A0A5K4FAK0_SCHMA Loading...

Clu domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FAK0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,407 aa.

						>A0A5K4FAK0_SCHMA|A0A5K4FAK0
MVDIESNETGDDKVIAVANGDSSKGDSPTKPEDVQDETPYTVKIIPTHSDPFELQVSSFELVQEIHRVLMDREETCSCTCFSLVLNGQTLDMFAELKSVDGLADGVELKVVEERYSVREAKNHVRHIHDLLHSIEPYDAYAGREQMSLSFVNSVAGELERKHFPTRLDMRIDFIPPDYVMPGFGANTNLPLLPLHPLDRDGKPVKCVRQLNYSNWNPPPPARRLLGDLIYLFFHTLEDKKYHITACPRGFYVNMSTDDQFNPHPIQHAYVAHSLIDLLRQLSPGFKRNFESLLKNRAAKHPFERVPTPYQVHSWLAPLVEHSPDSVRKEEAFSSRMACEENLPGQTRDWNEELQVTRELPQTRLTERLLRDRAIFKSNSDFVAAATRAAVSVVNGDIMAINPGETRKQQMFIWNNMFFSLGFDVKDHYKHFGGEYAAYAATSSDLCGVRAYSMLDQPGLYTLGTAIIDYRGFRVTAQTIIPGILEKEQEQLVVYGSIDFGKTVLTDKRYEELLSKTAKQLKIKPHKVVNHSGDTIQLYSSVDCKGIVGNDNRTYILDLLRTFPPDLNYLDNGSDIRPQLSPELVKLGYPYQHRHMLATLRQELIEAFFDHRYEIFLRLTALEIQKSKSSKGECDDQDTTGVQNKQANCSSTNDDPLSPKNSLVTTKHQIDHHDVTGHSSNALNSGIGTIKSPSKNQSDDLTLMKKLLEDDQDTQKNDVIREAIRKAAEAVGSQSTDRFELTFNPDIYQKFVKFCDSEEQSLTVDQELVCSACEFLVLKQIPAFVRDALSLCITPQDGRALIELMHQRGINVRYLNRVIESVSIHQSLGYLKKMAICEVLLRSAKHLFKTYLQDVDPMLLSVGVAHFLNCFLTACPNLTPLLGIDEQVLKLNRNKKNKKKLKNLRESPEEMAWLNETHSSLWSEMIKEAKEYYHYQITASDIDEFCKSYEVQRIQLLRTFCTSVGIQLLLREYNLNLPNGVKHHQKPVFNTEDIISLYPIVKHLHPHATDAYHYFTTGQARISAGHLQEGFELINEALSLLNGVYGPLHPDIGACNRLLARLSYVMGEHEAAILFQHRATMISERVHGIDNPNTATEYIHFSLYVFACGHISTALQLLYRARYIALLCHGECHPEITQIDTNIGLMLQLVGELDLALIFFENALSLIKLFYGERNLKEAFTCHLISLTYTYRGDFRTALDYEKRRFLIYKERLGPDSDYTKDSDECLRQLTQQAVTIARKVAELTTTASATKSIGSGDSSSSSSHLNSHLITNHISISESLVAKAVLSNAFGGGVSGNASTTGGSSGSLTLPMPTVSSVLETLNRVNGILVIQIRGKDDNQHSHEEDKNLSTNKSDLTEPHVVICDKIRQSKNDIHLLSPSSSDNKSPRSFPTSLNNNDVNKPVIPVL
					

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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	26.2	Very low	26.9	Very low	147 Å²	147	115.8 Å²	115.8	72%	0.724	66%	0.658	S	S	*	*				0	76.3	0	-62.3	-171.3	-170	0	0	112.1	D3 K376	M1-D3 VanDerWaalsContact CA-OD1 3.24Å; M1-D3 WeakPolarHBondContact CA-OD1 3.47Å; M1-K376 PolarHBondContact O-NZ 2.95Å
2	V	25	Very low	26.9	Very low	59 Å²	59	119.1 Å²	119.1	36%	0.358	67%	0.672	S	S	.	*				-128.3	135.6	100.8	73.7	0	0	0	0	102.4	K376	V2-K376 HydrophobicContact CG1-CD 4.45Å
3	D	30.7	Very low	26.7	Very low	40 Å²	40	124.2 Å²	124.2	21%	0.214	68%	0.682	C	S	.	*			trans	-115.1	126.8	-168.7	-51.7	-17.4	0	0	0	105.6	M1 N341 L342	M1-D3 VanDerWaalsContact CA-OD1 3.24Å; M1-D3 WeakPolarHBondContact CA-OD1 3.47Å; D3-N341 PolarHBondContact OD2-ND2 2.72Å; D3-L342 HydrophobicContact CB-CD1 4.28Å
4	I	27.6	Very low	26.9	Very low	159 Å²	159	125.4 Å²	125.4	82%	0.815	70%	0.695	S	S	*	*			trans	-99.1	90.9	-177.5	-58.4	177.7	0	0	0	107.7	S6	I4-S6 PolarHBondContact O-N 3.31Å
5	E	27.7	Very low	26.9	Very low	73 Å²	73	126.7 Å²	126.7	34%	0.341	70%	0.698	S	S	.	*			trans	-80.2	95.3	175.2	-73.2	-168.8	145.2	0	0	111	N7	E5-N7 PolarHBondContact O-N 3.16Å
6	S	28.3	Very low	27	Very low	90 Å²	90	124.3 Å²	124.3	63%	0.629	70%	0.7	S	S	*	*			trans	-81.4	100.5	165.6	57.8	0	0	0	0	110.6	I4 E8	I4-S6 PolarHBondContact O-N 3.31Å; S6-E8 PolarHBondContact O-N 3.31Å
7	N	28.6	Very low	26.9	Very low	146 Å²	146	124.6 Å²	124.6	78%	0.781	71%	0.705	S	S	*	*			trans	-68.8	118.9	-179.7	-88.2	-72.3	0	0	0	113.1	E5 T9	E5-N7 PolarHBondContact O-N 3.16Å; N7-T9 PolarHBondContact O-N 3.43Å
8	E	24.4	Very low	26.9	Very low	166 Å²	166	122.6 Å²	122.6	78%	0.776	71%	0.707	S	S	*	*			trans	-84.7	102.2	166.2	-73	-168.5	126.3	0	0	111.7	S6	S6-E8 PolarHBondContact O-N 3.31Å
9	T	26.3	Very low	27	Very low	141 Å²	141	125.2 Å²	125.2	87%	0.865	72%	0.718	S	S	*	*			trans	-151.1	116.9	150.6	53.7	0	0	0	0	111.7	N7	N7-T9 PolarHBondContact O-N 3.43Å
10	G	26.3	Very low	27.1	Very low	77 Å²	77	123 Å²	123	79%	0.794	72%	0.724	S	S	*	*			trans	135.6	115.9	162.2	0	0	0	0	0	115	D12	G10-D12 PolarHBondContact O-N 3Å
11	D	24.8	Very low	27.1	Very low	176 Å²	176	124.7 Å²	124.7	94%	0.941	73%	0.73	S	S	*	*			trans	-63.2	111.8	158.9	-81	-70.1	0	0	0	109.4
12	D	26.7	Very low	27.2	Very low	155 Å²	155	122.3 Å²	122.3	83%	0.829	73%	0.728	S	S	*	*			trans	-149.1	145.8	153.9	-132.9	-28.9	0	0	0	114	G10	G10-D12 PolarHBondContact O-N 3Å
13	K	25.3	Very low	27.4	Very low	185 Å²	185	124.3 Å²	124.3	80%	0.804	74%	0.744	S	S	*	*			trans	-99.6	99.8	-169.9	-70.1	173.2	-178.8	167.8	0	111.6	I15	K13-I15 PolarHBondContact O-N 3.3Å
14	V	28.2	Very low	27.3	Very low	142 Å²	142	132 Å²	132	86%	0.861	78%	0.776	S	S	*	*			trans	-88.9	101.5	169.9	-174.4	0	0	0	0	110.5
15	I	28	Very low	27.3	Very low	144 Å²	144	127.7 Å²	127.7	74%	0.738	77%	0.77	S	S	*	*			trans	-110.2	114.8	169.3	-62.6	174.1	0	0	0	108.8	K13 V17	K13-I15 PolarHBondContact O-N 3.3Å; I15-V17 HydrophobicContact CG2-CG2 4.23Å
16	A	27.8	Very low	27.4	Very low	88 Å²	88	131.6 Å²	131.6	73%	0.727	79%	0.793	S	S	*	*			trans	-146.5	121.1	161	0	0	0	0	0	108.2
17	V	25.9	Very low	27.3	Very low	130 Å²	130	132.1 Å²	132.1	79%	0.788	80%	0.797	S	S	*	*			cis	76.3	120.2	43.6	-179.7	0	0	0	0	111.4	I15	I15-V17 HydrophobicContact CG2-CG2 4.23Å
18	A	27.2	Very low	27.4	Very low	89 Å²	89	131.3 Å²	131.3	74%	0.736	80%	0.8	S	S	*	*			cis	-165.1	175.4	-10.1	0	0	0	0	0	111.4
19	N	28.3	Very low	27.6	Very low	171 Å²	171	129.7 Å²	129.7	91%	0.914	80%	0.801	S	S	*	*			trans	-65.6	149.3	166.2	-60.1	-37.6	0	0	0	112
20	G	28	Very low	27.6	Very low	81 Å²	81	131.5 Å²	131.5	84%	0.835	80%	0.797	S	S	*	*			trans	-173.7	129	171.6	0	0	0	0	0	114.7
21	D	27.9	Very low	27.7	Very low	160 Å²	160	134 Å²	134	86%	0.856	80%	0.8	S	S	*	*			trans	-81.7	146.9	-165.9	-118.6	-45.8	0	0	0	116.9
22	S	28.4	Very low	27.9	Very low	97 Å²	97	134 Å²	134	68%	0.678	79%	0.794	S	S	*	*			trans	77.6	117.8	139.6	76.6	0	0	0	0	124.2
23	S	28.1	Very low	28	Very low	101 Å²	101	132.8 Å²	132.8	71%	0.706	79%	0.788	S	S	*	*				99.5	135	128.3	83.9	0	0	0	0	122.8
24	K	29.1	Very low	28.4	Very low	201 Å²	201	130.5 Å²	130.5	87%	0.874	79%	0.789	S	S	*	*			trans	75.9	113.4	159.1	-60.5	-179.9	-178.2	176.6	0	120.9
25	G	28.4	Very low	28.8	Very low	68 Å²	68	131.6 Å²	131.6	70%	0.701	78%	0.784	S	S	*	*			trans	59.5	137	137.4	0	0	0	0	0	119.4
26	D	28.5	Very low	29.5	Very low	155 Å²	155	130.6 Å²	130.6	83%	0.829	78%	0.781	S	S	*	*			cis	-156.4	154.1	24	-86.7	-36.8	0	0	0	113.2
27	S	28	Very low	30.8	Very low	102 Å²	102	133.8 Å²	133.8	71%	0.713	78%	0.781	S	S	*	*			trans	63	142.5	159.1	70.5	0	0	0	0	120
28	P	29.4	Very low	32.3	Very low	129 Å²	129	131.3 Å²	131.3	84%	0.838	77%	0.766	S	S	*	*			trans	-85.2	114.5	172.7	32.9	-31.2	0	0	0	111.4
29	T	28.8	Very low	34.4	Very low	131 Å²	131	130.7 Å²	130.7	80%	0.804	75%	0.754	S	S	*	*			trans	-71.9	158	160.7	34.5	0	0	0	0	111
30	K	27.2	Very low	36.9	Very low	179 Å²	179	125.1 Å²	125.1	78%	0.778	72%	0.721	S	S	*	*			trans	-70.3	160.3	-173.7	-65.3	174.6	-178.9	176	0	111.7	E32	K30-E32 PolarHBondContact O-N 3.16Å; K30-E32 VanDerWaalsContact O-N 3.13Å
31	P	27.7	Very low	39.6	Very low	130 Å²	130	122.9 Å²	122.9	84%	0.844	69%	0.691	S	S	*	*			trans	-61.6	113	158.2	28.2	-33	0	0	0	108.4	D33	P31-D33 PolarHBondContact O-N 2.85Å
32	E	29.4	Very low	42.5	Very low	175 Å²	175	115.3 Å²	115.3	82%	0.818	65%	0.65	S	S	*	*			trans	-80.9	117.4	174.8	-71.4	-176.8	151.9	0	0	109.7	K30	K30-E32 PolarHBondContact O-N 3.16Å; K30-E32 VanDerWaalsContact O-N 3.13Å
33	D	29.2	Very low	45.5	Very low	131 Å²	131	113.9 Å²	113.9	70%	0.701	63%	0.632	S	S	*	*			trans	38	116.7	155.6	-54.4	-17.1	0	0	0	119.5	P31 Q35	P31-D33 PolarHBondContact O-N 2.85Å; D33-Q35 VanDerWaalsContact C-N 3.3Å; D33-Q35 HydrophobicContact CB-CG 4.32Å; D33-Q35 PolarHBondContact O-N 2.97Å
34	V	33.1	Very low	48.5	Very low	136 Å²	136	109.1 Å²	109.1	82%	0.824	60%	0.599	S	S	*	*			trans	-58.9	100.7	139.3	177.3	0	0	0	0	106.1	D36	V34-D36 PolarHBondContact O-N 3.33Å
35	Q	37.1	Very low	51.5	Low	165 Å²	165	101.4 Å²	101.4	77%	0.771	57%	0.566	S	S	*	*			trans	-71	114.1	172.2	-72.4	-172.2	-28	0	0	108.3	D33	D33-Q35 VanDerWaalsContact C-N 3.3Å; D33-Q35 HydrophobicContact CB-CG 4.32Å; D33-Q35 PolarHBondContact O-N 2.97Å
36	D	42.9	Very low	54.2	Low	123 Å²	123	98.9 Å²	98.9	66%	0.658	54%	0.538	S	S	*	.			trans	-52.4	140.2	-176.8	-68.2	-53.8	0	0	0	112.1	V34 T38	V34-D36 PolarHBondContact O-N 3.33Å; D36-T38 HydrophobicContact CB-CG2 4.32Å; D36-T38 PolarHBondContact O-N 3.08Å; D36-T38 PolarHBondContact O-OG1 2.8Å; D36-T38 VanDerWaalsContact O-OG1 3.06Å
37	E	54.2	Low	56.8	Low	156 Å²	156	94.2 Å²	94.2	73%	0.729	52%	0.515	S	S	*	.			trans	-63.1	84	161.6	-68.7	-169.4	146.2	0	0	108.9	P39	E37-P39 WeakPolarHBondContact O-CD 3.45Å
38	T	58.4	Low	59	Low	78 Å²	78	95.4 Å²	95.4	48%	0.479	51%	0.509	S	S	.	.			trans	-89.9	104.6	179.8	19.6	0	0	0	0	108.5	D36	D36-T38 HydrophobicContact CB-CG2 4.32Å; D36-T38 PolarHBondContact O-N 3.08Å; D36-T38 PolarHBondContact O-OG1 2.8Å; D36-T38 VanDerWaalsContact O-OG1 3.06Å
39	P	70.7	Confident	61.3	Low	76 Å²	76	91.2 Å²	91.2	49%	0.494	48%	0.483	S	S	.	.			trans	-70.3	138.3	177.8	29.8	-35.2	0	0	0	110	E37 V56	E37-P39 WeakPolarHBondContact O-CD 3.45Å; P39-V56 CarbonylContact C-O 3.49Å; P39-V56 WeakPolarHBondContact CA-O 3.41Å
40	Y	79.9	Confident	63.9	Low	54 Å²	54	90.8 Å²	90.8	21%	0.212	48%	0.475	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	132.3	170.7	-55.8	-61	0	0	0	109.6	V42 Q55 V56 L102	Y40-V42 PolarHBondContact O-N 2.93Å; Y40-Q55 WeakPolarHBondContact O-CA 3.27Å; Y40-V56 PolarHBondContact N-O 3.11Å; Y40-V56 WeakPolarHBondContact O-CG2 3.42Å; Y40-V56 PolarHBondContact O-N 2.75Å; Y40-L102 HydrophobicContact CD2-CD2 3.7Å; Y40-L102 HydrophobicContact CD2-CG 4.29Å; Y40-L102 HydrophobicContact CE2-CD2 3.91Å; Y40-L102 HydrophobicContact CG-CD2 4.47Å
41	T	86.1	Confident	66.8	Low	34 Å²	34	85.2 Å²	85.2	21%	0.209	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	100.1	169.3	-43.8	0	0	0	0	108.3	E53 Q55 D104 G105	T41-E53 HydrophobicContact CG2-CB 3.98Å; T41-E53 HydrophobicContact CG2-CG 4.16Å; T41-Q55 HydrophobicContact CG2-CG 4.28Å; T41-D104 WeakPolarHBondContact CA-OD1 3.29Å; T41-D104 WeakPolarHBondContact CB-OD1 3.39Å; T41-D104 PolarHBondContact N-OD1 2.9Å; T41-D104 PolarHBondContact OG1-OD1 2.93Å; T41-G105 WeakPolarHBondContact O-CA 3.43Å; T41-G105 PolarHBondContact O-N 2.63Å
42	V	88.2	Confident	69.8	Low	0 Å²	0	79.2 Å²	79.2	0%	0	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	131.8	-175.5	177.7	0	0	0	0	110.2	Y40 I44 E53 L54 V56 L102 L108	Y40-V42 PolarHBondContact O-N 2.93Å; V42-I44 HydrophobicContact CG1-CD1 4.19Å; V42-E53 WeakPolarHBondContact O-CA 3.47Å; V42-L54 PolarHBondContact N-O 2.9Å; V42-L54 PolarHBondContact O-N 3.08Å; V42-V56 HydrophobicContact CB-CG2 4.33Å; V42-V56 HydrophobicContact CG2-CG2 3.58Å; V42-L102 HydrophobicContact CG2-CD1 4.11Å; V42-L108 HydrophobicContact CG1-CB 4.13Å; V42-L108 HydrophobicContact CG1-CD1 3.62Å; V42-L108 HydrophobicContact CG1-CG 3.54Å
43	K	91.8	Very high	72.7	Confident	68 Å²	68	77.1 Å²	77.1	30%	0.296	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	101.7	-178	-177.7	176.6	166.7	-155.2	0	110.2	F52 V106 E107 L108	K43-F52 CarbonylContact C-O 3.6Å; K43-V106 PolarHBondContact N-O 2.7Å; K43-E107 HydrophobicContact CB-CG 4.48Å; K43-E107 HydrophobicContact CD-CG 4.12Å; K43-E107 WeakPolarHBondContact CE-OE1 3.17Å; K43-E107 IonicContact NZ-OE1 2.78Å; K43-E107 PolarHBondContact NZ-OE1 3.3Å; K43-E107 WeakPolarHBondContact O-CA 3.4Å; K43-L108 PolarHBondContact O-N 3.21Å
44	I	90.5	Very high	75.5	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	133	176.4	-49.5	-63.1	0	0	0	109.6	V42 P46 P51 F52 L54 I65 L69 L108 V110	V42-I44 HydrophobicContact CG1-CD1 4.19Å; I44-P46 HydrophobicContact CG2-CG 4.3Å; I44-P46 WeakPolarHBondContact O-CD 3.43Å; I44-P51 CarbonylContact O-C 3.53Å; I44-P51 WeakPolarHBondContact O-CA 3.4Å; I44-P51 WeakPolarHBondContact O-CB 3.44Å; I44-F52 HydrophobicContact CB-CD2 4.08Å; I44-F52 HydrophobicContact CB-CE2 3.81Å; I44-F52 HydrophobicContact CB-CZ 4.09Å; I44-F52 HydrophobicContact CG1-CD2 4.18Å; I44-F52 HydrophobicContact CG1-CE2 3.76Å; I44-F52 HydrophobicContact CG1-CZ 4.38Å; I44-F52 HydrophobicContact CG2-CE1 4.47Å; I44-F52 HydrophobicContact CG2-CE2 4.26Å; I44-F52 HydrophobicContact CG2-CZ 4.05Å; I44-F52 PolarHBondContact N-O 2.73Å; I44-F52 PolarHBondContact O-N 2.94Å; I44-L54 HydrophobicContact CD1-CD2 4.42Å; I44-L54 HydrophobicContact CG1-CB 4.08Å; I44-L54 HydrophobicContact CG1-CD2 4.44Å; I44-I65 HydrophobicContact CD1-CG2 4.12Å; I44-L69 HydrophobicContact CG1-CD2 4.32Å; I44-L69 HydrophobicContact CG2-CD1 4.3Å; I44-L69 HydrophobicContact CG2-CD2 3.86Å; I44-L108 CarbonylContact C-O 3.5Å; I44-L108 WeakPolarHBondContact CA-O 3.48Å; I44-L108 HydrophobicContact CD1-CB 4.25Å; I44-L108 HydrophobicContact CD1-CD1 4.48Å; I44-V110 HydrophobicContact CG2-CG2 3.76Å
45	I	91.6	Very high	78	Confident	39 Å²	39	71 Å²	71	20%	0.2	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	96.3	171.2	-61.2	174.4	0	0	0	108.2	P51 E107 L108 K109 V110	I45-P51 HydrophobicContact CB-CG 4.49Å; I45-P51 HydrophobicContact CG1-CB 4.11Å; I45-P51 HydrophobicContact CG1-CG 4.18Å; I45-P51 HydrophobicContact CG2-CG 4.27Å; I45-E107 HydrophobicContact CD1-CB 3.99Å; I45-E107 HydrophobicContact CD1-CG 4.12Å; I45-E107 WeakPolarHBondContact CD1-OE2 3.36Å; I45-L108 PolarHBondContact N-O 3.19Å; I45-K109 HydrophobicContact CB-CG 4.06Å; I45-K109 HydrophobicContact CD1-CG 4.07Å; I45-K109 HydrophobicContact CG2-CG 4.39Å; I45-V110 PolarHBondContact O-N 3.31Å
46	P	86.3	Confident	80.2	Confident	15 Å²	15	63.3 Å²	63.3	10%	0.097	33%	0.332	C	S	.	.			trans	-67.9	155.5	172.6	-19.8	33.8	0	0	0	112.5	I44 H48 S49 F52 T75	I44-P46 HydrophobicContact CG2-CG 4.3Å; I44-P46 WeakPolarHBondContact O-CD 3.43Å; P46-H48 VanDerWaalsContact C-N 3.32Å; P46-H48 PolarHBondContact O-N 3.46Å; P46-S49 VanDerWaalsContact CB-OG 3.25Å; P46-S49 WeakPolarHBondContact CB-OG 3.41Å; P46-S49 WeakPolarHBondContact CG-OG 3.46Å; P46-F52 HydrophobicContact CG-CD1 4.13Å; P46-F52 HydrophobicContact CG-CE1 3.7Å; P46-T75 HydrophobicContact CB-CG2 4.03Å; P46-T75 HydrophobicContact CG-CG2 3.82Å
47	T	81.5	Confident	81.9	Confident	58 Å²	58	58.8 Å²	58.8	36%	0.356	31%	0.309	S	S	.	.	S	Bend	trans	-66.4	-32	178	-28.9	0	0	0	0	113.3	V110 E112	T47-V110 PolarHBondContact OG1-O 2.76Å; T47-E112 HydrophobicContact CG2-CG 4.15Å
48	H	75.5	Confident	82.8	Confident	127 Å²	127	51.7 Å²	51.7	59%	0.588	28%	0.277	S	S	*	.	S	Bend	trans	-135.9	13.1	-166.4	-70.9	-2.5	0	0	0	114.4	P46 E112	P46-H48 VanDerWaalsContact C-N 3.32Å; P46-H48 PolarHBondContact O-N 3.46Å; H48-E112 IonicContact CE1-OE1 3.55Å; H48-E112 IonicContact NE2-OE1 2.7Å
49	S	76.3	Confident	83.4	Confident	40 Å²	40	52.7 Å²	52.7	28%	0.28	28%	0.275	S	S	.	.	S	Bend	trans	-147.3	162.6	177.5	57.6	0	0	0	0	112.5	P46 E74	P46-S49 VanDerWaalsContact CB-OG 3.25Å; P46-S49 WeakPolarHBondContact CB-OG 3.41Å; P46-S49 WeakPolarHBondContact CG-OG 3.46Å; S49-E74 PolarHBondContact OG-O 2.95Å
50	D	84.3	Confident	83.7	Confident	122 Å²	122	52.2 Å²	52.2	65%	0.652	27%	0.266	S	S	*	.			trans	-66.3	127.4	-169.6	-61.1	-51.7	0	0	0	112.8	K1401	D50-K1401 PolarHBondContact O-NZ 2.75Å
51	P	88.8	Confident	83.9	Confident	63 Å²	63	51.7 Å²	51.7	41%	0.409	27%	0.267	S	S	.	.			trans	-50.1	139.5	-178.7	-30.2	36.3	0	0	0	114.3	I44 I45 K1401	I44-P51 CarbonylContact O-C 3.53Å; I44-P51 WeakPolarHBondContact O-CA 3.4Å; I44-P51 WeakPolarHBondContact O-CB 3.44Å; I45-P51 HydrophobicContact CB-CG 4.49Å; I45-P51 HydrophobicContact CG1-CB 4.11Å; I45-P51 HydrophobicContact CG1-CG 4.18Å; I45-P51 HydrophobicContact CG2-CG 4.27Å; P51-K1401 PolarHBondContact O-NZ 3.03Å
52	F	90	Very high	83.9	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.018	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	155.8	-175.4	61	-102.8	0	0	0	112.5	K43 I44 P46 L69 R72 T75 K1401	K43-F52 CarbonylContact C-O 3.6Å; I44-F52 HydrophobicContact CB-CD2 4.08Å; I44-F52 HydrophobicContact CB-CE2 3.81Å; I44-F52 HydrophobicContact CB-CZ 4.09Å; I44-F52 HydrophobicContact CG1-CD2 4.18Å; I44-F52 HydrophobicContact CG1-CE2 3.76Å; I44-F52 HydrophobicContact CG1-CZ 4.38Å; I44-F52 HydrophobicContact CG2-CE1 4.47Å; I44-F52 HydrophobicContact CG2-CE2 4.26Å; I44-F52 HydrophobicContact CG2-CZ 4.05Å; I44-F52 PolarHBondContact N-O 2.73Å; I44-F52 PolarHBondContact O-N 2.94Å; P46-F52 HydrophobicContact CG-CD1 4.13Å; P46-F52 HydrophobicContact CG-CE1 3.7Å; F52-L69 HydrophobicContact CE2-CD2 4Å; F52-L69 HydrophobicContact CZ-CD2 3.53Å; F52-R72 VanDerWaalsContact CD2-NH1 3.31Å; F52-R72 VanDerWaalsContact CE2-NH1 3.32Å; F52-T75 HydrophobicContact CE1-CG2 3.77Å; F52-T75 HydrophobicContact CZ-CG2 4.09Å; F52-K1401 HydrophobicContact CB-CD 4.15Å
53	E	91	Very high	83.8	Confident	131 Å²	131	52.3 Å²	52.3	61%	0.612	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.8	143.9	174.8	-73.6	154	-160.4	0	0	110.7	T41 V42	T41-E53 HydrophobicContact CG2-CB 3.98Å; T41-E53 HydrophobicContact CG2-CG 4.16Å; V42-E53 WeakPolarHBondContact O-CA 3.47Å
54	L	86.9	Confident	83.4	Confident	16 Å²	16	51.9 Å²	51.9	8%	0.084	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	124.8	175.2	177	65.1	0	0	0	107.5	V42 I44 V56 I65 V68	V42-L54 PolarHBondContact N-O 2.9Å; V42-L54 PolarHBondContact O-N 3.08Å; I44-L54 HydrophobicContact CD1-CD2 4.42Å; I44-L54 HydrophobicContact CG1-CB 4.08Å; I44-L54 HydrophobicContact CG1-CD2 4.44Å; L54-V56 HydrophobicContact CD2-CG1 3.92Å; L54-V56 HydrophobicContact CG-CG1 3.9Å; L54-I65 HydrophobicContact CD2-CG2 4.04Å; L54-V68 HydrophobicContact CD1-CG1 3.84Å; L54-V68 HydrophobicContact CD2-CG1 4.02Å
55	Q	86.3	Confident	83.3	Confident	121 Å²	121	52 Å²	52	57%	0.565	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	134.8	169.7	-70	-178.4	-39.5	0	0	109.1	Y40 T41	Y40-Q55 WeakPolarHBondContact O-CA 3.27Å; T41-Q55 HydrophobicContact CG2-CG 4.28Å
56	V	82.3	Confident	83.1	Confident	5 Å²	5	50.9 Å²	50.9	3%	0.03	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	145.6	-178.8	-63.8	0	0	0	0	109.8	P39 Y40 V42 L54 E60 I65 L96	P39-V56 CarbonylContact C-O 3.49Å; P39-V56 WeakPolarHBondContact CA-O 3.41Å; Y40-V56 PolarHBondContact N-O 3.11Å; Y40-V56 WeakPolarHBondContact O-CG2 3.42Å; Y40-V56 PolarHBondContact O-N 2.75Å; V42-V56 HydrophobicContact CB-CG2 4.33Å; V42-V56 HydrophobicContact CG2-CG2 3.58Å; L54-V56 HydrophobicContact CD2-CG1 3.92Å; L54-V56 HydrophobicContact CG-CG1 3.9Å; V56-E60 WeakPolarHBondContact CA-OE2 3.39Å; V56-E60 VanDerWaalsContact CB-OE2 3.25Å; V56-E60 WeakPolarHBondContact CB-OE2 3.35Å; V56-I65 HydrophobicContact CG1-CD1 4.03Å; V56-I65 HydrophobicContact CG1-CG1 3.99Å; V56-L96 HydrophobicContact CB-CD1 3.73Å; V56-L96 HydrophobicContact CG1-CD1 4.42Å; V56-L96 HydrophobicContact CG2-CD1 3.67Å
57	S	78.7	Confident	83	Confident	27 Å²	27	57 Å²	57	19%	0.189	28%	0.282	C	S	.	.			trans	-80.7	147.3	175.5	179.8	0	0	0	0	111	F59 E60	S57-F59 PolarHBondContact O-N 3.12Å; S57-F59 VanDerWaalsContact O-N 3.11Å; S57-F59 PolarHBondContact OG-N 3Å; S57-E60 PolarHBondContact N-OE2 3.45Å; S57-E60 PolarHBondContact O-N 3.43Å; S57-E60 VanDerWaalsContact O-N 3.07Å
58	S	74.5	Confident	83.2	Confident	7 Å²	7	57.1 Å²	57.1	5%	0.049	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-18.6	175	62.8	0	0	0	0	113.4	K97	S58-K97 VanDerWaalsContact O-CB 3.26Å; S58-K97 WeakPolarHBondContact O-CB 3.29Å; S58-K97 WeakPolarHBondContact O-CG 3.33Å; S58-K97 PolarHBondContact O-N 3.15Å
59	F	70.9	Confident	83.8	Confident	99 Å²	99	51.2 Å²	51.2	43%	0.434	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-5.6	176.7	-64.7	-90.7	0	0	0	114.6	S57 K97	S57-F59 PolarHBondContact O-N 3.12Å; S57-F59 VanDerWaalsContact O-N 3.11Å; S57-F59 PolarHBondContact OG-N 3Å; F59-K97 HydrophobicContact CE1-CD 4.32Å
60	E	76.5	Confident	84.3	Confident	66 Å²	66	51.8 Å²	51.8	31%	0.308	25%	0.254	S	S	.	.			trans	-70.7	152.5	175.3	-80.1	165.2	179.2	0	0	111.2	V56 S57 E64 L96	V56-E60 WeakPolarHBondContact CA-OE2 3.39Å; V56-E60 VanDerWaalsContact CB-OE2 3.25Å; V56-E60 WeakPolarHBondContact CB-OE2 3.35Å; S57-E60 PolarHBondContact N-OE2 3.45Å; S57-E60 PolarHBondContact O-N 3.43Å; S57-E60 VanDerWaalsContact O-N 3.07Å; E60-E64 WeakPolarHBondContact CA-OE2 3.3Å; E60-L96 HydrophobicContact CB-CD1 3.99Å; E60-L96 WeakPolarHBondContact O-CG 3.41Å; E60-L96 PolarHBondContact O-N 2.89Å
61	L	84.7	Confident	84.2	Confident	44 Å²	44	49.5 Å²	49.5	23%	0.23	24%	0.242	C	C	.	.	B	Isolated β-bridge	trans	-90	150.3	174.4	-58.9	177.9	0	0	0	110.7	Q63 E64 A94 E95	L61-Q63 HydrophobicContact CB-CG 3.75Å; L61-Q63 HydrophobicContact CD1-CG 4.33Å; L61-Q63 VanDerWaalsContact CD1-NE2 3.34Å; L61-Q63 PolarHBondContact O-N 2.89Å; L61-Q63 VanDerWaalsContact O-N 3.13Å; L61-E64 HydrophobicContact CB-CG 4.45Å; L61-E64 PolarHBondContact N-OE2 3.02Å; L61-E64 WeakPolarHBondContact O-CB 3.4Å; L61-E64 PolarHBondContact O-N 3.48Å; L61-A94 WeakPolarHBondContact CA-O 3.25Å; L61-E95 HydrophobicContact CD2-CB 4.33Å; L61-E95 HydrophobicContact CD2-CG 3.74Å
62	V	85.7	Confident	84	Confident	0 Å²	0	48 Å²	48	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-55.2	-34.4	176.9	173.2	0	0	0	0	112.1	E64 I65 H66 L83 L90 D91 A94 L96 V99	V62-E64 VanDerWaalsContact C-N 3.26Å; V62-E64 PolarHBondContact O-N 3.09Å; V62-I65 WeakPolarHBondContact O-CB 3.45Å; V62-I65 PolarHBondContact O-N 2.87Å; V62-H66 PolarHBondContact O-CD2 2.91Å; V62-H66 PolarHBondContact O-N 3.4Å; V62-L83 HydrophobicContact CG1-CD1 4.07Å; V62-L90 HydrophobicContact CG1-CB 3.85Å; V62-L90 HydrophobicContact CG1-CD1 4.28Å; V62-L90 HydrophobicContact CG2-CB 4.16Å; V62-L90 HydrophobicContact CG2-CD1 4.12Å; V62-D91 VanDerWaalsContact CB-O 3.23Å; V62-D91 WeakPolarHBondContact CB-O 3.43Å; V62-D91 WeakPolarHBondContact CG2-O 3.31Å; V62-A94 HydrophobicContact CG2-CB 4.33Å; V62-A94 PolarHBondContact N-O 3.43Å; V62-L96 HydrophobicContact CG2-CD2 3.98Å; V62-V99 HydrophobicContact CG2-CG2 4.38Å
63	Q	86.1	Confident	83.8	Confident	46 Å²	46	49.7 Å²	49.7	22%	0.215	24%	0.236	C	C	.	.	H	α-helix	trans	-61	-26.3	172.6	60.8	171.8	-39.8	0	0	114.7	L61 H66 R67 M92	L61-Q63 HydrophobicContact CB-CG 3.75Å; L61-Q63 HydrophobicContact CD1-CG 4.33Å; L61-Q63 VanDerWaalsContact CD1-NE2 3.34Å; L61-Q63 PolarHBondContact O-N 2.89Å; L61-Q63 VanDerWaalsContact O-N 3.13Å; Q63-H66 WeakPolarHBondContact O-CB 3.49Å; Q63-H66 PolarHBondContact O-N 3.18Å; Q63-R67 PolarHBondContact O-N 3.09Å; Q63-M92 HydrophobicContact CB-CB 4.39Å; Q63-M92 HydrophobicContact CB-CE 4.27Å; Q63-M92 WeakPolarHBondContact CB-O 3.45Å; Q63-M92 WeakPolarHBondContact CG-O 3.49Å; Q63-M92 PolarHBondContact N-O 3.36Å
64	E	83.2	Confident	83.4	Confident	59 Å²	59	47.2 Å²	47.2	28%	0.276	23%	0.225	S	C	.	.	H	α-helix	trans	-72.9	-35.3	177.2	-65.2	177.4	123.7	0	0	110.3	E60 L61 V62 R67 V68	E60-E64 WeakPolarHBondContact CA-OE2 3.3Å; L61-E64 HydrophobicContact CB-CG 4.45Å; L61-E64 PolarHBondContact N-OE2 3.02Å; L61-E64 WeakPolarHBondContact O-CB 3.4Å; L61-E64 PolarHBondContact O-N 3.48Å; V62-E64 VanDerWaalsContact C-N 3.26Å; V62-E64 PolarHBondContact O-N 3.09Å; E64-R67 PolarHBondContact O-N 3.31Å; E64-V68 WeakPolarHBondContact O-CG2 3.3Å; E64-V68 PolarHBondContact O-N 3.15Å
65	I	88.1	Confident	83.5	Confident	2 Å²	2	46.8 Å²	46.8	1%	0.01	22%	0.223	C	C	.	.	H	α-helix	trans	-61.1	-47.5	166.7	-54.2	-176.6	0	0	0	110.5	I44 L54 V56 V62 R67 V68 L69 L83 L96 L108	I44-I65 HydrophobicContact CD1-CG2 4.12Å; L54-I65 HydrophobicContact CD2-CG2 4.04Å; V56-I65 HydrophobicContact CG1-CD1 4.03Å; V56-I65 HydrophobicContact CG1-CG1 3.99Å; V62-I65 WeakPolarHBondContact O-CB 3.45Å; V62-I65 PolarHBondContact O-N 2.87Å; I65-R67 VanDerWaalsContact C-N 3.25Å; I65-R67 PolarHBondContact O-N 3.29Å; I65-V68 PolarHBondContact O-N 3.28Å; I65-V68 VanDerWaalsContact O-N 3.17Å; I65-L69 HydrophobicContact CG2-CD1 4.1Å; I65-L69 HydrophobicContact CG2-CG 4.25Å; I65-L69 VanDerWaalsContact O-CG 3.31Å; I65-L69 WeakPolarHBondContact O-CG 3.48Å; I65-L69 PolarHBondContact O-N 3.26Å; I65-L83 HydrophobicContact CB-CD1 3.85Å; I65-L83 HydrophobicContact CG2-CD1 3.6Å; I65-L96 HydrophobicContact CD1-CD1 3.96Å; I65-L96 HydrophobicContact CD1-CD2 3.89Å; I65-L96 HydrophobicContact CG1-CD1 4.42Å; I65-L108 HydrophobicContact CD1-CD1 4.06Å
66	H	88.5	Confident	83.6	Confident	17 Å²	17	41 Å²	41	8%	0.079	20%	0.196	C	C	.	.	H	α-helix	trans	-54.1	-43.9	177.2	-82.8	-124.7	0	0	0	111.7	V62 Q63 L69 M70 F81 L83	V62-H66 PolarHBondContact O-CD2 2.91Å; V62-H66 PolarHBondContact O-N 3.4Å; Q63-H66 WeakPolarHBondContact O-CB 3.49Å; Q63-H66 PolarHBondContact O-N 3.18Å; H66-L69 PolarHBondContact O-N 3.48Å; H66-M70 PolarHBondContact O-N 2.6Å; H66-F81 HydrophobicContact CB-CE2 4.24Å; H66-F81 HydrophobicContact CB-CZ 4.1Å; H66-F81 AromaticContact CE1-CD2 3.86Å; H66-F81 AromaticContact CE1-CE2 3.66Å; H66-F81 PolarHBondContact CE1-O 2.98Å; H66-F81 VanDerWaalsContact CE1-O 3.23Å; H66-F81 AromaticContact CG-CE2 3.61Å; H66-F81 AromaticContact CG-CZ 3.94Å; H66-F81 AromaticContact ND1-CD2 3.93Å; H66-F81 AromaticContact ND1-CE2 3.37Å; H66-F81 WeakPolarHBondContact ND1-CE2 3.39Å; H66-F81 AromaticContact ND1-CZ 3.77Å; H66-L83 VanDerWaalsContact CD2-CD1 3.46Å; H66-L83 WeakPolarHBondContact CD2-CD1 3.21Å
67	R	84.4	Confident	83.8	Confident	142 Å²	142	41.4 Å²	41.4	54%	0.536	20%	0.199	S	C	.	.	H	α-helix	trans	-62.8	-49.1	176.5	-177.1	179.1	176.7	173.2	2.5	112.1	Q63 E64 I65 L69 M70 D71	Q63-R67 PolarHBondContact O-N 3.09Å; E64-R67 PolarHBondContact O-N 3.31Å; I65-R67 VanDerWaalsContact C-N 3.25Å; I65-R67 PolarHBondContact O-N 3.29Å; R67-L69 PolarHBondContact O-N 3.06Å; R67-M70 PolarHBondContact O-N 3.05Å; R67-D71 IonicContact NE-OD2 3.89Å; R67-D71 WeakPolarHBondContact O-CB 3.35Å; R67-D71 PolarHBondContact O-N 3.42Å
68	V	84.9	Confident	84.2	Confident	61 Å²	61	41.1 Å²	41.1	37%	0.37	20%	0.196	S	C	.	.	H	α-helix	trans	-56.8	-38.6	177.2	170.2	0	0	0	0	111.4	L54 E64 I65 D71 R72	L54-V68 HydrophobicContact CD1-CG1 3.84Å; L54-V68 HydrophobicContact CD2-CG1 4.02Å; E64-V68 WeakPolarHBondContact O-CG2 3.3Å; E64-V68 PolarHBondContact O-N 3.15Å; I65-V68 PolarHBondContact O-N 3.28Å; I65-V68 VanDerWaalsContact O-N 3.17Å; V68-D71 PolarHBondContact O-N 3.04Å; V68-R72 WeakPolarHBondContact O-CB 3.41Å; V68-R72 PolarHBondContact O-N 3.19Å
69	L	88.6	Confident	84.9	Confident	3 Å²	3	41.8 Å²	41.8	2%	0.016	20%	0.2	C	C	.	.	H	α-helix	trans	-68.4	-38	176	-63.5	178.8	0	0	0	113.1	I44 F52 I65 H66 R67 T75 C76 F81 L83 V110	I44-L69 HydrophobicContact CG1-CD2 4.32Å; I44-L69 HydrophobicContact CG2-CD1 4.3Å; I44-L69 HydrophobicContact CG2-CD2 3.86Å; F52-L69 HydrophobicContact CE2-CD2 4Å; F52-L69 HydrophobicContact CZ-CD2 3.53Å; I65-L69 HydrophobicContact CG2-CD1 4.1Å; I65-L69 HydrophobicContact CG2-CG 4.25Å; I65-L69 VanDerWaalsContact O-CG 3.31Å; I65-L69 WeakPolarHBondContact O-CG 3.48Å; I65-L69 PolarHBondContact O-N 3.26Å; H66-L69 PolarHBondContact O-N 3.48Å; R67-L69 PolarHBondContact O-N 3.06Å; L69-T75 CarbonylContact O-C 3.55Å; L69-T75 VanDerWaalsContact O-CB 3.26Å; L69-T75 WeakPolarHBondContact O-CB 3.35Å; L69-T75 PolarHBondContact O-OG1 3.09Å; L69-C76 PolarHBondContact O-N 3.17Å; L69-F81 HydrophobicContact CB-CZ 4Å; L69-F81 HydrophobicContact CD1-CE2 3.93Å; L69-F81 HydrophobicContact CD1-CZ 4.11Å; L69-L83 HydrophobicContact CD1-CD2 3.91Å; L69-V110 HydrophobicContact CD1-CG2 4.01Å
70	M	86.9	Confident	85.9	Confident	52 Å²	52	37.3 Å²	37.3	26%	0.256	18%	0.181	S	C	.	.	H	α-helix	trans	-69.9	-33.2	174	-75.8	-179.1	56.6	0	0	112.7	H66 R67 C76 T79 F81 H126	H66-M70 PolarHBondContact O-N 2.6Å; R67-M70 PolarHBondContact O-N 3.05Å; M70-C76 VanDerWaalsContact O-CA 3.29Å; M70-C76 WeakPolarHBondContact O-CA 3.31Å; M70-C76 WeakPolarHBondContact O-CB 3.41Å; M70-T79 HydrophobicContact CE-CG2 3.9Å; M70-T79 HydrophobicContact CG-CG2 4.45Å; M70-T79 HydrophobicContact SD-CG2 4.45Å; M70-F81 HydrophobicContact CG-CE1 4.15Å; M70-H126 HydrophobicContact CE-CB 4.41Å; M70-H126 WeakPolarHBondContact CE-ND1 3.09Å; M70-H126 PolarHBondContact O-CE1 3.03Å; M70-H126 VanDerWaalsContact O-CE1 3.32Å
71	D	81.6	Confident	86.7	Confident	74 Å²	74	35 Å²	35	40%	0.396	17%	0.17	S	C	.	.	H	α-helix	trans	-80.1	-23.4	179.8	-92.1	-43.8	0	0	0	113.8	R67 V68 R296	R67-D71 IonicContact NE-OD2 3.89Å; R67-D71 WeakPolarHBondContact O-CB 3.35Å; R67-D71 PolarHBondContact O-N 3.42Å; V68-D71 PolarHBondContact O-N 3.04Å; D71-R296 VanDerWaalsContact O-CZ 3.29Å; D71-R296 PolarHBondContact O-NH1 3.34Å; D71-R296 PolarHBondContact O-NH2 3.38Å; D71-R296 IonicContact OD1-NH2 3.77Å
72	R	85.1	Confident	87.1	Confident	31 Å²	31	33.4 Å²	33.4	12%	0.117	16%	0.163	C	C	.	.	S	Bend	trans	-82.8	133.4	-174.6	-176.2	176	-174.7	144.6	4.6	113.4	F52 V68 E74 T75 C76	F52-R72 VanDerWaalsContact CD2-NH1 3.31Å; F52-R72 VanDerWaalsContact CE2-NH1 3.32Å; V68-R72 WeakPolarHBondContact O-CB 3.41Å; V68-R72 PolarHBondContact O-N 3.19Å; R72-E74 VanDerWaalsContact C-N 3.29Å; R72-E74 WeakPolarHBondContact CD-OE2 3.37Å; R72-E74 VanDerWaalsContact CG-OE2 3.26Å; R72-E74 WeakPolarHBondContact CG-OE2 3.14Å; R72-E74 IonicContact CZ-OE2 3.92Å; R72-E74 IonicContact NE-OE2 2.64Å; R72-E74 PolarHBondContact NE-OE2 3.49Å; R72-E74 IonicContact NH2-OE2 2.89Å; R72-E74 PolarHBondContact O-N 3.38Å; R72-E74 VanDerWaalsContact O-N 3.12Å; R72-T75 PolarHBondContact O-N 3.42Å; R72-C76 VanDerWaalsContact O-CB 3.3Å; R72-C76 WeakPolarHBondContact O-CB 3.36Å; R72-C76 PolarHBondContact O-N 2.66Å
73	E	85.4	Confident	87.4	Confident	40 Å²	40	33.4 Å²	33.4	19%	0.187	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-34.3	-172.5	-79.6	72.2	-162.6	0	0	115.1	C76 L293 R296 A297 R304	E73-C76 PolarHBondContact O-SG 2.86Å; E73-C76 VanDerWaalsContact O-SG 3.37Å; E73-L293 HydrophobicContact CG-CB 4.33Å; E73-L293 HydrophobicContact CG-CD2 4.31Å; E73-R296 VanDerWaalsContact CD-NH1 3.27Å; E73-R296 WeakPolarHBondContact OE1-CG 3.32Å; E73-R296 IonicContact OE1-CZ 2.81Å; E73-R296 IonicContact OE1-NH1 3.22Å; E73-R296 PolarHBondContact OE1-NH1 2.73Å; E73-R296 IonicContact OE2-NH1 2.71Å; E73-A297 HydrophobicContact CG-CB 4.14Å; E73-R304 IonicContact OE1-CZ 2.84Å; E73-R304 IonicContact OE1-NH1 2.69Å; E73-R304 PolarHBondContact OE1-NH1 3.23Å; E73-R304 IonicContact OE2-NH1 2.71Å
74	E	83.2	Confident	87.7	Confident	79 Å²	79	32.2 Å²	32.2	37%	0.369	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-22.1	179.7	-60.9	98.6	-177.2	0	0	114.4	S49 R72	S49-E74 PolarHBondContact OG-O 2.95Å; R72-E74 VanDerWaalsContact C-N 3.29Å; R72-E74 WeakPolarHBondContact CD-OE2 3.37Å; R72-E74 VanDerWaalsContact CG-OE2 3.26Å; R72-E74 WeakPolarHBondContact CG-OE2 3.14Å; R72-E74 IonicContact CZ-OE2 3.92Å; R72-E74 IonicContact NE-OE2 2.64Å; R72-E74 PolarHBondContact NE-OE2 3.49Å; R72-E74 IonicContact NH2-OE2 2.89Å; R72-E74 PolarHBondContact O-N 3.38Å; R72-E74 VanDerWaalsContact O-N 3.12Å
75	T	88.7	Confident	88	Confident	7 Å²	7	29.7 Å²	29.7	4%	0.043	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.3	-8.3	-171.8	43.5	0	0	0	0	114.3	P46 F52 L69 R72 S77 C78	P46-T75 HydrophobicContact CB-CG2 4.03Å; P46-T75 HydrophobicContact CG-CG2 3.82Å; F52-T75 HydrophobicContact CE1-CG2 3.77Å; F52-T75 HydrophobicContact CZ-CG2 4.09Å; L69-T75 CarbonylContact O-C 3.55Å; L69-T75 VanDerWaalsContact O-CB 3.26Å; L69-T75 WeakPolarHBondContact O-CB 3.35Å; L69-T75 PolarHBondContact O-OG1 3.09Å; R72-T75 PolarHBondContact O-N 3.42Å; T75-S77 PolarHBondContact O-N 3.36Å; T75-C78 PolarHBondContact O-N 2.87Å
76	C	87.7	Confident	88	Confident	1 Å²	1	36 Å²	36	1%	0.007	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-15.6	-178.4	65.6	0	0	0	0	115.7	L69 M70 R72 E73 C78 H126 L130	L69-C76 PolarHBondContact O-N 3.17Å; M70-C76 VanDerWaalsContact O-CA 3.29Å; M70-C76 WeakPolarHBondContact O-CA 3.31Å; M70-C76 WeakPolarHBondContact O-CB 3.41Å; R72-C76 VanDerWaalsContact O-CB 3.3Å; R72-C76 WeakPolarHBondContact O-CB 3.36Å; R72-C76 PolarHBondContact O-N 2.66Å; E73-C76 PolarHBondContact O-SG 2.86Å; E73-C76 VanDerWaalsContact O-SG 3.37Å; C76-C78 VanDerWaalsContact C-N 3.27Å; C76-C78 PolarHBondContact O-N 3.01Å; C76-H126 PolarHBondContact O-CD2 3.38Å; C76-H126 PolarHBondContact O-NE2 2.97Å; C76-L130 HydrophobicContact CB-CD1 3.99Å; C76-L130 HydrophobicContact CB-CD2 4.07Å; C76-L130 WeakPolarHBondContact O-CD1 3.26Å
77	S	86.5	Confident	87.8	Confident	12 Å²	12	38.5 Å²	38.5	8%	0.084	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-10.9	171.9	49	0	0	0	0	114.5	T75 H123 S273	T75-S77 PolarHBondContact O-N 3.36Å; S77-H123 PolarHBondContact O-CE1 3.47Å; S77-S273 VanDerWaalsContact O-CB 3.26Å; S77-S273 WeakPolarHBondContact O-CB 3.44Å; S77-S273 PolarHBondContact O-OG 3.46Å
78	C	86.6	Confident	88	Confident	21 Å²	21	38.8 Å²	38.8	14%	0.142	22%	0.218	C	C	.	.			trans	-108	124.7	-178.8	-60.5	0	0	0	0	110.3	T75 C76 F81	T75-C78 PolarHBondContact O-N 2.87Å; C76-C78 VanDerWaalsContact C-N 3.27Å; C76-C78 PolarHBondContact O-N 3.01Å; C78-F81 HydrophobicContact CB-CD1 4.13Å; C78-F81 WeakPolarHBondContact O-CE1 3.2Å
79	T	90.1	Very high	88.2	Confident	22 Å²	22	40 Å²	40	14%	0.135	23%	0.226	C	C	.	.			trans	-137.7	-1.4	-178.5	78.7	0	0	0	0	114.4	M70 H123 H126	M70-T79 HydrophobicContact CE-CG2 3.9Å; M70-T79 HydrophobicContact CG-CG2 4.45Å; M70-T79 HydrophobicContact SD-CG2 4.45Å; T79-H123 WeakPolarHBondContact OG1-CB 3.49Å; T79-H123 PolarHBondContact OG1-ND1 3.42Å; T79-H126 HydrophobicContact CG2-CB 4.11Å; T79-H126 WeakPolarHBondContact CG2-CD2 3.5Å
80	C	92.5	Very high	88.3	Confident	5 Å²	5	40.9 Å²	40.9	3%	0.034	23%	0.231	C	C	.	.	S	Bend	trans	-132.4	77	-178.6	179.8	0	0	0	0	107.4	E113 Y115 E119 H272	C80-E113 PolarHBondContact O-N 2.91Å; C80-E113 PolarHBondContact SG-O 3.44Å; C80-Y115 HydrophobicContact CB-CD1 3.69Å; C80-Y115 HydrophobicContact CB-CE1 3.26Å; C80-Y115 HydrophobicContact CB-CE2 4.25Å; C80-Y115 HydrophobicContact CB-CG 4.34Å; C80-E119 HydrophobicContact CB-CB 4.17Å; C80-H272 PolarHBondContact O-CE1 3.01Å; C80-H272 PolarHBondContact O-NE2 2.96Å
81	F	92.8	Very high	88.4	Confident	18 Å²	18	43.2 Å²	43.2	8%	0.079	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	161.2	-173.9	63	-95.8	0	0	0	110.2	H66 L69 M70 C78 L83 V110 V111	H66-F81 HydrophobicContact CB-CE2 4.24Å; H66-F81 HydrophobicContact CB-CZ 4.1Å; H66-F81 AromaticContact CE1-CD2 3.86Å; H66-F81 AromaticContact CE1-CE2 3.66Å; H66-F81 PolarHBondContact CE1-O 2.98Å; H66-F81 VanDerWaalsContact CE1-O 3.23Å; H66-F81 AromaticContact CG-CE2 3.61Å; H66-F81 AromaticContact CG-CZ 3.94Å; H66-F81 AromaticContact ND1-CD2 3.93Å; H66-F81 AromaticContact ND1-CE2 3.37Å; H66-F81 WeakPolarHBondContact ND1-CE2 3.39Å; H66-F81 AromaticContact ND1-CZ 3.77Å; L69-F81 HydrophobicContact CB-CZ 4Å; L69-F81 HydrophobicContact CD1-CE2 3.93Å; L69-F81 HydrophobicContact CD1-CZ 4.11Å; M70-F81 HydrophobicContact CG-CE1 4.15Å; C78-F81 HydrophobicContact CB-CD1 4.13Å; C78-F81 WeakPolarHBondContact O-CE1 3.2Å; F81-L83 HydrophobicContact CE2-CD2 4.46Å; F81-L83 HydrophobicContact CE2-CG 4.44Å; F81-V110 HydrophobicContact CB-CG1 3.72Å; F81-V110 HydrophobicContact CD1-CG1 4.42Å; F81-V110 HydrophobicContact CD2-CG1 3.74Å; F81-V110 HydrophobicContact CE2-CG1 4.48Å; F81-V110 HydrophobicContact CG-CG1 3.71Å; F81-V111 CarbonylContact C-O 3.58Å; F81-V111 WeakPolarHBondContact CA-O 3.39Å; F81-V111 VanDerWaalsContact CB-O 3.27Å; F81-V111 WeakPolarHBondContact CB-O 3.25Å
82	S	92.2	Very high	88.4	Confident	10 Å²	10	43.6 Å²	43.6	7%	0.07	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	151.9	169.8	62.5	0	0	0	0	110.3	V111 E113	S82-V111 PolarHBondContact N-O 3.3Å; S82-V111 PolarHBondContact O-N 3.13Å; S82-E113 WeakPolarHBondContact CB-OE1 3.35Å; S82-E113 PolarHBondContact OG-OE1 3.05Å
