A0A024RCV8_HUMAN Loading...

DNA mismatch repair protein

Component of the post-replicative DNA mismatch repair system (MMR). Involved in DNA mismatch repair and meiotic recombination processes. Facilitates crossovers between homologs during meiosis.

AlphaFold DB , UniProt , Accession A0A024RCV8, Species HUMAN (Homo sapiens, Human), Gene MSH5-SAPCD1, Length 851 aa.

						>A0A024RCV8_HUMAN|A0A024RCV8|MSH5-SAPCD1
MASLGANPRRTPQGPRPGAASSGFPSPAPVPGPREAEEEEVEEEEELAEIHLCVLWNSGYLGIAYYDTSDSTIHFMPDAPDHESLKLLQRVLDEINPQSVVTSAKQDENMTRFLGKLASQEHREPKRPEIIFLPSVDFGLEISKQRLLSGNYSFIPDAMTATEKILFLSSIIPFDCLLTPPGDLRFTPIPLLIPSQVRALGGLLKFLGRRRIGVELEDYNVSVPILGFKKFMLTHLVNIDQDTYSVLQIFKSESHPSVYKVASGLKEGLSLFGILNRCHCKWGEKLLRLWFTRPTHDLGELSSRLDVIQFFLLPQNLDMAQMLHRLLGHIKNVPLILKRMKLSHTKVSDWQVLYKTVYSALGLRDACRSLPQSIQLFRDIAQEFSDDLHHIASLIGKVVDFEGSLAENRFTVLPNIDPEIDEKKRRLMGLPSFLTEVARKELENLDSRIPSCSVIYIPLIGFLLSIPRLPSMVEASDFEINGLDFMFLSEEKLHYRSARTKELDALLGDLHCEIRDQETLLMYQLQCQVLARAAVLTRVLDLASRLDVLLALASAARDYGYSRPRYSPQVLGVRIQNGRHPLMELCARTFVPNSTECGGDKGRVKVITGPNSSGKSIYLKQVGLITFMALVGSFVPAEEAEIGAVDAIFTRIHSCESISLGLSTFMIDLNQVAKAVNNATAQSLVLIDEFGKGTNTVDGLALLAAVLRHWLARGPTCPHIFVATNFLSLVQLQLLPQGPLVQYLTMETCEDGNDLVFFYQVCEGVAKASHASHTAAQAGLPDKLVARGKEVSDLIRSGKPIKPVKDLLKKNQMENCQTLVDKFMKLDLEDPNLDLNVFMSQEVLPAATSIL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.3	Very low	29.3	Very low	247 Å²	247	149 Å²	149	100%	1.217	85%	0.845	S	S	*	*				0	119.9	0	-87.2	-179.4	169.4	0	0	107.7
2	A	30.2	Very low	29.9	Very low	95 Å²	95	147.3 Å²	147.3	79%	0.785	84%	0.844	S	S	*	*			trans	42.8	115.3	170	0	0	0	0	0	119
3	S	25.6	Very low	29.7	Very low	101 Å²	101	150.5 Å²	150.5	71%	0.706	85%	0.847	S	S	*	*			cis	77.8	128.8	31.3	87	0	0	0	0	117.4
4	L	28.9	Very low	29.3	Very low	175 Å²	175	145.2 Å²	145.2	92%	0.916	84%	0.843	S	S	*	*			trans	101.9	133.1	153.8	-60.8	150.8	0	0	0	116.6
5	G	26.6	Very low	29.4	Very low	70 Å²	70	144.1 Å²	144.1	72%	0.722	84%	0.842	S	S	*	*			cis	163.4	160.9	-1	0	0	0	0	0	113.6
6	A	25.5	Very low	29.4	Very low	109 Å²	109	149.9 Å²	149.9	90%	0.901	85%	0.845	S	S	*	*			trans	91.2	115.8	147.7	0	0	0	0	0	123.1
7	N	25.7	Very low	29.6	Very low	159 Å²	159	148.5 Å²	148.5	85%	0.85	84%	0.844	S	S	*	*			trans	-75.7	-157.7	164.9	-81.1	-27.9	0	0	0	113
8	P	47.6	Very low	29.4	Very low	112 Å²	112	144.6 Å²	144.6	73%	0.727	84%	0.842	S	S	*	*				-133	-171.4	-75.2	41.9	-24.4	0	0	0	112.2
9	R	25.3	Very low	29.2	Very low	220 Å²	220	142.6 Å²	142.6	83%	0.83	84%	0.843	S	S	*	*			trans	175.3	140.3	150	-98.1	168	-173.3	-164.3	3.2	107.2
10	R	26.8	Very low	29.1	Very low	217 Å²	217	140.5 Å²	140.5	82%	0.819	84%	0.843	S	S	*	*			cis	-165	147.6	24.1	-107.4	165.3	176.3	178.9	-3.2	108.8
11	T	26.5	Very low	29	Very low	134 Å²	134	139.5 Å²	139.5	82%	0.822	84%	0.843	S	S	*	*			trans	-95.8	165.2	155.9	48.5	0	0	0	0	109
12	P	36.3	Very low	28.8	Very low	128 Å²	128	133.8 Å²	133.8	83%	0.831	83%	0.827	S	S	*	*				-149.1	178	73.3	34.6	-10.4	0	0	0	118.1
13	Q	27.9	Very low	28.6	Very low	190 Å²	190	132.6 Å²	132.6	89%	0.888	82%	0.824	S	S	*	*			trans	-54.4	148.5	-171.7	-66.8	163.8	-20.3	0	0	121.1
14	G	24.5	Very low	28.7	Very low	76 Å²	76	137.4 Å²	137.4	78%	0.784	83%	0.833	S	S	*	*			trans	66.6	163.9	135.2	0	0	0	0	0	120.3
15	P	30.6	Very low	28.7	Very low	128 Å²	128	135 Å²	135	83%	0.831	83%	0.828	S	S	*	*			cis	-132.9	176.6	5.6	39.1	-19.8	0	0	0	115.8
16	R	29.2	Very low	28.8	Very low	238 Å²	238	136.9 Å²	136.9	90%	0.898	83%	0.83	S	S	*	*			trans	-72.6	153.8	163.1	-76.6	-179.5	173	176.6	-2.6	110.9
17	P	32.8	Very low	29	Very low	126 Å²	126	137.7 Å²	137.7	82%	0.818	83%	0.826	S	S	*	*				-143.5	160.3	105.5	34.6	-17.9	0	0	0	113.9
18	G	26	Very low	29.3	Very low	78 Å²	78	134.2 Å²	134.2	80%	0.804	82%	0.819	S	S	*	*			trans	-82.9	158.6	175	0	0	0	0	0	113.7
19	A	26.2	Very low	28.4	Very low	106 Å²	106	134.9 Å²	134.9	88%	0.876	82%	0.823	S	S	*	*			trans	177.7	148.6	140.7	0	0	0	0	0	109.1
20	A	27.4	Very low	28.7	Very low	101 Å²	101	130.8 Å²	130.8	84%	0.835	82%	0.823	S	S	*	*			trans	-60.4	148.2	-174.9	0	0	0	0	0	114.7
21	S	26.1	Very low	28.9	Very low	120 Å²	120	124.8 Å²	124.8	84%	0.839	81%	0.812	S	S	*	*			trans	-156.9	137.1	138.5	53.2	0	0	0	0	111.1
22	S	29.1	Very low	28.9	Very low	126 Å²	126	120.7 Å²	120.7	88%	0.881	80%	0.796	S	S	*	*			trans	-60	136	177.7	47.1	0	0	0	0	113.9
23	G	25.8	Very low	28.5	Very low	71 Å²	71	121.1 Å²	121.1	73%	0.732	80%	0.799	S	S	*	*			trans	-155.7	126.6	167.6	0	0	0	0	0	110.8
24	F	28.7	Very low	28.3	Very low	202 Å²	202	123.7 Å²	123.7	89%	0.886	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-49.2	152	-172.1	-71.6	-98.2	0	0	0	116.4
25	P	28.9	Very low	28.4	Very low	124 Å²	124	127.3 Å²	127.3	81%	0.805	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-73.9	131.9	173.6	30.7	-30.4	0	0	0	110.6
26	S	27.7	Very low	28.2	Very low	110 Å²	110	125.2 Å²	125.2	77%	0.769	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-77	147.4	168.1	44.4	0	0	0	0	110.1
27	P	30	Very low	28	Very low	126 Å²	126	123 Å²	123	82%	0.818	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-72.3	136.5	179.4	11.7	-1.6	0	0	0	110.5
28	A	31.1	Very low	27.8	Very low	86 Å²	86	125.5 Å²	125.5	71%	0.711	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-58.2	147.8	175	0	0	0	0	0	111.6
29	P	30.3	Very low	27.8	Very low	125 Å²	125	130.2 Å²	130.2	81%	0.812	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-70	135.9	179	28.9	-32.4	0	0	0	111.1
30	V	31.4	Very low	28	Very low	135 Å²	135	133.6 Å²	133.6	82%	0.818	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-68.7	128.5	173.9	-178.2	0	0	0	0	109.2
31	P	30	Very low	28.1	Very low	91 Å²	91	134.8 Å²	134.8	59%	0.591	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-70.7	142.7	174.7	-5.5	20.6	0	0	0	110.9	E35	P31-E35 WeakPolarHBondContact CB-OE2 3.22Å
32	G	27.7	Very low	28.4	Very low	48 Å²	48	137.6 Å²	137.6	50%	0.495	79%	0.786	S	S	.	*	P	Polyproline II helix	trans	-74	169.2	-178.7	0	0	0	0	0	113.9	R34 E35	G32-R34 PolarHBondContact O-N 3.37Å; G32-E35 PolarHBondContact O-N 3.34Å
33	P	26.3	Very low	29	Very low	136 Å²	136	135.1 Å²	135.1	88%	0.883	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	28.8	-166	24.6	-20.2	0	0	0	115
34	R	25.4	Very low	29.5	Very low	244 Å²	244	139.2 Å²	139.2	92%	0.921	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.3	-1.3	174.7	-79.4	-173.7	174.8	-179.9	-1.9	114.3	G32	G32-R34 PolarHBondContact O-N 3.37Å
35	E	26.3	Very low	30.2	Very low	153 Å²	153	136.3 Å²	136.3	72%	0.715	75%	0.75	S	S	*	*	S	Bend	trans	-104.9	7.3	176.4	-69.5	178.6	169.2	0	0	112.8	P31 G32	P31-E35 WeakPolarHBondContact CB-OE2 3.22Å; G32-E35 PolarHBondContact O-N 3.34Å
36	A	25.4	Very low	31.1	Very low	83 Å²	83	136.8 Å²	136.8	69%	0.686	74%	0.741	S	S	*	*	S	Bend	trans	-96.4	4.7	-175.4	0	0	0	0	0	115.1
37	E	26.2	Very low	32.4	Very low	193 Å²	193	138.3 Å²	138.3	90%	0.902	74%	0.74	S	S	*	*	S	Bend	trans	-108.7	2.1	179	-72.7	-171.7	166	0	0	114.3
38	E	27.1	Very low	34.1	Very low	178 Å²	178	135 Å²	135	83%	0.832	72%	0.724	S	S	*	*			trans	-119.1	49.7	173.1	-69	-176.7	175.6	0	0	111.1	E40	E38-E40 PolarHBondContact O-N 3.5Å
39	E	26.1	Very low	36.6	Very low	177 Å²	177	134.1 Å²	134.1	83%	0.827	71%	0.705	S	S	*	*			trans	-73.8	88.1	151	-78.4	-171.7	172.5	0	0	106.8	V41	E39-V41 VanDerWaalsContact C-N 3.26Å; E39-V41 PolarHBondContact O-N 3.46Å
40	E	30.1	Very low	39.3	Very low	177 Å²	177	129.7 Å²	129.7	83%	0.827	67%	0.674	S	S	*	*			trans	-51.7	101.8	155.8	-75.7	-172.2	156	0	0	106.3	E38 E42	E38-E40 PolarHBondContact O-N 3.5Å; E40-E42 VanDerWaalsContact C-N 3.26Å; E40-E42 PolarHBondContact O-N 3.35Å
41	V	31.3	Very low	42.1	Very low	125 Å²	125	123.9 Å²	123.9	76%	0.758	64%	0.638	S	S	*	*			trans	-55.9	101.7	164.7	177.2	0	0	0	0	104.7	E39 E43	E39-V41 VanDerWaalsContact C-N 3.26Å; E39-V41 PolarHBondContact O-N 3.46Å; V41-E43 PolarHBondContact O-N 2.99Å
42	E	32.1	Very low	45.1	Very low	180 Å²	180	119.5 Å²	119.5	84%	0.841	61%	0.61	S	S	*	*			trans	-56.4	93.4	166.9	-73.8	-173.6	162.3	0	0	105.6	E40 E44	E40-E42 VanDerWaalsContact C-N 3.26Å; E40-E42 PolarHBondContact O-N 3.35Å; E42-E44 VanDerWaalsContact C-N 3.34Å; E42-E44 PolarHBondContact O-N 3.48Å
43	E	40.3	Very low	48.2	Very low	73 Å²	73	117.2 Å²	117.2	34%	0.341	59%	0.586	S	S	.	*			trans	-59.2	106.8	164.9	-72.8	-178.1	179	0	0	104.4	V41 E45 K281	V41-E43 PolarHBondContact O-N 2.99Å; E43-E45 PolarHBondContact O-N 2.9Å; E43-K281 VanDerWaalsContact OE2-CD 3.29Å; E43-K281 WeakPolarHBondContact OE2-CD 3.47Å; E43-K281 VanDerWaalsContact OE2-CE 3.22Å; E43-K281 WeakPolarHBondContact OE2-CE 3.4Å; E43-K281 IonicContact OE2-NZ 3.21Å; E43-K281 PolarHBondContact OE2-NZ 2.75Å
44	E	38.1	Very low	51.3	Low	157 Å²	157	110.9 Å²	110.9	73%	0.734	55%	0.545	S	S	*	.			trans	-53.4	92.7	162.3	-75.7	176.9	152.8	0	0	106.5	E42 E46	E42-E44 VanDerWaalsContact C-N 3.34Å; E42-E44 PolarHBondContact O-N 3.48Å; E44-E46 PolarHBondContact O-N 2.79Å
45	E	42.9	Very low	54.3	Low	142 Å²	142	100 Å²	100	66%	0.664	51%	0.505	S	S	*	.			trans	-70.4	88	175.8	-78.7	-176.2	173.8	0	0	106.7	E43 L47 K281	E43-E45 PolarHBondContact O-N 2.9Å; E45-L47 PolarHBondContact O-N 3.43Å; E45-K281 IonicContact OE1-NZ 2.66Å; E45-K281 PolarHBondContact OE1-NZ 2.99Å
46	E	48.3	Very low	57.1	Low	134 Å²	134	93.9 Å²	93.9	63%	0.626	48%	0.475	S	S	*	.			trans	-49.8	113.4	159.1	-81.4	-175.7	167.9	0	0	106.6	E44 A48 K338	E44-E46 PolarHBondContact O-N 2.79Å; E46-A48 PolarHBondContact O-N 2.98Å; E46-K338 IonicContact OE2-NZ 2.82Å; E46-K338 PolarHBondContact OE2-NZ 2.76Å; E46-K338 VanDerWaalsContact OE2-NZ 3.12Å
47	L	55.1	Low	59.6	Low	141 Å²	141	92 Å²	92	74%	0.738	45%	0.453	S	S	*	.			trans	-54.4	123.9	177.3	-76.2	165.7	0	0	0	108	E45 E49	E45-L47 PolarHBondContact O-N 3.43Å; L47-E49 WeakPolarHBondContact O-CG 3.34Å; L47-E49 PolarHBondContact O-N 2.81Å
48	A	64.3	Low	61.9	Low	58 Å²	58	87.3 Å²	87.3	48%	0.479	44%	0.442	S	S	.	.			trans	-60.9	109.6	-179.9	0	0	0	0	0	110	E46	E46-A48 PolarHBondContact O-N 2.98Å
49	E	83.3	Confident	64.1	Low	67 Å²	67	80 Å²	80	31%	0.313	42%	0.415	S	S	.	.			trans	-92.7	128.2	175	-58.8	-160.9	144.3	0	0	109.5	L47 H51 T68 Q98	L47-E49 WeakPolarHBondContact O-CG 3.34Å; L47-E49 PolarHBondContact O-N 2.81Å; E49-H51 IonicContact OE2-NE2 2.87Å; E49-T68 WeakPolarHBondContact CA-OG1 3.34Å; E49-T68 HydrophobicContact CB-CG2 3.97Å; E49-T68 WeakPolarHBondContact CB-OG1 3.46Å; E49-T68 PolarHBondContact N-OG1 3.22Å; E49-T68 WeakPolarHBondContact O-CG2 3.41Å; E49-T68 PolarHBondContact O-N 2.87Å; E49-T68 PolarHBondContact O-OG1 2.9Å; E49-Q98 PolarHBondContact OE1-NE2 2.97Å; E49-Q98 PolarHBondContact OE1-OE1 3.11Å
50	I	88.1	Confident	66.7	Low	32 Å²	32	74.6 Å²	74.6	16%	0.164	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	124.1	177.7	-59.4	171.7	0	0	0	109.8	Y65 Y66 I95 P97 Q98	I50-Y65 HydrophobicContact CG2-CD2 3.61Å; I50-Y65 HydrophobicContact CG2-CE2 4.39Å; I50-Y65 HydrophobicContact CG2-CG 4.09Å; I50-Y66 WeakPolarHBondContact CA-O 3.07Å; I50-I95 HydrophobicContact CB-CG2 4.43Å; I50-I95 HydrophobicContact CD1-CG2 4.22Å; I50-I95 HydrophobicContact CG2-CG2 3.53Å; I50-P97 HydrophobicContact CG2-CB 4.42Å; I50-P97 CarbonylContact O-C 3.56Å; I50-P97 WeakPolarHBondContact O-CA 3.29Å; I50-Q98 PolarHBondContact O-N 2.83Å
51	H	90.4	Very high	69.3	Low	12 Å²	12	66.1 Å²	66.1	6%	0.056	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	115.1	176.6	-56.5	-78.6	0	0	0	110.1	E49 Y65 Y66 S99 L203 F206	E49-H51 IonicContact OE2-NE2 2.87Å; H51-Y65 CarbonylContact O-C 3.48Å; H51-Y65 WeakPolarHBondContact O-CA 3.24Å; H51-Y65 WeakPolarHBondContact O-CB 3.19Å; H51-Y66 PolarHBondContact N-O 2.86Å; H51-Y66 PolarHBondContact O-N 2.91Å; H51-S99 PolarHBondContact ND1-OG 3.03Å; H51-L203 HydrophobicContact CB-CD1 4.49Å; H51-L203 WeakPolarHBondContact O-CD1 3.47Å; H51-F206 HydrophobicContact CB-CD1 4.41Å; H51-F206 HydrophobicContact CB-CE1 3.9Å; H51-F206 AromaticContact CG-CE1 3.89Å; H51-F206 AromaticContact ND1-CE1 3.8Å
52	L	92.6	Very high	71.9	Confident	0 Å²	0	60.2 Å²	60.2	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	140	-177.3	-176.6	71.8	0	0	0	110.5	V54 I63 A64 Y65 V91 L92 I95 P97 S99 V100 V101	L52-V54 HydrophobicContact CD1-CG2 4.4Å; L52-V54 HydrophobicContact CD2-CG2 3.56Å; L52-V54 HydrophobicContact CG-CG2 3.66Å; L52-I63 HydrophobicContact CD1-CG2 3.43Å; L52-I63 VanDerWaalsContact CD1-CG2 3.43Å; L52-A64 CarbonylContact C-O 3.55Å; L52-Y65 HydrophobicContact CD1-CD1 4.39Å; L52-V91 HydrophobicContact CD1-CG1 4.43Å; L52-V91 HydrophobicContact CD2-CG1 4.41Å; L52-L92 HydrophobicContact CD2-CD2 3.51Å; L52-L92 HydrophobicContact CD2-CG 4.47Å; L52-I95 HydrophobicContact CD1-CD1 4.06Å; L52-P97 HydrophobicContact CB-CB 3.67Å; L52-P97 HydrophobicContact CB-CG 3.96Å; L52-P97 HydrophobicContact CD2-CG 3.97Å; L52-S99 PolarHBondContact N-O 3.42Å; L52-V100 HydrophobicContact CB-CG2 4.49Å; L52-V100 HydrophobicContact CD2-CG2 4.27Å; L52-V100 CarbonylContact O-C 3.55Å; L52-V100 WeakPolarHBondContact O-CA 3.38Å; L52-V101 PolarHBondContact O-N 2.66Å
53	C	92.5	Very high	74.6	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	130	168.6	-175.1	0	0	0	0	109.8	I63 A64 V101 A199 L203	C53-I63 WeakPolarHBondContact O-CA 2.92Å; C53-A64 PolarHBondContact N-O 3.27Å; C53-A64 PolarHBondContact O-N 3.44Å; C53-V101 CarbonylContact C-O 3.52Å; C53-V101 VanDerWaalsContact CA-O 3.29Å; C53-V101 WeakPolarHBondContact CA-O 3.16Å; C53-V101 HydrophobicContact CB-CB 4.24Å; C53-A199 PolarHBondContact SG-O 3.32Å; C53-L203 HydrophobicContact CB-CB 3.73Å; C53-L203 HydrophobicContact CB-CD1 4.13Å; C53-L203 HydrophobicContact CB-CG 4.45Å
54	V	91.4	Very high	77.1	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	134.3	-173.9	-174.9	0	0	0	0	110.8	L52 L61 I63 L88 V100 V101 T102 M110	L52-V54 HydrophobicContact CD1-CG2 4.4Å; L52-V54 HydrophobicContact CD2-CG2 3.56Å; L52-V54 HydrophobicContact CG-CG2 3.66Å; V54-L61 HydrophobicContact CG1-CD1 3.64Å; V54-I63 HydrophobicContact CG1-CG1 4.35Å; V54-I63 HydrophobicContact CG2-CG1 4.38Å; V54-L88 HydrophobicContact CB-CD1 4.35Å; V54-L88 HydrophobicContact CG1-CD1 3.58Å; V54-L88 HydrophobicContact CG1-CD2 3.96Å; V54-L88 HydrophobicContact CG1-CG 4.42Å; V54-L88 HydrophobicContact CG2-CD1 3.87Å; V54-V100 HydrophobicContact CG2-CG1 4.22Å; V54-V101 PolarHBondContact N-O 2.72Å; V54-T102 WeakPolarHBondContact O-CB 3.12Å; V54-T102 PolarHBondContact O-OG1 3.5Å; V54-M110 HydrophobicContact CG1-CE 4.15Å
55	L	87.9	Confident	79.6	Confident	15 Å²	15	41.2 Å²	41.2	8%	0.079	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	132.7	168.9	-68.5	172	0	0	0	109.9	G62 F138 R198 A199	L55-G62 PolarHBondContact N-O 3.38Å; L55-G62 PolarHBondContact O-N 3.36Å; L55-F138 HydrophobicContact CD1-CB 4.24Å; L55-F138 HydrophobicContact CD1-CD1 3.67Å; L55-F138 HydrophobicContact CD1-CE1 4.39Å; L55-F138 HydrophobicContact CD1-CG 4.29Å; L55-F138 HydrophobicContact CD2-CD1 3.77Å; L55-F138 HydrophobicContact CD2-CE1 4.01Å; L55-F138 HydrophobicContact CD2-CG 4.1Å; L55-F138 HydrophobicContact CG-CD1 4.02Å; L55-F138 HydrophobicContact CG-CE1 4.31Å; L55-R198 HydrophobicContact CD1-CB 3.3Å; L55-A199 HydrophobicContact CD1-CB 4.33Å
56	W	85.4	Confident	81.9	Confident	24 Å²	24	34.6 Å²	34.6	9%	0.091	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	129.7	167.9	-178.7	64.2	0	0	0	108.4	Y60 L61 L85 D107 N109 M110	W56-Y60 WeakPolarHBondContact CA-O 3.17Å; W56-Y60 VanDerWaalsContact CD1-O 3.32Å; W56-L61 HydrophobicContact CB-CD1 4.05Å; W56-L85 HydrophobicContact CB-CD2 4.46Å; W56-L85 HydrophobicContact CD2-CD2 3.8Å; W56-L85 HydrophobicContact CE3-CD2 4.42Å; W56-L85 HydrophobicContact CG-CD2 3.82Å; W56-L85 HydrophobicContact CZ2-CD2 4.5Å; W56-D107 HydrophobicContact CE3-CB 3.69Å; W56-D107 HydrophobicContact CZ3-CB 3.44Å; W56-D107 VanDerWaalsContact CZ3-CB 3.44Å; W56-N109 HydrophobicContact CH2-CB 3.82Å; W56-N109 HydrophobicContact CZ3-CB 3.63Å; W56-M110 HydrophobicContact CB-CE 3.18Å; W56-M110 HydrophobicContact CE3-CB 4.1Å; W56-M110 HydrophobicContact CG-CE 4.14Å
57	N	79.1	Confident	83.8	Confident	43 Å²	43	29.5 Å²	29.5	23%	0.23	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	129.2	178.9	179.6	22.7	0	0	0	109.3	G59 Y60	N57-G59 PolarHBondContact O-N 3.47Å; N57-G59 VanDerWaalsContact O-N 3.16Å; N57-Y60 PolarHBondContact N-O 3.25Å; N57-Y60 PolarHBondContact O-N 3.32Å
58	S	73.9	Confident	85.1	Confident	95 Å²	95	23.6 Å²	23.6	66%	0.664	14%	0.139	S	C	*	.	T	Hydrogen-bonded Turn	trans	55	35.4	172.4	-52.8	0	0	0	0	113.8	Y60	S58-Y60 WeakPolarHBondContact O-CD2 3.47Å
59	G	73.2	Confident	85.7	Confident	26 Å²	26	22 Å²	22	27%	0.268	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	-1.5	-179.7	0	0	0	0	0	115.7	N57 D81	N57-G59 PolarHBondContact O-N 3.47Å; N57-G59 VanDerWaalsContact O-N 3.16Å; G59-D81 PolarHBondContact O-N 3.25Å
60	Y	80.3	Confident	85.4	Confident	62 Å²	62	19.1 Å²	19.1	24%	0.243	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	140.7	178.2	-70.1	-97.4	0	0	0	111.6	W56 N57 S58 D78 A79 P80 L178 L192	W56-Y60 WeakPolarHBondContact CA-O 3.17Å; W56-Y60 VanDerWaalsContact CD1-O 3.32Å; N57-Y60 PolarHBondContact N-O 3.25Å; N57-Y60 PolarHBondContact O-N 3.32Å; S58-Y60 WeakPolarHBondContact O-CD2 3.47Å; Y60-D78 HydrophobicContact CD1-CB 4.39Å; Y60-A79 WeakPolarHBondContact CA-O 3.47Å; Y60-P80 HydrophobicContact CD1-CB 4.44Å; Y60-P80 HydrophobicContact CE1-CB 4.22Å; Y60-L178 HydrophobicContact CE1-CD1 4.27Å; Y60-L192 HydrophobicContact CD1-CD2 3.7Å; Y60-L192 HydrophobicContact CD2-CD1 3.89Å; Y60-L192 HydrophobicContact CD2-CD2 3.86Å; Y60-L192 HydrophobicContact CD2-CG 4.21Å; Y60-L192 HydrophobicContact CE1-CD1 4.46Å; Y60-L192 HydrophobicContact CE1-CD2 3.85Å; Y60-L192 HydrophobicContact CE2-CD1 3.46Å; Y60-L192 VanDerWaalsContact CE2-CD1 3.46Å; Y60-L192 HydrophobicContact CE2-CD2 4.03Å; Y60-L192 HydrophobicContact CE2-CG 4.24Å; Y60-L192 HydrophobicContact CG-CD2 3.69Å
61	L	84.3	Confident	85.1	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	121.5	-178	-171.2	68.6	0	0	0	109.9	V54 W56 I63 M76 A79 D81 L87 L88 M110	V54-L61 HydrophobicContact CG1-CD1 3.64Å; W56-L61 HydrophobicContact CB-CD1 4.05Å; L61-I63 HydrophobicContact CD2-CD1 3.45Å; L61-I63 VanDerWaalsContact CD2-CD1 3.45Å; L61-I63 HydrophobicContact CD2-CG1 4.18Å; L61-I63 HydrophobicContact CG-CD1 3.79Å; L61-I63 HydrophobicContact CG-CG1 3.97Å; L61-M76 HydrophobicContact CD2-CE 4.46Å; L61-A79 PolarHBondContact N-O 3.31Å; L61-A79 PolarHBondContact O-N 3.16Å; L61-D81 HydrophobicContact CB-CB 4.22Å; L61-L87 HydrophobicContact CD2-CB 4.33Å; L61-L87 HydrophobicContact CD2-CD2 4.18Å; L61-L87 HydrophobicContact CD2-CG 4.2Å; L61-L88 HydrophobicContact CD1-CB 4.34Å; L61-L88 HydrophobicContact CD1-CD1 4.49Å; L61-L88 HydrophobicContact CD1-CD2 4.42Å; L61-L88 HydrophobicContact CD2-CB 3.78Å; L61-L88 HydrophobicContact CD2-CD1 4.42Å; L61-M110 HydrophobicContact CD1-CE 4.33Å
62	G	86.3	Confident	84.8	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	126.1	171.1	0	0	0	0	0	110.5	L55	L55-G62 PolarHBondContact N-O 3.38Å; L55-G62 PolarHBondContact O-N 3.36Å
63	I	89.4	Confident	84.7	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	136	-176.4	-68.6	164.5	0	0	0	110.7	L52 C53 V54 L61 F75 M76 L88 V91 F231	L52-I63 HydrophobicContact CD1-CG2 3.43Å; L52-I63 VanDerWaalsContact CD1-CG2 3.43Å; C53-I63 WeakPolarHBondContact O-CA 2.92Å; V54-I63 HydrophobicContact CG1-CG1 4.35Å; V54-I63 HydrophobicContact CG2-CG1 4.38Å; L61-I63 HydrophobicContact CD2-CD1 3.45Å; L61-I63 VanDerWaalsContact CD2-CD1 3.45Å; L61-I63 HydrophobicContact CD2-CG1 4.18Å; L61-I63 HydrophobicContact CG-CD1 3.79Å; L61-I63 HydrophobicContact CG-CG1 3.97Å; I63-F75 WeakPolarHBondContact O-CA 3.5Å; I63-M76 HydrophobicContact CB-CB 4.22Å; I63-M76 HydrophobicContact CB-CE 4.38Å; I63-M76 HydrophobicContact CD1-CE 3.54Å; I63-M76 HydrophobicContact CG1-CE 4.26Å; I63-M76 PolarHBondContact O-N 3.43Å; I63-L88 HydrophobicContact CD1-CD1 4.46Å; I63-V91 HydrophobicContact CD1-CB 4.01Å; I63-V91 HydrophobicContact CD1-CG1 3.74Å; I63-V91 HydrophobicContact CD1-CG2 3.44Å; I63-V91 VanDerWaalsContact CD1-CG2 3.44Å; I63-V91 HydrophobicContact CG2-CG1 4.22Å; I63-F231 HydrophobicContact CG2-CE1 4.33Å; I63-F231 HydrophobicContact CG2-CZ 3.87Å
64	A	91.6	Very high	84.5	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	142.7	166.2	0	0	0	0	0	110.3	L52 C53 H74 F75 A199 L200 L203	L52-A64 CarbonylContact C-O 3.55Å; C53-A64 PolarHBondContact N-O 3.27Å; C53-A64 PolarHBondContact O-N 3.44Å; A64-H74 CarbonylContact C-O 3.47Å; A64-H74 WeakPolarHBondContact CA-O 3.46Å; A64-F75 HydrophobicContact CB-CB 4.26Å; A64-A199 HydrophobicContact CB-CB 4.38Å; A64-L200 HydrophobicContact CB-CD2 3.79Å; A64-L200 HydrophobicContact CB-CG 3.93Å; A64-L203 HydrophobicContact CB-CD2 3.89Å
65	Y	92.3	Very high	84.4	Confident	12 Å²	12	18.1 Å²	18.1	5%	0.047	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	154	171.5	69	-92	0	0	0	112.3	I50 H51 L52 D67 I73 H74 I95 F231	I50-Y65 HydrophobicContact CG2-CD2 3.61Å; I50-Y65 HydrophobicContact CG2-CE2 4.39Å; I50-Y65 HydrophobicContact CG2-CG 4.09Å; H51-Y65 CarbonylContact O-C 3.48Å; H51-Y65 WeakPolarHBondContact O-CA 3.24Å; H51-Y65 WeakPolarHBondContact O-CB 3.19Å; L52-Y65 HydrophobicContact CD1-CD1 4.39Å; Y65-D67 HydrophobicContact CE2-CB 4.47Å; Y65-I73 CarbonylContact O-C 3.6Å; Y65-I73 WeakPolarHBondContact O-CA 3.21Å; Y65-H74 HydrophobicContact CD1-CB 3.66Å; Y65-H74 HydrophobicContact CD2-CB 3.98Å; Y65-H74 HydrophobicContact CE1-CB 3.24Å; Y65-H74 AromaticContact CE1-CG 3.93Å; Y65-H74 HydrophobicContact CE2-CB 3.58Å; Y65-H74 AromaticContact CE2-CG 3.52Å; Y65-H74 AromaticContact CE2-ND1 3.38Å; Y65-H74 WeakPolarHBondContact CE2-ND1 3.24Å; Y65-H74 HydrophobicContact CG-CB 4.03Å; Y65-H74 AromaticContact CZ-CD2 3.87Å; Y65-H74 AromaticContact CZ-CG 3.31Å; Y65-H74 AromaticContact CZ-ND1 3.69Å; Y65-H74 PolarHBondContact N-O 3.14Å; Y65-H74 PolarHBondContact O-N 3.24Å; Y65-H74 PolarHBondContact OH-CD2 3.14Å; Y65-H74 VanDerWaalsContact OH-CD2 3.32Å; Y65-H74 VanDerWaalsContact OH-CG 3.27Å; Y65-I95 HydrophobicContact CD1-CD1 3.49Å; Y65-I95 VanDerWaalsContact CD1-CD1 3.49Å; Y65-I95 HydrophobicContact CE1-CD1 3.54Å; Y65-I95 HydrophobicContact CE1-CG1 4.27Å; Y65-I95 HydrophobicContact CG-CD1 4.29Å; Y65-I95 HydrophobicContact CG-CG2 4.45Å; Y65-F231 HydrophobicContact CD1-CD1 4.44Å; Y65-F231 AromaticContact CD1-CE1 3.74Å; Y65-F231 HydrophobicContact CD1-CE1 3.74Å; Y65-F231 HydrophobicContact CD1-CZ 4.12Å; Y65-F231 AromaticContact CE1-CD1 3.8Å; Y65-F231 HydrophobicContact CE1-CD1 3.8Å; Y65-F231 AromaticContact CE1-CE1 3.49Å; Y65-F231 HydrophobicContact CE1-CE1 3.49Å; Y65-F231 VanDerWaalsContact CE1-CE1 3.49Å; Y65-F231 HydrophobicContact CE1-CG 4.43Å; Y65-F231 AromaticContact CE1-CZ 3.89Å; Y65-F231 HydrophobicContact CE1-CZ 3.89Å
66	Y	90.6	Very high	84.2	Confident	2 Å²	2	17.6 Å²	17.6	1%	0.008	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	128	174.4	177.8	-111.3	0	0	0	109.3	I50 H51 T68 S71 T72 I73 L207 I212 V223 P224	I50-Y66 WeakPolarHBondContact CA-O 3.07Å; H51-Y66 PolarHBondContact N-O 2.86Å; H51-Y66 PolarHBondContact O-N 2.91Å; Y66-T68 HydrophobicContact CD1-CG2 4.09Å; Y66-T68 HydrophobicContact CE1-CG2 3.75Å; Y66-S71 PolarHBondContact OH-OG 3.03Å; Y66-T72 WeakPolarHBondContact CD2-O 3.33Å; Y66-I73 HydrophobicContact CD2-CG1 3.78Å; Y66-L207 HydrophobicContact CD1-CD1 4.2Å; Y66-L207 HydrophobicContact CD1-CD2 3.49Å; Y66-L207 VanDerWaalsContact CD1-CD2 3.49Å; Y66-L207 HydrophobicContact CD2-CD1 4Å; Y66-L207 HydrophobicContact CE1-CD2 4.15Å; Y66-L207 HydrophobicContact CG-CD1 3.77Å; Y66-L207 HydrophobicContact CG-CD2 3.83Å; Y66-L207 HydrophobicContact CG-CG 4.46Å; Y66-I212 HydrophobicContact CE1-CG2 4.38Å; Y66-V223 HydrophobicContact CE1-CG1 4.31Å; Y66-P224 PolarHBondContact OH-O 2.89Å
67	D	87.3	Confident	84	Confident	27 Å²	27	17.5 Å²	17.5	14%	0.144	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	115.7	174.1	-175	-22.4	0	0	0	108.7	Y65 S69 S71 T72	Y65-D67 HydrophobicContact CE2-CB 4.47Å; D67-S69 PolarHBondContact O-N 3.05Å; D67-S69 VanDerWaalsContact OD1-CB 3.28Å; D67-S69 WeakPolarHBondContact OD1-CB 3.37Å; D67-S69 PolarHBondContact OD1-N 3.46Å; D67-S69 PolarHBondContact OD1-OG 3.45Å; D67-S69 PolarHBondContact OD2-OG 3.26Å; D67-S71 VanDerWaalsContact O-CA 3.23Å; D67-S71 WeakPolarHBondContact O-CA 3.5Å; D67-S71 PolarHBondContact O-N 3.13Å; D67-T72 PolarHBondContact N-O 3.16Å; D67-T72 VanDerWaalsContact N-O 3.1Å; D67-T72 PolarHBondContact O-N 3.4Å
68	T	83.1	Confident	84	Confident	17 Å²	17	16.1 Å²	16.1	10%	0.104	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-23.6	-179.1	50.7	0	0	0	0	113.2	E49 Y66 I212	E49-T68 WeakPolarHBondContact CA-OG1 3.34Å; E49-T68 HydrophobicContact CB-CG2 3.97Å; E49-T68 WeakPolarHBondContact CB-OG1 3.46Å; E49-T68 PolarHBondContact N-OG1 3.22Å; E49-T68 WeakPolarHBondContact O-CG2 3.41Å; E49-T68 PolarHBondContact O-N 2.87Å; E49-T68 PolarHBondContact O-OG1 2.9Å; Y66-T68 HydrophobicContact CD1-CG2 4.09Å; Y66-T68 HydrophobicContact CE1-CG2 3.75Å; T68-I212 HydrophobicContact CG2-CG2 3.67Å
69	S	76	Confident	84	Confident	24 Å²	24	12.5 Å²	12.5	17%	0.168	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-33.3	-175.6	74.1	0	0	0	0	112.8	D67	D67-S69 PolarHBondContact O-N 3.05Å; D67-S69 VanDerWaalsContact OD1-CB 3.28Å; D67-S69 WeakPolarHBondContact OD1-CB 3.37Å; D67-S69 PolarHBondContact OD1-N 3.46Å; D67-S69 PolarHBondContact OD1-OG 3.45Å; D67-S69 PolarHBondContact OD2-OG 3.26Å
70	D	77	Confident	84.1	Confident	8 Å²	8	15.7 Å²	15.7	4%	0.043	9%	0.09	C	C	.	.	T	Hydrogen-bonded Turn	trans	-113.9	-2.8	177.6	87.3	-16.2	0	0	0	113.4	T72 K229 W282 P334	D70-T72 HydrophobicContact CB-CG2 4.42Å; D70-T72 WeakPolarHBondContact O-CG2 3.34Å; D70-T72 PolarHBondContact O-N 3.2Å; D70-T72 VanDerWaalsContact OD1-CB 3.3Å; D70-T72 WeakPolarHBondContact OD1-CB 3.44Å; D70-T72 PolarHBondContact OD1-N 2.83Å; D70-T72 PolarHBondContact OD1-OG1 2.98Å; D70-T72 WeakPolarHBondContact OD2-CG2 3.39Å; D70-T72 PolarHBondContact OD2-OG1 3.15Å; D70-K229 IonicContact OD2-NZ 2.97Å; D70-K229 PolarHBondContact OD2-NZ 3.34Å; D70-W282 HydrophobicContact CB-CH2 3.62Å; D70-W282 HydrophobicContact CB-CZ3 4.44Å; D70-P334 HydrophobicContact CB-CB 4.35Å; D70-P334 HydrophobicContact CB-CG 4.5Å
71	S	83.2	Confident	83.8	Confident	1 Å²	1	13.5 Å²	13.5	1%	0.007	8%	0.082	C	C	.	.	T	Hydrogen-bonded Turn	trans	53	34.5	-178.2	-58.5	0	0	0	0	112.6	Y66 D67 I225 L226	Y66-S71 PolarHBondContact OH-OG 3.03Å; D67-S71 VanDerWaalsContact O-CA 3.23Å; D67-S71 WeakPolarHBondContact O-CA 3.5Å; D67-S71 PolarHBondContact O-N 3.13Å; S71-I225 WeakPolarHBondContact O-CA 3.49Å; S71-L226 PolarHBondContact O-N 3.25Å
72	T	84.4	Confident	83.2	Confident	3 Å²	3	20 Å²	20	2%	0.018	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	149.8	176.9	72.3	0	0	0	0	112.6	Y66 D67 D70 H74 L226 G227	Y66-T72 WeakPolarHBondContact CD2-O 3.33Å; D67-T72 PolarHBondContact N-O 3.16Å; D67-T72 VanDerWaalsContact N-O 3.1Å; D67-T72 PolarHBondContact O-N 3.4Å; D70-T72 HydrophobicContact CB-CG2 4.42Å; D70-T72 WeakPolarHBondContact O-CG2 3.34Å; D70-T72 PolarHBondContact O-N 3.2Å; D70-T72 VanDerWaalsContact OD1-CB 3.3Å; D70-T72 WeakPolarHBondContact OD1-CB 3.44Å; D70-T72 PolarHBondContact OD1-N 2.83Å; D70-T72 PolarHBondContact OD1-OG1 2.98Å; D70-T72 WeakPolarHBondContact OD2-CG2 3.39Å; D70-T72 PolarHBondContact OD2-OG1 3.15Å; T72-H74 PolarHBondContact OG1-CE1 3.26Å; T72-H74 PolarHBondContact OG1-ND1 3.35Å; T72-L226 HydrophobicContact CG2-CB 4.44Å; T72-G227 WeakPolarHBondContact CA-O 3.38Å
73	I	88.9	Confident	82.6	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	121.4	173.6	-65.2	174.7	0	0	0	108.5	Y65 Y66 L200 L203 L204 L207 I225 G227 F228 K229	Y65-I73 CarbonylContact O-C 3.6Å; Y65-I73 WeakPolarHBondContact O-CA 3.21Å; Y66-I73 HydrophobicContact CD2-CG1 3.78Å; I73-L200 HydrophobicContact CG2-CD2 3.46Å; I73-L200 VanDerWaalsContact CG2-CD2 3.46Å; I73-L203 HydrophobicContact CG2-CD2 3.96Å; I73-L204 HydrophobicContact CD1-CD2 3.56Å; I73-L204 HydrophobicContact CD1-CG 4.41Å; I73-L207 HydrophobicContact CD1-CD1 4.34Å; I73-I225 HydrophobicContact CD1-CD1 3.78Å; I73-I225 HydrophobicContact CD1-CG1 4.17Å; I73-I225 HydrophobicContact CD1-CG2 3.99Å; I73-I225 HydrophobicContact CG1-CG2 4.21Å; I73-G227 PolarHBondContact N-O 3.12Å; I73-F228 HydrophobicContact CB-CD1 3.72Å; I73-F228 HydrophobicContact CB-CE1 3.85Å; I73-F228 HydrophobicContact CD1-CE1 3.77Å; I73-F228 HydrophobicContact CD1-CZ 4.31Å; I73-F228 HydrophobicContact CG1-CE1 4.37Å; I73-F228 HydrophobicContact CG2-CD1 3.83Å; I73-F228 HydrophobicContact CG2-CE1 3.89Å; I73-F228 CarbonylContact O-C 3.53Å; I73-F228 VanDerWaalsContact O-CA 3.27Å; I73-F228 WeakPolarHBondContact O-CA 3.38Å; I73-K229 PolarHBondContact O-N 2.79Å
74	H	89	Confident	81.7	Confident	22 Å²	22	30.7 Å²	30.7	10%	0.102	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	138.4	173.3	-67.4	81.4	0	0	0	109.9	A64 Y65 T72 K229 F231	A64-H74 CarbonylContact C-O 3.47Å; A64-H74 WeakPolarHBondContact CA-O 3.46Å; Y65-H74 HydrophobicContact CD1-CB 3.66Å; Y65-H74 HydrophobicContact CD2-CB 3.98Å; Y65-H74 HydrophobicContact CE1-CB 3.24Å; Y65-H74 AromaticContact CE1-CG 3.93Å; Y65-H74 HydrophobicContact CE2-CB 3.58Å; Y65-H74 AromaticContact CE2-CG 3.52Å; Y65-H74 AromaticContact CE2-ND1 3.38Å; Y65-H74 WeakPolarHBondContact CE2-ND1 3.24Å; Y65-H74 HydrophobicContact CG-CB 4.03Å; Y65-H74 AromaticContact CZ-CD2 3.87Å; Y65-H74 AromaticContact CZ-CG 3.31Å; Y65-H74 AromaticContact CZ-ND1 3.69Å; Y65-H74 PolarHBondContact N-O 3.14Å; Y65-H74 PolarHBondContact O-N 3.24Å; Y65-H74 PolarHBondContact OH-CD2 3.14Å; Y65-H74 VanDerWaalsContact OH-CD2 3.32Å; Y65-H74 VanDerWaalsContact OH-CG 3.27Å; T72-H74 PolarHBondContact OG1-CE1 3.26Å; T72-H74 PolarHBondContact OG1-ND1 3.35Å; H74-K229 CarbonylContact C-O 3.56Å; H74-K229 WeakPolarHBondContact CA-O 3.47Å; H74-K229 VanDerWaalsContact NE2-CD 3.34Å; H74-K229 WeakPolarHBondContact NE2-CD 3.3Å; H74-F231 HydrophobicContact CB-CD1 3.96Å; H74-F231 HydrophobicContact CB-CE1 4.33Å
75	F	89.1	Confident	81.1	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	147.6	177.1	70.9	-81.7	0	0	0	112.1	I63 A64 I171 I172 L200 F228 K229 K230 F231	I63-F75 WeakPolarHBondContact O-CA 3.5Å; A64-F75 HydrophobicContact CB-CB 4.26Å; F75-I171 HydrophobicContact CE1-CG2 4.45Å; F75-I171 WeakPolarHBondContact CZ-O 3.48Å; F75-I172 HydrophobicContact CD1-CG1 4.46Å; F75-I172 HydrophobicContact CE1-CG1 3.85Å; F75-I172 HydrophobicContact CE2-CG1 4.34Å; F75-I172 HydrophobicContact CZ-CB 4.45Å; F75-I172 HydrophobicContact CZ-CG1 3.79Å; F75-L200 HydrophobicContact CB-CD1 4.11Å; F75-L200 HydrophobicContact CB-CD2 3.94Å; F75-L200 HydrophobicContact CB-CG 4.07Å; F75-L200 HydrophobicContact CD2-CD1 4.36Å; F75-L200 HydrophobicContact CG-CD1 4.09Å; F75-L200 HydrophobicContact CG-CD2 4.47Å; F75-F228 HydrophobicContact CE1-CB 4.2Å; F75-K229 WeakPolarHBondContact CD1-O 3.48Å; F75-K229 PolarHBondContact N-O 2.92Å; F75-K230 HydrophobicContact CE1-CB 4.3Å; F75-K230 HydrophobicContact CE2-CB 4.46Å; F75-K230 HydrophobicContact CE2-CG 4.49Å; F75-K230 HydrophobicContact CZ-CB 4.01Å; F75-K230 HydrophobicContact CZ-CG 4.5Å; F75-K230 WeakPolarHBondContact O-CA 3.35Å; F75-F231 VanDerWaalsContact C-CD1 3.44Å; F75-F231 WeakPolarHBondContact O-CD1 3.41Å; F75-F231 PolarHBondContact O-N 3.02Å
76	M	84.5	Confident	80.2	Confident	4 Å²	4	35.2 Å²	35.2	2%	0.02	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.7	174	-166.2	174.6	68.8	0	0	108.6	L61 I63 A79 L87 Q196 F231 L233	L61-M76 HydrophobicContact CD2-CE 4.46Å; I63-M76 HydrophobicContact CB-CB 4.22Å; I63-M76 HydrophobicContact CB-CE 4.38Å; I63-M76 HydrophobicContact CD1-CE 3.54Å; I63-M76 HydrophobicContact CG1-CE 4.26Å; I63-M76 PolarHBondContact O-N 3.43Å; M76-A79 HydrophobicContact CE-CB 3.9Å; M76-L87 HydrophobicContact CE-CD2 3.99Å; M76-Q196 WeakPolarHBondContact O-CB 3.2Å; M76-F231 WeakPolarHBondContact CA-O 3.14Å; M76-F231 HydrophobicContact CB-CD1 4.36Å; M76-F231 HydrophobicContact CB-CE1 3.86Å; M76-F231 HydrophobicContact CB-CE2 4.12Å; M76-F231 HydrophobicContact CB-CZ 3.74Å; M76-F231 HydrophobicContact CG-CE2 4.44Å; M76-F231 HydrophobicContact SD-CE2 4.21Å; M76-L233 HydrophobicContact SD-CD1 4.34Å; M76-L233 HydrophobicContact SD-CG 4.2Å
77	P	80.6	Confident	79.6	Confident	22 Å²	22	36.7 Å²	36.7	14%	0.143	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.9	157.5	168.8	-19.1	29.5	0	0	0	111.8	A79 K230 M232	P77-A79 PolarHBondContact O-N 3.2Å; P77-K230 HydrophobicContact CG-CD 4.24Å; P77-K230 HydrophobicContact CG-CG 4.24Å; P77-M232 HydrophobicContact CB-SD 4.43Å; P77-M232 VanDerWaalsContact CD-SD 3.5Å; P77-M232 HydrophobicContact CG-CE 4.08Å; P77-M232 HydrophobicContact CG-SD 3.64Å
78	D	78.4	Confident	79.4	Confident	13 Å²	13	35.6 Å²	35.6	7%	0.07	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	114.5	179.3	-74.1	-16.2	0	0	0	111.2	Y60 L192 P194 S195 Q196	Y60-D78 HydrophobicContact CD1-CB 4.39Å; D78-L192 HydrophobicContact CB-CD2 4.45Å; D78-P194 WeakPolarHBondContact OD2-CA 3.39Å; D78-S195 WeakPolarHBondContact OD1-CA 3.24Å; D78-S195 VanDerWaalsContact OD1-CB 3.32Å; D78-S195 WeakPolarHBondContact OD1-CB 3.41Å; D78-S195 PolarHBondContact OD1-N 2.59Å; D78-S195 PolarHBondContact OD2-N 2.71Å; D78-Q196 WeakPolarHBondContact OD1-CB 3.39Å; D78-Q196 PolarHBondContact OD1-N 2.8Å
79	A	74.3	Confident	79.3	Confident	20 Å²	20	37 Å²	37	17%	0.165	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	137.3	-179.6	0	0	0	0	0	109.5	Y60 L61 M76 P77 D81 L87	Y60-A79 WeakPolarHBondContact CA-O 3.47Å; L61-A79 PolarHBondContact N-O 3.31Å; L61-A79 PolarHBondContact O-N 3.16Å; M76-A79 HydrophobicContact CE-CB 3.9Å; P77-A79 PolarHBondContact O-N 3.2Å; A79-D81 PolarHBondContact O-N 3.31Å; A79-L87 HydrophobicContact CB-CD2 3.57Å
80	P	74.8	Confident	79.2	Confident	93 Å²	93	38.8 Å²	38.8	60%	0.604	20%	0.2	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-65.7	134.6	172.8	28.3	-33.2	0	0	0	109.7	Y60	Y60-P80 HydrophobicContact CD1-CB 4.44Å; Y60-P80 HydrophobicContact CE1-CB 4.22Å
81	D	73.8	Confident	79.4	Confident	15 Å²	15	38.4 Å²	38.4	8%	0.08	20%	0.198	C	C	.	.			trans	-125.9	150.2	171.4	-161.1	-2	0	0	0	109.8	G59 L61 A79 L85 K86 L87 L88	G59-D81 PolarHBondContact O-N 3.25Å; L61-D81 HydrophobicContact CB-CB 4.22Å; A79-D81 PolarHBondContact O-N 3.31Å; D81-L85 VanDerWaalsContact OD2-CA 3.26Å; D81-L85 WeakPolarHBondContact OD2-CA 3.14Å; D81-K86 PolarHBondContact OD1-N 2.73Å; D81-K86 VanDerWaalsContact OD1-N 3.17Å; D81-L87 HydrophobicContact CB-CB 4.1Å; D81-L87 WeakPolarHBondContact OD1-CB 3.36Å; D81-L87 PolarHBondContact OD1-N 3Å; D81-L87 WeakPolarHBondContact OD2-CB 3.42Å; D81-L87 PolarHBondContact OD2-N 2.91Å; D81-L88 PolarHBondContact OD2-N 3.27Å; D81-L88 VanDerWaalsContact OD2-N 3.08Å
82	H	72.7	Confident	79.4	Confident	137 Å²	137	39 Å²	39	63%	0.634	20%	0.202	S	C	*	.			trans	-74.6	162.4	176.8	-65.7	-64.3	0	0	0	110.6	S84 L85	H82-S84 PolarHBondContact O-N 3.38Å; H82-L85 PolarHBondContact O-N 3.01Å
83	E	72.9	Confident	79	Confident	152 Å²	152	42.8 Å²	42.8	71%	0.71	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-19.9	176.4	-64.3	-176.4	167.8	0	0	114	L85	E83-L85 VanDerWaalsContact C-N 3.31Å
84	S	70.3	Confident	78.3	Confident	72 Å²	72	44.5 Å²	44.5	50%	0.503	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-2.6	175.1	50.6	0	0	0	0	114.3	H82 K86	H82-S84 PolarHBondContact O-N 3.38Å; S84-K86 VanDerWaalsContact C-N 3.32Å; S84-K86 PolarHBondContact O-N 3.22Å
85	L	79.8	Confident	77.8	Confident	1 Å²	1	44 Å²	44	1%	0.005	23%	0.227	C	C	.	.			trans	52.8	45	178.3	-63.1	175.2	0	0	0	113.4	W56 D81 H82 E83 L88 Q89 M110 F113	W56-L85 HydrophobicContact CB-CD2 4.46Å; W56-L85 HydrophobicContact CD2-CD2 3.8Å; W56-L85 HydrophobicContact CE3-CD2 4.42Å; W56-L85 HydrophobicContact CG-CD2 3.82Å; W56-L85 HydrophobicContact CZ2-CD2 4.5Å; D81-L85 VanDerWaalsContact OD2-CA 3.26Å; D81-L85 WeakPolarHBondContact OD2-CA 3.14Å; H82-L85 PolarHBondContact O-N 3.01Å; E83-L85 VanDerWaalsContact C-N 3.31Å; L85-L88 HydrophobicContact CB-CB 4.17Å; L85-L88 HydrophobicContact CD1-CD2 4.35Å; L85-L88 PolarHBondContact O-N 2.87Å; L85-Q89 PolarHBondContact O-N 2.84Å; L85-M110 HydrophobicContact CD1-CB 4.21Å; L85-M110 HydrophobicContact CD1-CE 3.92Å; L85-M110 HydrophobicContact CD1-SD 3.94Å; L85-M110 HydrophobicContact CD2-CE 4.41Å; L85-F113 HydrophobicContact CB-CD2 4.05Å; L85-F113 HydrophobicContact CB-CE2 4.35Å; L85-F113 HydrophobicContact CB-CG 4.24Å; L85-F113 HydrophobicContact CD1-CB 3.7Å; L85-F113 HydrophobicContact CD1-CD1 4.22Å; L85-F113 HydrophobicContact CD1-CD2 4.49Å; L85-F113 HydrophobicContact CD1-CG 3.9Å
86	K	73.8	Confident	77.3	Confident	106 Å²	106	48.1 Å²	48.1	46%	0.461	25%	0.249	S	C	.	.	H	α-helix	trans	-68.4	-36.9	-177.8	-72.5	-172.8	-179.3	-167.8	0	111.5	D81 S84 Q89 R90 N678	D81-K86 PolarHBondContact OD1-N 2.73Å; D81-K86 VanDerWaalsContact OD1-N 3.17Å; S84-K86 VanDerWaalsContact C-N 3.32Å; S84-K86 PolarHBondContact O-N 3.22Å; K86-Q89 PolarHBondContact O-N 3.2Å; K86-R90 PolarHBondContact O-N 2.78Å; K86-N678 PolarHBondContact NZ-OD1 2.85Å
87	L	77.1	Confident	77.5	Confident	34 Å²	34	48.1 Å²	48.1	18%	0.178	25%	0.25	C	C	.	.	H	α-helix	trans	-66.2	-43.5	177.1	-176.9	64.7	0	0	0	110.2	L61 M76 A79 D81 Q89 R90 V91 L233	L61-L87 HydrophobicContact CD2-CB 4.33Å; L61-L87 HydrophobicContact CD2-CD2 4.18Å; L61-L87 HydrophobicContact CD2-CG 4.2Å; M76-L87 HydrophobicContact CE-CD2 3.99Å; A79-L87 HydrophobicContact CB-CD2 3.57Å; D81-L87 HydrophobicContact CB-CB 4.1Å; D81-L87 WeakPolarHBondContact OD1-CB 3.36Å; D81-L87 PolarHBondContact OD1-N 3Å; D81-L87 WeakPolarHBondContact OD2-CB 3.42Å; D81-L87 PolarHBondContact OD2-N 2.91Å; L87-Q89 PolarHBondContact O-N 2.85Å; L87-R90 WeakPolarHBondContact O-CB 3.44Å; L87-R90 PolarHBondContact O-N 2.78Å; L87-V91 WeakPolarHBondContact O-CG2 3.46Å; L87-V91 PolarHBondContact O-N 2.86Å; L87-L233 HydrophobicContact CD1-CB 4.3Å; L87-L233 HydrophobicContact CD1-CD1 3.85Å
88	L	82.6	Confident	77.8	Confident	3 Å²	3	50.8 Å²	50.8	2%	0.016	26%	0.26	C	S	.	.	H	α-helix	trans	-61.3	-43.7	175.5	179.3	56	0	0	0	112.8	V54 L61 I63 D81 L85 R90 V91 L92 M110 F113	V54-L88 HydrophobicContact CB-CD1 4.35Å; V54-L88 HydrophobicContact CG1-CD1 3.58Å; V54-L88 HydrophobicContact CG1-CD2 3.96Å; V54-L88 HydrophobicContact CG1-CG 4.42Å; V54-L88 HydrophobicContact CG2-CD1 3.87Å; L61-L88 HydrophobicContact CD1-CB 4.34Å; L61-L88 HydrophobicContact CD1-CD1 4.49Å; L61-L88 HydrophobicContact CD1-CD2 4.42Å; L61-L88 HydrophobicContact CD2-CB 3.78Å; L61-L88 HydrophobicContact CD2-CD1 4.42Å; I63-L88 HydrophobicContact CD1-CD1 4.46Å; D81-L88 PolarHBondContact OD2-N 3.27Å; D81-L88 VanDerWaalsContact OD2-N 3.08Å; L85-L88 HydrophobicContact CB-CB 4.17Å; L85-L88 HydrophobicContact CD1-CD2 4.35Å; L85-L88 PolarHBondContact O-N 2.87Å; L88-R90 VanDerWaalsContact C-N 3.27Å; L88-R90 PolarHBondContact O-N 2.88Å; L88-V91 WeakPolarHBondContact O-CB 3.45Å; L88-V91 PolarHBondContact O-N 3.3Å; L88-L92 HydrophobicContact CD1-CD1 4.33Å; L88-L92 HydrophobicContact CD1-CG 4.25Å; L88-L92 HydrophobicContact CG-CD1 4.22Å; L88-L92 WeakPolarHBondContact O-CG 3.29Å; L88-L92 PolarHBondContact O-N 2.81Å; L88-M110 HydrophobicContact CD2-CE 3.67Å; L88-M110 HydrophobicContact CD2-SD 3.71Å; L88-F113 HydrophobicContact CB-CE1 4.4Å; L88-F113 HydrophobicContact CB-CZ 4.45Å; L88-F113 HydrophobicContact CD2-CD1 3.69Å; L88-F113 HydrophobicContact CD2-CE1 3.38Å; L88-F113 HydrophobicContact CD2-CZ 4.21Å; L88-F113 HydrophobicContact CG-CD1 4.39Å; L88-F113 HydrophobicContact CG-CE1 3.6Å; L88-F113 HydrophobicContact CG-CZ 4.03Å
89	Q	81.1	Confident	78.2	Confident	46 Å²	46	50.2 Å²	50.2	22%	0.215	26%	0.258	C	S	.	.	H	α-helix	trans	-57.6	-43.9	175.2	-177	60.1	49	0	0	111.2	L85 K86 L87 V91 L92 D93 F113	L85-Q89 PolarHBondContact O-N 2.84Å; K86-Q89 PolarHBondContact O-N 3.2Å; L87-Q89 PolarHBondContact O-N 2.85Å; Q89-V91 PolarHBondContact O-N 3.4Å; Q89-L92 PolarHBondContact O-N 3.34Å; Q89-D93 VanDerWaalsContact NE2-CG 3.31Å; Q89-D93 PolarHBondContact NE2-OD1 2.84Å; Q89-D93 VanDerWaalsContact NE2-OD1 3.09Å; Q89-D93 PolarHBondContact NE2-OD2 2.71Å; Q89-D93 PolarHBondContact O-N 2.8Å; Q89-F113 HydrophobicContact CB-CE2 4Å; Q89-F113 HydrophobicContact CB-CZ 4.02Å
90	R	75.3	Confident	79	Confident	62 Å²	62	49.5 Å²	49.5	23%	0.234	25%	0.251	C	S	.	.	H	α-helix	trans	-60.6	-44.4	176.7	-171.1	-179.2	-175.4	171.2	7.5	112	K86 L87 L88 L92 D93 E94 L236 V237	K86-R90 PolarHBondContact O-N 2.78Å; L87-R90 WeakPolarHBondContact O-CB 3.44Å; L87-R90 PolarHBondContact O-N 2.78Å; L88-R90 VanDerWaalsContact C-N 3.27Å; L88-R90 PolarHBondContact O-N 2.88Å; R90-L92 VanDerWaalsContact C-N 3.31Å; R90-L92 PolarHBondContact O-N 2.82Å; R90-D93 PolarHBondContact O-N 3.28Å; R90-E94 VanDerWaalsContact O-CB 3.24Å; R90-E94 WeakPolarHBondContact O-CB 3.41Å; R90-E94 PolarHBondContact O-N 2.86Å; R90-L236 VanDerWaalsContact NH2-CB 3.28Å; R90-L236 PolarHBondContact NH2-O 3.09Å; R90-V237 VanDerWaalsContact NH2-C 3.32Å; R90-V237 PolarHBondContact NH2-O 3.5Å
91	V	81.4	Confident	79.8	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-59.2	-43.7	176.6	174.4	0	0	0	0	110.9	L52 I63 L87 L88 Q89 E94 I95 L233	L52-V91 HydrophobicContact CD1-CG1 4.43Å; L52-V91 HydrophobicContact CD2-CG1 4.41Å; I63-V91 HydrophobicContact CD1-CB 4.01Å; I63-V91 HydrophobicContact CD1-CG1 3.74Å; I63-V91 HydrophobicContact CD1-CG2 3.44Å; I63-V91 VanDerWaalsContact CD1-CG2 3.44Å; I63-V91 HydrophobicContact CG2-CG1 4.22Å; L87-V91 WeakPolarHBondContact O-CG2 3.46Å; L87-V91 PolarHBondContact O-N 2.86Å; L88-V91 WeakPolarHBondContact O-CB 3.45Å; L88-V91 PolarHBondContact O-N 3.3Å; Q89-V91 PolarHBondContact O-N 3.4Å; V91-E94 PolarHBondContact O-N 2.83Å; V91-I95 HydrophobicContact CG1-CD1 3.48Å; V91-I95 VanDerWaalsContact CG1-CD1 3.48Å; V91-I95 HydrophobicContact CG1-CG1 4.26Å; V91-I95 VanDerWaalsContact O-CB 3.31Å; V91-I95 WeakPolarHBondContact O-CB 3.39Å; V91-I95 WeakPolarHBondContact O-CG1 3.42Å; V91-I95 PolarHBondContact O-N 2.86Å; V91-L233 HydrophobicContact CB-CD1 4.35Å; V91-L233 HydrophobicContact CG2-CD1 3.28Å
92	L	82.4	Confident	80.6	Confident	14 Å²	14	44.4 Å²	44.4	7%	0.073	22%	0.219	C	C	.	.	H	α-helix	trans	-67.4	-44.5	-179.9	-71.5	170.6	0	0	0	112.2	L52 L88 Q89 R90 E94 N96 P97 V100 F113 L117	L52-L92 HydrophobicContact CD2-CD2 3.51Å; L52-L92 HydrophobicContact CD2-CG 4.47Å; L88-L92 HydrophobicContact CD1-CD1 4.33Å; L88-L92 HydrophobicContact CD1-CG 4.25Å; L88-L92 HydrophobicContact CG-CD1 4.22Å; L88-L92 WeakPolarHBondContact O-CG 3.29Å; L88-L92 PolarHBondContact O-N 2.81Å; Q89-L92 PolarHBondContact O-N 3.34Å; R90-L92 VanDerWaalsContact C-N 3.31Å; R90-L92 PolarHBondContact O-N 2.82Å; L92-E94 PolarHBondContact O-N 2.9Å; L92-N96 WeakPolarHBondContact O-CA 3.45Å; L92-N96 PolarHBondContact O-N 2.77Å; L92-P97 HydrophobicContact CD2-CG 3.79Å; L92-V100 HydrophobicContact CD2-CG2 3.72Å; L92-F113 HydrophobicContact CD1-CE1 3.73Å; L92-F113 HydrophobicContact CD1-CZ 3.89Å; L92-L117 HydrophobicContact CD1-CD1 3.45Å; L92-L117 VanDerWaalsContact CD1-CD1 3.45Å; L92-L117 HydrophobicContact CD1-CD2 4.19Å; L92-L117 HydrophobicContact CD1-CG 4.47Å
93	D	75.2	Confident	81.4	Confident	82 Å²	82	38.2 Å²	38.2	44%	0.439	19%	0.191	S	C	.	.	H	α-helix	trans	-63.8	-32.9	177.1	-69.9	-37.2	0	0	0	111.2	Q89 R90 R123	Q89-D93 VanDerWaalsContact NE2-CG 3.31Å; Q89-D93 PolarHBondContact NE2-OD1 2.84Å; Q89-D93 VanDerWaalsContact NE2-OD1 3.09Å; Q89-D93 PolarHBondContact NE2-OD2 2.71Å; Q89-D93 PolarHBondContact O-N 2.8Å; R90-D93 PolarHBondContact O-N 3.28Å; D93-R123 IonicContact OD1-NH1 3.23Å; D93-R123 PolarHBondContact OD1-NH1 3.22Å
94	E	74.6	Confident	82	Confident	37 Å²	37	34.2 Å²	34.2	17%	0.173	18%	0.184	C	C	.	.	H	α-helix	trans	-83.9	-39.1	-177.9	-174.5	178.8	143.5	0	0	114.4	R90 V91 L92 L233 R293	R90-E94 VanDerWaalsContact O-CB 3.24Å; R90-E94 WeakPolarHBondContact O-CB 3.41Å; R90-E94 PolarHBondContact O-N 2.86Å; V91-E94 PolarHBondContact O-N 2.83Å; L92-E94 PolarHBondContact O-N 2.9Å; E94-L233 VanDerWaalsContact OE1-CD2 3.29Å; E94-L233 WeakPolarHBondContact OE1-CD2 3.37Å; E94-L233 VanDerWaalsContact OE2-CD2 3.22Å; E94-L233 WeakPolarHBondContact OE2-CD2 3.38Å; E94-R293 HydrophobicContact CG-CG 4.05Å; E94-R293 WeakPolarHBondContact OE1-CD 3.41Å; E94-R293 WeakPolarHBondContact OE1-CG 3.25Å; E94-R293 IonicContact OE1-CZ 3.27Å; E94-R293 IonicContact OE1-NE 2.88Å; E94-R293 PolarHBondContact OE1-NE 3.07Å; E94-R293 IonicContact OE1-NH1 3.14Å; E94-R293 IonicContact OE1-NH2 3.34Å
95	I	79.6	Confident	82.7	Confident	10 Å²	10	38.8 Å²	38.8	5%	0.051	20%	0.195	C	C	.	.	H	α-helix	trans	-86.4	-31.2	-178.2	-64.2	177.8	0	0	0	111	I50 L52 Y65 V91 P97 F231	I50-I95 HydrophobicContact CB-CG2 4.43Å; I50-I95 HydrophobicContact CD1-CG2 4.22Å; I50-I95 HydrophobicContact CG2-CG2 3.53Å; L52-I95 HydrophobicContact CD1-CD1 4.06Å; Y65-I95 HydrophobicContact CD1-CD1 3.49Å; Y65-I95 VanDerWaalsContact CD1-CD1 3.49Å; Y65-I95 HydrophobicContact CE1-CD1 3.54Å; Y65-I95 HydrophobicContact CE1-CG1 4.27Å; Y65-I95 HydrophobicContact CG-CD1 4.29Å; Y65-I95 HydrophobicContact CG-CG2 4.45Å; V91-I95 HydrophobicContact CG1-CD1 3.48Å; V91-I95 VanDerWaalsContact CG1-CD1 3.48Å; V91-I95 HydrophobicContact CG1-CG1 4.26Å; V91-I95 VanDerWaalsContact O-CB 3.31Å; V91-I95 WeakPolarHBondContact O-CB 3.39Å; V91-I95 WeakPolarHBondContact O-CG1 3.42Å; V91-I95 PolarHBondContact O-N 2.86Å; I95-P97 HydrophobicContact CG2-CB 4.35Å; I95-F231 HydrophobicContact CD1-CE2 4.43Å; I95-F231 HydrophobicContact CD1-CZ 4.13Å
96	N	79.1	Confident	82.6	Confident	87 Å²	87	40.3 Å²	40.3	47%	0.465	20%	0.202	S	C	.	.			trans	47.4	59.7	-174.6	-169.4	37.9	0	0	0	113.1	L92	L92-N96 WeakPolarHBondContact O-CA 3.45Å; L92-N96 PolarHBondContact O-N 2.77Å
97	P	87	Confident	83	Confident	4 Å²	4	38.6 Å²	38.6	3%	0.026	20%	0.198	C	C	.	.			trans	-71.7	150.8	-173.5	32	-37.1	0	0	0	112.6	I50 L52 L92 I95 V100 P128	I50-P97 HydrophobicContact CG2-CB 4.42Å; I50-P97 CarbonylContact O-C 3.56Å; I50-P97 WeakPolarHBondContact O-CA 3.29Å; L52-P97 HydrophobicContact CB-CB 3.67Å; L52-P97 HydrophobicContact CB-CG 3.96Å; L52-P97 HydrophobicContact CD2-CG 3.97Å; L92-P97 HydrophobicContact CD2-CG 3.79Å; I95-P97 HydrophobicContact CG2-CB 4.35Å; P97-V100 HydrophobicContact CG-CG2 3.81Å; P97-P128 WeakPolarHBondContact O-CB 3.41Å
98	Q	86.9	Confident	83.1	Confident	78 Å²	78	43.4 Å²	43.4	36%	0.364	22%	0.219	S	C	.	.	S	Bend	trans	-78.7	-31.1	173.8	-177.1	173.1	-0.8	0	0	112.5	E49 I50 P128 E129	E49-Q98 PolarHBondContact OE1-NE2 2.97Å; E49-Q98 PolarHBondContact OE1-OE1 3.11Å; I50-Q98 PolarHBondContact O-N 2.83Å; Q98-P128 CarbonylContact O-C 3.55Å; Q98-P128 WeakPolarHBondContact O-CA 3.35Å; Q98-E129 PolarHBondContact O-N 2.89Å
99	S	88	Confident	83.1	Confident	2 Å²	2	45.4 Å²	45.4	1%	0.014	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.3	141.2	174.3	69.9	0	0	0	0	111.5	H51 L52 E129	H51-S99 PolarHBondContact ND1-OG 3.03Å; L52-S99 PolarHBondContact N-O 3.42Å; S99-E129 CarbonylContact C-O 3.59Å; S99-E129 WeakPolarHBondContact CA-O 3.2Å
100	V	90.9	Very high	83.2	Confident	5 Å²	5	43.2 Å²	43.2	3%	0.03	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	111.8	174.1	178.3	0	0	0	0	109	L52 V54 L92 P97 P128 E129 I130 I131	L52-V100 HydrophobicContact CB-CG2 4.49Å; L52-V100 HydrophobicContact CD2-CG2 4.27Å; L52-V100 CarbonylContact O-C 3.55Å; L52-V100 WeakPolarHBondContact O-CA 3.38Å; V54-V100 HydrophobicContact CG2-CG1 4.22Å; L92-V100 HydrophobicContact CD2-CG2 3.72Å; P97-V100 HydrophobicContact CG-CG2 3.81Å; V100-P128 HydrophobicContact CG2-CB 3.73Å; V100-P128 HydrophobicContact CG2-CG 4.14Å; V100-E129 PolarHBondContact N-O 3.33Å; V100-I130 WeakPolarHBondContact O-CA 3.41Å; V100-I131 PolarHBondContact O-N 3.41Å
101	V	90.9	Very high	83.5	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	132.7	-179.8	-175	0	0	0	0	109.6	L52 C53 V54 I131 L133 F138 F206	L52-V101 PolarHBondContact O-N 2.66Å; C53-V101 CarbonylContact C-O 3.52Å; C53-V101 VanDerWaalsContact CA-O 3.29Å; C53-V101 WeakPolarHBondContact CA-O 3.16Å; C53-V101 HydrophobicContact CB-CB 4.24Å; V54-V101 PolarHBondContact N-O 2.72Å; V101-I131 CarbonylContact C-O 3.52Å; V101-I131 WeakPolarHBondContact CA-O 3.36Å; V101-I131 HydrophobicContact CG2-CB 4.37Å; V101-L133 HydrophobicContact CG1-CD1 3.63Å; V101-L133 HydrophobicContact CG1-CG 3.95Å; V101-F138 HydrophobicContact CG1-CZ 4.47Å; V101-F206 HydrophobicContact CG1-CB 4.19Å; V101-F206 HydrophobicContact CG1-CD2 4.45Å; V101-F206 HydrophobicContact CG1-CG 4.38Å; V101-F206 HydrophobicContact CG2-CB 4.11Å; V101-F206 HydrophobicContact CG2-CD1 3.68Å; V101-F206 HydrophobicContact CG2-CD2 3.66Å; V101-F206 HydrophobicContact CG2-CE1 3.94Å; V101-F206 HydrophobicContact CG2-CE2 3.94Å; V101-F206 HydrophobicContact CG2-CG 3.52Å; V101-F206 HydrophobicContact CG2-CZ 4.08Å
102	T	91.9	Very high	83.6	Confident	1 Å²	1	50.5 Å²	50.5	1%	0.006	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	169.6	176.5	-161.6	0	0	0	0	112.1	V54 Q106 L114 I131 F132 L133 F138	V54-T102 WeakPolarHBondContact O-CB 3.12Å; V54-T102 PolarHBondContact O-OG1 3.5Å; T102-Q106 HydrophobicContact CG2-CG 4.43Å; T102-Q106 PolarHBondContact OG1-NE2 3.11Å; T102-L114 HydrophobicContact CG2-CD1 3.86Å; T102-I131 PolarHBondContact N-O 3.18Å; T102-F132 HydrophobicContact CG2-CD1 3.65Å; T102-F132 HydrophobicContact CG2-CE1 3.6Å; T102-F132 WeakPolarHBondContact O-CA 3.25Å; T102-L133 PolarHBondContact O-N 2.71Å; T102-F138 VanDerWaalsContact C-CZ 3.41Å
103	S	89.2	Confident	83.7	Confident	7 Å²	7	50.7 Å²	50.7	5%	0.049	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	144.5	175.9	155.5	0	0	0	0	111.4	K105 Q106 L133	S103-K105 PolarHBondContact O-N 3.41Å; S103-K105 PolarHBondContact OG-N 3.28Å; S103-K105 PolarHBondContact OG-O 2.81Å; S103-Q106 VanDerWaalsContact CA-NE2 3.31Å; S103-Q106 VanDerWaalsContact O-CG 3.23Å; S103-Q106 WeakPolarHBondContact O-CG 3.48Å; S103-Q106 PolarHBondContact O-NE2 3.4Å; S103-L133 CarbonylContact C-O 3.52Å; S103-L133 WeakPolarHBondContact CA-O 3.41Å
104	A	86	Confident	84.1	Confident	68 Å²	68	47.3 Å²	47.3	56%	0.562	24%	0.238	S	C	*	.	S	Bend	trans	-64.9	-24.5	173.2	0	0	0	0	0	112.8	F132 L133	A104-F132 HydrophobicContact CB-CB 4.36Å; A104-L133 PolarHBondContact N-O 2.95Å
105	K	83.5	Confident	84.3	Confident	167 Å²	167	47.3 Å²	47.3	73%	0.726	25%	0.248	S	C	*	.	S	Bend	trans	-99.3	105.7	172.6	-170.1	178.1	-178.6	-179.1	0	108.4	S103	S103-K105 PolarHBondContact O-N 3.41Å; S103-K105 PolarHBondContact OG-N 3.28Å; S103-K105 PolarHBondContact OG-O 2.81Å
106	Q	78.8	Confident	84.2	Confident	34 Å²	34	52.7 Å²	52.7	16%	0.159	27%	0.271	C	S	.	.			trans	-120.3	157.9	178.2	-66.9	-55.9	-42.6	0	0	111.2	T102 S103 M110	T102-Q106 HydrophobicContact CG2-CG 4.43Å; T102-Q106 PolarHBondContact OG1-NE2 3.11Å; S103-Q106 VanDerWaalsContact CA-NE2 3.31Å; S103-Q106 VanDerWaalsContact O-CG 3.23Å; S103-Q106 WeakPolarHBondContact O-CG 3.48Å; S103-Q106 PolarHBondContact O-NE2 3.4Å; Q106-M110 HydrophobicContact CB-CB 4.25Å; Q106-M110 HydrophobicContact CB-CG 4.19Å; Q106-M110 HydrophobicContact CG-CG 4.1Å
107	D	80.6	Confident	84.1	Confident	70 Å²	70	50 Å²	50	37%	0.374	26%	0.256	S	S	.	.			trans	-66.2	156.3	166.3	-70	-41.3	0	0	0	111.2	W56 N109 M110 T111	W56-D107 HydrophobicContact CE3-CB 3.69Å; W56-D107 HydrophobicContact CZ3-CB 3.44Å; W56-D107 VanDerWaalsContact CZ3-CB 3.44Å; D107-N109 VanDerWaalsContact C-N 3.3Å; D107-N109 PolarHBondContact O-N 3.47Å; D107-M110 PolarHBondContact O-N 2.81Å; D107-T111 PolarHBondContact O-N 3.25Å; D107-T111 PolarHBondContact O-OG1 3.43Å
108	E	80.3	Confident	83.3	Confident	135 Å²	135	52.6 Å²	52.6	63%	0.631	28%	0.278	S	S	*	.	H	α-helix	trans	-60.1	-39.7	-175.8	-163.7	-168.1	147.4	0	0	112.2	T111 R112	E108-T111 PolarHBondContact O-N 2.93Å; E108-R112 WeakPolarHBondContact O-CB 3.18Å; E108-R112 PolarHBondContact O-N 3.21Å; E108-R112 IonicContact OE1-CZ 3.53Å; E108-R112 IonicContact OE1-NH2 2.63Å; E108-R112 PolarHBondContact OE1-NH2 3.46Å
109	N	81.6	Confident	82.4	Confident	44 Å²	44	52.7 Å²	52.7	24%	0.235	29%	0.288	C	S	.	.	H	α-helix	trans	-65.7	-41	179.9	-62.3	-21.8	0	0	0	111.9	W56 D107 R112 F113	W56-N109 HydrophobicContact CH2-CB 3.82Å; W56-N109 HydrophobicContact CZ3-CB 3.63Å; D107-N109 VanDerWaalsContact C-N 3.3Å; D107-N109 PolarHBondContact O-N 3.47Å; N109-R112 PolarHBondContact O-N 2.82Å; N109-F113 WeakPolarHBondContact O-CB 3.3Å; N109-F113 PolarHBondContact O-N 2.96Å
110	M	83.3	Confident	80.9	Confident	1 Å²	1	56.7 Å²	56.7	1%	0.005	31%	0.306	C	S	.	.	H	α-helix	trans	-65.1	-41.6	173.9	179.6	64.4	72.7	0	0	111.1	V54 W56 L61 L85 L88 Q106 D107 R112 F113 L114	V54-M110 HydrophobicContact CG1-CE 4.15Å; W56-M110 HydrophobicContact CB-CE 3.18Å; W56-M110 HydrophobicContact CE3-CB 4.1Å; W56-M110 HydrophobicContact CG-CE 4.14Å; L61-M110 HydrophobicContact CD1-CE 4.33Å; L85-M110 HydrophobicContact CD1-CB 4.21Å; L85-M110 HydrophobicContact CD1-CE 3.92Å; L85-M110 HydrophobicContact CD1-SD 3.94Å; L85-M110 HydrophobicContact CD2-CE 4.41Å; L88-M110 HydrophobicContact CD2-CE 3.67Å; L88-M110 HydrophobicContact CD2-SD 3.71Å; Q106-M110 HydrophobicContact CB-CB 4.25Å; Q106-M110 HydrophobicContact CB-CG 4.19Å; Q106-M110 HydrophobicContact CG-CG 4.1Å; D107-M110 PolarHBondContact O-N 2.81Å; M110-R112 PolarHBondContact O-N 3.18Å; M110-F113 PolarHBondContact O-N 2.9Å; M110-F113 HydrophobicContact SD-CD1 4.42Å; M110-L114 HydrophobicContact CG-CD1 3.87Å; M110-L114 HydrophobicContact CG-CG 4.29Å; M110-L114 WeakPolarHBondContact O-CB 3.32Å; M110-L114 VanDerWaalsContact O-CG 3.3Å; M110-L114 WeakPolarHBondContact O-CG 3.36Å; M110-L114 PolarHBondContact O-N 3.41Å; M110-L114 HydrophobicContact SD-CD1 4.16Å; M110-L114 HydrophobicContact SD-CG 4.07Å
111	T	83.3	Confident	78.9	Confident	77 Å²	77	62.8 Å²	62.8	47%	0.472	33%	0.334	S	S	.	.	H	α-helix	trans	-62	-43.6	177.1	-53.1	0	0	0	0	111.4	D107 E108 F113 G115	D107-T111 PolarHBondContact O-N 3.25Å; D107-T111 PolarHBondContact O-OG1 3.43Å; E108-T111 PolarHBondContact O-N 2.93Å; T111-F113 VanDerWaalsContact C-N 3.33Å; T111-F113 PolarHBondContact O-N 3Å; T111-G115 PolarHBondContact O-N 3.3Å
112	R	82.5	Confident	76.8	Confident	137 Å²	137	67.5 Å²	67.5	52%	0.517	36%	0.356	S	S	.	.	H	α-helix	trans	-64.8	-38.3	175.9	-168.8	-177.7	-66.2	164.1	1.3	111.6	E108 N109 M110 K116	E108-R112 WeakPolarHBondContact O-CB 3.18Å; E108-R112 PolarHBondContact O-N 3.21Å; E108-R112 IonicContact OE1-CZ 3.53Å; E108-R112 IonicContact OE1-NH2 2.63Å; E108-R112 PolarHBondContact OE1-NH2 3.46Å; N109-R112 PolarHBondContact O-N 2.82Å; M110-R112 PolarHBondContact O-N 3.18Å; R112-K116 WeakPolarHBondContact O-CG 3.5Å; R112-K116 PolarHBondContact O-N 3.47Å
113	F	84.2	Confident	74.5	Confident	19 Å²	19	72.3 Å²	72.3	8%	0.083	37%	0.374	C	S	.	.	H	α-helix	trans	-66.7	-49.5	176.7	179.6	-96.8	0	0	0	112.1	L85 L88 Q89 L92 N109 M110 T111 G115 K116 L117	L85-F113 HydrophobicContact CB-CD2 4.05Å; L85-F113 HydrophobicContact CB-CE2 4.35Å; L85-F113 HydrophobicContact CB-CG 4.24Å; L85-F113 HydrophobicContact CD1-CB 3.7Å; L85-F113 HydrophobicContact CD1-CD1 4.22Å; L85-F113 HydrophobicContact CD1-CD2 4.49Å; L85-F113 HydrophobicContact CD1-CG 3.9Å; L88-F113 HydrophobicContact CB-CE1 4.4Å; L88-F113 HydrophobicContact CB-CZ 4.45Å; L88-F113 HydrophobicContact CD2-CD1 3.69Å; L88-F113 HydrophobicContact CD2-CE1 3.38Å; L88-F113 HydrophobicContact CD2-CZ 4.21Å; L88-F113 HydrophobicContact CG-CD1 4.39Å; L88-F113 HydrophobicContact CG-CE1 3.6Å; L88-F113 HydrophobicContact CG-CZ 4.03Å; Q89-F113 HydrophobicContact CB-CE2 4Å; Q89-F113 HydrophobicContact CB-CZ 4.02Å; L92-F113 HydrophobicContact CD1-CE1 3.73Å; L92-F113 HydrophobicContact CD1-CZ 3.89Å; N109-F113 WeakPolarHBondContact O-CB 3.3Å; N109-F113 PolarHBondContact O-N 2.96Å; M110-F113 PolarHBondContact O-N 2.9Å; M110-F113 HydrophobicContact SD-CD1 4.42Å; T111-F113 VanDerWaalsContact C-N 3.33Å; T111-F113 PolarHBondContact O-N 3Å; F113-G115 VanDerWaalsContact C-N 3.28Å; F113-G115 PolarHBondContact O-N 3.3Å; F113-K116 WeakPolarHBondContact O-CB 3.45Å; F113-K116 PolarHBondContact O-N 2.89Å; F113-K116 VanDerWaalsContact O-N 3.12Å; F113-L117 HydrophobicContact CD1-CD1 3.74Å; F113-L117 HydrophobicContact CD1-CG 4.45Å; F113-L117 HydrophobicContact CE1-CD1 3.27Å; F113-L117 HydrophobicContact CE1-CG 4.1Å; F113-L117 HydrophobicContact CZ-CD1 3.86Å; F113-L117 HydrophobicContact CZ-CG 4.3Å; F113-L117 PolarHBondContact O-N 2.86Å
114	L	83.6	Confident	72.5	Confident	11 Å²	11	81 Å²	81	6%	0.058	41%	0.414	C	S	.	.	H	α-helix	trans	-61.4	-37.6	174.4	-67.4	170.3	0	0	0	111.7	T102 M110 L117 A118 I130 F132	T102-L114 HydrophobicContact CG2-CD1 3.86Å; M110-L114 HydrophobicContact CG-CD1 3.87Å; M110-L114 HydrophobicContact CG-CG 4.29Å; M110-L114 WeakPolarHBondContact O-CB 3.32Å; M110-L114 VanDerWaalsContact O-CG 3.3Å; M110-L114 WeakPolarHBondContact O-CG 3.36Å; M110-L114 PolarHBondContact O-N 3.41Å; M110-L114 HydrophobicContact SD-CD1 4.16Å; M110-L114 HydrophobicContact SD-CG 4.07Å; L114-L117 HydrophobicContact CD2-CD1 4.35Å; L114-L117 PolarHBondContact O-N 3.17Å; L114-A118 WeakPolarHBondContact O-CB 3.45Å; L114-A118 PolarHBondContact O-N 3.23Å; L114-I130 HydrophobicContact CB-CD1 4.45Å; L114-I130 HydrophobicContact CD2-CD1 4.35Å; L114-I130 HydrophobicContact CD2-CG2 4.44Å; L114-F132 HydrophobicContact CD1-CE1 4.24Å
115	G	78.9	Confident	70.8	Confident	37 Å²	37	81.5 Å²	81.5	38%	0.381	41%	0.411	S	S	.	.	H	α-helix	trans	-62.2	-40.9	173	0	0	0	0	0	112.7	T111 F113 A118 S119	T111-G115 PolarHBondContact O-N 3.3Å; F113-G115 VanDerWaalsContact C-N 3.28Å; F113-G115 PolarHBondContact O-N 3.3Å; G115-A118 PolarHBondContact O-N 3.15Å; G115-S119 VanDerWaalsContact O-CB 3.29Å; G115-S119 WeakPolarHBondContact O-CB 3.43Å; G115-S119 PolarHBondContact O-N 3.43Å; G115-S119 PolarHBondContact O-OG 3.44Å; G115-S119 VanDerWaalsContact O-OG 3.07Å
116	K	78.2	Confident	69.5	Low	123 Å²	123	81 Å²	81	54%	0.535	41%	0.409	S	S	.	.	H	α-helix	trans	-65.3	-40.3	172.8	-75	175.9	-178	-177.2	0	112.2	R112 F113 A118 S119 Q120	R112-K116 WeakPolarHBondContact O-CG 3.5Å; R112-K116 PolarHBondContact O-N 3.47Å; F113-K116 WeakPolarHBondContact O-CB 3.45Å; F113-K116 PolarHBondContact O-N 2.89Å; F113-K116 VanDerWaalsContact O-N 3.12Å; K116-A118 VanDerWaalsContact C-N 3.32Å; K116-S119 WeakPolarHBondContact CA-OG 3.46Å; K116-S119 PolarHBondContact O-N 3.49Å; K116-S119 PolarHBondContact O-OG 2.91Å; K116-Q120 VanDerWaalsContact O-CG 3.28Å; K116-Q120 WeakPolarHBondContact O-CG 3.35Å; K116-Q120 PolarHBondContact O-N 2.88Å; K116-Q120 VanDerWaalsContact O-N 3.08Å
117	L	76.3	Confident	68.9	Low	30 Å²	30	86.3 Å²	86.3	16%	0.157	43%	0.428	C	S	.	.	H	α-helix	trans	-64.3	-39	175.1	-73.7	170.1	0	0	0	111.6	L92 F113 L114	L92-L117 HydrophobicContact CD1-CD1 3.45Å; L92-L117 VanDerWaalsContact CD1-CD1 3.45Å; L92-L117 HydrophobicContact CD1-CD2 4.19Å; L92-L117 HydrophobicContact CD1-CG 4.47Å; F113-L117 HydrophobicContact CD1-CD1 3.74Å; F113-L117 HydrophobicContact CD1-CG 4.45Å; F113-L117 HydrophobicContact CE1-CD1 3.27Å; F113-L117 HydrophobicContact CE1-CG 4.1Å; F113-L117 HydrophobicContact CZ-CD1 3.86Å; F113-L117 HydrophobicContact CZ-CG 4.3Å; F113-L117 PolarHBondContact O-N 2.86Å; L114-L117 HydrophobicContact CD2-CD1 4.35Å; L114-L117 PolarHBondContact O-N 3.17Å
118	A	71.4	Confident	68.8	Low	58 Å²	58	84.7 Å²	84.7	48%	0.479	42%	0.421	S	S	.	.	H	α-helix	trans	-70.9	-33.2	176.5	0	0	0	0	0	113	L114 G115 K116 I130	L114-A118 WeakPolarHBondContact O-CB 3.45Å; L114-A118 PolarHBondContact O-N 3.23Å; G115-A118 PolarHBondContact O-N 3.15Å; K116-A118 VanDerWaalsContact C-N 3.32Å; A118-I130 HydrophobicContact CB-CD1 4.16Å
119	S	66.3	Low	69	Low	81 Å²	81	83.1 Å²	83.1	57%	0.566	41%	0.414	S	S	*	.	H	α-helix	trans	-90.4	-8.9	-176.7	70.4	0	0	0	0	115.2	G115 K116 E121	G115-S119 VanDerWaalsContact O-CB 3.29Å; G115-S119 WeakPolarHBondContact O-CB 3.43Å; G115-S119 PolarHBondContact O-N 3.43Å; G115-S119 PolarHBondContact O-OG 3.44Å; G115-S119 VanDerWaalsContact O-OG 3.07Å; K116-S119 WeakPolarHBondContact CA-OG 3.46Å; K116-S119 PolarHBondContact O-N 3.49Å; K116-S119 PolarHBondContact O-OG 2.91Å; S119-E121 PolarHBondContact O-N 3.12Å
120	Q	58.3	Low	69.3	Low	85 Å²	85	83.2 Å²	83.2	40%	0.397	41%	0.414	S	S	.	.			trans	-69.3	93.9	173.6	-84.1	176.3	24.3	0	0	110.1	K116 H122	K116-Q120 VanDerWaalsContact O-CG 3.28Å; K116-Q120 WeakPolarHBondContact O-CG 3.35Å; K116-Q120 PolarHBondContact O-N 2.88Å; K116-Q120 VanDerWaalsContact O-N 3.08Å; Q120-H122 PolarHBondContact O-N 3.37Å
121	E	47.1	Very low	69.6	Low	134 Å²	134	84.1 Å²	84.1	63%	0.626	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-12.6	-173.4	-77.6	-174.5	160.8	0	0	114.7	S119 R127	S119-E121 PolarHBondContact O-N 3.12Å; E121-R127 VanDerWaalsContact C-NH2 3.33Å; E121-R127 PolarHBondContact O-NH2 3.37Å
122	H	47.9	Very low	69.9	Low	99 Å²	99	85.8 Å²	85.8	46%	0.458	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.9	17.9	-156.4	-60.1	-33.7	0	0	0	117.7	Q120 L660	Q120-H122 PolarHBondContact O-N 3.37Å; H122-L660 HydrophobicContact CB-CD2 4.19Å; H122-L660 PolarHBondContact CD2-O 3Å; H122-L660 WeakPolarHBondContact O-CD2 3.38Å
123	R	43.8	Very low	70.2	Confident	102 Å²	102	79.5 Å²	79.5	39%	0.385	40%	0.396	S	S	.	.			trans	-102	114.6	170.1	-96.3	-178.7	168.7	-167.4	-8.6	111.1	D93	D93-R123 IonicContact OD1-NH1 3.23Å; D93-R123 PolarHBondContact OD1-NH1 3.22Å
124	E	45.8	Very low	70.5	Confident	188 Å²	188	81.8 Å²	81.8	88%	0.879	41%	0.413	S	S	*	.			trans	-82.1	141.1	147.7	-80.1	-165.6	158.5	0	0	108.5
125	P	51.6	Low	70.6	Confident	79 Å²	79	84 Å²	84	51%	0.513	43%	0.429	S	S	.	.	S	Bend	cis	-94.8	165.1	13.9	33.7	-26.1	0	0	0	114.7
126	K	55.1	Low	70.9	Confident	158 Å²	158	87 Å²	87	69%	0.687	44%	0.44	S	S	*	.			trans	0	115.1	178.1	-69.7	178.3	178.2	178.6	0	117.4
127	R	67	Low	71.3	Confident	144 Å²	144	82.5 Å²	82.5	54%	0.543	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-60	135	170.3	-61.4	-174.4	-167.7	170.5	12.3	110.8	E121	E121-R127 VanDerWaalsContact C-NH2 3.33Å; E121-R127 PolarHBondContact O-NH2 3.37Å
128	P	78.1	Confident	71.7	Confident	36 Å²	36	81.5 Å²	81.5	23%	0.234	42%	0.416	C	S	.	.	P	Polyproline II helix	trans	-69.1	136.1	172	23.5	-29.7	0	0	0	111.5	P97 Q98 V100 I130	P97-P128 WeakPolarHBondContact O-CB 3.41Å; Q98-P128 CarbonylContact O-C 3.55Å; Q98-P128 WeakPolarHBondContact O-CA 3.35Å; V100-P128 HydrophobicContact CG2-CB 3.73Å; V100-P128 HydrophobicContact CG2-CG 4.14Å; P128-I130 PolarHBondContact O-N 3.23Å
129	E	85.6	Confident	72.4	Confident	103 Å²	103	79.8 Å²	79.8	48%	0.481	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	117.2	167.2	-171.6	-171.5	170.2	0	0	109.2	Q98 S99 V100 I131 R210	Q98-E129 PolarHBondContact O-N 2.89Å; S99-E129 CarbonylContact C-O 3.59Å; S99-E129 WeakPolarHBondContact CA-O 3.2Å; V100-E129 PolarHBondContact N-O 3.33Å; E129-I131 HydrophobicContact CG-CD1 4.2Å; E129-I131 HydrophobicContact CG-CG1 3.94Å; E129-R210 IonicContact OE1-CZ 3.73Å; E129-R210 IonicContact OE1-NH2 3.39Å; E129-R210 PolarHBondContact OE1-NH2 3.48Å; E129-R210 IonicContact OE2-NH2 2.64Å
130	I	87.9	Confident	73.2	Confident	45 Å²	45	78.5 Å²	78.5	23%	0.231	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	120.9	177.5	-56.1	175.8	0	0	0	109.2	V100 L114 A118 P128 F132	V100-I130 WeakPolarHBondContact O-CA 3.41Å; L114-I130 HydrophobicContact CB-CD1 4.45Å; L114-I130 HydrophobicContact CD2-CD1 4.35Å; L114-I130 HydrophobicContact CD2-CG2 4.44Å; A118-I130 HydrophobicContact CB-CD1 4.16Å; P128-I130 PolarHBondContact O-N 3.23Å; I130-F132 HydrophobicContact CG2-CD2 4.49Å; I130-F132 HydrophobicContact CG2-CE1 4.36Å; I130-F132 HydrophobicContact CG2-CE2 3.77Å; I130-F132 HydrophobicContact CG2-CZ 3.69Å
131	I	87.9	Confident	74.4	Confident	20 Å²	20	79.8 Å²	79.8	10%	0.103	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.4	-173.1	-57.4	176.4	0	0	0	109.8	V100 V101 T102 E129 F206	V100-I131 PolarHBondContact O-N 3.41Å; V101-I131 CarbonylContact C-O 3.52Å; V101-I131 WeakPolarHBondContact CA-O 3.36Å; V101-I131 HydrophobicContact CG2-CB 4.37Å; T102-I131 PolarHBondContact N-O 3.18Å; E129-I131 HydrophobicContact CG-CD1 4.2Å; E129-I131 HydrophobicContact CG-CG1 3.94Å; I131-F206 HydrophobicContact CD1-CD2 4.41Å; I131-F206 HydrophobicContact CD1-CE2 3.34Å; I131-F206 HydrophobicContact CD1-CZ 3.6Å; I131-F206 HydrophobicContact CG1-CE2 4.5Å; I131-F206 HydrophobicContact CG2-CD2 4.34Å; I131-F206 HydrophobicContact CG2-CE2 4.13Å
132	F	90.1	Very high	76.3	Confident	113 Å²	113	76.5 Å²	76.5	50%	0.496	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	124.6	178.1	-62.2	-80.8	0	0	0	111.1	T102 A104 L114 I130	T102-F132 HydrophobicContact CG2-CD1 3.65Å; T102-F132 HydrophobicContact CG2-CE1 3.6Å; T102-F132 WeakPolarHBondContact O-CA 3.25Å; A104-F132 HydrophobicContact CB-CB 4.36Å; L114-F132 HydrophobicContact CD1-CE1 4.24Å; I130-F132 HydrophobicContact CG2-CD2 4.49Å; I130-F132 HydrophobicContact CG2-CE1 4.36Å; I130-F132 HydrophobicContact CG2-CE2 3.77Å; I130-F132 HydrophobicContact CG2-CZ 3.69Å
