-CD1 3.43Å; A1142-I1146 VanDerWaalsContact O-CG1 3.23Å; A1142-I1146 WeakPolarHBondContact O-CG1 3.13Å; A1142-I1146 PolarHBondContact O-N 3.32Å; D1143-I1146 PolarHBondContact O-N 2.69Å; I1146-F1148 VanDerWaalsContact C-N 3.3Å; I1146-F1148 PolarHBondContact O-N 2.93Å; I1146-V1149 PolarHBondContact O-N 3.27Å; I1146-R1150 WeakPolarHBondContact O-CG 3.46Å; I1146-R1150 PolarHBondContact O-N 2.86Å; I1146-K1203 HydrophobicContact CD1-CG 4.15Å; I1146-K1207 HydrophobicContact CD1-CB 3.6Å; I1146-K1207 HydrophobicContact CD1-CG 3.79Å; I1146-K1207 HydrophobicContact CG1-CB 3.91Å; I1146-K1207 HydrophobicContact CG2-CB 4.29Å
1147	M	87.9	Confident	80.9	Confident	104 Å²	104	51 Å²	51	51%	0.512	28%	0.277	S	S	.	.	H	α-helix	trans	-63.5	-35.3	171.7	-72.8	-176.7	69.1	0	0	112.4	D1143 Q1151	D1143-M1147 WeakPolarHBondContact O-CB 3.5Å; D1143-M1147 WeakPolarHBondContact O-CG 3.3Å; D1143-M1147 PolarHBondContact O-N 2.75Å; M1147-Q1151 WeakPolarHBondContact O-CB 3.45Å; M1147-Q1151 WeakPolarHBondContact O-CG 3.32Å; M1147-Q1151 PolarHBondContact O-N 3.46Å; M1147-Q1151 VanDerWaalsContact O-N 3.1Å
1148	F	92.1	Very high	83.2	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.7	-46	172.5	157.5	-101	0	0	0	112.1	T1038 L1040 F1097 V1100 T1144 Y1145 I1146 N1152 W1173	T1038-F1148 HydrophobicContact CG2-CB 4.36Å; T1038-F1148 WeakPolarHBondContact O-CB 3.44Å; L1040-F1148 HydrophobicContact CB-CD2 4.38Å; L1040-F1148 HydrophobicContact CB-CE2 3.93Å; L1040-F1148 HydrophobicContact CD2-CE2 4.07Å; L1040-F1148 HydrophobicContact CG-CE2 4.16Å; L1040-F1148 WeakPolarHBondContact O-CD2 3.44Å; F1097-F1148 HydrophobicContact CB-CZ 4.31Å; F1097-F1148 HydrophobicContact CD1-CE2 4.27Å; F1097-F1148 AromaticContact CD1-CZ 3.74Å; F1097-F1148 HydrophobicContact CD1-CZ 3.74Å; F1097-F1148 HydrophobicContact CE1-CZ 4.41Å; F1097-F1148 HydrophobicContact CG-CZ 4.38Å; V1100-F1148 HydrophobicContact CB-CE1 3.91Å; V1100-F1148 HydrophobicContact CB-CE2 4.39Å; V1100-F1148 HydrophobicContact CB-CZ 3.81Å; V1100-F1148 HydrophobicContact CG1-CD1 4.01Å; V1100-F1148 HydrophobicContact CG1-CD2 4.36Å; V1100-F1148 HydrophobicContact CG1-CE1 3.84Å; V1100-F1148 HydrophobicContact CG1-CE2 4.22Å; V1100-F1148 HydrophobicContact CG1-CG 4.27Å; V1100-F1148 HydrophobicContact CG1-CZ 3.96Å; V1100-F1148 HydrophobicContact CG2-CE1 4.4Å; V1100-F1148 HydrophobicContact CG2-CE2 4.08Å; V1100-F1148 HydrophobicContact CG2-CZ 3.78Å; T1144-F1148 PolarHBondContact O-N 3.36Å; Y1145-F1148 AromaticContact CD2-CD1 3.77Å; Y1145-F1148 HydrophobicContact CD2-CD1 3.77Å; Y1145-F1148 HydrophobicContact CD2-CE1 4.32Å; Y1145-F1148 AromaticContact CE2-CD1 3.64Å; Y1145-F1148 HydrophobicContact CE2-CD1 3.64Å; Y1145-F1148 AromaticContact CE2-CE1 3.76Å; Y1145-F1148 HydrophobicContact CE2-CE1 3.76Å; Y1145-F1148 VanDerWaalsContact O-CB 3.29Å; Y1145-F1148 WeakPolarHBondContact O-CB 3.18Å; Y1145-F1148 PolarHBondContact O-N 3.28Å; I1146-F1148 VanDerWaalsContact C-N 3.3Å; I1146-F1148 PolarHBondContact O-N 2.93Å; F1148-N1152 VanDerWaalsContact CD2-ND2 3.34Å; F1148-N1152 WeakPolarHBondContact CD2-ND2 3.3Å; F1148-N1152 WeakPolarHBondContact CE2-ND2 3.37Å; F1148-N1152 PolarHBondContact O-N 3.22Å; F1148-N1152 PolarHBondContact O-ND2 2.74Å; F1148-W1173 HydrophobicContact CE1-CZ2 4.12Å; F1148-W1173 HydrophobicContact CZ-CZ2 4.42Å
1149	V	90.4	Very high	85.2	Confident	1 Å²	1	50.6 Å²	50.6	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-59	-58.2	177.2	168.5	0	0	0	0	110	Y1145 I1146 Q1151 N1152 Q1153 W1173 F1212	Y1145-V1149 HydrophobicContact CD1-CG2 4.11Å; Y1145-V1149 HydrophobicContact CE1-CG2 3.54Å; Y1145-V1149 HydrophobicContact CE2-CG2 4.33Å; Y1145-V1149 WeakPolarHBondContact O-CG2 3.37Å; Y1145-V1149 PolarHBondContact O-N 2.85Å; I1146-V1149 PolarHBondContact O-N 3.27Å; V1149-Q1151 PolarHBondContact O-N 3.03Å; V1149-N1152 PolarHBondContact O-N 3.23Å; V1149-Q1153 HydrophobicContact CG1-CG 4.31Å; V1149-Q1153 WeakPolarHBondContact O-CG 2.93Å; V1149-Q1153 PolarHBondContact O-N 2.95Å; V1149-W1173 HydrophobicContact CB-CH2 4.45Å; V1149-W1173 HydrophobicContact CB-CZ2 4.39Å; V1149-W1173 HydrophobicContact CG1-CH2 4.27Å; V1149-W1173 HydrophobicContact CG1-CZ2 4.39Å; V1149-W1173 HydrophobicContact CG2-CZ2 4.02Å; V1149-F1212 HydrophobicContact CG1-CD2 4.33Å; V1149-F1212 HydrophobicContact CG1-CE2 3.56Å; V1149-F1212 HydrophobicContact CG1-CZ 4.11Å
1150	R	90.6	Very high	86.9	Confident	98 Å²	98	43.7 Å²	43.7	37%	0.37	21%	0.208	S	C	.	.	H	α-helix	trans	-56.3	-54.6	-176.6	-68.7	172.5	-174.4	-160.8	-8.3	112.2	I1146 N1152 Q1153 D1154 D1211	I1146-R1150 WeakPolarHBondContact O-CG 3.46Å; I1146-R1150 PolarHBondContact O-N 2.86Å; R1150-N1152 PolarHBondContact O-N 2.93Å; R1150-Q1153 CarbonylContact O-C 3.55Å; R1150-Q1153 WeakPolarHBondContact O-CA 3.27Å; R1150-Q1153 WeakPolarHBondContact O-CB 3.38Å; R1150-Q1153 PolarHBondContact O-N 2.84Å; R1150-D1154 PolarHBondContact O-N 3.37Å; R1150-D1154 VanDerWaalsContact O-OD2 3.09Å; R1150-D1211 IonicContact CZ-OD1 2.71Å; R1150-D1211 IonicContact CZ-OD2 2.82Å; R1150-D1211 VanDerWaalsContact CZ-OD2 3.22Å; R1150-D1211 IonicContact NE-OD1 2.71Å; R1150-D1211 IonicContact NE-OD2 3.91Å; R1150-D1211 PolarHBondContact NE-OD2 2.93Å; R1150-D1211 IonicContact NH2-OD1 3.7Å; R1150-D1211 PolarHBondContact NH2-OD1 3Å; R1150-D1211 IonicContact NH2-OD2 3.81Å; R1150-D1211 PolarHBondContact NH2-OD2 2.8Å
1151	Q	90.3	Very high	87.5	Confident	75 Å²	75	45.1 Å²	45.1	35%	0.35	22%	0.216	S	C	.	.	H	α-helix	trans	-65.7	-18.5	-175.4	-67.8	-179.8	-2.3	0	0	113.8	M1147 V1149 I1155	M1147-Q1151 WeakPolarHBondContact O-CB 3.45Å; M1147-Q1151 WeakPolarHBondContact O-CG 3.32Å; M1147-Q1151 PolarHBondContact O-N 3.46Å; M1147-Q1151 VanDerWaalsContact O-N 3.1Å; V1149-Q1151 PolarHBondContact O-N 3.03Å; Q1151-I1155 WeakPolarHBondContact O-CD1 3.32Å; Q1151-I1155 WeakPolarHBondContact O-CG1 3.25Å; Q1151-I1155 PolarHBondContact O-N 2.88Å
1152	N	91.6	Very high	87.8	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-90	-30.8	169.9	-73.6	-80.7	0	0	0	112.9	L1040 R1041 I1042 F1097 F1148 V1149 R1150 L1156 W1173	L1040-N1152 PolarHBondContact O-ND2 2.83Å; R1041-N1152 WeakPolarHBondContact CA-OD1 3.34Å; I1042-N1152 PolarHBondContact N-OD1 3.13Å; F1097-N1152 HydrophobicContact CE1-CB 3.84Å; F1097-N1152 HydrophobicContact CZ-CB 3.84Å; F1148-N1152 VanDerWaalsContact CD2-ND2 3.34Å; F1148-N1152 WeakPolarHBondContact CD2-ND2 3.3Å; F1148-N1152 WeakPolarHBondContact CE2-ND2 3.37Å; F1148-N1152 PolarHBondContact O-N 3.22Å; F1148-N1152 PolarHBondContact O-ND2 2.74Å; V1149-N1152 PolarHBondContact O-N 3.23Å; R1150-N1152 PolarHBondContact O-N 2.93Å; N1152-L1156 WeakPolarHBondContact O-CB 3.28Å; N1152-L1156 WeakPolarHBondContact O-CD1 3.41Å; N1152-L1156 VanDerWaalsContact O-CG 3.29Å; N1152-L1156 WeakPolarHBondContact O-CG 3.49Å; N1152-L1156 PolarHBondContact O-N 3.29Å; N1152-L1156 VanDerWaalsContact O-N 3.08Å; N1152-W1173 HydrophobicContact CB-CH2 4.09Å
1153	Q	90.8	Very high	88	Confident	3 Å²	3	51.5 Å²	51.5	1%	0.014	25%	0.245	C	C	.	.	H	α-helix	trans	-61.5	-46.5	167.9	-69.5	171.5	-38.9	0	0	110.7	V1149 R1150 L1156 R1157 F1170 W1173 Q1215	V1149-Q1153 HydrophobicContact CG1-CG 4.31Å; V1149-Q1153 WeakPolarHBondContact O-CG 2.93Å; V1149-Q1153 PolarHBondContact O-N 2.95Å; R1150-Q1153 CarbonylContact O-C 3.55Å; R1150-Q1153 WeakPolarHBondContact O-CA 3.27Å; R1150-Q1153 WeakPolarHBondContact O-CB 3.38Å; R1150-Q1153 PolarHBondContact O-N 2.84Å; Q1153-L1156 PolarHBondContact O-N 2.8Å; Q1153-R1157 WeakPolarHBondContact O-CB 3.47Å; Q1153-R1157 PolarHBondContact O-N 3.22Å; Q1153-F1170 HydrophobicContact CB-CE1 4.19Å; Q1153-F1170 HydrophobicContact CB-CZ 3.83Å; Q1153-F1170 HydrophobicContact CG-CD1 4.46Å; Q1153-F1170 HydrophobicContact CG-CE1 3.87Å; Q1153-F1170 HydrophobicContact CG-CZ 3.93Å; Q1153-W1173 HydrophobicContact CG-CH2 4.24Å; Q1153-W1173 HydrophobicContact CG-CZ3 3.72Å; Q1153-Q1215 HydrophobicContact CB-CG 4.34Å; Q1153-Q1215 HydrophobicContact CG-CG 4.43Å
1154	D	90.1	Very high	88.3	Confident	83 Å²	83	53.1 Å²	53.1	44%	0.444	25%	0.252	S	S	.	.	H	α-helix	trans	-59.2	-50.4	178.3	-58	-32	0	0	0	111.1	R1150 L1156 R1157 E1158	R1150-D1154 PolarHBondContact O-N 3.37Å; R1150-D1154 VanDerWaalsContact O-OD2 3.09Å; D1154-L1156 VanDerWaalsContact C-N 3.3Å; D1154-L1156 PolarHBondContact O-N 2.87Å; D1154-R1157 PolarHBondContact O-N 2.8Å; D1154-E1158 VanDerWaalsContact O-CB 3.25Å; D1154-E1158 WeakPolarHBondContact O-CB 3.34Å; D1154-E1158 PolarHBondContact O-N 3.06Å
1155	I	90.1	Very high	88.4	Confident	34 Å²	34	51.9 Å²	51.9	17%	0.174	24%	0.242	C	C	.	.	H	α-helix	trans	-61.2	-36.4	177.8	-72.8	169.2	0	0	0	112.2	R1041 I1042 Q1151 K1159	R1041-I1155 HydrophobicContact CB-CD1 4.15Å; I1042-I1155 HydrophobicContact CB-CG2 4.22Å; I1042-I1155 HydrophobicContact CG2-CG2 4.44Å; Q1151-I1155 WeakPolarHBondContact O-CD1 3.32Å; Q1151-I1155 WeakPolarHBondContact O-CG1 3.25Å; Q1151-I1155 PolarHBondContact O-N 2.88Å; I1155-K1159 WeakPolarHBondContact O-CB 2.83Å; I1155-K1159 WeakPolarHBondContact O-CG 3.48Å; I1155-K1159 PolarHBondContact O-N 2.91Å
1156	L	90.1	Very high	88.4	Confident	5 Å²	5	52.3 Å²	52.3	3%	0.026	24%	0.244	C	C	.	.	H	α-helix	trans	-71.7	-44.3	177.4	-77.2	167.9	0	0	0	111.7	I1042 L1093 F1097 N1152 Q1153 D1154 E1158 K1159 V1160 L1169 F1170	I1042-L1156 HydrophobicContact CD1-CD1 3.9Å; I1042-L1156 HydrophobicContact CD1-CD2 3.89Å; I1042-L1156 HydrophobicContact CD1-CG 3.89Å; L1093-L1156 HydrophobicContact CD2-CD1 4.2Å; L1093-L1156 HydrophobicContact CD2-CD2 4.08Å; F1097-L1156 HydrophobicContact CE2-CD1 3.99Å; F1097-L1156 HydrophobicContact CZ-CD1 3.88Å; N1152-L1156 WeakPolarHBondContact O-CB 3.28Å; N1152-L1156 WeakPolarHBondContact O-CD1 3.41Å; N1152-L1156 VanDerWaalsContact O-CG 3.29Å; N1152-L1156 WeakPolarHBondContact O-CG 3.49Å; N1152-L1156 PolarHBondContact O-N 3.29Å; N1152-L1156 VanDerWaalsContact O-N 3.08Å; Q1153-L1156 PolarHBondContact O-N 2.8Å; D1154-L1156 VanDerWaalsContact C-N 3.3Å; D1154-L1156 PolarHBondContact O-N 2.87Å; L1156-E1158 VanDerWaalsContact C-N 3.33Å; L1156-E1158 PolarHBondContact O-N 2.83Å; L1156-K1159 PolarHBondContact O-N 2.83Å; L1156-V1160 HydrophobicContact CD2-CG2 3.99Å; L1156-V1160 WeakPolarHBondContact O-CB 3.41Å; L1156-V1160 PolarHBondContact O-N 3.29Å; L1156-L1169 HydrophobicContact CD1-CD2 3.83Å; L1156-F1170 HydrophobicContact CB-CE1 4.36Å; L1156-F1170 HydrophobicContact CB-CZ 4.34Å; L1156-F1170 HydrophobicContact CD1-CE1 4.03Å
1157	R	88.8	Confident	88.4	Confident	95 Å²	95	55.6 Å²	55.6	36%	0.358	26%	0.259	S	S	.	.	H	α-helix	trans	-71.8	-24.2	178.6	-173.3	173.7	-91.6	-76.2	4.5	113.3	Q1153 D1154 E1163 Q1215	Q1153-R1157 WeakPolarHBondContact O-CB 3.47Å; Q1153-R1157 PolarHBondContact O-N 3.22Å; D1154-R1157 PolarHBondContact O-N 2.8Å; R1157-E1163 IonicContact CZ-OE1 2.69Å; R1157-E1163 IonicContact NH1-OE1 3.64Å; R1157-E1163 PolarHBondContact NH1-OE1 3.31Å; R1157-E1163 IonicContact NH2-OE1 3.37Å; R1157-E1163 PolarHBondContact NH2-OE1 2.83Å; R1157-Q1215 VanDerWaalsContact CD-OE1 3.32Å; R1157-Q1215 PolarHBondContact NH2-O 2.83Å