83	L	91.7	Very high	88.3	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	126.9	172	-69.7	175.4	0	0	0	109.4	V62 I65 H66 L69 F81 L90 L108 V110	V62-L83 HydrophobicContact CG1-CD1 4.07Å; I65-L83 HydrophobicContact CB-CD1 3.85Å; I65-L83 HydrophobicContact CG2-CD1 3.6Å; H66-L83 VanDerWaalsContact CD2-CD1 3.46Å; H66-L83 WeakPolarHBondContact CD2-CD1 3.21Å; L69-L83 HydrophobicContact CD1-CD2 3.91Å; F81-L83 HydrophobicContact CE2-CD2 4.46Å; F81-L83 HydrophobicContact CE2-CG 4.44Å; L83-L90 HydrophobicContact CB-CD1 4.19Å; L83-L90 PolarHBondContact O-N 3.07Å; L83-L108 HydrophobicContact CD1-CD1 4.45Å; L83-V110 HydrophobicContact CD2-CG2 4.03Å
84	V	92.9	Very high	88.2	Confident	21 Å²	21	46.4 Å²	46.4	13%	0.127	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	119.9	-175.4	175.3	0	0	0	0	110.7	Q88 K109 V111	V84-Q88 CarbonylContact C-O 3.47Å; V84-Q88 VanDerWaalsContact CA-O 3.3Å; V84-Q88 WeakPolarHBondContact CA-O 3.38Å; V84-K109 HydrophobicContact CB-CB 4.48Å; V84-K109 PolarHBondContact N-O 3.43Å; V84-K109 PolarHBondContact O-N 3.23Å; V84-V111 HydrophobicContact CB-CG2 4.04Å; V84-V111 HydrophobicContact CG2-CB 4.1Å; V84-V111 HydrophobicContact CG2-CG2 3.6Å
85	L	90.5	Very high	88.2	Confident	5 Å²	5	46.1 Å²	46.1	3%	0.026	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	127.4	173.5	176.5	55.9	0	0	0	109.3	G87 Q88 L90 V99 V106 L108	L85-G87 PolarHBondContact O-N 2.67Å; L85-Q88 PolarHBondContact N-O 2.87Å; L85-Q88 PolarHBondContact O-N 3.09Å; L85-Q88 VanDerWaalsContact O-O 3.12Å; L85-L90 HydrophobicContact CB-CD2 3.83Å; L85-L90 HydrophobicContact CB-CG 4.29Å; L85-L90 HydrophobicContact CD2-CD2 4.34Å; L85-V99 HydrophobicContact CD2-CG1 3.48Å; L85-V99 VanDerWaalsContact CD2-CG1 3.48Å; L85-V106 HydrophobicContact CD1-CG1 3.28Å; L85-L108 HydrophobicContact CB-CD2 3.67Å; L85-L108 HydrophobicContact CD1-CD2 4.07Å; L85-L108 HydrophobicContact CG-CD2 4.3Å
86	N	87	Confident	87.9	Confident	136 Å²	136	45.9 Å²	45.9	73%	0.727	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	18.4	175.4	-63.3	-38.3	0	0	0	115.7
87	G	84.4	Confident	87.7	Confident	69 Å²	69	50.3 Å²	50.3	71%	0.711	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.6	0.2	-175.8	0	0	0	0	0	115.2	L85	L85-G87 PolarHBondContact O-N 2.67Å
88	Q	88	Confident	87.5	Confident	147 Å²	147	53.3 Å²	53.3	69%	0.687	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.7	140.3	169.7	-58	-172.8	18.6	0	0	110.1	V84 L85	V84-Q88 CarbonylContact C-O 3.47Å; V84-Q88 VanDerWaalsContact CA-O 3.3Å; V84-Q88 WeakPolarHBondContact CA-O 3.38Å; L85-Q88 PolarHBondContact N-O 2.87Å; L85-Q88 PolarHBondContact O-N 3.09Å; L85-Q88 VanDerWaalsContact O-O 3.12Å
89	T	90.5	Very high	87.3	Confident	88 Å²	88	53.1 Å²	53.1	54%	0.54	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	131.6	172.2	-57.7	0	0	0	0	109.7
90	L	90.3	Very high	86.9	Confident	20 Å²	20	59.7 Å²	59.7	11%	0.105	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-75	139.1	175.6	-60.4	-174.8	0	0	0	110.9	V62 L83 L85 V99 L108	V62-L90 HydrophobicContact CG1-CB 3.85Å; V62-L90 HydrophobicContact CG1-CD1 4.28Å; V62-L90 HydrophobicContact CG2-CB 4.16Å; V62-L90 HydrophobicContact CG2-CD1 4.12Å; L83-L90 HydrophobicContact CB-CD1 4.19Å; L83-L90 PolarHBondContact O-N 3.07Å; L85-L90 HydrophobicContact CB-CD2 3.83Å; L85-L90 HydrophobicContact CB-CG 4.29Å; L85-L90 HydrophobicContact CD2-CD2 4.34Å; L90-V99 HydrophobicContact CD2-CG1 3.47Å; L90-V99 VanDerWaalsContact CD2-CG1 3.47Å; L90-V99 HydrophobicContact CD2-CG2 4.29Å; L90-L108 HydrophobicContact CD1-CD1 4.15Å; L90-L108 HydrophobicContact CD1-CD2 3.83Å
91	D	88.3	Confident	86.1	Confident	102 Å²	102	61.9 Å²	61.9	55%	0.545	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-69.8	131.4	167.2	-172.8	-20.5	0	0	0	109.3	V62 F93 A94	V62-D91 VanDerWaalsContact CB-O 3.23Å; V62-D91 WeakPolarHBondContact CB-O 3.43Å; V62-D91 WeakPolarHBondContact CG2-O 3.31Å; D91-F93 PolarHBondContact O-N 3.05Å; D91-F93 PolarHBondContact OD1-N 2.94Å; D91-A94 HydrophobicContact CB-CB 4.21Å; D91-A94 PolarHBondContact O-N 3.46Å
92	M	82.7	Confident	85.4	Confident	82 Å²	82	62.1 Å²	62.1	40%	0.404	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-26.5	179.1	-68.7	-176.7	64.4	0	0	113.1	Q63	Q63-M92 HydrophobicContact CB-CB 4.39Å; Q63-M92 HydrophobicContact CB-CE 4.27Å; Q63-M92 WeakPolarHBondContact CB-O 3.45Å; Q63-M92 WeakPolarHBondContact CG-O 3.49Å; Q63-M92 PolarHBondContact N-O 3.36Å
93	F	83	Confident	84.8	Confident	109 Å²	109	63.8 Å²	63.8	48%	0.478	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	1	-177.5	-56.8	-77.2	0	0	0	113.9	D91	D91-F93 PolarHBondContact O-N 3.05Å; D91-F93 PolarHBondContact OD1-N 2.94Å
94	A	83.5	Confident	84.3	Confident	21 Å²	21	69 Å²	69	17%	0.174	40%	0.398	C	S	.	.			trans	-70.9	136.6	172.4	0	0	0	0	0	111.2	L61 V62 D91 V99	L61-A94 WeakPolarHBondContact CA-O 3.25Å; V62-A94 HydrophobicContact CG2-CB 4.33Å; V62-A94 PolarHBondContact N-O 3.43Å; D91-A94 HydrophobicContact CB-CB 4.21Å; D91-A94 PolarHBondContact O-N 3.46Å; A94-V99 HydrophobicContact CB-CG2 4.24Å
95	E	83.2	Confident	83.8	Confident	73 Å²	73	70.3 Å²	70.3	34%	0.341	42%	0.417	S	S	.	.	B	Isolated β-bridge	trans	-69.2	141.3	162	-61.4	-178.7	121.8	0	0	109.3	L61 K97 S98	L61-E95 HydrophobicContact CD2-CB 4.33Å; L61-E95 HydrophobicContact CD2-CG 3.74Å; E95-K97 VanDerWaalsContact C-N 3.27Å; E95-K97 HydrophobicContact CB-CG 4.19Å; E95-K97 PolarHBondContact O-N 3.16Å; E95-K97 IonicContact OE1-NZ 2.74Å; E95-K97 PolarHBondContact OE1-NZ 3.1Å; E95-K97 WeakPolarHBondContact OE2-CE 3.37Å; E95-K97 IonicContact OE2-NZ 2.67Å; E95-K97 PolarHBondContact OE2-NZ 3.47Å; E95-S98 PolarHBondContact N-OG 3.29Å; E95-S98 WeakPolarHBondContact O-CA 3.39Å; E95-S98 WeakPolarHBondContact O-CB 3.46Å; E95-S98 PolarHBondContact O-N 3.31Å; E95-S98 PolarHBondContact O-OG 3.4Å
96	L	82.8	Confident	83.8	Confident	1 Å²	1	71.4 Å²	71.4	1%	0.005	42%	0.423	C	S	.	.	G	3₁₀ helix	trans	-59.7	-34.7	-177.6	-73.5	173.5	0	0	0	113.2	V56 E60 V62 I65 S98 V99 L102	V56-L96 HydrophobicContact CB-CD1 3.73Å; V56-L96 HydrophobicContact CG1-CD1 4.42Å; V56-L96 HydrophobicContact CG2-CD1 3.67Å; E60-L96 HydrophobicContact CB-CD1 3.99Å; E60-L96 WeakPolarHBondContact O-CG 3.41Å; E60-L96 PolarHBondContact O-N 2.89Å; V62-L96 HydrophobicContact CG2-CD2 3.98Å; I65-L96 HydrophobicContact CD1-CD1 3.96Å; I65-L96 HydrophobicContact CD1-CD2 3.89Å; I65-L96 HydrophobicContact CG1-CD1 4.42Å; L96-S98 PolarHBondContact O-N 3.13Å; L96-V99 WeakPolarHBondContact O-CB 3.2Å; L96-V99 PolarHBondContact O-N 3.25Å; L96-V99 VanDerWaalsContact O-N 3.15Å; L96-L102 HydrophobicContact CB-CD2 3.62Å; L96-L102 HydrophobicContact CD2-CD2 3.94Å; L96-L102 HydrophobicContact CG-CD2 4.29Å; L96-L102 VanDerWaalsContact O-CD2 3.26Å; L96-L102 WeakPolarHBondContact O-CD2 3.3Å
97	K	82.2	Confident	84	Confident	95 Å²	95	68.8 Å²	68.8	41%	0.413	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-63.6	-16.4	171.9	68.1	174.2	-175	-81.2	0	115.3	S58 F59 E95	S58-K97 VanDerWaalsContact O-CB 3.26Å; S58-K97 WeakPolarHBondContact O-CB 3.29Å; S58-K97 WeakPolarHBondContact O-CG 3.33Å; S58-K97 PolarHBondContact O-N 3.15Å; F59-K97 HydrophobicContact CE1-CD 4.32Å; E95-K97 VanDerWaalsContact C-N 3.27Å; E95-K97 HydrophobicContact CB-CG 4.19Å; E95-K97 PolarHBondContact O-N 3.16Å; E95-K97 IonicContact OE1-NZ 2.74Å; E95-K97 PolarHBondContact OE1-NZ 3.1Å; E95-K97 WeakPolarHBondContact OE2-CE 3.37Å; E95-K97 IonicContact OE2-NZ 2.67Å; E95-K97 PolarHBondContact OE2-NZ 3.47Å
98	S	82.9	Confident	84.2	Confident	74 Å²	74	65.5 Å²	65.5	52%	0.517	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-93.8	-4	177	72.7	0	0	0	0	113.6	E95 L96 D100	E95-S98 PolarHBondContact N-OG 3.29Å; E95-S98 WeakPolarHBondContact O-CA 3.39Å; E95-S98 WeakPolarHBondContact O-CB 3.46Å; E95-S98 PolarHBondContact O-N 3.31Å; E95-S98 PolarHBondContact O-OG 3.4Å; L96-S98 PolarHBondContact O-N 3.13Å; S98-D100 PolarHBondContact O-N 3.12Å
99	V	82.7	Confident	84.4	Confident	18 Å²	18	63.3 Å²	63.3	11%	0.109	36%	0.361	C	S	.	.	S	Bend	trans	-84.1	108	-178.4	175.8	0	0	0	0	110.6	V62 L85 L90 A94 L96 G101 L102	V62-V99 HydrophobicContact CG2-CG2 4.38Å; L85-V99 HydrophobicContact CD2-CG1 3.48Å; L85-V99 VanDerWaalsContact CD2-CG1 3.48Å; L90-V99 HydrophobicContact CD2-CG1 3.47Å; L90-V99 VanDerWaalsContact CD2-CG1 3.47Å; L90-V99 HydrophobicContact CD2-CG2 4.29Å; A94-V99 HydrophobicContact CB-CG2 4.24Å; L96-V99 WeakPolarHBondContact O-CB 3.2Å; L96-V99 PolarHBondContact O-N 3.25Å; L96-V99 VanDerWaalsContact O-N 3.15Å; V99-G101 PolarHBondContact O-N 3.31Å; V99-G101 VanDerWaalsContact O-N 3.15Å; V99-L102 HydrophobicContact CB-CB 4.19Å; V99-L102 HydrophobicContact CG1-CB 4.22Å; V99-L102 WeakPolarHBondContact O-CB 3.37Å; V99-L102 PolarHBondContact O-N 3.04Å; V99-L102 VanDerWaalsContact O-N 3.08Å
100	D	80.3	Confident	84.5	Confident	159 Å²	159	59.7 Å²	59.7	85%	0.85	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	117.3	177.2	-93.6	-31	0	0	0	112.2	S98	S98-D100 PolarHBondContact O-N 3.12Å
101	G	77	Confident	84.6	Confident	51 Å²	51	61.6 Å²	61.6	53%	0.526	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.7	12.6	178.3	0	0	0	0	0	115.6	V99	V99-G101 PolarHBondContact O-N 3.31Å; V99-G101 VanDerWaalsContact O-N 3.15Å
102	L	76.6	Confident	84.8	Confident	23 Å²	23	60.1 Å²	60.1	12%	0.12	34%	0.341	C	S	.	.			trans	-70.7	136.2	164.1	-168.4	71.2	0	0	0	110.6	Y40 V42 L96 V99 V106	Y40-L102 HydrophobicContact CD2-CD2 3.7Å; Y40-L102 HydrophobicContact CD2-CG 4.29Å; Y40-L102 HydrophobicContact CE2-CD2 3.91Å; Y40-L102 HydrophobicContact CG-CD2 4.47Å; V42-L102 HydrophobicContact CG2-CD1 4.11Å; L96-L102 HydrophobicContact CB-CD2 3.62Å; L96-L102 HydrophobicContact CD2-CD2 3.94Å; L96-L102 HydrophobicContact CG-CD2 4.29Å; L96-L102 VanDerWaalsContact O-CD2 3.26Å; L96-L102 WeakPolarHBondContact O-CD2 3.3Å; V99-L102 HydrophobicContact CB-CB 4.19Å; V99-L102 HydrophobicContact CG1-CB 4.22Å; V99-L102 WeakPolarHBondContact O-CB 3.37Å; V99-L102 PolarHBondContact O-N 3.04Å; V99-L102 VanDerWaalsContact O-N 3.08Å; L102-V106 HydrophobicContact CD1-CG1 4.31Å
103	A	79.9	Confident	85.2	Confident	45 Å²	45	59.8 Å²	59.8	37%	0.372	34%	0.339	S	S	.	.			trans	-159.5	169.6	177.8	0	0	0	0	0	110	V106	A103-V106 HydrophobicContact CB-CG2 3.91Å; A103-V106 VanDerWaalsContact O-CB 3.28Å; A103-V106 WeakPolarHBondContact O-CB 3.23Å; A103-V106 VanDerWaalsContact O-CG2 3.25Å; A103-V106 WeakPolarHBondContact O-CG2 3.45Å; A103-V106 PolarHBondContact O-N 2.76Å
104	D	82	Confident	85.8	Confident	109 Å²	109	64 Å²	64	58%	0.583	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	134.9	174	-168	50.7	0	0	0	111.4	T41	T41-D104 WeakPolarHBondContact CA-OD1 3.29Å; T41-D104 WeakPolarHBondContact CB-OD1 3.39Å; T41-D104 PolarHBondContact N-OD1 2.9Å; T41-D104 PolarHBondContact OG1-OD1 2.93Å
105	G	83.2	Confident	86.3	Confident	50 Å²	50	63.1 Å²	63.1	52%	0.515	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.5	3.5	-176.2	0	0	0	0	0	116.3	T41	T41-G105 WeakPolarHBondContact O-CA 3.43Å; T41-G105 PolarHBondContact O-N 2.63Å
106	V	89	Confident	86.8	Confident	27 Å²	27	62.1 Å²	62.1	16%	0.164	34%	0.344	C	S	.	.			trans	-67.2	141.4	-177.5	160.7	0	0	0	0	113.1	K43 L85 L102 A103	K43-V106 PolarHBondContact N-O 2.7Å; L85-V106 HydrophobicContact CD1-CG1 3.28Å; L102-V106 HydrophobicContact CD1-CG1 4.31Å; A103-V106 HydrophobicContact CB-CG2 3.91Å; A103-V106 VanDerWaalsContact O-CB 3.28Å; A103-V106 WeakPolarHBondContact O-CB 3.23Å; A103-V106 VanDerWaalsContact O-CG2 3.25Å; A103-V106 WeakPolarHBondContact O-CG2 3.45Å; A103-V106 PolarHBondContact O-N 2.76Å
107	E	90.8	Very high	87.1	Confident	81 Å²	81	65.3 Å²	65.3	38%	0.379	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	114.9	177.2	-62.8	-165.7	152.8	0	0	112.6	K43 I45	K43-E107 HydrophobicContact CB-CG 4.48Å; K43-E107 HydrophobicContact CD-CG 4.12Å; K43-E107 WeakPolarHBondContact CE-OE1 3.17Å; K43-E107 IonicContact NZ-OE1 2.78Å; K43-E107 PolarHBondContact NZ-OE1 3.3Å; K43-E107 WeakPolarHBondContact O-CA 3.4Å; I45-E107 HydrophobicContact CD1-CB 3.99Å; I45-E107 HydrophobicContact CD1-CG 4.12Å; I45-E107 WeakPolarHBondContact CD1-OE2 3.36Å
108	L	90.6	Very high	87.2	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	127.7	166.4	-68.5	-172.7	0	0	0	110.5	V42 K43 I44 I45 I65 L83 L85 L90	V42-L108 HydrophobicContact CG1-CB 4.13Å; V42-L108 HydrophobicContact CG1-CD1 3.62Å; V42-L108 HydrophobicContact CG1-CG 3.54Å; K43-L108 PolarHBondContact O-N 3.21Å; I44-L108 CarbonylContact C-O 3.5Å; I44-L108 WeakPolarHBondContact CA-O 3.48Å; I44-L108 HydrophobicContact CD1-CB 4.25Å; I44-L108 HydrophobicContact CD1-CD1 4.48Å; I45-L108 PolarHBondContact N-O 3.19Å; I65-L108 HydrophobicContact CD1-CD1 4.06Å; L83-L108 HydrophobicContact CD1-CD1 4.45Å; L85-L108 HydrophobicContact CB-CD2 3.67Å; L85-L108 HydrophobicContact CD1-CD2 4.07Å; L85-L108 HydrophobicContact CG-CD2 4.3Å; L90-L108 HydrophobicContact CD1-CD1 4.15Å; L90-L108 HydrophobicContact CD1-CD2 3.83Å
109	K	92.1	Very high	87.6	Confident	101 Å²	101	65.6 Å²	65.6	44%	0.439	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	127.1	179.2	-70.8	169.2	-174.8	170.3	0	110.2	I45 V84 V111	I45-K109 HydrophobicContact CB-CG 4.06Å; I45-K109 HydrophobicContact CD1-CG 4.07Å; I45-K109 HydrophobicContact CG2-CG 4.39Å; V84-K109 HydrophobicContact CB-CB 4.48Å; V84-K109 PolarHBondContact N-O 3.43Å; V84-K109 PolarHBondContact O-N 3.23Å; K109-V111 HydrophobicContact CB-CG2 4.5Å
110	V	91.1	Very high	88	Confident	13 Å²	13	64.8 Å²	64.8	8%	0.079	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	117	170.6	-175.5	0	0	0	0	107.4	I44 I45 T47 L69 F81 L83	I44-V110 HydrophobicContact CG2-CG2 3.76Å; I45-V110 PolarHBondContact O-N 3.31Å; T47-V110 PolarHBondContact OG1-O 2.76Å; L69-V110 HydrophobicContact CD1-CG2 4.01Å; F81-V110 HydrophobicContact CB-CG1 3.72Å; F81-V110 HydrophobicContact CD1-CG1 4.42Å; F81-V110 HydrophobicContact CD2-CG1 3.74Å; F81-V110 HydrophobicContact CE2-CG1 4.48Å; F81-V110 HydrophobicContact CG-CG1 3.71Å; L83-V110 HydrophobicContact CD2-CG2 4.03Å
111	V	92	Very high	88.4	Confident	59 Å²	59	60.2 Å²	60.2	36%	0.358	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	129.1	-179.2	178.5	0	0	0	0	109.4	F81 S82 V84 K109 E113	F81-V111 CarbonylContact C-O 3.58Å; F81-V111 WeakPolarHBondContact CA-O 3.39Å; F81-V111 VanDerWaalsContact CB-O 3.27Å; F81-V111 WeakPolarHBondContact CB-O 3.25Å; S82-V111 PolarHBondContact N-O 3.3Å; S82-V111 PolarHBondContact O-N 3.13Å; V84-V111 HydrophobicContact CB-CG2 4.04Å; V84-V111 HydrophobicContact CG2-CB 4.1Å; V84-V111 HydrophobicContact CG2-CG2 3.6Å; K109-V111 HydrophobicContact CB-CG2 4.5Å; V111-E113 PolarHBondContact O-N 3.24Å
112	E	92.5	Very high	88.8	Confident	71 Å²	71	60.3 Å²	60.3	33%	0.332	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	122.1	178.8	-77.8	-179.4	-179.4	0	0	112.1	T47 H48 H272	T47-E112 HydrophobicContact CG2-CG 4.15Å; H48-E112 IonicContact CE1-OE1 3.55Å; H48-E112 IonicContact NE2-OE1 2.7Å; E112-H272 VanDerWaalsContact CD-CB 3.4Å; E112-H272 VanDerWaalsContact CD-CG 3.44Å; E112-H272 HydrophobicContact CG-CB 4.26Å; E112-H272 WeakPolarHBondContact OE1-CB 3.34Å; E112-H272 IonicContact OE1-CG 2.71Å; E112-H272 WeakPolarHBondContact OE2-CB 3.48Å; E112-H272 IonicContact OE2-CD2 2.91Å; E112-H272 IonicContact OE2-CG 3.11Å
113	E	92.8	Very high	89.5	Confident	76 Å²	76	59.2 Å²	59.2	36%	0.355	30%	0.304	S	S	.	.			trans	-98.1	164.8	179	-74.5	-60.2	164	0	0	113.1	C80 S82 V111 Y115 H272	C80-E113 PolarHBondContact O-N 2.91Å; C80-E113 PolarHBondContact SG-O 3.44Å; S82-E113 WeakPolarHBondContact CB-OE1 3.35Å; S82-E113 PolarHBondContact OG-OE1 3.05Å; V111-E113 PolarHBondContact O-N 3.24Å; E113-Y115 PolarHBondContact O-N 3.15Å; E113-H272 PolarHBondContact O-NE2 3.3Å
114	R	94.1	Very high	90	Very high	197 Å²	197	57.4 Å²	57.4	74%	0.743	29%	0.288	S	S	*	.			trans	-85.5	111	-178	-64.6	-171.8	-174.4	169.6	4.6	112.2	S116 P247	R114-S116 PolarHBondContact O-N 3.26Å; R114-P247 WeakPolarHBondContact CA-O 3.43Å; R114-P247 HydrophobicContact CB-CB 4.29Å; R114-P247 WeakPolarHBondContact CB-O 3.4Å; R114-P247 WeakPolarHBondContact CG-O 3.06Å
115	Y	94.6	Very high	90.2	Very high	3 Å²	3	54.2 Å²	54.2	1%	0.012	27%	0.268	C	S	.	.			trans	-48.9	124.2	173.3	-65.2	-84.9	0	0	0	113.5	C80 E113 E119 A120 H123 L228 P247 F250 H272	C80-Y115 HydrophobicContact CB-CD1 3.69Å; C80-Y115 HydrophobicContact CB-CE1 3.26Å; C80-Y115 HydrophobicContact CB-CE2 4.25Å; C80-Y115 HydrophobicContact CB-CG 4.34Å; E113-Y115 PolarHBondContact O-N 3.15Å; Y115-E119 HydrophobicContact CD1-CB 3.85Å; Y115-A120 HydrophobicContact CD1-CB 4.32Å; Y115-H123 HydrophobicContact CE1-CB 3.88Å; Y115-H123 AromaticContact CE1-CG 3.92Å; Y115-H123 PolarHBondContact OH-CE1 3.49Å; Y115-H123 PolarHBondContact OH-ND1 3.07Å; Y115-L228 VanDerWaalsContact O-CD1 3.28Å; Y115-L228 WeakPolarHBondContact O-CD1 3.09Å; Y115-P247 WeakPolarHBondContact O-CA 3.48Å; Y115-F250 HydrophobicContact CE1-CE2 4.22Å; Y115-F250 HydrophobicContact CE1-CZ 4.45Å; Y115-F250 HydrophobicContact CE2-CE2 4.09Å; Y115-F250 AromaticContact CZ-CE2 3.87Å; Y115-H272 AromaticContact CE2-CD2 3.87Å; Y115-H272 AromaticContact CE2-CE1 3.34Å; Y115-H272 WeakPolarHBondContact CE2-CE1 3.34Å; Y115-H272 AromaticContact CE2-CG 3.98Å; Y115-H272 AromaticContact CE2-ND1 3.64Å; Y115-H272 AromaticContact CE2-NE2 3.47Å; Y115-H272 WeakPolarHBondContact CE2-NE2 3.2Å; Y115-H272 VanDerWaalsContact CE2-O 3.23Å; Y115-H272 WeakPolarHBondContact CE2-O 3.23Å; Y115-H272 AromaticContact CZ-CE1 3.49Å; Y115-H272 VanDerWaalsContact CZ-CE1 3.49Å; Y115-H272 AromaticContact CZ-ND1 3.78Å; Y115-H272 PolarHBondContact OH-CE1 2.91Å; Y115-H272 PolarHBondContact OH-ND1 3.38Å; Y115-H272 VanDerWaalsContact OH-ND1 3.15Å; Y115-H272 PolarHBondContact OH-O 3.3Å; Y115-H272 VanDerWaalsContact OH-O 3.07Å
116	S	93.4	Very high	90.5	Very high	51 Å²	51	53 Å²	53	36%	0.357	25%	0.249	S	C	.	.			trans	-83.9	-177.1	152.1	81.5	0	0	0	0	110.5	R114 R118 E119 A120	R114-S116 PolarHBondContact O-N 3.26Å; S116-R118 PolarHBondContact O-N 3.42Å; S116-R118 PolarHBondContact OG-N 3.34Å; S116-E119 WeakPolarHBondContact CA-OE2 3.42Å; S116-E119 WeakPolarHBondContact CB-OE2 3.5Å; S116-E119 PolarHBondContact N-OE2 2.89Å; S116-E119 PolarHBondContact OG-OE2 3.4Å; S116-A120 VanDerWaalsContact O-CB 3.24Å; S116-A120 WeakPolarHBondContact O-CB 3.24Å; S116-A120 PolarHBondContact O-N 2.73Å
117	V	89.5	Confident	90.5	Very high	69 Å²	69	51.7 Å²	51.7	42%	0.418	24%	0.241	S	C	.	.	H	α-helix	trans	-63.6	-30.6	171.7	-176.9	0	0	0	0	111.4	K121 L228 I229	V117-K121 WeakPolarHBondContact O-CG 3.31Å; V117-K121 PolarHBondContact O-N 2.89Å; V117-L228 HydrophobicContact CG2-CB 4.27Å; V117-L228 HydrophobicContact CG2-CD2 3.81Å; V117-I229 HydrophobicContact CG1-CG2 4.42Å
118	R	85.2	Confident	90.4	Very high	106 Å²	106	49.2 Å²	49.2	40%	0.4	23%	0.229	S	C	.	.	H	α-helix	trans	-68.7	-55.1	178.8	-174.6	179.3	178	-177.3	-3.1	110.8	S116 A120 K121 N122 N341	S116-R118 PolarHBondContact O-N 3.42Å; S116-R118 PolarHBondContact OG-N 3.34Å; R118-A120 VanDerWaalsContact C-N 3.31Å; R118-A120 PolarHBondContact O-N 3.49Å; R118-K121 PolarHBondContact O-N 3.49Å; R118-N122 PolarHBondContact O-N 3.14Å; R118-N122 PolarHBondContact O-OD1 3.09Å; R118-N341 PolarHBondContact NH2-O 2.88Å
119	E	90.5	Very high	90	Very high	69 Å²	69	52.8 Å²	52.8	32%	0.322	25%	0.249	S	C	.	.	H	α-helix	trans	-64.5	-35.5	178.8	-61.5	109.9	146.8	0	0	112.1	C80 Y115 S116 K121 N122 H123	C80-E119 HydrophobicContact CB-CB 4.17Å; Y115-E119 HydrophobicContact CD1-CB 3.85Å; S116-E119 WeakPolarHBondContact CA-OE2 3.42Å; S116-E119 WeakPolarHBondContact CB-OE2 3.5Å; S116-E119 PolarHBondContact N-OE2 2.89Å; S116-E119 PolarHBondContact OG-OE2 3.4Å; E119-K121 VanDerWaalsContact C-N 3.32Å; E119-K121 PolarHBondContact O-N 2.72Å; E119-N122 PolarHBondContact O-N 2.89Å; E119-H123 VanDerWaalsContact O-CB 3.24Å; E119-H123 WeakPolarHBondContact O-CB 3.09Å; E119-H123 PolarHBondContact O-N 2.93Å
120	A	91.7	Very high	89.8	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.6	-36.9	178.3	0	0	0	0	0	112.6	Y115 S116 R118 V124 L228 I229 A245	Y115-A120 HydrophobicContact CD1-CB 4.32Å; S116-A120 VanDerWaalsContact O-CB 3.24Å; S116-A120 WeakPolarHBondContact O-CB 3.24Å; S116-A120 PolarHBondContact O-N 2.73Å; R118-A120 VanDerWaalsContact C-N 3.31Å; R118-A120 PolarHBondContact O-N 3.49Å; A120-V124 VanDerWaalsContact O-CG2 3.31Å; A120-V124 WeakPolarHBondContact O-CG2 3.17Å; A120-V124 PolarHBondContact O-N 2.87Å; A120-L228 HydrophobicContact CB-CD1 4.19Å; A120-I229 HydrophobicContact CB-CD1 4.02Å; A120-I229 HydrophobicContact CB-CG1 4.22Å; A120-A245 HydrophobicContact CB-CB 4.37Å
121	K	88.2	Confident	89.6	Confident	64 Å²	64	48.4 Å²	48.4	28%	0.278	23%	0.23	S	C	.	.	H	α-helix	trans	-69	-49.5	172	-72.8	-170.7	176.9	-158.8	0	111.9	V117 R118 E119 H123 V124 R125 E329	V117-K121 WeakPolarHBondContact O-CG 3.31Å; V117-K121 PolarHBondContact O-N 2.89Å; R118-K121 PolarHBondContact O-N 3.49Å; E119-K121 VanDerWaalsContact C-N 3.32Å; E119-K121 PolarHBondContact O-N 2.72Å; K121-H123 PolarHBondContact O-N 2.97Å; K121-V124 PolarHBondContact O-N 3.45Å; K121-R125 PolarHBondContact O-N 3.15Å; K121-E329 WeakPolarHBondContact CE-OE1 3.46Å; K121-E329 IonicContact NZ-OE1 3.82Å; K121-E329 PolarHBondContact NZ-OE1 2.71Å
122	N	85.3	Confident	89.1	Confident	52 Å²	52	49 Å²	49	28%	0.278	23%	0.228	S	C	.	.	H	α-helix	trans	-60.4	-35.9	-178.9	-71.4	9.4	0	0	0	111.6	R118 E119 R125 H126	R118-N122 PolarHBondContact O-N 3.14Å; R118-N122 PolarHBondContact O-OD1 3.09Å; E119-N122 PolarHBondContact O-N 2.89Å; N122-R125 PolarHBondContact O-N 3.11Å; N122-R125 PolarHBondContact OD1-NH1 3.19Å; N122-H126 WeakPolarHBondContact O-CB 3.5Å; N122-H126 PolarHBondContact O-N 2.98Å
123	H	91.4	Very high	88.6	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.4	-43.4	172.4	-171.9	75.8	0	0	0	112.9	S77 T79 Y115 E119 K121 I127 F250 L274	S77-H123 PolarHBondContact O-CE1 3.47Å; T79-H123 WeakPolarHBondContact OG1-CB 3.49Å; T79-H123 PolarHBondContact OG1-ND1 3.42Å; Y115-H123 HydrophobicContact CE1-CB 3.88Å; Y115-H123 AromaticContact CE1-CG 3.92Å; Y115-H123 PolarHBondContact OH-CE1 3.49Å; Y115-H123 PolarHBondContact OH-ND1 3.07Å; E119-H123 VanDerWaalsContact O-CB 3.24Å; E119-H123 WeakPolarHBondContact O-CB 3.09Å; E119-H123 PolarHBondContact O-N 2.93Å; K121-H123 PolarHBondContact O-N 2.97Å; H123-I127 VanDerWaalsContact NE2-CD1 3.32Å; H123-I127 WeakPolarHBondContact NE2-CD1 3.41Å; H123-I127 WeakPolarHBondContact O-CB 3.4Å; H123-I127 VanDerWaalsContact O-CG1 3.26Å; H123-I127 WeakPolarHBondContact O-CG1 3.37Å; H123-I127 PolarHBondContact O-N 3.17Å; H123-F250 AromaticContact CD2-CE2 3.36Å; H123-F250 WeakPolarHBondContact CD2-CE2 3.27Å; H123-F250 AromaticContact CD2-CZ 3.41Å; H123-F250 VanDerWaalsContact CD2-CZ 3.41Å; H123-F250 WeakPolarHBondContact CD2-CZ 3.42Å; H123-F250 AromaticContact NE2-CE2 3.66Å; H123-L274 PolarHBondContact NE2-N 3.34Å
124	V	90.8	Very high	88	Confident	7 Å²	7	45.8 Å²	45.8	4%	0.042	22%	0.219	C	C	.	.	H	α-helix	trans	-65.9	-39.7	177.1	169.7	0	0	0	0	111.2	A120 K121 I127 H128 I229 L231 F250 L274	A120-V124 VanDerWaalsContact O-CG2 3.31Å; A120-V124 WeakPolarHBondContact O-CG2 3.17Å; A120-V124 PolarHBondContact O-N 2.87Å; K121-V124 PolarHBondContact O-N 3.45Å; V124-I127 PolarHBondContact O-N 3.43Å; V124-H128 PolarHBondContact O-N 3.38Å; V124-I229 HydrophobicContact CG2-CD1 4Å; V124-L231 HydrophobicContact CG1-CD2 4.24Å; V124-L231 HydrophobicContact CG2-CD1 3.67Å; V124-L231 HydrophobicContact CG2-CD2 4.11Å; V124-L231 HydrophobicContact CG2-CG 4.49Å; V124-F250 HydrophobicContact CG2-CE1 4.42Å; V124-L274 HydrophobicContact CG2-CD2 4.11Å
125	R	86	Confident	87.3	Confident	42 Å²	42	39 Å²	39	16%	0.158	20%	0.195	C	C	.	.	H	α-helix	trans	-63.9	-54.2	173.7	-173	-179.6	-61	113.4	6.4	111.6	K121 N122 I127 H128 D129 V326 E340	K121-R125 PolarHBondContact O-N 3.15Å; N122-R125 PolarHBondContact O-N 3.11Å; N122-R125 PolarHBondContact OD1-NH1 3.19Å; R125-I127 PolarHBondContact O-N 3.14Å; R125-I127 VanDerWaalsContact O-N 3.09Å; R125-H128 CarbonylContact O-C 3.49Å; R125-H128 VanDerWaalsContact O-CA 3.32Å; R125-H128 WeakPolarHBondContact O-CA 3.3Å; R125-H128 WeakPolarHBondContact O-CB 3.46Å; R125-H128 PolarHBondContact O-N 3.16Å; R125-D129 PolarHBondContact O-N 3.4Å; R125-V326 HydrophobicContact CB-CG1 4.49Å; R125-V326 HydrophobicContact CG-CG1 4.17Å; R125-E340 IonicContact CZ-OE2 3.88Å; R125-E340 IonicContact NH1-OE2 2.66Å; R125-E340 PolarHBondContact NH1-OE2 3.35Å; R125-E340 VanDerWaalsContact NH2-CD 3.26Å; R125-E340 IonicContact NH2-OE1 3.97Å; R125-E340 PolarHBondContact NH2-OE1 2.76Å; R125-E340 VanDerWaalsContact NH2-OE1 3.1Å; R125-E340 IonicContact NH2-OE2 2.77Å; R125-E340 PolarHBondContact NH2-OE2 3.3Å
126	H	88.2	Confident	86.6	Confident	24 Å²	24	41.3 Å²	41.3	11%	0.111	21%	0.211	C	C	.	.	H	α-helix	trans	-54.1	-35.5	177.8	179.9	83.9	0	0	0	112.7	M70 C76 T79 N122 D129 L130	M70-H126 HydrophobicContact CE-CB 4.41Å; M70-H126 WeakPolarHBondContact CE-ND1 3.09Å; M70-H126 PolarHBondContact O-CE1 3.03Å; M70-H126 VanDerWaalsContact O-CE1 3.32Å; C76-H126 PolarHBondContact O-CD2 3.38Å; C76-H126 PolarHBondContact O-NE2 2.97Å; T79-H126 HydrophobicContact CG2-CB 4.11Å; T79-H126 WeakPolarHBondContact CG2-CD2 3.5Å; N122-H126 WeakPolarHBondContact O-CB 3.5Å; N122-H126 PolarHBondContact O-N 2.98Å; H126-D129 PolarHBondContact O-N 3.41Å; H126-L130 WeakPolarHBondContact O-CB 3.48Å; H126-L130 VanDerWaalsContact O-CG 3.28Å; H126-L130 WeakPolarHBondContact O-CG 3.25Å; H126-L130 PolarHBondContact O-N 3.49Å
127	I	90.7	Very high	86.1	Confident	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-69.6	-39.2	173.4	-72.1	172.3	0	0	0	112.3	H123 V124 R125 L131 L210 L274 I275	H123-I127 VanDerWaalsContact NE2-CD1 3.32Å; H123-I127 WeakPolarHBondContact NE2-CD1 3.41Å; H123-I127 WeakPolarHBondContact O-CB 3.4Å; H123-I127 VanDerWaalsContact O-CG1 3.26Å; H123-I127 WeakPolarHBondContact O-CG1 3.37Å; H123-I127 PolarHBondContact O-N 3.17Å; V124-I127 PolarHBondContact O-N 3.43Å; R125-I127 PolarHBondContact O-N 3.14Å; R125-I127 VanDerWaalsContact O-N 3.09Å; I127-L131 HydrophobicContact CG2-CD1 4.21Å; I127-L131 WeakPolarHBondContact O-CB 3.41Å; I127-L131 WeakPolarHBondContact O-CG 3.03Å; I127-L131 PolarHBondContact O-N 3.35Å; I127-L210 HydrophobicContact CG2-CD2 4.01Å; I127-L274 HydrophobicContact CD1-CB 3.63Å; I127-L274 HydrophobicContact CD1-CD2 4.03Å; I127-L274 HydrophobicContact CD1-CG 4.08Å; I127-I275 HydrophobicContact CD1-CD1 4.09Å; I127-I275 HydrophobicContact CD1-CG1 3.85Å; I127-I275 HydrophobicContact CG1-CD1 3.7Å; I127-I275 HydrophobicContact CG1-CG1 3.91Å; I127-I275 HydrophobicContact CG2-CG1 4.31Å
128	H	87.2	Confident	85.9	Confident	29 Å²	29	42.5 Å²	42.5	13%	0.134	21%	0.205	C	C	.	.	H	α-helix	trans	-61.3	-47.7	171.8	-169.4	-102	0	0	0	110.8	V124 R125 L130 L131 H132 D324 V326	V124-H128 PolarHBondContact O-N 3.38Å; R125-H128 CarbonylContact O-C 3.49Å; R125-H128 VanDerWaalsContact O-CA 3.32Å; R125-H128 WeakPolarHBondContact O-CA 3.3Å; R125-H128 WeakPolarHBondContact O-CB 3.46Å; R125-H128 PolarHBondContact O-N 3.16Å; H128-L130 PolarHBondContact O-N 2.93Å; H128-L131 WeakPolarHBondContact O-CB 3.1Å; H128-L131 PolarHBondContact O-N 3.49Å; H128-L131 VanDerWaalsContact O-N 3.07Å; H128-H132 AromaticContact CD2-CD2 3.87Å; H128-H132 AromaticContact CE1-CD2 3.69Å; H128-H132 AromaticContact ND1-CD2 3.9Å; H128-H132 AromaticContact NE2-CD2 3.68Å; H128-H132 AromaticContact NE2-NE2 3.65Å; H128-H132 PolarHBondContact O-CD2 3.47Å; H128-H132 VanDerWaalsContact O-CD2 3.24Å; H128-H132 PolarHBondContact O-N 3.44Å; H128-D324 IonicContact CE1-OD1 3Å; H128-D324 IonicContact CE1-OD2 3.67Å; H128-D324 PolarHBondContact CE1-OD2 2.8Å; H128-D324 IonicContact NE2-OD1 3.18Å; H128-D324 IonicContact NE2-OD2 3.17Å; H128-V326 HydrophobicContact CB-CG1 4.49Å; H128-V326 HydrophobicContact CB-CG2 4.01Å
129	D	82.5	Confident	86	Confident	75 Å²	75	38 Å²	38	40%	0.401	19%	0.191	S	C	.	.	H	α-helix	trans	-60.8	-45.3	178.8	-51.9	-24.8	0	0	0	110.8	R125 H126 L131 H132 S133	R125-D129 PolarHBondContact O-N 3.4Å; H126-D129 PolarHBondContact O-N 3.41Å; D129-L131 VanDerWaalsContact C-N 3.33Å; D129-L131 PolarHBondContact O-N 3.01Å; D129-H132 CarbonylContact O-C 3.55Å; D129-H132 PolarHBondContact O-N 3.22Å; D129-S133 WeakPolarHBondContact O-CA 3.28Å; D129-S133 VanDerWaalsContact O-CB 3.22Å; D129-S133 WeakPolarHBondContact O-CB 3.31Å; D129-S133 PolarHBondContact O-N 3.3Å
130	L	87.8	Confident	86	Confident	6 Å²	6	35.1 Å²	35.1	3%	0.031	18%	0.177	C	C	.	.	H	α-helix	trans	-57.9	-43.9	172.6	-78.3	175.2	0	0	0	112.2	C76 H126 H128 H132 S133 I275 L292	C76-L130 HydrophobicContact CB-CD1 3.99Å; C76-L130 HydrophobicContact CB-CD2 4.07Å; C76-L130 WeakPolarHBondContact O-CD1 3.26Å; H126-L130 WeakPolarHBondContact O-CB 3.48Å; H126-L130 VanDerWaalsContact O-CG 3.28Å; H126-L130 WeakPolarHBondContact O-CG 3.25Å; H126-L130 PolarHBondContact O-N 3.49Å; H128-L130 PolarHBondContact O-N 2.93Å; L130-H132 VanDerWaalsContact C-N 3.26Å; L130-H132 PolarHBondContact O-N 3.02Å; L130-S133 PolarHBondContact O-N 3.06Å; L130-S133 PolarHBondContact O-OG 3.16Å; L130-I275 HydrophobicContact CD1-CD1 4.05Å; L130-L292 WeakPolarHBondContact O-CD2 3.29Å
131	L	87.6	Confident	85.8	Confident	17 Å²	17	36.3 Å²	36.3	9%	0.089	19%	0.187	C	C	.	.	H	α-helix	trans	-64	-30	179.2	-76	176.1	0	0	0	113.3	I127 H128 D129 C206 V207 L210 F285 F289 L292	I127-L131 HydrophobicContact CG2-CD1 4.21Å; I127-L131 WeakPolarHBondContact O-CB 3.41Å; I127-L131 WeakPolarHBondContact O-CG 3.03Å; I127-L131 PolarHBondContact O-N 3.35Å; H128-L131 WeakPolarHBondContact O-CB 3.1Å; H128-L131 PolarHBondContact O-N 3.49Å; H128-L131 VanDerWaalsContact O-N 3.07Å; D129-L131 VanDerWaalsContact C-N 3.33Å; D129-L131 PolarHBondContact O-N 3.01Å; L131-C206 HydrophobicContact CD2-CB 3.62Å; L131-V207 HydrophobicContact CD1-CG1 4.19Å; L131-V207 HydrophobicContact CD1-CG2 4.38Å; L131-L210 HydrophobicContact CD1-CD2 4.19Å; L131-F285 HydrophobicContact CD2-CE2 4.02Å; L131-F289 HydrophobicContact CD2-CD2 3.99Å; L131-F289 HydrophobicContact CD2-CE2 4.27Å; L131-L292 HydrophobicContact CD2-CD2 4.23Å
132	H	82.2	Confident	85.7	Confident	70 Å²	70	33.2 Å²	33.2	32%	0.324	17%	0.173	S	C	.	.	H	α-helix	trans	-102.4	-7.7	-179.6	-69.2	-71.5	0	0	0	114	H128 D129 L130 I134 E135	H128-H132 AromaticContact CD2-CD2 3.87Å; H128-H132 AromaticContact CE1-CD2 3.69Å; H128-H132 AromaticContact ND1-CD2 3.9Å; H128-H132 AromaticContact NE2-CD2 3.68Å; H128-H132 AromaticContact NE2-NE2 3.65Å; H128-H132 PolarHBondContact O-CD2 3.47Å; H128-H132 VanDerWaalsContact O-CD2 3.24Å; H128-H132 PolarHBondContact O-N 3.44Å; D129-H132 CarbonylContact O-C 3.55Å; D129-H132 PolarHBondContact O-N 3.22Å; L130-H132 VanDerWaalsContact C-N 3.26Å; L130-H132 PolarHBondContact O-N 3.02Å; H132-I134 PolarHBondContact O-N 3.38Å; H132-E135 IonicContact CE1-OE2 2.7Å; H132-E135 IonicContact CG-OE2 2.76Å; H132-E135 IonicContact ND1-OE2 2.61Å; H132-E135 PolarHBondContact ND1-OE2 2.86Å; H132-E135 WeakPolarHBondContact O-CB 2.95Å; H132-E135 PolarHBondContact O-N 3.04Å
133	S	80.4	Confident	85.5	Confident	43 Å²	43	37.6 Å²	37.6	30%	0.301	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-5.3	-171.2	63.2	0	0	0	0	118.3	D129 L130	D129-S133 WeakPolarHBondContact O-CA 3.28Å; D129-S133 VanDerWaalsContact O-CB 3.22Å; D129-S133 WeakPolarHBondContact O-CB 3.31Å; D129-S133 PolarHBondContact O-N 3.3Å; L130-S133 PolarHBondContact O-N 3.06Å; L130-S133 PolarHBondContact O-OG 3.16Å
134	I	80	Confident	84.7	Confident	37 Å²	37	44.2 Å²	44.2	19%	0.19	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-109.5	-24.1	178.3	-50.6	-168.5	0	0	0	111.3	H132 L292 N295 R296 K299	H132-I134 PolarHBondContact O-N 3.38Å; I134-L292 HydrophobicContact CD1-CD1 3.66Å; I134-L292 HydrophobicContact CD1-CG 4.06Å; I134-L292 VanDerWaalsContact CD1-O 3.28Å; I134-L292 WeakPolarHBondContact CD1-O 3.26Å; I134-L292 HydrophobicContact CG1-CD1 4.06Å; I134-N295 HydrophobicContact CD1-CB 3.5Å; I134-N295 VanDerWaalsContact CD1-CB 3.5Å; I134-R296 HydrophobicContact CD1-CB 4.04Å; I134-R296 HydrophobicContact CG1-CB 4.36Å; I134-K299 PolarHBondContact O-NZ 2.86Å
135	E	79.9	Confident	84.4	Confident	55 Å²	55	46.6 Å²	46.6	26%	0.257	23%	0.228	S	C	.	.			trans	-70.9	137.6	-175.5	-59.4	-166.6	119.4	0	0	111	H132 Y137	H132-E135 IonicContact CE1-OE2 2.7Å; H132-E135 IonicContact CG-OE2 2.76Å; H132-E135 IonicContact ND1-OE2 2.61Å; H132-E135 PolarHBondContact ND1-OE2 2.86Å; H132-E135 WeakPolarHBondContact O-CB 2.95Å; H132-E135 PolarHBondContact O-N 3.04Å; E135-Y137 VanDerWaalsContact C-N 3.26Å; E135-Y137 HydrophobicContact CB-CD2 3.84Å; E135-Y137 HydrophobicContact CB-CE2 3.71Å; E135-Y137 HydrophobicContact CB-CG 4.44Å; E135-Y137 HydrophobicContact CG-CE2 4.08Å; E135-Y137 PolarHBondContact O-N 3.04Å; E135-Y137 WeakPolarHBondContact OE1-CE2 3.2Å; E135-Y137 PolarHBondContact OE1-OH 3.25Å; E135-Y137 VanDerWaalsContact OE1-OH 3.13Å; E135-Y137 VanDerWaalsContact OE2-CE2 3.24Å; E135-Y137 WeakPolarHBondContact OE2-CE2 3.26Å
136	P	81.3	Confident	84.5	Confident	51 Å²	51	46.7 Å²	46.7	33%	0.331	23%	0.23	S	C	.	.	S	Bend	trans	-82.7	6.7	-171.8	34.2	-38.2	0	0	0	114	D138 A139 Y140 L148	P136-D138 PolarHBondContact O-N 2.83Å; P136-A139 CarbonylContact O-C 3.51Å; P136-A139 WeakPolarHBondContact O-CA 3.31Å; P136-A139 WeakPolarHBondContact O-CB 3.35Å; P136-A139 PolarHBondContact O-N 3.05Å; P136-A139 VanDerWaalsContact O-N 3.13Å; P136-Y140 HydrophobicContact CB-CD2 3.9Å; P136-Y140 HydrophobicContact CB-CE2 3.72Å; P136-Y140 HydrophobicContact CG-CD2 4.07Å; P136-Y140 HydrophobicContact CG-CE2 3.66Å; P136-Y140 WeakPolarHBondContact O-CD2 3.3Å; P136-Y140 PolarHBondContact O-N 3.35Å; P136-L148 HydrophobicContact CB-CD2 4.23Å
137	Y	81.9	Confident	84.6	Confident	80 Å²	80	45.6 Å²	45.6	31%	0.314	23%	0.225	S	C	.	.	H	α-helix	trans	-63.7	-45.4	-165.3	-52	-42.1	0	0	0	113.4	E135 A139 Y140 A141 V319	E135-Y137 VanDerWaalsContact C-N 3.26Å; E135-Y137 HydrophobicContact CB-CD2 3.84Å; E135-Y137 HydrophobicContact CB-CE2 3.71Å; E135-Y137 HydrophobicContact CB-CG 4.44Å; E135-Y137 HydrophobicContact CG-CE2 4.08Å; E135-Y137 PolarHBondContact O-N 3.04Å; E135-Y137 WeakPolarHBondContact OE1-CE2 3.2Å; E135-Y137 PolarHBondContact OE1-OH 3.25Å; E135-Y137 VanDerWaalsContact OE1-OH 3.13Å; E135-Y137 VanDerWaalsContact OE2-CE2 3.24Å; E135-Y137 WeakPolarHBondContact OE2-CE2 3.26Å; Y137-A139 VanDerWaalsContact C-N 3.29Å; Y137-A139 PolarHBondContact O-N 3.41Å; Y137-Y140 WeakPolarHBondContact O-CB 3.49Å; Y137-Y140 PolarHBondContact O-N 3.26Å; Y137-A141 WeakPolarHBondContact O-CB 3.33Å; Y137-A141 PolarHBondContact O-N 3.06Å; Y137-V319 HydrophobicContact CD1-CB 4.43Å; Y137-V319 HydrophobicContact CD1-CG1 4.05Å; Y137-V319 HydrophobicContact CD1-CG2 3.43Å; Y137-V319 VanDerWaalsContact CD1-CG2 3.43Å; Y137-V319 HydrophobicContact CD2-CG1 4.18Å; Y137-V319 HydrophobicContact CE1-CB 4.37Å; Y137-V319 HydrophobicContact CE1-CG1 3.82Å; Y137-V319 HydrophobicContact CE1-CG2 3.62Å; Y137-V319 HydrophobicContact CE2-CG1 3.94Å; Y137-V319 HydrophobicContact CG-CG1 4.25Å; Y137-V319 HydrophobicContact CG-CG2 4.14Å