133	L	89.7	Confident	78.1	Confident	4 Å²	4	71.8 Å²	71.8	2%	0.021	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	151.7	171.1	-68.6	179.6	0	0	0	110.8	V101 T102 S103 A104 S135 F138 K205 F206	V101-L133 HydrophobicContact CG1-CD1 3.63Å; V101-L133 HydrophobicContact CG1-CG 3.95Å; T102-L133 PolarHBondContact O-N 2.71Å; S103-L133 CarbonylContact C-O 3.52Å; S103-L133 WeakPolarHBondContact CA-O 3.41Å; A104-L133 PolarHBondContact N-O 2.95Å; L133-S135 PolarHBondContact O-N 3.12Å; L133-F138 HydrophobicContact CB-CE2 3.54Å; L133-F138 HydrophobicContact CB-CZ 3.86Å; L133-F138 HydrophobicContact CD1-CZ 4.23Å; L133-K205 HydrophobicContact CD1-CG 4.38Å; L133-F206 HydrophobicContact CD1-CB 4.17Å
134	P	89.3	Confident	80.1	Confident	67 Å²	67	70 Å²	70	44%	0.435	36%	0.356	S	S	.	.			trans	-53.1	139.1	175.6	-25.5	34	0	0	0	112.3	V136 D137 F138	P134-V136 PolarHBondContact O-N 2.67Å; P134-V136 VanDerWaalsContact O-N 3.1Å; P134-D137 WeakPolarHBondContact CD-OD2 3.45Å; P134-D137 WeakPolarHBondContact O-CB 3.23Å; P134-D137 PolarHBondContact O-N 2.8Å; P134-F138 WeakPolarHBondContact O-CD2 3.25Å
135	S	85.5	Confident	81.9	Confident	57 Å²	57	66.5 Å²	66.5	40%	0.399	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-59.8	-26.3	-178.3	55.6	0	0	0	0	113.7	L133 D137 F138	L133-S135 PolarHBondContact O-N 3.12Å; S135-D137 PolarHBondContact O-N 3.2Å; S135-F138 PolarHBondContact O-N 3.21Å
136	V	86.5	Confident	83.7	Confident	101 Å²	101	64.7 Å²	64.7	61%	0.612	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-60.9	-33.8	174.9	-175.2	0	0	0	0	111.6	P134 F138 G139 I142	P134-V136 PolarHBondContact O-N 2.67Å; P134-V136 VanDerWaalsContact O-N 3.1Å; V136-F138 PolarHBondContact O-N 2.89Å; V136-G139 PolarHBondContact O-N 2.99Å; V136-G139 VanDerWaalsContact O-N 3.15Å; V136-I142 HydrophobicContact CG1-CD1 3.97Å; V136-I142 VanDerWaalsContact O-CD1 3.3Å; V136-I142 WeakPolarHBondContact O-CD1 3.46Å
137	D	86.3	Confident	85.1	Confident	29 Å²	29	57.2 Å²	57.2	16%	0.155	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-69.3	-15.9	-178.8	-78.9	-44.6	0	0	0	113.6	P134 S135 R146 K205	P134-D137 WeakPolarHBondContact CD-OD2 3.45Å; P134-D137 WeakPolarHBondContact O-CB 3.23Å; P134-D137 PolarHBondContact O-N 2.8Å; S135-D137 PolarHBondContact O-N 3.2Å; D137-R146 PolarHBondContact O-NH1 3.29Å; D137-R146 IonicContact OD1-NH2 3.8Å; D137-R146 PolarHBondContact OD1-NH2 2.85Å; D137-K205 HydrophobicContact CB-CG 4.36Å; D137-K205 WeakPolarHBondContact OD1-CE 3.41Å
138	F	85.4	Confident	85.9	Confident	8 Å²	8	52.2 Å²	52.2	4%	0.035	27%	0.274	C	S	.	.	G	3₁₀ helix	trans	-102.7	11.2	177.2	-58.7	-89	0	0	0	113	L55 V101 T102 L133 P134 S135 V136 R198	L55-F138 HydrophobicContact CD1-CB 4.24Å; L55-F138 HydrophobicContact CD1-CD1 3.67Å; L55-F138 HydrophobicContact CD1-CE1 4.39Å; L55-F138 HydrophobicContact CD1-CG 4.29Å; L55-F138 HydrophobicContact CD2-CD1 3.77Å; L55-F138 HydrophobicContact CD2-CE1 4.01Å; L55-F138 HydrophobicContact CD2-CG 4.1Å; L55-F138 HydrophobicContact CG-CD1 4.02Å; L55-F138 HydrophobicContact CG-CE1 4.31Å; V101-F138 HydrophobicContact CG1-CZ 4.47Å; T102-F138 VanDerWaalsContact C-CZ 3.41Å; L133-F138 HydrophobicContact CB-CE2 3.54Å; L133-F138 HydrophobicContact CB-CZ 3.86Å; L133-F138 HydrophobicContact CD1-CZ 4.23Å; P134-F138 WeakPolarHBondContact O-CD2 3.25Å; S135-F138 PolarHBondContact O-N 3.21Å; V136-F138 PolarHBondContact O-N 2.89Å; F138-R198 VanDerWaalsContact O-CD 3.25Å; F138-R198 WeakPolarHBondContact O-CD 3.28Å; F138-R198 WeakPolarHBondContact O-CG 3.21Å
139	G	85.6	Confident	86.2	Confident	23 Å²	23	55 Å²	55	24%	0.237	29%	0.294	C	S	.	.			trans	-57	139.7	170.9	0	0	0	0	0	110.8	V136 E141 I142 S143	V136-G139 PolarHBondContact O-N 2.99Å; V136-G139 VanDerWaalsContact O-N 3.15Å; G139-E141 PolarHBondContact O-N 2.65Å; G139-I142 PolarHBondContact O-N 2.96Å; G139-S143 VanDerWaalsContact O-CB 3.28Å; G139-S143 WeakPolarHBondContact O-CB 3.5Å; G139-S143 PolarHBondContact O-N 3.46Å; G139-S143 PolarHBondContact O-OG 2.94Å
140	L	83.2	Confident	85.8	Confident	54 Å²	54	50.9 Å²	50.9	28%	0.283	28%	0.28	S	S	.	.	H	α-helix	trans	-58.5	-49.9	-176.1	177.2	60.8	0	0	0	111.8	S143 K144 P194 V197 R198	L140-S143 PolarHBondContact O-N 3.1Å; L140-K144 WeakPolarHBondContact O-CB 3.44Å; L140-K144 PolarHBondContact O-N 3.49Å; L140-P194 HydrophobicContact CD1-CG 3.65Å; L140-P194 HydrophobicContact CD2-CG 4.18Å; L140-V197 HydrophobicContact CD1-CB 4.11Å; L140-V197 HydrophobicContact CD1-CG1 3.98Å; L140-R198 HydrophobicContact CB-CG 4.5Å; L140-R198 HydrophobicContact CD1-CG 4.38Å
141	E	83.2	Confident	85.2	Confident	111 Å²	111	53.3 Å²	53.3	52%	0.519	29%	0.293	S	S	.	.	H	α-helix	trans	-66.5	-41.4	-176.8	-163.6	57.2	-148.3	0	0	111.8	G139 S143 K144 Q145	G139-E141 PolarHBondContact O-N 2.65Å; E141-S143 VanDerWaalsContact C-N 3.31Å; E141-S143 PolarHBondContact O-N 3.34Å; E141-K144 PolarHBondContact O-N 2.85Å; E141-Q145 WeakPolarHBondContact O-CB 3.44Å; E141-Q145 WeakPolarHBondContact O-CG 3.4Å; E141-Q145 PolarHBondContact O-N 3.48Å
142	I	86.3	Confident	84.8	Confident	65 Å²	65	52.6 Å²	52.6	33%	0.333	29%	0.289	S	S	.	.	H	α-helix	trans	-62.3	-41.8	175.7	-65.2	168	0	0	0	110.4	V136 G139 Q145 R146	V136-I142 HydrophobicContact CG1-CD1 3.97Å; V136-I142 VanDerWaalsContact O-CD1 3.3Å; V136-I142 WeakPolarHBondContact O-CD1 3.46Å; G139-I142 PolarHBondContact O-N 2.96Å; I142-Q145 PolarHBondContact O-N 3.41Å; I142-R146 WeakPolarHBondContact O-CB 3.21Å; I142-R146 PolarHBondContact O-N 2.9Å
143	S	86.9	Confident	83.7	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-67	-42.2	178.8	-59.7	0	0	0	0	111.7	G139 L140 E141 R146 L147 V197	G139-S143 VanDerWaalsContact O-CB 3.28Å; G139-S143 WeakPolarHBondContact O-CB 3.5Å; G139-S143 PolarHBondContact O-N 3.46Å; G139-S143 PolarHBondContact O-OG 2.94Å; L140-S143 PolarHBondContact O-N 3.1Å; E141-S143 VanDerWaalsContact C-N 3.31Å; E141-S143 PolarHBondContact O-N 3.34Å; S143-R146 PolarHBondContact O-N 3.35Å; S143-L147 PolarHBondContact O-N 3.06Å; S143-V197 WeakPolarHBondContact CB-O 3.49Å
144	K	84.3	Confident	82.8	Confident	65 Å²	65	49.6 Å²	49.6	28%	0.283	28%	0.278	S	S	.	.	H	α-helix	trans	-62.6	-47.7	174.8	-172.3	177.7	-177.2	176.1	0	111.1	L140 E141 R146 L147 L148 F174	L140-K144 WeakPolarHBondContact O-CB 3.44Å; L140-K144 PolarHBondContact O-N 3.49Å; E141-K144 PolarHBondContact O-N 2.85Å; K144-R146 VanDerWaalsContact C-N 3.32Å; K144-R146 PolarHBondContact O-N 2.87Å; K144-L147 PolarHBondContact O-N 3Å; K144-L148 HydrophobicContact CG-CD1 4.23Å; K144-L148 WeakPolarHBondContact O-CG 3.25Å; K144-L148 PolarHBondContact O-N 3.09Å; K144-F174 HydrophobicContact CG-CD1 4.09Å; K144-F174 HydrophobicContact CG-CE1 4.21Å
145	Q	85.3	Confident	82	Confident	114 Å²	114	47 Å²	47	53%	0.533	26%	0.261	S	S	.	.	H	α-helix	trans	-59.3	-42.4	175.9	-75	-177.7	-3.8	0	0	111.9	E141 I142 L147 L148 S149	E141-Q145 WeakPolarHBondContact O-CB 3.44Å; E141-Q145 WeakPolarHBondContact O-CG 3.4Å; E141-Q145 PolarHBondContact O-N 3.48Å; I142-Q145 PolarHBondContact O-N 3.41Å; Q145-L147 PolarHBondContact O-N 3.16Å; Q145-L148 PolarHBondContact O-N 3.23Å; Q145-S149 WeakPolarHBondContact O-CB 3.43Å; Q145-S149 PolarHBondContact O-N 3.04Å; Q145-S149 PolarHBondContact O-OG 2.87Å
146	R	87.6	Confident	81.1	Confident	42 Å²	42	47.8 Å²	47.8	16%	0.158	27%	0.265	C	S	.	.	H	α-helix	trans	-63.9	-38.4	177	-168.7	180	-64.6	136	0.7	112.6	D137 I142 S143 K144 S149 G150 G201 L204	D137-R146 PolarHBondContact O-NH1 3.29Å; D137-R146 IonicContact OD1-NH2 3.8Å; D137-R146 PolarHBondContact OD1-NH2 2.85Å; I142-R146 WeakPolarHBondContact O-CB 3.21Å; I142-R146 PolarHBondContact O-N 2.9Å; S143-R146 PolarHBondContact O-N 3.35Å; K144-R146 VanDerWaalsContact C-N 3.32Å; K144-R146 PolarHBondContact O-N 2.87Å; R146-S149 PolarHBondContact O-OG 2.87Å; R146-G150 PolarHBondContact O-N 3.25Å; R146-G150 VanDerWaalsContact O-N 3.14Å; R146-G201 VanDerWaalsContact CD-O 3.27Å; R146-G201 WeakPolarHBondContact CD-O 3.39Å; R146-G201 VanDerWaalsContact NH1-C 3.26Å; R146-G201 PolarHBondContact NH1-O 3Å; R146-L204 HydrophobicContact CG-CB 4.08Å; R146-L204 HydrophobicContact CG-CD1 4.35Å
147	L	85.5	Confident	80.1	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.9	-42.2	173.1	-80.8	161.6	0	0	0	111.3	S143 K144 Q145 Y152 I172 F174 V197 L200 L204 F228	S143-L147 PolarHBondContact O-N 3.06Å; K144-L147 PolarHBondContact O-N 3Å; Q145-L147 PolarHBondContact O-N 3.16Å; L147-Y152 WeakPolarHBondContact CA-OH 3.34Å; L147-Y152 WeakPolarHBondContact O-CE2 3.25Å; L147-Y152 VanDerWaalsContact O-CZ 3.31Å; L147-Y152 PolarHBondContact O-OH 2.97Å; L147-I172 HydrophobicContact CD2-CD1 4.17Å; L147-F174 HydrophobicContact CB-CE1 4.36Å; L147-F174 HydrophobicContact CD1-CE1 3.94Å; L147-V197 HydrophobicContact CD1-CG1 3.88Å; L147-L200 HydrophobicContact CD1-CB 4.07Å; L147-L200 HydrophobicContact CD1-CD1 4.42Å; L147-L200 HydrophobicContact CD2-CB 4.27Å; L147-L204 HydrophobicContact CD2-CD1 3.61Å; L147-L204 HydrophobicContact CG-CD1 3.96Å; L147-F228 HydrophobicContact CD2-CE1 4.11Å; L147-F228 HydrophobicContact CD2-CZ 3.88Å
148	L	84.6	Confident	79	Confident	40 Å²	40	53.8 Å²	53.8	21%	0.209	31%	0.307	C	S	.	.	H	α-helix	trans	-74.1	-33.3	-179.5	-65.5	175.6	0	0	0	113.1	K144 Q145 K164 I165 L168 F174	K144-L148 HydrophobicContact CG-CD1 4.23Å; K144-L148 WeakPolarHBondContact O-CG 3.25Å; K144-L148 PolarHBondContact O-N 3.09Å; Q145-L148 PolarHBondContact O-N 3.23Å; L148-K164 WeakPolarHBondContact O-CE 3.41Å; L148-K164 PolarHBondContact O-NZ 3.28Å; L148-I165 HydrophobicContact CD1-CD1 4.45Å; L148-I165 HydrophobicContact CD1-CG1 4.02Å; L148-I165 HydrophobicContact CD2-CB 4.41Å; L148-I165 HydrophobicContact CD2-CG1 3.64Å; L148-I165 HydrophobicContact CG-CG1 4.45Å; L148-L168 HydrophobicContact CD2-CD1 3.94Å; L148-F174 HydrophobicContact CD2-CZ 4.38Å
149	S	82.6	Confident	78.6	Confident	94 Å²	94	56.3 Å²	56.3	66%	0.657	32%	0.319	S	S	*	.	H	α-helix	trans	-84.3	-7.8	178.9	68.1	0	0	0	0	114.1	Q145 R146	Q145-S149 WeakPolarHBondContact O-CB 3.43Å; Q145-S149 PolarHBondContact O-N 3.04Å; Q145-S149 PolarHBondContact O-OG 2.87Å; R146-S149 PolarHBondContact O-OG 2.87Å
150	G	78.2	Confident	78.3	Confident	17 Å²	17	58.3 Å²	58.3	18%	0.175	33%	0.327	C	S	.	.			trans	-59.6	141	177	0	0	0	0	0	113.1	R146 Y152 K164	R146-G150 PolarHBondContact O-N 3.25Å; R146-G150 VanDerWaalsContact O-N 3.14Å; G150-Y152 WeakPolarHBondContact O-CD2 3.49Å; G150-K164 PolarHBondContact O-NZ 2.97Å
151	N	75.1	Confident	77.9	Confident	96 Å²	96	59.4 Å²	59.4	51%	0.513	34%	0.344	S	S	.	.			trans	-91.1	101.8	173.2	-173.9	-4.4	0	0	0	109.6
152	Y	79.6	Confident	77.7	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.016	35%	0.348	C	S	.	.			trans	-108.3	132.2	-175	-55.9	-65.2	0	0	0	111.1	L147 G150 F154 I155 L168 I225 F228	L147-Y152 WeakPolarHBondContact CA-OH 3.34Å; L147-Y152 WeakPolarHBondContact O-CE2 3.25Å; L147-Y152 VanDerWaalsContact O-CZ 3.31Å; L147-Y152 PolarHBondContact O-OH 2.97Å; G150-Y152 WeakPolarHBondContact O-CD2 3.49Å; Y152-F154 HydrophobicContact CD1-CE1 4.15Å; Y152-F154 HydrophobicContact CD1-CZ 4.02Å; Y152-F154 HydrophobicContact CD2-CZ 4.46Å; Y152-F154 HydrophobicContact CG-CE1 4.1Å; Y152-F154 HydrophobicContact CG-CE2 4.45Å; Y152-F154 AromaticContact CG-CZ 3.78Å; Y152-F154 HydrophobicContact CG-CZ 3.78Å; Y152-F154 PolarHBondContact O-N 2.83Å; Y152-I155 HydrophobicContact CD2-CD1 3.71Å; Y152-I155 HydrophobicContact CD2-CG1 4.39Å; Y152-I155 HydrophobicContact CG-CD1 4.39Å; Y152-I155 PolarHBondContact O-N 3.37Å; Y152-I155 VanDerWaalsContact O-N 3.16Å; Y152-L168 HydrophobicContact CE2-CD1 4.11Å; Y152-L168 HydrophobicContact CE2-CD2 4.41Å; Y152-I225 HydrophobicContact CD1-CB 4.11Å; Y152-I225 HydrophobicContact CD1-CD1 4.31Å; Y152-I225 HydrophobicContact CD1-CG2 3.94Å; Y152-I225 HydrophobicContact CE1-CD1 4.03Å; Y152-I225 HydrophobicContact CE1-CG2 4.29Å; Y152-F228 AromaticContact CD1-CE2 3.9Å; Y152-F228 HydrophobicContact CD1-CE2 3.9Å; Y152-F228 HydrophobicContact CD1-CZ 4.22Å; Y152-F228 AromaticContact CE1-CE2 3.49Å; Y152-F228 HydrophobicContact CE1-CE2 3.49Å; Y152-F228 VanDerWaalsContact CE1-CE2 3.49Å; Y152-F228 AromaticContact CE1-CZ 3.43Å; Y152-F228 HydrophobicContact CE1-CZ 3.43Å; Y152-F228 VanDerWaalsContact CE1-CZ 3.43Å; Y152-F228 HydrophobicContact CE2-CE2 4.31Å; Y152-F228 HydrophobicContact CG-CE2 4.47Å; Y152-F228 AromaticContact CZ-CE2 3.72Å; Y152-F228 AromaticContact CZ-CZ 3.69Å
153	S	67.6	Low	77.3	Confident	22 Å²	22	60 Å²	60	15%	0.154	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-20.6	-174.1	-65.4	0	0	0	0	114.5	I225 K341	S153-I225 PolarHBondContact N-O 3.31Å; S153-K341 WeakPolarHBondContact OG-CD 3.46Å; S153-K341 VanDerWaalsContact OG-CE 3.3Å; S153-K341 WeakPolarHBondContact OG-CE 3.44Å; S153-K341 PolarHBondContact OG-NZ 2.79Å
154	F	70.8	Confident	77	Confident	32 Å²	32	62 Å²	62	14%	0.14	36%	0.361	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.7	-3.3	178.9	55.4	-90.7	0	0	0	113.3	Y152 F167 I225 L226 G227 F228	Y152-F154 HydrophobicContact CD1-CE1 4.15Å; Y152-F154 HydrophobicContact CD1-CZ 4.02Å; Y152-F154 HydrophobicContact CD2-CZ 4.46Å; Y152-F154 HydrophobicContact CG-CE1 4.1Å; Y152-F154 HydrophobicContact CG-CE2 4.45Å; Y152-F154 AromaticContact CG-CZ 3.78Å; Y152-F154 HydrophobicContact CG-CZ 3.78Å; Y152-F154 PolarHBondContact O-N 2.83Å; F154-F167 AromaticContact CD2-CE1 3.77Å; F154-F167 HydrophobicContact CD2-CE1 3.77Å; F154-F167 HydrophobicContact CD2-CZ 4.22Å; F154-F167 AromaticContact CE2-CE1 3.77Å; F154-F167 HydrophobicContact CE2-CE1 3.77Å; F154-I225 HydrophobicContact CE1-CG2 4.44Å; F154-L226 VanDerWaalsContact CD1-C 3.46Å; F154-L226 VanDerWaalsContact CD1-O 3.22Å; F154-L226 WeakPolarHBondContact CD1-O 2.99Å; F154-G227 VanDerWaalsContact CE1-CA 3.47Å; F154-F228 HydrophobicContact CE1-CD2 4.45Å; F154-F228 HydrophobicContact CE2-CD2 4.43Å; F154-F228 AromaticContact CZ-CD2 3.64Å; F154-F228 HydrophobicContact CZ-CD2 3.64Å; F154-F228 AromaticContact CZ-CE2 3.82Å; F154-F228 HydrophobicContact CZ-CE2 3.82Å
155	I	72.9	Confident	76.7	Confident	14 Å²	14	62.4 Å²	62.4	7%	0.072	37%	0.365	C	S	.	.	S	Bend	trans	-104.3	115.2	175.6	-58.1	-168.5	0	0	0	107.5	Y152 M159 K164 F167 L168	Y152-I155 HydrophobicContact CD2-CD1 3.71Å; Y152-I155 HydrophobicContact CD2-CG1 4.39Å; Y152-I155 HydrophobicContact CG-CD1 4.39Å; Y152-I155 PolarHBondContact O-N 3.37Å; Y152-I155 VanDerWaalsContact O-N 3.16Å; I155-M159 HydrophobicContact CG2-CB 4.24Å; I155-M159 HydrophobicContact CG2-SD 3.8Å; I155-K164 HydrophobicContact CD1-CG 4.03Å; I155-K164 HydrophobicContact CG2-CD 4.41Å; I155-K164 HydrophobicContact CG2-CG 4.21Å; I155-F167 HydrophobicContact CD1-CD1 3.93Å; I155-F167 HydrophobicContact CD1-CE1 4.2Å; I155-F167 HydrophobicContact CG1-CD1 4.16Å; I155-F167 HydrophobicContact CG1-CE1 4.06Å; I155-L168 HydrophobicContact CD1-CD1 4.31Å; I155-L168 HydrophobicContact CD1-CD2 4.01Å; I155-L168 HydrophobicContact CD1-CG 4.05Å
156	P	66.4	Low	76.4	Confident	73 Å²	73	62.6 Å²	62.6	47%	0.474	37%	0.369	S	S	.	.			trans	-59.6	140	177	-22.8	33.1	0	0	0	111.7	A158 M159	P156-A158 PolarHBondContact O-N 3.5Å; P156-A158 VanDerWaalsContact O-N 3.12Å; P156-M159 VanDerWaalsContact O-CB 3.28Å; P156-M159 WeakPolarHBondContact O-CB 3.26Å; P156-M159 PolarHBondContact O-N 2.64Å
157	D	65.1	Low	76	Confident	158 Å²	158	64 Å²	64	85%	0.845	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-21.3	176.4	-67.3	-39.4	0	0	0	113	M159	D157-M159 VanDerWaalsContact C-N 3.28Å; D157-M159 PolarHBondContact O-N 2.92Å
158	A	63.9	Low	75.7	Confident	97 Å²	97	64.1 Å²	64.1	80%	0.802	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-10	176.5	0	0	0	0	0	114	P156	P156-A158 PolarHBondContact O-N 3.5Å; P156-A158 VanDerWaalsContact O-N 3.12Å
159	M	76.4	Confident	75.5	Confident	61 Å²	61	64.6 Å²	64.6	30%	0.3	38%	0.384	S	S	.	.	S	Bend	trans	-72.5	130.6	-177.8	-171.7	176.6	-108	0	0	110.7	I155 P156 D157 E163 K164 F167	I155-M159 HydrophobicContact CG2-CB 4.24Å; I155-M159 HydrophobicContact CG2-SD 3.8Å; P156-M159 VanDerWaalsContact O-CB 3.28Å; P156-M159 WeakPolarHBondContact O-CB 3.26Å; P156-M159 PolarHBondContact O-N 2.64Å; D157-M159 VanDerWaalsContact C-N 3.28Å; D157-M159 PolarHBondContact O-N 2.92Å; M159-E163 HydrophobicContact CE-CB 4.13Å; M159-E163 HydrophobicContact CG-CB 3.42Å; M159-E163 VanDerWaalsContact CG-CB 3.42Å; M159-E163 HydrophobicContact SD-CB 4.05Å; M159-K164 HydrophobicContact CG-CB 4.45Å; M159-K164 HydrophobicContact SD-CB 4.22Å; M159-F167 HydrophobicContact CE-CB 4.23Å; M159-F167 HydrophobicContact CE-CG 4.5Å; M159-F167 HydrophobicContact SD-CB 4.3Å
160	T	79.5	Confident	75.2	Confident	65 Å²	65	64.5 Å²	64.5	40%	0.399	38%	0.383	S	S	.	.			trans	-66.1	155.7	177.9	61.5	0	0	0	0	111.4	T162 E163 K164	T160-T162 PolarHBondContact O-N 2.88Å; T160-T162 VanDerWaalsContact O-N 3.16Å; T160-T162 PolarHBondContact OG1-OG1 3.35Å; T160-T162 VanDerWaalsContact OG1-OG1 3.09Å; T160-E163 WeakPolarHBondContact CB-OE2 3.49Å; T160-E163 PolarHBondContact N-OE2 3.49Å; T160-E163 PolarHBondContact O-N 2.9Å; T160-E163 VanDerWaalsContact O-N 3.12Å; T160-E163 WeakPolarHBondContact OG1-CB 3.35Å; T160-E163 WeakPolarHBondContact OG1-CG 3.41Å; T160-E163 PolarHBondContact OG1-N 2.89Å; T160-E163 PolarHBondContact OG1-OE2 3.27Å; T160-K164 WeakPolarHBondContact O-CB 3.5Å; T160-K164 PolarHBondContact O-N 2.83Å
161	A	75.1	Confident	75.1	Confident	78 Å²	78	66.1 Å²	66.1	65%	0.645	39%	0.387	S	S	*	.	H	α-helix	trans	-56.1	-34.9	177.8	0	0	0	0	0	112.7	I165	A161-I165 WeakPolarHBondContact O-CD1 3.04Å; A161-I165 VanDerWaalsContact O-CG1 3.23Å; A161-I165 WeakPolarHBondContact O-CG1 3.35Å; A161-I165 PolarHBondContact O-N 3.16Å
162	T	77.2	Confident	75.3	Confident	96 Å²	96	61.5 Å²	61.5	59%	0.589	36%	0.363	S	S	*	.	H	α-helix	trans	-68	-44.3	176	37	0	0	0	0	112.9	T160 K164 I165 L166	T160-T162 PolarHBondContact O-N 2.88Å; T160-T162 VanDerWaalsContact O-N 3.16Å; T160-T162 PolarHBondContact OG1-OG1 3.35Å; T160-T162 VanDerWaalsContact OG1-OG1 3.09Å; T162-K164 VanDerWaalsContact C-N 3.34Å; T162-I165 PolarHBondContact O-N 2.78Å; T162-L166 WeakPolarHBondContact O-CG 3.34Å; T162-L166 PolarHBondContact O-N 3.05Å
163	E	79.3	Confident	74.9	Confident	93 Å²	93	64.2 Å²	64.2	44%	0.435	38%	0.381	S	S	.	.	H	α-helix	trans	-66.4	-38.6	176.1	-71.7	162.9	156.1	0	0	111.2	M159 T160 I165 L166 F167	M159-E163 HydrophobicContact CE-CB 4.13Å; M159-E163 HydrophobicContact CG-CB 3.42Å; M159-E163 VanDerWaalsContact CG-CB 3.42Å; M159-E163 HydrophobicContact SD-CB 4.05Å; T160-E163 WeakPolarHBondContact CB-OE2 3.49Å; T160-E163 PolarHBondContact N-OE2 3.49Å; T160-E163 PolarHBondContact O-N 2.9Å; T160-E163 VanDerWaalsContact O-N 3.12Å; T160-E163 WeakPolarHBondContact OG1-CB 3.35Å; T160-E163 WeakPolarHBondContact OG1-CG 3.41Å; T160-E163 PolarHBondContact OG1-N 2.89Å; T160-E163 PolarHBondContact OG1-OE2 3.27Å; E163-I165 VanDerWaalsContact C-N 3.33Å; E163-I165 PolarHBondContact O-N 2.88Å; E163-L166 PolarHBondContact O-N 3.15Å; E163-F167 VanDerWaalsContact O-CB 3.3Å; E163-F167 WeakPolarHBondContact O-CB 3.46Å; E163-F167 PolarHBondContact O-N 3.5Å
164	K	79.2	Confident	75	Confident	41 Å²	41	64 Å²	64	18%	0.178	38%	0.377	C	S	.	.	H	α-helix	trans	-61.2	-41.5	175	-171.1	177.3	-172.2	-174.8	0	111.8	L148 G150 I155 M159 T160 T162 L168	L148-K164 WeakPolarHBondContact O-CE 3.41Å; L148-K164 PolarHBondContact O-NZ 3.28Å; G150-K164 PolarHBondContact O-NZ 2.97Å; I155-K164 HydrophobicContact CD1-CG 4.03Å; I155-K164 HydrophobicContact CG2-CD 4.41Å; I155-K164 HydrophobicContact CG2-CG 4.21Å; M159-K164 HydrophobicContact CG-CB 4.45Å; M159-K164 HydrophobicContact SD-CB 4.22Å; T160-K164 WeakPolarHBondContact O-CB 3.5Å; T160-K164 PolarHBondContact O-N 2.83Å; T162-K164 VanDerWaalsContact C-N 3.34Å; K164-L168 HydrophobicContact CG-CD1 4.11Å; K164-L168 WeakPolarHBondContact O-CB 3.48Å; K164-L168 WeakPolarHBondContact O-CG 3.21Å; K164-L168 PolarHBondContact O-N 2.88Å
165	I	79	Confident	74.5	Confident	73 Å²	73	68.4 Å²	68.4	37%	0.374	40%	0.402	S	S	.	.	H	α-helix	trans	-63.1	-48.7	174.4	-70.3	162.3	0	0	0	110.4	L148 A161 T162 E163 F167 L168 S169	L148-I165 HydrophobicContact CD1-CD1 4.45Å; L148-I165 HydrophobicContact CD1-CG1 4.02Å; L148-I165 HydrophobicContact CD2-CB 4.41Å; L148-I165 HydrophobicContact CD2-CG1 3.64Å; L148-I165 HydrophobicContact CG-CG1 4.45Å; A161-I165 WeakPolarHBondContact O-CD1 3.04Å; A161-I165 VanDerWaalsContact O-CG1 3.23Å; A161-I165 WeakPolarHBondContact O-CG1 3.35Å; A161-I165 PolarHBondContact O-N 3.16Å; T162-I165 PolarHBondContact O-N 2.78Å; E163-I165 VanDerWaalsContact C-N 3.33Å; E163-I165 PolarHBondContact O-N 2.88Å; I165-F167 PolarHBondContact O-N 3.47Å; I165-L168 PolarHBondContact O-N 2.95Å; I165-S169 WeakPolarHBondContact O-CB 3.45Å; I165-S169 PolarHBondContact O-N 3.27Å; I165-S169 PolarHBondContact O-OG 2.77Å
166	L	77.9	Confident	73.4	Confident	118 Å²	118	69.8 Å²	69.8	62%	0.618	41%	0.412	S	S	*	.	H	α-helix	trans	-60.4	-47	179.6	-73	170.2	0	0	0	111.4	T162 E163 S169 S170	T162-L166 WeakPolarHBondContact O-CG 3.34Å; T162-L166 PolarHBondContact O-N 3.05Å; E163-L166 PolarHBondContact O-N 3.15Å; L166-S169 WeakPolarHBondContact CA-OG 3.35Å; L166-S169 PolarHBondContact O-N 3.26Å; L166-S169 PolarHBondContact O-OG 3.23Å; L166-S170 PolarHBondContact O-N 2.85Å
167	F	79.6	Confident	72.2	Confident	73 Å²	73	73.9 Å²	73.9	32%	0.32	43%	0.43	S	S	.	.	H	α-helix	trans	-59.9	-52.5	177.8	-179	-100	0	0	0	111.7	F154 I155 M159 E163 I165 S169 S170 I171	F154-F167 AromaticContact CD2-CE1 3.77Å; F154-F167 HydrophobicContact CD2-CE1 3.77Å; F154-F167 HydrophobicContact CD2-CZ 4.22Å; F154-F167 AromaticContact CE2-CE1 3.77Å; F154-F167 HydrophobicContact CE2-CE1 3.77Å; I155-F167 HydrophobicContact CD1-CD1 3.93Å; I155-F167 HydrophobicContact CD1-CE1 4.2Å; I155-F167 HydrophobicContact CG1-CD1 4.16Å; I155-F167 HydrophobicContact CG1-CE1 4.06Å; M159-F167 HydrophobicContact CE-CB 4.23Å; M159-F167 HydrophobicContact CE-CG 4.5Å; M159-F167 HydrophobicContact SD-CB 4.3Å; E163-F167 VanDerWaalsContact O-CB 3.3Å; E163-F167 WeakPolarHBondContact O-CB 3.46Å; E163-F167 PolarHBondContact O-N 3.5Å; I165-F167 PolarHBondContact O-N 3.47Å; F167-S169 VanDerWaalsContact C-N 3.28Å; F167-S169 PolarHBondContact O-N 2.96Å; F167-S170 WeakPolarHBondContact O-CB 3.36Å; F167-S170 PolarHBondContact O-N 3.2Å; F167-S170 VanDerWaalsContact O-N 3.14Å; F167-S170 PolarHBondContact O-OG 3.3Å; F167-I171 HydrophobicContact CD1-CD1 4.05Å; F167-I171 HydrophobicContact CE1-CD1 3.46Å; F167-I171 VanDerWaalsContact CE1-CD1 3.46Å; F167-I171 HydrophobicContact CE2-CD1 4.32Å; F167-I171 HydrophobicContact CZ-CD1 3.63Å; F167-I171 PolarHBondContact O-N 3.38Å
168	L	80.2	Confident	71.1	Confident	1 Å²	1	71.8 Å²	71.8	1%	0.005	42%	0.418	C	S	.	.	H	α-helix	trans	-64.2	-33.6	178.2	-73.1	173.1	0	0	0	112.2	L148 Y152 I155 K164 I165 S170 I171 I172 F174 F228	L148-L168 HydrophobicContact CD2-CD1 3.94Å; Y152-L168 HydrophobicContact CE2-CD1 4.11Å; Y152-L168 HydrophobicContact CE2-CD2 4.41Å; I155-L168 HydrophobicContact CD1-CD1 4.31Å; I155-L168 HydrophobicContact CD1-CD2 4.01Å; I155-L168 HydrophobicContact CD1-CG 4.05Å; K164-L168 HydrophobicContact CG-CD1 4.11Å; K164-L168 WeakPolarHBondContact O-CB 3.48Å; K164-L168 WeakPolarHBondContact O-CG 3.21Å; K164-L168 PolarHBondContact O-N 2.88Å; I165-L168 PolarHBondContact O-N 2.95Å; L168-S170 VanDerWaalsContact C-N 3.28Å; L168-S170 PolarHBondContact O-N 2.93Å; L168-I171 PolarHBondContact O-N 3.32Å; L168-I172 PolarHBondContact O-N 3.4Å; L168-F174 HydrophobicContact CB-CE2 3.95Å; L168-F174 HydrophobicContact CB-CZ 4.07Å; L168-F228 HydrophobicContact CD2-CD2 4.36Å; L168-F228 HydrophobicContact CD2-CE2 4.13Å
169	S	79.1	Confident	69.5	Low	50 Å²	50	73.3 Å²	73.3	35%	0.35	42%	0.417	S	S	.	.	H	α-helix	trans	-68.6	-26.9	176.6	74.1	0	0	0	0	113.3	I165 L166 F167 I171 I172	I165-S169 WeakPolarHBondContact O-CB 3.45Å; I165-S169 PolarHBondContact O-N 3.27Å; I165-S169 PolarHBondContact O-OG 2.77Å; L166-S169 WeakPolarHBondContact CA-OG 3.35Å; L166-S169 PolarHBondContact O-N 3.26Å; L166-S169 PolarHBondContact O-OG 3.23Å; F167-S169 VanDerWaalsContact C-N 3.28Å; F167-S169 PolarHBondContact O-N 2.96Å; S169-I171 VanDerWaalsContact C-N 3.3Å; S169-I172 WeakPolarHBondContact CA-O 3.43Å
170	S	78.1	Confident	67.4	Low	92 Å²	92	75 Å²	75	64%	0.643	43%	0.433	S	S	*	.	H	α-helix	trans	-71.4	-27.8	174.1	78.4	0	0	0	0	112.4	L166 F167 L168	L166-S170 PolarHBondContact O-N 2.85Å; F167-S170 WeakPolarHBondContact O-CB 3.36Å; F167-S170 PolarHBondContact O-N 3.2Å; F167-S170 VanDerWaalsContact O-N 3.14Å; F167-S170 PolarHBondContact O-OG 3.3Å; L168-S170 VanDerWaalsContact C-N 3.28Å; L168-S170 PolarHBondContact O-N 2.93Å
171	I	74.4	Confident	65.3	Low	51 Å²	51	78.2 Å²	78.2	26%	0.262	46%	0.455	S	S	.	.	H	α-helix	trans	-92.4	-50.2	-179.1	-57.4	171.3	0	0	0	110.2	F75 F167 L168 S169 F228	F75-I171 HydrophobicContact CE1-CG2 4.45Å; F75-I171 WeakPolarHBondContact CZ-O 3.48Å; F167-I171 HydrophobicContact CD1-CD1 4.05Å; F167-I171 HydrophobicContact CE1-CD1 3.46Å; F167-I171 VanDerWaalsContact CE1-CD1 3.46Å; F167-I171 HydrophobicContact CE2-CD1 4.32Å; F167-I171 HydrophobicContact CZ-CD1 3.63Å; F167-I171 PolarHBondContact O-N 3.38Å; L168-I171 PolarHBondContact O-N 3.32Å; S169-I171 VanDerWaalsContact C-N 3.3Å; I171-F228 HydrophobicContact CG2-CB 3.91Å
172	I	80.2	Confident	63.6	Low	0 Å²	0	78.2 Å²	78.2	0%	0	46%	0.462	C	S	.	.	S	Bend	trans	-113.3	107.9	-177.7	-58.4	161	0	0	0	107.3	F75 L147 L168 S169 F174 V197 L200 F228	F75-I172 HydrophobicContact CD1-CG1 4.46Å; F75-I172 HydrophobicContact CE1-CG1 3.85Å; F75-I172 HydrophobicContact CE2-CG1 4.34Å; F75-I172 HydrophobicContact CZ-CB 4.45Å; F75-I172 HydrophobicContact CZ-CG1 3.79Å; L147-I172 HydrophobicContact CD2-CD1 4.17Å; L168-I172 PolarHBondContact O-N 3.4Å; S169-I172 WeakPolarHBondContact CA-O 3.43Å; I172-F174 WeakPolarHBondContact O-CD2 3.47Å; I172-F174 PolarHBondContact O-N 3.33Å; I172-V197 HydrophobicContact CG2-CG2 4.38Å; I172-L200 HydrophobicContact CD1-CD1 3.97Å; I172-L200 HydrophobicContact CG1-CD1 4.27Å; I172-L200 HydrophobicContact CG2-CD1 3.85Å; I172-F228 HydrophobicContact CD1-CD1 3.93Å; I172-F228 HydrophobicContact CD1-CD2 4.21Å; I172-F228 HydrophobicContact CD1-CE1 4.11Å; I172-F228 HydrophobicContact CD1-CE2 4.38Å; I172-F228 HydrophobicContact CD1-CG 3.99Å; I172-F228 HydrophobicContact CD1-CZ 4.34Å
173	P	70.7	Confident	61.6	Low	61 Å²	61	79.4 Å²	79.4	40%	0.396	47%	0.465	S	S	.	.			trans	-65.2	111.7	174.3	22.5	-27	0	0	0	108.8	D175 Q196	P173-D175 VanDerWaalsContact C-N 3.29Å; P173-Q196 PolarHBondContact O-NE2 3.18Å; P173-Q196 VanDerWaalsContact O-NE2 3.1Å
174	F	69.9	Low	59.7	Low	17 Å²	17	83 Å²	83	8%	0.075	49%	0.486	C	S	.	.	S	Bend	trans	-76.1	-21	177.6	-69.8	-70.6	0	0	0	112.4	K144 L147 L148 L168 I172 V197	K144-F174 HydrophobicContact CG-CD1 4.09Å; K144-F174 HydrophobicContact CG-CE1 4.21Å; L147-F174 HydrophobicContact CB-CE1 4.36Å; L147-F174 HydrophobicContact CD1-CE1 3.94Å; L148-F174 HydrophobicContact CD2-CZ 4.38Å; L168-F174 HydrophobicContact CB-CE2 3.95Å; L168-F174 HydrophobicContact CB-CZ 4.07Å; I172-F174 WeakPolarHBondContact O-CD2 3.47Å; I172-F174 PolarHBondContact O-N 3.33Å; F174-V197 HydrophobicContact CD1-CG1 4.23Å; F174-V197 HydrophobicContact CD1-CG2 4.19Å
175	D	60.4	Low	57.7	Low	125 Å²	125	91 Å²	91	67%	0.668	52%	0.515	S	S	*	.	S	Bend	trans	-114.1	127.1	178.3	-59.8	-39.4	0	0	0	109.8	P173 L177	P173-D175 VanDerWaalsContact C-N 3.29Å; D175-L177 PolarHBondContact O-N 3.38Å
176	C	49.7	Very low	56	Low	42 Å²	42	97.5 Å²	97.5	28%	0.284	54%	0.541	S	S	.	.			trans	-80.3	97.7	174.7	-87	0	0	0	0	110.5	L192	C176-L192 HydrophobicContact CB-CB 4.32Å
177	L	41.3	Very low	53.7	Low	159 Å²	159	97.3 Å²	97.3	83%	0.832	55%	0.545	S	S	*	.			trans	-101.1	79.7	163.4	-74.8	168.6	0	0	0	109.2	D175 T179	D175-L177 PolarHBondContact O-N 3.38Å; L177-T179 PolarHBondContact O-N 3.3Å
178	L	41	Very low	51.4	Low	115 Å²	115	100.2 Å²	100.2	60%	0.602	57%	0.571	S	S	*	*			trans	-78.9	104.9	166.8	-72.9	169.7	0	0	0	108.3	Y60 L192	Y60-L178 HydrophobicContact CE1-CD1 4.27Å; L178-L192 HydrophobicContact CD1-CD2 4.5Å
179	T	31.8	Very low	49.4	Very low	128 Å²	128	106.3 Å²	106.3	79%	0.785	60%	0.603	S	S	*	*			trans	-91.5	122.7	160.1	33.7	0	0	0	0	108	L177	L177-T179 PolarHBondContact O-N 3.3Å
180	P	32.4	Very low	47.6	Very low	96 Å²	96	109.1 Å²	109.1	62%	0.623	62%	0.62	S	S	*	*			trans	-68.7	145.1	175.6	26.1	-31.1	0	0	0	110.4	G182	P180-G182 PolarHBondContact O-N 3.09Å; P180-G182 VanDerWaalsContact O-N 3.12Å
181	P	35.3	Very low	46	Very low	134 Å²	134	113.1 Å²	113.1	87%	0.87	63%	0.633	S	S	*	*	S	Bend	trans	-72.7	107	173.1	28.9	-29.5	0	0	0	109.2
182	G	38.7	Very low	45	Very low	77 Å²	77	112.8 Å²	112.8	79%	0.794	63%	0.631	S	S	*	*	S	Bend	trans	94.2	31.8	151.7	0	0	0	0	0	119.2	P180	P180-G182 PolarHBondContact O-N 3.09Å; P180-G182 VanDerWaalsContact O-N 3.12Å
183	D	35	Very low	44	Very low	122 Å²	122	116 Å²	116	65%	0.652	65%	0.648	S	S	*	*			trans	-135.7	111	163.6	-128	-21.5	0	0	0	112.5	R185	D183-R185 PolarHBondContact O-N 3.32Å
184	L	39.5	Very low	44	Very low	167 Å²	167	113.5 Å²	113.5	87%	0.874	63%	0.631	S	S	*	*			trans	-80.9	61.8	-177.1	-160.7	85.1	0	0	0	110.1
185	R	37.8	Very low	44.4	Very low	210 Å²	210	112.8 Å²	112.8	79%	0.792	63%	0.629	S	S	*	*			trans	-136.5	114.2	168.2	-78.8	-173.9	-104.6	-122.7	-3.2	111.2	D183 T187	D183-R185 PolarHBondContact O-N 3.32Å; R185-T187 PolarHBondContact O-N 3.42Å
186	F	43.5	Very low	45.6	Very low	209 Å²	209	107 Å²	107	92%	0.917	60%	0.598	S	S	*	*			trans	-59	115.2	-179.9	-81.2	-101.7	0	0	0	113.1
187	T	28.7	Very low	47.3	Very low	115 Å²	115	105 Å²	105	71%	0.706	58%	0.584	S	S	*	*			trans	-143.5	129.6	143.1	45.2	0	0	0	0	108.9	R185 I189	R185-T187 PolarHBondContact O-N 3.42Å; T187-I189 PolarHBondContact O-N 3.43Å
188	P	32.5	Very low	49.5	Very low	133 Å²	133	100.2 Å²	100.2	86%	0.864	56%	0.555	S	S	*	*			trans	-72.8	112.4	171.3	4.1	11	0	0	0	108.5
189	I	37.6	Very low	51.8	Low	130 Å²	130	94.7 Å²	94.7	67%	0.667	53%	0.526	S	S	*	.			trans	-71.7	140.4	171.9	-61.3	169.2	0	0	0	107.7	T187 L191	T187-I189 PolarHBondContact O-N 3.43Å; I189-L191 PolarHBondContact O-N 2.95Å
190	P	40.4	Very low	54.6	Low	109 Å²	109	88.6 Å²	88.6	71%	0.708	49%	0.489	S	S	*	.			trans	-62.7	138.4	-174.5	-10.6	23.9	0	0	0	110.6	L192	P190-L192 PolarHBondContact O-N 3.34Å
191	L	44.6	Very low	57.2	Low	176 Å²	176	84 Å²	84	92%	0.921	46%	0.459	S	S	*	.			trans	-20.9	94.9	169.4	-125.6	79.8	0	0	0	112.3	I189 I193	I189-L191 PolarHBondContact O-N 2.95Å; L191-I193 PolarHBondContact O-N 3.23Å
192	L	53.2	Low	59.8	Low	44 Å²	44	77.7 Å²	77.7	23%	0.23	42%	0.418	C	S	.	.			trans	-66.6	120.2	174.4	-138.5	94.2	0	0	0	107.1	Y60 D78 C176 L178 P190 P194	Y60-L192 HydrophobicContact CD1-CD2 3.7Å; Y60-L192 HydrophobicContact CD2-CD1 3.89Å; Y60-L192 HydrophobicContact CD2-CD2 3.86Å; Y60-L192 HydrophobicContact CD2-CG 4.21Å; Y60-L192 HydrophobicContact CE1-CD1 4.46Å; Y60-L192 HydrophobicContact CE1-CD2 3.85Å; Y60-L192 HydrophobicContact CE2-CD1 3.46Å; Y60-L192 VanDerWaalsContact CE2-CD1 3.46Å; Y60-L192 HydrophobicContact CE2-CD2 4.03Å; Y60-L192 HydrophobicContact CE2-CG 4.24Å; Y60-L192 HydrophobicContact CG-CD2 3.69Å; D78-L192 HydrophobicContact CB-CD2 4.45Å; C176-L192 HydrophobicContact CB-CB 4.32Å; L178-L192 HydrophobicContact CD1-CD2 4.5Å; P190-L192 PolarHBondContact O-N 3.34Å; L192-P194 WeakPolarHBondContact O-CD 3.33Å
193	I	61.1	Low	62.3	Low	67 Å²	67	74 Å²	74	34%	0.344	38%	0.38	S	S	.	.			trans	-67.9	120.7	173.6	-72	172.4	0	0	0	107.2	L191 S195	L191-I193 PolarHBondContact O-N 3.23Å; I193-S195 PolarHBondContact O-N 3.11Å
194	P	69.4	Low	64.9	Low	8 Å²	8	69.2 Å²	69.2	5%	0.052	35%	0.354	C	S	.	.			trans	-70.2	98.3	-175.2	16.1	-17.1	0	0	0	110.9	D78 L140 L192 Q196 V197 R198	D78-P194 WeakPolarHBondContact OD2-CA 3.39Å; L140-P194 HydrophobicContact CD1-CG 3.65Å; L140-P194 HydrophobicContact CD2-CG 4.18Å; L192-P194 WeakPolarHBondContact O-CD 3.33Å; P194-Q196 VanDerWaalsContact C-N 3.28Å; P194-Q196 HydrophobicContact CB-CG 4.46Å; P194-Q196 PolarHBondContact O-N 2.81Å; P194-V197 HydrophobicContact CB-CB 4.36Å; P194-V197 HydrophobicContact CB-CG2 4.01Å; P194-V197 HydrophobicContact CG-CG2 4.44Å; P194-V197 PolarHBondContact O-N 3.06Å; P194-R198 PolarHBondContact O-N 3.42Å
195	S	79.1	Confident	67.3	Low	2 Å²	2	65 Å²	65	1%	0.014	33%	0.329	C	S	.	.	H	α-helix	trans	-69	-29.9	-177.2	-67.5	0	0	0	0	111	D78 I193 V197 R198 A199	D78-S195 WeakPolarHBondContact OD1-CA 3.24Å; D78-S195 VanDerWaalsContact OD1-CB 3.32Å; D78-S195 WeakPolarHBondContact OD1-CB 3.41Å; D78-S195 PolarHBondContact OD1-N 2.59Å; D78-S195 PolarHBondContact OD2-N 2.71Å; I193-S195 PolarHBondContact O-N 3.11Å; S195-V197 PolarHBondContact O-N 3.21Å; S195-R198 PolarHBondContact O-N 2.78Å; S195-A199 WeakPolarHBondContact O-CB 3.42Å; S195-A199 PolarHBondContact O-N 2.99Å
196	Q	85.3	Confident	69.8	Low	5 Å²	5	55.3 Å²	55.3	2%	0.023	29%	0.293	C	S	.	.	H	α-helix	trans	-58.1	-44.7	174	68.4	179.3	63.3	0	0	112	M76 D78 P173 P194 R198 A199 L200	M76-Q196 WeakPolarHBondContact O-CB 3.2Å; D78-Q196 WeakPolarHBondContact OD1-CB 3.39Å; D78-Q196 PolarHBondContact OD1-N 2.8Å; P173-Q196 PolarHBondContact O-NE2 3.18Å; P173-Q196 VanDerWaalsContact O-NE2 3.1Å; P194-Q196 VanDerWaalsContact C-N 3.28Å; P194-Q196 HydrophobicContact CB-CG 4.46Å; P194-Q196 PolarHBondContact O-N 2.81Å; Q196-R198 VanDerWaalsContact C-N 3.32Å; Q196-R198 PolarHBondContact O-N 2.74Å; Q196-A199 PolarHBondContact O-N 2.99Å; Q196-L200 WeakPolarHBondContact O-CB 3.36Å; Q196-L200 WeakPolarHBondContact O-CG 3.43Å; Q196-L200 PolarHBondContact O-N 2.99Å
197	V	85.1	Confident	71.9	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-69.8	-37.7	-177.4	176.3	0	0	0	0	109.4	L140 S143 L147 I172 F174 P194 S195 G201	L140-V197 HydrophobicContact CD1-CB 4.11Å; L140-V197 HydrophobicContact CD1-CG1 3.98Å; S143-V197 WeakPolarHBondContact CB-O 3.49Å; L147-V197 HydrophobicContact CD1-CG1 3.88Å; I172-V197 HydrophobicContact CG2-CG2 4.38Å; F174-V197 HydrophobicContact CD1-CG1 4.23Å; F174-V197 HydrophobicContact CD1-CG2 4.19Å; P194-V197 HydrophobicContact CB-CB 4.36Å; P194-V197 HydrophobicContact CB-CG2 4.01Å; P194-V197 HydrophobicContact CG-CG2 4.44Å; P194-V197 PolarHBondContact O-N 3.06Å; S195-V197 PolarHBondContact O-N 3.21Å; V197-G201 PolarHBondContact O-N 3.13Å
198	R	88.3	Confident	74.5	Confident	57 Å²	57	42.4 Å²	42.4	22%	0.215	24%	0.241	C	C	.	.	H	α-helix	trans	-67.4	-40.9	175.4	-64	-179.5	170.8	-164.5	-2.2	112.1	L55 F138 L140 P194 S195 Q196 G201 G202	L55-R198 HydrophobicContact CD1-CB 3.3Å; F138-R198 VanDerWaalsContact O-CD 3.25Å; F138-R198 WeakPolarHBondContact O-CD 3.28Å; F138-R198 WeakPolarHBondContact O-CG 3.21Å; L140-R198 HydrophobicContact CB-CG 4.5Å; L140-R198 HydrophobicContact CD1-CG 4.38Å; P194-R198 PolarHBondContact O-N 3.42Å; S195-R198 PolarHBondContact O-N 2.78Å; Q196-R198 VanDerWaalsContact C-N 3.32Å; Q196-R198 PolarHBondContact O-N 2.74Å; R198-G201 PolarHBondContact O-N 3.36Å; R198-G202 PolarHBondContact O-N 3.49Å
199	A	89	Confident	77.1	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-65.2	-43.5	176.4	0	0	0	0	0	110.9	C53 L55 A64 S195 Q196 G202 L203	C53-A199 PolarHBondContact SG-O 3.32Å; L55-A199 HydrophobicContact CD1-CB 4.33Å; A64-A199 HydrophobicContact CB-CB 4.38Å; S195-A199 WeakPolarHBondContact O-CB 3.42Å; S195-A199 PolarHBondContact O-N 2.99Å; Q196-A199 PolarHBondContact O-N 2.99Å; A199-G202 PolarHBondContact O-N 3.44Å; A199-L203 WeakPolarHBondContact O-CB 3.42Å; A199-L203 PolarHBondContact O-N 2.78Å
200	L	89.6	Confident	79.2	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.1	-48.1	172	-82.4	167.3	0	0	0	112.4	A64 I73 F75 L147 I172 Q196 G202 L203 L204 F228	A64-L200 HydrophobicContact CB-CD2 3.79Å; A64-L200 HydrophobicContact CB-CG 3.93Å; I73-L200 HydrophobicContact CG2-CD2 3.46Å; I73-L200 VanDerWaalsContact CG2-CD2 3.46Å; F75-L200 HydrophobicContact CB-CD1 4.11Å; F75-L200 HydrophobicContact CB-CD2 3.94Å; F75-L200 HydrophobicContact CB-CG 4.07Å; F75-L200 HydrophobicContact CD2-CD1 4.36Å; F75-L200 HydrophobicContact CG-CD1 4.09Å; F75-L200 HydrophobicContact CG-CD2 4.47Å; L147-L200 HydrophobicContact CD1-CB 4.07Å; L147-L200 HydrophobicContact CD1-CD1 4.42Å; L147-L200 HydrophobicContact CD2-CB 4.27Å; I172-L200 HydrophobicContact CD1-CD1 3.97Å; I172-L200 HydrophobicContact CG1-CD1 4.27Å; I172-L200 HydrophobicContact CG2-CD1 3.85Å; Q196-L200 WeakPolarHBondContact O-CB 3.36Å; Q196-L200 WeakPolarHBondContact O-CG 3.43Å; Q196-L200 PolarHBondContact O-N 2.99Å; L200-G202 PolarHBondContact O-N 2.96Å; L200-L203 PolarHBondContact O-N 3.44Å; L200-L204 WeakPolarHBondContact O-CG 3.26Å; L200-L204 PolarHBondContact O-N 2.83Å; L200-F228 HydrophobicContact CD2-CD1 4.22Å; L200-F228 HydrophobicContact CD2-CE1 4.01Å
201	G	87.9	Confident	81.2	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.7	-45.1	176.4	0	0	0	0	0	112.3	R146 V197 R198 L204 K205	R146-G201 VanDerWaalsContact CD-O 3.27Å; R146-G201 WeakPolarHBondContact CD-O 3.39Å; R146-G201 VanDerWaalsContact NH1-C 3.26Å; R146-G201 PolarHBondContact NH1-O 3Å; V197-G201 PolarHBondContact O-N 3.13Å; R198-G201 PolarHBondContact O-N 3.36Å; G201-L204 PolarHBondContact O-N 3.35Å; G201-K205 PolarHBondContact O-N 3.28Å
202	G	89.4	Confident	82.8	Confident	0 Å²	0	32.8 Å²	32.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-60.1	-43.9	176.3	0	0	0	0	0	112.7	R198 A199 L200 K205 F206	R198-G202 PolarHBondContact O-N 3.49Å; A199-G202 PolarHBondContact O-N 3.44Å; L200-G202 PolarHBondContact O-N 2.96Å; G202-K205 WeakPolarHBondContact O-CB 3.43Å; G202-K205 PolarHBondContact O-N 3.19Å; G202-F206 PolarHBondContact O-N 3.01Å
203	L	91.4	Very high	83.6	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-60.6	-48.3	175.2	-176.5	64.2	0	0	0	111.5	H51 C53 A64 I73 A199 L200 K205 F206 L207	H51-L203 HydrophobicContact CB-CD1 4.49Å; H51-L203 WeakPolarHBondContact O-CD1 3.47Å; C53-L203 HydrophobicContact CB-CB 3.73Å; C53-L203 HydrophobicContact CB-CD1 4.13Å; C53-L203 HydrophobicContact CB-CG 4.45Å; A64-L203 HydrophobicContact CB-CD2 3.89Å; I73-L203 HydrophobicContact CG2-CD2 3.96Å; A199-L203 WeakPolarHBondContact O-CB 3.42Å; A199-L203 PolarHBondContact O-N 2.78Å; L200-L203 PolarHBondContact O-N 3.44Å; L203-K205 VanDerWaalsContact C-N 3.27Å; L203-K205 PolarHBondContact O-N 3.07Å; L203-F206 WeakPolarHBondContact O-CB 3.17Å; L203-F206 PolarHBondContact O-N 2.86Å; L203-F206 VanDerWaalsContact O-N 3.08Å; L203-L207 HydrophobicContact CD1-CG 4.41Å; L203-L207 HydrophobicContact CG-CD1 4.21Å; L203-L207 HydrophobicContact CG-CG 4.37Å; L203-L207 WeakPolarHBondContact O-CG 3.31Å; L203-L207 PolarHBondContact O-N 3.3Å
204	L	89.6	Confident	84.2	Confident	21 Å²	21	29.2 Å²	29.2	11%	0.11	14%	0.143	C	C	.	.	H	α-helix	trans	-59.8	-37.3	177.8	-72.6	175	0	0	0	112.6	I73 R146 L147 L200 G201 G208 I225	I73-L204 HydrophobicContact CD1-CD2 3.56Å; I73-L204 HydrophobicContact CD1-CG 4.41Å; R146-L204 HydrophobicContact CG-CB 4.08Å; R146-L204 HydrophobicContact CG-CD1 4.35Å; L147-L204 HydrophobicContact CD2-CD1 3.61Å; L147-L204 HydrophobicContact CG-CD1 3.96Å; L200-L204 WeakPolarHBondContact O-CG 3.26Å; L200-L204 PolarHBondContact O-N 2.83Å; G201-L204 PolarHBondContact O-N 3.35Å; L204-G208 PolarHBondContact O-N 2.95Å; L204-I225 HydrophobicContact CD2-CD1 3.49Å; L204-I225 VanDerWaalsContact CD2-CD1 3.49Å
205	K	90.1	Very high	84.6	Confident	80 Å²	80	35.1 Å²	35.1	35%	0.348	17%	0.17	S	C	.	.	H	α-helix	trans	-64.7	-43.1	174.7	-178.8	60.5	170.2	-177.6	0	111.5	L133 D137 G201 G202 L203 R209	L133-K205 HydrophobicContact CD1-CG 4.38Å; D137-K205 HydrophobicContact CB-CG 4.36Å; D137-K205 WeakPolarHBondContact OD1-CE 3.41Å; G201-K205 PolarHBondContact O-N 3.28Å; G202-K205 WeakPolarHBondContact O-CB 3.43Å; G202-K205 PolarHBondContact O-N 3.19Å; L203-K205 VanDerWaalsContact C-N 3.27Å; L203-K205 PolarHBondContact O-N 3.07Å; K205-R209 WeakPolarHBondContact O-CB 3.35Å; K205-R209 PolarHBondContact O-N 2.85Å
206	F	89.6	Confident	84.3	Confident	6 Å²	6	43.5 Å²	43.5	3%	0.026	21%	0.213	C	C	.	.	H	α-helix	trans	-61.7	-51.4	177	174.8	-107	0	0	0	111.6	H51 V101 I131 L133 G202 L203 G208 R209 R210 I212	H51-F206 HydrophobicContact CB-CD1 4.41Å; H51-F206 HydrophobicContact CB-CE1 3.9Å; H51-F206 AromaticContact CG-CE1 3.89Å; H51-F206 AromaticContact ND1-CE1 3.8Å; V101-F206 HydrophobicContact CG1-CB 4.19Å; V101-F206 HydrophobicContact CG1-CD2 4.45Å; V101-F206 HydrophobicContact CG1-CG 4.38Å; V101-F206 HydrophobicContact CG2-CB 4.11Å; V101-F206 HydrophobicContact CG2-CD1 3.68Å; V101-F206 HydrophobicContact CG2-CD2 3.66Å; V101-F206 HydrophobicContact CG2-CE1 3.94Å; V101-F206 HydrophobicContact CG2-CE2 3.94Å; V101-F206 HydrophobicContact CG2-CG 3.52Å; V101-F206 HydrophobicContact CG2-CZ 4.08Å; I131-F206 HydrophobicContact CD1-CD2 4.41Å; I131-F206 HydrophobicContact CD1-CE2 3.34Å; I131-F206 HydrophobicContact CD1-CZ 3.6Å; I131-F206 HydrophobicContact CG1-CE2 4.5Å; I131-F206 HydrophobicContact CG2-CD2 4.34Å; I131-F206 HydrophobicContact CG2-CE2 4.13Å; L133-F206 HydrophobicContact CD1-CB 4.17Å; G202-F206 PolarHBondContact O-N 3.01Å; L203-F206 WeakPolarHBondContact O-CB 3.17Å; L203-F206 PolarHBondContact O-N 2.86Å; L203-F206 VanDerWaalsContact O-N 3.08Å; F206-G208 VanDerWaalsContact C-N 3.34Å; F206-G208 PolarHBondContact O-N 3.04Å; F206-R209 PolarHBondContact O-N 3.22Å; F206-R209 VanDerWaalsContact O-N 3.14Å; F206-R210 HydrophobicContact CD2-CG 4.2Å; F206-R210 HydrophobicContact CE2-CG 3.65Å; F206-R210 HydrophobicContact CZ-CG 3.97Å; F206-R210 PolarHBondContact O-N 3.28Å; F206-I212 HydrophobicContact CD1-CD1 3.96Å; F206-I212 HydrophobicContact CE1-CD1 3.34Å; F206-I212 HydrophobicContact CZ-CD1 3.99Å
207	L	87.5	Confident	83.7	Confident	3 Å²	3	45.8 Å²	45.8	2%	0.016	22%	0.224	C	C	.	.	H	α-helix	trans	-56.5	-47.1	177.5	-66.4	177.5	0	0	0	111.4	Y66 I73 L203 R209 R211 I212 V223	Y66-L207 HydrophobicContact CD1-CD1 4.2Å; Y66-L207 HydrophobicContact CD1-CD2 3.49Å; Y66-L207 VanDerWaalsContact CD1-CD2 3.49Å; Y66-L207 HydrophobicContact CD2-CD1 4Å; Y66-L207 HydrophobicContact CE1-CD2 4.15Å; Y66-L207 HydrophobicContact CG-CD1 3.77Å; Y66-L207 HydrophobicContact CG-CD2 3.83Å; Y66-L207 HydrophobicContact CG-CG 4.46Å; I73-L207 HydrophobicContact CD1-CD1 4.34Å; L203-L207 HydrophobicContact CD1-CG 4.41Å; L203-L207 HydrophobicContact CG-CD1 4.21Å; L203-L207 HydrophobicContact CG-CG 4.37Å; L203-L207 WeakPolarHBondContact O-CG 3.31Å; L203-L207 PolarHBondContact O-N 3.3Å; L207-R209 VanDerWaalsContact C-N 3.34Å; L207-R209 PolarHBondContact O-N 3.44Å; L207-R211 VanDerWaalsContact O-CA 3.31Å; L207-R211 WeakPolarHBondContact O-CA 3.35Å; L207-R211 PolarHBondContact O-N 3.44Å; L207-I212 HydrophobicContact CD2-CB 4.29Å; L207-I212 HydrophobicContact CD2-CD1 3.66Å; L207-I212 HydrophobicContact CD2-CG1 4.49Å; L207-V223 HydrophobicContact CB-CG2 4.4Å; L207-V223 WeakPolarHBondContact O-CG2 3.33Å
208	G	84.4	Confident	83.1	Confident	50 Å²	50	51.9 Å²	51.9	52%	0.515	26%	0.257	S	S	.	.	H	α-helix	trans	-65.9	-32.6	178.2	0	0	0	0	0	113.9	L204 F206	L204-G208 PolarHBondContact O-N 2.95Å; F206-G208 VanDerWaalsContact C-N 3.34Å; F206-G208 PolarHBondContact O-N 3.04Å
209	R	85.8	Confident	82.2	Confident	178 Å²	178	58.7 Å²	58.7	67%	0.672	28%	0.284	S	S	*	.	H	α-helix	trans	-76.8	-41	179.7	-174.8	178.1	179.7	-179.8	-0.6	112.6	K205 F206 L207	K205-R209 WeakPolarHBondContact O-CB 3.35Å; K205-R209 PolarHBondContact O-N 2.85Å; F206-R209 PolarHBondContact O-N 3.22Å; F206-R209 VanDerWaalsContact O-N 3.14Å; L207-R209 VanDerWaalsContact C-N 3.34Å; L207-R209 PolarHBondContact O-N 3.44Å
210	R	83.4	Confident	81.3	Confident	119 Å²	119	66.2 Å²	66.2	45%	0.449	32%	0.324	S	S	.	.	H	α-helix	trans	-85.8	-17.1	178.9	-74.2	-107.9	-166.9	-159.8	10	113	E129 F206 I212	E129-R210 IonicContact OE1-CZ 3.73Å; E129-R210 IonicContact OE1-NH2 3.39Å; E129-R210 PolarHBondContact OE1-NH2 3.48Å; E129-R210 IonicContact OE2-NH2 2.64Å; F206-R210 HydrophobicContact CD2-CG 4.2Å; F206-R210 HydrophobicContact CE2-CG 3.65Å; F206-R210 HydrophobicContact CZ-CG 3.97Å; F206-R210 PolarHBondContact O-N 3.28Å; R210-I212 VanDerWaalsContact C-N 3.26Å; R210-I212 HydrophobicContact CB-CD1 4.13Å; R210-I212 HydrophobicContact CB-CG1 3.81Å; R210-I212 PolarHBondContact O-N 3.26Å
211	R	82.5	Confident	80.5	Confident	43 Å²	43	68.3 Å²	68.3	16%	0.162	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	55	41.2	-178.3	-57.8	-166.4	71.2	-160.2	-2.1	112.8	L207 G213 V214 E215 E217 D218 V221	L207-R211 VanDerWaalsContact O-CA 3.31Å; L207-R211 WeakPolarHBondContact O-CA 3.35Å; L207-R211 PolarHBondContact O-N 3.44Å; R211-G213 PolarHBondContact O-N 3.46Å; R211-V214 HydrophobicContact CB-CG2 4.13Å; R211-V214 CarbonylContact O-C 3.59Å; R211-V214 VanDerWaalsContact O-C 3.3Å; R211-V214 WeakPolarHBondContact O-CG2 3.27Å; R211-V214 PolarHBondContact O-N 3.45Å; R211-E215 WeakPolarHBondContact O-CG 3.26Å; R211-E215 PolarHBondContact O-N 3.48Å; R211-E215 VanDerWaalsContact O-N 3.16Å; R211-E217 PolarHBondContact NH1-O 2.94Å; R211-E217 PolarHBondContact NH2-O 2.86Å; R211-D218 PolarHBondContact NH2-O 3.3Å; R211-V221 PolarHBondContact NH2-O 2.54Å
212	I	77.9	Confident	80	Confident	5 Å²	5	70.6 Å²	70.6	3%	0.026	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	125	-174.9	-67	163.4	0	0	0	110.4	Y66 T68 F206 L207 R210 V214	Y66-I212 HydrophobicContact CE1-CG2 4.38Å; T68-I212 HydrophobicContact CG2-CG2 3.67Å; F206-I212 HydrophobicContact CD1-CD1 3.96Å; F206-I212 HydrophobicContact CE1-CD1 3.34Å; F206-I212 HydrophobicContact CZ-CD1 3.99Å; L207-I212 HydrophobicContact CD2-CB 4.29Å; L207-I212 HydrophobicContact CD2-CD1 3.66Å; L207-I212 HydrophobicContact CD2-CG1 4.49Å; R210-I212 VanDerWaalsContact C-N 3.26Å; R210-I212 HydrophobicContact CB-CD1 4.13Å; R210-I212 HydrophobicContact CB-CG1 3.81Å; R210-I212 PolarHBondContact O-N 3.26Å; I212-V214 VanDerWaalsContact C-N 3.28Å; I212-V214 PolarHBondContact O-N 2.92Å
213	G	69	Low	79.7	Confident	35 Å²	35	71.4 Å²	71.4	36%	0.361	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.9	-1.6	-179.5	0	0	0	0	0	115.9	R211	R211-G213 PolarHBondContact O-N 3.46Å
214	V	74.8	Confident	79.1	Confident	2 Å²	2	71.4 Å²	71.4	1%	0.012	36%	0.357	C	S	.	.			trans	-138.1	32.6	174.9	-65.8	0	0	0	0	110.7	R211 I212 L216 E217 V221 V223 L342	R211-V214 HydrophobicContact CB-CG2 4.13Å; R211-V214 CarbonylContact O-C 3.59Å; R211-V214 VanDerWaalsContact O-C 3.3Å; R211-V214 WeakPolarHBondContact O-CG2 3.27Å; R211-V214 PolarHBondContact O-N 3.45Å; I212-V214 VanDerWaalsContact C-N 3.28Å; I212-V214 PolarHBondContact O-N 2.92Å; V214-L216 VanDerWaalsContact C-N 3.27Å; V214-L216 PolarHBondContact O-N 3.38Å; V214-E217 HydrophobicContact CB-CB 4.08Å; V214-E217 HydrophobicContact CB-CG 3.92Å; V214-E217 HydrophobicContact CG1-CG 4.24Å; V214-E217 PolarHBondContact O-N 3.33Å; V214-V221 HydrophobicContact CB-CG1 4.36Å; V214-V221 HydrophobicContact CG1-CG1 4.04Å; V214-V223 HydrophobicContact CG2-CG2 4.03Å; V214-L342 HydrophobicContact CG1-CD1 4.29Å; V214-L342 HydrophobicContact CG1-CD2 3.61Å
215	E	76.7	Confident	78.8	Confident	132 Å²	132	70.9 Å²	70.9	62%	0.617	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-32.3	-171	-61.2	-174.8	171.3	0	0	112.7	R211	R211-E215 WeakPolarHBondContact O-CG 3.26Å; R211-E215 PolarHBondContact O-N 3.48Å; R211-E215 VanDerWaalsContact O-N 3.16Å
216	L	72.4	Confident	78.2	Confident	177 Å²	177	67.9 Å²	67.9	93%	0.927	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95	-1.8	-179.1	-58.5	177.4	0	0	0	113.4	V214	V214-L216 VanDerWaalsContact C-N 3.27Å; V214-L216 PolarHBondContact O-N 3.38Å
217	E	73.2	Confident	77.8	Confident	53 Å²	53	68.2 Å²	68.2	25%	0.248	35%	0.348	C	S	.	.	S	Bend	trans	-88.3	159.1	-175.7	-61.6	-67.4	168.1	0	0	112.4	R211 V214 V221 H344	R211-E217 PolarHBondContact NH1-O 2.94Å; R211-E217 PolarHBondContact NH2-O 2.86Å; V214-E217 HydrophobicContact CB-CB 4.08Å; V214-E217 HydrophobicContact CB-CG 3.92Å; V214-E217 HydrophobicContact CG1-CG 4.24Å; V214-E217 PolarHBondContact O-N 3.33Å; E217-V221 HydrophobicContact CB-CB 4.02Å; E217-V221 HydrophobicContact CB-CG1 4.25Å; E217-V221 HydrophobicContact CB-CG2 4.18Å; E217-H344 IonicContact OE1-CE1 2.86Å; E217-H344 PolarHBondContact OE1-CE1 2.82Å; E217-H344 IonicContact OE1-ND1 2.94Å; E217-H344 IonicContact OE2-CE1 3.7Å
218	D	71.8	Confident	77.5	Confident	128 Å²	128	69.1 Å²	69.1	68%	0.684	35%	0.352	S	S	*	.			trans	-54.5	146	177.2	-77.9	-28.5	0	0	0	112.6	R211 N220 V221	R211-D218 PolarHBondContact NH2-O 3.3Å; D218-N220 PolarHBondContact O-N 2.66Å; D218-V221 HydrophobicContact CB-CG2 4.45Å; D218-V221 WeakPolarHBondContact O-CB 3.08Å; D218-V221 PolarHBondContact O-N 2.9Å
219	Y	69.6	Low	77.4	Confident	201 Å²	201	70.2 Å²	70.2	79%	0.788	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-22.9	-174.1	-165	-97.1	0	0	0	115	V221	Y219-V221 VanDerWaalsContact C-N 3.31Å
220	N	70.5	Confident	77.3	Confident	157 Å²	157	67.9 Å²	67.9	84%	0.84	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-15	179.7	-62.6	-22.6	0	0	0	113.4	D218 S222	D218-N220 PolarHBondContact O-N 2.66Å; N220-S222 PolarHBondContact O-N 3.17Å
221	V	72.8	Confident	77.1	Confident	44 Å²	44	63.1 Å²	63.1	27%	0.267	32%	0.319	S	S	.	.	P	Polyproline II helix	trans	-81.4	116.2	-179.8	-176.8	0	0	0	0	110	R211 V214 E217 D218 Y219 L342	R211-V221 PolarHBondContact NH2-O 2.54Å; V214-V221 HydrophobicContact CB-CG1 4.36Å; V214-V221 HydrophobicContact CG1-CG1 4.04Å; E217-V221 HydrophobicContact CB-CB 4.02Å; E217-V221 HydrophobicContact CB-CG1 4.25Å; E217-V221 HydrophobicContact CB-CG2 4.18Å; D218-V221 HydrophobicContact CB-CG2 4.45Å; D218-V221 WeakPolarHBondContact O-CB 3.08Å; D218-V221 PolarHBondContact O-N 2.9Å; Y219-V221 VanDerWaalsContact C-N 3.31Å; V221-L342 HydrophobicContact CG1-CD2 3.51Å
222	S	77.9	Confident	76.4	Confident	49 Å²	49	65.2 Å²	65.2	34%	0.343	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-83.6	154.4	176.6	64.6	0	0	0	0	112	N220	N220-S222 PolarHBondContact O-N 3.17Å
223	V	82.1	Confident	75.9	Confident	16 Å²	16	65.5 Å²	65.5	10%	0.097	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-57.9	128.7	174.9	178.2	0	0	0	0	109.3	Y66 L207 V214 I225	Y66-V223 HydrophobicContact CE1-CG1 4.31Å; L207-V223 HydrophobicContact CB-CG2 4.4Å; L207-V223 WeakPolarHBondContact O-CG2 3.33Å; V214-V223 HydrophobicContact CG2-CG2 4.03Å; V223-I225 PolarHBondContact O-N 2.88Å
224	P	78.7	Confident	75.6	Confident	0 Å²	0	68 Å²	68	0%	0	34%	0.342	C	S	.	.	P	Polyproline II helix	trans	-63.9	123.4	178.3	24.9	-33.2	0	0	0	110.5	Y66 K338 K341	Y66-P224 PolarHBondContact OH-O 2.89Å; P224-K338 HydrophobicContact CB-CG 4.47Å; P224-K338 HydrophobicContact CG-CD 4.46Å; P224-K338 HydrophobicContact CG-CG 4.03Å; P224-K341 HydrophobicContact CB-CD 3.91Å
225	I	84.1	Confident	75.3	Confident	11 Å²	11	72.7 Å²	72.7	6%	0.056	36%	0.364	C	S	.	.			trans	-124.2	110.7	171.4	-59.1	166.9	0	0	0	107.3	S71 I73 Y152 S153 F154 L204 V223	S71-I225 WeakPolarHBondContact O-CA 3.49Å; I73-I225 HydrophobicContact CD1-CD1 3.78Å; I73-I225 HydrophobicContact CD1-CG1 4.17Å; I73-I225 HydrophobicContact CD1-CG2 3.99Å; I73-I225 HydrophobicContact CG1-CG2 4.21Å; Y152-I225 HydrophobicContact CD1-CB 4.11Å; Y152-I225 HydrophobicContact CD1-CD1 4.31Å; Y152-I225 HydrophobicContact CD1-CG2 3.94Å; Y152-I225 HydrophobicContact CE1-CD1 4.03Å; Y152-I225 HydrophobicContact CE1-CG2 4.29Å; S153-I225 PolarHBondContact N-O 3.31Å; F154-I225 HydrophobicContact CE1-CG2 4.44Å; L204-I225 HydrophobicContact CD2-CD1 3.49Å; L204-I225 VanDerWaalsContact CD2-CD1 3.49Å; V223-I225 PolarHBondContact O-N 2.88Å
226	L	77.6	Confident	75.5	Confident	16 Å²	16	67.6 Å²	67.6	8%	0.084	34%	0.341	C	S	.	.			trans	-93.2	-14	-175.3	-62.1	-175.7	0	0	0	113.3	S71 T72 F154 P334 L337	S71-L226 PolarHBondContact O-N 3.25Å; T72-L226 HydrophobicContact CG2-CB 4.44Å; F154-L226 VanDerWaalsContact CD1-C 3.46Å; F154-L226 VanDerWaalsContact CD1-O 3.22Å; F154-L226 WeakPolarHBondContact CD1-O 2.99Å; L226-P334 HydrophobicContact CD1-CB 4.25Å; L226-L337 HydrophobicContact CD1-CB 4.05Å; L226-L337 HydrophobicContact CD2-CB 4.42Å
227	G	80.1	Confident	76.1	Confident	14 Å²	14	59.5 Å²	59.5	14%	0.144	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.9	165.3	177.1	0	0	0	0	0	114.5	T72 I73 F154	T72-G227 WeakPolarHBondContact CA-O 3.38Å; I73-G227 PolarHBondContact N-O 3.12Å; F154-G227 VanDerWaalsContact CE1-CA 3.47Å
228	F	82.9	Confident	76.6	Confident	21 Å²	21	59.1 Å²	59.1	9%	0.092	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	128.6	166.8	-69.8	-79.2	0	0	0	109.8	I73 F75 L147 Y152 F154 L168 I171 I172 L200	I73-F228 HydrophobicContact CB-CD1 3.72Å; I73-F228 HydrophobicContact CB-CE1 3.85Å; I73-F228 HydrophobicContact CD1-CE1 3.77Å; I73-F228 HydrophobicContact CD1-CZ 4.31Å; I73-F228 HydrophobicContact CG1-CE1 4.37Å; I73-F228 HydrophobicContact CG2-CD1 3.83Å; I73-F228 HydrophobicContact CG2-CE1 3.89Å; I73-F228 CarbonylContact O-C 3.53Å; I73-F228 VanDerWaalsContact O-CA 3.27Å; I73-F228 WeakPolarHBondContact O-CA 3.38Å; F75-F228 HydrophobicContact CE1-CB 4.2Å; L147-F228 HydrophobicContact CD2-CE1 4.11Å; L147-F228 HydrophobicContact CD2-CZ 3.88Å; Y152-F228 AromaticContact CD1-CE2 3.9Å; Y152-F228 HydrophobicContact CD1-CE2 3.9Å; Y152-F228 HydrophobicContact CD1-CZ 4.22Å; Y152-F228 AromaticContact CE1-CE2 3.49Å; Y152-F228 HydrophobicContact CE1-CE2 3.49Å; Y152-F228 VanDerWaalsContact CE1-CE2 3.49Å; Y152-F228 AromaticContact CE1-CZ 3.43Å; Y152-F228 HydrophobicContact CE1-CZ 3.43Å; Y152-F228 VanDerWaalsContact CE1-CZ 3.43Å; Y152-F228 HydrophobicContact CE2-CE2 4.31Å; Y152-F228 HydrophobicContact CG-CE2 4.47Å; Y152-F228 AromaticContact CZ-CE2 3.72Å; Y152-F228 AromaticContact CZ-CZ 3.69Å; F154-F228 HydrophobicContact CE1-CD2 4.45Å; F154-F228 HydrophobicContact CE2-CD2 4.43Å; F154-F228 AromaticContact CZ-CD2 3.64Å; F154-F228 HydrophobicContact CZ-CD2 3.64Å; F154-F228 AromaticContact CZ-CE2 3.82Å; F154-F228 HydrophobicContact CZ-CE2 3.82Å; L168-F228 HydrophobicContact CD2-CD2 4.36Å; L168-F228 HydrophobicContact CD2-CE2 4.13Å; I171-F228 HydrophobicContact CG2-CB 3.91Å; I172-F228 HydrophobicContact CD1-CD1 3.93Å; I172-F228 HydrophobicContact CD1-CD2 4.21Å; I172-F228 HydrophobicContact CD1-CE1 4.11Å; I172-F228 HydrophobicContact CD1-CE2 4.38Å; I172-F228 HydrophobicContact CD1-CG 3.99Å; I172-F228 HydrophobicContact CD1-CZ 4.34Å; L200-F228 HydrophobicContact CD2-CD1 4.22Å; L200-F228 HydrophobicContact CD2-CE1 4.01Å
229	K	82.3	Confident	77.2	Confident	73 Å²	73	53.8 Å²	53.8	32%	0.317	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.1	178.4	-72.7	174.4	179.8	168.2	0	110.1	D70 I73 H74 F75	D70-K229 IonicContact OD2-NZ 2.97Å; D70-K229 PolarHBondContact OD2-NZ 3.34Å; I73-K229 PolarHBondContact O-N 2.79Å; H74-K229 CarbonylContact C-O 3.56Å; H74-K229 WeakPolarHBondContact CA-O 3.47Å; H74-K229 VanDerWaalsContact NE2-CD 3.34Å; H74-K229 WeakPolarHBondContact NE2-CD 3.3Å; F75-K229 WeakPolarHBondContact CD1-O 3.48Å; F75-K229 PolarHBondContact N-O 2.92Å
230	K	82.3	Confident	77.3	Confident	130 Å²	130	45.5 Å²	45.5	57%	0.565	24%	0.239	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-79.7	131.9	171.5	-179.2	-175.8	175.5	176.8	0	108.9	F75 P77	F75-K230 HydrophobicContact CE1-CB 4.3Å; F75-K230 HydrophobicContact CE2-CB 4.46Å; F75-K230 HydrophobicContact CE2-CG 4.49Å; F75-K230 HydrophobicContact CZ-CB 4.01Å; F75-K230 HydrophobicContact CZ-CG 4.5Å; F75-K230 WeakPolarHBondContact O-CA 3.35Å; P77-K230 HydrophobicContact CG-CD 4.24Å; P77-K230 HydrophobicContact CG-CG 4.24Å
231	F	79.1	Confident	77.4	Confident	18 Å²	18	43.2 Å²	43.2	8%	0.079	22%	0.223	C	C	.	.			trans	-121.7	150.8	166.1	79.4	-82	0	0	0	110.5	I63 Y65 H74 F75 M76 I95 L233	I63-F231 HydrophobicContact CG2-CE1 4.33Å; I63-F231 HydrophobicContact CG2-CZ 3.87Å; Y65-F231 HydrophobicContact CD1-CD1 4.44Å; Y65-F231 AromaticContact CD1-CE1 3.74Å; Y65-F231 HydrophobicContact CD1-CE1 3.74Å; Y65-F231 HydrophobicContact CD1-CZ 4.12Å; Y65-F231 AromaticContact CE1-CD1 3.8Å; Y65-F231 HydrophobicContact CE1-CD1 3.8Å; Y65-F231 AromaticContact CE1-CE1 3.49Å; Y65-F231 HydrophobicContact CE1-CE1 3.49Å; Y65-F231 VanDerWaalsContact CE1-CE1 3.49Å; Y65-F231 HydrophobicContact CE1-CG 4.43Å; Y65-F231 AromaticContact CE1-CZ 3.89Å; Y65-F231 HydrophobicContact CE1-CZ 3.89Å; H74-F231 HydrophobicContact CB-CD1 3.96Å; H74-F231 HydrophobicContact CB-CE1 4.33Å; F75-F231 VanDerWaalsContact C-CD1 3.44Å; F75-F231 WeakPolarHBondContact O-CD1 3.41Å; F75-F231 PolarHBondContact O-N 3.02Å; M76-F231 WeakPolarHBondContact CA-O 3.14Å; M76-F231 HydrophobicContact CB-CD1 4.36Å; M76-F231 HydrophobicContact CB-CE1 3.86Å; M76-F231 HydrophobicContact CB-CE2 4.12Å; M76-F231 HydrophobicContact CB-CZ 3.74Å; M76-F231 HydrophobicContact CG-CE2 4.44Å; M76-F231 HydrophobicContact SD-CE2 4.21Å; I95-F231 HydrophobicContact CD1-CE2 4.43Å; I95-F231 HydrophobicContact CD1-CZ 4.13Å; F231-L233 HydrophobicContact CD2-CD2 4.28Å; F231-L233 HydrophobicContact CE2-CD2 4.29Å; F231-L233 HydrophobicContact CE2-CG 4.31Å
232	M	67.7	Low	77.5	Confident	87 Å²	87	43.6 Å²	43.6	43%	0.429	22%	0.224	S	C	.	.			trans	-134.3	139.3	177.3	-68	-75.9	-120.7	0	0	107.9	P77 T234	P77-M232 HydrophobicContact CB-SD 4.43Å; P77-M232 VanDerWaalsContact CD-SD 3.5Å; P77-M232 HydrophobicContact CG-CE 4.08Å; P77-M232 HydrophobicContact CG-SD 3.64Å; M232-T234 VanDerWaalsContact C-N 3.35Å; M232-T234 WeakPolarHBondContact CB-OG1 3.46Å
233	L	67.9	Low	77.8	Confident	12 Å²	12	41.3 Å²	41.3	6%	0.063	21%	0.208	C	C	.	.			trans	-93.5	0.8	172.9	-60.1	-178	0	0	0	112.7	M76 L87 V91 E94 F231 L236	M76-L233 HydrophobicContact SD-CD1 4.34Å; M76-L233 HydrophobicContact SD-CG 4.2Å; L87-L233 HydrophobicContact CD1-CB 4.3Å; L87-L233 HydrophobicContact CD1-CD1 3.85Å; V91-L233 HydrophobicContact CB-CD1 4.35Å; V91-L233 HydrophobicContact CG2-CD1 3.28Å; E94-L233 VanDerWaalsContact OE1-CD2 3.29Å; E94-L233 WeakPolarHBondContact OE1-CD2 3.37Å; E94-L233 VanDerWaalsContact OE2-CD2 3.22Å; E94-L233 WeakPolarHBondContact OE2-CD2 3.38Å; F231-L233 HydrophobicContact CD2-CD2 4.28Å; F231-L233 HydrophobicContact CE2-CD2 4.29Å; F231-L233 HydrophobicContact CE2-CG 4.31Å; L233-L236 HydrophobicContact CB-CD1 4.36Å; L233-L236 HydrophobicContact CD2-CD1 3.53Å; L233-L236 PolarHBondContact O-N 3.39Å
234	T	62.2	Low	77.9	Confident	87 Å²	87	41.3 Å²	41.3	53%	0.534	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	136.2	170.2	53.5	0	0	0	0	108.8	M232	M232-T234 VanDerWaalsContact C-N 3.35Å; M232-T234 WeakPolarHBondContact CB-OG1 3.46Å
235	H	70.4	Confident	78	Confident	100 Å²	100	44.6 Å²	44.6	46%	0.463	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.4	3.1	-178.4	-46.7	-63.2	0	0	0	117.4	T295 H296 D297	H235-T295 CarbonylContact O-C 3.56Å; H235-T295 WeakPolarHBondContact O-CA 3.45Å; H235-T295 PolarHBondContact O-OG1 3.49Å; H235-H296 VanDerWaalsContact C-CE1 3.49Å; H235-H296 VanDerWaalsContact C-ND1 3.34Å; H235-H296 WeakPolarHBondContact CA-CE1 3.47Å; H235-H296 AromaticContact ND1-CD2 3.9Å; H235-H296 AromaticContact ND1-NE2 3.33Å; H235-H296 PolarHBondContact ND1-NE2 2.97Å; H235-H296 PolarHBondContact O-N 3.03Å; H235-H296 PolarHBondContact O-ND1 2.95Å; H235-D297 HydrophobicContact CB-CB 4.21Å
236	L	80.9	Confident	78.1	Confident	26 Å²	26	44.7 Å²	44.7	14%	0.136	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-85.7	143	174.5	-63.8	-179.2	0	0	0	112.4	R90 L233 R293 P294	R90-L236 VanDerWaalsContact NH2-CB 3.28Å; R90-L236 PolarHBondContact NH2-O 3.09Å; L233-L236 HydrophobicContact CB-CD1 4.36Å; L233-L236 HydrophobicContact CD2-CD1 3.53Å; L233-L236 PolarHBondContact O-N 3.39Å; L236-R293 HydrophobicContact CD1-CB 4.41Å; L236-R293 HydrophobicContact CD2-CB 3.91Å; L236-P294 WeakPolarHBondContact CA-O 3.28Å
237	V	84.9	Confident	78.5	Confident	6 Å²	6	44 Å²	44	4%	0.036	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-79.8	135.4	171.6	-179.3	0	0	0	0	108.9	R90 I239 P294 H296 L630 D646 I648	R90-V237 VanDerWaalsContact NH2-C 3.32Å; R90-V237 PolarHBondContact NH2-O 3.5Å; V237-I239 HydrophobicContact CG1-CG1 4.21Å; V237-P294 HydrophobicContact CB-CB 4.25Å; V237-P294 HydrophobicContact CB-CG 4.09Å; V237-P294 HydrophobicContact CG2-CB 4.41Å; V237-P294 PolarHBondContact N-O 3.35Å; V237-H296 HydrophobicContact CG2-CB 4.24Å; V237-L630 HydrophobicContact CG1-CD1 4.15Å; V237-L630 HydrophobicContact CG2-CB 4.38Å; V237-L630 HydrophobicContact CG2-CD1 4.08Å; V237-L630 HydrophobicContact CG2-CD2 4.06Å; V237-L630 HydrophobicContact CG2-CG 4.39Å; V237-D646 CarbonylContact C-O 3.56Å; V237-D646 WeakPolarHBondContact CA-O 3.35Å; V237-I648 HydrophobicContact CG1-CG1 4.49Å
238	N	83.3	Confident	79	Confident	45 Å²	45	46 Å²	46	24%	0.241	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	122.3	177.8	-172.9	38.4	0	0	0	110.7	D646 A647 I648	N238-D646 PolarHBondContact N-O 3.48Å; N238-A647 HydrophobicContact CB-CB 3.85Å; N238-A647 CarbonylContact O-C 3.59Å; N238-A647 WeakPolarHBondContact O-CA 3.28Å; N238-I648 PolarHBondContact O-N 2.89Å
239	I	83.1	Confident	79.2	Confident	17 Å²	17	45 Å²	45	9%	0.087	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	123.1	178.2	-58.8	-173.5	0	0	0	108.4	V237 T243 Y244 P294 F627 I648	V237-I239 HydrophobicContact CG1-CG1 4.21Å; I239-T243 HydrophobicContact CG2-CG2 3.72Å; I239-Y244 HydrophobicContact CB-CE1 4.47Å; I239-Y244 HydrophobicContact CB-CE2 4.08Å; I239-Y244 HydrophobicContact CD1-CE1 4.38Å; I239-Y244 HydrophobicContact CG2-CD1 4.31Å; I239-Y244 HydrophobicContact CG2-CD2 4.14Å; I239-Y244 HydrophobicContact CG2-CE1 3.95Å; I239-Y244 HydrophobicContact CG2-CE2 3.78Å; I239-Y244 HydrophobicContact CG2-CG 4.38Å; I239-P294 HydrophobicContact CD1-CG 3.42Å; I239-P294 VanDerWaalsContact CD1-CG 3.42Å; I239-P294 HydrophobicContact CG1-CG 4.2Å; I239-F627 HydrophobicContact CD1-CD2 3.46Å; I239-F627 VanDerWaalsContact CD1-CD2 3.46Å; I239-F627 HydrophobicContact CD1-CE2 3.56Å; I239-I648 HydrophobicContact CD1-CD1 4.32Å; I239-I648 HydrophobicContact CG1-CB 4.39Å
240	D	73.6	Confident	79.4	Confident	26 Å²	26	43 Å²	43	14%	0.139	22%	0.219	C	C	.	.			trans	-69.2	145.9	176.8	-70.8	-19.1	0	0	0	111.3	D242 T243 Y244 F649	D240-D242 PolarHBondContact O-N 3.45Å; D240-D242 VanDerWaalsContact O-N 3.16Å; D240-T243 WeakPolarHBondContact O-CA 3.41Å; D240-T243 WeakPolarHBondContact O-CB 3.31Å; D240-T243 PolarHBondContact O-N 3.39Å; D240-Y244 PolarHBondContact O-N 3.22Å; D240-F649 WeakPolarHBondContact OD2-CD1 3.41Å
241	Q	71.5	Confident	79.3	Confident	110 Å²	110	40.3 Å²	40.3	51%	0.514	21%	0.207	S	C	.	.	H	α-helix	trans	-54	-38	178.5	-171.7	62.7	12.2	0	0	113.5	T243 Y244	Q241-T243 PolarHBondContact O-N 3.46Å; Q241-Y244 PolarHBondContact O-N 3.43Å
242	D	75.9	Confident	78.8	Confident	52 Å²	52	43 Å²	43	28%	0.278	23%	0.228	S	C	.	.	H	α-helix	trans	-61.9	-36.3	177.7	-59.5	-19.9	0	0	0	110.7	D240 Y244 S245 V246 Q671	D240-D242 PolarHBondContact O-N 3.45Å; D240-D242 VanDerWaalsContact O-N 3.16Å; D242-Y244 VanDerWaalsContact C-N 3.35Å; D242-Y244 PolarHBondContact O-N 2.97Å; D242-S245 PolarHBondContact O-N 2.89Å; D242-V246 VanDerWaalsContact O-CB 3.22Å; D242-V246 WeakPolarHBondContact O-CB 3.3Å; D242-V246 WeakPolarHBondContact O-CG2 3.5Å; D242-V246 PolarHBondContact O-N 2.84Å; D242-Q671 PolarHBondContact OD2-NE2 3.47Å
243	T	83.5	Confident	78.7	Confident	1 Å²	1	43 Å²	43	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-63	-38.3	178.2	-60.2	0	0	0	0	112.1	I239 D240 Q241 S245 V246 L247 I648 T650	I239-T243 HydrophobicContact CG2-CG2 3.72Å; D240-T243 WeakPolarHBondContact O-CA 3.41Å; D240-T243 WeakPolarHBondContact O-CB 3.31Å; D240-T243 PolarHBondContact O-N 3.39Å; Q241-T243 PolarHBondContact O-N 3.46Å; T243-S245 VanDerWaalsContact C-N 3.33Å; T243-S245 PolarHBondContact O-N 3.48Å; T243-V246 PolarHBondContact O-N 2.88Å; T243-L247 HydrophobicContact CG2-CD1 3.6Å; T243-L247 HydrophobicContact CG2-CG 4.05Å; T243-L247 WeakPolarHBondContact O-CB 3.26Å; T243-L247 PolarHBondContact O-N 3.22Å; T243-I648 HydrophobicContact CG2-CG2 4.11Å; T243-T650 VanDerWaalsContact CA-OG1 3.27Å; T243-T650 WeakPolarHBondContact CA-OG1 3.43Å; T243-T650 WeakPolarHBondContact CB-OG1 3.31Å; T243-T650 HydrophobicContact CG2-CG2 3.54Å; T243-T650 PolarHBondContact OG1-N 3.49Å; T243-T650 PolarHBondContact OG1-OG1 2.91Å
244	Y	83.7	Confident	78	Confident	16 Å²	16	46.8 Å²	46.8	6%	0.063	25%	0.254	C	S	.	.	H	α-helix	trans	-60.6	-42	175.9	-73	-61.7	0	0	0	112.5	I239 D240 Q241 D242 Q248 I249 F250 F291 T292 F627	I239-Y244 HydrophobicContact CB-CE1 4.47Å; I239-Y244 HydrophobicContact CB-CE2 4.08Å; I239-Y244 HydrophobicContact CD1-CE1 4.38Å; I239-Y244 HydrophobicContact CG2-CD1 4.31Å; I239-Y244 HydrophobicContact CG2-CD2 4.14Å; I239-Y244 HydrophobicContact CG2-CE1 3.95Å; I239-Y244 HydrophobicContact CG2-CE2 3.78Å; I239-Y244 HydrophobicContact CG2-CG 4.38Å; D240-Y244 PolarHBondContact O-N 3.22Å; Q241-Y244 PolarHBondContact O-N 3.43Å; D242-Y244 VanDerWaalsContact C-N 3.35Å; D242-Y244 PolarHBondContact O-N 2.97Å; Y244-Q248 PolarHBondContact O-N 2.83Å; Y244-I249 HydrophobicContact CD1-CB 3.95Å; Y244-I249 HydrophobicContact CD1-CD1 3.65Å; Y244-I249 HydrophobicContact CD1-CG1 4.39Å; Y244-I249 HydrophobicContact CD1-CG2 3.87Å; Y244-I249 HydrophobicContact CE1-CD1 4.12Å; Y244-I249 HydrophobicContact CE1-CG2 4.38Å; Y244-I249 PolarHBondContact O-N 3.34Å; Y244-F250 HydrophobicContact CD1-CD2 4.01Å; Y244-F250 AromaticContact CD1-CE2 3.87Å; Y244-F250 HydrophobicContact CD1-CE2 3.87Å; Y244-F250 HydrophobicContact CE1-CE2 4.19Å; Y244-F250 HydrophobicContact CG-CD2 4.24Å; Y244-F250 HydrophobicContact CG-CE2 4.39Å; Y244-F291 VanDerWaalsContact CE1-O 3.29Å; Y244-F291 WeakPolarHBondContact CE1-O 3.35Å; Y244-F291 PolarHBondContact OH-O 2.98Å; Y244-T292 WeakPolarHBondContact OH-CA 3.32Å; Y244-T292 PolarHBondContact OH-O 3.45Å; Y244-F627 HydrophobicContact CE1-CE2 4.04Å; Y244-F627 HydrophobicContact CE1-CZ 4.35Å