1158	E	87.1	Confident	88.4	Confident	137 Å²	137	54.7 Å²	54.7	64%	0.64	25%	0.253	S	S	*	.	H	α-helix	trans	-76.9	-31.5	172.1	-174.3	-165.1	177.5	0	0	112.7	D1154 L1156	D1154-E1158 VanDerWaalsContact O-CB 3.25Å; D1154-E1158 WeakPolarHBondContact O-CB 3.34Å; D1154-E1158 PolarHBondContact O-N 3.06Å; L1156-E1158 VanDerWaalsContact C-N 3.33Å; L1156-E1158 PolarHBondContact O-N 2.83Å
1159	K	87.1	Confident	88.4	Confident	74 Å²	74	54.9 Å²	54.9	32%	0.322	25%	0.254	S	S	.	.	H	α-helix	trans	-127.1	0.5	-162.4	-52.4	-170.3	-170.1	-171.6	0	116.3	A1044 C1047 N1051 I1155 L1156	A1044-K1159 HydrophobicContact CB-CD 4.33Å; C1047-K1159 HydrophobicContact CB-CB 3.75Å; N1051-K1159 PolarHBondContact ND2-O 3.21Å; I1155-K1159 WeakPolarHBondContact O-CB 2.83Å; I1155-K1159 WeakPolarHBondContact O-CG 3.48Å; I1155-K1159 PolarHBondContact O-N 2.91Å; L1156-K1159 PolarHBondContact O-N 2.83Å
1160	V	87.5	Confident	88.5	Confident	13 Å²	13	54.9 Å²	54.9	8%	0.079	25%	0.253	C	S	.	.			trans	-105.1	128.6	170.9	175.8	0	0	0	0	109.2	C1047 F1050 N1051 L1156 E1162 I1166	C1047-V1160 HydrophobicContact CB-CG2 4.21Å; F1050-V1160 HydrophobicContact CD1-CG1 3.73Å; F1050-V1160 HydrophobicContact CD1-CG2 4.48Å; F1050-V1160 HydrophobicContact CE1-CG1 3.92Å; N1051-V1160 VanDerWaalsContact OD1-CA 3.28Å; N1051-V1160 WeakPolarHBondContact OD1-CA 3.49Å; L1156-V1160 HydrophobicContact CD2-CG2 3.99Å; L1156-V1160 WeakPolarHBondContact O-CB 3.41Å; L1156-V1160 PolarHBondContact O-N 3.29Å; V1160-E1162 PolarHBondContact O-N 3.14Å; V1160-I1166 HydrophobicContact CB-CD1 3.93Å; V1160-I1166 HydrophobicContact CB-CG1 3.92Å; V1160-I1166 HydrophobicContact CG1-CD1 4.16Å; V1160-I1166 HydrophobicContact CG1-CG1 3.83Å
1161	N	83.1	Confident	88.5	Confident	75 Å²	75	51.8 Å²	51.8	40%	0.401	24%	0.244	S	C	.	.	S	Bend	trans	-81.6	-8.9	-165.1	-68.9	9.2	0	0	0	114.8	N1051	N1051-N1161 PolarHBondContact ND2-OD1 3.16Å; N1051-N1161 VanDerWaalsContact ND2-OD1 3.11Å; N1051-N1161 PolarHBondContact OD1-N 3.27Å
1162	E	83.8	Confident	88.5	Confident	61 Å²	61	51.5 Å²	51.5	29%	0.285	24%	0.243	S	C	.	.			trans	-129.5	113.7	-175.4	-81.6	-63.8	157.3	0	0	112.2	V1054 K1058 V1160 M1164 Y1165 I1166	V1054-E1162 HydrophobicContact CG1-CB 3.86Å; V1054-E1162 HydrophobicContact CG1-CG 3.28Å; K1058-E1162 WeakPolarHBondContact CE-OE1 3.34Å; K1058-E1162 IonicContact NZ-OE1 2.77Å; K1058-E1162 PolarHBondContact NZ-OE1 2.75Å; V1160-E1162 PolarHBondContact O-N 3.14Å; E1162-M1164 VanDerWaalsContact C-N 3.34Å; E1162-M1164 PolarHBondContact O-N 3.46Å; E1162-Y1165 HydrophobicContact CB-CD2 3.73Å; E1162-Y1165 HydrophobicContact CB-CE2 4.33Å; E1162-Y1165 HydrophobicContact CG-CD2 4.49Å; E1162-Y1165 PolarHBondContact O-N 3.44Å; E1162-I1166 PolarHBondContact O-N 3.07Å
1163	E	84.2	Confident	88.6	Confident	96 Å²	96	51.5 Å²	51.5	45%	0.449	24%	0.243	S	C	.	.	H	α-helix	trans	-61.8	-38	-175.3	-174.5	152.9	-145.7	0	0	112.8	R1157 Y1165 I1166 E1167	R1157-E1163 IonicContact CZ-OE1 2.69Å; R1157-E1163 IonicContact NH1-OE1 3.64Å; R1157-E1163 PolarHBondContact NH1-OE1 3.31Å; R1157-E1163 IonicContact NH2-OE1 3.37Å; R1157-E1163 PolarHBondContact NH2-OE1 2.83Å; E1163-Y1165 PolarHBondContact O-N 2.83Å; E1163-I1166 WeakPolarHBondContact O-CA 3.42Å; E1163-I1166 WeakPolarHBondContact O-CB 3.44Å; E1163-I1166 PolarHBondContact O-N 2.97Å; E1163-E1167 HydrophobicContact CG-CG 4.2Å; E1163-E1167 WeakPolarHBondContact O-CG 3.26Å; E1163-E1167 PolarHBondContact O-N 2.76Å
1164	M	87.6	Confident	88.7	Confident	106 Å²	106	51.4 Å²	51.4	52%	0.522	24%	0.242	S	C	.	.	H	α-helix	trans	-59.3	-23.8	-180	-161.5	-137.1	-161.6	0	0	114.1	E1162 K1168	E1162-M1164 VanDerWaalsContact C-N 3.34Å; E1162-M1164 PolarHBondContact O-N 3.46Å; M1164-K1168 VanDerWaalsContact O-CD 3.25Å; M1164-K1168 WeakPolarHBondContact O-CD 3.44Å; M1164-K1168 WeakPolarHBondContact O-CE 3.34Å; M1164-K1168 VanDerWaalsContact O-CG 3.26Å; M1164-K1168 WeakPolarHBondContact O-CG 3.48Å; M1164-K1168 PolarHBondContact SD-NZ 3.41Å
1165	Y	86.7	Confident	88.8	Confident	22 Å²	22	49.7 Å²	49.7	9%	0.086	24%	0.237	C	C	.	.	H	α-helix	trans	-91.2	-27.8	174.3	-65.1	-70.3	0	0	0	112.6	F1050 V1054 K1057 V1086 I1090 E1162 E1163 K1168 L1169	F1050-Y1165 HydrophobicContact CE1-CG 4.23Å; F1050-Y1165 HydrophobicContact CZ-CG 4.48Å; V1054-Y1165 HydrophobicContact CG1-CE2 4.37Å; V1054-Y1165 HydrophobicContact CG2-CD2 3.82Å; V1054-Y1165 HydrophobicContact CG2-CE2 3.96Å; K1057-Y1165 WeakPolarHBondContact CD-OH 3.26Å; V1086-Y1165 HydrophobicContact CG1-CD1 3.66Å; V1086-Y1165 HydrophobicContact CG1-CE1 3.75Å; V1086-Y1165 HydrophobicContact CG1-CG 4.4Å; I1090-Y1165 HydrophobicContact CD1-CD1 4.37Å; E1162-Y1165 HydrophobicContact CB-CD2 3.73Å; E1162-Y1165 HydrophobicContact CB-CE2 4.33Å; E1162-Y1165 HydrophobicContact CG-CD2 4.49Å; E1162-Y1165 PolarHBondContact O-N 3.44Å; E1163-Y1165 PolarHBondContact O-N 2.83Å; Y1165-K1168 HydrophobicContact CD1-CD 4.44Å; Y1165-L1169 VanDerWaalsContact O-CB 3.28Å; Y1165-L1169 WeakPolarHBondContact O-CB 3.48Å; Y1165-L1169 PolarHBondContact O-N 3.18Å; Y1165-L1169 VanDerWaalsContact O-N 3.09Å
1166	I	88.4	Confident	88.9	Confident	9 Å²	9	49.7 Å²	49.7	5%	0.046	24%	0.24	C	C	.	.	H	α-helix	trans	-66.2	-47.1	172.2	-61.5	168.2	0	0	0	109.7	V1160 E1162 E1163 L1169 F1170	V1160-I1166 HydrophobicContact CB-CD1 3.93Å; V1160-I1166 HydrophobicContact CB-CG1 3.92Å; V1160-I1166 HydrophobicContact CG1-CD1 4.16Å; V1160-I1166 HydrophobicContact CG1-CG1 3.83Å; E1162-I1166 PolarHBondContact O-N 3.07Å; E1163-I1166 WeakPolarHBondContact O-CA 3.42Å; E1163-I1166 WeakPolarHBondContact O-CB 3.44Å; E1163-I1166 PolarHBondContact O-N 2.97Å; I1166-L1169 PolarHBondContact O-N 2.94Å; I1166-F1170 HydrophobicContact CG2-CD2 3.74Å; I1166-F1170 HydrophobicContact CG2-CE1 4.22Å; I1166-F1170 HydrophobicContact CG2-CE2 3.3Å; I1166-F1170 HydrophobicContact CG2-CG 4.38Å; I1166-F1170 HydrophobicContact CG2-CZ 3.57Å; I1166-F1170 WeakPolarHBondContact O-CG 3.39Å; I1166-F1170 PolarHBondContact O-N 3.26Å
1167	E	87.8	Confident	89	Confident	77 Å²	77	49.5 Å²	49.5	36%	0.36	24%	0.239	S	C	.	.	H	α-helix	trans	-54.5	-55	175.8	-70.1	175.9	150.3	0	0	111.5	E1163 L1169 F1170 D1171	E1163-E1167 HydrophobicContact CG-CG 4.2Å; E1163-E1167 WeakPolarHBondContact O-CG 3.26Å; E1163-E1167 PolarHBondContact O-N 2.76Å; E1167-L1169 VanDerWaalsContact C-N 3.26Å; E1167-L1169 PolarHBondContact O-N 3.17Å; E1167-F1170 PolarHBondContact O-N 2.97Å; E1167-F1170 VanDerWaalsContact O-N 3.1Å; E1167-D1171 PolarHBondContact O-N 3.36Å
1168	K	88.6	Confident	89.1	Confident	85 Å²	85	45 Å²	45	37%	0.37	22%	0.222	S	C	.	.	H	α-helix	trans	-56.2	-39.4	177.2	-71.7	169.2	-171.3	166.1	0	112.6	M1164 Y1165 Q1172	M1164-K1168 VanDerWaalsContact O-CD 3.25Å; M1164-K1168 WeakPolarHBondContact O-CD 3.44Å; M1164-K1168 WeakPolarHBondContact O-CE 3.34Å; M1164-K1168 VanDerWaalsContact O-CG 3.26Å; M1164-K1168 WeakPolarHBondContact O-CG 3.48Å; M1164-K1168 PolarHBondContact SD-NZ 3.41Å; Y1165-K1168 HydrophobicContact CD1-CD 4.44Å; K1168-Q1172 WeakPolarHBondContact O-CB 3.37Å; K1168-Q1172 PolarHBondContact O-N 3.11Å
1169	L	90.8	Very high	89.4	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-69.5	-39.6	178.9	-172.6	148.4	0	0	0	111.5	F1050 I1090 L1093 V1094 F1097 L1156 Y1165 I1166 E1167 W1173	F1050-L1169 HydrophobicContact CE2-CD1 4.43Å; I1090-L1169 HydrophobicContact CB-CD1 4.41Å; I1090-L1169 HydrophobicContact CG1-CB 4.5Å; I1090-L1169 HydrophobicContact CG1-CD1 4.18Å; I1090-L1169 HydrophobicContact CG2-CB 3.92Å; I1090-L1169 HydrophobicContact CG2-CD1 4.16Å; I1090-L1169 HydrophobicContact CG2-CG 3.98Å; L1093-L1169 HydrophobicContact CB-CD1 4.39Å; L1093-L1169 HydrophobicContact CD2-CD1 3.56Å; L1093-L1169 HydrophobicContact CD2-CD2 4.46Å; V1094-L1169 HydrophobicContact CG2-CG 4.35Å; F1097-L1169 HydrophobicContact CE2-CD2 4.24Å; L1156-L1169 HydrophobicContact CD1-CD2 3.83Å; Y1165-L1169 VanDerWaalsContact O-CB 3.28Å; Y1165-L1169 WeakPolarHBondContact O-CB 3.48Å; Y1165-L1169 PolarHBondContact O-N 3.18Å; Y1165-L1169 VanDerWaalsContact O-N 3.09Å; I1166-L1169 PolarHBondContact O-N 2.94Å; E1167-L1169 VanDerWaalsContact C-N 3.26Å; E1167-L1169 PolarHBondContact O-N 3.17Å; L1169-W1173 HydrophobicContact CD2-CE3 4.46Å; L1169-W1173 WeakPolarHBondContact O-CB 3.5Å; L1169-W1173 PolarHBondContact O-N 3.43Å
1170	F	93.1	Very high	89.6	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-70.6	-41.5	175.7	-68.9	-14.1	0	0	0	112.5	Q1153 L1156 I1166 E1167 Q1172 W1173 Y1174 F1212 Q1215 V1217	Q1153-F1170 HydrophobicContact CB-CE1 4.19Å; Q1153-F1170 HydrophobicContact CB-CZ 3.83Å; Q1153-F1170 HydrophobicContact CG-CD1 4.46Å; Q1153-F1170 HydrophobicContact CG-CE1 3.87Å; Q1153-F1170 HydrophobicContact CG-CZ 3.93Å; L1156-F1170 HydrophobicContact CB-CE1 4.36Å; L1156-F1170 HydrophobicContact CB-CZ 4.34Å; L1156-F1170 HydrophobicContact CD1-CE1 4.03Å; I1166-F1170 HydrophobicContact CG2-CD2 3.74Å; I1166-F1170 HydrophobicContact CG2-CE1 4.22Å; I1166-F1170 HydrophobicContact CG2-CE2 3.3Å; I1166-F1170 HydrophobicContact CG2-CG 4.38Å; I1166-F1170 HydrophobicContact CG2-CZ 3.57Å; I1166-F1170 WeakPolarHBondContact O-CG 3.39Å; I1166-F1170 PolarHBondContact O-N 3.26Å; E1167-F1170 PolarHBondContact O-N 2.97Å; E1167-F1170 VanDerWaalsContact O-N 3.1Å; F1170-Q1172 PolarHBondContact O-N 3.41Å; F1170-W1173 HydrophobicContact CD1-CE3 4.08Å; F1170-W1173 HydrophobicContact CD1-CZ3 4.49Å; F1170-W1173 HydrophobicContact CE1-CE3 4.35Å; F1170-W1173 HydrophobicContact CE1-CZ3 4.33Å; F1170-W1173 PolarHBondContact O-N 3.28Å; F1170-Y1174 WeakPolarHBondContact O-CB 3.38Å; F1170-Y1174 PolarHBondContact O-N 2.78Å; F1170-F1212 HydrophobicContact CB-CD1 4.01Å; F1170-F1212 HydrophobicContact CB-CE1 4.05Å; F1170-F1212 HydrophobicContact CD1-CE1 4.32Å; F1170-F1212 HydrophobicContact CG-CE1 4.34Å; F1170-Q1215 HydrophobicContact CD2-CB 3.73Å; F1170-Q1215 HydrophobicContact CE2-CB 3.82Å; F1170-Q1215 HydrophobicContact CE2-CG 4.19Å; F1170-V1217 HydrophobicContact CB-CG2 3.72Å
1171	D	90.2	Very high	89.7	Confident	33 Å²	33	42.3 Å²	42.3	18%	0.176	21%	0.21	C	C	.	.	H	α-helix	trans	-54.4	-50.6	170.4	-94.1	-27.4	0	0	0	110.9	E1167 S1175 V1217 T1221	E1167-D1171 PolarHBondContact O-N 3.36Å; D1171-S1175 VanDerWaalsContact O-CB 3.25Å; D1171-S1175 WeakPolarHBondContact O-CB 3.13Å; D1171-S1175 PolarHBondContact O-N 3.38Å; D1171-S1175 PolarHBondContact O-OG 3.5Å; D1171-V1217 WeakPolarHBondContact OD1-CG1 3.03Å; D1171-T1221 HydrophobicContact CB-CG2 4.26Å; D1171-T1221 VanDerWaalsContact OD1-CB 3.26Å; D1171-T1221 WeakPolarHBondContact OD1-CB 3.33Å; D1171-T1221 WeakPolarHBondContact OD1-CG2 3.22Å; D1171-T1221 PolarHBondContact OD1-OG1 3.15Å