138	D	84.4	Confident	84.6	Confident	65 Å²	65	46.2 Å²	46.2	35%	0.348	23%	0.228	S	C	.	.	H	α-helix	trans	-69.9	-30.1	176.6	-62.7	-62.3	0	0	0	111.9	P136 A141 G142 R143	P136-D138 PolarHBondContact O-N 2.83Å; D138-A141 CarbonylContact O-C 3.59Å; D138-A141 PolarHBondContact O-N 3.32Å; D138-G142 PolarHBondContact O-N 3.2Å; D138-R143 HydrophobicContact CB-CB 3.79Å; D138-R143 PolarHBondContact O-N 2.65Å; D138-R143 WeakPolarHBondContact OD1-CB 3.31Å; D138-R143 WeakPolarHBondContact OD1-CD 3.48Å; D138-R143 IonicContact OD1-NH1 3.22Å
139	A	88	Confident	84.8	Confident	11 Å²	11	45.6 Å²	45.6	9%	0.091	23%	0.228	C	C	.	.	H	α-helix	trans	-69.2	-28.3	171.4	0	0	0	0	0	114.3	P136 Y137 M146 S147 L148	P136-A139 CarbonylContact O-C 3.51Å; P136-A139 WeakPolarHBondContact O-CA 3.31Å; P136-A139 WeakPolarHBondContact O-CB 3.35Å; P136-A139 PolarHBondContact O-N 3.05Å; P136-A139 VanDerWaalsContact O-N 3.13Å; Y137-A139 VanDerWaalsContact C-N 3.29Å; Y137-A139 PolarHBondContact O-N 3.41Å; A139-M146 HydrophobicContact CB-CB 4.23Å; A139-S147 VanDerWaalsContact CB-C 3.45Å; A139-S147 VanDerWaalsContact CB-O 3.27Å; A139-S147 WeakPolarHBondContact CB-O 3.09Å; A139-S147 WeakPolarHBondContact O-CA 3.32Å; A139-L148 HydrophobicContact CB-CD2 4Å
140	Y	90.5	Very high	85.2	Confident	10 Å²	10	43.2 Å²	43.2	4%	0.039	21%	0.214	C	C	.	.	H	α-helix	trans	-72	-43.2	166.8	-82.6	-74.9	0	0	0	111.2	P136 Y137 L148 H195 S313 L315 A316 P317 Q966	P136-Y140 HydrophobicContact CB-CD2 3.9Å; P136-Y140 HydrophobicContact CB-CE2 3.72Å; P136-Y140 HydrophobicContact CG-CD2 4.07Å; P136-Y140 HydrophobicContact CG-CE2 3.66Å; P136-Y140 WeakPolarHBondContact O-CD2 3.3Å; P136-Y140 PolarHBondContact O-N 3.35Å; Y137-Y140 WeakPolarHBondContact O-CB 3.49Å; Y137-Y140 PolarHBondContact O-N 3.26Å; Y140-L148 HydrophobicContact CD1-CD1 3.84Å; Y140-L148 HydrophobicContact CD1-CD2 4.29Å; Y140-L148 HydrophobicContact CD2-CD2 4.1Å; Y140-L148 HydrophobicContact CE1-CD1 3.71Å; Y140-L148 HydrophobicContact CE1-CD2 4.26Å; Y140-L148 HydrophobicContact CE2-CD2 4.02Å; Y140-L148 HydrophobicContact CG-CD1 4.49Å; Y140-L148 HydrophobicContact CG-CD2 4.2Å; Y140-H195 AromaticContact CE1-CE1 3.86Å; Y140-H195 AromaticContact CE1-ND1 3.4Å; Y140-H195 WeakPolarHBondContact CE1-ND1 3.43Å; Y140-S313 PolarHBondContact O-N 3.5Å; Y140-L315 VanDerWaalsContact CD1-O 3.27Å; Y140-L315 WeakPolarHBondContact CD1-O 3.36Å; Y140-A316 HydrophobicContact CD1-CB 3.87Å; Y140-A316 HydrophobicContact CG-CB 4.09Å; Y140-P317 HydrophobicContact CD2-CG 4.16Å; Y140-P317 HydrophobicContact CE1-CG 4.43Å; Y140-P317 VanDerWaalsContact CE2-CD 3.49Å; Y140-P317 HydrophobicContact CE2-CG 3.71Å; Y140-Q966 PolarHBondContact O-NE2 3.05Å
141	A	87.6	Confident	85.3	Confident	24 Å²	24	42.9 Å²	42.9	20%	0.198	21%	0.212	C	C	.	.	H	α-helix	trans	-87.3	0.9	-171.6	0	0	0	0	0	115.1	Y137 D138 R143 H312	Y137-A141 WeakPolarHBondContact O-CB 3.33Å; Y137-A141 PolarHBondContact O-N 3.06Å; D138-A141 CarbonylContact O-C 3.59Å; D138-A141 PolarHBondContact O-N 3.32Å; A141-R143 HydrophobicContact CB-CG 3.88Å; A141-R143 PolarHBondContact O-N 3.19Å; A141-H312 PolarHBondContact O-CD2 2.69Å
142	G	86.4	Confident	85.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	30	-176.1	0	0	0	0	0	113.3	D138 Q310	D138-G142 PolarHBondContact O-N 3.2Å; G142-Q310 WeakPolarHBondContact O-CG 3.47Å; G142-Q310 PolarHBondContact O-NE2 3.48Å
143	R	80.6	Confident	85	Confident	143 Å²	143	44 Å²	44	54%	0.54	23%	0.226	S	C	.	.			trans	-93.8	150.9	-177.1	-71.7	175	176.3	-166.7	-0.2	111.2	D138 A141 Q145 M146	D138-R143 HydrophobicContact CB-CB 3.79Å; D138-R143 PolarHBondContact O-N 2.65Å; D138-R143 WeakPolarHBondContact OD1-CB 3.31Å; D138-R143 WeakPolarHBondContact OD1-CD 3.48Å; D138-R143 IonicContact OD1-NH1 3.22Å; A141-R143 HydrophobicContact CB-CG 3.88Å; A141-R143 PolarHBondContact O-N 3.19Å; R143-Q145 PolarHBondContact O-N 2.98Å; R143-M146 WeakPolarHBondContact O-CB 3.14Å; R143-M146 PolarHBondContact O-N 3Å
144	E	75.9	Confident	85.1	Confident	139 Å²	139	43.1 Å²	43.1	65%	0.65	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	40.7	41.6	-175.8	-54.7	-37.8	101.9	0	0	113.5	M146	E144-M146 PolarHBondContact O-N 2.96Å; E144-M146 VanDerWaalsContact O-N 3.16Å
145	Q	82.8	Confident	85.1	Confident	58 Å²	58	41.4 Å²	41.4	27%	0.271	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	24	177.6	-88.7	176.9	-18.5	0	0	114.6	R143 P306 T307 P308	R143-Q145 PolarHBondContact O-N 2.98Å; Q145-P306 HydrophobicContact CB-CB 3.77Å; Q145-T307 WeakPolarHBondContact CB-O 3.47Å; Q145-T307 WeakPolarHBondContact CG-O 3.39Å; Q145-T307 PolarHBondContact O-N 3.24Å; Q145-P308 PolarHBondContact NE2-O 2.94Å
146	M	88.1	Confident	84.4	Confident	43 Å²	43	39.1 Å²	39.1	21%	0.212	20%	0.202	C	C	.	.			trans	-94.6	152.6	176.1	-64.6	-62	-91.8	0	0	113.1	A139 R143 E144 E303 P306 R1084	A139-M146 HydrophobicContact CB-CB 4.23Å; R143-M146 WeakPolarHBondContact O-CB 3.14Å; R143-M146 PolarHBondContact O-N 3Å; E144-M146 PolarHBondContact O-N 2.96Å; E144-M146 VanDerWaalsContact O-N 3.16Å; M146-E303 VanDerWaalsContact CE-O 3.3Å; M146-E303 WeakPolarHBondContact CE-O 3.43Å; M146-P306 HydrophobicContact SD-CB 4.36Å; M146-P306 HydrophobicContact SD-CG 4.2Å; M146-R1084 PolarHBondContact SD-NH2 3.46Å; M146-R1084 VanDerWaalsContact SD-NH2 3.38Å
147	S	91.3	Very high	83.5	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.014	21%	0.209	C	C	.	.			trans	-151.5	166.3	-176.1	60.9	0	0	0	0	111.9	A139 R1084	A139-S147 VanDerWaalsContact CB-C 3.45Å; A139-S147 VanDerWaalsContact CB-O 3.27Å; A139-S147 WeakPolarHBondContact CB-O 3.09Å; A139-S147 WeakPolarHBondContact O-CA 3.32Å; S147-R1084 WeakPolarHBondContact CB-O 3.28Å; S147-R1084 VanDerWaalsContact N-NH1 3.15Å; S147-R1084 PolarHBondContact O-NH1 2.89Å; S147-R1084 WeakPolarHBondContact OG-CA 3.17Å; S147-R1084 WeakPolarHBondContact OG-CD 3.46Å; S147-R1084 PolarHBondContact OG-O 3.43Å
148	L	91.4	Very high	82.5	Confident	12 Å²	12	39.8 Å²	39.8	6%	0.063	20%	0.204	C	C	.	.			trans	-75.6	154.4	-175.7	-63.8	173.7	0	0	0	113.4	P136 A139 Y140 I1088	P136-L148 HydrophobicContact CB-CD2 4.23Å; A139-L148 HydrophobicContact CB-CD2 4Å; Y140-L148 HydrophobicContact CD1-CD1 3.84Å; Y140-L148 HydrophobicContact CD1-CD2 4.29Å; Y140-L148 HydrophobicContact CD2-CD2 4.1Å; Y140-L148 HydrophobicContact CE1-CD1 3.71Å; Y140-L148 HydrophobicContact CE1-CD2 4.26Å; Y140-L148 HydrophobicContact CE2-CD2 4.02Å; Y140-L148 HydrophobicContact CG-CD1 4.49Å; Y140-L148 HydrophobicContact CG-CD2 4.2Å; L148-I1088 HydrophobicContact CB-CD1 3.94Å; L148-I1088 HydrophobicContact CB-CG1 4.23Å; L148-I1088 HydrophobicContact CB-CG2 3.74Å; L148-I1088 HydrophobicContact CD1-CD1 3.61Å; L148-I1088 HydrophobicContact CD1-CG1 4.22Å; L148-I1088 HydrophobicContact CG-CD1 4.43Å
149	S	89.7	Confident	81.1	Confident	17 Å²	17	41.3 Å²	41.3	12%	0.119	21%	0.209	C	C	.	.			trans	-124.8	144.2	168.8	167.3	0	0	0	0	107.6	P196 E303 E1083	S149-P196 WeakPolarHBondContact O-CG 3.45Å; S149-E303 WeakPolarHBondContact CB-OE1 3.48Å; S149-E303 PolarHBondContact OG-OE1 3.41Å; S149-E1083 WeakPolarHBondContact CA-OE2 3.41Å
150	F	91.3	Very high	79.3	Confident	24 Å²	24	47.1 Å²	47.1	11%	0.105	23%	0.229	C	C	.	.			trans	-132.8	-34.5	178.5	-174.3	-82.8	0	0	0	112.3	N152 S153 V154 P196 E1083 I1088 R1119	F150-N152 PolarHBondContact O-N 2.63Å; F150-N152 VanDerWaalsContact O-N 3.12Å; F150-S153 WeakPolarHBondContact O-CB 3.38Å; F150-S153 PolarHBondContact O-N 2.93Å; F150-S153 PolarHBondContact O-OG 3.1Å; F150-V154 HydrophobicContact CD1-CG2 4.33Å; F150-V154 HydrophobicContact CE1-CG2 3.69Å; F150-V154 HydrophobicContact CZ-CG2 4.46Å; F150-P196 HydrophobicContact CD2-CB 4.11Å; F150-E1083 WeakPolarHBondContact CB-OE1 3.25Å; F150-E1083 VanDerWaalsContact N-CD 3.34Å; F150-E1083 PolarHBondContact N-OE1 2.9Å; F150-E1083 PolarHBondContact N-OE2 3.16Å; F150-I1088 HydrophobicContact CB-CB 4.39Å; F150-I1088 HydrophobicContact CB-CG2 4.09Å; F150-R1119 HydrophobicContact CD1-CG 4.22Å; F150-R1119 VanDerWaalsContact CE1-CD 3.48Å; F150-R1119 HydrophobicContact CE1-CG 3.93Å; F150-R1119 VanDerWaalsContact CE2-NH1 3.27Å
151	V	90.3	Very high	76.9	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.2	-36.3	-172.5	67.6	0	0	0	0	112.9	S153 V154 A155 T1079 M1080 E1083 Y1097 F1100 L1116	V151-S153 PolarHBondContact O-N 3.18Å; V151-V154 PolarHBondContact O-N 3.11Å; V151-A155 HydrophobicContact CG2-CB 4.21Å; V151-A155 WeakPolarHBondContact O-CB 3.48Å; V151-A155 PolarHBondContact O-N 3.01Å; V151-T1079 HydrophobicContact CB-CG2 3.99Å; V151-T1079 HydrophobicContact CG1-CG2 4.45Å; V151-T1079 HydrophobicContact CG2-CG2 3.8Å; V151-M1080 HydrophobicContact CG1-CB 3.81Å; V151-M1080 HydrophobicContact CG1-CG 3.94Å; V151-E1083 WeakPolarHBondContact CB-OE1 3.28Å; V151-E1083 VanDerWaalsContact N-CD 3.33Å; V151-E1083 PolarHBondContact N-OE1 2.93Å; V151-E1083 PolarHBondContact N-OE2 3.02Å; V151-E1083 VanDerWaalsContact N-OE2 3.08Å; V151-Y1097 HydrophobicContact CB-CE1 4.14Å; V151-Y1097 HydrophobicContact CG2-CE1 4.32Å; V151-F1100 HydrophobicContact CG2-CD1 3.91Å; V151-F1100 HydrophobicContact CG2-CE1 3.58Å; V151-L1116 HydrophobicContact CG2-CD2 4.39Å
152	N	84.4	Confident	74.4	Confident	30 Å²	30	63.8 Å²	63.8	16%	0.16	30%	0.3	C	S	.	.	H	α-helix	trans	-69.7	-17.6	179.4	-67.1	-29.8	0	0	0	113.7	F150 V154 G156 E303 H1076	F150-N152 PolarHBondContact O-N 2.63Å; F150-N152 VanDerWaalsContact O-N 3.12Å; N152-V154 VanDerWaalsContact C-N 3.29Å; N152-G156 WeakPolarHBondContact O-CA 3.36Å; N152-G156 PolarHBondContact O-N 2.8Å; N152-G156 VanDerWaalsContact O-N 3.1Å; N152-E303 PolarHBondContact ND2-OE1 3.12Å; N152-H1076 PolarHBondContact OD1-NE2 3.06Å
153	S	79.7	Confident	72	Confident	79 Å²	79	69.8 Å²	69.8	55%	0.552	33%	0.326	S	S	*	.	H	α-helix	trans	-76.7	-14.2	170.7	72.7	0	0	0	0	113.9	F150 V151	F150-S153 WeakPolarHBondContact O-CB 3.38Å; F150-S153 PolarHBondContact O-N 2.93Å; F150-S153 PolarHBondContact O-OG 3.1Å; V151-S153 PolarHBondContact O-N 3.18Å
154	V	80.7	Confident	69.8	Low	25 Å²	25	67.4 Å²	67.4	15%	0.152	33%	0.329	C	S	.	.	H	α-helix	trans	-109.6	-41.1	177.6	175.5	0	0	0	0	111.6	F150 V151 N152 T1112 Q1115 L1116	F150-V154 HydrophobicContact CD1-CG2 4.33Å; F150-V154 HydrophobicContact CE1-CG2 3.69Å; F150-V154 HydrophobicContact CZ-CG2 4.46Å; V151-V154 PolarHBondContact O-N 3.11Å; N152-V154 VanDerWaalsContact C-N 3.29Å; V154-T1112 HydrophobicContact CG1-CG2 4.2Å; V154-Q1115 HydrophobicContact CG1-CB 3.68Å; V154-L1116 HydrophobicContact CG1-CD2 4.03Å; V154-L1116 HydrophobicContact CG1-CG 4.03Å
155	A	80.2	Confident	67.7	Low	2 Å²	2	67.1 Å²	67.1	2%	0.017	34%	0.337	C	S	.	.	H	α-helix	trans	-111.5	-5.3	-170.2	0	0	0	0	0	114.6	V151 E157 L158 F1100 T1112	V151-A155 HydrophobicContact CG2-CB 4.21Å; V151-A155 WeakPolarHBondContact O-CB 3.48Å; V151-A155 PolarHBondContact O-N 3.01Å; A155-E157 PolarHBondContact O-N 3.4Å; A155-L158 HydrophobicContact CB-CD1 4.15Å; A155-L158 WeakPolarHBondContact O-CB 3.4Å; A155-L158 WeakPolarHBondContact O-CG 3.32Å; A155-L158 PolarHBondContact O-N 3.41Å; A155-F1100 HydrophobicContact CB-CE1 3.56Å; A155-F1100 HydrophobicContact CB-CZ 3.92Å; A155-T1112 HydrophobicContact CB-CG2 4.14Å
156	G	65.7	Low	65.2	Low	6 Å²	6	75.4 Å²	75.4	6%	0.062	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-3.5	-175.5	0	0	0	0	0	115.8	N152 R160	N152-G156 WeakPolarHBondContact O-CA 3.36Å; N152-G156 PolarHBondContact O-N 2.8Å; N152-G156 VanDerWaalsContact O-N 3.1Å; G156-R160 WeakPolarHBondContact O-CD 3.35Å; G156-R160 WeakPolarHBondContact O-CG 3.36Å; G156-R160 PolarHBondContact O-NE 3.45Å
157	E	61.9	Low	62.5	Low	104 Å²	104	80.7 Å²	80.7	49%	0.486	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-21.5	167.4	-61.7	-154.6	148.5	0	0	113.3	A155 E159 R160	A155-E157 PolarHBondContact O-N 3.4Å; E157-E159 VanDerWaalsContact C-N 3.27Å; E157-E159 PolarHBondContact O-N 2.66Å; E157-R160 PolarHBondContact O-N 3.44Å
158	L	61.7	Low	59.7	Low	41 Å²	41	86.2 Å²	86.2	22%	0.215	42%	0.423	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-32	180	-62.8	179.4	0	0	0	112.5	A155 R160 F1100 V1104 H1109 T1112	A155-L158 HydrophobicContact CB-CD1 4.15Å; A155-L158 WeakPolarHBondContact O-CB 3.4Å; A155-L158 WeakPolarHBondContact O-CG 3.32Å; A155-L158 PolarHBondContact O-N 3.41Å; L158-R160 VanDerWaalsContact C-N 3.28Å; L158-R160 PolarHBondContact O-N 3.04Å; L158-F1100 HydrophobicContact CD1-CZ 4.29Å; L158-V1104 HydrophobicContact CD1-CG1 4.07Å; L158-V1104 HydrophobicContact CD1-CG2 3.84Å; L158-H1109 HydrophobicContact CD2-CB 3.95Å; L158-T1112 HydrophobicContact CD1-CG2 4.12Å; L158-T1112 HydrophobicContact CG-CG2 4.45Å
159	E	55.5	Low	57.3	Low	97 Å²	97	92.1 Å²	92.1	45%	0.453	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-16.3	174.3	-60.3	-175.5	137.7	0	0	112.9	E157 H300 H1076	E157-E159 VanDerWaalsContact C-N 3.27Å; E157-E159 PolarHBondContact O-N 2.66Å; E159-H300 IonicContact OE1-CD2 2.66Å; E159-H1076 IonicContact OE1-CE1 3.52Å; E159-H1076 PolarHBondContact OE1-CE1 3.16Å; E159-H1076 VanDerWaalsContact OE1-CE1 3.3Å; E159-H1076 IonicContact OE1-ND1 3.73Å
160	R	49.2	Very low	55.1	Low	134 Å²	134	98.6 Å²	98.6	51%	0.506	47%	0.474	S	S	.	.			trans	-97.9	115.9	-169.3	-64.1	177.7	-177.6	166.4	2.5	110.4	G156 E157 L158 H162	G156-R160 WeakPolarHBondContact O-CD 3.35Å; G156-R160 WeakPolarHBondContact O-CG 3.36Å; G156-R160 PolarHBondContact O-NE 3.45Å; E157-R160 PolarHBondContact O-N 3.44Å; L158-R160 VanDerWaalsContact C-N 3.28Å; L158-R160 PolarHBondContact O-N 3.04Å; R160-H162 PolarHBondContact O-N 3.14Å
161	K	39.5	Very low	53.4	Low	209 Å²	209	103 Å²	103	91%	0.909	50%	0.497	S	S	*	.	S	Bend	trans	-67.7	27.3	-179.5	-61.9	-177.6	176.6	178.8	0	115.3
162	H	35.9	Very low	52.4	Low	174 Å²	174	106.4 Å²	106.4	81%	0.806	52%	0.516	S	S	*	.			trans	-145.5	93.8	179.4	-106.9	38.6	0	0	0	111.2	R160	R160-H162 PolarHBondContact O-N 3.14Å
163	F	35.6	Very low	52.5	Low	127 Å²	127	106.8 Å²	106.8	56%	0.557	52%	0.516	S	S	*	.			trans	-70.7	127	168.7	-72.9	-79.8	0	0	0	110.8	T165 H1109	F163-T165 PolarHBondContact O-N 3.21Å; F163-T165 PolarHBondContact O-OG1 2.83Å; F163-H1109 AromaticContact CZ-CE1 3.71Å
164	P	34.9	Very low	52.9	Low	93 Å²	93	107.4 Å²	107.4	60%	0.604	51%	0.512	S	S	*	.			trans	-60.2	107	172.5	-23.2	34.5	0	0	0	111.2	R166	P164-R166 PolarHBondContact O-N 3.22Å; P164-R166 VanDerWaalsContact O-N 3.11Å
165	T	32.3	Very low	53.4	Low	132 Å²	132	106.5 Å²	106.5	81%	0.81	51%	0.507	S	S	*	.			trans	-81	102	-174.3	-21.1	0	0	0	0	110.8	F163	F163-T165 PolarHBondContact O-N 3.21Å; F163-T165 PolarHBondContact O-OG1 2.83Å
166	R	30.1	Very low	54	Low	232 Å²	232	108.5 Å²	108.5	88%	0.875	52%	0.52	S	S	*	.			trans	88.3	106.4	177.9	-52.1	163.8	172.7	173.5	-2.2	116	P164	P164-R166 PolarHBondContact O-N 3.22Å; P164-R166 VanDerWaalsContact O-N 3.11Å
167	L	31.5	Very low	55.2	Low	155 Å²	155	114.2 Å²	114.2	81%	0.812	55%	0.549	S	S	*	.	S	Bend		-157.1	167.4	128.5	-100.3	148.5	0	0	0	108	M169	L167-M169 PolarHBondContact O-N 3.35Å
168	D	32.1	Very low	56.6	Low	117 Å²	117	111.9 Å²	111.9	63%	0.626	54%	0.536	S	S	*	.			trans	-51.2	90.6	-156.4	-70.3	-49.8	0	0	0	118.3	R170 I171	D168-R170 PolarHBondContact O-N 3.12Å; D168-I171 HydrophobicContact CB-CD1 4.29Å; D168-I171 HydrophobicContact CB-CG1 4.45Å; D168-I171 PolarHBondContact O-N 2.73Å; D168-I171 VanDerWaalsContact O-N 3.12Å
169	M	40.7	Very low	58.1	Low	137 Å²	137	110 Å²	110	68%	0.675	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-4	175.8	-51.4	-172.9	-51.4	0	0	116.4	L167 F173	L167-M169 PolarHBondContact O-N 3.35Å; M169-F173 WeakPolarHBondContact O-CD2 3.19Å; M169-F173 WeakPolarHBondContact O-CE2 3.38Å
170	R	43.4	Very low	59.9	Low	153 Å²	153	107 Å²	107	58%	0.577	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-22.7	177.2	-75	-169.5	176.1	-149.8	-3.9	113.4	D168	D168-R170 PolarHBondContact O-N 3.12Å
171	I	56.6	Low	62.1	Low	115 Å²	115	101.8 Å²	101.8	59%	0.59	50%	0.496	S	S	*	.	S	Bend	trans	-77.3	-38.7	-175.4	-59.7	178.7	0	0	0	110.1	D168 F173 I174	D168-I171 HydrophobicContact CB-CD1 4.29Å; D168-I171 HydrophobicContact CB-CG1 4.45Å; D168-I171 PolarHBondContact O-N 2.73Å; D168-I171 VanDerWaalsContact O-N 3.12Å; I171-F173 VanDerWaalsContact C-N 3.25Å; I171-F173 PolarHBondContact O-N 2.63Å; I171-I174 PolarHBondContact O-N 2.78Å
172	D	69.9	Low	64.3	Low	73 Å²	73	93.9 Å²	93.9	39%	0.39	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-21.7	-170.5	-44.9	-38.4	0	0	0	114.6	S1111	D172-S1111 VanDerWaalsContact CB-OG 3.26Å; D172-S1111 WeakPolarHBondContact CB-OG 3.36Å
173	F	84.5	Confident	66.6	Low	38 Å²	38	88.1 Å²	88.1	17%	0.167	45%	0.447	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-18.2	179.6	-59.9	-55.8	0	0	0	113.6	M169 I171 I1110 L1114 Y1118 V1149	M169-F173 WeakPolarHBondContact O-CD2 3.19Å; M169-F173 WeakPolarHBondContact O-CE2 3.38Å; I171-F173 VanDerWaalsContact C-N 3.25Å; I171-F173 PolarHBondContact O-N 2.63Å; F173-I1110 HydrophobicContact CE1-CB 4.28Å; F173-I1110 HydrophobicContact CE1-CG2 4.06Å; F173-L1114 HydrophobicContact CB-CD1 4.38Å; F173-L1114 HydrophobicContact CD1-CD1 3.89Å; F173-Y1118 PolarHBondContact O-OH 2.95Å; F173-V1149 HydrophobicContact CB-CG1 4.36Å; F173-V1149 HydrophobicContact CD1-CG1 4.49Å; F173-V1149 HydrophobicContact CD1-CG2 4.09Å; F173-V1149 HydrophobicContact CD2-CG1 3.52Å; F173-V1149 HydrophobicContact CD2-CG2 4.47Å; F173-V1149 HydrophobicContact CE1-CG2 4.04Å; F173-V1149 HydrophobicContact CE2-CG1 3.8Å; F173-V1149 HydrophobicContact CE2-CG2 4.43Å; F173-V1149 HydrophobicContact CG-CG1 3.9Å; F173-V1149 HydrophobicContact CG-CG2 4.3Å; F173-V1149 HydrophobicContact CZ-CG1 4.4Å; F173-V1149 HydrophobicContact CZ-CG2 4.22Å
174	I	89	Confident	68.1	Low	92 Å²	92	83 Å²	83	47%	0.472	43%	0.429	S	S	.	.	S	Bend	trans	-76.5	125.1	-171.8	-61.8	173.9	0	0	0	109.5	I171	I171-I174 PolarHBondContact O-N 2.78Å
175	P	91.9	Very high	69.7	Low	6 Å²	6	82.3 Å²	82.3	4%	0.039	43%	0.432	C	S	.	.	P	Polyproline II helix	trans	-64.7	133.8	175.6	27.6	-34	0	0	0	110.5	V179 M180 Y1118 L1154 F1158	P175-V179 HydrophobicContact CB-CB 4.49Å; P175-M180 HydrophobicContact CB-SD 3.97Å; P175-M180 HydrophobicContact CG-SD 3.41Å; P175-M180 WeakPolarHBondContact CG-SD 3.17Å; P175-Y1118 HydrophobicContact CB-CD1 4.31Å; P175-Y1118 HydrophobicContact CB-CE1 3.78Å; P175-Y1118 HydrophobicContact CB-CE2 4.14Å; P175-Y1118 WeakPolarHBondContact CD-OH 3.41Å; P175-L1154 HydrophobicContact CG-CD1 4.27Å; P175-L1154 HydrophobicContact CG-CD2 4.24Å; P175-F1158 HydrophobicContact CB-CE2 4.45Å; P175-F1158 HydrophobicContact CB-CZ 4.15Å; P175-F1158 HydrophobicContact CG-CE2 4.13Å; P175-F1158 HydrophobicContact CG-CZ 4.3Å
176	P	91.2	Very high	71.1	Confident	44 Å²	44	82.9 Å²	82.9	29%	0.286	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-60.7	148.4	169.6	-22.1	32.7	0	0	0	111.8	Y178 V179	P176-Y178 HydrophobicContact CB-CD1 3.84Å; P176-Y178 HydrophobicContact CB-CE1 3.37Å; P176-Y178 HydrophobicContact CB-CE2 4.19Å; P176-Y178 HydrophobicContact CB-CG 4.41Å; P176-Y178 HydrophobicContact CG-CE1 4.17Å; P176-Y178 PolarHBondContact O-N 3.1Å; P176-V179 HydrophobicContact CB-CG2 4.22Å; P176-V179 HydrophobicContact CG-CG2 4.25Å; P176-V179 WeakPolarHBondContact O-CA 3.43Å; P176-V179 VanDerWaalsContact O-CB 3.3Å; P176-V179 WeakPolarHBondContact O-CB 3.2Å; P176-V179 PolarHBondContact O-N 3.29Å
177	D	91.5	Very high	73.2	Confident	126 Å²	126	75.2 Å²	75.2	67%	0.674	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-49.8	-40.5	-176.8	-64	-25.5	0	0	0	113.6	V179 M180 F183	D177-V179 PolarHBondContact O-N 3.3Å; D177-V179 VanDerWaalsContact O-N 3.16Å; D177-M180 WeakPolarHBondContact O-CB 3.43Å; D177-M180 PolarHBondContact O-N 3.43Å; D177-F183 HydrophobicContact CB-CD2 4.16Å; D177-F183 HydrophobicContact CB-CE2 3.94Å; D177-F183 WeakPolarHBondContact O-CB 3.39Å; D177-F183 WeakPolarHBondContact O-CD2 3.47Å; D177-F183 WeakPolarHBondContact O-CG 3.29Å
178	Y	91.2	Very high	75.5	Confident	55 Å²	55	69.1 Å²	69.1	22%	0.216	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-69.9	-6.7	-179.9	62	-100.1	0	0	0	114.8	P176 P190 P193 Y1122	P176-Y178 HydrophobicContact CB-CD1 3.84Å; P176-Y178 HydrophobicContact CB-CE1 3.37Å; P176-Y178 HydrophobicContact CB-CE2 4.19Å; P176-Y178 HydrophobicContact CB-CG 4.41Å; P176-Y178 HydrophobicContact CG-CE1 4.17Å; P176-Y178 PolarHBondContact O-N 3.1Å; Y178-P190 HydrophobicContact CD1-CG 3.73Å; Y178-P190 HydrophobicContact CG-CG 3.75Å; Y178-P193 HydrophobicContact CD1-CG 4.28Å; Y178-P193 HydrophobicContact CE1-CB 4.27Å; Y178-P193 HydrophobicContact CE1-CG 3.66Å; Y178-P193 HydrophobicContact CE2-CB 4.04Å; Y178-P193 HydrophobicContact CE2-CG 4.19Å; Y178-Y1122 AromaticContact CD2-CD2 3.59Å; Y178-Y1122 HydrophobicContact CD2-CD2 3.59Å; Y178-Y1122 HydrophobicContact CD2-CE2 4.21Å; Y178-Y1122 HydrophobicContact CD2-CG 4.25Å; Y178-Y1122 AromaticContact CE2-CD2 3.86Å; Y178-Y1122 HydrophobicContact CE2-CD2 3.86Å; Y178-Y1122 HydrophobicContact CE2-CE2 4.47Å; Y178-Y1122 HydrophobicContact CE2-CG 4.13Å
179	V	93.3	Very high	78.2	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	35%	0.348	C	S	.	.	G	3₁₀ helix	trans	-97.6	-18.4	173.6	-174.9	0	0	0	0	110.6	P175 P176 D177 Y1118 R1121	P175-V179 HydrophobicContact CB-CB 4.49Å; P176-V179 HydrophobicContact CB-CG2 4.22Å; P176-V179 HydrophobicContact CG-CG2 4.25Å; P176-V179 WeakPolarHBondContact O-CA 3.43Å; P176-V179 VanDerWaalsContact O-CB 3.3Å; P176-V179 WeakPolarHBondContact O-CB 3.2Å; P176-V179 PolarHBondContact O-N 3.29Å; D177-V179 PolarHBondContact O-N 3.3Å; D177-V179 VanDerWaalsContact O-N 3.16Å; V179-Y1118 HydrophobicContact CG1-CD1 3.78Å; V179-Y1118 HydrophobicContact CG1-CG 4.16Å; V179-R1121 HydrophobicContact CG1-CB 4.13Å; V179-R1121 HydrophobicContact CG1-CG 4.49Å; V179-R1121 WeakPolarHBondContact O-CD 3.39Å; V179-R1121 PolarHBondContact O-NE 3.37Å; V179-R1121 PolarHBondContact O-NH1 2.73Å
180	M	94.7	Very high	80.7	Confident	35 Å²	35	58.5 Å²	58.5	17%	0.172	33%	0.325	C	S	.	.	S	Bend	trans	-66.4	135.6	-176.5	-69.5	-62	-70.6	0	0	112.6	P175 D177 G182 F183 L1154 I1157 F1158	P175-M180 HydrophobicContact CB-SD 3.97Å; P175-M180 HydrophobicContact CG-SD 3.41Å; P175-M180 WeakPolarHBondContact CG-SD 3.17Å; D177-M180 WeakPolarHBondContact O-CB 3.43Å; D177-M180 PolarHBondContact O-N 3.43Å; M180-G182 PolarHBondContact O-N 3.28Å; M180-F183 VanDerWaalsContact O-CB 3.31Å; M180-F183 WeakPolarHBondContact O-CB 3.3Å; M180-F183 PolarHBondContact O-N 3.05Å; M180-F183 VanDerWaalsContact O-N 3.14Å; M180-L1154 HydrophobicContact CE-CD2 3.69Å; M180-L1154 HydrophobicContact SD-CD2 4.13Å; M180-I1157 HydrophobicContact CE-CB 4.38Å; M180-I1157 HydrophobicContact CE-CD1 3.69Å; M180-I1157 HydrophobicContact CE-CG2 4.05Å; M180-F1158 HydrophobicContact SD-CE2 4.07Å; M180-F1158 HydrophobicContact SD-CZ 4.03Å
181	P	93.8	Very high	83	Confident	24 Å²	24	51.2 Å²	51.2	16%	0.156	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.9	125.1	176.4	-27.6	35.1	0	0	0	112.6	I1157 F1158 N1161	P181-I1157 HydrophobicContact CB-CG2 4.21Å; P181-I1157 HydrophobicContact CG-CG2 4.02Å; P181-F1158 HydrophobicContact CG-CD1 3.61Å; P181-F1158 HydrophobicContact CG-CE1 3.78Å; P181-F1158 HydrophobicContact CG-CG 4.18Å; P181-F1158 HydrophobicContact CG-CZ 4.46Å; P181-N1161 HydrophobicContact CB-CB 3.78Å; P181-N1161 HydrophobicContact CG-CB 4.14Å
182	G	87.2	Confident	84.5	Confident	44 Å²	44	49.4 Å²	49.4	45%	0.454	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	91	-4.7	178.3	0	0	0	0	0	115.4	M180 G184 A185 E1130	M180-G182 PolarHBondContact O-N 3.28Å; G182-G184 PolarHBondContact O-N 3.43Å; G182-A185 WeakPolarHBondContact O-CB 3.43Å; G182-A185 PolarHBondContact O-N 3.09Å; G182-A185 VanDerWaalsContact O-N 3.16Å; G182-E1130 PolarHBondContact N-OE1 3.07Å
183	F	83.8	Confident	85.4	Confident	52 Å²	52	47.4 Å²	47.4	23%	0.228	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-51.6	-41.3	175	177.3	-90.1	0	0	0	112.2	D177 M180 A185 T187 N188	D177-F183 HydrophobicContact CB-CD2 4.16Å; D177-F183 HydrophobicContact CB-CE2 3.94Å; D177-F183 WeakPolarHBondContact O-CB 3.39Å; D177-F183 WeakPolarHBondContact O-CD2 3.47Å; D177-F183 WeakPolarHBondContact O-CG 3.29Å; M180-F183 VanDerWaalsContact O-CB 3.31Å; M180-F183 WeakPolarHBondContact O-CB 3.3Å; M180-F183 PolarHBondContact O-N 3.05Å; M180-F183 VanDerWaalsContact O-N 3.14Å; F183-A185 PolarHBondContact O-N 3.25Å; F183-A185 VanDerWaalsContact O-N 3.11Å; F183-T187 HydrophobicContact CE1-CG2 3.82Å; F183-T187 HydrophobicContact CE2-CG2 4.25Å; F183-T187 HydrophobicContact CZ-CG2 3.56Å; F183-N188 WeakPolarHBondContact CE1-O 3.26Å
184	G	66.8	Low	85.6	Confident	19 Å²	19	45.7 Å²	45.7	20%	0.196	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-69.9	-0.6	-176.9	0	0	0	0	0	116.5	G182 Q951	G182-G184 PolarHBondContact O-N 3.43Å; G184-Q951 PolarHBondContact O-NE2 3.28Å
185	A	67.4	Low	85.5	Confident	80 Å²	80	41.5 Å²	41.5	66%	0.661	25%	0.25	S	S	*	.	G	3₁₀ helix	trans	-72.2	-28.2	-176.1	0	0	0	0	0	114.1	G182 F183	G182-A185 WeakPolarHBondContact O-CB 3.43Å; G182-A185 PolarHBondContact O-N 3.09Å; G182-A185 VanDerWaalsContact O-N 3.16Å; F183-A185 PolarHBondContact O-N 3.25Å; F183-A185 VanDerWaalsContact O-N 3.11Å
186	N	62.4	Low	84.7	Confident	144 Å²	144	43.1 Å²	43.1	77%	0.77	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.6	-16.5	177.8	-66.2	-81.9	0	0	0	113.3	N975	N186-N975 PolarHBondContact O-ND2 2.95Å
187	T	73.7	Confident	83.5	Confident	70 Å²	70	45 Å²	45	43%	0.429	27%	0.268	S	S	.	.	S	Bend	trans	-110	141.3	-172.9	-43.7	0	0	0	0	110.3	F183	F183-T187 HydrophobicContact CE1-CG2 3.82Å; F183-T187 HydrophobicContact CE2-CG2 4.25Å; F183-T187 HydrophobicContact CZ-CG2 3.56Å
188	N	80.2	Confident	82	Confident	27 Å²	27	44.7 Å²	44.7	14%	0.144	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-69.1	144.1	168.8	-74.3	-20.7	0	0	0	109.9	F183 Y972 L974 N975	F183-N188 WeakPolarHBondContact CE1-O 3.26Å; N188-Y972 PolarHBondContact ND2-O 3Å; N188-L974 PolarHBondContact ND2-N 3.42Å; N188-N975 PolarHBondContact OD1-ND2 2.84Å; N188-N975 VanDerWaalsContact OD1-ND2 3.15Å; N188-N975 PolarHBondContact OD1-OD1 3.44Å
189	L	90	Very high	80	Confident	3 Å²	3	53 Å²	53	2%	0.016	30%	0.298	C	S	.	.	P	Polyproline II helix	trans	-58.6	128.7	162.5	-68.2	162	0	0	0	108.9	I953 Y1122 L1125 L1126	L189-I953 HydrophobicContact CB-CG2 4.39Å; L189-I953 HydrophobicContact CD1-CG2 4.25Å; L189-Y1122 HydrophobicContact CB-CE2 4.43Å; L189-Y1122 HydrophobicContact CD2-CD2 4.29Å; L189-Y1122 HydrophobicContact CD2-CE2 4.48Å; L189-L1125 HydrophobicContact CD1-CB 3.78Å; L189-L1125 HydrophobicContact CD2-CB 4Å; L189-L1125 HydrophobicContact CD2-CD1 3.97Å; L189-L1126 HydrophobicContact CD1-CB 4.19Å; L189-L1126 HydrophobicContact CD1-CD1 4.47Å
190	P	91.5	Very high	77.9	Confident	28 Å²	28	60.3 Å²	60.3	18%	0.182	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-68.7	142.6	174.8	29.8	-33.9	0	0	0	109.9	Y178 P193 E971 Y1122	Y178-P190 HydrophobicContact CD1-CG 3.73Å; Y178-P190 HydrophobicContact CG-CG 3.75Å; P190-P193 HydrophobicContact CB-CG 4.44Å; P190-P193 HydrophobicContact CG-CG 4.04Å; P190-E971 VanDerWaalsContact CA-OE2 3.26Å; P190-E971 WeakPolarHBondContact CA-OE2 3.35Å; P190-Y1122 WeakPolarHBondContact O-CE2 3.28Å; P190-Y1122 PolarHBondContact O-OH 3.4Å
191	L	92.4	Very high	76	Confident	1 Å²	1	60.5 Å²	60.5	1%	0.005	35%	0.348	C	S	.	.	S	Bend	trans	-88.5	-26.9	-178.3	-73.8	179.4	0	0	0	114	P193 L194 W314 L315 I953 L969 E971 Y972	L191-P193 VanDerWaalsContact C-CD 3.47Å; L191-P193 VanDerWaalsContact C-N 3.33Å; L191-L194 WeakPolarHBondContact O-CB 3.13Å; L191-L194 PolarHBondContact O-N 3.43Å; L191-W314 HydrophobicContact CD1-CH2 4.39Å; L191-W314 HydrophobicContact CD2-CH2 3.94Å; L191-W314 HydrophobicContact CD2-CZ2 4.19Å; L191-L315 HydrophobicContact CB-CD1 4.29Å; L191-L315 HydrophobicContact CD1-CD1 3.84Å; L191-L315 HydrophobicContact CD1-CD2 4.06Å; L191-L315 HydrophobicContact CD2-CD1 3.78Å; L191-L315 HydrophobicContact CG-CD1 4.19Å; L191-I953 HydrophobicContact CD1-CD1 4.03Å; L191-I953 HydrophobicContact CD2-CD1 3.91Å; L191-I953 HydrophobicContact CD2-CG1 4.09Å; L191-I953 HydrophobicContact CG-CD1 4.05Å; L191-L969 HydrophobicContact CB-CD1 4.31Å; L191-E971 VanDerWaalsContact N-CD 3.29Å; L191-E971 PolarHBondContact N-OE1 3.21Å; L191-E971 PolarHBondContact N-OE2 2.94Å; L191-Y972 HydrophobicContact CD1-CD2 3.89Å; L191-Y972 HydrophobicContact CD1-CE2 4.26Å
192	L	88.6	Confident	74.6	Confident	77 Å²	77	68.4 Å²	68.4	40%	0.403	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-55.9	-38.4	-179	-69.7	167.2	0	0	0	113.9	L194 L197 L969 E971	L192-L194 PolarHBondContact O-N 2.9Å; L192-L194 VanDerWaalsContact O-N 3.16Å; L192-L197 HydrophobicContact CB-CD1 4.09Å; L192-L197 HydrophobicContact CD2-CD1 3.85Å; L192-L197 WeakPolarHBondContact O-CD1 3.43Å; L192-L969 HydrophobicContact CD2-CD1 4.37Å; L192-L969 HydrophobicContact CD2-CG 4.22Å; L192-E971 HydrophobicContact CD1-CG 4.27Å; L192-E971 VanDerWaalsContact CG-OE1 3.31Å; L192-E971 WeakPolarHBondContact CG-OE1 3.3Å; L192-E971 PolarHBondContact N-OE1 3.37Å
193	P	88.7	Confident	73.9	Confident	31 Å²	31	70.6 Å²	70.6	20%	0.201	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-65.7	-9	174.2	-23.6	36.3	0	0	0	115.7	Y178 P190 L191 H195 R1119 Y1122	Y178-P193 HydrophobicContact CD1-CG 4.28Å; Y178-P193 HydrophobicContact CE1-CB 4.27Å; Y178-P193 HydrophobicContact CE1-CG 3.66Å; Y178-P193 HydrophobicContact CE2-CB 4.04Å; Y178-P193 HydrophobicContact CE2-CG 4.19Å; P190-P193 HydrophobicContact CB-CG 4.44Å; P190-P193 HydrophobicContact CG-CG 4.04Å; L191-P193 VanDerWaalsContact C-CD 3.47Å; L191-P193 VanDerWaalsContact C-N 3.33Å; P193-H195 VanDerWaalsContact C-N 3.28Å; P193-H195 PolarHBondContact O-N 2.86Å; P193-R1119 PolarHBondContact O-NH1 3.22Å; P193-Y1122 HydrophobicContact CB-CE1 4.44Å
194	L	89.3	Confident	73.9	Confident	1 Å²	1	69.9 Å²	69.9	1%	0.005	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-67.4	-30	179.8	-163.2	64.4	0	0	0	112.6	L191 L192 W314 L315 I1088 D1089 R1119 Y1122 L1126	L191-L194 WeakPolarHBondContact O-CB 3.13Å; L191-L194 PolarHBondContact O-N 3.43Å; L192-L194 PolarHBondContact O-N 2.9Å; L192-L194 VanDerWaalsContact O-N 3.16Å; L194-W314 HydrophobicContact CD2-CZ2 4.3Å; L194-L315 HydrophobicContact CD2-CD1 3.94Å; L194-I1088 WeakPolarHBondContact O-CD1 3.5Å; L194-D1089 HydrophobicContact CD1-CB 3.65Å; L194-D1089 HydrophobicContact CD2-CB 4.17Å; L194-D1089 HydrophobicContact CG-CB 4.18Å; L194-R1119 PolarHBondContact O-NH1 2.93Å; L194-R1119 PolarHBondContact O-NH2 3.12Å; L194-Y1122 HydrophobicContact CB-CE1 4.25Å; L194-Y1122 WeakPolarHBondContact CB-OH 3.35Å; L194-Y1122 HydrophobicContact CD1-CE1 3.59Å; L194-Y1122 PolarHBondContact N-OH 3.03Å; L194-L1126 HydrophobicContact CD1-CD2 3.55Å; L194-L1126 HydrophobicContact CD2-CD2 4.12Å; L194-L1126 HydrophobicContact CG-CD2 4.49Å
195	H	86	Confident	74.9	Confident	4 Å²	4	75 Å²	75	2%	0.019	40%	0.403	C	S	.	.	S	Bend	trans	-112.6	155.5	-168.7	-61.4	-85.8	0	0	0	113.1	Y140 P193 L197 S313 L315 L969	Y140-H195 AromaticContact CE1-CE1 3.86Å; Y140-H195 AromaticContact CE1-ND1 3.4Å; Y140-H195 WeakPolarHBondContact CE1-ND1 3.43Å; P193-H195 VanDerWaalsContact C-N 3.28Å; P193-H195 PolarHBondContact O-N 2.86Å; H195-L197 PolarHBondContact O-N 3.24Å; H195-S313 PolarHBondContact CE1-OG 2.89Å; H195-L315 PolarHBondContact CE1-O 3.25Å; H195-L315 VanDerWaalsContact NE2-CB 3.34Å; H195-L315 WeakPolarHBondContact NE2-CB 3.14Å; H195-L969 HydrophobicContact CB-CD2 3.95Å; H195-L969 VanDerWaalsContact CD2-CD1 3.4Å; H195-L969 WeakPolarHBondContact CD2-CD1 3.48Å; H195-L969 WeakPolarHBondContact CD2-CD2 3.25Å
196	P	75.7	Confident	76	Confident	41 Å²	41	71.4 Å²	71.4	27%	0.266	37%	0.373	S	S	.	.			trans	-72.8	75.9	173.2	34.3	-38.9	0	0	0	110	S149 F150 D198	S149-P196 WeakPolarHBondContact O-CG 3.45Å; F150-P196 HydrophobicContact CD2-CB 4.11Å; P196-D198 PolarHBondContact O-N 2.86Å
197	L	65.9	Low	77.3	Confident	82 Å²	82	65.5 Å²	65.5	43%	0.429	34%	0.342	S	S	.	.			trans	-77.6	101.7	172.4	-64.5	177.8	0	0	0	108.7	L192 H195 R199 L969	L192-L197 HydrophobicContact CB-CD1 4.09Å; L192-L197 HydrophobicContact CD2-CD1 3.85Å; L192-L197 WeakPolarHBondContact O-CD1 3.43Å; H195-L197 PolarHBondContact O-N 3.24Å; L197-R199 PolarHBondContact O-N 3.4Å; L197-L969 HydrophobicContact CD2-CD2 4.18Å
198	D	59.7	Low	78.1	Confident	121 Å²	121	67.8 Å²	67.8	65%	0.647	34%	0.343	S	S	*	.			trans	-56.8	118.6	170.4	-170	-19.1	0	0	0	109.1	P196 D200 G201	P196-D198 PolarHBondContact O-N 2.86Å; D198-D200 PolarHBondContact OD1-N 3.04Å; D198-D200 VanDerWaalsContact OD1-N 3.1Å; D198-G201 VanDerWaalsContact CG-N 3.35Å; D198-G201 PolarHBondContact OD1-N 2.86Å; D198-G201 WeakPolarHBondContact OD2-CA 3.47Å
199	R	50.1	Low	78.5	Confident	229 Å²	229	69.5 Å²	69.5	86%	0.864	35%	0.35	S	S	*	.	S	Bend	trans	-81.7	-20.1	-173.2	-69.1	-174.5	173.7	-177.8	-1.3	112.8	L197	L197-R199 PolarHBondContact O-N 3.4Å
200	D	48	Very low	78.5	Confident	153 Å²	153	70.2 Å²	70.2	82%	0.818	35%	0.353	S	S	*	.	S	Bend	trans	-132.4	-26.2	-168.4	-68.1	-74.9	0	0	0	113.5	D198 K202	D198-D200 PolarHBondContact OD1-N 3.04Å; D198-D200 VanDerWaalsContact OD1-N 3.1Å; D200-K202 PolarHBondContact O-N 2.82Å
201	G	55.7	Low	78.5	Confident	40 Å²	40	69.4 Å²	69.4	41%	0.412	35%	0.348	S	S	.	.			trans	-79.5	110.6	-179.1	0	0	0	0	0	114	D198	D198-G201 VanDerWaalsContact CG-N 3.35Å; D198-G201 PolarHBondContact OD1-N 2.86Å; D198-G201 WeakPolarHBondContact OD2-CA 3.47Å
202	K	63.5	Low	78.3	Confident	189 Å²	189	70.8 Å²	70.8	82%	0.822	35%	0.353	S	S	*	.			trans	-74.8	141.1	161	-68.2	-178.8	-179.6	177.5	0	109.8	D200 V204	D200-K202 PolarHBondContact O-N 2.82Å; K202-V204 PolarHBondContact O-N 3.49Å
203	P	72.2	Confident	78.4	Confident	90 Å²	90	67.4 Å²	67.4	58%	0.584	34%	0.336	S	S	*	.			trans	-57.9	136.8	178.9	23.2	-33.4	0	0	0	111.4	K205	P203-K205 VanDerWaalsContact C-N 3.26Å; P203-K205 PolarHBondContact O-N 2.91Å
204	V	84.5	Confident	78.5	Confident	38 Å²	38	73.1 Å²	73.1	23%	0.23	37%	0.365	C	S	.	.			trans	-78.2	73.5	-171.8	-173.4	0	0	0	0	110.3	K202 C206 N288 L292	K202-V204 PolarHBondContact O-N 3.49Å; V204-C206 PolarHBondContact O-N 3.13Å; V204-C206 VanDerWaalsContact O-N 3.07Å; V204-C206 PolarHBondContact O-SG 3.04Å; V204-C206 VanDerWaalsContact O-SG 3.38Å; V204-N288 HydrophobicContact CG1-CB 4.18Å; V204-N288 VanDerWaalsContact CG1-O 3.27Å; V204-N288 WeakPolarHBondContact CG1-O 3.05Å; V204-L292 HydrophobicContact CB-CD1 4Å; V204-L292 HydrophobicContact CG1-CB 4.23Å; V204-L292 HydrophobicContact CG1-CD1 4.36Å
205	K	87.2	Confident	78.6	Confident	125 Å²	125	77.1 Å²	77.1	54%	0.543	38%	0.38	S	S	.	.			trans	-68.9	104.7	-177.9	-172.6	158.1	-172.9	159.2	0	111.2	P203 V207 L236 N288	P203-K205 VanDerWaalsContact C-N 3.26Å; P203-K205 PolarHBondContact O-N 2.91Å; K205-V207 WeakPolarHBondContact CE-O 3.21Å; K205-V207 WeakPolarHBondContact CG-O 3.33Å; K205-L236 HydrophobicContact CG-CD2 4.33Å; K205-L236 WeakPolarHBondContact O-CD1 3.31Å; K205-N288 PolarHBondContact O-ND2 3.4Å
206	C	90.8	Very high	78.9	Confident	5 Å²	5	79 Å²	79	3%	0.034	39%	0.39	C	S	.	.			trans	-84.6	-27.1	179.8	-59.7	0	0	0	0	114	L131 V204 L236 F285 N288 F289	L131-C206 HydrophobicContact CD2-CB 3.62Å; V204-C206 PolarHBondContact O-N 3.13Å; V204-C206 VanDerWaalsContact O-N 3.07Å; V204-C206 PolarHBondContact O-SG 3.04Å; V204-C206 VanDerWaalsContact O-SG 3.38Å; C206-L236 WeakPolarHBondContact O-CG 3.4Å; C206-F285 HydrophobicContact CB-CD2 3.89Å; C206-F285 HydrophobicContact CB-CE2 4.13Å; C206-N288 HydrophobicContact CB-CB 4.31Å; C206-F289 PolarHBondContact SG-N 3.09Å