245	S	82	Confident	77.5	Confident	68 Å²	68	45.3 Å²	45.3	48%	0.476	24%	0.242	S	C	.	.	H	α-helix	trans	-71.9	-46.7	177.5	-179.5	0	0	0	0	111.8	D242 T243 L247 Q248	D242-S245 PolarHBondContact O-N 2.89Å; T243-S245 VanDerWaalsContact C-N 3.33Å; T243-S245 PolarHBondContact O-N 3.48Å; S245-L247 PolarHBondContact O-N 3.16Å; S245-Q248 WeakPolarHBondContact O-CA 3.35Å; S245-Q248 PolarHBondContact O-N 3.36Å
246	V	84.4	Confident	76.6	Confident	14 Å²	14	46.7 Å²	46.7	9%	0.085	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-44.1	-175.2	159.8	0	0	0	0	113	D242 T243 Q248 K620 I652	D242-V246 VanDerWaalsContact O-CB 3.22Å; D242-V246 WeakPolarHBondContact O-CB 3.3Å; D242-V246 WeakPolarHBondContact O-CG2 3.5Å; D242-V246 PolarHBondContact O-N 2.84Å; T243-V246 PolarHBondContact O-N 2.88Å; V246-Q248 PolarHBondContact O-N 3.29Å; V246-K620 WeakPolarHBondContact O-CE 3.37Å; V246-K620 PolarHBondContact O-NZ 2.97Å; V246-I652 HydrophobicContact CG1-CB 3.48Å; V246-I652 VanDerWaalsContact CG1-CB 3.48Å; V246-I652 HydrophobicContact CG1-CD1 4.18Å; V246-I652 HydrophobicContact CG1-CG1 4.16Å; V246-I652 HydrophobicContact CG1-CG2 4.2Å; V246-I652 VanDerWaalsContact CG1-O 3.3Å; V246-I652 WeakPolarHBondContact CG1-O 3.25Å; V246-I652 VanDerWaalsContact CG2-O 3.29Å; V246-I652 WeakPolarHBondContact CG2-O 3.3Å
247	L	87.8	Confident	75	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-3.1	174.1	-64.5	-177.6	0	0	0	112	T243 S245 I249 K620 L624 T650 L686	T243-L247 HydrophobicContact CG2-CD1 3.6Å; T243-L247 HydrophobicContact CG2-CG 4.05Å; T243-L247 WeakPolarHBondContact O-CB 3.26Å; T243-L247 PolarHBondContact O-N 3.22Å; S245-L247 PolarHBondContact O-N 3.16Å; L247-I249 HydrophobicContact CB-CD1 4.15Å; L247-I249 HydrophobicContact CB-CG1 3.95Å; L247-I249 HydrophobicContact CD1-CD1 4.23Å; L247-I249 PolarHBondContact O-N 2.86Å; L247-K620 HydrophobicContact CD2-CB 4.16Å; L247-K620 HydrophobicContact CD2-CG 4.06Å; L247-L624 HydrophobicContact CB-CD2 4.03Å; L247-L624 HydrophobicContact CB-CG 4.35Å; L247-L624 WeakPolarHBondContact O-CD2 3.37Å; L247-T650 HydrophobicContact CD1-CG2 4.45Å; L247-T650 HydrophobicContact CG-CG2 4.41Å; L247-L686 HydrophobicContact CD2-CD1 4.46Å
248	Q	88.9	Confident	73.3	Confident	57 Å²	57	53 Å²	53	27%	0.266	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	40.5	-175.7	-56.1	-179.8	-90.6	0	0	111.6	Y244 S245 V246 F250 S270 L271 L582	Y244-Q248 PolarHBondContact O-N 2.83Å; S245-Q248 WeakPolarHBondContact O-CA 3.35Å; S245-Q248 PolarHBondContact O-N 3.36Å; V246-Q248 PolarHBondContact O-N 3.29Å; Q248-F250 VanDerWaalsContact C-N 3.34Å; Q248-S270 CarbonylContact O-C 3.59Å; Q248-S270 VanDerWaalsContact O-CA 3.3Å; Q248-S270 WeakPolarHBondContact O-CA 3.33Å; Q248-S270 WeakPolarHBondContact O-CB 3.34Å; Q248-L271 PolarHBondContact O-N 2.94Å; Q248-L582 HydrophobicContact CB-CD1 3.78Å
249	I	88.1	Confident	71.5	Confident	0 Å²	0	61.9 Å²	61.9	0%	0	33%	0.332	C	S	.	.	S	Bend	trans	-64.9	-47	173.9	-67.1	168.5	0	0	0	108.7	Y244 L247 L271 F272 F291 L624 F627	Y244-I249 HydrophobicContact CD1-CB 3.95Å; Y244-I249 HydrophobicContact CD1-CD1 3.65Å; Y244-I249 HydrophobicContact CD1-CG1 4.39Å; Y244-I249 HydrophobicContact CD1-CG2 3.87Å; Y244-I249 HydrophobicContact CE1-CD1 4.12Å; Y244-I249 HydrophobicContact CE1-CG2 4.38Å; Y244-I249 PolarHBondContact O-N 3.34Å; L247-I249 HydrophobicContact CB-CD1 4.15Å; L247-I249 HydrophobicContact CB-CG1 3.95Å; L247-I249 HydrophobicContact CD1-CD1 4.23Å; L247-I249 PolarHBondContact O-N 2.86Å; I249-L271 HydrophobicContact CG1-CD2 4.41Å; I249-L271 PolarHBondContact O-N 3.47Å; I249-F272 VanDerWaalsContact O-CB 3.32Å; I249-F272 WeakPolarHBondContact O-CB 3.24Å; I249-F272 PolarHBondContact O-N 2.71Å; I249-F291 HydrophobicContact CG2-CB 4.5Å; I249-F291 HydrophobicContact CG2-CD1 3.71Å; I249-F291 HydrophobicContact CG2-CE1 4.48Å; I249-L624 HydrophobicContact CG1-CD2 4.19Å; I249-F627 HydrophobicContact CD1-CD1 4.01Å; I249-F627 HydrophobicContact CD1-CD2 3.78Å; I249-F627 HydrophobicContact CD1-CE1 3.97Å; I249-F627 HydrophobicContact CD1-CE2 3.72Å; I249-F627 HydrophobicContact CD1-CG 3.91Å; I249-F627 HydrophobicContact CD1-CZ 3.81Å; I249-F627 HydrophobicContact CG1-CD1 4.27Å; I249-F627 HydrophobicContact CG1-CE1 4.13Å; I249-F627 HydrophobicContact CG1-CZ 4.35Å; I249-F627 HydrophobicContact CG2-CE1 3.8Å; I249-F627 HydrophobicContact CG2-CZ 3.72Å
250	F	86.3	Confident	69.7	Low	30 Å²	30	66.9 Å²	66.9	13%	0.132	35%	0.353	C	S	.	.	S	Bend	trans	-118.9	142.3	168.4	-56.7	-69.5	0	0	0	109.3	Y244 Q248 E267 F272 R288 F291 T292	Y244-F250 HydrophobicContact CD1-CD2 4.01Å; Y244-F250 AromaticContact CD1-CE2 3.87Å; Y244-F250 HydrophobicContact CD1-CE2 3.87Å; Y244-F250 HydrophobicContact CE1-CE2 4.19Å; Y244-F250 HydrophobicContact CG-CD2 4.24Å; Y244-F250 HydrophobicContact CG-CE2 4.39Å; Q248-F250 VanDerWaalsContact C-N 3.34Å; F250-E267 VanDerWaalsContact CA-OE1 3.29Å; F250-E267 WeakPolarHBondContact CA-OE1 3.45Å; F250-F272 HydrophobicContact CD1-CB 3.71Å; F250-F272 HydrophobicContact CD1-CD1 4.39Å; F250-F272 HydrophobicContact CD1-CD2 4.49Å; F250-F272 AromaticContact CD1-CG 3.95Å; F250-F272 HydrophobicContact CD1-CG 3.95Å; F250-F272 HydrophobicContact CE1-CB 3.8Å; F250-F272 HydrophobicContact CE1-CD1 4.44Å; F250-F272 AromaticContact CE1-CD2 3.84Å; F250-F272 HydrophobicContact CE1-CD2 3.84Å; F250-F272 AromaticContact CE1-CG 3.76Å; F250-F272 HydrophobicContact CE1-CG 3.76Å; F250-R288 HydrophobicContact CE1-CG 3.99Å; F250-R288 HydrophobicContact CZ-CG 4.2Å; F250-F291 HydrophobicContact CE1-CB 4.11Å; F250-F291 HydrophobicContact CE1-CD1 4.4Å; F250-F291 HydrophobicContact CE2-CB 4.28Å; F250-F291 HydrophobicContact CZ-CB 3.47Å; F250-F291 VanDerWaalsContact CZ-CB 3.47Å; F250-F291 HydrophobicContact CZ-CD1 4.41Å; F250-F291 HydrophobicContact CZ-CG 4.41Å; F250-T292 HydrophobicContact CE2-CG2 3.76Å; F250-T292 HydrophobicContact CZ-CG2 3.82Å
251	K	80.1	Confident	68.1	Low	75 Å²	75	70.1 Å²	70.1	33%	0.326	37%	0.374	S	S	.	.			trans	-143.1	113.8	172.1	-167.1	-173.4	-175.9	-161	0	109.2	E253 E267 G268	K251-E253 HydrophobicContact CD-CG 4.43Å; K251-E253 VanDerWaalsContact CE-OE1 3.3Å; K251-E253 WeakPolarHBondContact CE-OE1 3.46Å; K251-E253 IonicContact NZ-OE1 2.98Å; K251-E253 PolarHBondContact NZ-OE1 3.32Å; K251-E267 PolarHBondContact N-OE1 3.4Å; K251-E267 CarbonylContact O-C 3.6Å; K251-E267 WeakPolarHBondContact O-CA 3.38Å; K251-G268 PolarHBondContact O-N 3.21Å
252	S	69.3	Low	66.7	Low	74 Å²	74	69.9 Å²	69.9	52%	0.517	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	121.3	173.1	-60.1	0	0	0	0	109.6
253	E	64.5	Low	65.1	Low	86 Å²	86	71.9 Å²	71.9	40%	0.402	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	134	170.8	-71.6	-175.7	179.5	0	0	109.7	K251 K266	K251-E253 HydrophobicContact CD-CG 4.43Å; K251-E253 VanDerWaalsContact CE-OE1 3.3Å; K251-E253 WeakPolarHBondContact CE-OE1 3.46Å; K251-E253 IonicContact NZ-OE1 2.98Å; K251-E253 PolarHBondContact NZ-OE1 3.32Å; E253-K266 PolarHBondContact N-O 3.04Å; E253-K266 PolarHBondContact O-N 3.03Å; E253-K266 VanDerWaalsContact O-N 3.13Å
254	S	53.2	Low	63.5	Low	92 Å²	92	73.8 Å²	73.8	64%	0.643	43%	0.429	S	S	*	.			trans	-72.4	137.6	173	48.9	0	0	0	0	109.6
255	H	52.2	Low	62.1	Low	57 Å²	57	78.9 Å²	78.9	26%	0.264	46%	0.456	S	S	.	.			trans	-61.6	133.3	177.2	-162.7	-83.9	0	0	0	109.6	S257	H255-S257 PolarHBondContact CE1-OG 3.05Å; H255-S257 VanDerWaalsContact CE1-OG 3.24Å; H255-S257 PolarHBondContact ND1-N 3.14Å; H255-S257 PolarHBondContact ND1-OG 3.12Å; H255-S257 PolarHBondContact O-N 3.42Å
256	P	51.3	Low	61.3	Low	128 Å²	128	81.9 Å²	81.9	83%	0.831	46%	0.461	S	S	*	.	S	Bend	trans	-64.7	-13	-176.2	20.9	-30.7	0	0	0	114.1
257	S	47	Very low	60.7	Low	43 Å²	43	83.7 Å²	83.7	30%	0.301	47%	0.468	S	S	.	.	S	Bend	trans	-93.9	117.5	174.2	71.2	0	0	0	0	111.9	H255 Y259 K260	H255-S257 PolarHBondContact CE1-OG 3.05Å; H255-S257 VanDerWaalsContact CE1-OG 3.24Å; H255-S257 PolarHBondContact ND1-N 3.14Å; H255-S257 PolarHBondContact ND1-OG 3.12Å; H255-S257 PolarHBondContact O-N 3.42Å; S257-Y259 PolarHBondContact O-N 3.48Å; S257-Y259 VanDerWaalsContact O-N 3.1Å; S257-K260 PolarHBondContact O-N 3.03Å; S257-K260 WeakPolarHBondContact OG-CB 3.39Å
258	V	49.5	Very low	60.2	Low	122 Å²	122	84.4 Å²	84.4	74%	0.739	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-53.8	-31.3	178.2	-176.7	0	0	0	0	113.1	K260 V261	V258-K260 PolarHBondContact O-N 2.73Å; V258-V261 VanDerWaalsContact O-CG2 3.31Å; V258-V261 WeakPolarHBondContact O-CG2 3.44Å; V258-V261 PolarHBondContact O-N 3.29Å
259	Y	45.7	Very low	59.9	Low	232 Å²	232	85.3 Å²	85.3	91%	0.91	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-75.5	-15.9	179.8	-69.2	-81.3	0	0	0	115.2	S257	S257-Y259 PolarHBondContact O-N 3.48Å; S257-Y259 VanDerWaalsContact O-N 3.1Å
260	K	45.2	Very low	60	Low	122 Å²	122	85.3 Å²	85.3	53%	0.53	48%	0.482	S	S	.	.	G	3₁₀ helix	trans	-106.6	11.7	175.4	-68.5	-167.3	173.8	-169	0	113	S257 V258 A262 S263	S257-K260 PolarHBondContact O-N 3.03Å; S257-K260 WeakPolarHBondContact OG-CB 3.39Å; V258-K260 PolarHBondContact O-N 2.73Å; K260-A262 PolarHBondContact O-N 3.42Å; K260-S263 VanDerWaalsContact O-CB 3.29Å; K260-S263 WeakPolarHBondContact O-CB 3.5Å; K260-S263 PolarHBondContact O-N 3.49Å
261	V	40.6	Very low	60.3	Low	93 Å²	93	83.9 Å²	83.9	56%	0.564	48%	0.476	S	S	*	.	G	3₁₀ helix	trans	-62.4	-24.7	176.5	175.2	0	0	0	0	111.5	V258 S263	V258-V261 VanDerWaalsContact O-CG2 3.31Å; V258-V261 WeakPolarHBondContact O-CG2 3.44Å; V258-V261 PolarHBondContact O-N 3.29Å; V261-S263 VanDerWaalsContact C-N 3.32Å
262	A	41.7	Very low	60.9	Low	105 Å²	105	80.3 Å²	80.3	87%	0.868	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-74	-18	172.4	0	0	0	0	0	114.1	K260 G264	K260-A262 PolarHBondContact O-N 3.42Å; A262-G264 PolarHBondContact O-N 3.13Å
263	S	43.1	Very low	61.9	Low	95 Å²	95	78.5 Å²	78.5	66%	0.664	45%	0.453	S	S	*	.	G	3₁₀ helix	trans	-82.1	12	-177.2	-175.8	0	0	0	0	113.7	K260 V261	K260-S263 VanDerWaalsContact O-CB 3.29Å; K260-S263 WeakPolarHBondContact O-CB 3.5Å; K260-S263 PolarHBondContact O-N 3.49Å; V261-S263 VanDerWaalsContact C-N 3.32Å
264	G	48.8	Very low	63.2	Low	41 Å²	41	75 Å²	75	42%	0.423	44%	0.437	S	S	.	.			trans	89.7	162.8	177.3	0	0	0	0	0	114.8	A262	A262-G264 PolarHBondContact O-N 3.13Å
265	L	55.5	Low	65.1	Low	122 Å²	122	70.7 Å²	70.7	64%	0.639	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-74.8	127.3	173.2	-67.2	164	0	0	0	108.7
266	K	63.8	Low	67	Low	131 Å²	131	69.7 Å²	69.7	57%	0.57	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.9	148.6	173	-75.9	-167.2	175.2	-172.7	0	110	E253 G268	E253-K266 PolarHBondContact N-O 3.04Å; E253-K266 PolarHBondContact O-N 3.03Å; E253-K266 VanDerWaalsContact O-N 3.13Å; K266-G268 PolarHBondContact O-N 3.01Å
267	E	73.2	Confident	68.8	Low	52 Å²	52	66.8 Å²	66.8	24%	0.243	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	120.2	171.3	-166.3	75.7	-154.3	0	0	109	F250 K251 S270 F272 R288	F250-E267 VanDerWaalsContact CA-OE1 3.29Å; F250-E267 WeakPolarHBondContact CA-OE1 3.45Å; K251-E267 PolarHBondContact N-OE1 3.4Å; K251-E267 CarbonylContact O-C 3.6Å; K251-E267 WeakPolarHBondContact O-CA 3.38Å; E267-S270 WeakPolarHBondContact CG-OG 3.42Å; E267-S270 VanDerWaalsContact OE1-CB 3.27Å; E267-S270 WeakPolarHBondContact OE1-CB 3.34Å; E267-S270 PolarHBondContact OE1-OG 3.31Å; E267-F272 HydrophobicContact CG-CD1 3.96Å; E267-R288 IonicContact OE2-CZ 2.64Å; E267-R288 IonicContact OE2-NH2 2.69Å; E267-R288 PolarHBondContact OE2-NH2 3.29Å
268	G	75.8	Confident	70.9	Confident	15 Å²	15	65.9 Å²	65.9	16%	0.155	37%	0.37	C	S	.	.			trans	-82.7	-161.2	173.7	0	0	0	0	0	112.1	K251 K266 S270	K251-G268 PolarHBondContact O-N 3.21Å; K266-G268 PolarHBondContact O-N 3.01Å; G268-S270 PolarHBondContact O-N 3.35Å
269	L	83.6	Confident	72.7	Confident	76 Å²	76	65 Å²	65	40%	0.398	36%	0.357	S	S	.	.	S	Bend	trans	-66.9	101.9	175.1	-174.2	70.8	0	0	0	110.5	I274	L269-I274 HydrophobicContact CD1-CG2 4.25Å
270	S	90.8	Very high	74.6	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	32%	0.317	C	S	.	.	S	Bend	trans	-142.7	165.8	-178.9	73.7	0	0	0	0	111.6	Q248 E267 G268 F272 G273 I274	Q248-S270 CarbonylContact O-C 3.59Å; Q248-S270 VanDerWaalsContact O-CA 3.3Å; Q248-S270 WeakPolarHBondContact O-CA 3.33Å; Q248-S270 WeakPolarHBondContact O-CB 3.34Å; E267-S270 WeakPolarHBondContact CG-OG 3.42Å; E267-S270 VanDerWaalsContact OE1-CB 3.27Å; E267-S270 WeakPolarHBondContact OE1-CB 3.34Å; E267-S270 PolarHBondContact OE1-OG 3.31Å; G268-S270 PolarHBondContact O-N 3.35Å; S270-F272 VanDerWaalsContact C-N 3.27Å; S270-F272 PolarHBondContact O-N 2.91Å; S270-F272 PolarHBondContact OG-N 3.31Å; S270-G273 PolarHBondContact O-N 3.02Å; S270-G273 PolarHBondContact OG-N 3.44Å; S270-I274 PolarHBondContact O-N 2.97Å; S270-I274 VanDerWaalsContact O-N 3.11Å
271	L	92.2	Very high	76.4	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-59.2	-42.1	174.9	-176.1	66.5	0	0	0	110.9	Q248 I249 I274 L275 F291 P581 L624 F627 M628	Q248-L271 PolarHBondContact O-N 2.94Å; I249-L271 HydrophobicContact CG1-CD2 4.41Å; I249-L271 PolarHBondContact O-N 3.47Å; L271-I274 HydrophobicContact CD1-CD1 4.12Å; L271-I274 HydrophobicContact CD1-CG1 4.38Å; L271-I274 WeakPolarHBondContact O-CG1 3.04Å; L271-I274 PolarHBondContact O-N 3.38Å; L271-L275 HydrophobicContact CD1-CD1 3.82Å; L271-L275 HydrophobicContact CD1-CG 4.3Å; L271-L275 HydrophobicContact CG-CD1 3.98Å; L271-L275 WeakPolarHBondContact O-CB 3.23Å; L271-L275 WeakPolarHBondContact O-CG 3.33Å; L271-L275 PolarHBondContact O-N 2.87Å; L271-F291 HydrophobicContact CB-CE1 4.39Å; L271-F291 HydrophobicContact CD2-CE1 4Å; L271-F291 HydrophobicContact CG-CE1 3.91Å; L271-F291 HydrophobicContact CG-CZ 4.49Å; L271-P581 HydrophobicContact CD1-CB 4.32Å; L271-P581 HydrophobicContact CD1-CG 3.99Å; L271-L624 HydrophobicContact CB-CD2 4.4Å; L271-L624 HydrophobicContact CD2-CD2 3.85Å; L271-L624 HydrophobicContact CG-CD2 4.5Å; L271-F627 HydrophobicContact CD2-CD1 3.52Å; L271-F627 HydrophobicContact CD2-CE1 3.64Å; L271-M628 HydrophobicContact CD1-CG 4.09Å; L271-M628 HydrophobicContact CD1-SD 3.82Å; L271-M628 HydrophobicContact CD2-CG 3.89Å
272	F	92.3	Very high	78.4	Confident	1 Å²	1	50 Å²	50	0%	0.004	29%	0.289	C	S	.	.	H	α-helix	trans	-61.6	-45.4	175.9	179.5	-101.2	0	0	0	111	I249 F250 E267 S270 I274 L275 N276 E284 L287 R288 F291	I249-F272 VanDerWaalsContact O-CB 3.32Å; I249-F272 WeakPolarHBondContact O-CB 3.24Å; I249-F272 PolarHBondContact O-N 2.71Å; F250-F272 HydrophobicContact CD1-CB 3.71Å; F250-F272 HydrophobicContact CD1-CD1 4.39Å; F250-F272 HydrophobicContact CD1-CD2 4.49Å; F250-F272 AromaticContact CD1-CG 3.95Å; F250-F272 HydrophobicContact CD1-CG 3.95Å; F250-F272 HydrophobicContact CE1-CB 3.8Å; F250-F272 HydrophobicContact CE1-CD1 4.44Å; F250-F272 AromaticContact CE1-CD2 3.84Å; F250-F272 HydrophobicContact CE1-CD2 3.84Å; F250-F272 AromaticContact CE1-CG 3.76Å; F250-F272 HydrophobicContact CE1-CG 3.76Å; E267-F272 HydrophobicContact CG-CD1 3.96Å; S270-F272 VanDerWaalsContact C-N 3.27Å; S270-F272 PolarHBondContact O-N 2.91Å; S270-F272 PolarHBondContact OG-N 3.31Å; F272-I274 VanDerWaalsContact C-N 3.34Å; F272-I274 PolarHBondContact O-N 3.38Å; F272-L275 PolarHBondContact O-N 2.85Å; F272-N276 HydrophobicContact CD1-CB 4.44Å; F272-N276 HydrophobicContact CE1-CB 4.17Å; F272-N276 HydrophobicContact CE2-CB 4.31Å; F272-N276 HydrophobicContact CZ-CB 4.11Å; F272-N276 WeakPolarHBondContact O-CB 3.49Å; F272-N276 PolarHBondContact O-N 3.13Å; F272-E284 HydrophobicContact CZ-CG 3.9Å; F272-L287 HydrophobicContact CD2-CD2 4.21Å; F272-L287 HydrophobicContact CD2-CG 4.16Å; F272-L287 HydrophobicContact CE2-CB 4.16Å; F272-L287 HydrophobicContact CE2-CD2 3.83Å; F272-L287 HydrophobicContact CE2-CG 3.77Å; F272-R288 HydrophobicContact CE2-CB 3.71Å; F272-R288 HydrophobicContact CE2-CG 4.49Å; F272-R288 HydrophobicContact CZ-CB 3.94Å; F272-F291 HydrophobicContact CB-CD1 4.03Å; F272-F291 HydrophobicContact CB-CE1 4Å; F272-F291 HydrophobicContact CD2-CD1 4.1Å; F272-F291 HydrophobicContact CD2-CE1 4.28Å; F272-F291 HydrophobicContact CD2-CG 4.39Å
273	G	89.6	Confident	80.6	Confident	36 Å²	36	45 Å²	45	37%	0.371	25%	0.248	S	C	.	.	H	α-helix	trans	-61	-37	179.5	0	0	0	0	0	114	S270	S270-G273 PolarHBondContact O-N 3.02Å; S270-G273 PolarHBondContact OG-N 3.44Å
274	I	92.4	Very high	82.7	Confident	13 Å²	13	44.2 Å²	44.2	7%	0.067	23%	0.234	C	C	.	.	H	α-helix	trans	-79.7	-26.7	-179.7	63.3	157.6	0	0	0	113.7	L269 S270 L271 F272 P581 L582 L585	L269-I274 HydrophobicContact CD1-CG2 4.25Å; S270-I274 PolarHBondContact O-N 2.97Å; S270-I274 VanDerWaalsContact O-N 3.11Å; L271-I274 HydrophobicContact CD1-CD1 4.12Å; L271-I274 HydrophobicContact CD1-CG1 4.38Å; L271-I274 WeakPolarHBondContact O-CG1 3.04Å; L271-I274 PolarHBondContact O-N 3.38Å; F272-I274 VanDerWaalsContact C-N 3.34Å; F272-I274 PolarHBondContact O-N 3.38Å; I274-P581 HydrophobicContact CD1-CB 3.96Å; I274-L582 HydrophobicContact CD1-CD2 3.89Å; I274-L582 HydrophobicContact CG1-CD2 4.1Å; I274-L582 HydrophobicContact CG2-CD2 4Å; I274-L585 HydrophobicContact CB-CD1 4.4Å; I274-L585 HydrophobicContact CG2-CD1 3.64Å
275	L	93	Very high	84.4	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-94.8	-24.5	-178.6	-69.6	-177.1	0	0	0	112.6	L271 F272 R277 F291 L552 A555 Y561 M628	L271-L275 HydrophobicContact CD1-CD1 3.82Å; L271-L275 HydrophobicContact CD1-CG 4.3Å; L271-L275 HydrophobicContact CG-CD1 3.98Å; L271-L275 WeakPolarHBondContact O-CB 3.23Å; L271-L275 WeakPolarHBondContact O-CG 3.33Å; L271-L275 PolarHBondContact O-N 2.87Å; F272-L275 PolarHBondContact O-N 2.85Å; L275-R277 PolarHBondContact O-N 3.08Å; L275-F291 HydrophobicContact CB-CZ 4.04Å; L275-F291 HydrophobicContact CD1-CE1 4.32Å; L275-F291 HydrophobicContact CD1-CE2 4.49Å; L275-F291 HydrophobicContact CD1-CZ 3.58Å; L275-F291 HydrophobicContact CG-CZ 4.39Å; L275-L552 HydrophobicContact CB-CD2 4.15Å; L275-L552 HydrophobicContact CD1-CD2 4.29Å; L275-L552 HydrophobicContact CD2-CD2 4.41Å; L275-A555 HydrophobicContact CD2-CB 3.71Å; L275-Y561 HydrophobicContact CD2-CE2 4.13Å; L275-M628 HydrophobicContact CD1-CE 3.88Å; L275-M628 HydrophobicContact CD1-CG 4.45Å; L275-M628 HydrophobicContact CD2-CE 4.29Å
276	N	91.4	Very high	85.8	Confident	36 Å²	36	42.1 Å²	42.1	19%	0.193	21%	0.208	C	C	.	.			trans	-73.9	99.1	177	-175.1	20.4	0	0	0	110.7	F272 C278 E284 L287	F272-N276 HydrophobicContact CD1-CB 4.44Å; F272-N276 HydrophobicContact CE1-CB 4.17Å; F272-N276 HydrophobicContact CE2-CB 4.31Å; F272-N276 HydrophobicContact CZ-CB 4.11Å; F272-N276 WeakPolarHBondContact O-CB 3.49Å; F272-N276 PolarHBondContact O-N 3.13Å; N276-C278 PolarHBondContact OD1-N 2.93Å; N276-C278 PolarHBondContact OD1-SG 3.27Å; N276-C278 VanDerWaalsContact OD1-SG 3.33Å; N276-E284 VanDerWaalsContact ND2-CD 3.32Å; N276-E284 WeakPolarHBondContact ND2-CG 3.27Å; N276-E284 PolarHBondContact ND2-OE1 3.13Å; N276-L287 VanDerWaalsContact CA-CD2 3.46Å; N276-L287 HydrophobicContact CB-CD2 3.65Å
277	R	90.4	Very high	87	Confident	66 Å²	66	35.9 Å²	35.9	25%	0.249	18%	0.181	C	C	.	.			trans	-126.2	28.2	173.4	-58.7	178.8	175.7	-161.5	-5.5	111	L275 A551 S554 D558 Y559	L275-R277 PolarHBondContact O-N 3.08Å; R277-A551 HydrophobicContact CB-CB 4.01Å; R277-S554 PolarHBondContact NH1-O 2.91Å; R277-S554 PolarHBondContact NH1-OG 3.46Å; R277-D558 IonicContact CZ-OD2 3.74Å; R277-D558 VanDerWaalsContact NH1-CG 3.3Å; R277-D558 IonicContact NH1-OD2 2.84Å; R277-D558 PolarHBondContact NH1-OD2 2.88Å; R277-D558 IonicContact NH2-OD2 3.98Å; R277-D558 PolarHBondContact NH2-OD2 3.45Å; R277-D558 VanDerWaalsContact NH2-OD2 3.14Å; R277-Y559 PolarHBondContact NH2-OH 3.3Å
278	C	90.3	Very high	87.6	Confident	25 Å²	25	37.9 Å²	37.9	17%	0.169	19%	0.187	C	C	.	.			trans	-69.3	142.4	-178.7	-56.5	0	0	0	0	109.8	N276 E284 D547	N276-C278 PolarHBondContact OD1-N 2.93Å; N276-C278 PolarHBondContact OD1-SG 3.27Å; N276-C278 VanDerWaalsContact OD1-SG 3.33Å; C278-E284 HydrophobicContact CB-CB 4.41Å; C278-D547 WeakPolarHBondContact CB-OD2 3.5Å
279	H	87	Confident	88	Confident	103 Å²	103	40.2 Å²	40.2	48%	0.477	20%	0.195	S	C	.	.	S	Bend	trans	-93.4	-19.1	175.8	-81.6	-89.4	0	0	0	112.8	H324 D547	H279-H324 AromaticContact CD2-CD2 4Å; H279-H324 AromaticContact CD2-CE1 3.96Å; H279-H324 AromaticContact CD2-CG 3.54Å; H279-H324 AromaticContact CD2-ND1 3.51Å; H279-H324 AromaticContact NE2-CG 3.77Å; H279-H324 AromaticContact NE2-ND1 3.38Å; H279-H324 PolarHBondContact NE2-ND1 3.29Å; H279-D547 PolarHBondContact N-OD1 2.95Å; H279-D547 PolarHBondContact N-OD2 2.92Å; H279-D547 VanDerWaalsContact N-OD2 3.12Å
280	C	85.6	Confident	88.2	Confident	9 Å²	9	37.5 Å²	37.5	6%	0.061	18%	0.18	C	C	.	.	S	Bend	trans	-106.8	137	176.8	-175.1	0	0	0	0	110.6	W282 G283 E284 I330 D547	C280-W282 PolarHBondContact O-N 3.48Å; C280-W282 PolarHBondContact SG-N 2.86Å; C280-G283 WeakPolarHBondContact O-CA 3.44Å; C280-G283 PolarHBondContact O-N 3.15Å; C280-E284 PolarHBondContact O-N 3.45Å; C280-I330 PolarHBondContact SG-O 3.12Å; C280-D547 WeakPolarHBondContact CA-OD2 3.42Å; C280-D547 VanDerWaalsContact CB-OD2 3.28Å; C280-D547 WeakPolarHBondContact CB-OD2 3.34Å; C280-D547 PolarHBondContact N-OD2 2.84Å
281	K	83.9	Confident	88.1	Confident	86 Å²	86	37.5 Å²	37.5	37%	0.374	18%	0.18	S	C	.	.	H	α-helix	trans	-57.2	-32	173.6	-69.6	-167.4	174.2	-167.3	0	112.8	E43 E45 E284 K285	E43-K281 VanDerWaalsContact OE2-CD 3.29Å; E43-K281 WeakPolarHBondContact OE2-CD 3.47Å; E43-K281 VanDerWaalsContact OE2-CE 3.22Å; E43-K281 WeakPolarHBondContact OE2-CE 3.4Å; E43-K281 IonicContact OE2-NZ 3.21Å; E43-K281 PolarHBondContact OE2-NZ 2.75Å; E45-K281 IonicContact OE1-NZ 2.66Å; E45-K281 PolarHBondContact OE1-NZ 2.99Å; K281-E284 PolarHBondContact O-N 2.91Å; K281-K285 WeakPolarHBondContact O-CG 3.48Å; K281-K285 PolarHBondContact O-N 3.48Å
282	W	83	Confident	87.7	Confident	38 Å²	38	39.8 Å²	39.8	14%	0.144	19%	0.194	C	C	.	.	H	α-helix	trans	-70	-34.8	174.6	-77.7	91.6	0	0	0	112.6	D70 C280 K285 L286 P334	D70-W282 HydrophobicContact CB-CH2 3.62Å; D70-W282 HydrophobicContact CB-CZ3 4.44Å; C280-W282 PolarHBondContact O-N 3.48Å; C280-W282 PolarHBondContact SG-N 2.86Å; W282-K285 PolarHBondContact O-N 2.93Å; W282-L286 VanDerWaalsContact O-CB 3.31Å; W282-L286 WeakPolarHBondContact O-CB 3.32Å; W282-L286 PolarHBondContact O-N 3.27Å; W282-P334 HydrophobicContact CH2-CG 3.94Å; W282-P334 HydrophobicContact CZ2-CB 4.26Å; W282-P334 HydrophobicContact CZ2-CG 3.53Å
283	G	87	Confident	87.2	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-61.5	-48	170.4	0	0	0	0	0	110.8	C280 K285 L286 L287 V548	C280-G283 WeakPolarHBondContact O-CA 3.44Å; C280-G283 PolarHBondContact O-N 3.15Å; G283-K285 PolarHBondContact O-N 2.92Å; G283-L286 PolarHBondContact O-N 3.43Å; G283-L286 VanDerWaalsContact O-N 3.15Å; G283-L287 WeakPolarHBondContact O-CB 3.28Å; G283-L287 PolarHBondContact O-N 3.41Å; G283-V548 WeakPolarHBondContact O-CG2 3.49Å
284	E	87.4	Confident	87.2	Confident	78 Å²	78	40.2 Å²	40.2	36%	0.364	18%	0.184	S	C	.	.	H	α-helix	trans	-57.8	-47.5	175.7	177.1	172	-169	0	0	112.6	F272 N276 C278 C280 K281 L286 L287 R288	F272-E284 HydrophobicContact CZ-CG 3.9Å; N276-E284 VanDerWaalsContact ND2-CD 3.32Å; N276-E284 WeakPolarHBondContact ND2-CG 3.27Å; N276-E284 PolarHBondContact ND2-OE1 3.13Å; C278-E284 HydrophobicContact CB-CB 4.41Å; C280-E284 PolarHBondContact O-N 3.45Å; K281-E284 PolarHBondContact O-N 2.91Å; E284-L286 VanDerWaalsContact C-N 3.31Å; E284-L286 PolarHBondContact O-N 2.83Å; E284-L287 PolarHBondContact O-N 3.26Å; E284-R288 WeakPolarHBondContact O-CB 3.47Å; E284-R288 PolarHBondContact O-N 3.34Å
285	K	83.7	Confident	87.1	Confident	95 Å²	95	40.3 Å²	40.3	41%	0.413	19%	0.185	S	C	.	.	H	α-helix	trans	-59.4	-42.1	175.8	-75.3	-178.4	178.8	-173.3	0	111.7	K281 W282 G283 R288 L289	K281-K285 WeakPolarHBondContact O-CG 3.48Å; K281-K285 PolarHBondContact O-N 3.48Å; W282-K285 PolarHBondContact O-N 2.93Å; G283-K285 PolarHBondContact O-N 2.92Å; K285-R288 PolarHBondContact O-N 3.2Å; K285-L289 WeakPolarHBondContact O-CB 3.31Å; K285-L289 PolarHBondContact O-N 3.17Å
286	L	85.8	Confident	86.8	Confident	23 Å²	23	43.7 Å²	43.7	12%	0.12	20%	0.201	C	C	.	.	H	α-helix	trans	-68.5	-40.7	178.2	-177.5	66.1	0	0	0	112.2	W282 G283 E284 R288 L289 W290 R545 V548	W282-L286 VanDerWaalsContact O-CB 3.31Å; W282-L286 WeakPolarHBondContact O-CB 3.32Å; W282-L286 PolarHBondContact O-N 3.27Å; G283-L286 PolarHBondContact O-N 3.43Å; G283-L286 VanDerWaalsContact O-N 3.15Å; E284-L286 VanDerWaalsContact C-N 3.31Å; E284-L286 PolarHBondContact O-N 2.83Å; L286-R288 VanDerWaalsContact C-N 3.33Å; L286-R288 PolarHBondContact O-N 3.11Å; L286-L289 HydrophobicContact CD1-CD2 4.18Å; L286-L289 CarbonylContact O-C 3.58Å; L286-L289 WeakPolarHBondContact O-CA 3.32Å; L286-L289 VanDerWaalsContact O-CB 3.3Å; L286-L289 WeakPolarHBondContact O-CB 3.2Å; L286-L289 PolarHBondContact O-N 3.3Å; L286-W290 HydrophobicContact CD2-CZ2 4.11Å; L286-W290 HydrophobicContact CG-CZ2 4.41Å; L286-W290 PolarHBondContact O-N 3.35Å; L286-R545 HydrophobicContact CD2-CB 4.23Å; L286-R545 HydrophobicContact CD2-CG 3.65Å; L286-V548 HydrophobicContact CB-CG2 4.02Å; L286-V548 HydrophobicContact CD2-CG2 4.07Å; L286-V548 HydrophobicContact CG-CG2 4.17Å
287	L	89.7	Confident	86.7	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.5	-44.5	174.8	177.8	65.9	0	0	0	110.6	F272 N276 G283 E284 L289 W290 F291 V548 L552	F272-L287 HydrophobicContact CD2-CD2 4.21Å; F272-L287 HydrophobicContact CD2-CG 4.16Å; F272-L287 HydrophobicContact CE2-CB 4.16Å; F272-L287 HydrophobicContact CE2-CD2 3.83Å; F272-L287 HydrophobicContact CE2-CG 3.77Å; N276-L287 VanDerWaalsContact CA-CD2 3.46Å; N276-L287 HydrophobicContact CB-CD2 3.65Å; G283-L287 WeakPolarHBondContact O-CB 3.28Å; G283-L287 PolarHBondContact O-N 3.41Å; E284-L287 PolarHBondContact O-N 3.26Å; L287-L289 VanDerWaalsContact C-N 3.25Å; L287-L289 PolarHBondContact O-N 2.66Å; L287-W290 PolarHBondContact O-N 3.11Å; L287-W290 VanDerWaalsContact O-N 3.15Å; L287-F291 HydrophobicContact CD1-CD2 3.86Å; L287-F291 HydrophobicContact CD1-CE2 3.35Å; L287-F291 HydrophobicContact CD1-CZ 4.13Å; L287-F291 HydrophobicContact CG-CD2 4.3Å; L287-F291 HydrophobicContact CG-CE2 4.05Å; L287-F291 VanDerWaalsContact O-CD2 3.3Å; L287-F291 WeakPolarHBondContact O-CD2 3.48Å; L287-F291 PolarHBondContact O-N 3.49Å; L287-V548 HydrophobicContact CB-CG1 4.09Å; L287-V548 HydrophobicContact CB-CG2 3.92Å; L287-V548 HydrophobicContact CD1-CG1 3.76Å; L287-V548 HydrophobicContact CG-CG1 4.48Å; L287-L552 HydrophobicContact CD1-CD2 4.22Å
288	R	85.5	Confident	86.6	Confident	94 Å²	94	46.2 Å²	46.2	36%	0.355	22%	0.219	S	C	.	.	H	α-helix	trans	-60.1	-40.7	175.5	-176	172.9	-78.8	-98.5	-0.6	110.4	F250 E267 F272 E284 K285 L286 F291 T292	F250-R288 HydrophobicContact CE1-CG 3.99Å; F250-R288 HydrophobicContact CZ-CG 4.2Å; E267-R288 IonicContact OE2-CZ 2.64Å; E267-R288 IonicContact OE2-NH2 2.69Å; E267-R288 PolarHBondContact OE2-NH2 3.29Å; F272-R288 HydrophobicContact CE2-CB 3.71Å; F272-R288 HydrophobicContact CE2-CG 4.49Å; F272-R288 HydrophobicContact CZ-CB 3.94Å; E284-R288 WeakPolarHBondContact O-CB 3.47Å; E284-R288 PolarHBondContact O-N 3.34Å; K285-R288 PolarHBondContact O-N 3.2Å; L286-R288 VanDerWaalsContact C-N 3.33Å; L286-R288 PolarHBondContact O-N 3.11Å; R288-F291 PolarHBondContact O-N 3.4Å; R288-T292 WeakPolarHBondContact O-CG2 3.31Å; R288-T292 PolarHBondContact O-N 3.49Å; R288-T292 PolarHBondContact O-OG1 3.15Å
289	L	83.8	Confident	86.5	Confident	65 Å²	65	47.3 Å²	47.3	34%	0.34	23%	0.234	S	C	.	.	H	α-helix	trans	-62.1	-42.6	174.1	-170.3	70.2	0	0	0	112.4	K285 L286 L287 F291 T292 R293	K285-L289 WeakPolarHBondContact O-CB 3.31Å; K285-L289 PolarHBondContact O-N 3.17Å; L286-L289 HydrophobicContact CD1-CD2 4.18Å; L286-L289 CarbonylContact O-C 3.58Å; L286-L289 WeakPolarHBondContact O-CA 3.32Å; L286-L289 VanDerWaalsContact O-CB 3.3Å; L286-L289 WeakPolarHBondContact O-CB 3.2Å; L286-L289 PolarHBondContact O-N 3.3Å; L287-L289 VanDerWaalsContact C-N 3.25Å; L287-L289 PolarHBondContact O-N 2.66Å; L289-F291 VanDerWaalsContact C-N 3.28Å; L289-F291 PolarHBondContact O-N 3.34Å; L289-T292 WeakPolarHBondContact CA-OG1 3.39Å; L289-T292 PolarHBondContact O-N 3.38Å; L289-T292 PolarHBondContact O-OG1 3.41Å; L289-T292 VanDerWaalsContact O-OG1 3.06Å; L289-R293 HydrophobicContact CD1-CG 4.37Å; L289-R293 VanDerWaalsContact CD1-NE 3.34Å; L289-R293 VanDerWaalsContact O-CB 3.27Å; L289-R293 WeakPolarHBondContact O-CB 3.27Å; L289-R293 PolarHBondContact O-N 2.92Å
290	W	88	Confident	86.7	Confident	18 Å²	18	45.2 Å²	45.2	7%	0.068	22%	0.224	C	C	.	.	H	α-helix	trans	-65.3	-33.8	176.8	-71.8	5.4	0	0	0	112.2	L286 L287 R293 R304 R545 V548 L549 L552 V631	L286-W290 HydrophobicContact CD2-CZ2 4.11Å; L286-W290 HydrophobicContact CG-CZ2 4.41Å; L286-W290 PolarHBondContact O-N 3.35Å; L287-W290 PolarHBondContact O-N 3.11Å; L287-W290 VanDerWaalsContact O-N 3.15Å; W290-R293 CarbonylContact O-C 3.58Å; W290-R293 VanDerWaalsContact O-C 3.25Å; W290-R293 PolarHBondContact O-N 2.83Å; W290-R304 HydrophobicContact CH2-CG 4.13Å; W290-R304 HydrophobicContact CZ3-CG 4.29Å; W290-R545 HydrophobicContact CZ2-CG 4.37Å; W290-V548 HydrophobicContact CD2-CG1 4.23Å; W290-V548 HydrophobicContact CE3-CG1 3.48Å; W290-V548 VanDerWaalsContact CE3-CG1 3.48Å; W290-V548 HydrophobicContact CH2-CB 4.27Å; W290-V548 HydrophobicContact CH2-CG1 3.92Å; W290-V548 HydrophobicContact CZ3-CB 4.13Å; W290-V548 HydrophobicContact CZ3-CG1 3.3Å; W290-L549 HydrophobicContact CH2-CD1 4.41Å; W290-L549 HydrophobicContact CH2-CD2 3.84Å; W290-L549 HydrophobicContact CH2-CG 3.93Å; W290-L549 HydrophobicContact CZ3-CD2 3.78Å; W290-L549 HydrophobicContact CZ3-CG 4.23Å; W290-L552 HydrophobicContact CZ3-CD1 4.35Å; W290-V631 HydrophobicContact CB-CG1 4.24Å
291	F	88.4	Confident	87	Confident	1 Å²	1	44.8 Å²	44.8	0%	0.004	22%	0.222	C	C	.	.	H	α-helix	trans	-73.4	-35.4	177	-84.1	-138.4	0	0	0	112	Y244 I249 F250 L271 F272 L275 L287 R288 L289 R293 F627 V631	Y244-F291 VanDerWaalsContact CE1-O 3.29Å; Y244-F291 WeakPolarHBondContact CE1-O 3.35Å; Y244-F291 PolarHBondContact OH-O 2.98Å; I249-F291 HydrophobicContact CG2-CB 4.5Å; I249-F291 HydrophobicContact CG2-CD1 3.71Å; I249-F291 HydrophobicContact CG2-CE1 4.48Å; F250-F291 HydrophobicContact CE1-CB 4.11Å; F250-F291 HydrophobicContact CE1-CD1 4.4Å; F250-F291 HydrophobicContact CE2-CB 4.28Å; F250-F291 HydrophobicContact CZ-CB 3.47Å; F250-F291 VanDerWaalsContact CZ-CB 3.47Å; F250-F291 HydrophobicContact CZ-CD1 4.41Å; F250-F291 HydrophobicContact CZ-CG 4.41Å; L271-F291 HydrophobicContact CB-CE1 4.39Å; L271-F291 HydrophobicContact CD2-CE1 4Å; L271-F291 HydrophobicContact CG-CE1 3.91Å; L271-F291 HydrophobicContact CG-CZ 4.49Å; F272-F291 HydrophobicContact CB-CD1 4.03Å; F272-F291 HydrophobicContact CB-CE1 4Å; F272-F291 HydrophobicContact CD2-CD1 4.1Å; F272-F291 HydrophobicContact CD2-CE1 4.28Å; F272-F291 HydrophobicContact CD2-CG 4.39Å; L275-F291 HydrophobicContact CB-CZ 4.04Å; L275-F291 HydrophobicContact CD1-CE1 4.32Å; L275-F291 HydrophobicContact CD1-CE2 4.49Å; L275-F291 HydrophobicContact CD1-CZ 3.58Å; L275-F291 HydrophobicContact CG-CZ 4.39Å; L287-F291 HydrophobicContact CD1-CD2 3.86Å; L287-F291 HydrophobicContact CD1-CE2 3.35Å; L287-F291 HydrophobicContact CD1-CZ 4.13Å; L287-F291 HydrophobicContact CG-CD2 4.3Å; L287-F291 HydrophobicContact CG-CE2 4.05Å; L287-F291 VanDerWaalsContact O-CD2 3.3Å; L287-F291 WeakPolarHBondContact O-CD2 3.48Å; L287-F291 PolarHBondContact O-N 3.49Å; R288-F291 PolarHBondContact O-N 3.4Å; L289-F291 VanDerWaalsContact C-N 3.28Å; L289-F291 PolarHBondContact O-N 3.34Å; F291-R293 VanDerWaalsContact C-N 3.33Å; F291-F627 HydrophobicContact CB-CZ 4.05Å; F291-F627 AromaticContact CD1-CE1 3.92Å; F291-F627 HydrophobicContact CD1-CE1 3.92Å; F291-F627 HydrophobicContact CD1-CZ 4.18Å; F291-F627 HydrophobicContact CE1-CE1 4.27Å; F291-F627 HydrophobicContact CG-CE1 4.15Å; F291-F627 HydrophobicContact CG-CZ 4.11Å; F291-F627 WeakPolarHBondContact O-CE2 3.41Å; F291-F627 VanDerWaalsContact O-CZ 3.23Å; F291-F627 WeakPolarHBondContact O-CZ 3.29Å; F291-V631 HydrophobicContact CD2-CG1 3.85Å; F291-V631 HydrophobicContact CD2-CG2 4.1Å; F291-V631 HydrophobicContact CE2-CG1 3.75Å; F291-V631 HydrophobicContact CE2-CG2 4.42Å
292	T	82.6	Confident	87.5	Confident	47 Å²	47	42.8 Å²	42.8	29%	0.288	22%	0.218	S	C	.	.	H	α-helix	trans	-78.3	-20.5	174	56.4	0	0	0	0	112.9	Y244 F250 R288 L289 P294	Y244-T292 WeakPolarHBondContact OH-CA 3.32Å; Y244-T292 PolarHBondContact OH-O 3.45Å; F250-T292 HydrophobicContact CE2-CG2 3.76Å; F250-T292 HydrophobicContact CZ-CG2 3.82Å; R288-T292 WeakPolarHBondContact O-CG2 3.31Å; R288-T292 PolarHBondContact O-N 3.49Å; R288-T292 PolarHBondContact O-OG1 3.15Å; L289-T292 WeakPolarHBondContact CA-OG1 3.39Å; L289-T292 PolarHBondContact O-N 3.38Å; L289-T292 PolarHBondContact O-OG1 3.41Å; L289-T292 VanDerWaalsContact O-OG1 3.06Å; T292-P294 VanDerWaalsContact C-CD 3.42Å
293	R	83.7	Confident	88	Confident	47 Å²	47	42.2 Å²	42.2	18%	0.177	22%	0.22	C	C	.	.	S	Bend	trans	-128.4	63.6	-177.4	-54.9	-179.6	-176	-170.8	-9.5	112.3	E94 L236 L289 W290 F291	E94-R293 HydrophobicContact CG-CG 4.05Å; E94-R293 WeakPolarHBondContact OE1-CD 3.41Å; E94-R293 WeakPolarHBondContact OE1-CG 3.25Å; E94-R293 IonicContact OE1-CZ 3.27Å; E94-R293 IonicContact OE1-NE 2.88Å; E94-R293 PolarHBondContact OE1-NE 3.07Å; E94-R293 IonicContact OE1-NH1 3.14Å; E94-R293 IonicContact OE1-NH2 3.34Å; L236-R293 HydrophobicContact CD1-CB 4.41Å; L236-R293 HydrophobicContact CD2-CB 3.91Å; L289-R293 HydrophobicContact CD1-CG 4.37Å; L289-R293 VanDerWaalsContact CD1-NE 3.34Å; L289-R293 VanDerWaalsContact O-CB 3.27Å; L289-R293 WeakPolarHBondContact O-CB 3.27Å; L289-R293 PolarHBondContact O-N 2.92Å; W290-R293 CarbonylContact O-C 3.58Å; W290-R293 VanDerWaalsContact O-C 3.25Å; W290-R293 PolarHBondContact O-N 2.83Å; F291-R293 VanDerWaalsContact C-N 3.33Å
294	P	89.1	Confident	88.4	Confident	0 Å²	0	43 Å²	43	0%	0	22%	0.224	C	C	.	.			trans	-62.1	144.5	172.7	18.2	-21.4	0	0	0	110.5	L236 V237 I239 T292 F627 L630 V631	L236-P294 WeakPolarHBondContact CA-O 3.28Å; V237-P294 HydrophobicContact CB-CB 4.25Å; V237-P294 HydrophobicContact CB-CG 4.09Å; V237-P294 HydrophobicContact CG2-CB 4.41Å; V237-P294 PolarHBondContact N-O 3.35Å; I239-P294 HydrophobicContact CD1-CG 3.42Å; I239-P294 VanDerWaalsContact CD1-CG 3.42Å; I239-P294 HydrophobicContact CG1-CG 4.2Å; T292-P294 VanDerWaalsContact C-CD 3.42Å; P294-F627 HydrophobicContact CB-CE2 4.48Å; P294-F627 HydrophobicContact CG-CD2 4.38Å; P294-F627 HydrophobicContact CG-CE2 3.97Å; P294-L630 HydrophobicContact CB-CB 4Å; P294-V631 HydrophobicContact CB-CG2 4.46Å
295	T	88.9	Confident	88.7	Confident	14 Å²	14	39.4 Å²	39.4	9%	0.086	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-114.5	148.7	-174.4	-176.7	0	0	0	0	110.5	H235 D297 E300 L301 L630	H235-T295 CarbonylContact O-C 3.56Å; H235-T295 WeakPolarHBondContact O-CA 3.45Å; H235-T295 PolarHBondContact O-OG1 3.49Å; T295-D297 WeakPolarHBondContact OG1-CB 3.44Å; T295-D297 PolarHBondContact OG1-N 2.81Å; T295-E300 HydrophobicContact CG2-CG 4.21Å; T295-L301 HydrophobicContact CG2-CD2 3.69Å; T295-L301 HydrophobicContact CG2-CG 3.96Å; T295-L630 PolarHBondContact N-O 2.77Å; T295-L630 VanDerWaalsContact O-O 3.1Å
296	H	87.6	Confident	89.3	Confident	72 Å²	72	38.1 Å²	38.1	33%	0.333	20%	0.204	S	C	.	.			trans	-104.1	8	167.3	67.3	-107.7	0	0	0	112.5	H235 V237 L298	H235-H296 VanDerWaalsContact C-CE1 3.49Å; H235-H296 VanDerWaalsContact C-ND1 3.34Å; H235-H296 WeakPolarHBondContact CA-CE1 3.47Å; H235-H296 AromaticContact ND1-CD2 3.9Å; H235-H296 AromaticContact ND1-NE2 3.33Å; H235-H296 PolarHBondContact ND1-NE2 2.97Å; H235-H296 PolarHBondContact O-N 3.03Å; H235-H296 PolarHBondContact O-ND1 2.95Å; V237-H296 HydrophobicContact CG2-CB 4.24Å; H296-L298 PolarHBondContact O-N 3.48Å
297	D	88.4	Confident	89.7	Confident	72 Å²	72	37 Å²	37	39%	0.385	20%	0.199	S	C	.	.			trans	-71.2	107.6	172.6	-178.6	4.8	0	0	0	110.7	H235 T295 G299 E300 L301	H235-D297 HydrophobicContact CB-CB 4.21Å; T295-D297 WeakPolarHBondContact OG1-CB 3.44Å; T295-D297 PolarHBondContact OG1-N 2.81Å; D297-G299 PolarHBondContact O-N 2.77Å; D297-G299 PolarHBondContact OD1-N 2.97Å; D297-E300 HydrophobicContact CB-CB 4.18Å; D297-E300 PolarHBondContact O-N 2.94Å; D297-L301 VanDerWaalsContact O-CG 3.28Å; D297-L301 WeakPolarHBondContact O-CG 3.46Å; D297-L301 PolarHBondContact O-N 3.32Å
298	L	88.5	Confident	90	Very high	84 Å²	84	37 Å²	37	44%	0.44	20%	0.199	S	C	.	.	H	α-helix	trans	-62.5	-29.1	-179.2	-60	-177.2	0	0	0	113	H296 L301 S302 Y566	H296-L298 PolarHBondContact O-N 3.48Å; L298-L301 HydrophobicContact CD2-CD1 4.5Å; L298-S302 WeakPolarHBondContact O-CB 3.27Å; L298-S302 PolarHBondContact O-N 3.01Å; L298-S302 PolarHBondContact O-OG 2.96Å; L298-Y566 HydrophobicContact CD2-CD1 4.15Å; L298-Y566 HydrophobicContact CD2-CD2 4.32Å; L298-Y566 HydrophobicContact CD2-CG 3.77Å
299	G	89.6	Confident	90.4	Very high	47 Å²	47	35.9 Å²	35.9	49%	0.485	20%	0.197	S	C	.	.	H	α-helix	trans	-67	-50.6	178.1	0	0	0	0	0	111.2	D297 S302 S303	D297-G299 PolarHBondContact O-N 2.77Å; D297-G299 PolarHBondContact OD1-N 2.97Å; G299-S302 PolarHBondContact O-N 3.03Å; G299-S303 WeakPolarHBondContact O-CB 3.48Å; G299-S303 PolarHBondContact O-N 3.28Å
300	E	90.5	Very high	90.9	Very high	59 Å²	59	34.1 Å²	34.1	28%	0.276	19%	0.187	S	C	.	.	H	α-helix	trans	-62.2	-46.9	176.1	179.6	64.4	-166.5	0	0	111.6	T295 D297 S302 S303 R304	T295-E300 HydrophobicContact CG2-CG 4.21Å; D297-E300 HydrophobicContact CB-CB 4.18Å; D297-E300 PolarHBondContact O-N 2.94Å; E300-S302 PolarHBondContact O-N 2.99Å; E300-S303 WeakPolarHBondContact O-CB 3.38Å; E300-S303 PolarHBondContact O-N 3Å; E300-R304 WeakPolarHBondContact O-CG 3.37Å; E300-R304 PolarHBondContact O-N 3.09Å; E300-R304 IonicContact OE1-CZ 3.18Å; E300-R304 VanDerWaalsContact OE1-CZ 3.27Å; E300-R304 IonicContact OE1-NE 3.12Å; E300-R304 PolarHBondContact OE1-NE 3.42Å; E300-R304 IonicContact OE1-NH2 3.89Å; E300-R304 PolarHBondContact OE1-NH2 2.9Å
301	L	92.9	Very high	91.2	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-60.5	-44.5	178.1	-67.4	173.9	0	0	0	112	T295 D297 L298 R304 L305 Y566 L630	T295-L301 HydrophobicContact CG2-CD2 3.69Å; T295-L301 HydrophobicContact CG2-CG 3.96Å; D297-L301 VanDerWaalsContact O-CG 3.28Å; D297-L301 WeakPolarHBondContact O-CG 3.46Å; D297-L301 PolarHBondContact O-N 3.32Å; L298-L301 HydrophobicContact CD2-CD1 4.5Å; L301-R304 PolarHBondContact O-N 3.44Å; L301-L305 WeakPolarHBondContact O-CG 3.46Å; L301-L305 PolarHBondContact O-N 3.31Å; L301-Y566 HydrophobicContact CB-CE2 3.72Å; L301-Y566 HydrophobicContact CD1-CD1 4.4Å; L301-Y566 HydrophobicContact CD1-CE1 3.79Å; L301-Y566 HydrophobicContact CD1-CE2 4.27Å; L301-L630 WeakPolarHBondContact CD2-O 3.3Å
302	S	92.6	Very high	91.4	Very high	43 Å²	43	35.2 Å²	35.2	30%	0.301	19%	0.194	S	C	.	.	H	α-helix	trans	-65	-41.7	178.9	-59.5	0	0	0	0	111.7	L298 G299 E300 R304 L305 D306	L298-S302 WeakPolarHBondContact O-CB 3.27Å; L298-S302 PolarHBondContact O-N 3.01Å; L298-S302 PolarHBondContact O-OG 2.96Å; G299-S302 PolarHBondContact O-N 3.03Å; E300-S302 PolarHBondContact O-N 2.99Å; S302-R304 VanDerWaalsContact C-N 3.33Å; S302-R304 PolarHBondContact O-N 3.01Å; S302-L305 PolarHBondContact O-N 3.33Å; S302-D306 VanDerWaalsContact O-CG 3.26Å; S302-D306 PolarHBondContact O-N 3.05Å
303	S	93.5	Very high	91.8	Very high	27 Å²	27	36.8 Å²	36.8	19%	0.189	20%	0.2	C	C	.	.	H	α-helix	trans	-57.8	-44.1	176	-176.4	0	0	0	0	112	G299 E300 D306 V307	G299-S303 WeakPolarHBondContact O-CB 3.48Å; G299-S303 PolarHBondContact O-N 3.28Å; E300-S303 WeakPolarHBondContact O-CB 3.38Å; E300-S303 PolarHBondContact O-N 3Å; S303-D306 PolarHBondContact O-N 3.31Å; S303-V307 PolarHBondContact O-N 3.01Å
304	R	95.4	Very high	92	Very high	17 Å²	17	39.9 Å²	39.9	6%	0.064	23%	0.226	C	C	.	.	H	α-helix	trans	-62.1	-48.3	175.1	-66.5	175.6	-171.1	-173.8	1.3	111.8	W290 E300 L301 S302 D306 V307 I308 L549 V631	W290-R304 HydrophobicContact CH2-CG 4.13Å; W290-R304 HydrophobicContact CZ3-CG 4.29Å; E300-R304 WeakPolarHBondContact O-CG 3.37Å; E300-R304 PolarHBondContact O-N 3.09Å; E300-R304 IonicContact OE1-CZ 3.18Å; E300-R304 VanDerWaalsContact OE1-CZ 3.27Å; E300-R304 IonicContact OE1-NE 3.12Å; E300-R304 PolarHBondContact OE1-NE 3.42Å; E300-R304 IonicContact OE1-NH2 3.89Å; E300-R304 PolarHBondContact OE1-NH2 2.9Å; L301-R304 PolarHBondContact O-N 3.44Å; S302-R304 VanDerWaalsContact C-N 3.33Å; S302-R304 PolarHBondContact O-N 3.01Å; R304-D306 VanDerWaalsContact C-N 3.28Å; R304-D306 PolarHBondContact O-N 2.98Å; R304-V307 PolarHBondContact O-N 3.44Å; R304-I308 WeakPolarHBondContact O-CG1 3.35Å; R304-I308 PolarHBondContact O-N 2.85Å; R304-I308 VanDerWaalsContact O-N 3.15Å; R304-L549 HydrophobicContact CB-CD2 3.67Å; R304-L549 HydrophobicContact CG-CD2 3.95Å; R304-V631 PolarHBondContact NH1-O 3.33Å
305	L	95.2	Very high	92	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-63.5	-31.6	-179.6	-68.1	178.2	0	0	0	113.1	L301 S302 I308 Q309 R563 P564 Y566 G632 F634	L301-L305 WeakPolarHBondContact O-CG 3.46Å; L301-L305 PolarHBondContact O-N 3.31Å; S302-L305 PolarHBondContact O-N 3.33Å; L305-I308 PolarHBondContact O-N 3.33Å; L305-Q309 WeakPolarHBondContact O-CB 3.44Å; L305-Q309 PolarHBondContact O-N 3.32Å; L305-R563 HydrophobicContact CD1-CG 4.24Å; L305-P564 HydrophobicContact CD1-CG 3.98Å; L305-P564 HydrophobicContact CD2-CG 4.13Å; L305-Y566 HydrophobicContact CD1-CE2 3.53Å; L305-G632 WeakPolarHBondContact CD2-O 3.39Å; L305-F634 HydrophobicContact CB-CE1 4.4Å; L305-F634 HydrophobicContact CD2-CD1 3.57Å; L305-F634 HydrophobicContact CD2-CE1 3.71Å
306	D	94.8	Very high	92.2	Very high	69 Å²	69	48.7 Å²	48.7	37%	0.369	27%	0.267	S	S	.	.	H	α-helix	trans	-67.6	-41.1	178	-72.6	-21.4	0	0	0	112.4	S302 S303 R304 F310 R563	S302-D306 VanDerWaalsContact O-CG 3.26Å; S302-D306 PolarHBondContact O-N 3.05Å; S303-D306 PolarHBondContact O-N 3.31Å; R304-D306 VanDerWaalsContact C-N 3.28Å; R304-D306 PolarHBondContact O-N 2.98Å; D306-F310 WeakPolarHBondContact O-CB 3.35Å; D306-F310 PolarHBondContact O-N 3.04Å; D306-R563 IonicContact OD1-CZ 3.48Å; D306-R563 VanDerWaalsContact OD1-CZ 3.25Å; D306-R563 IonicContact OD1-NH1 2.81Å; D306-R563 PolarHBondContact OD1-NH1 3.36Å; D306-R563 IonicContact OD1-NH2 3.84Å; D306-R563 PolarHBondContact OD1-NH2 2.85Å
307	V	94.9	Very high	92.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-63.6	-46.6	173.8	179	0	0	0	0	110.4	S303 R304 Q309 F310 F311 I374 L376 F377 L549	S303-V307 PolarHBondContact O-N 3.01Å; R304-V307 PolarHBondContact O-N 3.44Å; V307-Q309 PolarHBondContact O-N 2.87Å; V307-F310 WeakPolarHBondContact O-CB 3.48Å; V307-F310 PolarHBondContact O-N 3.49Å; V307-F311 HydrophobicContact CG1-CD2 3.87Å; V307-F311 HydrophobicContact CG1-CE2 3.81Å; V307-F311 WeakPolarHBondContact O-CD2 3.49Å; V307-F311 PolarHBondContact O-N 2.84Å; V307-I374 HydrophobicContact CG2-CG2 3.6Å; V307-L376 HydrophobicContact CG1-CD2 4.46Å; V307-L376 HydrophobicContact CG2-CB 4.22Å; V307-L376 HydrophobicContact CG2-CD2 4.1Å; V307-F377 HydrophobicContact CG1-CE1 4.17Å; V307-F377 HydrophobicContact CG1-CZ 4.16Å; V307-L549 HydrophobicContact CB-CB 4.31Å; V307-L549 HydrophobicContact CB-CD1 3.87Å; V307-L549 HydrophobicContact CG1-CB 3.74Å; V307-L549 HydrophobicContact CG1-CD1 3.86Å; V307-L549 HydrophobicContact CG1-CG 4.39Å; V307-L549 HydrophobicContact CG2-CD1 3.92Å
308	I	95.5	Very high	92.3	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-60.6	-49.6	179.2	-66.2	167	0	0	0	109.8	R304 L305 F310 F311 L312 L549 L552 A553 G632 F634	R304-I308 WeakPolarHBondContact O-CG1 3.35Å; R304-I308 PolarHBondContact O-N 2.85Å; R304-I308 VanDerWaalsContact O-N 3.15Å; L305-I308 PolarHBondContact O-N 3.33Å; I308-F310 PolarHBondContact O-N 3.43Å; I308-F311 PolarHBondContact O-N 3.3Å; I308-F311 VanDerWaalsContact O-N 3.11Å; I308-L312 HydrophobicContact CB-CD1 4.45Å; I308-L312 HydrophobicContact CG2-CD1 3.28Å; I308-L312 WeakPolarHBondContact O-CD1 3.23Å; I308-L312 PolarHBondContact O-N 3.16Å; I308-L549 HydrophobicContact CD1-CD2 4.02Å; I308-L549 HydrophobicContact CG1-CB 4.45Å; I308-L549 HydrophobicContact CG1-CD2 4.02Å; I308-L552 HydrophobicContact CD1-CB 3.91Å; I308-L552 HydrophobicContact CD1-CD1 4.13Å; I308-L552 HydrophobicContact CG1-CB 4.33Å; I308-A553 HydrophobicContact CB-CB 4.48Å; I308-A553 HydrophobicContact CG2-CB 4.01Å; I308-G632 VanDerWaalsContact CD1-O 3.31Å; I308-G632 WeakPolarHBondContact CD1-O 3.47Å; I308-F634 HydrophobicContact CB-CD1 4.08Å; I308-F634 HydrophobicContact CB-CE1 3.73Å; I308-F634 HydrophobicContact CB-CZ 4.44Å; I308-F634 HydrophobicContact CD1-CD1 4.43Å; I308-F634 HydrophobicContact CG2-CD1 3.37Å; I308-F634 HydrophobicContact CG2-CD2 4.43Å; I308-F634 HydrophobicContact CG2-CE1 3.31Å; I308-F634 HydrophobicContact CG2-CE2 4.38Å; I308-F634 HydrophobicContact CG2-CG 3.97Å; I308-F634 HydrophobicContact CG2-CZ 3.85Å
309	Q	94.9	Very high	92.4	Very high	69 Å²	69	48.3 Å²	48.3	32%	0.322	27%	0.267	S	S	.	.	H	α-helix	trans	-55.9	-39.1	178.2	-176.7	62.3	64.3	0	0	112.7	L305 V307 F634	L305-Q309 WeakPolarHBondContact O-CB 3.44Å; L305-Q309 PolarHBondContact O-N 3.32Å; V307-Q309 PolarHBondContact O-N 2.87Å; Q309-F634 HydrophobicContact CB-CZ 4.03Å
310	F	94.6	Very high	92.4	Very high	28 Å²	28	46.5 Å²	46.5	12%	0.123	25%	0.247	C	C	.	.	H	α-helix	trans	-63.5	-45.7	177.6	177.7	-95.8	0	0	0	111.9	D306 V307 I308 L313 N316 L370 P371 I374 F377	D306-F310 WeakPolarHBondContact O-CB 3.35Å; D306-F310 PolarHBondContact O-N 3.04Å; V307-F310 WeakPolarHBondContact O-CB 3.48Å; V307-F310 PolarHBondContact O-N 3.49Å; I308-F310 PolarHBondContact O-N 3.43Å; F310-L313 WeakPolarHBondContact O-CB 3.4Å; F310-L313 PolarHBondContact O-N 2.8Å; F310-N316 HydrophobicContact CE1-CB 4.09Å; F310-N316 WeakPolarHBondContact CE2-ND2 3.35Å; F310-N316 HydrophobicContact CZ-CB 4.34Å; F310-N316 VanDerWaalsContact CZ-CG 3.44Å; F310-N316 WeakPolarHBondContact CZ-ND2 3.41Å; F310-N316 PolarHBondContact O-ND2 2.86Å; F310-L370 HydrophobicContact CE1-CD2 3.46Å; F310-L370 VanDerWaalsContact CE1-CD2 3.46Å; F310-L370 HydrophobicContact CZ-CD2 3.47Å; F310-L370 VanDerWaalsContact CZ-CD2 3.47Å; F310-P371 HydrophobicContact CD2-CG 4.29Å; F310-P371 HydrophobicContact CE2-CG 3.57Å; F310-P371 HydrophobicContact CZ-CG 4.12Å; F310-I374 HydrophobicContact CB-CD1 3.76Å; F310-I374 HydrophobicContact CD2-CD1 4.19Å; F310-I374 HydrophobicContact CG-CD1 3.95Å; F310-F377 AromaticContact CD1-CE2 3.81Å; F310-F377 HydrophobicContact CD1-CE2 3.81Å; F310-F377 AromaticContact CD1-CZ 3.91Å; F310-F377 HydrophobicContact CD1-CZ 3.91Å; F310-F377 HydrophobicContact CE1-CE2 4.09Å; F310-F377 HydrophobicContact CE1-CZ 4.36Å; F310-F377 HydrophobicContact CG-CE2 4.22Å
311	F	93.6	Very high	92.4	Very high	3 Å²	3	48.2 Å²	48.2	1%	0.013	26%	0.255	C	S	.	.	H	α-helix	trans	-80.8	-12	-179.1	-70.7	-63.6	0	0	0	114.7	V307 I308 L313 N316 A320 L323 L370 F377 L546 L550 A553	V307-F311 HydrophobicContact CG1-CD2 3.87Å; V307-F311 HydrophobicContact CG1-CE2 3.81Å; V307-F311 WeakPolarHBondContact O-CD2 3.49Å; V307-F311 PolarHBondContact O-N 2.84Å; I308-F311 PolarHBondContact O-N 3.3Å; I308-F311 VanDerWaalsContact O-N 3.11Å; F311-L313 PolarHBondContact O-N 2.81Å; F311-N316 HydrophobicContact CD1-CB 4.35Å; F311-A320 HydrophobicContact CD1-CB 3.85Å; F311-A320 HydrophobicContact CE1-CB 4.34Å; F311-L323 HydrophobicContact CE1-CD1 3.79Å; F311-L323 HydrophobicContact CZ-CD1 3.54Å; F311-L370 HydrophobicContact CZ-CD1 4.27Å; F311-F377 HydrophobicContact CD2-CZ 4.37Å; F311-F377 AromaticContact CE2-CE1 3.72Å; F311-F377 HydrophobicContact CE2-CE1 3.72Å; F311-F377 AromaticContact CE2-CZ 3.43Å; F311-F377 HydrophobicContact CE2-CZ 3.43Å; F311-F377 VanDerWaalsContact CE2-CZ 3.43Å; F311-F377 AromaticContact CZ-CE1 3.91Å; F311-F377 HydrophobicContact CZ-CE1 3.91Å; F311-F377 AromaticContact CZ-CZ 3.63Å; F311-F377 HydrophobicContact CZ-CZ 3.63Å; F311-L546 HydrophobicContact CE2-CD1 4.11Å; F311-L546 HydrophobicContact CZ-CD1 4.47Å; F311-L550 HydrophobicContact CB-CD2 4.25Å; F311-L550 HydrophobicContact CD1-CD2 3.75Å; F311-L550 HydrophobicContact CD2-CD2 3.39Å; F311-L550 HydrophobicContact CD2-CG 4.35Å; F311-L550 HydrophobicContact CE1-CD2 3.85Å; F311-L550 HydrophobicContact CE2-CD2 3.47Å; F311-L550 VanDerWaalsContact CE2-CD2 3.47Å; F311-L550 HydrophobicContact CE2-CG 4.23Å; F311-L550 HydrophobicContact CG-CD2 3.53Å; F311-L550 HydrophobicContact CZ-CD2 3.71Å; F311-A553 HydrophobicContact CB-CB 3.96Å
312	L	92.1	Very high	92.4	Very high	39 Å²	39	52.4 Å²	52.4	20%	0.204	28%	0.276	C	S	.	.	H	α-helix	trans	-69.4	-22.1	167.7	-95.1	98.5	0	0	0	112.9	I308 A553 A556 F634	I308-L312 HydrophobicContact CB-CD1 4.45Å; I308-L312 HydrophobicContact CG2-CD1 3.28Å; I308-L312 WeakPolarHBondContact O-CD1 3.23Å; I308-L312 PolarHBondContact O-N 3.16Å; L312-A553 HydrophobicContact CD1-CB 4.25Å; L312-A556 HydrophobicContact CD1-CB 4.14Å; L312-A556 HydrophobicContact CD2-CB 4.46Å; L312-F634 HydrophobicContact CD1-CD2 4.11Å; L312-F634 HydrophobicContact CD1-CE2 3.77Å; L312-F634 HydrophobicContact CD1-CZ 4.05Å; L312-F634 HydrophobicContact CD2-CD2 4.09Å; L312-F634 HydrophobicContact CD2-CE2 3.86Å; L312-F634 HydrophobicContact CG-CE2 4.44Å
313	L	91.6	Very high	92.4	Very high	81 Å²	81	50.4 Å²	50.4	42%	0.424	26%	0.262	S	S	.	.	S	Bend	trans	-68.5	129.4	179.7	-63.5	173.8	0	0	0	110.5	F310 F311 Q315 N316	F310-L313 WeakPolarHBondContact O-CB 3.4Å; F310-L313 PolarHBondContact O-N 2.8Å; F311-L313 PolarHBondContact O-N 2.81Å; L313-Q315 PolarHBondContact O-N 2.98Å; L313-N316 PolarHBondContact O-N 3.07Å
314	P	88.1	Confident	92.2	Very high	112 Å²	112	50.4 Å²	50.4	73%	0.727	26%	0.259	S	S	*	.	G	3₁₀ helix	trans	-56.2	-30	-176.7	-27.9	34.6	0	0	0	114.6	N316 L317	P314-N316 PolarHBondContact O-N 3.19Å; P314-L317 WeakPolarHBondContact O-CB 3.37Å; P314-L317 PolarHBondContact O-N 3.11Å
315	Q	90	Very high	92	Very high	175 Å²	175	57.2 Å²	57.2	82%	0.818	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-65.6	-24.1	-179.8	-61.7	173.4	11	0	0	113.1	L313	L313-Q315 PolarHBondContact O-N 2.98Å
316	N	91.2	Very high	91.8	Very high	24 Å²	24	58.6 Å²	58.6	13%	0.128	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-98.8	3.7	-175.7	-62.4	-33.4	0	0	0	112.6	F310 F311 L313 P314 M319 A320	F310-N316 HydrophobicContact CE1-CB 4.09Å; F310-N316 WeakPolarHBondContact CE2-ND2 3.35Å; F310-N316 HydrophobicContact CZ-CB 4.34Å; F310-N316 VanDerWaalsContact CZ-CG 3.44Å; F310-N316 WeakPolarHBondContact CZ-ND2 3.41Å; F310-N316 PolarHBondContact O-ND2 2.86Å; F311-N316 HydrophobicContact CD1-CB 4.35Å; L313-N316 PolarHBondContact O-N 3.07Å; P314-N316 PolarHBondContact O-N 3.19Å; N316-M319 PolarHBondContact O-N 3.49Å; N316-A320 PolarHBondContact O-N 3.42Å
317	L	88.5	Confident	91.6	Very high	47 Å²	47	55.3 Å²	55.3	25%	0.246	27%	0.274	C	S	.	.	H	α-helix	trans	-67.7	-42.1	-173.5	-170.7	137.4	0	0	0	112.4	P314 M319 A320 Q321	P314-L317 WeakPolarHBondContact O-CB 3.37Å; P314-L317 PolarHBondContact O-N 3.11Å; L317-M319 VanDerWaalsContact C-N 3.26Å; L317-M319 PolarHBondContact O-N 2.99Å; L317-A320 WeakPolarHBondContact O-CB 3.39Å; L317-A320 PolarHBondContact O-N 3.06Å; L317-Q321 HydrophobicContact CD2-CG 4.45Å; L317-Q321 WeakPolarHBondContact O-CG 3.3Å; L317-Q321 PolarHBondContact O-N 2.79Å
318	D	90.4	Very high	91.2	Very high	119 Å²	119	56.2 Å²	56.2	64%	0.636	28%	0.283	S	S	*	.	H	α-helix	trans	-62.2	-38.6	176.2	-64.1	-30.5	0	0	0	111.2	Q321 M322	D318-Q321 PolarHBondContact O-N 2.88Å; D318-M322 PolarHBondContact O-N 2.79Å
319	M	90.6	Very high	90.8	Very high	54 Å²	54	61.1 Å²	61.1	27%	0.266	31%	0.306	S	S	.	.	H	α-helix	trans	-67.6	-42.4	175.7	-171	153	-75.5	0	0	111.6	N316 L317 Q321 M322 L323 L370	N316-M319 PolarHBondContact O-N 3.49Å; L317-M319 VanDerWaalsContact C-N 3.26Å; L317-M319 PolarHBondContact O-N 2.99Å; M319-Q321 VanDerWaalsContact C-N 3.32Å; M319-Q321 PolarHBondContact O-N 3.43Å; M319-M322 WeakPolarHBondContact O-CB 3.43Å; M319-M322 PolarHBondContact O-N 3.02Å; M319-L323 HydrophobicContact CG-CD1 4.39Å; M319-L323 VanDerWaalsContact O-CG 3.3Å; M319-L323 WeakPolarHBondContact O-CG 3.14Å; M319-L323 PolarHBondContact O-N 2.85Å; M319-L370 HydrophobicContact CG-CD2 4.37Å; M319-L370 HydrophobicContact SD-CD1 4.38Å; M319-L370 HydrophobicContact SD-CD2 3.24Å; M319-L370 WeakPolarHBondContact SD-CD2 3.33Å; M319-L370 HydrophobicContact SD-CG 3.81Å
320	A	90.1	Very high	90.4	Very high	9 Å²	9	57.9 Å²	57.9	7%	0.074	29%	0.291	C	S	.	.	H	α-helix	trans	-58.3	-42.9	174	0	0	0	0	0	112	F311 N316 L317 L323 H324 L550	F311-A320 HydrophobicContact CD1-CB 3.85Å; F311-A320 HydrophobicContact CE1-CB 4.34Å; N316-A320 PolarHBondContact O-N 3.42Å; L317-A320 WeakPolarHBondContact O-CB 3.39Å; L317-A320 PolarHBondContact O-N 3.06Å; A320-L323 PolarHBondContact O-N 2.84Å; A320-H324 PolarHBondContact O-N 3.02Å; A320-L550 HydrophobicContact CB-CD2 4Å
321	Q	90.5	Very high	90	Very high	95 Å²	95	60.9 Å²	60.9	44%	0.444	30%	0.304	S	S	.	.	H	α-helix	trans	-67.3	-35.2	176.7	-70.3	179.7	-2.7	0	0	113.1	L317 D318 M319 R325	L317-Q321 HydrophobicContact CD2-CG 4.45Å; L317-Q321 WeakPolarHBondContact O-CG 3.3Å; L317-Q321 PolarHBondContact O-N 2.79Å; D318-Q321 PolarHBondContact O-N 2.88Å; M319-Q321 VanDerWaalsContact C-N 3.32Å; M319-Q321 PolarHBondContact O-N 3.43Å; Q321-R325 WeakPolarHBondContact O-CG 3.49Å; Q321-R325 PolarHBondContact O-N 2.83Å; Q321-R325 PolarHBondContact O-NE 2.9Å
322	M	92.6	Very high	89.2	Confident	89 Å²	89	62.2 Å²	62.2	44%	0.438	31%	0.311	S	S	.	.	H	α-helix	trans	-64.4	-45.4	172.2	179.6	179.3	174.2	0	0	110.9	D318 M319 R325 L326	D318-M322 PolarHBondContact O-N 2.79Å; M319-M322 WeakPolarHBondContact O-CB 3.43Å; M319-M322 PolarHBondContact O-N 3.02Å; M322-R325 PolarHBondContact O-N 2.87Å; M322-L326 HydrophobicContact CE-CD1 4.36Å; M322-L326 HydrophobicContact CG-CD1 4.41Å; M322-L326 WeakPolarHBondContact O-CG 3.31Å; M322-L326 PolarHBondContact O-N 2.85Å; M322-L326 VanDerWaalsContact O-N 3.13Å
323	L	91.8	Very high	88.8	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.4	-43.8	177.3	-66.6	172.5	0	0	0	111.7	F311 M319 A320 R325 L326 L327 L363 A366 L370 L546 L550	F311-L323 HydrophobicContact CE1-CD1 3.79Å; F311-L323 HydrophobicContact CZ-CD1 3.54Å; M319-L323 HydrophobicContact CG-CD1 4.39Å; M319-L323 VanDerWaalsContact O-CG 3.3Å; M319-L323 WeakPolarHBondContact O-CG 3.14Å; M319-L323 PolarHBondContact O-N 2.85Å; A320-L323 PolarHBondContact O-N 2.84Å; L323-R325 VanDerWaalsContact C-N 3.33Å; L323-R325 PolarHBondContact O-N 3.05Å; L323-L326 PolarHBondContact O-N 2.9Å; L323-L327 WeakPolarHBondContact O-CB 3.37Å; L323-L327 VanDerWaalsContact O-CG 3.25Å; L323-L327 WeakPolarHBondContact O-CG 3.29Å; L323-L327 PolarHBondContact O-N 3.05Å; L323-L363 HydrophobicContact CB-CD2 4.45Å; L323-L363 HydrophobicContact CD2-CD2 3.51Å; L323-A366 HydrophobicContact CD2-CB 3.79Å; L323-L370 HydrophobicContact CD1-CD1 4.48Å; L323-L546 HydrophobicContact CD1-CD2 4.45Å; L323-L546 HydrophobicContact CD2-CD2 4.44Å; L323-L550 HydrophobicContact CB-CD1 3.8Å; L323-L550 HydrophobicContact CD1-CD1 4.3Å
324	H	90.9	Very high	88.2	Confident	27 Å²	27	56.8 Å²	56.8	13%	0.125	28%	0.283	C	S	.	.	H	α-helix	trans	-56	-44.1	174.1	-82.1	-170.7	0	0	0	112.9	H279 A320 L326 L327 G328 L550	H279-H324 AromaticContact CD2-CD2 4Å; H279-H324 AromaticContact CD2-CE1 3.96Å; H279-H324 AromaticContact CD2-CG 3.54Å; H279-H324 AromaticContact CD2-ND1 3.51Å; H279-H324 AromaticContact NE2-CG 3.77Å; H279-H324 AromaticContact NE2-ND1 3.38Å; H279-H324 PolarHBondContact NE2-ND1 3.29Å; A320-H324 PolarHBondContact O-N 3.02Å; H324-L326 PolarHBondContact O-N 3.32Å; H324-L327 PolarHBondContact O-N 3.42Å; H324-G328 PolarHBondContact O-N 3.17Å; H324-L550 WeakPolarHBondContact NE2-CB 3.49Å
325	R	90.3	Very high	87.8	Confident	161 Å²	161	53.3 Å²	53.3	61%	0.608	26%	0.258	S	S	*	.	H	α-helix	trans	-61.2	-44.3	177.3	-77.5	-179.7	-89.5	172.6	-9.3	111.6	Q321 M322 L323 G328 H329	Q321-R325 WeakPolarHBondContact O-CG 3.49Å; Q321-R325 PolarHBondContact O-N 2.83Å; Q321-R325 PolarHBondContact O-NE 2.9Å; M322-R325 PolarHBondContact O-N 2.87Å; L323-R325 VanDerWaalsContact C-N 3.33Å; L323-R325 PolarHBondContact O-N 3.05Å; R325-G328 PolarHBondContact O-N 2.82Å; R325-H329 PolarHBondContact O-CD2 3.41Å
326	L	91.2	Very high	87.6	Confident	30 Å²	30	45.3 Å²	45.3	16%	0.157	22%	0.221	C	C	.	.	H	α-helix	trans	-64.8	-40.9	176.2	-66.5	171.6	0	0	0	112.1	M322 L323 H324 G328 H329 S359 L363	M322-L326 HydrophobicContact CE-CD1 4.36Å; M322-L326 HydrophobicContact CG-CD1 4.41Å; M322-L326 WeakPolarHBondContact O-CG 3.31Å; M322-L326 PolarHBondContact O-N 2.85Å; M322-L326 VanDerWaalsContact O-N 3.13Å; L323-L326 PolarHBondContact O-N 2.9Å; H324-L326 PolarHBondContact O-N 3.32Å; L326-G328 PolarHBondContact O-N 2.89Å; L326-H329 PolarHBondContact O-N 3.49Å; L326-S359 WeakPolarHBondContact O-CB 3.28Å; L326-L363 HydrophobicContact CB-CD2 3.69Å; L326-L363 HydrophobicContact CB-CG 3.96Å; L326-L363 HydrophobicContact CD1-CD2 3.94Å; L326-L363 HydrophobicContact CD1-CG 4.3Å; L326-L363 HydrophobicContact CG-CD2 4.49Å
327	L	89.5	Confident	87.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-66.2	-34.6	178.1	-71.8	164.9	0	0	0	112.7	L323 H324 H329 I330 L363 A543 L546 D547 L550	L323-L327 WeakPolarHBondContact O-CB 3.37Å; L323-L327 VanDerWaalsContact O-CG 3.25Å; L323-L327 WeakPolarHBondContact O-CG 3.29Å; L323-L327 PolarHBondContact O-N 3.05Å; H324-L327 PolarHBondContact O-N 3.42Å; L327-H329 PolarHBondContact O-N 2.81Å; L327-I330 HydrophobicContact CD2-CD1 4.24Å; L327-I330 WeakPolarHBondContact O-CB 3.49Å; L327-I330 PolarHBondContact O-N 2.98Å; L327-L363 HydrophobicContact CD2-CD1 3.75Å; L327-L363 HydrophobicContact CD2-CD2 4.49Å; L327-L363 HydrophobicContact CG-CD1 4.32Å; L327-L363 HydrophobicContact CG-CD2 4.27Å; L327-A543 HydrophobicContact CD2-CB 3.85Å; L327-A543 WeakPolarHBondContact CD2-O 3.46Å; L327-L546 HydrophobicContact CD1-CD2 4.49Å; L327-L546 HydrophobicContact CD1-CG 4.38Å; L327-D547 HydrophobicContact CD1-CB 3.87Å; L327-D547 HydrophobicContact CD2-CB 4.29Å; L327-L550 HydrophobicContact CD1-CD1 3.68Å
328	G	87	Confident	86.7	Confident	19 Å²	19	42.6 Å²	42.6	20%	0.196	21%	0.206	C	C	.	.	H	α-helix	trans	-62.6	-22.8	176.9	0	0	0	0	0	114.3	H324 R325 L326 K331	H324-G328 PolarHBondContact O-N 3.17Å; R325-G328 PolarHBondContact O-N 2.82Å; L326-G328 PolarHBondContact O-N 2.89Å; G328-K331 PolarHBondContact O-NZ 2.83Å
329	H	87.8	Confident	86.2	Confident	102 Å²	102	40 Å²	40	47%	0.472	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-9.8	175	-64.9	-56.4	0	0	0	113.7	R325 L326 L327 K331 T356 S359	R325-H329 PolarHBondContact O-CD2 3.41Å; L326-H329 PolarHBondContact O-N 3.49Å; L327-H329 PolarHBondContact O-N 2.81Å; H329-K331 PolarHBondContact O-N 2.92Å; H329-T356 PolarHBondContact O-OG1 3.03Å; H329-S359 WeakPolarHBondContact CB-OG 3.35Å
330	I	86.7	Confident	85.9	Confident	2 Å²	2	37.5 Å²	37.5	1%	0.01	18%	0.175	C	C	.	.			trans	-81.5	114	175.1	-62.5	-173.9	0	0	0	108.7	C280 L327 T356 L363 L540 A543	C280-I330 PolarHBondContact SG-O 3.12Å; L327-I330 HydrophobicContact CD2-CD1 4.24Å; L327-I330 WeakPolarHBondContact O-CB 3.49Å; L327-I330 PolarHBondContact O-N 2.98Å; I330-T356 HydrophobicContact CB-CG2 4.29Å; I330-T356 HydrophobicContact CG1-CG2 4.27Å; I330-T356 HydrophobicContact CG2-CG2 3.94Å; I330-L363 HydrophobicContact CD1-CD1 3.5Å; I330-L540 HydrophobicContact CG2-CD2 3.51Å; I330-A543 HydrophobicContact CD1-CB 3.71Å
331	K	84.6	Confident	85.3	Confident	90 Å²	90	39.2 Å²	39.2	39%	0.391	18%	0.181	S	C	.	.			trans	-112.3	-172.5	-177	-59.5	-61.2	-173.8	-175.1	0	111.9	G328 H329 V333 V352 T356	G328-K331 PolarHBondContact O-NZ 2.83Å; H329-K331 PolarHBondContact O-N 2.92Å; K331-V333 PolarHBondContact O-N 3.42Å; K331-V352 HydrophobicContact CB-CG1 3.39Å; K331-V352 HydrophobicContact CG-CG1 3.74Å; K331-T356 PolarHBondContact N-OG1 2.82Å
332	N	78.4	Confident	84.6	Confident	31 Å²	31	35.9 Å²	35.9	17%	0.166	17%	0.166	C	C	.	.			trans	-73.2	89.9	-175	-170.4	-4.4	0	0	0	113.2	P334 L335 I336	N332-P334 WeakPolarHBondContact OD1-CD 3.45Å; N332-L335 PolarHBondContact OD1-N 3.44Å; N332-I336 WeakPolarHBondContact O-CG1 3.45Å
333	V	82.9	Confident	83.7	Confident	2 Å²	2	34.6 Å²	34.6	1%	0.012	17%	0.165	C	C	.	.	H	α-helix	trans	-71	-39.4	178.4	-172.3	0	0	0	0	113.6	K331 L335 I336 L337 L353 T356 L536 L540	K331-V333 PolarHBondContact O-N 3.42Å; V333-L335 VanDerWaalsContact C-N 3.3Å; V333-L335 PolarHBondContact O-N 3.2Å; V333-I336 CarbonylContact O-C 3.58Å; V333-I336 WeakPolarHBondContact O-CA 3.35Å; V333-I336 WeakPolarHBondContact O-CB 3.26Å; V333-I336 PolarHBondContact O-N 3.42Å; V333-L337 HydrophobicContact CG1-CD1 3.89Å; V333-L337 HydrophobicContact CG1-CD2 4.45Å; V333-L337 HydrophobicContact CG1-CG 3.87Å; V333-L337 WeakPolarHBondContact O-CG 3.29Å; V333-L337 PolarHBondContact O-N 3.25Å; V333-L353 HydrophobicContact CG1-CD1 3.93Å; V333-T356 HydrophobicContact CG2-CG2 3.68Å; V333-L536 HydrophobicContact CG1-CB 4.02Å; V333-L536 HydrophobicContact CG1-CD1 4Å; V333-L536 HydrophobicContact CG1-CG 4.5Å; V333-L540 HydrophobicContact CB-CD1 3.8Å; V333-L540 HydrophobicContact CG2-CD1 4.16Å; V333-L540 HydrophobicContact CG2-CD2 4.25Å; V333-L540 HydrophobicContact CG2-CG 4.41Å
334	P	79.6	Confident	83	Confident	5 Å²	5	39.8 Å²	39.8	3%	0.032	19%	0.19	C	C	.	.	H	α-helix	trans	-59.1	-38.1	-179.7	-33.1	39	0	0	0	113.9	D70 L226 W282 N332 I336 L337 K338 L540	D70-P334 HydrophobicContact CB-CB 4.35Å; D70-P334 HydrophobicContact CB-CG 4.5Å; L226-P334 HydrophobicContact CD1-CB 4.25Å; W282-P334 HydrophobicContact CH2-CG 3.94Å; W282-P334 HydrophobicContact CZ2-CB 4.26Å; W282-P334 HydrophobicContact CZ2-CG 3.53Å; N332-P334 WeakPolarHBondContact OD1-CD 3.45Å; P334-I336 VanDerWaalsContact C-N 3.35Å; P334-L337 PolarHBondContact O-N 3.04Å; P334-K338 WeakPolarHBondContact O-CB 3.27Å; P334-K338 PolarHBondContact O-N 3.35Å; P334-L540 HydrophobicContact CG-CD1 3.88Å
335	L	80.2	Confident	82.5	Confident	38 Å²	38	39.5 Å²	39.5	20%	0.199	19%	0.19	C	C	.	.	H	α-helix	trans	-64.9	-40.8	174.7	-171.4	71.1	0	0	0	111.6	N332 V333 K338 R339	N332-L335 PolarHBondContact OD1-N 3.44Å; V333-L335 VanDerWaalsContact C-N 3.3Å; V333-L335 PolarHBondContact O-N 3.2Å; L335-K338 WeakPolarHBondContact O-CB 3.34Å; L335-K338 PolarHBondContact O-N 2.91Å; L335-R339 WeakPolarHBondContact O-CG 3.47Å; L335-R339 PolarHBondContact O-N 3.45Å
336	I	84.4	Confident	82.2	Confident	7 Å²	7	37.4 Å²	37.4	4%	0.036	19%	0.185	C	C	.	.	H	α-helix	trans	-63.5	-44.4	175.1	-65.4	167	0	0	0	110.3	N332 V333 P334 K338 R339 M340 D349 V352	N332-I336 WeakPolarHBondContact O-CG1 3.45Å; V333-I336 CarbonylContact O-C 3.58Å; V333-I336 WeakPolarHBondContact O-CA 3.35Å; V333-I336 WeakPolarHBondContact O-CB 3.26Å; V333-I336 PolarHBondContact O-N 3.42Å; P334-I336 VanDerWaalsContact C-N 3.35Å; I336-K338 VanDerWaalsContact C-N 3.33Å; I336-K338 PolarHBondContact O-N 3.34Å; I336-R339 PolarHBondContact O-N 3.37Å; I336-M340 HydrophobicContact CG2-CE 3.76Å; I336-M340 HydrophobicContact CG2-CG 4.39Å; I336-M340 HydrophobicContact CG2-SD 4.09Å; I336-M340 WeakPolarHBondContact O-CB 3.32Å; I336-M340 VanDerWaalsContact O-CG 3.3Å; I336-M340 WeakPolarHBondContact O-CG 3.41Å; I336-M340 PolarHBondContact O-N 3.02Å; I336-D349 HydrophobicContact CG1-CB 4.14Å; I336-D349 HydrophobicContact CG2-CB 4.01Å; I336-V352 HydrophobicContact CD1-CB 4.08Å; I336-V352 HydrophobicContact CD1-CG1 3.68Å
337	L	83.2	Confident	81.9	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-36.7	177.2	-65.8	174	0	0	0	112.2	L226 V333 P334 M340 K341 V529 L530 A533 L536	L226-L337 HydrophobicContact CD1-CB 4.05Å; L226-L337 HydrophobicContact CD2-CB 4.42Å; V333-L337 HydrophobicContact CG1-CD1 3.89Å; V333-L337 HydrophobicContact CG1-CD2 4.45Å; V333-L337 HydrophobicContact CG1-CG 3.87Å; V333-L337 WeakPolarHBondContact O-CG 3.29Å; V333-L337 PolarHBondContact O-N 3.25Å; P334-L337 PolarHBondContact O-N 3.04Å; L337-M340 HydrophobicContact CD2-SD 4.23Å; L337-M340 WeakPolarHBondContact O-CB 3.33Å; L337-M340 PolarHBondContact O-N 2.9Å; L337-K341 PolarHBondContact O-N 3.3Å; L337-V529 HydrophobicContact CD2-CG1 4.44Å; L337-L530 HydrophobicContact CD2-CD2 4.15Å; L337-A533 HydrophobicContact CD1-CB 3.97Å; L337-A533 HydrophobicContact CD2-CB 4.21Å; L337-L536 HydrophobicContact CD2-CD1 4.05Å