1172	Q	91.8	Very high	90	Very high	70 Å²	70	39.6 Å²	39.6	33%	0.327	20%	0.197	S	C	.	.	H	α-helix	trans	-70.1	-37.3	-178.4	-169.4	-179.6	-17.8	0	0	112	V1094 K1168 F1170 S1176	V1094-Q1172 HydrophobicContact CG1-CG 4.25Å; V1094-Q1172 HydrophobicContact CG2-CB 4.18Å; V1094-Q1172 HydrophobicContact CG2-CG 4.19Å; K1168-Q1172 WeakPolarHBondContact O-CB 3.37Å; K1168-Q1172 PolarHBondContact O-N 3.11Å; F1170-Q1172 PolarHBondContact O-N 3.41Å; Q1172-S1176 VanDerWaalsContact O-CB 3.24Å; Q1172-S1176 WeakPolarHBondContact O-CB 3.19Å; Q1172-S1176 PolarHBondContact O-N 3.05Å; Q1172-S1176 PolarHBondContact O-OG 3.49Å
1173	W	93.4	Very high	90.3	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-65.5	-48.1	175.7	-174.9	8.3	0	0	0	111.6	V1094 F1097 F1148 V1149 N1152 Q1153 L1169 F1170 S1176 S1177 F1212	V1094-W1173 HydrophobicContact CG2-CB 4.07Å; F1097-W1173 HydrophobicContact CB-CD2 4.24Å; F1097-W1173 HydrophobicContact CB-CG 4.45Å; F1097-W1173 HydrophobicContact CB-CZ2 4Å; F1097-W1173 HydrophobicContact CD1-CH2 4.49Å; F1097-W1173 HydrophobicContact CD1-CZ2 4.27Å; F1097-W1173 AromaticContact CD2-CD2 3.33Å; F1097-W1173 HydrophobicContact CD2-CD2 3.33Å; F1097-W1173 AromaticContact CD2-CE2 3.46Å; F1097-W1173 VanDerWaalsContact CD2-CE2 3.46Å; F1097-W1173 AromaticContact CD2-CE3 3.53Å; F1097-W1173 HydrophobicContact CD2-CE3 3.53Å; F1097-W1173 AromaticContact CD2-CG 3.89Å; F1097-W1173 HydrophobicContact CD2-CG 3.89Å; F1097-W1173 AromaticContact CD2-CH2 3.96Å; F1097-W1173 HydrophobicContact CD2-CH2 3.96Å; F1097-W1173 AromaticContact CD2-CZ2 3.79Å; F1097-W1173 HydrophobicContact CD2-CZ2 3.79Å; F1097-W1173 AromaticContact CD2-CZ3 3.84Å; F1097-W1173 HydrophobicContact CD2-CZ3 3.84Å; F1097-W1173 AromaticContact CD2-NE1 3.98Å; F1097-W1173 HydrophobicContact CE1-CH2 4.34Å; F1097-W1173 AromaticContact CE2-CD2 3.77Å; F1097-W1173 HydrophobicContact CE2-CD2 3.77Å; F1097-W1173 AromaticContact CE2-CE3 3.41Å; F1097-W1173 HydrophobicContact CE2-CE3 3.41Å; F1097-W1173 VanDerWaalsContact CE2-CE3 3.41Å; F1097-W1173 AromaticContact CE2-CH2 3.8Å; F1097-W1173 HydrophobicContact CE2-CH2 3.8Å; F1097-W1173 HydrophobicContact CE2-CZ2 4.12Å; F1097-W1173 AromaticContact CE2-CZ3 3.42Å; F1097-W1173 HydrophobicContact CE2-CZ3 3.42Å; F1097-W1173 VanDerWaalsContact CE2-CZ3 3.42Å; F1097-W1173 HydrophobicContact CG-CD2 4.09Å; F1097-W1173 AromaticContact CG-CE2 3.71Å; F1097-W1173 HydrophobicContact CG-CH2 4.27Å; F1097-W1173 AromaticContact CG-CZ2 3.82Å; F1097-W1173 HydrophobicContact CG-CZ2 3.82Å; F1097-W1173 HydrophobicContact CZ-CE3 4.31Å; F1097-W1173 AromaticContact CZ-CH2 3.96Å; F1097-W1173 HydrophobicContact CZ-CH2 3.96Å; F1097-W1173 HydrophobicContact CZ-CZ2 4.46Å; F1097-W1173 AromaticContact CZ-CZ3 3.87Å; F1097-W1173 HydrophobicContact CZ-CZ3 3.87Å; F1148-W1173 HydrophobicContact CE1-CZ2 4.12Å; F1148-W1173 HydrophobicContact CZ-CZ2 4.42Å; V1149-W1173 HydrophobicContact CB-CH2 4.45Å; V1149-W1173 HydrophobicContact CB-CZ2 4.39Å; V1149-W1173 HydrophobicContact CG1-CH2 4.27Å; V1149-W1173 HydrophobicContact CG1-CZ2 4.39Å; V1149-W1173 HydrophobicContact CG2-CZ2 4.02Å; N1152-W1173 HydrophobicContact CB-CH2 4.09Å; Q1153-W1173 HydrophobicContact CG-CH2 4.24Å; Q1153-W1173 HydrophobicContact CG-CZ3 3.72Å; L1169-W1173 HydrophobicContact CD2-CE3 4.46Å; L1169-W1173 WeakPolarHBondContact O-CB 3.5Å; L1169-W1173 PolarHBondContact O-N 3.43Å; F1170-W1173 HydrophobicContact CD1-CE3 4.08Å; F1170-W1173 HydrophobicContact CD1-CZ3 4.49Å; F1170-W1173 HydrophobicContact CE1-CE3 4.35Å; F1170-W1173 HydrophobicContact CE1-CZ3 4.33Å; F1170-W1173 PolarHBondContact O-N 3.28Å; W1173-S1176 PolarHBondContact O-N 2.91Å; W1173-S1177 WeakPolarHBondContact O-CB 3.2Å; W1173-S1177 PolarHBondContact O-N 2.99Å; W1173-S1177 PolarHBondContact O-OG 2.84Å; W1173-F1212 HydrophobicContact CB-CE1 4.16Å; W1173-F1212 HydrophobicContact CB-CZ 4.28Å; W1173-F1212 HydrophobicContact CD2-CE1 4.01Å; W1173-F1212 AromaticContact CD2-CZ 3.5Å; W1173-F1212 HydrophobicContact CD2-CZ 3.5Å; W1173-F1212 AromaticContact CE2-CZ 3.9Å; W1173-F1212 AromaticContact CE3-CE1 3.86Å; W1173-F1212 HydrophobicContact CE3-CE1 3.86Å; W1173-F1212 AromaticContact CE3-CZ 3.63Å; W1173-F1212 HydrophobicContact CE3-CZ 3.63Å; W1173-F1212 HydrophobicContact CG-CE1 4.19Å; W1173-F1212 AromaticContact CG-CZ 3.83Å; W1173-F1212 HydrophobicContact CG-CZ 3.83Å; W1173-F1212 HydrophobicContact CH2-CZ 4.47Å; W1173-F1212 HydrophobicContact CZ2-CZ 4.38Å; W1173-F1212 HydrophobicContact CZ3-CZ 4.13Å
1174	Y	92.9	Very high	90.6	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.1	-51.9	176	177.5	-91.5	0	0	0	111.2	F1170 S1176 S1177 M1178 T1208 Y1209 F1212 V1217 T1221 L1222 Y1227	F1170-Y1174 WeakPolarHBondContact O-CB 3.38Å; F1170-Y1174 PolarHBondContact O-N 2.78Å; Y1174-S1176 VanDerWaalsContact C-N 3.32Å; Y1174-S1176 PolarHBondContact O-N 2.85Å; Y1174-S1177 WeakPolarHBondContact O-CB 3.42Å; Y1174-S1177 PolarHBondContact O-N 3.15Å; Y1174-S1177 VanDerWaalsContact O-N 3.15Å; Y1174-M1178 HydrophobicContact CD1-CG 4.35Å; Y1174-M1178 HydrophobicContact CD2-CE 4.23Å; Y1174-M1178 HydrophobicContact CD2-CG 4.49Å; Y1174-M1178 HydrophobicContact CE1-CG 3.83Å; Y1174-M1178 HydrophobicContact CE2-CE 3.46Å; Y1174-M1178 VanDerWaalsContact CE2-CE 3.46Å; Y1174-M1178 HydrophobicContact CE2-CG 4Å; Y1174-M1178 PolarHBondContact O-N 2.98Å; Y1174-T1208 HydrophobicContact CD2-CG2 4.14Å; Y1174-T1208 HydrophobicContact CE2-CG2 4.34Å; Y1174-Y1209 WeakPolarHBondContact OH-CD2 3.48Å; Y1174-F1212 HydrophobicContact CD2-CB 3.82Å; Y1174-F1212 AromaticContact CD2-CD2 3.99Å; Y1174-F1212 HydrophobicContact CD2-CD2 3.99Å; Y1174-F1212 AromaticContact CD2-CG 3.89Å; Y1174-F1212 HydrophobicContact CD2-CG 3.89Å; Y1174-F1212 HydrophobicContact CG-CB 4.42Å; Y1174-F1212 HydrophobicContact CG-CG 4.4Å; Y1174-V1217 HydrophobicContact CD1-CG1 4.48Å; Y1174-V1217 HydrophobicContact CG-CG1 4.44Å; Y1174-T1221 HydrophobicContact CD1-CG2 4.18Å; Y1174-T1221 WeakPolarHBondContact CE1-O 3.36Å; Y1174-L1222 HydrophobicContact CD2-CD2 4.25Å; Y1174-L1222 HydrophobicContact CE1-CD2 4.24Å; Y1174-L1222 WeakPolarHBondContact CE1-O 3.39Å; Y1174-L1222 HydrophobicContact CE2-CD2 3.95Å; Y1174-L1222 PolarHBondContact OH-O 2.86Å; Y1174-Y1227 VanDerWaalsContact OH-CD2 3.23Å; Y1174-Y1227 WeakPolarHBondContact OH-CD2 3.37Å
1175	S	91.3	Very high	90.5	Very high	47 Å²	47	32 Å²	32	33%	0.329	16%	0.164	S	C	.	.	H	α-helix	trans	-57.2	-44.1	-179.8	-62	0	0	0	0	112.4	D1171 K1179 T1221	D1171-S1175 VanDerWaalsContact O-CB 3.25Å; D1171-S1175 WeakPolarHBondContact O-CB 3.13Å; D1171-S1175 PolarHBondContact O-N 3.38Å; D1171-S1175 PolarHBondContact O-OG 3.5Å; S1175-K1179 VanDerWaalsContact O-CB 3.32Å; S1175-K1179 WeakPolarHBondContact O-CB 3.33Å; S1175-K1179 PolarHBondContact O-N 3.41Å; S1175-T1221 VanDerWaalsContact OG-CG2 3.24Å; S1175-T1221 WeakPolarHBondContact OG-CG2 3.47Å
1176	S	92.4	Very high	90.4	Very high	35 Å²	35	34.2 Å²	34.2	25%	0.245	18%	0.18	C	C	.	.	H	α-helix	trans	-70.3	-36.8	179.4	-55	0	0	0	0	111.9	Q1172 W1173 Y1174 K1179 V1180	Q1172-S1176 VanDerWaalsContact O-CB 3.24Å; Q1172-S1176 WeakPolarHBondContact O-CB 3.19Å; Q1172-S1176 PolarHBondContact O-N 3.05Å; Q1172-S1176 PolarHBondContact O-OG 3.49Å; W1173-S1176 PolarHBondContact O-N 2.91Å; Y1174-S1176 VanDerWaalsContact C-N 3.32Å; Y1174-S1176 PolarHBondContact O-N 2.85Å; S1176-K1179 PolarHBondContact O-N 2.89Å; S1176-V1180 PolarHBondContact O-N 2.91Å
1177	S	91.4	Very high	90.2	Very high	1 Å²	1	39.3 Å²	39.3	1%	0.007	21%	0.207	C	C	.	.	H	α-helix	trans	-64	-48.4	176.1	-59.2	0	0	0	0	111.7	W1173 Y1174 K1179 V1180 I1181	W1173-S1177 WeakPolarHBondContact O-CB 3.2Å; W1173-S1177 PolarHBondContact O-N 2.99Å; W1173-S1177 PolarHBondContact O-OG 2.84Å; Y1174-S1177 WeakPolarHBondContact O-CB 3.42Å; Y1174-S1177 PolarHBondContact O-N 3.15Å; Y1174-S1177 VanDerWaalsContact O-N 3.15Å; S1177-K1179 VanDerWaalsContact C-N 3.32Å; S1177-K1179 PolarHBondContact O-N 2.72Å; S1177-V1180 PolarHBondContact O-N 3.33Å; S1177-I1181 WeakPolarHBondContact O-CG1 3.26Å; S1177-I1181 PolarHBondContact O-N 3.29Å
1178	M	92.6	Very high	90.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-66.2	-34.8	177.2	-67.1	-56.4	165.9	0	0	112	Y1174 I1181 C1182 V1205 T1208 T1226 Y1227	Y1174-M1178 HydrophobicContact CD1-CG 4.35Å; Y1174-M1178 HydrophobicContact CD2-CE 4.23Å; Y1174-M1178 HydrophobicContact CD2-CG 4.49Å; Y1174-M1178 HydrophobicContact CE1-CG 3.83Å; Y1174-M1178 HydrophobicContact CE2-CE 3.46Å; Y1174-M1178 VanDerWaalsContact CE2-CE 3.46Å; Y1174-M1178 HydrophobicContact CE2-CG 4Å; Y1174-M1178 PolarHBondContact O-N 2.98Å; M1178-I1181 PolarHBondContact O-N 3.23Å; M1178-I1181 HydrophobicContact SD-CD1 4.26Å; M1178-C1182 VanDerWaalsContact O-CB 3.23Å; M1178-C1182 WeakPolarHBondContact O-CB 3.47Å; M1178-C1182 PolarHBondContact O-N 2.93Å; M1178-V1205 HydrophobicContact CE-CG1 4.34Å; M1178-V1205 HydrophobicContact SD-CG1 4.45Å; M1178-V1205 HydrophobicContact SD-CG2 4.46Å; M1178-T1208 HydrophobicContact CE-CG2 3.81Å; M1178-T1226 HydrophobicContact CB-CG2 4.38Å; M1178-Y1227 HydrophobicContact CE-CD2 4.43Å; M1178-Y1227 HydrophobicContact SD-CD2 4.16Å
1179	K	91.9	Very high	89.6	Confident	135 Å²	135	37.8 Å²	37.8	59%	0.587	20%	0.203	S	C	*	.	H	α-helix	trans	-62.2	-44.1	172.5	-175.9	176.1	177.5	-177.8	0	112.4	S1175 S1176 S1177 C1182 V1183 T1226	S1175-K1179 VanDerWaalsContact O-CB 3.32Å; S1175-K1179 WeakPolarHBondContact O-CB 3.33Å; S1175-K1179 PolarHBondContact O-N 3.41Å; S1176-K1179 PolarHBondContact O-N 2.89Å; S1177-K1179 VanDerWaalsContact C-N 3.32Å; S1177-K1179 PolarHBondContact O-N 2.72Å; K1179-C1182 WeakPolarHBondContact O-CB 3.41Å; K1179-C1182 PolarHBondContact O-N 2.75Å; K1179-V1183 WeakPolarHBondContact O-CG2 3.47Å; K1179-V1183 PolarHBondContact O-N 2.97Å; K1179-T1226 HydrophobicContact CB-CG2 4.38Å
1180	V	91.8	Very high	88.9	Confident	31 Å²	31	45.4 Å²	45.4	19%	0.188	24%	0.244	C	C	.	.	H	α-helix	trans	-69	-38.3	178.6	166.6	0	0	0	0	112.1	V1098 E1102 L1105 S1176 S1177 C1182 V1183 W1184	V1098-V1180 HydrophobicContact CG1-CB 4.31Å; V1098-V1180 HydrophobicContact CG1-CG2 3.59Å; E1102-V1180 HydrophobicContact CG-CG1 3.86Å; L1105-V1180 HydrophobicContact CD1-CG1 3.68Å; S1176-V1180 PolarHBondContact O-N 2.91Å; S1177-V1180 PolarHBondContact O-N 3.33Å; V1180-C1182 VanDerWaalsContact C-N 3.34Å; V1180-V1183 PolarHBondContact O-N 2.8Å; V1180-W1184 WeakPolarHBondContact O-CB 3.39Å; V1180-W1184 PolarHBondContact O-N 2.86Å
1181	I	89.2	Confident	88.1	Confident	1 Å²	1	48.5 Å²	48.5	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-62.6	-42.4	171.6	-66.2	165.1	0	0	0	110.7	L1101 L1105 S1177 M1178 W1184 L1185 L1201 I1204 V1205 V1230	L1101-I1181 HydrophobicContact CD1-CD1 4.46Å; L1101-I1181 HydrophobicContact CD1-CG1 4.44Å; L1101-I1181 HydrophobicContact CD2-CD1 4.18Å; L1101-I1181 HydrophobicContact CD2-CG1 4.11Å; L1105-I1181 HydrophobicContact CD1-CG1 4.34Å; S1177-I1181 WeakPolarHBondContact O-CG1 3.26Å; S1177-I1181 PolarHBondContact O-N 3.29Å; M1178-I1181 PolarHBondContact O-N 3.23Å; M1178-I1181 HydrophobicContact SD-CD1 4.26Å; I1181-W1184 PolarHBondContact O-N 3.02Å; I1181-L1185 HydrophobicContact CG2-CD1 4Å; I1181-L1185 WeakPolarHBondContact O-CB 3.38Å; I1181-L1185 WeakPolarHBondContact O-CG 3Å; I1181-L1185 PolarHBondContact O-N 2.68Å; I1181-L1201 HydrophobicContact CG2-CD2 4.48Å; I1181-I1204 HydrophobicContact CD1-CG2 4.25Å; I1181-V1205 HydrophobicContact CD1-CG2 4.1Å; I1181-V1205 HydrophobicContact CG2-CG2 4.28Å; I1181-V1230 HydrophobicContact CG2-CG1 3.77Å; I1181-V1230 HydrophobicContact CG2-CG2 4.14Å