207	V	90.4	Very high	79.6	Confident	21 Å²	21	81.2 Å²	81.2	13%	0.127	40%	0.404	C	S	.	.			trans	-130.8	158.8	-177.2	-56.4	0	0	0	0	111	L131 K205 L210 F233 F285	L131-V207 HydrophobicContact CD1-CG1 4.19Å; L131-V207 HydrophobicContact CD1-CG2 4.38Å; K205-V207 WeakPolarHBondContact CE-O 3.21Å; K205-V207 WeakPolarHBondContact CG-O 3.33Å; V207-L210 HydrophobicContact CG2-CB 4.38Å; V207-F233 HydrophobicContact CB-CE2 4.25Å; V207-F233 HydrophobicContact CG1-CE2 3.8Å; V207-F285 HydrophobicContact CG1-CD2 3.59Å; V207-F285 HydrophobicContact CG1-CE2 3.75Å
208	R	89.3	Confident	81	Confident	118 Å²	118	77.3 Å²	77.3	45%	0.445	38%	0.384	S	S	.	.	S	Bend	trans	-85.2	-43.5	163	-72.8	-176.4	-179.8	-114.3	14.9	111.3	H234 T235 L236 D238	R208-H234 HydrophobicContact CB-CB 4.12Å; R208-H234 WeakPolarHBondContact CB-O 3.26Å; R208-H234 WeakPolarHBondContact CD-NE2 3.48Å; R208-H234 PolarHBondContact N-O 2.82Å; R208-T235 WeakPolarHBondContact CD-O 3.37Å; R208-T235 WeakPolarHBondContact CG-O 3.49Å; R208-L236 HydrophobicContact CG-CD2 4.29Å; R208-L236 PolarHBondContact NE-O 3.43Å; R208-L236 VanDerWaalsContact NE-O 3.14Å; R208-L236 PolarHBondContact NH2-O 3Å; R208-D238 VanDerWaalsContact CD-OD1 3.26Å; R208-D238 WeakPolarHBondContact CD-OD1 3.39Å; R208-D238 VanDerWaalsContact CZ-CG 3.46Å; R208-D238 IonicContact CZ-OD1 3.08Å; R208-D238 IonicContact CZ-OD2 3.19Å; R208-D238 IonicContact NE-OD1 3.04Å; R208-D238 PolarHBondContact NE-OD1 3.28Å; R208-D238 IonicContact NE-OD2 3.6Å; R208-D238 IonicContact NH1-OD1 3.5Å; R208-D238 IonicContact NH1-OD2 3.9Å; R208-D238 IonicContact NH2-OD1 3.45Å; R208-D238 PolarHBondContact NH2-OD1 2.94Å; R208-D238 IonicContact NH2-OD2 2.66Å; R208-D238 PolarHBondContact NH2-OD2 3.44Å
209	Q	89.1	Confident	82.6	Confident	62 Å²	62	74.1 Å²	74.1	29%	0.29	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	133.5	177.4	-168.4	177.1	-16	0	0	108.9	N211 F232 H234	Q209-N211 HydrophobicContact CG-CB 4.27Å; Q209-N211 WeakPolarHBondContact CG-ND2 3.38Å; Q209-N211 PolarHBondContact NE2-ND2 3.34Å; Q209-F232 HydrophobicContact CB-CE1 4.39Å; Q209-F232 HydrophobicContact CG-CD1 4.34Å; Q209-F232 HydrophobicContact CG-CE1 4.3Å; Q209-H234 HydrophobicContact CB-CB 3.86Å; Q209-H234 PolarHBondContact N-O 2.7Å; Q209-H234 PolarHBondContact O-N 2.82Å
210	L	90.9	Very high	84.7	Confident	18 Å²	18	67.8 Å²	67.8	9%	0.094	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	110.4	167.1	176.3	64.9	0	0	0	106.4	I127 L131 V207 F233 L278	I127-L210 HydrophobicContact CG2-CD2 4.01Å; L131-L210 HydrophobicContact CD1-CD2 4.19Å; V207-L210 HydrophobicContact CG2-CB 4.38Å; L210-F233 HydrophobicContact CD1-CB 4.15Å; L210-F233 HydrophobicContact CD1-CD2 4.29Å; L210-F233 HydrophobicContact CD1-CG 4.49Å; L210-L278 HydrophobicContact CD1-CD1 4.5Å; L210-L278 HydrophobicContact CD1-CD2 4.35Å; L210-L278 HydrophobicContact CD2-CD1 3.89Å
211	N	89.7	Confident	86.9	Confident	12 Å²	12	63.9 Å²	63.9	6%	0.064	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	166.5	-168.7	-86.3	-36.7	0	0	0	111.5	Q209 L231 F232 P323 S325	Q209-N211 HydrophobicContact CG-CB 4.27Å; Q209-N211 WeakPolarHBondContact CG-ND2 3.38Å; Q209-N211 PolarHBondContact NE2-ND2 3.34Å; N211-L231 CarbonylContact O-C 3.56Å; N211-L231 WeakPolarHBondContact O-CA 3.35Å; N211-F232 PolarHBondContact N-O 3.01Å; N211-F232 PolarHBondContact O-N 2.92Å; N211-P323 PolarHBondContact ND2-O 2.69Å; N211-S325 WeakPolarHBondContact CA-OG 3.49Å; N211-S325 VanDerWaalsContact CB-OG 3.23Å; N211-S325 WeakPolarHBondContact CB-OG 3.34Å; N211-S325 VanDerWaalsContact CG-OG 3.24Å; N211-S325 VanDerWaalsContact OD1-CB 3.26Å; N211-S325 WeakPolarHBondContact OD1-CB 3.42Å; N211-S325 PolarHBondContact OD1-N 3.13Å; N211-S325 PolarHBondContact OD1-OG 3.12Å
212	Y	89.4	Confident	88.8	Confident	30 Å²	30	63.5 Å²	63.5	12%	0.118	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	137.2	163.9	-71	-72.7	0	0	0	110.9	N216 I229 L231 S325 E329	Y212-N216 WeakPolarHBondContact CD1-ND2 3.31Å; Y212-I229 HydrophobicContact CE1-CB 4.3Å; Y212-I229 HydrophobicContact CE1-CD1 3.96Å; Y212-I229 HydrophobicContact CE1-CG2 4.33Å; Y212-L231 HydrophobicContact CD1-CD2 3.68Å; Y212-L231 HydrophobicContact CE1-CD2 3.92Å; Y212-L231 HydrophobicContact CG-CD2 4.33Å; Y212-S325 PolarHBondContact N-OG 3.34Å; Y212-E329 HydrophobicContact CE2-CB 4.4Å; Y212-E329 WeakPolarHBondContact CE2-OE2 3.41Å; Y212-E329 VanDerWaalsContact CZ-OE2 3.24Å; Y212-E329 PolarHBondContact OH-OE2 2.7Å
213	S	90.8	Very high	90.2	Very high	5 Å²	5	61.2 Å²	61.2	4%	0.035	32%	0.32	C	S	.	.			trans	-68.2	147.2	174.9	-178.5	0	0	0	0	110.5	W215 N216 Y230 H242	S213-W215 PolarHBondContact O-N 3.31Å; S213-W215 PolarHBondContact OG-N 3.24Å; S213-N216 WeakPolarHBondContact O-CB 3.42Å; S213-N216 PolarHBondContact O-N 2.68Å; S213-Y230 WeakPolarHBondContact CB-O 3.2Å; S213-Y230 PolarHBondContact N-O 3.25Å; S213-H242 WeakPolarHBondContact CB-CE1 3.41Å; S213-H242 PolarHBondContact OG-CE1 2.71Å; S213-H242 PolarHBondContact OG-ND1 2.71Å
214	N	90	Very high	91.2	Very high	152 Å²	152	64.3 Å²	64.3	81%	0.813	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-16.6	171.6	-69.3	-26.5	0	0	0	113.1	N216	N214-N216 VanDerWaalsContact C-N 3.33Å
215	W	92.7	Very high	91.5	Very high	85 Å²	85	68.2 Å²	68.2	32%	0.322	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-5.4	174.1	-56.7	120.3	0	0	0	114.1	S213 Y230 H242 T256 F260	S213-W215 PolarHBondContact O-N 3.31Å; S213-W215 PolarHBondContact OG-N 3.24Å; W215-Y230 HydrophobicContact CB-CD2 4.06Å; W215-Y230 WeakPolarHBondContact O-CD2 3.49Å; W215-H242 AromaticContact CD1-CE1 3.84Å; W215-T256 PolarHBondContact NE1-O 3.45Å; W215-F260 HydrophobicContact CB-CD2 3.7Å; W215-F260 HydrophobicContact CB-CE2 3.85Å; W215-F260 AromaticContact CD1-CD2 3.97Å; W215-F260 HydrophobicContact CD2-CB 3.7Å; W215-F260 AromaticContact CD2-CD2 3.77Å; W215-F260 HydrophobicContact CD2-CD2 3.77Å; W215-F260 HydrophobicContact CD2-CG 4.02Å; W215-F260 HydrophobicContact CE3-CB 3.74Å; W215-F260 HydrophobicContact CE3-CD2 4.2Å; W215-F260 HydrophobicContact CE3-CG 4.08Å; W215-F260 HydrophobicContact CG-CB 4.36Å; W215-F260 AromaticContact CG-CD2 3.52Å; W215-F260 HydrophobicContact CG-CD2 3.52Å; W215-F260 HydrophobicContact CG-CE2 4.19Å; W215-F260 HydrophobicContact CG-CG 4.27Å; W215-F260 HydrophobicContact CH2-CB 3.99Å; W215-F260 HydrophobicContact CZ2-CB 3.94Å; W215-F260 HydrophobicContact CZ3-CB 3.88Å
216	N	90.6	Very high	91.8	Very high	44 Å²	44	63.2 Å²	63.2	24%	0.235	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-83.5	140.9	-179.5	-166	65.8	0	0	0	111.3	Y212 S213 N214 I229 Y230	Y212-N216 WeakPolarHBondContact CD1-ND2 3.31Å; S213-N216 WeakPolarHBondContact O-CB 3.42Å; S213-N216 PolarHBondContact O-N 2.68Å; N214-N216 VanDerWaalsContact C-N 3.33Å; N216-I229 WeakPolarHBondContact OD1-CA 3.23Å; N216-Y230 PolarHBondContact OD1-N 2.74Å
217	P	92.2	Very high	92.1	Very high	86 Å²	86	63.1 Å²	63.1	56%	0.558	33%	0.332	S	S	*	.	S	Bend	cis	-82.8	155.9	2.6	34.3	-36.4	0	0	0	113.5
218	P	93.9	Very high	92.3	Very high	0 Å²	0	63.3 Å²	63.3	0%	0	33%	0.333	C	S	.	.	P	Polyproline II helix	trans	-54.7	140.1	177.5	-26.7	35.1	0	0	0	113.1	R222 R223 D227 L228 Y230	P218-R222 HydrophobicContact CB-CB 4.37Å; P218-R223 HydrophobicContact CB-CG 4.12Å; P218-R223 VanDerWaalsContact O-CZ 3.32Å; P218-R223 PolarHBondContact O-NE 3.49Å; P218-R223 PolarHBondContact O-NH2 2.9Å; P218-D227 HydrophobicContact CB-CB 3.95Å; P218-D227 HydrophobicContact CG-CB 4.05Å; P218-L228 WeakPolarHBondContact CD-O 3.45Å; P218-L228 WeakPolarHBondContact CG-O 3.16Å; P218-Y230 HydrophobicContact CB-CD2 4.49Å; P218-Y230 HydrophobicContact CB-CE2 3.79Å; P218-Y230 HydrophobicContact CG-CD1 4.45Å; P218-Y230 HydrophobicContact CG-CD2 3.97Å; P218-Y230 HydrophobicContact CG-CE1 4.2Å; P218-Y230 HydrophobicContact CG-CE2 3.73Å; P218-Y230 HydrophobicContact CG-CG 4.33Å
219	P	93.8	Very high	92.5	Very high	54 Å²	54	57.9 Å²	57.9	35%	0.351	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-70.3	157.8	176.5	28.8	-34.9	0	0	0	111.3	A221 R222 R223	P219-A221 VanDerWaalsContact C-N 3.31Å; P219-A221 PolarHBondContact O-N 2.9Å; P219-A221 VanDerWaalsContact O-N 3.15Å; P219-R222 HydrophobicContact CG-CB 4.04Å; P219-R222 HydrophobicContact CG-CG 3.85Å; P219-R222 WeakPolarHBondContact O-CA 3.16Å; P219-R222 PolarHBondContact O-N 2.85Å; P219-R223 PolarHBondContact O-N 3.26Å; P219-R223 VanDerWaalsContact O-N 3.08Å
220	P	94.3	Very high	92.8	Very high	97 Å²	97	55 Å²	55	63%	0.63	30%	0.299	S	S	*	.	H	α-helix	trans	-52.7	-42.1	-173.2	-29.5	36	0	0	0	114.7	R222 R223 L224	P220-R222 PolarHBondContact O-N 3.12Å; P220-R223 PolarHBondContact O-N 3.42Å; P220-L224 WeakPolarHBondContact O-CG 3.39Å; P220-L224 PolarHBondContact O-N 2.88Å; P220-L224 VanDerWaalsContact O-N 3.08Å
221	A	94.4	Very high	93	Very high	71 Å²	71	54.2 Å²	54.2	59%	0.587	30%	0.295	S	S	*	.	H	α-helix	trans	-64.2	-21.6	177.6	0	0	0	0	0	114.2	P219	P219-A221 VanDerWaalsContact C-N 3.31Å; P219-A221 PolarHBondContact O-N 2.9Å; P219-A221 VanDerWaalsContact O-N 3.15Å
222	R	94.6	Very high	93.2	Very high	31 Å²	31	54.4 Å²	54.4	12%	0.117	30%	0.295	C	S	.	.	H	α-helix	trans	-91.1	-31.3	174.1	-71.4	-56.2	-52.8	-164.9	-2.3	112.7	P218 P219 P220 L224 L225 G226 D227 Y230 P262	P218-R222 HydrophobicContact CB-CB 4.37Å; P219-R222 HydrophobicContact CG-CB 4.04Å; P219-R222 HydrophobicContact CG-CG 3.85Å; P219-R222 WeakPolarHBondContact O-CA 3.16Å; P219-R222 PolarHBondContact O-N 2.85Å; P220-R222 PolarHBondContact O-N 3.12Å; R222-L224 VanDerWaalsContact C-N 3.28Å; R222-L224 PolarHBondContact O-N 3Å; R222-L225 CarbonylContact O-C 3.53Å; R222-L225 WeakPolarHBondContact O-CA 3.49Å; R222-L225 WeakPolarHBondContact O-CB 3.3Å; R222-L225 PolarHBondContact O-N 3.25Å; R222-G226 PolarHBondContact O-N 2.89Å; R222-D227 HydrophobicContact CB-CB 4.15Å; R222-D227 WeakPolarHBondContact CB-OD2 3.38Å; R222-D227 IonicContact CZ-OD1 2.88Å; R222-D227 IonicContact CZ-OD2 3.03Å; R222-D227 IonicContact NE-OD1 2.71Å; R222-D227 IonicContact NE-OD2 3.52Å; R222-D227 PolarHBondContact NE-OD2 2.9Å; R222-D227 VanDerWaalsContact NH2-CG 3.26Å; R222-D227 IonicContact NH2-OD1 3.98Å; R222-D227 PolarHBondContact NH2-OD1 3.15Å; R222-D227 IonicContact NH2-OD2 2.83Å; R222-D227 PolarHBondContact NH2-OD2 3.18Å; R222-D227 PolarHBondContact O-N 3.19Å; R222-Y230 WeakPolarHBondContact CB-OH 3.48Å; R222-P262 HydrophobicContact CG-CG 4.11Å; R222-P262 PolarHBondContact NH2-O 3.39Å; R222-P262 VanDerWaalsContact NH2-O 3.12Å
223	R	93.5	Very high	93.5	Very high	141 Å²	141	53 Å²	53	53%	0.532	29%	0.289	S	S	.	.	H	α-helix	trans	-60.7	-38.6	168.7	-60.6	-176.5	-159.6	179.9	5.1	111.6	P218 P219 P220 L225 G226	P218-R223 HydrophobicContact CB-CG 4.12Å; P218-R223 VanDerWaalsContact O-CZ 3.32Å; P218-R223 PolarHBondContact O-NE 3.49Å; P218-R223 PolarHBondContact O-NH2 2.9Å; P219-R223 PolarHBondContact O-N 3.26Å; P219-R223 VanDerWaalsContact O-N 3.08Å; P220-R223 PolarHBondContact O-N 3.42Å; R223-L225 PolarHBondContact O-N 3Å; R223-G226 PolarHBondContact O-N 3.01Å
224	L	92.1	Very high	93.6	Very high	155 Å²	155	54.4 Å²	54.4	81%	0.812	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-16.6	172.2	-69.4	174.5	0	0	0	114.1	P220 R222	P220-L224 WeakPolarHBondContact O-CG 3.39Å; P220-L224 PolarHBondContact O-N 2.88Å; P220-L224 VanDerWaalsContact O-N 3.08Å; R222-L224 VanDerWaalsContact C-N 3.28Å; R222-L224 PolarHBondContact O-N 3Å
225	L	92.7	Very high	93.8	Very high	121 Å²	121	47.1 Å²	47.1	63%	0.634	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	4.8	172.2	-62.7	175.8	0	0	0	112.8	R222 R223	R222-L225 CarbonylContact O-C 3.53Å; R222-L225 WeakPolarHBondContact O-CA 3.49Å; R222-L225 WeakPolarHBondContact O-CB 3.3Å; R222-L225 PolarHBondContact O-N 3.25Å; R223-L225 PolarHBondContact O-N 3Å
226	G	93.1	Very high	93.8	Very high	19 Å²	19	45.1 Å²	45.1	20%	0.196	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.6	12.4	177.8	0	0	0	0	0	115.9	R222 R223 L228 C246 P247	R222-G226 PolarHBondContact O-N 2.89Å; R223-G226 PolarHBondContact O-N 3.01Å; G226-L228 PolarHBondContact O-N 3.09Å; G226-C246 VanDerWaalsContact O-CA 3.22Å; G226-C246 WeakPolarHBondContact O-CA 3.45Å; G226-C246 WeakPolarHBondContact O-CB 3.4Å; G226-P247 WeakPolarHBondContact O-CD 3.43Å
227	D	96.1	Very high	94	Very high	4 Å²	4	46.4 Å²	46.4	2%	0.021	26%	0.256	C	S	.	.			trans	-75.6	119.1	171.6	-65.8	-2.9	0	0	0	110.2	P218 R222 Y230 T244 Y251	P218-D227 HydrophobicContact CB-CB 3.95Å; P218-D227 HydrophobicContact CG-CB 4.05Å; R222-D227 HydrophobicContact CB-CB 4.15Å; R222-D227 WeakPolarHBondContact CB-OD2 3.38Å; R222-D227 IonicContact CZ-OD1 2.88Å; R222-D227 IonicContact CZ-OD2 3.03Å; R222-D227 IonicContact NE-OD1 2.71Å; R222-D227 IonicContact NE-OD2 3.52Å; R222-D227 PolarHBondContact NE-OD2 2.9Å; R222-D227 VanDerWaalsContact NH2-CG 3.26Å; R222-D227 IonicContact NH2-OD1 3.98Å; R222-D227 PolarHBondContact NH2-OD1 3.15Å; R222-D227 IonicContact NH2-OD2 2.83Å; R222-D227 PolarHBondContact NH2-OD2 3.18Å; R222-D227 PolarHBondContact O-N 3.19Å; D227-Y230 HydrophobicContact CB-CE1 3.93Å; D227-Y230 WeakPolarHBondContact OD2-CE1 3.27Å; D227-Y230 PolarHBondContact OD2-OH 3.28Å; D227-T244 HydrophobicContact CB-CG2 4.01Å; D227-T244 WeakPolarHBondContact OD1-CG2 3.24Å; D227-Y251 PolarHBondContact OD1-OH 3.23Å
228	L	95	Very high	94.1	Very high	25 Å²	25	46.6 Å²	46.6	13%	0.131	25%	0.253	C	S	.	.			trans	-93	-57.2	-176.4	-60.2	170.2	0	0	0	112.3	Y115 V117 A120 P218 G226 A245 P247	Y115-L228 VanDerWaalsContact O-CD1 3.28Å; Y115-L228 WeakPolarHBondContact O-CD1 3.09Å; V117-L228 HydrophobicContact CG2-CB 4.27Å; V117-L228 HydrophobicContact CG2-CD2 3.81Å; A120-L228 HydrophobicContact CB-CD1 4.19Å; P218-L228 WeakPolarHBondContact CD-O 3.45Å; P218-L228 WeakPolarHBondContact CG-O 3.16Å; G226-L228 PolarHBondContact O-N 3.09Å; L228-A245 HydrophobicContact CB-CB 4.35Å; L228-A245 PolarHBondContact N-O 2.96Å; L228-P247 HydrophobicContact CD1-CG 4.36Å; L228-P247 HydrophobicContact CD2-CG 4.33Å
229	I	94.4	Very high	94.2	Very high	4 Å²	4	51.5 Å²	51.5	2%	0.021	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	156.3	177.8	55.2	170.6	0	0	0	109.8	V117 A120 V124 Y212 N216 L231 A245	V117-I229 HydrophobicContact CG1-CG2 4.42Å; A120-I229 HydrophobicContact CB-CD1 4.02Å; A120-I229 HydrophobicContact CB-CG1 4.22Å; V124-I229 HydrophobicContact CG2-CD1 4Å; Y212-I229 HydrophobicContact CE1-CB 4.3Å; Y212-I229 HydrophobicContact CE1-CD1 3.96Å; Y212-I229 HydrophobicContact CE1-CG2 4.33Å; N216-I229 WeakPolarHBondContact OD1-CA 3.23Å; I229-L231 HydrophobicContact CD1-CD2 4.29Å; I229-A245 HydrophobicContact CD1-CB 4.25Å; I229-A245 HydrophobicContact CG1-CB 3.47Å; I229-A245 VanDerWaalsContact CG1-CB 3.47Å; I229-A245 PolarHBondContact O-N 3.38Å
230	Y	95.3	Very high	94.2	Very high	1 Å²	1	54.1 Å²	54.1	0%	0.004	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	135	171.5	-57.4	-50.8	0	0	0	111.2	S213 W215 N216 P218 R222 D227 I243 T244 F260 P262	S213-Y230 WeakPolarHBondContact CB-O 3.2Å; S213-Y230 PolarHBondContact N-O 3.25Å; W215-Y230 HydrophobicContact CB-CD2 4.06Å; W215-Y230 WeakPolarHBondContact O-CD2 3.49Å; N216-Y230 PolarHBondContact OD1-N 2.74Å; P218-Y230 HydrophobicContact CB-CD2 4.49Å; P218-Y230 HydrophobicContact CB-CE2 3.79Å; P218-Y230 HydrophobicContact CG-CD1 4.45Å; P218-Y230 HydrophobicContact CG-CD2 3.97Å; P218-Y230 HydrophobicContact CG-CE1 4.2Å; P218-Y230 HydrophobicContact CG-CE2 3.73Å; P218-Y230 HydrophobicContact CG-CG 4.33Å; R222-Y230 WeakPolarHBondContact CB-OH 3.48Å; D227-Y230 HydrophobicContact CB-CE1 3.93Å; D227-Y230 WeakPolarHBondContact OD2-CE1 3.27Å; D227-Y230 PolarHBondContact OD2-OH 3.28Å; Y230-I243 CarbonylContact C-O 3.58Å; Y230-I243 WeakPolarHBondContact CA-O 3.44Å; Y230-T244 HydrophobicContact CD1-CG2 3.92Å; Y230-T244 HydrophobicContact CE1-CG2 3.73Å; Y230-F260 HydrophobicContact CD2-CE2 4.17Å; Y230-F260 AromaticContact CE2-CE2 3.55Å; Y230-F260 HydrophobicContact CE2-CE2 3.55Å; Y230-F260 AromaticContact CE2-CZ 3.63Å; Y230-F260 HydrophobicContact CE2-CZ 3.63Å; Y230-F260 AromaticContact CZ-CE2 3.88Å; Y230-F260 AromaticContact CZ-CZ 3.81Å; Y230-P262 HydrophobicContact CE1-CB 4.11Å; Y230-P262 WeakPolarHBondContact OH-CB 3.28Å
231	L	94.6	Very high	94.3	Very high	1 Å²	1	51.9 Å²	51.9	1%	0.005	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	160.4	179.5	-55.9	173	0	0	0	110.9	V124 N211 Y212 I229 H242 I243 F250 L274	V124-L231 HydrophobicContact CG1-CD2 4.24Å; V124-L231 HydrophobicContact CG2-CD1 3.67Å; V124-L231 HydrophobicContact CG2-CD2 4.11Å; V124-L231 HydrophobicContact CG2-CG 4.49Å; N211-L231 CarbonylContact O-C 3.56Å; N211-L231 WeakPolarHBondContact O-CA 3.35Å; Y212-L231 HydrophobicContact CD1-CD2 3.68Å; Y212-L231 HydrophobicContact CE1-CD2 3.92Å; Y212-L231 HydrophobicContact CG-CD2 4.33Å; I229-L231 HydrophobicContact CD1-CD2 4.29Å; L231-H242 WeakPolarHBondContact O-CA 3.36Å; L231-I243 HydrophobicContact CB-CB 4.2Å; L231-I243 PolarHBondContact N-O 3.16Å; L231-I243 PolarHBondContact O-N 2.98Å; L231-F250 HydrophobicContact CD1-CD1 4.27Å; L231-F250 HydrophobicContact CD1-CE1 4.21Å; L231-L274 HydrophobicContact CD1-CD1 4.35Å; L231-L274 HydrophobicContact CD1-CD2 3.69Å
232	F	94.4	Very high	94.4	Very high	17 Å²	17	48.9 Å²	48.9	8%	0.075	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	129.4	175.1	171	-94.2	0	0	0	108.8	Q209 N211 H234 K240 Y241 H242 D257	Q209-F232 HydrophobicContact CB-CE1 4.39Å; Q209-F232 HydrophobicContact CG-CD1 4.34Å; Q209-F232 HydrophobicContact CG-CE1 4.3Å; N211-F232 PolarHBondContact N-O 3.01Å; N211-F232 PolarHBondContact O-N 2.92Å; F232-H234 HydrophobicContact CE1-CB 3.99Å; F232-H234 HydrophobicContact CZ-CB 4.28Å; F232-K240 HydrophobicContact CE2-CB 4.06Å; F232-K240 HydrophobicContact CE2-CD 3.96Å; F232-K240 HydrophobicContact CE2-CG 4.04Å; F232-K240 HydrophobicContact CZ-CB 4.33Å; F232-K240 HydrophobicContact CZ-CD 3.87Å; F232-K240 HydrophobicContact CZ-CG 3.85Å; F232-Y241 WeakPolarHBondContact CA-O 3.35Å; F232-H242 AromaticContact CD2-NE2 3.66Å; F232-D257 WeakPolarHBondContact CE2-OD1 3.08Å
233	F	94.5	Very high	94.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	120.5	-177.3	173.7	-138.1	0	0	0	110.6	V207 L210 T235 K240 Y241 I243 L278 L281	V207-F233 HydrophobicContact CB-CE2 4.25Å; V207-F233 HydrophobicContact CG1-CE2 3.8Å; L210-F233 HydrophobicContact CD1-CB 4.15Å; L210-F233 HydrophobicContact CD1-CD2 4.29Å; L210-F233 HydrophobicContact CD1-CG 4.49Å; F233-T235 HydrophobicContact CD1-CG2 4Å; F233-T235 HydrophobicContact CE1-CG2 3.5Å; F233-T235 VanDerWaalsContact CE1-CG2 3.5Å; F233-T235 HydrophobicContact CE2-CG2 4.26Å; F233-T235 HydrophobicContact CZ-CG2 3.65Å; F233-K240 CarbonylContact O-C 3.57Å; F233-K240 WeakPolarHBondContact O-CA 3.17Å; F233-Y241 AromaticContact CD1-CD2 3.96Å; F233-Y241 HydrophobicContact CD1-CD2 3.96Å; F233-Y241 HydrophobicContact CE1-CD2 4.45Å; F233-Y241 PolarHBondContact N-O 3.35Å; F233-Y241 PolarHBondContact O-N 2.82Å; F233-I243 HydrophobicContact CB-CD1 3.94Å; F233-I243 HydrophobicContact CD1-CD1 4.43Å; F233-L278 HydrophobicContact CB-CD2 4.29Å; F233-L278 HydrophobicContact CD1-CD2 3.33Å; F233-L278 HydrophobicContact CD2-CD2 3.84Å; F233-L278 HydrophobicContact CE1-CB 4.39Å; F233-L278 HydrophobicContact CE1-CD2 3.39Å; F233-L278 HydrophobicContact CE1-CG 4.45Å; F233-L278 HydrophobicContact CE2-CD2 3.92Å; F233-L278 HydrophobicContact CG-CD2 3.56Å; F233-L278 HydrophobicContact CZ-CB 4.38Å; F233-L278 HydrophobicContact CZ-CD2 3.7Å; F233-L281 HydrophobicContact CD1-CD1 4.13Å; F233-L281 HydrophobicContact CE1-CB 4.04Å; F233-L281 HydrophobicContact CE1-CD1 4.35Å
234	H	93.9	Very high	94.7	Very high	34 Å²	34	40.7 Å²	40.7	16%	0.157	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	115.3	172.3	-171.6	178.3	0	0	0	108.7	R208 Q209 F232 D238 K239	R208-H234 HydrophobicContact CB-CB 4.12Å; R208-H234 WeakPolarHBondContact CB-O 3.26Å; R208-H234 WeakPolarHBondContact CD-NE2 3.48Å; R208-H234 PolarHBondContact N-O 2.82Å; Q209-H234 HydrophobicContact CB-CB 3.86Å; Q209-H234 PolarHBondContact N-O 2.7Å; Q209-H234 PolarHBondContact O-N 2.82Å; F232-H234 HydrophobicContact CE1-CB 3.99Å; F232-H234 HydrophobicContact CZ-CB 4.28Å; H234-D238 IonicContact CD2-OD1 3.64Å; H234-D238 IonicContact CE1-OD1 3.56Å; H234-D238 IonicContact NE2-OD1 2.83Å; H234-D238 PolarHBondContact NE2-OD1 2.74Å; H234-K239 CarbonylContact C-O 3.59Å; H234-K239 WeakPolarHBondContact CA-O 3.36Å; H234-K239 PolarHBondContact CD2-O 2.98Å
235	T	94.6	Very high	94.9	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.164	C	C	.	.			trans	-80.9	164.1	-175.2	86.3	0	0	0	0	112.2	R208 F233 E237 D238 K239 Y241	R208-T235 WeakPolarHBondContact CD-O 3.37Å; R208-T235 WeakPolarHBondContact CG-O 3.49Å; F233-T235 HydrophobicContact CD1-CG2 4Å; F233-T235 HydrophobicContact CE1-CG2 3.5Å; F233-T235 VanDerWaalsContact CE1-CG2 3.5Å; F233-T235 HydrophobicContact CE2-CG2 4.26Å; F233-T235 HydrophobicContact CZ-CG2 3.65Å; T235-E237 WeakPolarHBondContact CB-OE2 3.45Å; T235-E237 PolarHBondContact O-N 2.87Å; T235-E237 PolarHBondContact OG1-N 2.95Å; T235-E237 PolarHBondContact OG1-OE2 2.98Å; T235-D238 PolarHBondContact O-N 3.45Å; T235-D238 VanDerWaalsContact O-N 3.12Å; T235-K239 HydrophobicContact CG2-CB 4.06Å; T235-K239 PolarHBondContact N-O 2.69Å; T235-K239 PolarHBondContact OG1-N 2.87Å; T235-Y241 HydrophobicContact CG2-CD2 3.83Å; T235-Y241 HydrophobicContact CG2-CE2 3.63Å
236	L	92.6	Very high	95	Very high	42 Å²	42	28.5 Å²	28.5	22%	0.22	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-33.8	175.3	-60.3	178.4	0	0	0	112.1	K205 C206 R208 D238 N288	K205-L236 HydrophobicContact CG-CD2 4.33Å; K205-L236 WeakPolarHBondContact O-CD1 3.31Å; C206-L236 WeakPolarHBondContact O-CG 3.4Å; R208-L236 HydrophobicContact CG-CD2 4.29Å; R208-L236 PolarHBondContact NE-O 3.43Å; R208-L236 VanDerWaalsContact NE-O 3.14Å; R208-L236 PolarHBondContact NH2-O 3Å; L236-D238 PolarHBondContact O-N 2.79Å; L236-N288 WeakPolarHBondContact CD1-ND2 3.27Å
237	E	94.5	Very high	95.2	Very high	71 Å²	71	29.8 Å²	29.8	33%	0.332	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	17.8	176	-43.5	88.4	161.2	0	0	114.3	T235 K239 S282 P283 G284	T235-E237 WeakPolarHBondContact CB-OE2 3.45Å; T235-E237 PolarHBondContact O-N 2.87Å; T235-E237 PolarHBondContact OG1-N 2.95Å; T235-E237 PolarHBondContact OG1-OE2 2.98Å; E237-K239 VanDerWaalsContact C-N 3.26Å; E237-K239 PolarHBondContact O-N 3.2Å; E237-S282 VanDerWaalsContact CD-OG 3.23Å; E237-S282 PolarHBondContact OE1-OG 2.94Å; E237-S282 PolarHBondContact OE2-OG 2.98Å; E237-P283 VanDerWaalsContact OE1-CD 3.3Å; E237-P283 WeakPolarHBondContact OE1-CD 3.4Å; E237-G284 WeakPolarHBondContact OE1-CA 3.45Å; E237-G284 PolarHBondContact OE1-N 3.35Å
238	D	94.2	Very high	95.1	Very high	90 Å²	90	38.6 Å²	38.6	48%	0.481	18%	0.178	S	C	.	.	S	Bend	trans	58.7	27.4	177.1	-74.1	-55.5	0	0	0	115.9	R208 H234 T235 L236	R208-D238 VanDerWaalsContact CD-OD1 3.26Å; R208-D238 WeakPolarHBondContact CD-OD1 3.39Å; R208-D238 VanDerWaalsContact CZ-CG 3.46Å; R208-D238 IonicContact CZ-OD1 3.08Å; R208-D238 IonicContact CZ-OD2 3.19Å; R208-D238 IonicContact NE-OD1 3.04Å; R208-D238 PolarHBondContact NE-OD1 3.28Å; R208-D238 IonicContact NE-OD2 3.6Å; R208-D238 IonicContact NH1-OD1 3.5Å; R208-D238 IonicContact NH1-OD2 3.9Å; R208-D238 IonicContact NH2-OD1 3.45Å; R208-D238 PolarHBondContact NH2-OD1 2.94Å; R208-D238 IonicContact NH2-OD2 2.66Å; R208-D238 PolarHBondContact NH2-OD2 3.44Å; H234-D238 IonicContact CD2-OD1 3.64Å; H234-D238 IonicContact CE1-OD1 3.56Å; H234-D238 IonicContact NE2-OD1 2.83Å; H234-D238 PolarHBondContact NE2-OD1 2.74Å; T235-D238 PolarHBondContact O-N 3.45Å; T235-D238 VanDerWaalsContact O-N 3.12Å; L236-D238 PolarHBondContact O-N 2.79Å
239	K	95.2	Very high	95	Very high	103 Å²	103	37.4 Å²	37.4	45%	0.448	17%	0.171	S	C	.	.			trans	-88.7	146.3	167.9	-57.8	-177.4	-172.3	173	0	110.5	H234 T235 E237 Y241	H234-K239 CarbonylContact C-O 3.59Å; H234-K239 WeakPolarHBondContact CA-O 3.36Å; H234-K239 PolarHBondContact CD2-O 2.98Å; T235-K239 HydrophobicContact CG2-CB 4.06Å; T235-K239 PolarHBondContact N-O 2.69Å; T235-K239 PolarHBondContact OG1-N 2.87Å; E237-K239 VanDerWaalsContact C-N 3.26Å; E237-K239 PolarHBondContact O-N 3.2Å; K239-Y241 HydrophobicContact CB-CD2 4.48Å; K239-Y241 HydrophobicContact CB-CE2 3.75Å; K239-Y241 HydrophobicContact CD-CE2 4.33Å; K239-Y241 WeakPolarHBondContact CD-OH 3.43Å
240	K	94.9	Very high	95.2	Very high	109 Å²	109	37.2 Å²	37.2	47%	0.474	17%	0.17	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	139.2	173.4	-68.2	-179.3	171.5	-174.8	0	110.2	F232 F233 D257	F232-K240 HydrophobicContact CE2-CB 4.06Å; F232-K240 HydrophobicContact CE2-CD 3.96Å; F232-K240 HydrophobicContact CE2-CG 4.04Å; F232-K240 HydrophobicContact CZ-CB 4.33Å; F232-K240 HydrophobicContact CZ-CD 3.87Å; F232-K240 HydrophobicContact CZ-CG 3.85Å; F233-K240 CarbonylContact O-C 3.57Å; F233-K240 WeakPolarHBondContact O-CA 3.17Å; K240-D257 IonicContact NZ-OD2 3.88Å; K240-D257 PolarHBondContact NZ-OD2 2.72Å
241	Y	95.5	Very high	95.3	Very high	50 Å²	50	38 Å²	38	20%	0.196	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	137.4	177	-62.2	-75.4	0	0	0	110.6	F232 F233 T235 K239 V252 L281	F232-Y241 WeakPolarHBondContact CA-O 3.35Å; F233-Y241 AromaticContact CD1-CD2 3.96Å; F233-Y241 HydrophobicContact CD1-CD2 3.96Å; F233-Y241 HydrophobicContact CE1-CD2 4.45Å; F233-Y241 PolarHBondContact N-O 3.35Å; F233-Y241 PolarHBondContact O-N 2.82Å; T235-Y241 HydrophobicContact CG2-CD2 3.83Å; T235-Y241 HydrophobicContact CG2-CE2 3.63Å; K239-Y241 HydrophobicContact CB-CD2 4.48Å; K239-Y241 HydrophobicContact CB-CE2 3.75Å; K239-Y241 HydrophobicContact CD-CE2 4.33Å; K239-Y241 WeakPolarHBondContact CD-OH 3.43Å; Y241-V252 HydrophobicContact CD1-CG1 3.99Å; Y241-V252 HydrophobicContact CD1-CG2 4.42Å; Y241-L281 HydrophobicContact CD1-CD2 4.29Å; Y241-L281 HydrophobicContact CD2-CB 4.38Å; Y241-L281 HydrophobicContact CD2-CD1 4.19Å; Y241-L281 HydrophobicContact CE1-CD2 3.99Å; Y241-L281 HydrophobicContact CE2-CB 4.04Å; Y241-L281 HydrophobicContact CE2-CD2 4.29Å; Y241-L281 HydrophobicContact CG-CD1 4.23Å
242	H	96.4	Very high	95.4	Very high	9 Å²	9	38.3 Å²	38.3	4%	0.042	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	130.4	165	-64.8	-96.1	0	0	0	109.1	S213 W215 L231 F232 V252 N253 S255 D257	S213-H242 WeakPolarHBondContact CB-CE1 3.41Å; S213-H242 PolarHBondContact OG-CE1 2.71Å; S213-H242 PolarHBondContact OG-ND1 2.71Å; W215-H242 AromaticContact CD1-CE1 3.84Å; L231-H242 WeakPolarHBondContact O-CA 3.36Å; F232-H242 AromaticContact CD2-NE2 3.66Å; H242-V252 WeakPolarHBondContact O-CA 3.34Å; H242-N253 WeakPolarHBondContact CB-OD1 3.39Å; H242-N253 PolarHBondContact O-N 2.84Å; H242-S255 PolarHBondContact CD2-O 2.93Å; H242-D257 IonicContact NE2-OD1 3.82Å
243	I	97	Very high	95.4	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	138.8	-174.2	-66.4	166.5	0	0	0	108.4	Y230 L231 F233 F250 Y251 V252 L274 L277 L278 L281	Y230-I243 CarbonylContact C-O 3.58Å; Y230-I243 WeakPolarHBondContact CA-O 3.44Å; L231-I243 HydrophobicContact CB-CB 4.2Å; L231-I243 PolarHBondContact N-O 3.16Å; L231-I243 PolarHBondContact O-N 2.98Å; F233-I243 HydrophobicContact CB-CD1 3.94Å; F233-I243 HydrophobicContact CD1-CD1 4.43Å; I243-F250 HydrophobicContact CG2-CB 4.01Å; I243-F250 HydrophobicContact CG2-CD1 4.28Å; I243-Y251 CarbonylContact C-O 3.3Å; I243-Y251 VanDerWaalsContact CA-O 3.31Å; I243-Y251 WeakPolarHBondContact CA-O 3.45Å; I243-V252 HydrophobicContact CG1-CG2 4.25Å; I243-L274 HydrophobicContact CD1-CD1 4.09Å; I243-L274 HydrophobicContact CG2-CD1 4.28Å; I243-L277 HydrophobicContact CD1-CD2 3.96Å; I243-L277 HydrophobicContact CG1-CD2 4.05Å; I243-L277 HydrophobicContact CG2-CD2 3.83Å; I243-L278 HydrophobicContact CD1-CD2 4.17Å; I243-L281 HydrophobicContact CD1-CD1 4.35Å
244	T	97.2	Very high	95.5	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	133.5	169.3	-57	0	0	0	0	109.2	D227 Y230 F250 Y251 N253	D227-T244 HydrophobicContact CB-CG2 4.01Å; D227-T244 WeakPolarHBondContact OD1-CG2 3.24Å; Y230-T244 HydrophobicContact CD1-CG2 3.92Å; Y230-T244 HydrophobicContact CE1-CG2 3.73Å; T244-F250 WeakPolarHBondContact O-CA 3.41Å; T244-Y251 HydrophobicContact CG2-CE1 3.63Å; T244-Y251 HydrophobicContact CG2-CE2 4.49Å; T244-Y251 WeakPolarHBondContact CG2-OH 3.45Å; T244-Y251 PolarHBondContact N-O 3.04Å; T244-Y251 PolarHBondContact O-N 3.19Å; T244-N253 PolarHBondContact OG1-ND2 3.48Å
245	A	96.8	Very high	95.5	Very high	1 Å²	1	40.8 Å²	40.8	1%	0.008	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	139.4	161.8	0	0	0	0	0	110.1	A120 L228 I229 G249 F250	A120-A245 HydrophobicContact CB-CB 4.37Å; L228-A245 HydrophobicContact CB-CB 4.35Å; L228-A245 PolarHBondContact N-O 2.96Å; I229-A245 HydrophobicContact CD1-CB 4.25Å; I229-A245 HydrophobicContact CG1-CB 3.47Å; I229-A245 VanDerWaalsContact CG1-CB 3.47Å; I229-A245 PolarHBondContact O-N 3.38Å; A245-G249 CarbonylContact C-O 3.5Å; A245-G249 WeakPolarHBondContact CA-O 3.26Å; A245-F250 HydrophobicContact CB-CD1 3.64Å; A245-F250 HydrophobicContact CB-CE1 3.45Å; A245-F250 VanDerWaalsContact CB-CE1 3.45Å; A245-F250 HydrophobicContact CB-CZ 4.24Å
246	C	95.4	Very high	95.5	Very high	19 Å²	19	43.9 Å²	43.9	13%	0.128	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	173.1	172.5	71.7	0	0	0	0	110.3	G226 R248 G249 Y251	G226-C246 VanDerWaalsContact O-CA 3.22Å; G226-C246 WeakPolarHBondContact O-CA 3.45Å; G226-C246 WeakPolarHBondContact O-CB 3.4Å; C246-R248 PolarHBondContact O-N 3.27Å; C246-G249 PolarHBondContact N-O 3.18Å; C246-G249 PolarHBondContact O-N 3.33Å; C246-Y251 HydrophobicContact CB-CE1 4.31Å
247	P	96	Very high	95.3	Very high	45 Å²	45	45.1 Å²	45.1	29%	0.292	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	13.2	177.2	-26.4	35.2	0	0	0	116.8	R114 Y115 G226 L228	R114-P247 WeakPolarHBondContact CA-O 3.43Å; R114-P247 HydrophobicContact CB-CB 4.29Å; R114-P247 WeakPolarHBondContact CB-O 3.4Å; R114-P247 WeakPolarHBondContact CG-O 3.06Å; Y115-P247 WeakPolarHBondContact O-CA 3.48Å; G226-P247 WeakPolarHBondContact O-CD 3.43Å; L228-P247 HydrophobicContact CD1-CG 4.36Å; L228-P247 HydrophobicContact CD2-CG 4.33Å
248	R	94.1	Very high	95.2	Very high	190 Å²	190	49.1 Å²	49.1	72%	0.717	24%	0.239	S	C	*	.	T	Hydrogen-bonded Turn	trans	-125.6	9.1	173.2	-64.9	-175.9	60.7	-169.5	-4.8	112.9	C246 V270	C246-R248 PolarHBondContact O-N 3.27Å; R248-V270 HydrophobicContact CB-CG1 4.46Å
249	G	94.6	Very high	95.3	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	103.4	-141.3	-174	0	0	0	0	0	112.9	A245 C246 A271 H272	A245-G249 CarbonylContact C-O 3.5Å; A245-G249 WeakPolarHBondContact CA-O 3.26Å; C246-G249 PolarHBondContact N-O 3.18Å; C246-G249 PolarHBondContact O-N 3.33Å; G249-A271 CarbonylContact C-O 3.56Å; G249-A271 WeakPolarHBondContact CA-O 3.42Å; G249-H272 WeakPolarHBondContact CA-O 3.47Å
250	F	97.1	Very high	95.2	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	141.2	-161.3	-56.3	-96.2	0	0	0	112.2	Y115 H123 V124 L231 I243 T244 A245 V270 A271 H272 L274 L277	Y115-F250 HydrophobicContact CE1-CE2 4.22Å; Y115-F250 HydrophobicContact CE1-CZ 4.45Å; Y115-F250 HydrophobicContact CE2-CE2 4.09Å; Y115-F250 AromaticContact CZ-CE2 3.87Å; H123-F250 AromaticContact CD2-CE2 3.36Å; H123-F250 WeakPolarHBondContact CD2-CE2 3.27Å; H123-F250 AromaticContact CD2-CZ 3.41Å; H123-F250 VanDerWaalsContact CD2-CZ 3.41Å; H123-F250 WeakPolarHBondContact CD2-CZ 3.42Å; H123-F250 AromaticContact NE2-CE2 3.66Å; V124-F250 HydrophobicContact CG2-CE1 4.42Å; L231-F250 HydrophobicContact CD1-CD1 4.27Å; L231-F250 HydrophobicContact CD1-CE1 4.21Å; I243-F250 HydrophobicContact CG2-CB 4.01Å; I243-F250 HydrophobicContact CG2-CD1 4.28Å; T244-F250 WeakPolarHBondContact O-CA 3.41Å; A245-F250 HydrophobicContact CB-CD1 3.64Å; A245-F250 HydrophobicContact CB-CE1 3.45Å; A245-F250 VanDerWaalsContact CB-CE1 3.45Å; A245-F250 HydrophobicContact CB-CZ 4.24Å; F250-V270 WeakPolarHBondContact O-CA 3.17Å; F250-A271 PolarHBondContact N-O 2.88Å; F250-A271 PolarHBondContact O-N 3.43Å; F250-H272 WeakPolarHBondContact CD2-O 3.12Å; F250-H272 WeakPolarHBondContact CE2-O 3.23Å; F250-L274 HydrophobicContact CB-CD1 4.24Å; F250-L274 HydrophobicContact CD1-CB 4.14Å; F250-L274 HydrophobicContact CD1-CD1 4.12Å; F250-L274 HydrophobicContact CD2-CB 3.75Å; F250-L274 HydrophobicContact CE1-CB 4.28Å; F250-L274 HydrophobicContact CE2-CB 3.94Å; F250-L274 HydrophobicContact CG-CB 3.88Å; F250-L274 HydrophobicContact CG-CD1 4.16Å; F250-L274 HydrophobicContact CZ-CB 4.21Å; F250-L277 HydrophobicContact CB-CD2 3.83Å
251	Y	97	Very high	95.2	Very high	17 Å²	17	46.3 Å²	46.3	7%	0.067	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	153.1	177.4	70	-92.4	0	0	0	112.6	D227 I243 T244 C246 N253 P262 P264 Y269	D227-Y251 PolarHBondContact OD1-OH 3.23Å; I243-Y251 CarbonylContact C-O 3.3Å; I243-Y251 VanDerWaalsContact CA-O 3.31Å; I243-Y251 WeakPolarHBondContact CA-O 3.45Å; T244-Y251 HydrophobicContact CG2-CE1 3.63Å; T244-Y251 HydrophobicContact CG2-CE2 4.49Å; T244-Y251 WeakPolarHBondContact CG2-OH 3.45Å; T244-Y251 PolarHBondContact N-O 3.04Å; T244-Y251 PolarHBondContact O-N 3.19Å; C246-Y251 HydrophobicContact CB-CE1 4.31Å; Y251-N253 HydrophobicContact CE2-CB 4.12Å; Y251-P262 PolarHBondContact OH-O 2.97Å; Y251-P264 HydrophobicContact CD2-CB 3.78Å; Y251-P264 HydrophobicContact CD2-CG 3.94Å; Y251-P264 HydrophobicContact CE2-CB 3.81Å; Y251-P264 HydrophobicContact CE2-CG 3.54Å; Y251-Y269 WeakPolarHBondContact CB-O 3.38Å
252	V	97.3	Very high	95	Very high	8 Å²	8	44.4 Å²	44.4	5%	0.048	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	128.2	174.3	-177.9	0	0	0	0	110.6	Y241 H242 I243 I265 L277 L281	Y241-V252 HydrophobicContact CD1-CG1 3.99Å; Y241-V252 HydrophobicContact CD1-CG2 4.42Å; H242-V252 WeakPolarHBondContact O-CA 3.34Å; I243-V252 HydrophobicContact CG1-CG2 4.25Å; V252-I265 HydrophobicContact CB-CD1 3.98Å; V252-I265 HydrophobicContact CB-CG1 4.26Å; V252-I265 HydrophobicContact CB-CG2 4.4Å; V252-I265 HydrophobicContact CG1-CD1 4.13Å; V252-I265 HydrophobicContact CG1-CG2 3.83Å; V252-I265 PolarHBondContact O-N 3.22Å; V252-L277 HydrophobicContact CG2-CD1 4.37Å; V252-L281 HydrophobicContact CG2-CD1 3.61Å; V252-L281 HydrophobicContact CG2-CD2 3.85Å; V252-L281 HydrophobicContact CG2-CG 4.32Å
253	N	95.1	Very high	94.9	Very high	5 Å²	5	48.6 Å²	48.6	3%	0.027	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	167.3	175.2	72.5	62.4	0	0	0	111.9	H242 T244 Y251 S255 H263	H242-N253 WeakPolarHBondContact CB-OD1 3.39Å; H242-N253 PolarHBondContact O-N 2.84Å; T244-N253 PolarHBondContact OG1-ND2 3.48Å; Y251-N253 HydrophobicContact CE2-CB 4.12Å; N253-S255 VanDerWaalsContact C-N 3.26Å; N253-S255 PolarHBondContact O-N 2.83Å; N253-S255 WeakPolarHBondContact OD1-CB 3.4Å; N253-S255 PolarHBondContact OD1-N 3.06Å; N253-S255 PolarHBondContact OD1-OG 3.17Å; N253-H263 CarbonylContact C-O 3.56Å; N253-H263 VanDerWaalsContact CA-O 3.25Å; N253-H263 WeakPolarHBondContact CA-O 3.4Å; N253-H263 WeakPolarHBondContact CB-O 3.45Å
254	M	95.4	Very high	94.7	Very high	87 Å²	87	51.5 Å²	51.5	43%	0.429	26%	0.259	S	S	.	.	S	Bend	trans	-83	12	-176.3	-70.4	-169.5	-72	0	0	114.5	N261 H263 I265	M254-N261 CarbonylContact C-O 3.5Å; M254-N261 HydrophobicContact CB-CB 4.11Å; M254-N261 WeakPolarHBondContact CB-ND2 3.38Å; M254-N261 PolarHBondContact N-O 2.79Å; M254-N261 VanDerWaalsContact N-O 3.16Å; M254-H263 HydrophobicContact CE-CB 3.57Å; M254-H263 PolarHBondContact N-O 3.44Å; M254-I265 HydrophobicContact CG-CB 4.4Å; M254-I265 HydrophobicContact CG-CG2 3.89Å