338	K	77.8	Confident	81.7	Confident	14 Å²	14	39.4 Å²	39.4	6%	0.061	20%	0.201	C	C	.	.	H	α-helix	trans	-60.5	-50.2	171.7	179.3	-178.1	173.6	-167.2	0	110.4	E46 P224 P334 L335 I336 M340 K341 L342	E46-K338 IonicContact OE2-NZ 2.82Å; E46-K338 PolarHBondContact OE2-NZ 2.76Å; E46-K338 VanDerWaalsContact OE2-NZ 3.12Å; P224-K338 HydrophobicContact CB-CG 4.47Å; P224-K338 HydrophobicContact CG-CD 4.46Å; P224-K338 HydrophobicContact CG-CG 4.03Å; P334-K338 WeakPolarHBondContact O-CB 3.27Å; P334-K338 PolarHBondContact O-N 3.35Å; L335-K338 WeakPolarHBondContact O-CB 3.34Å; L335-K338 PolarHBondContact O-N 2.91Å; I336-K338 VanDerWaalsContact C-N 3.33Å; I336-K338 PolarHBondContact O-N 3.34Å; K338-M340 VanDerWaalsContact C-N 3.34Å; K338-M340 PolarHBondContact O-N 3.34Å; K338-K341 PolarHBondContact O-N 3.47Å; K338-L342 HydrophobicContact CG-CD1 4.4Å; K338-L342 WeakPolarHBondContact O-CG 3.44Å; K338-L342 PolarHBondContact O-N 3.21Å; K338-L342 VanDerWaalsContact O-N 3.08Å
339	R	80.9	Confident	81.7	Confident	65 Å²	65	38.9 Å²	38.9	25%	0.245	19%	0.194	C	C	.	.	H	α-helix	trans	-63.3	-36.9	176.8	-70.6	177.4	-178.4	164.9	1.1	112.8	L335 I336 L342 S343 H344 D349	L335-R339 WeakPolarHBondContact O-CG 3.47Å; L335-R339 PolarHBondContact O-N 3.45Å; I336-R339 PolarHBondContact O-N 3.37Å; R339-L342 CarbonylContact O-C 3.55Å; R339-L342 PolarHBondContact O-N 3.03Å; R339-S343 PolarHBondContact O-N 2.93Å; R339-H344 PolarHBondContact O-N 3.22Å; R339-D349 IonicContact NH1-OD1 3.03Å; R339-D349 PolarHBondContact NH1-OD1 2.87Å; R339-D349 IonicContact NH1-OD2 2.7Å
340	M	83.6	Confident	81.7	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-60	-44.2	172.1	-77.9	179.4	172.7	0	0	111.8	I336 L337 K338 L342 S343 T345 W350 L353 Q526 V529 L530	I336-M340 HydrophobicContact CG2-CE 3.76Å; I336-M340 HydrophobicContact CG2-CG 4.39Å; I336-M340 HydrophobicContact CG2-SD 4.09Å; I336-M340 WeakPolarHBondContact O-CB 3.32Å; I336-M340 VanDerWaalsContact O-CG 3.3Å; I336-M340 WeakPolarHBondContact O-CG 3.41Å; I336-M340 PolarHBondContact O-N 3.02Å; L337-M340 HydrophobicContact CD2-SD 4.23Å; L337-M340 WeakPolarHBondContact O-CB 3.33Å; L337-M340 PolarHBondContact O-N 2.9Å; K338-M340 VanDerWaalsContact C-N 3.34Å; K338-M340 PolarHBondContact O-N 3.34Å; M340-L342 VanDerWaalsContact C-N 3.31Å; M340-L342 PolarHBondContact O-N 3.27Å; M340-S343 PolarHBondContact O-N 3Å; M340-S343 VanDerWaalsContact O-N 3.15Å; M340-T345 VanDerWaalsContact CA-CG2 3.48Å; M340-T345 HydrophobicContact CB-CG2 4Å; M340-T345 HydrophobicContact CE-CG2 4.44Å; M340-T345 HydrophobicContact CG-CG2 3.3Å; M340-W350 HydrophobicContact CE-CD2 4.07Å; M340-W350 HydrophobicContact CE-CE3 3.81Å; M340-W350 HydrophobicContact CE-CH2 3.75Å; M340-W350 HydrophobicContact CE-CZ2 4.01Å; M340-W350 HydrophobicContact CE-CZ3 3.64Å; M340-L353 HydrophobicContact CE-CD2 3.48Å; M340-L353 VanDerWaalsContact CE-CD2 3.48Å; M340-L353 HydrophobicContact SD-CD2 4.23Å; M340-Q526 HydrophobicContact CG-CG 4.31Å; M340-V529 HydrophobicContact SD-CG1 4.1Å; M340-L530 HydrophobicContact CB-CD1 4.39Å; M340-L530 HydrophobicContact CB-CD2 4.17Å; M340-L530 HydrophobicContact CB-CG 4.38Å
341	K	77.3	Confident	81.8	Confident	45 Å²	45	35.8 Å²	35.8	20%	0.196	18%	0.179	C	C	.	.	H	α-helix	trans	-64.9	-36.6	177	-170.3	178.8	-172.9	168.3	0	112.3	S153 P224 L337 K338 S343	S153-K341 WeakPolarHBondContact OG-CD 3.46Å; S153-K341 VanDerWaalsContact OG-CE 3.3Å; S153-K341 WeakPolarHBondContact OG-CE 3.44Å; S153-K341 PolarHBondContact OG-NZ 2.79Å; P224-K341 HydrophobicContact CB-CD 3.91Å; L337-K341 PolarHBondContact O-N 3.3Å; K338-K341 PolarHBondContact O-N 3.47Å; K341-S343 PolarHBondContact O-N 2.95Å
342	L	75.4	Confident	82.1	Confident	25 Å²	25	33.7 Å²	33.7	13%	0.131	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81	0.8	177.2	-59.7	176.8	0	0	0	113.1	V214 V221 K338 R339 M340 H344	V214-L342 HydrophobicContact CG1-CD1 4.29Å; V214-L342 HydrophobicContact CG1-CD2 3.61Å; V221-L342 HydrophobicContact CG1-CD2 3.51Å; K338-L342 HydrophobicContact CG-CD1 4.4Å; K338-L342 WeakPolarHBondContact O-CG 3.44Å; K338-L342 PolarHBondContact O-N 3.21Å; K338-L342 VanDerWaalsContact O-N 3.08Å; R339-L342 CarbonylContact O-C 3.55Å; R339-L342 PolarHBondContact O-N 3.03Å; M340-L342 VanDerWaalsContact C-N 3.31Å; M340-L342 PolarHBondContact O-N 3.27Å; L342-H344 PolarHBondContact O-CD2 3.36Å; L342-H344 PolarHBondContact O-N 3.45Å
343	S	74.7	Confident	82.7	Confident	61 Å²	61	32.2 Å²	32.2	43%	0.427	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	22.9	-175.4	-51.7	0	0	0	0	114.4	R339 M340 K341	R339-S343 PolarHBondContact O-N 2.93Å; M340-S343 PolarHBondContact O-N 3Å; M340-S343 VanDerWaalsContact O-N 3.15Å; K341-S343 PolarHBondContact O-N 2.95Å
344	H	76.8	Confident	83.1	Confident	110 Å²	110	35.4 Å²	35.4	51%	0.509	18%	0.178	S	C	.	.			trans	-105.8	33.5	-178.2	-69.1	-178.6	0	0	0	112.3	E217 R339 L342	E217-H344 IonicContact OE1-CE1 2.86Å; E217-H344 PolarHBondContact OE1-CE1 2.82Å; E217-H344 IonicContact OE1-ND1 2.94Å; E217-H344 IonicContact OE2-CE1 3.7Å; R339-H344 PolarHBondContact O-N 3.22Å; L342-H344 PolarHBondContact O-CD2 3.36Å; L342-H344 PolarHBondContact O-N 3.45Å
345	T	80.9	Confident	83.6	Confident	20 Å²	20	40.9 Å²	40.9	12%	0.123	20%	0.202	C	C	.	.			trans	-72.7	132.6	-176.1	53.8	0	0	0	0	112.6	M340 W350 Q526	M340-T345 VanDerWaalsContact CA-CG2 3.48Å; M340-T345 HydrophobicContact CB-CG2 4Å; M340-T345 HydrophobicContact CE-CG2 4.44Å; M340-T345 HydrophobicContact CG-CG2 3.3Å; T345-W350 PolarHBondContact OG1-NE1 3.22Å; T345-Q526 VanDerWaalsContact CG2-NE2 3.29Å; T345-Q526 PolarHBondContact OG1-NE2 3.09Å
346	K	83.6	Confident	84.1	Confident	118 Å²	118	39.2 Å²	39.2	51%	0.513	19%	0.193	S	C	.	.			trans	-86.7	160.3	170.9	-60.4	-177.2	-178.5	-178.7	0	110.9	S348 D349	K346-S348 PolarHBondContact O-N 3.4Å; K346-D349 PolarHBondContact N-OD2 2.98Å; K346-D349 WeakPolarHBondContact O-CB 3.32Å; K346-D349 PolarHBondContact O-N 2.81Å; K346-D349 VanDerWaalsContact O-N 3.12Å
347	V	83.8	Confident	84.5	Confident	15 Å²	15	38.9 Å²	38.9	9%	0.091	19%	0.191	C	C	.	.	H	α-helix	trans	-58.9	-38.3	173	175.8	0	0	0	0	111.3	D349 W350 Q351 L405 R409	V347-D349 VanDerWaalsContact C-N 3.3Å; V347-D349 PolarHBondContact O-N 3.29Å; V347-W350 PolarHBondContact O-N 3.41Å; V347-Q351 PolarHBondContact O-N 3.39Å; V347-L405 HydrophobicContact CG1-CD2 4.36Å; V347-R409 WeakPolarHBondContact CG2-O 3.46Å
348	S	85.3	Confident	84.8	Confident	57 Å²	57	46 Å²	46	40%	0.399	22%	0.219	S	C	.	.	H	α-helix	trans	-61.8	-35.8	176.2	53.7	0	0	0	0	112.6	K346 W350 Q351 V352	K346-S348 PolarHBondContact O-N 3.4Å; S348-W350 VanDerWaalsContact C-N 3.31Å; S348-W350 PolarHBondContact O-N 2.98Å; S348-Q351 PolarHBondContact O-N 3.14Å; S348-V352 WeakPolarHBondContact O-CB 3.3Å; S348-V352 VanDerWaalsContact O-CG2 3.24Å; S348-V352 WeakPolarHBondContact O-CG2 3.38Å; S348-V352 PolarHBondContact O-N 2.9Å
349	D	88.2	Confident	85.5	Confident	8 Å²	8	45.7 Å²	45.7	4%	0.043	22%	0.219	C	C	.	.	H	α-helix	trans	-62.2	-39.9	178.7	-64.1	-35.4	0	0	0	111	I336 R339 K346 V347 V352 L353	I336-D349 HydrophobicContact CG1-CB 4.14Å; I336-D349 HydrophobicContact CG2-CB 4.01Å; R339-D349 IonicContact NH1-OD1 3.03Å; R339-D349 PolarHBondContact NH1-OD1 2.87Å; R339-D349 IonicContact NH1-OD2 2.7Å; K346-D349 PolarHBondContact N-OD2 2.98Å; K346-D349 WeakPolarHBondContact O-CB 3.32Å; K346-D349 PolarHBondContact O-N 2.81Å; K346-D349 VanDerWaalsContact O-N 3.12Å; V347-D349 VanDerWaalsContact C-N 3.3Å; V347-D349 PolarHBondContact O-N 3.29Å; D349-V352 PolarHBondContact O-N 3.11Å; D349-L353 VanDerWaalsContact O-CB 3.28Å; D349-L353 WeakPolarHBondContact O-CB 3.49Å; D349-L353 PolarHBondContact O-N 3.29Å
350	W	88.5	Confident	86	Confident	2 Å²	2	42.6 Å²	42.6	1%	0.008	21%	0.207	C	C	.	.	H	α-helix	trans	-66.6	-41.9	176.6	-70.6	105	0	0	0	112.7	M340 T345 V347 S348 L353 Y354 I395 F401 F410 M522 L525 Q526 V529	M340-W350 HydrophobicContact CE-CD2 4.07Å; M340-W350 HydrophobicContact CE-CE3 3.81Å; M340-W350 HydrophobicContact CE-CH2 3.75Å; M340-W350 HydrophobicContact CE-CZ2 4.01Å; M340-W350 HydrophobicContact CE-CZ3 3.64Å; T345-W350 PolarHBondContact OG1-NE1 3.22Å; V347-W350 PolarHBondContact O-N 3.41Å; S348-W350 VanDerWaalsContact C-N 3.31Å; S348-W350 PolarHBondContact O-N 2.98Å; W350-L353 PolarHBondContact O-N 3.36Å; W350-Y354 WeakPolarHBondContact O-CB 3.06Å; W350-Y354 PolarHBondContact O-N 3Å; W350-I395 HydrophobicContact CE3-CD1 4.41Å; W350-I395 HydrophobicContact CE3-CG1 4.35Å; W350-I395 HydrophobicContact CE3-CG2 4.41Å; W350-I395 HydrophobicContact CZ3-CD1 4.43Å; W350-I395 HydrophobicContact CZ3-CG1 4.24Å; W350-F401 HydrophobicContact CB-CE1 4.31Å; W350-F410 AromaticContact CD1-CD2 3.89Å; W350-F410 HydrophobicContact CD2-CE2 4.25Å; W350-F410 AromaticContact CE2-CE2 3.95Å; W350-F410 HydrophobicContact CG-CD2 4.46Å; W350-F410 HydrophobicContact CG-CE2 4.4Å; W350-F410 HydrophobicContact CZ2-CE2 4.36Å; W350-F410 AromaticContact NE1-CD2 3.7Å; W350-F410 AromaticContact NE1-CE2 3.92Å; W350-M522 HydrophobicContact CZ2-CG 3.89Å; W350-L525 HydrophobicContact CE3-CD2 4.18Å; W350-L525 HydrophobicContact CH2-CB 4.18Å; W350-L525 HydrophobicContact CH2-CD2 3.66Å; W350-L525 HydrophobicContact CH2-CG 3.69Å; W350-L525 HydrophobicContact CZ2-CD2 4.38Å; W350-L525 HydrophobicContact CZ3-CD2 3.54Å; W350-L525 HydrophobicContact CZ3-CG 3.78Å; W350-Q526 HydrophobicContact CH2-CG 3.76Å; W350-Q526 HydrophobicContact CZ2-CG 3.55Å; W350-V529 HydrophobicContact CZ3-CG2 4.36Å
351	Q	88.3	Confident	86.3	Confident	36 Å²	36	43.2 Å²	43.2	17%	0.168	21%	0.21	C	C	.	.	H	α-helix	trans	-63.8	-44.7	175.9	-72.4	-179.1	-9.2	0	0	111.7	V347 S348 Y354 K355 F401	V347-Q351 PolarHBondContact O-N 3.39Å; S348-Q351 PolarHBondContact O-N 3.14Å; Q351-Y354 PolarHBondContact O-N 2.64Å; Q351-K355 WeakPolarHBondContact O-CB 3.22Å; Q351-K355 WeakPolarHBondContact O-CG 3.5Å; Q351-K355 PolarHBondContact O-N 3.39Å; Q351-F401 HydrophobicContact CB-CD1 4.37Å; Q351-F401 HydrophobicContact CB-CE1 4.41Å; Q351-F401 HydrophobicContact CG-CB 4.43Å; Q351-F401 HydrophobicContact CG-CD1 3.33Å; Q351-F401 HydrophobicContact CG-CE1 3.8Å; Q351-F401 HydrophobicContact CG-CG 4.14Å; Q351-F401 PolarHBondContact NE2-O 2.99Å
352	V	89.9	Confident	87	Confident	46 Å²	46	42.1 Å²	42.1	28%	0.279	21%	0.212	S	C	.	.	H	α-helix	trans	-64.6	-43.7	178.5	171.3	0	0	0	0	110.8	K331 I336 S348 D349 K355 T356	K331-V352 HydrophobicContact CB-CG1 3.39Å; K331-V352 HydrophobicContact CG-CG1 3.74Å; I336-V352 HydrophobicContact CD1-CB 4.08Å; I336-V352 HydrophobicContact CD1-CG1 3.68Å; S348-V352 WeakPolarHBondContact O-CB 3.3Å; S348-V352 VanDerWaalsContact O-CG2 3.24Å; S348-V352 WeakPolarHBondContact O-CG2 3.38Å; S348-V352 PolarHBondContact O-N 2.9Å; D349-V352 PolarHBondContact O-N 3.11Å; V352-K355 PolarHBondContact O-N 3.21Å; V352-T356 VanDerWaalsContact O-CB 3.3Å; V352-T356 WeakPolarHBondContact O-CB 3.3Å; V352-T356 PolarHBondContact O-N 3.37Å; V352-T356 PolarHBondContact O-OG1 3.43Å
353	L	91	Very high	87.7	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.2	-47.2	175.9	-179.8	63	0	0	0	111.1	V333 M340 D349 W350 T356 V357 I395 V529 L536	V333-L353 HydrophobicContact CG1-CD1 3.93Å; M340-L353 HydrophobicContact CE-CD2 3.48Å; M340-L353 VanDerWaalsContact CE-CD2 3.48Å; M340-L353 HydrophobicContact SD-CD2 4.23Å; D349-L353 VanDerWaalsContact O-CB 3.28Å; D349-L353 WeakPolarHBondContact O-CB 3.49Å; D349-L353 PolarHBondContact O-N 3.29Å; W350-L353 PolarHBondContact O-N 3.36Å; L353-T356 PolarHBondContact O-N 2.98Å; L353-V357 HydrophobicContact CD1-CG2 4.11Å; L353-V357 HydrophobicContact CG-CG2 4.42Å; L353-V357 WeakPolarHBondContact O-CB 3.35Å; L353-V357 VanDerWaalsContact O-CG2 3.27Å; L353-V357 WeakPolarHBondContact O-CG2 3.46Å; L353-V357 PolarHBondContact O-N 3.34Å; L353-I395 HydrophobicContact CD2-CD1 3.68Å; L353-I395 HydrophobicContact CG-CD1 3.97Å; L353-V529 HydrophobicContact CD2-CG1 3.99Å; L353-L536 HydrophobicContact CD1-CD1 4.05Å; L353-L536 HydrophobicContact CD1-CD2 4.43Å
354	Y	91.3	Very high	88.5	Confident	70 Å²	70	39 Å²	39	28%	0.275	19%	0.189	S	C	.	.	H	α-helix	trans	-60.2	-48.8	178.3	-179	-102.7	0	0	0	112.2	W350 Q351 T356 V357 Y358 A392 I395 F401	W350-Y354 WeakPolarHBondContact O-CB 3.06Å; W350-Y354 PolarHBondContact O-N 3Å; Q351-Y354 PolarHBondContact O-N 2.64Å; Y354-T356 VanDerWaalsContact C-N 3.3Å; Y354-T356 PolarHBondContact O-N 3.15Å; Y354-V357 PolarHBondContact O-N 3.09Å; Y354-Y358 WeakPolarHBondContact O-CB 3.42Å; Y354-Y358 PolarHBondContact O-N 3.21Å; Y354-A392 WeakPolarHBondContact CE2-O 3.3Å; Y354-I395 HydrophobicContact CD2-CB 4.12Å; Y354-I395 HydrophobicContact CD2-CG2 3.92Å; Y354-I395 HydrophobicContact CG-CG2 4.34Å; Y354-F401 AromaticContact CD1-CE2 3.91Å; Y354-F401 HydrophobicContact CD1-CE2 3.91Å; Y354-F401 AromaticContact CD1-CZ 4Å; Y354-F401 HydrophobicContact CD1-CZ 4Å; Y354-F401 HydrophobicContact CD2-CE2 4.39Å; Y354-F401 HydrophobicContact CD2-CZ 4.21Å; Y354-F401 HydrophobicContact CE1-CE2 4.29Å; Y354-F401 AromaticContact CG-CE2 3.97Å; Y354-F401 HydrophobicContact CG-CE2 3.97Å; Y354-F401 AromaticContact CG-CZ 3.68Å; Y354-F401 HydrophobicContact CG-CZ 3.68Å
355	K	90.5	Very high	89.2	Confident	120 Å²	120	37.9 Å²	37.9	52%	0.522	19%	0.186	S	C	.	.	H	α-helix	trans	-59.6	-40.5	176.3	-73.8	179.2	-177.6	178.5	0	111.9	Q351 V352 S359	Q351-K355 WeakPolarHBondContact O-CB 3.22Å; Q351-K355 WeakPolarHBondContact O-CG 3.5Å; Q351-K355 PolarHBondContact O-N 3.39Å; V352-K355 PolarHBondContact O-N 3.21Å; K355-S359 VanDerWaalsContact O-CB 3.29Å; K355-S359 WeakPolarHBondContact O-CB 3.44Å; K355-S359 PolarHBondContact O-N 3.2Å; K355-S359 PolarHBondContact O-OG 3.35Å
356	T	91.4	Very high	89.7	Confident	2 Å²	2	37.3 Å²	37.3	1%	0.012	18%	0.184	C	C	.	.	H	α-helix	trans	-63.7	-48.4	177.6	-62.9	0	0	0	0	111.2	H329 I330 K331 V333 V352 L353 Y354 S359 A360	H329-T356 PolarHBondContact O-OG1 3.03Å; I330-T356 HydrophobicContact CB-CG2 4.29Å; I330-T356 HydrophobicContact CG1-CG2 4.27Å; I330-T356 HydrophobicContact CG2-CG2 3.94Å; K331-T356 PolarHBondContact N-OG1 2.82Å; V333-T356 HydrophobicContact CG2-CG2 3.68Å; V352-T356 VanDerWaalsContact O-CB 3.3Å; V352-T356 WeakPolarHBondContact O-CB 3.3Å; V352-T356 PolarHBondContact O-N 3.37Å; V352-T356 PolarHBondContact O-OG1 3.43Å; L353-T356 PolarHBondContact O-N 2.98Å; Y354-T356 VanDerWaalsContact C-N 3.3Å; Y354-T356 PolarHBondContact O-N 3.15Å; T356-S359 PolarHBondContact O-N 3.33Å; T356-A360 WeakPolarHBondContact O-CB 3.46Å; T356-A360 PolarHBondContact O-N 3.02Å
357	V	91.4	Very high	90	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.006	16%	0.159	C	C	.	.	H	α-helix	trans	-63.3	-44.4	179.1	169.8	0	0	0	0	111.1	L353 Y354 A360 L361 L388 I391 A392 L536	L353-V357 HydrophobicContact CD1-CG2 4.11Å; L353-V357 HydrophobicContact CG-CG2 4.42Å; L353-V357 WeakPolarHBondContact O-CB 3.35Å; L353-V357 VanDerWaalsContact O-CG2 3.27Å; L353-V357 WeakPolarHBondContact O-CG2 3.46Å; L353-V357 PolarHBondContact O-N 3.34Å; Y354-V357 PolarHBondContact O-N 3.09Å; V357-A360 PolarHBondContact O-N 2.97Å; V357-L361 WeakPolarHBondContact O-CG 3.44Å; V357-L361 PolarHBondContact O-N 2.91Å; V357-L388 HydrophobicContact CB-CD1 4.26Å; V357-L388 HydrophobicContact CG1-CD1 3.73Å; V357-L388 HydrophobicContact CG1-CG 3.94Å; V357-L388 WeakPolarHBondContact CG1-O 3.35Å; V357-L388 HydrophobicContact CG2-CD1 4.03Å; V357-I391 HydrophobicContact CG1-CG2 4.46Å; V357-I391 HydrophobicContact CG2-CG2 4.08Å; V357-A392 HydrophobicContact CG1-CB 3.55Å; V357-L536 HydrophobicContact CG2-CD2 3.69Å
358	Y	90.9	Very high	90.2	Very high	151 Å²	151	37.3 Å²	37.3	59%	0.592	18%	0.179	S	C	*	.	H	α-helix	trans	-63.6	-42.6	177.7	-170.2	-95.4	0	0	0	112	Y354 A360 L361 G362	Y354-Y358 WeakPolarHBondContact O-CB 3.42Å; Y354-Y358 PolarHBondContact O-N 3.21Å; Y358-A360 VanDerWaalsContact C-N 3.33Å; Y358-A360 PolarHBondContact O-N 3.42Å; Y358-L361 WeakPolarHBondContact O-CB 3.33Å; Y358-L361 PolarHBondContact O-N 3.43Å; Y358-G362 PolarHBondContact O-N 3.4Å
359	S	91.6	Very high	90.4	Very high	7 Å²	7	38.6 Å²	38.6	5%	0.049	19%	0.188	C	C	.	.	H	α-helix	trans	-66.1	-37.2	177.1	-56	0	0	0	0	111.8	L326 H329 K355 T356 G362 L363	L326-S359 WeakPolarHBondContact O-CB 3.28Å; H329-S359 WeakPolarHBondContact CB-OG 3.35Å; K355-S359 VanDerWaalsContact O-CB 3.29Å; K355-S359 WeakPolarHBondContact O-CB 3.44Å; K355-S359 PolarHBondContact O-N 3.2Å; K355-S359 PolarHBondContact O-OG 3.35Å; T356-S359 PolarHBondContact O-N 3.33Å; S359-G362 PolarHBondContact O-N 2.91Å; S359-L363 WeakPolarHBondContact O-CG 3.47Å; S359-L363 PolarHBondContact O-N 3.18Å
360	A	91.5	Very high	90.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.6	-39.8	173.1	0	0	0	0	0	112.2	T356 V357 Y358 G362 L363 R364 F384 L388 V539	T356-A360 WeakPolarHBondContact O-CB 3.46Å; T356-A360 PolarHBondContact O-N 3.02Å; V357-A360 PolarHBondContact O-N 2.97Å; Y358-A360 VanDerWaalsContact C-N 3.33Å; Y358-A360 PolarHBondContact O-N 3.42Å; A360-G362 VanDerWaalsContact C-N 3.32Å; A360-G362 PolarHBondContact O-N 3.31Å; A360-L363 WeakPolarHBondContact O-CB 3.47Å; A360-L363 PolarHBondContact O-N 2.86Å; A360-R364 PolarHBondContact O-N 3.43Å; A360-F384 HydrophobicContact CB-CD2 4.2Å; A360-F384 HydrophobicContact CB-CE2 3.89Å; A360-F384 WeakPolarHBondContact O-CD2 3.24Å; A360-F384 WeakPolarHBondContact O-CE2 3.29Å; A360-L388 HydrophobicContact CB-CD2 3.76Å; A360-V539 HydrophobicContact CB-CG1 3.53Å; A360-V539 HydrophobicContact CB-CG2 4.41Å
361	L	90.9	Very high	90.6	Very high	14 Å²	14	41.1 Å²	41.1	7%	0.073	20%	0.204	C	C	.	.	H	α-helix	trans	-60.6	-42	171.2	-68.2	170.4	0	0	0	111.7	V357 Y358 L363 R364 D365 L388 H389 A392	V357-L361 WeakPolarHBondContact O-CG 3.44Å; V357-L361 PolarHBondContact O-N 2.91Å; Y358-L361 WeakPolarHBondContact O-CB 3.33Å; Y358-L361 PolarHBondContact O-N 3.43Å; L361-L363 VanDerWaalsContact C-N 3.34Å; L361-L363 PolarHBondContact O-N 3.32Å; L361-R364 WeakPolarHBondContact O-CB 3.36Å; L361-R364 PolarHBondContact O-N 3.21Å; L361-D365 PolarHBondContact O-N 3.37Å; L361-D365 VanDerWaalsContact O-N 3.09Å; L361-L388 HydrophobicContact CD2-CB 4.26Å; L361-L388 HydrophobicContact CD2-CD2 3.91Å; L361-L388 HydrophobicContact CD2-CG 4.08Å; L361-L388 HydrophobicContact CG-CD2 4.1Å; L361-L388 HydrophobicContact CG-CG 4.26Å; L361-H389 HydrophobicContact CD2-CB 4.25Å; L361-A392 HydrophobicContact CD1-CB 3.83Å
362	G	90.7	Very high	90.6	Very high	22 Å²	22	42.7 Å²	42.7	23%	0.227	21%	0.212	C	C	.	.	H	α-helix	trans	-60.2	-40.5	172.8	0	0	0	0	0	113.1	Y358 S359 A360 D365 A366	Y358-G362 PolarHBondContact O-N 3.4Å; S359-G362 PolarHBondContact O-N 2.91Å; A360-G362 VanDerWaalsContact C-N 3.32Å; A360-G362 PolarHBondContact O-N 3.31Å; G362-D365 PolarHBondContact O-N 3.24Å; G362-A366 WeakPolarHBondContact O-CB 2.96Å; G362-A366 PolarHBondContact O-N 3.18Å
363	L	91.4	Very high	90.5	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-63.2	-41.6	175	-73	176.7	0	0	0	111.9	L323 L326 L327 I330 S359 A360 L361 D365 A366 C367 F384 A543 L546	L323-L363 HydrophobicContact CB-CD2 4.45Å; L323-L363 HydrophobicContact CD2-CD2 3.51Å; L326-L363 HydrophobicContact CB-CD2 3.69Å; L326-L363 HydrophobicContact CB-CG 3.96Å; L326-L363 HydrophobicContact CD1-CD2 3.94Å; L326-L363 HydrophobicContact CD1-CG 4.3Å; L326-L363 HydrophobicContact CG-CD2 4.49Å; L327-L363 HydrophobicContact CD2-CD1 3.75Å; L327-L363 HydrophobicContact CD2-CD2 4.49Å; L327-L363 HydrophobicContact CG-CD1 4.32Å; L327-L363 HydrophobicContact CG-CD2 4.27Å; I330-L363 HydrophobicContact CD1-CD1 3.5Å; S359-L363 WeakPolarHBondContact O-CG 3.47Å; S359-L363 PolarHBondContact O-N 3.18Å; A360-L363 WeakPolarHBondContact O-CB 3.47Å; A360-L363 PolarHBondContact O-N 2.86Å; L361-L363 VanDerWaalsContact C-N 3.34Å; L361-L363 PolarHBondContact O-N 3.32Å; L363-D365 VanDerWaalsContact C-N 3.35Å; L363-D365 PolarHBondContact O-N 3.26Å; L363-A366 PolarHBondContact O-N 3.43Å; L363-C367 WeakPolarHBondContact O-CB 3.31Å; L363-C367 PolarHBondContact O-N 3.38Å; L363-C367 PolarHBondContact O-SG 2.95Å; L363-F384 HydrophobicContact CB-CE2 4.21Å; L363-A543 HydrophobicContact CD1-CB 4.39Å; L363-L546 HydrophobicContact CD2-CD2 4.38Å
364	R	91.2	Very high	90.5	Very high	20 Å²	20	46 Å²	46	8%	0.075	24%	0.235	C	C	.	.	H	α-helix	trans	-58	-49.2	175.7	-179.4	-175.3	72.7	-177.5	0.6	111.1	A360 L361 C367 R368 F384	A360-R364 PolarHBondContact O-N 3.43Å; L361-R364 WeakPolarHBondContact O-CB 3.36Å; L361-R364 PolarHBondContact O-N 3.21Å; R364-C367 PolarHBondContact O-N 3.5Å; R364-R368 WeakPolarHBondContact O-CG 3.38Å; R364-R368 PolarHBondContact O-N 2.85Å; R364-F384 HydrophobicContact CB-CB 3.9Å; R364-F384 HydrophobicContact CB-CD2 3.93Å; R364-F384 HydrophobicContact CB-CG 4.33Å; R364-F384 WeakPolarHBondContact CD-O 3.14Å; R364-F384 HydrophobicContact CG-CB 3.92Å; R364-F384 PolarHBondContact NH1-O 3.47Å
365	D	90.4	Very high	90.5	Very high	85 Å²	85	48.4 Å²	48.4	46%	0.455	25%	0.249	S	C	.	.	H	α-helix	trans	-68.6	-37.8	-176.1	-64.7	-18.7	0	0	0	111.2	L361 G362 L363 R368	L361-D365 PolarHBondContact O-N 3.37Å; L361-D365 VanDerWaalsContact O-N 3.09Å; G362-D365 PolarHBondContact O-N 3.24Å; L363-D365 VanDerWaalsContact C-N 3.35Å; L363-D365 PolarHBondContact O-N 3.26Å; D365-R368 PolarHBondContact O-N 2.72Å; D365-R368 IonicContact OD1-NH1 2.79Å
366	A	91.1	Very high	90.5	Very high	8 Å²	8	43.2 Å²	43.2	7%	0.066	23%	0.227	C	C	.	.	H	α-helix	trans	-61.8	-46.7	170.7	0	0	0	0	0	111.9	L323 G362 L363 R368 S369	L323-A366 HydrophobicContact CD2-CB 3.79Å; G362-A366 WeakPolarHBondContact O-CB 2.96Å; G362-A366 PolarHBondContact O-N 3.18Å; L363-A366 PolarHBondContact O-N 3.43Å; A366-R368 VanDerWaalsContact C-N 3.29Å; A366-R368 PolarHBondContact O-N 3.09Å; A366-S369 PolarHBondContact O-N 3.27Å; A366-S369 VanDerWaalsContact O-N 3.11Å; A366-S369 PolarHBondContact O-OG 2.97Å
367	C	89.8	Confident	90.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-67.9	-24.6	-179.6	-67.7	0	0	0	0	113.7	L363 R364 S369 L370 Q372 I380	L363-C367 WeakPolarHBondContact O-CB 3.31Å; L363-C367 PolarHBondContact O-N 3.38Å; L363-C367 PolarHBondContact O-SG 2.95Å; R364-C367 PolarHBondContact O-N 3.5Å; C367-S369 VanDerWaalsContact C-N 3.29Å; C367-S369 PolarHBondContact O-N 3.44Å; C367-L370 WeakPolarHBondContact O-CB 3.3Å; C367-L370 PolarHBondContact O-N 3.16Å; C367-Q372 PolarHBondContact O-NE2 2.91Å; C367-I380 HydrophobicContact CB-CB 4.19Å; C367-I380 HydrophobicContact CB-CG2 3.85Å
368	R	89.3	Confident	90.5	Very high	134 Å²	134	48 Å²	48	51%	0.506	25%	0.245	S	C	.	.	H	α-helix	trans	-66	-31.7	171.4	-78.9	175	175.6	-179.5	-3	112.9	R364 D365 A366 L370 A381	R364-R368 WeakPolarHBondContact O-CG 3.38Å; R364-R368 PolarHBondContact O-N 2.85Å; D365-R368 PolarHBondContact O-N 2.72Å; D365-R368 IonicContact OD1-NH1 2.79Å; A366-R368 VanDerWaalsContact C-N 3.29Å; A366-R368 PolarHBondContact O-N 3.09Å; R368-L370 VanDerWaalsContact C-N 3.27Å; R368-A381 HydrophobicContact CG-CB 3.81Å
369	S	88.9	Confident	90.4	Very high	83 Å²	83	43.4 Å²	43.4	58%	0.58	23%	0.23	S	C	*	.	H	α-helix	trans	-77.3	-14.4	176.5	74.6	0	0	0	0	113.4	A366 C367	A366-S369 PolarHBondContact O-N 3.27Å; A366-S369 VanDerWaalsContact O-N 3.11Å; A366-S369 PolarHBondContact O-OG 2.97Å; C367-S369 VanDerWaalsContact C-N 3.29Å; C367-S369 PolarHBondContact O-N 3.44Å
370	L	90.2	Very high	90.3	Very high	9 Å²	9	43.1 Å²	43.1	5%	0.047	23%	0.228	C	C	.	.	S	Bend	trans	-83.4	159.7	-179.5	-71.2	178.6	0	0	0	112.9	F310 F311 M319 L323 C367 R368 Q372 F377	F310-L370 HydrophobicContact CE1-CD2 3.46Å; F310-L370 VanDerWaalsContact CE1-CD2 3.46Å; F310-L370 HydrophobicContact CZ-CD2 3.47Å; F310-L370 VanDerWaalsContact CZ-CD2 3.47Å; F311-L370 HydrophobicContact CZ-CD1 4.27Å; M319-L370 HydrophobicContact CG-CD2 4.37Å; M319-L370 HydrophobicContact SD-CD1 4.38Å; M319-L370 HydrophobicContact SD-CD2 3.24Å; M319-L370 WeakPolarHBondContact SD-CD2 3.33Å; M319-L370 HydrophobicContact SD-CG 3.81Å; L323-L370 HydrophobicContact CD1-CD1 4.48Å; C367-L370 WeakPolarHBondContact O-CB 3.3Å; C367-L370 PolarHBondContact O-N 3.16Å; R368-L370 VanDerWaalsContact C-N 3.27Å; L370-Q372 PolarHBondContact O-N 3.49Å; L370-Q372 VanDerWaalsContact O-N 3.16Å; L370-Q372 PolarHBondContact O-NE2 3.28Å; L370-F377 HydrophobicContact CB-CB 4.33Å; L370-F377 HydrophobicContact CB-CD2 3.7Å; L370-F377 HydrophobicContact CB-CE2 4.22Å; L370-F377 HydrophobicContact CB-CG 4.1Å; L370-F377 HydrophobicContact CD1-CD1 4Å; L370-F377 HydrophobicContact CD1-CD2 3.95Å; L370-F377 HydrophobicContact CD1-CE1 4.02Å; L370-F377 HydrophobicContact CD1-CE2 3.94Å; L370-F377 HydrophobicContact CD1-CG 3.99Å; L370-F377 HydrophobicContact CD1-CZ 4Å; L370-F377 HydrophobicContact CG-CD2 4.41Å
371	P	90.5	Very high	90.2	Very high	54 Å²	54	43.6 Å²	43.6	35%	0.351	23%	0.232	S	C	.	.			trans	-60.5	118	178.4	-22.6	33.7	0	0	0	112.5	F310 S373 I374	F310-P371 HydrophobicContact CD2-CG 4.29Å; F310-P371 HydrophobicContact CE2-CG 3.57Å; F310-P371 HydrophobicContact CZ-CG 4.12Å; P371-S373 PolarHBondContact O-N 3.31Å; P371-S373 VanDerWaalsContact O-N 3.09Å; P371-I374 PolarHBondContact O-N 2.91Å
372	Q	89.2	Confident	90	Very high	69 Å²	69	49.2 Å²	49.2	32%	0.322	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	1.6	180	-58.6	-59.7	-54.6	0	0	113.7	C367 L370 I374 R378	C367-Q372 PolarHBondContact O-NE2 2.91Å; L370-Q372 PolarHBondContact O-N 3.49Å; L370-Q372 VanDerWaalsContact O-N 3.16Å; L370-Q372 PolarHBondContact O-NE2 3.28Å; Q372-I374 VanDerWaalsContact C-N 3.26Å; Q372-R378 PolarHBondContact O-NE 3.3Å; Q372-R378 VanDerWaalsContact O-NE 3.13Å; Q372-R378 PolarHBondContact O-NH2 3.43Å; Q372-R378 VanDerWaalsContact OE1-CA 3.25Å
373	S	88	Confident	89.6	Confident	97 Å²	97	52.2 Å²	52.2	68%	0.678	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-29.9	169.8	53.8	0	0	0	0	112	P371	P371-S373 PolarHBondContact O-N 3.31Å; P371-S373 VanDerWaalsContact O-N 3.09Å
374	I	90.9	Very high	89.2	Confident	18 Å²	18	52.2 Å²	52.2	9%	0.092	27%	0.266	C	S	.	.	S	Bend	trans	-83.7	121.2	177	-68.2	167.7	0	0	0	108.6	V307 F310 P371 Q372 L376 F377 R378	V307-I374 HydrophobicContact CG2-CG2 3.6Å; F310-I374 HydrophobicContact CB-CD1 3.76Å; F310-I374 HydrophobicContact CD2-CD1 4.19Å; F310-I374 HydrophobicContact CG-CD1 3.95Å; P371-I374 PolarHBondContact O-N 2.91Å; Q372-I374 VanDerWaalsContact C-N 3.26Å; I374-L376 HydrophobicContact CG2-CB 4.39Å; I374-L376 PolarHBondContact O-N 3.5Å; I374-F377 HydrophobicContact CB-CD2 3.64Å; I374-F377 HydrophobicContact CB-CE2 3.96Å; I374-F377 HydrophobicContact CB-CG 4.22Å; I374-F377 HydrophobicContact CD1-CD2 3.93Å; I374-F377 HydrophobicContact CD1-CE2 3.4Å; I374-F377 HydrophobicContact CD1-CZ 4.18Å; I374-F377 HydrophobicContact CG1-CD2 4.35Å; I374-F377 HydrophobicContact CG1-CE2 4.25Å; I374-F377 HydrophobicContact CG2-CD1 4.33Å; I374-F377 HydrophobicContact CG2-CD2 3.73Å; I374-F377 HydrophobicContact CG2-CE1 4.42Å; I374-F377 HydrophobicContact CG2-CE2 3.87Å; I374-F377 HydrophobicContact CG2-CG 3.97Å; I374-F377 HydrophobicContact CG2-CZ 4.2Å; I374-F377 PolarHBondContact O-N 3.31Å; I374-R378 PolarHBondContact O-N 2.86Å
375	Q	90	Very high	88.5	Confident	122 Å²	122	53 Å²	53	57%	0.57	27%	0.274	S	S	*	.	H	α-helix	trans	-58.4	-44.7	-174.5	-68.1	-177.3	-9.6	0	0	112.2	F377 R378 D379	Q375-F377 VanDerWaalsContact C-N 3.33Å; Q375-F377 PolarHBondContact O-N 2.93Å; Q375-R378 WeakPolarHBondContact O-CB 3.24Å; Q375-R378 PolarHBondContact O-N 2.58Å; Q375-R378 VanDerWaalsContact O-N 3.11Å; Q375-D379 VanDerWaalsContact O-CG 3.22Å; Q375-D379 PolarHBondContact O-N 3.41Å
376	L	91.1	Very high	87.9	Confident	11 Å²	11	55.1 Å²	55.1	6%	0.058	29%	0.286	C	S	.	.	H	α-helix	trans	-58.3	-41.3	-178.6	-177.4	63.9	0	0	0	113.2	V307 I374 R378 D379 I380 L542 R545 L546 L549	V307-L376 HydrophobicContact CG1-CD2 4.46Å; V307-L376 HydrophobicContact CG2-CB 4.22Å; V307-L376 HydrophobicContact CG2-CD2 4.1Å; I374-L376 HydrophobicContact CG2-CB 4.39Å; I374-L376 PolarHBondContact O-N 3.5Å; L376-R378 VanDerWaalsContact C-N 3.33Å; L376-D379 PolarHBondContact O-N 3.14Å; L376-I380 HydrophobicContact CD1-CD1 4.19Å; L376-I380 HydrophobicContact CD1-CG1 4.5Å; L376-I380 HydrophobicContact CG-CD1 4.04Å; L376-I380 VanDerWaalsContact O-CG1 3.3Å; L376-I380 WeakPolarHBondContact O-CG1 3.49Å; L376-I380 PolarHBondContact O-N 3.35Å; L376-L542 HydrophobicContact CD1-CD2 4.08Å; L376-R545 HydrophobicContact CD1-CB 4.16Å; L376-L546 HydrophobicContact CD2-CB 4.31Å; L376-L546 HydrophobicContact CD2-CD1 4.25Å; L376-L549 HydrophobicContact CD2-CD1 3.64Å
377	F	92.1	Very high	87.5	Confident	0 Å²	0	57.6 Å²	57.6	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-69	-36.5	179.5	-57.4	-24.5	0	0	0	111.7	V307 F310 F311 L370 I374 Q375 A381 L546	V307-F377 HydrophobicContact CG1-CE1 4.17Å; V307-F377 HydrophobicContact CG1-CZ 4.16Å; F310-F377 AromaticContact CD1-CE2 3.81Å; F310-F377 HydrophobicContact CD1-CE2 3.81Å; F310-F377 AromaticContact CD1-CZ 3.91Å; F310-F377 HydrophobicContact CD1-CZ 3.91Å; F310-F377 HydrophobicContact CE1-CE2 4.09Å; F310-F377 HydrophobicContact CE1-CZ 4.36Å; F310-F377 HydrophobicContact CG-CE2 4.22Å; F311-F377 HydrophobicContact CD2-CZ 4.37Å; F311-F377 AromaticContact CE2-CE1 3.72Å; F311-F377 HydrophobicContact CE2-CE1 3.72Å; F311-F377 AromaticContact CE2-CZ 3.43Å; F311-F377 HydrophobicContact CE2-CZ 3.43Å; F311-F377 VanDerWaalsContact CE2-CZ 3.43Å; F311-F377 AromaticContact CZ-CE1 3.91Å; F311-F377 HydrophobicContact CZ-CE1 3.91Å; F311-F377 AromaticContact CZ-CZ 3.63Å; F311-F377 HydrophobicContact CZ-CZ 3.63Å; L370-F377 HydrophobicContact CB-CB 4.33Å; L370-F377 HydrophobicContact CB-CD2 3.7Å; L370-F377 HydrophobicContact CB-CE2 4.22Å; L370-F377 HydrophobicContact CB-CG 4.1Å; L370-F377 HydrophobicContact CD1-CD1 4Å; L370-F377 HydrophobicContact CD1-CD2 3.95Å; L370-F377 HydrophobicContact CD1-CE1 4.02Å; L370-F377 HydrophobicContact CD1-CE2 3.94Å; L370-F377 HydrophobicContact CD1-CG 3.99Å; L370-F377 HydrophobicContact CD1-CZ 4Å; L370-F377 HydrophobicContact CG-CD2 4.41Å; I374-F377 HydrophobicContact CB-CD2 3.64Å; I374-F377 HydrophobicContact CB-CE2 3.96Å; I374-F377 HydrophobicContact CB-CG 4.22Å; I374-F377 HydrophobicContact CD1-CD2 3.93Å; I374-F377 HydrophobicContact CD1-CE2 3.4Å; I374-F377 HydrophobicContact CD1-CZ 4.18Å; I374-F377 HydrophobicContact CG1-CD2 4.35Å; I374-F377 HydrophobicContact CG1-CE2 4.25Å; I374-F377 HydrophobicContact CG2-CD1 4.33Å; I374-F377 HydrophobicContact CG2-CD2 3.73Å; I374-F377 HydrophobicContact CG2-CE1 4.42Å; I374-F377 HydrophobicContact CG2-CE2 3.87Å; I374-F377 HydrophobicContact CG2-CG 3.97Å; I374-F377 HydrophobicContact CG2-CZ 4.2Å; I374-F377 PolarHBondContact O-N 3.31Å; Q375-F377 VanDerWaalsContact C-N 3.33Å; Q375-F377 PolarHBondContact O-N 2.93Å; F377-A381 VanDerWaalsContact O-CB 3.28Å; F377-A381 WeakPolarHBondContact O-CB 3.38Å; F377-A381 PolarHBondContact O-N 2.87Å; F377-L546 HydrophobicContact CE1-CD1 3.99Å
378	R	90.6	Very high	87.3	Confident	103 Å²	103	57.6 Å²	57.6	39%	0.389	30%	0.298	S	S	.	.	H	α-helix	trans	-65	-45.9	174.3	-171.8	-168.2	-56.9	-178.1	3.4	111.4	Q372 I374 Q375 L376 I380 A381 Q382	Q372-R378 PolarHBondContact O-NE 3.3Å; Q372-R378 VanDerWaalsContact O-NE 3.13Å; Q372-R378 PolarHBondContact O-NH2 3.43Å; Q372-R378 VanDerWaalsContact OE1-CA 3.25Å; I374-R378 PolarHBondContact O-N 2.86Å; Q375-R378 WeakPolarHBondContact O-CB 3.24Å; Q375-R378 PolarHBondContact O-N 2.58Å; Q375-R378 VanDerWaalsContact O-N 3.11Å; L376-R378 VanDerWaalsContact C-N 3.33Å; R378-I380 PolarHBondContact O-N 2.69Å; R378-A381 PolarHBondContact O-N 2.62Å; R378-Q382 HydrophobicContact CG-CG 4.49Å; R378-Q382 WeakPolarHBondContact O-CB 3.37Å; R378-Q382 WeakPolarHBondContact O-CG 3.16Å; R378-Q382 PolarHBondContact O-N 3.02Å
379	D	90.1	Very high	87.2	Confident	54 Å²	54	56.3 Å²	56.3	29%	0.289	30%	0.298	S	S	.	.	H	α-helix	trans	-61.7	-45.8	179.3	-65.3	-10.5	0	0	0	110.3	Q375 L376 A381 Q382 E383 L542	Q375-D379 VanDerWaalsContact O-CG 3.22Å; Q375-D379 PolarHBondContact O-N 3.41Å; L376-D379 PolarHBondContact O-N 3.14Å; D379-A381 VanDerWaalsContact C-N 3.33Å; D379-A381 PolarHBondContact O-N 3.32Å; D379-Q382 PolarHBondContact O-N 3.49Å; D379-E383 WeakPolarHBondContact O-CB 3.3Å; D379-E383 WeakPolarHBondContact O-CG 3.47Å; D379-E383 PolarHBondContact O-N 2.59Å; D379-L542 HydrophobicContact CB-CD1 4.28Å; D379-L542 HydrophobicContact CB-CD2 4.24Å
380	I	89.5	Confident	87.1	Confident	1 Å²	1	55.8 Å²	55.8	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-42	175.4	-67.7	166.6	0	0	0	111.3	C367 L376 R378 Q382 F384 L542 L546	C367-I380 HydrophobicContact CB-CB 4.19Å; C367-I380 HydrophobicContact CB-CG2 3.85Å; L376-I380 HydrophobicContact CD1-CD1 4.19Å; L376-I380 HydrophobicContact CD1-CG1 4.5Å; L376-I380 HydrophobicContact CG-CD1 4.04Å; L376-I380 VanDerWaalsContact O-CG1 3.3Å; L376-I380 WeakPolarHBondContact O-CG1 3.49Å; L376-I380 PolarHBondContact O-N 3.35Å; R378-I380 PolarHBondContact O-N 2.69Å; I380-Q382 VanDerWaalsContact C-N 3.31Å; I380-Q382 PolarHBondContact O-N 2.97Å; I380-F384 HydrophobicContact CG2-CD1 4.39Å; I380-F384 HydrophobicContact CG2-CD2 4.18Å; I380-F384 HydrophobicContact CG2-CE1 4.17Å; I380-F384 HydrophobicContact CG2-CE2 3.96Å; I380-F384 HydrophobicContact CG2-CG 4.4Å; I380-F384 HydrophobicContact CG2-CZ 3.95Å; I380-F384 WeakPolarHBondContact O-CB 3.35Å; I380-F384 WeakPolarHBondContact O-CD1 3.33Å; I380-F384 WeakPolarHBondContact O-CG 3.3Å; I380-F384 PolarHBondContact O-N 3.48Å; I380-L542 HydrophobicContact CG1-CB 3.8Å; I380-L542 HydrophobicContact CG1-CD1 4.22Å; I380-L546 HydrophobicContact CD1-CB 4.19Å; I380-L546 HydrophobicContact CD1-CD2 3.97Å
381	A	88.7	Confident	87.1	Confident	10 Å²	10	55.4 Å²	55.4	8%	0.083	28%	0.284	C	S	.	.	H	α-helix	trans	-67.7	-29	-179.2	0	0	0	0	0	113.7	R368 F377 R378 D379	R368-A381 HydrophobicContact CG-CB 3.81Å; F377-A381 VanDerWaalsContact O-CB 3.28Å; F377-A381 WeakPolarHBondContact O-CB 3.38Å; F377-A381 PolarHBondContact O-N 2.87Å; R378-A381 PolarHBondContact O-N 2.62Å; D379-A381 VanDerWaalsContact C-N 3.33Å; D379-A381 PolarHBondContact O-N 3.32Å
382	Q	86.6	Confident	87	Confident	132 Å²	132	53.2 Å²	53.2	62%	0.617	27%	0.27	S	S	*	.	H	α-helix	trans	-94.6	-44.5	-177.6	-70.1	-177	-8.2	0	0	113.2	R378 D379 I380 F384	R378-Q382 HydrophobicContact CG-CG 4.49Å; R378-Q382 WeakPolarHBondContact O-CB 3.37Å; R378-Q382 WeakPolarHBondContact O-CG 3.16Å; R378-Q382 PolarHBondContact O-N 3.02Å; D379-Q382 PolarHBondContact O-N 3.49Å; I380-Q382 VanDerWaalsContact C-N 3.31Å; I380-Q382 PolarHBondContact O-N 2.97Å; Q382-F384 VanDerWaalsContact C-N 3.34Å; Q382-F384 PolarHBondContact O-N 2.78Å
383	E	83	Confident	87.1	Confident	85 Å²	85	51.7 Å²	51.7	40%	0.397	27%	0.267	S	S	.	.	H	α-helix	trans	-76	-23.1	-172.9	-64.9	-83	131	0	0	112.6	D379 S385 R538 L542	D379-E383 WeakPolarHBondContact O-CB 3.3Å; D379-E383 WeakPolarHBondContact O-CG 3.47Å; D379-E383 PolarHBondContact O-N 2.59Å; E383-S385 PolarHBondContact O-N 2.83Å; E383-R538 HydrophobicContact CB-CG 4.18Å; E383-R538 WeakPolarHBondContact OE2-CG 3.16Å; E383-R538 IonicContact OE2-CZ 3.81Å; E383-R538 IonicContact OE2-NE 3.58Å; E383-R538 PolarHBondContact OE2-NE 3.32Å; E383-R538 IonicContact OE2-NH2 3.13Å; E383-L542 HydrophobicContact CB-CD1 3.89Å; E383-L542 HydrophobicContact CG-CD1 4.08Å
384	F	81.9	Confident	87.1	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.009	24%	0.243	C	C	.	.	S	Bend	trans	-79.4	73.7	175.9	-71.5	27.8	0	0	0	108.5	A360 L363 R364 I380 Q382 L388 V539 L542	A360-F384 HydrophobicContact CB-CD2 4.2Å; A360-F384 HydrophobicContact CB-CE2 3.89Å; A360-F384 WeakPolarHBondContact O-CD2 3.24Å; A360-F384 WeakPolarHBondContact O-CE2 3.29Å; L363-F384 HydrophobicContact CB-CE2 4.21Å; R364-F384 HydrophobicContact CB-CB 3.9Å; R364-F384 HydrophobicContact CB-CD2 3.93Å; R364-F384 HydrophobicContact CB-CG 4.33Å; R364-F384 WeakPolarHBondContact CD-O 3.14Å; R364-F384 HydrophobicContact CG-CB 3.92Å; R364-F384 PolarHBondContact NH1-O 3.47Å; I380-F384 HydrophobicContact CG2-CD1 4.39Å; I380-F384 HydrophobicContact CG2-CD2 4.18Å; I380-F384 HydrophobicContact CG2-CE1 4.17Å; I380-F384 HydrophobicContact CG2-CE2 3.96Å; I380-F384 HydrophobicContact CG2-CG 4.4Å; I380-F384 HydrophobicContact CG2-CZ 3.95Å; I380-F384 WeakPolarHBondContact O-CB 3.35Å; I380-F384 WeakPolarHBondContact O-CD1 3.33Å; I380-F384 WeakPolarHBondContact O-CG 3.3Å; I380-F384 PolarHBondContact O-N 3.48Å; Q382-F384 VanDerWaalsContact C-N 3.34Å; Q382-F384 PolarHBondContact O-N 2.78Å; F384-L388 HydrophobicContact CB-CD2 4.29Å; F384-L388 HydrophobicContact CD2-CD2 4.2Å; F384-L388 HydrophobicContact CG-CD2 4.42Å; F384-V539 HydrophobicContact CD1-CG2 3.85Å; F384-V539 HydrophobicContact CD2-CG2 4.24Å; F384-V539 HydrophobicContact CE1-CB 4.12Å; F384-V539 HydrophobicContact CE1-CG1 4.42Å; F384-V539 HydrophobicContact CE1-CG2 3.73Å; F384-V539 HydrophobicContact CE2-CG1 4.11Å; F384-V539 HydrophobicContact CE2-CG2 4.14Å; F384-V539 HydrophobicContact CG-CG2 4.12Å; F384-V539 HydrophobicContact CZ-CB 4.05Å; F384-V539 HydrophobicContact CZ-CG1 3.85Å; F384-V539 HydrophobicContact CZ-CG2 3.89Å; F384-L542 HydrophobicContact CD1-CD1 4.5Å; F384-L542 HydrophobicContact CE1-CB 4.13Å; F384-L542 HydrophobicContact CE1-CD1 4.01Å
385	S	76	Confident	87.1	Confident	35 Å²	35	47.8 Å²	47.8	25%	0.245	24%	0.239	C	C	.	.			trans	-69.8	177.5	-168.6	70.7	0	0	0	0	114.1	E383 D387 L388	E383-S385 PolarHBondContact O-N 2.83Å; S385-D387 PolarHBondContact O-N 3.41Å; S385-D387 WeakPolarHBondContact OG-CB 3.4Å; S385-D387 PolarHBondContact OG-N 3.34Å; S385-D387 PolarHBondContact OG-OD2 2.76Å; S385-L388 WeakPolarHBondContact O-CB 3.23Å; S385-L388 PolarHBondContact O-N 3.3Å
386	D	78.1	Confident	87	Confident	130 Å²	130	43.3 Å²	43.3	70%	0.695	23%	0.225	S	C	*	.	H	α-helix	trans	-62.2	-19.6	172.4	-65.4	-31.9	0	0	0	112.8	L388 H389 H390	D386-L388 VanDerWaalsContact C-N 3.28Å; D386-L388 PolarHBondContact O-N 3.41Å; D386-H389 WeakPolarHBondContact O-CB 3.38Å; D386-H389 PolarHBondContact O-N 2.97Å; D386-H390 PolarHBondContact O-N 2.84Å
387	D	82.4	Confident	86.9	Confident	61 Å²	61	49.1 Å²	49.1	33%	0.326	25%	0.25	S	S	.	.	H	α-helix	trans	-62.3	-37.1	173.9	-68	-49	0	0	0	112.2	S385 H389 H390 I391 R532 V535	S385-D387 PolarHBondContact O-N 3.41Å; S385-D387 WeakPolarHBondContact OG-CB 3.4Å; S385-D387 PolarHBondContact OG-N 3.34Å; S385-D387 PolarHBondContact OG-OD2 2.76Å; D387-H389 VanDerWaalsContact C-N 3.31Å; D387-H389 PolarHBondContact O-N 2.87Å; D387-H390 WeakPolarHBondContact O-CB 3.43Å; D387-H390 PolarHBondContact O-N 3.07Å; D387-I391 VanDerWaalsContact O-CG1 3.32Å; D387-I391 WeakPolarHBondContact O-CG1 3.19Å; D387-I391 PolarHBondContact O-N 3.46Å; D387-R532 IonicContact OD1-CZ 2.62Å; D387-R532 IonicContact OD1-NE 3.6Å; D387-R532 IonicContact OD1-NH1 3.93Å; D387-R532 PolarHBondContact OD1-NH1 3.49Å; D387-V535 HydrophobicContact CB-CG2 4.06Å
388	L	85.9	Confident	86.8	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-65.3	-39.7	176.5	-169.6	68.1	0	0	0	110.8	V357 A360 L361 F384 S385 D386 H390 I391 A392 V535 L536 V539	V357-L388 HydrophobicContact CB-CD1 4.26Å; V357-L388 HydrophobicContact CG1-CD1 3.73Å; V357-L388 HydrophobicContact CG1-CG 3.94Å; V357-L388 WeakPolarHBondContact CG1-O 3.35Å; V357-L388 HydrophobicContact CG2-CD1 4.03Å; A360-L388 HydrophobicContact CB-CD2 3.76Å; L361-L388 HydrophobicContact CD2-CB 4.26Å; L361-L388 HydrophobicContact CD2-CD2 3.91Å; L361-L388 HydrophobicContact CD2-CG 4.08Å; L361-L388 HydrophobicContact CG-CD2 4.1Å; L361-L388 HydrophobicContact CG-CG 4.26Å; F384-L388 HydrophobicContact CB-CD2 4.29Å; F384-L388 HydrophobicContact CD2-CD2 4.2Å; F384-L388 HydrophobicContact CG-CD2 4.42Å; S385-L388 WeakPolarHBondContact O-CB 3.23Å; S385-L388 PolarHBondContact O-N 3.3Å; D386-L388 VanDerWaalsContact C-N 3.28Å; D386-L388 PolarHBondContact O-N 3.41Å; L388-H390 VanDerWaalsContact C-N 3.33Å; L388-I391 PolarHBondContact O-N 3.45Å; L388-A392 PolarHBondContact O-N 2.66Å; L388-V535 HydrophobicContact CB-CG1 4.29Å; L388-L536 HydrophobicContact CD1-CD2 3.86Å; L388-V539 HydrophobicContact CD1-CG2 4.26Å; L388-V539 HydrophobicContact CD2-CG2 4.07Å
389	H	86.8	Confident	86.7	Confident	107 Å²	107	45.5 Å²	45.5	50%	0.495	24%	0.239	S	C	.	.	H	α-helix	trans	-66	-38	174.6	-168.5	73.3	0	0	0	111.6	L361 D386 D387 A392 S393	L361-H389 HydrophobicContact CD2-CB 4.25Å; D386-H389 WeakPolarHBondContact O-CB 3.38Å; D386-H389 PolarHBondContact O-N 2.97Å; D387-H389 VanDerWaalsContact C-N 3.31Å; D387-H389 PolarHBondContact O-N 2.87Å; H389-A392 PolarHBondContact O-N 2.82Å; H389-S393 WeakPolarHBondContact O-CB 3.4Å; H389-S393 PolarHBondContact O-N 2.94Å
390	H	88.4	Confident	86.7	Confident	71 Å²	71	44.8 Å²	44.8	33%	0.329	24%	0.236	S	C	.	.	H	α-helix	trans	-63.6	-45.7	174.9	-171.9	79.5	0	0	0	112	D386 D387 L388 A392 S393 L394 R532	D386-H390 PolarHBondContact O-N 2.84Å; D387-H390 WeakPolarHBondContact O-CB 3.43Å; D387-H390 PolarHBondContact O-N 3.07Å; L388-H390 VanDerWaalsContact C-N 3.33Å; H390-A392 VanDerWaalsContact C-N 3.34Å; H390-A392 PolarHBondContact O-N 3.35Å; H390-S393 PolarHBondContact O-N 3.07Å; H390-L394 WeakPolarHBondContact CD2-CD1 3.39Å; H390-L394 VanDerWaalsContact NE2-CD1 3.32Å; H390-L394 WeakPolarHBondContact NE2-CD1 3.22Å; H390-L394 WeakPolarHBondContact O-CB 3.49Å; H390-L394 WeakPolarHBondContact O-CG 3.46Å; H390-L394 PolarHBondContact O-N 3.44Å; H390-R532 PolarHBondContact CD2-NH1 3Å; H390-R532 PolarHBondContact CD2-NH2 3.42Å; H390-R532 VanDerWaalsContact CG-NH1 3.3Å; H390-R532 PolarHBondContact NE2-NH2 2.9Å
391	I	88.5	Confident	86.6	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.005	25%	0.245	C	C	.	.	H	α-helix	trans	-58.9	-47	174.9	-66.4	164.8	0	0	0	110.4	V357 D387 L388 S393 L394 I395 V529 R532 L536	V357-I391 HydrophobicContact CG1-CG2 4.46Å; V357-I391 HydrophobicContact CG2-CG2 4.08Å; D387-I391 VanDerWaalsContact O-CG1 3.32Å; D387-I391 WeakPolarHBondContact O-CG1 3.19Å; D387-I391 PolarHBondContact O-N 3.46Å; L388-I391 PolarHBondContact O-N 3.45Å; I391-S393 VanDerWaalsContact C-N 3.34Å; I391-S393 PolarHBondContact O-N 2.95Å; I391-L394 PolarHBondContact O-N 3Å; I391-I395 HydrophobicContact CG2-CD1 3.73Å; I391-I395 HydrophobicContact CG2-CG1 4.45Å; I391-I395 WeakPolarHBondContact O-CG1 3.27Å; I391-I395 PolarHBondContact O-N 3.23Å; I391-V529 HydrophobicContact CG2-CG2 4.41Å; I391-R532 HydrophobicContact CD1-CB 3.89Å; I391-R532 HydrophobicContact CG1-CB 4.37Å; I391-L536 HydrophobicContact CD1-CD1 4.46Å; I391-L536 HydrophobicContact CD1-CD2 4.29Å; I391-L536 HydrophobicContact CD1-CG 4.27Å
392	A	89.4	Confident	86.4	Confident	9 Å²	9	54.2 Å²	54.2	7%	0.074	28%	0.277	C	S	.	.	H	α-helix	trans	-58.1	-47.2	177.8	0	0	0	0	0	111.5	Y354 V357 L361 L388 H389 H390 G396	Y354-A392 WeakPolarHBondContact CE2-O 3.3Å; V357-A392 HydrophobicContact CG1-CB 3.55Å; L361-A392 HydrophobicContact CD1-CB 3.83Å; L388-A392 PolarHBondContact O-N 2.66Å; H389-A392 PolarHBondContact O-N 2.82Å; H390-A392 VanDerWaalsContact C-N 3.34Å; H390-A392 PolarHBondContact O-N 3.35Å; A392-G396 PolarHBondContact O-N 2.86Å
393	S	90.3	Very high	86.3	Confident	37 Å²	37	48.8 Å²	48.8	26%	0.259	26%	0.256	S	S	.	.	H	α-helix	trans	-68.1	-36.1	-179.9	178.9	0	0	0	0	112.4	H389 H390 I391 K397	H389-S393 WeakPolarHBondContact O-CB 3.4Å; H389-S393 PolarHBondContact O-N 2.94Å; H390-S393 PolarHBondContact O-N 3.07Å; I391-S393 VanDerWaalsContact C-N 3.34Å; I391-S393 PolarHBondContact O-N 2.95Å; S393-K397 VanDerWaalsContact O-CB 3.25Å; S393-K397 WeakPolarHBondContact O-CB 3.39Å; S393-K397 WeakPolarHBondContact O-CD 3.34Å; S393-K397 WeakPolarHBondContact O-CG 3.48Å; S393-K397 PolarHBondContact O-N 3.25Å; S393-K397 VanDerWaalsContact O-N 3.11Å; S393-K397 VanDerWaalsContact OG-CE 3.25Å; S393-K397 WeakPolarHBondContact OG-CE 3.48Å; S393-K397 PolarHBondContact OG-NZ 3.33Å
394	L	89.6	Confident	86.4	Confident	32 Å²	32	44.8 Å²	44.8	17%	0.168	24%	0.238	C	C	.	.	H	α-helix	trans	-65	-53.1	177.7	-80.1	173.8	0	0	0	110.2	H390 I391 G396 K397 V398 L525 Q528	H390-L394 WeakPolarHBondContact CD2-CD1 3.39Å; H390-L394 VanDerWaalsContact NE2-CD1 3.32Å; H390-L394 WeakPolarHBondContact NE2-CD1 3.22Å; H390-L394 WeakPolarHBondContact O-CB 3.49Å; H390-L394 WeakPolarHBondContact O-CG 3.46Å; H390-L394 PolarHBondContact O-N 3.44Å; I391-L394 PolarHBondContact O-N 3Å; L394-G396 PolarHBondContact O-N 3.28Å; L394-K397 PolarHBondContact O-N 3.44Å; L394-V398 WeakPolarHBondContact O-CB 3.45Å; L394-V398 VanDerWaalsContact O-CG2 3.3Å; L394-V398 WeakPolarHBondContact O-CG2 3.46Å; L394-V398 PolarHBondContact O-N 3.07Å; L394-L525 HydrophobicContact CB-CD1 4.05Å; L394-Q528 HydrophobicContact CD1-CB 4.32Å
395	I	89.9	Confident	86.6	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-62.4	-47	-178.6	-61.9	170.8	0	0	0	110.2	W350 L353 Y354 I391 K397 V398 V399 F401 V529	W350-I395 HydrophobicContact CE3-CD1 4.41Å; W350-I395 HydrophobicContact CE3-CG1 4.35Å; W350-I395 HydrophobicContact CE3-CG2 4.41Å; W350-I395 HydrophobicContact CZ3-CD1 4.43Å; W350-I395 HydrophobicContact CZ3-CG1 4.24Å; L353-I395 HydrophobicContact CD2-CD1 3.68Å; L353-I395 HydrophobicContact CG-CD1 3.97Å; Y354-I395 HydrophobicContact CD2-CB 4.12Å; Y354-I395 HydrophobicContact CD2-CG2 3.92Å; Y354-I395 HydrophobicContact CG-CG2 4.34Å; I391-I395 HydrophobicContact CG2-CD1 3.73Å; I391-I395 HydrophobicContact CG2-CG1 4.45Å; I391-I395 WeakPolarHBondContact O-CG1 3.27Å; I391-I395 PolarHBondContact O-N 3.23Å; I395-K397 VanDerWaalsContact C-N 3.27Å; I395-K397 PolarHBondContact O-N 3.49Å; I395-V398 PolarHBondContact O-N 3.38Å; I395-V399 HydrophobicContact CG2-CB 4.41Å; I395-V399 HydrophobicContact CG2-CG2 3.93Å; I395-V399 WeakPolarHBondContact O-CB 3.29Å; I395-V399 WeakPolarHBondContact O-CG2 3.39Å; I395-V399 PolarHBondContact O-N 3.19Å; I395-F401 HydrophobicContact CG2-CE1 4.43Å; I395-F401 HydrophobicContact CG2-CZ 3.79Å; I395-V529 HydrophobicContact CD1-CG2 4.43Å; I395-V529 HydrophobicContact CG1-CG2 4.49Å
396	G	88.4	Confident	87	Confident	28 Å²	28	52.1 Å²	52.1	29%	0.289	29%	0.287	S	S	.	.	H	α-helix	trans	-68.7	-20.2	-178.5	0	0	0	0	0	115	A392 L394 L413	A392-G396 PolarHBondContact O-N 2.86Å; L394-G396 PolarHBondContact O-N 3.28Å; G396-L413 WeakPolarHBondContact O-CD1 3.47Å
397	K	89.3	Confident	87.2	Confident	133 Å²	133	51 Å²	51	58%	0.578	28%	0.277	S	S	*	.	H	α-helix	trans	-88.7	-32.3	174.6	-75.9	175.2	179.9	169.1	0	112.7	S393 L394 I395 L413 I416	S393-K397 VanDerWaalsContact O-CB 3.25Å; S393-K397 WeakPolarHBondContact O-CB 3.39Å; S393-K397 WeakPolarHBondContact O-CD 3.34Å; S393-K397 WeakPolarHBondContact O-CG 3.48Å; S393-K397 PolarHBondContact O-N 3.25Å; S393-K397 VanDerWaalsContact O-N 3.11Å; S393-K397 VanDerWaalsContact OG-CE 3.25Å; S393-K397 WeakPolarHBondContact OG-CE 3.48Å; S393-K397 PolarHBondContact OG-NZ 3.33Å; L394-K397 PolarHBondContact O-N 3.44Å; I395-K397 VanDerWaalsContact C-N 3.27Å; I395-K397 PolarHBondContact O-N 3.49Å; K397-L413 WeakPolarHBondContact O-CD1 3.29Å; K397-I416 WeakPolarHBondContact O-CD1 3.34Å; K397-I416 WeakPolarHBondContact O-CG1 3.15Å
398	V	89	Confident	87.2	Confident	24 Å²	24	55 Å²	55	15%	0.145	30%	0.298	C	S	.	.	H	α-helix	trans	-92.2	-43.3	-172.7	176.5	0	0	0	0	111.8	L394 I395 F410 V412 L413 L525	L394-V398 WeakPolarHBondContact O-CB 3.45Å; L394-V398 VanDerWaalsContact O-CG2 3.3Å; L394-V398 WeakPolarHBondContact O-CG2 3.46Å; L394-V398 PolarHBondContact O-N 3.07Å; I395-V398 PolarHBondContact O-N 3.38Å; V398-F410 HydrophobicContact CG1-CZ 4.45Å; V398-V412 HydrophobicContact CG1-CG1 4.38Å; V398-V412 WeakPolarHBondContact O-CA 3.49Å; V398-V412 WeakPolarHBondContact O-CG1 3.24Å; V398-L413 PolarHBondContact O-N 3.2Å; V398-L525 HydrophobicContact CB-CD2 4.31Å; V398-L525 HydrophobicContact CG1-CD2 4.12Å
399	V	89.2	Confident	87.1	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.018	31%	0.308	C	S	.	.	B	Isolated β-bridge	trans	-89.4	125.7	-167.6	-172.8	0	0	0	0	111.4	I395 F401 F410 L413 L525	I395-V399 HydrophobicContact CG2-CB 4.41Å; I395-V399 HydrophobicContact CG2-CG2 3.93Å; I395-V399 WeakPolarHBondContact O-CB 3.29Å; I395-V399 WeakPolarHBondContact O-CG2 3.39Å; I395-V399 PolarHBondContact O-N 3.19Å; V399-F401 HydrophobicContact CB-CE1 4.2Å; V399-F401 HydrophobicContact CB-CZ 4.29Å; V399-F401 HydrophobicContact CG1-CD1 3.81Å; V399-F401 HydrophobicContact CG1-CE1 3.76Å; V399-F401 HydrophobicContact CG1-CG 4.46Å; V399-F401 HydrophobicContact CG1-CZ 4.34Å; V399-F401 PolarHBondContact O-N 2.9Å; V399-F410 HydrophobicContact CB-CE2 4.37Å; V399-F410 HydrophobicContact CG1-CD2 4.48Å; V399-F410 HydrophobicContact CG1-CE2 4.02Å; V399-F410 HydrophobicContact CG2-CE2 3.6Å; V399-F410 HydrophobicContact CG2-CZ 3.85Å; V399-L413 WeakPolarHBondContact O-CD1 3.25Å; V399-L525 HydrophobicContact CG2-CD2 3.73Å
400	D	89.3	Confident	87.1	Confident	40 Å²	40	53.4 Å²	53.4	21%	0.214	29%	0.288	C	S	.	.			trans	-88.7	100	168	180	-1.8	0	0	0	109.2	E402 G403 S404 T411 L413	D400-E402 PolarHBondContact OD1-N 3.25Å; D400-E402 VanDerWaalsContact OD1-N 3.13Å; D400-G403 PolarHBondContact OD1-N 3.03Å; D400-S404 WeakPolarHBondContact O-CB 3.33Å; D400-S404 PolarHBondContact O-N 2.95Å; D400-S404 PolarHBondContact O-OG 3.48Å; D400-T411 PolarHBondContact N-O 3.06Å; D400-T411 PolarHBondContact O-OG1 2.79Å; D400-L413 HydrophobicContact CB-CD2 3.83Å; D400-L413 HydrophobicContact CB-CG 3.97Å
401	F	87.5	Confident	87	Confident	45 Å²	45	50.1 Å²	50.1	20%	0.197	27%	0.274	C	S	.	.	H	α-helix	trans	-69.9	-31.5	-177.2	-64.9	-63.4	0	0	0	113.7	W350 Q351 Y354 I395 V399 L405	W350-F401 HydrophobicContact CB-CE1 4.31Å; Q351-F401 HydrophobicContact CB-CD1 4.37Å; Q351-F401 HydrophobicContact CB-CE1 4.41Å; Q351-F401 HydrophobicContact CG-CB 4.43Å; Q351-F401 HydrophobicContact CG-CD1 3.33Å; Q351-F401 HydrophobicContact CG-CE1 3.8Å; Q351-F401 HydrophobicContact CG-CG 4.14Å; Q351-F401 PolarHBondContact NE2-O 2.99Å; Y354-F401 AromaticContact CD1-CE2 3.91Å; Y354-F401 HydrophobicContact CD1-CE2 3.91Å; Y354-F401 AromaticContact CD1-CZ 4Å; Y354-F401 HydrophobicContact CD1-CZ 4Å; Y354-F401 HydrophobicContact CD2-CE2 4.39Å; Y354-F401 HydrophobicContact CD2-CZ 4.21Å; Y354-F401 HydrophobicContact CE1-CE2 4.29Å; Y354-F401 AromaticContact CG-CE2 3.97Å; Y354-F401 HydrophobicContact CG-CE2 3.97Å; Y354-F401 AromaticContact CG-CZ 3.68Å; Y354-F401 HydrophobicContact CG-CZ 3.68Å; I395-F401 HydrophobicContact CG2-CE1 4.43Å; I395-F401 HydrophobicContact CG2-CZ 3.79Å; V399-F401 HydrophobicContact CB-CE1 4.2Å; V399-F401 HydrophobicContact CB-CZ 4.29Å; V399-F401 HydrophobicContact CG1-CD1 3.81Å; V399-F401 HydrophobicContact CG1-CE1 3.76Å; V399-F401 HydrophobicContact CG1-CG 4.46Å; V399-F401 HydrophobicContact CG1-CZ 4.34Å; V399-F401 PolarHBondContact O-N 2.9Å; F401-L405 WeakPolarHBondContact O-CG 3.39Å; F401-L405 PolarHBondContact O-N 2.86Å
402	E	85.4	Confident	87	Confident	164 Å²	164	50.2 Å²	50.2	77%	0.766	27%	0.274	S	S	*	.	H	α-helix	trans	-76.9	-49.2	-178.9	-68.2	-176.7	177	0	0	110	D400 S404 L405 A406	D400-E402 PolarHBondContact OD1-N 3.25Å; D400-E402 VanDerWaalsContact OD1-N 3.13Å; E402-S404 VanDerWaalsContact C-N 3.25Å; E402-S404 PolarHBondContact O-N 3.29Å; E402-L405 PolarHBondContact O-N 2.96Å; E402-A406 PolarHBondContact O-N 3.16Å
403	G	83.3	Confident	87	Confident	17 Å²	17	52.2 Å²	52.2	18%	0.175	28%	0.283	C	S	.	.	H	α-helix	trans	-58.7	-39.4	174.4	0	0	0	0	0	112	D400 L405 A406 E407 T411	D400-G403 PolarHBondContact OD1-N 3.03Å; G403-L405 VanDerWaalsContact C-N 3.34Å; G403-L405 PolarHBondContact O-N 3.02Å; G403-A406 PolarHBondContact O-N 2.95Å; G403-E407 PolarHBondContact O-N 3.47Å; G403-T411 VanDerWaalsContact C-OG1 3.24Å
404	S	86.5	Confident	86.7	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.007	30%	0.296	C	S	.	.	H	α-helix	trans	-69.2	-32.8	-177.7	-61.3	0	0	0	0	113.1	D400 E402 N408 R409 T411	D400-S404 WeakPolarHBondContact O-CB 3.33Å; D400-S404 PolarHBondContact O-N 2.95Å; D400-S404 PolarHBondContact O-OG 3.48Å; E402-S404 VanDerWaalsContact C-N 3.25Å; E402-S404 PolarHBondContact O-N 3.29Å; S404-N408 CarbonylContact O-C 3.56Å; S404-N408 VanDerWaalsContact O-CA 3.3Å; S404-N408 WeakPolarHBondContact O-CA 3.48Å; S404-N408 PolarHBondContact O-N 2.98Å; S404-R409 CarbonylContact C-O 3.3Å; S404-R409 WeakPolarHBondContact CA-O 3.3Å; S404-R409 WeakPolarHBondContact CB-O 3.47Å; S404-R409 PolarHBondContact O-N 3.37Å; S404-R409 PolarHBondContact OG-O 3.21Å; S404-T411 WeakPolarHBondContact CA-OG1 3.41Å; S404-T411 PolarHBondContact N-OG1 3.17Å; S404-T411 PolarHBondContact OG-N 3.5Å; S404-T411 PolarHBondContact OG-OG1 3.13Å
405	L	85	Confident	86.4	Confident	103 Å²	103	59.8 Å²	59.8	54%	0.539	33%	0.325	S	S	.	.	H	α-helix	trans	-72.2	-44.3	173.9	-75.7	173.4	0	0	0	111.4	V347 F401 E402 G403 E407 N408	V347-L405 HydrophobicContact CG1-CD2 4.36Å; F401-L405 WeakPolarHBondContact O-CG 3.39Å; F401-L405 PolarHBondContact O-N 2.86Å; E402-L405 PolarHBondContact O-N 2.96Å; G403-L405 VanDerWaalsContact C-N 3.34Å; G403-L405 PolarHBondContact O-N 3.02Å; L405-E407 VanDerWaalsContact C-N 3.29Å; L405-E407 PolarHBondContact O-N 3.17Å; L405-N408 PolarHBondContact O-N 2.9Å
406	A	85.6	Confident	86.2	Confident	89 Å²	89	63.1 Å²	63.1	74%	0.736	34%	0.342	S	S	*	.	H	α-helix	trans	-61.3	-39.6	-178.9	0	0	0	0	0	112.1	E402 G403	E402-A406 PolarHBondContact O-N 3.16Å; G403-A406 PolarHBondContact O-N 2.95Å
407	E	81.4	Confident	86.2	Confident	107 Å²	107	63.7 Å²	63.7	50%	0.5	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-0.3	-178.8	-61.9	-173.8	-178.1	0	0	113.2	G403 L405 R409 T411	G403-E407 PolarHBondContact O-N 3.47Å; L405-E407 VanDerWaalsContact C-N 3.29Å; L405-E407 PolarHBondContact O-N 3.17Å; E407-R409 HydrophobicContact CB-CG 3.76Å; E407-R409 PolarHBondContact O-N 3.3Å; E407-R409 VanDerWaalsContact O-N 3.16Å; E407-R409 IonicContact OE2-CZ 3.4Å; E407-R409 IonicContact OE2-NE 3.07Å; E407-R409 PolarHBondContact OE2-NE 3.1Å; E407-R409 IonicContact OE2-NH2 3.56Å; E407-R409 PolarHBondContact OE2-NH2 3.26Å; E407-T411 HydrophobicContact CB-CG2 4.48Å
408	N	82.9	Confident	86.1	Confident	143 Å²	143	62.2 Å²	62.2	77%	0.765	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.5	38.1	-174.2	-166	28	0	0	0	113.3	S404 L405	S404-N408 CarbonylContact O-C 3.56Å; S404-N408 VanDerWaalsContact O-CA 3.3Å; S404-N408 WeakPolarHBondContact O-CA 3.48Å; S404-N408 PolarHBondContact O-N 2.98Å; L405-N408 PolarHBondContact O-N 2.9Å
409	R	83.4	Confident	86.1	Confident	55 Å²	55	66.4 Å²	66.4	21%	0.208	36%	0.361	C	S	.	.	S	Bend	trans	-150.7	160.8	-177.2	74.6	-171.7	-170.6	81.6	8.5	110.6	V347 S404 E407 T411 E518	V347-R409 WeakPolarHBondContact CG2-O 3.46Å; S404-R409 CarbonylContact C-O 3.3Å; S404-R409 WeakPolarHBondContact CA-O 3.3Å; S404-R409 WeakPolarHBondContact CB-O 3.47Å; S404-R409 PolarHBondContact O-N 3.37Å; S404-R409 PolarHBondContact OG-O 3.21Å; E407-R409 HydrophobicContact CB-CG 3.76Å; E407-R409 PolarHBondContact O-N 3.3Å; E407-R409 VanDerWaalsContact O-N 3.16Å; E407-R409 IonicContact OE2-CZ 3.4Å; E407-R409 IonicContact OE2-NE 3.07Å; E407-R409 PolarHBondContact OE2-NE 3.1Å; E407-R409 IonicContact OE2-NH2 3.56Å; E407-R409 PolarHBondContact OE2-NH2 3.26Å; R409-T411 HydrophobicContact CG-CG2 3.96Å; R409-T411 PolarHBondContact O-N 3.15Å; R409-E518 IonicContact CZ-OE2 2.76Å; R409-E518 VanDerWaalsContact CZ-OE2 3.23Å; R409-E518 IonicContact NH1-OE2 2.73Å; R409-E518 PolarHBondContact NH1-OE2 3.3Å; R409-E518 IonicContact NH2-OE2 3.43Å; R409-E518 PolarHBondContact NH2-OE2 2.7Å
410	F	85.9	Confident	86	Confident	19 Å²	19	66.4 Å²	66.4	8%	0.083	36%	0.361	C	S	.	.			trans	-66.9	125.5	174.6	-175.3	-90.7	0	0	0	110.5	W350 V398 V399 V412 M522 L525	W350-F410 AromaticContact CD1-CD2 3.89Å; W350-F410 HydrophobicContact CD2-CE2 4.25Å; W350-F410 AromaticContact CE2-CE2 3.95Å; W350-F410 HydrophobicContact CG-CD2 4.46Å; W350-F410 HydrophobicContact CG-CE2 4.4Å; W350-F410 HydrophobicContact CZ2-CE2 4.36Å; W350-F410 AromaticContact NE1-CD2 3.7Å; W350-F410 AromaticContact NE1-CE2 3.92Å; V398-F410 HydrophobicContact CG1-CZ 4.45Å; V399-F410 HydrophobicContact CB-CE2 4.37Å; V399-F410 HydrophobicContact CG1-CD2 4.48Å; V399-F410 HydrophobicContact CG1-CE2 4.02Å; V399-F410 HydrophobicContact CG2-CE2 3.6Å; V399-F410 HydrophobicContact CG2-CZ 3.85Å; F410-V412 HydrophobicContact CD1-CG2 4.29Å; F410-V412 HydrophobicContact CE1-CG2 3.65Å; F410-M522 HydrophobicContact CB-CG 4.46Å; F410-M522 HydrophobicContact CB-SD 3.74Å; F410-M522 HydrophobicContact CD1-CB 3.65Å; F410-M522 HydrophobicContact CD1-CG 4.08Å; F410-M522 HydrophobicContact CD1-SD 4.41Å; F410-M522 HydrophobicContact CD2-CB 4.34Å; F410-M522 HydrophobicContact CD2-CG 3.87Å; F410-M522 HydrophobicContact CD2-SD 4.01Å; F410-M522 HydrophobicContact CE1-CB 3.66Å; F410-M522 HydrophobicContact CE1-CG 4.22Å; F410-M522 HydrophobicContact CE2-CB 4.35Å; F410-M522 HydrophobicContact CE2-CG 4.02Å; F410-M522 HydrophobicContact CG-CB 3.99Å; F410-M522 HydrophobicContact CG-CG 3.89Å; F410-M522 HydrophobicContact CG-SD 3.82Å; F410-M522 HydrophobicContact CZ-CB 4.03Å; F410-M522 HydrophobicContact CZ-CG 4.19Å; F410-L525 HydrophobicContact CE2-CD2 4.43Å; F410-L525 HydrophobicContact CZ-CD2 4.16Å
411	T	87	Confident	86	Confident	3 Å²	3	65.7 Å²	65.7	2%	0.018	36%	0.357	C	S	.	.			trans	-128.5	146.6	176.4	61.2	0	0	0	0	110.6	D400 G403 S404 E407 R409 E518	D400-T411 PolarHBondContact N-O 3.06Å; D400-T411 PolarHBondContact O-OG1 2.79Å; G403-T411 VanDerWaalsContact C-OG1 3.24Å; S404-T411 WeakPolarHBondContact CA-OG1 3.41Å; S404-T411 PolarHBondContact N-OG1 3.17Å; S404-T411 PolarHBondContact OG-N 3.5Å; S404-T411 PolarHBondContact OG-OG1 3.13Å; E407-T411 HydrophobicContact CB-CG2 4.48Å; R409-T411 HydrophobicContact CG-CG2 3.96Å; R409-T411 PolarHBondContact O-N 3.15Å; T411-E518 WeakPolarHBondContact CA-OE1 3.32Å
412	V	88.9	Confident	86.1	Confident	3 Å²	3	67.9 Å²	67.9	2%	0.018	37%	0.368	C	S	.	.	B	Isolated β-bridge	trans	-101.2	141.1	-176.4	-179.8	0	0	0	0	110.7	V398 F410 I416 K424 E518 L521	V398-V412 HydrophobicContact CG1-CG1 4.38Å; V398-V412 WeakPolarHBondContact O-CA 3.49Å; V398-V412 WeakPolarHBondContact O-CG1 3.24Å; F410-V412 HydrophobicContact CD1-CG2 4.29Å; F410-V412 HydrophobicContact CE1-CG2 3.65Å; V412-I416 HydrophobicContact CG1-CB 3.67Å; V412-I416 HydrophobicContact CG1-CG1 4.07Å; V412-I416 HydrophobicContact CG1-CG2 3.77Å; V412-K424 PolarHBondContact O-NZ 2.79Å; V412-E518 HydrophobicContact CB-CG 4.49Å; V412-E518 HydrophobicContact CG2-CB 4.39Å; V412-E518 HydrophobicContact CG2-CG 4.01Å; V412-E518 PolarHBondContact N-OE1 3.43Å; V412-L521 HydrophobicContact CG1-CD1 4.25Å; V412-L521 HydrophobicContact CG2-CB 4.39Å; V412-L521 HydrophobicContact CG2-CD1 3.99Å
413	L	88.4	Confident	86.2	Confident	51 Å²	51	61.8 Å²	61.8	27%	0.267	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-61.3	150.6	174.8	-80.3	170.2	0	0	0	112.1	G396 K397 V398 V399 D400 I416	G396-L413 WeakPolarHBondContact O-CD1 3.47Å; K397-L413 WeakPolarHBondContact O-CD1 3.29Å; V398-L413 PolarHBondContact O-N 3.2Å; V399-L413 WeakPolarHBondContact O-CD1 3.25Å; D400-L413 HydrophobicContact CB-CD2 3.83Å; D400-L413 HydrophobicContact CB-CG 3.97Å; L413-I416 HydrophobicContact CB-CG1 4.27Å; L413-I416 WeakPolarHBondContact O-CG1 3.41Å
414	P	83.9	Confident	86.4	Confident	82 Å²	82	62.9 Å²	62.9	53%	0.532	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.7	148.1	177.1	28.1	-34.3	0	0	0	111.6
415	N	83.8	Confident	86.5	Confident	145 Å²	145	71.5 Å²	71.5	78%	0.775	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.8	18.6	-178.3	-43	-75.8	0	0	0	115.7	D421	N415-D421 WeakPolarHBondContact CA-OD2 3.44Å; N415-D421 PolarHBondContact N-OD2 3.49Å
416	I	86.6	Confident	86.5	Confident	70 Å²	70	72.7 Å²	72.7	36%	0.359	37%	0.368	S	S	.	.	S	Bend	trans	-91.9	-45.6	173.2	-63.8	-65.2	0	0	0	111.2	K397 V412 L413	K397-I416 WeakPolarHBondContact O-CD1 3.34Å; K397-I416 WeakPolarHBondContact O-CG1 3.15Å; V412-I416 HydrophobicContact CG1-CB 3.67Å; V412-I416 HydrophobicContact CG1-CG1 4.07Å; V412-I416 HydrophobicContact CG1-CG2 3.77Å; L413-I416 HydrophobicContact CB-CG1 4.27Å; L413-I416 WeakPolarHBondContact O-CG1 3.41Å
417	D	87.6	Confident	86.5	Confident	40 Å²	40	70.9 Å²	70.9	21%	0.214	35%	0.346	C	S	.	.			trans	-130.4	115.3	177.2	-172.3	-61.8	0	0	0	109.3	E419 I420 D421 L521	D417-E419 PolarHBondContact O-N 3.38Å; D417-E419 WeakPolarHBondContact OD1-CA 3.36Å; D417-E419 VanDerWaalsContact OD1-CB 3.29Å; D417-E419 WeakPolarHBondContact OD1-CB 3.47Å; D417-E419 PolarHBondContact OD1-N 3.38Å; D417-I420 HydrophobicContact CB-CB 4.12Å; D417-I420 HydrophobicContact CB-CD1 3.88Å; D417-I420 HydrophobicContact CB-CG1 3.95Å; D417-I420 PolarHBondContact O-N 3.29Å; D417-I420 PolarHBondContact OD1-N 3.21Å; D417-I420 VanDerWaalsContact OD1-N 3.08Å; D417-D421 PolarHBondContact O-N 3.18Å; D417-L521 HydrophobicContact CB-CD1 4.06Å
418	P	88.6	Confident	86.7	Confident	103 Å²	103	73 Å²	73	67%	0.669	36%	0.358	S	S	*	.	H	α-helix	trans	-66.1	-27	-175.8	27.9	-34.5	0	0	0	112.8	E422	P418-E422 WeakPolarHBondContact O-CB 3.28Å; P418-E422 PolarHBondContact O-N 3.19Å
419	E	87.8	Confident	86.9	Confident	112 Å²	112	67.8 Å²	67.8	52%	0.523	34%	0.338	S	S	.	.	H	α-helix	trans	-72.4	-43.9	177.9	-58.8	-171.5	170.2	0	0	110.8	D417 D421 E422 K423 Q517	D417-E419 PolarHBondContact O-N 3.38Å; D417-E419 WeakPolarHBondContact OD1-CA 3.36Å; D417-E419 VanDerWaalsContact OD1-CB 3.29Å; D417-E419 WeakPolarHBondContact OD1-CB 3.47Å; D417-E419 PolarHBondContact OD1-N 3.38Å; E419-D421 VanDerWaalsContact C-N 3.32Å; E419-D421 PolarHBondContact O-N 3.45Å; E419-E422 PolarHBondContact O-N 3.03Å; E419-K423 WeakPolarHBondContact O-CG 3.08Å; E419-K423 PolarHBondContact O-N 3Å; E419-Q517 PolarHBondContact OE2-NE2 2.89Å
420	I	87.6	Confident	87	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.01	33%	0.331	C	S	.	.	H	α-helix	trans	-62.3	-44.1	175.8	-62.6	179.9	0	0	0	110	D417 E422 K423 K424 I514 Q517 E518 L521	D417-I420 HydrophobicContact CB-CB 4.12Å; D417-I420 HydrophobicContact CB-CD1 3.88Å; D417-I420 HydrophobicContact CB-CG1 3.95Å; D417-I420 PolarHBondContact O-N 3.29Å; D417-I420 PolarHBondContact OD1-N 3.21Å; D417-I420 VanDerWaalsContact OD1-N 3.08Å; I420-E422 VanDerWaalsContact C-N 3.34Å; I420-E422 PolarHBondContact O-N 3.46Å; I420-K423 PolarHBondContact O-N 3.42Å; I420-K424 HydrophobicContact CG2-CD 4.01Å; I420-K424 HydrophobicContact CG2-CG 4.22Å; I420-K424 WeakPolarHBondContact O-CB 3.38Å; I420-K424 WeakPolarHBondContact O-CG 3.3Å; I420-K424 PolarHBondContact O-N 3.33Å; I420-I514 HydrophobicContact CG2-CG2 4.47Å; I420-Q517 HydrophobicContact CD1-CB 3.88Å; I420-Q517 HydrophobicContact CG1-CB 3.89Å; I420-E518 HydrophobicContact CD1-CG 4.02Å; I420-E518 HydrophobicContact CG2-CG 4.24Å; I420-L521 HydrophobicContact CD1-CD1 3.34Å; I420-L521 HydrophobicContact CD1-CG 4.34Å
421	D	88.8	Confident	87	Confident	25 Å²	25	68.8 Å²	68.8	13%	0.134	35%	0.352	C	S	.	.	H	α-helix	trans	-62.3	-41	178.6	-72.6	-24.8	0	0	0	112.2	N415 D417 E419 R425	N415-D421 WeakPolarHBondContact CA-OD2 3.44Å; N415-D421 PolarHBondContact N-OD2 3.49Å; D417-D421 PolarHBondContact O-N 3.18Å; E419-D421 VanDerWaalsContact C-N 3.32Å; E419-D421 PolarHBondContact O-N 3.45Å; D421-R425 WeakPolarHBondContact O-CB 3.43Å; D421-R425 PolarHBondContact O-N 3.31Å
422	E	89.1	Confident	87	Confident	92 Å²	92	72.6 Å²	72.6	43%	0.43	38%	0.379	S	S	.	.	H	α-helix	trans	-63.5	-45.3	175.7	-174.3	175.1	-178.2	0	0	111.3	P418 E419 I420 R425 R426	P418-E422 WeakPolarHBondContact O-CB 3.28Å; P418-E422 PolarHBondContact O-N 3.19Å; E419-E422 PolarHBondContact O-N 3.03Å; I420-E422 VanDerWaalsContact C-N 3.34Å; I420-E422 PolarHBondContact O-N 3.46Å; E422-R425 PolarHBondContact O-N 3.2Å; E422-R426 WeakPolarHBondContact O-CG 3.43Å; E422-R426 PolarHBondContact O-N 2.87Å; E422-R426 IonicContact OE1-CZ 3.71Å; E422-R426 IonicContact OE1-NE 3Å; E422-R426 PolarHBondContact OE1-NE 2.8Å; E422-R426 IonicContact OE1-NH2 3.86Å; E422-R426 PolarHBondContact OE1-NH2 3.12Å
423	K	87.8	Confident	86.9	Confident	36 Å²	36	76.8 Å²	76.8	16%	0.157	40%	0.398	C	S	.	.	H	α-helix	trans	-65.8	-42.8	177.8	-68.5	180	-170.2	-173.5	0	112.1	E419 I420 R425 R426 L427 L510 E513 I514	E419-K423 WeakPolarHBondContact O-CG 3.08Å; E419-K423 PolarHBondContact O-N 3Å; I420-K423 PolarHBondContact O-N 3.42Å; K423-R425 VanDerWaalsContact C-N 3.32Å; K423-R425 PolarHBondContact O-N 3.35Å; K423-R426 PolarHBondContact O-N 3.11Å; K423-L427 WeakPolarHBondContact O-CB 3.2Å; K423-L427 PolarHBondContact O-N 3.21Å; K423-L510 HydrophobicContact CG-CD2 4.46Å; K423-E513 HydrophobicContact CD-CB 4.35Å; K423-E513 VanDerWaalsContact CE-OE2 3.32Å; K423-E513 WeakPolarHBondContact CE-OE2 3.27Å; K423-E513 IonicContact NZ-OE2 3.99Å; K423-E513 PolarHBondContact NZ-OE2 2.83Å; K423-I514 HydrophobicContact CB-CD1 3.89Å; K423-I514 HydrophobicContact CB-CG1 3.6Å; K423-I514 HydrophobicContact CD-CG1 4.33Å