1182	C	89.8	Confident	87.4	Confident	19 Å²	19	51 Å²	51	13%	0.128	27%	0.27	C	S	.	.	H	α-helix	trans	-62.4	-44.1	177.4	-166.3	0	0	0	0	112.4	M1178 K1179 V1180 L1185 T1186 T1226 V1230	M1178-C1182 VanDerWaalsContact O-CB 3.23Å; M1178-C1182 WeakPolarHBondContact O-CB 3.47Å; M1178-C1182 PolarHBondContact O-N 2.93Å; K1179-C1182 WeakPolarHBondContact O-CB 3.41Å; K1179-C1182 PolarHBondContact O-N 2.75Å; V1180-C1182 VanDerWaalsContact C-N 3.34Å; C1182-L1185 PolarHBondContact O-N 3.14Å; C1182-T1186 WeakPolarHBondContact O-CB 2.95Å; C1182-T1186 PolarHBondContact O-N 2.85Å; C1182-T1186 PolarHBondContact O-OG1 2.8Å; C1182-T1226 HydrophobicContact CB-CG2 3.63Å; C1182-V1230 HydrophobicContact CB-CG2 3.54Å
1183	V	90.4	Very high	86.8	Confident	72 Å²	72	48 Å²	48	44%	0.436	26%	0.257	S	S	.	.	H	α-helix	trans	-62.6	-48.2	174.4	171.4	0	0	0	0	110.8	K1179 V1180 L1185 T1186 D1187	K1179-V1183 WeakPolarHBondContact O-CG2 3.47Å; K1179-V1183 PolarHBondContact O-N 2.97Å; V1180-V1183 PolarHBondContact O-N 2.8Å; V1183-L1185 PolarHBondContact O-N 2.98Å; V1183-T1186 CarbonylContact O-C 3.6Å; V1183-T1186 WeakPolarHBondContact O-CA 3.36Å; V1183-T1186 WeakPolarHBondContact O-CB 3.36Å; V1183-T1186 PolarHBondContact O-N 3.19Å; V1183-D1187 VanDerWaalsContact O-CG 3.27Å; V1183-D1187 PolarHBondContact O-N 2.8Å
1184	W	89.8	Confident	86.1	Confident	21 Å²	21	52 Å²	52	8%	0.08	28%	0.275	C	S	.	.	H	α-helix	trans	-60.4	-32.9	179.7	-174.3	96	0	0	0	113.4	L1105 L1108 V1180 I1181 R1188 L1193 L1201	L1105-W1184 HydrophobicContact CB-CG 4.16Å; L1105-W1184 HydrophobicContact CD1-CB 4.19Å; L1105-W1184 HydrophobicContact CD1-CG 4.28Å; L1105-W1184 HydrophobicContact CD2-CD2 3.97Å; L1105-W1184 HydrophobicContact CD2-CE3 4.4Å; L1105-W1184 HydrophobicContact CD2-CG 4.02Å; L1105-W1184 HydrophobicContact CG-CG 4.39Å; L1105-W1184 PolarHBondContact O-NE1 3.1Å; L1108-W1184 HydrophobicContact CB-CZ2 4.09Å; V1180-W1184 WeakPolarHBondContact O-CB 3.39Å; V1180-W1184 PolarHBondContact O-N 2.86Å; I1181-W1184 PolarHBondContact O-N 3.02Å; W1184-R1188 VanDerWaalsContact CE2-CZ 3.43Å; W1184-R1188 VanDerWaalsContact CZ2-NE 3.31Å; W1184-R1188 WeakPolarHBondContact O-CD 3.3Å; W1184-R1188 PolarHBondContact O-NH1 2.88Å; W1184-L1193 HydrophobicContact CH2-CD2 4.28Å; W1184-L1193 HydrophobicContact CZ3-CD2 3.97Å; W1184-L1201 HydrophobicContact CE3-CD1 4.14Å; W1184-L1201 HydrophobicContact CH2-CD1 4.16Å; W1184-L1201 HydrophobicContact CZ3-CD1 3.52Å
1185	L	85.9	Confident	85.2	Confident	9 Å²	9	53.6 Å²	53.6	5%	0.047	28%	0.283	C	S	.	.	H	α-helix	trans	-75.5	-34.1	171.1	-72.1	171.4	0	0	0	112.6	I1181 C1182 V1183 R1188 L1189 L1193 L1201 V1230 L1234	I1181-L1185 HydrophobicContact CG2-CD1 4Å; I1181-L1185 WeakPolarHBondContact O-CB 3.38Å; I1181-L1185 WeakPolarHBondContact O-CG 3Å; I1181-L1185 PolarHBondContact O-N 2.68Å; C1182-L1185 PolarHBondContact O-N 3.14Å; V1183-L1185 PolarHBondContact O-N 2.98Å; L1185-R1188 CarbonylContact O-C 3.59Å; L1185-R1188 PolarHBondContact O-N 3.3Å; L1185-R1188 VanDerWaalsContact O-N 3.13Å; L1185-L1189 PolarHBondContact O-N 3.12Å; L1185-L1193 HydrophobicContact CD2-CD1 3.67Å; L1185-L1193 HydrophobicContact CD2-CD2 4.37Å; L1185-L1201 HydrophobicContact CD2-CD1 4.22Å; L1185-V1230 HydrophobicContact CD1-CB 4.4Å; L1185-V1230 HydrophobicContact CD1-CG1 3.98Å; L1185-V1230 HydrophobicContact CD1-CG2 4.27Å; L1185-L1234 HydrophobicContact CD1-CD2 4.37Å; L1185-L1234 HydrophobicContact CD1-CG 4.34Å; L1185-L1234 HydrophobicContact CD2-CD2 4.37Å
1186	T	85.4	Confident	84.4	Confident	70 Å²	70	55 Å²	55	43%	0.429	28%	0.282	S	S	.	.	H	α-helix	trans	-67.4	-39.7	177.3	-58.2	0	0	0	0	111.1	C1182 V1183 R1188 L1189	C1182-T1186 WeakPolarHBondContact O-CB 2.95Å; C1182-T1186 PolarHBondContact O-N 2.85Å; C1182-T1186 PolarHBondContact O-OG1 2.8Å; V1183-T1186 CarbonylContact O-C 3.6Å; V1183-T1186 WeakPolarHBondContact O-CA 3.36Å; V1183-T1186 WeakPolarHBondContact O-CB 3.36Å; V1183-T1186 PolarHBondContact O-N 3.19Å; T1186-R1188 PolarHBondContact O-N 3.38Å; T1186-L1189 HydrophobicContact CG2-CD1 3.98Å; T1186-L1189 VanDerWaalsContact O-CG 3.31Å; T1186-L1189 WeakPolarHBondContact O-CG 3.39Å; T1186-L1189 PolarHBondContact O-N 3.35Å
1187	D	84.4	Confident	83.8	Confident	116 Å²	116	53.5 Å²	53.5	62%	0.62	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-8.5	172.2	-60.7	-25.7	0	0	0	113.3	V1183	V1183-D1187 VanDerWaalsContact O-CG 3.27Å; V1183-D1187 PolarHBondContact O-N 2.8Å
1188	R	83.9	Confident	83.2	Confident	30 Å²	30	53.4 Å²	53.4	11%	0.113	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.4	20.1	-177.1	-69.4	170.3	-179.6	61.6	17.1	112.7	S1109 D1112 W1184 L1185 T1186 D1190 L1191 R1233	S1109-R1188 VanDerWaalsContact CB-NH2 3.34Å; D1112-R1188 IonicContact OD1-CZ 2.81Å; D1112-R1188 IonicContact OD1-NE 3.47Å; D1112-R1188 PolarHBondContact OD1-NE 3.19Å; D1112-R1188 IonicContact OD1-NH2 3.96Å; D1112-R1188 IonicContact OD2-CZ 3.8Å; D1112-R1188 IonicContact OD2-NE 3.27Å; D1112-R1188 PolarHBondContact OD2-NE 3.27Å; D1112-R1188 VanDerWaalsContact OD2-NE 3.1Å; D1112-R1188 IonicContact OD2-NH2 2.72Å; D1112-R1188 PolarHBondContact OD2-NH2 3.08Å; W1184-R1188 VanDerWaalsContact CE2-CZ 3.43Å; W1184-R1188 VanDerWaalsContact CZ2-NE 3.31Å; W1184-R1188 WeakPolarHBondContact O-CD 3.3Å; W1184-R1188 PolarHBondContact O-NH1 2.88Å; L1185-R1188 CarbonylContact O-C 3.59Å; L1185-R1188 PolarHBondContact O-N 3.3Å; L1185-R1188 VanDerWaalsContact O-N 3.13Å; T1186-R1188 PolarHBondContact O-N 3.38Å; R1188-D1190 PolarHBondContact O-N 2.98Å; R1188-D1190 VanDerWaalsContact O-N 3.14Å; R1188-L1191 HydrophobicContact CG-CD1 4.38Å; R1188-L1191 PolarHBondContact O-N 3.17Å; R1188-R1233 PolarHBondContact O-NH2 2.91Å
1189	L	78.8	Confident	82.6	Confident	99 Å²	99	56 Å²	56	52%	0.518	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-41.8	-178	-86	167.2	0	0	0	113.3	L1185 T1186 R1233	L1185-L1189 PolarHBondContact O-N 3.12Å; T1186-L1189 HydrophobicContact CG2-CD1 3.98Å; T1186-L1189 VanDerWaalsContact O-CG 3.31Å; T1186-L1189 WeakPolarHBondContact O-CG 3.39Å; T1186-L1189 PolarHBondContact O-N 3.35Å; L1189-R1233 PolarHBondContact O-NH1 2.82Å; L1189-R1233 PolarHBondContact O-NH2 2.8Å; L1189-R1233 VanDerWaalsContact O-NH2 3.15Å
1190	D	76.9	Confident	82	Confident	165 Å²	165	49.8 Å²	49.8	88%	0.882	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.2	4.8	-176.2	-55.3	-49.2	0	0	0	114.5	R1188	R1188-D1190 PolarHBondContact O-N 2.98Å; R1188-D1190 VanDerWaalsContact O-N 3.14Å
1191	L	76.2	Confident	81.7	Confident	64 Å²	64	48.3 Å²	48.3	34%	0.335	25%	0.246	S	C	.	.	S	Bend	trans	-112.9	145.4	178.7	-62.3	177.4	0	0	0	110.7	R1188 R1233	R1188-L1191 HydrophobicContact CG-CD1 4.38Å; R1188-L1191 PolarHBondContact O-N 3.17Å; L1191-R1233 PolarHBondContact O-NH2 2.88Å
1192	Q	75.4	Confident	81.5	Confident	86 Å²	86	48.3 Å²	48.3	40%	0.402	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-83.5	138.2	170.4	-172.1	172.5	-8.1	0	0	109.9
1193	L	78.9	Confident	81.2	Confident	7 Å²	7	49.4 Å²	49.4	4%	0.037	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-77.2	130.2	-179.1	-64.4	-179.7	0	0	0	111.6	W1184 L1185 L1198 L1201 L1234 E1237	W1184-L1193 HydrophobicContact CH2-CD2 4.28Å; W1184-L1193 HydrophobicContact CZ3-CD2 3.97Å; L1185-L1193 HydrophobicContact CD2-CD1 3.67Å; L1185-L1193 HydrophobicContact CD2-CD2 4.37Å; L1193-L1198 HydrophobicContact CB-CB 4.39Å; L1193-L1198 HydrophobicContact CD1-CD1 4.38Å; L1193-L1201 HydrophobicContact CD1-CD1 4.36Å; L1193-L1234 HydrophobicContact CD1-CD2 4.17Å; L1193-E1237 HydrophobicContact CD1-CB 4.44Å; L1193-E1237 HydrophobicContact CD1-CG 3.87Å; L1193-E1237 HydrophobicContact CG-CG 4.16Å; L1193-E1237 PolarHBondContact N-OE2 3.37Å
1194	H	77.9	Confident	81.1	Confident	83 Å²	83	46 Å²	46	38%	0.384	23%	0.228	S	C	.	.	P	Polyproline II helix	trans	-63.4	140	173.4	174.9	-104.2	0	0	0	110.4	Y1111 Y1196 Q1197 L1198	Y1111-H1194 AromaticContact CD1-CE1 3.79Å; Y1111-H1194 AromaticContact CD1-ND1 3.71Å; H1194-Y1196 PolarHBondContact ND1-N 3.35Å; H1194-Y1196 PolarHBondContact O-N 3.05Å; H1194-Q1197 HydrophobicContact CB-CG 4.16Å; H1194-Q1197 WeakPolarHBondContact O-CA 3.38Å; H1194-Q1197 VanDerWaalsContact O-CB 3.3Å; H1194-Q1197 WeakPolarHBondContact O-CB 3.45Å; H1194-Q1197 PolarHBondContact O-N 3.14Å; H1194-L1198 PolarHBondContact O-N 3.02Å
1195	I	74.9	Confident	81	Confident	35 Å²	35	45 Å²	45	18%	0.179	22%	0.224	C	C	.	.	H	α-helix	trans	-53.4	-34.4	-170.9	-60.8	175.1	0	0	0	113	K1199 E1245	I1195-K1199 HydrophobicContact CG2-CD 4.47Å; I1195-K1199 WeakPolarHBondContact O-CB 3.41Å; I1195-K1199 WeakPolarHBondContact O-CG 3.46Å; I1195-K1199 PolarHBondContact O-N 2.85Å; I1195-E1245 HydrophobicContact CD1-CB 4.33Å; I1195-E1245 HydrophobicContact CD1-CG 4.34Å; I1195-E1245 WeakPolarHBondContact CD1-OE2 3.43Å
1196	Y	74.9	Confident	81	Confident	77 Å²	77	46.3 Å²	46.3	30%	0.302	23%	0.23	S	C	.	.	H	α-helix	trans	-68.7	-38.6	174.3	-177.6	-110.2	0	0	0	113.2	L1108 Y1111 H1194 T1200	L1108-Y1196 HydrophobicContact CD2-CD1 4.36Å; L1108-Y1196 HydrophobicContact CD2-CE1 4.19Å; Y1111-Y1196 HydrophobicContact CD1-CD1 4.25Å; Y1111-Y1196 HydrophobicContact CD2-CD1 4.16Å; Y1111-Y1196 AromaticContact CE1-CD1 3.88Å; Y1111-Y1196 HydrophobicContact CE1-CD1 3.88Å; Y1111-Y1196 HydrophobicContact CE1-CE1 4.43Å; Y1111-Y1196 AromaticContact CE2-CD1 3.81Å; Y1111-Y1196 HydrophobicContact CE2-CD1 3.81Å; Y1111-Y1196 AromaticContact CE2-CE1 3.85Å; Y1111-Y1196 HydrophobicContact CE2-CE1 3.85Å; Y1111-Y1196 HydrophobicContact CG-CD1 4.39Å; Y1111-Y1196 AromaticContact CZ-CD1 3.65Å; Y1111-Y1196 AromaticContact CZ-CE1 3.77Å; H1194-Y1196 PolarHBondContact ND1-N 3.35Å; H1194-Y1196 PolarHBondContact O-N 3.05Å; Y1196-T1200 WeakPolarHBondContact O-CB 3.3Å; Y1196-T1200 PolarHBondContact O-N 2.58Å; Y1196-T1200 PolarHBondContact O-OG1 3.26Å
1197	Q	78.8	Confident	81.1	Confident	2 Å²	2	47.1 Å²	47.1	1%	0.009	23%	0.227	C	C	.	.	H	α-helix	trans	-63.5	-49.8	173.9	-58.5	173.4	-46	0	0	110	L1108 D1112 H1194 K1199 T1200 L1201	L1108-Q1197 PolarHBondContact O-NE2 3.45Å; D1112-Q1197 PolarHBondContact OD1-NE2 2.91Å; H1194-Q1197 HydrophobicContact CB-CG 4.16Å; H1194-Q1197 WeakPolarHBondContact O-CA 3.38Å; H1194-Q1197 VanDerWaalsContact O-CB 3.3Å; H1194-Q1197 WeakPolarHBondContact O-CB 3.45Å; H1194-Q1197 PolarHBondContact O-N 3.14Å; Q1197-K1199 PolarHBondContact O-N 3.4Å; Q1197-T1200 PolarHBondContact O-N 3.44Å; Q1197-L1201 WeakPolarHBondContact O-CB 3.36Å; Q1197-L1201 VanDerWaalsContact O-CG 3.29Å; Q1197-L1201 WeakPolarHBondContact O-CG 3.44Å; Q1197-L1201 PolarHBondContact O-N 2.76Å