255	S	95.3	Very high	94.5	Very high	10 Å²	10	54.6 Å²	54.6	7%	0.07	28%	0.275	C	S	.	.			trans	-71.1	158.6	176.2	-49.3	0	0	0	0	111.5	H242 N253 Q259 N261	H242-S255 PolarHBondContact CD2-O 2.93Å; N253-S255 VanDerWaalsContact C-N 3.26Å; N253-S255 PolarHBondContact O-N 2.83Å; N253-S255 WeakPolarHBondContact OD1-CB 3.4Å; N253-S255 PolarHBondContact OD1-N 3.06Å; N253-S255 PolarHBondContact OD1-OG 3.17Å; S255-Q259 CarbonylContact C-O 3.58Å; S255-Q259 WeakPolarHBondContact CA-O 3.42Å; S255-N261 PolarHBondContact N-O 3.39Å; S255-N261 VanDerWaalsContact N-O 3.09Å; S255-N261 VanDerWaalsContact OG-C 3.26Å; S255-N261 PolarHBondContact OG-N 3.41Å; S255-N261 PolarHBondContact OG-O 2.88Å
256	T	93.5	Very high	94	Very high	66 Å²	66	62.3 Å²	62.3	41%	0.405	31%	0.311	S	S	.	.			trans	-129.3	175.7	170.5	57.5	0	0	0	0	109.3	W215 D258 Q259	W215-T256 PolarHBondContact NE1-O 3.45Å; T256-D258 PolarHBondContact O-N 2.79Å; T256-Q259 PolarHBondContact N-O 2.94Å; T256-Q259 WeakPolarHBondContact OG1-CB 3.05Å; T256-Q259 PolarHBondContact OG1-N 2.94Å; T256-Q259 PolarHBondContact OG1-O 2.81Å
257	D	89.2	Confident	93.5	Very high	67 Å²	67	69.5 Å²	69.5	36%	0.358	34%	0.342	S	S	.	.	S	Bend	trans	-55.9	-36.2	175.1	-62.2	-7.3	0	0	0	111.9	F232 K240 H242	F232-D257 WeakPolarHBondContact CE2-OD1 3.08Å; K240-D257 IonicContact NZ-OD2 3.88Å; K240-D257 PolarHBondContact NZ-OD2 2.72Å; H242-D257 IonicContact NE2-OD1 3.82Å
258	D	93.1	Very high	92.8	Very high	155 Å²	155	68.8 Å²	68.8	83%	0.829	34%	0.34	S	S	*	.	S	Bend	trans	-98.3	-28.1	-176.5	-57	-70.7	0	0	0	114.3	T256	T256-D258 PolarHBondContact O-N 2.79Å
259	Q	95.1	Very high	92.7	Very high	133 Å²	133	64.8 Å²	64.8	62%	0.621	33%	0.325	S	S	*	.			trans	-127.3	117.6	-173.4	-173	-177.9	10.9	0	0	112.5	S255 T256	S255-Q259 CarbonylContact C-O 3.58Å; S255-Q259 WeakPolarHBondContact CA-O 3.42Å; T256-Q259 PolarHBondContact N-O 2.94Å; T256-Q259 WeakPolarHBondContact OG1-CB 3.05Å; T256-Q259 PolarHBondContact OG1-N 2.94Å; T256-Q259 PolarHBondContact OG1-O 2.81Å
260	F	94.4	Very high	92.6	Very high	65 Å²	65	67.6 Å²	67.6	29%	0.285	34%	0.342	S	S	.	.			trans	-72.8	126.2	171.8	-175.5	-127.7	0	0	0	112.2	W215 Y230 P262	W215-F260 HydrophobicContact CB-CD2 3.7Å; W215-F260 HydrophobicContact CB-CE2 3.85Å; W215-F260 AromaticContact CD1-CD2 3.97Å; W215-F260 HydrophobicContact CD2-CB 3.7Å; W215-F260 AromaticContact CD2-CD2 3.77Å; W215-F260 HydrophobicContact CD2-CD2 3.77Å; W215-F260 HydrophobicContact CD2-CG 4.02Å; W215-F260 HydrophobicContact CE3-CB 3.74Å; W215-F260 HydrophobicContact CE3-CD2 4.2Å; W215-F260 HydrophobicContact CE3-CG 4.08Å; W215-F260 HydrophobicContact CG-CB 4.36Å; W215-F260 AromaticContact CG-CD2 3.52Å; W215-F260 HydrophobicContact CG-CD2 3.52Å; W215-F260 HydrophobicContact CG-CE2 4.19Å; W215-F260 HydrophobicContact CG-CG 4.27Å; W215-F260 HydrophobicContact CH2-CB 3.99Å; W215-F260 HydrophobicContact CZ2-CB 3.94Å; W215-F260 HydrophobicContact CZ3-CB 3.88Å; Y230-F260 HydrophobicContact CD2-CE2 4.17Å; Y230-F260 AromaticContact CE2-CE2 3.55Å; Y230-F260 HydrophobicContact CE2-CE2 3.55Å; Y230-F260 AromaticContact CE2-CZ 3.63Å; Y230-F260 HydrophobicContact CE2-CZ 3.63Å; Y230-F260 AromaticContact CZ-CE2 3.88Å; Y230-F260 AromaticContact CZ-CZ 3.81Å; F260-P262 HydrophobicContact CE1-CB 4.44Å; F260-P262 HydrophobicContact CE1-CG 3.76Å; F260-P262 HydrophobicContact CE2-CB 3.81Å; F260-P262 HydrophobicContact CE2-CG 4.01Å; F260-P262 HydrophobicContact CZ-CB 3.67Å; F260-P262 HydrophobicContact CZ-CG 3.47Å; F260-P262 VanDerWaalsContact CZ-CG 3.47Å
261	N	94.3	Very high	92.4	Very high	46 Å²	46	67.7 Å²	67.7	25%	0.246	34%	0.344	C	S	.	.			trans	-152	86.8	171.2	-175.5	6.2	0	0	0	110.2	M254 S255 H263	M254-N261 CarbonylContact C-O 3.5Å; M254-N261 HydrophobicContact CB-CB 4.11Å; M254-N261 WeakPolarHBondContact CB-ND2 3.38Å; M254-N261 PolarHBondContact N-O 2.79Å; M254-N261 VanDerWaalsContact N-O 3.16Å; S255-N261 PolarHBondContact N-O 3.39Å; S255-N261 VanDerWaalsContact N-O 3.09Å; S255-N261 VanDerWaalsContact OG-C 3.26Å; S255-N261 PolarHBondContact OG-N 3.41Å; S255-N261 PolarHBondContact OG-O 2.88Å; N261-H263 PolarHBondContact O-N 3.24Å; N261-H263 PolarHBondContact OD1-ND1 2.83Å
262	P	91.2	Very high	92.3	Very high	9 Å²	9	67.9 Å²	67.9	6%	0.058	35%	0.345	C	S	.	.			trans	-75.1	9.5	-170.9	32.6	-38.4	0	0	0	114.4	R222 Y230 Y251 F260	R222-P262 HydrophobicContact CG-CG 4.11Å; R222-P262 PolarHBondContact NH2-O 3.39Å; R222-P262 VanDerWaalsContact NH2-O 3.12Å; Y230-P262 HydrophobicContact CE1-CB 4.11Å; Y230-P262 WeakPolarHBondContact OH-CB 3.28Å; Y251-P262 PolarHBondContact OH-O 2.97Å; F260-P262 HydrophobicContact CE1-CB 4.44Å; F260-P262 HydrophobicContact CE1-CG 3.76Å; F260-P262 HydrophobicContact CE2-CB 3.81Å; F260-P262 HydrophobicContact CE2-CG 4.01Å; F260-P262 HydrophobicContact CZ-CB 3.67Å; F260-P262 HydrophobicContact CZ-CG 3.47Å; F260-P262 VanDerWaalsContact CZ-CG 3.47Å
263	H	93.1	Very high	92.1	Very high	97 Å²	97	67.6 Å²	67.6	45%	0.449	34%	0.344	S	S	.	.	S	Bend	trans	-73.3	143.9	173.4	-62.2	96.5	0	0	0	110.5	N253 M254 N261	N253-H263 CarbonylContact C-O 3.56Å; N253-H263 VanDerWaalsContact CA-O 3.25Å; N253-H263 WeakPolarHBondContact CA-O 3.4Å; N253-H263 WeakPolarHBondContact CB-O 3.45Å; M254-H263 HydrophobicContact CE-CB 3.57Å; M254-H263 PolarHBondContact N-O 3.44Å; N261-H263 PolarHBondContact O-N 3.24Å; N261-H263 PolarHBondContact OD1-ND1 2.83Å
264	P	93.3	Very high	92.1	Very high	61 Å²	61	67.4 Å²	67.4	40%	0.396	34%	0.342	S	S	.	.	B	Isolated β-bridge	trans	-57.3	147.9	174.8	-17.3	26.6	0	0	0	111.9	Y251 A268	Y251-P264 HydrophobicContact CD2-CB 3.78Å; Y251-P264 HydrophobicContact CD2-CG 3.94Å; Y251-P264 HydrophobicContact CE2-CB 3.81Å; Y251-P264 HydrophobicContact CE2-CG 3.54Å; P264-A268 HydrophobicContact CB-CB 3.52Å
265	I	92.9	Very high	92	Very high	65 Å²	65	63.2 Å²	63.2	33%	0.333	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-60.2	158.8	169.8	62.9	171.6	0	0	0	111.5	V252 M254 H267 A268	V252-I265 HydrophobicContact CB-CD1 3.98Å; V252-I265 HydrophobicContact CB-CG1 4.26Å; V252-I265 HydrophobicContact CB-CG2 4.4Å; V252-I265 HydrophobicContact CG1-CD1 4.13Å; V252-I265 HydrophobicContact CG1-CG2 3.83Å; V252-I265 PolarHBondContact O-N 3.22Å; M254-I265 HydrophobicContact CG-CB 4.4Å; M254-I265 HydrophobicContact CG-CG2 3.89Å; I265-H267 PolarHBondContact O-N 2.84Å; I265-A268 HydrophobicContact CG1-CB 3.74Å; I265-A268 VanDerWaalsContact O-CB 3.27Å; I265-A268 WeakPolarHBondContact O-CB 3.33Å; I265-A268 PolarHBondContact O-N 3.44Å
266	Q	86	Confident	91.9	Very high	163 Å²	163	64.4 Å²	64.4	76%	0.762	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	126.1	173.7	-164.1	-172.7	-38.5	0	0	109.7	A268	Q266-A268 VanDerWaalsContact C-N 3.34Å
267	H	84.9	Confident	92	Very high	170 Å²	170	61.3 Å²	61.3	79%	0.787	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.1	33.1	-170.6	-47.3	-74.2	0	0	0	114.8	I265 Y269	I265-H267 PolarHBondContact O-N 2.84Å; H267-Y269 PolarHBondContact O-N 3.07Å
268	A	82.8	Confident	92.3	Very high	30 Å²	30	58.1 Å²	58.1	25%	0.248	29%	0.291	C	S	.	.			trans	-52.3	122.9	174.2	0	0	0	0	0	112.8	P264 I265 Q266	P264-A268 HydrophobicContact CB-CB 3.52Å; I265-A268 HydrophobicContact CG1-CB 3.74Å; I265-A268 VanDerWaalsContact O-CB 3.27Å; I265-A268 WeakPolarHBondContact O-CB 3.33Å; I265-A268 PolarHBondContact O-N 3.44Å; Q266-A268 VanDerWaalsContact C-N 3.34Å
269	Y	90.6	Very high	92.3	Very high	106 Å²	106	54 Å²	54	42%	0.416	26%	0.264	S	S	.	.			trans	-75.6	139.6	164.4	-179.6	-117	0	0	0	109.6	Y251 H267 A271 L277 Q280	Y251-Y269 WeakPolarHBondContact CB-O 3.38Å; H267-Y269 PolarHBondContact O-N 3.07Å; Y269-A271 HydrophobicContact CD1-CB 4.25Å; Y269-A271 HydrophobicContact CE1-CB 3.68Å; Y269-L277 HydrophobicContact CD1-CD1 4.13Å; Y269-Q280 VanDerWaalsContact CB-OE1 3.3Å; Y269-Q280 VanDerWaalsContact CG-NE2 3.25Å
270	V	92.9	Very high	92.2	Very high	59 Å²	59	52.6 Å²	52.6	36%	0.358	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	118.1	171.4	-170.8	0	0	0	0	106.5	R248 F250	R248-V270 HydrophobicContact CB-CG1 4.46Å; F250-V270 WeakPolarHBondContact O-CA 3.17Å
271	A	93.5	Very high	92.3	Very high	3 Å²	3	50.6 Å²	50.6	3%	0.025	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	143.1	174.1	0	0	0	0	0	109.2	G249 F250 Y269 S273 D276 L277	G249-A271 CarbonylContact C-O 3.56Å; G249-A271 WeakPolarHBondContact CA-O 3.42Å; F250-A271 PolarHBondContact N-O 2.88Å; F250-A271 PolarHBondContact O-N 3.43Å; Y269-A271 HydrophobicContact CD1-CB 4.25Å; Y269-A271 HydrophobicContact CE1-CB 3.68Å; A271-S273 VanDerWaalsContact CB-O 3.27Å; A271-S273 WeakPolarHBondContact CB-O 3.47Å; A271-D276 HydrophobicContact CB-CB 4.32Å; A271-L277 HydrophobicContact CB-CB 3.99Å
272	H	94.1	Very high	92.3	Very high	20 Å²	20	48.4 Å²	48.4	9%	0.093	24%	0.238	C	C	.	.	S	Bend	trans	-65.9	-52.5	173.2	-175.9	-78.2	0	0	0	110.8	C80 E112 E113 Y115 G249 F250	C80-H272 PolarHBondContact O-CE1 3.01Å; C80-H272 PolarHBondContact O-NE2 2.96Å; E112-H272 VanDerWaalsContact CD-CB 3.4Å; E112-H272 VanDerWaalsContact CD-CG 3.44Å; E112-H272 HydrophobicContact CG-CB 4.26Å; E112-H272 WeakPolarHBondContact OE1-CB 3.34Å; E112-H272 IonicContact OE1-CG 2.71Å; E112-H272 WeakPolarHBondContact OE2-CB 3.48Å; E112-H272 IonicContact OE2-CD2 2.91Å; E112-H272 IonicContact OE2-CG 3.11Å; E113-H272 PolarHBondContact O-NE2 3.3Å; Y115-H272 AromaticContact CE2-CD2 3.87Å; Y115-H272 AromaticContact CE2-CE1 3.34Å; Y115-H272 WeakPolarHBondContact CE2-CE1 3.34Å; Y115-H272 AromaticContact CE2-CG 3.98Å; Y115-H272 AromaticContact CE2-ND1 3.64Å; Y115-H272 AromaticContact CE2-NE2 3.47Å; Y115-H272 WeakPolarHBondContact CE2-NE2 3.2Å; Y115-H272 VanDerWaalsContact CE2-O 3.23Å; Y115-H272 WeakPolarHBondContact CE2-O 3.23Å; Y115-H272 AromaticContact CZ-CE1 3.49Å; Y115-H272 VanDerWaalsContact CZ-CE1 3.49Å; Y115-H272 AromaticContact CZ-ND1 3.78Å; Y115-H272 PolarHBondContact OH-CE1 2.91Å; Y115-H272 PolarHBondContact OH-ND1 3.38Å; Y115-H272 VanDerWaalsContact OH-ND1 3.15Å; Y115-H272 PolarHBondContact OH-O 3.3Å; Y115-H272 VanDerWaalsContact OH-O 3.07Å; G249-H272 WeakPolarHBondContact CA-O 3.47Å; F250-H272 WeakPolarHBondContact CD2-O 3.12Å; F250-H272 WeakPolarHBondContact CE2-O 3.23Å
273	S	93.2	Very high	92.5	Very high	3 Å²	3	52.3 Å²	52.3	2%	0.021	26%	0.263	C	S	.	.	S	Bend	trans	-80.1	135.7	171.1	-175.3	0	0	0	0	111.9	S77 A271 I275 D276 L277	S77-S273 VanDerWaalsContact O-CB 3.26Å; S77-S273 WeakPolarHBondContact O-CB 3.44Å; S77-S273 PolarHBondContact O-OG 3.46Å; A271-S273 VanDerWaalsContact CB-O 3.27Å; A271-S273 WeakPolarHBondContact CB-O 3.47Å; S273-I275 VanDerWaalsContact C-N 3.27Å; S273-I275 PolarHBondContact O-N 3.49Å; S273-I275 PolarHBondContact OG-N 2.87Å; S273-D276 PolarHBondContact O-N 3Å; S273-L277 PolarHBondContact O-N 3.19Å
274	L	94.9	Very high	92.6	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.7	-35.6	168.5	173.8	63.4	0	0	0	111.1	H123 V124 I127 L231 I243 F250 D276 L277 L278	H123-L274 PolarHBondContact NE2-N 3.34Å; V124-L274 HydrophobicContact CG2-CD2 4.11Å; I127-L274 HydrophobicContact CD1-CB 3.63Å; I127-L274 HydrophobicContact CD1-CD2 4.03Å; I127-L274 HydrophobicContact CD1-CG 4.08Å; L231-L274 HydrophobicContact CD1-CD1 4.35Å; L231-L274 HydrophobicContact CD1-CD2 3.69Å; I243-L274 HydrophobicContact CD1-CD1 4.09Å; I243-L274 HydrophobicContact CG2-CD1 4.28Å; F250-L274 HydrophobicContact CB-CD1 4.24Å; F250-L274 HydrophobicContact CD1-CB 4.14Å; F250-L274 HydrophobicContact CD1-CD1 4.12Å; F250-L274 HydrophobicContact CD2-CB 3.75Å; F250-L274 HydrophobicContact CE1-CB 4.28Å; F250-L274 HydrophobicContact CE2-CB 3.94Å; F250-L274 HydrophobicContact CG-CB 3.88Å; F250-L274 HydrophobicContact CG-CD1 4.16Å; F250-L274 HydrophobicContact CZ-CB 4.21Å; L274-D276 VanDerWaalsContact C-N 3.26Å; L274-D276 PolarHBondContact O-N 3.48Å; L274-L277 HydrophobicContact CD1-CD2 4.41Å; L274-L277 WeakPolarHBondContact O-CB 3.49Å; L274-L277 PolarHBondContact O-N 2.61Å; L274-L277 VanDerWaalsContact O-N 3.16Å; L274-L278 HydrophobicContact CD1-CD2 4.17Å; L274-L278 HydrophobicContact CD1-CG 4.13Å; L274-L278 HydrophobicContact CG-CD1 4.16Å; L274-L278 HydrophobicContact CG-CG 4.19Å; L274-L278 VanDerWaalsContact O-CG 3.3Å; L274-L278 WeakPolarHBondContact O-CG 3.4Å; L274-L278 PolarHBondContact O-N 2.88Å
275	I	93.9	Very high	92.7	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-56.9	-39.3	177.7	-84.3	159.9	0	0	0	111.6	I127 L130 S273 L278 R279 F285 F289	I127-I275 HydrophobicContact CD1-CD1 4.09Å; I127-I275 HydrophobicContact CD1-CG1 3.85Å; I127-I275 HydrophobicContact CG1-CD1 3.7Å; I127-I275 HydrophobicContact CG1-CG1 3.91Å; I127-I275 HydrophobicContact CG2-CG1 4.31Å; L130-I275 HydrophobicContact CD1-CD1 4.05Å; S273-I275 VanDerWaalsContact C-N 3.27Å; S273-I275 PolarHBondContact O-N 3.49Å; S273-I275 PolarHBondContact OG-N 2.87Å; I275-L278 PolarHBondContact O-N 2.99Å; I275-R279 HydrophobicContact CG2-CG 4.3Å; I275-R279 WeakPolarHBondContact O-CB 3.47Å; I275-R279 VanDerWaalsContact O-CG 3.28Å; I275-R279 WeakPolarHBondContact O-CG 3.4Å; I275-R279 PolarHBondContact O-N 2.85Å; I275-F285 HydrophobicContact CG1-CZ 4.48Å; I275-F289 HydrophobicContact CD1-CE1 4.14Å; I275-F289 HydrophobicContact CD1-CE2 4.24Å; I275-F289 HydrophobicContact CD1-CZ 3.54Å; I275-F289 HydrophobicContact CG1-CE1 4.44Å; I275-F289 HydrophobicContact CG1-CZ 4.07Å; I275-F289 HydrophobicContact CG2-CD1 4.39Å; I275-F289 HydrophobicContact CG2-CE1 3.86Å; I275-F289 HydrophobicContact CG2-CZ 4.33Å
276	D	92.7	Very high	92.8	Very high	34 Å²	34	47.1 Å²	47.1	18%	0.182	24%	0.235	C	C	.	.	H	α-helix	trans	-75.4	-30.4	-178.8	-67	-46.1	0	0	0	112.7	A271 S273 L274 R279 Q280	A271-D276 HydrophobicContact CB-CB 4.32Å; S273-D276 PolarHBondContact O-N 3Å; L274-D276 VanDerWaalsContact C-N 3.26Å; L274-D276 PolarHBondContact O-N 3.48Å; D276-R279 VanDerWaalsContact OD1-CD 3.26Å; D276-R279 WeakPolarHBondContact OD1-CD 3.32Å; D276-R279 IonicContact OD1-CZ 2.74Å; D276-R279 IonicContact OD1-NE 2.64Å; D276-R279 IonicContact OD1-NH1 3.15Å; D276-R279 PolarHBondContact OD1-NH1 2.87Å; D276-Q280 PolarHBondContact O-N 2.74Å; D276-Q280 VanDerWaalsContact O-N 3.1Å
277	L	95.3	Very high	93.2	Very high	2 Å²	2	48 Å²	48	1%	0.01	23%	0.231	C	C	.	.	H	α-helix	trans	-63.4	-46.9	165.8	-174.9	64.6	0	0	0	111.1	I243 F250 V252 Y269 A271 S273 L274 R279 Q280 L281	I243-L277 HydrophobicContact CD1-CD2 3.96Å; I243-L277 HydrophobicContact CG1-CD2 4.05Å; I243-L277 HydrophobicContact CG2-CD2 3.83Å; F250-L277 HydrophobicContact CB-CD2 3.83Å; V252-L277 HydrophobicContact CG2-CD1 4.37Å; Y269-L277 HydrophobicContact CD1-CD1 4.13Å; A271-L277 HydrophobicContact CB-CB 3.99Å; S273-L277 PolarHBondContact O-N 3.19Å; L274-L277 HydrophobicContact CD1-CD2 4.41Å; L274-L277 WeakPolarHBondContact O-CB 3.49Å; L274-L277 PolarHBondContact O-N 2.61Å; L274-L277 VanDerWaalsContact O-N 3.16Å; L277-R279 PolarHBondContact O-N 2.9Å; L277-Q280 PolarHBondContact O-N 3.31Å; L277-L281 HydrophobicContact CD1-CD1 4.19Å; L277-L281 HydrophobicContact CD1-CG 4.37Å; L277-L281 HydrophobicContact CG-CD1 3.88Å; L277-L281 HydrophobicContact CG-CG 4.43Å; L277-L281 VanDerWaalsContact O-CG 3.28Å; L277-L281 WeakPolarHBondContact O-CG 3.26Å; L277-L281 PolarHBondContact O-N 3.07Å
278	L	95.7	Very high	93.6	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.3	-40.5	178.8	-60.6	179.1	0	0	0	112	L210 F233 I243 L274 I275 Q280 L281 S282 F285	L210-L278 HydrophobicContact CD1-CD1 4.5Å; L210-L278 HydrophobicContact CD1-CD2 4.35Å; L210-L278 HydrophobicContact CD2-CD1 3.89Å; F233-L278 HydrophobicContact CB-CD2 4.29Å; F233-L278 HydrophobicContact CD1-CD2 3.33Å; F233-L278 HydrophobicContact CD2-CD2 3.84Å; F233-L278 HydrophobicContact CE1-CB 4.39Å; F233-L278 HydrophobicContact CE1-CD2 3.39Å; F233-L278 HydrophobicContact CE1-CG 4.45Å; F233-L278 HydrophobicContact CE2-CD2 3.92Å; F233-L278 HydrophobicContact CG-CD2 3.56Å; F233-L278 HydrophobicContact CZ-CB 4.38Å; F233-L278 HydrophobicContact CZ-CD2 3.7Å; I243-L278 HydrophobicContact CD1-CD2 4.17Å; L274-L278 HydrophobicContact CD1-CD2 4.17Å; L274-L278 HydrophobicContact CD1-CG 4.13Å; L274-L278 HydrophobicContact CG-CD1 4.16Å; L274-L278 HydrophobicContact CG-CG 4.19Å; L274-L278 VanDerWaalsContact O-CG 3.3Å; L274-L278 WeakPolarHBondContact O-CG 3.4Å; L274-L278 PolarHBondContact O-N 2.88Å; I275-L278 PolarHBondContact O-N 2.99Å; L278-Q280 VanDerWaalsContact C-N 3.3Å; L278-Q280 PolarHBondContact O-N 3.28Å; L278-L281 PolarHBondContact O-N 3.01Å; L278-S282 PolarHBondContact O-N 3.34Å; L278-F285 HydrophobicContact CB-CD1 3.63Å; L278-F285 HydrophobicContact CB-CD2 4.34Å; L278-F285 HydrophobicContact CB-CE1 3.46Å; L278-F285 VanDerWaalsContact CB-CE1 3.46Å; L278-F285 HydrophobicContact CB-CE2 4.18Å; L278-F285 HydrophobicContact CB-CG 4.09Å; L278-F285 HydrophobicContact CB-CZ 3.75Å; L278-F285 HydrophobicContact CD1-CE1 4.3Å; L278-F285 HydrophobicContact CD1-CE2 3.84Å; L278-F285 HydrophobicContact CD1-CZ 3.7Å; L278-F285 HydrophobicContact CG-CZ 4.39Å
279	R	94.2	Very high	94.1	Very high	68 Å²	68	40.7 Å²	40.7	26%	0.257	19%	0.194	S	C	.	.	H	α-helix	trans	-59.8	-34.8	172.9	-78.5	165.8	168.1	166.9	-2	112.7	I275 D276 L277 F285 K286	I275-R279 HydrophobicContact CG2-CG 4.3Å; I275-R279 WeakPolarHBondContact O-CB 3.47Å; I275-R279 VanDerWaalsContact O-CG 3.28Å; I275-R279 WeakPolarHBondContact O-CG 3.4Å; I275-R279 PolarHBondContact O-N 2.85Å; D276-R279 VanDerWaalsContact OD1-CD 3.26Å; D276-R279 WeakPolarHBondContact OD1-CD 3.32Å; D276-R279 IonicContact OD1-CZ 2.74Å; D276-R279 IonicContact OD1-NE 2.64Å; D276-R279 IonicContact OD1-NH1 3.15Å; D276-R279 PolarHBondContact OD1-NH1 2.87Å; L277-R279 PolarHBondContact O-N 2.9Å; R279-F285 HydrophobicContact CG-CD1 4.17Å; R279-F285 HydrophobicContact CG-CE1 4.09Å; R279-K286 HydrophobicContact CB-CB 4.45Å; R279-K286 HydrophobicContact CG-CB 4.37Å; R279-K286 HydrophobicContact CG-CG 4.45Å
280	Q	93.3	Very high	94.1	Very high	104 Å²	104	39.5 Å²	39.5	49%	0.486	19%	0.192	S	C	.	.	H	α-helix	trans	-75.7	-39.3	175.8	-171.5	-172.3	81.2	0	0	112.1	Y269 D276 L277 L278	Y269-Q280 VanDerWaalsContact CB-OE1 3.3Å; Y269-Q280 VanDerWaalsContact CG-NE2 3.25Å; D276-Q280 PolarHBondContact O-N 2.74Å; D276-Q280 VanDerWaalsContact O-N 3.1Å; L277-Q280 PolarHBondContact O-N 3.31Å; L278-Q280 VanDerWaalsContact C-N 3.3Å; L278-Q280 PolarHBondContact O-N 3.28Å
281	L	94.5	Very high	94	Very high	22 Å²	22	39 Å²	39	12%	0.115	19%	0.192	C	C	.	.	H	α-helix	trans	-77.6	-30.6	-175.2	-67.6	173.3	0	0	0	114.1	F233 Y241 I243 V252 L277 L278	F233-L281 HydrophobicContact CD1-CD1 4.13Å; F233-L281 HydrophobicContact CE1-CB 4.04Å; F233-L281 HydrophobicContact CE1-CD1 4.35Å; Y241-L281 HydrophobicContact CD1-CD2 4.29Å; Y241-L281 HydrophobicContact CD2-CB 4.38Å; Y241-L281 HydrophobicContact CD2-CD1 4.19Å; Y241-L281 HydrophobicContact CE1-CD2 3.99Å; Y241-L281 HydrophobicContact CE2-CB 4.04Å; Y241-L281 HydrophobicContact CE2-CD2 4.29Å; Y241-L281 HydrophobicContact CG-CD1 4.23Å; I243-L281 HydrophobicContact CD1-CD1 4.35Å; V252-L281 HydrophobicContact CG2-CD1 3.61Å; V252-L281 HydrophobicContact CG2-CD2 3.85Å; V252-L281 HydrophobicContact CG2-CG 4.32Å; L277-L281 HydrophobicContact CD1-CD1 4.19Å; L277-L281 HydrophobicContact CD1-CG 4.37Å; L277-L281 HydrophobicContact CG-CD1 3.88Å; L277-L281 HydrophobicContact CG-CG 4.43Å; L277-L281 VanDerWaalsContact O-CG 3.28Å; L277-L281 WeakPolarHBondContact O-CG 3.26Å; L277-L281 PolarHBondContact O-N 3.07Å; L278-L281 PolarHBondContact O-N 3.01Å
282	S	96.1	Very high	93.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.192	C	C	.	.			trans	-134	107.7	-176.2	177.1	0	0	0	0	112.3	E237 L278 G284 F285 K286	E237-S282 VanDerWaalsContact CD-OG 3.23Å; E237-S282 PolarHBondContact OE1-OG 2.94Å; E237-S282 PolarHBondContact OE2-OG 2.98Å; L278-S282 PolarHBondContact O-N 3.34Å; S282-G284 PolarHBondContact O-N 3.38Å; S282-F285 WeakPolarHBondContact O-CB 3.33Å; S282-F285 PolarHBondContact O-N 2.96Å; S282-F285 PolarHBondContact OG-N 3.46Å; S282-K286 PolarHBondContact O-N 3.13Å
283	P	94.9	Very high	93.7	Very high	91 Å²	91	39.4 Å²	39.4	59%	0.591	19%	0.193	S	C	*	.	H	α-helix	trans	-57.2	-31.9	169.2	-27	35.8	0	0	0	113.7	E237 R287	E237-P283 VanDerWaalsContact OE1-CD 3.3Å; E237-P283 WeakPolarHBondContact OE1-CD 3.4Å; P283-R287 PolarHBondContact O-N 3.01Å; P283-R287 VanDerWaalsContact O-N 3.07Å
284	G	94	Very high	93.5	Very high	15 Å²	15	46 Å²	46	16%	0.155	22%	0.222	C	C	.	.	H	α-helix	trans	-66.3	-45.9	173.3	0	0	0	0	0	112.4	E237 S282 R287 N288	E237-G284 WeakPolarHBondContact OE1-CA 3.45Å; E237-G284 PolarHBondContact OE1-N 3.35Å; S282-G284 PolarHBondContact O-N 3.38Å; G284-R287 PolarHBondContact O-N 3.47Å; G284-N288 WeakPolarHBondContact O-CB 3.24Å; G284-N288 PolarHBondContact O-N 3.2Å
285	F	95.7	Very high	93	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-56.6	-50.6	171.5	178.5	-93.6	0	0	0	110.7	L131 C206 V207 I275 L278 R279 S282 R287 N288 F289	L131-F285 HydrophobicContact CD2-CE2 4.02Å; C206-F285 HydrophobicContact CB-CD2 3.89Å; C206-F285 HydrophobicContact CB-CE2 4.13Å; V207-F285 HydrophobicContact CG1-CD2 3.59Å; V207-F285 HydrophobicContact CG1-CE2 3.75Å; I275-F285 HydrophobicContact CG1-CZ 4.48Å; L278-F285 HydrophobicContact CB-CD1 3.63Å; L278-F285 HydrophobicContact CB-CD2 4.34Å; L278-F285 HydrophobicContact CB-CE1 3.46Å; L278-F285 VanDerWaalsContact CB-CE1 3.46Å; L278-F285 HydrophobicContact CB-CE2 4.18Å; L278-F285 HydrophobicContact CB-CG 4.09Å; L278-F285 HydrophobicContact CB-CZ 3.75Å; L278-F285 HydrophobicContact CD1-CE1 4.3Å; L278-F285 HydrophobicContact CD1-CE2 3.84Å; L278-F285 HydrophobicContact CD1-CZ 3.7Å; L278-F285 HydrophobicContact CG-CZ 4.39Å; R279-F285 HydrophobicContact CG-CD1 4.17Å; R279-F285 HydrophobicContact CG-CE1 4.09Å; S282-F285 WeakPolarHBondContact O-CB 3.33Å; S282-F285 PolarHBondContact O-N 2.96Å; S282-F285 PolarHBondContact OG-N 3.46Å; F285-R287 PolarHBondContact O-N 3.23Å; F285-N288 PolarHBondContact O-N 3.08Å; F285-F289 HydrophobicContact CD1-CB 4.45Å; F285-F289 HydrophobicContact CE1-CB 4.21Å; F285-F289 HydrophobicContact CE1-CG 4.21Å; F285-F289 HydrophobicContact CE2-CD2 4.48Å; F285-F289 HydrophobicContact CZ-CB 4.36Å; F285-F289 HydrophobicContact CZ-CD2 4.01Å; F285-F289 HydrophobicContact CZ-CG 4.15Å; F285-F289 WeakPolarHBondContact O-CB 3.1Å; F285-F289 PolarHBondContact O-N 3.28Å
286	K	94.8	Very high	92.6	Very high	99 Å²	99	50.3 Å²	50.3	43%	0.43	24%	0.243	S	C	.	.	H	α-helix	trans	-54.3	-52.5	-179.9	178.2	170.5	177.1	171.9	0	111.9	R279 S282 E290	R279-K286 HydrophobicContact CB-CB 4.45Å; R279-K286 HydrophobicContact CG-CB 4.37Å; R279-K286 HydrophobicContact CG-CG 4.45Å; S282-K286 PolarHBondContact O-N 3.13Å; K286-E290 WeakPolarHBondContact CE-OE1 3.34Å; K286-E290 VanDerWaalsContact CG-OE1 3.28Å; K286-E290 WeakPolarHBondContact CG-OE1 3.44Å; K286-E290 IonicContact NZ-OE1 2.8Å; K286-E290 WeakPolarHBondContact O-CB 3.18Å; K286-E290 VanDerWaalsContact O-CG 3.3Å; K286-E290 WeakPolarHBondContact O-CG 3.18Å; K286-E290 PolarHBondContact O-N 2.95Å
287	R	94.6	Very high	92.2	Very high	181 Å²	181	51.4 Å²	51.4	68%	0.683	26%	0.257	S	S	*	.	H	α-helix	trans	-61.8	-46.2	179.8	-178.6	-174.9	-65	157	0.6	112.4	P283 G284 F285 E290 S291	P283-R287 PolarHBondContact O-N 3.01Å; P283-R287 VanDerWaalsContact O-N 3.07Å; G284-R287 PolarHBondContact O-N 3.47Å; F285-R287 PolarHBondContact O-N 3.23Å; R287-E290 PolarHBondContact O-N 2.64Å; R287-S291 PolarHBondContact O-N 3.48Å; R287-S291 VanDerWaalsContact O-N 3.12Å
288	N	94	Very high	91.5	Very high	46 Å²	46	54.2 Å²	54.2	25%	0.246	28%	0.281	C	S	.	.	H	α-helix	trans	-73	-35.9	-175	-71.4	14.1	0	0	0	110.9	V204 K205 C206 L236 G284 F285 S291 L292	V204-N288 HydrophobicContact CG1-CB 4.18Å; V204-N288 VanDerWaalsContact CG1-O 3.27Å; V204-N288 WeakPolarHBondContact CG1-O 3.05Å; K205-N288 PolarHBondContact O-ND2 3.4Å; C206-N288 HydrophobicContact CB-CB 4.31Å; L236-N288 WeakPolarHBondContact CD1-ND2 3.27Å; G284-N288 WeakPolarHBondContact O-CB 3.24Å; G284-N288 PolarHBondContact O-N 3.2Å; F285-N288 PolarHBondContact O-N 3.08Å; N288-S291 CarbonylContact O-C 3.59Å; N288-S291 WeakPolarHBondContact O-CA 3.24Å; N288-S291 WeakPolarHBondContact O-CB 3.4Å; N288-S291 PolarHBondContact O-N 3.43Å; N288-S291 VanDerWaalsContact O-N 3.11Å; N288-L292 WeakPolarHBondContact O-CB 3.26Å; N288-L292 PolarHBondContact O-N 3.36Å
289	F	93.1	Very high	90.8	Very high	1 Å²	1	56.8 Å²	56.8	0%	0.004	29%	0.292	C	S	.	.	H	α-helix	trans	-67.6	-37.6	174.5	-167.5	-103.2	0	0	0	112.1	L131 C206 I275 F285 S291 L292 L293	L131-F289 HydrophobicContact CD2-CD2 3.99Å; L131-F289 HydrophobicContact CD2-CE2 4.27Å; C206-F289 PolarHBondContact SG-N 3.09Å; I275-F289 HydrophobicContact CD1-CE1 4.14Å; I275-F289 HydrophobicContact CD1-CE2 4.24Å; I275-F289 HydrophobicContact CD1-CZ 3.54Å; I275-F289 HydrophobicContact CG1-CE1 4.44Å; I275-F289 HydrophobicContact CG1-CZ 4.07Å; I275-F289 HydrophobicContact CG2-CD1 4.39Å; I275-F289 HydrophobicContact CG2-CE1 3.86Å; I275-F289 HydrophobicContact CG2-CZ 4.33Å; F285-F289 HydrophobicContact CD1-CB 4.45Å; F285-F289 HydrophobicContact CE1-CB 4.21Å; F285-F289 HydrophobicContact CE1-CG 4.21Å; F285-F289 HydrophobicContact CE2-CD2 4.48Å; F285-F289 HydrophobicContact CZ-CB 4.36Å; F285-F289 HydrophobicContact CZ-CD2 4.01Å; F285-F289 HydrophobicContact CZ-CG 4.15Å; F285-F289 WeakPolarHBondContact O-CB 3.1Å; F285-F289 PolarHBondContact O-N 3.28Å; F289-S291 VanDerWaalsContact C-N 3.26Å; F289-S291 PolarHBondContact O-N 2.79Å; F289-L292 HydrophobicContact CD2-CD2 4.08Å; F289-L292 HydrophobicContact CE2-CD2 4.31Å; F289-L292 WeakPolarHBondContact O-CB 3.47Å; F289-L292 PolarHBondContact O-N 2.87Å; F289-L293 HydrophobicContact CD1-CD1 4.05Å; F289-L293 HydrophobicContact CD1-CG 4.36Å; F289-L293 HydrophobicContact CE1-CD1 3.67Å; F289-L293 HydrophobicContact CE1-CD2 4.41Å; F289-L293 HydrophobicContact CE1-CG 4.07Å; F289-L293 HydrophobicContact CZ-CD1 4.33Å; F289-L293 HydrophobicContact CZ-CD2 4.26Å; F289-L293 HydrophobicContact CZ-CG 4.35Å; F289-L293 WeakPolarHBondContact O-CG 3.34Å; F289-L293 PolarHBondContact O-N 3.38Å
290	E	91.6	Very high	90.3	Very high	82 Å²	82	54.9 Å²	54.9	38%	0.383	29%	0.286	S	S	.	.	H	α-helix	trans	-61.9	-31.7	168.9	-75.8	170.2	-161.5	0	0	112.8	K286 R287 K294	K286-E290 WeakPolarHBondContact CE-OE1 3.34Å; K286-E290 VanDerWaalsContact CG-OE1 3.28Å; K286-E290 WeakPolarHBondContact CG-OE1 3.44Å; K286-E290 IonicContact NZ-OE1 2.8Å; K286-E290 WeakPolarHBondContact O-CB 3.18Å; K286-E290 VanDerWaalsContact O-CG 3.3Å; K286-E290 WeakPolarHBondContact O-CG 3.18Å; K286-E290 PolarHBondContact O-N 2.95Å; R287-E290 PolarHBondContact O-N 2.64Å; E290-K294 WeakPolarHBondContact O-CD 3.24Å; E290-K294 VanDerWaalsContact O-CG 3.29Å; E290-K294 WeakPolarHBondContact O-CG 3.44Å; E290-K294 PolarHBondContact O-N 2.97Å
291	S	90.4	Very high	89.8	Confident	49 Å²	49	52.8 Å²	52.8	34%	0.343	28%	0.281	S	S	.	.	H	α-helix	trans	-77.5	-34.9	173	-161.6	0	0	0	0	112.4	R287 N288 F289 K294 N295	R287-S291 PolarHBondContact O-N 3.48Å; R287-S291 VanDerWaalsContact O-N 3.12Å; N288-S291 CarbonylContact O-C 3.59Å; N288-S291 WeakPolarHBondContact O-CA 3.24Å; N288-S291 WeakPolarHBondContact O-CB 3.4Å; N288-S291 PolarHBondContact O-N 3.43Å; N288-S291 VanDerWaalsContact O-N 3.11Å; F289-S291 VanDerWaalsContact C-N 3.26Å; F289-S291 PolarHBondContact O-N 2.79Å; S291-K294 PolarHBondContact O-N 3.31Å; S291-N295 PolarHBondContact O-N 3.04Å; S291-N295 PolarHBondContact O-OD1 3.29Å
292	L	90.3	Very high	89.5	Confident	7 Å²	7	52.4 Å²	52.4	4%	0.037	28%	0.279	C	S	.	.	H	α-helix	trans	-63	-51.6	176.9	-169.4	77.2	0	0	0	110.2	L130 L131 I134 V204 N288 F289 K294 N295 R296	L130-L292 WeakPolarHBondContact O-CD2 3.29Å; L131-L292 HydrophobicContact CD2-CD2 4.23Å; I134-L292 HydrophobicContact CD1-CD1 3.66Å; I134-L292 HydrophobicContact CD1-CG 4.06Å; I134-L292 VanDerWaalsContact CD1-O 3.28Å; I134-L292 WeakPolarHBondContact CD1-O 3.26Å; I134-L292 HydrophobicContact CG1-CD1 4.06Å; V204-L292 HydrophobicContact CB-CD1 4Å; V204-L292 HydrophobicContact CG1-CB 4.23Å; V204-L292 HydrophobicContact CG1-CD1 4.36Å; N288-L292 WeakPolarHBondContact O-CB 3.26Å; N288-L292 PolarHBondContact O-N 3.36Å; F289-L292 HydrophobicContact CD2-CD2 4.08Å; F289-L292 HydrophobicContact CE2-CD2 4.31Å; F289-L292 WeakPolarHBondContact O-CB 3.47Å; F289-L292 PolarHBondContact O-N 2.87Å; L292-K294 VanDerWaalsContact C-N 3.27Å; L292-K294 PolarHBondContact O-N 3.46Å; L292-N295 PolarHBondContact O-N 3.01Å; L292-N295 VanDerWaalsContact O-N 3.09Å; L292-R296 WeakPolarHBondContact O-CB 3.38Å; L292-R296 PolarHBondContact O-N 3.42Å
293	L	90.3	Very high	88.9	Confident	23 Å²	23	53.7 Å²	53.7	12%	0.12	29%	0.285	C	S	.	.	H	α-helix	trans	-59.7	-36.5	177.7	-66.4	178.8	0	0	0	112.5	E73 F289 R296 A297	E73-L293 HydrophobicContact CG-CB 4.33Å; E73-L293 HydrophobicContact CG-CD2 4.31Å; F289-L293 HydrophobicContact CD1-CD1 4.05Å; F289-L293 HydrophobicContact CD1-CG 4.36Å; F289-L293 HydrophobicContact CE1-CD1 3.67Å; F289-L293 HydrophobicContact CE1-CD2 4.41Å; F289-L293 HydrophobicContact CE1-CG 4.07Å; F289-L293 HydrophobicContact CZ-CD1 4.33Å; F289-L293 HydrophobicContact CZ-CD2 4.26Å; F289-L293 HydrophobicContact CZ-CG 4.35Å; F289-L293 WeakPolarHBondContact O-CG 3.34Å; F289-L293 PolarHBondContact O-N 3.38Å; L293-R296 PolarHBondContact O-N 2.66Å; L293-A297 WeakPolarHBondContact O-CB 3.43Å; L293-A297 PolarHBondContact O-N 3.4Å
294	K	88.6	Confident	88.2	Confident	143 Å²	143	53 Å²	53	62%	0.622	27%	0.27	S	S	*	.	H	α-helix	trans	-64.1	-44.1	173.4	-73.8	169.4	-174.5	170.9	0	112.4	E290 S291 L292 R296 A297 A298	E290-K294 WeakPolarHBondContact O-CD 3.24Å; E290-K294 VanDerWaalsContact O-CG 3.29Å; E290-K294 WeakPolarHBondContact O-CG 3.44Å; E290-K294 PolarHBondContact O-N 2.97Å; S291-K294 PolarHBondContact O-N 3.31Å; L292-K294 VanDerWaalsContact C-N 3.27Å; L292-K294 PolarHBondContact O-N 3.46Å; K294-R296 VanDerWaalsContact C-N 3.32Å; K294-R296 PolarHBondContact O-N 3.17Å; K294-A297 PolarHBondContact O-N 2.63Å; K294-A298 WeakPolarHBondContact O-CB 3.39Å; K294-A298 PolarHBondContact O-N 2.76Å
295	N	84.9	Confident	87.7	Confident	72 Å²	72	54.9 Å²	54.9	39%	0.385	28%	0.279	S	S	.	.	H	α-helix	trans	-67.5	-33.4	176.9	-70	16	0	0	0	111.6	I134 S291 L292 A298 K299	I134-N295 HydrophobicContact CD1-CB 3.5Å; I134-N295 VanDerWaalsContact CD1-CB 3.5Å; S291-N295 PolarHBondContact O-N 3.04Å; S291-N295 PolarHBondContact O-OD1 3.29Å; L292-N295 PolarHBondContact O-N 3.01Å; L292-N295 VanDerWaalsContact O-N 3.09Å; N295-A298 PolarHBondContact O-N 2.78Å; N295-K299 PolarHBondContact O-N 3.02Å
296	R	85.8	Confident	87.2	Confident	17 Å²	17	57.4 Å²	57.4	6%	0.064	30%	0.296	C	S	.	.	H	α-helix	trans	-68.1	-43.3	175.2	-171.5	-179.3	177.2	-93.7	11.8	111.8	D71 E73 I134 L292 L293 K294 A298 K299	D71-R296 VanDerWaalsContact O-CZ 3.29Å; D71-R296 PolarHBondContact O-NH1 3.34Å; D71-R296 PolarHBondContact O-NH2 3.38Å; D71-R296 IonicContact OD1-NH2 3.77Å; E73-R296 VanDerWaalsContact CD-NH1 3.27Å; E73-R296 WeakPolarHBondContact OE1-CG 3.32Å; E73-R296 IonicContact OE1-CZ 2.81Å; E73-R296 IonicContact OE1-NH1 3.22Å; E73-R296 PolarHBondContact OE1-NH1 2.73Å; E73-R296 IonicContact OE2-NH1 2.71Å; I134-R296 HydrophobicContact CD1-CB 4.04Å; I134-R296 HydrophobicContact CG1-CB 4.36Å; L292-R296 WeakPolarHBondContact O-CB 3.38Å; L292-R296 PolarHBondContact O-N 3.42Å; L293-R296 PolarHBondContact O-N 2.66Å; K294-R296 VanDerWaalsContact C-N 3.32Å; K294-R296 PolarHBondContact O-N 3.17Å; R296-A298 VanDerWaalsContact C-N 3.27Å; R296-A298 PolarHBondContact O-N 3.08Å; R296-K299 PolarHBondContact O-N 3.27Å
297	A	84.5	Confident	86.8	Confident	57 Å²	57	52.7 Å²	52.7	47%	0.471	28%	0.275	S	S	.	.	H	α-helix	trans	-67	-26.4	174.1	0	0	0	0	0	113.2	E73 L293 K294 K299	E73-A297 HydrophobicContact CG-CB 4.14Å; L293-A297 WeakPolarHBondContact O-CB 3.43Å; L293-A297 PolarHBondContact O-N 3.4Å; K294-A297 PolarHBondContact O-N 2.63Å; A297-K299 VanDerWaalsContact C-N 3.35Å
298	A	80.7	Confident	86.2	Confident	62 Å²	62	45.7 Å²	45.7	51%	0.512	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-2.9	178.3	0	0	0	0	0	114.5	K294 N295 R296	K294-A298 WeakPolarHBondContact O-CB 3.39Å; K294-A298 PolarHBondContact O-N 2.76Å; N295-A298 PolarHBondContact O-N 2.78Å; R296-A298 VanDerWaalsContact C-N 3.27Å; R296-A298 PolarHBondContact O-N 3.08Å
299	K	80.9	Confident	85.7	Confident	54 Å²	54	45.6 Å²	45.6	24%	0.235	25%	0.25	C	C	.	.	S	Bend	trans	-87	136.4	169.6	-79.5	-169.6	163.4	-177.8	0	111	I134 N295 R296 A297 E303 R304	I134-K299 PolarHBondContact O-NZ 2.86Å; N295-K299 PolarHBondContact O-N 3.02Å; R296-K299 PolarHBondContact O-N 3.27Å; A297-K299 VanDerWaalsContact C-N 3.35Å; K299-E303 HydrophobicContact CD-CB 4.39Å; K299-E303 VanDerWaalsContact CD-OE2 3.3Å; K299-E303 WeakPolarHBondContact CD-OE2 3.31Å; K299-E303 WeakPolarHBondContact CE-OE2 3.45Å; K299-E303 VanDerWaalsContact CG-OE2 3.3Å; K299-E303 WeakPolarHBondContact CG-OE2 3.45Å; K299-R304 HydrophobicContact CB-CG 4.37Å
300	H	83.4	Confident	85.3	Confident	27 Å²	27	49.5 Å²	49.5	13%	0.125	27%	0.268	C	S	.	.			trans	-57.9	139.4	173.7	-176	-90.2	0	0	0	110.7	E159 F302 E303 M1080	E159-H300 IonicContact OE1-CD2 2.66Å; H300-F302 VanDerWaalsContact C-N 3.26Å; H300-F302 AromaticContact CE1-CD1 3.83Å; H300-F302 AromaticContact CE1-CD2 3.61Å; H300-F302 AromaticContact CE1-CG 3.5Å; H300-F302 VanDerWaalsContact CE1-CG 3.5Å; H300-F302 WeakPolarHBondContact CE1-CG 3.39Å; H300-F302 AromaticContact ND1-CD2 3.98Å; H300-F302 AromaticContact ND1-CG 3.66Å; H300-F302 PolarHBondContact ND1-N 3.34Å; H300-F302 PolarHBondContact O-N 2.9Å; H300-F302 VanDerWaalsContact O-N 3.09Å; H300-E303 WeakPolarHBondContact O-CB 3.42Å; H300-E303 PolarHBondContact O-N 2.9Å; H300-M1080 HydrophobicContact CB-SD 4.13Å; H300-M1080 WeakPolarHBondContact CE1-CE 3.35Å; H300-M1080 VanDerWaalsContact ND1-CE 3.34Å; H300-M1080 WeakPolarHBondContact ND1-CE 3.46Å; H300-M1080 PolarHBondContact ND1-SD 2.97Å; H300-M1080 WeakPolarHBondContact NE2-CE 3.41Å
301	P	83.7	Confident	85.3	Confident	60 Å²	60	46.6 Å²	46.6	39%	0.39	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-48.2	-40.1	-176.8	-32.8	37.1	0	0	0	115.5	E303 R304 V305	P301-E303 PolarHBondContact O-N 3.48Å; P301-E303 VanDerWaalsContact O-N 3.15Å; P301-R304 PolarHBondContact O-N 3.01Å; P301-V305 PolarHBondContact O-N 3.35Å; P301-V305 VanDerWaalsContact O-N 3.12Å
302	F	87.2	Confident	85.3	Confident	15 Å²	15	45.8 Å²	45.8	7%	0.066	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-62.7	-19.8	179.5	-64.6	-6	0	0	0	114.5	H300 R304 P1046 L1047 R1077 M1080 I1081 R1084	H300-F302 VanDerWaalsContact C-N 3.26Å; H300-F302 AromaticContact CE1-CD1 3.83Å; H300-F302 AromaticContact CE1-CD2 3.61Å; H300-F302 AromaticContact CE1-CG 3.5Å; H300-F302 VanDerWaalsContact CE1-CG 3.5Å; H300-F302 WeakPolarHBondContact CE1-CG 3.39Å; H300-F302 AromaticContact ND1-CD2 3.98Å; H300-F302 AromaticContact ND1-CG 3.66Å; H300-F302 PolarHBondContact ND1-N 3.34Å; H300-F302 PolarHBondContact O-N 2.9Å; H300-F302 VanDerWaalsContact O-N 3.09Å; F302-R304 VanDerWaalsContact C-N 3.31Å; F302-P1046 HydrophobicContact CD1-CB 4.43Å; F302-P1046 HydrophobicContact CE1-CB 3.91Å; F302-L1047 HydrophobicContact CB-CD2 4.09Å; F302-L1047 HydrophobicContact CD1-CD2 4.43Å; F302-L1047 HydrophobicContact CD2-CD2 4.3Å; F302-L1047 HydrophobicContact CG-CD2 4.04Å; F302-R1077 HydrophobicContact CE2-CB 4.06Å; F302-R1077 HydrophobicContact CE2-CG 4.08Å; F302-R1077 HydrophobicContact CZ-CG 4.46Å; F302-M1080 HydrophobicContact CB-SD 4.48Å; F302-M1080 HydrophobicContact CD2-CE 4.25Å; F302-M1080 HydrophobicContact CD2-CG 4.32Å; F302-M1080 HydrophobicContact CD2-SD 4.27Å; F302-I1081 HydrophobicContact CD2-CG1 4.01Å; F302-I1081 HydrophobicContact CE2-CD1 3.92Å; F302-I1081 HydrophobicContact CE2-CG1 3.78Å; F302-R1084 PolarHBondContact O-NE 2.96Å; F302-R1084 PolarHBondContact O-NH2 2.85Å