424	K	87.2	Confident	86.9	Confident	40 Å²	40	75 Å²	75	17%	0.174	39%	0.388	C	S	.	.	H	α-helix	trans	-59.3	-42.3	173.6	-77.1	-176.9	179.1	-178.5	0	111.2	V412 I420 L427 M428 I514 E518	V412-K424 PolarHBondContact O-NZ 2.79Å; I420-K424 HydrophobicContact CG2-CD 4.01Å; I420-K424 HydrophobicContact CG2-CG 4.22Å; I420-K424 WeakPolarHBondContact O-CB 3.38Å; I420-K424 WeakPolarHBondContact O-CG 3.3Å; I420-K424 PolarHBondContact O-N 3.33Å; K424-L427 PolarHBondContact O-N 3.42Å; K424-M428 WeakPolarHBondContact O-CG 3.43Å; K424-M428 PolarHBondContact O-N 3.06Å; K424-I514 HydrophobicContact CG-CD1 4.16Å; K424-I514 HydrophobicContact CG-CG2 4.36Å; K424-E518 WeakPolarHBondContact CE-OE1 3.43Å; K424-E518 IonicContact NZ-OE1 2.67Å; K424-E518 PolarHBondContact NZ-OE1 2.94Å
425	R	88.6	Confident	87	Confident	181 Å²	181	75.9 Å²	75.9	68%	0.683	39%	0.392	S	S	*	.	H	α-helix	trans	-63.3	-42.7	175.9	-169	-175.9	-58.5	147.1	6.2	112.2	D421 E422 K423 L427 M428 G429	D421-R425 WeakPolarHBondContact O-CB 3.43Å; D421-R425 PolarHBondContact O-N 3.31Å; E422-R425 PolarHBondContact O-N 3.2Å; K423-R425 VanDerWaalsContact C-N 3.32Å; K423-R425 PolarHBondContact O-N 3.35Å; R425-L427 VanDerWaalsContact C-N 3.34Å; R425-M428 PolarHBondContact O-N 3.46Å; R425-G429 PolarHBondContact O-N 3.42Å; R425-G429 VanDerWaalsContact O-N 3.11Å
426	R	85.8	Confident	87.1	Confident	128 Å²	128	73.3 Å²	73.3	48%	0.483	38%	0.376	S	S	.	.	H	α-helix	trans	-62.4	-41.3	174.6	-70.8	175.2	-175.4	-165.2	3.4	111.4	E422 K423 G429 L430 L510	E422-R426 WeakPolarHBondContact O-CG 3.43Å; E422-R426 PolarHBondContact O-N 2.87Å; E422-R426 IonicContact OE1-CZ 3.71Å; E422-R426 IonicContact OE1-NE 3Å; E422-R426 PolarHBondContact OE1-NE 2.8Å; E422-R426 IonicContact OE1-NH2 3.86Å; E422-R426 PolarHBondContact OE1-NH2 3.12Å; K423-R426 PolarHBondContact O-N 3.11Å; R426-G429 PolarHBondContact O-N 2.97Å; R426-L430 PolarHBondContact O-N 2.97Å; R426-L430 VanDerWaalsContact O-N 3.11Å; R426-L510 HydrophobicContact CB-CD1 4.24Å
427	L	85.3	Confident	87.1	Confident	51 Å²	51	70.4 Å²	70.4	27%	0.267	36%	0.361	S	S	.	.	H	α-helix	trans	-64.3	-43.2	176.4	-173.8	66.4	0	0	0	112.1	K423 K424 R425 G429 L430 I514	K423-L427 WeakPolarHBondContact O-CB 3.2Å; K423-L427 PolarHBondContact O-N 3.21Å; K424-L427 PolarHBondContact O-N 3.42Å; R425-L427 VanDerWaalsContact C-N 3.34Å; L427-G429 VanDerWaalsContact C-N 3.29Å; L427-G429 PolarHBondContact O-N 3.48Å; L427-L430 HydrophobicContact CD1-CD2 4.03Å; L427-L430 WeakPolarHBondContact O-CB 3.44Å; L427-L430 PolarHBondContact O-N 3.49Å; L427-L430 VanDerWaalsContact O-N 3.12Å; L427-I514 HydrophobicContact CB-CD1 4.37Å; L427-I514 HydrophobicContact CD2-CD1 4.02Å
428	M	86.3	Confident	87	Confident	153 Å²	153	69 Å²	69	75%	0.754	36%	0.355	S	S	*	.	H	α-helix	trans	-62.9	-34.2	175.9	-71.2	-177.6	-161	0	0	112.7	K424 R425 L430 P431	K424-M428 WeakPolarHBondContact O-CG 3.43Å; K424-M428 PolarHBondContact O-N 3.06Å; R425-M428 PolarHBondContact O-N 3.46Å; M428-L430 VanDerWaalsContact C-N 3.32Å; M428-P431 WeakPolarHBondContact O-CD 3.04Å
429	G	85.9	Confident	86.9	Confident	32 Å²	32	70.1 Å²	70.1	33%	0.33	35%	0.346	S	S	.	.	H	α-helix	trans	-80	-10.3	175.6	0	0	0	0	0	114.6	R425 R426 L427 S432 F433	R425-G429 PolarHBondContact O-N 3.42Å; R425-G429 VanDerWaalsContact O-N 3.11Å; R426-G429 PolarHBondContact O-N 2.97Å; L427-G429 VanDerWaalsContact C-N 3.29Å; L427-G429 PolarHBondContact O-N 3.48Å; G429-S432 PolarHBondContact O-OG 3.24Å; G429-F433 PolarHBondContact O-N 2.95Å
430	L	87	Confident	86.7	Confident	12 Å²	12	68.6 Å²	68.6	6%	0.063	34%	0.337	C	S	.	.	H	α-helix	trans	-63	-44.5	-173.5	-166.8	63.9	0	0	0	113	R426 L427 M428 S432 F433 L434 Y456 F462 L507	R426-L430 PolarHBondContact O-N 2.97Å; R426-L430 VanDerWaalsContact O-N 3.11Å; L427-L430 HydrophobicContact CD1-CD2 4.03Å; L427-L430 WeakPolarHBondContact O-CB 3.44Å; L427-L430 PolarHBondContact O-N 3.49Å; L427-L430 VanDerWaalsContact O-N 3.12Å; M428-L430 VanDerWaalsContact C-N 3.32Å; L430-S432 PolarHBondContact O-N 2.94Å; L430-F433 HydrophobicContact CD1-CD1 4.38Å; L430-F433 PolarHBondContact O-N 3Å; L430-F433 VanDerWaalsContact O-N 3.12Å; L430-L434 HydrophobicContact CD1-CD2 4.21Å; L430-L434 HydrophobicContact CD1-CG 4.13Å; L430-L434 HydrophobicContact CD2-CD1 4.47Å; L430-L434 HydrophobicContact CG-CD1 3.99Å; L430-L434 HydrophobicContact CG-CG 4Å; L430-L434 WeakPolarHBondContact O-CB 3.29Å; L430-L434 VanDerWaalsContact O-CG 3.31Å; L430-L434 WeakPolarHBondContact O-CG 3.07Å; L430-L434 PolarHBondContact O-N 2.89Å; L430-Y456 HydrophobicContact CD2-CD1 4.24Å; L430-Y456 HydrophobicContact CD2-CG 4.36Å; L430-F462 HydrophobicContact CD1-CE1 3.93Å; L430-F462 HydrophobicContact CD1-CZ 4.09Å; L430-F462 HydrophobicContact CD2-CE1 3.99Å; L430-F462 HydrophobicContact CD2-CZ 4.19Å; L430-F462 HydrophobicContact CG-CE1 4.32Å; L430-L507 HydrophobicContact CD1-CD1 3.91Å
431	P	85.7	Confident	86.5	Confident	83 Å²	83	69.1 Å²	69.1	54%	0.539	34%	0.339	S	S	.	.	H	α-helix	trans	-60.2	-42.6	-178.8	-25	35.6	0	0	0	113.6	M428 F433 T435	M428-P431 WeakPolarHBondContact O-CD 3.04Å; P431-F433 VanDerWaalsContact C-N 3.34Å; P431-F433 PolarHBondContact O-N 2.58Å; P431-T435 PolarHBondContact O-N 3.29Å; P431-T435 PolarHBondContact O-OG1 3.42Å
432	S	87	Confident	86.2	Confident	84 Å²	84	71.1 Å²	71.1	59%	0.587	35%	0.35	S	S	*	.	H	α-helix	trans	-63.7	-40.5	175.5	41.8	0	0	0	0	112	G429 L430 T435 E436	G429-S432 PolarHBondContact O-OG 3.24Å; L430-S432 PolarHBondContact O-N 2.94Å; S432-T435 PolarHBondContact O-N 3.18Å; S432-E436 PolarHBondContact O-N 3.15Å
433	F	86.7	Confident	85.9	Confident	91 Å²	91	72.8 Å²	72.8	40%	0.399	36%	0.358	S	S	.	.	H	α-helix	trans	-68.1	-45.2	178.5	177.5	-106.2	0	0	0	111.9	G429 L430 P431 T435 E436 V437 L503 L507	G429-F433 PolarHBondContact O-N 2.95Å; L430-F433 HydrophobicContact CD1-CD1 4.38Å; L430-F433 PolarHBondContact O-N 3Å; L430-F433 VanDerWaalsContact O-N 3.12Å; P431-F433 VanDerWaalsContact C-N 3.34Å; P431-F433 PolarHBondContact O-N 2.58Å; F433-T435 PolarHBondContact O-N 2.91Å; F433-E436 PolarHBondContact O-N 2.81Å; F433-E436 VanDerWaalsContact O-N 3.08Å; F433-V437 HydrophobicContact CD1-CG2 4.24Å; F433-V437 HydrophobicContact CE1-CG2 3.84Å; F433-V437 HydrophobicContact CE2-CG2 4.28Å; F433-V437 HydrophobicContact CZ-CG2 3.87Å; F433-V437 WeakPolarHBondContact O-CG2 3.49Å; F433-V437 PolarHBondContact O-N 2.91Å; F433-L503 HydrophobicContact CE1-CD2 3.67Å; F433-L503 HydrophobicContact CZ-CD2 4.13Å; F433-L507 HydrophobicContact CE1-CD1 4.37Å
434	L	87.3	Confident	85.3	Confident	14 Å²	14	77.3 Å²	77.3	7%	0.073	38%	0.384	C	S	.	.	H	α-helix	trans	-62.6	-32.5	176.9	-66.9	-174.2	0	0	0	112.3	L430 V437 A438 V454 F462 L503	L430-L434 HydrophobicContact CD1-CD2 4.21Å; L430-L434 HydrophobicContact CD1-CG 4.13Å; L430-L434 HydrophobicContact CD2-CD1 4.47Å; L430-L434 HydrophobicContact CG-CD1 3.99Å; L430-L434 HydrophobicContact CG-CG 4Å; L430-L434 WeakPolarHBondContact O-CB 3.29Å; L430-L434 VanDerWaalsContact O-CG 3.31Å; L430-L434 WeakPolarHBondContact O-CG 3.07Å; L430-L434 PolarHBondContact O-N 2.89Å; L434-V437 PolarHBondContact O-N 3.15Å; L434-A438 VanDerWaalsContact O-CB 3.28Å; L434-A438 WeakPolarHBondContact O-CB 3.22Å; L434-A438 PolarHBondContact O-N 2.98Å; L434-V454 HydrophobicContact CB-CB 4.4Å; L434-V454 HydrophobicContact CD2-CB 4.49Å; L434-V454 HydrophobicContact CD2-CG1 3.82Å; L434-F462 HydrophobicContact CD1-CD1 4.29Å; L434-F462 HydrophobicContact CD1-CE1 4.15Å; L434-F462 HydrophobicContact CD2-CD1 3.78Å; L434-F462 HydrophobicContact CD2-CE1 3.77Å; L434-F462 HydrophobicContact CG-CE1 4.46Å; L434-L503 HydrophobicContact CD2-CD1 4.36Å
435	T	87.4	Confident	84.8	Confident	100 Å²	100	76.9 Å²	76.9	61%	0.613	38%	0.383	S	S	*	.	H	α-helix	trans	-64.5	-40.9	173.6	-55.6	0	0	0	0	111.4	P431 S432 F433 A438 R439	P431-T435 PolarHBondContact O-N 3.29Å; P431-T435 PolarHBondContact O-OG1 3.42Å; S432-T435 PolarHBondContact O-N 3.18Å; F433-T435 PolarHBondContact O-N 2.91Å; T435-A438 PolarHBondContact O-N 2.98Å; T435-R439 PolarHBondContact O-N 3.38Å; T435-R439 VanDerWaalsContact O-N 3.11Å
436	E	85.4	Confident	84.1	Confident	91 Å²	91	71.7 Å²	71.7	43%	0.425	37%	0.369	S	S	.	.	H	α-helix	trans	-68.7	-39.3	175.7	-164.6	-171.3	155.9	0	0	112.1	S432 F433 R439 K440	S432-E436 PolarHBondContact O-N 3.15Å; F433-E436 PolarHBondContact O-N 2.81Å; F433-E436 VanDerWaalsContact O-N 3.08Å; E436-R439 WeakPolarHBondContact O-CB 3.41Å; E436-R439 PolarHBondContact O-N 2.93Å; E436-K440 PolarHBondContact O-N 3.45Å; E436-K440 VanDerWaalsContact O-N 3.17Å; E436-K440 WeakPolarHBondContact OE1-CE 3.32Å; E436-K440 IonicContact OE1-NZ 2.65Å; E436-K440 PolarHBondContact OE1-NZ 3.49Å
437	V	85.8	Confident	83.3	Confident	8 Å²	8	71.2 Å²	71.2	5%	0.048	39%	0.385	C	S	.	.	H	α-helix	trans	-63.9	-44.7	174.8	177	0	0	0	0	110.6	F433 L434 R439 K440 E441 V454 L503	F433-V437 HydrophobicContact CD1-CG2 4.24Å; F433-V437 HydrophobicContact CE1-CG2 3.84Å; F433-V437 HydrophobicContact CE2-CG2 4.28Å; F433-V437 HydrophobicContact CZ-CG2 3.87Å; F433-V437 WeakPolarHBondContact O-CG2 3.49Å; F433-V437 PolarHBondContact O-N 2.91Å; L434-V437 PolarHBondContact O-N 3.15Å; V437-R439 PolarHBondContact O-N 3.41Å; V437-K440 PolarHBondContact O-N 2.88Å; V437-K440 VanDerWaalsContact O-N 3.08Å; V437-E441 HydrophobicContact CG1-CG 4.21Å; V437-E441 WeakPolarHBondContact O-CG 3.39Å; V437-E441 PolarHBondContact O-N 3.39Å; V437-V454 HydrophobicContact CG1-CG2 4.22Å; V437-L503 HydrophobicContact CG1-CD1 4.12Å
438	A	86.8	Confident	82.6	Confident	10 Å²	10	77.7 Å²	77.7	8%	0.083	41%	0.406	C	S	.	.	H	α-helix	trans	-58.2	-38.4	176.8	0	0	0	0	0	111.9	L434 T435 E441 L442 V454	L434-A438 VanDerWaalsContact O-CB 3.28Å; L434-A438 WeakPolarHBondContact O-CB 3.22Å; L434-A438 PolarHBondContact O-N 2.98Å; T435-A438 PolarHBondContact O-N 2.98Å; A438-E441 PolarHBondContact O-N 3.32Å; A438-L442 WeakPolarHBondContact O-CB 3.32Å; A438-L442 PolarHBondContact O-N 2.87Å; A438-V454 HydrophobicContact CB-CB 4.39Å; A438-V454 HydrophobicContact CB-CG2 3.88Å
439	R	85	Confident	82.1	Confident	128 Å²	128	71.2 Å²	71.2	48%	0.483	37%	0.374	S	S	.	.	H	α-helix	trans	-62.8	-42.6	174.9	-166.7	-171	69.3	71.3	5.3	112.2	T435 E436 V437 L442 E443	T435-R439 PolarHBondContact O-N 3.38Å; T435-R439 VanDerWaalsContact O-N 3.11Å; E436-R439 WeakPolarHBondContact O-CB 3.41Å; E436-R439 PolarHBondContact O-N 2.93Å; V437-R439 PolarHBondContact O-N 3.41Å; R439-L442 PolarHBondContact O-N 2.94Å; R439-E443 IonicContact CZ-OE1 2.95Å; R439-E443 IonicContact NH1-OE1 2.64Å; R439-E443 PolarHBondContact NH1-OE1 3.35Å; R439-E443 PolarHBondContact O-N 2.86Å
440	K	83.8	Confident	81.6	Confident	79 Å²	79	74.1 Å²	74.1	34%	0.343	39%	0.387	S	S	.	.	H	α-helix	trans	-71.9	-36.7	178.5	-69.5	175.8	-174.5	163	0	112.3	E436 V437 L442 E443 N444	E436-K440 PolarHBondContact O-N 3.45Å; E436-K440 VanDerWaalsContact O-N 3.17Å; E436-K440 WeakPolarHBondContact OE1-CE 3.32Å; E436-K440 IonicContact OE1-NZ 2.65Å; E436-K440 PolarHBondContact OE1-NZ 3.49Å; V437-K440 PolarHBondContact O-N 2.88Å; V437-K440 VanDerWaalsContact O-N 3.08Å; K440-L442 VanDerWaalsContact C-N 3.34Å; K440-E443 PolarHBondContact O-N 2.98Å; K440-N444 PolarHBondContact O-ND2 2.9Å
441	E	83.1	Confident	81.4	Confident	13 Å²	13	76.5 Å²	76.5	6%	0.061	41%	0.405	C	S	.	.	H	α-helix	trans	-64.9	-40.3	173.6	-72.4	-65.7	97.4	0	0	110.9	V437 A438 E443 N444 L445 L464 S497 R499	V437-E441 HydrophobicContact CG1-CG 4.21Å; V437-E441 WeakPolarHBondContact O-CG 3.39Å; V437-E441 PolarHBondContact O-N 3.39Å; A438-E441 PolarHBondContact O-N 3.32Å; E441-E443 PolarHBondContact O-N 2.83Å; E441-N444 PolarHBondContact O-N 3.45Å; E441-L445 VanDerWaalsContact O-CG 3.28Å; E441-L445 WeakPolarHBondContact O-CG 3.29Å; E441-L445 PolarHBondContact O-N 3.18Å; E441-L445 VanDerWaalsContact O-N 3.1Å; E441-L464 HydrophobicContact CB-CD1 3.99Å; E441-L464 HydrophobicContact CG-CD1 4.05Å; E441-S497 WeakPolarHBondContact OE2-CB 3.46Å; E441-S497 PolarHBondContact OE2-OG 2.95Å; E441-R499 WeakPolarHBondContact OE1-CB 3.4Å; E441-R499 WeakPolarHBondContact OE1-CG 3.3Å
442	L	83.8	Confident	81.3	Confident	67 Å²	67	73.5 Å²	73.5	35%	0.351	39%	0.386	S	S	.	.	H	α-helix	trans	-59.8	-33.3	177.2	-172.3	65.4	0	0	0	112.9	A438 R439 K440 N444 C452	A438-L442 WeakPolarHBondContact O-CB 3.32Å; A438-L442 PolarHBondContact O-N 2.87Å; R439-L442 PolarHBondContact O-N 2.94Å; K440-L442 VanDerWaalsContact C-N 3.34Å; L442-N444 VanDerWaalsContact C-N 3.29Å; L442-N444 PolarHBondContact O-N 3.23Å; L442-C452 HydrophobicContact CB-CB 4.45Å; L442-C452 HydrophobicContact CD1-CB 4.08Å
443	E	81.6	Confident	81.2	Confident	128 Å²	128	71.7 Å²	71.7	60%	0.598	37%	0.373	S	S	*	.	H	α-helix	trans	-67.5	-28	175.5	-69.8	171.7	-178.4	0	0	113	R439 K440 E441	R439-E443 IonicContact CZ-OE1 2.95Å; R439-E443 IonicContact NH1-OE1 2.64Å; R439-E443 PolarHBondContact NH1-OE1 3.35Å; R439-E443 PolarHBondContact O-N 2.86Å; K440-E443 PolarHBondContact O-N 2.98Å; E441-E443 PolarHBondContact O-N 2.83Å
444	N	76.1	Confident	81.3	Confident	131 Å²	131	68 Å²	68	70%	0.701	36%	0.358	S	S	*	.	H	α-helix	trans	-92.3	-16	-179	-68	-31.3	0	0	0	113.3	K440 E441 L442	K440-N444 PolarHBondContact O-ND2 2.9Å; E441-N444 PolarHBondContact O-N 3.45Å; L442-N444 VanDerWaalsContact C-N 3.29Å; L442-N444 PolarHBondContact O-N 3.23Å
445	L	77.1	Confident	81.3	Confident	30 Å²	30	69.8 Å²	69.8	16%	0.157	37%	0.367	C	S	.	.	S	Bend	trans	-80.5	159.2	179.7	-73.5	170.4	0	0	0	111.6	E441 S447 I449 C452 L464 I466 L483	E441-L445 VanDerWaalsContact O-CG 3.28Å; E441-L445 WeakPolarHBondContact O-CG 3.29Å; E441-L445 PolarHBondContact O-N 3.18Å; E441-L445 VanDerWaalsContact O-N 3.1Å; L445-S447 PolarHBondContact O-N 3.41Å; L445-I449 HydrophobicContact CB-CD1 4.2Å; L445-I449 HydrophobicContact CD2-CD1 4.22Å; L445-C452 HydrophobicContact CD1-CB 4.1Å; L445-L464 HydrophobicContact CD1-CD2 4.23Å; L445-L464 HydrophobicContact CD2-CD2 4.39Å; L445-I466 HydrophobicContact CD1-CD1 4.29Å; L445-I466 HydrophobicContact CD2-CD1 4.47Å; L445-L483 HydrophobicContact CD2-CD1 3.95Å
446	D	72.2	Confident	81.3	Confident	73 Å²	73	67 Å²	67	39%	0.39	35%	0.346	S	S	.	.			trans	-60.6	135.7	177.5	-170.5	-16.4	0	0	0	110.9	R448 I449	D446-R448 PolarHBondContact O-N 2.95Å; D446-R448 PolarHBondContact OD1-N 3.07Å; D446-R448 IonicContact OD1-NE 3.16Å; D446-R448 IonicContact OD2-CZ 2.66Å; D446-R448 IonicContact OD2-NE 3.55Å; D446-R448 PolarHBondContact OD2-NE 2.71Å; D446-R448 IonicContact OD2-NH2 2.84Å; D446-R448 PolarHBondContact OD2-NH2 3.32Å; D446-I449 WeakPolarHBondContact O-CB 3.21Å; D446-I449 PolarHBondContact O-N 3.12Å
447	S	69.1	Low	81.3	Confident	118 Å²	118	65 Å²	65	83%	0.825	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.8	-18.2	176.8	60.4	0	0	0	0	116.1	L445 I449	L445-S447 PolarHBondContact O-N 3.41Å; S447-I449 VanDerWaalsContact C-N 3.29Å
448	R	71.3	Confident	81.2	Confident	186 Å²	186	67.1 Å²	67.1	70%	0.702	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-13.6	176.4	-64.5	-179	-74.1	172.4	0.1	113.7	D446 P450	D446-R448 PolarHBondContact O-N 2.95Å; D446-R448 PolarHBondContact OD1-N 3.07Å; D446-R448 IonicContact OD1-NE 3.16Å; D446-R448 IonicContact OD2-CZ 2.66Å; D446-R448 IonicContact OD2-NE 3.55Å; D446-R448 PolarHBondContact OD2-NE 2.71Å; D446-R448 IonicContact OD2-NH2 2.84Å; D446-R448 PolarHBondContact OD2-NH2 3.32Å; R448-P450 WeakPolarHBondContact O-CD 3.31Å
449	I	76.9	Confident	81	Confident	17 Å²	17	73.4 Å²	73.4	9%	0.087	38%	0.383	C	S	.	.			trans	-90.4	115.1	-178.5	-62.5	176.8	0	0	0	109.3	L445 D446 S447 I466	L445-I449 HydrophobicContact CB-CD1 4.2Å; L445-I449 HydrophobicContact CD2-CD1 4.22Å; D446-I449 WeakPolarHBondContact O-CB 3.21Å; D446-I449 PolarHBondContact O-N 3.12Å; S447-I449 VanDerWaalsContact C-N 3.29Å; I449-I466 HydrophobicContact CD1-CD1 4.24Å; I449-I466 HydrophobicContact CD1-CG2 4.31Å; I449-I466 HydrophobicContact CG1-CG2 4.43Å; I449-I466 HydrophobicContact CG2-CG2 3.56Å
450	P	74.4	Confident	80.9	Confident	93 Å²	93	70.4 Å²	70.4	60%	0.604	38%	0.376	S	S	*	.			trans	-79.2	-27.3	-169.1	29.7	-35.3	0	0	0	113.8	R448 P467	R448-P450 WeakPolarHBondContact O-CD 3.31Å; P450-P467 HydrophobicContact CG-CG 3.89Å
451	S	82.1	Confident	81	Confident	62 Å²	62	67 Å²	67	43%	0.434	36%	0.363	S	S	.	.			trans	-158.4	156	179.5	61.8	0	0	0	0	110.5	P467	S451-P467 WeakPolarHBondContact O-CD 3.3Å
452	C	83.9	Confident	81.3	Confident	21 Å²	21	66.5 Å²	66.5	14%	0.142	36%	0.361	C	S	.	.			trans	-139.9	141.8	177.6	-171.8	0	0	0	0	109.6	L442 L445 L464	L442-C452 HydrophobicContact CB-CB 4.45Å; L442-C452 HydrophobicContact CD1-CB 4.08Å; L445-C452 HydrophobicContact CD1-CB 4.1Å; C452-L464 WeakPolarHBondContact SG-CD1 3.03Å; C452-L464 VanDerWaalsContact SG-CG 3.51Å
453	S	86	Confident	81.6	Confident	46 Å²	46	63.3 Å²	63.3	32%	0.322	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	130.5	174.5	54.3	0	0	0	0	109.6	S465	S453-S465 PolarHBondContact N-O 2.86Å; S453-S465 WeakPolarHBondContact O-CA 3.46Å; S453-S465 WeakPolarHBondContact O-CB 3.49Å; S453-S465 PolarHBondContact O-N 3.17Å; S453-S465 WeakPolarHBondContact OG-CB 3.49Å; S453-S465 PolarHBondContact OG-O 2.96Å
454	V	87.8	Confident	81.9	Confident	13 Å²	13	57.2 Å²	57.2	8%	0.079	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	121.5	170.9	-178.2	0	0	0	0	107.3	L434 V437 A438 L463 L464	L434-V454 HydrophobicContact CB-CB 4.4Å; L434-V454 HydrophobicContact CD2-CB 4.49Å; L434-V454 HydrophobicContact CD2-CG1 3.82Å; V437-V454 HydrophobicContact CG1-CG2 4.22Å; A438-V454 HydrophobicContact CB-CB 4.39Å; A438-V454 HydrophobicContact CB-CG2 3.88Å; V454-L463 CarbonylContact C-O 3.6Å; V454-L463 WeakPolarHBondContact CA-O 3.48Å; V454-L464 HydrophobicContact CG2-CD1 3.78Å
455	I	87.4	Confident	82.5	Confident	51 Å²	51	51 Å²	51	26%	0.262	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	154	179.1	66.7	170.7	0	0	0	109.5	I457 F462 L463 H494	I455-I457 HydrophobicContact CD1-CD1 3.85Å; I455-I457 HydrophobicContact CD1-CG1 4.08Å; I455-I457 HydrophobicContact CG1-CG1 4.5Å; I455-F462 WeakPolarHBondContact O-CA 3.16Å; I455-L463 HydrophobicContact CD1-CB 4.45Å; I455-L463 HydrophobicContact CG1-CB 3.88Å; I455-L463 PolarHBondContact N-O 3.35Å; I455-L463 PolarHBondContact O-N 2.99Å; I455-H494 VanDerWaalsContact CD1-CE1 3.4Å; I455-H494 WeakPolarHBondContact CD1-CE1 3.27Å; I455-H494 WeakPolarHBondContact CD1-ND1 3.41Å
456	Y	87.4	Confident	83	Confident	41 Å²	41	49.8 Å²	49.8	16%	0.161	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	126.6	171.9	165.4	-108.2	0	0	0	108.4	L430 P458 F462 D509 L510 H511	L430-Y456 HydrophobicContact CD2-CD1 4.24Å; L430-Y456 HydrophobicContact CD2-CG 4.36Å; Y456-P458 HydrophobicContact CE1-CG 4.32Å; Y456-F462 HydrophobicContact CD2-CD1 4.09Å; Y456-F462 HydrophobicContact CD2-CD2 4.37Å; Y456-F462 AromaticContact CD2-CE1 3.8Å; Y456-F462 HydrophobicContact CD2-CE1 3.8Å; Y456-F462 HydrophobicContact CD2-CE2 4.08Å; Y456-F462 HydrophobicContact CD2-CG 4.36Å; Y456-F462 AromaticContact CD2-CZ 3.78Å; Y456-F462 HydrophobicContact CD2-CZ 3.78Å; Y456-F462 HydrophobicContact CE2-CE2 4.48Å; Y456-F462 HydrophobicContact CE2-CZ 4.35Å; Y456-F462 HydrophobicContact CG-CD1 4.33Å; Y456-F462 AromaticContact CG-CE1 3.95Å; Y456-F462 HydrophobicContact CG-CE1 3.95Å; Y456-F462 HydrophobicContact CG-CZ 4.28Å; Y456-D509 PolarHBondContact OH-OD1 3.24Å; Y456-L510 PolarHBondContact OH-N 2.63Å; Y456-H511 HydrophobicContact CE1-CB 4.04Å; Y456-H511 VanDerWaalsContact OH-CB 3.26Å; Y456-H511 WeakPolarHBondContact OH-CB 3.42Å; Y456-H511 PolarHBondContact OH-N 3.34Å; Y456-H511 VanDerWaalsContact OH-N 3.1Å
457	I	85.9	Confident	83.6	Confident	51 Å²	51	48.1 Å²	48.1	26%	0.262	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	122.6	175.1	-55.4	179	0	0	0	107.6	I455 I460 G461 L463 F487	I455-I457 HydrophobicContact CD1-CD1 3.85Å; I455-I457 HydrophobicContact CD1-CG1 4.08Å; I455-I457 HydrophobicContact CG1-CG1 4.5Å; I457-I460 HydrophobicContact CB-CB 4.18Å; I457-I460 HydrophobicContact CB-CD1 4.42Å; I457-I460 HydrophobicContact CG2-CB 4.32Å; I457-I460 HydrophobicContact CG2-CD1 3.87Å; I457-I460 HydrophobicContact CG2-CG1 4.15Å; I457-I460 PolarHBondContact O-N 3.43Å; I457-I460 VanDerWaalsContact O-N 3.16Å; I457-G461 PolarHBondContact N-O 2.88Å; I457-G461 VanDerWaalsContact N-O 3.09Å; I457-G461 PolarHBondContact O-N 3.29Å; I457-L463 HydrophobicContact CD1-CD1 3.83Å; I457-L463 HydrophobicContact CG1-CD1 4.4Å; I457-F487 HydrophobicContact CD1-CZ 3.97Å
458	P	83.2	Confident	84.3	Confident	51 Å²	51	46 Å²	46	33%	0.331	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.3	144.3	176.1	-26.1	34.5	0	0	0	111.9	Y456 I460 H511	Y456-P458 HydrophobicContact CE1-CG 4.32Å; P458-I460 PolarHBondContact O-N 3.06Å; P458-H511 HydrophobicContact CG-CB 4.22Å
459	L	82.3	Confident	84.7	Confident	142 Å²	142	38.5 Å²	38.5	74%	0.743	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.3	-22.4	-174.1	-52.7	171.4	0	0	0	116.2	D509	L459-D509 WeakPolarHBondContact CA-OD2 3.19Å; L459-D509 PolarHBondContact N-OD2 3.21Å
460	I	84.5	Confident	84.4	Confident	66 Å²	66	44 Å²	44	34%	0.338	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-36.6	178.5	-54.9	-178.2	0	0	0	111.5	I457 P458 L463 F487 R496	I457-I460 HydrophobicContact CB-CB 4.18Å; I457-I460 HydrophobicContact CB-CD1 4.42Å; I457-I460 HydrophobicContact CG2-CB 4.32Å; I457-I460 HydrophobicContact CG2-CD1 3.87Å; I457-I460 HydrophobicContact CG2-CG1 4.15Å; I457-I460 PolarHBondContact O-N 3.43Å; I457-I460 VanDerWaalsContact O-N 3.16Å; P458-I460 PolarHBondContact O-N 3.06Å; I460-L463 HydrophobicContact CG2-CD1 3.88Å; I460-L463 HydrophobicContact CG2-CD2 4.26Å; I460-L463 HydrophobicContact CG2-CG 4.33Å; I460-F487 HydrophobicContact CD1-CE1 4.45Å; I460-R496 PolarHBondContact O-NH2 3.43Å
461	G	85.5	Confident	84	Confident	8 Å²	8	43.8 Å²	43.8	8%	0.082	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	100.7	-162.1	-179.6	0	0	0	0	0	114	I457 D504	I457-G461 PolarHBondContact N-O 2.88Å; I457-G461 VanDerWaalsContact N-O 3.09Å; I457-G461 PolarHBondContact O-N 3.29Å; G461-D504 WeakPolarHBondContact CA-OD1 3.49Å
462	F	89.9	Confident	83.6	Confident	1 Å²	1	42 Å²	42	0%	0.004	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	131.6	178.1	-64.4	-82	0	0	0	111	L430 L434 I455 Y456 T500 L503 D504 L507	L430-F462 HydrophobicContact CD1-CE1 3.93Å; L430-F462 HydrophobicContact CD1-CZ 4.09Å; L430-F462 HydrophobicContact CD2-CE1 3.99Å; L430-F462 HydrophobicContact CD2-CZ 4.19Å; L430-F462 HydrophobicContact CG-CE1 4.32Å; L434-F462 HydrophobicContact CD1-CD1 4.29Å; L434-F462 HydrophobicContact CD1-CE1 4.15Å; L434-F462 HydrophobicContact CD2-CD1 3.78Å; L434-F462 HydrophobicContact CD2-CE1 3.77Å; L434-F462 HydrophobicContact CG-CE1 4.46Å; I455-F462 WeakPolarHBondContact O-CA 3.16Å; Y456-F462 HydrophobicContact CD2-CD1 4.09Å; Y456-F462 HydrophobicContact CD2-CD2 4.37Å; Y456-F462 AromaticContact CD2-CE1 3.8Å; Y456-F462 HydrophobicContact CD2-CE1 3.8Å; Y456-F462 HydrophobicContact CD2-CE2 4.08Å; Y456-F462 HydrophobicContact CD2-CG 4.36Å; Y456-F462 AromaticContact CD2-CZ 3.78Å; Y456-F462 HydrophobicContact CD2-CZ 3.78Å; Y456-F462 HydrophobicContact CE2-CE2 4.48Å; Y456-F462 HydrophobicContact CE2-CZ 4.35Å; Y456-F462 HydrophobicContact CG-CD1 4.33Å; Y456-F462 AromaticContact CG-CE1 3.95Å; Y456-F462 HydrophobicContact CG-CE1 3.95Å; Y456-F462 HydrophobicContact CG-CZ 4.28Å; F462-T500 VanDerWaalsContact O-CB 3.31Å; F462-T500 WeakPolarHBondContact O-CB 3.5Å; F462-T500 PolarHBondContact O-OG1 2.95Å; F462-L503 HydrophobicContact CB-CB 4.31Å; F462-L503 HydrophobicContact CD2-CB 3.71Å; F462-L503 HydrophobicContact CE2-CB 4.24Å; F462-L503 HydrophobicContact CG-CB 3.97Å; F462-L503 HydrophobicContact CG-CD1 4.48Å; F462-D504 WeakPolarHBondContact CD2-OD1 3.38Å; F462-D504 PolarHBondContact N-OD1 3.25Å; F462-L507 HydrophobicContact CE2-CB 3.95Å; F462-L507 HydrophobicContact CE2-CD1 4.19Å; F462-L507 HydrophobicContact CZ-CB 4.15Å; F462-L507 HydrophobicContact CZ-CD1 3.81Å
463	L	89.4	Confident	82.8	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	142.6	-178.1	-61.1	171.2	0	0	0	110.8	V454 I455 I457 I460 M486 F487 H494 Y495 R496	V454-L463 CarbonylContact C-O 3.6Å; V454-L463 WeakPolarHBondContact CA-O 3.48Å; I455-L463 HydrophobicContact CD1-CB 4.45Å; I455-L463 HydrophobicContact CG1-CB 3.88Å; I455-L463 PolarHBondContact N-O 3.35Å; I455-L463 PolarHBondContact O-N 2.99Å; I457-L463 HydrophobicContact CD1-CD1 3.83Å; I457-L463 HydrophobicContact CG1-CD1 4.4Å; I460-L463 HydrophobicContact CG2-CD1 3.88Å; I460-L463 HydrophobicContact CG2-CD2 4.26Å; I460-L463 HydrophobicContact CG2-CG 4.33Å; L463-M486 HydrophobicContact CD2-CG 3.98Å; L463-F487 HydrophobicContact CD1-CE1 3.76Å; L463-F487 HydrophobicContact CD1-CZ 3.99Å; L463-H494 HydrophobicContact CD1-CB 4.29Å; L463-Y495 WeakPolarHBondContact CA-O 3.49Å; L463-R496 HydrophobicContact CD2-CG 3.84Å
464	L	88.6	Confident	82	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	112.2	170.9	-166.9	74.3	0	0	0	108.4	E441 L445 C452 V454 I466 L483 Y495 T500	E441-L464 HydrophobicContact CB-CD1 3.99Å; E441-L464 HydrophobicContact CG-CD1 4.05Å; L445-L464 HydrophobicContact CD1-CD2 4.23Å; L445-L464 HydrophobicContact CD2-CD2 4.39Å; C452-L464 WeakPolarHBondContact SG-CD1 3.03Å; C452-L464 VanDerWaalsContact SG-CG 3.51Å; V454-L464 HydrophobicContact CG2-CD1 3.78Å; L464-I466 HydrophobicContact CD2-CD1 4Å; L464-I466 HydrophobicContact CD2-CG1 4.46Å; L464-I466 HydrophobicContact CG-CD1 4.39Å; L464-I466 HydrophobicContact CG-CG1 4.32Å; L464-L483 HydrophobicContact CD2-CD1 4.15Å; L464-L483 HydrophobicContact CD2-CD2 3.78Å; L464-Y495 PolarHBondContact N-O 2.92Å; L464-Y495 PolarHBondContact O-N 3.44Å; L464-T500 HydrophobicContact CB-CG2 4.23Å
465	S	87.9	Confident	81	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.014	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	122.7	179.8	-175.4	0	0	0	0	110.5	S453 L493 H494	S453-S465 PolarHBondContact N-O 2.86Å; S453-S465 WeakPolarHBondContact O-CA 3.46Å; S453-S465 WeakPolarHBondContact O-CB 3.49Å; S453-S465 PolarHBondContact O-N 3.17Å; S453-S465 WeakPolarHBondContact OG-CB 3.49Å; S453-S465 PolarHBondContact OG-O 2.96Å; S465-L493 WeakPolarHBondContact CA-O 3.38Å; S465-H494 PolarHBondContact OG-CE1 2.97Å
466	I	87.4	Confident	80	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.021	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	134.7	-174.9	-56.4	178.7	0	0	0	108.2	L445 I449 L464 L483 K492 L493 Y495	L445-I466 HydrophobicContact CD1-CD1 4.29Å; L445-I466 HydrophobicContact CD2-CD1 4.47Å; I449-I466 HydrophobicContact CD1-CD1 4.24Å; I449-I466 HydrophobicContact CD1-CG2 4.31Å; I449-I466 HydrophobicContact CG1-CG2 4.43Å; I449-I466 HydrophobicContact CG2-CG2 3.56Å; L464-I466 HydrophobicContact CD2-CD1 4Å; L464-I466 HydrophobicContact CD2-CG1 4.46Å; L464-I466 HydrophobicContact CG-CD1 4.39Å; L464-I466 HydrophobicContact CG-CG1 4.32Å; I466-L483 HydrophobicContact CD1-CD1 3.95Å; I466-K492 CarbonylContact O-C 3.6Å; I466-K492 WeakPolarHBondContact O-CA 3.4Å; I466-L493 PolarHBondContact N-O 3.03Å; I466-L493 PolarHBondContact O-N 3.25Å; I466-Y495 HydrophobicContact CB-CE2 4.41Å; I466-Y495 HydrophobicContact CD1-CD2 3.88Å; I466-Y495 HydrophobicContact CD1-CE2 4.12Å; I466-Y495 HydrophobicContact CG1-CD2 4.24Å
467	P	85.1	Confident	79.2	Confident	37 Å²	37	55.4 Å²	55.4	24%	0.24	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	138.9	175.7	27.7	-34	0	0	0	110.5	P450 S451 L469	P450-P467 HydrophobicContact CG-CG 3.89Å; S451-P467 WeakPolarHBondContact O-CD 3.3Å; P467-L469 PolarHBondContact O-N 3.24Å
468	R	82.6	Confident	78.5	Confident	73 Å²	73	54.1 Å²	54.1	28%	0.275	32%	0.317	S	S	.	.	P	Polyproline II helix	trans	-63.3	122.4	175.9	-173.1	-169.9	-176.3	166.8	2.8	109.7	M472 E491 L493	R468-M472 HydrophobicContact CG-CB 4.4Å; R468-M472 VanDerWaalsContact CZ-O 3.31Å; R468-M472 PolarHBondContact NE-O 3.36Å; R468-M472 PolarHBondContact NH2-O 2.88Å; R468-E491 VanDerWaalsContact CB-O 3.23Å; R468-E491 WeakPolarHBondContact CB-O 3.4Å; R468-E491 WeakPolarHBondContact CD-OE2 3.41Å; R468-E491 PolarHBondContact N-O 2.96Å; R468-E491 IonicContact NE-OE2 3.43Å; R468-E491 IonicContact NH1-OE2 3.69Å; R468-E491 PolarHBondContact NH1-OE2 3.47Å; R468-L493 HydrophobicContact CB-CD1 4.38Å; R468-L493 HydrophobicContact CB-CG 4.49Å; R468-L493 HydrophobicContact CG-CD1 4.32Å
469	L	80.3	Confident	78	Confident	30 Å²	30	59.4 Å²	59.4	16%	0.157	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-75.9	144.5	174.6	-64.3	174.6	0	0	0	109.8	P467 S471 M472	P467-L469 PolarHBondContact O-N 3.24Å; L469-S471 PolarHBondContact O-N 3.46Å; L469-M472 HydrophobicContact CB-CG 4.29Å; L469-M472 HydrophobicContact CB-SD 4.16Å; L469-M472 HydrophobicContact CD1-CE 4.3Å; L469-M472 HydrophobicContact CG-SD 4.49Å; L469-M472 PolarHBondContact O-N 3.43Å
470	P	71.6	Confident	77.6	Confident	132 Å²	132	54.7 Å²	54.7	86%	0.857	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-18.1	177.9	-26.2	34.4	0	0	0	114.7
471	S	66.1	Low	76.9	Confident	88 Å²	88	59.7 Å²	59.7	62%	0.615	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-8.3	177.3	58.7	0	0	0	0	114.6	L469	L469-S471 PolarHBondContact O-N 3.46Å
472	M	72.4	Confident	76.3	Confident	26 Å²	26	62.6 Å²	62.6	13%	0.128	37%	0.37	C	S	.	.			trans	-101.7	93.6	-175	-65.6	173.7	160.2	0	0	110.4	R468 L469 D477 F478 I480 L493	R468-M472 HydrophobicContact CG-CB 4.4Å; R468-M472 VanDerWaalsContact CZ-O 3.31Å; R468-M472 PolarHBondContact NE-O 3.36Å; R468-M472 PolarHBondContact NH2-O 2.88Å; L469-M472 HydrophobicContact CB-CG 4.29Å; L469-M472 HydrophobicContact CB-SD 4.16Å; L469-M472 HydrophobicContact CD1-CE 4.3Å; L469-M472 HydrophobicContact CG-SD 4.49Å; L469-M472 PolarHBondContact O-N 3.43Å; M472-D477 HydrophobicContact CB-CB 4.03Å; M472-D477 WeakPolarHBondContact CE-O 3.47Å; M472-D477 HydrophobicContact CG-CB 4.16Å; M472-F478 HydrophobicContact CB-CD1 3.99Å; M472-F478 HydrophobicContact CB-CE1 3.79Å; M472-I480 HydrophobicContact CE-CD1 4.1Å; M472-I480 HydrophobicContact CE-CG1 4.34Å; M472-L493 HydrophobicContact SD-CD1 3.63Å
473	V	67.1	Low	75.9	Confident	106 Å²	106	63.4 Å²	63.4	64%	0.642	37%	0.374	S	S	*	.			trans	-110.7	-37.8	-172	-173.5	0	0	0	0	111.5	D477	V473-D477 PolarHBondContact N-OD2 3.16Å
474	E	70.2	Confident	75.6	Confident	133 Å²	133	67.1 Å²	67.1	62%	0.621	39%	0.394	S	S	*	.	S	Bend	trans	-101.8	160.4	-179.3	-60.8	-169.1	164.4	0	0	112.2	S476 D477	E474-S476 PolarHBondContact O-N 3.02Å; E474-D477 PolarHBondContact N-OD2 3.27Å; E474-D477 WeakPolarHBondContact O-CB 3.49Å; E474-D477 PolarHBondContact O-N 2.94Å
475	A	65.6	Low	75.5	Confident	77 Å²	77	70.7 Å²	70.7	64%	0.636	41%	0.41	S	S	*	.	G	3₁₀ helix	trans	-62.7	-28.6	-177.7	0	0	0	0	0	113.4	D477 F478	A475-D477 VanDerWaalsContact C-N 3.26Å; A475-D477 PolarHBondContact O-N 2.67Å; A475-F478 PolarHBondContact O-N 3.41Å
476	S	66.9	Low	75.4	Confident	73 Å²	73	74.3 Å²	74.3	51%	0.51	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-66.9	-25.4	172.7	46.3	0	0	0	0	113.1	E474 F478 E479	E474-S476 PolarHBondContact O-N 3.02Å; S476-F478 PolarHBondContact O-N 3.25Å; S476-E479 PolarHBondContact O-N 3.31Å
477	D	69.9	Low	75.3	Confident	64 Å²	64	77.3 Å²	77.3	34%	0.342	44%	0.441	S	S	.	.	G	3₁₀ helix	trans	-77	-12.4	179.7	-55.3	-32.2	0	0	0	112.2	M472 V473 E474 A475	M472-D477 HydrophobicContact CB-CB 4.03Å; M472-D477 WeakPolarHBondContact CE-O 3.47Å; M472-D477 HydrophobicContact CG-CB 4.16Å; V473-D477 PolarHBondContact N-OD2 3.16Å; E474-D477 PolarHBondContact N-OD2 3.27Å; E474-D477 WeakPolarHBondContact O-CB 3.49Å; E474-D477 PolarHBondContact O-N 2.94Å; A475-D477 VanDerWaalsContact C-N 3.26Å; A475-D477 PolarHBondContact O-N 2.67Å
478	F	72.8	Confident	75.3	Confident	24 Å²	24	78.9 Å²	78.9	11%	0.105	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-86	-11.1	177.5	-54.5	-32.5	0	0	0	112.6	M472 A475 S476 I480 F485 L493 Y495	M472-F478 HydrophobicContact CB-CD1 3.99Å; M472-F478 HydrophobicContact CB-CE1 3.79Å; A475-F478 PolarHBondContact O-N 3.41Å; S476-F478 PolarHBondContact O-N 3.25Å; F478-I480 PolarHBondContact O-N 3.3Å; F478-F485 HydrophobicContact CB-CD2 4.18Å; F478-F485 HydrophobicContact CB-CE2 4.42Å; F478-F485 HydrophobicContact CB-CG 4.37Å; F478-F485 HydrophobicContact CD2-CZ 4.32Å; F478-L493 HydrophobicContact CB-CD2 4.37Å; F478-L493 HydrophobicContact CD1-CD1 3.84Å; F478-L493 HydrophobicContact CD1-CD2 3.6Å; F478-L493 HydrophobicContact CD1-CG 4.39Å; F478-L493 HydrophobicContact CD2-CD2 4.25Å; F478-L493 HydrophobicContact CE1-CD1 4.28Å; F478-L493 HydrophobicContact CE1-CD2 3.88Å; F478-L493 HydrophobicContact CE2-CD2 4.5Å; F478-L493 HydrophobicContact CG-CD2 3.82Å; F478-L493 HydrophobicContact CZ-CD2 4.33Å; F478-Y495 WeakPolarHBondContact O-CE1 3.46Å; F478-Y495 PolarHBondContact O-OH 3.4Å
479	E	71.2	Confident	75.4	Confident	162 Å²	162	78 Å²	78	76%	0.757	45%	0.452	S	S	*	.			trans	-79.5	108.1	177.2	-65.6	-174.8	175.6	0	0	110.4	S476	S476-E479 PolarHBondContact O-N 3.31Å
480	I	74.4	Confident	75.3	Confident	42 Å²	42	84.8 Å²	84.8	22%	0.215	48%	0.483	C	S	.	.	B	Isolated β-bridge	trans	-108.1	128.7	176.9	-57.9	172.5	0	0	0	108	M472 F478 G482 L483 Y495	M472-I480 HydrophobicContact CE-CD1 4.1Å; M472-I480 HydrophobicContact CE-CG1 4.34Å; F478-I480 PolarHBondContact O-N 3.3Å; I480-G482 PolarHBondContact O-N 2.74Å; I480-G482 VanDerWaalsContact O-N 3.13Å; I480-L483 HydrophobicContact CB-CB 4.21Å; I480-L483 HydrophobicContact CB-CD1 4.06Å; I480-L483 HydrophobicContact CB-CG 4.45Å; I480-L483 HydrophobicContact CD1-CD1 4.18Å; I480-L483 HydrophobicContact CG2-CD1 3.87Å; I480-L483 HydrophobicContact CG2-CG 4.3Å; I480-L483 PolarHBondContact O-N 3.49Å; I480-Y495 HydrophobicContact CD1-CE1 4.33Å; I480-Y495 HydrophobicContact CD1-CE2 4.06Å
481	N	69.9	Low	75.8	Confident	171 Å²	171	84.1 Å²	84.1	91%	0.914	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	120	-179.1	-74.8	-39.9	0	0	0	111.6
482	G	73.3	Confident	76.6	Confident	70 Å²	70	84.6 Å²	84.6	72%	0.722	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	88	1.7	-179.8	0	0	0	0	0	115.5	I480	I480-G482 PolarHBondContact O-N 2.74Å; I480-G482 VanDerWaalsContact O-N 3.13Å
483	L	82.1	Confident	77.2	Confident	17 Å²	17	83.4 Å²	83.4	9%	0.089	45%	0.453	C	S	.	.	B	Isolated β-bridge	trans	-121.3	127.6	174.9	-63.5	-178.9	0	0	0	110.6	L445 L464 I466 I480 Y495 S497	L445-L483 HydrophobicContact CD2-CD1 3.95Å; L464-L483 HydrophobicContact CD2-CD1 4.15Å; L464-L483 HydrophobicContact CD2-CD2 3.78Å; I466-L483 HydrophobicContact CD1-CD1 3.95Å; I480-L483 HydrophobicContact CB-CB 4.21Å; I480-L483 HydrophobicContact CB-CD1 4.06Å; I480-L483 HydrophobicContact CB-CG 4.45Å; I480-L483 HydrophobicContact CD1-CD1 4.18Å; I480-L483 HydrophobicContact CG2-CD1 3.87Å; I480-L483 HydrophobicContact CG2-CG 4.3Å; I480-L483 PolarHBondContact O-N 3.49Å; L483-Y495 HydrophobicContact CB-CD1 3.75Å; L483-Y495 HydrophobicContact CB-CE1 4.46Å; L483-Y495 HydrophobicContact CB-CG 4.07Å; L483-Y495 HydrophobicContact CD1-CD1 4.49Å; L483-Y495 HydrophobicContact CD1-CD2 4.47Å; L483-Y495 HydrophobicContact CD1-CG 4.23Å; L483-S497 VanDerWaalsContact CD2-CB 3.41Å
484	D	83.1	Confident	78.1	Confident	78 Å²	78	79 Å²	79	42%	0.417	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	114.5	176.6	-61.2	-24	0	0	0	109.6	Y495 R496 K501	D484-Y495 CarbonylContact O-C 3.48Å; D484-Y495 VanDerWaalsContact O-CA 3.25Å; D484-Y495 WeakPolarHBondContact O-CA 3.16Å; D484-R496 HydrophobicContact CB-CB 4.31Å; D484-R496 PolarHBondContact N-O 3.4Å; D484-R496 PolarHBondContact O-N 3.41Å; D484-K501 VanDerWaalsContact OD2-CE 3.3Å; D484-K501 WeakPolarHBondContact OD2-CE 3.4Å; D484-K501 IonicContact OD2-NZ 3.97Å; D484-K501 PolarHBondContact OD2-NZ 3.06Å
485	F	85.6	Confident	79	Confident	75 Å²	75	72.6 Å²	72.6	33%	0.329	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	134.2	178.2	176.5	-106.3	0	0	0	111.6	F478 F487 L488 L493 Y495	F478-F485 HydrophobicContact CB-CD2 4.18Å; F478-F485 HydrophobicContact CB-CE2 4.42Å; F478-F485 HydrophobicContact CB-CG 4.37Å; F478-F485 HydrophobicContact CD2-CZ 4.32Å; F485-F487 WeakPolarHBondContact CE2-O 3.24Å; F485-F487 VanDerWaalsContact CZ-C 3.43Å; F485-L488 HydrophobicContact CZ-CB 4.32Å; F485-L493 HydrophobicContact CD2-CD2 4.26Å; F485-L493 HydrophobicContact CE2-CB 4.47Å; F485-L493 HydrophobicContact CE2-CD2 3.53Å; F485-L493 HydrophobicContact CZ-CD2 4.3Å; F485-Y495 HydrophobicContact CB-CD1 4.01Å; F485-Y495 HydrophobicContact CB-CE1 3.73Å; F485-Y495 HydrophobicContact CD2-CD1 4.34Å; F485-Y495 AromaticContact CD2-CE1 3.81Å; F485-Y495 HydrophobicContact CD2-CE1 3.81Å; F485-Y495 HydrophobicContact CG-CE1 4.26Å
486	M	85.4	Confident	80	Confident	78 Å²	78	72.8 Å²	72.8	38%	0.384	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	-61.2	178.5	-62	-82.8	73.9	0	0	112.5	L463 H494 R496	L463-M486 HydrophobicContact CD2-CG 3.98Å; M486-H494 WeakPolarHBondContact CB-O 3.37Å; M486-H494 PolarHBondContact N-O 3.23Å; M486-R496 HydrophobicContact CG-CG 4.04Å; M486-R496 HydrophobicContact SD-CG 4.06Å
487	F	86.4	Confident	80.9	Confident	67 Å²	67	69.5 Å²	69.5	29%	0.294	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.5	163.7	179.4	61.5	-89	0	0	0	111.5	I457 I460 L463 F485 H494	I457-F487 HydrophobicContact CD1-CZ 3.97Å; I460-F487 HydrophobicContact CD1-CE1 4.45Å; L463-F487 HydrophobicContact CD1-CE1 3.76Å; L463-F487 HydrophobicContact CD1-CZ 3.99Å; F485-F487 WeakPolarHBondContact CE2-O 3.24Å; F485-F487 VanDerWaalsContact CZ-C 3.43Å; F487-H494 HydrophobicContact CD1-CB 4.35Å; F487-H494 HydrophobicContact CD2-CB 4.43Å; F487-H494 AromaticContact CD2-CD2 3.58Å; F487-H494 HydrophobicContact CE1-CB 4.11Å; F487-H494 HydrophobicContact CE2-CB 4.21Å; F487-H494 AromaticContact CE2-CD2 3.19Å; F487-H494 WeakPolarHBondContact CE2-CD2 3.42Å; F487-H494 AromaticContact CE2-CG 3.69Å; F487-H494 AromaticContact CE2-NE2 3.68Å; F487-H494 HydrophobicContact CG-CB 4.49Å; F487-H494 HydrophobicContact CZ-CB 4.03Å; F487-H494 AromaticContact CZ-CD2 3.76Å; F487-H494 AromaticContact CZ-CG 3.76Å; F487-H494 PolarHBondContact O-N 3.34Å
488	L	84.9	Confident	81.6	Confident	71 Å²	71	69.6 Å²	69.6	37%	0.372	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	129.1	172.9	175.2	75.9	0	0	0	108.6	F485 L493	F485-L488 HydrophobicContact CZ-CB 4.32Å; L488-L493 HydrophobicContact CB-CD2 4.22Å; L488-L493 HydrophobicContact CD1-CD2 3.52Å; L488-L493 HydrophobicContact CD1-CG 3.9Å; L488-L493 HydrophobicContact CG-CD2 4.4Å
489	S	84.2	Confident	82.2	Confident	54 Å²	54	73.6 Å²	73.6	38%	0.378	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	133.6	173.1	-170.3	0	0	0	0	109.8	E491 K492	S489-E491 VanDerWaalsContact C-N 3.32Å; S489-E491 PolarHBondContact O-N 3.26Å; S489-K492 PolarHBondContact N-O 3.44Å; S489-K492 WeakPolarHBondContact O-CA 3.42Å; S489-K492 WeakPolarHBondContact O-CB 3.19Å; S489-K492 PolarHBondContact O-N 3.37Å
490	E	78.8	Confident	82.8	Confident	172 Å²	172	66 Å²	66	80%	0.804	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.1	46.6	175.4	-59.2	-176.7	173.3	0	0	114.8	K492	E490-K492 PolarHBondContact O-N 2.96Å
491	E	80.6	Confident	83.4	Confident	118 Å²	118	68.7 Å²	68.7	55%	0.551	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	20.2	-176.8	-57.5	-65.6	164.7	0	0	114.9	R468 S489	R468-E491 VanDerWaalsContact CB-O 3.23Å; R468-E491 WeakPolarHBondContact CB-O 3.4Å; R468-E491 WeakPolarHBondContact CD-OE2 3.41Å; R468-E491 PolarHBondContact N-O 2.96Å; R468-E491 IonicContact NE-OE2 3.43Å; R468-E491 IonicContact NH1-OE2 3.69Å; R468-E491 PolarHBondContact NH1-OE2 3.47Å; S489-E491 VanDerWaalsContact C-N 3.32Å; S489-E491 PolarHBondContact O-N 3.26Å
492	K	82.9	Confident	84.2	Confident	98 Å²	98	65 Å²	65	43%	0.426	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	129.8	171.6	-62.9	178.2	-175.8	171.3	0	110.7	I466 S489 E490 H494	I466-K492 CarbonylContact O-C 3.6Å; I466-K492 WeakPolarHBondContact O-CA 3.4Å; S489-K492 PolarHBondContact N-O 3.44Å; S489-K492 WeakPolarHBondContact O-CA 3.42Å; S489-K492 WeakPolarHBondContact O-CB 3.19Å; S489-K492 PolarHBondContact O-N 3.37Å; E490-K492 PolarHBondContact O-N 2.96Å; K492-H494 PolarHBondContact O-CD2 2.96Å
493	L	85.2	Confident	84.7	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	125.9	175.9	-65.4	162	0	0	0	108.6	S465 I466 R468 M472 F478 F485 L488 Y495	S465-L493 WeakPolarHBondContact CA-O 3.38Å; I466-L493 PolarHBondContact N-O 3.03Å; I466-L493 PolarHBondContact O-N 3.25Å; R468-L493 HydrophobicContact CB-CD1 4.38Å; R468-L493 HydrophobicContact CB-CG 4.49Å; R468-L493 HydrophobicContact CG-CD1 4.32Å; M472-L493 HydrophobicContact SD-CD1 3.63Å; F478-L493 HydrophobicContact CB-CD2 4.37Å; F478-L493 HydrophobicContact CD1-CD1 3.84Å; F478-L493 HydrophobicContact CD1-CD2 3.6Å; F478-L493 HydrophobicContact CD1-CG 4.39Å; F478-L493 HydrophobicContact CD2-CD2 4.25Å; F478-L493 HydrophobicContact CE1-CD1 4.28Å; F478-L493 HydrophobicContact CE1-CD2 3.88Å; F478-L493 HydrophobicContact CE2-CD2 4.5Å; F478-L493 HydrophobicContact CG-CD2 3.82Å; F478-L493 HydrophobicContact CZ-CD2 4.33Å; F485-L493 HydrophobicContact CD2-CD2 4.26Å; F485-L493 HydrophobicContact CE2-CB 4.47Å; F485-L493 HydrophobicContact CE2-CD2 3.53Å; F485-L493 HydrophobicContact CZ-CD2 4.3Å; L488-L493 HydrophobicContact CB-CD2 4.22Å; L488-L493 HydrophobicContact CD1-CD2 3.52Å; L488-L493 HydrophobicContact CD1-CG 3.9Å; L488-L493 HydrophobicContact CG-CD2 4.4Å; L493-Y495 HydrophobicContact CB-CD2 4.2Å; L493-Y495 HydrophobicContact CB-CE2 3.35Å; L493-Y495 HydrophobicContact CD1-CE2 4.41Å; L493-Y495 HydrophobicContact CG-CE2 4.44Å
494	H	87.7	Confident	84.9	Confident	13 Å²	13	63.4 Å²	63.4	6%	0.06	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	125.8	179.6	-61.6	-86.3	0	0	0	110.5	I455 L463 S465 M486 F487 K492	I455-H494 VanDerWaalsContact CD1-CE1 3.4Å; I455-H494 WeakPolarHBondContact CD1-CE1 3.27Å; I455-H494 WeakPolarHBondContact CD1-ND1 3.41Å; L463-H494 HydrophobicContact CD1-CB 4.29Å; S465-H494 PolarHBondContact OG-CE1 2.97Å; M486-H494 WeakPolarHBondContact CB-O 3.37Å; M486-H494 PolarHBondContact N-O 3.23Å; F487-H494 HydrophobicContact CD1-CB 4.35Å; F487-H494 HydrophobicContact CD2-CB 4.43Å; F487-H494 AromaticContact CD2-CD2 3.58Å; F487-H494 HydrophobicContact CE1-CB 4.11Å; F487-H494 HydrophobicContact CE2-CB 4.21Å; F487-H494 AromaticContact CE2-CD2 3.19Å; F487-H494 WeakPolarHBondContact CE2-CD2 3.42Å; F487-H494 AromaticContact CE2-CG 3.69Å; F487-H494 AromaticContact CE2-NE2 3.68Å; F487-H494 HydrophobicContact CG-CB 4.49Å; F487-H494 HydrophobicContact CZ-CB 4.03Å; F487-H494 AromaticContact CZ-CD2 3.76Å; F487-H494 AromaticContact CZ-CG 3.76Å; F487-H494 PolarHBondContact O-N 3.34Å; K492-H494 PolarHBondContact O-CD2 2.96Å
495	Y	87.3	Confident	85	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	157.2	-175.5	-65.2	-83.7	0	0	0	112	L463 L464 I466 F478 I480 L483 D484 F485 L493	L463-Y495 WeakPolarHBondContact CA-O 3.49Å; L464-Y495 PolarHBondContact N-O 2.92Å; L464-Y495 PolarHBondContact O-N 3.44Å; I466-Y495 HydrophobicContact CB-CE2 4.41Å; I466-Y495 HydrophobicContact CD1-CD2 3.88Å; I466-Y495 HydrophobicContact CD1-CE2 4.12Å; I466-Y495 HydrophobicContact CG1-CD2 4.24Å; F478-Y495 WeakPolarHBondContact O-CE1 3.46Å; F478-Y495 PolarHBondContact O-OH 3.4Å; I480-Y495 HydrophobicContact CD1-CE1 4.33Å; I480-Y495 HydrophobicContact CD1-CE2 4.06Å; L483-Y495 HydrophobicContact CB-CD1 3.75Å; L483-Y495 HydrophobicContact CB-CE1 4.46Å; L483-Y495 HydrophobicContact CB-CG 4.07Å; L483-Y495 HydrophobicContact CD1-CD1 4.49Å; L483-Y495 HydrophobicContact CD1-CD2 4.47Å; L483-Y495 HydrophobicContact CD1-CG 4.23Å; D484-Y495 CarbonylContact O-C 3.48Å; D484-Y495 VanDerWaalsContact O-CA 3.25Å; D484-Y495 WeakPolarHBondContact O-CA 3.16Å; F485-Y495 HydrophobicContact CB-CD1 4.01Å; F485-Y495 HydrophobicContact CB-CE1 3.73Å; F485-Y495 HydrophobicContact CD2-CD1 4.34Å; F485-Y495 AromaticContact CD2-CE1 3.81Å; F485-Y495 HydrophobicContact CD2-CE1 3.81Å; F485-Y495 HydrophobicContact CG-CE1 4.26Å; L493-Y495 HydrophobicContact CB-CD2 4.2Å; L493-Y495 HydrophobicContact CB-CE2 3.35Å; L493-Y495 HydrophobicContact CD1-CE2 4.41Å; L493-Y495 HydrophobicContact CG-CE2 4.44Å
496	R	87.1	Confident	84.8	Confident	81 Å²	81	66.9 Å²	66.9	31%	0.306	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119.9	160.5	-73.3	-178	172	165	-2.3	109.7	I460 L463 D484 M486 T500	I460-R496 PolarHBondContact O-NH2 3.43Å; L463-R496 HydrophobicContact CD2-CG 3.84Å; D484-R496 HydrophobicContact CB-CB 4.31Å; D484-R496 PolarHBondContact N-O 3.4Å; D484-R496 PolarHBondContact O-N 3.41Å; M486-R496 HydrophobicContact CG-CG 4.04Å; M486-R496 HydrophobicContact SD-CG 4.06Å; R496-T500 WeakPolarHBondContact CA-OG1 3.26Å
497	S	86.9	Confident	84.6	Confident	4 Å²	4	65.1 Å²	65.1	3%	0.028	33%	0.333	C	S	.	.			trans	-94.1	167.7	170.7	84.2	0	0	0	0	110.6	E441 L483 R499 T500 K501	E441-S497 WeakPolarHBondContact OE2-CB 3.46Å; E441-S497 PolarHBondContact OE2-OG 2.95Å; L483-S497 VanDerWaalsContact CD2-CB 3.41Å; S497-R499 PolarHBondContact O-N 3.48Å; S497-R499 PolarHBondContact OG-N 3.25Å; S497-T500 PolarHBondContact N-OG1 3.38Å; S497-T500 PolarHBondContact O-N 2.92Å; S497-T500 PolarHBondContact O-OG1 3.21Å; S497-T500 VanDerWaalsContact O-OG1 3.09Å; S497-T500 PolarHBondContact OG-N 3.22Å; S497-K501 WeakPolarHBondContact O-CG 3.42Å; S497-K501 PolarHBondContact O-N 3.07Å
498	A	85.1	Confident	84.5	Confident	65 Å²	65	63.1 Å²	63.1	54%	0.537	33%	0.331	S	S	.	.	H	α-helix	trans	-55.2	-37.1	172.2	0	0	0	0	0	111.5	K501 E502	A498-K501 PolarHBondContact O-N 3.48Å; A498-E502 WeakPolarHBondContact O-CG 3.19Å; A498-E502 PolarHBondContact O-N 3.03Å
499	R	84.1	Confident	84.5	Confident	109 Å²	109	61.3 Å²	61.3	41%	0.411	32%	0.322	S	S	.	.	H	α-helix	trans	-74.1	-36.3	-179.7	-66.5	-74.5	-73	175.9	-4.2	112.3	E441 S497 K501 E502 L503	E441-R499 WeakPolarHBondContact OE1-CB 3.4Å; E441-R499 WeakPolarHBondContact OE1-CG 3.3Å; S497-R499 PolarHBondContact O-N 3.48Å; S497-R499 PolarHBondContact OG-N 3.25Å; R499-K501 VanDerWaalsContact C-N 3.33Å; R499-E502 WeakPolarHBondContact CD-OE2 3.49Å; R499-E502 IonicContact CZ-OE2 3.09Å; R499-E502 IonicContact NE-OE2 3.74Å; R499-E502 IonicContact NH1-OE2 2.74Å; R499-E502 PolarHBondContact NH1-OE2 2.9Å; R499-E502 PolarHBondContact O-N 2.99Å; R499-L503 VanDerWaalsContact O-CG 3.28Å; R499-L503 WeakPolarHBondContact O-CG 3.44Å; R499-L503 PolarHBondContact O-N 2.91Å
500	T	85	Confident	84.5	Confident	1 Å²	1	59 Å²	59	1%	0.006	31%	0.306	C	S	.	.	H	α-helix	trans	-68.4	-33.9	173.4	69.7	0	0	0	0	112	F462 L464 R496 S497 L503 D504	F462-T500 VanDerWaalsContact O-CB 3.31Å; F462-T500 WeakPolarHBondContact O-CB 3.5Å; F462-T500 PolarHBondContact O-OG1 2.95Å; L464-T500 HydrophobicContact CB-CG2 4.23Å; R496-T500 WeakPolarHBondContact CA-OG1 3.26Å; S497-T500 PolarHBondContact N-OG1 3.38Å; S497-T500 PolarHBondContact O-N 2.92Å; S497-T500 PolarHBondContact O-OG1 3.21Å; S497-T500 VanDerWaalsContact O-OG1 3.09Å; S497-T500 PolarHBondContact OG-N 3.22Å; T500-L503 PolarHBondContact O-N 3.46Å; T500-D504 PolarHBondContact O-N 2.98Å
501	K	85.2	Confident	84.8	Confident	100 Å²	100	54.1 Å²	54.1	44%	0.435	28%	0.283	S	S	.	.	H	α-helix	trans	-66.1	-39	172	-68.6	176.3	-177.5	175.5	0	112.7	D484 S497 A498 R499 L503 D504 A505	D484-K501 VanDerWaalsContact OD2-CE 3.3Å; D484-K501 WeakPolarHBondContact OD2-CE 3.4Å; D484-K501 IonicContact OD2-NZ 3.97Å; D484-K501 PolarHBondContact OD2-NZ 3.06Å; S497-K501 WeakPolarHBondContact O-CG 3.42Å; S497-K501 PolarHBondContact O-N 3.07Å; A498-K501 PolarHBondContact O-N 3.48Å; R499-K501 VanDerWaalsContact C-N 3.33Å; K501-L503 VanDerWaalsContact C-N 3.33Å; K501-D504 PolarHBondContact O-N 3.08Å; K501-A505 PolarHBondContact O-N 3.44Å; K501-A505 VanDerWaalsContact O-N 3.08Å
502	E	87.1	Confident	85.1	Confident	93 Å²	93	49 Å²	49	44%	0.435	26%	0.26	S	S	.	.	H	α-helix	trans	-62.1	-41.8	171.8	-75.8	173.7	-169.6	0	0	111.4	A498 R499 A505 L506	A498-E502 WeakPolarHBondContact O-CG 3.19Å; A498-E502 PolarHBondContact O-N 3.03Å; R499-E502 WeakPolarHBondContact CD-OE2 3.49Å; R499-E502 IonicContact CZ-OE2 3.09Å; R499-E502 IonicContact NE-OE2 3.74Å; R499-E502 IonicContact NH1-OE2 2.74Å; R499-E502 PolarHBondContact NH1-OE2 2.9Å; R499-E502 PolarHBondContact O-N 2.99Å; E502-A505 PolarHBondContact O-N 2.81Å; E502-L506 WeakPolarHBondContact O-CB 3.32Å; E502-L506 VanDerWaalsContact O-CG 3.3Å; E502-L506 WeakPolarHBondContact O-CG 3.42Å; E502-L506 PolarHBondContact O-N 2.72Å
503	L	84.6	Confident	85.3	Confident	14 Å²	14	48.2 Å²	48.2	7%	0.073	26%	0.258	C	S	.	.	H	α-helix	trans	-64.6	-42.7	176.9	-71.4	175.8	0	0	0	112.2	F433 L434 V437 F462 R499 T500 K501 A505 L506 L507	F433-L503 HydrophobicContact CE1-CD2 3.67Å; F433-L503 HydrophobicContact CZ-CD2 4.13Å; L434-L503 HydrophobicContact CD2-CD1 4.36Å; V437-L503 HydrophobicContact CG1-CD1 4.12Å; F462-L503 HydrophobicContact CB-CB 4.31Å; F462-L503 HydrophobicContact CD2-CB 3.71Å; F462-L503 HydrophobicContact CE2-CB 4.24Å; F462-L503 HydrophobicContact CG-CB 3.97Å; F462-L503 HydrophobicContact CG-CD1 4.48Å; R499-L503 VanDerWaalsContact O-CG 3.28Å; R499-L503 WeakPolarHBondContact O-CG 3.44Å; R499-L503 PolarHBondContact O-N 2.91Å; T500-L503 PolarHBondContact O-N 3.46Å; K501-L503 VanDerWaalsContact C-N 3.33Å; L503-A505 VanDerWaalsContact C-N 3.29Å; L503-A505 PolarHBondContact O-N 3.49Å; L503-L506 PolarHBondContact O-N 3Å; L503-L507 HydrophobicContact CD2-CD1 4.16Å; L503-L507 WeakPolarHBondContact O-CB 3.19Å; L503-L507 PolarHBondContact O-N 3.28Å
504	D	85.6	Confident	85.4	Confident	40 Å²	40	48.3 Å²	48.3	21%	0.214	26%	0.258	C	S	.	.	H	α-helix	trans	-59.2	-40.9	173.7	-76.9	-31.8	0	0	0	111.3	G461 F462 T500 K501 G508	G461-D504 WeakPolarHBondContact CA-OD1 3.49Å; F462-D504 WeakPolarHBondContact CD2-OD1 3.38Å; F462-D504 PolarHBondContact N-OD1 3.25Å; T500-D504 PolarHBondContact O-N 2.98Å; K501-D504 PolarHBondContact O-N 3.08Å; D504-G508 VanDerWaalsContact O-CA 3.25Å; D504-G508 WeakPolarHBondContact O-CA 3.3Å; D504-G508 PolarHBondContact O-N 3.45Å
505	A	84.8	Confident	85.4	Confident	89 Å²	89	52.6 Å²	52.6	74%	0.736	27%	0.274	S	S	*	.	H	α-helix	trans	-71.8	-32.4	179.2	0	0	0	0	0	113.7	K501 E502 L503	K501-A505 PolarHBondContact O-N 3.44Å; K501-A505 VanDerWaalsContact O-N 3.08Å; E502-A505 PolarHBondContact O-N 2.81Å; L503-A505 VanDerWaalsContact C-N 3.29Å; L503-A505 PolarHBondContact O-N 3.49Å
506	L	82.9	Confident	85.4	Confident	136 Å²	136	56.8 Å²	56.8	71%	0.712	30%	0.296	S	S	*	.	H	α-helix	trans	-87.5	-41.4	-176.6	-75.2	168.6	0	0	0	113.5	E502 L503	E502-L506 WeakPolarHBondContact O-CB 3.32Å; E502-L506 VanDerWaalsContact O-CG 3.3Å; E502-L506 WeakPolarHBondContact O-CG 3.42Å; E502-L506 PolarHBondContact O-N 2.72Å; L503-L506 PolarHBondContact O-N 3Å
507	L	80.4	Confident	85.5	Confident	41 Å²	41	54.8 Å²	54.8	22%	0.215	29%	0.29	C	S	.	.	H	α-helix	trans	-101	-26.6	-174.4	-64.8	175.7	0	0	0	112.5	L430 F433 F462 L503 L510	L430-L507 HydrophobicContact CD1-CD1 3.91Å; F433-L507 HydrophobicContact CE1-CD1 4.37Å; F462-L507 HydrophobicContact CE2-CB 3.95Å; F462-L507 HydrophobicContact CE2-CD1 4.19Å; F462-L507 HydrophobicContact CZ-CB 4.15Å; F462-L507 HydrophobicContact CZ-CD1 3.81Å; L503-L507 HydrophobicContact CD2-CD1 4.16Å; L503-L507 WeakPolarHBondContact O-CB 3.19Å; L503-L507 PolarHBondContact O-N 3.28Å; L507-L510 WeakPolarHBondContact O-CD2 3.29Å; L507-L510 WeakPolarHBondContact O-CG 3.39Å
508	G	83.9	Confident	85.6	Confident	25 Å²	25	54.6 Å²	54.6	26%	0.258	29%	0.289	S	S	.	.			trans	61.7	-159.4	-177.3	0	0	0	0	0	113.1	D504 L510	D504-G508 VanDerWaalsContact O-CA 3.25Å; D504-G508 WeakPolarHBondContact O-CA 3.3Å; D504-G508 PolarHBondContact O-N 3.45Å; G508-L510 PolarHBondContact O-N 3.44Å
509	D	85.4	Confident	85.7	Confident	34 Å²	34	54.7 Å²	54.7	18%	0.182	28%	0.283	C	S	.	.			trans	-95.6	77	176.5	-163.7	-27.8	0	0	0	110.3	Y456 L459 H511 C512 E513	Y456-D509 PolarHBondContact OH-OD1 3.24Å; L459-D509 WeakPolarHBondContact CA-OD2 3.19Å; L459-D509 PolarHBondContact N-OD2 3.21Å; D509-H511 PolarHBondContact O-N 2.82Å; D509-H511 PolarHBondContact OD1-N 2.79Å; D509-C512 HydrophobicContact CB-CB 4.07Å; D509-C512 VanDerWaalsContact CG-SG 3.57Å; D509-C512 PolarHBondContact O-N 3.45Å; D509-C512 WeakPolarHBondContact OD1-CB 3.46Å; D509-C512 PolarHBondContact OD1-N 2.96Å; D509-C512 PolarHBondContact OD2-SG 3.42Å; D509-C512 VanDerWaalsContact OD2-SG 3.35Å; D509-E513 WeakPolarHBondContact O-CG 3.37Å; D509-E513 PolarHBondContact O-N 3.1Å
510	L	83.6	Confident	85.9	Confident	6 Å²	6	54.3 Å²	54.3	3%	0.031	29%	0.289	C	S	.	.	H	α-helix	trans	-55.7	-36.1	-178.9	-66.2	174.7	0	0	0	112.3	K423 R426 Y456 L507 G508 I514	K423-L510 HydrophobicContact CG-CD2 4.46Å; R426-L510 HydrophobicContact CB-CD1 4.24Å; Y456-L510 PolarHBondContact OH-N 2.63Å; L507-L510 WeakPolarHBondContact O-CD2 3.29Å; L507-L510 WeakPolarHBondContact O-CG 3.39Å; G508-L510 PolarHBondContact O-N 3.44Å; L510-I514 WeakPolarHBondContact O-CB 3.45Å; L510-I514 WeakPolarHBondContact O-CD1 3.36Å; L510-I514 WeakPolarHBondContact O-CG1 3.37Å; L510-I514 PolarHBondContact O-N 3.14Å
511	H	85.3	Confident	86.1	Confident	69 Å²	69	55.6 Å²	55.6	32%	0.319	30%	0.295	S	S	.	.	H	α-helix	trans	-68.8	-44.2	-179.8	-171.2	-74.8	0	0	0	111.7	Y456 P458 D509 R515	Y456-H511 HydrophobicContact CE1-CB 4.04Å; Y456-H511 VanDerWaalsContact OH-CB 3.26Å; Y456-H511 WeakPolarHBondContact OH-CB 3.42Å; Y456-H511 PolarHBondContact OH-N 3.34Å; Y456-H511 VanDerWaalsContact OH-N 3.1Å; P458-H511 HydrophobicContact CG-CB 4.22Å; D509-H511 PolarHBondContact O-N 2.82Å; D509-H511 PolarHBondContact OD1-N 2.79Å; H511-R515 WeakPolarHBondContact O-CB 3.39Å; H511-R515 PolarHBondContact O-N 3.21Å; H511-R515 VanDerWaalsContact O-N 3.1Å
512	C	86.3	Confident	86.2	Confident	11 Å²	11	51.9 Å²	51.9	7%	0.074	28%	0.28	C	S	.	.	H	α-helix	trans	-65.5	-42.7	174.3	-76.2	0	0	0	0	111.9	D509 I514 R515 D516	D509-C512 HydrophobicContact CB-CB 4.07Å; D509-C512 VanDerWaalsContact CG-SG 3.57Å; D509-C512 PolarHBondContact O-N 3.45Å; D509-C512 WeakPolarHBondContact OD1-CB 3.46Å; D509-C512 PolarHBondContact OD1-N 2.96Å; D509-C512 PolarHBondContact OD2-SG 3.42Å; D509-C512 VanDerWaalsContact OD2-SG 3.35Å; C512-I514 PolarHBondContact O-N 3.01Å; C512-R515 PolarHBondContact O-N 3Å; C512-D516 WeakPolarHBondContact O-CB 3.43Å; C512-D516 PolarHBondContact O-N 2.83Å
513	E	87.1	Confident	86.2	Confident	80 Å²	80	53.4 Å²	53.4	37%	0.374	28%	0.282	S	S	.	.	H	α-helix	trans	-62.6	-44.3	178.6	-72.9	-176.2	-161.7	0	0	113	K423 D509 R515 D516 Q517	K423-E513 HydrophobicContact CD-CB 4.35Å; K423-E513 VanDerWaalsContact CE-OE2 3.32Å; K423-E513 WeakPolarHBondContact CE-OE2 3.27Å; K423-E513 IonicContact NZ-OE2 3.99Å; K423-E513 PolarHBondContact NZ-OE2 2.83Å; D509-E513 WeakPolarHBondContact O-CG 3.37Å; D509-E513 PolarHBondContact O-N 3.1Å; E513-R515 VanDerWaalsContact C-N 3.32Å; E513-R515 PolarHBondContact O-N 3.46Å; E513-D516 PolarHBondContact O-N 3.2Å; E513-Q517 WeakPolarHBondContact O-CB 3.37Å; E513-Q517 WeakPolarHBondContact O-CG 3.45Å; E513-Q517 PolarHBondContact O-N 2.81Å
514	I	88.2	Confident	86.4	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.021	30%	0.3	C	S	.	.	H	α-helix	trans	-59.5	-47	175.2	-71	163.6	0	0	0	109.6	I420 K423 K424 L427 L510 C512 D516 Q517 E518	I420-I514 HydrophobicContact CG2-CG2 4.47Å; K423-I514 HydrophobicContact CB-CD1 3.89Å; K423-I514 HydrophobicContact CB-CG1 3.6Å; K423-I514 HydrophobicContact CD-CG1 4.33Å; K424-I514 HydrophobicContact CG-CD1 4.16Å; K424-I514 HydrophobicContact CG-CG2 4.36Å; L427-I514 HydrophobicContact CB-CD1 4.37Å; L427-I514 HydrophobicContact CD2-CD1 4.02Å; L510-I514 WeakPolarHBondContact O-CB 3.45Å; L510-I514 WeakPolarHBondContact O-CD1 3.36Å; L510-I514 WeakPolarHBondContact O-CG1 3.37Å; L510-I514 PolarHBondContact O-N 3.14Å; C512-I514 PolarHBondContact O-N 3.01Å; I514-D516 VanDerWaalsContact C-N 3.35Å; I514-D516 PolarHBondContact O-N 2.9Å; I514-Q517 PolarHBondContact O-N 3.34Å; I514-E518 HydrophobicContact CG2-CG 4.3Å; I514-E518 WeakPolarHBondContact CG2-OE2 3.49Å; I514-E518 WeakPolarHBondContact O-CB 3.29Å; I514-E518 WeakPolarHBondContact O-CG 3.45Å; I514-E518 PolarHBondContact O-N 3.44Å
515	R	87.4	Confident	86.5	Confident	102 Å²	102	55.5 Å²	55.5	39%	0.385	29%	0.291	S	S	.	.	H	α-helix	trans	-60.7	-44.8	-179.9	-177.1	-165.6	66.3	-162.2	-4.6	111.7	H511 C512 E513 E518 T519	H511-R515 WeakPolarHBondContact O-CB 3.39Å; H511-R515 PolarHBondContact O-N 3.21Å; H511-R515 VanDerWaalsContact O-N 3.1Å; C512-R515 PolarHBondContact O-N 3Å; E513-R515 VanDerWaalsContact C-N 3.32Å; E513-R515 PolarHBondContact O-N 3.46Å; R515-E518 PolarHBondContact O-N 3.36Å; R515-T519 VanDerWaalsContact O-CB 3.32Å; R515-T519 WeakPolarHBondContact O-CB 3.48Å; R515-T519 PolarHBondContact O-N 2.71Å; R515-T519 PolarHBondContact O-OG1 2.7Å
516	D	87.9	Confident	86.7	Confident	88 Å²	88	51.4 Å²	51.4	47%	0.471	26%	0.257	S	S	.	.	H	α-helix	trans	-69.1	-38.2	-176.7	-64.2	-6.3	0	0	0	110.6	C512 E513 I514 T519 L520	C512-D516 WeakPolarHBondContact O-CB 3.43Å; C512-D516 PolarHBondContact O-N 2.83Å; E513-D516 PolarHBondContact O-N 3.2Å; I514-D516 VanDerWaalsContact C-N 3.35Å; I514-D516 PolarHBondContact O-N 2.9Å; D516-T519 PolarHBondContact O-N 2.94Å; D516-L520 PolarHBondContact O-N 3.47Å
517	Q	88.4	Confident	86.7	Confident	39 Å²	39	47.5 Å²	47.5	18%	0.182	24%	0.24	C	C	.	.	H	α-helix	trans	-67.6	-42.9	173	-72.1	-178.5	-55.4	0	0	112.7	E419 I420 E513 I514 T519 L520 L521	E419-Q517 PolarHBondContact OE2-NE2 2.89Å; I420-Q517 HydrophobicContact CD1-CB 3.88Å; I420-Q517 HydrophobicContact CG1-CB 3.89Å; E513-Q517 WeakPolarHBondContact O-CB 3.37Å; E513-Q517 WeakPolarHBondContact O-CG 3.45Å; E513-Q517 PolarHBondContact O-N 2.81Å; I514-Q517 PolarHBondContact O-N 3.34Å; Q517-T519 VanDerWaalsContact C-N 3.29Å; Q517-T519 PolarHBondContact O-N 3.37Å; Q517-L520 WeakPolarHBondContact O-CB 3.46Å; Q517-L520 PolarHBondContact O-N 3.23Å; Q517-L521 PolarHBondContact O-N 3Å
518	E	89.6	Confident	87	Confident	1 Å²	1	50 Å²	50	1%	0.005	25%	0.25	C	S	.	.	H	α-helix	trans	-64.4	-35.7	175	-73.4	-175.7	130.2	0	0	111.7	R409 T411 V412 I420 K424 I514 R515 L521 M522	R409-E518 IonicContact CZ-OE2 2.76Å; R409-E518 VanDerWaalsContact CZ-OE2 3.23Å; R409-E518 IonicContact NH1-OE2 2.73Å; R409-E518 PolarHBondContact NH1-OE2 3.3Å; R409-E518 IonicContact NH2-OE2 3.43Å; R409-E518 PolarHBondContact NH2-OE2 2.7Å; T411-E518 WeakPolarHBondContact CA-OE1 3.32Å; V412-E518 HydrophobicContact CB-CG 4.49Å; V412-E518 HydrophobicContact CG2-CB 4.39Å; V412-E518 HydrophobicContact CG2-CG 4.01Å; V412-E518 PolarHBondContact N-OE1 3.43Å; I420-E518 HydrophobicContact CD1-CG 4.02Å; I420-E518 HydrophobicContact CG2-CG 4.24Å; K424-E518 WeakPolarHBondContact CE-OE1 3.43Å; K424-E518 IonicContact NZ-OE1 2.67Å; K424-E518 PolarHBondContact NZ-OE1 2.94Å; I514-E518 HydrophobicContact CG2-CG 4.3Å; I514-E518 WeakPolarHBondContact CG2-OE2 3.49Å; I514-E518 WeakPolarHBondContact O-CB 3.29Å; I514-E518 WeakPolarHBondContact O-CG 3.45Å; I514-E518 PolarHBondContact O-N 3.44Å; R515-E518 PolarHBondContact O-N 3.36Å; E518-L521 PolarHBondContact O-N 2.96Å; E518-M522 WeakPolarHBondContact O-CB 3.43Å; E518-M522 PolarHBondContact O-N 3.11Å
519	T	87.5	Confident	87.2	Confident	67 Å²	67	48.8 Å²	48.8	41%	0.411	24%	0.238	S	C	.	.	H	α-helix	trans	-66.3	-38.9	173.8	-56.8	0	0	0	0	111.4	R515 D516 Q517 M522 Y523	R515-T519 VanDerWaalsContact O-CB 3.32Å; R515-T519 WeakPolarHBondContact O-CB 3.48Å; R515-T519 PolarHBondContact O-N 2.71Å; R515-T519 PolarHBondContact O-OG1 2.7Å; D516-T519 PolarHBondContact O-N 2.94Å; Q517-T519 VanDerWaalsContact C-N 3.29Å; Q517-T519 PolarHBondContact O-N 3.37Å; T519-M522 HydrophobicContact CG2-CE 4.17Å; T519-M522 WeakPolarHBondContact O-CB 3.34Å; T519-M522 PolarHBondContact O-N 3.5Å; T519-Y523 PolarHBondContact O-N 3.19Å
520	L	88	Confident	87.1	Confident	100 Å²	100	48.4 Å²	48.4	52%	0.524	24%	0.236	S	C	.	.	H	α-helix	trans	-63.6	-44.8	174.8	-177.2	66.7	0	0	0	111.6	D516 Q517 M522 Y523 Q524	D516-L520 PolarHBondContact O-N 3.47Å; Q517-L520 WeakPolarHBondContact O-CB 3.46Å; Q517-L520 PolarHBondContact O-N 3.23Å; L520-M522 VanDerWaalsContact C-N 3.35Å; L520-Y523 PolarHBondContact O-N 2.78Å; L520-Q524 WeakPolarHBondContact O-CG 3.44Å; L520-Q524 PolarHBondContact O-N 3.32Å
521	L	88.3	Confident	87	Confident	28 Å²	28	51.3 Å²	51.3	15%	0.147	26%	0.261	C	S	.	.	H	α-helix	trans	-64.2	-39.9	175.3	-73.6	177.7	0	0	0	111.9	V412 D417 I420 Q517 E518 Y523 Q524 L525	V412-L521 HydrophobicContact CG1-CD1 4.25Å; V412-L521 HydrophobicContact CG2-CB 4.39Å; V412-L521 HydrophobicContact CG2-CD1 3.99Å; D417-L521 HydrophobicContact CB-CD1 4.06Å; I420-L521 HydrophobicContact CD1-CD1 3.34Å; I420-L521 HydrophobicContact CD1-CG 4.34Å; Q517-L521 PolarHBondContact O-N 3Å; E518-L521 PolarHBondContact O-N 2.96Å; L521-Y523 VanDerWaalsContact C-N 3.33Å; L521-Y523 PolarHBondContact O-N 3.32Å; L521-Q524 PolarHBondContact O-N 3.2Å; L521-L525 WeakPolarHBondContact O-CB 3.34Å; L521-L525 PolarHBondContact O-N 3.19Å
522	M	88.6	Confident	86.9	Confident	23 Å²	23	51.6 Å²	51.6	11%	0.113	26%	0.259	C	S	.	.	H	α-helix	trans	-57.2	-47.7	172.9	-174.6	-175.9	63.9	0	0	110.7	W350 F410 E518 T519 L520 L525 Q526	W350-M522 HydrophobicContact CZ2-CG 3.89Å; F410-M522 HydrophobicContact CB-CG 4.46Å; F410-M522 HydrophobicContact CB-SD 3.74Å; F410-M522 HydrophobicContact CD1-CB 3.65Å; F410-M522 HydrophobicContact CD1-CG 4.08Å; F410-M522 HydrophobicContact CD1-SD 4.41Å; F410-M522 HydrophobicContact CD2-CB 4.34Å; F410-M522 HydrophobicContact CD2-CG 3.87Å; F410-M522 HydrophobicContact CD2-SD 4.01Å; F410-M522 HydrophobicContact CE1-CB 3.66Å; F410-M522 HydrophobicContact CE1-CG 4.22Å; F410-M522 HydrophobicContact CE2-CB 4.35Å; F410-M522 HydrophobicContact CE2-CG 4.02Å; F410-M522 HydrophobicContact CG-CB 3.99Å; F410-M522 HydrophobicContact CG-CG 3.89Å; F410-M522 HydrophobicContact CG-SD 3.82Å; F410-M522 HydrophobicContact CZ-CB 4.03Å; F410-M522 HydrophobicContact CZ-CG 4.19Å; E518-M522 WeakPolarHBondContact O-CB 3.43Å; E518-M522 PolarHBondContact O-N 3.11Å; T519-M522 HydrophobicContact CG2-CE 4.17Å; T519-M522 WeakPolarHBondContact O-CB 3.34Å; T519-M522 PolarHBondContact O-N 3.5Å; L520-M522 VanDerWaalsContact C-N 3.35Å; M522-L525 WeakPolarHBondContact O-CB 3.38Å; M522-L525 PolarHBondContact O-N 3.48Å; M522-Q526 VanDerWaalsContact O-CG 3.3Å; M522-Q526 WeakPolarHBondContact O-CG 3.3Å; M522-Q526 PolarHBondContact O-N 3.04Å
523	Y	86.8	Confident	86.7	Confident	124 Å²	124	51.4 Å²	51.4	49%	0.486	26%	0.259	S	S	.	.	H	α-helix	trans	-61.9	-44.3	178.1	178.4	-103.2	0	0	0	112.2	T519 L520 L521 L525 Q526 C527	T519-Y523 PolarHBondContact O-N 3.19Å; L520-Y523 PolarHBondContact O-N 2.78Å; L521-Y523 VanDerWaalsContact C-N 3.33Å; L521-Y523 PolarHBondContact O-N 3.32Å; Y523-L525 VanDerWaalsContact C-N 3.31Å; Y523-L525 PolarHBondContact O-N 3.43Å; Y523-Q526 WeakPolarHBondContact O-CB 3.33Å; Y523-Q526 PolarHBondContact O-N 2.95Å; Y523-C527 PolarHBondContact O-N 2.97Å; Y523-C527 PolarHBondContact O-SG 3.31Å; Y523-C527 VanDerWaalsContact O-SG 3.38Å
524	Q	87.4	Confident	86.3	Confident	93 Å²	93	50.7 Å²	50.7	44%	0.435	27%	0.266	S	S	.	.	H	α-helix	trans	-59.8	-42.1	175.2	-70.6	176.2	4.1	0	0	112	L520 L521 C527 Q528	L520-Q524 WeakPolarHBondContact O-CG 3.44Å; L520-Q524 PolarHBondContact O-N 3.32Å; L521-Q524 PolarHBondContact O-N 3.2Å; Q524-C527 PolarHBondContact O-N 2.91Å; Q524-Q528 WeakPolarHBondContact O-CG 3.27Å; Q524-Q528 PolarHBondContact O-N 2.89Å; Q524-Q528 VanDerWaalsContact O-N 3.16Å
525	L	88.7	Confident	86.2	Confident	6 Å²	6	51.6 Å²	51.6	3%	0.031	27%	0.272	C	S	.	.	H	α-helix	trans	-63.7	-42.9	175.5	-176.5	64.4	0	0	0	111.3	W350 L394 V398 V399 F410 L521 M522 Y523 C527 Q528 V529	W350-L525 HydrophobicContact CE3-CD2 4.18Å; W350-L525 HydrophobicContact CH2-CB 4.18Å; W350-L525 HydrophobicContact CH2-CD2 3.66Å; W350-L525 HydrophobicContact CH2-CG 3.69Å; W350-L525 HydrophobicContact CZ2-CD2 4.38Å; W350-L525 HydrophobicContact CZ3-CD2 3.54Å; W350-L525 HydrophobicContact CZ3-CG 3.78Å; L394-L525 HydrophobicContact CB-CD1 4.05Å; V398-L525 HydrophobicContact CB-CD2 4.31Å; V398-L525 HydrophobicContact CG1-CD2 4.12Å; V399-L525 HydrophobicContact CG2-CD2 3.73Å; F410-L525 HydrophobicContact CE2-CD2 4.43Å; F410-L525 HydrophobicContact CZ-CD2 4.16Å; L521-L525 WeakPolarHBondContact O-CB 3.34Å; L521-L525 PolarHBondContact O-N 3.19Å; M522-L525 WeakPolarHBondContact O-CB 3.38Å; M522-L525 PolarHBondContact O-N 3.48Å; Y523-L525 VanDerWaalsContact C-N 3.31Å; Y523-L525 PolarHBondContact O-N 3.43Å; L525-C527 PolarHBondContact O-N 3.49Å; L525-Q528 PolarHBondContact O-N 3.42Å; L525-V529 WeakPolarHBondContact O-CG2 3.41Å; L525-V529 PolarHBondContact O-N 2.8Å
526	Q	88.1	Confident	86.1	Confident	3 Å²	3	46.9 Å²	46.9	1%	0.014	25%	0.254	C	S	.	.	H	α-helix	trans	-57.7	-47	175.1	-71.4	169	-12.3	0	0	111.3	M340 T345 W350 M522 Y523 Q528 V529 L530	M340-Q526 HydrophobicContact CG-CG 4.31Å; T345-Q526 VanDerWaalsContact CG2-NE2 3.29Å; T345-Q526 PolarHBondContact OG1-NE2 3.09Å; W350-Q526 HydrophobicContact CH2-CG 3.76Å; W350-Q526 HydrophobicContact CZ2-CG 3.55Å; M522-Q526 VanDerWaalsContact O-CG 3.3Å; M522-Q526 WeakPolarHBondContact O-CG 3.3Å; M522-Q526 PolarHBondContact O-N 3.04Å; Y523-Q526 WeakPolarHBondContact O-CB 3.33Å; Y523-Q526 PolarHBondContact O-N 2.95Å; Q526-Q528 VanDerWaalsContact C-N 3.31Å; Q526-Q528 PolarHBondContact O-N 2.8Å; Q526-V529 PolarHBondContact O-N 3.15Å; Q526-L530 WeakPolarHBondContact O-CB 3.31Å; Q526-L530 VanDerWaalsContact O-CG 3.26Å; Q526-L530 WeakPolarHBondContact O-CG 3.37Å; Q526-L530 PolarHBondContact O-N 3.2Å