1198	L	79.8	Confident	81.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57	-52.4	-179.9	-176.3	57	0	0	0	111.6	L1193 H1194 T1200 L1201 I1202 L1234 E1237 A1241	L1193-L1198 HydrophobicContact CB-CB 4.39Å; L1193-L1198 HydrophobicContact CD1-CD1 4.38Å; H1194-L1198 PolarHBondContact O-N 3.02Å; L1198-T1200 VanDerWaalsContact C-N 3.35Å; L1198-T1200 PolarHBondContact O-N 2.99Å; L1198-L1201 PolarHBondContact O-N 3.25Å; L1198-I1202 HydrophobicContact CD1-CD1 3.74Å; L1198-I1202 HydrophobicContact CD1-CG1 4.11Å; L1198-I1202 HydrophobicContact CG-CD1 3.85Å; L1198-I1202 WeakPolarHBondContact O-CB 3.45Å; L1198-I1202 VanDerWaalsContact O-CG1 3.22Å; L1198-I1202 WeakPolarHBondContact O-CG1 3.41Å; L1198-I1202 PolarHBondContact O-N 2.88Å; L1198-L1234 HydrophobicContact CD1-CD2 3.95Å; L1198-E1237 HydrophobicContact CD1-CB 3.61Å; L1198-E1237 HydrophobicContact CD2-CB 4.11Å; L1198-A1241 HydrophobicContact CD2-CB 3.86Å
1199	K	78.7	Confident	81.4	Confident	55 Å²	55	41.7 Å²	41.7	24%	0.239	20%	0.198	C	C	.	.	H	α-helix	trans	-56.8	-45	174.9	-77.6	-173.7	177.3	-171.1	0	113.1	I1195 Q1197 K1203 G1248 L1249 I1252	I1195-K1199 HydrophobicContact CG2-CD 4.47Å; I1195-K1199 WeakPolarHBondContact O-CB 3.41Å; I1195-K1199 WeakPolarHBondContact O-CG 3.46Å; I1195-K1199 PolarHBondContact O-N 2.85Å; Q1197-K1199 PolarHBondContact O-N 3.4Å; K1199-K1203 VanDerWaalsContact O-CB 3.26Å; K1199-K1203 WeakPolarHBondContact O-CB 3.4Å; K1199-K1203 PolarHBondContact O-N 3.05Å; K1199-G1248 WeakPolarHBondContact CE-O 3.45Å; K1199-G1248 PolarHBondContact NZ-O 3.25Å; K1199-L1249 HydrophobicContact CG-CD2 3.93Å; K1199-I1252 HydrophobicContact CB-CD1 4.23Å; K1199-I1252 HydrophobicContact CD-CD1 4.31Å; K1199-I1252 HydrophobicContact CG-CD1 4.29Å
1200	T	81.1	Confident	81.8	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-64.7	-43.3	-178.9	-52.7	0	0	0	0	110.7	L1108 L1141 A1142 Y1196 Q1197 L1198 K1203 I1204	L1108-T1200 HydrophobicContact CD1-CG2 4Å; L1108-T1200 HydrophobicContact CD2-CG2 4.03Å; L1141-T1200 HydrophobicContact CB-CG2 4.21Å; A1142-T1200 HydrophobicContact CB-CG2 3.87Å; Y1196-T1200 WeakPolarHBondContact O-CB 3.3Å; Y1196-T1200 PolarHBondContact O-N 2.58Å; Y1196-T1200 PolarHBondContact O-OG1 3.26Å; Q1197-T1200 PolarHBondContact O-N 3.44Å; L1198-T1200 VanDerWaalsContact C-N 3.35Å; L1198-T1200 PolarHBondContact O-N 2.99Å; T1200-K1203 PolarHBondContact O-N 2.98Å; T1200-I1204 HydrophobicContact CG2-CD1 3.93Å; T1200-I1204 WeakPolarHBondContact O-CB 3.44Å; T1200-I1204 VanDerWaalsContact O-CG1 3.28Å; T1200-I1204 WeakPolarHBondContact O-CG1 3.16Å; T1200-I1204 PolarHBondContact O-N 3.01Å
1201	L	85.5	Confident	82.3	Confident	0 Å²	0	34.6 Å²	34.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-69.7	-45.2	-179.7	-70	168.5	0	0	0	112.5	L1105 L1108 I1181 W1184 L1185 L1193 Q1197 L1198 K1203 I1204 V1205 L1234	L1105-L1201 HydrophobicContact CD2-CD2 3.68Å; L1108-L1201 HydrophobicContact CD1-CD2 4.27Å; L1108-L1201 HydrophobicContact CD1-CG 4.47Å; I1181-L1201 HydrophobicContact CG2-CD2 4.48Å; W1184-L1201 HydrophobicContact CE3-CD1 4.14Å; W1184-L1201 HydrophobicContact CH2-CD1 4.16Å; W1184-L1201 HydrophobicContact CZ3-CD1 3.52Å; L1185-L1201 HydrophobicContact CD2-CD1 4.22Å; L1193-L1201 HydrophobicContact CD1-CD1 4.36Å; Q1197-L1201 WeakPolarHBondContact O-CB 3.36Å; Q1197-L1201 VanDerWaalsContact O-CG 3.29Å; Q1197-L1201 WeakPolarHBondContact O-CG 3.44Å; Q1197-L1201 PolarHBondContact O-N 2.76Å; L1198-L1201 PolarHBondContact O-N 3.25Å; L1201-K1203 VanDerWaalsContact C-N 3.28Å; L1201-K1203 PolarHBondContact O-N 3.18Å; L1201-I1204 PolarHBondContact O-N 3.36Å; L1201-V1205 WeakPolarHBondContact O-CB 3.35Å; L1201-V1205 VanDerWaalsContact O-CG2 3.3Å; L1201-V1205 WeakPolarHBondContact O-CG2 3.28Å; L1201-V1205 PolarHBondContact O-N 3.1Å; L1201-L1234 HydrophobicContact CB-CD1 4.37Å; L1201-L1234 HydrophobicContact CB-CD2 3.95Å; L1201-L1234 HydrophobicContact CD1-CD2 4.4Å
1202	I	83.6	Confident	83	Confident	1 Å²	1	31.5 Å²	31.5	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-55.8	-46.7	174	-67.2	172.4	0	0	0	110.1	L1198 V1205 K1206 L1234 E1238 I1252 M1254	L1198-I1202 HydrophobicContact CD1-CD1 3.74Å; L1198-I1202 HydrophobicContact CD1-CG1 4.11Å; L1198-I1202 HydrophobicContact CG-CD1 3.85Å; L1198-I1202 WeakPolarHBondContact O-CB 3.45Å; L1198-I1202 VanDerWaalsContact O-CG1 3.22Å; L1198-I1202 WeakPolarHBondContact O-CG1 3.41Å; L1198-I1202 PolarHBondContact O-N 2.88Å; I1202-V1205 PolarHBondContact O-N 3Å; I1202-K1206 HydrophobicContact CG2-CD 4.34Å; I1202-K1206 WeakPolarHBondContact O-CB 3.35Å; I1202-K1206 PolarHBondContact O-N 3.37Å; I1202-L1234 HydrophobicContact CG1-CB 4.36Å; I1202-E1238 HydrophobicContact CD1-CB 4.33Å; I1202-E1238 HydrophobicContact CD1-CG 4.46Å; I1202-I1252 HydrophobicContact CB-CG2 4Å; I1202-I1252 HydrophobicContact CG2-CG2 3.57Å; I1202-M1254 HydrophobicContact CB-SD 4.04Å; I1202-M1254 HydrophobicContact CD1-CG 4.05Å; I1202-M1254 HydrophobicContact CG1-CG 3.79Å; I1202-M1254 HydrophobicContact CG1-SD 3.74Å; I1202-M1254 HydrophobicContact CG2-CG 4.12Å; I1202-M1254 HydrophobicContact CG2-SD 3.77Å
1203	K	84.6	Confident	83.6	Confident	43 Å²	43	32.7 Å²	32.7	19%	0.187	14%	0.138	C	C	.	.	H	α-helix	trans	-66.7	-43.1	-179.7	-173.1	169.3	171.6	-176.8	0	112.5	D1140 A1142 D1143 I1146 K1199 T1200 L1201 K1207 I1252	D1140-K1203 WeakPolarHBondContact OD2-CD 3.32Å; D1140-K1203 WeakPolarHBondContact OD2-CE 3.44Å; D1140-K1203 IonicContact OD2-NZ 2.72Å; D1140-K1203 PolarHBondContact OD2-NZ 2.75Å; A1142-K1203 HydrophobicContact CB-CB 3.96Å; A1142-K1203 HydrophobicContact CB-CD 3.86Å; A1142-K1203 HydrophobicContact CB-CG 3.84Å; D1143-K1203 WeakPolarHBondContact OD1-CE 3.3Å; D1143-K1203 IonicContact OD1-NZ 2.7Å; D1143-K1203 PolarHBondContact OD1-NZ 3.4Å; D1143-K1203 IonicContact OD2-NZ 2.69Å; D1143-K1203 PolarHBondContact OD2-NZ 3.06Å; I1146-K1203 HydrophobicContact CD1-CG 4.15Å; K1199-K1203 VanDerWaalsContact O-CB 3.26Å; K1199-K1203 WeakPolarHBondContact O-CB 3.4Å; K1199-K1203 PolarHBondContact O-N 3.05Å; T1200-K1203 PolarHBondContact O-N 2.98Å; L1201-K1203 VanDerWaalsContact C-N 3.28Å; L1201-K1203 PolarHBondContact O-N 3.18Å; K1203-K1207 VanDerWaalsContact O-CB 3.3Å; K1203-K1207 WeakPolarHBondContact O-CB 3.24Å; K1203-K1207 WeakPolarHBondContact O-CG 3.36Å; K1203-K1207 PolarHBondContact O-N 2.99Å; K1203-K1207 VanDerWaalsContact O-N 3.15Å; K1203-I1252 HydrophobicContact CD-CD1 4.42Å
1204	I	87.3	Confident	83.9	Confident	0 Å²	0	38.5 Å²	38.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.2	-51.9	173.6	-73.2	172.5	0	0	0	110.3	V1104 A1142 Y1145 I1181 T1200 L1201 T1208	V1104-I1204 HydrophobicContact CG1-CD1 3.99Å; A1142-I1204 HydrophobicContact CB-CD1 4.39Å; A1142-I1204 HydrophobicContact CB-CG1 3.75Å; Y1145-I1204 HydrophobicContact CD1-CD1 4.25Å; Y1145-I1204 HydrophobicContact CD1-CG1 4.16Å; Y1145-I1204 HydrophobicContact CD1-CG2 3.93Å; Y1145-I1204 HydrophobicContact CE1-CG2 4Å; I1181-I1204 HydrophobicContact CD1-CG2 4.25Å; T1200-I1204 HydrophobicContact CG2-CD1 3.93Å; T1200-I1204 WeakPolarHBondContact O-CB 3.44Å; T1200-I1204 VanDerWaalsContact O-CG1 3.28Å; T1200-I1204 WeakPolarHBondContact O-CG1 3.16Å; T1200-I1204 PolarHBondContact O-N 3.01Å; L1201-I1204 PolarHBondContact O-N 3.36Å; I1204-T1208 WeakPolarHBondContact O-CB 3.49Å; I1204-T1208 PolarHBondContact O-N 3.43Å; I1204-T1208 PolarHBondContact O-OG1 2.93Å
1205	V	88.1	Confident	84.3	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.4	-51.9	-174.3	170.8	0	0	0	0	111.2	M1178 I1181 L1201 I1202 K1207 T1208 Y1209 Y1227 V1230 L1234	M1178-V1205 HydrophobicContact CE-CG1 4.34Å; M1178-V1205 HydrophobicContact SD-CG1 4.45Å; M1178-V1205 HydrophobicContact SD-CG2 4.46Å; I1181-V1205 HydrophobicContact CD1-CG2 4.1Å; I1181-V1205 HydrophobicContact CG2-CG2 4.28Å; L1201-V1205 WeakPolarHBondContact O-CB 3.35Å; L1201-V1205 VanDerWaalsContact O-CG2 3.3Å; L1201-V1205 WeakPolarHBondContact O-CG2 3.28Å; L1201-V1205 PolarHBondContact O-N 3.1Å; I1202-V1205 PolarHBondContact O-N 3Å; V1205-K1207 PolarHBondContact O-N 2.58Å; V1205-T1208 PolarHBondContact O-N 2.98Å; V1205-Y1209 WeakPolarHBondContact O-CB 3.47Å; V1205-Y1209 PolarHBondContact O-N 2.85Å; V1205-Y1227 HydrophobicContact CG1-CD2 4.27Å; V1205-Y1227 HydrophobicContact CG1-CE2 3.67Å; V1205-V1230 HydrophobicContact CG1-CG1 4.37Å; V1205-V1230 HydrophobicContact CG2-CG1 3.9Å; V1205-L1234 HydrophobicContact CB-CD1 4.33Å; V1205-L1234 HydrophobicContact CG2-CD1 3.94Å
1206	K	86.7	Confident	84.6	Confident	37 Å²	37	35.9 Å²	35.9	16%	0.161	17%	0.166	C	C	.	.	H	α-helix	trans	-65	-39.8	-179.5	-74.9	-174.1	61.7	174.7	0	113.6	I1202 R1210 T1253 M1254 K1255 D1256	I1202-K1206 HydrophobicContact CG2-CD 4.34Å; I1202-K1206 WeakPolarHBondContact O-CB 3.35Å; I1202-K1206 PolarHBondContact O-N 3.37Å; K1206-R1210 PolarHBondContact O-N 3.15Å; K1206-R1210 VanDerWaalsContact O-N 3.12Å; K1206-T1253 VanDerWaalsContact CD-O 3.25Å; K1206-T1253 WeakPolarHBondContact CD-O 3.49Å; K1206-T1253 PolarHBondContact NZ-O 3.32Å; K1206-M1254 HydrophobicContact CG-SD 4.45Å; K1206-K1255 PolarHBondContact NZ-O 2.69Å; K1206-D1256 IonicContact NZ-OD1 3.46Å
1207	K	86.9	Confident	85.1	Confident	87 Å²	87	32.5 Å²	32.5	38%	0.378	15%	0.153	S	C	.	.	H	α-helix	trans	-72.1	-40.2	177.2	-66.6	-65.4	-174	-173	0	111.5	I1146 K1203 V1205 Y1209 R1210 D1211	I1146-K1207 HydrophobicContact CD1-CB 3.6Å; I1146-K1207 HydrophobicContact CD1-CG 3.79Å; I1146-K1207 HydrophobicContact CG1-CB 3.91Å; I1146-K1207 HydrophobicContact CG2-CB 4.29Å; K1203-K1207 VanDerWaalsContact O-CB 3.3Å; K1203-K1207 WeakPolarHBondContact O-CB 3.24Å; K1203-K1207 WeakPolarHBondContact O-CG 3.36Å; K1203-K1207 PolarHBondContact O-N 2.99Å; K1203-K1207 VanDerWaalsContact O-N 3.15Å; V1205-K1207 PolarHBondContact O-N 2.58Å; K1207-Y1209 PolarHBondContact O-N 2.81Å; K1207-R1210 PolarHBondContact O-N 2.78Å; K1207-D1211 VanDerWaalsContact O-CB 3.24Å; K1207-D1211 WeakPolarHBondContact O-CB 3.29Å; K1207-D1211 PolarHBondContact O-N 3.02Å
1208	T	86.9	Confident	85.4	Confident	2 Å²	2	37.8 Å²	37.8	1%	0.012	18%	0.181	C	C	.	.	H	α-helix	trans	-60.2	-46.1	173.9	-56.3	0	0	0	0	111.1	Y1174 M1178 I1204 V1205 R1210 D1211 F1212	Y1174-T1208 HydrophobicContact CD2-CG2 4.14Å; Y1174-T1208 HydrophobicContact CE2-CG2 4.34Å; M1178-T1208 HydrophobicContact CE-CG2 3.81Å; I1204-T1208 WeakPolarHBondContact O-CB 3.49Å; I1204-T1208 PolarHBondContact O-N 3.43Å; I1204-T1208 PolarHBondContact O-OG1 2.93Å; V1205-T1208 PolarHBondContact O-N 2.98Å; T1208-R1210 PolarHBondContact O-N 2.85Å; T1208-D1211 PolarHBondContact O-N 2.81Å; T1208-F1212 HydrophobicContact CG2-CD2 3.56Å; T1208-F1212 HydrophobicContact CG2-CE2 3.69Å; T1208-F1212 WeakPolarHBondContact O-CB 3.46Å; T1208-F1212 WeakPolarHBondContact O-CD2 3.46Å; T1208-F1212 PolarHBondContact O-N 2.75Å