303	E	84.5	Confident	85.5	Confident	27 Å²	27	45.9 Å²	45.9	13%	0.126	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-76.9	-19.8	172.7	-58.2	-165.2	165.5	0	0	113	M146 S149 N152 K299 H300 P301	M146-E303 VanDerWaalsContact CE-O 3.3Å; M146-E303 WeakPolarHBondContact CE-O 3.43Å; S149-E303 WeakPolarHBondContact CB-OE1 3.48Å; S149-E303 PolarHBondContact OG-OE1 3.41Å; N152-E303 PolarHBondContact ND2-OE1 3.12Å; K299-E303 HydrophobicContact CD-CB 4.39Å; K299-E303 VanDerWaalsContact CD-OE2 3.3Å; K299-E303 WeakPolarHBondContact CD-OE2 3.31Å; K299-E303 WeakPolarHBondContact CE-OE2 3.45Å; K299-E303 VanDerWaalsContact CG-OE2 3.3Å; K299-E303 WeakPolarHBondContact CG-OE2 3.45Å; H300-E303 WeakPolarHBondContact O-CB 3.42Å; H300-E303 PolarHBondContact O-N 2.9Å; P301-E303 PolarHBondContact O-N 3.48Å; P301-E303 VanDerWaalsContact O-N 3.15Å
304	R	79.8	Confident	85.7	Confident	75 Å²	75	44.9 Å²	44.9	28%	0.283	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-29.3	-175.2	-59.9	-167.9	-77.5	164.1	-12.2	113	E73 K299 P301 F302 P306	E73-R304 IonicContact OE1-CZ 2.84Å; E73-R304 IonicContact OE1-NH1 2.69Å; E73-R304 PolarHBondContact OE1-NH1 3.23Å; E73-R304 IonicContact OE2-NH1 2.71Å; K299-R304 HydrophobicContact CB-CG 4.37Å; P301-R304 PolarHBondContact O-N 3.01Å; F302-R304 VanDerWaalsContact C-N 3.31Å; R304-P306 WeakPolarHBondContact O-CD 3.42Å
305	V	83.5	Confident	86.1	Confident	55 Å²	55	38 Å²	38	33%	0.333	21%	0.213	S	C	.	.	S	Bend	trans	-79.4	120.3	179.3	176.2	0	0	0	0	110.6	P301 P1046 L1047 R1084	P301-V305 PolarHBondContact O-N 3.35Å; P301-V305 VanDerWaalsContact O-N 3.12Å; V305-P1046 HydrophobicContact CG1-CG 3.99Å; V305-L1047 HydrophobicContact CG1-CD1 4.45Å; V305-L1047 VanDerWaalsContact O-CD1 3.26Å; V305-L1047 WeakPolarHBondContact O-CD1 3.12Å; V305-R1084 PolarHBondContact O-NH2 2.83Å
306	P	84.7	Confident	86.4	Confident	54 Å²	54	34.9 Å²	34.9	35%	0.351	20%	0.197	S	C	.	.	P	Polyproline II helix	trans	-57	147.2	174.5	-24.7	34.9	0	0	0	112.8	Q145 M146 R304	Q145-P306 HydrophobicContact CB-CB 3.77Å; M146-P306 HydrophobicContact SD-CB 4.36Å; M146-P306 HydrophobicContact SD-CG 4.2Å; R304-P306 WeakPolarHBondContact O-CD 3.42Å
307	T	85.7	Confident	86.6	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	20%	0.204	C	C	.	.	P	Polyproline II helix	trans	-101.1	140.1	179.5	118.4	0	0	0	0	109.8	Q145 Y309 L1047 R1084	Q145-T307 WeakPolarHBondContact CB-O 3.47Å; Q145-T307 WeakPolarHBondContact CG-O 3.39Å; Q145-T307 PolarHBondContact O-N 3.24Å; T307-Y309 PolarHBondContact O-N 3.5Å; T307-Y309 PolarHBondContact OG1-N 3.42Å; T307-Y309 VanDerWaalsContact OG1-N 3.09Å; T307-Y309 PolarHBondContact OG1-O 3.14Å; T307-Y309 VanDerWaalsContact OG1-O 3.06Å; T307-L1047 HydrophobicContact CG2-CD1 3.82Å; T307-R1084 HydrophobicContact CG2-CB 4.2Å
308	P	81.9	Confident	86.6	Confident	34 Å²	34	39.8 Å²	39.8	22%	0.221	22%	0.217	C	C	.	.	S	Bend	trans	-60	-12.8	177.8	22.6	-30.6	0	0	0	113.9	Q145 F375	Q145-P308 PolarHBondContact NE2-O 2.94Å; P308-F375 HydrophobicContact CB-CE1 4.12Å; P308-F375 HydrophobicContact CB-CZ 3.89Å; P308-F375 HydrophobicContact CG-CE1 4.07Å; P308-F375 HydrophobicContact CG-CZ 3.71Å
309	Y	84.5	Confident	86.5	Confident	44 Å²	44	40 Å²	40	17%	0.173	21%	0.212	C	C	.	.	S	Bend	trans	-97	137.6	179.4	-56	-83.5	0	0	0	113.3	T307 V311 H1048 P1049 V1085	T307-Y309 PolarHBondContact O-N 3.5Å; T307-Y309 PolarHBondContact OG1-N 3.42Å; T307-Y309 VanDerWaalsContact OG1-N 3.09Å; T307-Y309 PolarHBondContact OG1-O 3.14Å; T307-Y309 VanDerWaalsContact OG1-O 3.06Å; Y309-V311 PolarHBondContact O-N 3.44Å; Y309-H1048 AromaticContact CZ-CD2 3.97Å; Y309-H1048 PolarHBondContact OH-CD2 3.06Å; Y309-H1048 PolarHBondContact OH-NE2 3.05Å; Y309-P1049 WeakPolarHBondContact OH-CD 3.44Å; Y309-V1085 HydrophobicContact CD2-CB 4.34Å; Y309-V1085 HydrophobicContact CD2-CG1 3.53Å; Y309-V1085 HydrophobicContact CD2-CG2 4.13Å; Y309-V1085 HydrophobicContact CE2-CG1 3.67Å; Y309-V1085 HydrophobicContact CE2-CG2 4.44Å; Y309-V1085 HydrophobicContact CG-CG1 4.07Å
310	Q	84.9	Confident	86.4	Confident	82 Å²	82	46 Å²	46	38%	0.383	24%	0.241	S	C	.	.			trans	-89.4	77.3	178.9	-155.1	-173.2	9.3	0	0	112.6	G142 H312	G142-Q310 WeakPolarHBondContact O-CG 3.47Å; G142-Q310 PolarHBondContact O-NE2 3.48Å; Q310-H312 PolarHBondContact NE2-CE1 3.12Å; Q310-H312 PolarHBondContact NE2-NE2 3.37Å; Q310-H312 PolarHBondContact O-N 2.84Å; Q310-H312 PolarHBondContact O-ND1 2.71Å; Q310-H312 VanDerWaalsContact O-ND1 3.11Å
311	V	90.3	Very high	86.2	Confident	22 Å²	22	52.1 Å²	52.1	13%	0.133	27%	0.269	C	S	.	.			trans	-87.2	93.6	-175.2	-173.8	0	0	0	0	111.2	Y309 R1084 V1085	Y309-V311 PolarHBondContact O-N 3.44Å; V311-R1084 WeakPolarHBondContact CG2-O 3.41Å; V311-V1085 WeakPolarHBondContact CG2-O 3.44Å
312	H	91.8	Very high	85.9	Confident	32 Å²	32	51.7 Å²	51.7	15%	0.148	27%	0.268	C	S	.	.			trans	-79.1	144.9	173.9	-57.4	81.9	0	0	0	111.3	A141 Q310 Y997	A141-H312 PolarHBondContact O-CD2 2.69Å; Q310-H312 PolarHBondContact NE2-CE1 3.12Å; Q310-H312 PolarHBondContact NE2-NE2 3.37Å; Q310-H312 PolarHBondContact O-N 2.84Å; Q310-H312 PolarHBondContact O-ND1 2.71Å; Q310-H312 VanDerWaalsContact O-ND1 3.11Å; H312-Y997 HydrophobicContact CB-CD1 4.26Å; H312-Y997 HydrophobicContact CB-CD2 3.73Å; H312-Y997 HydrophobicContact CB-CE1 4.22Å; H312-Y997 HydrophobicContact CB-CE2 3.68Å; H312-Y997 HydrophobicContact CB-CG 4.01Å; H312-Y997 VanDerWaalsContact CD2-CB 3.42Å; H312-Y997 WeakPolarHBondContact CD2-CB 3.43Å; H312-Y997 AromaticContact CD2-CD2 3.85Å; H312-Y997 AromaticContact CD2-CG 3.7Å; H312-Y997 AromaticContact CG-CD2 3.52Å; H312-Y997 AromaticContact CG-CE2 3.97Å; H312-Y997 AromaticContact CG-CG 3.8Å; H312-Y997 AromaticContact ND1-CD2 3.67Å
313	S	93.7	Very high	85.3	Confident	9 Å²	9	55.8 Å²	55.8	6%	0.063	30%	0.296	C	S	.	.			trans	-93.2	133.6	166.2	-159.2	0	0	0	0	111	Y140 H195 L315 Q966	Y140-S313 PolarHBondContact O-N 3.5Å; H195-S313 PolarHBondContact CE1-OG 2.89Å; S313-L315 WeakPolarHBondContact CB-O 3.48Å; S313-L315 PolarHBondContact O-N 2.96Å; S313-L315 PolarHBondContact OG-O 2.99Å; S313-Q966 WeakPolarHBondContact O-CG 3.42Å; S313-Q966 PolarHBondContact O-NE2 3.23Å
314	W	95.3	Very high	84.8	Confident	1 Å²	1	55.9 Å²	55.9	0%	0.004	30%	0.297	C	S	.	.	S	Bend	trans	-74.4	-4.4	178.8	70.4	-84.8	0	0	0	113.6	L191 L194 L956 R957 C960 T961 Q966 L967 D1089	L191-W314 HydrophobicContact CD1-CH2 4.39Å; L191-W314 HydrophobicContact CD2-CH2 3.94Å; L191-W314 HydrophobicContact CD2-CZ2 4.19Å; L194-W314 HydrophobicContact CD2-CZ2 4.3Å; W314-L956 HydrophobicContact CH2-CD2 4.43Å; W314-L956 HydrophobicContact CZ3-CD2 3.98Å; W314-L956 HydrophobicContact CZ3-CG 3.94Å; W314-R957 HydrophobicContact CH2-CB 4.05Å; W314-R957 HydrophobicContact CZ2-CB 3.62Å; W314-R957 HydrophobicContact CZ2-CG 3.98Å; W314-C960 HydrophobicContact CB-CB 4.24Å; W314-C960 HydrophobicContact CE3-CB 4.03Å; W314-T961 HydrophobicContact CB-CG2 3.82Å; W314-T961 HydrophobicContact CG-CG2 3.8Å; W314-Q966 WeakPolarHBondContact O-CA 3.2Å; W314-L967 PolarHBondContact O-N 2.93Å; W314-D1089 PolarHBondContact NE1-OD2 3.31Å
315	L	95.3	Very high	84.3	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	137.9	172.5	-74.6	162.9	0	0	0	109.5	Y140 L191 L194 H195 S313 L967 L969	Y140-L315 VanDerWaalsContact CD1-O 3.27Å; Y140-L315 WeakPolarHBondContact CD1-O 3.36Å; L191-L315 HydrophobicContact CB-CD1 4.29Å; L191-L315 HydrophobicContact CD1-CD1 3.84Å; L191-L315 HydrophobicContact CD1-CD2 4.06Å; L191-L315 HydrophobicContact CD2-CD1 3.78Å; L191-L315 HydrophobicContact CG-CD1 4.19Å; L194-L315 HydrophobicContact CD2-CD1 3.94Å; H195-L315 PolarHBondContact CE1-O 3.25Å; H195-L315 VanDerWaalsContact NE2-CB 3.34Å; H195-L315 WeakPolarHBondContact NE2-CB 3.14Å; S313-L315 WeakPolarHBondContact CB-O 3.48Å; S313-L315 PolarHBondContact O-N 2.96Å; S313-L315 PolarHBondContact OG-O 2.99Å; L315-L967 CarbonylContact C-O 3.56Å; L315-L967 VanDerWaalsContact CA-O 3.31Å; L315-L967 WeakPolarHBondContact CA-O 3.45Å; L315-L967 HydrophobicContact CD2-CB 3.94Å; L315-L969 HydrophobicContact CB-CB 4.45Å; L315-L969 HydrophobicContact CB-CD1 4.45Å; L315-L969 HydrophobicContact CD1-CD1 4.41Å
316	A	92.5	Very high	83.7	Confident	6 Å²	6	50.6 Å²	50.6	5%	0.05	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	145	174.5	0	0	0	0	0	111.9	Y140 Q966 L967 L968 L969 I994	Y140-A316 HydrophobicContact CD1-CB 3.87Å; Y140-A316 HydrophobicContact CG-CB 4.09Å; A316-Q966 HydrophobicContact CB-CG 4.07Å; A316-L967 PolarHBondContact N-O 3.38Å; A316-L968 CarbonylContact O-C 3.57Å; A316-L969 WeakPolarHBondContact O-CB 3.34Å; A316-L969 PolarHBondContact O-N 3.39Å; A316-I994 HydrophobicContact CB-CD1 4.03Å; A316-I994 WeakPolarHBondContact O-CD1 3.33Å
317	P	89.5	Confident	83.4	Confident	35 Å²	35	51.9 Å²	51.9	23%	0.227	27%	0.272	C	S	.	.	P	Polyproline II helix	trans	-66.5	155.3	173.5	29.9	-36.1	0	0	0	111.2	Y140 V319	Y140-P317 HydrophobicContact CD2-CG 4.16Å; Y140-P317 HydrophobicContact CE1-CG 4.43Å; Y140-P317 VanDerWaalsContact CE2-CD 3.49Å; Y140-P317 HydrophobicContact CE2-CG 3.71Å; P317-V319 PolarHBondContact O-N 3.05Å
318	L	84.1	Confident	82.8	Confident	142 Å²	142	59.6 Å²	59.6	74%	0.743	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-68.5	121	171.3	-176.5	64.2	0	0	0	109.9	L968	L318-L968 HydrophobicContact CB-CD1 3.78Å
319	V	79.4	Confident	82.2	Confident	65 Å²	65	59.5 Å²	59.5	39%	0.394	30%	0.302	S	S	.	.	P	Polyproline II helix	trans	-102.7	130.5	177	-171	0	0	0	0	109.4	Y137 P317 H321	Y137-V319 HydrophobicContact CD1-CB 4.43Å; Y137-V319 HydrophobicContact CD1-CG1 4.05Å; Y137-V319 HydrophobicContact CD1-CG2 3.43Å; Y137-V319 VanDerWaalsContact CD1-CG2 3.43Å; Y137-V319 HydrophobicContact CD2-CG1 4.18Å; Y137-V319 HydrophobicContact CE1-CB 4.37Å; Y137-V319 HydrophobicContact CE1-CG1 3.82Å; Y137-V319 HydrophobicContact CE1-CG2 3.62Å; Y137-V319 HydrophobicContact CE2-CG1 3.94Å; Y137-V319 HydrophobicContact CG-CG1 4.25Å; Y137-V319 HydrophobicContact CG-CG2 4.14Å; P317-V319 PolarHBondContact O-N 3.05Å; V319-H321 PolarHBondContact O-N 3.25Å
320	E	78.9	Confident	81.4	Confident	181 Å²	181	61 Å²	61	85%	0.846	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-69.8	122.9	176	-171.1	-175.8	178.4	0	0	110.5	S322	E320-S322 PolarHBondContact O-N 3.17Å
321	H	79.3	Confident	80.7	Confident	155 Å²	155	59.3 Å²	59.3	72%	0.718	31%	0.31	S	S	*	.			trans	-77.3	89.5	-176	-165.1	102.3	0	0	0	111.9	V319 R327	V319-H321 PolarHBondContact O-N 3.25Å; H321-R327 PolarHBondContact CE1-NH1 2.75Å; H321-R327 PolarHBondContact NE2-NH1 3.42Å
322	S	77	Confident	79.6	Confident	52 Å²	52	64.5 Å²	64.5	36%	0.364	33%	0.332	S	S	.	.			trans	-73.6	149.4	176.7	59.6	0	0	0	0	113.2	E320 D324 R327	E320-S322 PolarHBondContact O-N 3.17Å; S322-D324 PolarHBondContact O-N 2.53Å; S322-R327 PolarHBondContact O-NH1 2.89Å; S322-R327 VanDerWaalsContact O-NH1 3.11Å
323	P	75.2	Confident	78.2	Confident	100 Å²	100	64.1 Å²	64.1	65%	0.649	33%	0.332	S	S	*	.			trans	-65.8	116.1	173	-22	34	0	0	0	112.6	N211	N211-P323 PolarHBondContact ND2-O 2.69Å
324	D	73.6	Confident	76.6	Confident	29 Å²	29	67.4 Å²	67.4	16%	0.155	36%	0.355	C	S	.	.			trans	-135.1	131	-173.1	173.6	-11.7	0	0	0	108.9	H128 S322 V326 R327	H128-D324 IonicContact CE1-OD1 3Å; H128-D324 IonicContact CE1-OD2 3.67Å; H128-D324 PolarHBondContact CE1-OD2 2.8Å; H128-D324 IonicContact NE2-OD1 3.18Å; H128-D324 IonicContact NE2-OD2 3.17Å; S322-D324 PolarHBondContact O-N 2.53Å; D324-V326 PolarHBondContact OD1-N 3.41Å; D324-R327 HydrophobicContact CB-CB 4.11Å; D324-R327 VanDerWaalsContact CB-CZ 3.41Å; D324-R327 WeakPolarHBondContact OD1-CB 3.15Å; D324-R327 PolarHBondContact OD1-N 2.92Å; D324-R327 VanDerWaalsContact OD2-CB 3.23Å; D324-R327 WeakPolarHBondContact OD2-CB 3.47Å; D324-R327 IonicContact OD2-CZ 3.75Å; D324-R327 IonicContact OD2-NE 3.83Å; D324-R327 PolarHBondContact OD2-NE 2.98Å; D324-R327 IonicContact OD2-NH2 3.21Å; D324-R327 PolarHBondContact OD2-NH2 3.18Å
325	S	69.7	Low	74.9	Confident	16 Å²	16	74.8 Å²	74.8	11%	0.112	38%	0.383	C	S	.	.	S	Bend	trans	-107.6	-12.2	-178.1	68.6	0	0	0	0	114	N211 Y212 K328 E329	N211-S325 WeakPolarHBondContact CA-OG 3.49Å; N211-S325 VanDerWaalsContact CB-OG 3.23Å; N211-S325 WeakPolarHBondContact CB-OG 3.34Å; N211-S325 VanDerWaalsContact CG-OG 3.24Å; N211-S325 VanDerWaalsContact OD1-CB 3.26Å; N211-S325 WeakPolarHBondContact OD1-CB 3.42Å; N211-S325 PolarHBondContact OD1-N 3.13Å; N211-S325 PolarHBondContact OD1-OG 3.12Å; Y212-S325 PolarHBondContact N-OG 3.34Å; S325-K328 PolarHBondContact O-N 3.38Å; S325-E329 PolarHBondContact O-N 3.1Å
326	V	70.8	Confident	72.9	Confident	4 Å²	4	80.2 Å²	80.2	2%	0.024	41%	0.41	C	S	.	.	H	α-helix	trans	-73.1	-49.1	170.6	-174.9	0	0	0	0	107.6	R125 H128 D324 K328 E329 E330	R125-V326 HydrophobicContact CB-CG1 4.49Å; R125-V326 HydrophobicContact CG-CG1 4.17Å; H128-V326 HydrophobicContact CB-CG1 4.49Å; H128-V326 HydrophobicContact CB-CG2 4.01Å; D324-V326 PolarHBondContact OD1-N 3.41Å; V326-K328 PolarHBondContact O-N 3.09Å; V326-K328 VanDerWaalsContact O-N 3.14Å; V326-E329 CarbonylContact O-C 3.32Å; V326-E329 WeakPolarHBondContact O-CA 3.26Å; V326-E329 WeakPolarHBondContact O-CB 3.28Å; V326-E329 PolarHBondContact O-N 2.92Å; V326-E330 WeakPolarHBondContact CG1-OE1 3.34Å; V326-E330 WeakPolarHBondContact O-CG 3.45Å; V326-E330 PolarHBondContact O-N 3.21Å
327	R	77.9	Confident	71	Confident	80 Å²	80	81.3 Å²	81.3	30%	0.302	42%	0.419	S	S	.	.	H	α-helix	trans	-53.3	-31.8	167.5	-171.8	-167.5	-48.4	161.9	5.1	113.8	H321 S322 D324 E330 A331	H321-R327 PolarHBondContact CE1-NH1 2.75Å; H321-R327 PolarHBondContact NE2-NH1 3.42Å; S322-R327 PolarHBondContact O-NH1 2.89Å; S322-R327 VanDerWaalsContact O-NH1 3.11Å; D324-R327 HydrophobicContact CB-CB 4.11Å; D324-R327 VanDerWaalsContact CB-CZ 3.41Å; D324-R327 WeakPolarHBondContact OD1-CB 3.15Å; D324-R327 PolarHBondContact OD1-N 2.92Å; D324-R327 VanDerWaalsContact OD2-CB 3.23Å; D324-R327 WeakPolarHBondContact OD2-CB 3.47Å; D324-R327 IonicContact OD2-CZ 3.75Å; D324-R327 IonicContact OD2-NE 3.83Å; D324-R327 PolarHBondContact OD2-NE 2.98Å; D324-R327 IonicContact OD2-NH2 3.21Å; D324-R327 PolarHBondContact OD2-NH2 3.18Å; R327-E330 WeakPolarHBondContact CA-OE2 3.35Å; R327-A331 WeakPolarHBondContact O-CB 3.49Å; R327-A331 PolarHBondContact O-N 2.71Å; R327-A331 VanDerWaalsContact O-N 3.12Å
328	K	73.5	Confident	69.1	Low	163 Å²	163	82.6 Å²	82.6	71%	0.709	43%	0.428	S	S	*	.	H	α-helix	trans	-74.8	-35	174.9	-174.3	-172.1	170.6	-171.6	0	112.4	S325 V326	S325-K328 PolarHBondContact O-N 3.38Å; V326-K328 PolarHBondContact O-N 3.09Å; V326-K328 VanDerWaalsContact O-N 3.14Å
329	E	68.5	Low	67.6	Low	32 Å²	32	78.9 Å²	78.9	15%	0.15	41%	0.407	C	S	.	.	H	α-helix	trans	-73.5	-44.4	175.6	-178.6	159.6	-119.8	0	0	111.1	K121 Y212 S325 V326 A331 F332 S333	K121-E329 WeakPolarHBondContact CE-OE1 3.46Å; K121-E329 IonicContact NZ-OE1 3.82Å; K121-E329 PolarHBondContact NZ-OE1 2.71Å; Y212-E329 HydrophobicContact CE2-CB 4.4Å; Y212-E329 WeakPolarHBondContact CE2-OE2 3.41Å; Y212-E329 VanDerWaalsContact CZ-OE2 3.24Å; Y212-E329 PolarHBondContact OH-OE2 2.7Å; S325-E329 PolarHBondContact O-N 3.1Å; V326-E329 CarbonylContact O-C 3.32Å; V326-E329 WeakPolarHBondContact O-CA 3.26Å; V326-E329 WeakPolarHBondContact O-CB 3.28Å; V326-E329 PolarHBondContact O-N 2.92Å; E329-A331 VanDerWaalsContact C-N 3.32Å; E329-A331 PolarHBondContact O-N 3.38Å; E329-F332 CarbonylContact O-C 3.5Å; E329-F332 WeakPolarHBondContact O-CA 3.24Å; E329-F332 VanDerWaalsContact O-CB 3.32Å; E329-F332 WeakPolarHBondContact O-CB 3.48Å; E329-F332 PolarHBondContact O-N 3.34Å; E329-S333 PolarHBondContact O-N 2.85Å; E329-S333 PolarHBondContact O-OG 3.36Å
330	E	67.5	Low	66.1	Low	76 Å²	76	78.7 Å²	78.7	36%	0.355	40%	0.401	S	S	.	.	H	α-helix	trans	-56.2	-44	172.2	-69.6	162.8	-176.4	0	0	112.2	V326 R327 F332 S333 S334	V326-E330 WeakPolarHBondContact CG1-OE1 3.34Å; V326-E330 WeakPolarHBondContact O-CG 3.45Å; V326-E330 PolarHBondContact O-N 3.21Å; R327-E330 WeakPolarHBondContact CA-OE2 3.35Å; E330-F332 PolarHBondContact O-N 2.81Å; E330-F332 VanDerWaalsContact O-N 3.09Å; E330-S333 PolarHBondContact O-N 3.22Å; E330-S334 VanDerWaalsContact O-CB 3.3Å; E330-S334 WeakPolarHBondContact O-CB 3.25Å; E330-S334 PolarHBondContact O-N 3.11Å; E330-S334 PolarHBondContact O-OG 3.48Å
331	A	70.7	Confident	64.6	Low	45 Å²	45	72.2 Å²	72.2	37%	0.372	37%	0.373	S	S	.	.	H	α-helix	trans	-67.3	-2.5	174.2	0	0	0	0	0	114.3	R327 E329 R335	R327-A331 WeakPolarHBondContact O-CB 3.49Å; R327-A331 PolarHBondContact O-N 2.71Å; R327-A331 VanDerWaalsContact O-N 3.12Å; E329-A331 VanDerWaalsContact C-N 3.32Å; E329-A331 PolarHBondContact O-N 3.38Å; A331-R335 WeakPolarHBondContact O-CD 3.31Å; A331-R335 PolarHBondContact O-NE 3.37Å
332	F	66.9	Low	63.2	Low	132 Å²	132	66.3 Å²	66.3	58%	0.579	35%	0.346	S	S	*	.	H	α-helix	trans	-104.7	-48.7	168.1	-173.8	-90	0	0	0	111.3	E329 E330 S334 R335 M336	E329-F332 CarbonylContact O-C 3.5Å; E329-F332 WeakPolarHBondContact O-CA 3.24Å; E329-F332 VanDerWaalsContact O-CB 3.32Å; E329-F332 WeakPolarHBondContact O-CB 3.48Å; E329-F332 PolarHBondContact O-N 3.34Å; E330-F332 PolarHBondContact O-N 2.81Å; E330-F332 VanDerWaalsContact O-N 3.09Å; F332-S334 VanDerWaalsContact C-N 3.33Å; F332-S334 PolarHBondContact O-N 3.48Å; F332-R335 WeakPolarHBondContact O-CB 3.25Å; F332-R335 PolarHBondContact O-N 3.48Å; F332-M336 HydrophobicContact CD1-CG 4.28Å; F332-M336 HydrophobicContact CE1-CG 3.94Å; F332-M336 HydrophobicContact CE1-SD 3.75Å; F332-M336 HydrophobicContact CZ-CG 4.49Å; F332-M336 HydrophobicContact CZ-SD 3.97Å
333	S	62.8	Low	61.7	Low	23 Å²	23	68.5 Å²	68.5	16%	0.161	36%	0.359	C	S	.	.	H	α-helix	trans	-56.4	-45.4	178.4	-58	0	0	0	0	112.1	E329 E330 R335 M336 E340	E329-S333 PolarHBondContact O-N 2.85Å; E329-S333 PolarHBondContact O-OG 3.36Å; E330-S333 PolarHBondContact O-N 3.22Å; S333-R335 PolarHBondContact O-N 3.08Å; S333-M336 PolarHBondContact O-N 3.34Å; S333-E340 VanDerWaalsContact CB-OE1 3.23Å; S333-E340 WeakPolarHBondContact CB-OE1 3.38Å; S333-E340 PolarHBondContact OG-OE1 3.43Å
334	S	59.8	Low	60.5	Low	78 Å²	78	67.2 Å²	67.2	55%	0.545	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-21.9	175.3	52.5	0	0	0	0	115.1	E330 F332	E330-S334 VanDerWaalsContact O-CB 3.3Å; E330-S334 WeakPolarHBondContact O-CB 3.25Å; E330-S334 PolarHBondContact O-N 3.11Å; E330-S334 PolarHBondContact O-OG 3.48Å; F332-S334 VanDerWaalsContact C-N 3.33Å; F332-S334 PolarHBondContact O-N 3.48Å
335	R	59.4	Low	59.7	Low	157 Å²	157	70.6 Å²	70.6	59%	0.592	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.7	-6.6	178	-55.2	-176.7	-166.5	-125.8	-3	114.2	A331 F332 S333 W413	A331-R335 WeakPolarHBondContact O-CD 3.31Å; A331-R335 PolarHBondContact O-NE 3.37Å; F332-R335 WeakPolarHBondContact O-CB 3.25Å; F332-R335 PolarHBondContact O-N 3.48Å; S333-R335 PolarHBondContact O-N 3.08Å; R335-W413 WeakPolarHBondContact O-CH2 3.15Å
336	M	54.2	Low	59.6	Low	114 Å²	114	73.8 Å²	73.8	56%	0.562	40%	0.398	S	S	*	.	S	Bend	trans	-97.4	1.7	-174.2	-65	-104.1	63	0	0	113	F332 S333 C338	F332-M336 HydrophobicContact CD1-CG 4.28Å; F332-M336 HydrophobicContact CE1-CG 3.94Å; F332-M336 HydrophobicContact CE1-SD 3.75Å; F332-M336 HydrophobicContact CZ-CG 4.49Å; F332-M336 HydrophobicContact CZ-SD 3.97Å; S333-M336 PolarHBondContact O-N 3.34Å; M336-C338 HydrophobicContact CB-CB 4.45Å; M336-C338 PolarHBondContact O-N 3.01Å
337	A	53.1	Low	60.2	Low	28 Å²	28	74.8 Å²	74.8	23%	0.231	40%	0.401	C	S	.	.	S	Bend	trans	57.3	-7.9	-168.7	0	0	0	0	0	115.9	W413	A337-W413 HydrophobicContact CB-CD2 4.09Å; A337-W413 HydrophobicContact CB-CE3 4.22Å; A337-W413 HydrophobicContact CB-CH2 3.77Å; A337-W413 HydrophobicContact CB-CZ2 3.6Å; A337-W413 HydrophobicContact CB-CZ3 4.07Å
338	C	48.2	Very low	60.6	Low	63 Å²	63	74.3 Å²	74.3	43%	0.426	41%	0.405	S	S	.	.			trans	-85.5	110.5	-179.8	-168.5	0	0	0	0	109.5	M336 E340	M336-C338 HydrophobicContact CB-CB 4.45Å; M336-C338 PolarHBondContact O-N 3.01Å; C338-E340 PolarHBondContact O-N 3.16Å
339	E	52.4	Low	61.5	Low	63 Å²	63	66.7 Å²	66.7	29%	0.294	37%	0.372	S	S	.	.			trans	-66.7	129.7	164.6	-60.4	-163	139.4	0	0	107.7	N341 L342 R387	E339-N341 PolarHBondContact O-N 3.3Å; E339-L342 PolarHBondContact O-N 3.13Å; E339-R387 IonicContact OE1-NH2 2.72Å; E339-R387 PolarHBondContact OE1-NH2 3.31Å
340	E	48	Very low	62.7	Low	61 Å²	61	65.1 Å²	65.1	29%	0.285	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-8.5	-166.7	-59.5	-169.2	167.3	0	0	115	R125 S333 C338	R125-E340 IonicContact CZ-OE2 3.88Å; R125-E340 IonicContact NH1-OE2 2.66Å; R125-E340 PolarHBondContact NH1-OE2 3.35Å; R125-E340 VanDerWaalsContact NH2-CD 3.26Å; R125-E340 IonicContact NH2-OE1 3.97Å; R125-E340 PolarHBondContact NH2-OE1 2.76Å; R125-E340 VanDerWaalsContact NH2-OE1 3.1Å; R125-E340 IonicContact NH2-OE2 2.77Å; R125-E340 PolarHBondContact NH2-OE2 3.3Å; S333-E340 VanDerWaalsContact CB-OE1 3.23Å; S333-E340 WeakPolarHBondContact CB-OE1 3.38Å; S333-E340 PolarHBondContact OG-OE1 3.43Å; C338-E340 PolarHBondContact O-N 3.16Å
341	N	48.1	Very low	63.9	Low	45 Å²	45	64.8 Å²	64.8	24%	0.241	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-30.1	-179.5	-75.3	1.2	0	0	0	114	D3 R118 E339 P343	D3-N341 PolarHBondContact OD2-ND2 2.72Å; R118-N341 PolarHBondContact NH2-O 2.88Å; E339-N341 PolarHBondContact O-N 3.3Å; N341-P343 VanDerWaalsContact O-CD 3.28Å; N341-P343 WeakPolarHBondContact O-CD 3.14Å
342	L	50.3	Low	64.9	Low	31 Å²	31	65.4 Å²	65.4	16%	0.162	36%	0.358	C	S	.	.	S	Bend	trans	-108.8	96.3	-178.2	-78.6	80.6	0	0	0	110.2	D3 E339 G344	D3-L342 HydrophobicContact CB-CD1 4.28Å; E339-L342 PolarHBondContact O-N 3.13Å; L342-G344 PolarHBondContact O-N 3.25Å
343	P	44.6	Very low	66.2	Low	98 Å²	98	59.7 Å²	59.7	64%	0.636	33%	0.334	S	S	*	.	S	Bend	trans	-76.8	82.9	-174.6	32.1	-36.6	0	0	0	112.5	N341	N341-P343 VanDerWaalsContact O-CD 3.28Å; N341-P343 WeakPolarHBondContact O-CD 3.14Å
344	G	51.6	Low	67.7	Low	73 Å²	73	58.6 Å²	58.6	75%	0.753	33%	0.326	S	S	*	.	S	Bend	trans	116.7	-4.1	166.3	0	0	0	0	0	116.3	L342	L342-G344 PolarHBondContact O-N 3.25Å
345	Q	56.2	Low	69.3	Low	100 Å²	100	57.9 Å²	57.9	47%	0.467	32%	0.318	S	S	.	.			trans	-109	133.1	170.9	-73.7	179.5	-20.4	0	0	110.5
346	T	68.1	Low	70.8	Confident	84 Å²	84	51.1 Å²	51.1	52%	0.515	29%	0.294	S	S	.	.			trans	-81.4	132.4	165.9	49	0	0	0	0	109.4	N415	T346-N415 WeakPolarHBondContact CB-ND2 3.48Å; T346-N415 PolarHBondContact O-ND2 3.01Å; T346-N415 PolarHBondContact OG1-ND2 3.18Å; T346-N415 VanDerWaalsContact OG1-ND2 3.08Å
347	R	81.7	Confident	72.5	Confident	24 Å²	24	47.5 Å²	47.5	9%	0.091	27%	0.274	C	S	.	.			trans	-61.3	133.5	-178.3	-163.6	169.2	177.2	178.5	-4.6	111.1	W349 E352 D380 N414 N415	R347-W349 HydrophobicContact CG-CD2 4.44Å; R347-W349 HydrophobicContact CG-CZ2 4.45Å; R347-W349 VanDerWaalsContact CZ-CZ3 3.48Å; R347-W349 PolarHBondContact O-N 2.98Å; R347-E352 WeakPolarHBondContact CD-OE1 3.4Å; R347-E352 WeakPolarHBondContact CG-OE1 3.27Å; R347-E352 IonicContact CZ-OE1 3.61Å; R347-E352 IonicContact CZ-OE2 2.75Å; R347-E352 VanDerWaalsContact CZ-OE2 3.32Å; R347-E352 VanDerWaalsContact NE-CD 3.31Å; R347-E352 IonicContact NE-OE1 3.63Å; R347-E352 PolarHBondContact NE-OE1 3.19Å; R347-E352 IonicContact NE-OE2 2.72Å; R347-E352 PolarHBondContact NE-OE2 3.45Å; R347-E352 VanDerWaalsContact NE-OE2 3.11Å; R347-E352 IonicContact NH2-OE1 2.76Å; R347-E352 IonicContact NH2-OE2 3.44Å; R347-E352 PolarHBondContact NH2-OE2 3.42Å; R347-D380 IonicContact CZ-OD2 2.72Å; R347-D380 IonicContact NH1-OD2 3.58Å; R347-D380 PolarHBondContact NH1-OD2 3.06Å; R347-D380 IonicContact NH2-OD2 3.17Å; R347-D380 PolarHBondContact NH2-OD2 2.84Å; R347-D380 VanDerWaalsContact NH2-OD2 3.17Å; R347-N414 PolarHBondContact N-OD1 3.48Å; R347-N415 WeakPolarHBondContact O-CB 3.11Å; R347-N415 PolarHBondContact O-ND2 3.1Å
348	D	87.7	Confident	74.3	Confident	71 Å²	71	50.2 Å²	50.2	38%	0.38	28%	0.282	S	S	.	.			trans	-94.7	92	172.2	-165.1	-35.6	0	0	0	110.2	N350 E351 E352	D348-N350 PolarHBondContact O-N 2.91Å; D348-N350 WeakPolarHBondContact OD1-CA 3.39Å; D348-N350 WeakPolarHBondContact OD1-CB 3.45Å; D348-N350 PolarHBondContact OD1-N 2.94Å; D348-E351 HydrophobicContact CB-CB 3.97Å; D348-E351 PolarHBondContact O-N 3.17Å; D348-E351 PolarHBondContact OD1-N 3.24Å; D348-E352 PolarHBondContact O-N 2.86Å
349	W	92	Very high	76.4	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.008	28%	0.277	C	S	.	.	H	α-helix	trans	-63.2	-24.1	177.6	-60.6	101.6	0	0	0	113.9	R347 L353 D380 F381 A384 N414 M416 T478	R347-W349 HydrophobicContact CG-CD2 4.44Å; R347-W349 HydrophobicContact CG-CZ2 4.45Å; R347-W349 VanDerWaalsContact CZ-CZ3 3.48Å; R347-W349 PolarHBondContact O-N 2.98Å; W349-L353 WeakPolarHBondContact O-CB 3.36Å; W349-L353 WeakPolarHBondContact O-CD1 3.34Å; W349-L353 WeakPolarHBondContact O-CG 3.33Å; W349-L353 PolarHBondContact O-N 3.37Å; W349-D380 HydrophobicContact CH2-CB 4.17Å; W349-D380 HydrophobicContact CZ3-CB 3.89Å; W349-F381 HydrophobicContact CB-CD2 4.01Å; W349-F381 HydrophobicContact CD2-CB 4.48Å; W349-F381 HydrophobicContact CD2-CD2 4.1Å; W349-F381 HydrophobicContact CE3-CB 3.7Å; W349-F381 HydrophobicContact CE3-CD2 4.13Å; W349-F381 HydrophobicContact CE3-CG 4.43Å; W349-F381 HydrophobicContact CG-CD2 4.08Å; W349-F381 VanDerWaalsContact CZ3-CA 3.41Å; W349-F381 HydrophobicContact CZ3-CB 3.91Å; W349-F381 VanDerWaalsContact CZ3-N 3.29Å; W349-A384 HydrophobicContact CH2-CB 3.66Å; W349-A384 HydrophobicContact CZ2-CB 3.33Å; W349-N414 PolarHBondContact NE1-ND2 2.93Å; W349-N414 PolarHBondContact NE1-O 2.82Å; W349-M416 HydrophobicContact CG-CG 4.13Å; W349-T478 HydrophobicContact CB-CG2 3.8Å
350	N	93.5	Very high	78.1	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-75.6	-51.3	176.4	-171.4	70.5	0	0	0	109.7	D348 E352 L353 Q354 T478 I479 Y554	D348-N350 PolarHBondContact O-N 2.91Å; D348-N350 WeakPolarHBondContact OD1-CA 3.39Å; D348-N350 WeakPolarHBondContact OD1-CB 3.45Å; D348-N350 PolarHBondContact OD1-N 2.94Å; N350-E352 PolarHBondContact O-N 3.31Å; N350-L353 PolarHBondContact O-N 3.45Å; N350-Q354 WeakPolarHBondContact O-CG 3.49Å; N350-Q354 PolarHBondContact O-N 3.01Å; N350-Q354 PolarHBondContact OD1-NE2 2.83Å; N350-Q354 VanDerWaalsContact OD1-NE2 3.17Å; N350-T478 PolarHBondContact OD1-OG1 3.4Å; N350-I479 WeakPolarHBondContact CB-O 3.36Å; N350-Y554 PolarHBondContact ND2-OH 2.89Å
351	E	93.5	Very high	80	Confident	68 Å²	68	51.5 Å²	51.5	32%	0.318	29%	0.291	S	S	.	.	H	α-helix	trans	-58	-48.2	180	-167.4	59	-147.4	0	0	111	D348 L353 Q354 V355 R552	D348-E351 HydrophobicContact CB-CB 3.97Å; D348-E351 PolarHBondContact O-N 3.17Å; D348-E351 PolarHBondContact OD1-N 3.24Å; E351-L353 PolarHBondContact O-N 3.4Å; E351-Q354 PolarHBondContact O-N 2.86Å; E351-V355 HydrophobicContact CG-CG2 4.08Å; E351-V355 WeakPolarHBondContact O-CB 3.28Å; E351-V355 VanDerWaalsContact O-CG2 3.27Å; E351-V355 WeakPolarHBondContact O-CG2 3.32Å; E351-V355 PolarHBondContact O-N 2.96Å; E351-V355 WeakPolarHBondContact OE1-CG2 3.38Å; E351-R552 IonicContact OE1-CZ 3.46Å; E351-R552 IonicContact OE1-NH1 3.57Å; E351-R552 PolarHBondContact OE1-NH1 3.13Å; E351-R552 IonicContact OE1-NH2 2.75Å; E351-R552 PolarHBondContact OE1-NH2 3.45Å; E351-R552 IonicContact OE2-CZ 3.72Å; E351-R552 IonicContact OE2-NH1 3.31Å; E351-R552 PolarHBondContact OE2-NH1 2.87Å; E351-R552 IonicContact OE2-NH2 3.75Å
352	E	91.3	Very high	81.9	Confident	59 Å²	59	54.9 Å²	54.9	28%	0.276	31%	0.313	S	S	.	.	H	α-helix	trans	-59.2	-41.8	177	-77.1	-175.6	-138.3	0	0	113.6	R347 D348 N350 T356	R347-E352 WeakPolarHBondContact CD-OE1 3.4Å; R347-E352 WeakPolarHBondContact CG-OE1 3.27Å; R347-E352 IonicContact CZ-OE1 3.61Å; R347-E352 IonicContact CZ-OE2 2.75Å; R347-E352 VanDerWaalsContact CZ-OE2 3.32Å; R347-E352 VanDerWaalsContact NE-CD 3.31Å; R347-E352 IonicContact NE-OE1 3.63Å; R347-E352 PolarHBondContact NE-OE1 3.19Å; R347-E352 IonicContact NE-OE2 2.72Å; R347-E352 PolarHBondContact NE-OE2 3.45Å; R347-E352 VanDerWaalsContact NE-OE2 3.11Å; R347-E352 IonicContact NH2-OE1 2.76Å; R347-E352 IonicContact NH2-OE2 3.44Å; R347-E352 PolarHBondContact NH2-OE2 3.42Å; D348-E352 PolarHBondContact O-N 2.86Å; N350-E352 PolarHBondContact O-N 3.31Å; E352-T356 WeakPolarHBondContact O-CB 3.45Å; E352-T356 VanDerWaalsContact O-CG2 3.29Å; E352-T356 WeakPolarHBondContact O-CG2 3.34Å; E352-T356 PolarHBondContact O-N 3.35Å; E352-T356 PolarHBondContact O-OG1 3.14Å
353	L	92.8	Very high	83.8	Confident	12 Å²	12	61.8 Å²	61.8	6%	0.063	34%	0.337	C	S	.	.	H	α-helix	trans	-74.2	-25.4	-179.6	-71	178.3	0	0	0	113.1	W349 N350 E351 T356 R357 N378 F381 T478	W349-L353 WeakPolarHBondContact O-CB 3.36Å; W349-L353 WeakPolarHBondContact O-CD1 3.34Å; W349-L353 WeakPolarHBondContact O-CG 3.33Å; W349-L353 PolarHBondContact O-N 3.37Å; N350-L353 PolarHBondContact O-N 3.45Å; E351-L353 PolarHBondContact O-N 3.4Å; L353-T356 PolarHBondContact O-OG1 3.06Å; L353-R357 WeakPolarHBondContact O-CD 3.49Å; L353-R357 WeakPolarHBondContact O-CG 3.17Å; L353-N378 HydrophobicContact CD2-CB 4.37Å; L353-F381 HydrophobicContact CD1-CB 4.41Å; L353-F381 HydrophobicContact CD1-CD1 4.43Å; L353-F381 HydrophobicContact CD1-CD2 4.37Å; L353-F381 HydrophobicContact CD1-CG 4.15Å; L353-T478 HydrophobicContact CD1-CG2 4Å
354	Q	94.4	Very high	85.8	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-84.7	-42.3	172.4	-49.6	-33.7	-31.6	0	0	112	N350 E351 T356 R357 E358 Y460 T461 Y554	N350-Q354 WeakPolarHBondContact O-CG 3.49Å; N350-Q354 PolarHBondContact O-N 3.01Å; N350-Q354 PolarHBondContact OD1-NE2 2.83Å; N350-Q354 VanDerWaalsContact OD1-NE2 3.17Å; E351-Q354 PolarHBondContact O-N 2.86Å; Q354-T356 VanDerWaalsContact C-N 3.32Å; Q354-T356 PolarHBondContact O-N 2.89Å; Q354-R357 CarbonylContact O-C 3.59Å; Q354-R357 WeakPolarHBondContact O-CA 3.46Å; Q354-R357 WeakPolarHBondContact O-CB 3.24Å; Q354-R357 PolarHBondContact O-N 3.39Å; Q354-E358 WeakPolarHBondContact O-CG 3.47Å; Q354-E358 PolarHBondContact O-N 2.98Å; Q354-Y460 HydrophobicContact CB-CD1 3.97Å; Q354-Y460 HydrophobicContact CB-CE1 4.19Å; Q354-Y460 HydrophobicContact CG-CD1 3.99Å; Q354-T461 PolarHBondContact NE2-O 3.11Å; Q354-Y554 HydrophobicContact CG-CE1 4.15Å
355	V	93.4	Very high	87.5	Confident	62 Å²	62	60.7 Å²	60.7	38%	0.376	31%	0.311	S	S	.	.	H	α-helix	trans	-59.1	-42	176.2	169.2	0	0	0	0	111.4	E351 R357 E358 L359	E351-V355 HydrophobicContact CG-CG2 4.08Å; E351-V355 WeakPolarHBondContact O-CB 3.28Å; E351-V355 VanDerWaalsContact O-CG2 3.27Å; E351-V355 WeakPolarHBondContact O-CG2 3.32Å; E351-V355 PolarHBondContact O-N 2.96Å; E351-V355 WeakPolarHBondContact OE1-CG2 3.38Å; V355-R357 VanDerWaalsContact C-N 3.27Å; V355-R357 PolarHBondContact O-N 3.16Å; V355-E358 PolarHBondContact O-N 2.96Å; V355-L359 PolarHBondContact O-N 3.25Å
356	T	92.1	Very high	89.1	Confident	15 Å²	15	58.1 Å²	58.1	9%	0.092	30%	0.3	C	S	.	.	H	α-helix	trans	-65.4	-28.7	175.6	50.6	0	0	0	0	113.1	E352 L353 Q354 R370 A373 I374	E352-T356 WeakPolarHBondContact O-CB 3.45Å; E352-T356 VanDerWaalsContact O-CG2 3.29Å; E352-T356 WeakPolarHBondContact O-CG2 3.34Å; E352-T356 PolarHBondContact O-N 3.35Å; E352-T356 PolarHBondContact O-OG1 3.14Å; L353-T356 PolarHBondContact O-OG1 3.06Å; Q354-T356 VanDerWaalsContact C-N 3.32Å; Q354-T356 PolarHBondContact O-N 2.89Å; T356-R370 WeakPolarHBondContact O-CG 3.47Å; T356-A373 HydrophobicContact CG2-CB 3.69Å; T356-I374 WeakPolarHBondContact O-CG1 3.41Å
357	R	89.5	Confident	90.1	Very high	39 Å²	39	57.5 Å²	57.5	15%	0.147	29%	0.288	C	S	.	.	H	α-helix	trans	-74.9	-30.4	169	-71.9	168	166.9	162.5	-8.3	112.8	L353 Q354 V355 L359 R370 I374 S452 T461	L353-R357 WeakPolarHBondContact O-CD 3.49Å; L353-R357 WeakPolarHBondContact O-CG 3.17Å; Q354-R357 CarbonylContact O-C 3.59Å; Q354-R357 WeakPolarHBondContact O-CA 3.46Å; Q354-R357 WeakPolarHBondContact O-CB 3.24Å; Q354-R357 PolarHBondContact O-N 3.39Å; V355-R357 VanDerWaalsContact C-N 3.27Å; V355-R357 PolarHBondContact O-N 3.16Å; R357-L359 VanDerWaalsContact C-N 3.29Å; R357-L359 PolarHBondContact O-N 2.92Å; R357-R370 VanDerWaalsContact O-CZ 3.28Å; R357-R370 PolarHBondContact O-NE 3.28Å; R357-R370 PolarHBondContact O-NH2 3.4Å; R357-I374 HydrophobicContact CG-CD1 4.23Å; R357-S452 PolarHBondContact NH2-OG 3.42Å; R357-T461 PolarHBondContact NH1-O 3.42Å; R357-T461 PolarHBondContact NH1-OG1 3.15Å; R357-T461 PolarHBondContact NH2-OG1 3.39Å
358	E	91.5	Very high	90.5	Very high	84 Å²	84	57.6 Å²	57.6	39%	0.393	29%	0.29	S	S	.	.	H	α-helix	trans	-80.1	-6.7	-179.2	-71.2	168.4	157.8	0	0	114.1	Q354 V355 Y460 R552	Q354-E358 WeakPolarHBondContact O-CG 3.47Å; Q354-E358 PolarHBondContact O-N 2.98Å; V355-E358 PolarHBondContact O-N 2.96Å; E358-Y460 HydrophobicContact CG-CE1 4.01Å; E358-Y460 WeakPolarHBondContact OE1-CE1 3.39Å; E358-Y460 PolarHBondContact OE1-OH 3.17Å; E358-R552 IonicContact OE1-CZ 3.39Å; E358-R552 IonicContact OE1-NE 2.71Å; E358-R552 PolarHBondContact OE1-NE 3.26Å; E358-R552 IonicContact OE1-NH2 3.73Å; E358-R552 IonicContact OE2-CZ 2.73Å; E358-R552 IonicContact OE2-NE 3.16Å; E358-R552 PolarHBondContact OE2-NE 2.96Å; E358-R552 IonicContact OE2-NH2 2.9Å; E358-R552 PolarHBondContact OE2-NH2 3.36Å
359	L	91.7	Very high	90.6	Very high	61 Å²	61	58.9 Å²	58.9	32%	0.319	30%	0.296	S	S	.	.	S	Bend	trans	-54.5	146.7	174	-71.7	173.1	0	0	0	112.3	V355 R357 R370 A373	V355-L359 PolarHBondContact O-N 3.25Å; R357-L359 VanDerWaalsContact C-N 3.29Å; R357-L359 PolarHBondContact O-N 2.92Å; L359-R370 HydrophobicContact CB-CB 4.02Å; L359-R370 HydrophobicContact CB-CG 4Å; L359-R370 HydrophobicContact CD1-CB 4.28Å; L359-R370 HydrophobicContact CD1-CG 4.5Å; L359-R370 WeakPolarHBondContact O-CD 3.47Å; L359-A373 HydrophobicContact CD1-CB 3.79Å
360	P	88.9	Confident	90.6	Very high	80 Å²	80	59.3 Å²	59.3	52%	0.519	30%	0.298	S	S	.	.			trans	-54	153.1	177.8	-27.4	35.6	0	0	0	114	E366	P360-E366 HydrophobicContact CB-CB 4.21Å; P360-E366 HydrophobicContact CB-CG 4.15Å; P360-E366 WeakPolarHBondContact O-CB 3.36Å
361	Q	86.7	Confident	90.5	Very high	74 Å²	74	60.3 Å²	60.3	35%	0.346	30%	0.303	S	S	.	.			trans	-132.3	6.1	-175.8	-51.8	-170.6	17.9	0	0	113.9	R367 R370 D455	Q361-R367 HydrophobicContact CB-CG 3.92Å; Q361-R367 WeakPolarHBondContact O-CD 2.81Å; Q361-R367 VanDerWaalsContact O-CG 3.28Å; Q361-R367 WeakPolarHBondContact O-CG 3.4Å; Q361-R367 PolarHBondContact O-NH1 2.83Å; Q361-R370 VanDerWaalsContact NE2-NH2 3.15Å; Q361-D455 PolarHBondContact NE2-OD2 2.94Å
362	T	88.8	Confident	90.4	Very high	116 Å²	116	62.9 Å²	62.9	71%	0.712	31%	0.31	S	S	*	.	S	Bend	trans	-75.6	-39.3	-166.7	74.3	0	0	0	0	112	E366	T362-E366 WeakPolarHBondContact CA-OE2 3.49Å; T362-E366 WeakPolarHBondContact CB-OE2 3.5Å; T362-E366 PolarHBondContact N-OE2 2.97Å; T362-E366 PolarHBondContact OG1-OE1 3.28Å; T362-E366 PolarHBondContact OG1-OE2 3.34Å