527	C	84.3	Confident	85.9	Confident	54 Å²	54	44.4 Å²	44.4	37%	0.365	24%	0.242	S	C	.	.	H	α-helix	trans	-58.5	-42.4	177.5	-68.3	0	0	0	0	112.2	Y523 Q524 L525 L530 A531	Y523-C527 PolarHBondContact O-N 2.97Å; Y523-C527 PolarHBondContact O-SG 3.31Å; Y523-C527 VanDerWaalsContact O-SG 3.38Å; Q524-C527 PolarHBondContact O-N 2.91Å; L525-C527 PolarHBondContact O-N 3.49Å; C527-L530 PolarHBondContact O-N 3.39Å; C527-A531 WeakPolarHBondContact O-CB 3.21Å; C527-A531 PolarHBondContact O-N 3.18Å
528	Q	86.3	Confident	85.7	Confident	92 Å²	92	46.4 Å²	46.4	43%	0.43	25%	0.248	S	C	.	.	H	α-helix	trans	-67	-38.6	178.6	-69.5	-177.9	17.1	0	0	112.7	L394 Q524 L525 Q526	L394-Q528 HydrophobicContact CD1-CB 4.32Å; Q524-Q528 WeakPolarHBondContact O-CG 3.27Å; Q524-Q528 PolarHBondContact O-N 2.89Å; Q524-Q528 VanDerWaalsContact O-N 3.16Å; L525-Q528 PolarHBondContact O-N 3.42Å; Q526-Q528 VanDerWaalsContact C-N 3.31Å; Q526-Q528 PolarHBondContact O-N 2.8Å
529	V	87.8	Confident	85.7	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-68.5	-45.9	175.6	173.1	0	0	0	0	110.8	L337 M340 W350 L353 I391 I395 L525 Q526 A531 R532 A533 L536	L337-V529 HydrophobicContact CD2-CG1 4.44Å; M340-V529 HydrophobicContact SD-CG1 4.1Å; W350-V529 HydrophobicContact CZ3-CG2 4.36Å; L353-V529 HydrophobicContact CD2-CG1 3.99Å; I391-V529 HydrophobicContact CG2-CG2 4.41Å; I395-V529 HydrophobicContact CD1-CG2 4.43Å; I395-V529 HydrophobicContact CG1-CG2 4.49Å; L525-V529 WeakPolarHBondContact O-CG2 3.41Å; L525-V529 PolarHBondContact O-N 2.8Å; Q526-V529 PolarHBondContact O-N 3.15Å; V529-A531 VanDerWaalsContact C-N 3.3Å; V529-A531 PolarHBondContact O-N 2.88Å; V529-R532 CarbonylContact O-C 3.51Å; V529-R532 PolarHBondContact O-N 3.23Å; V529-A533 PolarHBondContact O-N 3.12Å; V529-L536 HydrophobicContact CG1-CD1 4.31Å
530	L	83.3	Confident	85.7	Confident	26 Å²	26	43.7 Å²	43.7	14%	0.136	23%	0.231	C	C	.	.	H	α-helix	trans	-61.4	-37.5	179.9	-74.2	170.4	0	0	0	112.1	L337 M340 Q526 C527 R532 A533	L337-L530 HydrophobicContact CD2-CD2 4.15Å; M340-L530 HydrophobicContact CB-CD1 4.39Å; M340-L530 HydrophobicContact CB-CD2 4.17Å; M340-L530 HydrophobicContact CB-CG 4.38Å; Q526-L530 WeakPolarHBondContact O-CB 3.31Å; Q526-L530 VanDerWaalsContact O-CG 3.26Å; Q526-L530 WeakPolarHBondContact O-CG 3.37Å; Q526-L530 PolarHBondContact O-N 3.2Å; C527-L530 PolarHBondContact O-N 3.39Å; L530-R532 PolarHBondContact O-N 3.41Å; L530-R532 VanDerWaalsContact O-N 3.09Å; L530-A533 VanDerWaalsContact O-CB 3.23Å; L530-A533 WeakPolarHBondContact O-CB 3.39Å; L530-A533 PolarHBondContact O-N 3.32Å; L530-A533 VanDerWaalsContact O-N 3.1Å
531	A	81.8	Confident	85.6	Confident	68 Å²	68	41.2 Å²	41.2	56%	0.562	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-22.7	175.1	0	0	0	0	0	113.4	C527 V529	C527-A531 WeakPolarHBondContact O-CB 3.21Å; C527-A531 PolarHBondContact O-N 3.18Å; V529-A531 VanDerWaalsContact C-N 3.3Å; V529-A531 PolarHBondContact O-N 2.88Å
532	R	83.8	Confident	85.7	Confident	75 Å²	75	39.9 Å²	39.9	28%	0.283	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115	16.5	179.7	-58.1	-174.4	-166.8	-158.9	12.5	113.1	D387 H390 I391 V529 L530 A534 V535	D387-R532 IonicContact OD1-CZ 2.62Å; D387-R532 IonicContact OD1-NE 3.6Å; D387-R532 IonicContact OD1-NH1 3.93Å; D387-R532 PolarHBondContact OD1-NH1 3.49Å; H390-R532 PolarHBondContact CD2-NH1 3Å; H390-R532 PolarHBondContact CD2-NH2 3.42Å; H390-R532 VanDerWaalsContact CG-NH1 3.3Å; H390-R532 PolarHBondContact NE2-NH2 2.9Å; I391-R532 HydrophobicContact CD1-CB 3.89Å; I391-R532 HydrophobicContact CG1-CB 4.37Å; V529-R532 CarbonylContact O-C 3.51Å; V529-R532 PolarHBondContact O-N 3.23Å; L530-R532 PolarHBondContact O-N 3.41Å; L530-R532 VanDerWaalsContact O-N 3.09Å; R532-A534 PolarHBondContact O-N 3.45Å; R532-A534 VanDerWaalsContact O-N 3.12Å; R532-V535 PolarHBondContact O-N 2.93Å
533	A	81.7	Confident	85.9	Confident	7 Å²	7	38.9 Å²	38.9	6%	0.058	21%	0.207	C	C	.	.	H	α-helix	trans	-59	-26.7	-177.4	0	0	0	0	0	113.9	L337 V529 L530 V535 L536 T537	L337-A533 HydrophobicContact CD1-CB 3.97Å; L337-A533 HydrophobicContact CD2-CB 4.21Å; V529-A533 PolarHBondContact O-N 3.12Å; L530-A533 VanDerWaalsContact O-CB 3.23Å; L530-A533 WeakPolarHBondContact O-CB 3.39Å; L530-A533 PolarHBondContact O-N 3.32Å; L530-A533 VanDerWaalsContact O-N 3.1Å; A533-V535 VanDerWaalsContact C-N 3.28Å; A533-V535 PolarHBondContact O-N 3.33Å; A533-L536 WeakPolarHBondContact O-CB 3.47Å; A533-L536 PolarHBondContact O-N 3.07Å; A533-L536 VanDerWaalsContact O-N 3.12Å; A533-T537 PolarHBondContact O-N 3.49Å; A533-T537 VanDerWaalsContact O-N 3.12Å; A533-T537 PolarHBondContact O-OG1 3.22Å
534	A	79.3	Confident	86.1	Confident	64 Å²	64	33.3 Å²	33.3	53%	0.529	19%	0.186	S	C	.	.	H	α-helix	trans	-57.8	-39.1	179	0	0	0	0	0	112.8	R532 L536 T537 R538	R532-A534 PolarHBondContact O-N 3.45Å; R532-A534 VanDerWaalsContact O-N 3.12Å; A534-L536 VanDerWaalsContact C-N 3.34Å; A534-L536 PolarHBondContact O-N 3.17Å; A534-T537 PolarHBondContact O-N 3.12Å; A534-R538 PolarHBondContact O-N 3.23Å
535	V	85.6	Confident	86.3	Confident	23 Å²	23	32.8 Å²	32.8	14%	0.139	18%	0.18	C	C	.	.	H	α-helix	trans	-65.9	-39	178.3	-179.6	0	0	0	0	110.6	D387 L388 R532 A533 R538 V539	D387-V535 HydrophobicContact CB-CG2 4.06Å; L388-V535 HydrophobicContact CB-CG1 4.29Å; R532-V535 PolarHBondContact O-N 2.93Å; A533-V535 VanDerWaalsContact C-N 3.28Å; A533-V535 PolarHBondContact O-N 3.33Å; V535-R538 WeakPolarHBondContact O-CB 3.44Å; V535-R538 PolarHBondContact O-N 3.04Å; V535-V539 VanDerWaalsContact O-CG2 3.32Å; V535-V539 WeakPolarHBondContact O-CG2 3.4Å; V535-V539 PolarHBondContact O-N 3.36Å
536	L	86	Confident	86.6	Confident	3 Å²	3	32.5 Å²	32.5	2%	0.016	18%	0.179	C	C	.	.	H	α-helix	trans	-64.6	-41.3	177.3	-62	173.1	0	0	0	111.9	V333 L337 L353 V357 L388 I391 V529 A533 A534 R538 V539 L540	V333-L536 HydrophobicContact CG1-CB 4.02Å; V333-L536 HydrophobicContact CG1-CD1 4Å; V333-L536 HydrophobicContact CG1-CG 4.5Å; L337-L536 HydrophobicContact CD2-CD1 4.05Å; L353-L536 HydrophobicContact CD1-CD1 4.05Å; L353-L536 HydrophobicContact CD1-CD2 4.43Å; V357-L536 HydrophobicContact CG2-CD2 3.69Å; L388-L536 HydrophobicContact CD1-CD2 3.86Å; I391-L536 HydrophobicContact CD1-CD1 4.46Å; I391-L536 HydrophobicContact CD1-CD2 4.29Å; I391-L536 HydrophobicContact CD1-CG 4.27Å; V529-L536 HydrophobicContact CG1-CD1 4.31Å; A533-L536 WeakPolarHBondContact O-CB 3.47Å; A533-L536 PolarHBondContact O-N 3.07Å; A533-L536 VanDerWaalsContact O-N 3.12Å; A534-L536 VanDerWaalsContact C-N 3.34Å; A534-L536 PolarHBondContact O-N 3.17Å; L536-R538 VanDerWaalsContact C-N 3.29Å; L536-R538 PolarHBondContact O-N 2.75Å; L536-V539 WeakPolarHBondContact O-CB 3.28Å; L536-V539 PolarHBondContact O-N 3.12Å; L536-L540 PolarHBondContact O-N 2.88Å; L536-L540 VanDerWaalsContact O-N 3.12Å
537	T	81.9	Confident	86.9	Confident	37 Å²	37	32.3 Å²	32.3	23%	0.227	18%	0.178	C	C	.	.	H	α-helix	trans	-63.1	-38.6	174.7	-55.4	0	0	0	0	111.4	A533 A534 L540 D541	A533-T537 PolarHBondContact O-N 3.49Å; A533-T537 VanDerWaalsContact O-N 3.12Å; A533-T537 PolarHBondContact O-OG1 3.22Å; A534-T537 PolarHBondContact O-N 3.12Å; T537-L540 PolarHBondContact O-N 3.03Å; T537-D541 PolarHBondContact O-N 3.43Å; T537-D541 VanDerWaalsContact O-N 3.12Å
538	R	85	Confident	87.5	Confident	81 Å²	81	29.8 Å²	29.8	31%	0.306	16%	0.161	S	C	.	.	H	α-helix	trans	-67.6	-40	177.2	-171.1	57.1	164.9	162.6	1.1	112.5	E383 A534 V535 L536 L540 D541 L542	E383-R538 HydrophobicContact CB-CG 4.18Å; E383-R538 WeakPolarHBondContact OE2-CG 3.16Å; E383-R538 IonicContact OE2-CZ 3.81Å; E383-R538 IonicContact OE2-NE 3.58Å; E383-R538 PolarHBondContact OE2-NE 3.32Å; E383-R538 IonicContact OE2-NH2 3.13Å; A534-R538 PolarHBondContact O-N 3.23Å; V535-R538 WeakPolarHBondContact O-CB 3.44Å; V535-R538 PolarHBondContact O-N 3.04Å; L536-R538 VanDerWaalsContact C-N 3.29Å; L536-R538 PolarHBondContact O-N 2.75Å; R538-L540 VanDerWaalsContact C-N 3.28Å; R538-L540 PolarHBondContact O-N 3.31Å; R538-D541 IonicContact NH1-OD2 2.71Å; R538-D541 PolarHBondContact NH1-OD2 3.36Å; R538-D541 PolarHBondContact O-N 3.12Å; R538-L542 HydrophobicContact CG-CD1 4.31Å; R538-L542 PolarHBondContact O-N 3.07Å
539	V	88.9	Confident	87.9	Confident	4 Å²	4	25.7 Å²	25.7	2%	0.024	14%	0.142	C	C	.	.	H	α-helix	trans	-55.9	-45	172.3	166.6	0	0	0	0	110.5	A360 F384 L388 V535 L536 A543	A360-V539 HydrophobicContact CB-CG1 3.53Å; A360-V539 HydrophobicContact CB-CG2 4.41Å; F384-V539 HydrophobicContact CD1-CG2 3.85Å; F384-V539 HydrophobicContact CD2-CG2 4.24Å; F384-V539 HydrophobicContact CE1-CB 4.12Å; F384-V539 HydrophobicContact CE1-CG1 4.42Å; F384-V539 HydrophobicContact CE1-CG2 3.73Å; F384-V539 HydrophobicContact CE2-CG1 4.11Å; F384-V539 HydrophobicContact CE2-CG2 4.14Å; F384-V539 HydrophobicContact CG-CG2 4.12Å; F384-V539 HydrophobicContact CZ-CB 4.05Å; F384-V539 HydrophobicContact CZ-CG1 3.85Å; F384-V539 HydrophobicContact CZ-CG2 3.89Å; L388-V539 HydrophobicContact CD1-CG2 4.26Å; L388-V539 HydrophobicContact CD2-CG2 4.07Å; V535-V539 VanDerWaalsContact O-CG2 3.32Å; V535-V539 WeakPolarHBondContact O-CG2 3.4Å; V535-V539 PolarHBondContact O-N 3.36Å; L536-V539 WeakPolarHBondContact O-CB 3.28Å; L536-V539 PolarHBondContact O-N 3.12Å; V539-A543 WeakPolarHBondContact O-CB 3.36Å; V539-A543 PolarHBondContact O-N 2.84Å
540	L	87.6	Confident	88.2	Confident	6 Å²	6	25.9 Å²	25.9	3%	0.031	14%	0.143	C	C	.	.	H	α-helix	trans	-66	-42.2	179	-70.7	178	0	0	0	113.7	I330 V333 P334 L536 T537 R538 S544	I330-L540 HydrophobicContact CG2-CD2 3.51Å; V333-L540 HydrophobicContact CB-CD1 3.8Å; V333-L540 HydrophobicContact CG2-CD1 4.16Å; V333-L540 HydrophobicContact CG2-CD2 4.25Å; V333-L540 HydrophobicContact CG2-CG 4.41Å; P334-L540 HydrophobicContact CG-CD1 3.88Å; L536-L540 PolarHBondContact O-N 2.88Å; L536-L540 VanDerWaalsContact O-N 3.12Å; T537-L540 PolarHBondContact O-N 3.03Å; R538-L540 VanDerWaalsContact C-N 3.28Å; R538-L540 PolarHBondContact O-N 3.31Å; L540-S544 WeakPolarHBondContact O-CB 3.43Å; L540-S544 PolarHBondContact O-N 2.61Å; L540-S544 PolarHBondContact O-OG 2.88Å
541	D	85.8	Confident	88.8	Confident	48 Å²	48	24.6 Å²	24.6	26%	0.257	14%	0.136	S	C	.	.	H	α-helix	trans	-60.7	-47.6	176.6	175.8	48	0	0	0	111.2	T537 R538 S544 R545	T537-D541 PolarHBondContact O-N 3.43Å; T537-D541 VanDerWaalsContact O-N 3.12Å; R538-D541 IonicContact NH1-OD2 2.71Å; R538-D541 PolarHBondContact NH1-OD2 3.36Å; R538-D541 PolarHBondContact O-N 3.12Å; D541-S544 PolarHBondContact O-OG 2.93Å; D541-R545 VanDerWaalsContact O-CG 3.24Å; D541-R545 WeakPolarHBondContact O-CG 3.43Å; D541-R545 PolarHBondContact O-N 3.09Å; D541-R545 IonicContact OD1-CZ 3.99Å; D541-R545 IonicContact OD1-NE 3.82Å; D541-R545 PolarHBondContact OD1-NE 3.42Å; D541-R545 IonicContact OD1-NH2 2.79Å; D541-R545 PolarHBondContact OD1-NH2 2.83Å; D541-R545 IonicContact OD2-CZ 3.91Å; D541-R545 IonicContact OD2-NE 3.9Å; D541-R545 IonicContact OD2-NH2 2.83Å; D541-R545 PolarHBondContact OD2-NH2 2.93Å
542	L	91.3	Very high	89.5	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-74	-39.1	-179.2	-64.1	177.1	0	0	0	112.9	L376 D379 I380 E383 F384 R538 R545 L546	L376-L542 HydrophobicContact CD1-CD2 4.08Å; D379-L542 HydrophobicContact CB-CD1 4.28Å; D379-L542 HydrophobicContact CB-CD2 4.24Å; I380-L542 HydrophobicContact CG1-CB 3.8Å; I380-L542 HydrophobicContact CG1-CD1 4.22Å; E383-L542 HydrophobicContact CB-CD1 3.89Å; E383-L542 HydrophobicContact CG-CD1 4.08Å; F384-L542 HydrophobicContact CD1-CD1 4.5Å; F384-L542 HydrophobicContact CE1-CB 4.13Å; F384-L542 HydrophobicContact CE1-CD1 4.01Å; R538-L542 HydrophobicContact CG-CD1 4.31Å; R538-L542 PolarHBondContact O-N 3.07Å; L542-R545 PolarHBondContact O-N 3.32Å; L542-L546 PolarHBondContact O-N 2.79Å
543	A	92.2	Very high	90	Very high	2 Å²	2	18 Å²	18	2%	0.017	10%	0.097	C	C	.	.	H	α-helix	trans	-65.6	-41.7	177.4	0	0	0	0	0	111.8	L327 I330 L363 V539 L546 D547	L327-A543 HydrophobicContact CD2-CB 3.85Å; L327-A543 WeakPolarHBondContact CD2-O 3.46Å; I330-A543 HydrophobicContact CD1-CB 3.71Å; L363-A543 HydrophobicContact CD1-CB 4.39Å; V539-A543 WeakPolarHBondContact O-CB 3.36Å; V539-A543 PolarHBondContact O-N 2.84Å; A543-L546 PolarHBondContact O-N 2.8Å; A543-D547 WeakPolarHBondContact O-CB 3.43Å; A543-D547 PolarHBondContact O-N 3.33Å
544	S	91	Very high	90.6	Very high	7 Å²	7	18.4 Å²	18.4	5%	0.049	10%	0.1	C	C	.	.	H	α-helix	trans	-64.1	-41.9	175.6	57.3	0	0	0	0	111.7	L540 D541 L546 D547 V548	L540-S544 WeakPolarHBondContact O-CB 3.43Å; L540-S544 PolarHBondContact O-N 2.61Å; L540-S544 PolarHBondContact O-OG 2.88Å; D541-S544 PolarHBondContact O-OG 2.93Å; S544-L546 VanDerWaalsContact C-N 3.33Å; S544-L546 PolarHBondContact O-N 2.71Å; S544-D547 PolarHBondContact O-N 2.93Å; S544-V548 VanDerWaalsContact O-CG2 3.29Å; S544-V548 WeakPolarHBondContact O-CG2 3.23Å; S544-V548 PolarHBondContact O-N 3.12Å
545	R	93.1	Very high	91.3	Very high	82 Å²	82	15.4 Å²	15.4	31%	0.309	8%	0.075	S	C	.	.	H	α-helix	trans	-58.7	-44.3	173.5	-71.4	171.3	-164.7	-146	5.1	112.1	L286 W290 L376 D541 L542 L549	L286-R545 HydrophobicContact CD2-CB 4.23Å; L286-R545 HydrophobicContact CD2-CG 3.65Å; W290-R545 HydrophobicContact CZ2-CG 4.37Å; L376-R545 HydrophobicContact CD1-CB 4.16Å; D541-R545 VanDerWaalsContact O-CG 3.24Å; D541-R545 WeakPolarHBondContact O-CG 3.43Å; D541-R545 PolarHBondContact O-N 3.09Å; D541-R545 IonicContact OD1-CZ 3.99Å; D541-R545 IonicContact OD1-NE 3.82Å; D541-R545 PolarHBondContact OD1-NE 3.42Å; D541-R545 IonicContact OD1-NH2 2.79Å; D541-R545 PolarHBondContact OD1-NH2 2.83Å; D541-R545 IonicContact OD2-CZ 3.91Å; D541-R545 IonicContact OD2-NE 3.9Å; D541-R545 IonicContact OD2-NH2 2.83Å; D541-R545 PolarHBondContact OD2-NH2 2.93Å; L542-R545 PolarHBondContact O-N 3.32Å; R545-L549 WeakPolarHBondContact O-CD1 3.34Å; R545-L549 VanDerWaalsContact O-CG 3.24Å; R545-L549 WeakPolarHBondContact O-CG 3.41Å; R545-L549 PolarHBondContact O-N 3.49Å; R545-L549 VanDerWaalsContact O-N 3.14Å
546	L	94.3	Very high	91.7	Very high	0 Å²	0	14.3 Å²	14.3	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-63.2	-45.5	177.6	-179.1	62.7	0	0	0	111.5	F311 L323 L327 L363 L376 F377 I380 L542 A543 S544 V548 L549 L550	F311-L546 HydrophobicContact CE2-CD1 4.11Å; F311-L546 HydrophobicContact CZ-CD1 4.47Å; L323-L546 HydrophobicContact CD1-CD2 4.45Å; L323-L546 HydrophobicContact CD2-CD2 4.44Å; L327-L546 HydrophobicContact CD1-CD2 4.49Å; L327-L546 HydrophobicContact CD1-CG 4.38Å; L363-L546 HydrophobicContact CD2-CD2 4.38Å; L376-L546 HydrophobicContact CD2-CB 4.31Å; L376-L546 HydrophobicContact CD2-CD1 4.25Å; F377-L546 HydrophobicContact CE1-CD1 3.99Å; I380-L546 HydrophobicContact CD1-CB 4.19Å; I380-L546 HydrophobicContact CD1-CD2 3.97Å; L542-L546 PolarHBondContact O-N 2.79Å; A543-L546 PolarHBondContact O-N 2.8Å; S544-L546 VanDerWaalsContact C-N 3.33Å; S544-L546 PolarHBondContact O-N 2.71Å; L546-V548 PolarHBondContact O-N 2.76Å; L546-L549 PolarHBondContact O-N 2.87Å; L546-L550 HydrophobicContact CD1-CD1 4.09Å; L546-L550 HydrophobicContact CD1-CG 4.17Å; L546-L550 HydrophobicContact CD2-CD1 4.48Å; L546-L550 HydrophobicContact CG-CD1 3.84Å; L546-L550 HydrophobicContact CG-CG 4.36Å; L546-L550 WeakPolarHBondContact O-CB 3.42Å; L546-L550 VanDerWaalsContact O-CG 3.28Å; L546-L550 WeakPolarHBondContact O-CG 3.45Å; L546-L550 PolarHBondContact O-N 3.48Å
547	D	95	Very high	92.1	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-59.8	-45.7	178.8	-168.5	31	0	0	0	111.9	C278 H279 C280 L327 A543 S544 L549 L550 A551	C278-D547 WeakPolarHBondContact CB-OD2 3.5Å; H279-D547 PolarHBondContact N-OD1 2.95Å; H279-D547 PolarHBondContact N-OD2 2.92Å; H279-D547 VanDerWaalsContact N-OD2 3.12Å; C280-D547 WeakPolarHBondContact CA-OD2 3.42Å; C280-D547 VanDerWaalsContact CB-OD2 3.28Å; C280-D547 WeakPolarHBondContact CB-OD2 3.34Å; C280-D547 PolarHBondContact N-OD2 2.84Å; L327-D547 HydrophobicContact CD1-CB 3.87Å; L327-D547 HydrophobicContact CD2-CB 4.29Å; A543-D547 WeakPolarHBondContact O-CB 3.43Å; A543-D547 PolarHBondContact O-N 3.33Å; S544-D547 PolarHBondContact O-N 2.93Å; D547-L549 PolarHBondContact O-N 3.02Å; D547-L550 PolarHBondContact O-N 3.22Å; D547-A551 WeakPolarHBondContact O-CB 3.44Å; D547-A551 PolarHBondContact O-N 2.93Å
548	V	95.4	Very high	92.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-59.9	-45.5	176.5	175.4	0	0	0	0	111.7	G283 L286 L287 W290 S544 L546 A551 L552	G283-V548 WeakPolarHBondContact O-CG2 3.49Å; L286-V548 HydrophobicContact CB-CG2 4.02Å; L286-V548 HydrophobicContact CD2-CG2 4.07Å; L286-V548 HydrophobicContact CG-CG2 4.17Å; L287-V548 HydrophobicContact CB-CG1 4.09Å; L287-V548 HydrophobicContact CB-CG2 3.92Å; L287-V548 HydrophobicContact CD1-CG1 3.76Å; L287-V548 HydrophobicContact CG-CG1 4.48Å; W290-V548 HydrophobicContact CD2-CG1 4.23Å; W290-V548 HydrophobicContact CE3-CG1 3.48Å; W290-V548 VanDerWaalsContact CE3-CG1 3.48Å; W290-V548 HydrophobicContact CH2-CB 4.27Å; W290-V548 HydrophobicContact CH2-CG1 3.92Å; W290-V548 HydrophobicContact CZ3-CB 4.13Å; W290-V548 HydrophobicContact CZ3-CG1 3.3Å; S544-V548 VanDerWaalsContact O-CG2 3.29Å; S544-V548 WeakPolarHBondContact O-CG2 3.23Å; S544-V548 PolarHBondContact O-N 3.12Å; L546-V548 PolarHBondContact O-N 2.76Å; V548-A551 WeakPolarHBondContact O-CB 3.34Å; V548-A551 PolarHBondContact O-N 2.97Å; V548-L552 HydrophobicContact CG1-CD1 4.21Å; V548-L552 HydrophobicContact CG1-CG 4.5Å; V548-L552 WeakPolarHBondContact O-CG 3.17Å; V548-L552 PolarHBondContact O-N 3.39Å
549	L	95.6	Very high	92.9	Very high	6 Å²	6	19.9 Å²	19.9	3%	0.031	9%	0.093	C	C	.	.	H	α-helix	trans	-70.4	-35.5	-177.9	-66.4	168.2	0	0	0	112.1	W290 R304 V307 I308 L376 R545 L546 D547 A553	W290-L549 HydrophobicContact CH2-CD1 4.41Å; W290-L549 HydrophobicContact CH2-CD2 3.84Å; W290-L549 HydrophobicContact CH2-CG 3.93Å; W290-L549 HydrophobicContact CZ3-CD2 3.78Å; W290-L549 HydrophobicContact CZ3-CG 4.23Å; R304-L549 HydrophobicContact CB-CD2 3.67Å; R304-L549 HydrophobicContact CG-CD2 3.95Å; V307-L549 HydrophobicContact CB-CB 4.31Å; V307-L549 HydrophobicContact CB-CD1 3.87Å; V307-L549 HydrophobicContact CG1-CB 3.74Å; V307-L549 HydrophobicContact CG1-CD1 3.86Å; V307-L549 HydrophobicContact CG1-CG 4.39Å; V307-L549 HydrophobicContact CG2-CD1 3.92Å; I308-L549 HydrophobicContact CD1-CD2 4.02Å; I308-L549 HydrophobicContact CG1-CB 4.45Å; I308-L549 HydrophobicContact CG1-CD2 4.02Å; L376-L549 HydrophobicContact CD2-CD1 3.64Å; R545-L549 WeakPolarHBondContact O-CD1 3.34Å; R545-L549 VanDerWaalsContact O-CG 3.24Å; R545-L549 WeakPolarHBondContact O-CG 3.41Å; R545-L549 PolarHBondContact O-N 3.49Å; R545-L549 VanDerWaalsContact O-N 3.14Å; L546-L549 PolarHBondContact O-N 2.87Å; D547-L549 PolarHBondContact O-N 3.02Å; L549-A553 WeakPolarHBondContact O-CB 3.45Å; L549-A553 PolarHBondContact O-N 3.3Å
550	L	94.7	Very high	93.1	Very high	4 Å²	4	22 Å²	22	2%	0.021	12%	0.115	C	C	.	.	H	α-helix	trans	-66.8	-39.6	172.2	-71.4	169.9	0	0	0	111.8	F311 A320 L323 H324 L327 L546 D547 A553 S554	F311-L550 HydrophobicContact CB-CD2 4.25Å; F311-L550 HydrophobicContact CD1-CD2 3.75Å; F311-L550 HydrophobicContact CD2-CD2 3.39Å; F311-L550 HydrophobicContact CD2-CG 4.35Å; F311-L550 HydrophobicContact CE1-CD2 3.85Å; F311-L550 HydrophobicContact CE2-CD2 3.47Å; F311-L550 VanDerWaalsContact CE2-CD2 3.47Å; F311-L550 HydrophobicContact CE2-CG 4.23Å; F311-L550 HydrophobicContact CG-CD2 3.53Å; F311-L550 HydrophobicContact CZ-CD2 3.71Å; A320-L550 HydrophobicContact CB-CD2 4Å; L323-L550 HydrophobicContact CB-CD1 3.8Å; L323-L550 HydrophobicContact CD1-CD1 4.3Å; H324-L550 WeakPolarHBondContact NE2-CB 3.49Å; L327-L550 HydrophobicContact CD1-CD1 3.68Å; L546-L550 HydrophobicContact CD1-CD1 4.09Å; L546-L550 HydrophobicContact CD1-CG 4.17Å; L546-L550 HydrophobicContact CD2-CD1 4.48Å; L546-L550 HydrophobicContact CG-CD1 3.84Å; L546-L550 HydrophobicContact CG-CG 4.36Å; L546-L550 WeakPolarHBondContact O-CB 3.42Å; L546-L550 VanDerWaalsContact O-CG 3.28Å; L546-L550 WeakPolarHBondContact O-CG 3.45Å; L546-L550 PolarHBondContact O-N 3.48Å; D547-L550 PolarHBondContact O-N 3.22Å; L550-A553 PolarHBondContact O-N 3.12Å; L550-S554 WeakPolarHBondContact O-CB 3.25Å; L550-S554 PolarHBondContact O-N 3.06Å
551	A	94.8	Very high	93.5	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.2	-46.9	174.3	0	0	0	0	0	111.6	R277 D547 V548 A553 S554 A555	R277-A551 HydrophobicContact CB-CB 4.01Å; D547-A551 WeakPolarHBondContact O-CB 3.44Å; D547-A551 PolarHBondContact O-N 2.93Å; V548-A551 WeakPolarHBondContact O-CB 3.34Å; V548-A551 PolarHBondContact O-N 2.97Å; A551-A553 PolarHBondContact O-N 3.09Å; A551-S554 WeakPolarHBondContact O-CB 3.22Å; A551-S554 PolarHBondContact O-N 3.32Å; A551-A555 PolarHBondContact O-N 2.87Å
552	L	95.8	Very high	94	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.005	11%	0.112	C	C	.	.	H	α-helix	trans	-63.7	-39	175.3	-68.7	176.9	0	0	0	112.2	L275 L287 W290 I308 V548 A555 A556	L275-L552 HydrophobicContact CB-CD2 4.15Å; L275-L552 HydrophobicContact CD1-CD2 4.29Å; L275-L552 HydrophobicContact CD2-CD2 4.41Å; L287-L552 HydrophobicContact CD1-CD2 4.22Å; W290-L552 HydrophobicContact CZ3-CD1 4.35Å; I308-L552 HydrophobicContact CD1-CB 3.91Å; I308-L552 HydrophobicContact CD1-CD1 4.13Å; I308-L552 HydrophobicContact CG1-CB 4.33Å; V548-L552 HydrophobicContact CG1-CD1 4.21Å; V548-L552 HydrophobicContact CG1-CG 4.5Å; V548-L552 WeakPolarHBondContact O-CG 3.17Å; V548-L552 PolarHBondContact O-N 3.39Å; L552-A555 PolarHBondContact O-N 2.77Å; L552-A556 VanDerWaalsContact O-CB 3.23Å; L552-A556 WeakPolarHBondContact O-CB 3.45Å; L552-A556 PolarHBondContact O-N 2.97Å
553	A	95.3	Very high	94.2	Very high	2 Å²	2	25.1 Å²	25.1	2%	0.017	13%	0.127	C	C	.	.	H	α-helix	trans	-65.3	-40.8	175.3	0	0	0	0	0	112.5	I308 F311 L312 L549 L550 A551 A556 R557	I308-A553 HydrophobicContact CB-CB 4.48Å; I308-A553 HydrophobicContact CG2-CB 4.01Å; F311-A553 HydrophobicContact CB-CB 3.96Å; L312-A553 HydrophobicContact CD1-CB 4.25Å; L549-A553 WeakPolarHBondContact O-CB 3.45Å; L549-A553 PolarHBondContact O-N 3.3Å; L550-A553 PolarHBondContact O-N 3.12Å; A551-A553 PolarHBondContact O-N 3.09Å; A553-A556 PolarHBondContact O-N 3.16Å; A553-R557 WeakPolarHBondContact O-CB 3.25Å; A553-R557 PolarHBondContact O-N 2.89Å
554	S	93.9	Very high	94.4	Very high	17 Å²	17	25.1 Å²	25.1	12%	0.119	13%	0.127	C	C	.	.	H	α-helix	trans	-60.7	-48.5	173.9	-178.8	0	0	0	0	111.3	R277 L550 A551 R557 D558	R277-S554 PolarHBondContact NH1-O 2.91Å; R277-S554 PolarHBondContact NH1-OG 3.46Å; L550-S554 WeakPolarHBondContact O-CB 3.25Å; L550-S554 PolarHBondContact O-N 3.06Å; A551-S554 WeakPolarHBondContact O-CB 3.22Å; A551-S554 PolarHBondContact O-N 3.32Å; S554-R557 PolarHBondContact O-N 3.46Å; S554-D558 PolarHBondContact O-N 2.87Å; S554-D558 VanDerWaalsContact O-N 3.14Å
555	A	93.7	Very high	94.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.2	-43.6	176.9	0	0	0	0	0	112.2	L275 A551 L552 R557 D558 Y559	L275-A555 HydrophobicContact CD2-CB 3.71Å; A551-A555 PolarHBondContact O-N 2.87Å; L552-A555 PolarHBondContact O-N 2.77Å; A555-R557 VanDerWaalsContact C-N 3.3Å; A555-R557 PolarHBondContact O-N 3.24Å; A555-D558 PolarHBondContact O-N 3.33Å; A555-Y559 HydrophobicContact CB-CD2 4.22Å; A555-Y559 HydrophobicContact CB-CE2 4.13Å; A555-Y559 WeakPolarHBondContact O-CD2 3.35Å; A555-Y559 PolarHBondContact O-N 3.25Å
556	A	94.8	Very high	94.4	Very high	1 Å²	1	31 Å²	31	1%	0.008	15%	0.148	C	C	.	.	H	α-helix	trans	-61.4	-37.8	178.7	0	0	0	0	0	112.6	L312 L552 A553 G560 Y561 F634	L312-A556 HydrophobicContact CD1-CB 4.14Å; L312-A556 HydrophobicContact CD2-CB 4.46Å; L552-A556 VanDerWaalsContact O-CB 3.23Å; L552-A556 WeakPolarHBondContact O-CB 3.45Å; L552-A556 PolarHBondContact O-N 2.97Å; A553-A556 PolarHBondContact O-N 3.16Å; A556-G560 CarbonylContact O-C 3.49Å; A556-G560 WeakPolarHBondContact O-CA 3.45Å; A556-G560 PolarHBondContact O-N 2.88Å; A556-Y561 HydrophobicContact CB-CD2 4.47Å; A556-Y561 PolarHBondContact O-N 3.25Å; A556-F634 HydrophobicContact CB-CB 3.78Å; A556-F634 HydrophobicContact CB-CD2 4.28Å; A556-F634 HydrophobicContact CB-CG 4.19Å
557	R	93.5	Very high	93.7	Very high	93 Å²	93	31.8 Å²	31.8	35%	0.351	15%	0.154	S	C	.	.	H	α-helix	trans	-66.5	-48	175.9	-179.3	179.9	61	-131.9	-4.6	111.9	A553 S554 A555 Y559 G560	A553-R557 WeakPolarHBondContact O-CB 3.25Å; A553-R557 PolarHBondContact O-N 2.89Å; S554-R557 PolarHBondContact O-N 3.46Å; A555-R557 VanDerWaalsContact C-N 3.3Å; A555-R557 PolarHBondContact O-N 3.24Å; R557-Y559 PolarHBondContact O-N 3.42Å; R557-G560 PolarHBondContact O-N 3.32Å
558	D	92.3	Very high	92.6	Very high	95 Å²	95	37.3 Å²	37.3	51%	0.508	19%	0.189	S	C	.	.	H	α-helix	trans	-68.4	-35.3	-175.1	-73.2	12.8	0	0	0	112.6	R277 S554 A555	R277-D558 IonicContact CZ-OD2 3.74Å; R277-D558 VanDerWaalsContact NH1-CG 3.3Å; R277-D558 IonicContact NH1-OD2 2.84Å; R277-D558 PolarHBondContact NH1-OD2 2.88Å; R277-D558 IonicContact NH2-OD2 3.98Å; R277-D558 PolarHBondContact NH2-OD2 3.45Å; R277-D558 VanDerWaalsContact NH2-OD2 3.14Å; S554-D558 PolarHBondContact O-N 2.87Å; S554-D558 VanDerWaalsContact O-N 3.14Å; A555-D558 PolarHBondContact O-N 3.33Å
559	Y	92.1	Very high	91.2	Very high	50 Å²	50	45.4 Å²	45.4	20%	0.196	23%	0.227	C	C	.	.	H	α-helix	trans	-96.1	-0.1	179.9	-54.5	-54.3	0	0	0	113.9	R277 A555 R557 Y561 R579 L585	R277-Y559 PolarHBondContact NH2-OH 3.3Å; A555-Y559 HydrophobicContact CB-CD2 4.22Å; A555-Y559 HydrophobicContact CB-CE2 4.13Å; A555-Y559 WeakPolarHBondContact O-CD2 3.35Å; A555-Y559 PolarHBondContact O-N 3.25Å; R557-Y559 PolarHBondContact O-N 3.42Å; Y559-Y561 VanDerWaalsContact CB-CZ 3.46Å; Y559-Y561 HydrophobicContact CD2-CE1 4.45Å; Y559-Y561 AromaticContact CD2-CE2 3.94Å; Y559-Y561 HydrophobicContact CD2-CE2 3.94Å; Y559-Y561 AromaticContact CD2-CZ 3.77Å; Y559-Y561 HydrophobicContact CG-CE1 4.16Å; Y559-Y561 HydrophobicContact CG-CE2 4.45Å; Y559-Y561 AromaticContact CG-CZ 3.91Å; Y559-R579 PolarHBondContact O-NH1 2.95Å; Y559-R579 VanDerWaalsContact O-NH1 3.12Å; Y559-L585 HydrophobicContact CD1-CD2 4.02Å; Y559-L585 HydrophobicContact CE1-CD1 4.48Å; Y559-L585 HydrophobicContact CE1-CD2 3.58Å
560	G	92.8	Very high	89.9	Confident	49 Å²	49	46.2 Å²	46.2	51%	0.505	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	50.5	-179.3	0	0	0	0	0	112.8	A556 R557 R579	A556-G560 CarbonylContact O-C 3.49Å; A556-G560 WeakPolarHBondContact O-CA 3.45Å; A556-G560 PolarHBondContact O-N 2.88Å; R557-G560 PolarHBondContact O-N 3.32Å; G560-R579 PolarHBondContact O-NH2 3.36Å
561	Y	96.1	Very high	89	Confident	12 Å²	12	50.3 Å²	50.3	5%	0.047	25%	0.254	C	S	.	.			trans	-83.1	152.1	177.9	-65.5	-11.3	0	0	0	111.7	L275 A556 Y559 M628 V635 P636	L275-Y561 HydrophobicContact CD2-CE2 4.13Å; A556-Y561 HydrophobicContact CB-CD2 4.47Å; A556-Y561 PolarHBondContact O-N 3.25Å; Y559-Y561 VanDerWaalsContact CB-CZ 3.46Å; Y559-Y561 HydrophobicContact CD2-CE1 4.45Å; Y559-Y561 AromaticContact CD2-CE2 3.94Å; Y559-Y561 HydrophobicContact CD2-CE2 3.94Å; Y559-Y561 AromaticContact CD2-CZ 3.77Å; Y559-Y561 HydrophobicContact CG-CE1 4.16Å; Y559-Y561 HydrophobicContact CG-CE2 4.45Å; Y559-Y561 AromaticContact CG-CZ 3.91Å; Y561-M628 HydrophobicContact CD2-CE 3.87Å; Y561-M628 HydrophobicContact CE2-CE 3.53Å; Y561-V635 WeakPolarHBondContact CA-O 3.17Å; Y561-V635 WeakPolarHBondContact CB-O 3.25Å; Y561-P636 HydrophobicContact CD1-CB 3.84Å; Y561-P636 HydrophobicContact CE1-CB 3.5Å; Y561-P636 VanDerWaalsContact CE1-CB 3.5Å; Y561-P636 HydrophobicContact CE1-CG 4.42Å
562	S	96.1	Very high	88.4	Confident	23 Å²	23	50.4 Å²	50.4	16%	0.161	26%	0.255	C	S	.	.	B	Isolated β-bridge	trans	-107.3	156.3	-178.8	62.1	0	0	0	0	112.2	P564 F634 V635 A637 E638	S562-P564 WeakPolarHBondContact O-CD 3.46Å; S562-F634 CarbonylContact O-C 3.59Å; S562-F634 WeakPolarHBondContact O-CA 3.41Å; S562-F634 WeakPolarHBondContact O-CB 3.48Å; S562-V635 PolarHBondContact N-O 3.43Å; S562-V635 PolarHBondContact O-N 2.89Å; S562-A637 VanDerWaalsContact CB-O 3.25Å; S562-A637 WeakPolarHBondContact CB-O 3.33Å; S562-A637 PolarHBondContact OG-O 3.21Å; S562-E638 WeakPolarHBondContact CB-O 3.41Å; S562-E638 PolarHBondContact OG-O 3.37Å
563	R	96.4	Very high	88.1	Confident	84 Å²	84	50.6 Å²	50.6	32%	0.317	26%	0.256	S	S	.	.			trans	-73.9	119.5	177.6	-176.5	173.3	173.7	148.8	0.8	109.8	L305 D306 F634	L305-R563 HydrophobicContact CD1-CG 4.24Å; D306-R563 IonicContact OD1-CZ 3.48Å; D306-R563 VanDerWaalsContact OD1-CZ 3.25Å; D306-R563 IonicContact OD1-NH1 2.81Å; D306-R563 PolarHBondContact OD1-NH1 3.36Å; D306-R563 IonicContact OD1-NH2 3.84Å; D306-R563 PolarHBondContact OD1-NH2 2.85Å; R563-F634 HydrophobicContact CB-CD2 4.27Å; R563-F634 HydrophobicContact CB-CE1 4.04Å; R563-F634 HydrophobicContact CB-CE2 3.76Å; R563-F634 HydrophobicContact CB-CZ 3.64Å; R563-F634 HydrophobicContact CG-CE1 4.05Å; R563-F634 HydrophobicContact CG-CZ 4Å
564	P	95.2	Very high	88.1	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.013	27%	0.273	C	S	.	.			trans	-69.7	150.3	173.5	30	-34.6	0	0	0	111	L305 S562 A629 V635 A640	L305-P564 HydrophobicContact CD1-CG 3.98Å; L305-P564 HydrophobicContact CD2-CG 4.13Å; S562-P564 WeakPolarHBondContact O-CD 3.46Å; P564-A629 HydrophobicContact CB-CB 4.12Å; P564-A629 HydrophobicContact CG-CB 4.19Å; P564-V635 HydrophobicContact CB-CG1 4.43Å; P564-V635 HydrophobicContact CB-CG2 4.26Å; P564-V635 HydrophobicContact CG-CG1 4.32Å; P564-A640 CarbonylContact C-O 3.59Å; P564-A640 WeakPolarHBondContact CA-O 3.1Å; P564-A640 HydrophobicContact CB-CB 4.43Å
565	R	93.6	Very high	88.1	Confident	169 Å²	169	54.5 Å²	54.5	64%	0.638	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.7	133.6	172.6	-63.9	-177.6	-177.6	159.4	6	109.5	A640 E641 I642	R565-A640 PolarHBondContact N-O 2.94Å; R565-E641 CarbonylContact O-C 3.59Å; R565-E641 VanDerWaalsContact O-CA 3.29Å; R565-E641 WeakPolarHBondContact O-CA 3.27Å; R565-I642 PolarHBondContact O-N 3.13Å
566	Y	90.7	Very high	88.2	Confident	43 Å²	43	58 Å²	58	17%	0.169	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	127.4	173.3	-51.8	-75.5	0	0	0	109.4	L298 L301 L305 A629 I642	L298-Y566 HydrophobicContact CD2-CD1 4.15Å; L298-Y566 HydrophobicContact CD2-CD2 4.32Å; L298-Y566 HydrophobicContact CD2-CG 3.77Å; L301-Y566 HydrophobicContact CB-CE2 3.72Å; L301-Y566 HydrophobicContact CD1-CD1 4.4Å; L301-Y566 HydrophobicContact CD1-CE1 3.79Å; L301-Y566 HydrophobicContact CD1-CE2 4.27Å; L305-Y566 HydrophobicContact CD1-CE2 3.53Å; Y566-A629 HydrophobicContact CE1-CB 4.37Å; Y566-A629 PolarHBondContact OH-O 3.22Å; Y566-I642 WeakPolarHBondContact CA-O 3.47Å; Y566-I642 HydrophobicContact CD1-CB 4.39Å
567	S	80.4	Confident	88.2	Confident	17 Å²	17	61 Å²	61	12%	0.119	30%	0.299	C	S	.	.			trans	-131.4	123	180	-179.7	0	0	0	0	110	Q569 V570 E641 I642	S567-Q569 PolarHBondContact O-N 3.11Å; S567-Q569 PolarHBondContact OG-N 2.89Å; S567-V570 PolarHBondContact O-N 3.28Å; S567-E641 WeakPolarHBondContact CB-OE1 3.43Å; S567-E641 PolarHBondContact OG-OE1 3.04Å; S567-I642 PolarHBondContact N-O 3.3Å
568	P	71	Confident	88.4	Confident	115 Å²	115	56.5 Å²	56.5	75%	0.747	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-15.6	173.4	28.4	-33.1	0	0	0	112.2
569	Q	66.3	Low	88.5	Confident	171 Å²	171	54.1 Å²	54.1	80%	0.799	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-27.5	-179.7	-59.5	167.8	6.7	0	0	111.8	S567 L571	S567-Q569 PolarHBondContact O-N 3.11Å; S567-Q569 PolarHBondContact OG-N 2.89Å; Q569-L571 PolarHBondContact O-N 2.95Å
570	V	68.1	Low	88.7	Confident	22 Å²	22	52 Å²	52	13%	0.133	26%	0.258	C	S	.	.			trans	-80	115.9	174.8	173.2	0	0	0	0	109.5	S567 G572 E641 G643	S567-V570 PolarHBondContact O-N 3.28Å; V570-G572 PolarHBondContact O-N 3.43Å; V570-E641 HydrophobicContact CB-CG 4.36Å; V570-E641 HydrophobicContact CG2-CG 3.83Å; V570-E641 WeakPolarHBondContact CG2-OE1 3.32Å; V570-G643 VanDerWaalsContact O-CA 3.24Å; V570-G643 WeakPolarHBondContact O-CA 3.3Å
571	L	75.7	Confident	88.7	Confident	91 Å²	91	49.7 Å²	49.7	48%	0.476	24%	0.235	S	C	.	.			trans	-85.3	102.2	168.3	-64.1	165.7	0	0	0	106.9	Q569 G598 H719	Q569-L571 PolarHBondContact O-N 2.95Å; L571-G598 WeakPolarHBondContact O-CA 3.22Å; L571-H719 PolarHBondContact O-CE1 3.31Å; L571-H719 VanDerWaalsContact O-CE1 3.27Å
572	G	82.5	Confident	88.5	Confident	2 Å²	2	49.4 Å²	49.4	2%	0.021	23%	0.234	C	C	.	.	S	Bend	trans	107.3	-132.4	174.9	0	0	0	0	0	114.3	V570 C597 G643 H719	V570-G572 PolarHBondContact O-N 3.43Å; G572-C597 WeakPolarHBondContact CA-O 3.22Å; G572-G643 WeakPolarHBondContact O-CA 3.48Å; G572-G643 PolarHBondContact O-N 3.47Å; G572-H719 WeakPolarHBondContact CA-CE1 3.29Å; G572-H719 WeakPolarHBondContact CA-NE2 3.32Å; G572-H719 PolarHBondContact N-CE1 2.91Å; G572-H719 PolarHBondContact N-NE2 3.39Å
573	V	90.2	Very high	88.3	Confident	4 Å²	4	51.5 Å²	51.5	2%	0.024	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	136	-174.9	-64.1	0	0	0	0	112	T595 E596 C597 V622 T626 I642 F721	V573-T595 HydrophobicContact CG2-CG2 4.47Å; V573-E596 CarbonylContact O-C 3.57Å; V573-C597 HydrophobicContact CG2-CB 4.04Å; V573-C597 PolarHBondContact N-O 2.87Å; V573-C597 VanDerWaalsContact N-O 3.11Å; V573-C597 PolarHBondContact O-N 3.27Å; V573-V622 HydrophobicContact CG2-CG1 4.16Å; V573-T626 HydrophobicContact CG1-CG2 4.23Å; V573-I642 HydrophobicContact CB-CD1 4.22Å; V573-I642 HydrophobicContact CG1-CD1 3.88Å; V573-I642 HydrophobicContact CG1-CG2 4.43Å; V573-F721 HydrophobicContact CG2-CE2 4.33Å; V573-F721 HydrophobicContact CG2-CZ 4.16Å
574	R	93.7	Very high	88	Confident	101 Å²	101	50.1 Å²	50.1	38%	0.381	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	115.8	169.7	173.7	-175.4	-71.1	145.4	-3.8	108.4	T595 E596 A640 E641	R574-T595 CarbonylContact C-O 3.53Å; R574-T595 WeakPolarHBondContact CA-O 3.23Å; R574-E596 HydrophobicContact CG-CG 4.34Å; R574-E596 IonicContact NE-OE1 2.7Å; R574-E596 PolarHBondContact NE-OE1 2.63Å; R574-A640 CarbonylContact O-C 3.25Å; R574-A640 WeakPolarHBondContact O-CA 3.3Å; R574-E641 HydrophobicContact CB-CB 4.25Å; R574-E641 IonicContact CZ-OE2 3.86Å; R574-E641 PolarHBondContact N-O 3.34Å; R574-E641 IonicContact NH1-OE2 2.8Å; R574-E641 PolarHBondContact NH1-OE2 3.3Å; R574-E641 PolarHBondContact O-N 3.41Å
575	I	95	Very high	87.6	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	122.2	-176.7	-57.4	167.2	0	0	0	106.8	S594 T595 V622 I625 A637	I575-S594 CarbonylContact O-C 3.52Å; I575-S594 WeakPolarHBondContact O-CA 3.34Å; I575-T595 PolarHBondContact N-O 3.48Å; I575-T595 PolarHBondContact O-N 3.22Å; I575-V622 HydrophobicContact CD1-CG1 4.43Å; I575-I625 HydrophobicContact CD1-CB 4.01Å; I575-I625 HydrophobicContact CD1-CD1 4.21Å; I575-I625 HydrophobicContact CD1-CG2 3.63Å; I575-I625 HydrophobicContact CG1-CG2 4.01Å; I575-I625 HydrophobicContact CG2-CD1 3.82Å; I575-I625 HydrophobicContact CG2-CG2 4.42Å; I575-A637 HydrophobicContact CG2-CB 3.85Å
576	Q	95.8	Very high	87.3	Confident	73 Å²	73	49.8 Å²	49.8	34%	0.341	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	128.6	173.1	-64	-174.9	33.9	0	0	109.6	G578 E638 E639	Q576-G578 VanDerWaalsContact C-N 3.27Å; Q576-G578 PolarHBondContact O-N 2.9Å; Q576-E638 PolarHBondContact O-N 3.24Å; Q576-E639 HydrophobicContact CB-CB 4.19Å; Q576-E639 HydrophobicContact CG-CB 4.36Å; Q576-E639 PolarHBondContact N-O 2.86Å; Q576-E639 PolarHBondContact NE2-OE2 3.06Å
577	N	95.3	Very high	87	Confident	63 Å²	63	49.5 Å²	49.5	34%	0.337	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	48.5	47.9	178.1	-69.7	-32	0	0	0	113.1	P592 S594 E638	N577-P592 HydrophobicContact CB-CB 3.89Å; N577-P592 HydrophobicContact CB-CG 4.32Å; N577-S594 PolarHBondContact N-OG 3.37Å; N577-E638 HydrophobicContact CB-CB 4.02Å; N577-E638 PolarHBondContact ND2-OE2 3.48Å
578	G	96.4	Very high	86.9	Confident	0 Å²	0	60.9 Å²	60.9	0%	0	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	146.3	178	0	0	0	0	0	111.9	Q576 P592 N593 Q621 P636	Q576-G578 VanDerWaalsContact C-N 3.27Å; Q576-G578 PolarHBondContact O-N 2.9Å; G578-P592 CarbonylContact O-C 3.58Å; G578-P592 VanDerWaalsContact O-CA 3.26Å; G578-P592 WeakPolarHBondContact O-CA 3.33Å; G578-N593 WeakPolarHBondContact CA-O 3.32Å; G578-N593 PolarHBondContact N-O 3.19Å; G578-N593 PolarHBondContact O-N 3.09Å; G578-Q621 VanDerWaalsContact C-CD 3.49Å; G578-Q621 PolarHBondContact O-NE2 2.93Å; G578-Q621 PolarHBondContact O-OE1 2.92Å; G578-P636 CarbonylContact C-O 3.58Å; G578-P636 WeakPolarHBondContact CA-O 3.23Å
579	R	95.6	Very high	87.7	Confident	45 Å²	45	61.3 Å²	61.3	17%	0.17	30%	0.302	C	S	.	.			trans	-123.8	147.6	178.2	-59.3	168.5	-74.3	159.5	-5.2	110.5	Y559 G560 P581 E584 F590 P592 P636	Y559-R579 PolarHBondContact O-NH1 2.95Å; Y559-R579 VanDerWaalsContact O-NH1 3.12Å; G560-R579 PolarHBondContact O-NH2 3.36Å; R579-P581 WeakPolarHBondContact O-CD 3.41Å; R579-E584 WeakPolarHBondContact CD-OE1 3.4Å; R579-E584 IonicContact CZ-OE1 3.42Å; R579-E584 IonicContact CZ-OE2 2.8Å; R579-E584 IonicContact NE-OE1 3.96Å; R579-E584 IonicContact NE-OE2 3.25Å; R579-E584 IonicContact NH1-OE1 2.84Å; R579-E584 PolarHBondContact NH1-OE1 3.03Å; R579-E584 IonicContact NH1-OE2 3.71Å; R579-E584 PolarHBondContact NH1-OE2 2.8Å; R579-F590 HydrophobicContact CB-CD1 4.04Å; R579-F590 HydrophobicContact CB-CE1 4.01Å; R579-F590 HydrophobicContact CG-CD1 4.07Å; R579-F590 HydrophobicContact CG-CE1 4.32Å; R579-P592 HydrophobicContact CG-CB 4.06Å; R579-P636 HydrophobicContact CB-CB 4.19Å; R579-P636 PolarHBondContact N-O 3.42Å; R579-P636 VanDerWaalsContact O-CG 3.27Å; R579-P636 WeakPolarHBondContact O-CG 3.37Å
580	H	95.2	Very high	88.9	Confident	5 Å²	5	55.1 Å²	55.1	2%	0.023	27%	0.273	C	S	.	.			trans	-83.4	115	174.4	-174.8	-56.3	0	0	0	109.6	L582 M583 E584 F590 I617 Q621 L624	H580-L582 VanDerWaalsContact C-N 3.3Å; H580-L582 PolarHBondContact ND1-N 2.83Å; H580-L582 PolarHBondContact O-N 3.31Å; H580-L582 VanDerWaalsContact O-N 3.13Å; H580-M583 HydrophobicContact CB-CB 3.93Å; H580-M583 PolarHBondContact ND1-N 3.3Å; H580-M583 PolarHBondContact O-N 2.98Å; H580-M583 VanDerWaalsContact O-N 3.13Å; H580-E584 WeakPolarHBondContact O-CB 3.35Å; H580-E584 PolarHBondContact O-N 3.46Å; H580-F590 HydrophobicContact CB-CE2 3.84Å; H580-F590 HydrophobicContact CB-CZ 3.69Å; H580-I617 HydrophobicContact CB-CG2 3.94Å; H580-Q621 HydrophobicContact CB-CB 4.11Å; H580-L624 VanDerWaalsContact CE1-CD1 3.47Å; H580-L624 WeakPolarHBondContact CE1-CD1 3.3Å
581	P	93.6	Very high	90.1	Very high	1 Å²	1	56.4 Å²	56.4	1%	0.006	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-34.2	-166.5	22.8	-33.1	0	0	0	113.7	L271 I274 R579 L624 M628 P636	L271-P581 HydrophobicContact CD1-CB 4.32Å; L271-P581 HydrophobicContact CD1-CG 3.99Å; I274-P581 HydrophobicContact CD1-CB 3.96Å; R579-P581 WeakPolarHBondContact O-CD 3.41Å; P581-L624 HydrophobicContact CG-CB 4.23Å; P581-L624 HydrophobicContact CG-CD1 4.03Å; P581-M628 HydrophobicContact CG-SD 4.26Å; P581-P636 HydrophobicContact CB-CG 4.18Å; P581-P636 HydrophobicContact CG-CG 4.31Å
582	L	92.3	Very high	91	Very high	5 Å²	5	54.5 Å²	54.5	3%	0.026	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-37.3	177.1	-53.4	175.7	0	0	0	113.9	Q248 I274 H580 L585 C586	Q248-L582 HydrophobicContact CB-CD1 3.78Å; I274-L582 HydrophobicContact CD1-CD2 3.89Å; I274-L582 HydrophobicContact CG1-CD2 4.1Å; I274-L582 HydrophobicContact CG2-CD2 4Å; H580-L582 VanDerWaalsContact C-N 3.3Å; H580-L582 PolarHBondContact ND1-N 2.83Å; H580-L582 PolarHBondContact O-N 3.31Å; H580-L582 VanDerWaalsContact O-N 3.13Å; L582-L585 PolarHBondContact O-N 3.04Å; L582-C586 PolarHBondContact O-SG 3.38Å
583	M	90.8	Very high	91.6	Very high	67 Å²	67	54.9 Å²	54.9	33%	0.33	28%	0.276	S	S	.	.	H	α-helix	trans	-74.8	-31.6	-175.7	-170.8	58.4	53.8	0	0	111.3	H580 L585 C586 A587 F590 I617	H580-M583 HydrophobicContact CB-CB 3.93Å; H580-M583 PolarHBondContact ND1-N 3.3Å; H580-M583 PolarHBondContact O-N 2.98Å; H580-M583 VanDerWaalsContact O-N 3.13Å; M583-L585 PolarHBondContact O-N 2.83Å; M583-C586 PolarHBondContact O-N 3.29Å; M583-C586 VanDerWaalsContact O-N 3.11Å; M583-C586 HydrophobicContact SD-CB 4.4Å; M583-A587 WeakPolarHBondContact O-CB 3.47Å; M583-A587 PolarHBondContact O-N 3.46Å; M583-F590 HydrophobicContact CB-CD2 4.16Å; M583-F590 HydrophobicContact CB-CE2 3.85Å; M583-F590 HydrophobicContact CG-CD2 3.98Å; M583-F590 HydrophobicContact CG-CE2 3.82Å; M583-I617 HydrophobicContact CB-CG2 4.41Å; M583-I617 HydrophobicContact CE-CD1 4.11Å; M583-I617 HydrophobicContact CG-CD1 4.3Å; M583-I617 HydrophobicContact CG-CG2 4.37Å; M583-I617 HydrophobicContact SD-CD1 4.46Å
584	E	90.9	Very high	91.9	Very high	55 Å²	55	57.7 Å²	57.7	26%	0.257	30%	0.295	S	S	.	.	H	α-helix	trans	-57.3	-33.2	173.2	-179.1	173.3	-167.2	0	0	112.3	R579 H580 F590	R579-E584 WeakPolarHBondContact CD-OE1 3.4Å; R579-E584 IonicContact CZ-OE1 3.42Å; R579-E584 IonicContact CZ-OE2 2.8Å; R579-E584 IonicContact NE-OE1 3.96Å; R579-E584 IonicContact NE-OE2 3.25Å; R579-E584 IonicContact NH1-OE1 2.84Å; R579-E584 PolarHBondContact NH1-OE1 3.03Å; R579-E584 IonicContact NH1-OE2 3.71Å; R579-E584 PolarHBondContact NH1-OE2 2.8Å; H580-E584 WeakPolarHBondContact O-CB 3.35Å; H580-E584 PolarHBondContact O-N 3.46Å; E584-F590 HydrophobicContact CB-CB 4.49Å
585	L	87.6	Confident	91.8	Very high	79 Å²	79	53 Å²	53	41%	0.414	28%	0.278	S	S	.	.	H	α-helix	trans	-77.7	-27.4	177.6	-58.2	175.9	0	0	0	113.1	I274 Y559 L582 M583	I274-L585 HydrophobicContact CB-CD1 4.4Å; I274-L585 HydrophobicContact CG2-CD1 3.64Å; Y559-L585 HydrophobicContact CD1-CD2 4.02Å; Y559-L585 HydrophobicContact CE1-CD1 4.48Å; Y559-L585 HydrophobicContact CE1-CD2 3.58Å; L582-L585 PolarHBondContact O-N 3.04Å; M583-L585 PolarHBondContact O-N 2.83Å
586	C	86.8	Confident	91.6	Very high	86 Å²	86	56.5 Å²	56.5	58%	0.581	29%	0.294	S	S	*	.	H	α-helix	trans	-89.1	-28.9	-178.4	-64.6	0	0	0	0	112.7	L582 M583	L582-C586 PolarHBondContact O-SG 3.38Å; M583-C586 PolarHBondContact O-N 3.29Å; M583-C586 VanDerWaalsContact O-N 3.11Å; M583-C586 HydrophobicContact SD-CB 4.4Å
587	A	84.3	Confident	91.2	Very high	37 Å²	37	53.3 Å²	53.3	31%	0.306	28%	0.28	S	S	.	.	S	Bend	trans	-94.7	140.3	-175.9	0	0	0	0	0	111.2	M583 T589	M583-A587 WeakPolarHBondContact O-CB 3.47Å; M583-A587 PolarHBondContact O-N 3.46Å; A587-T589 VanDerWaalsContact C-N 3.26Å; A587-T589 PolarHBondContact O-N 3.42Å
588	R	79.1	Confident	90.6	Very high	256 Å²	256	50.8 Å²	50.8	97%	0.966	27%	0.269	S	S	*	.	S	Bend	trans	-65.1	-30.6	174.3	-68.1	-175.7	179.6	-177.3	-0.1	113
589	T	86.9	Confident	89.6	Confident	123 Å²	123	53 Å²	53	76%	0.755	29%	0.292	S	S	*	.	S	Bend	trans	-146.5	126	179.7	-50.9	0	0	0	0	107.4	A587	A587-T589 VanDerWaalsContact C-N 3.26Å; A587-T589 PolarHBondContact O-N 3.42Å
590	F	91.8	Very high	88.4	Confident	42 Å²	42	58.8 Å²	58.8	18%	0.184	33%	0.326	C	S	.	.			trans	-114.5	132.5	178.5	-172.2	-85	0	0	0	109.5	R579 H580 M583 E584 P592 I617	R579-F590 HydrophobicContact CB-CD1 4.04Å; R579-F590 HydrophobicContact CB-CE1 4.01Å; R579-F590 HydrophobicContact CG-CD1 4.07Å; R579-F590 HydrophobicContact CG-CE1 4.32Å; H580-F590 HydrophobicContact CB-CE2 3.84Å; H580-F590 HydrophobicContact CB-CZ 3.69Å; M583-F590 HydrophobicContact CB-CD2 4.16Å; M583-F590 HydrophobicContact CB-CE2 3.85Å; M583-F590 HydrophobicContact CG-CD2 3.98Å; M583-F590 HydrophobicContact CG-CE2 3.82Å; E584-F590 HydrophobicContact CB-CB 4.49Å; F590-P592 WeakPolarHBondContact O-CD 3.42Å; F590-I617 HydrophobicContact CE2-CG2 4.13Å; F590-I617 HydrophobicContact CZ-CG2 4.34Å
591	V	93.7	Very high	87.7	Confident	49 Å²	49	62.9 Å²	62.9	30%	0.297	34%	0.344	S	S	.	.			trans	-91.7	113.6	179.1	-179.5	0	0	0	0	109	N593	V591-N593 PolarHBondContact O-ND2 3.13Å; V591-N593 VanDerWaalsContact O-ND2 3.16Å
592	P	94.6	Very high	87.3	Confident	51 Å²	51	62.9 Å²	62.9	33%	0.331	34%	0.344	S	S	.	.			trans	-69.8	147.2	179.3	29.8	-34.3	0	0	0	111.1	N577 G578 R579 F590	N577-P592 HydrophobicContact CB-CB 3.89Å; N577-P592 HydrophobicContact CB-CG 4.32Å; G578-P592 CarbonylContact O-C 3.58Å; G578-P592 VanDerWaalsContact O-CA 3.26Å; G578-P592 WeakPolarHBondContact O-CA 3.33Å; R579-P592 HydrophobicContact CG-CB 4.06Å; F590-P592 WeakPolarHBondContact O-CD 3.42Å
593	N	95.1	Very high	87.2	Confident	10 Å²	10	63.7 Å²	63.7	5%	0.053	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	132.7	-178.4	-78.1	-78.3	0	0	0	111.3	G578 V591 Y618 Q621 Y759 Q760 V761	G578-N593 WeakPolarHBondContact CA-O 3.32Å; G578-N593 PolarHBondContact N-O 3.19Å; G578-N593 PolarHBondContact O-N 3.09Å; V591-N593 PolarHBondContact O-ND2 3.13Å; V591-N593 VanDerWaalsContact O-ND2 3.16Å; N593-Y618 HydrophobicContact CB-CD2 3.91Å; N593-Y618 HydrophobicContact CB-CE2 3.96Å; N593-Q621 PolarHBondContact O-NE2 3.1Å; N593-Y759 PolarHBondContact ND2-O 3.02Å; N593-Q760 WeakPolarHBondContact OD1-CA 3.35Å; N593-V761 HydrophobicContact CB-CG2 4.41Å; N593-V761 PolarHBondContact OD1-N 2.65Å
594	S	94.9	Very high	87.3	Confident	62 Å²	62	60.5 Å²	60.5	43%	0.434	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	147.4	174.6	-62.5	0	0	0	0	111.3	I575 N577	I575-S594 CarbonylContact O-C 3.52Å; I575-S594 WeakPolarHBondContact O-CA 3.34Å; N577-S594 PolarHBondContact N-OG 3.37Å
595	T	93.2	Very high	87.4	Confident	2 Å²	2	57.9 Å²	57.9	1%	0.012	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	127.6	-177.9	-57.5	0	0	0	0	110	V573 R574 I575 Y618 V622 F721	V573-T595 HydrophobicContact CG2-CG2 4.47Å; R574-T595 CarbonylContact C-O 3.53Å; R574-T595 WeakPolarHBondContact CA-O 3.23Å; I575-T595 PolarHBondContact N-O 3.48Å; I575-T595 PolarHBondContact O-N 3.22Å; T595-Y618 WeakPolarHBondContact CG2-OH 3.41Å; T595-Y618 VanDerWaalsContact OG1-CE2 3.24Å; T595-Y618 WeakPolarHBondContact OG1-CE2 3.46Å; T595-Y618 PolarHBondContact OG1-OH 3.46Å; T595-V622 HydrophobicContact CG2-CG1 4.42Å; T595-V622 HydrophobicContact CG2-CG2 3.85Å; T595-V622 WeakPolarHBondContact OG1-CG2 3.28Å; T595-F721 HydrophobicContact CG2-CE1 3.46Å; T595-F721 VanDerWaalsContact CG2-CE1 3.46Å; T595-F721 HydrophobicContact CG2-CZ 3.48Å; T595-F721 VanDerWaalsContact CG2-CZ 3.48Å
596	E	90.8	Very high	87.6	Confident	76 Å²	76	54.1 Å²	54.1	36%	0.355	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	122.5	170.5	-60.7	-166.3	137.8	0	0	109.4	V573 R574 K601 K605	V573-E596 CarbonylContact O-C 3.57Å; R574-E596 HydrophobicContact CG-CG 4.34Å; R574-E596 IonicContact NE-OE1 2.7Å; R574-E596 PolarHBondContact NE-OE1 2.63Å; E596-K601 HydrophobicContact CB-CB 4.41Å; E596-K601 HydrophobicContact CB-CG 4.28Å; E596-K601 WeakPolarHBondContact OE2-CE 3.48Å; E596-K601 WeakPolarHBondContact OE2-CG 3.44Å; E596-K605 WeakPolarHBondContact O-CE 3.12Å; E596-K605 PolarHBondContact O-NZ 3.23Å
597	C	87.4	Confident	87.9	Confident	5 Å²	5	50 Å²	50	3%	0.034	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	123.8	178.2	-175.8	0	0	0	0	111.1	G572 V573 R603 H719 F721	G572-C597 WeakPolarHBondContact CA-O 3.22Å; V573-C597 HydrophobicContact CG2-CB 4.04Å; V573-C597 PolarHBondContact N-O 2.87Å; V573-C597 VanDerWaalsContact N-O 3.11Å; V573-C597 PolarHBondContact O-N 3.27Å; C597-R603 PolarHBondContact SG-O 2.88Å; C597-H719 PolarHBondContact SG-ND1 2.79Å; C597-F721 HydrophobicContact CB-CE1 4.4Å; C597-F721 HydrophobicContact CB-CE2 3.88Å; C597-F721 HydrophobicContact CB-CZ 3.47Å; C597-F721 VanDerWaalsContact CB-CZ 3.47Å
598	G	81.3	Confident	88.2	Confident	11 Å²	11	48.3 Å²	48.3	11%	0.113	26%	0.257	C	S	.	.	S	Bend	trans	98.8	-179.9	-179.3	0	0	0	0	0	114.8	L571 D600 K601 G602	L571-G598 WeakPolarHBondContact O-CA 3.22Å; G598-D600 PolarHBondContact O-N 3Å; G598-K601 PolarHBondContact O-N 3.09Å; G598-G602 PolarHBondContact N-O 2.93Å
599	G	75.4	Confident	88.5	Confident	47 Å²	47	36.5 Å²	36.5	49%	0.485	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	57.1	-132.6	-164.4	0	0	0	0	0	111.9	K601	G599-K601 VanDerWaalsContact C-N 3.27Å; G599-K601 PolarHBondContact O-N 3.02Å
600	D	72	Confident	88.3	Confident	166 Å²	166	31.3 Å²	31.3	89%	0.888	18%	0.183	S	C	*	.	G	3₁₀ helix	trans	-73.9	-14.6	-177.3	-57.9	-29.7	0	0	0	113.9	G598 G602	G598-D600 PolarHBondContact O-N 3Å; D600-G602 VanDerWaalsContact C-N 3.3Å; D600-G602 PolarHBondContact O-N 3.45Å
601	K	79.3	Confident	87.8	Confident	91 Å²	91	33.1 Å²	33.1	40%	0.396	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-87.1	0.9	-178.1	-67.7	-72.1	-172.8	169.2	0	113.1	E596 G598 G599 K605 Q742	E596-K601 HydrophobicContact CB-CB 4.41Å; E596-K601 HydrophobicContact CB-CG 4.28Å; E596-K601 WeakPolarHBondContact OE2-CE 3.48Å; E596-K601 WeakPolarHBondContact OE2-CG 3.44Å; G598-K601 PolarHBondContact O-N 3.09Å; G599-K601 VanDerWaalsContact C-N 3.27Å; G599-K601 PolarHBondContact O-N 3.02Å; K601-K605 PolarHBondContact O-NZ 2.93Å; K601-Q742 PolarHBondContact O-OE1 2.83Å
602	G	84.8	Confident	87.1	Confident	1 Å²	1	35.2 Å²	35.2	1%	0.01	21%	0.212	C	C	.	.			trans	78.5	157.7	-179	0	0	0	0	0	113.7	G598 D600 K605 P739 L740	G598-G602 PolarHBondContact N-O 2.93Å; D600-G602 VanDerWaalsContact C-N 3.3Å; D600-G602 PolarHBondContact O-N 3.45Å; G602-K605 WeakPolarHBondContact O-CE 3.49Å; G602-K605 PolarHBondContact O-NZ 3.16Å; G602-P739 WeakPolarHBondContact CA-O 3.43Å; G602-P739 PolarHBondContact N-O 3.1Å; G602-L740 CarbonylContact C-O 3.5Å
603	R	90.1	Very high	86.6	Confident	21 Å²	21	32.9 Å²	32.9	8%	0.079	20%	0.197	C	C	.	.	S	Bend	trans	-101.2	-18.1	-172.5	-66.3	178.6	170.4	-101.7	-4.1	113.4	C597 A681 C717 H719 I720 L740	C597-R603 PolarHBondContact SG-O 2.88Å; R603-A681 PolarHBondContact NH1-O 3.48Å; R603-C717 WeakPolarHBondContact CD-O 3.23Å; R603-C717 PolarHBondContact NH1-O 2.95Å; R603-H719 PolarHBondContact NH1-CE1 3.38Å; R603-H719 PolarHBondContact NH1-NE2 2.81Å; R603-I720 PolarHBondContact O-N 3.05Å; R603-L740 HydrophobicContact CG-CD2 4.28Å; R603-L740 PolarHBondContact N-O 3.48Å
604	V	92.8	Very high	86.2	Confident	0 Å²	0	33 Å²	33	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	117.2	-178.3	-176.3	0	0	0	0	109.6	V606 L707 L711 I720 L740 V741 Q742	V604-V606 HydrophobicContact CG1-CG2 4.38Å; V604-L707 HydrophobicContact CG1-CD2 4.3Å; V604-L711 HydrophobicContact CB-CD2 4.27Å; V604-L711 HydrophobicContact CG2-CD2 3.6Å; V604-L711 HydrophobicContact CG2-CG 4.26Å; V604-I720 CarbonylContact C-O 3.58Å; V604-I720 WeakPolarHBondContact CA-O 3.5Å; V604-I720 HydrophobicContact CG1-CB 4.33Å; V604-I720 HydrophobicContact CG2-CB 4.26Å; V604-I720 HydrophobicContact CG2-CD1 3.91Å; V604-I720 HydrophobicContact CG2-CG1 4.32Å; V604-L740 PolarHBondContact N-O 3.33Å; V604-V741 HydrophobicContact CB-CG2 4.34Å; V604-V741 WeakPolarHBondContact O-CA 3.43Å; V604-Q742 PolarHBondContact O-N 3.44Å
605	K	93.3	Very high	86	Confident	1 Å²	1	30.4 Å²	30.4	0%	0.004	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	116.5	179	-51.8	-57.1	-177.7	163.6	0	109.6	E596 K601 G602 I720 F721 V722 Q742 L744	E596-K605 WeakPolarHBondContact O-CE 3.12Å; E596-K605 PolarHBondContact O-NZ 3.23Å; K601-K605 PolarHBondContact O-NZ 2.93Å; G602-K605 WeakPolarHBondContact O-CE 3.49Å; G602-K605 PolarHBondContact O-NZ 3.16Å; K605-I720 PolarHBondContact N-O 2.83Å; K605-F721 HydrophobicContact CB-CD1 3.72Å; K605-F721 HydrophobicContact CB-CE1 4.12Å; K605-F721 HydrophobicContact CB-CG 4.34Å; K605-F721 HydrophobicContact CG-CD1 3.78Å; K605-F721 HydrophobicContact CG-CE1 3.67Å; K605-F721 HydrophobicContact CG-CG 4.46Å; K605-F721 HydrophobicContact CG-CZ 4.28Å; K605-V722 PolarHBondContact O-N 3.14Å; K605-Q742 WeakPolarHBondContact CA-O 3.4Å; K605-Q742 HydrophobicContact CD-CB 3.9Å; K605-L744 HydrophobicContact CB-CD1 4.16Å; K605-L744 HydrophobicContact CD-CD1 4.47Å
606	V	93.3	Very high	85.9	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	107.6	176.7	-177.9	0	0	0	0	108.5	V604 T608 V722 T724 L729 L735 V741 Q742 Y743 L744	V604-V606 HydrophobicContact CG1-CG2 4.38Å; V606-T608 HydrophobicContact CG1-CG2 4.4Å; V606-V722 CarbonylContact C-O 3.57Å; V606-T724 HydrophobicContact CG1-CG2 4.06Å; V606-L729 HydrophobicContact CG1-CD2 4.19Å; V606-L735 HydrophobicContact CG2-CD1 3.9Å; V606-V741 HydrophobicContact CG2-CG1 4.27Å; V606-Q742 PolarHBondContact N-O 3.44Å; V606-Y743 HydrophobicContact CB-CD1 3.79Å; V606-Y743 HydrophobicContact CB-CE1 4.05Å; V606-Y743 HydrophobicContact CG1-CD1 4.07Å; V606-Y743 HydrophobicContact CG1-CE1 4.22Å; V606-Y743 HydrophobicContact CG2-CD1 4.43Å; V606-Y743 HydrophobicContact CG2-CE1 4.25Å; V606-L744 PolarHBondContact O-N 3.41Å
607	I	92.9	Very high	86	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	121.6	-176.9	-55.5	128.7	0	0	0	109.2	K615 Y618 L619 F721 V722 A723 T724 L744	I607-K615 HydrophobicContact CG2-CD 4.48Å; I607-K615 HydrophobicContact CG2-CG 4.25Å; I607-Y618 HydrophobicContact CD1-CD1 4Å; I607-Y618 HydrophobicContact CD1-CE1 3.89Å; I607-Y618 HydrophobicContact CG1-CD1 4.4Å; I607-Y618 HydrophobicContact CG1-CE1 4.2Å; I607-L619 HydrophobicContact CD1-CD2 3.7Å; I607-L619 HydrophobicContact CD1-CG 4.47Å; I607-F721 HydrophobicContact CD1-CB 4.31Å; I607-F721 HydrophobicContact CD1-CD1 4.31Å; I607-V722 PolarHBondContact N-O 3.4Å; I607-A723 WeakPolarHBondContact O-CA 3.42Å; I607-T724 PolarHBondContact O-N 3.22Å; I607-L744 CarbonylContact C-O 3.19Å; I607-L744 WeakPolarHBondContact CA-O 3.37Å; I607-L744 HydrophobicContact CG1-CB 4.09Å; I607-L744 HydrophobicContact CG1-CD1 4.18Å
608	T	90.5	Very high	86.3	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	153	179.4	60.1	0	0	0	0	111.3	V606 T724 L727 V730 L744 T745 M746 A766	V606-T608 HydrophobicContact CG1-CG2 4.4Å; T608-T724 HydrophobicContact CG2-CG2 4.35Å; T608-L727 HydrophobicContact CG2-CD2 4.49Å; T608-V730 HydrophobicContact CG2-CG2 4.34Å; T608-L744 PolarHBondContact N-O 2.88Å; T608-L744 PolarHBondContact OG1-O 3.44Å; T608-T745 WeakPolarHBondContact O-CA 3.44Å; T608-T745 WeakPolarHBondContact O-CB 3.34Å; T608-T745 PolarHBondContact O-OG1 2.86Å; T608-M746 PolarHBondContact O-N 3.21Å; T608-M746 VanDerWaalsContact O-N 3.15Å; T608-A766 PolarHBondContact OG1-N 3.32Å
609	G	85.6	Confident	86.9	Confident	9 Å²	9	30.7 Å²	30.7	9%	0.093	19%	0.185	C	C	.	.			trans	158.6	172	175.7	0	0	0	0	0	112.5	K615	G609-K615 PolarHBondContact O-NZ 3.38Å
610	P	81.4	Confident	87.7	Confident	13 Å²	13	30.3 Å²	30.3	8%	0.084	17%	0.17	C	C	.	.			trans	-59.8	161.6	-179.2	-25.5	37.4	0	0	0	113.3	S613 K615 T748 L755 F757 H770	P610-S613 WeakPolarHBondContact O-CB 3.44Å; P610-S613 PolarHBondContact O-N 2.9Å; P610-S613 PolarHBondContact O-OG 2.73Å; P610-K615 PolarHBondContact O-NZ 3.37Å; P610-T748 HydrophobicContact CG-CG2 3.97Å; P610-L755 HydrophobicContact CB-CD2 4.31Å; P610-L755 HydrophobicContact CG-CD2 4.24Å; P610-F757 HydrophobicContact CB-CE1 3.92Å; P610-F757 HydrophobicContact CG-CE1 4.34Å; P610-H770 HydrophobicContact CG-CB 4.33Å
611	N	81.1	Confident	88.8	Confident	80 Å²	80	22.5 Å²	22.5	43%	0.428	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	150.5	167	-70.4	-11.4	0	0	0	109.4	S613 N725	N611-S613 PolarHBondContact O-N 2.88Å; N611-S613 VanDerWaalsContact O-N 3.12Å; N611-N725 PolarHBondContact OD1-ND2 3.41Å
612	S	80.1	Confident	89.6	Confident	94 Å²	94	18.1 Å²	18.1	66%	0.657	11%	0.109	S	C	*	.	T	Hydrogen-bonded Turn	trans	66	3.9	-177.7	-47.9	0	0	0	0	116	G614 Y759	S612-G614 PolarHBondContact O-N 2.81Å; S612-Y759 WeakPolarHBondContact O-CE1 3.32Å
613	S	83.6	Confident	90.1	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.007	11%	0.108	C	C	.	.	S	Bend	trans	-76.6	-0.2	175.7	70	0	0	0	0	114.6	P610 N611 M746 Y759	P610-S613 WeakPolarHBondContact O-CB 3.44Å; P610-S613 PolarHBondContact O-N 2.9Å; P610-S613 PolarHBondContact O-OG 2.73Å; N611-S613 PolarHBondContact O-N 2.88Å; N611-S613 VanDerWaalsContact O-N 3.12Å; S613-M746 WeakPolarHBondContact O-CE 3.37Å; S613-M746 WeakPolarHBondContact OG-CB 3.45Å; S613-M746 WeakPolarHBondContact OG-CG 3.33Å; S613-Y759 WeakPolarHBondContact O-CD1 3.41Å
614	G	87.1	Confident	90.3	Very high	12 Å²	12	17.1 Å²	17.1	12%	0.124	11%	0.105	C	C	.	.	S	Bend	trans	96.7	6.9	176.7	0	0	0	0	0	116.4	S612 S616 I617 Y618	S612-G614 PolarHBondContact O-N 2.81Å; G614-S616 PolarHBondContact O-N 3.08Å; G614-I617 WeakPolarHBondContact O-CB 3.22Å; G614-I617 PolarHBondContact O-N 3.39Å; G614-I617 VanDerWaalsContact O-N 3.08Å; G614-Y618 PolarHBondContact O-N 2.9Å
615	K	90.9	Very high	90.5	Very high	8 Å²	8	17.1 Å²	17.1	4%	0.035	11%	0.105	C	C	.	.	H	α-helix	trans	-50.4	-50	-179.5	-57.4	-171.7	-60	-81.4	0	113.8	I607 G609 P610 I617 Y618 L619 A723 N725 M746	I607-K615 HydrophobicContact CG2-CD 4.48Å; I607-K615 HydrophobicContact CG2-CG 4.25Å; G609-K615 PolarHBondContact O-NZ 3.38Å; P610-K615 PolarHBondContact O-NZ 3.37Å; K615-I617 VanDerWaalsContact C-N 3.34Å; K615-I617 PolarHBondContact O-N 2.92Å; K615-Y618 PolarHBondContact O-N 3.35Å; K615-L619 PolarHBondContact O-N 3.01Å; K615-L619 VanDerWaalsContact O-N 3.07Å; K615-A723 HydrophobicContact CB-CB 3.98Å; K615-N725 VanDerWaalsContact CE-OD1 3.31Å; K615-N725 WeakPolarHBondContact CE-OD1 3.14Å; K615-N725 PolarHBondContact NZ-OD1 2.86Å; K615-M746 HydrophobicContact CG-CG 3.73Å
616	S	90.9	Very high	90.6	Very high	42 Å²	42	17 Å²	17	29%	0.294	10%	0.104	S	C	.	.	H	α-helix	trans	-66.3	-36.9	-179.9	-47.1	0	0	0	0	112	G614 L619 K620 D688	G614-S616 PolarHBondContact O-N 3.08Å; S616-L619 PolarHBondContact O-N 3.12Å; S616-K620 VanDerWaalsContact O-CG 3.32Å; S616-K620 WeakPolarHBondContact O-CG 3.28Å; S616-K620 PolarHBondContact O-N 2.82Å; S616-D688 WeakPolarHBondContact CB-OD2 3.39Å; S616-D688 PolarHBondContact OG-OD2 3.28Å
617	I	92.2	Very high	90.7	Very high	54 Å²	54	17 Å²	17	28%	0.277	10%	0.104	S	C	.	.	H	α-helix	trans	-65.2	-43.6	177.2	-61	172.5	0	0	0	109.5	H580 M583 F590 G614 K615 L619 K620 Q621	H580-I617 HydrophobicContact CB-CG2 3.94Å; M583-I617 HydrophobicContact CB-CG2 4.41Å; M583-I617 HydrophobicContact CE-CD1 4.11Å; M583-I617 HydrophobicContact CG-CD1 4.3Å; M583-I617 HydrophobicContact CG-CG2 4.37Å; M583-I617 HydrophobicContact SD-CD1 4.46Å; F590-I617 HydrophobicContact CE2-CG2 4.13Å; F590-I617 HydrophobicContact CZ-CG2 4.34Å; G614-I617 WeakPolarHBondContact O-CB 3.22Å; G614-I617 PolarHBondContact O-N 3.39Å; G614-I617 VanDerWaalsContact O-N 3.08Å; K615-I617 VanDerWaalsContact C-N 3.34Å; K615-I617 PolarHBondContact O-N 2.92Å; I617-L619 PolarHBondContact O-N 2.79Å; I617-K620 PolarHBondContact O-N 2.66Å; I617-Q621 VanDerWaalsContact O-CB 3.29Å; I617-Q621 WeakPolarHBondContact O-CB 3.4Å; I617-Q621 PolarHBondContact O-N 3.36Å
618	Y	93.9	Very high	90.8	Very high	5 Å²	5	17.1 Å²	17.1	2%	0.02	11%	0.105	C	C	.	.	H	α-helix	trans	-60.2	-44.5	175.2	175.3	-107.1	0	0	0	112.5	N593 T595 I607 G614 K615 Q621 V622 F721 V761	N593-Y618 HydrophobicContact CB-CD2 3.91Å; N593-Y618 HydrophobicContact CB-CE2 3.96Å; T595-Y618 WeakPolarHBondContact CG2-OH 3.41Å; T595-Y618 VanDerWaalsContact OG1-CE2 3.24Å; T595-Y618 WeakPolarHBondContact OG1-CE2 3.46Å; T595-Y618 PolarHBondContact OG1-OH 3.46Å; I607-Y618 HydrophobicContact CD1-CD1 4Å; I607-Y618 HydrophobicContact CD1-CE1 3.89Å; I607-Y618 HydrophobicContact CG1-CD1 4.4Å; I607-Y618 HydrophobicContact CG1-CE1 4.2Å; G614-Y618 PolarHBondContact O-N 2.9Å; K615-Y618 PolarHBondContact O-N 3.35Å; Y618-Q621 WeakPolarHBondContact O-CB 3.4Å; Y618-Q621 PolarHBondContact O-N 3.49Å; Y618-V622 HydrophobicContact CE2-CG2 4.33Å; Y618-V622 WeakPolarHBondContact O-CG2 3.11Å; Y618-V622 PolarHBondContact O-N 3.07Å; Y618-V622 VanDerWaalsContact O-N 3.17Å; Y618-F721 HydrophobicContact CE1-CD1 4.49Å; Y618-V761 HydrophobicContact CD1-CG2 4.16Å; Y618-V761 HydrophobicContact CD2-CG2 3.68Å; Y618-V761 HydrophobicContact CE1-CG2 4.24Å; Y618-V761 HydrophobicContact CE2-CG2 3.78Å; Y618-V761 HydrophobicContact CG-CG2 3.87Å
619	L	93.8	Very high	91	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-60	-49.5	174.8	-72.8	-180	0	0	0	112.2	I607 K615 S616 I617 Q621 V622 G623 I652 I687 D688 F721 A723	I607-L619 HydrophobicContact CD1-CD2 3.7Å; I607-L619 HydrophobicContact CD1-CG 4.47Å; K615-L619 PolarHBondContact O-N 3.01Å; K615-L619 VanDerWaalsContact O-N 3.07Å; S616-L619 PolarHBondContact O-N 3.12Å; I617-L619 PolarHBondContact O-N 2.79Å; L619-Q621 VanDerWaalsContact C-N 3.28Å; L619-Q621 PolarHBondContact O-N 3.35Å; L619-V622 PolarHBondContact O-N 2.85Å; L619-G623 PolarHBondContact O-N 2.82Å; L619-G623 VanDerWaalsContact O-N 3.16Å; L619-I652 HydrophobicContact CB-CD1 4.24Å; L619-I687 WeakPolarHBondContact CD1-O 3.48Å; L619-D688 HydrophobicContact CD1-CB 3.73Å; L619-F721 HydrophobicContact CD2-CB 3.3Å; L619-F721 HydrophobicContact CD2-CG 4.34Å; L619-A723 HydrophobicContact CD1-CB 3.44Å; L619-A723 VanDerWaalsContact CD1-CB 3.44Å; L619-A723 HydrophobicContact CG-CB 4.16Å
620	K	93.3	Very high	91.4	Very high	39 Å²	39	16.9 Å²	16.9	17%	0.17	10%	0.101	C	C	.	.	H	α-helix	trans	-61.9	-38	179.2	-70.2	-173.7	-176.5	-155.9	0	111.7	V246 L247 S616 I617 G623 L624 I652	V246-K620 WeakPolarHBondContact O-CE 3.37Å; V246-K620 PolarHBondContact O-NZ 2.97Å; L247-K620 HydrophobicContact CD2-CB 4.16Å; L247-K620 HydrophobicContact CD2-CG 4.06Å; S616-K620 VanDerWaalsContact O-CG 3.32Å; S616-K620 WeakPolarHBondContact O-CG 3.28Å; S616-K620 PolarHBondContact O-N 2.82Å; I617-K620 PolarHBondContact O-N 2.66Å; K620-G623 PolarHBondContact O-N 3.21Å; K620-L624 WeakPolarHBondContact O-CB 3.29Å; K620-L624 VanDerWaalsContact O-CG 3.31Å; K620-L624 WeakPolarHBondContact O-CG 3.35Å; K620-L624 PolarHBondContact O-N 2.96Å; K620-I652 HydrophobicContact CG-CD1 4.08Å; K620-I652 HydrophobicContact CG-CG2 4.47Å
621	Q	94.9	Very high	92	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-57.1	-50.8	175.3	171.4	-176.9	-48.7	0	0	111.6	G578 H580 N593 I617 Y618 L619 G623 L624 I625	G578-Q621 VanDerWaalsContact C-CD 3.49Å; G578-Q621 PolarHBondContact O-NE2 2.93Å; G578-Q621 PolarHBondContact O-OE1 2.92Å; H580-Q621 HydrophobicContact CB-CB 4.11Å; N593-Q621 PolarHBondContact O-NE2 3.1Å; I617-Q621 VanDerWaalsContact O-CB 3.29Å; I617-Q621 WeakPolarHBondContact O-CB 3.4Å; I617-Q621 PolarHBondContact O-N 3.36Å; Y618-Q621 WeakPolarHBondContact O-CB 3.4Å; Y618-Q621 PolarHBondContact O-N 3.49Å; L619-Q621 VanDerWaalsContact C-N 3.28Å; L619-Q621 PolarHBondContact O-N 3.35Å; Q621-G623 VanDerWaalsContact C-N 3.3Å; Q621-G623 PolarHBondContact O-N 2.88Å; Q621-L624 PolarHBondContact O-N 3.25Å; Q621-I625 HydrophobicContact CG-CD1 3.68Å; Q621-I625 HydrophobicContact CG-CG1 4.46Å; Q621-I625 WeakPolarHBondContact O-CB 3.45Å; Q621-I625 WeakPolarHBondContact O-CG1 3.47Å; Q621-I625 PolarHBondContact O-N 3.33Å
622	V	95.2	Very high	92.6	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-60.1	-43.7	179.1	176.5	0	0	0	0	110.7	V573 I575 T595 Y618 L619 T626 F721	V573-V622 HydrophobicContact CG2-CG1 4.16Å; I575-V622 HydrophobicContact CD1-CG1 4.43Å; T595-V622 HydrophobicContact CG2-CG1 4.42Å; T595-V622 HydrophobicContact CG2-CG2 3.85Å; T595-V622 WeakPolarHBondContact OG1-CG2 3.28Å; Y618-V622 HydrophobicContact CE2-CG2 4.33Å; Y618-V622 WeakPolarHBondContact O-CG2 3.11Å; Y618-V622 PolarHBondContact O-N 3.07Å; Y618-V622 VanDerWaalsContact O-N 3.17Å; L619-V622 PolarHBondContact O-N 2.85Å; V622-T626 WeakPolarHBondContact O-CB 3.29Å; V622-T626 PolarHBondContact O-N 3.14Å; V622-T626 VanDerWaalsContact O-N 3.11Å; V622-T626 PolarHBondContact O-OG1 3.49Å; V622-F721 HydrophobicContact CG1-CD2 4.38Å; V622-F721 HydrophobicContact CG1-CE1 4.44Å; V622-F721 HydrophobicContact CG1-CE2 3.86Å; V622-F721 HydrophobicContact CG1-CZ 3.88Å; V622-F721 HydrophobicContact CG2-CE1 4.45Å
623	G	94.4	Very high	93.4	Very high	0 Å²	0	8 Å²	8	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-60.9	-47.6	176.2	0	0	0	0	0	113.3	L619 K620 Q621 T626 F627	L619-G623 PolarHBondContact O-N 2.82Å; L619-G623 VanDerWaalsContact O-N 3.16Å; K620-G623 PolarHBondContact O-N 3.21Å; Q621-G623 VanDerWaalsContact C-N 3.3Å; Q621-G623 PolarHBondContact O-N 2.88Å; G623-T626 PolarHBondContact O-N 3.48Å; G623-F627 VanDerWaalsContact O-CB 3.3Å; G623-F627 WeakPolarHBondContact O-CB 3.35Å; G623-F627 PolarHBondContact O-N 3.4Å
624	L	95.6	Very high	94	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-67.5	-42.6	-178.4	-75.9	168.1	0	0	0	112.6	L247 I249 L271 H580 P581 K620 Q621 T626 F627 M628	L247-L624 HydrophobicContact CB-CD2 4.03Å; L247-L624 HydrophobicContact CB-CG 4.35Å; L247-L624 WeakPolarHBondContact O-CD2 3.37Å; I249-L624 HydrophobicContact CG1-CD2 4.19Å; L271-L624 HydrophobicContact CB-CD2 4.4Å; L271-L624 HydrophobicContact CD2-CD2 3.85Å; L271-L624 HydrophobicContact CG-CD2 4.5Å; H580-L624 VanDerWaalsContact CE1-CD1 3.47Å; H580-L624 WeakPolarHBondContact CE1-CD1 3.3Å; P581-L624 HydrophobicContact CG-CB 4.23Å; P581-L624 HydrophobicContact CG-CD1 4.03Å; K620-L624 WeakPolarHBondContact O-CB 3.29Å; K620-L624 VanDerWaalsContact O-CG 3.31Å; K620-L624 WeakPolarHBondContact O-CG 3.35Å; K620-L624 PolarHBondContact O-N 2.96Å; Q621-L624 PolarHBondContact O-N 3.25Å; L624-T626 VanDerWaalsContact C-N 3.33Å; L624-T626 PolarHBondContact O-N 3.22Å; L624-F627 PolarHBondContact O-N 3.36Å; L624-M628 WeakPolarHBondContact O-CB 3.28Å; L624-M628 VanDerWaalsContact O-CG 3.27Å; L624-M628 WeakPolarHBondContact O-CG 3.46Å; L624-M628 PolarHBondContact O-N 2.75Å