1209	Y	87.4	Confident	85.5	Confident	29 Å²	29	44.5 Å²	44.5	11%	0.114	21%	0.212	C	C	.	.	H	α-helix	trans	-55	-52.9	174.4	-178.2	-85.9	0	0	0	111.9	Y1174 V1205 K1207 D1211 R1213 L1222 N1223 Y1227	Y1174-Y1209 WeakPolarHBondContact OH-CD2 3.48Å; V1205-Y1209 WeakPolarHBondContact O-CB 3.47Å; V1205-Y1209 PolarHBondContact O-N 2.85Å; K1207-Y1209 PolarHBondContact O-N 2.81Å; Y1209-D1211 PolarHBondContact O-N 3.09Å; Y1209-R1213 VanDerWaalsContact O-CB 3.28Å; Y1209-R1213 WeakPolarHBondContact O-CB 3.26Å; Y1209-R1213 PolarHBondContact O-N 2.89Å; Y1209-L1222 HydrophobicContact CD2-CB 4.28Å; Y1209-L1222 HydrophobicContact CD2-CD2 4.42Å; Y1209-L1222 HydrophobicContact CE2-CB 3.71Å; Y1209-N1223 PolarHBondContact OH-ND2 2.76Å; Y1209-N1223 PolarHBondContact OH-OD1 2.82Å; Y1209-Y1227 HydrophobicContact CD2-CD1 4.46Å; Y1209-Y1227 HydrophobicContact CD2-CD2 4.24Å; Y1209-Y1227 AromaticContact CD2-CE1 3.86Å; Y1209-Y1227 HydrophobicContact CD2-CE1 3.86Å; Y1209-Y1227 AromaticContact CD2-CE2 3.61Å; Y1209-Y1227 HydrophobicContact CD2-CE2 3.61Å; Y1209-Y1227 AromaticContact CD2-CZ 3.39Å; Y1209-Y1227 HydrophobicContact CE2-CD1 4.36Å; Y1209-Y1227 AromaticContact CE2-CE1 3.78Å; Y1209-Y1227 HydrophobicContact CE2-CE1 3.78Å; Y1209-Y1227 HydrophobicContact CE2-CE2 4.37Å; Y1209-Y1227 AromaticContact CE2-CZ 3.79Å; Y1209-Y1227 HydrophobicContact CG-CE2 4.26Å
1210	R	86.9	Confident	85.6	Confident	104 Å²	104	45 Å²	45	39%	0.392	23%	0.233	S	C	.	.	H	α-helix	trans	-64.3	-40.5	-179.8	-177.5	165.6	174.6	151.6	-7.2	113	K1206 K1207 T1208 L1214 D1258	K1206-R1210 PolarHBondContact O-N 3.15Å; K1206-R1210 VanDerWaalsContact O-N 3.12Å; K1207-R1210 PolarHBondContact O-N 2.78Å; T1208-R1210 PolarHBondContact O-N 2.85Å; R1210-L1214 HydrophobicContact CG-CD1 4.26Å; R1210-L1214 VanDerWaalsContact O-CG 3.3Å; R1210-L1214 WeakPolarHBondContact O-CG 3.46Å; R1210-L1214 PolarHBondContact O-N 2.98Å; R1210-L1214 VanDerWaalsContact O-N 3.08Å; R1210-D1258 IonicContact CZ-OD2 2.7Å; R1210-D1258 IonicContact NH1-OD1 2.69Å; R1210-D1258 PolarHBondContact NH1-OD1 2.81Å; R1210-D1258 IonicContact NH1-OD2 2.88Å; R1210-D1258 PolarHBondContact NH1-OD2 2.67Å
1211	D	87.8	Confident	85.8	Confident	11 Å²	11	46 Å²	46	6%	0.059	24%	0.24	C	C	.	.	H	α-helix	trans	-74.1	-38.8	-175.7	-64.2	-19	0	0	0	111.7	R1150 K1207 T1208 Y1209 L1214 Q1215	R1150-D1211 IonicContact CZ-OD1 2.71Å; R1150-D1211 IonicContact CZ-OD2 2.82Å; R1150-D1211 VanDerWaalsContact CZ-OD2 3.22Å; R1150-D1211 IonicContact NE-OD1 2.71Å; R1150-D1211 IonicContact NE-OD2 3.91Å; R1150-D1211 PolarHBondContact NE-OD2 2.93Å; R1150-D1211 IonicContact NH2-OD1 3.7Å; R1150-D1211 PolarHBondContact NH2-OD1 3Å; R1150-D1211 IonicContact NH2-OD2 3.81Å; R1150-D1211 PolarHBondContact NH2-OD2 2.8Å; K1207-D1211 VanDerWaalsContact O-CB 3.24Å; K1207-D1211 WeakPolarHBondContact O-CB 3.29Å; K1207-D1211 PolarHBondContact O-N 3.02Å; T1208-D1211 PolarHBondContact O-N 2.81Å; Y1209-D1211 PolarHBondContact O-N 3.09Å; D1211-L1214 PolarHBondContact O-N 2.9Å; D1211-Q1215 VanDerWaalsContact O-CG 3.31Å; D1211-Q1215 WeakPolarHBondContact O-CG 3.39Å; D1211-Q1215 PolarHBondContact O-N 2.88Å
1212	F	90.9	Very high	85.8	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-72.1	-33.6	172.4	-82.2	-88.9	0	0	0	112.7	V1149 F1170 W1173 Y1174 T1208 L1214 Q1215 G1216 V1217 L1222	V1149-F1212 HydrophobicContact CG1-CD2 4.33Å; V1149-F1212 HydrophobicContact CG1-CE2 3.56Å; V1149-F1212 HydrophobicContact CG1-CZ 4.11Å; F1170-F1212 HydrophobicContact CB-CD1 4.01Å; F1170-F1212 HydrophobicContact CB-CE1 4.05Å; F1170-F1212 HydrophobicContact CD1-CE1 4.32Å; F1170-F1212 HydrophobicContact CG-CE1 4.34Å; W1173-F1212 HydrophobicContact CB-CE1 4.16Å; W1173-F1212 HydrophobicContact CB-CZ 4.28Å; W1173-F1212 HydrophobicContact CD2-CE1 4.01Å; W1173-F1212 AromaticContact CD2-CZ 3.5Å; W1173-F1212 HydrophobicContact CD2-CZ 3.5Å; W1173-F1212 AromaticContact CE2-CZ 3.9Å; W1173-F1212 AromaticContact CE3-CE1 3.86Å; W1173-F1212 HydrophobicContact CE3-CE1 3.86Å; W1173-F1212 AromaticContact CE3-CZ 3.63Å; W1173-F1212 HydrophobicContact CE3-CZ 3.63Å; W1173-F1212 HydrophobicContact CG-CE1 4.19Å; W1173-F1212 AromaticContact CG-CZ 3.83Å; W1173-F1212 HydrophobicContact CG-CZ 3.83Å; W1173-F1212 HydrophobicContact CH2-CZ 4.47Å; W1173-F1212 HydrophobicContact CZ2-CZ 4.38Å; W1173-F1212 HydrophobicContact CZ3-CZ 4.13Å; Y1174-F1212 HydrophobicContact CD2-CB 3.82Å; Y1174-F1212 AromaticContact CD2-CD2 3.99Å; Y1174-F1212 HydrophobicContact CD2-CD2 3.99Å; Y1174-F1212 AromaticContact CD2-CG 3.89Å; Y1174-F1212 HydrophobicContact CD2-CG 3.89Å; Y1174-F1212 HydrophobicContact CG-CB 4.42Å; Y1174-F1212 HydrophobicContact CG-CG 4.4Å; T1208-F1212 HydrophobicContact CG2-CD2 3.56Å; T1208-F1212 HydrophobicContact CG2-CE2 3.69Å; T1208-F1212 WeakPolarHBondContact O-CB 3.46Å; T1208-F1212 WeakPolarHBondContact O-CD2 3.46Å; T1208-F1212 PolarHBondContact O-N 2.75Å; F1212-L1214 VanDerWaalsContact C-N 3.3Å; F1212-L1214 PolarHBondContact O-N 3.02Å; F1212-Q1215 PolarHBondContact O-N 2.89Å; F1212-Q1215 VanDerWaalsContact O-N 3.07Å; F1212-G1216 PolarHBondContact O-N 3.43Å; F1212-V1217 HydrophobicContact CB-CB 4.27Å; F1212-V1217 HydrophobicContact CB-CG2 3.9Å; F1212-V1217 HydrophobicContact CD1-CG2 3.75Å; F1212-V1217 HydrophobicContact CG-CG2 4.32Å; F1212-V1217 WeakPolarHBondContact O-CB 3.3Å; F1212-V1217 PolarHBondContact O-N 2.82Å; F1212-L1222 HydrophobicContact CB-CD2 4.33Å
1213	R	87.1	Confident	85.9	Confident	110 Å²	110	49.5 Å²	49.5	42%	0.415	26%	0.258	S	S	.	.	H	α-helix	trans	-58.8	-40.9	170.4	-172.8	176.4	72.5	178.6	0.2	112	Y1209 Q1215 L1222	Y1209-R1213 VanDerWaalsContact O-CB 3.28Å; Y1209-R1213 WeakPolarHBondContact O-CB 3.26Å; Y1209-R1213 PolarHBondContact O-N 2.89Å; R1213-Q1215 PolarHBondContact O-N 2.62Å; R1213-L1222 HydrophobicContact CB-CD1 3.64Å; R1213-L1222 HydrophobicContact CB-CD2 4.48Å; R1213-L1222 HydrophobicContact CG-CD1 3.72Å
1214	L	86.9	Confident	86.1	Confident	130 Å²	130	48.7 Å²	48.7	68%	0.681	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-13.5	176.3	-72.2	168.9	0	0	0	113.9	R1210 D1211 F1212	R1210-L1214 HydrophobicContact CG-CD1 4.26Å; R1210-L1214 VanDerWaalsContact O-CG 3.3Å; R1210-L1214 WeakPolarHBondContact O-CG 3.46Å; R1210-L1214 PolarHBondContact O-N 2.98Å; R1210-L1214 VanDerWaalsContact O-N 3.08Å; D1211-L1214 PolarHBondContact O-N 2.9Å; F1212-L1214 VanDerWaalsContact C-N 3.3Å; F1212-L1214 PolarHBondContact O-N 3.02Å
1215	Q	84.9	Confident	86.1	Confident	24 Å²	24	57.4 Å²	57.4	11%	0.112	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-2.5	-179	-71.7	-73.1	-5.6	0	0	114.1	Q1153 R1157 F1170 D1211 F1212 R1213	Q1153-Q1215 HydrophobicContact CB-CG 4.34Å; Q1153-Q1215 HydrophobicContact CG-CG 4.43Å; R1157-Q1215 VanDerWaalsContact CD-OE1 3.32Å; R1157-Q1215 PolarHBondContact NH2-O 2.83Å; F1170-Q1215 HydrophobicContact CD2-CB 3.73Å; F1170-Q1215 HydrophobicContact CE2-CB 3.82Å; F1170-Q1215 HydrophobicContact CE2-CG 4.19Å; D1211-Q1215 VanDerWaalsContact O-CG 3.31Å; D1211-Q1215 WeakPolarHBondContact O-CG 3.39Å; D1211-Q1215 PolarHBondContact O-N 2.88Å; F1212-Q1215 PolarHBondContact O-N 2.89Å; F1212-Q1215 VanDerWaalsContact O-N 3.07Å; R1213-Q1215 PolarHBondContact O-N 2.62Å
1216	G	81.1	Confident	86.1	Confident	38 Å²	38	59.7 Å²	59.7	39%	0.392	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.2	3.3	175.3	0	0	0	0	0	116.2	F1212 L1218	F1212-G1216 PolarHBondContact O-N 3.43Å; G1216-L1218 PolarHBondContact O-N 2.9Å
1217	V	86.6	Confident	86.2	Confident	7 Å²	7	58.4 Å²	58.4	4%	0.042	30%	0.304	C	S	.	.			trans	-62	130	178.7	174.1	0	0	0	0	110.9	F1170 D1171 Y1174 F1212 T1221 L1222	F1170-V1217 HydrophobicContact CB-CG2 3.72Å; D1171-V1217 WeakPolarHBondContact OD1-CG1 3.03Å; Y1174-V1217 HydrophobicContact CD1-CG1 4.48Å; Y1174-V1217 HydrophobicContact CG-CG1 4.44Å; F1212-V1217 HydrophobicContact CB-CB 4.27Å; F1212-V1217 HydrophobicContact CB-CG2 3.9Å; F1212-V1217 HydrophobicContact CD1-CG2 3.75Å; F1212-V1217 HydrophobicContact CG-CG2 4.32Å; F1212-V1217 WeakPolarHBondContact O-CB 3.3Å; F1212-V1217 PolarHBondContact O-N 2.82Å; V1217-T1221 HydrophobicContact CG1-CG2 3.91Å; V1217-L1222 HydrophobicContact CB-CD2 4.09Å; V1217-L1222 HydrophobicContact CB-CG 4.34Å; V1217-L1222 HydrophobicContact CG1-CD2 3.69Å; V1217-L1222 HydrophobicContact CG1-CG 3.84Å; V1217-L1222 WeakPolarHBondContact O-CD1 3.34Å
1218	L	85.6	Confident	86.1	Confident	112 Å²	112	57 Å²	57	59%	0.586	30%	0.3	S	S	*	.			trans	-63	143.8	-173.5	-65.8	172.3	0	0	0	112.2	G1216 G1220 T1221 L1222	G1216-L1218 PolarHBondContact O-N 2.9Å; L1218-G1220 PolarHBondContact O-N 3.15Å; L1218-G1220 VanDerWaalsContact O-N 3.16Å; L1218-T1221 WeakPolarHBondContact O-CA 3.36Å; L1218-T1221 VanDerWaalsContact O-CB 3.32Å; L1218-T1221 WeakPolarHBondContact O-CB 3.25Å; L1218-T1221 PolarHBondContact O-N 2.92Å; L1218-L1222 PolarHBondContact O-N 3.36Å
1219	E	81.4	Confident	86.2	Confident	141 Å²	141	60.6 Å²	60.6	66%	0.659	32%	0.323	S	S	*	.	H	α-helix	trans	-58.9	-32.2	-179.7	-65.3	-164.2	139.6	0	0	113.5	T1221 L1222 N1223	E1219-T1221 VanDerWaalsContact C-N 3.3Å; E1219-T1221 PolarHBondContact O-N 2.9Å; E1219-L1222 PolarHBondContact O-N 3.29Å; E1219-N1223 WeakPolarHBondContact O-CB 3.25Å; E1219-N1223 PolarHBondContact O-N 3.36Å; E1219-N1223 PolarHBondContact O-ND2 2.92Å
1220	G	80.3	Confident	86.2	Confident	66 Å²	66	59.3 Å²	59.3	68%	0.68	32%	0.318	S	S	*	.	H	α-helix	trans	-70	-23.7	173.6	0	0	0	0	0	114.1	L1218	L1218-G1220 PolarHBondContact O-N 3.15Å; L1218-G1220 VanDerWaalsContact O-N 3.16Å
1221	T	85.3	Confident	86.2	Confident	25 Å²	25	56.9 Å²	56.9	15%	0.153	31%	0.311	C	S	.	.	H	α-helix	trans	-81	-45.8	171	-51	0	0	0	0	110.3	D1171 Y1174 S1175 V1217 L1218 E1219 S1224	D1171-T1221 HydrophobicContact CB-CG2 4.26Å; D1171-T1221 VanDerWaalsContact OD1-CB 3.26Å; D1171-T1221 WeakPolarHBondContact OD1-CB 3.33Å; D1171-T1221 WeakPolarHBondContact OD1-CG2 3.22Å; D1171-T1221 PolarHBondContact OD1-OG1 3.15Å; Y1174-T1221 HydrophobicContact CD1-CG2 4.18Å; Y1174-T1221 WeakPolarHBondContact CE1-O 3.36Å; S1175-T1221 VanDerWaalsContact OG-CG2 3.24Å; S1175-T1221 WeakPolarHBondContact OG-CG2 3.47Å; V1217-T1221 HydrophobicContact CG1-CG2 3.91Å; L1218-T1221 WeakPolarHBondContact O-CA 3.36Å; L1218-T1221 VanDerWaalsContact O-CB 3.32Å; L1218-T1221 WeakPolarHBondContact O-CB 3.25Å; L1218-T1221 PolarHBondContact O-N 2.92Å; E1219-T1221 VanDerWaalsContact C-N 3.3Å; E1219-T1221 PolarHBondContact O-N 2.9Å; T1221-S1224 WeakPolarHBondContact O-CB 3.42Å; T1221-S1224 PolarHBondContact O-N 3.01Å
1222	L	85.8	Confident	86.1	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-56.7	-55.6	177.4	-68.9	174.4	0	0	0	111.4	Y1174 Y1209 F1212 R1213 V1217 L1218 E1219 S1224 Y1227	Y1174-L1222 HydrophobicContact CD2-CD2 4.25Å; Y1174-L1222 HydrophobicContact CE1-CD2 4.24Å; Y1174-L1222 WeakPolarHBondContact CE1-O 3.39Å; Y1174-L1222 HydrophobicContact CE2-CD2 3.95Å; Y1174-L1222 PolarHBondContact OH-O 2.86Å; Y1209-L1222 HydrophobicContact CD2-CB 4.28Å; Y1209-L1222 HydrophobicContact CD2-CD2 4.42Å; Y1209-L1222 HydrophobicContact CE2-CB 3.71Å; F1212-L1222 HydrophobicContact CB-CD2 4.33Å; R1213-L1222 HydrophobicContact CB-CD1 3.64Å; R1213-L1222 HydrophobicContact CB-CD2 4.48Å; R1213-L1222 HydrophobicContact CG-CD1 3.72Å; V1217-L1222 HydrophobicContact CB-CD2 4.09Å; V1217-L1222 HydrophobicContact CB-CG 4.34Å; V1217-L1222 HydrophobicContact CG1-CD2 3.69Å; V1217-L1222 HydrophobicContact CG1-CG 3.84Å; V1217-L1222 WeakPolarHBondContact O-CD1 3.34Å; L1218-L1222 PolarHBondContact O-N 3.36Å; E1219-L1222 PolarHBondContact O-N 3.29Å; L1222-S1224 PolarHBondContact O-N 2.82Å; L1222-S1224 VanDerWaalsContact O-N 3.13Å; L1222-Y1227 WeakPolarHBondContact O-CB 3.45Å