363	R	88.9	Confident	90.5	Very high	175 Å²	175	61.1 Å²	61.1	66%	0.66	31%	0.306	S	S	*	.	S	Bend	trans	-101.2	155.1	177.4	-56.1	177.6	-173.8	-150.8	-2.7	110.9	T365 E366 R367	R363-T365 VanDerWaalsContact C-N 3.32Å; R363-T365 PolarHBondContact O-N 3.05Å; R363-E366 HydrophobicContact CB-CB 4.35Å; R363-E366 HydrophobicContact CB-CG 3.93Å; R363-E366 VanDerWaalsContact CD-OE1 3.24Å; R363-E366 WeakPolarHBondContact CD-OE1 3.46Å; R363-E366 HydrophobicContact CG-CG 4.43Å; R363-E366 VanDerWaalsContact CG-OE1 3.31Å; R363-E366 WeakPolarHBondContact CG-OE1 3.29Å; R363-E366 PolarHBondContact N-OE2 2.95Å; R363-E366 IonicContact NE-OE1 3.59Å; R363-E366 WeakPolarHBondContact O-CB 3.3Å; R363-E366 PolarHBondContact O-N 3.46Å; R363-R367 PolarHBondContact O-N 3.46Å; R363-R367 VanDerWaalsContact O-N 3.1Å
364	L	87.3	Confident	90.4	Very high	53 Å²	53	61.9 Å²	61.9	28%	0.277	31%	0.31	S	S	.	.	H	α-helix	trans	-57.4	-45.7	174.4	176.3	58.8	0	0	0	111.3	E366 R367 L368 D1009	L364-E366 VanDerWaalsContact C-N 3.3Å; L364-E366 PolarHBondContact O-N 3.46Å; L364-R367 PolarHBondContact O-N 3.42Å; L364-L368 HydrophobicContact CD1-CD1 3.9Å; L364-L368 HydrophobicContact CD1-CG 4.05Å; L364-L368 HydrophobicContact CG-CD1 3.77Å; L364-L368 HydrophobicContact CG-CG 4.39Å; L364-L368 WeakPolarHBondContact O-CG 3.28Å; L364-L368 PolarHBondContact O-N 3.46Å; L364-D1009 HydrophobicContact CD1-CB 3.51Å; L364-D1009 VanDerWaalsContact CD1-CG 3.48Å
365	T	87.4	Confident	90.3	Very high	95 Å²	95	62.6 Å²	62.6	58%	0.583	31%	0.313	S	S	*	.	H	α-helix	trans	-58.7	-39.1	176.6	-37.7	0	0	0	0	112.7	R363 L368 L369	R363-T365 VanDerWaalsContact C-N 3.32Å; R363-T365 PolarHBondContact O-N 3.05Å; T365-L368 PolarHBondContact O-N 3.14Å; T365-L369 HydrophobicContact CG2-CD1 4.33Å; T365-L369 WeakPolarHBondContact O-CB 3.17Å; T365-L369 VanDerWaalsContact O-CG 3.26Å; T365-L369 WeakPolarHBondContact O-CG 3.15Å; T365-L369 PolarHBondContact O-N 3.3Å
366	E	89.6	Confident	90.2	Very high	47 Å²	47	62.3 Å²	62.3	22%	0.22	31%	0.306	C	S	.	.	H	α-helix	trans	-64.6	-45.7	176.7	-66.4	164.1	-167.6	0	0	110.8	P360 T362 R363 L364 L369 R370	P360-E366 HydrophobicContact CB-CB 4.21Å; P360-E366 HydrophobicContact CB-CG 4.15Å; P360-E366 WeakPolarHBondContact O-CB 3.36Å; T362-E366 WeakPolarHBondContact CA-OE2 3.49Å; T362-E366 WeakPolarHBondContact CB-OE2 3.5Å; T362-E366 PolarHBondContact N-OE2 2.97Å; T362-E366 PolarHBondContact OG1-OE1 3.28Å; T362-E366 PolarHBondContact OG1-OE2 3.34Å; R363-E366 HydrophobicContact CB-CB 4.35Å; R363-E366 HydrophobicContact CB-CG 3.93Å; R363-E366 VanDerWaalsContact CD-OE1 3.24Å; R363-E366 WeakPolarHBondContact CD-OE1 3.46Å; R363-E366 HydrophobicContact CG-CG 4.43Å; R363-E366 VanDerWaalsContact CG-OE1 3.31Å; R363-E366 WeakPolarHBondContact CG-OE1 3.29Å; R363-E366 PolarHBondContact N-OE2 2.95Å; R363-E366 IonicContact NE-OE1 3.59Å; R363-E366 WeakPolarHBondContact O-CB 3.3Å; R363-E366 PolarHBondContact O-N 3.46Å; L364-E366 VanDerWaalsContact C-N 3.3Å; L364-E366 PolarHBondContact O-N 3.46Å; E366-L369 PolarHBondContact O-N 2.91Å; E366-R370 VanDerWaalsContact O-CB 3.29Å; E366-R370 WeakPolarHBondContact O-CB 3.16Å; E366-R370 PolarHBondContact O-N 2.97Å
367	R	90.2	Very high	90.1	Very high	70 Å²	70	62 Å²	62	26%	0.264	31%	0.305	S	S	.	.	H	α-helix	trans	-65.6	-38.5	177.1	-67.7	-166.2	-56	-83.4	1.9	113.2	Q361 R363 L364 R370 D371 D1009	Q361-R367 HydrophobicContact CB-CG 3.92Å; Q361-R367 WeakPolarHBondContact O-CD 2.81Å; Q361-R367 VanDerWaalsContact O-CG 3.28Å; Q361-R367 WeakPolarHBondContact O-CG 3.4Å; Q361-R367 PolarHBondContact O-NH1 2.83Å; R363-R367 PolarHBondContact O-N 3.46Å; R363-R367 VanDerWaalsContact O-N 3.1Å; L364-R367 PolarHBondContact O-N 3.42Å; R367-R370 WeakPolarHBondContact O-CB 3.28Å; R367-R370 PolarHBondContact O-N 3.37Å; R367-D371 WeakPolarHBondContact O-CB 3.43Å; R367-D371 PolarHBondContact O-N 3.04Å; R367-D1009 IonicContact CZ-OD1 2.72Å; R367-D1009 IonicContact CZ-OD2 2.9Å; R367-D1009 IonicContact NE-OD1 2.77Å; R367-D1009 PolarHBondContact NE-OD1 3.41Å; R367-D1009 IonicContact NE-OD2 3.81Å; R367-D1009 PolarHBondContact NE-OD2 3.06Å; R367-D1009 IonicContact NH2-OD1 2.81Å; R367-D1009 PolarHBondContact NH2-OD1 3.04Å; R367-D1009 IonicContact NH2-OD2 3.92Å
368	L	89.2	Confident	90.3	Very high	27 Å²	27	60.8 Å²	60.8	14%	0.141	30%	0.302	C	S	.	.	H	α-helix	trans	-67.1	-42.1	176	-68.5	163.9	0	0	0	111.9	L364 T365 R370 D371 R372 A1010 L1039 V1043	L364-L368 HydrophobicContact CD1-CD1 3.9Å; L364-L368 HydrophobicContact CD1-CG 4.05Å; L364-L368 HydrophobicContact CG-CD1 3.77Å; L364-L368 HydrophobicContact CG-CG 4.39Å; L364-L368 WeakPolarHBondContact O-CG 3.28Å; L364-L368 PolarHBondContact O-N 3.46Å; T365-L368 PolarHBondContact O-N 3.14Å; L368-R370 VanDerWaalsContact C-N 3.3Å; L368-R370 PolarHBondContact O-N 2.83Å; L368-D371 PolarHBondContact O-N 3.39Å; L368-R372 VanDerWaalsContact O-CB 3.31Å; L368-R372 WeakPolarHBondContact O-CB 3.28Å; L368-R372 PolarHBondContact O-N 3.38Å; L368-A1010 HydrophobicContact CD2-CB 4.42Å; L368-L1039 HydrophobicContact CD1-CD2 3.72Å; L368-L1039 HydrophobicContact CD2-CB 4.29Å; L368-L1039 HydrophobicContact CD2-CD2 4.42Å; L368-V1043 HydrophobicContact CB-CG2 4.5Å; L368-V1043 HydrophobicContact CD2-CG2 3.98Å
369	L	89	Confident	90.2	Very high	97 Å²	97	57.7 Å²	57.7	51%	0.508	29%	0.289	S	S	.	.	H	α-helix	trans	-63.3	-37.9	173.1	-72.7	170.3	0	0	0	111.6	T365 E366 A373	T365-L369 HydrophobicContact CG2-CD1 4.33Å; T365-L369 WeakPolarHBondContact O-CB 3.17Å; T365-L369 VanDerWaalsContact O-CG 3.26Å; T365-L369 WeakPolarHBondContact O-CG 3.15Å; T365-L369 PolarHBondContact O-N 3.3Å; E366-L369 PolarHBondContact O-N 2.91Å; L369-A373 WeakPolarHBondContact O-CB 3.45Å; L369-A373 PolarHBondContact O-N 2.89Å
370	R	92.7	Very high	90	Very high	12 Å²	12	56.1 Å²	56.1	5%	0.045	28%	0.281	C	S	.	.	H	α-helix	trans	-64.4	-50.6	173.8	177.2	173.3	-173.2	-94.7	1.7	112.4	T356 R357 L359 Q361 E366 R367 L368 R372 A373 I374 D455	T356-R370 WeakPolarHBondContact O-CG 3.47Å; R357-R370 VanDerWaalsContact O-CZ 3.28Å; R357-R370 PolarHBondContact O-NE 3.28Å; R357-R370 PolarHBondContact O-NH2 3.4Å; L359-R370 HydrophobicContact CB-CB 4.02Å; L359-R370 HydrophobicContact CB-CG 4Å; L359-R370 HydrophobicContact CD1-CB 4.28Å; L359-R370 HydrophobicContact CD1-CG 4.5Å; L359-R370 WeakPolarHBondContact O-CD 3.47Å; Q361-R370 VanDerWaalsContact NE2-NH2 3.15Å; E366-R370 VanDerWaalsContact O-CB 3.29Å; E366-R370 WeakPolarHBondContact O-CB 3.16Å; E366-R370 PolarHBondContact O-N 2.97Å; R367-R370 WeakPolarHBondContact O-CB 3.28Å; R367-R370 PolarHBondContact O-N 3.37Å; L368-R370 VanDerWaalsContact C-N 3.3Å; L368-R370 PolarHBondContact O-N 2.83Å; R370-R372 VanDerWaalsContact C-N 3.3Å; R370-R372 PolarHBondContact O-N 3.31Å; R370-A373 PolarHBondContact O-N 2.81Å; R370-A373 VanDerWaalsContact O-N 3.1Å; R370-I374 HydrophobicContact CG-CD1 3.7Å; R370-I374 HydrophobicContact CG-CG1 4.34Å; R370-I374 WeakPolarHBondContact O-CG1 3.27Å; R370-I374 PolarHBondContact O-N 3.01Å; R370-D455 IonicContact CZ-OD1 2.73Å; R370-D455 IonicContact CZ-OD2 3.35Å; R370-D455 IonicContact NH1-OD1 2.68Å; R370-D455 IonicContact NH1-OD2 3.92Å; R370-D455 PolarHBondContact NH1-OD2 3.13Å; R370-D455 IonicContact NH2-OD1 2.72Å; R370-D455 PolarHBondContact NH2-OD1 2.92Å; R370-D455 IonicContact NH2-OD2 3.34Å; R370-D455 PolarHBondContact NH2-OD2 3.17Å
371	D	91.8	Very high	90.1	Very high	21 Å²	21	52.3 Å²	52.3	11%	0.112	26%	0.256	C	S	.	.	H	α-helix	trans	-60.6	-41	177.6	-76.7	0.8	0	0	0	110.9	R367 L368 A373 F375 A1007 T1008 V1043	R367-D371 WeakPolarHBondContact O-CB 3.43Å; R367-D371 PolarHBondContact O-N 3.04Å; L368-D371 PolarHBondContact O-N 3.39Å; D371-A373 PolarHBondContact O-N 3.18Å; D371-F375 WeakPolarHBondContact O-CB 3.4Å; D371-F375 PolarHBondContact O-N 2.9Å; D371-A1007 WeakPolarHBondContact OD2-CA 3.45Å; D371-T1008 PolarHBondContact OD2-N 2.86Å; D371-V1043 HydrophobicContact CB-CG1 3.95Å; D371-V1043 HydrophobicContact CB-CG2 4.26Å
372	R	91.9	Very high	90.4	Very high	121 Å²	121	49.6 Å²	49.6	46%	0.457	25%	0.245	S	C	.	.	H	α-helix	trans	-57.1	-47.1	172.1	-172.7	-176	-175.1	-163.2	-3.1	111.3	L368 R370 K376 G1042	L368-R372 VanDerWaalsContact O-CB 3.31Å; L368-R372 WeakPolarHBondContact O-CB 3.28Å; L368-R372 PolarHBondContact O-N 3.38Å; R370-R372 VanDerWaalsContact C-N 3.3Å; R370-R372 PolarHBondContact O-N 3.31Å; R372-K376 WeakPolarHBondContact O-CB 3.35Å; R372-K376 PolarHBondContact O-N 2.86Å; R372-G1042 WeakPolarHBondContact CD-O 3.21Å; R372-G1042 WeakPolarHBondContact CG-O 3.08Å; R372-G1042 PolarHBondContact NE-O 3.45Å
373	A	91.8	Very high	90.4	Very high	23 Å²	23	45.3 Å²	45.3	19%	0.19	22%	0.221	C	C	.	.	H	α-helix	trans	-68.6	-46.7	-178.3	0	0	0	0	0	112.4	T356 L359 L369 R370 D371 K376 S377	T356-A373 HydrophobicContact CG2-CB 3.69Å; L359-A373 HydrophobicContact CD1-CB 3.79Å; L369-A373 WeakPolarHBondContact O-CB 3.45Å; L369-A373 PolarHBondContact O-N 2.89Å; R370-A373 PolarHBondContact O-N 2.81Å; R370-A373 VanDerWaalsContact O-N 3.1Å; D371-A373 PolarHBondContact O-N 3.18Å; A373-K376 PolarHBondContact O-N 2.87Å; A373-S377 PolarHBondContact O-N 3.21Å; A373-S377 PolarHBondContact O-OG 3.48Å
374	I	92.6	Very high	90.4	Very high	27 Å²	27	37.2 Å²	37.2	14%	0.138	19%	0.191	C	C	.	.	H	α-helix	trans	-62.2	-46.6	177.7	-64	170	0	0	0	110.5	T356 R357 R370 K376 N378 P1005	T356-I374 WeakPolarHBondContact O-CG1 3.41Å; R357-I374 HydrophobicContact CG-CD1 4.23Å; R370-I374 HydrophobicContact CG-CD1 3.7Å; R370-I374 HydrophobicContact CG-CG1 4.34Å; R370-I374 WeakPolarHBondContact O-CG1 3.27Å; R370-I374 PolarHBondContact O-N 3.01Å; I374-K376 VanDerWaalsContact C-N 3.32Å; I374-K376 PolarHBondContact O-N 3.44Å; I374-N378 WeakPolarHBondContact O-CB 3.1Å; I374-N378 PolarHBondContact O-N 3.03Å; I374-P1005 HydrophobicContact CG2-CB 3.94Å; I374-P1005 HydrophobicContact CG2-CG 4.03Å
375	F	92.2	Very high	90.7	Very high	16 Å²	16	34.7 Å²	34.7	7%	0.07	18%	0.178	C	C	.	.	H	α-helix	trans	-57.7	-45.9	176.6	177.3	-101.3	0	0	0	111.7	P308 D371 S379 P1005 Y1044 H1048	P308-F375 HydrophobicContact CB-CE1 4.12Å; P308-F375 HydrophobicContact CB-CZ 3.89Å; P308-F375 HydrophobicContact CG-CE1 4.07Å; P308-F375 HydrophobicContact CG-CZ 3.71Å; D371-F375 WeakPolarHBondContact O-CB 3.4Å; D371-F375 PolarHBondContact O-N 2.9Å; F375-S379 WeakPolarHBondContact O-CB 3.23Å; F375-S379 PolarHBondContact O-N 3.07Å; F375-S379 PolarHBondContact O-OG 3.05Å; F375-P1005 HydrophobicContact CB-CB 4.32Å; F375-P1005 HydrophobicContact CD2-CB 4.49Å; F375-Y1044 HydrophobicContact CB-CD1 4.45Å; F375-Y1044 AromaticContact CD1-CD1 3.88Å; F375-Y1044 HydrophobicContact CD1-CD1 3.88Å; F375-Y1044 AromaticContact CD2-CD1 3.52Å; F375-Y1044 HydrophobicContact CD2-CD1 3.52Å; F375-Y1044 AromaticContact CD2-CE1 3.7Å; F375-Y1044 HydrophobicContact CD2-CE1 3.7Å; F375-Y1044 AromaticContact CE1-CD1 3.92Å; F375-Y1044 HydrophobicContact CE1-CD1 3.92Å; F375-Y1044 HydrophobicContact CE1-CG 4.49Å; F375-Y1044 AromaticContact CE2-CD1 3.55Å; F375-Y1044 HydrophobicContact CE2-CD1 3.55Å; F375-Y1044 AromaticContact CE2-CE1 3.9Å; F375-Y1044 HydrophobicContact CE2-CE1 3.9Å; F375-Y1044 AromaticContact CG-CD1 3.68Å; F375-Y1044 HydrophobicContact CG-CD1 3.68Å; F375-Y1044 HydrophobicContact CG-CE1 4.17Å; F375-Y1044 AromaticContact CZ-CD1 3.75Å; F375-Y1044 HydrophobicContact CZ-CD1 3.75Å; F375-Y1044 HydrophobicContact CZ-CG 4.4Å; F375-H1048 AromaticContact CE2-NE2 3.92Å; F375-H1048 AromaticContact CZ-CD2 4Å
376	K	89.8	Confident	90.9	Very high	55 Å²	55	30.4 Å²	30.4	24%	0.239	15%	0.152	C	C	.	.	H	α-helix	trans	-66.7	-53.4	-178.5	-170.5	-126.1	-174.1	64.7	0	112.7	M1 V2 R372 A373 I374 N378 S379 D380	M1-K376 PolarHBondContact O-NZ 2.95Å; V2-K376 HydrophobicContact CG1-CD 4.45Å; R372-K376 WeakPolarHBondContact O-CB 3.35Å; R372-K376 PolarHBondContact O-N 2.86Å; A373-K376 PolarHBondContact O-N 2.87Å; I374-K376 VanDerWaalsContact C-N 3.32Å; I374-K376 PolarHBondContact O-N 3.44Å; K376-N378 VanDerWaalsContact C-N 3.32Å; K376-N378 PolarHBondContact O-N 2.94Å; K376-S379 WeakPolarHBondContact O-CB 3.31Å; K376-S379 PolarHBondContact O-N 3.15Å; K376-S379 VanDerWaalsContact O-N 3.08Å; K376-D380 PolarHBondContact O-N 3.39Å
377	S	90.8	Very high	90.8	Very high	10 Å²	10	34 Å²	34	7%	0.07	16%	0.163	C	C	.	.	H	α-helix	trans	-65.5	-35.2	-178.2	-65.4	0	0	0	0	112.1	A373 F381	A373-S377 PolarHBondContact O-N 3.21Å; A373-S377 PolarHBondContact O-OG 3.48Å; S377-F381 VanDerWaalsContact O-CB 3.24Å; S377-F381 WeakPolarHBondContact O-CB 3.48Å; S377-F381 PolarHBondContact O-N 2.92Å
378	N	92.6	Very high	90.9	Very high	13 Å²	13	30.8 Å²	30.8	7%	0.07	15%	0.152	C	C	.	.	H	α-helix	trans	-65.4	-38.1	171.1	178.9	90.3	0	0	0	112.2	L353 I374 K376 F381 V382 L1003 P1005	L353-N378 HydrophobicContact CD2-CB 4.37Å; I374-N378 WeakPolarHBondContact O-CB 3.1Å; I374-N378 PolarHBondContact O-N 3.03Å; K376-N378 VanDerWaalsContact C-N 3.32Å; K376-N378 PolarHBondContact O-N 2.94Å; N378-F381 PolarHBondContact O-N 3.32Å; N378-V382 WeakPolarHBondContact O-CB 3.45Å; N378-V382 VanDerWaalsContact O-CG2 3.25Å; N378-V382 WeakPolarHBondContact O-CG2 3.43Å; N378-V382 PolarHBondContact O-N 2.65Å; N378-L1003 PolarHBondContact ND2-O 3.4Å; N378-L1003 VanDerWaalsContact ND2-O 3.16Å; N378-P1005 HydrophobicContact CB-CG 3.79Å; N378-P1005 WeakPolarHBondContact ND2-CD 3.33Å
379	S	90.1	Very high	91.1	Very high	18 Å²	18	29.5 Å²	29.5	13%	0.126	15%	0.145	C	C	.	.	H	α-helix	trans	-69	-44.2	177.7	-60.1	0	0	0	0	112.3	F375 K376 V382 A383	F375-S379 WeakPolarHBondContact O-CB 3.23Å; F375-S379 PolarHBondContact O-N 3.07Å; F375-S379 PolarHBondContact O-OG 3.05Å; K376-S379 WeakPolarHBondContact O-CB 3.31Å; K376-S379 PolarHBondContact O-N 3.15Å; K376-S379 VanDerWaalsContact O-N 3.08Å; S379-V382 PolarHBondContact O-N 2.9Å; S379-A383 PolarHBondContact O-N 3.27Å
380	D	87.6	Confident	91.3	Very high	29 Å²	29	26.3 Å²	26.3	16%	0.155	13%	0.13	C	C	.	.	H	α-helix	trans	-59.4	-45.1	172.7	-82	-0.7	0	0	0	110.6	R347 W349 K376 A383 A384	R347-D380 IonicContact CZ-OD2 2.72Å; R347-D380 IonicContact NH1-OD2 3.58Å; R347-D380 PolarHBondContact NH1-OD2 3.06Å; R347-D380 IonicContact NH2-OD2 3.17Å; R347-D380 PolarHBondContact NH2-OD2 2.84Å; R347-D380 VanDerWaalsContact NH2-OD2 3.17Å; W349-D380 HydrophobicContact CH2-CB 4.17Å; W349-D380 HydrophobicContact CZ3-CB 3.89Å; K376-D380 PolarHBondContact O-N 3.39Å; D380-A383 PolarHBondContact O-N 3.12Å; D380-A384 WeakPolarHBondContact O-CB 3.41Å; D380-A384 PolarHBondContact O-N 2.81Å
381	F	91.9	Very high	91.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.5	-48.2	176.4	167.6	-100.2	0	0	0	112	W349 L353 S377 N378 A383 A384 A385 M416 G463 A465 T478	W349-F381 HydrophobicContact CB-CD2 4.01Å; W349-F381 HydrophobicContact CD2-CB 4.48Å; W349-F381 HydrophobicContact CD2-CD2 4.1Å; W349-F381 HydrophobicContact CE3-CB 3.7Å; W349-F381 HydrophobicContact CE3-CD2 4.13Å; W349-F381 HydrophobicContact CE3-CG 4.43Å; W349-F381 HydrophobicContact CG-CD2 4.08Å; W349-F381 VanDerWaalsContact CZ3-CA 3.41Å; W349-F381 HydrophobicContact CZ3-CB 3.91Å; W349-F381 VanDerWaalsContact CZ3-N 3.29Å; L353-F381 HydrophobicContact CD1-CB 4.41Å; L353-F381 HydrophobicContact CD1-CD1 4.43Å; L353-F381 HydrophobicContact CD1-CD2 4.37Å; L353-F381 HydrophobicContact CD1-CG 4.15Å; S377-F381 VanDerWaalsContact O-CB 3.24Å; S377-F381 WeakPolarHBondContact O-CB 3.48Å; S377-F381 PolarHBondContact O-N 2.92Å; N378-F381 PolarHBondContact O-N 3.32Å; F381-A383 VanDerWaalsContact C-N 3.32Å; F381-A383 PolarHBondContact O-N 3.48Å; F381-A384 PolarHBondContact O-N 3.47Å; F381-A385 WeakPolarHBondContact O-CB 3.5Å; F381-A385 PolarHBondContact O-N 3.04Å; F381-M416 HydrophobicContact CD2-CG 4.35Å; F381-M416 HydrophobicContact CD2-SD 3.77Å; F381-M416 HydrophobicContact CE2-CG 3.86Å; F381-M416 HydrophobicContact CE2-SD 3.53Å; F381-M416 VanDerWaalsContact CE2-SD 3.53Å; F381-M416 HydrophobicContact CZ-SD 4.45Å; F381-G463 VanDerWaalsContact CE1-C 3.5Å; F381-G463 VanDerWaalsContact CZ-C 3.43Å; F381-G463 WeakPolarHBondContact CZ-O 3.33Å; F381-A465 HydrophobicContact CE1-CB 4.23Å; F381-T478 HydrophobicContact CD2-CG2 4.12Å; F381-T478 HydrophobicContact CE2-CG2 3.6Å; F381-T478 HydrophobicContact CZ-CG2 4.18Å
382	V	92.5	Very high	91.2	Very high	16 Å²	16	26.5 Å²	26.5	10%	0.097	14%	0.135	C	C	.	.	H	α-helix	trans	-62.4	-39.3	179	168.3	0	0	0	0	111.3	N378 S379 T386 V1000 H1002	N378-V382 WeakPolarHBondContact O-CB 3.45Å; N378-V382 VanDerWaalsContact O-CG2 3.25Å; N378-V382 WeakPolarHBondContact O-CG2 3.43Å; N378-V382 PolarHBondContact O-N 2.65Å; S379-V382 PolarHBondContact O-N 2.9Å; V382-T386 VanDerWaalsContact O-CB 3.27Å; V382-T386 WeakPolarHBondContact O-CB 3.25Å; V382-T386 PolarHBondContact O-N 2.9Å; V382-T386 PolarHBondContact O-OG1 3.01Å; V382-V1000 HydrophobicContact CG1-CG1 4.02Å; V382-H1002 HydrophobicContact CG2-CB 3.55Å
383	A	88.3	Confident	91.2	Very high	26 Å²	26	21 Å²	21	22%	0.215	11%	0.114	C	C	.	.	H	α-helix	trans	-64.6	-46.8	175.4	0	0	0	0	0	111.9	S379 D380 F381 T386 R387	S379-A383 PolarHBondContact O-N 3.27Å; D380-A383 PolarHBondContact O-N 3.12Å; F381-A383 VanDerWaalsContact C-N 3.32Å; F381-A383 PolarHBondContact O-N 3.48Å; A383-T386 PolarHBondContact O-N 2.99Å; A383-R387 WeakPolarHBondContact O-CG 3.38Å; A383-R387 PolarHBondContact O-N 3.35Å
384	A	88.7	Confident	91.1	Very high	5 Å²	5	23 Å²	23	4%	0.041	12%	0.122	C	C	.	.	H	α-helix	trans	-63.7	-46.1	177.4	0	0	0	0	0	112.5	W349 D380 F381 T386 R387 A388 M416	W349-A384 HydrophobicContact CH2-CB 3.66Å; W349-A384 HydrophobicContact CZ2-CB 3.33Å; D380-A384 WeakPolarHBondContact O-CB 3.41Å; D380-A384 PolarHBondContact O-N 2.81Å; F381-A384 PolarHBondContact O-N 3.47Å; A384-T386 VanDerWaalsContact C-N 3.28Å; A384-T386 PolarHBondContact O-N 2.92Å; A384-R387 PolarHBondContact O-N 2.98Å; A384-A388 WeakPolarHBondContact O-CB 3.39Å; A384-A388 PolarHBondContact O-N 3.11Å; A384-M416 HydrophobicContact CB-CE 3.93Å
385	A	93.2	Very high	90.9	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.6	-38.2	175.8	0	0	0	0	0	111.9	F381 A389 M416 A465 A476	F381-A385 WeakPolarHBondContact O-CB 3.5Å; F381-A385 PolarHBondContact O-N 3.04Å; A385-A389 VanDerWaalsContact O-CB 3.22Å; A385-A389 WeakPolarHBondContact O-CB 3.29Å; A385-A389 PolarHBondContact O-N 3.48Å; A385-M416 HydrophobicContact CB-SD 3.87Å; A385-A465 HydrophobicContact CB-CB 4.4Å; A385-A476 HydrophobicContact CB-CB 3.85Å
386	T	92.1	Very high	90.6	Very high	5 Å²	5	27.7 Å²	27.7	3%	0.031	16%	0.161	C	C	.	.	H	α-helix	trans	-69.2	-45.4	178.1	-59	0	0	0	0	111.9	V382 A383 A384 A388 A389 V390 P998 V1000	V382-T386 VanDerWaalsContact O-CB 3.27Å; V382-T386 WeakPolarHBondContact O-CB 3.25Å; V382-T386 PolarHBondContact O-N 2.9Å; V382-T386 PolarHBondContact O-OG1 3.01Å; A383-T386 PolarHBondContact O-N 2.99Å; A384-T386 VanDerWaalsContact C-N 3.28Å; A384-T386 PolarHBondContact O-N 2.92Å; T386-A388 PolarHBondContact O-N 3.24Å; T386-A389 PolarHBondContact O-N 3.39Å; T386-V390 WeakPolarHBondContact O-CG2 3.5Å; T386-V390 PolarHBondContact O-N 3.3Å; T386-P998 HydrophobicContact CG2-CB 3.87Å; T386-P998 HydrophobicContact CG2-CG 3.45Å; T386-P998 VanDerWaalsContact CG2-CG 3.45Å; T386-V1000 HydrophobicContact CG2-CG2 3.71Å; T386-V1000 WeakPolarHBondContact OG1-CG2 3.49Å
387	R	88.7	Confident	90.4	Very high	122 Å²	122	25.4 Å²	25.4	46%	0.46	15%	0.151	S	C	.	.	H	α-helix	trans	-57.4	-48	172.7	-69.3	-171.4	-65.4	-102.4	7	111.2	E339 A383 A384 V390 S391	E339-R387 IonicContact OE1-NH2 2.72Å; E339-R387 PolarHBondContact OE1-NH2 3.31Å; A383-R387 WeakPolarHBondContact O-CG 3.38Å; A383-R387 PolarHBondContact O-N 3.35Å; A384-R387 PolarHBondContact O-N 2.98Å; R387-V390 PolarHBondContact O-N 3.31Å; R387-S391 PolarHBondContact O-N 2.96Å; R387-S391 PolarHBondContact O-OG 3.49Å
388	A	90.9	Very high	90.3	Very high	3 Å²	3	32.6 Å²	32.6	3%	0.025	19%	0.186	C	C	.	.	H	α-helix	trans	-66.7	-41.1	-178.6	0	0	0	0	0	113.1	A384 T386 V390 S391 V392 I397 W413 M416 F418	A384-A388 WeakPolarHBondContact O-CB 3.39Å; A384-A388 PolarHBondContact O-N 3.11Å; T386-A388 PolarHBondContact O-N 3.24Å; A388-V390 VanDerWaalsContact C-N 3.32Å; A388-V390 PolarHBondContact O-N 3.47Å; A388-S391 WeakPolarHBondContact O-CB 3.41Å; A388-S391 PolarHBondContact O-N 3.22Å; A388-S391 VanDerWaalsContact O-N 3.15Å; A388-V392 WeakPolarHBondContact O-CG2 3.2Å; A388-V392 PolarHBondContact O-N 3.13Å; A388-I397 HydrophobicContact CB-CD1 4.48Å; A388-W413 HydrophobicContact CB-CG 4.48Å; A388-M416 HydrophobicContact CB-CE 4.48Å; A388-F418 HydrophobicContact CB-CE1 3.76Å; A388-F418 HydrophobicContact CB-CE2 4.1Å; A388-F418 HydrophobicContact CB-CZ 3.33Å
389	A	94.3	Very high	90.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-62.7	-36.5	177.3	0	0	0	0	0	112.8	A385 T386 V392 V393 F418 I467 V474	A385-A389 VanDerWaalsContact O-CB 3.22Å; A385-A389 WeakPolarHBondContact O-CB 3.29Å; A385-A389 PolarHBondContact O-N 3.48Å; T386-A389 PolarHBondContact O-N 3.39Å; A389-V392 PolarHBondContact O-N 3.24Å; A389-V393 WeakPolarHBondContact O-CG2 3.25Å; A389-V393 PolarHBondContact O-N 3.35Å; A389-V393 VanDerWaalsContact O-N 3.09Å; A389-F418 HydrophobicContact CB-CE1 4.47Å; A389-I467 HydrophobicContact CB-CB 3.87Å; A389-I467 HydrophobicContact CB-CD1 3.83Å; A389-I467 HydrophobicContact CB-CG1 3.74Å; A389-I467 HydrophobicContact CB-CG2 4.08Å; A389-V474 HydrophobicContact CB-CB 4.01Å; A389-V474 HydrophobicContact CB-CG1 4.05Å; A389-V474 HydrophobicContact CB-CG2 4.15Å
390	V	92.3	Very high	90.3	Very high	30 Å²	30	36.6 Å²	36.6	18%	0.182	21%	0.206	C	C	.	.	H	α-helix	trans	-62.3	-46.7	172.1	167.8	0	0	0	0	110.6	T386 R387 A388 V392 V393 N394 Y469 P998	T386-V390 WeakPolarHBondContact O-CG2 3.5Å; T386-V390 PolarHBondContact O-N 3.3Å; R387-V390 PolarHBondContact O-N 3.31Å; A388-V390 VanDerWaalsContact C-N 3.32Å; A388-V390 PolarHBondContact O-N 3.47Å; V390-V392 PolarHBondContact O-N 3.1Å; V390-V393 PolarHBondContact O-N 3.31Å; V390-N394 WeakPolarHBondContact O-CB 3.05Å; V390-N394 VanDerWaalsContact O-CG 3.22Å; V390-N394 PolarHBondContact O-N 2.7Å; V390-N394 PolarHBondContact O-ND2 3.01Å; V390-Y469 HydrophobicContact CB-CD1 4.41Å; V390-Y469 HydrophobicContact CB-CE1 4.14Å; V390-Y469 HydrophobicContact CG1-CE1 3.81Å; V390-Y469 HydrophobicContact CG2-CD1 4.03Å; V390-Y469 HydrophobicContact CG2-CD2 4.36Å; V390-Y469 HydrophobicContact CG2-CE1 4.03Å; V390-Y469 HydrophobicContact CG2-CE2 4.35Å; V390-Y469 HydrophobicContact CG2-CG 4.2Å; V390-P998 HydrophobicContact CG2-CB 4.23Å; V390-P998 HydrophobicContact CG2-CG 4.09Å
391	S	90.2	Very high	90.4	Very high	32 Å²	32	37.1 Å²	37.1	22%	0.224	21%	0.209	C	C	.	.	H	α-helix	trans	-63.5	-37.8	176.6	-62	0	0	0	0	113.5	R387 A388 N394 G395 D396	R387-S391 PolarHBondContact O-N 2.96Å; R387-S391 PolarHBondContact O-OG 3.49Å; A388-S391 WeakPolarHBondContact O-CB 3.41Å; A388-S391 PolarHBondContact O-N 3.22Å; A388-S391 VanDerWaalsContact O-N 3.15Å; S391-N394 PolarHBondContact O-N 3.19Å; S391-G395 PolarHBondContact O-N 3.03Å; S391-D396 PolarHBondContact O-N 2.75Å
392	V	92.4	Very high	90.4	Very high	6 Å²	6	41.3 Å²	41.3	4%	0.036	24%	0.236	C	C	.	.	H	α-helix	trans	-59.6	-49.1	172.3	164.8	0	0	0	0	111	A388 A389 V390 N394 G395 I397 F411 F418 L420	A388-V392 WeakPolarHBondContact O-CG2 3.2Å; A388-V392 PolarHBondContact O-N 3.13Å; A389-V392 PolarHBondContact O-N 3.24Å; V390-V392 PolarHBondContact O-N 3.1Å; V392-N394 VanDerWaalsContact C-N 3.34Å; V392-N394 PolarHBondContact O-N 3.09Å; V392-G395 PolarHBondContact O-N 3.45Å; V392-I397 HydrophobicContact CG2-CB 4.23Å; V392-I397 HydrophobicContact CG2-CD1 3.91Å; V392-I397 HydrophobicContact CG2-CG2 4.4Å; V392-F411 HydrophobicContact CG1-CD1 4.18Å; V392-F411 HydrophobicContact CG1-CD2 3.56Å; V392-F411 HydrophobicContact CG1-CE1 4.13Å; V392-F411 HydrophobicContact CG1-CE2 3.54Å; V392-F411 HydrophobicContact CG1-CG 3.93Å; V392-F411 HydrophobicContact CG1-CZ 3.84Å; V392-F411 HydrophobicContact CG2-CB 4Å; V392-F411 HydrophobicContact CG2-CD1 4.18Å; V392-F411 HydrophobicContact CG2-CD2 4.29Å; V392-F411 HydrophobicContact CG2-CG 3.9Å; V392-F418 HydrophobicContact CG2-CB 4.37Å; V392-F418 HydrophobicContact CG2-CG 4.27Å; V392-L420 HydrophobicContact CG1-CD2 4.39Å
393	V	92.4	Very high	90.3	Very high	4 Å²	4	44.4 Å²	44.4	2%	0.024	27%	0.272	C	S	.	.	H	α-helix	trans	-70	-31.7	-178.4	174	0	0	0	0	112.1	A389 V390 G395 R406 Y469 R470 F472 V474	A389-V393 WeakPolarHBondContact O-CG2 3.25Å; A389-V393 PolarHBondContact O-N 3.35Å; A389-V393 VanDerWaalsContact O-N 3.09Å; V390-V393 PolarHBondContact O-N 3.31Å; V393-G395 VanDerWaalsContact C-N 3.33Å; V393-R406 PolarHBondContact O-NH2 3.42Å; V393-Y469 HydrophobicContact CB-CD1 3.82Å; V393-Y469 HydrophobicContact CB-CE1 4.23Å; V393-Y469 HydrophobicContact CG1-CD1 3.81Å; V393-Y469 HydrophobicContact CG1-CE1 4.14Å; V393-Y469 HydrophobicContact CG2-CD1 4.27Å; V393-R470 HydrophobicContact CG1-CB 3.93Å; V393-F472 HydrophobicContact CG1-CB 4.32Å; V393-F472 HydrophobicContact CG1-CD2 3.73Å; V393-F472 HydrophobicContact CG1-CE2 4.46Å; V393-F472 HydrophobicContact CG1-CG 4.2Å; V393-F472 HydrophobicContact CG2-CB 3.96Å; V393-F472 HydrophobicContact CG2-CG 4.43Å; V393-V474 HydrophobicContact CG2-CG2 3.53Å
394	N	89.8	Confident	90.4	Very high	66 Å²	66	46.3 Å²	46.3	35%	0.353	28%	0.276	S	S	.	.	H	α-helix	trans	-72.6	-24.4	173.7	-70.7	-16.5	0	0	0	113.4	V390 S391 V392 D396 R470	V390-N394 WeakPolarHBondContact O-CB 3.05Å; V390-N394 VanDerWaalsContact O-CG 3.22Å; V390-N394 PolarHBondContact O-N 2.7Å; V390-N394 PolarHBondContact O-ND2 3.01Å; S391-N394 PolarHBondContact O-N 3.19Å; V392-N394 VanDerWaalsContact C-N 3.34Å; V392-N394 PolarHBondContact O-N 3.09Å; N394-D396 VanDerWaalsContact CB-OD2 3.24Å; N394-D396 WeakPolarHBondContact CB-OD2 3.26Å; N394-R470 PolarHBondContact OD1-NH1 3.13Å
395	G	87.8	Confident	90.4	Very high	55 Å²	55	50 Å²	50	57%	0.567	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.3	15	-177.8	0	0	0	0	0	114.4	S391 V392 V393 I397	S391-G395 PolarHBondContact O-N 3.03Å; V392-G395 PolarHBondContact O-N 3.45Å; V393-G395 VanDerWaalsContact C-N 3.33Å; G395-I397 VanDerWaalsContact C-N 3.3Å
396	D	85.5	Confident	90.1	Very high	86 Å²	86	55.1 Å²	55.1	46%	0.46	32%	0.318	S	S	.	.			trans	-74.7	-20.3	176.2	-65.6	-72.2	0	0	0	112.6	S391 N394	S391-D396 PolarHBondContact O-N 2.75Å; N394-D396 VanDerWaalsContact CB-OD2 3.24Å; N394-D396 WeakPolarHBondContact CB-OD2 3.26Å
397	I	87	Confident	89.9	Confident	8 Å²	8	59 Å²	59	4%	0.041	33%	0.334	C	S	.	.	S	Bend	trans	-107.1	130.2	177.2	-63.2	167.2	0	0	0	109.3	A388 V392 G395 F411 W413	A388-I397 HydrophobicContact CB-CD1 4.48Å; V392-I397 HydrophobicContact CG2-CB 4.23Å; V392-I397 HydrophobicContact CG2-CD1 3.91Å; V392-I397 HydrophobicContact CG2-CG2 4.4Å; G395-I397 VanDerWaalsContact C-N 3.3Å; I397-F411 HydrophobicContact CG2-CB 4.27Å; I397-F411 HydrophobicContact CG2-CD1 4.13Å; I397-F411 WeakPolarHBondContact O-CE1 3.5Å; I397-W413 HydrophobicContact CB-CE3 4.43Å; I397-W413 HydrophobicContact CD1-CB 3.95Å; I397-W413 HydrophobicContact CD1-CD2 3.61Å; I397-W413 HydrophobicContact CD1-CE3 4.12Å; I397-W413 HydrophobicContact CD1-CG 3.55Å; I397-W413 HydrophobicContact CG1-CD2 3.81Å; I397-W413 HydrophobicContact CG1-CE3 3.81Å; I397-W413 HydrophobicContact CG1-CG 4.25Å; I397-W413 HydrophobicContact CG1-CH2 4.38Å; I397-W413 HydrophobicContact CG1-CZ2 4.4Å; I397-W413 HydrophobicContact CG1-CZ3 4.12Å; I397-W413 HydrophobicContact CG2-CB 4.35Å; I397-W413 HydrophobicContact CG2-CD2 4.35Å; I397-W413 HydrophobicContact CG2-CE3 3.86Å; I397-W413 HydrophobicContact CG2-CZ3 4.5Å
398	M	88.1	Confident	89.9	Confident	161 Å²	161	55.2 Å²	55.2	79%	0.793	32%	0.322	S	S	*	.			trans	-74.2	137.5	176.8	-70.2	-177.9	62.2	0	0	111.8
399	A	92.3	Very high	90	Very high	12 Å²	12	57.1 Å²	57.1	10%	0.099	33%	0.33	C	S	.	.			trans	-68.3	148.2	169.5	0	0	0	0	0	111.3	N401 P402 Q409 M410 F411	A399-N401 VanDerWaalsContact C-N 3.3Å; A399-P402 WeakPolarHBondContact O-CD 3.13Å; A399-Q409 HydrophobicContact CB-CB 3.78Å; A399-Q409 HydrophobicContact CB-CG 3.77Å; A399-M410 CarbonylContact C-O 3.51Å; A399-M410 WeakPolarHBondContact CA-O 3.35Å; A399-F411 HydrophobicContact CB-CD1 4.03Å; A399-F411 HydrophobicContact CB-CE1 3.71Å; A399-F411 HydrophobicContact CB-CZ 4.07Å
400	I	90.3	Very high	89.9	Confident	103 Å²	103	60.3 Å²	60.3	53%	0.528	35%	0.345	S	S	.	.	S	Bend	trans	-69.7	-33.7	174.3	-56.1	160.5	0	0	0	110.4	P402 M410 I412	I400-P402 WeakPolarHBondContact O-CD 3.47Å; I400-M410 PolarHBondContact N-O 2.83Å; I400-I412 HydrophobicContact CD1-CB 3.99Å; I400-I412 HydrophobicContact CD1-CD1 3.71Å; I400-I412 HydrophobicContact CD1-CG1 3.69Å
401	N	91	Very high	90	Very high	39 Å²	39	59.3 Å²	59.3	21%	0.209	34%	0.339	C	S	.	.	S	Bend	trans	-112.6	60.1	179.8	60.1	-18.9	0	0	0	111.3	A399 G403 E404 Q408 Q409 M410	A399-N401 VanDerWaalsContact C-N 3.3Å; N401-G403 PolarHBondContact O-N 3.28Å; N401-E404 HydrophobicContact CB-CB 4.46Å; N401-E404 HydrophobicContact CB-CG 4.01Å; N401-E404 WeakPolarHBondContact O-CB 3.5Å; N401-E404 PolarHBondContact O-N 2.85Å; N401-Q408 PolarHBondContact ND2-O 3.23Å; N401-Q409 WeakPolarHBondContact OD1-CA 3.42Å; N401-M410 PolarHBondContact OD1-N 3.3Å; N401-M410 PolarHBondContact OD1-O 3.5Å
402	P	90.7	Very high	90.1	Very high	88 Å²	88	60.3 Å²	60.3	57%	0.571	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-8	-169.3	31.5	-37.7	0	0	0	114.4	A399 I400	A399-P402 WeakPolarHBondContact O-CD 3.13Å; I400-P402 WeakPolarHBondContact O-CD 3.47Å
403	G	90.3	Very high	89.8	Confident	82 Å²	82	62.8 Å²	62.8	85%	0.845	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-13.8	171.3	0	0	0	0	0	114.7	N401	N401-G403 PolarHBondContact O-N 3.28Å
404	E	90.3	Very high	89.4	Confident	65 Å²	65	63.3 Å²	63.3	30%	0.304	35%	0.352	S	S	.	.	S	Bend	trans	-80.3	159.3	174	-65.6	-84.8	-141	0	0	110.4	N401 Q408 Q409 K425	N401-E404 HydrophobicContact CB-CB 4.46Å; N401-E404 HydrophobicContact CB-CG 4.01Å; N401-E404 WeakPolarHBondContact O-CB 3.5Å; N401-E404 PolarHBondContact O-N 2.85Å; E404-Q408 HydrophobicContact CB-CB 4.11Å; E404-Q409 PolarHBondContact O-NE2 2.79Å; E404-K425 VanDerWaalsContact OE1-CE 3.23Å; E404-K425 WeakPolarHBondContact OE1-CE 3.42Å; E404-K425 IonicContact OE1-NZ 3.53Å; E404-K425 PolarHBondContact OE1-NZ 3.11Å
405	T	89.2	Confident	89.3	Confident	83 Å²	83	62.5 Å²	62.5	51%	0.509	35%	0.348	S	S	.	.			trans	-65.8	155.3	179.8	71.5	0	0	0	0	111.7	K407 Q408 Q409	T405-K407 PolarHBondContact O-N 3.5Å; T405-Q408 CarbonylContact O-C 3.55Å; T405-Q408 WeakPolarHBondContact O-CA 3.42Å; T405-Q408 PolarHBondContact O-N 2.97Å; T405-Q408 PolarHBondContact OG1-OE1 3.39Å; T405-Q409 PolarHBondContact O-N 3.12Å; T405-Q409 VanDerWaalsContact O-N 3.16Å
406	R	87	Confident	89.5	Confident	108 Å²	108	60 Å²	60	41%	0.408	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-51.8	-35.5	-176.1	-168	-179.8	-177.6	-162	1.1	113.9	V393 Q408 Q409 L420	V393-R406 PolarHBondContact O-NH2 3.42Å; R406-Q408 VanDerWaalsContact C-N 3.26Å; R406-Q408 PolarHBondContact O-N 3.38Å; R406-Q409 PolarHBondContact O-N 3.28Å; R406-L420 VanDerWaalsContact O-CD1 3.26Å; R406-L420 WeakPolarHBondContact O-CD1 3.17Å
407	K	87.8	Confident	89.9	Confident	85 Å²	85	58.5 Å²	58.5	37%	0.37	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-67.7	-22.9	176.6	-69.6	-166.7	168.1	-173.9	0	114.3	T405 F422 E434	T405-K407 PolarHBondContact O-N 3.5Å; K407-F422 HydrophobicContact CB-CB 4.05Å; K407-F422 HydrophobicContact CB-CD2 3.69Å; K407-F422 HydrophobicContact CB-CE2 4.26Å; K407-F422 HydrophobicContact CB-CG 3.91Å; K407-F422 HydrophobicContact CD-CB 4.28Å; K407-F422 HydrophobicContact CD-CD1 3.74Å; K407-F422 HydrophobicContact CD-CD2 4.18Å; K407-F422 HydrophobicContact CD-CE1 4.02Å; K407-F422 HydrophobicContact CD-CE2 4.43Å; K407-F422 HydrophobicContact CD-CG 3.82Å; K407-F422 HydrophobicContact CD-CZ 4.36Å; K407-F422 HydrophobicContact CG-CB 4.42Å; K407-F422 HydrophobicContact CG-CD1 4.13Å; K407-F422 HydrophobicContact CG-CD2 3.65Å; K407-F422 HydrophobicContact CG-CE1 4.26Å; K407-F422 HydrophobicContact CG-CE2 3.79Å; K407-F422 HydrophobicContact CG-CG 3.82Å; K407-F422 HydrophobicContact CG-CZ 4.1Å; K407-E434 IonicContact NZ-OE1 2.7Å; K407-E434 PolarHBondContact NZ-OE1 2.84Å
408	Q	89.1	Confident	90.4	Very high	44 Å²	44	58.1 Å²	58.1	21%	0.206	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-105.9	-0	-175.4	-63	162.3	-30.6	0	0	112.3	N401 E404 T405 R406 V424	N401-Q408 PolarHBondContact ND2-O 3.23Å; E404-Q408 HydrophobicContact CB-CB 4.11Å; T405-Q408 CarbonylContact O-C 3.55Å; T405-Q408 WeakPolarHBondContact O-CA 3.42Å; T405-Q408 PolarHBondContact O-N 2.97Å; T405-Q408 PolarHBondContact OG1-OE1 3.39Å; R406-Q408 VanDerWaalsContact C-N 3.26Å; R406-Q408 PolarHBondContact O-N 3.38Å; Q408-V424 HydrophobicContact CG-CG1 4.31Å; Q408-V424 HydrophobicContact CG-CG2 4.46Å
409	Q	92.5	Very high	90.7	Very high	42 Å²	42	51.8 Å²	51.8	20%	0.196	28%	0.281	C	S	.	.			trans	-73.4	138	179.2	-78.7	169.7	3.7	0	0	111.4	A399 N401 E404 T405 R406 F411	A399-Q409 HydrophobicContact CB-CB 3.78Å; A399-Q409 HydrophobicContact CB-CG 3.77Å; N401-Q409 WeakPolarHBondContact OD1-CA 3.42Å; E404-Q409 PolarHBondContact O-NE2 2.79Å; T405-Q409 PolarHBondContact O-N 3.12Å; T405-Q409 VanDerWaalsContact O-N 3.16Å; R406-Q409 PolarHBondContact O-N 3.28Å; Q409-F411 HydrophobicContact CB-CE2 3.87Å; Q409-F411 HydrophobicContact CB-CZ 3.75Å; Q409-F411 WeakPolarHBondContact O-CE2 3.36Å
410	M	93.1	Very high	90.8	Very high	67 Å²	67	51.9 Å²	51.9	33%	0.33	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	144.3	179.4	-67.2	172.6	173.2	0	0	108.9	A399 I400 N401 F417	A399-M410 CarbonylContact C-O 3.51Å; A399-M410 WeakPolarHBondContact CA-O 3.35Å; I400-M410 PolarHBondContact N-O 2.83Å; N401-M410 PolarHBondContact OD1-N 3.3Å; N401-M410 PolarHBondContact OD1-O 3.5Å; M410-F417 HydrophobicContact CB-CE2 3.92Å; M410-F417 HydrophobicContact CB-CZ 4.18Å; M410-F417 HydrophobicContact CE-CZ 4.39Å; M410-F417 HydrophobicContact CG-CE2 4.2Å; M410-F417 HydrophobicContact CG-CZ 3.96Å; M410-F417 HydrophobicContact SD-CE2 4.12Å; M410-F417 HydrophobicContact SD-CZ 3.84Å
411	F	94.2	Very high	90.9	Very high	9 Å²	9	47.4 Å²	47.4	4%	0.039	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	145.7	-171.9	-46.5	-106.3	0	0	0	109.4	V392 I397 A399 Q409 F418	V392-F411 HydrophobicContact CG1-CD1 4.18Å; V392-F411 HydrophobicContact CG1-CD2 3.56Å; V392-F411 HydrophobicContact CG1-CE1 4.13Å; V392-F411 HydrophobicContact CG1-CE2 3.54Å; V392-F411 HydrophobicContact CG1-CG 3.93Å; V392-F411 HydrophobicContact CG1-CZ 3.84Å; V392-F411 HydrophobicContact CG2-CB 4Å; V392-F411 HydrophobicContact CG2-CD1 4.18Å; V392-F411 HydrophobicContact CG2-CD2 4.29Å; V392-F411 HydrophobicContact CG2-CG 3.9Å; I397-F411 HydrophobicContact CG2-CB 4.27Å; I397-F411 HydrophobicContact CG2-CD1 4.13Å; I397-F411 WeakPolarHBondContact O-CE1 3.5Å; A399-F411 HydrophobicContact CB-CD1 4.03Å; A399-F411 HydrophobicContact CB-CE1 3.71Å; A399-F411 HydrophobicContact CB-CZ 4.07Å; Q409-F411 HydrophobicContact CB-CE2 3.87Å; Q409-F411 HydrophobicContact CB-CZ 3.75Å; Q409-F411 WeakPolarHBondContact O-CE2 3.36Å; F411-F418 HydrophobicContact CB-CB 4.21Å; F411-F418 PolarHBondContact N-O 3Å; F411-F418 PolarHBondContact O-N 3.41Å