625	I	96.4	Very high	94.5	Very high	0 Å²	0	7.6 Å²	7.6	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-61.4	-45.6	176	-71.5	170.9	0	0	0	110.3	I575 Q621 M628 A629 V635 P636	I575-I625 HydrophobicContact CD1-CB 4.01Å; I575-I625 HydrophobicContact CD1-CD1 4.21Å; I575-I625 HydrophobicContact CD1-CG2 3.63Å; I575-I625 HydrophobicContact CG1-CG2 4.01Å; I575-I625 HydrophobicContact CG2-CD1 3.82Å; I575-I625 HydrophobicContact CG2-CG2 4.42Å; Q621-I625 HydrophobicContact CG-CD1 3.68Å; Q621-I625 HydrophobicContact CG-CG1 4.46Å; Q621-I625 WeakPolarHBondContact O-CB 3.45Å; Q621-I625 WeakPolarHBondContact O-CG1 3.47Å; Q621-I625 PolarHBondContact O-N 3.33Å; I625-M628 PolarHBondContact O-N 3.39Å; I625-A629 PolarHBondContact O-N 2.76Å; I625-V635 HydrophobicContact CG2-CB 4.11Å; I625-V635 HydrophobicContact CG2-CG1 4.34Å; I625-V635 HydrophobicContact CG2-CG2 4.36Å; I625-P636 HydrophobicContact CD1-CG 4.33Å; I625-P636 HydrophobicContact CG1-CG 3.74Å
626	T	95.1	Very high	94.8	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-62.4	-45.3	177.4	-52.1	0	0	0	0	110.8	V573 V622 G623 L624 A629 L630 I642 V645 L684	V573-T626 HydrophobicContact CG1-CG2 4.23Å; V622-T626 WeakPolarHBondContact O-CB 3.29Å; V622-T626 PolarHBondContact O-N 3.14Å; V622-T626 VanDerWaalsContact O-N 3.11Å; V622-T626 PolarHBondContact O-OG1 3.49Å; G623-T626 PolarHBondContact O-N 3.48Å; L624-T626 VanDerWaalsContact C-N 3.33Å; L624-T626 PolarHBondContact O-N 3.22Å; T626-A629 PolarHBondContact O-N 2.87Å; T626-L630 HydrophobicContact CG2-CD1 3.94Å; T626-L630 VanDerWaalsContact O-CG 3.27Å; T626-L630 WeakPolarHBondContact O-CG 3.32Å; T626-L630 PolarHBondContact O-N 2.97Å; T626-I642 HydrophobicContact CG2-CG2 4.33Å; T626-V645 HydrophobicContact CG2-CG1 4.49Å; T626-V645 HydrophobicContact CG2-CG2 4.08Å; T626-L684 HydrophobicContact CG2-CD2 4.09Å
627	F	95.3	Very high	95.1	Very high	0 Å²	0	5.4 Å²	5.4	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-60.5	-48.5	177.1	175	-95	0	0	0	112.5	I239 Y244 I249 L271 F291 P294 G623 L624 A629 L630 V631 I648	I239-F627 HydrophobicContact CD1-CD2 3.46Å; I239-F627 VanDerWaalsContact CD1-CD2 3.46Å; I239-F627 HydrophobicContact CD1-CE2 3.56Å; Y244-F627 HydrophobicContact CE1-CE2 4.04Å; Y244-F627 HydrophobicContact CE1-CZ 4.35Å; I249-F627 HydrophobicContact CD1-CD1 4.01Å; I249-F627 HydrophobicContact CD1-CD2 3.78Å; I249-F627 HydrophobicContact CD1-CE1 3.97Å; I249-F627 HydrophobicContact CD1-CE2 3.72Å; I249-F627 HydrophobicContact CD1-CG 3.91Å; I249-F627 HydrophobicContact CD1-CZ 3.81Å; I249-F627 HydrophobicContact CG1-CD1 4.27Å; I249-F627 HydrophobicContact CG1-CE1 4.13Å; I249-F627 HydrophobicContact CG1-CZ 4.35Å; I249-F627 HydrophobicContact CG2-CE1 3.8Å; I249-F627 HydrophobicContact CG2-CZ 3.72Å; L271-F627 HydrophobicContact CD2-CD1 3.52Å; L271-F627 HydrophobicContact CD2-CE1 3.64Å; F291-F627 HydrophobicContact CB-CZ 4.05Å; F291-F627 AromaticContact CD1-CE1 3.92Å; F291-F627 HydrophobicContact CD1-CE1 3.92Å; F291-F627 HydrophobicContact CD1-CZ 4.18Å; F291-F627 HydrophobicContact CE1-CE1 4.27Å; F291-F627 HydrophobicContact CG-CE1 4.15Å; F291-F627 HydrophobicContact CG-CZ 4.11Å; F291-F627 WeakPolarHBondContact O-CE2 3.41Å; F291-F627 VanDerWaalsContact O-CZ 3.23Å; F291-F627 WeakPolarHBondContact O-CZ 3.29Å; P294-F627 HydrophobicContact CB-CE2 4.48Å; P294-F627 HydrophobicContact CG-CD2 4.38Å; P294-F627 HydrophobicContact CG-CE2 3.97Å; G623-F627 VanDerWaalsContact O-CB 3.3Å; G623-F627 WeakPolarHBondContact O-CB 3.35Å; G623-F627 PolarHBondContact O-N 3.4Å; L624-F627 PolarHBondContact O-N 3.36Å; F627-A629 VanDerWaalsContact C-N 3.27Å; F627-A629 PolarHBondContact O-N 2.89Å; F627-L630 CarbonylContact O-C 3.58Å; F627-L630 PolarHBondContact O-N 2.93Å; F627-V631 HydrophobicContact CD1-CG2 4.24Å; F627-V631 HydrophobicContact CE1-CG2 3.76Å; F627-V631 HydrophobicContact CE2-CG2 4.3Å; F627-V631 HydrophobicContact CZ-CG2 3.81Å; F627-V631 WeakPolarHBondContact O-CG2 3.27Å; F627-V631 PolarHBondContact O-N 3.01Å; F627-I648 HydrophobicContact CB-CD1 4.24Å
628	M	96.1	Very high	95.2	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.005	4%	0.04	C	C	.	.	H	α-helix	trans	-58.8	-39.7	177.6	-73.4	175.2	75.4	0	0	111.9	L271 L275 Y561 P581 L624 I625 V631 G632 S633 F634 V635 P636	L271-M628 HydrophobicContact CD1-CG 4.09Å; L271-M628 HydrophobicContact CD1-SD 3.82Å; L271-M628 HydrophobicContact CD2-CG 3.89Å; L275-M628 HydrophobicContact CD1-CE 3.88Å; L275-M628 HydrophobicContact CD1-CG 4.45Å; L275-M628 HydrophobicContact CD2-CE 4.29Å; Y561-M628 HydrophobicContact CD2-CE 3.87Å; Y561-M628 HydrophobicContact CE2-CE 3.53Å; P581-M628 HydrophobicContact CG-SD 4.26Å; L624-M628 WeakPolarHBondContact O-CB 3.28Å; L624-M628 VanDerWaalsContact O-CG 3.27Å; L624-M628 WeakPolarHBondContact O-CG 3.46Å; L624-M628 PolarHBondContact O-N 2.75Å; I625-M628 PolarHBondContact O-N 3.39Å; M628-V631 PolarHBondContact O-N 2.94Å; M628-G632 PolarHBondContact O-N 3.5Å; M628-S633 WeakPolarHBondContact O-CB 3.47Å; M628-S633 PolarHBondContact O-N 3.43Å; M628-F634 WeakPolarHBondContact CE-O 3.4Å; M628-V635 HydrophobicContact CB-CG1 3.92Å; M628-P636 VanDerWaalsContact SD-CD 3.55Å; M628-P636 HydrophobicContact SD-CG 4.18Å
629	A	95.2	Very high	95.3	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-63.8	-38.8	173.6	0	0	0	0	0	112.1	P564 Y566 I625 T626 F627 V631 G632 V635 I642	P564-A629 HydrophobicContact CB-CB 4.12Å; P564-A629 HydrophobicContact CG-CB 4.19Å; Y566-A629 HydrophobicContact CE1-CB 4.37Å; Y566-A629 PolarHBondContact OH-O 3.22Å; I625-A629 PolarHBondContact O-N 2.76Å; T626-A629 PolarHBondContact O-N 2.87Å; F627-A629 VanDerWaalsContact C-N 3.27Å; F627-A629 PolarHBondContact O-N 2.89Å; A629-V631 VanDerWaalsContact C-N 3.28Å; A629-V631 PolarHBondContact O-N 2.9Å; A629-G632 PolarHBondContact O-N 2.86Å; A629-G632 VanDerWaalsContact O-N 3.09Å; A629-V635 HydrophobicContact CB-CG1 4.03Å; A629-I642 HydrophobicContact CB-CB 4.48Å; A629-I642 HydrophobicContact CB-CG1 3.78Å
630	L	93.3	Very high	95.3	Very high	4 Å²	4	12.7 Å²	12.7	2%	0.021	6%	0.06	C	C	.	.	H	α-helix	trans	-76.5	-12.2	178.1	-63.9	164.3	0	0	0	113.8	V237 P294 T295 L301 T626 F627 V645 I648	V237-L630 HydrophobicContact CG1-CD1 4.15Å; V237-L630 HydrophobicContact CG2-CB 4.38Å; V237-L630 HydrophobicContact CG2-CD1 4.08Å; V237-L630 HydrophobicContact CG2-CD2 4.06Å; V237-L630 HydrophobicContact CG2-CG 4.39Å; P294-L630 HydrophobicContact CB-CB 4Å; T295-L630 PolarHBondContact N-O 2.77Å; T295-L630 VanDerWaalsContact O-O 3.1Å; L301-L630 WeakPolarHBondContact CD2-O 3.3Å; T626-L630 HydrophobicContact CG2-CD1 3.94Å; T626-L630 VanDerWaalsContact O-CG 3.27Å; T626-L630 WeakPolarHBondContact O-CG 3.32Å; T626-L630 PolarHBondContact O-N 2.97Å; F627-L630 CarbonylContact O-C 3.58Å; F627-L630 PolarHBondContact O-N 2.93Å; L630-V645 HydrophobicContact CD1-CB 4.07Å; L630-V645 HydrophobicContact CD1-CG1 4.07Å; L630-V645 HydrophobicContact CD2-CB 4.42Å; L630-I648 HydrophobicContact CD1-CD1 4.13Å
631	V	93.8	Very high	95.4	Very high	1 Å²	1	13 Å²	13	1%	0.006	6%	0.062	C	C	.	.	H	α-helix	trans	-82.1	-21.1	166.6	171.1	0	0	0	0	111.2	W290 F291 P294 R304 F627 M628 A629	W290-V631 HydrophobicContact CB-CG1 4.24Å; F291-V631 HydrophobicContact CD2-CG1 3.85Å; F291-V631 HydrophobicContact CD2-CG2 4.1Å; F291-V631 HydrophobicContact CE2-CG1 3.75Å; F291-V631 HydrophobicContact CE2-CG2 4.42Å; P294-V631 HydrophobicContact CB-CG2 4.46Å; R304-V631 PolarHBondContact NH1-O 3.33Å; F627-V631 HydrophobicContact CD1-CG2 4.24Å; F627-V631 HydrophobicContact CE1-CG2 3.76Å; F627-V631 HydrophobicContact CE2-CG2 4.3Å; F627-V631 HydrophobicContact CZ-CG2 3.81Å; F627-V631 WeakPolarHBondContact O-CG2 3.27Å; F627-V631 PolarHBondContact O-N 3.01Å; M628-V631 PolarHBondContact O-N 2.94Å; A629-V631 VanDerWaalsContact C-N 3.28Å; A629-V631 PolarHBondContact O-N 2.9Å
632	G	94.1	Very high	95.2	Very high	0 Å²	0	13 Å²	13	0%	0	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.5	25.8	-172.5	0	0	0	0	0	113.1	L305 I308 M628 A629	L305-G632 WeakPolarHBondContact CD2-O 3.39Å; I308-G632 VanDerWaalsContact CD1-O 3.31Å; I308-G632 WeakPolarHBondContact CD1-O 3.47Å; M628-G632 PolarHBondContact O-N 3.5Å; A629-G632 PolarHBondContact O-N 2.86Å; A629-G632 VanDerWaalsContact O-N 3.09Å
633	S	96.3	Very high	95	Very high	1 Å²	1	13.3 Å²	13.3	1%	0.007	7%	0.066	C	C	.	.			trans	-92.3	159.3	172.3	179.9	0	0	0	0	111.1	M628	M628-S633 WeakPolarHBondContact O-CB 3.47Å; M628-S633 PolarHBondContact O-N 3.43Å
634	F	96.9	Very high	94.6	Very high	4 Å²	4	15.7 Å²	15.7	2%	0.018	9%	0.085	C	C	.	.			trans	-68.5	155.3	162.4	-78.5	37.4	0	0	0	109.2	L305 I308 Q309 L312 A556 S562 R563 M628	L305-F634 HydrophobicContact CB-CE1 4.4Å; L305-F634 HydrophobicContact CD2-CD1 3.57Å; L305-F634 HydrophobicContact CD2-CE1 3.71Å; I308-F634 HydrophobicContact CB-CD1 4.08Å; I308-F634 HydrophobicContact CB-CE1 3.73Å; I308-F634 HydrophobicContact CB-CZ 4.44Å; I308-F634 HydrophobicContact CD1-CD1 4.43Å; I308-F634 HydrophobicContact CG2-CD1 3.37Å; I308-F634 HydrophobicContact CG2-CD2 4.43Å; I308-F634 HydrophobicContact CG2-CE1 3.31Å; I308-F634 HydrophobicContact CG2-CE2 4.38Å; I308-F634 HydrophobicContact CG2-CG 3.97Å; I308-F634 HydrophobicContact CG2-CZ 3.85Å; Q309-F634 HydrophobicContact CB-CZ 4.03Å; L312-F634 HydrophobicContact CD1-CD2 4.11Å; L312-F634 HydrophobicContact CD1-CE2 3.77Å; L312-F634 HydrophobicContact CD1-CZ 4.05Å; L312-F634 HydrophobicContact CD2-CD2 4.09Å; L312-F634 HydrophobicContact CD2-CE2 3.86Å; L312-F634 HydrophobicContact CG-CE2 4.44Å; A556-F634 HydrophobicContact CB-CB 3.78Å; A556-F634 HydrophobicContact CB-CD2 4.28Å; A556-F634 HydrophobicContact CB-CG 4.19Å; S562-F634 CarbonylContact O-C 3.59Å; S562-F634 WeakPolarHBondContact O-CA 3.41Å; S562-F634 WeakPolarHBondContact O-CB 3.48Å; R563-F634 HydrophobicContact CB-CD2 4.27Å; R563-F634 HydrophobicContact CB-CE1 4.04Å; R563-F634 HydrophobicContact CB-CE2 3.76Å; R563-F634 HydrophobicContact CB-CZ 3.64Å; R563-F634 HydrophobicContact CG-CE1 4.05Å; R563-F634 HydrophobicContact CG-CZ 4Å; M628-F634 WeakPolarHBondContact CE-O 3.4Å
635	V	97.3	Very high	94.3	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.087	C	C	.	.	B	Isolated β-bridge	trans	-121.8	151.6	-168.2	-62.2	0	0	0	0	113.2	Y561 S562 P564 I625 M628 A629 A637 A640	Y561-V635 WeakPolarHBondContact CA-O 3.17Å; Y561-V635 WeakPolarHBondContact CB-O 3.25Å; S562-V635 PolarHBondContact N-O 3.43Å; S562-V635 PolarHBondContact O-N 2.89Å; P564-V635 HydrophobicContact CB-CG1 4.43Å; P564-V635 HydrophobicContact CB-CG2 4.26Å; P564-V635 HydrophobicContact CG-CG1 4.32Å; I625-V635 HydrophobicContact CG2-CB 4.11Å; I625-V635 HydrophobicContact CG2-CG1 4.34Å; I625-V635 HydrophobicContact CG2-CG2 4.36Å; M628-V635 HydrophobicContact CB-CG1 3.92Å; A629-V635 HydrophobicContact CB-CG1 4.03Å; V635-A637 HydrophobicContact CG2-CB 4.32Å; V635-A637 PolarHBondContact O-N 3.15Å; V635-A640 HydrophobicContact CG2-CB 3.55Å
636	P	96.6	Very high	93.9	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.096	C	C	.	.	S	Bend	trans	-76.5	71.6	178.5	31.7	-36.6	0	0	0	111.2	Y561 G578 R579 P581 I625 M628	Y561-P636 HydrophobicContact CD1-CB 3.84Å; Y561-P636 HydrophobicContact CE1-CB 3.5Å; Y561-P636 VanDerWaalsContact CE1-CB 3.5Å; Y561-P636 HydrophobicContact CE1-CG 4.42Å; G578-P636 CarbonylContact C-O 3.58Å; G578-P636 WeakPolarHBondContact CA-O 3.23Å; R579-P636 HydrophobicContact CB-CB 4.19Å; R579-P636 PolarHBondContact N-O 3.42Å; R579-P636 VanDerWaalsContact O-CG 3.27Å; R579-P636 WeakPolarHBondContact O-CG 3.37Å; P581-P636 HydrophobicContact CB-CG 4.18Å; P581-P636 HydrophobicContact CG-CG 4.31Å; I625-P636 HydrophobicContact CD1-CG 4.33Å; I625-P636 HydrophobicContact CG1-CG 3.74Å; M628-P636 VanDerWaalsContact SD-CD 3.55Å; M628-P636 HydrophobicContact SD-CG 4.18Å
637	A	96.8	Very high	93.7	Very high	3 Å²	3	17.8 Å²	17.8	3%	0.025	10%	0.097	C	C	.	.	S	Bend	trans	-149.2	163.8	176.8	0	0	0	0	0	109.9	S562 I575 V635 A640	S562-A637 VanDerWaalsContact CB-O 3.25Å; S562-A637 WeakPolarHBondContact CB-O 3.33Å; S562-A637 PolarHBondContact OG-O 3.21Å; I575-A637 HydrophobicContact CG2-CB 3.85Å; V635-A637 HydrophobicContact CG2-CB 4.32Å; V635-A637 PolarHBondContact O-N 3.15Å; A637-A640 HydrophobicContact CB-CB 4.3Å
638	E	95.6	Very high	93.5	Very high	121 Å²	121	17.9 Å²	17.9	57%	0.565	10%	0.098	S	C	*	.	S	Bend	trans	-71.9	-49.2	167.9	-175.8	175.7	179.6	0	0	109.9	S562 Q576 N577	S562-E638 WeakPolarHBondContact CB-O 3.41Å; S562-E638 PolarHBondContact OG-O 3.37Å; Q576-E638 PolarHBondContact O-N 3.24Å; N577-E638 HydrophobicContact CB-CB 4.02Å; N577-E638 PolarHBondContact ND2-OE2 3.48Å
639	E	95.2	Very high	93.3	Very high	87 Å²	87	18 Å²	18	41%	0.407	10%	0.098	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	142.7	171.8	-59	-169.1	149.8	0	0	109.8	Q576	Q576-E639 HydrophobicContact CB-CB 4.19Å; Q576-E639 HydrophobicContact CG-CB 4.36Å; Q576-E639 PolarHBondContact N-O 2.86Å; Q576-E639 PolarHBondContact NE2-OE2 3.06Å
640	A	95.1	Very high	93	Very high	5 Å²	5	18.4 Å²	18.4	4%	0.041	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	130	173.5	0	0	0	0	0	110.7	P564 R565 R574 V635 A637	P564-A640 CarbonylContact C-O 3.59Å; P564-A640 WeakPolarHBondContact CA-O 3.1Å; P564-A640 HydrophobicContact CB-CB 4.43Å; R565-A640 PolarHBondContact N-O 2.94Å; R574-A640 CarbonylContact O-C 3.25Å; R574-A640 WeakPolarHBondContact O-CA 3.3Å; V635-A640 HydrophobicContact CG2-CB 3.55Å; A637-A640 HydrophobicContact CB-CB 4.3Å
641	E	93.9	Very high	92.8	Very high	44 Å²	44	19.1 Å²	19.1	21%	0.206	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	117.5	173.4	-172.3	178.2	-165.2	0	0	108.6	R565 S567 V570 R574	R565-E641 CarbonylContact O-C 3.59Å; R565-E641 VanDerWaalsContact O-CA 3.29Å; R565-E641 WeakPolarHBondContact O-CA 3.27Å; S567-E641 WeakPolarHBondContact CB-OE1 3.43Å; S567-E641 PolarHBondContact OG-OE1 3.04Å; V570-E641 HydrophobicContact CB-CG 4.36Å; V570-E641 HydrophobicContact CG2-CG 3.83Å; V570-E641 WeakPolarHBondContact CG2-OE1 3.32Å; R574-E641 HydrophobicContact CB-CB 4.25Å; R574-E641 IonicContact CZ-OE2 3.86Å; R574-E641 PolarHBondContact N-O 3.34Å; R574-E641 IonicContact NH1-OE2 2.8Å; R574-E641 PolarHBondContact NH1-OE2 3.3Å; R574-E641 PolarHBondContact O-N 3.41Å
642	I	92	Very high	91.9	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	123.8	-172	-52.4	-63.1	0	0	0	108.4	R565 Y566 S567 V573 T626 A629 V645	R565-I642 PolarHBondContact O-N 3.13Å; Y566-I642 WeakPolarHBondContact CA-O 3.47Å; Y566-I642 HydrophobicContact CD1-CB 4.39Å; S567-I642 PolarHBondContact N-O 3.3Å; V573-I642 HydrophobicContact CB-CD1 4.22Å; V573-I642 HydrophobicContact CG1-CD1 3.88Å; V573-I642 HydrophobicContact CG1-CG2 4.43Å; T626-I642 HydrophobicContact CG2-CG2 4.33Å; A629-I642 HydrophobicContact CB-CB 4.48Å; A629-I642 HydrophobicContact CB-CG1 3.78Å; I642-V645 HydrophobicContact CG2-CG2 4.48Å
643	G	89.3	Confident	90.6	Very high	7 Å²	7	25.9 Å²	25.9	7%	0.072	13%	0.134	C	C	.	.			trans	-78.6	-173.2	173.6	0	0	0	0	0	112.7	V570 G572 V645	V570-G643 VanDerWaalsContact O-CA 3.24Å; V570-G643 WeakPolarHBondContact O-CA 3.3Å; G572-G643 WeakPolarHBondContact O-CA 3.48Å; G572-G643 PolarHBondContact O-N 3.47Å; G643-V645 PolarHBondContact O-N 2.95Å
644	A	86.4	Confident	88.6	Confident	50 Å²	50	26.8 Å²	26.8	41%	0.413	14%	0.141	S	C	.	.			trans	-68.2	119.9	173.8	0	0	0	0	0	110.7	Q682	A644-Q682 HydrophobicContact CB-CG 4.37Å; A644-Q682 WeakPolarHBondContact O-CB 3.46Å
645	V	90.1	Very high	86.4	Confident	5 Å²	5	30.8 Å²	30.8	3%	0.03	17%	0.169	C	C	.	.			trans	-123.1	122.9	176.5	179.9	0	0	0	0	109	T626 L630 I642 G643 I648 Q682 L684	T626-V645 HydrophobicContact CG2-CG1 4.49Å; T626-V645 HydrophobicContact CG2-CG2 4.08Å; L630-V645 HydrophobicContact CD1-CB 4.07Å; L630-V645 HydrophobicContact CD1-CG1 4.07Å; L630-V645 HydrophobicContact CD2-CB 4.42Å; I642-V645 HydrophobicContact CG2-CG2 4.48Å; G643-V645 PolarHBondContact O-N 2.95Å; V645-I648 HydrophobicContact CG1-CG1 4.28Å; V645-Q682 WeakPolarHBondContact CA-O 3.43Å; V645-L684 HydrophobicContact CG1-CB 4.33Å
646	D	88.4	Confident	84.1	Confident	36 Å²	36	38.7 Å²	38.7	19%	0.193	21%	0.206	C	C	.	.			trans	-101.5	-23.6	-177	70.6	-23.3	0	0	0	113.4	V237 N238 T680 Q682 S683	V237-D646 CarbonylContact C-O 3.56Å; V237-D646 WeakPolarHBondContact CA-O 3.35Å; N238-D646 PolarHBondContact N-O 3.48Å; D646-T680 PolarHBondContact OD1-OG1 2.96Å; D646-T680 WeakPolarHBondContact OD2-CB 3.3Å; D646-T680 WeakPolarHBondContact OD2-CG2 3.4Å; D646-T680 PolarHBondContact OD2-OG1 3.1Å; D646-Q682 HydrophobicContact CB-CB 4.3Å; D646-Q682 VanDerWaalsContact OD1-C 3.24Å; D646-S683 WeakPolarHBondContact OD1-CA 3.33Å; D646-S683 WeakPolarHBondContact OD1-CB 3.21Å; D646-S683 PolarHBondContact OD1-N 2.83Å; D646-S683 PolarHBondContact OD1-OG 2.86Å
647	A	89.4	Confident	81.8	Confident	4 Å²	4	41.2 Å²	41.2	3%	0.033	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	149.4	179.5	0	0	0	0	0	112.6	N238 F649 S683 L684	N238-A647 HydrophobicContact CB-CB 3.85Å; N238-A647 CarbonylContact O-C 3.59Å; N238-A647 WeakPolarHBondContact O-CA 3.28Å; A647-F649 HydrophobicContact CB-CD2 4.12Å; A647-F649 HydrophobicContact CB-CE2 3.44Å; A647-F649 VanDerWaalsContact CB-CE2 3.44Å; A647-F649 HydrophobicContact CB-CZ 3.83Å; A647-S683 WeakPolarHBondContact O-CA 3.34Å; A647-L684 PolarHBondContact O-N 2.76Å
648	I	92	Very high	79.5	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	112.2	170.3	-56.4	174.4	0	0	0	108.7	V237 N238 I239 T243 F627 L630 V645 T650 L684	V237-I648 HydrophobicContact CG1-CG1 4.49Å; N238-I648 PolarHBondContact O-N 2.89Å; I239-I648 HydrophobicContact CD1-CD1 4.32Å; I239-I648 HydrophobicContact CG1-CB 4.39Å; T243-I648 HydrophobicContact CG2-CG2 4.11Å; F627-I648 HydrophobicContact CB-CD1 4.24Å; L630-I648 HydrophobicContact CD1-CD1 4.13Å; V645-I648 HydrophobicContact CG1-CG1 4.28Å; I648-T650 HydrophobicContact CG2-CG2 4.25Å; I648-L684 CarbonylContact C-O 3.44Å; I648-L684 WeakPolarHBondContact CA-O 3.24Å; I648-L684 HydrophobicContact CG1-CB 4.42Å
649	F	91.3	Very high	77.1	Confident	3 Å²	3	48.1 Å²	48.1	1%	0.013	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	135.7	175.4	-62.7	-75.3	0	0	0	110.2	D240 A647 A675 N678 A679 L684 V685 L686	D240-F649 WeakPolarHBondContact OD2-CD1 3.41Å; A647-F649 HydrophobicContact CB-CD2 4.12Å; A647-F649 HydrophobicContact CB-CE2 3.44Å; A647-F649 VanDerWaalsContact CB-CE2 3.44Å; A647-F649 HydrophobicContact CB-CZ 3.83Å; F649-A675 HydrophobicContact CB-CB 3.8Å; F649-A675 HydrophobicContact CD1-CB 4.28Å; F649-A675 HydrophobicContact CG-CB 3.95Å; F649-N678 HydrophobicContact CE1-CB 4.29Å; F649-N678 HydrophobicContact CZ-CB 3.8Å; F649-A679 HydrophobicContact CD2-CB 4.15Å; F649-A679 HydrophobicContact CE2-CB 3.98Å; F649-L684 PolarHBondContact N-O 3.1Å; F649-V685 HydrophobicContact CB-CG1 4.42Å; F649-V685 HydrophobicContact CB-CG2 4.35Å; F649-V685 HydrophobicContact CD2-CG2 4.24Å; F649-V685 WeakPolarHBondContact O-CA 3.36Å; F649-L686 PolarHBondContact O-N 3.3Å
650	T	90.1	Very high	75.2	Confident	9 Å²	9	46.3 Å²	46.3	6%	0.055	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	140.6	177	66.4	0	0	0	0	111.8	T243 L247 I648 L686	T243-T650 VanDerWaalsContact CA-OG1 3.27Å; T243-T650 WeakPolarHBondContact CA-OG1 3.43Å; T243-T650 WeakPolarHBondContact CB-OG1 3.31Å; T243-T650 HydrophobicContact CG2-CG2 3.54Å; T243-T650 PolarHBondContact OG1-N 3.49Å; T243-T650 PolarHBondContact OG1-OG1 2.91Å; L247-T650 HydrophobicContact CD1-CG2 4.45Å; L247-T650 HydrophobicContact CG-CG2 4.41Å; I648-T650 HydrophobicContact CG2-CG2 4.25Å; T650-L686 CarbonylContact C-O 3.56Å; T650-L686 WeakPolarHBondContact CA-O 3.42Å; T650-L686 HydrophobicContact CG2-CB 4.12Å; T650-L686 HydrophobicContact CG2-CD1 3.99Å; T650-L686 HydrophobicContact CG2-CG 4.34Å
651	R	88.3	Confident	73.4	Confident	19 Å²	19	49.4 Å²	49.4	7%	0.072	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	90.2	156.8	-172.3	-73.2	173.4	168.8	-7.6	105.5	D668 Q671 V672 L686 D688 E689	R651-D668 VanDerWaalsContact CZ-CG 3.48Å; R651-D668 IonicContact CZ-OD1 2.73Å; R651-D668 IonicContact CZ-OD2 3.83Å; R651-D668 VanDerWaalsContact NE-CG 3.29Å; R651-D668 IonicContact NE-OD1 3.66Å; R651-D668 PolarHBondContact NE-OD1 3.29Å; R651-D668 IonicContact NE-OD2 3.42Å; R651-D668 IonicContact NH2-OD1 3.96Å; R651-D668 PolarHBondContact NH2-OD1 3.28Å; R651-D668 IonicContact NH2-OD2 3.68Å; R651-D668 PolarHBondContact NH2-OD2 2.69Å; R651-Q671 HydrophobicContact CB-CB 4.4Å; R651-Q671 HydrophobicContact CG-CB 4.3Å; R651-V672 HydrophobicContact CB-CG2 4.24Å; R651-V672 HydrophobicContact CG-CG2 4.14Å; R651-L686 PolarHBondContact N-O 3.03Å; R651-D688 PolarHBondContact NH1-O 3.13Å; R651-D688 PolarHBondContact O-N 2.96Å; R651-E689 PolarHBondContact NH1-O 3.44Å
652	I	74.9	Confident	72.1	Confident	3 Å²	3	51.6 Å²	51.6	2%	0.015	31%	0.307	C	S	.	.			trans	-135.8	99.1	176.9	-49.3	170.5	0	0	0	107.6	V246 L619 K620 L686 D688	V246-I652 HydrophobicContact CG1-CB 3.48Å; V246-I652 VanDerWaalsContact CG1-CB 3.48Å; V246-I652 HydrophobicContact CG1-CD1 4.18Å; V246-I652 HydrophobicContact CG1-CG1 4.16Å; V246-I652 HydrophobicContact CG1-CG2 4.2Å; V246-I652 VanDerWaalsContact CG1-O 3.3Å; V246-I652 WeakPolarHBondContact CG1-O 3.25Å; V246-I652 VanDerWaalsContact CG2-O 3.29Å; V246-I652 WeakPolarHBondContact CG2-O 3.3Å; L619-I652 HydrophobicContact CB-CD1 4.24Å; K620-I652 HydrophobicContact CG-CD1 4.08Å; K620-I652 HydrophobicContact CG-CG2 4.47Å; I652-L686 HydrophobicContact CD1-CB 3.97Å; I652-L686 HydrophobicContact CD1-CD1 4.36Å; I652-L686 HydrophobicContact CG1-CB 4.46Å; I652-D688 HydrophobicContact CB-CB 3.98Å; I652-D688 HydrophobicContact CG1-CB 3.85Å; I652-D688 HydrophobicContact CG2-CB 3.78Å
653	H	66.2	Low	71.1	Confident	140 Å²	140	54.8 Å²	54.8	65%	0.648	33%	0.329	S	S	*	.			trans	67.7	123.4	-178.2	-130.4	75.2	0	0	0	114.7
654	S	55.8	Low	70.4	Confident	20 Å²	20	57.1 Å²	57.1	14%	0.14	34%	0.342	C	S	.	.			trans	-83.7	117.2	171.8	-17.7	0	0	0	0	107.6	E656 D668	S654-E656 PolarHBondContact O-N 2.99Å; S654-E656 VanDerWaalsContact O-N 3.15Å; S654-D668 PolarHBondContact OG-OD1 3.42Å
655	C	48.9	Very low	70.1	Confident	89 Å²	89	56.8 Å²	56.8	60%	0.601	33%	0.331	S	S	*	.			trans	-68.8	111.2	166.9	-75.4	0	0	0	0	108	S657	C655-S657 PolarHBondContact O-N 2.81Å
656	E	50.7	Low	69.5	Low	166 Å²	166	60.4 Å²	60.4	78%	0.776	35%	0.349	S	S	*	.			trans	-62.1	126.3	172.9	-69.1	-176.9	169.3	0	0	109.2	S654 T664	S654-E656 PolarHBondContact O-N 2.99Å; S654-E656 VanDerWaalsContact O-N 3.15Å; E656-T664 HydrophobicContact CG-CG2 4.15Å
657	S	48.2	Very low	69	Low	53 Å²	53	60 Å²	60	37%	0.371	35%	0.346	S	S	.	.			trans	-132.8	117.6	164.5	179.5	0	0	0	0	107.6	C655 S659 L660	C655-S657 PolarHBondContact O-N 2.81Å; S657-S659 PolarHBondContact O-N 3.17Å; S657-S659 VanDerWaalsContact O-N 3.13Å; S657-S659 WeakPolarHBondContact OG-CB 3.43Å; S657-S659 PolarHBondContact OG-N 3.16Å; S657-S659 PolarHBondContact OG-OG 3.39Å; S657-L660 PolarHBondContact O-N 3.33Å; S657-L660 VanDerWaalsContact O-N 3.09Å
658	I	48.8	Very low	68.6	Low	174 Å²	174	59.9 Å²	59.9	89%	0.892	35%	0.345	S	S	*	.	G	3₁₀ helix	trans	-54.8	-30.3	174.5	-59.3	170.9	0	0	0	109.8	L660	I658-L660 VanDerWaalsContact C-N 3.29Å; I658-L660 PolarHBondContact O-N 3.25Å
659	S	44	Very low	68.2	Low	94 Å²	94	62.4 Å²	62.4	66%	0.657	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-68.6	-19.1	-179	-42.4	0	0	0	0	114.5	S657	S657-S659 PolarHBondContact O-N 3.17Å; S657-S659 VanDerWaalsContact O-N 3.13Å; S657-S659 WeakPolarHBondContact OG-CB 3.43Å; S657-S659 PolarHBondContact OG-N 3.16Å; S657-S659 PolarHBondContact OG-OG 3.39Å
660	L	55.4	Low	67.8	Low	50 Å²	50	65.9 Å²	65.9	26%	0.262	38%	0.377	S	S	.	.	G	3₁₀ helix	trans	-81.8	-18.9	-177.2	-74.5	170.3	0	0	0	113.8	H122 S657 I658 L662 I667	H122-L660 HydrophobicContact CB-CD2 4.19Å; H122-L660 PolarHBondContact CD2-O 3Å; H122-L660 WeakPolarHBondContact O-CD2 3.38Å; S657-L660 PolarHBondContact O-N 3.33Å; S657-L660 VanDerWaalsContact O-N 3.09Å; I658-L660 VanDerWaalsContact C-N 3.29Å; I658-L660 PolarHBondContact O-N 3.25Å; L660-L662 PolarHBondContact O-N 3.37Å; L660-I667 HydrophobicContact CD1-CD1 4.31Å
661	G	58.3	Low	67.4	Low	69 Å²	69	66.1 Å²	66.1	71%	0.711	38%	0.378	S	S	*	.			trans	62.9	7.1	179.5	0	0	0	0	0	115.9
662	L	65.2	Low	67.4	Low	90 Å²	90	65.6 Å²	65.6	47%	0.471	38%	0.377	S	S	.	.			trans	-104.6	146.8	-179.9	-65.1	177.2	0	0	0	111.2	L660 M666 I667	L660-L662 PolarHBondContact O-N 3.37Å; L662-M666 HydrophobicContact CD2-CG 4.26Å; L662-I667 HydrophobicContact CB-CD1 4.28Å; L662-I667 HydrophobicContact CB-CG1 3.89Å; L662-I667 HydrophobicContact CD1-CG1 4.39Å
663	S	71.4	Confident	68	Low	68 Å²	68	67.4 Å²	67.4	48%	0.476	39%	0.392	S	S	.	.			trans	-69.1	149.8	171.4	69.4	0	0	0	0	111	F665 M666 I667	S663-F665 PolarHBondContact O-N 2.85Å; S663-M666 WeakPolarHBondContact O-CB 3.45Å; S663-M666 PolarHBondContact O-N 3.18Å; S663-M666 WeakPolarHBondContact OG-CB 3.44Å; S663-M666 PolarHBondContact OG-N 2.87Å; S663-I667 PolarHBondContact O-N 3.45Å
664	T	73.8	Confident	68.8	Low	57 Å²	57	64 Å²	64	35%	0.35	38%	0.375	S	S	.	.	H	α-helix	trans	-52.9	-43.6	176.9	49.9	0	0	0	0	111.7	E656 M666 I667 D668	E656-T664 HydrophobicContact CG-CG2 4.15Å; T664-M666 PolarHBondContact O-N 3.23Å; T664-I667 PolarHBondContact O-N 3.46Å; T664-D668 PolarHBondContact O-N 2.97Å
665	F	80.4	Confident	70.3	Confident	42 Å²	42	63.2 Å²	63.2	18%	0.184	37%	0.37	C	S	.	.	H	α-helix	trans	-62.9	-36.9	175.9	-176.7	-115.4	0	0	0	113.4	S663 D668 L669 T694 L702	S663-F665 PolarHBondContact O-N 2.85Å; F665-D668 PolarHBondContact O-N 3.35Å; F665-L669 HydrophobicContact CD1-CD1 3.78Å; F665-L669 HydrophobicContact CD1-CG 4.48Å; F665-L669 HydrophobicContact CE1-CD1 3.35Å; F665-L669 HydrophobicContact CE1-CG 4.11Å; F665-L669 HydrophobicContact CE2-CD1 4.38Å; F665-L669 HydrophobicContact CE2-CG 4.27Å; F665-L669 HydrophobicContact CG-CD1 4.47Å; F665-L669 HydrophobicContact CZ-CD1 3.69Å; F665-L669 HydrophobicContact CZ-CD2 4.26Å; F665-L669 HydrophobicContact CZ-CG 3.99Å; F665-L669 WeakPolarHBondContact O-CB 3.26Å; F665-L669 WeakPolarHBondContact O-CG 3.35Å; F665-L669 PolarHBondContact O-N 3.32Å; F665-T694 HydrophobicContact CD2-CG2 4.19Å; F665-T694 HydrophobicContact CE2-CG2 3.65Å; F665-T694 HydrophobicContact CZ-CG2 3.91Å; F665-L702 HydrophobicContact CE2-CD1 4.28Å; F665-L702 HydrophobicContact CZ-CD1 3.67Å
666	M	79.1	Confident	72.3	Confident	82 Å²	82	60.4 Å²	60.4	40%	0.404	35%	0.35	S	S	.	.	H	α-helix	trans	-69.1	-38.9	176.5	-173	62.3	70.4	0	0	111.7	L662 S663 T664 D668 L669 N670	L662-M666 HydrophobicContact CD2-CG 4.26Å; S663-M666 WeakPolarHBondContact O-CB 3.45Å; S663-M666 PolarHBondContact O-N 3.18Å; S663-M666 WeakPolarHBondContact OG-CB 3.44Å; S663-M666 PolarHBondContact OG-N 2.87Å; T664-M666 PolarHBondContact O-N 3.23Å; M666-D668 VanDerWaalsContact C-N 3.32Å; M666-L669 PolarHBondContact O-N 2.8Å; M666-N670 WeakPolarHBondContact O-CB 3.38Å; M666-N670 PolarHBondContact O-N 2.97Å; M666-N670 PolarHBondContact O-ND2 3.48Å
667	I	76.3	Confident	74	Confident	26 Å²	26	58.3 Å²	58.3	13%	0.133	34%	0.344	C	S	.	.	H	α-helix	trans	-60.6	-46	174.5	-64.3	169.3	0	0	0	109.8	L660 L662 S663 T664 L669 N670 Q671	L660-I667 HydrophobicContact CD1-CD1 4.31Å; L662-I667 HydrophobicContact CB-CD1 4.28Å; L662-I667 HydrophobicContact CB-CG1 3.89Å; L662-I667 HydrophobicContact CD1-CG1 4.39Å; S663-I667 PolarHBondContact O-N 3.45Å; T664-I667 PolarHBondContact O-N 3.46Å; I667-L669 PolarHBondContact O-N 3.23Å; I667-N670 PolarHBondContact O-N 3.39Å; I667-Q671 PolarHBondContact O-N 2.84Å
668	D	81.8	Confident	75.7	Confident	3 Å²	3	58.8 Å²	58.8	2%	0.016	34%	0.343	C	S	.	.	H	α-helix	trans	-61.1	-44.4	177.3	-64.1	-35	0	0	0	112.8	R651 S654 T664 F665 M666 N670 Q671 V672 F690	R651-D668 VanDerWaalsContact CZ-CG 3.48Å; R651-D668 IonicContact CZ-OD1 2.73Å; R651-D668 IonicContact CZ-OD2 3.83Å; R651-D668 VanDerWaalsContact NE-CG 3.29Å; R651-D668 IonicContact NE-OD1 3.66Å; R651-D668 PolarHBondContact NE-OD1 3.29Å; R651-D668 IonicContact NE-OD2 3.42Å; R651-D668 IonicContact NH2-OD1 3.96Å; R651-D668 PolarHBondContact NH2-OD1 3.28Å; R651-D668 IonicContact NH2-OD2 3.68Å; R651-D668 PolarHBondContact NH2-OD2 2.69Å; S654-D668 PolarHBondContact OG-OD1 3.42Å; T664-D668 PolarHBondContact O-N 2.97Å; F665-D668 PolarHBondContact O-N 3.35Å; M666-D668 VanDerWaalsContact C-N 3.32Å; D668-N670 VanDerWaalsContact C-N 3.33Å; D668-N670 PolarHBondContact O-N 2.85Å; D668-Q671 PolarHBondContact O-N 2.95Å; D668-V672 WeakPolarHBondContact O-CG2 3.5Å; D668-V672 PolarHBondContact O-N 3.07Å; D668-F690 HydrophobicContact CB-CD2 4.22Å; D668-F690 HydrophobicContact CB-CE2 4.17Å
669	L	84.6	Confident	77.6	Confident	53 Å²	53	50.7 Å²	50.7	28%	0.277	30%	0.302	S	S	.	.	H	α-helix	trans	-61.4	-42.4	176.9	-82	172	0	0	0	111.5	F665 M666 I667 Q671 V672 A673 F690	F665-L669 HydrophobicContact CD1-CD1 3.78Å; F665-L669 HydrophobicContact CD1-CG 4.48Å; F665-L669 HydrophobicContact CE1-CD1 3.35Å; F665-L669 HydrophobicContact CE1-CG 4.11Å; F665-L669 HydrophobicContact CE2-CD1 4.38Å; F665-L669 HydrophobicContact CE2-CG 4.27Å; F665-L669 HydrophobicContact CG-CD1 4.47Å; F665-L669 HydrophobicContact CZ-CD1 3.69Å; F665-L669 HydrophobicContact CZ-CD2 4.26Å; F665-L669 HydrophobicContact CZ-CG 3.99Å; F665-L669 WeakPolarHBondContact O-CB 3.26Å; F665-L669 WeakPolarHBondContact O-CG 3.35Å; F665-L669 PolarHBondContact O-N 3.32Å; M666-L669 PolarHBondContact O-N 2.8Å; I667-L669 PolarHBondContact O-N 3.23Å; L669-Q671 PolarHBondContact O-N 2.8Å; L669-V672 PolarHBondContact O-N 3.16Å; L669-A673 WeakPolarHBondContact O-CB 3.44Å; L669-A673 PolarHBondContact O-N 3.3Å; L669-F690 HydrophobicContact CD2-CE2 4.42Å; L669-F690 HydrophobicContact CD2-CZ 4.02Å
670	N	81.8	Confident	79.8	Confident	76 Å²	76	48.5 Å²	48.5	41%	0.406	29%	0.285	S	S	.	.	H	α-helix	trans	-64	-39.9	178	-76.4	-28	0	0	0	112.2	M666 I667 D668 A673 K674	M666-N670 WeakPolarHBondContact O-CB 3.38Å; M666-N670 PolarHBondContact O-N 2.97Å; M666-N670 PolarHBondContact O-ND2 3.48Å; I667-N670 PolarHBondContact O-N 3.39Å; D668-N670 VanDerWaalsContact C-N 3.33Å; D668-N670 PolarHBondContact O-N 2.85Å; N670-A673 PolarHBondContact O-N 2.8Å; N670-K674 WeakPolarHBondContact O-CG 3.41Å; N670-K674 PolarHBondContact O-N 2.87Å
671	Q	82.3	Confident	81.4	Confident	15 Å²	15	47.6 Å²	47.6	7%	0.07	28%	0.284	C	S	.	.	H	α-helix	trans	-65.2	-47.7	176.1	-73	-178.6	-10.2	0	0	111.8	D242 R651 I667 D668 L669 A673 K674 A675	D242-Q671 PolarHBondContact OD2-NE2 3.47Å; R651-Q671 HydrophobicContact CB-CB 4.4Å; R651-Q671 HydrophobicContact CG-CB 4.3Å; I667-Q671 PolarHBondContact O-N 2.84Å; D668-Q671 PolarHBondContact O-N 2.95Å; L669-Q671 PolarHBondContact O-N 2.8Å; Q671-A673 VanDerWaalsContact C-N 3.32Å; Q671-A673 PolarHBondContact O-N 2.98Å; Q671-K674 WeakPolarHBondContact O-CB 3.3Å; Q671-K674 PolarHBondContact O-N 2.95Å; Q671-A675 PolarHBondContact O-N 2.95Å
672	V	88.3	Confident	82.9	Confident	8 Å²	8	48.8 Å²	48.8	5%	0.048	27%	0.271	C	S	.	.	H	α-helix	trans	-65.4	-37.9	177.2	175.8	0	0	0	0	111.1	R651 D668 L669 K674 A675 V676 F690 V706	R651-V672 HydrophobicContact CB-CG2 4.24Å; R651-V672 HydrophobicContact CG-CG2 4.14Å; D668-V672 WeakPolarHBondContact O-CG2 3.5Å; D668-V672 PolarHBondContact O-N 3.07Å; L669-V672 PolarHBondContact O-N 3.16Å; V672-K674 VanDerWaalsContact C-N 3.33Å; V672-K674 PolarHBondContact O-N 2.86Å; V672-A675 PolarHBondContact O-N 2.88Å; V672-V676 HydrophobicContact CG1-CG2 4.02Å; V672-V676 WeakPolarHBondContact O-CB 3.4Å; V672-V676 VanDerWaalsContact O-CG2 3.29Å; V672-V676 WeakPolarHBondContact O-CG2 3.47Å; V672-V676 PolarHBondContact O-N 3.3Å; V672-F690 HydrophobicContact CB-CE2 4.14Å; V672-F690 HydrophobicContact CB-CZ 4.31Å; V672-F690 HydrophobicContact CG1-CZ 4.37Å; V672-F690 HydrophobicContact CG2-CD2 3.56Å; V672-F690 HydrophobicContact CG2-CE2 3.59Å; V672-F690 HydrophobicContact CG2-CG 4.06Å; V672-F690 HydrophobicContact CG2-CZ 4.11Å; V672-V706 HydrophobicContact CG1-CG1 3.93Å; V672-V706 HydrophobicContact CG1-CG2 4.06Å
673	A	87	Confident	84.2	Confident	40 Å²	40	44.5 Å²	44.5	33%	0.331	25%	0.249	S	C	.	.	H	α-helix	trans	-61.4	-39.9	176.3	0	0	0	0	0	112.1	L669 N670 Q671 V676 N677	L669-A673 WeakPolarHBondContact O-CB 3.44Å; L669-A673 PolarHBondContact O-N 3.3Å; N670-A673 PolarHBondContact O-N 2.8Å; Q671-A673 VanDerWaalsContact C-N 3.32Å; Q671-A673 PolarHBondContact O-N 2.98Å; A673-V676 PolarHBondContact O-N 3.06Å; A673-N677 VanDerWaalsContact O-CB 3.29Å; A673-N677 WeakPolarHBondContact O-CB 3.46Å; A673-N677 PolarHBondContact O-N 3.29Å; A673-N677 PolarHBondContact O-ND2 3.3Å
674	K	82.9	Confident	85.2	Confident	68 Å²	68	41.4 Å²	41.4	30%	0.296	23%	0.227	S	C	.	.	H	α-helix	trans	-60	-47.9	173.2	-73.3	174.2	-176.6	178.5	0	111.4	N670 Q671 V672 N677 N678	N670-K674 WeakPolarHBondContact O-CG 3.41Å; N670-K674 PolarHBondContact O-N 2.87Å; Q671-K674 WeakPolarHBondContact O-CB 3.3Å; Q671-K674 PolarHBondContact O-N 2.95Å; V672-K674 VanDerWaalsContact C-N 3.33Å; V672-K674 PolarHBondContact O-N 2.86Å; K674-N677 PolarHBondContact O-N 2.99Å; K674-N678 WeakPolarHBondContact O-CB 3.44Å; K674-N678 PolarHBondContact O-N 3.08Å; K674-N678 PolarHBondContact O-ND2 3Å
675	A	88.3	Confident	86.2	Confident	5 Å²	5	38.8 Å²	38.8	4%	0.041	21%	0.211	C	C	.	.	H	α-helix	trans	-61.9	-45.8	177.9	0	0	0	0	0	111.7	F649 Q671 V672 N677 A679 V685 W710	F649-A675 HydrophobicContact CB-CB 3.8Å; F649-A675 HydrophobicContact CD1-CB 4.28Å; F649-A675 HydrophobicContact CG-CB 3.95Å; Q671-A675 PolarHBondContact O-N 2.95Å; V672-A675 PolarHBondContact O-N 2.88Å; A675-N677 VanDerWaalsContact C-N 3.34Å; A675-N677 PolarHBondContact O-N 3Å; A675-A679 WeakPolarHBondContact O-CB 3.33Å; A675-A679 PolarHBondContact O-N 3.49Å; A675-V685 HydrophobicContact CB-CG1 4.24Å; A675-W710 HydrophobicContact CB-CZ2 4.2Å
676	V	90.1	Very high	86.9	Confident	30 Å²	30	36.8 Å²	36.8	18%	0.182	20%	0.202	C	C	.	.	H	α-helix	trans	-61.4	-42.8	179.7	170.7	0	0	0	0	111.5	V672 A673 V706 W710	V672-V676 HydrophobicContact CG1-CG2 4.02Å; V672-V676 WeakPolarHBondContact O-CB 3.4Å; V672-V676 VanDerWaalsContact O-CG2 3.29Å; V672-V676 WeakPolarHBondContact O-CG2 3.47Å; V672-V676 PolarHBondContact O-N 3.3Å; A673-V676 PolarHBondContact O-N 3.06Å; V676-V706 HydrophobicContact CG2-CG1 3.96Å; V676-W710 HydrophobicContact CB-CZ2 4.23Å; V676-W710 HydrophobicContact CG2-CH2 4Å; V676-W710 HydrophobicContact CG2-CZ2 3.41Å; V676-W710 VanDerWaalsContact CG2-CZ2 3.41Å
677	N	85.4	Confident	87.5	Confident	122 Å²	122	33 Å²	33	65%	0.652	18%	0.183	S	C	*	.	H	α-helix	trans	-80.6	-23.9	-174.6	-69.5	-36.3	0	0	0	114.4	A673 K674 A675	A673-N677 VanDerWaalsContact O-CB 3.29Å; A673-N677 WeakPolarHBondContact O-CB 3.46Å; A673-N677 PolarHBondContact O-N 3.29Å; A673-N677 PolarHBondContact O-ND2 3.3Å; K674-N677 PolarHBondContact O-N 2.99Å; A675-N677 VanDerWaalsContact C-N 3.34Å; A675-N677 PolarHBondContact O-N 3Å
678	N	84.2	Confident	88.2	Confident	62 Å²	62	32 Å²	32	33%	0.332	18%	0.179	S	C	.	.	H	α-helix	trans	-117.5	-14.2	-173	-62.8	-42	0	0	0	114.4	K86 F649 K674	K86-N678 PolarHBondContact NZ-OD1 2.85Å; F649-N678 HydrophobicContact CE1-CB 4.29Å; F649-N678 HydrophobicContact CZ-CB 3.8Å; K674-N678 WeakPolarHBondContact O-CB 3.44Å; K674-N678 PolarHBondContact O-N 3.08Å; K674-N678 PolarHBondContact O-ND2 3Å
679	A	89.1	Confident	88.4	Confident	4 Å²	4	33.7 Å²	33.7	3%	0.033	19%	0.186	C	C	.	.			trans	-69.1	133.8	-179	0	0	0	0	0	112.9	F649 A675 V685 R713 P718	F649-A679 HydrophobicContact CD2-CB 4.15Å; F649-A679 HydrophobicContact CE2-CB 3.98Å; A675-A679 WeakPolarHBondContact O-CB 3.33Å; A675-A679 PolarHBondContact O-N 3.49Å; A679-V685 HydrophobicContact CB-CG2 4.13Å; A679-R713 PolarHBondContact O-NH1 3.45Å; A679-P718 HydrophobicContact CB-CB 4.22Å; A679-P718 HydrophobicContact CB-CG 4.19Å
680	T	89.8	Confident	88.5	Confident	49 Å²	49	31.3 Å²	31.3	30%	0.301	17%	0.174	S	C	.	.			trans	-104.3	-177.5	175.6	82.2	0	0	0	0	110.8	D646 Q682 S683 P718	D646-T680 PolarHBondContact OD1-OG1 2.96Å; D646-T680 WeakPolarHBondContact OD2-CB 3.3Å; D646-T680 WeakPolarHBondContact OD2-CG2 3.4Å; D646-T680 PolarHBondContact OD2-OG1 3.1Å; T680-Q682 PolarHBondContact O-N 2.8Å; T680-Q682 PolarHBondContact OG1-N 3.47Å; T680-S683 PolarHBondContact N-OG 2.8Å; T680-S683 PolarHBondContact O-N 3.06Å; T680-S683 PolarHBondContact OG1-OG 3.24Å; T680-P718 WeakPolarHBondContact O-CA 3.3Å; T680-P718 VanDerWaalsContact O-CB 3.26Å; T680-P718 WeakPolarHBondContact O-CB 3.46Å
681	A	89.4	Confident	88.5	Confident	31 Å²	31	27.7 Å²	27.7	26%	0.256	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-15.9	176.8	0	0	0	0	0	114.1	R603	R603-A681 PolarHBondContact NH1-O 3.48Å
682	Q	89.7	Confident	88.4	Confident	94 Å²	94	31.3 Å²	31.3	44%	0.439	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	-8.2	-179.2	-71.9	177.8	-19.8	0	0	112.4	A644 V645 D646 T680	A644-Q682 HydrophobicContact CB-CG 4.37Å; A644-Q682 WeakPolarHBondContact O-CB 3.46Å; V645-Q682 WeakPolarHBondContact CA-O 3.43Å; D646-Q682 HydrophobicContact CB-CB 4.3Å; D646-Q682 VanDerWaalsContact OD1-C 3.24Å; T680-Q682 PolarHBondContact O-N 2.8Å; T680-Q682 PolarHBondContact OG1-N 3.47Å
683	S	92.1	Very high	87.8	Confident	0 Å²	0	33 Å²	33	0%	0	19%	0.188	C	C	.	.			trans	-75.3	142.3	-176.2	-52.1	0	0	0	0	111.8	D646 A647 T680 P718 H719	D646-S683 WeakPolarHBondContact OD1-CA 3.33Å; D646-S683 WeakPolarHBondContact OD1-CB 3.21Å; D646-S683 PolarHBondContact OD1-N 2.83Å; D646-S683 PolarHBondContact OD1-OG 2.86Å; A647-S683 WeakPolarHBondContact O-CA 3.34Å; T680-S683 PolarHBondContact N-OG 2.8Å; T680-S683 PolarHBondContact O-N 3.06Å; T680-S683 PolarHBondContact OG1-OG 3.24Å; S683-P718 WeakPolarHBondContact O-CB 3.13Å; S683-H719 PolarHBondContact O-N 2.91Å
684	L	93.5	Very high	87.6	Confident	2 Å²	2	33.3 Å²	33.3	1%	0.01	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	122.9	171.1	179.6	64.5	0	0	0	109.3	T626 V645 A647 I648 F649 L686 H719 F721	T626-L684 HydrophobicContact CG2-CD2 4.09Å; V645-L684 HydrophobicContact CG1-CB 4.33Å; A647-L684 PolarHBondContact O-N 2.76Å; I648-L684 CarbonylContact C-O 3.44Å; I648-L684 WeakPolarHBondContact CA-O 3.24Å; I648-L684 HydrophobicContact CG1-CB 4.42Å; F649-L684 PolarHBondContact N-O 3.1Å; L684-L686 HydrophobicContact CD1-CD2 4.06Å; L684-L686 HydrophobicContact CD2-CD2 4.41Å; L684-L686 HydrophobicContact CG-CD2 4.1Å; L684-L686 HydrophobicContact CG-CG 4.4Å; L684-H719 CarbonylContact C-O 3.58Å; L684-H719 WeakPolarHBondContact CA-O 3.32Å; L684-H719 HydrophobicContact CD1-CB 4.26Å; L684-F721 HydrophobicContact CD1-CD2 3.71Å; L684-F721 HydrophobicContact CD1-CE2 3.65Å
685	V	94.5	Very high	87.6	Confident	2 Å²	2	35.3 Å²	35.3	1%	0.012	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	120.3	-179.3	-174.6	0	0	0	0	109.2	F649 A675 A679 I687 W710 P718 H719 I720 F721	F649-V685 HydrophobicContact CB-CG1 4.42Å; F649-V685 HydrophobicContact CB-CG2 4.35Å; F649-V685 HydrophobicContact CD2-CG2 4.24Å; F649-V685 WeakPolarHBondContact O-CA 3.36Å; A675-V685 HydrophobicContact CB-CG1 4.24Å; A679-V685 HydrophobicContact CB-CG2 4.13Å; V685-I687 HydrophobicContact CG1-CD1 4.13Å; V685-I687 HydrophobicContact CG1-CG1 3.95Å; V685-W710 HydrophobicContact CG1-CH2 4Å; V685-W710 HydrophobicContact CG1-CZ2 4.45Å; V685-P718 HydrophobicContact CG2-CB 4.08Å; V685-P718 HydrophobicContact CG2-CG 4.39Å; V685-H719 PolarHBondContact N-O 3.46Å; V685-I720 HydrophobicContact CB-CG1 4.29Å; V685-I720 HydrophobicContact CB-CG2 4.34Å; V685-I720 HydrophobicContact CG1-CG2 4.47Å; V685-I720 CarbonylContact O-C 3.58Å; V685-I720 WeakPolarHBondContact O-CA 3.46Å; V685-F721 PolarHBondContact O-N 3.03Å
686	L	94.3	Very high	87.3	Confident	0 Å²	0	40 Å²	40	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	117.5	178.4	-50.3	176.9	0	0	0	109.8	L247 F649 T650 R651 I652 L684 F721	L247-L686 HydrophobicContact CD2-CD1 4.46Å; F649-L686 PolarHBondContact O-N 3.3Å; T650-L686 CarbonylContact C-O 3.56Å; T650-L686 WeakPolarHBondContact CA-O 3.42Å; T650-L686 HydrophobicContact CG2-CB 4.12Å; T650-L686 HydrophobicContact CG2-CD1 3.99Å; T650-L686 HydrophobicContact CG2-CG 4.34Å; R651-L686 PolarHBondContact N-O 3.03Å; I652-L686 HydrophobicContact CD1-CB 3.97Å; I652-L686 HydrophobicContact CD1-CD1 4.36Å; I652-L686 HydrophobicContact CG1-CB 4.46Å; L684-L686 HydrophobicContact CD1-CD2 4.06Å; L684-L686 HydrophobicContact CD2-CD2 4.41Å; L684-L686 HydrophobicContact CG-CD2 4.1Å; L684-L686 HydrophobicContact CG-CG 4.4Å; L686-F721 HydrophobicContact CD2-CB 3.88Å; L686-F721 HydrophobicContact CD2-CD2 3.9Å; L686-F721 HydrophobicContact CD2-CG 4.18Å
687	I	93.4	Very high	87.1	Confident	3 Å²	3	43.5 Å²	43.5	2%	0.015	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	118.5	-178.9	-55.1	179.1	0	0	0	108.5	L619 V685 F690 W710 I720 F721 V722 A723	L619-I687 WeakPolarHBondContact CD1-O 3.48Å; V685-I687 HydrophobicContact CG1-CD1 4.13Å; V685-I687 HydrophobicContact CG1-CG1 3.95Å; I687-F690 HydrophobicContact CG2-CB 3.53Å; I687-W710 HydrophobicContact CD1-CH2 3.76Å; I687-W710 HydrophobicContact CD1-CZ3 3.61Å; I687-I720 HydrophobicContact CD1-CG2 4.48Å; I687-F721 PolarHBondContact N-O 2.84Å; I687-V722 HydrophobicContact CB-CG1 4.35Å; I687-V722 HydrophobicContact CB-CG2 4.31Å; I687-V722 HydrophobicContact CD1-CG2 4.42Å; I687-V722 HydrophobicContact CG2-CG1 4.41Å; I687-V722 CarbonylContact O-C 3.51Å; I687-V722 VanDerWaalsContact O-CA 3.24Å; I687-V722 WeakPolarHBondContact O-CA 3.06Å; I687-A723 PolarHBondContact O-N 2.95Å
688	D	90.9	Very high	87.2	Confident	6 Å²	6	41.4 Å²	41.4	3%	0.032	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	116.1	174	-169.4	17.3	0	0	0	108.8	S616 L619 R651 I652 F690 A723	S616-D688 WeakPolarHBondContact CB-OD2 3.39Å; S616-D688 PolarHBondContact OG-OD2 3.28Å; L619-D688 HydrophobicContact CD1-CB 3.73Å; R651-D688 PolarHBondContact NH1-O 3.13Å; R651-D688 PolarHBondContact O-N 2.96Å; I652-D688 HydrophobicContact CB-CB 3.98Å; I652-D688 HydrophobicContact CG1-CB 3.85Å; I652-D688 HydrophobicContact CG2-CB 3.78Å; D688-F690 PolarHBondContact O-N 3.31Å; D688-A723 WeakPolarHBondContact OD1-CB 3.43Å
689	E	86.1	Confident	87.4	Confident	38 Å²	38	38.4 Å²	38.4	18%	0.178	22%	0.223	C	C	.	.	S	Bend	trans	58.8	37.8	167.9	-66.3	-175.3	151.3	0	0	116.7	R651 K692 A723 N725	R651-E689 PolarHBondContact NH1-O 3.44Å; E689-K692 HydrophobicContact CB-CD 3.88Å; E689-K692 HydrophobicContact CB-CG 4.41Å; E689-K692 HydrophobicContact CG-CD 4.4Å; E689-K692 IonicContact OE1-NZ 2.71Å; E689-K692 PolarHBondContact OE1-NZ 3.48Å; E689-K692 WeakPolarHBondContact OE2-CE 3.41Å; E689-K692 IonicContact OE2-NZ 2.97Å; E689-K692 PolarHBondContact OE2-NZ 3.22Å; E689-A723 PolarHBondContact N-O 3.32Å; E689-N725 PolarHBondContact OE1-ND2 3.27Å; E689-N725 PolarHBondContact OE1-OD1 2.92Å
690	F	86.4	Confident	87.4	Confident	3 Å²	3	39.1 Å²	39.1	1%	0.013	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	141.6	177.6	176.8	-109.9	0	0	0	112.5	D668 L669 V672 I687 D688 L702 L703 F726	D668-F690 HydrophobicContact CB-CD2 4.22Å; D668-F690 HydrophobicContact CB-CE2 4.17Å; L669-F690 HydrophobicContact CD2-CE2 4.42Å; L669-F690 HydrophobicContact CD2-CZ 4.02Å; V672-F690 HydrophobicContact CB-CE2 4.14Å; V672-F690 HydrophobicContact CB-CZ 4.31Å; V672-F690 HydrophobicContact CG1-CZ 4.37Å; V672-F690 HydrophobicContact CG2-CD2 3.56Å; V672-F690 HydrophobicContact CG2-CE2 3.59Å; V672-F690 HydrophobicContact CG2-CG 4.06Å; V672-F690 HydrophobicContact CG2-CZ 4.11Å; I687-F690 HydrophobicContact CG2-CB 3.53Å; D688-F690 PolarHBondContact O-N 3.31Å; F690-L702 HydrophobicContact CE1-CB 4.2Å; F690-L703 HydrophobicContact CB-CD1 4.39Å; F690-L703 HydrophobicContact CD1-CB 4.18Å; F690-L703 HydrophobicContact CD1-CD1 4.04Å; F690-F726 WeakPolarHBondContact O-CE2 3.29Å
691	G	81.2	Confident	87.4	Confident	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.9	7.7	177.8	0	0	0	0	0	115.5	G699	G691-G699 WeakPolarHBondContact O-CA 3.35Å
692	K	79.6	Confident	87.5	Confident	90 Å²	90	41 Å²	41	39%	0.391	24%	0.237	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-24.4	177.8	-75.5	-169.1	175.1	-173.6	0	115.3	E689 T694 N725	E689-K692 HydrophobicContact CB-CD 3.88Å; E689-K692 HydrophobicContact CB-CG 4.41Å; E689-K692 HydrophobicContact CG-CD 4.4Å; E689-K692 IonicContact OE1-NZ 2.71Å; E689-K692 PolarHBondContact OE1-NZ 3.48Å; E689-K692 WeakPolarHBondContact OE2-CE 3.41Å; E689-K692 IonicContact OE2-NZ 2.97Å; E689-K692 PolarHBondContact OE2-NZ 3.22Å; K692-T694 PolarHBondContact O-N 2.99Å; K692-N725 PolarHBondContact NZ-ND2 3.35Å
693	G	75.6	Confident	87.6	Confident	43 Å²	43	36.5 Å²	36.5	44%	0.443	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	11.6	-175.9	0	0	0	0	0	115.4
694	T	82.6	Confident	87.6	Confident	48 Å²	48	36.9 Å²	36.9	29%	0.294	22%	0.219	S	C	.	.	S	Bend	trans	-143.2	-178	-176	-169.9	0	0	0	0	110.7	F665 K692 T696 D698	F665-T694 HydrophobicContact CD2-CG2 4.19Å; F665-T694 HydrophobicContact CE2-CG2 3.65Å; F665-T694 HydrophobicContact CZ-CG2 3.91Å; K692-T694 PolarHBondContact O-N 2.99Å; T694-T696 PolarHBondContact O-N 2.58Å; T694-D698 HydrophobicContact CG2-CB 4.39Å
695	N	84.3	Confident	87.5	Confident	109 Å²	109	39.5 Å²	39.5	58%	0.583	24%	0.241	S	C	*	.			trans	-48.8	134	172	-74	-26.7	0	0	0	110.4	V697 D698 G699	N695-V697 PolarHBondContact O-N 3.47Å; N695-D698 HydrophobicContact CB-CB 4.1Å; N695-D698 VanDerWaalsContact CB-OD2 3.3Å; N695-D698 WeakPolarHBondContact CB-OD2 3.49Å; N695-D698 PolarHBondContact ND2-OD2 3.21Å; N695-D698 PolarHBondContact O-N 2.74Å; N695-G699 PolarHBondContact O-N 2.93Å
696	T	81.9	Confident	87.4	Confident	103 Å²	103	40.5 Å²	40.5	63%	0.632	25%	0.247	S	C	*	.	H	α-helix	trans	-58.1	-35.8	-174.7	50.9	0	0	0	0	113.1	T694 L700	T694-T696 PolarHBondContact O-N 2.58Å; T696-L700 VanDerWaalsContact O-CB 3.23Å; T696-L700 WeakPolarHBondContact O-CB 3.1Å; T696-L700 PolarHBondContact O-N 2.75Å
697	V	85.8	Confident	87.3	Confident	105 Å²	105	40.5 Å²	40.5	64%	0.636	25%	0.247	S	C	*	.	H	α-helix	trans	-69	-46.4	176.8	-177.5	0	0	0	0	110.9	N695 L700 A701	N695-V697 PolarHBondContact O-N 3.47Å; V697-L700 PolarHBondContact O-N 2.96Å; V697-A701 VanDerWaalsContact O-CB 3.31Å; V697-A701 WeakPolarHBondContact O-CB 3.29Å; V697-A701 PolarHBondContact O-N 3.4Å
698	D	87.9	Confident	87.2	Confident	77 Å²	77	46.9 Å²	46.9	41%	0.412	27%	0.271	S	S	.	.	H	α-helix	trans	-66.9	-42	-179.6	-61.9	-29	0	0	0	111.1	T694 N695 A701 L702	T694-D698 HydrophobicContact CG2-CB 4.39Å; N695-D698 HydrophobicContact CB-CB 4.1Å; N695-D698 VanDerWaalsContact CB-OD2 3.3Å; N695-D698 WeakPolarHBondContact CB-OD2 3.49Å; N695-D698 PolarHBondContact ND2-OD2 3.21Å; N695-D698 PolarHBondContact O-N 2.74Å; D698-A701 PolarHBondContact O-N 3.35Å; D698-L702 WeakPolarHBondContact O-CB 3.18Å; D698-L702 VanDerWaalsContact O-CG 3.3Å; D698-L702 WeakPolarHBondContact O-CG 3.43Å; D698-L702 PolarHBondContact O-N 3.39Å
699	G	87.9	Confident	87.3	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-62.4	-43.7	175.8	0	0	0	0	0	112.9	G691 N695 L703	G691-G699 WeakPolarHBondContact O-CA 3.35Å; N695-G699 PolarHBondContact O-N 2.93Å; G699-L703 WeakPolarHBondContact O-CB 3.43Å; G699-L703 PolarHBondContact O-N 3.46Å
700	L	89.1	Confident	87.6	Confident	18 Å²	18	49.4 Å²	49.4	9%	0.094	28%	0.283	C	S	.	.	H	α-helix	trans	-63	-45.6	173.6	175.6	60.5	0	0	0	111.7	T696 V697 L702 L703 A704 F726 L729 L732 L734	T696-L700 VanDerWaalsContact O-CB 3.23Å; T696-L700 WeakPolarHBondContact O-CB 3.1Å; T696-L700 PolarHBondContact O-N 2.75Å; V697-L700 PolarHBondContact O-N 2.96Å; L700-L702 VanDerWaalsContact C-N 3.34Å; L700-L702 PolarHBondContact O-N 2.97Å; L700-L703 PolarHBondContact O-N 3.28Å; L700-A704 WeakPolarHBondContact O-CB 3.34Å; L700-A704 PolarHBondContact O-N 3.12Å; L700-F726 HydrophobicContact CD1-CB 3.9Å; L700-F726 HydrophobicContact CD1-CD2 4.34Å; L700-F726 HydrophobicContact CD1-CG 4.22Å; L700-L729 HydrophobicContact CD1-CB 3.81Å; L700-L729 HydrophobicContact CD1-CD1 3.82Å; L700-L729 HydrophobicContact CD1-CG 4.43Å; L700-L732 HydrophobicContact CD2-CD1 4.42Å; L700-L734 HydrophobicContact CD1-CD1 3.94Å; L700-L734 HydrophobicContact CD2-CD1 3.86Å; L700-L734 HydrophobicContact CG-CD1 3.78Å
701	A	89.9	Confident	87.8	Confident	55 Å²	55	50 Å²	50	46%	0.455	29%	0.286	S	S	.	.	H	α-helix	trans	-61.6	-42.9	179.7	0	0	0	0	0	111.5	V697 D698 A704 A705	V697-A701 VanDerWaalsContact O-CB 3.31Å; V697-A701 WeakPolarHBondContact O-CB 3.29Å; V697-A701 PolarHBondContact O-N 3.4Å; D698-A701 PolarHBondContact O-N 3.35Å; A701-A704 PolarHBondContact O-N 2.95Å; A701-A705 VanDerWaalsContact O-CB 3.27Å; A701-A705 WeakPolarHBondContact O-CB 3.31Å; A701-A705 PolarHBondContact O-N 3.24Å
702	L	91	Very high	88.1	Confident	65 Å²	65	54.3 Å²	54.3	34%	0.34	32%	0.321	S	S	.	.	H	α-helix	trans	-64.5	-46.8	176.2	-74.6	169.5	0	0	0	112.2	F665 F690 D698 L700 A704 A705 V706	F665-L702 HydrophobicContact CE2-CD1 4.28Å; F665-L702 HydrophobicContact CZ-CD1 3.67Å; F690-L702 HydrophobicContact CE1-CB 4.2Å; D698-L702 WeakPolarHBondContact O-CB 3.18Å; D698-L702 VanDerWaalsContact O-CG 3.3Å; D698-L702 WeakPolarHBondContact O-CG 3.43Å; D698-L702 PolarHBondContact O-N 3.39Å; L700-L702 VanDerWaalsContact C-N 3.34Å; L700-L702 PolarHBondContact O-N 2.97Å; L702-A704 VanDerWaalsContact C-N 3.33Å; L702-A704 PolarHBondContact O-N 2.72Å; L702-A705 PolarHBondContact O-N 3.47Å; L702-V706 WeakPolarHBondContact O-CB 3.44Å; L702-V706 WeakPolarHBondContact O-CG2 3.42Å; L702-V706 PolarHBondContact O-N 2.88Å
703	L	91.3	Very high	88.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-59	-46.4	176.4	177.5	63.4	0	0	0	111.1	F690 G699 L700 V706 L707 V722 F726 L729	F690-L703 HydrophobicContact CB-CD1 4.39Å; F690-L703 HydrophobicContact CD1-CB 4.18Å; F690-L703 HydrophobicContact CD1-CD1 4.04Å; G699-L703 WeakPolarHBondContact O-CB 3.43Å; G699-L703 PolarHBondContact O-N 3.46Å; L700-L703 PolarHBondContact O-N 3.28Å; L703-V706 PolarHBondContact O-N 2.89Å; L703-L707 HydrophobicContact CD1-CD1 4.05Å; L703-L707 HydrophobicContact CD1-CG 4.31Å; L703-L707 HydrophobicContact CG-CD1 4.12Å; L703-L707 WeakPolarHBondContact O-CG 3.48Å; L703-L707 PolarHBondContact O-N 2.9Å; L703-V722 HydrophobicContact CD1-CG1 4.14Å; L703-F726 HydrophobicContact CD2-CD2 3.97Å; L703-L729 HydrophobicContact CD2-CD2 4.23Å
704	A	91.6	Very high	88.9	Confident	7 Å²	7	53 Å²	53	6%	0.058	31%	0.306	C	S	.	.	H	α-helix	trans	-62.6	-42.6	177.4	0	0	0	0	0	111.7	L700 A701 L702 L707 R708 L729 L734	L700-A704 WeakPolarHBondContact O-CB 3.34Å; L700-A704 PolarHBondContact O-N 3.12Å; A701-A704 PolarHBondContact O-N 2.95Å; L702-A704 VanDerWaalsContact C-N 3.33Å; L702-A704 PolarHBondContact O-N 2.72Å; A704-L707 PolarHBondContact O-N 3.39Å; A704-R708 VanDerWaalsContact O-CB 3.31Å; A704-R708 WeakPolarHBondContact O-CB 3.39Å; A704-R708 WeakPolarHBondContact O-CG 3.3Å; A704-R708 PolarHBondContact O-N 3.47Å; A704-L729 HydrophobicContact CB-CD1 3.86Å; A704-L734 HydrophobicContact CB-CB 4.13Å; A704-L734 HydrophobicContact CB-CD1 4.29Å
705	A	91.7	Very high	88.8	Confident	57 Å²	57	55.8 Å²	55.8	47%	0.471	33%	0.325	S	S	.	.	H	α-helix	trans	-62.5	-44.8	178.3	0	0	0	0	0	112.1	A701 L702 R708 H709	A701-A705 VanDerWaalsContact O-CB 3.27Å; A701-A705 WeakPolarHBondContact O-CB 3.31Å; A701-A705 PolarHBondContact O-N 3.24Å; L702-A705 PolarHBondContact O-N 3.47Å; A705-R708 PolarHBondContact O-N 2.96Å; A705-H709 WeakPolarHBondContact O-CB 3.42Å; A705-H709 PolarHBondContact O-N 3.38Å
706	V	92.9	Very high	88.9	Confident	23 Å²	23	53.8 Å²	53.8	14%	0.139	32%	0.317	C	S	.	.	H	α-helix	trans	-61.8	-47.1	177.1	167	0	0	0	0	111.1	V672 V676 L702 L703 H709 W710	V672-V706 HydrophobicContact CG1-CG1 3.93Å; V672-V706 HydrophobicContact CG1-CG2 4.06Å; V676-V706 HydrophobicContact CG2-CG1 3.96Å; L702-V706 WeakPolarHBondContact O-CB 3.44Å; L702-V706 WeakPolarHBondContact O-CG2 3.42Å; L702-V706 PolarHBondContact O-N 2.88Å; L703-V706 PolarHBondContact O-N 2.89Å; V706-H709 WeakPolarHBondContact O-CB 3.39Å; V706-H709 PolarHBondContact O-N 3.18Å; V706-W710 HydrophobicContact CG1-CD2 4.38Å; V706-W710 HydrophobicContact CG1-CE3 3.68Å; V706-W710 HydrophobicContact CG1-CH2 3.51Å; V706-W710 HydrophobicContact CG1-CZ2 4.2Å; V706-W710 HydrophobicContact CG1-CZ3 3.22Å; V706-W710 PolarHBondContact O-N 2.87Å
707	L	92.8	Very high	89.3	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-65.8	-41.4	178.3	-67	173	0	0	0	112.3	V604 L703 A704 H709 W710 L711 I720 V722 L729 L735	V604-L707 HydrophobicContact CG1-CD2 4.3Å; L703-L707 HydrophobicContact CD1-CD1 4.05Å; L703-L707 HydrophobicContact CD1-CG 4.31Å; L703-L707 HydrophobicContact CG-CD1 4.12Å; L703-L707 WeakPolarHBondContact O-CG 3.48Å; L703-L707 PolarHBondContact O-N 2.9Å; A704-L707 PolarHBondContact O-N 3.39Å; L707-H709 VanDerWaalsContact C-N 3.3Å; L707-H709 PolarHBondContact O-N 3.25Å; L707-W710 HydrophobicContact CD2-CE3 4.15Å; L707-W710 HydrophobicContact CD2-CZ3 4.26Å; L707-W710 PolarHBondContact O-N 3.37Å; L707-L711 WeakPolarHBondContact O-CB 3.43Å; L707-L711 VanDerWaalsContact O-CG 3.25Å; L707-L711 WeakPolarHBondContact O-CG 3.49Å; L707-L711 PolarHBondContact O-N 3.33Å; L707-I720 HydrophobicContact CD2-CG2 4.27Å; L707-V722 HydrophobicContact CD1-CG2 4.39Å; L707-V722 HydrophobicContact CD2-CG2 3.61Å; L707-L729 HydrophobicContact CD1-CD2 4.26Å; L707-L735 HydrophobicContact CB-CD2 3.67Å; L707-L735 HydrophobicContact CD1-CD1 4.23Å; L707-L735 HydrophobicContact CD1-CD2 4.08Å
708	R	91.4	Very high	89.6	Confident	137 Å²	137	43.9 Å²	43.9	52%	0.517	26%	0.256	S	S	.	.	H	α-helix	trans	-63.1	-37.2	175.3	-73.4	176.3	77.5	116.2	-0.9	112	A704 A705 L711 A712 L734 L735	A704-R708 VanDerWaalsContact O-CB 3.31Å; A704-R708 WeakPolarHBondContact O-CB 3.39Å; A704-R708 WeakPolarHBondContact O-CG 3.3Å; A704-R708 PolarHBondContact O-N 3.47Å; A705-R708 PolarHBondContact O-N 2.96Å; R708-L711 PolarHBondContact O-N 3.27Å; R708-A712 VanDerWaalsContact O-CB 3.32Å; R708-A712 WeakPolarHBondContact O-CB 3.31Å; R708-A712 PolarHBondContact O-N 3.15Å; R708-L734 WeakPolarHBondContact CD-O 3.41Å; R708-L734 PolarHBondContact NH1-O 3.32Å; R708-L735 HydrophobicContact CG-CD2 4.38Å
709	H	92.1	Very high	89.8	Confident	98 Å²	98	40.4 Å²	40.4	45%	0.454	24%	0.238	S	C	.	.	H	α-helix	trans	-59.2	-47	175.6	176.6	79.1	0	0	0	111.4	A705 V706 L707 A712	A705-H709 WeakPolarHBondContact O-CB 3.42Å; A705-H709 PolarHBondContact O-N 3.38Å; V706-H709 WeakPolarHBondContact O-CB 3.39Å; V706-H709 PolarHBondContact O-N 3.18Å; L707-H709 VanDerWaalsContact C-N 3.3Å; L707-H709 PolarHBondContact O-N 3.25Å; H709-A712 PolarHBondContact O-N 3.07Å
710	W	91.8	Very high	90.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-69.8	-38.6	176.3	-71.2	-47.5	0	0	0	113.4	A675 V676 V685 I687 V706 L707 A712 R713 C717 P718 I720	A675-W710 HydrophobicContact CB-CZ2 4.2Å; V676-W710 HydrophobicContact CB-CZ2 4.23Å; V676-W710 HydrophobicContact CG2-CH2 4Å; V676-W710 HydrophobicContact CG2-CZ2 3.41Å; V676-W710 VanDerWaalsContact CG2-CZ2 3.41Å; V685-W710 HydrophobicContact CG1-CH2 4Å; V685-W710 HydrophobicContact CG1-CZ2 4.45Å; I687-W710 HydrophobicContact CD1-CH2 3.76Å; I687-W710 HydrophobicContact CD1-CZ3 3.61Å; V706-W710 HydrophobicContact CG1-CD2 4.38Å; V706-W710 HydrophobicContact CG1-CE3 3.68Å; V706-W710 HydrophobicContact CG1-CH2 3.51Å; V706-W710 HydrophobicContact CG1-CZ2 4.2Å; V706-W710 HydrophobicContact CG1-CZ3 3.22Å; V706-W710 PolarHBondContact O-N 2.87Å; L707-W710 HydrophobicContact CD2-CE3 4.15Å; L707-W710 HydrophobicContact CD2-CZ3 4.26Å; L707-W710 PolarHBondContact O-N 3.37Å; W710-A712 VanDerWaalsContact C-N 3.29Å; W710-A712 PolarHBondContact O-N 2.93Å; W710-R713 VanDerWaalsContact O-CB 3.3Å; W710-R713 WeakPolarHBondContact O-CB 3.44Å; W710-R713 PolarHBondContact O-N 3.44Å; W710-R713 VanDerWaalsContact O-N 3.15Å; W710-C717 PolarHBondContact O-SG 3.26Å; W710-P718 HydrophobicContact CB-CG 4.48Å; W710-P718 HydrophobicContact CD2-CG 4.47Å; W710-P718 HydrophobicContact CG-CG 4.06Å; W710-I720 HydrophobicContact CB-CD1 3.71Å; W710-I720 HydrophobicContact CD2-CD1 3.63Å; W710-I720 HydrophobicContact CE3-CD1 3.31Å; W710-I720 HydrophobicContact CE3-CG1 4.43Å; W710-I720 HydrophobicContact CG-CD1 3.85Å; W710-I720 HydrophobicContact CZ3-CD1 4.01Å; W710-I720 HydrophobicContact CZ3-CG2 4.46Å
711	L	90.5	Very high	90.4	Very high	15 Å²	15	39.6 Å²	39.6	8%	0.079	23%	0.233	C	C	.	.	H	α-helix	trans	-65	-33.4	177.4	-72.8	168.1	0	0	0	112.2	V604 L707 R708 R713 G714 L735 P736 L740 V741	V604-L711 HydrophobicContact CB-CD2 4.27Å; V604-L711 HydrophobicContact CG2-CD2 3.6Å; V604-L711 HydrophobicContact CG2-CG 4.26Å; L707-L711 WeakPolarHBondContact O-CB 3.43Å; L707-L711 VanDerWaalsContact O-CG 3.25Å; L707-L711 WeakPolarHBondContact O-CG 3.49Å; L707-L711 PolarHBondContact O-N 3.33Å; R708-L711 PolarHBondContact O-N 3.27Å; L711-R713 PolarHBondContact O-N 3.44Å; L711-R713 VanDerWaalsContact O-N 3.16Å; L711-G714 PolarHBondContact O-N 2.94Å; L711-L735 HydrophobicContact CD1-CD2 4.3Å; L711-P736 HydrophobicContact CB-CG 4.4Å; L711-P736 HydrophobicContact CD1-CG 3.91Å; L711-L740 HydrophobicContact CD2-CB 3.96Å; L711-V741 HydrophobicContact CD1-CG2 3.59Å; L711-V741 HydrophobicContact CD2-CG2 3.52Å; L711-V741 HydrophobicContact CG-CG2 4.22Å
712	A	89.1	Confident	90.6	Very high	91 Å²	91	37 Å²	37	75%	0.752	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-18.9	175.4	0	0	0	0	0	113.2	R708 H709 W710 G714	R708-A712 VanDerWaalsContact O-CB 3.32Å; R708-A712 WeakPolarHBondContact O-CB 3.31Å; R708-A712 PolarHBondContact O-N 3.15Å; H709-A712 PolarHBondContact O-N 3.07Å; W710-A712 VanDerWaalsContact C-N 3.29Å; W710-A712 PolarHBondContact O-N 2.93Å; A712-G714 PolarHBondContact O-N 3.28Å
713	R	87.1	Confident	90.7	Very high	88 Å²	88	33.9 Å²	33.9	33%	0.332	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-6.8	174.8	-58.3	179.7	68.7	176.6	-0.9	113.4	A679 W710 L711 P715 T716	A679-R713 PolarHBondContact O-NH1 3.45Å; W710-R713 VanDerWaalsContact O-CB 3.3Å; W710-R713 WeakPolarHBondContact O-CB 3.44Å; W710-R713 PolarHBondContact O-N 3.44Å; W710-R713 VanDerWaalsContact O-N 3.15Å; L711-R713 PolarHBondContact O-N 3.44Å; L711-R713 VanDerWaalsContact O-N 3.16Å; R713-P715 WeakPolarHBondContact O-CD 3.37Å; R713-T716 WeakPolarHBondContact CB-OG1 3.46Å; R713-T716 PolarHBondContact O-N 3.12Å; R713-T716 VanDerWaalsContact O-N 3.15Å; R713-T716 PolarHBondContact O-OG1 3.18Å
714	G	84.6	Confident	90.6	Very high	18 Å²	18	34 Å²	34	19%	0.186	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	57.1	-119.2	175.1	0	0	0	0	0	113	L711 A712 T716 C717	L711-G714 PolarHBondContact O-N 2.94Å; A712-G714 PolarHBondContact O-N 3.28Å; G714-T716 PolarHBondContact O-N 3.43Å; G714-C717 WeakPolarHBondContact O-CB 3.01Å; G714-C717 PolarHBondContact O-N 3.08Å; G714-C717 VanDerWaalsContact O-N 3.13Å
715	P	80.9	Confident	90.3	Very high	106 Å²	106	35.9 Å²	35.9	69%	0.688	21%	0.205	S	C	*	.	G	3₁₀ helix	trans	-65.9	-20.1	-177.9	28.5	-35.1	0	0	0	113.4	R713 C717	R713-P715 WeakPolarHBondContact O-CD 3.37Å; P715-C717 VanDerWaalsContact C-N 3.28Å
716	T	85.7	Confident	89.9	Confident	66 Å²	66	34.7 Å²	34.7	41%	0.405	19%	0.19	S	C	.	.	G	3₁₀ helix	trans	-90.5	11.7	177.7	65.8	0	0	0	0	113.4	R713 G714	R713-T716 WeakPolarHBondContact CB-OG1 3.46Å; R713-T716 PolarHBondContact O-N 3.12Å; R713-T716 VanDerWaalsContact O-N 3.15Å; R713-T716 PolarHBondContact O-OG1 3.18Å; G714-T716 PolarHBondContact O-N 3.43Å
717	C	89.4	Confident	89.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	19%	0.189	C	C	.	.			trans	-64.1	134	174.3	-169.3	0	0	0	0	110.5	R603 W710 G714 P715	R603-C717 WeakPolarHBondContact CD-O 3.23Å; R603-C717 PolarHBondContact NH1-O 2.95Å; W710-C717 PolarHBondContact O-SG 3.26Å; G714-C717 WeakPolarHBondContact O-CB 3.01Å; G714-C717 PolarHBondContact O-N 3.08Å; G714-C717 VanDerWaalsContact O-N 3.13Å; P715-C717 VanDerWaalsContact C-N 3.28Å
718	P	92.2	Very high	88.9	Confident	0 Å²	0	37 Å²	37	0%	0	21%	0.205	C	C	.	.			trans	-62.3	167.7	171.3	21.4	-28.4	0	0	0	111.9	A679 T680 S683 V685 W710 I720	A679-P718 HydrophobicContact CB-CB 4.22Å; A679-P718 HydrophobicContact CB-CG 4.19Å; T680-P718 WeakPolarHBondContact O-CA 3.3Å; T680-P718 VanDerWaalsContact O-CB 3.26Å; T680-P718 WeakPolarHBondContact O-CB 3.46Å; S683-P718 WeakPolarHBondContact O-CB 3.13Å; V685-P718 HydrophobicContact CG2-CB 4.08Å; V685-P718 HydrophobicContact CG2-CG 4.39Å; W710-P718 HydrophobicContact CB-CG 4.48Å; W710-P718 HydrophobicContact CD2-CG 4.47Å; W710-P718 HydrophobicContact CG-CG 4.06Å; P718-I720 HydrophobicContact CB-CG1 4.29Å; P718-I720 HydrophobicContact CG-CD1 4.02Å; P718-I720 HydrophobicContact CG-CG1 3.94Å; P718-I720 PolarHBondContact O-N 3.43Å
719	H	93.3	Very high	88.5	Confident	5 Å²	5	30.5 Å²	30.5	2%	0.023	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	111.7	170.7	-65.2	-77.6	0	0	0	109	L571 G572 C597 R603 S683 L684 V685	L571-H719 PolarHBondContact O-CE1 3.31Å; L571-H719 VanDerWaalsContact O-CE1 3.27Å; G572-H719 WeakPolarHBondContact CA-CE1 3.29Å; G572-H719 WeakPolarHBondContact CA-NE2 3.32Å; G572-H719 PolarHBondContact N-CE1 2.91Å; G572-H719 PolarHBondContact N-NE2 3.39Å; C597-H719 PolarHBondContact SG-ND1 2.79Å; R603-H719 PolarHBondContact NH1-CE1 3.38Å; R603-H719 PolarHBondContact NH1-NE2 2.81Å; S683-H719 PolarHBondContact O-N 2.91Å; L684-H719 CarbonylContact C-O 3.58Å; L684-H719 WeakPolarHBondContact CA-O 3.32Å; L684-H719 HydrophobicContact CD1-CB 4.26Å; V685-H719 PolarHBondContact N-O 3.46Å
720	I	94.1	Very high	88	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129.2	-170.5	-47.9	173.5	0	0	0	110.2	R603 V604 K605 V685 I687 L707 W710 P718 V722	R603-I720 PolarHBondContact O-N 3.05Å; V604-I720 CarbonylContact C-O 3.58Å; V604-I720 WeakPolarHBondContact CA-O 3.5Å; V604-I720 HydrophobicContact CG1-CB 4.33Å; V604-I720 HydrophobicContact CG2-CB 4.26Å; V604-I720 HydrophobicContact CG2-CD1 3.91Å; V604-I720 HydrophobicContact CG2-CG1 4.32Å; K605-I720 PolarHBondContact N-O 2.83Å; V685-I720 HydrophobicContact CB-CG1 4.29Å; V685-I720 HydrophobicContact CB-CG2 4.34Å; V685-I720 HydrophobicContact CG1-CG2 4.47Å; V685-I720 CarbonylContact O-C 3.58Å; V685-I720 WeakPolarHBondContact O-CA 3.46Å; I687-I720 HydrophobicContact CD1-CG2 4.48Å; L707-I720 HydrophobicContact CD2-CG2 4.27Å; W710-I720 HydrophobicContact CB-CD1 3.71Å; W710-I720 HydrophobicContact CD2-CD1 3.63Å; W710-I720 HydrophobicContact CE3-CD1 3.31Å; W710-I720 HydrophobicContact CE3-CG1 4.43Å; W710-I720 HydrophobicContact CG-CD1 3.85Å; W710-I720 HydrophobicContact CZ3-CD1 4.01Å; W710-I720 HydrophobicContact CZ3-CG2 4.46Å; P718-I720 HydrophobicContact CB-CG1 4.29Å; P718-I720 HydrophobicContact CG-CD1 4.02Å; P718-I720 HydrophobicContact CG-CG1 3.94Å; P718-I720 PolarHBondContact O-N 3.43Å; I720-V722 HydrophobicContact CG2-CG2 3.56Å
721	F	94.8	Very high	87.4	Confident	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	123.1	166.3	-64.5	-101.6	0	0	0	109.7	V573 T595 C597 K605 I607 Y618 L619 V622 L684 V685 L686 I687	V573-F721 HydrophobicContact CG2-CE2 4.33Å; V573-F721 HydrophobicContact CG2-CZ 4.16Å; T595-F721 HydrophobicContact CG2-CE1 3.46Å; T595-F721 VanDerWaalsContact CG2-CE1 3.46Å; T595-F721 HydrophobicContact CG2-CZ 3.48Å; T595-F721 VanDerWaalsContact CG2-CZ 3.48Å; C597-F721 HydrophobicContact CB-CE1 4.4Å; C597-F721 HydrophobicContact CB-CE2 3.88Å; C597-F721 HydrophobicContact CB-CZ 3.47Å; C597-F721 VanDerWaalsContact CB-CZ 3.47Å; K605-F721 HydrophobicContact CB-CD1 3.72Å; K605-F721 HydrophobicContact CB-CE1 4.12Å; K605-F721 HydrophobicContact CB-CG 4.34Å; K605-F721 HydrophobicContact CG-CD1 3.78Å; K605-F721 HydrophobicContact CG-CE1 3.67Å; K605-F721 HydrophobicContact CG-CG 4.46Å; K605-F721 HydrophobicContact CG-CZ 4.28Å; I607-F721 HydrophobicContact CD1-CB 4.31Å; I607-F721 HydrophobicContact CD1-CD1 4.31Å; Y618-F721 HydrophobicContact CE1-CD1 4.49Å; L619-F721 HydrophobicContact CD2-CB 3.3Å; L619-F721 HydrophobicContact CD2-CG 4.34Å; V622-F721 HydrophobicContact CG1-CD2 4.38Å; V622-F721 HydrophobicContact CG1-CE1 4.44Å; V622-F721 HydrophobicContact CG1-CE2 3.86Å; V622-F721 HydrophobicContact CG1-CZ 3.88Å; V622-F721 HydrophobicContact CG2-CE1 4.45Å; L684-F721 HydrophobicContact CD1-CD2 3.71Å; L684-F721 HydrophobicContact CD1-CE2 3.65Å; V685-F721 PolarHBondContact O-N 3.03Å; L686-F721 HydrophobicContact CD2-CB 3.88Å; L686-F721 HydrophobicContact CD2-CD2 3.9Å; L686-F721 HydrophobicContact CD2-CG 4.18Å; I687-F721 PolarHBondContact N-O 2.84Å