1223	N	85.7	Confident	85.9	Confident	74 Å²	74	66.5 Å²	66.5	40%	0.396	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	41.7	-179.8	-62.2	-57.3	0	0	0	112.4	Y1209 E1219	Y1209-N1223 PolarHBondContact OH-ND2 2.76Å; Y1209-N1223 PolarHBondContact OH-OD1 2.82Å; E1219-N1223 WeakPolarHBondContact O-CB 3.25Å; E1219-N1223 PolarHBondContact O-N 3.36Å; E1219-N1223 PolarHBondContact O-ND2 2.92Å
1224	S	88.9	Confident	85.8	Confident	26 Å²	26	61.3 Å²	61.3	18%	0.182	33%	0.327	C	S	.	.			trans	-65.3	152.5	175.1	67.6	0	0	0	0	111.6	T1221 L1222 T1226 Y1227 D1228	T1221-S1224 WeakPolarHBondContact O-CB 3.42Å; T1221-S1224 PolarHBondContact O-N 3.01Å; L1222-S1224 PolarHBondContact O-N 2.82Å; L1222-S1224 VanDerWaalsContact O-N 3.13Å; S1224-T1226 PolarHBondContact O-N 2.79Å; S1224-Y1227 WeakPolarHBondContact O-CA 3.48Å; S1224-Y1227 WeakPolarHBondContact O-CB 3.12Å; S1224-Y1227 PolarHBondContact O-N 2.82Å; S1224-Y1227 PolarHBondContact OG-N 2.67Å; S1224-D1228 PolarHBondContact O-N 2.87Å
1225	K	86.6	Confident	85.6	Confident	183 Å²	183	57.4 Å²	57.4	80%	0.796	31%	0.308	S	S	*	.	H	α-helix	trans	-53.5	-24.2	173	-64.1	-178.9	-179.1	177.9	0	113.5	T1229	K1225-T1229 PolarHBondContact O-N 2.81Å; K1225-T1229 PolarHBondContact O-OG1 2.78Å
1226	T	87.9	Confident	85.6	Confident	48 Å²	48	60.6 Å²	60.6	29%	0.294	33%	0.329	S	S	.	.	H	α-helix	trans	-74	-45.5	175.6	-56.5	0	0	0	0	111.1	M1178 K1179 C1182 S1224 T1229 V1230	M1178-T1226 HydrophobicContact CB-CG2 4.38Å; K1179-T1226 HydrophobicContact CB-CG2 4.38Å; C1182-T1226 HydrophobicContact CB-CG2 3.63Å; S1224-T1226 PolarHBondContact O-N 2.79Å; T1226-T1229 PolarHBondContact O-N 2.88Å; T1226-V1230 WeakPolarHBondContact O-CG2 3.23Å; T1226-V1230 PolarHBondContact O-N 3.21Å
1227	Y	88.8	Confident	85.5	Confident	9 Å²	9	59.2 Å²	59.2	4%	0.035	31%	0.312	C	S	.	.	H	α-helix	trans	-60.2	-47.4	172	176.1	-102.4	0	0	0	111.4	Y1174 M1178 V1205 Y1209 L1222 S1224 T1229 V1230 H1231	Y1174-Y1227 VanDerWaalsContact OH-CD2 3.23Å; Y1174-Y1227 WeakPolarHBondContact OH-CD2 3.37Å; M1178-Y1227 HydrophobicContact CE-CD2 4.43Å; M1178-Y1227 HydrophobicContact SD-CD2 4.16Å; V1205-Y1227 HydrophobicContact CG1-CD2 4.27Å; V1205-Y1227 HydrophobicContact CG1-CE2 3.67Å; Y1209-Y1227 HydrophobicContact CD2-CD1 4.46Å; Y1209-Y1227 HydrophobicContact CD2-CD2 4.24Å; Y1209-Y1227 AromaticContact CD2-CE1 3.86Å; Y1209-Y1227 HydrophobicContact CD2-CE1 3.86Å; Y1209-Y1227 AromaticContact CD2-CE2 3.61Å; Y1209-Y1227 HydrophobicContact CD2-CE2 3.61Å; Y1209-Y1227 AromaticContact CD2-CZ 3.39Å; Y1209-Y1227 HydrophobicContact CE2-CD1 4.36Å; Y1209-Y1227 AromaticContact CE2-CE1 3.78Å; Y1209-Y1227 HydrophobicContact CE2-CE1 3.78Å; Y1209-Y1227 HydrophobicContact CE2-CE2 4.37Å; Y1209-Y1227 AromaticContact CE2-CZ 3.79Å; Y1209-Y1227 HydrophobicContact CG-CE2 4.26Å; L1222-Y1227 WeakPolarHBondContact O-CB 3.45Å; S1224-Y1227 WeakPolarHBondContact O-CA 3.48Å; S1224-Y1227 WeakPolarHBondContact O-CB 3.12Å; S1224-Y1227 PolarHBondContact O-N 2.82Å; S1224-Y1227 PolarHBondContact OG-N 2.67Å; Y1227-T1229 PolarHBondContact O-N 2.83Å; Y1227-V1230 PolarHBondContact O-N 2.9Å; Y1227-V1230 VanDerWaalsContact O-N 3.15Å; Y1227-H1231 AromaticContact CZ-CD2 3.98Å; Y1227-H1231 WeakPolarHBondContact O-CB 3.48Å; Y1227-H1231 PolarHBondContact O-N 2.8Å
1228	D	86.4	Confident	85.1	Confident	57 Å²	57	60.3 Å²	60.3	31%	0.305	32%	0.317	S	S	.	.	H	α-helix	trans	-50.3	-43.3	173.5	-98.9	27	0	0	0	112.9	S1224 R1232	S1224-D1228 PolarHBondContact O-N 2.87Å; D1228-R1232 WeakPolarHBondContact O-CB 3.15Å; D1228-R1232 WeakPolarHBondContact O-CD 3.36Å; D1228-R1232 WeakPolarHBondContact O-CG 3.4Å; D1228-R1232 PolarHBondContact O-N 2.61Å; D1228-R1232 IonicContact OD2-CZ 2.79Å; D1228-R1232 IonicContact OD2-NE 2.82Å; D1228-R1232 IonicContact OD2-NH2 3.12Å; D1228-R1232 PolarHBondContact OD2-NH2 2.64Å
1229	T	87.4	Confident	84.6	Confident	79 Å²	79	57.6 Å²	57.6	49%	0.485	31%	0.311	S	S	.	.	H	α-helix	trans	-69.9	-44.4	-178.6	-57.8	0	0	0	0	111.3	K1225 T1226 Y1227 R1233	K1225-T1229 PolarHBondContact O-N 2.81Å; K1225-T1229 PolarHBondContact O-OG1 2.78Å; T1226-T1229 PolarHBondContact O-N 2.88Å; Y1227-T1229 PolarHBondContact O-N 2.83Å; T1229-R1233 PolarHBondContact O-N 3.06Å; T1229-R1233 VanDerWaalsContact O-N 3.11Å
1230	V	87.6	Confident	84.3	Confident	1 Å²	1	54 Å²	54	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-60.8	-50.1	174.1	170.4	0	0	0	0	110.8	I1181 C1182 L1185 V1205 T1226 Y1227 R1232 R1233 L1234	I1181-V1230 HydrophobicContact CG2-CG1 3.77Å; I1181-V1230 HydrophobicContact CG2-CG2 4.14Å; C1182-V1230 HydrophobicContact CB-CG2 3.54Å; L1185-V1230 HydrophobicContact CD1-CB 4.4Å; L1185-V1230 HydrophobicContact CD1-CG1 3.98Å; L1185-V1230 HydrophobicContact CD1-CG2 4.27Å; V1205-V1230 HydrophobicContact CG1-CG1 4.37Å; V1205-V1230 HydrophobicContact CG2-CG1 3.9Å; T1226-V1230 WeakPolarHBondContact O-CG2 3.23Å; T1226-V1230 PolarHBondContact O-N 3.21Å; Y1227-V1230 PolarHBondContact O-N 2.9Å; Y1227-V1230 VanDerWaalsContact O-N 3.15Å; V1230-R1232 PolarHBondContact O-N 2.81Å; V1230-R1233 PolarHBondContact O-N 3.45Å; V1230-L1234 HydrophobicContact CG1-CD1 3.82Å; V1230-L1234 HydrophobicContact CG1-CG 4.41Å; V1230-L1234 WeakPolarHBondContact O-CG 3.28Å; V1230-L1234 PolarHBondContact O-N 2.76Å
1231	H	87.5	Confident	83.8	Confident	53 Å²	53	51 Å²	51	25%	0.245	27%	0.267	C	S	.	.	H	α-helix	trans	-57.9	-50.9	-179.7	-173.5	-50.1	0	0	0	110.8	Y1227 R1233 L1234 T1235 M1254	Y1227-H1231 AromaticContact CZ-CD2 3.98Å; Y1227-H1231 WeakPolarHBondContact O-CB 3.48Å; Y1227-H1231 PolarHBondContact O-N 2.8Å; H1231-R1233 PolarHBondContact O-N 2.91Å; H1231-L1234 PolarHBondContact O-N 2.86Å; H1231-T1235 PolarHBondContact CE1-OG1 2.87Å; H1231-T1235 PolarHBondContact ND1-OG1 2.9Å; H1231-T1235 VanDerWaalsContact ND1-OG1 3.09Å; H1231-T1235 PolarHBondContact NE2-OG1 3.09Å; H1231-T1235 WeakPolarHBondContact O-CB 3.43Å; H1231-T1235 PolarHBondContact O-N 2.82Å; H1231-T1235 PolarHBondContact O-OG1 3.31Å; H1231-M1254 HydrophobicContact CB-CE 4.06Å; H1231-M1254 WeakPolarHBondContact CD2-CE 3.41Å; H1231-M1254 VanDerWaalsContact CG-CE 3.46Å
1232	R	86.1	Confident	82.9	Confident	157 Å²	157	52.8 Å²	52.8	59%	0.592	28%	0.281	S	S	*	.	H	α-helix	trans	-61.3	-41.9	-179.8	-69.4	168.2	-159	-160.5	8.3	112.2	D1228 V1230 T1235 V1236	D1228-R1232 WeakPolarHBondContact O-CB 3.15Å; D1228-R1232 WeakPolarHBondContact O-CD 3.36Å; D1228-R1232 WeakPolarHBondContact O-CG 3.4Å; D1228-R1232 PolarHBondContact O-N 2.61Å; D1228-R1232 IonicContact OD2-CZ 2.79Å; D1228-R1232 IonicContact OD2-NE 2.82Å; D1228-R1232 IonicContact OD2-NH2 3.12Å; D1228-R1232 PolarHBondContact OD2-NH2 2.64Å; V1230-R1232 PolarHBondContact O-N 2.81Å; R1232-T1235 PolarHBondContact O-N 3.13Å; R1232-V1236 WeakPolarHBondContact O-CG2 3.4Å; R1232-V1236 PolarHBondContact O-N 2.93Å
1233	R	86.3	Confident	81.8	Confident	57 Å²	57	59 Å²	59	22%	0.215	32%	0.318	C	S	.	.	H	α-helix	trans	-63.7	-46.7	175.4	-179.1	60.9	-176.8	-126.3	-1.6	111.2	R1188 L1189 L1191 T1229 V1230 H1231 T1235 V1236 E1237	R1188-R1233 PolarHBondContact O-NH2 2.91Å; L1189-R1233 PolarHBondContact O-NH1 2.82Å; L1189-R1233 PolarHBondContact O-NH2 2.8Å; L1189-R1233 VanDerWaalsContact O-NH2 3.15Å; L1191-R1233 PolarHBondContact O-NH2 2.88Å; T1229-R1233 PolarHBondContact O-N 3.06Å; T1229-R1233 VanDerWaalsContact O-N 3.11Å; V1230-R1233 PolarHBondContact O-N 3.45Å; H1231-R1233 PolarHBondContact O-N 2.91Å; R1233-T1235 PolarHBondContact O-N 2.82Å; R1233-V1236 PolarHBondContact O-N 3.14Å; R1233-E1237 HydrophobicContact CG-CG 4.33Å; R1233-E1237 IonicContact CZ-OE1 2.93Å; R1233-E1237 IonicContact NE-OE1 3.72Å; R1233-E1237 PolarHBondContact NE-OE1 3.41Å; R1233-E1237 IonicContact NH2-OE1 3.13Å; R1233-E1237 PolarHBondContact NH2-OE1 3.19Å; R1233-E1237 VanDerWaalsContact O-CG 3.25Å; R1233-E1237 WeakPolarHBondContact O-CG 3.29Å; R1233-E1237 PolarHBondContact O-N 2.89Å
1234	L	84.8	Confident	80.5	Confident	0 Å²	0	59 Å²	59	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-63.8	-37.7	179.1	-67.5	176.2	0	0	0	112.7	L1185 L1193 L1198 L1201 I1202 V1205 V1230 H1231 E1237 E1238 M1254	L1185-L1234 HydrophobicContact CD1-CD2 4.37Å; L1185-L1234 HydrophobicContact CD1-CG 4.34Å; L1185-L1234 HydrophobicContact CD2-CD2 4.37Å; L1193-L1234 HydrophobicContact CD1-CD2 4.17Å; L1198-L1234 HydrophobicContact CD1-CD2 3.95Å; L1201-L1234 HydrophobicContact CB-CD1 4.37Å; L1201-L1234 HydrophobicContact CB-CD2 3.95Å; L1201-L1234 HydrophobicContact CD1-CD2 4.4Å; I1202-L1234 HydrophobicContact CG1-CB 4.36Å; V1205-L1234 HydrophobicContact CB-CD1 4.33Å; V1205-L1234 HydrophobicContact CG2-CD1 3.94Å; V1230-L1234 HydrophobicContact CG1-CD1 3.82Å; V1230-L1234 HydrophobicContact CG1-CG 4.41Å; V1230-L1234 WeakPolarHBondContact O-CG 3.28Å; V1230-L1234 PolarHBondContact O-N 2.76Å; H1231-L1234 PolarHBondContact O-N 2.86Å; L1234-E1237 PolarHBondContact O-N 2.92Å; L1234-E1238 WeakPolarHBondContact O-CB 3.39Å; L1234-E1238 PolarHBondContact O-N 2.85Å; L1234-M1254 HydrophobicContact CB-CE 4.48Å; L1234-M1254 HydrophobicContact CB-CG 3.9Å; L1234-M1254 HydrophobicContact CB-SD 3.85Å; L1234-M1254 HydrophobicContact CD1-SD 4.06Å
1235	T	83.6	Confident	78.7	Confident	49 Å²	49	63.3 Å²	63.3	30%	0.301	34%	0.342	S	S	.	.	H	α-helix	trans	-65.4	-38.7	174.2	-54.7	0	0	0	0	112.3	H1231 R1232 R1233 E1238 A1239	H1231-T1235 PolarHBondContact CE1-OG1 2.87Å; H1231-T1235 PolarHBondContact ND1-OG1 2.9Å; H1231-T1235 VanDerWaalsContact ND1-OG1 3.09Å; H1231-T1235 PolarHBondContact NE2-OG1 3.09Å; H1231-T1235 WeakPolarHBondContact O-CB 3.43Å; H1231-T1235 PolarHBondContact O-N 2.82Å; H1231-T1235 PolarHBondContact O-OG1 3.31Å; R1232-T1235 PolarHBondContact O-N 3.13Å; R1233-T1235 PolarHBondContact O-N 2.82Å; T1235-E1238 PolarHBondContact O-N 3.04Å; T1235-A1239 WeakPolarHBondContact O-CB 3.48Å; T1235-A1239 PolarHBondContact O-N 2.93Å
1236	V	83.2	Confident	77	Confident	90 Å²	90	59 Å²	59	55%	0.545	35%	0.349	S	S	.	.	H	α-helix	trans	-69.8	-39.8	176.4	170.3	0	0	0	0	111.5	R1232 R1233 A1239 T1240	R1232-V1236 WeakPolarHBondContact O-CG2 3.4Å; R1232-V1236 PolarHBondContact O-N 2.93Å; R1233-V1236 PolarHBondContact O-N 3.14Å; V1236-A1239 PolarHBondContact O-N 3.17Å; V1236-T1240 WeakPolarHBondContact O-CB 3.23Å; V1236-T1240 PolarHBondContact O-N 2.99Å; V1236-T1240 PolarHBondContact O-OG1 2.84Å
1237	E	79	Confident	75.3	Confident	9 Å²	9	59.5 Å²	59.5	4%	0.042	36%	0.364	C	S	.	.	H	α-helix	trans	-62.9	-42.3	173.3	-69	-81.4	174.9	0	0	111.6	L1193 L1198 R1233 L1234 T1240 A1241	L1193-E1237 HydrophobicContact CD1-CB 4.44Å; L1193-E1237 HydrophobicContact CD1-CG 3.87Å; L1193-E1237 HydrophobicContact CG-CG 4.16Å; L1193-E1237 PolarHBondContact N-OE2 3.37Å; L1198-E1237 HydrophobicContact CD1-CB 3.61Å; L1198-E1237 HydrophobicContact CD2-CB 4.11Å; R1233-E1237 HydrophobicContact CG-CG 4.33Å; R1233-E1237 IonicContact CZ-OE1 2.93Å; R1233-E1237 IonicContact NE-OE1 3.72Å; R1233-E1237 PolarHBondContact NE-OE1 3.41Å; R1233-E1237 IonicContact NH2-OE1 3.13Å; R1233-E1237 PolarHBondContact NH2-OE1 3.19Å; R1233-E1237 VanDerWaalsContact O-CG 3.25Å; R1233-E1237 WeakPolarHBondContact O-CG 3.29Å; R1233-E1237 PolarHBondContact O-N 2.89Å; L1234-E1237 PolarHBondContact O-N 2.92Å; E1237-T1240 PolarHBondContact O-N 3.25Å; E1237-A1241 VanDerWaalsContact O-CB 3.29Å; E1237-A1241 WeakPolarHBondContact O-CB 3.17Å; E1237-A1241 PolarHBondContact O-N 2.81Å
1238	E	79.4	Confident	73.5	Confident	30 Å²	30	60.1 Å²	60.1	14%	0.14	37%	0.373	C	S	.	.	H	α-helix	trans	-63.2	-45.2	175.3	-173.4	-171.6	154.9	0	0	112.4	I1202 L1234 T1235 T1240 A1241 S1242 L1249 T1253 M1254	I1202-E1238 HydrophobicContact CD1-CB 4.33Å; I1202-E1238 HydrophobicContact CD1-CG 4.46Å; L1234-E1238 WeakPolarHBondContact O-CB 3.39Å; L1234-E1238 PolarHBondContact O-N 2.85Å; T1235-E1238 PolarHBondContact O-N 3.04Å; E1238-T1240 VanDerWaalsContact C-N 3.27Å; E1238-T1240 PolarHBondContact O-N 2.64Å; E1238-A1241 PolarHBondContact O-N 2.79Å; E1238-S1242 VanDerWaalsContact O-CB 3.29Å; E1238-S1242 WeakPolarHBondContact O-CB 3.37Å; E1238-S1242 PolarHBondContact O-N 3.26Å; E1238-S1242 PolarHBondContact O-OG 2.84Å; E1238-L1249 HydrophobicContact CG-CD1 4.27Å; E1238-T1253 VanDerWaalsContact OE1-CA 3.3Å; E1238-T1253 WeakPolarHBondContact OE1-CA 3.3Å; E1238-T1253 WeakPolarHBondContact OE1-CB 3.5Å; E1238-T1253 PolarHBondContact OE1-OG1 2.75Å; E1238-M1254 VanDerWaalsContact OE2-CB 3.29Å; E1238-M1254 WeakPolarHBondContact OE2-CB 3.46Å; E1238-M1254 PolarHBondContact OE2-N 3.48Å
1239	A	75.8	Confident	72.2	Confident	55 Å²	55	58.7 Å²	58.7	46%	0.455	37%	0.365	S	S	.	.	H	α-helix	trans	-61.8	-36.7	174.5	0	0	0	0	0	111.8	T1235 V1236 S1242 V1243	T1235-A1239 WeakPolarHBondContact O-CB 3.48Å; T1235-A1239 PolarHBondContact O-N 2.93Å; V1236-A1239 PolarHBondContact O-N 3.17Å; A1239-S1242 PolarHBondContact O-OG 3.46Å; A1239-V1243 WeakPolarHBondContact O-CG2 3.49Å
1240	T	74.5	Confident	70.6	Confident	66 Å²	66	63.2 Å²	63.2	41%	0.405	38%	0.381	S	S	.	.	H	α-helix	trans	-71.7	-48.2	178.1	-54.3	0	0	0	0	111.3	V1236 E1237 E1238 S1242 V1243 S1244	V1236-T1240 WeakPolarHBondContact O-CB 3.23Å; V1236-T1240 PolarHBondContact O-N 2.99Å; V1236-T1240 PolarHBondContact O-OG1 2.84Å; E1237-T1240 PolarHBondContact O-N 3.25Å; E1238-T1240 VanDerWaalsContact C-N 3.27Å; E1238-T1240 PolarHBondContact O-N 2.64Å; T1240-S1242 PolarHBondContact O-N 3.22Å; T1240-V1243 PolarHBondContact O-N 2.89Å; T1240-S1244 PolarHBondContact O-N 2.65Å; T1240-S1244 VanDerWaalsContact O-N 3.16Å
1241	A	69.1	Low	69.3	Low	3 Å²	3	67.3 Å²	67.3	3%	0.025	42%	0.423	C	S	.	.	H	α-helix	trans	-67.4	-34.8	-178.3	0	0	0	0	0	113.3	L1198 E1237 E1238 V1243 S1244 E1245 L1249	L1198-A1241 HydrophobicContact CD2-CB 3.86Å; E1237-A1241 VanDerWaalsContact O-CB 3.29Å; E1237-A1241 WeakPolarHBondContact O-CB 3.17Å; E1237-A1241 PolarHBondContact O-N 2.81Å; E1238-A1241 PolarHBondContact O-N 2.79Å; A1241-V1243 VanDerWaalsContact C-N 3.27Å; A1241-V1243 PolarHBondContact O-N 3.3Å; A1241-S1244 WeakPolarHBondContact CA-OG 3.32Å; A1241-S1244 PolarHBondContact O-N 2.56Å; A1241-S1244 PolarHBondContact O-OG 3.16Å; A1241-E1245 PolarHBondContact O-N 3.35Å; A1241-E1245 VanDerWaalsContact O-N 3.07Å; A1241-L1249 HydrophobicContact CB-CD1 3.93Å
1242	S	66.6	Low	68	Low	63 Å²	63	67 Å²	67	44%	0.441	42%	0.423	S	S	.	.	H	α-helix	trans	-70.2	-21.6	176.2	55.3	0	0	0	0	113.6	E1238 A1239 T1240	E1238-S1242 VanDerWaalsContact O-CB 3.29Å; E1238-S1242 WeakPolarHBondContact O-CB 3.37Å; E1238-S1242 PolarHBondContact O-N 3.26Å; E1238-S1242 PolarHBondContact O-OG 2.84Å; A1239-S1242 PolarHBondContact O-OG 3.46Å; T1240-S1242 PolarHBondContact O-N 3.22Å
1243	V	62.9	Low	67.2	Low	129 Å²	129	61.6 Å²	61.6	78%	0.782	41%	0.407	S	S	*	.	H	α-helix	trans	-85.1	-30.6	171.6	173.9	0	0	0	0	112	A1239 T1240 A1241	A1239-V1243 WeakPolarHBondContact O-CG2 3.49Å; T1240-V1243 PolarHBondContact O-N 2.89Å; A1241-V1243 VanDerWaalsContact C-N 3.27Å; A1241-V1243 PolarHBondContact O-N 3.3Å
1244	S	57.4	Low	66.5	Low	75 Å²	75	59 Å²	59	52%	0.524	40%	0.397	S	S	.	.	H	α-helix	trans	-82.8	-37.7	-178.2	64.1	0	0	0	0	114.7	T1240 A1241	T1240-S1244 PolarHBondContact O-N 2.65Å; T1240-S1244 VanDerWaalsContact O-N 3.16Å; A1241-S1244 WeakPolarHBondContact CA-OG 3.32Å; A1241-S1244 PolarHBondContact O-N 2.56Å; A1241-S1244 PolarHBondContact O-OG 3.16Å
1245	E	53	Low	65.6	Low	117 Å²	117	65.8 Å²	65.8	55%	0.547	43%	0.427	S	S	.	.	S	Bend	trans	-127.1	99.5	177.2	-72.9	-162	172.9	0	0	111.9	I1195 A1241 G1247 G1248	I1195-E1245 HydrophobicContact CD1-CB 4.33Å; I1195-E1245 HydrophobicContact CD1-CG 4.34Å; I1195-E1245 WeakPolarHBondContact CD1-OE2 3.43Å; A1241-E1245 PolarHBondContact O-N 3.35Å; A1241-E1245 VanDerWaalsContact O-N 3.07Å; E1245-G1247 PolarHBondContact O-N 2.82Å; E1245-G1248 PolarHBondContact O-N 2.73Å
1246	G	49.4	Very low	64.4	Low	92 Å²	92	67.6 Å²	67.6	95%	0.948	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	47.9	-176.7	0	0	0	0	0	116.4
1247	G	52.7	Low	62.8	Low	58 Å²	58	67 Å²	67	60%	0.598	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-179	-10.5	176.6	0	0	0	0	0	115.1	E1245 L1249	E1245-G1247 PolarHBondContact O-N 2.82Å; G1247-L1249 PolarHBondContact O-N 2.94Å
1248	G	51.7	Low	61.2	Low	23 Å²	23	71.7 Å²	71.7	24%	0.237	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-25.5	-168.4	0	0	0	0	0	116.2	K1199 E1245	K1199-G1248 WeakPolarHBondContact CE-O 3.45Å; K1199-G1248 PolarHBondContact NZ-O 3.25Å; E1245-G1248 PolarHBondContact O-N 2.73Å
1249	L	57.7	Low	59.5	Low	26 Å²	26	78.6 Å²	78.6	14%	0.136	49%	0.493	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.2	10.4	-160.8	-85.1	164.3	0	0	0	117.3	K1199 E1238 A1241 G1247 G1251 I1252	K1199-L1249 HydrophobicContact CG-CD2 3.93Å; E1238-L1249 HydrophobicContact CG-CD1 4.27Å; A1241-L1249 HydrophobicContact CB-CD1 3.93Å; G1247-L1249 PolarHBondContact O-N 2.94Å; L1249-G1251 PolarHBondContact O-N 2.86Å; L1249-I1252 PolarHBondContact O-N 3.09Å
1250	Q	55.5	Low	57.7	Low	175 Å²	175	84 Å²	84	82%	0.818	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.6	124	-177.6	-74.9	-174.3	-23.3	0	0	114.1
1251	G	60	Low	55.9	Low	86 Å²	86	90 Å²	90	89%	0.887	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.7	0.1	168.7	0	0	0	0	0	117.7	L1249	L1249-G1251 PolarHBondContact O-N 2.86Å
1252	I	60.2	Low	54.2	Low	46 Å²	46	99.5 Å²	99.5	24%	0.236	58%	0.576	C	S	.	*			trans	-135.6	114.2	-179.5	-59.6	179.1	0	0	0	110.1	K1199 I1202 K1203 L1249	K1199-I1252 HydrophobicContact CB-CD1 4.23Å; K1199-I1252 HydrophobicContact CD-CD1 4.31Å; K1199-I1252 HydrophobicContact CG-CD1 4.29Å; I1202-I1252 HydrophobicContact CB-CG2 4Å; I1202-I1252 HydrophobicContact CG2-CG2 3.57Å; K1203-I1252 HydrophobicContact CD-CD1 4.42Å; L1249-I1252 PolarHBondContact O-N 3.09Å
1253	T	69.6	Low	52.6	Low	45 Å²	45	104 Å²	104	28%	0.276	63%	0.632	S	S	.	*			trans	-136.1	149.7	178	179.6	0	0	0	0	111.7	K1206 E1238 K1255	K1206-T1253 VanDerWaalsContact CD-O 3.25Å; K1206-T1253 WeakPolarHBondContact CD-O 3.49Å; K1206-T1253 PolarHBondContact NZ-O 3.32Å; E1238-T1253 VanDerWaalsContact OE1-CA 3.3Å; E1238-T1253 WeakPolarHBondContact OE1-CA 3.3Å; E1238-T1253 WeakPolarHBondContact OE1-CB 3.5Å; E1238-T1253 PolarHBondContact OE1-OG1 2.75Å; T1253-K1255 VanDerWaalsContact C-N 3.34Å; T1253-K1255 HydrophobicContact CG2-CB 4.16Å; T1253-K1255 PolarHBondContact OG1-N 3.06Å
1254	M	71.6	Confident	52.1	Low	1 Å²	1	102.8 Å²	102.8	1%	0.005	62%	0.624	C	S	.	*	S	Bend	trans	-68.7	-27.1	169.3	-77.8	-60.6	-54.6	0	0	113	I1202 K1206 H1231 L1234 E1238 D1256	I1202-M1254 HydrophobicContact CB-SD 4.04Å; I1202-M1254 HydrophobicContact CD1-CG 4.05Å; I1202-M1254 HydrophobicContact CG1-CG 3.79Å; I1202-M1254 HydrophobicContact CG1-SD 3.74Å; I1202-M1254 HydrophobicContact CG2-CG 4.12Å; I1202-M1254 HydrophobicContact CG2-SD 3.77Å; K1206-M1254 HydrophobicContact CG-SD 4.45Å; H1231-M1254 HydrophobicContact CB-CE 4.06Å; H1231-M1254 WeakPolarHBondContact CD2-CE 3.41Å; H1231-M1254 VanDerWaalsContact CG-CE 3.46Å; L1234-M1254 HydrophobicContact CB-CE 4.48Å; L1234-M1254 HydrophobicContact CB-CG 3.9Å; L1234-M1254 HydrophobicContact CB-SD 3.85Å; L1234-M1254 HydrophobicContact CD1-SD 4.06Å; E1238-M1254 VanDerWaalsContact OE2-CB 3.29Å; E1238-M1254 WeakPolarHBondContact OE2-CB 3.46Å; E1238-M1254 PolarHBondContact OE2-N 3.48Å; M1254-D1256 PolarHBondContact O-N 3Å
1255	K	65.1	Low	51.8	Low	144 Å²	144	104.2 Å²	104.2	63%	0.626	63%	0.63	S	S	*	*	S	Bend	trans	-56.3	134.1	175.4	-76.5	-170.7	169.6	-164.6	0	110.7	K1206 T1253 S1257	K1206-K1255 PolarHBondContact NZ-O 2.69Å; T1253-K1255 VanDerWaalsContact C-N 3.34Å; T1253-K1255 HydrophobicContact CG2-CB 4.16Å; T1253-K1255 PolarHBondContact OG1-N 3.06Å; K1255-S1257 PolarHBondContact O-N 2.82Å; K1255-S1257 PolarHBondContact O-OG 3.17Å
1256	D	57.2	Low	51.7	Low	86 Å²	86	103.5 Å²	103.5	46%	0.46	63%	0.634	S	S	.	*			trans	-68.6	130.7	175.8	-77.9	-46.7	0	0	0	111.3	K1206 M1254 D1258	K1206-D1256 IonicContact NZ-OD1 3.46Å; M1254-D1256 PolarHBondContact O-N 3Å; D1256-D1258 VanDerWaalsContact C-N 3.35Å
1257	S	50.2	Low	51.9	Low	77 Å²	77	104.2 Å²	104.2	54%	0.538	62%	0.616	S	S	.	*	S	Bend	trans	-97.9	4.2	-168.7	-42.1	0	0	0	0	111.9	K1255	K1255-S1257 PolarHBondContact O-N 2.82Å; K1255-S1257 PolarHBondContact O-OG 3.17Å
1258	D	46.2	Very low	51.8	Low	109 Å²	109	107.1 Å²	107.1	58%	0.583	62%	0.617	S	S	*	*	S	Bend	trans	-96.6	4.3	-178.4	-61.8	-10.6	0	0	0	110.9	R1210 D1256	R1210-D1258 IonicContact CZ-OD2 2.7Å; R1210-D1258 IonicContact NH1-OD1 2.69Å; R1210-D1258 PolarHBondContact NH1-OD1 2.81Å; R1210-D1258 IonicContact NH1-OD2 2.88Å; R1210-D1258 PolarHBondContact NH1-OD2 2.67Å; D1256-D1258 VanDerWaalsContact C-N 3.35Å
1259	E	42.9	Very low	51.8	Low	175 Å²	175	112.7 Å²	112.7	82%	0.818	64%	0.642	S	S	*	*	S	Bend	trans	-109.7	-0.7	179.6	-68.9	-166	153.6	0	0	115.3
1260	E	38.6	Very low	51.4	Low	169 Å²	169	118.9 Å²	118.9	79%	0.79	68%	0.678	S	S	*	*	S	Bend	trans	-108.6	26.5	-176.6	-71.1	-172.5	163.5	0	0	114
1261	E	35.7	Very low	51.1	Low	192 Å²	192	114.5 Å²	114.5	90%	0.897	67%	0.668	S	S	*	*	S	Bend	trans	-126.3	12.4	-179.9	-134.8	173.4	-142.7	0	0	116.2
1262	E	34.1	Very low	50.4	Low	202 Å²	202	116.9 Å²	116.9	94%	0.944	65%	0.649	S	S	*	*			trans	-118.3	104.6	161.4	-74	-161.3	155.2	0	0	111.1
1263	G	33	Very low	49.5	Very low	157 Å²	157	123.4 Å²	123.4	100%	1.619	69%	0.687	S	S	*	*			trans	-164.9	0	177.8	0	0	0	0	0	113.4

Retrieved 1,263 of 1,263 residues in 336.7 ms (Link to these results)

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