722	V	94.4	Very high	87	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.006	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	114.1	-177.3	-173.7	0	0	0	0	109.5	K605 V606 I607 I687 L703 L707 I720	K605-V722 PolarHBondContact O-N 3.14Å; V606-V722 CarbonylContact C-O 3.57Å; I607-V722 PolarHBondContact N-O 3.4Å; I687-V722 HydrophobicContact CB-CG1 4.35Å; I687-V722 HydrophobicContact CB-CG2 4.31Å; I687-V722 HydrophobicContact CD1-CG2 4.42Å; I687-V722 HydrophobicContact CG2-CG1 4.41Å; I687-V722 CarbonylContact O-C 3.51Å; I687-V722 VanDerWaalsContact O-CA 3.24Å; I687-V722 WeakPolarHBondContact O-CA 3.06Å; L703-V722 HydrophobicContact CD1-CG1 4.14Å; L707-V722 HydrophobicContact CD1-CG2 4.39Å; L707-V722 HydrophobicContact CD2-CG2 3.61Å; I720-V722 HydrophobicContact CG2-CG2 3.56Å
723	A	92.6	Very high	86.7	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	128.2	163.9	0	0	0	0	0	109.4	I607 K615 L619 I687 D688 E689	I607-A723 WeakPolarHBondContact O-CA 3.42Å; K615-A723 HydrophobicContact CB-CB 3.98Å; L619-A723 HydrophobicContact CD1-CB 3.44Å; L619-A723 VanDerWaalsContact CD1-CB 3.44Å; L619-A723 HydrophobicContact CG-CB 4.16Å; I687-A723 PolarHBondContact O-N 2.95Å; D688-A723 WeakPolarHBondContact OD1-CB 3.43Å; E689-A723 PolarHBondContact N-O 3.32Å
724	T	89.8	Confident	86.5	Confident	1 Å²	1	38 Å²	38	1%	0.006	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144	146.8	179.2	-172.8	0	0	0	0	112.4	V606 I607 T608 F726 L729	V606-T724 HydrophobicContact CG1-CG2 4.06Å; I607-T724 PolarHBondContact O-N 3.22Å; T608-T724 HydrophobicContact CG2-CG2 4.35Å; T724-F726 PolarHBondContact OG1-N 3.03Å; T724-F726 VanDerWaalsContact OG1-N 3.07Å; T724-L729 HydrophobicContact CG2-CD2 4.26Å
725	N	84.5	Confident	86.5	Confident	48 Å²	48	37.2 Å²	37.2	26%	0.257	20%	0.201	S	C	.	.			trans	-93.5	-4.5	170.3	-68.2	-8.3	0	0	0	112.2	N611 K615 E689 K692 L727	N611-N725 PolarHBondContact OD1-ND2 3.41Å; K615-N725 VanDerWaalsContact CE-OD1 3.31Å; K615-N725 WeakPolarHBondContact CE-OD1 3.14Å; K615-N725 PolarHBondContact NZ-OD1 2.86Å; E689-N725 PolarHBondContact OE1-ND2 3.27Å; E689-N725 PolarHBondContact OE1-OD1 2.92Å; K692-N725 PolarHBondContact NZ-ND2 3.35Å; N725-L727 VanDerWaalsContact C-N 3.32Å; N725-L727 PolarHBondContact O-N 3.07Å
726	F	84.9	Confident	86.4	Confident	31 Å²	31	35.1 Å²	35.1	14%	0.136	19%	0.187	C	C	.	.			trans	-77.3	81.9	178	-63.3	-48.2	0	0	0	111	F690 L700 L703 T724 S728 L729	F690-F726 WeakPolarHBondContact O-CE2 3.29Å; L700-F726 HydrophobicContact CD1-CB 3.9Å; L700-F726 HydrophobicContact CD1-CD2 4.34Å; L700-F726 HydrophobicContact CD1-CG 4.22Å; L703-F726 HydrophobicContact CD2-CD2 3.97Å; T724-F726 PolarHBondContact OG1-N 3.03Å; T724-F726 VanDerWaalsContact OG1-N 3.07Å; F726-S728 PolarHBondContact O-N 3.26Å; F726-L729 HydrophobicContact CB-CB 4.44Å; F726-L729 WeakPolarHBondContact O-CB 3.4Å; F726-L729 PolarHBondContact O-N 3.39Å
727	L	81.3	Confident	85.7	Confident	25 Å²	25	38.5 Å²	38.5	13%	0.131	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-30.1	172.1	-62.4	175.6	0	0	0	111.8	T608 N725 L729 V730 Q731 A766	T608-L727 HydrophobicContact CG2-CD2 4.49Å; N725-L727 VanDerWaalsContact C-N 3.32Å; N725-L727 PolarHBondContact O-N 3.07Å; L727-L729 PolarHBondContact O-N 3.07Å; L727-V730 PolarHBondContact O-N 3.06Å; L727-Q731 WeakPolarHBondContact O-CG 3.4Å; L727-Q731 PolarHBondContact O-N 3.04Å; L727-A766 HydrophobicContact CD2-CB 3.87Å
728	S	81.6	Confident	85	Confident	48 Å²	48	40.2 Å²	40.2	34%	0.336	22%	0.216	S	C	.	.	H	α-helix	trans	-56.5	-28.5	174.1	-50.2	0	0	0	0	113.3	F726 V730 L732	F726-S728 PolarHBondContact O-N 3.26Å; S728-V730 PolarHBondContact O-N 3.49Å; S728-L732 WeakPolarHBondContact O-CB 3.41Å; S728-L732 WeakPolarHBondContact O-CG 3.36Å; S728-L732 PolarHBondContact O-N 3.03Å
729	L	83.6	Confident	84.5	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-58.6	-39.3	175.8	-173.4	73.1	0	0	0	111.4	V606 L700 L703 A704 L707 T724 F726 L727 L734 L735	V606-L729 HydrophobicContact CG1-CD2 4.19Å; L700-L729 HydrophobicContact CD1-CB 3.81Å; L700-L729 HydrophobicContact CD1-CD1 3.82Å; L700-L729 HydrophobicContact CD1-CG 4.43Å; L703-L729 HydrophobicContact CD2-CD2 4.23Å; A704-L729 HydrophobicContact CB-CD1 3.86Å; L707-L729 HydrophobicContact CD1-CD2 4.26Å; T724-L729 HydrophobicContact CG2-CD2 4.26Å; F726-L729 HydrophobicContact CB-CB 4.44Å; F726-L729 WeakPolarHBondContact O-CB 3.4Å; F726-L729 PolarHBondContact O-N 3.39Å; L727-L729 PolarHBondContact O-N 3.07Å; L729-L734 HydrophobicContact CD1-CB 4.15Å; L729-L734 HydrophobicContact CD1-CD1 4.34Å; L729-L734 PolarHBondContact O-N 3.32Å; L729-L735 HydrophobicContact CD1-CD2 4.5Å; L729-L735 HydrophobicContact CD1-CG 4.29Å; L729-L735 HydrophobicContact CD2-CD1 4.07Å; L729-L735 HydrophobicContact CG-CD1 4.26Å; L729-L735 HydrophobicContact CG-CG 4.32Å
730	V	82.2	Confident	84.1	Confident	22 Å²	22	47.7 Å²	47.7	13%	0.133	26%	0.262	C	S	.	.	H	α-helix	trans	-86.6	-44.5	-179.4	-167.5	0	0	0	0	110.9	T608 L727 S728 L732 Q733 Y743 V765	T608-V730 HydrophobicContact CG2-CG2 4.34Å; L727-V730 PolarHBondContact O-N 3.06Å; S728-V730 PolarHBondContact O-N 3.49Å; V730-L732 PolarHBondContact O-N 3.05Å; V730-Q733 PolarHBondContact O-N 2.71Å; V730-Q733 VanDerWaalsContact O-N 3.11Å; V730-Y743 HydrophobicContact CB-CE1 4.37Å; V730-Y743 HydrophobicContact CG1-CD1 4.13Å; V730-Y743 HydrophobicContact CG1-CE1 4.01Å; V730-Y743 HydrophobicContact CG2-CD1 3.82Å; V730-Y743 HydrophobicContact CG2-CE1 3.7Å; V730-V765 HydrophobicContact CB-CG1 3.98Å; V730-V765 HydrophobicContact CG1-CB 4.33Å; V730-V765 HydrophobicContact CG1-CG1 3.73Å; V730-V765 HydrophobicContact CG1-CG2 3.64Å; V730-V765 HydrophobicContact CG2-CG1 4.13Å
731	Q	80.1	Confident	83.9	Confident	132 Å²	132	48.7 Å²	48.7	62%	0.617	27%	0.268	S	S	*	.	H	α-helix	trans	-63.2	-38.7	-178.6	-68.9	176.1	-13	0	0	112.9	L727 Q733	L727-Q731 WeakPolarHBondContact O-CG 3.4Å; L727-Q731 PolarHBondContact O-N 3.04Å; Q731-Q733 VanDerWaalsContact C-N 3.28Å
732	L	81.2	Confident	83.7	Confident	112 Å²	112	50.3 Å²	50.3	59%	0.586	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	3.4	178	-60.6	173.6	0	0	0	113	L700 S728 V730 L734	L700-L732 HydrophobicContact CD2-CD1 4.42Å; S728-L732 WeakPolarHBondContact O-CB 3.41Å; S728-L732 WeakPolarHBondContact O-CG 3.36Å; S728-L732 PolarHBondContact O-N 3.03Å; V730-L732 PolarHBondContact O-N 3.05Å; L732-L734 HydrophobicContact CB-CD1 4.42Å; L732-L734 HydrophobicContact CB-CD2 4.03Å; L732-L734 HydrophobicContact CB-CG 3.86Å; L732-L734 PolarHBondContact O-N 2.9Å
733	Q	81.8	Confident	83.5	Confident	133 Å²	133	51.9 Å²	51.9	62%	0.621	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	43.8	-179.6	-58.8	-178.2	-0.6	0	0	113	V730 Q731 L735	V730-Q733 PolarHBondContact O-N 2.71Å; V730-Q733 VanDerWaalsContact O-N 3.11Å; Q731-Q733 VanDerWaalsContact C-N 3.28Å; Q733-L735 PolarHBondContact O-N 2.84Å
734	L	83	Confident	83.5	Confident	49 Å²	49	52.5 Å²	52.5	26%	0.257	29%	0.285	S	S	.	.			trans	-70.4	-18.8	-175.2	-64.3	178.9	0	0	0	112.9	L700 A704 R708 L729 L732	L700-L734 HydrophobicContact CD1-CD1 3.94Å; L700-L734 HydrophobicContact CD2-CD1 3.86Å; L700-L734 HydrophobicContact CG-CD1 3.78Å; A704-L734 HydrophobicContact CB-CB 4.13Å; A704-L734 HydrophobicContact CB-CD1 4.29Å; R708-L734 WeakPolarHBondContact CD-O 3.41Å; R708-L734 PolarHBondContact NH1-O 3.32Å; L729-L734 HydrophobicContact CD1-CB 4.15Å; L729-L734 HydrophobicContact CD1-CD1 4.34Å; L729-L734 PolarHBondContact O-N 3.32Å; L732-L734 HydrophobicContact CB-CD1 4.42Å; L732-L734 HydrophobicContact CB-CD2 4.03Å; L732-L734 HydrophobicContact CB-CG 3.86Å; L732-L734 PolarHBondContact O-N 2.9Å
735	L	85.4	Confident	83.6	Confident	3 Å²	3	53.3 Å²	53.3	2%	0.016	29%	0.29	C	S	.	.	S	Bend	trans	-95.8	143.3	175.4	-60.5	178	0	0	0	110.5	V606 L707 R708 L711 L729 Q733 Q737 V741 Y743	V606-L735 HydrophobicContact CG2-CD1 3.9Å; L707-L735 HydrophobicContact CB-CD2 3.67Å; L707-L735 HydrophobicContact CD1-CD1 4.23Å; L707-L735 HydrophobicContact CD1-CD2 4.08Å; R708-L735 HydrophobicContact CG-CD2 4.38Å; L711-L735 HydrophobicContact CD1-CD2 4.3Å; L729-L735 HydrophobicContact CD1-CD2 4.5Å; L729-L735 HydrophobicContact CD1-CG 4.29Å; L729-L735 HydrophobicContact CD2-CD1 4.07Å; L729-L735 HydrophobicContact CG-CD1 4.26Å; L729-L735 HydrophobicContact CG-CG 4.32Å; Q733-L735 PolarHBondContact O-N 2.84Å; L735-Q737 PolarHBondContact O-N 2.85Å; L735-V741 HydrophobicContact CD1-CG1 4.35Å; L735-Y743 HydrophobicContact CD1-CE1 4.39Å
736	P	78.4	Confident	83.9	Confident	61 Å²	61	51.2 Å²	51.2	40%	0.396	28%	0.278	S	S	.	.	P	Polyproline II helix	trans	-63	134.8	176.2	27.2	-33.7	0	0	0	110.4	L711 G738	L711-P736 HydrophobicContact CB-CG 4.4Å; L711-P736 HydrophobicContact CD1-CG 3.91Å; P736-G738 PolarHBondContact O-N 3.32Å
737	Q	71.8	Confident	84.1	Confident	137 Å²	137	53.5 Å²	53.5	64%	0.64	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-69.3	120.7	170.9	-63.9	-65.4	-24.9	0	0	108.4	L735	L735-Q737 PolarHBondContact O-N 2.85Å
738	G	74.1	Confident	84.4	Confident	36 Å²	36	54.2 Å²	54.2	37%	0.371	30%	0.295	S	S	.	.	S	Bend	trans	-174.7	164.1	-179.4	0	0	0	0	0	112.8	P736 L740 V741	P736-G738 PolarHBondContact O-N 3.32Å; G738-L740 PolarHBondContact O-N 3.08Å; G738-V741 PolarHBondContact O-N 2.87Å
739	P	81	Confident	84.5	Confident	113 Å²	113	54.7 Å²	54.7	73%	0.734	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-12	-176.1	28.7	-36.1	0	0	0	113.2	G602	G602-P739 WeakPolarHBondContact CA-O 3.43Å; G602-P739 PolarHBondContact N-O 3.1Å
740	L	84.9	Confident	84.3	Confident	50 Å²	50	59.6 Å²	59.6	26%	0.262	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-21.6	179	-69.4	173.6	0	0	0	113.6	G602 R603 V604 L711 G738	G602-L740 CarbonylContact C-O 3.5Å; R603-L740 HydrophobicContact CG-CD2 4.28Å; R603-L740 PolarHBondContact N-O 3.48Å; V604-L740 PolarHBondContact N-O 3.33Å; L711-L740 HydrophobicContact CD2-CB 3.96Å; G738-L740 PolarHBondContact O-N 3.08Å
741	V	90.1	Very high	84	Confident	20 Å²	20	64.2 Å²	64.2	12%	0.121	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	128.9	-175.9	-176.8	0	0	0	0	109.8	V604 V606 L711 L735 G738 Y743	V604-V741 HydrophobicContact CB-CG2 4.34Å; V604-V741 WeakPolarHBondContact O-CA 3.43Å; V606-V741 HydrophobicContact CG2-CG1 4.27Å; L711-V741 HydrophobicContact CD1-CG2 3.59Å; L711-V741 HydrophobicContact CD2-CG2 3.52Å; L711-V741 HydrophobicContact CG-CG2 4.22Å; L735-V741 HydrophobicContact CD1-CG1 4.35Å; G738-V741 PolarHBondContact O-N 2.87Å; V741-Y743 HydrophobicContact CG1-CE1 4.38Å; V741-Y743 HydrophobicContact CG1-CE2 4.12Å
742	Q	90.8	Very high	83.8	Confident	34 Å²	34	61.1 Å²	61.1	16%	0.159	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	136	171.7	-165.5	179.5	20.5	0	0	110.4	K601 V604 K605 V606 L744 E763	K601-Q742 PolarHBondContact O-OE1 2.83Å; V604-Q742 PolarHBondContact O-N 3.44Å; K605-Q742 WeakPolarHBondContact CA-O 3.4Å; K605-Q742 HydrophobicContact CD-CB 3.9Å; V606-Q742 PolarHBondContact N-O 3.44Å; Q742-L744 HydrophobicContact CG-CD2 4.31Å; Q742-E763 PolarHBondContact NE2-OE1 2.9Å
743	Y	91.4	Very high	83.1	Confident	35 Å²	35	62.2 Å²	62.2	14%	0.137	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	128.7	175.5	-61.8	-79.2	0	0	0	110.2	V606 V730 L735 V741 G764 V765	V606-Y743 HydrophobicContact CB-CD1 3.79Å; V606-Y743 HydrophobicContact CB-CE1 4.05Å; V606-Y743 HydrophobicContact CG1-CD1 4.07Å; V606-Y743 HydrophobicContact CG1-CE1 4.22Å; V606-Y743 HydrophobicContact CG2-CD1 4.43Å; V606-Y743 HydrophobicContact CG2-CE1 4.25Å; V730-Y743 HydrophobicContact CB-CE1 4.37Å; V730-Y743 HydrophobicContact CG1-CD1 4.13Å; V730-Y743 HydrophobicContact CG1-CE1 4.01Å; V730-Y743 HydrophobicContact CG2-CD1 3.82Å; V730-Y743 HydrophobicContact CG2-CE1 3.7Å; L735-Y743 HydrophobicContact CD1-CE1 4.39Å; V741-Y743 HydrophobicContact CG1-CE1 4.38Å; V741-Y743 HydrophobicContact CG1-CE2 4.12Å; Y743-G764 CarbonylContact C-O 3.2Å; Y743-G764 PolarHBondContact O-N 3.27Å; Y743-V765 HydrophobicContact CG-CG2 4.22Å
744	L	92.3	Very high	82.6	Confident	13 Å²	13	60.4 Å²	60.4	7%	0.068	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	152.1	178.5	-57.8	176.6	0	0	0	109.2	K605 V606 I607 T608 Q742 V761 C762 E763 G764	K605-L744 HydrophobicContact CB-CD1 4.16Å; K605-L744 HydrophobicContact CD-CD1 4.47Å; V606-L744 PolarHBondContact O-N 3.41Å; I607-L744 CarbonylContact C-O 3.19Å; I607-L744 WeakPolarHBondContact CA-O 3.37Å; I607-L744 HydrophobicContact CG1-CB 4.09Å; I607-L744 HydrophobicContact CG1-CD1 4.18Å; T608-L744 PolarHBondContact N-O 2.88Å; T608-L744 PolarHBondContact OG1-O 3.44Å; Q742-L744 HydrophobicContact CG-CD2 4.31Å; L744-V761 HydrophobicContact CB-CG1 4Å; L744-V761 HydrophobicContact CD1-CG1 4.07Å; L744-V761 HydrophobicContact CD2-CG1 4.44Å; L744-V761 HydrophobicContact CG-CG1 4.4Å; L744-C762 CarbonylContact C-O 3.47Å; L744-C762 WeakPolarHBondContact CA-O 3.4Å; L744-E763 HydrophobicContact CD2-CG 4.16Å; L744-G764 CarbonylContact C-O 3.58Å; L744-G764 WeakPolarHBondContact CA-O 3.37Å; L744-G764 PolarHBondContact N-O 3.16Å
745	T	92.1	Very high	82.4	Confident	17 Å²	17	58.3 Å²	58.3	10%	0.104	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	150.8	173.6	-163.3	0	0	0	0	112.7	T608 C762 A766	T608-T745 WeakPolarHBondContact O-CA 3.44Å; T608-T745 WeakPolarHBondContact O-CB 3.34Å; T608-T745 PolarHBondContact O-OG1 2.86Å; T745-C762 PolarHBondContact N-O 3.38Å; T745-C762 PolarHBondContact O-N 2.9Å; T745-C762 PolarHBondContact O-SG 2.78Å; T745-A766 PolarHBondContact OG1-N 2.99Å
746	M	90.7	Very high	82.3	Confident	4 Å²	4	61.2 Å²	61.2	2%	0.02	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	127.8	172	-60.5	-56.7	-68	0	0	109.2	T608 S613 K615 Q760 V761	T608-M746 PolarHBondContact O-N 3.21Å; T608-M746 VanDerWaalsContact O-N 3.15Å; S613-M746 WeakPolarHBondContact O-CE 3.37Å; S613-M746 WeakPolarHBondContact OG-CB 3.45Å; S613-M746 WeakPolarHBondContact OG-CG 3.33Å; K615-M746 HydrophobicContact CG-CG 3.73Å; M746-Q760 WeakPolarHBondContact CA-O 3.15Å; M746-V761 HydrophobicContact CE-CG2 4.12Å; M746-V761 HydrophobicContact SD-CB 4.48Å; M746-V761 HydrophobicContact SD-CG2 3.5Å; M746-V761 WeakPolarHBondContact SD-CG2 3.32Å
747	E	89	Confident	82.7	Confident	80 Å²	80	59.9 Å²	59.9	37%	0.374	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	132.4	-178	-166.1	173.2	-165	0	0	111.7	F758 Q760	E747-F758 HydrophobicContact CB-CB 4.29Å; E747-F758 HydrophobicContact CB-CD2 4.36Å; E747-F758 HydrophobicContact CG-CD2 3.88Å; E747-F758 PolarHBondContact O-N 3.33Å; E747-Q760 HydrophobicContact CB-CB 4.48Å; E747-Q760 PolarHBondContact N-O 2.9Å
748	T	86.4	Confident	83.5	Confident	40 Å²	40	57.9 Å²	57.9	25%	0.245	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	140.2	-179.8	58.4	0	0	0	0	110.4	P610 V756 F757	P610-T748 HydrophobicContact CG-CG2 3.97Å; T748-V756 WeakPolarHBondContact CA-O 3.35Å; T748-F757 HydrophobicContact CG2-CD1 3.74Å; T748-F757 HydrophobicContact CG2-CE1 4.23Å
749	C	84	Confident	84.3	Confident	57 Å²	57	61.3 Å²	61.3	39%	0.385	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	140.5	170.1	-179.6	0	0	0	0	110.1	V756 F758	C749-V756 PolarHBondContact N-O 3.23Å; C749-V756 PolarHBondContact O-N 3.21Å; C749-F758 HydrophobicContact CB-CE2 3.42Å; C749-F758 VanDerWaalsContact CB-CE2 3.42Å; C749-F758 HydrophobicContact CB-CZ 3.86Å
750	E	79.3	Confident	84.8	Confident	104 Å²	104	60.6 Å²	60.6	49%	0.486	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	116.9	169.2	-63.6	-176.1	156.9	0	0	107.5	L755 H770 H773	E750-L755 HydrophobicContact CG-CD1 3.88Å; E750-H770 IonicContact OE1-CE1 2.86Å; E750-H770 PolarHBondContact OE1-CE1 2.96Å; E750-H770 IonicContact OE1-ND1 2.67Å; E750-H770 PolarHBondContact OE1-ND1 3.27Å; E750-H773 IonicContact OE1-CE1 3.25Å; E750-H773 PolarHBondContact OE1-CE1 2.63Å; E750-H773 VanDerWaalsContact OE1-CE1 3.25Å; E750-H773 IonicContact OE1-ND1 2.71Å
751	D	76.9	Confident	85.1	Confident	119 Å²	119	59.4 Å²	59.4	64%	0.636	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.4	95.2	172.6	-171.7	15.8	0	0	0	108.8	N753 D754 V756	D751-N753 PolarHBondContact O-N 2.96Å; D751-N753 VanDerWaalsContact O-N 3.1Å; D751-D754 PolarHBondContact N-O 3.16Å; D751-D754 PolarHBondContact O-N 3.13Å; D751-V756 HydrophobicContact CB-CG2 4.43Å
752	G	74.9	Confident	85.2	Confident	67 Å²	67	60.3 Å²	60.3	69%	0.691	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	-111.3	-173.8	0	0	0	0	0	112.5
753	N	67.6	Low	85.1	Confident	134 Å²	134	65.2 Å²	65.2	72%	0.717	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-9.6	177.1	-76.8	-10.1	0	0	0	113.2	D751	D751-N753 PolarHBondContact O-N 2.96Å; D751-N753 VanDerWaalsContact O-N 3.1Å
754	D	69.6	Low	84.8	Confident	95 Å²	95	64.9 Å²	64.9	51%	0.508	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	137.4	-175.9	-76	-44.6	0	0	0	111.6	D751	D751-D754 PolarHBondContact N-O 3.16Å; D751-D754 PolarHBondContact O-N 3.13Å
755	L	79.4	Confident	84.3	Confident	5 Å²	5	66.9 Å²	66.9	3%	0.026	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	115.5	171.9	-171.1	71.6	0	0	0	108.6	P610 E750 F757 H770 H773 Q777	P610-L755 HydrophobicContact CB-CD2 4.31Å; P610-L755 HydrophobicContact CG-CD2 4.24Å; E750-L755 HydrophobicContact CG-CD1 3.88Å; L755-F757 HydrophobicContact CD2-CD1 4.47Å; L755-F757 HydrophobicContact CD2-CE1 3.48Å; L755-F757 VanDerWaalsContact CD2-CE1 3.48Å; L755-F757 HydrophobicContact CD2-CZ 3.67Å; L755-F757 HydrophobicContact CG-CE1 4Å; L755-F757 HydrophobicContact CG-CZ 4.21Å; L755-H770 HydrophobicContact CD1-CB 4.31Å; L755-H770 HydrophobicContact CD2-CB 3.52Å; L755-H773 HydrophobicContact CB-CB 4.2Å; L755-Q777 VanDerWaalsContact N-NE2 3.1Å; L755-Q777 PolarHBondContact O-NE2 3.1Å
756	V	84.2	Confident	83.5	Confident	64 Å²	64	66.8 Å²	66.8	39%	0.388	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	127	177	-176.9	0	0	0	0	109.2	T748 C749 D751	T748-V756 WeakPolarHBondContact CA-O 3.35Å; C749-V756 PolarHBondContact N-O 3.23Å; C749-V756 PolarHBondContact O-N 3.21Å; D751-V756 HydrophobicContact CB-CG2 4.43Å
757	F	86.9	Confident	82.4	Confident	34 Å²	34	76.5 Å²	76.5	15%	0.149	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	120.5	176.1	-53.8	-70.2	0	0	0	109.7	P610 T748 L755 Y759	P610-F757 HydrophobicContact CB-CE1 3.92Å; P610-F757 HydrophobicContact CG-CE1 4.34Å; T748-F757 HydrophobicContact CG2-CD1 3.74Å; T748-F757 HydrophobicContact CG2-CE1 4.23Å; L755-F757 HydrophobicContact CD2-CD1 4.47Å; L755-F757 HydrophobicContact CD2-CE1 3.48Å; L755-F757 VanDerWaalsContact CD2-CE1 3.48Å; L755-F757 HydrophobicContact CD2-CZ 3.67Å; L755-F757 HydrophobicContact CG-CE1 4Å; L755-F757 HydrophobicContact CG-CZ 4.21Å; F757-Y759 VanDerWaalsContact C-N 3.31Å; F757-Y759 HydrophobicContact CB-CD1 4.2Å; F757-Y759 HydrophobicContact CB-CD2 4.49Å; F757-Y759 HydrophobicContact CB-CE1 3.78Å; F757-Y759 HydrophobicContact CB-CE2 4.1Å; F757-Y759 HydrophobicContact CG-CE1 4.46Å; F757-Y759 WeakPolarHBondContact O-CD2 3.38Å; F757-Y759 WeakPolarHBondContact O-CE2 3.4Å
758	F	88.6	Confident	81.3	Confident	95 Å²	95	75 Å²	75	42%	0.417	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	-12.4	174.4	-66.7	-79.7	0	0	0	113	E747 C749 Q760	E747-F758 HydrophobicContact CB-CB 4.29Å; E747-F758 HydrophobicContact CB-CD2 4.36Å; E747-F758 HydrophobicContact CG-CD2 3.88Å; E747-F758 PolarHBondContact O-N 3.33Å; C749-F758 HydrophobicContact CB-CE2 3.42Å; C749-F758 VanDerWaalsContact CB-CE2 3.42Å; C749-F758 HydrophobicContact CB-CZ 3.86Å; F758-Q760 HydrophobicContact CB-CB 4.48Å; F758-Q760 PolarHBondContact O-N 3.16Å; F758-Q760 VanDerWaalsContact O-N 3.09Å
759	Y	89.9	Confident	80.3	Confident	108 Å²	108	76.4 Å²	76.4	42%	0.424	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	57.7	19.7	-176.7	-53.1	-70.6	0	0	0	114.2	N593 S612 S613 F757	N593-Y759 PolarHBondContact ND2-O 3.02Å; S612-Y759 WeakPolarHBondContact O-CE1 3.32Å; S613-Y759 WeakPolarHBondContact O-CD1 3.41Å; F757-Y759 VanDerWaalsContact C-N 3.31Å; F757-Y759 HydrophobicContact CB-CD1 4.2Å; F757-Y759 HydrophobicContact CB-CD2 4.49Å; F757-Y759 HydrophobicContact CB-CE1 3.78Å; F757-Y759 HydrophobicContact CB-CE2 4.1Å; F757-Y759 HydrophobicContact CG-CE1 4.46Å; F757-Y759 WeakPolarHBondContact O-CD2 3.38Å; F757-Y759 WeakPolarHBondContact O-CE2 3.4Å
760	Q	91.5	Very high	79.7	Confident	98 Å²	98	74.8 Å²	74.8	46%	0.458	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	135.9	177.8	-171.4	166.2	-4	0	0	110.9	N593 M746 E747 F758	N593-Q760 WeakPolarHBondContact OD1-CA 3.35Å; M746-Q760 WeakPolarHBondContact CA-O 3.15Å; E747-Q760 HydrophobicContact CB-CB 4.48Å; E747-Q760 PolarHBondContact N-O 2.9Å; F758-Q760 HydrophobicContact CB-CB 4.48Å; F758-Q760 PolarHBondContact O-N 3.16Å; F758-Q760 VanDerWaalsContact O-N 3.09Å
761	V	92.4	Very high	79.3	Confident	24 Å²	24	73 Å²	73	15%	0.145	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	130.4	174.4	179.5	0	0	0	0	109.3	N593 Y618 L744 M746	N593-V761 HydrophobicContact CB-CG2 4.41Å; N593-V761 PolarHBondContact OD1-N 2.65Å; Y618-V761 HydrophobicContact CD1-CG2 4.16Å; Y618-V761 HydrophobicContact CD2-CG2 3.68Å; Y618-V761 HydrophobicContact CE1-CG2 4.24Å; Y618-V761 HydrophobicContact CE2-CG2 3.78Å; Y618-V761 HydrophobicContact CG-CG2 3.87Å; L744-V761 HydrophobicContact CB-CG1 4Å; L744-V761 HydrophobicContact CD1-CG1 4.07Å; L744-V761 HydrophobicContact CD2-CG1 4.44Å; L744-V761 HydrophobicContact CG-CG1 4.4Å; M746-V761 HydrophobicContact CE-CG2 4.12Å; M746-V761 HydrophobicContact SD-CB 4.48Å; M746-V761 HydrophobicContact SD-CG2 3.5Å; M746-V761 WeakPolarHBondContact SD-CG2 3.32Å
762	C	91.2	Very high	79.1	Confident	40 Å²	40	68.8 Å²	68.8	27%	0.27	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	154.4	178.3	50.5	0	0	0	0	111.1	L744 T745	L744-C762 CarbonylContact C-O 3.47Å; L744-C762 WeakPolarHBondContact CA-O 3.4Å; T745-C762 PolarHBondContact N-O 3.38Å; T745-C762 PolarHBondContact O-N 2.9Å; T745-C762 PolarHBondContact O-SG 2.78Å
763	E	88.8	Confident	79.1	Confident	136 Å²	136	67.5 Å²	67.5	64%	0.636	37%	0.368	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.6	133	177.5	-65.3	-170.9	173.4	0	0	110.3	Q742 L744	Q742-E763 PolarHBondContact NE2-OE1 2.9Å; L744-E763 HydrophobicContact CD2-CG 4.16Å
764	G	85.4	Confident	79.4	Confident	28 Å²	28	63.2 Å²	63.2	29%	0.289	35%	0.347	S	S	.	.	S	Bend	trans	134.9	-163	178.6	0	0	0	0	0	113.9	Y743 L744	Y743-G764 CarbonylContact C-O 3.2Å; Y743-G764 PolarHBondContact O-N 3.27Å; L744-G764 CarbonylContact C-O 3.58Å; L744-G764 WeakPolarHBondContact CA-O 3.37Å; L744-G764 PolarHBondContact N-O 3.16Å
765	V	81.1	Confident	79.8	Confident	55 Å²	55	59.9 Å²	59.9	33%	0.333	33%	0.333	S	S	.	.			trans	-131.3	137.9	-172.9	-173.5	0	0	0	0	108.3	V730 Y743 K767	V730-V765 HydrophobicContact CB-CG1 3.98Å; V730-V765 HydrophobicContact CG1-CB 4.33Å; V730-V765 HydrophobicContact CG1-CG1 3.73Å; V730-V765 HydrophobicContact CG1-CG2 3.64Å; V730-V765 HydrophobicContact CG2-CG1 4.13Å; Y743-V765 HydrophobicContact CG-CG2 4.22Å; V765-K767 PolarHBondContact O-N 2.94Å
766	A	75.9	Confident	79.9	Confident	15 Å²	15	61.3 Å²	61.3	12%	0.124	35%	0.346	C	S	.	.			trans	-59.6	128.7	174.5	0	0	0	0	0	111.1	T608 L727 T745	T608-A766 PolarHBondContact OG1-N 3.32Å; L727-A766 HydrophobicContact CD2-CB 3.87Å; T745-A766 PolarHBondContact OG1-N 2.99Å
767	K	67.8	Low	79.4	Confident	208 Å²	208	62.1 Å²	62.1	90%	0.904	35%	0.345	S	S	*	.			trans	-75.4	-31.9	-174.4	-66.5	179.3	-178.1	173.2	0	113.4	V765	V765-K767 PolarHBondContact O-N 2.94Å
768	A	65.3	Low	79.2	Confident	50 Å²	50	64.3 Å²	64.3	41%	0.413	37%	0.37	S	S	.	.	S	Bend	trans	-148.9	161.2	-178.2	0	0	0	0	0	112.5	H770	A768-H770 PolarHBondContact O-CD2 3Å; A768-H770 VanDerWaalsContact O-CD2 3.27Å; A768-H770 PolarHBondContact O-NE2 3.34Å
769	S	65.5	Low	78.8	Confident	69 Å²	69	62.9 Å²	62.9	48%	0.483	38%	0.382	S	S	.	.			trans	-85.6	118.2	168.2	62.7	0	0	0	0	109.8	A771	S769-A771 PolarHBondContact O-N 3.43Å
770	H	71.3	Confident	78.6	Confident	22 Å²	22	61.1 Å²	61.1	10%	0.102	38%	0.379	C	S	.	.			trans	-90.2	25.1	-177.7	-57.8	-92.4	0	0	0	113.2	P610 E750 L755 A768 S772 H773 T774	P610-H770 HydrophobicContact CG-CB 4.33Å; E750-H770 IonicContact OE1-CE1 2.86Å; E750-H770 PolarHBondContact OE1-CE1 2.96Å; E750-H770 IonicContact OE1-ND1 2.67Å; E750-H770 PolarHBondContact OE1-ND1 3.27Å; L755-H770 HydrophobicContact CD1-CB 4.31Å; L755-H770 HydrophobicContact CD2-CB 3.52Å; A768-H770 PolarHBondContact O-CD2 3Å; A768-H770 VanDerWaalsContact O-CD2 3.27Å; A768-H770 PolarHBondContact O-NE2 3.34Å; H770-S772 PolarHBondContact O-N 3.02Å; H770-H773 AromaticContact ND1-ND1 3.86Å; H770-H773 PolarHBondContact O-N 2.98Å; H770-T774 PolarHBondContact O-N 2.7Å; H770-T774 VanDerWaalsContact O-N 3.13Å; H770-T774 PolarHBondContact O-OG1 2.67Å
771	A	71.1	Confident	78.4	Confident	67 Å²	67	60.3 Å²	60.3	55%	0.554	38%	0.383	S	S	*	.	H	α-helix	trans	-60.2	-32.2	-175.8	0	0	0	0	0	113	S769 T774 A775	S769-A771 PolarHBondContact O-N 3.43Å; A771-T774 PolarHBondContact O-N 2.64Å; A771-A775 WeakPolarHBondContact O-CB 3.44Å; A771-A775 PolarHBondContact O-N 3.43Å
772	S	73.1	Confident	78	Confident	31 Å²	31	65.1 Å²	65.1	22%	0.217	41%	0.407	C	S	.	.	H	α-helix	trans	-64.9	-38.6	174.6	52.5	0	0	0	0	112.7	H770 A775 A776 V785	H770-S772 PolarHBondContact O-N 3.02Å; S772-A775 PolarHBondContact O-N 3.45Å; S772-A776 PolarHBondContact O-N 2.82Å; S772-V785 WeakPolarHBondContact O-CG1 3.45Å
773	H	74.1	Confident	77.7	Confident	39 Å²	39	72.1 Å²	72.1	18%	0.181	43%	0.433	C	S	.	.	H	α-helix	trans	-70.4	-41.8	177.6	-62.8	108.1	0	0	0	110.8	E750 L755 H770 A775 A776 Q777	E750-H773 IonicContact OE1-CE1 3.25Å; E750-H773 PolarHBondContact OE1-CE1 2.63Å; E750-H773 VanDerWaalsContact OE1-CE1 3.25Å; E750-H773 IonicContact OE1-ND1 2.71Å; L755-H773 HydrophobicContact CB-CB 4.2Å; H770-H773 AromaticContact ND1-ND1 3.86Å; H770-H773 PolarHBondContact O-N 2.98Å; H773-A775 VanDerWaalsContact C-N 3.28Å; H773-A775 PolarHBondContact O-N 3.44Å; H773-A776 PolarHBondContact O-N 3.39Å; H773-Q777 WeakPolarHBondContact O-CG 3.35Å; H773-Q777 PolarHBondContact O-N 2.7Å
774	T	74.9	Confident	77.6	Confident	45 Å²	45	70.3 Å²	70.3	28%	0.276	43%	0.427	S	S	.	.	H	α-helix	trans	-61.2	-37.6	173.5	-46.5	0	0	0	0	111.9	H770 A771 Q777 A778	H770-T774 PolarHBondContact O-N 2.7Å; H770-T774 VanDerWaalsContact O-N 3.13Å; H770-T774 PolarHBondContact O-OG1 2.67Å; A771-T774 PolarHBondContact O-N 2.64Å; T774-Q777 PolarHBondContact O-N 3.49Å; T774-A778 WeakPolarHBondContact O-CB 3.36Å; T774-A778 PolarHBondContact O-N 3.38Å
775	A	78.3	Confident	77.6	Confident	25 Å²	25	70 Å²	70	21%	0.207	42%	0.42	C	S	.	.	H	α-helix	trans	-64.8	-43.7	175.1	0	0	0	0	0	112.2	A771 S772 H773 A778 L780 V785	A771-A775 WeakPolarHBondContact O-CB 3.44Å; A771-A775 PolarHBondContact O-N 3.43Å; S772-A775 PolarHBondContact O-N 3.45Å; H773-A775 VanDerWaalsContact C-N 3.28Å; H773-A775 PolarHBondContact O-N 3.44Å; A775-A778 PolarHBondContact O-N 3Å; A775-L780 HydrophobicContact CB-CD1 3.61Å; A775-L780 WeakPolarHBondContact O-CB 3.16Å; A775-L780 PolarHBondContact O-N 3.32Å; A775-V785 HydrophobicContact CB-CG2 4.17Å
776	A	79.6	Confident	77.7	Confident	35 Å²	35	70.4 Å²	70.4	29%	0.289	43%	0.429	S	S	.	.	H	α-helix	trans	-61.3	-44.9	175	0	0	0	0	0	111.7	S772 H773 A778 G779 V785	S772-A776 PolarHBondContact O-N 2.82Å; H773-A776 PolarHBondContact O-N 3.39Å; A776-A778 VanDerWaalsContact C-N 3.28Å; A776-A778 PolarHBondContact O-N 3.06Å; A776-G779 PolarHBondContact O-N 2.87Å; A776-V785 HydrophobicContact CB-CG2 4.43Å
777	Q	75.6	Confident	78.1	Confident	80 Å²	80	72.2 Å²	72.2	37%	0.374	43%	0.433	S	S	.	.	H	α-helix	trans	-62.8	-31.3	176	-74.3	179.9	-23.7	0	0	113.4	L755 H773 T774 G779	L755-Q777 VanDerWaalsContact N-NE2 3.1Å; L755-Q777 PolarHBondContact O-NE2 3.1Å; H773-Q777 WeakPolarHBondContact O-CG 3.35Å; H773-Q777 PolarHBondContact O-N 2.7Å; T774-Q777 PolarHBondContact O-N 3.49Å; Q777-G779 PolarHBondContact O-N 3.25Å
778	A	81.4	Confident	78.9	Confident	81 Å²	81	64.2 Å²	64.2	67%	0.669	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-1.8	173.3	0	0	0	0	0	113.5	T774 A775 A776	T774-A778 WeakPolarHBondContact O-CB 3.36Å; T774-A778 PolarHBondContact O-N 3.38Å; A775-A778 PolarHBondContact O-N 3Å; A776-A778 VanDerWaalsContact C-N 3.28Å; A776-A778 PolarHBondContact O-N 3.06Å
779	G	81.4	Confident	79.8	Confident	65 Å²	65	67.4 Å²	67.4	67%	0.67	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.4	19.8	179	0	0	0	0	0	114.4	A776 Q777	A776-G779 PolarHBondContact O-N 2.87Å; Q777-G779 PolarHBondContact O-N 3.25Å
780	L	84.5	Confident	80.6	Confident	71 Å²	71	67.5 Å²	67.5	37%	0.372	41%	0.407	S	S	.	.			trans	-69.9	141.9	174.4	-77.6	149	0	0	0	110.8	A775 D782 L784 V785	A775-L780 HydrophobicContact CB-CD1 3.61Å; A775-L780 WeakPolarHBondContact O-CB 3.16Å; A775-L780 PolarHBondContact O-N 3.32Å; L780-D782 PolarHBondContact O-N 3.38Å; L780-L784 HydrophobicContact CD2-CD1 4.28Å; L780-L784 HydrophobicContact CD2-CD2 4.15Å; L780-V785 HydrophobicContact CB-CG2 4.01Å
781	P	88	Confident	81.2	Confident	81 Å²	81	68 Å²	68	53%	0.526	41%	0.411	S	S	.	.			trans	-58.3	136.7	-179.8	-24.4	33.1	0	0	0	112.8	K783 L784 V785	P781-K783 PolarHBondContact O-N 3.12Å; P781-K783 VanDerWaalsContact O-N 3.09Å; P781-L784 HydrophobicContact CB-CB 4.45Å; P781-L784 WeakPolarHBondContact O-CA 3.48Å; P781-L784 VanDerWaalsContact O-CB 3.3Å; P781-L784 WeakPolarHBondContact O-CB 3.26Å; P781-L784 PolarHBondContact O-N 2.88Å; P781-V785 PolarHBondContact O-N 3.11Å; P781-V785 VanDerWaalsContact O-N 3.1Å
782	D	84.6	Confident	81.6	Confident	125 Å²	125	67.3 Å²	67.3	67%	0.668	40%	0.402	S	S	*	.	H	α-helix	trans	-54.2	-37	-177.3	-63.1	-35.4	0	0	0	113.3	L780 L784 V785 A786	L780-D782 PolarHBondContact O-N 3.38Å; D782-L784 VanDerWaalsContact C-N 3.27Å; D782-L784 PolarHBondContact O-N 3.22Å; D782-V785 PolarHBondContact O-N 3.11Å; D782-A786 VanDerWaalsContact O-CB 3.26Å; D782-A786 WeakPolarHBondContact O-CB 3.36Å; D782-A786 PolarHBondContact O-N 3.41Å
783	K	84.9	Confident	81.9	Confident	187 Å²	187	69.3 Å²	69.3	81%	0.813	41%	0.41	S	S	*	.	H	α-helix	trans	-61.1	-36.4	176.1	-66.5	-175.7	-179.8	179.5	0	112.2	P781 R787	P781-K783 PolarHBondContact O-N 3.12Å; P781-K783 VanDerWaalsContact O-N 3.09Å; K783-R787 VanDerWaalsContact O-CB 3.32Å; K783-R787 WeakPolarHBondContact O-CB 3.42Å; K783-R787 PolarHBondContact O-N 2.96Å; K783-R787 VanDerWaalsContact O-N 3.09Å
784	L	85.3	Confident	82.3	Confident	98 Å²	98	69 Å²	69	51%	0.513	41%	0.41	S	S	.	.	H	α-helix	trans	-73.9	-42.7	178	-168.1	157.2	0	0	0	110.3	L780 P781 D782 R787 G788	L780-L784 HydrophobicContact CD2-CD1 4.28Å; L780-L784 HydrophobicContact CD2-CD2 4.15Å; P781-L784 HydrophobicContact CB-CB 4.45Å; P781-L784 WeakPolarHBondContact O-CA 3.48Å; P781-L784 VanDerWaalsContact O-CB 3.3Å; P781-L784 WeakPolarHBondContact O-CB 3.26Å; P781-L784 PolarHBondContact O-N 2.88Å; D782-L784 VanDerWaalsContact C-N 3.27Å; D782-L784 PolarHBondContact O-N 3.22Å; L784-R787 PolarHBondContact O-N 3.49Å; L784-G788 PolarHBondContact O-N 3.2Å
785	V	85.6	Confident	82.4	Confident	22 Å²	22	72.3 Å²	72.3	13%	0.133	43%	0.425	C	S	.	.	H	α-helix	trans	-62.8	-46.7	176.4	-180	0	0	0	0	111.1	S772 A775 A776 L780 P781 D782 R787 G788 K789	S772-V785 WeakPolarHBondContact O-CG1 3.45Å; A775-V785 HydrophobicContact CB-CG2 4.17Å; A776-V785 HydrophobicContact CB-CG2 4.43Å; L780-V785 HydrophobicContact CB-CG2 4.01Å; P781-V785 PolarHBondContact O-N 3.11Å; P781-V785 VanDerWaalsContact O-N 3.1Å; D782-V785 PolarHBondContact O-N 3.11Å; V785-R787 VanDerWaalsContact C-N 3.33Å; V785-R787 PolarHBondContact O-N 2.94Å; V785-G788 PolarHBondContact O-N 3.48Å; V785-G788 VanDerWaalsContact O-N 3.15Å; V785-K789 PolarHBondContact O-N 3.21Å
786	A	84.6	Confident	82.1	Confident	63 Å²	63	79.6 Å²	79.6	52%	0.521	45%	0.447	S	S	.	.	H	α-helix	trans	-59.1	-44.3	176.2	0	0	0	0	0	111.4	D782 K789 E790	D782-A786 VanDerWaalsContact O-CB 3.26Å; D782-A786 WeakPolarHBondContact O-CB 3.36Å; D782-A786 PolarHBondContact O-N 3.41Å; A786-K789 PolarHBondContact O-N 3.1Å; A786-E790 PolarHBondContact O-N 2.8Å
787	R	83.6	Confident	81.9	Confident	53 Å²	53	81 Å²	81	20%	0.2	45%	0.454	C	S	.	.	H	α-helix	trans	-64.5	-40.1	175.1	-179	57.2	-177.2	-179.3	3.2	112.3	K783 L784 V785 K789 E790 V791 K802	K783-R787 VanDerWaalsContact O-CB 3.32Å; K783-R787 WeakPolarHBondContact O-CB 3.42Å; K783-R787 PolarHBondContact O-N 2.96Å; K783-R787 VanDerWaalsContact O-N 3.09Å; L784-R787 PolarHBondContact O-N 3.49Å; V785-R787 VanDerWaalsContact C-N 3.33Å; V785-R787 PolarHBondContact O-N 2.94Å; R787-K789 VanDerWaalsContact C-N 3.31Å; R787-K789 PolarHBondContact O-N 2.76Å; R787-E790 WeakPolarHBondContact CD-OE2 3.31Å; R787-E790 IonicContact CZ-OE1 3.9Å; R787-E790 IonicContact CZ-OE2 2.88Å; R787-E790 IonicContact NE-OE2 2.81Å; R787-E790 IonicContact NH1-OE1 3.49Å; R787-E790 PolarHBondContact NH1-OE1 3.22Å; R787-E790 IonicContact NH1-OE2 2.69Å; R787-E790 PolarHBondContact NH1-OE2 2.81Å; R787-E790 PolarHBondContact O-N 3.36Å; R787-V791 HydrophobicContact CG-CG2 4.44Å; R787-V791 WeakPolarHBondContact O-CB 3.5Å; R787-V791 VanDerWaalsContact O-CG2 3.3Å; R787-V791 WeakPolarHBondContact O-CG2 3.49Å; R787-V791 PolarHBondContact O-N 2.85Å; R787-K802 PolarHBondContact NH2-O 3Å
788	G	84.9	Confident	81.9	Confident	40 Å²	40	80.5 Å²	80.5	41%	0.412	47%	0.471	S	S	.	.	H	α-helix	trans	-60.2	-41.5	175.4	0	0	0	0	0	112.2	L784 V785 V791 S792	L784-G788 PolarHBondContact O-N 3.2Å; V785-G788 PolarHBondContact O-N 3.48Å; V785-G788 VanDerWaalsContact O-N 3.15Å; G788-V791 PolarHBondContact O-N 3.37Å; G788-S792 WeakPolarHBondContact O-CB 3.37Å; G788-S792 PolarHBondContact O-N 2.77Å
789	K	83	Confident	81.8	Confident	117 Å²	117	82.9 Å²	82.9	51%	0.509	47%	0.466	S	S	.	.	H	α-helix	trans	-63.4	-48	175.2	-168.1	173.7	-177.8	175.3	0	111.5	V785 A786 R787 V791 S792 D793	V785-K789 PolarHBondContact O-N 3.21Å; A786-K789 PolarHBondContact O-N 3.1Å; R787-K789 VanDerWaalsContact C-N 3.31Å; R787-K789 PolarHBondContact O-N 2.76Å; K789-V791 PolarHBondContact O-N 3.48Å; K789-S792 WeakPolarHBondContact O-CB 3.4Å; K789-S792 PolarHBondContact O-N 2.56Å; K789-S792 VanDerWaalsContact O-N 3.15Å; K789-D793 PolarHBondContact O-N 3.08Å
790	E	82.9	Confident	81.6	Confident	71 Å²	71	84.6 Å²	84.6	33%	0.332	47%	0.466	S	S	.	.	H	α-helix	trans	-56.4	-48.1	175.4	-171.9	-160.1	158.3	0	0	111.7	A786 R787 S792 D793 L794	A786-E790 PolarHBondContact O-N 2.8Å; R787-E790 WeakPolarHBondContact CD-OE2 3.31Å; R787-E790 IonicContact CZ-OE1 3.9Å; R787-E790 IonicContact CZ-OE2 2.88Å; R787-E790 IonicContact NE-OE2 2.81Å; R787-E790 IonicContact NH1-OE1 3.49Å; R787-E790 PolarHBondContact NH1-OE1 3.22Å; R787-E790 IonicContact NH1-OE2 2.69Å; R787-E790 PolarHBondContact NH1-OE2 2.81Å; R787-E790 PolarHBondContact O-N 3.36Å; E790-S792 VanDerWaalsContact C-N 3.32Å; E790-S792 PolarHBondContact O-N 2.73Å; E790-D793 PolarHBondContact O-N 2.77Å; E790-L794 HydrophobicContact CG-CD1 4.19Å; E790-L794 VanDerWaalsContact O-CG 3.28Å; E790-L794 WeakPolarHBondContact O-CG 3.25Å; E790-L794 PolarHBondContact O-N 3.12Å
791	V	83.3	Confident	81.4	Confident	33 Å²	33	85.5 Å²	85.5	20%	0.2	47%	0.47	C	S	.	.	H	α-helix	trans	-62.6	-40.2	178.1	170.8	0	0	0	0	111.2	R787 G788 K789 D793 L794 I795 I801	R787-V791 HydrophobicContact CG-CG2 4.44Å; R787-V791 WeakPolarHBondContact O-CB 3.5Å; R787-V791 VanDerWaalsContact O-CG2 3.3Å; R787-V791 WeakPolarHBondContact O-CG2 3.49Å; R787-V791 PolarHBondContact O-N 2.85Å; G788-V791 PolarHBondContact O-N 3.37Å; K789-V791 PolarHBondContact O-N 3.48Å; V791-D793 VanDerWaalsContact C-N 3.35Å; V791-D793 PolarHBondContact O-N 3.45Å; V791-L794 PolarHBondContact O-N 3.01Å; V791-I795 HydrophobicContact CG1-CD1 3.75Å; V791-I795 HydrophobicContact CG1-CG1 4.33Å; V791-I795 VanDerWaalsContact O-CG1 3.25Å; V791-I795 WeakPolarHBondContact O-CG1 3.45Å; V791-I795 PolarHBondContact O-N 3.35Å; V791-I801 HydrophobicContact CG1-CD1 3.8Å; V791-I801 HydrophobicContact CG1-CG1 4.33Å; V791-I801 HydrophobicContact CG2-CG2 4.08Å
792	S	79.9	Confident	80.7	Confident	51 Å²	51	86.5 Å²	86.5	36%	0.357	47%	0.466	S	S	.	.	H	α-helix	trans	-61	-43.1	176.3	-168.2	0	0	0	0	112.1	G788 K789 E790 I795 R796	G788-S792 WeakPolarHBondContact O-CB 3.37Å; G788-S792 PolarHBondContact O-N 2.77Å; K789-S792 WeakPolarHBondContact O-CB 3.4Å; K789-S792 PolarHBondContact O-N 2.56Å; K789-S792 VanDerWaalsContact O-N 3.15Å; E790-S792 VanDerWaalsContact C-N 3.32Å; E790-S792 PolarHBondContact O-N 2.73Å; S792-I795 PolarHBondContact O-N 3.28Å; S792-R796 WeakPolarHBondContact O-CB 3.43Å; S792-R796 PolarHBondContact O-N 3.5Å
793	D	79.9	Confident	80	Confident	74 Å²	74	84.1 Å²	84.1	40%	0.396	46%	0.457	S	S	.	.	H	α-helix	trans	-69.1	-36.4	177.9	-68.2	-27.1	0	0	0	112	K789 E790 V791 R796 S797	K789-D793 PolarHBondContact O-N 3.08Å; E790-D793 PolarHBondContact O-N 2.77Å; V791-D793 VanDerWaalsContact C-N 3.35Å; V791-D793 PolarHBondContact O-N 3.45Å; D793-R796 PolarHBondContact O-N 2.95Å; D793-S797 WeakPolarHBondContact O-CB 3.33Å; D793-S797 PolarHBondContact O-N 2.79Å; D793-S797 PolarHBondContact O-OG 3.16Å
794	L	81.5	Confident	79.1	Confident	32 Å²	32	79.2 Å²	79.2	17%	0.168	44%	0.443	C	S	.	.	H	α-helix	trans	-65.2	-43.5	173.8	-71.1	172.1	0	0	0	111.8	E790 V791 S797 G798 K799 I801	E790-L794 HydrophobicContact CG-CD1 4.19Å; E790-L794 VanDerWaalsContact O-CG 3.28Å; E790-L794 WeakPolarHBondContact O-CG 3.25Å; E790-L794 PolarHBondContact O-N 3.12Å; V791-L794 PolarHBondContact O-N 3.01Å; L794-S797 WeakPolarHBondContact CA-OG 3.43Å; L794-S797 CarbonylContact O-C 3.45Å; L794-S797 PolarHBondContact O-N 3.09Å; L794-S797 PolarHBondContact O-OG 2.82Å; L794-G798 PolarHBondContact O-N 3.05Å; L794-K799 HydrophobicContact CD2-CB 3.73Å; L794-K799 HydrophobicContact CD2-CD 4.31Å; L794-K799 PolarHBondContact O-N 3.3Å; L794-I801 HydrophobicContact CB-CG1 4.49Å
795	I	78.5	Confident	77.9	Confident	115 Å²	115	82.5 Å²	82.5	59%	0.59	45%	0.453	S	S	*	.	H	α-helix	trans	-61.7	-44.9	174.5	-69.1	167.2	0	0	0	110.2	V791 S792 S797 G798 I801	V791-I795 HydrophobicContact CG1-CD1 3.75Å; V791-I795 HydrophobicContact CG1-CG1 4.33Å; V791-I795 VanDerWaalsContact O-CG1 3.25Å; V791-I795 WeakPolarHBondContact O-CG1 3.45Å; V791-I795 PolarHBondContact O-N 3.35Å; S792-I795 PolarHBondContact O-N 3.28Å; I795-S797 VanDerWaalsContact C-N 3.29Å; I795-S797 PolarHBondContact O-N 2.87Å; I795-G798 PolarHBondContact O-N 3.32Å; I795-I801 HydrophobicContact CD1-CD1 4.37Å; I795-I801 HydrophobicContact CG1-CD1 4.12Å
796	R	71.6	Confident	76.6	Confident	177 Å²	177	85.3 Å²	85.3	67%	0.668	47%	0.467	S	S	*	.	H	α-helix	trans	-63.7	-34.7	178.6	-167.7	-178.2	-58.1	162.2	8.3	112.7	S792 D793	S792-R796 WeakPolarHBondContact O-CB 3.43Å; S792-R796 PolarHBondContact O-N 3.5Å; D793-R796 PolarHBondContact O-N 2.95Å
797	S	76.1	Confident	75.4	Confident	64 Å²	64	84.8 Å²	84.8	45%	0.448	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	0.6	179	58.6	0	0	0	0	114.1	D793 L794 I795 K799	D793-S797 WeakPolarHBondContact O-CB 3.33Å; D793-S797 PolarHBondContact O-N 2.79Å; D793-S797 PolarHBondContact O-OG 3.16Å; L794-S797 WeakPolarHBondContact CA-OG 3.43Å; L794-S797 CarbonylContact O-C 3.45Å; L794-S797 PolarHBondContact O-N 3.09Å; L794-S797 PolarHBondContact O-OG 2.82Å; I795-S797 VanDerWaalsContact C-N 3.29Å; I795-S797 PolarHBondContact O-N 2.87Å; S797-K799 PolarHBondContact O-N 2.95Å
798	G	74.4	Confident	74.3	Confident	70 Å²	70	87.1 Å²	87.1	72%	0.722	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.7	20.5	-178.7	0	0	0	0	0	114	L794 I795	L794-G798 PolarHBondContact O-N 3.05Å; I795-G798 PolarHBondContact O-N 3.32Å
799	K	79	Confident	73.2	Confident	131 Å²	131	91.7 Å²	91.7	57%	0.57	48%	0.48	S	S	*	.			trans	-90.2	144.7	-178.4	-70	179.3	-177	174.7	0	110.7	L794 S797 I801	L794-K799 HydrophobicContact CD2-CB 3.73Å; L794-K799 HydrophobicContact CD2-CD 4.31Å; L794-K799 PolarHBondContact O-N 3.3Å; S797-K799 PolarHBondContact O-N 2.95Å; K799-I801 PolarHBondContact O-N 3.41Å
800	P	77.9	Confident	72.2	Confident	102 Å²	102	91.5 Å²	91.5	66%	0.662	48%	0.479	S	S	*	.			trans	-64.7	134.4	180	25.7	-33.2	0	0	0	111.2	K802	P800-K802 PolarHBondContact O-N 3.29Å
801	I	80.1	Confident	71.3	Confident	89 Å²	89	92.4 Å²	92.4	46%	0.456	49%	0.486	S	S	.	.			trans	-73.1	108.3	176.6	-59.1	164.8	0	0	0	108.2	V791 L794 I795 K799	V791-I801 HydrophobicContact CG1-CD1 3.8Å; V791-I801 HydrophobicContact CG1-CG1 4.33Å; V791-I801 HydrophobicContact CG2-CG2 4.08Å; L794-I801 HydrophobicContact CB-CG1 4.49Å; I795-I801 HydrophobicContact CD1-CD1 4.37Å; I795-I801 HydrophobicContact CG1-CD1 4.12Å; K799-I801 PolarHBondContact O-N 3.41Å
802	K	74	Confident	70.5	Confident	102 Å²	102	94 Å²	94	44%	0.443	49%	0.491	S	S	.	.			trans	-79.2	138.8	-180	-64.5	-175.8	-178.1	179.8	0	111	R787 P800 L807	R787-K802 PolarHBondContact NH2-O 3Å; P800-K802 PolarHBondContact O-N 3.29Å; K802-L807 HydrophobicContact CB-CG 4.44Å
803	P	70	Confident	69.8	Low	75 Å²	75	97.6 Å²	97.6	49%	0.487	50%	0.504	S	S	.	.			trans	-58.4	143.5	171.7	-21.2	31.6	0	0	0	111.6	K805 D806 L807	P803-K805 PolarHBondContact O-N 2.98Å; P803-K805 VanDerWaalsContact O-N 3.15Å; P803-D806 WeakPolarHBondContact CD-OD2 3.28Å; P803-D806 WeakPolarHBondContact CG-OD2 3.44Å; P803-D806 PolarHBondContact O-N 3.17Å; P803-L807 PolarHBondContact O-N 3.11Å
804	V	65.2	Low	69.4	Low	84 Å²	84	98.4 Å²	98.4	51%	0.509	51%	0.506	S	S	.	.	H	α-helix	trans	-57.4	-32.2	179.1	-178.9	0	0	0	0	111.8	D806 L807 L808	V804-D806 VanDerWaalsContact C-N 3.33Å; V804-D806 PolarHBondContact O-N 3.08Å; V804-L807 PolarHBondContact O-N 2.92Å; V804-L808 PolarHBondContact O-N 3.47Å
805	K	60.6	Low	68.7	Low	168 Å²	168	100.7 Å²	100.7	73%	0.73	52%	0.518	S	S	*	.	H	α-helix	trans	-65.7	-31	176.4	-69.3	-174.5	176.5	-178.1	0	113.5	P803 K809	P803-K805 PolarHBondContact O-N 2.98Å; P803-K805 VanDerWaalsContact O-N 3.15Å; K805-K809 WeakPolarHBondContact O-CG 3.19Å; K805-K809 PolarHBondContact O-N 3.36Å
806	D	58.7	Low	68.2	Low	80 Å²	80	97.2 Å²	97.2	43%	0.428	50%	0.503	S	S	.	.	H	α-helix	trans	-82	-28.5	-179.9	-65.7	-26	0	0	0	112	P803 V804 K810	P803-D806 WeakPolarHBondContact CD-OD2 3.28Å; P803-D806 WeakPolarHBondContact CG-OD2 3.44Å; P803-D806 PolarHBondContact O-N 3.17Å; V804-D806 VanDerWaalsContact C-N 3.33Å; V804-D806 PolarHBondContact O-N 3.08Å; D806-K810 WeakPolarHBondContact O-CB 3.14Å; D806-K810 PolarHBondContact O-N 3.34Å
807	L	59.4	Low	68.3	Low	53 Å²	53	94.6 Å²	94.6	28%	0.277	50%	0.498	S	S	.	.	H	α-helix	trans	-66.6	-42.3	170.9	-73.5	165.2	0	0	0	111.5	K802 P803 V804 K810 N811	K802-L807 HydrophobicContact CB-CG 4.44Å; P803-L807 PolarHBondContact O-N 3.11Å; V804-L807 PolarHBondContact O-N 2.92Å; L807-K810 PolarHBondContact O-N 3.3Å; L807-N811 PolarHBondContact O-N 2.81Å
808	L	60.5	Low	68.2	Low	102 Å²	102	95.1 Å²	95.1	53%	0.534	50%	0.499	S	S	.	.	H	α-helix	trans	-62.3	-45.4	174.5	-72.9	168.2	0	0	0	111.7	V804 K810 N811 Q812	V804-L808 PolarHBondContact O-N 3.47Å; L808-K810 VanDerWaalsContact C-N 3.32Å; L808-K810 PolarHBondContact O-N 3.48Å; L808-N811 PolarHBondContact O-N 2.85Å; L808-Q812 WeakPolarHBondContact O-CB 3.3Å; L808-Q812 VanDerWaalsContact O-CG 3.27Å; L808-Q812 WeakPolarHBondContact O-CG 3.37Å; L808-Q812 PolarHBondContact O-N 2.94Å
809	K	59.8	Low	68.2	Low	136 Å²	136	93.6 Å²	93.6	59%	0.591	47%	0.474	S	S	*	.	H	α-helix	trans	-61.9	-37.6	176	-77.7	-178.5	177.6	-178.4	0	113	K805 M813	K805-K809 WeakPolarHBondContact O-CG 3.19Å; K805-K809 PolarHBondContact O-N 3.36Å; K809-M813 WeakPolarHBondContact O-CB 3.28Å; K809-M813 PolarHBondContact O-N 2.86Å
810	K	63.2	Low	67.9	Low	112 Å²	112	91.2 Å²	91.2	49%	0.487	47%	0.471	S	S	.	.	H	α-helix	trans	-72.6	-41.8	179.8	-159.1	-176.1	177	-157.9	0	112	D806 L807 L808 Q812 M813 E814	D806-K810 WeakPolarHBondContact O-CB 3.14Å; D806-K810 PolarHBondContact O-N 3.34Å; L807-K810 PolarHBondContact O-N 3.3Å; L808-K810 VanDerWaalsContact C-N 3.32Å; L808-K810 PolarHBondContact O-N 3.48Å; K810-Q812 VanDerWaalsContact C-N 3.34Å; K810-M813 PolarHBondContact O-N 3.34Å; K810-E814 IonicContact NZ-OE1 3.86Å; K810-E814 PolarHBondContact O-N 3Å
811	N	64.5	Low	67.9	Low	91 Å²	91	90.7 Å²	90.7	49%	0.487	46%	0.462	S	S	.	.	H	α-helix	trans	-64.5	-39.4	172.8	-78.1	3.6	0	0	0	111.7	L807 L808 M813 E814 N815	L807-N811 PolarHBondContact O-N 2.81Å; L808-N811 PolarHBondContact O-N 2.85Å; N811-M813 VanDerWaalsContact C-N 3.34Å; N811-E814 PolarHBondContact O-N 3.22Å; N811-N815 VanDerWaalsContact O-CB 3.31Å; N811-N815 WeakPolarHBondContact O-CB 3.44Å; N811-N815 VanDerWaalsContact O-CG 3.29Å; N811-N815 PolarHBondContact O-N 3.35Å
812	Q	64.8	Low	67.5	Low	65 Å²	65	90.6 Å²	90.6	30%	0.304	46%	0.458	S	S	.	.	H	α-helix	trans	-61.9	-42.6	172.2	-77.1	178.9	-20.3	0	0	111.2	L808 K810 N815 C816 S849	L808-Q812 WeakPolarHBondContact O-CB 3.3Å; L808-Q812 VanDerWaalsContact O-CG 3.27Å; L808-Q812 WeakPolarHBondContact O-CG 3.37Å; L808-Q812 PolarHBondContact O-N 2.94Å; K810-Q812 VanDerWaalsContact C-N 3.34Å; Q812-N815 PolarHBondContact O-N 3.47Å; Q812-C816 WeakPolarHBondContact O-CB 3.46Å; Q812-C816 PolarHBondContact O-N 3.39Å; Q812-C816 PolarHBondContact O-SG 2.74Å; Q812-S849 PolarHBondContact NE2-O 2.96Å
813	M	65.8	Low	67.5	Low	127 Å²	127	91.1 Å²	91.1	63%	0.626	46%	0.461	S	S	*	.	H	α-helix	trans	-66.3	-43.1	177.4	-164.7	71.2	81.5	0	0	112.4	K809 K810 N811 C816 Q817	K809-M813 WeakPolarHBondContact O-CB 3.28Å; K809-M813 PolarHBondContact O-N 2.86Å; K810-M813 PolarHBondContact O-N 3.34Å; N811-M813 VanDerWaalsContact C-N 3.34Å; M813-C816 PolarHBondContact O-N 2.8Å; M813-Q817 VanDerWaalsContact O-CB 3.25Å; M813-Q817 WeakPolarHBondContact O-CB 3.46Å; M813-Q817 PolarHBondContact O-N 3.29Å
814	E	71.5	Confident	67.5	Low	92 Å²	92	94.6 Å²	94.6	43%	0.43	47%	0.473	S	S	.	.	H	α-helix	trans	-64.4	-41.2	175.3	-85.9	172.4	-169	0	0	111.5	K810 N811 Q817 T818	K810-E814 IonicContact NZ-OE1 3.86Å; K810-E814 PolarHBondContact O-N 3Å; N811-E814 PolarHBondContact O-N 3.22Å; E814-Q817 PolarHBondContact O-N 3.24Å; E814-T818 WeakPolarHBondContact O-CB 3.45Å; E814-T818 PolarHBondContact O-N 2.97Å; E814-T818 PolarHBondContact O-OG1 3.43Å
815	N	67.1	Low	67.9	Low	80 Å²	80	99.1 Å²	99.1	43%	0.428	49%	0.485	S	S	.	.	H	α-helix	trans	-63.4	-44.5	173.7	-77.2	-4.6	0	0	0	111.7	N811 Q812 Q817 T818 L819	N811-N815 VanDerWaalsContact O-CB 3.31Å; N811-N815 WeakPolarHBondContact O-CB 3.44Å; N811-N815 VanDerWaalsContact O-CG 3.29Å; N811-N815 PolarHBondContact O-N 3.35Å; Q812-N815 PolarHBondContact O-N 3.47Å; N815-Q817 VanDerWaalsContact C-N 3.32Å; N815-Q817 PolarHBondContact O-N 2.91Å; N815-T818 PolarHBondContact O-N 3.09Å; N815-L819 VanDerWaalsContact O-CB 3.3Å; N815-L819 WeakPolarHBondContact O-CB 3.4Å; N815-L819 PolarHBondContact O-N 2.8Å
816	C	68.1	Low	68.6	Low	42 Å²	42	93 Å²	93	28%	0.284	46%	0.46	S	S	.	.	H	α-helix	trans	-59.2	-43.7	173.4	-73.8	0	0	0	0	111.5	Q812 M813 L819 V820 I850	Q812-C816 WeakPolarHBondContact O-CB 3.46Å; Q812-C816 PolarHBondContact O-N 3.39Å; Q812-C816 PolarHBondContact O-SG 2.74Å; M813-C816 PolarHBondContact O-N 2.8Å; C816-L819 PolarHBondContact O-N 2.65Å; C816-V820 WeakPolarHBondContact O-CB 3.49Å; C816-V820 VanDerWaalsContact O-CG2 3.25Å; C816-V820 WeakPolarHBondContact O-CG2 3.37Å; C816-V820 PolarHBondContact O-N 3.42Å; C816-I850 WeakPolarHBondContact SG-CD1 3.33Å
817	Q	73.4	Confident	69	Low	121 Å²	121	94 Å²	94	57%	0.565	47%	0.466	S	S	*	.	H	α-helix	trans	-68.5	-40.8	-177.9	-159.8	166.9	13.5	0	0	111.5	M813 E814 N815 L819 V820 D821	M813-Q817 VanDerWaalsContact O-CB 3.25Å; M813-Q817 WeakPolarHBondContact O-CB 3.46Å; M813-Q817 PolarHBondContact O-N 3.29Å; E814-Q817 PolarHBondContact O-N 3.24Å; N815-Q817 VanDerWaalsContact C-N 3.32Å; N815-Q817 PolarHBondContact O-N 2.91Å; Q817-L819 VanDerWaalsContact C-N 3.32Å; Q817-L819 PolarHBondContact O-N 3.08Å; Q817-V820 PolarHBondContact O-N 3.27Å; Q817-D821 WeakPolarHBondContact O-CB 3.31Å; Q817-D821 PolarHBondContact O-N 3.38Å
818	T	74.1	Confident	69.4	Low	75 Å²	75	97.7 Å²	97.7	46%	0.46	49%	0.485	S	S	.	.	H	α-helix	trans	-65.1	-37	174.9	-45.4	0	0	0	0	111.6	E814 N815 D821 K822	E814-T818 WeakPolarHBondContact O-CB 3.45Å; E814-T818 PolarHBondContact O-N 2.97Å; E814-T818 PolarHBondContact O-OG1 3.43Å; N815-T818 PolarHBondContact O-N 3.09Å; T818-D821 PolarHBondContact O-N 3.02Å; T818-K822 WeakPolarHBondContact O-CB 3.46Å; T818-K822 WeakPolarHBondContact O-CG 3.46Å; T818-K822 PolarHBondContact O-N 3.06Å
819	L	73.6	Confident	69.5	Low	39 Å²	39	101.4 Å²	101.4	20%	0.204	50%	0.5	C	S	.	.	H	α-helix	trans	-69.5	-41.2	176.4	-168.1	133.9	0	0	0	111.9	N815 C816 Q817 K822 F823 E842 V843 A846	N815-L819 VanDerWaalsContact O-CB 3.3Å; N815-L819 WeakPolarHBondContact O-CB 3.4Å; N815-L819 PolarHBondContact O-N 2.8Å; C816-L819 PolarHBondContact O-N 2.65Å; Q817-L819 VanDerWaalsContact C-N 3.32Å; Q817-L819 PolarHBondContact O-N 3.08Å; L819-K822 PolarHBondContact O-N 3.5Å; L819-F823 WeakPolarHBondContact O-CB 3.39Å; L819-F823 PolarHBondContact O-N 3.47Å; L819-E842 VanDerWaalsContact CD1-O 3.31Å; L819-E842 WeakPolarHBondContact CD1-O 3.46Å; L819-V843 HydrophobicContact CD1-CG2 4.5Å; L819-A846 HydrophobicContact CD1-CB 3.31Å
820	V	74.3	Confident	70	Confident	81 Å²	81	98.5 Å²	98.5	49%	0.491	49%	0.49	S	S	.	.	H	α-helix	trans	-63.1	-43.6	172.9	170.5	0	0	0	0	110.7	C816 Q817 K822 F823 M824	C816-V820 WeakPolarHBondContact O-CB 3.49Å; C816-V820 VanDerWaalsContact O-CG2 3.25Å; C816-V820 WeakPolarHBondContact O-CG2 3.37Å; C816-V820 PolarHBondContact O-N 3.42Å; Q817-V820 PolarHBondContact O-N 3.27Å; V820-K822 PolarHBondContact O-N 2.96Å; V820-F823 WeakPolarHBondContact O-CB 3.13Å; V820-F823 PolarHBondContact O-N 2.85Å; V820-M824 HydrophobicContact CG1-CG 4.27Å; V820-M824 WeakPolarHBondContact O-CB 3.37Å; V820-M824 VanDerWaalsContact O-CG 3.23Å; V820-M824 WeakPolarHBondContact O-CG 3.39Å; V820-M824 PolarHBondContact O-N 3.2Å
821	D	76.2	Confident	69.8	Low	90 Å²	90	99 Å²	99	48%	0.481	51%	0.506	S	S	.	.	H	α-helix	trans	-65.4	-37.6	177.3	-78.8	-14.8	0	0	0	112.7	Q817 T818 K825	Q817-D821 WeakPolarHBondContact O-CB 3.31Å; Q817-D821 PolarHBondContact O-N 3.38Å; T818-D821 PolarHBondContact O-N 3.02Å; D821-K825 WeakPolarHBondContact O-CG 3.23Å; D821-K825 PolarHBondContact O-N 2.86Å
822	K	73.1	Confident	69.8	Low	87 Å²	87	101.7 Å²	101.7	38%	0.378	52%	0.52	S	S	.	.	H	α-helix	trans	-65.6	-41.4	172	-81	-174	179.9	-174.2	0	111.5	T818 L819 V820 K825 F838 E842	T818-K822 WeakPolarHBondContact O-CB 3.46Å; T818-K822 WeakPolarHBondContact O-CG 3.46Å; T818-K822 PolarHBondContact O-N 3.06Å; L819-K822 PolarHBondContact O-N 3.5Å; V820-K822 PolarHBondContact O-N 2.96Å; K822-K825 PolarHBondContact O-N 3.17Å; K822-F838 HydrophobicContact CB-CE2 4.49Å; K822-E842 IonicContact NZ-OE1 2.75Å; K822-E842 PolarHBondContact NZ-OE1 2.95Å; K822-E842 IonicContact NZ-OE2 3.56Å; K822-E842 PolarHBondContact NZ-OE2 2.66Å
823	F	73.1	Confident	69.8	Low	114 Å²	114	101.1 Å²	101.1	50%	0.5	52%	0.519	S	S	.	.	H	α-helix	trans	-64.3	-42.7	177.3	-175.8	-97.9	0	0	0	112	L819 V820 K825 L826 F838	L819-F823 WeakPolarHBondContact O-CB 3.39Å; L819-F823 PolarHBondContact O-N 3.47Å; V820-F823 WeakPolarHBondContact O-CB 3.13Å; V820-F823 PolarHBondContact O-N 2.85Å; F823-K825 PolarHBondContact O-N 3.49Å; F823-L826 HydrophobicContact CD2-CD1 3.87Å; F823-L826 HydrophobicContact CE2-CD1 4.41Å; F823-L826 HydrophobicContact CG-CD1 4.49Å; F823-L826 WeakPolarHBondContact O-CB 3.28Å; F823-L826 PolarHBondContact O-N 3.1Å; F823-L826 VanDerWaalsContact O-N 3.16Å; F823-F838 HydrophobicContact CB-CZ 4.47Å; F823-F838 AromaticContact CD2-CE1 3.97Å; F823-F838 HydrophobicContact CD2-CE1 3.97Å; F823-F838 HydrophobicContact CD2-CZ 4.49Å
824	M	71.1	Confident	70	Confident	148 Å²	148	99.2 Å²	99.2	73%	0.729	51%	0.511	S	S	*	.	H	α-helix	trans	-68.1	-16.5	178.5	-70.2	-65.5	-67.2	0	0	113.9	V820	V820-M824 HydrophobicContact CG1-CG 4.27Å; V820-M824 WeakPolarHBondContact O-CB 3.37Å; V820-M824 VanDerWaalsContact O-CG 3.23Å; V820-M824 WeakPolarHBondContact O-CG 3.39Å; V820-M824 PolarHBondContact O-N 3.2Å
825	K	74.1	Confident	69.7	Low	179 Å²	179	99.1 Å²	99.1	78%	0.778	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-1.6	175.6	-74	175.9	-176.3	174.8	0	113.6	D821 K822 F823 D827	D821-K825 WeakPolarHBondContact O-CG 3.23Å; D821-K825 PolarHBondContact O-N 2.86Å; K822-K825 PolarHBondContact O-N 3.17Å; F823-K825 PolarHBondContact O-N 3.49Å; K825-D827 PolarHBondContact O-N 3.03Å
826	L	73.4	Confident	69.6	Low	38 Å²	38	101.3 Å²	101.3	20%	0.199	52%	0.524	C	S	.	.			trans	-72.1	123.2	174.1	-73	163.1	0	0	0	109.5	F823 L833 F838	F823-L826 HydrophobicContact CD2-CD1 3.87Å; F823-L826 HydrophobicContact CE2-CD1 4.41Å; F823-L826 HydrophobicContact CG-CD1 4.49Å; F823-L826 WeakPolarHBondContact O-CB 3.28Å; F823-L826 PolarHBondContact O-N 3.1Å; F823-L826 VanDerWaalsContact O-N 3.16Å; L826-L833 HydrophobicContact CD2-CD1 3.67Å; L826-L833 HydrophobicContact CD2-CD2 4.15Å; L826-L833 HydrophobicContact CD2-CG 4.39Å; L826-F838 HydrophobicContact CD1-CD1 3.84Å; L826-F838 HydrophobicContact CD1-CD2 4.08Å; L826-F838 HydrophobicContact CD1-CE1 3.66Å; L826-F838 HydrophobicContact CD1-CE2 3.89Å; L826-F838 HydrophobicContact CD1-CG 4.05Å; L826-F838 HydrophobicContact CD1-CZ 3.68Å; L826-F838 HydrophobicContact CD2-CD2 4.07Å; L826-F838 HydrophobicContact CD2-CE2 4.31Å; L826-F838 HydrophobicContact CD2-CG 4.42Å; L826-F838 HydrophobicContact CG-CE2 4.35Å
827	D	69	Low	69.7	Low	102 Å²	102	102.2 Å²	102.2	55%	0.545	53%	0.529	S	S	.	.			trans	-89	106.6	171.3	-169.3	-6.9	0	0	0	109.2	K825 E829 D830	K825-D827 PolarHBondContact O-N 3.03Å; D827-E829 PolarHBondContact O-N 2.93Å; D827-E829 PolarHBondContact OD1-N 2.82Å; D827-D830 PolarHBondContact O-N 2.81Å
828	L	66.8	Low	69.5	Low	131 Å²	131	98 Å²	98	69%	0.686	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-6	-176	-66.4	169.9	0	0	0	113.1	L833 L835	L828-L833 HydrophobicContact CD2-CD2 4.29Å; L828-L835 HydrophobicContact CD2-CD1 4.38Å
829	E	62.3	Low	69.2	Low	179 Å²	179	99.1 Å²	99.1	84%	0.836	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.2	-3.9	176.7	-60.3	-168.7	170.2	0	0	113.1	D827 P831	D827-E829 PolarHBondContact O-N 2.93Å; D827-E829 PolarHBondContact OD1-N 2.82Å; E829-P831 WeakPolarHBondContact O-CD 3.11Å
830	D	70.3	Confident	68.9	Low	75 Å²	75	100 Å²	100	40%	0.401	52%	0.519	S	S	.	.			trans	-75.1	116.9	176	-174.1	-7.8	0	0	0	111.3	D827 N832 L833	D827-D830 PolarHBondContact O-N 2.81Å; D830-N832 PolarHBondContact O-N 3.01Å; D830-N832 VanDerWaalsContact O-N 3.14Å; D830-N832 PolarHBondContact OD1-N 3.47Å; D830-L833 HydrophobicContact CB-CB 4.33Å; D830-L833 WeakPolarHBondContact O-CB 3.44Å; D830-L833 PolarHBondContact O-N 3.27Å; D830-L833 VanDerWaalsContact O-N 3.14Å
831	P	59.9	Low	68.5	Low	124 Å²	124	102.8 Å²	102.8	81%	0.805	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-9	-179.2	27.4	-34.5	0	0	0	114.5	E829	E829-P831 WeakPolarHBondContact O-CD 3.11Å
832	N	63.9	Low	68.1	Low	146 Å²	146	102 Å²	102	78%	0.781	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.1	2.1	174.8	-68.8	-36.7	0	0	0	113.7	D830 D834	D830-N832 PolarHBondContact O-N 3.01Å; D830-N832 VanDerWaalsContact O-N 3.14Å; D830-N832 PolarHBondContact OD1-N 3.47Å; N832-D834 PolarHBondContact O-N 2.74Å
833	L	64	Low	67.7	Low	54 Å²	54	99.7 Å²	99.7	28%	0.283	51%	0.513	S	S	.	.			trans	-78.5	104.7	-178	-163.5	82.3	0	0	0	111.6	L826 L828 D830 L835	L826-L833 HydrophobicContact CD2-CD1 3.67Å; L826-L833 HydrophobicContact CD2-CD2 4.15Å; L826-L833 HydrophobicContact CD2-CG 4.39Å; L828-L833 HydrophobicContact CD2-CD2 4.29Å; D830-L833 HydrophobicContact CB-CB 4.33Å; D830-L833 WeakPolarHBondContact O-CB 3.44Å; D830-L833 PolarHBondContact O-N 3.27Å; D830-L833 VanDerWaalsContact O-N 3.14Å; L833-L835 HydrophobicContact CD2-CD1 3.98Å; L833-L835 PolarHBondContact O-N 3.25Å
834	D	70.1	Confident	67.3	Low	87 Å²	87	99.7 Å²	99.7	47%	0.465	52%	0.518	S	S	.	.			trans	-89	98.4	171.8	-167.8	-15.9	0	0	0	111	N832 N836 V837 F838	N832-D834 PolarHBondContact O-N 2.74Å; D834-N836 PolarHBondContact O-N 2.81Å; D834-N836 WeakPolarHBondContact OD1-CB 3.45Å; D834-N836 PolarHBondContact OD1-N 2.93Å; D834-V837 HydrophobicContact CB-CB 4.19Å; D834-V837 HydrophobicContact CB-CG2 3.95Å; D834-V837 PolarHBondContact O-N 2.87Å; D834-V837 VanDerWaalsContact O-N 3.12Å; D834-V837 WeakPolarHBondContact OD2-CG2 3.19Å; D834-F838 PolarHBondContact O-N 3.25Å
835	L	66	Low	67	Low	90 Å²	90	96 Å²	96	47%	0.471	51%	0.505	S	S	.	.	H	α-helix	trans	-57.9	-28.6	177	-92.5	95.6	0	0	0	113	L828 L833 V837 F838 M839	L828-L835 HydrophobicContact CD2-CD1 4.38Å; L833-L835 HydrophobicContact CD2-CD1 3.98Å; L833-L835 PolarHBondContact O-N 3.25Å; L835-V837 VanDerWaalsContact C-N 3.33Å; L835-F838 PolarHBondContact O-N 3.43Å; L835-M839 WeakPolarHBondContact O-CB 3.45Å; L835-M839 WeakPolarHBondContact O-CG 3.48Å; L835-M839 PolarHBondContact O-N 2.94Å
836	N	64.5	Low	66.2	Low	125 Å²	125	88.3 Å²	88.3	67%	0.668	48%	0.475	S	S	*	.	H	α-helix	trans	-71.9	-32.1	179.7	-65.2	-49.6	0	0	0	111.6	D834 S840	D834-N836 PolarHBondContact O-N 2.81Å; D834-N836 WeakPolarHBondContact OD1-CB 3.45Å; D834-N836 PolarHBondContact OD1-N 2.93Å; N836-S840 VanDerWaalsContact O-CB 3.3Å; N836-S840 WeakPolarHBondContact O-CB 3.38Å; N836-S840 PolarHBondContact O-N 2.64Å; N836-S840 PolarHBondContact O-OG 2.9Å
837	V	70.1	Confident	65.4	Low	61 Å²	61	88.1 Å²	88.1	37%	0.37	48%	0.479	S	S	.	.	H	α-helix	trans	-71.2	-43.3	174.8	176.6	0	0	0	0	110.5	D834 L835 S840 Q841	D834-V837 HydrophobicContact CB-CB 4.19Å; D834-V837 HydrophobicContact CB-CG2 3.95Å; D834-V837 PolarHBondContact O-N 2.87Å; D834-V837 VanDerWaalsContact O-N 3.12Å; D834-V837 WeakPolarHBondContact OD2-CG2 3.19Å; L835-V837 VanDerWaalsContact C-N 3.33Å; V837-S840 WeakPolarHBondContact CA-OG 3.25Å; V837-S840 PolarHBondContact O-N 3.44Å; V837-S840 PolarHBondContact O-OG 2.85Å; V837-S840 VanDerWaalsContact O-OG 3.12Å; V837-Q841 HydrophobicContact CG1-CG 4.28Å; V837-Q841 WeakPolarHBondContact O-CB 3.38Å; V837-Q841 WeakPolarHBondContact O-CG 3.49Å; V837-Q841 PolarHBondContact O-N 3.47Å
838	F	70	Confident	64.8	Low	33 Å²	33	88.6 Å²	88.6	15%	0.145	49%	0.486	C	S	.	.	H	α-helix	trans	-61.6	-46.2	174.7	-179.5	-94.9	0	0	0	112.1	K822 F823 L826 D834 L835 S840 E842 V843	K822-F838 HydrophobicContact CB-CE2 4.49Å; F823-F838 HydrophobicContact CB-CZ 4.47Å; F823-F838 AromaticContact CD2-CE1 3.97Å; F823-F838 HydrophobicContact CD2-CE1 3.97Å; F823-F838 HydrophobicContact CD2-CZ 4.49Å; L826-F838 HydrophobicContact CD1-CD1 3.84Å; L826-F838 HydrophobicContact CD1-CD2 4.08Å; L826-F838 HydrophobicContact CD1-CE1 3.66Å; L826-F838 HydrophobicContact CD1-CE2 3.89Å; L826-F838 HydrophobicContact CD1-CG 4.05Å; L826-F838 HydrophobicContact CD1-CZ 3.68Å; L826-F838 HydrophobicContact CD2-CD2 4.07Å; L826-F838 HydrophobicContact CD2-CE2 4.31Å; L826-F838 HydrophobicContact CD2-CG 4.42Å; L826-F838 HydrophobicContact CG-CE2 4.35Å; D834-F838 PolarHBondContact O-N 3.25Å; L835-F838 PolarHBondContact O-N 3.43Å; F838-S840 VanDerWaalsContact C-N 3.31Å; F838-S840 PolarHBondContact O-N 3.42Å; F838-E842 HydrophobicContact CD2-CB 4.2Å; F838-E842 HydrophobicContact CD2-CG 4.1Å; F838-E842 HydrophobicContact CE2-CB 4.01Å; F838-E842 HydrophobicContact CE2-CG 4.07Å; F838-E842 HydrophobicContact CZ-CB 4.29Å; F838-E842 WeakPolarHBondContact O-CB 3.21Å; F838-E842 PolarHBondContact O-N 2.95Å; F838-V843 HydrophobicContact CD1-CG2 4.2Å; F838-V843 HydrophobicContact CE1-CG2 3.81Å
839	M	66.6	Low	64	Low	99 Å²	99	84.7 Å²	84.7	49%	0.488	47%	0.469	S	S	.	.	I	π-helix	trans	-64	-35.9	178.7	-68.9	-69.4	-83.8	0	0	112.3	L835 V843 L844	L835-M839 WeakPolarHBondContact O-CB 3.45Å; L835-M839 WeakPolarHBondContact O-CG 3.48Å; L835-M839 PolarHBondContact O-N 2.94Å; M839-V843 WeakPolarHBondContact O-CB 3.48Å; M839-V843 PolarHBondContact O-N 2.97Å; M839-V843 HydrophobicContact SD-CB 4.24Å; M839-V843 HydrophobicContact SD-CG1 4.45Å; M839-V843 HydrophobicContact SD-CG2 3.84Å; M839-L844 PolarHBondContact O-N 2.74Å; M839-L844 VanDerWaalsContact O-N 3.09Å
840	S	67.6	Low	63.5	Low	58 Å²	58	79.3 Å²	79.3	41%	0.406	45%	0.446	S	S	.	.	I	π-helix	trans	-80.3	-34.5	-179.5	58.9	0	0	0	0	114.5	N836 V837 F838	N836-S840 VanDerWaalsContact O-CB 3.3Å; N836-S840 WeakPolarHBondContact O-CB 3.38Å; N836-S840 PolarHBondContact O-N 2.64Å; N836-S840 PolarHBondContact O-OG 2.9Å; V837-S840 WeakPolarHBondContact CA-OG 3.25Å; V837-S840 PolarHBondContact O-N 3.44Å; V837-S840 PolarHBondContact O-OG 2.85Å; V837-S840 VanDerWaalsContact O-OG 3.12Å; F838-S840 VanDerWaalsContact C-N 3.31Å; F838-S840 PolarHBondContact O-N 3.42Å
841	Q	67.6	Low	62.1	Low	138 Å²	138	85.2 Å²	85.2	65%	0.645	48%	0.476	S	S	*	.	I	π-helix	trans	-95	-27.6	-175.3	-66.3	-173.1	-8.5	0	0	114.3	V837 P845	V837-Q841 HydrophobicContact CG1-CG 4.28Å; V837-Q841 WeakPolarHBondContact O-CB 3.38Å; V837-Q841 WeakPolarHBondContact O-CG 3.49Å; V837-Q841 PolarHBondContact O-N 3.47Å; Q841-P845 WeakPolarHBondContact O-CG 3.3Å
842	E	66.6	Low	62.2	Low	73 Å²	73	83.3 Å²	83.3	34%	0.341	46%	0.46	S	S	.	.	I	π-helix	trans	-112	-36.9	-175.1	-67.2	-79.2	-179.6	0	0	112	L819 K822 F838 A846	L819-E842 VanDerWaalsContact CD1-O 3.31Å; L819-E842 WeakPolarHBondContact CD1-O 3.46Å; K822-E842 IonicContact NZ-OE1 2.75Å; K822-E842 PolarHBondContact NZ-OE1 2.95Å; K822-E842 IonicContact NZ-OE2 3.56Å; K822-E842 PolarHBondContact NZ-OE2 2.66Å; F838-E842 HydrophobicContact CD2-CB 4.2Å; F838-E842 HydrophobicContact CD2-CG 4.1Å; F838-E842 HydrophobicContact CE2-CB 4.01Å; F838-E842 HydrophobicContact CE2-CG 4.07Å; F838-E842 HydrophobicContact CZ-CB 4.29Å; F838-E842 WeakPolarHBondContact O-CB 3.21Å; F838-E842 PolarHBondContact O-N 2.95Å; E842-A846 WeakPolarHBondContact O-CB 3.46Å
843	V	64.9	Low	62.1	Low	39 Å²	39	80 Å²	80	24%	0.236	44%	0.443	C	S	.	.	I	π-helix	trans	-89.4	-46.6	-174.1	-175.2	0	0	0	0	113.4	L819 F838 M839 A846 A847	L819-V843 HydrophobicContact CD1-CG2 4.5Å; F838-V843 HydrophobicContact CD1-CG2 4.2Å; F838-V843 HydrophobicContact CE1-CG2 3.81Å; M839-V843 WeakPolarHBondContact O-CB 3.48Å; M839-V843 PolarHBondContact O-N 2.97Å; M839-V843 HydrophobicContact SD-CB 4.24Å; M839-V843 HydrophobicContact SD-CG1 4.45Å; M839-V843 HydrophobicContact SD-CG2 3.84Å; V843-A846 PolarHBondContact O-N 2.97Å; V843-A847 WeakPolarHBondContact O-CB 3.48Å; V843-A847 PolarHBondContact O-N 2.9Å
844	L	64.3	Low	62	Low	114 Å²	114	81.4 Å²	81.4	60%	0.597	45%	0.452	S	S	*	.	H	α-helix	trans	-61.2	-40.8	178.4	-75.3	173.2	0	0	0	114.2	M839 T848	M839-L844 PolarHBondContact O-N 2.74Å; M839-L844 VanDerWaalsContact O-N 3.09Å; L844-T848 PolarHBondContact O-N 3.32Å; L844-T848 PolarHBondContact O-OG1 3.35Å
845	P	64.4	Low	61.6	Low	71 Å²	71	81.1 Å²	81.1	46%	0.461	45%	0.451	S	S	.	.	H	α-helix	trans	-71.1	-32.5	177.1	-21.2	36.2	0	0	0	113	Q841 T848	Q841-P845 WeakPolarHBondContact O-CG 3.3Å; P845-T848 WeakPolarHBondContact CA-OG1 3.13Å; P845-T848 PolarHBondContact O-OG1 3.39Å
846	A	58.4	Low	61.3	Low	17 Å²	17	80.6 Å²	80.6	14%	0.14	45%	0.45	C	S	.	.	H	α-helix	trans	-71.4	-40.7	174.9	0	0	0	0	0	111.4	L819 E842 V843 T848 S849 I850	L819-A846 HydrophobicContact CD1-CB 3.31Å; E842-A846 WeakPolarHBondContact O-CB 3.46Å; V843-A846 PolarHBondContact O-N 2.97Å; A846-T848 VanDerWaalsContact C-N 3.3Å; A846-T848 PolarHBondContact O-N 3.44Å; A846-S849 PolarHBondContact O-N 3.25Å; A846-S849 PolarHBondContact O-OG 2.84Å; A846-I850 HydrophobicContact CB-CD1 4.34Å; A846-I850 VanDerWaalsContact O-CD1 3.29Å; A846-I850 WeakPolarHBondContact O-CD1 3.46Å; A846-I850 VanDerWaalsContact O-CG1 3.26Å; A846-I850 WeakPolarHBondContact O-CG1 3.49Å; A846-I850 PolarHBondContact O-N 2.89Å
847	A	55.8	Low	61.1	Low	35 Å²	35	77.6 Å²	77.6	29%	0.289	44%	0.435	S	S	.	.	H	α-helix	trans	-60.7	-36.2	178.1	0	0	0	0	0	112.9	V843 S849 I850 L851	V843-A847 WeakPolarHBondContact O-CB 3.48Å; V843-A847 PolarHBondContact O-N 2.9Å; A847-S849 PolarHBondContact O-N 3.45Å; A847-I850 PolarHBondContact O-N 2.83Å; A847-L851 WeakPolarHBondContact O-CB 3.02Å; A847-L851 PolarHBondContact O-N 3.13Å
848	T	56	Low	60.4	Low	111 Å²	111	78.8 Å²	78.8	68%	0.681	44%	0.44	S	S	*	.	H	α-helix	trans	-72.4	-12.3	175.1	30	0	0	0	0	114.2	L844 P845 A846	L844-T848 PolarHBondContact O-N 3.32Å; L844-T848 PolarHBondContact O-OG1 3.35Å; P845-T848 WeakPolarHBondContact CA-OG1 3.13Å; P845-T848 PolarHBondContact O-OG1 3.39Å; A846-T848 VanDerWaalsContact C-N 3.3Å; A846-T848 PolarHBondContact O-N 3.44Å
849	S	50.8	Low	59.7	Low	50 Å²	50	82.3 Å²	82.3	35%	0.35	46%	0.463	S	S	.	.	H	α-helix	trans	-96.9	-15.9	172.6	79.9	0	0	0	0	113.6	Q812 A846 A847	Q812-S849 PolarHBondContact NE2-O 2.96Å; A846-S849 PolarHBondContact O-N 3.25Å; A846-S849 PolarHBondContact O-OG 2.84Å; A847-S849 PolarHBondContact O-N 3.45Å
850	I	50.9	Low	59.1	Low	65 Å²	65	80.9 Å²	80.9	33%	0.333	46%	0.461	S	S	.	.	H	α-helix	trans	-103.2	-38.5	-174	-64.6	160	0	0	0	111.4	C816 A846 A847	C816-I850 WeakPolarHBondContact SG-CD1 3.33Å; A846-I850 HydrophobicContact CB-CD1 4.34Å; A846-I850 VanDerWaalsContact O-CD1 3.29Å; A846-I850 WeakPolarHBondContact O-CD1 3.46Å; A846-I850 VanDerWaalsContact O-CG1 3.26Å; A846-I850 WeakPolarHBondContact O-CG1 3.49Å; A846-I850 PolarHBondContact O-N 2.89Å; A847-I850 PolarHBondContact O-N 2.83Å
851	L	42.3	Very low	58.4	Low	200 Å²	200	83 Å²	83	100%	1.047	47%	0.466	S	S	*	.			trans	-84.7	0	170.2	-73.2	159.3	0	0	0	110.7	A847	A847-L851 WeakPolarHBondContact O-CB 3.02Å; A847-L851 PolarHBondContact O-N 3.13Å

Retrieved 851 of 851 residues in 2660.2 ms (Link to these results)

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