412	I	91.5	Very high	90.9	Very high	53 Å²	53	46.5 Å²	46.5	27%	0.272	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	132.8	164.6	-80.1	165.2	0	0	0	107.3	I400 M416 F417 I479 L484	I400-I412 HydrophobicContact CD1-CB 3.99Å; I400-I412 HydrophobicContact CD1-CD1 3.71Å; I400-I412 HydrophobicContact CD1-CG1 3.69Å; I412-M416 VanDerWaalsContact CA-O 3.28Å; I412-M416 WeakPolarHBondContact CA-O 3.49Å; I412-F417 HydrophobicContact CG1-CB 4.37Å; I412-F417 HydrophobicContact CG1-CD2 4.1Å; I412-I479 HydrophobicContact CD1-CD1 3.89Å; I412-I479 HydrophobicContact CG1-CD1 3.9Å; I412-I479 HydrophobicContact CG2-CD1 4.05Å; I412-L484 HydrophobicContact CD1-CD1 3.94Å; I412-L484 HydrophobicContact CD1-CD2 4.33Å
413	W	86.6	Confident	90.9	Very high	59 Å²	59	43.3 Å²	43.3	22%	0.223	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	129.6	178.7	-172.5	-100.9	0	0	0	110.3	R335 A337 A388 I397 N415 M416 F418	R335-W413 WeakPolarHBondContact O-CH2 3.15Å; A337-W413 HydrophobicContact CB-CD2 4.09Å; A337-W413 HydrophobicContact CB-CE3 4.22Å; A337-W413 HydrophobicContact CB-CH2 3.77Å; A337-W413 HydrophobicContact CB-CZ2 3.6Å; A337-W413 HydrophobicContact CB-CZ3 4.07Å; A388-W413 HydrophobicContact CB-CG 4.48Å; I397-W413 HydrophobicContact CB-CE3 4.43Å; I397-W413 HydrophobicContact CD1-CB 3.95Å; I397-W413 HydrophobicContact CD1-CD2 3.61Å; I397-W413 HydrophobicContact CD1-CE3 4.12Å; I397-W413 HydrophobicContact CD1-CG 3.55Å; I397-W413 HydrophobicContact CG1-CD2 3.81Å; I397-W413 HydrophobicContact CG1-CE3 3.81Å; I397-W413 HydrophobicContact CG1-CG 4.25Å; I397-W413 HydrophobicContact CG1-CH2 4.38Å; I397-W413 HydrophobicContact CG1-CZ2 4.4Å; I397-W413 HydrophobicContact CG1-CZ3 4.12Å; I397-W413 HydrophobicContact CG2-CB 4.35Å; I397-W413 HydrophobicContact CG2-CD2 4.35Å; I397-W413 HydrophobicContact CG2-CE3 3.86Å; I397-W413 HydrophobicContact CG2-CZ3 4.5Å; W413-N415 VanDerWaalsContact C-N 3.3Å; W413-N415 PolarHBondContact O-N 3.39Å; W413-M416 PolarHBondContact N-O 3.47Å; W413-M416 PolarHBondContact O-N 2.87Å; W413-F418 HydrophobicContact CB-CD2 4.47Å; W413-F418 HydrophobicContact CB-CE2 3.87Å
414	N	83.4	Confident	90.8	Very high	14 Å²	14	41.4 Å²	41.4	8%	0.075	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	42.2	55.4	-174.9	-167.7	28.7	0	0	0	112.2	R347 W349 M416	R347-N414 PolarHBondContact N-OD1 3.48Å; W349-N414 PolarHBondContact NE1-ND2 2.93Å; W349-N414 PolarHBondContact NE1-O 2.82Å; N414-M416 HydrophobicContact CB-CE 4.45Å; N414-M416 PolarHBondContact O-N 2.84Å
415	N	87.7	Confident	90.5	Very high	50 Å²	50	45.1 Å²	45.1	27%	0.267	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.8	19.7	-179.8	-58.1	-24.5	0	0	0	117.1	T346 R347 W413 I479	T346-N415 WeakPolarHBondContact CB-ND2 3.48Å; T346-N415 PolarHBondContact O-ND2 3.01Å; T346-N415 PolarHBondContact OG1-ND2 3.18Å; T346-N415 VanDerWaalsContact OG1-ND2 3.08Å; R347-N415 WeakPolarHBondContact O-CB 3.11Å; R347-N415 PolarHBondContact O-ND2 3.1Å; W413-N415 VanDerWaalsContact C-N 3.3Å; W413-N415 PolarHBondContact O-N 3.39Å; N415-I479 WeakPolarHBondContact O-CD1 3.41Å; N415-I479 WeakPolarHBondContact O-CG1 3.48Å
416	M	92.5	Very high	90.3	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	143.2	167.9	-60.7	176.7	-79.6	0	0	110.4	W349 F381 A384 A385 A388 I412 W413 N414 F418 Q477	W349-M416 HydrophobicContact CG-CG 4.13Å; F381-M416 HydrophobicContact CD2-CG 4.35Å; F381-M416 HydrophobicContact CD2-SD 3.77Å; F381-M416 HydrophobicContact CE2-CG 3.86Å; F381-M416 HydrophobicContact CE2-SD 3.53Å; F381-M416 VanDerWaalsContact CE2-SD 3.53Å; F381-M416 HydrophobicContact CZ-SD 4.45Å; A384-M416 HydrophobicContact CB-CE 3.93Å; A385-M416 HydrophobicContact CB-SD 3.87Å; A388-M416 HydrophobicContact CB-CE 4.48Å; I412-M416 VanDerWaalsContact CA-O 3.28Å; I412-M416 WeakPolarHBondContact CA-O 3.49Å; W413-M416 PolarHBondContact N-O 3.47Å; W413-M416 PolarHBondContact O-N 2.87Å; N414-M416 HydrophobicContact CB-CE 4.45Å; N414-M416 PolarHBondContact O-N 2.84Å; M416-F418 HydrophobicContact CB-CE2 3.61Å; M416-F418 HydrophobicContact CB-CZ 3.72Å; M416-F418 HydrophobicContact CE-CZ 4Å; M416-F418 WeakPolarHBondContact O-CE2 3.18Å; M416-F418 HydrophobicContact SD-CZ 4.26Å; M416-Q477 WeakPolarHBondContact CA-O 3.47Å
417	F	94.4	Very high	90.2	Very high	55 Å²	55	44.1 Å²	44.1	24%	0.241	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	137.9	172	174.4	-99.5	0	0	0	110.5	M410 I412 A476 Q477 I479	M410-F417 HydrophobicContact CB-CE2 3.92Å; M410-F417 HydrophobicContact CB-CZ 4.18Å; M410-F417 HydrophobicContact CE-CZ 4.39Å; M410-F417 HydrophobicContact CG-CE2 4.2Å; M410-F417 HydrophobicContact CG-CZ 3.96Å; M410-F417 HydrophobicContact SD-CE2 4.12Å; M410-F417 HydrophobicContact SD-CZ 3.84Å; I412-F417 HydrophobicContact CG1-CB 4.37Å; I412-F417 HydrophobicContact CG1-CD2 4.1Å; F417-A476 WeakPolarHBondContact O-CA 3.46Å; F417-Q477 PolarHBondContact N-O 3.27Å; F417-Q477 PolarHBondContact O-N 3.16Å; F417-I479 HydrophobicContact CB-CG1 4.05Å
418	F	96	Very high	90.2	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	129.6	179.3	-56.1	-98.5	0	0	0	111	A388 A389 V392 F411 W413 M416 V474 T475 A476	A388-F418 HydrophobicContact CB-CE1 3.76Å; A388-F418 HydrophobicContact CB-CE2 4.1Å; A388-F418 HydrophobicContact CB-CZ 3.33Å; A389-F418 HydrophobicContact CB-CE1 4.47Å; V392-F418 HydrophobicContact CG2-CB 4.37Å; V392-F418 HydrophobicContact CG2-CG 4.27Å; F411-F418 HydrophobicContact CB-CB 4.21Å; F411-F418 PolarHBondContact N-O 3Å; F411-F418 PolarHBondContact O-N 3.41Å; W413-F418 HydrophobicContact CB-CD2 4.47Å; W413-F418 HydrophobicContact CB-CE2 3.87Å; M416-F418 HydrophobicContact CB-CE2 3.61Å; M416-F418 HydrophobicContact CB-CZ 3.72Å; M416-F418 HydrophobicContact CE-CZ 4Å; M416-F418 WeakPolarHBondContact O-CE2 3.18Å; M416-F418 HydrophobicContact SD-CZ 4.26Å; F418-V474 HydrophobicContact CB-CG1 4.03Å; F418-V474 HydrophobicContact CD1-CG1 3.86Å; F418-V474 HydrophobicContact CG-CG1 4.44Å; F418-T475 WeakPolarHBondContact CA-O 3.43Å; F418-A476 HydrophobicContact CD1-CB 3.64Å; F418-A476 HydrophobicContact CE1-CB 3.48Å; F418-A476 VanDerWaalsContact CE1-CB 3.48Å; F418-A476 HydrophobicContact CZ-CB 4.33Å
419	S	94.7	Very high	90.1	Very high	28 Å²	28	46.2 Å²	46.2	20%	0.196	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	151.5	172.1	61	0	0	0	0	110.9	V474 T475	S419-V474 CarbonylContact O-C 3.44Å; S419-V474 WeakPolarHBondContact O-CA 3.26Å; S419-T475 PolarHBondContact N-O 3.5Å; S419-T475 PolarHBondContact O-N 2.81Å
420	L	94.4	Very high	89.7	Confident	14 Å²	14	51.3 Å²	51.3	7%	0.073	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	140.3	172.7	-57.2	-174.1	0	0	0	110.2	V392 R406 F422 F472 R473 V474	V392-L420 HydrophobicContact CG1-CD2 4.39Å; R406-L420 VanDerWaalsContact O-CD1 3.26Å; R406-L420 WeakPolarHBondContact O-CD1 3.17Å; L420-F422 HydrophobicContact CB-CD2 3.65Å; L420-F422 HydrophobicContact CB-CE2 3.98Å; L420-F422 HydrophobicContact CD1-CD2 4.36Å; L420-F422 HydrophobicContact CD1-CE2 4.09Å; L420-F422 PolarHBondContact O-N 2.94Å; L420-F472 HydrophobicContact CD1-CD1 4.29Å; L420-R473 WeakPolarHBondContact CA-O 3.44Å; L420-V474 HydrophobicContact CD2-CG1 4.48Å; L420-V474 HydrophobicContact CD2-CG2 3.9Å
421	G	91.9	Very high	89.3	Confident	9 Å²	9	49.1 Å²	49.1	9%	0.093	24%	0.235	C	C	.	.	S	Bend	trans	-75.5	54.2	-176.3	0	0	0	0	0	115.1	R473	G421-R473 PolarHBondContact N-O 3.23Å
422	F	92.4	Very high	89	Confident	20 Å²	20	50.1 Å²	50.1	9%	0.088	25%	0.247	C	C	.	.	S	Bend	trans	-117.7	163.8	177	-63.4	-69.5	0	0	0	111.5	K407 L420 V424 E434 A437 F472	K407-F422 HydrophobicContact CB-CB 4.05Å; K407-F422 HydrophobicContact CB-CD2 3.69Å; K407-F422 HydrophobicContact CB-CE2 4.26Å; K407-F422 HydrophobicContact CB-CG 3.91Å; K407-F422 HydrophobicContact CD-CB 4.28Å; K407-F422 HydrophobicContact CD-CD1 3.74Å; K407-F422 HydrophobicContact CD-CD2 4.18Å; K407-F422 HydrophobicContact CD-CE1 4.02Å; K407-F422 HydrophobicContact CD-CE2 4.43Å; K407-F422 HydrophobicContact CD-CG 3.82Å; K407-F422 HydrophobicContact CD-CZ 4.36Å; K407-F422 HydrophobicContact CG-CB 4.42Å; K407-F422 HydrophobicContact CG-CD1 4.13Å; K407-F422 HydrophobicContact CG-CD2 3.65Å; K407-F422 HydrophobicContact CG-CE1 4.26Å; K407-F422 HydrophobicContact CG-CE2 3.79Å; K407-F422 HydrophobicContact CG-CG 3.82Å; K407-F422 HydrophobicContact CG-CZ 4.1Å; L420-F422 HydrophobicContact CB-CD2 3.65Å; L420-F422 HydrophobicContact CB-CE2 3.98Å; L420-F422 HydrophobicContact CD1-CD2 4.36Å; L420-F422 HydrophobicContact CD1-CE2 4.09Å; L420-F422 PolarHBondContact O-N 2.94Å; F422-V424 PolarHBondContact O-N 2.31Å; F422-V424 VanDerWaalsContact O-N 3.11Å; F422-E434 VanDerWaalsContact CA-OE2 3.24Å; F422-E434 WeakPolarHBondContact CA-OE2 3.41Å; F422-E434 WeakPolarHBondContact CB-OE2 3.5Å; F422-E434 WeakPolarHBondContact CD1-OE2 3.22Å; F422-A437 VanDerWaalsContact C-CB 3.43Å; F422-A437 WeakPolarHBondContact O-CB 3.5Å; F422-F472 AromaticContact CE2-CD1 3.76Å; F422-F472 HydrophobicContact CE2-CD1 3.76Å; F422-F472 AromaticContact CE2-CE1 3.95Å; F422-F472 HydrophobicContact CE2-CE1 3.95Å; F422-F472 AromaticContact CZ-CD1 3.84Å; F422-F472 HydrophobicContact CZ-CD1 3.84Å; F422-F472 AromaticContact CZ-CE1 3.92Å; F422-F472 HydrophobicContact CZ-CE1 3.92Å
423	D	90.1	Very high	89	Confident	22 Å²	22	48.1 Å²	48.1	12%	0.118	24%	0.24	C	C	.	.			trans	-76.8	94.7	176	-169.2	8.6	0	0	0	111.9	K425 H427 Y428 K429 G433 E434 A437	D423-K425 PolarHBondContact O-N 3.24Å; D423-H427 PolarHBondContact OD1-N 3.17Å; D423-Y428 PolarHBondContact OD1-N 2.94Å; D423-Y428 PolarHBondContact OD2-N 2.84Å; D423-K429 PolarHBondContact OD2-N 2.7Å; D423-K429 VanDerWaalsContact OD2-N 3.09Å; D423-G433 WeakPolarHBondContact OD2-CA 3.42Å; D423-E434 PolarHBondContact N-OE2 2.77Å; D423-A437 HydrophobicContact CB-CB 4.26Å
424	V	87.4	Confident	89.2	Confident	42 Å²	42	48.8 Å²	48.8	26%	0.255	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-76.1	119.3	178	178.5	0	0	0	0	110	Q408 F422 D426 H427	Q408-V424 HydrophobicContact CG-CG1 4.31Å; Q408-V424 HydrophobicContact CG-CG2 4.46Å; F422-V424 PolarHBondContact O-N 2.31Å; F422-V424 VanDerWaalsContact O-N 3.11Å; V424-D426 VanDerWaalsContact C-N 3.34Å; V424-D426 PolarHBondContact O-N 2.99Å; V424-H427 WeakPolarHBondContact O-CB 3.36Å; V424-H427 PolarHBondContact O-N 3.1Å
425	K	85.2	Confident	89.6	Confident	143 Å²	143	53.7 Å²	53.7	62%	0.622	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	59.8	37.8	174.1	-61.8	173.6	-178.5	175.6	0	113.7	E404 D423 H427	E404-K425 VanDerWaalsContact OE1-CE 3.23Å; E404-K425 WeakPolarHBondContact OE1-CE 3.42Å; E404-K425 IonicContact OE1-NZ 3.53Å; E404-K425 PolarHBondContact OE1-NZ 3.11Å; D423-K425 PolarHBondContact O-N 3.24Å; K425-H427 PolarHBondContact O-N 3.09Å
426	D	85.8	Confident	89.8	Confident	89 Å²	89	51.3 Å²	51.3	48%	0.476	25%	0.252	S	S	.	.	G	3₁₀ helix	trans	60	19.3	178	-80.3	1.2	0	0	0	114.1	V424 Y428 K429	V424-D426 VanDerWaalsContact C-N 3.34Å; V424-D426 PolarHBondContact O-N 2.99Å; D426-Y428 VanDerWaalsContact C-N 3.3Å; D426-Y428 PolarHBondContact O-N 3.24Å; D426-K429 HydrophobicContact CB-CB 4.05Å; D426-K429 HydrophobicContact CB-CD 3.99Å; D426-K429 WeakPolarHBondContact O-CB 3.38Å; D426-K429 PolarHBondContact O-N 3.34Å; D426-K429 VanDerWaalsContact O-N 3.11Å; D426-K429 WeakPolarHBondContact OD2-CD 3.2Å; D426-K429 WeakPolarHBondContact OD2-CE 3.44Å; D426-K429 IonicContact OD2-NZ 3.65Å; D426-K429 PolarHBondContact OD2-NZ 3.09Å
427	H	84.4	Confident	89.8	Confident	81 Å²	81	51.5 Å²	51.5	38%	0.375	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-38.8	-175.8	-174.1	87.5	0	0	0	112.6	D423 V424 K425 F499	D423-H427 PolarHBondContact OD1-N 3.17Å; V424-H427 WeakPolarHBondContact O-CB 3.36Å; V424-H427 PolarHBondContact O-N 3.1Å; K425-H427 PolarHBondContact O-N 3.09Å; H427-F499 AromaticContact CD2-CZ 3.87Å; H427-F499 AromaticContact CE1-CE2 3.93Å; H427-F499 AromaticContact CE1-CZ 3.37Å; H427-F499 WeakPolarHBondContact CE1-CZ 3.22Å; H427-F499 AromaticContact ND1-CZ 3.82Å; H427-F499 AromaticContact NE2-CE1 3.86Å; H427-F499 AromaticContact NE2-CZ 3.41Å; H427-F499 WeakPolarHBondContact NE2-CZ 3.33Å
428	Y	86.4	Confident	89.7	Confident	47 Å²	47	51.8 Å²	51.8	18%	0.184	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	3.1	178.7	-69.7	-79.2	0	0	0	114.1	D423 D426 H430 F431 G432 G433 A436 A437 A440 L559 L596	D423-Y428 PolarHBondContact OD1-N 2.94Å; D423-Y428 PolarHBondContact OD2-N 2.84Å; D426-Y428 VanDerWaalsContact C-N 3.3Å; D426-Y428 PolarHBondContact O-N 3.24Å; Y428-H430 VanDerWaalsContact C-N 3.27Å; Y428-H430 PolarHBondContact O-N 2.9Å; Y428-H430 VanDerWaalsContact O-N 3.15Å; Y428-F431 HydrophobicContact CD1-CD2 4.47Å; Y428-F431 CarbonylContact O-C 3.59Å; Y428-F431 WeakPolarHBondContact O-CA 3.48Å; Y428-F431 PolarHBondContact O-N 2.85Å; Y428-G432 PolarHBondContact O-N 3.16Å; Y428-G432 VanDerWaalsContact O-N 3.13Å; Y428-G433 PolarHBondContact O-N 3.23Å; Y428-A436 HydrophobicContact CD1-CB 4.17Å; Y428-A436 HydrophobicContact CG-CB 4.36Å; Y428-A437 HydrophobicContact CD2-CB 3.75Å; Y428-A437 HydrophobicContact CE2-CB 4.22Å; Y428-A437 HydrophobicContact CG-CB 4.26Å; Y428-A440 HydrophobicContact CE1-CB 3.82Å; Y428-L559 HydrophobicContact CE1-CD2 4.16Å; Y428-L596 HydrophobicContact CD1-CD1 4.11Å; Y428-L596 HydrophobicContact CE1-CD1 4.06Å
429	K	88.5	Confident	89.6	Confident	125 Å²	125	52.6 Å²	52.6	54%	0.543	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-51.3	-41.9	-176.6	-173.3	-179.3	-155.1	155	0	113.7	D423 D426 F431	D423-K429 PolarHBondContact OD2-N 2.7Å; D423-K429 VanDerWaalsContact OD2-N 3.09Å; D426-K429 HydrophobicContact CB-CB 4.05Å; D426-K429 HydrophobicContact CB-CD 3.99Å; D426-K429 WeakPolarHBondContact O-CB 3.38Å; D426-K429 PolarHBondContact O-N 3.34Å; D426-K429 VanDerWaalsContact O-N 3.11Å; D426-K429 WeakPolarHBondContact OD2-CD 3.2Å; D426-K429 WeakPolarHBondContact OD2-CE 3.44Å; D426-K429 IonicContact OD2-NZ 3.65Å; D426-K429 PolarHBondContact OD2-NZ 3.09Å; K429-F431 PolarHBondContact O-N 2.93Å
430	H	84.2	Confident	89.5	Confident	149 Å²	149	51.4 Å²	51.4	69%	0.69	25%	0.252	S	S	*	.	G	3₁₀ helix	trans	-74.3	-11.7	178.3	-68.5	-60.9	0	0	0	114.3	Y428	Y428-H430 VanDerWaalsContact C-N 3.27Å; Y428-H430 PolarHBondContact O-N 2.9Å; Y428-H430 VanDerWaalsContact O-N 3.15Å
431	F	84.4	Confident	89.5	Confident	21 Å²	21	51.7 Å²	51.7	9%	0.092	25%	0.254	C	S	.	.	G	3₁₀ helix	trans	-110.2	-0.7	180	-58.2	-73.8	0	0	0	113.6	Y428 K429 A436 F499 H594 M595 L596 F750	Y428-F431 HydrophobicContact CD1-CD2 4.47Å; Y428-F431 CarbonylContact O-C 3.59Å; Y428-F431 WeakPolarHBondContact O-CA 3.48Å; Y428-F431 PolarHBondContact O-N 2.85Å; K429-F431 PolarHBondContact O-N 2.93Å; F431-A436 HydrophobicContact CB-CB 4Å; F431-A436 WeakPolarHBondContact O-CB 3.35Å; F431-F499 HydrophobicContact CE2-CD1 4.25Å; F431-F499 AromaticContact CE2-CE1 3.8Å; F431-F499 HydrophobicContact CE2-CE1 3.8Å; F431-F499 HydrophobicContact CE2-CZ 4.2Å; F431-F499 HydrophobicContact CZ-CD1 4.43Å; F431-F499 HydrophobicContact CZ-CE1 4.41Å; F431-H594 CarbonylContact O-C 3.57Å; F431-H594 WeakPolarHBondContact O-CA 3.21Å; F431-M595 HydrophobicContact CD1-CB 4.37Å; F431-M595 PolarHBondContact O-N 2.86Å; F431-L596 HydrophobicContact CB-CD2 4.11Å; F431-L596 HydrophobicContact CB-CG 4.27Å; F431-L596 HydrophobicContact CD1-CD2 3.99Å; F431-L596 HydrophobicContact CG-CD2 4.08Å; F431-F750 HydrophobicContact CE2-CE2 4.5Å; F431-F750 HydrophobicContact CZ-CD2 4.2Å; F431-F750 AromaticContact CZ-CE2 3.93Å; F431-F750 HydrophobicContact CZ-CE2 3.93Å
432	G	87.9	Confident	89.6	Confident	30 Å²	30	52.9 Å²	52.9	31%	0.309	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	122.7	5.8	-177.8	0	0	0	0	0	115.5	Y428 E434 Y435	Y428-G432 PolarHBondContact O-N 3.16Å; Y428-G432 VanDerWaalsContact O-N 3.13Å; G432-E434 PolarHBondContact O-N 2.95Å; G432-Y435 PolarHBondContact O-N 2.78Å
433	G	91.1	Very high	89.6	Confident	12 Å²	12	53 Å²	53	12%	0.124	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.2	-130.4	175.2	0	0	0	0	0	113.2	D423 Y428 Y435 A436 A437	D423-G433 WeakPolarHBondContact OD2-CA 3.42Å; Y428-G433 PolarHBondContact O-N 3.23Å; G433-Y435 PolarHBondContact O-N 3.3Å; G433-Y435 VanDerWaalsContact O-N 3.16Å; G433-A436 WeakPolarHBondContact O-CA 3.3Å; G433-A436 WeakPolarHBondContact O-CB 3.49Å; G433-A436 PolarHBondContact O-N 2.81Å; G433-A437 PolarHBondContact O-N 3.04Å
434	E	90.9	Very high	89.8	Confident	72 Å²	72	52.5 Å²	52.5	34%	0.336	26%	0.262	S	S	.	.	H	α-helix	trans	-50.6	-39.3	-179.9	-61.3	-81.5	-133.1	0	0	113.4	K407 F422 D423 G432 A436 Y438	K407-E434 IonicContact NZ-OE1 2.7Å; K407-E434 PolarHBondContact NZ-OE1 2.84Å; F422-E434 VanDerWaalsContact CA-OE2 3.24Å; F422-E434 WeakPolarHBondContact CA-OE2 3.41Å; F422-E434 WeakPolarHBondContact CB-OE2 3.5Å; F422-E434 WeakPolarHBondContact CD1-OE2 3.22Å; D423-E434 PolarHBondContact N-OE2 2.77Å; G432-E434 PolarHBondContact O-N 2.95Å; E434-A436 VanDerWaalsContact C-N 3.34Å; E434-Y438 WeakPolarHBondContact O-CB 3.5Å; E434-Y438 PolarHBondContact O-N 3.22Å
435	Y	91	Very high	90.2	Very high	118 Å²	118	50.9 Å²	50.9	46%	0.463	25%	0.251	S	S	.	.	H	α-helix	trans	-67.5	-35.7	177.2	-66	-72	0	0	0	112.3	G432 G433 A439 R593	G432-Y435 PolarHBondContact O-N 2.78Å; G433-Y435 PolarHBondContact O-N 3.3Å; G433-Y435 VanDerWaalsContact O-N 3.16Å; Y435-A439 WeakPolarHBondContact O-CB 3.28Å; Y435-A439 PolarHBondContact O-N 3.02Å; Y435-R593 HydrophobicContact CD2-CB 4.14Å; Y435-R593 HydrophobicContact CG-CB 4.07Å; Y435-R593 PolarHBondContact OH-NH1 3.15Å
436	A	92.3	Very high	90.5	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-72.7	-42.9	176.8	0	0	0	0	0	111.4	Y428 F431 G433 E434 Y438 A439 A440 H594 L596	Y428-A436 HydrophobicContact CD1-CB 4.17Å; Y428-A436 HydrophobicContact CG-CB 4.36Å; F431-A436 HydrophobicContact CB-CB 4Å; F431-A436 WeakPolarHBondContact O-CB 3.35Å; G433-A436 WeakPolarHBondContact O-CA 3.3Å; G433-A436 WeakPolarHBondContact O-CB 3.49Å; G433-A436 PolarHBondContact O-N 2.81Å; E434-A436 VanDerWaalsContact C-N 3.34Å; A436-Y438 PolarHBondContact O-N 3.2Å; A436-A439 PolarHBondContact O-N 2.87Å; A436-A440 VanDerWaalsContact O-CB 3.28Å; A436-A440 WeakPolarHBondContact O-CB 3.25Å; A436-A440 PolarHBondContact O-N 3.02Å; A436-H594 HydrophobicContact CB-CB 3.91Å; A436-L596 HydrophobicContact CB-CD1 3.96Å; A436-L596 HydrophobicContact CB-CG 4.37Å
437	A	93.3	Very high	90.9	Very high	4 Å²	4	42.3 Å²	42.3	3%	0.033	22%	0.216	C	C	.	.	H	α-helix	trans	-59.9	-45.5	173.1	0	0	0	0	0	112	F422 D423 Y428 G433 A439 A440 T441	F422-A437 VanDerWaalsContact C-CB 3.43Å; F422-A437 WeakPolarHBondContact O-CB 3.5Å; D423-A437 HydrophobicContact CB-CB 4.26Å; Y428-A437 HydrophobicContact CD2-CB 3.75Å; Y428-A437 HydrophobicContact CE2-CB 4.22Å; Y428-A437 HydrophobicContact CG-CB 4.26Å; G433-A437 PolarHBondContact O-N 3.04Å; A437-A439 VanDerWaalsContact C-N 3.31Å; A437-A439 PolarHBondContact O-N 3.47Å; A437-A440 PolarHBondContact O-N 3.41Å; A437-T441 PolarHBondContact O-N 3.3Å
438	Y	92.6	Very high	91.4	Very high	61 Å²	61	38.7 Å²	38.7	24%	0.239	20%	0.199	C	C	.	.	H	α-helix	trans	-61.8	-37.7	176	-172.2	-94.8	0	0	0	112.6	E434 A436 T441 D468 R473 K848	E434-Y438 WeakPolarHBondContact O-CB 3.5Å; E434-Y438 PolarHBondContact O-N 3.22Å; A436-Y438 PolarHBondContact O-N 3.2Å; Y438-T441 PolarHBondContact O-OG1 3.49Å; Y438-D468 PolarHBondContact OH-OD1 3.46Å; Y438-D468 VanDerWaalsContact OH-OD1 3.08Å; Y438-D468 PolarHBondContact OH-OD2 3.24Å; Y438-R473 HydrophobicContact CD2-CB 4.17Å; Y438-R473 HydrophobicContact CE2-CB 3.83Å; Y438-R473 PolarHBondContact O-NH1 2.91Å; Y438-R473 PolarHBondContact OH-NH2 3.39Å; Y438-K848 HydrophobicContact CE2-CD 4.36Å; Y438-K848 WeakPolarHBondContact OH-CE 3.16Å; Y438-K848 PolarHBondContact OH-NZ 3.06Å
439	A	92.5	Very high	91.8	Very high	17 Å²	17	40.7 Å²	40.7	14%	0.14	21%	0.207	C	C	.	.	H	α-helix	trans	-71.6	-44.8	175.9	0	0	0	0	0	112.6	Y435 A436 A437 T441 S442 S443 H594	Y435-A439 WeakPolarHBondContact O-CB 3.28Å; Y435-A439 PolarHBondContact O-N 3.02Å; A436-A439 PolarHBondContact O-N 2.87Å; A437-A439 VanDerWaalsContact C-N 3.31Å; A437-A439 PolarHBondContact O-N 3.47Å; A439-T441 VanDerWaalsContact C-N 3.3Å; A439-T441 PolarHBondContact O-N 3.21Å; A439-S442 PolarHBondContact O-N 2.73Å; A439-S443 PolarHBondContact O-N 3.3Å; A439-H594 WeakPolarHBondContact CB-CE1 3.35Å
440	A	93.4	Very high	92	Very high	4 Å²	4	34.8 Å²	34.8	3%	0.033	18%	0.182	C	C	.	.	H	α-helix	trans	-52	-46.4	-176.8	0	0	0	0	0	112	Y428 A436 A437 S442 S443 D444 L559 L596	Y428-A440 HydrophobicContact CE1-CB 3.82Å; A436-A440 VanDerWaalsContact O-CB 3.28Å; A436-A440 WeakPolarHBondContact O-CB 3.25Å; A436-A440 PolarHBondContact O-N 3.02Å; A437-A440 PolarHBondContact O-N 3.41Å; A440-S442 VanDerWaalsContact C-N 3.26Å; A440-S442 PolarHBondContact O-N 3.45Å; A440-S443 PolarHBondContact O-N 3.31Å; A440-S443 VanDerWaalsContact O-N 3.1Å; A440-D444 WeakPolarHBondContact O-CB 3.45Å; A440-D444 PolarHBondContact O-N 3.31Å; A440-L559 HydrophobicContact CB-CD2 3.85Å; A440-L596 HydrophobicContact CB-CD1 4.02Å
441	T	94	Very high	92.5	Very high	20 Å²	20	28.1 Å²	28.1	12%	0.123	15%	0.15	C	C	.	.	H	α-helix	trans	-52.3	-41.1	174.8	58.8	0	0	0	0	113.3	A437 Y438 A439 L445 I466 R473 T475	A437-T441 PolarHBondContact O-N 3.3Å; Y438-T441 PolarHBondContact O-OG1 3.49Å; A439-T441 VanDerWaalsContact C-N 3.3Å; A439-T441 PolarHBondContact O-N 3.21Å; T441-L445 PolarHBondContact O-N 3.05Å; T441-I466 WeakPolarHBondContact O-CD1 3.15Å; T441-R473 VanDerWaalsContact OG1-CD 3.25Å; T441-R473 WeakPolarHBondContact OG1-CD 3.37Å; T441-R473 PolarHBondContact OG1-NH1 3.03Å; T441-R473 VanDerWaalsContact OG1-NH1 3.14Å; T441-T475 VanDerWaalsContact CG2-OG1 3.3Å; T441-T475 WeakPolarHBondContact CG2-OG1 3.36Å
442	S	93.1	Very high	92.8	Very high	33 Å²	33	28.7 Å²	28.7	23%	0.231	16%	0.157	C	C	.	.	H	α-helix	trans	-80	-29.2	-179.8	-64.6	0	0	0	0	113	A439 A440 C446 R473	A439-S442 PolarHBondContact O-N 2.73Å; A440-S442 VanDerWaalsContact C-N 3.26Å; A440-S442 PolarHBondContact O-N 3.45Å; S442-C446 PolarHBondContact O-N 3.2Å; S442-C446 PolarHBondContact O-SG 3.36Å; S442-C446 VanDerWaalsContact O-SG 3.34Å; S442-R473 PolarHBondContact OG-NH1 3.48Å
443	S	93.2	Very high	92.9	Very high	23 Å²	23	33.2 Å²	33.2	16%	0.161	17%	0.172	C	C	.	.	H	α-helix	trans	-69.9	-42.6	171.4	-61	0	0	0	0	111.5	A439 A440 C446 G447 L559	A439-S443 PolarHBondContact O-N 3.3Å; A440-S443 PolarHBondContact O-N 3.31Å; A440-S443 VanDerWaalsContact O-N 3.1Å; S443-C446 WeakPolarHBondContact O-CA 3.41Å; S443-C446 WeakPolarHBondContact O-CB 3.47Å; S443-C446 PolarHBondContact O-N 3.42Å; S443-C446 VanDerWaalsContact O-N 3.12Å; S443-G447 PolarHBondContact O-N 3.05Å; S443-L559 WeakPolarHBondContact CB-O 3.45Å
444	D	94.8	Very high	92.8	Very high	12 Å²	12	34.4 Å²	34.4	6%	0.064	18%	0.175	C	C	.	.	H	α-helix	trans	-59.2	-50.8	176.1	178.7	67.4	0	0	0	111.5	A440 C446 G447 V448 L558	A440-D444 WeakPolarHBondContact O-CB 3.45Å; A440-D444 PolarHBondContact O-N 3.31Å; D444-C446 PolarHBondContact O-N 3.26Å; D444-C446 VanDerWaalsContact O-N 3.16Å; D444-G447 CarbonylContact O-C 3.5Å; D444-G447 WeakPolarHBondContact O-CA 3.3Å; D444-G447 PolarHBondContact O-N 2.98Å; D444-V448 WeakPolarHBondContact O-CG2 3.34Å; D444-V448 PolarHBondContact O-N 2.92Å; D444-L558 PolarHBondContact OD1-N 2.75Å
445	L	94.7	Very high	92.7	Very high	7 Å²	7	33.6 Å²	33.6	4%	0.037	17%	0.173	C	C	.	.	H	α-helix	trans	-58.7	-30.3	174.6	177.1	63.6	0	0	0	113.2	T441 R449 T464 I466 K1001 L1003	T441-L445 PolarHBondContact O-N 3.05Å; L445-R449 VanDerWaalsContact O-CB 3.27Å; L445-R449 WeakPolarHBondContact O-CB 3.44Å; L445-R449 PolarHBondContact O-N 3.17Å; L445-T464 HydrophobicContact CD1-CG2 4.14Å; L445-I466 HydrophobicContact CB-CD1 3.78Å; L445-I466 HydrophobicContact CB-CG1 4.48Å; L445-I466 HydrophobicContact CD2-CD1 3.63Å; L445-I466 HydrophobicContact CD2-CG1 3.97Å; L445-I466 HydrophobicContact CG-CD1 4.34Å; L445-K1001 HydrophobicContact CD2-CB 3.81Å; L445-L1003 HydrophobicContact CD1-CD1 3.74Å
446	C	93.2	Very high	92.8	Very high	52 Å²	52	29.6 Å²	29.6	35%	0.351	16%	0.158	S	C	.	.	H	α-helix	trans	-70.9	-38.8	172.2	-75.1	0	0	0	0	112.3	S442 S443 D444 A450	S442-C446 PolarHBondContact O-N 3.2Å; S442-C446 PolarHBondContact O-SG 3.36Å; S442-C446 VanDerWaalsContact O-SG 3.34Å; S443-C446 WeakPolarHBondContact O-CA 3.41Å; S443-C446 WeakPolarHBondContact O-CB 3.47Å; S443-C446 PolarHBondContact O-N 3.42Å; S443-C446 VanDerWaalsContact O-N 3.12Å; D444-C446 PolarHBondContact O-N 3.26Å; D444-C446 VanDerWaalsContact O-N 3.16Å; C446-A450 WeakPolarHBondContact O-CB 3.17Å; C446-A450 PolarHBondContact O-N 3.04Å
447	G	93.9	Very high	92.8	Very high	1 Å²	1	34 Å²	34	1%	0.01	19%	0.187	C	C	.	.	H	α-helix	trans	-68.2	-46.1	173.6	0	0	0	0	0	113	S443 D444 R449 A450 Y451	S443-G447 PolarHBondContact O-N 3.05Å; D444-G447 CarbonylContact O-C 3.5Å; D444-G447 WeakPolarHBondContact O-CA 3.3Å; D444-G447 PolarHBondContact O-N 2.98Å; G447-R449 VanDerWaalsContact C-N 3.27Å; G447-R449 PolarHBondContact O-N 3.3Å; G447-A450 WeakPolarHBondContact O-CB 3.29Å; G447-A450 PolarHBondContact O-N 3.49Å; G447-Y451 WeakPolarHBondContact O-CD2 3.33Å; G447-Y451 PolarHBondContact O-N 2.88Å
448	V	95	Very high	92.8	Very high	4 Å²	4	35.2 Å²	35.2	2%	0.024	20%	0.2	C	C	.	.	H	α-helix	trans	-55.4	-43.7	173.1	174.3	0	0	0	0	110.6	D444 S452 L558 L1003	D444-V448 WeakPolarHBondContact O-CG2 3.34Å; D444-V448 PolarHBondContact O-N 2.92Å; V448-S452 WeakPolarHBondContact O-CB 3.37Å; V448-S452 PolarHBondContact O-N 3.44Å; V448-L558 HydrophobicContact CB-CD1 4.47Å; V448-L558 HydrophobicContact CG2-CD1 3.95Å; V448-L1003 HydrophobicContact CG1-CD1 3.94Å; V448-L1003 HydrophobicContact CG1-CD2 4.29Å
449	R	93.4	Very high	92.9	Very high	89 Å²	89	33.4 Å²	33.4	34%	0.336	19%	0.194	S	C	.	.	H	α-helix	trans	-61	-48.6	173.1	-178.9	-175.5	-63.3	-168.2	-5.4	111.9	L445 G447 S452 M453 H1002 L1003	L445-R449 VanDerWaalsContact O-CB 3.27Å; L445-R449 WeakPolarHBondContact O-CB 3.44Å; L445-R449 PolarHBondContact O-N 3.17Å; G447-R449 VanDerWaalsContact C-N 3.27Å; G447-R449 PolarHBondContact O-N 3.3Å; R449-S452 PolarHBondContact O-N 3.39Å; R449-M453 HydrophobicContact CG-CE 3.97Å; R449-M453 HydrophobicContact CG-CG 4.45Å; R449-M453 HydrophobicContact CG-SD 3.77Å; R449-M453 WeakPolarHBondContact O-CB 3.48Å; R449-M453 WeakPolarHBondContact O-CG 3.34Å; R449-M453 PolarHBondContact O-N 3.23Å; R449-H1002 PolarHBondContact NH2-O 3.5Å; R449-L1003 HydrophobicContact CB-CG 4.42Å
450	A	92.9	Very high	93	Very high	2 Å²	2	34.2 Å²	34.2	2%	0.017	19%	0.194	C	C	.	.	H	α-helix	trans	-59.3	-48.5	-178.9	0	0	0	0	0	111.8	C446 G447 M453 L454 L520 T561 F562	C446-A450 WeakPolarHBondContact O-CB 3.17Å; C446-A450 PolarHBondContact O-N 3.04Å; G447-A450 WeakPolarHBondContact O-CB 3.29Å; G447-A450 PolarHBondContact O-N 3.49Å; A450-M453 PolarHBondContact O-N 2.93Å; A450-L454 WeakPolarHBondContact O-CG 3.26Å; A450-L520 HydrophobicContact CB-CD2 4.04Å; A450-T561 HydrophobicContact CB-CG2 4.46Å; A450-F562 HydrophobicContact CB-CE2 4.09Å; A450-F562 HydrophobicContact CB-CZ 3.7Å
451	Y	94.3	Very high	93.1	Very high	9 Å²	9	34.2 Å²	34.2	4%	0.035	19%	0.194	C	C	.	.	H	α-helix	trans	-66.8	-40.6	176.6	-83.3	-88.2	0	0	0	112.7	G447 M453 L454 L459 L513 T516 L520 S539 I555 L558 T561	G447-Y451 WeakPolarHBondContact O-CD2 3.33Å; G447-Y451 PolarHBondContact O-N 2.88Å; Y451-M453 PolarHBondContact O-N 2.89Å; Y451-L454 PolarHBondContact O-N 3.42Å; Y451-L459 HydrophobicContact CD1-CD2 3.95Å; Y451-L459 HydrophobicContact CE1-CD2 4.28Å; Y451-L513 HydrophobicContact CE1-CD2 4.04Å; Y451-T516 HydrophobicContact CD1-CG2 4.44Å; Y451-L520 HydrophobicContact CD1-CD1 4.26Å; Y451-L520 HydrophobicContact CD2-CD1 4.05Å; Y451-L520 HydrophobicContact CE1-CD1 3.93Å; Y451-L520 HydrophobicContact CE2-CD1 3.71Å; Y451-L520 HydrophobicContact CG-CD1 4.33Å; Y451-S539 PolarHBondContact OH-OG 2.95Å; Y451-I555 HydrophobicContact CD1-CD1 4.19Å; Y451-I555 HydrophobicContact CE1-CD1 3.75Å; Y451-I555 HydrophobicContact CE2-CD1 4.25Å; Y451-L558 HydrophobicContact CD2-CD1 3.82Å; Y451-L558 HydrophobicContact CD2-CD2 3.83Å; Y451-L558 HydrophobicContact CD2-CG 4.43Å; Y451-L558 HydrophobicContact CE2-CD1 4.45Å; Y451-L558 HydrophobicContact CE2-CD2 3.59Å; Y451-L558 HydrophobicContact CG-CD1 4.4Å; Y451-T561 HydrophobicContact CD2-CG2 4.27Å; Y451-T561 HydrophobicContact CE2-CG2 3.77Å
452	S	92.2	Very high	93.1	Very high	33 Å²	33	34 Å²	34	23%	0.231	19%	0.191	C	C	.	.	H	α-helix	trans	-69.1	-17.8	178.1	-172.2	0	0	0	0	114	R357 V448 R449	R357-S452 PolarHBondContact NH2-OG 3.42Å; V448-S452 WeakPolarHBondContact O-CB 3.37Å; V448-S452 PolarHBondContact O-N 3.44Å; R449-S452 PolarHBondContact O-N 3.39Å
453	M	88.2	Confident	93.2	Very high	125 Å²	125	32.6 Å²	32.6	62%	0.616	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-11.7	174.9	-78.3	174.9	159.5	0	0	113.5	R449 A450 Y451	R449-M453 HydrophobicContact CG-CE 3.97Å; R449-M453 HydrophobicContact CG-CG 4.45Å; R449-M453 HydrophobicContact CG-SD 3.77Å; R449-M453 WeakPolarHBondContact O-CB 3.48Å; R449-M453 WeakPolarHBondContact O-CG 3.34Å; R449-M453 PolarHBondContact O-N 3.23Å; A450-M453 PolarHBondContact O-N 2.93Å; Y451-M453 PolarHBondContact O-N 2.89Å
454	L	90	Very high	93.3	Very high	37 Å²	37	31.6 Å²	31.6	19%	0.194	18%	0.175	C	C	.	.	S	Bend	trans	-87	-17.9	175.2	-53.7	174.3	0	0	0	113.2	A450 Y451 Q456 T516 Q519 L520	A450-L454 WeakPolarHBondContact O-CG 3.26Å; Y451-L454 PolarHBondContact O-N 3.42Å; L454-Q456 PolarHBondContact O-N 3.47Å; L454-T516 HydrophobicContact CB-CG2 4.44Å; L454-T516 HydrophobicContact CD1-CG2 3.57Å; L454-Q519 HydrophobicContact CD2-CB 3.84Å; L454-L520 HydrophobicContact CD1-CD1 3.95Å; L454-L520 HydrophobicContact CD1-CD2 3.99Å; L454-L520 HydrophobicContact CD1-CG 3.74Å; L454-L520 HydrophobicContact CD2-CD2 4.27Å; L454-L520 HydrophobicContact CG-CD2 4.43Å
455	D	89.4	Confident	93.4	Very high	55 Å²	55	31 Å²	31	29%	0.294	17%	0.172	S	C	.	.			trans	47.9	34.2	179.1	-159	37.4	0	0	0	115	Q361 R370 P457	Q361-D455 PolarHBondContact NE2-OD2 2.94Å; R370-D455 IonicContact CZ-OD1 2.73Å; R370-D455 IonicContact CZ-OD2 3.35Å; R370-D455 IonicContact NH1-OD1 2.68Å; R370-D455 IonicContact NH1-OD2 3.92Å; R370-D455 PolarHBondContact NH1-OD2 3.13Å; R370-D455 IonicContact NH2-OD1 2.72Å; R370-D455 PolarHBondContact NH2-OD1 2.92Å; R370-D455 IonicContact NH2-OD2 3.34Å; R370-D455 PolarHBondContact NH2-OD2 3.17Å; D455-P457 WeakPolarHBondContact O-CD 3.41Å
456	Q	92.7	Very high	93.5	Very high	33 Å²	33	30.7 Å²	30.7	15%	0.154	17%	0.171	C	C	.	.			trans	-63.2	113.9	-175.2	169.7	57.2	66	0	0	111.1	L454 G458 L459 L512 T516	L454-Q456 PolarHBondContact O-N 3.47Å; Q456-G458 PolarHBondContact O-N 3.46Å; Q456-L459 HydrophobicContact CB-CB 4.36Å; Q456-L459 HydrophobicContact CG-CB 4.07Å; Q456-L459 HydrophobicContact CG-CD2 4.47Å; Q456-L459 PolarHBondContact O-N 3.34Å; Q456-L459 VanDerWaalsContact O-N 3.15Å; Q456-L512 HydrophobicContact CG-CD2 4.26Å; Q456-T516 HydrophobicContact CB-CG2 3.62Å; Q456-T516 HydrophobicContact CG-CG2 3.85Å
457	P	92.1	Very high	93.7	Very high	93 Å²	93	28.2 Å²	28.2	60%	0.604	15%	0.154	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	135.6	-179.9	-27.1	36.8	0	0	0	112.1	D455 L512	D455-P457 WeakPolarHBondContact O-CD 3.41Å; P457-L512 VanDerWaalsContact O-CD2 3.23Å; P457-L512 WeakPolarHBondContact O-CD2 3.42Å
458	G	93.2	Very high	93.9	Very high	29 Å²	29	29 Å²	29	30%	0.299	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.2	-9.4	-177.9	0	0	0	0	0	115.8	Q456 Y460 L512 T553	Q456-G458 PolarHBondContact O-N 3.46Å; G458-Y460 WeakPolarHBondContact O-CD2 3.31Å; G458-Y460 VanDerWaalsContact O-CE2 3.24Å; G458-Y460 WeakPolarHBondContact O-CE2 3.36Å; G458-L512 WeakPolarHBondContact O-CD1 3.31Å; G458-T553 PolarHBondContact O-OG1 2.92Å
459	L	94.9	Very high	93.9	Very high	23 Å²	23	30 Å²	30	12%	0.12	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	118.2	178.7	-174.4	70.5	0	0	0	110.7	Y451 Q456 Y509 L512 L513 T516 I555	Y451-L459 HydrophobicContact CD1-CD2 3.95Å; Y451-L459 HydrophobicContact CE1-CD2 4.28Å; Q456-L459 HydrophobicContact CB-CB 4.36Å; Q456-L459 HydrophobicContact CG-CB 4.07Å; Q456-L459 HydrophobicContact CG-CD2 4.47Å; Q456-L459 PolarHBondContact O-N 3.34Å; Q456-L459 VanDerWaalsContact O-N 3.15Å; L459-Y509 HydrophobicContact CD1-CD1 4.37Å; L459-Y509 HydrophobicContact CD1-CE1 4.05Å; L459-L512 HydrophobicContact CB-CB 4.41Å; L459-L512 HydrophobicContact CB-CD1 4.33Å; L459-L512 HydrophobicContact CB-CD2 4.48Å; L459-L512 HydrophobicContact CD1-CB 4.41Å; L459-L512 HydrophobicContact CD1-CD1 4.47Å; L459-L513 HydrophobicContact CD1-CD2 3.91Å; L459-L513 HydrophobicContact CD2-CD2 3.65Å; L459-L513 HydrophobicContact CG-CD2 4.46Å; L459-T516 HydrophobicContact CD2-CG2 3.91Å; L459-I555 HydrophobicContact CD1-CB 4.09Å; L459-I555 HydrophobicContact CD1-CG2 4.02Å; L459-I555 HydrophobicContact CD2-CG2 4.45Å; L459-I555 HydrophobicContact CG-CG2 4.12Å
460	Y	95.2	Very high	93.9	Very high	34 Å²	34	27 Å²	27	13%	0.133	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	148.1	-168.6	-56.4	-98.5	0	0	0	111.4	Q354 E358 G458 R552 T553 Y554 I555	Q354-Y460 HydrophobicContact CB-CD1 3.97Å; Q354-Y460 HydrophobicContact CB-CE1 4.19Å; Q354-Y460 HydrophobicContact CG-CD1 3.99Å; E358-Y460 HydrophobicContact CG-CE1 4.01Å; E358-Y460 WeakPolarHBondContact OE1-CE1 3.39Å; E358-Y460 PolarHBondContact OE1-OH 3.17Å; G458-Y460 WeakPolarHBondContact O-CD2 3.31Å; G458-Y460 VanDerWaalsContact O-CE2 3.24Å; G458-Y460 WeakPolarHBondContact O-CE2 3.36Å; Y460-R552 HydrophobicContact CD2-CB 3.7Å; Y460-R552 HydrophobicContact CD2-CG 4.25Å; Y460-R552 HydrophobicContact CE1-CG 4.16Å; Y460-R552 HydrophobicContact CE2-CB 3.72Å; Y460-R552 HydrophobicContact CE2-CG 3.86Å; Y460-R552 HydrophobicContact CG-CB 4.14Å; Y460-T553 WeakPolarHBondContact CD2-O 3.26Å; Y460-T553 PolarHBondContact N-O 3.44Å; Y460-Y554 WeakPolarHBondContact O-CA 3.41Å; Y460-I555 PolarHBondContact O-N 2.76Å
461	T	94.8	Very high	93.9	Very high	5 Å²	5	27.4 Å²	27.4	3%	0.031	16%	0.155	C	C	.	.			trans	-125.5	151.1	175.9	48.6	0	0	0	0	110.6	Q354 R357 I555	Q354-T461 PolarHBondContact NE2-O 3.11Å; R357-T461 PolarHBondContact NH1-O 3.42Å; R357-T461 PolarHBondContact NH1-OG1 3.15Å; R357-T461 PolarHBondContact NH2-OG1 3.39Å; T461-I555 HydrophobicContact CG2-CG2 3.7Å
462	L	94.3	Very high	93.9	Very high	14 Å²	14	27.6 Å²	27.6	7%	0.073	16%	0.156	C	C	.	.			trans	-72.1	141.2	-179.9	-53	-178.9	0	0	0	111.3	T464 I480 Y554	L462-T464 PolarHBondContact O-N 3.41Å; L462-T464 VanDerWaalsContact O-N 3.16Å; L462-T464 PolarHBondContact O-OG1 2.96Å; L462-I480 HydrophobicContact CD2-CD1 4.1Å; L462-I480 HydrophobicContact CD2-CG1 3.57Å; L462-Y554 HydrophobicContact CD2-CD1 3.8Å; L462-Y554 HydrophobicContact CD2-CE1 4.28Å
463	G	94.4	Very high	94	Very high	5 Å²	5	26.3 Å²	26.3	5%	0.052	15%	0.146	C	C	.	.			trans	-59.8	119.7	165.7	0	0	0	0	0	108	F381 Q477 T478	F381-G463 VanDerWaalsContact CE1-C 3.5Å; F381-G463 VanDerWaalsContact CZ-C 3.43Å; F381-G463 WeakPolarHBondContact CZ-O 3.33Å; G463-Q477 CarbonylContact O-C 3.35Å; G463-Q477 VanDerWaalsContact O-CA 3.26Å; G463-Q477 WeakPolarHBondContact O-CA 3.5Å; G463-T478 PolarHBondContact N-OG1 3.21Å; G463-T478 PolarHBondContact O-N 2.9Å
464	T	96.4	Very high	94.5	Very high	1 Å²	1	20.4 Å²	20.4	1%	0.006	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	124.8	-167.4	-57.1	0	0	0	0	111.2	L445 L462 A476 Q477	L445-T464 HydrophobicContact CD1-CG2 4.14Å; L462-T464 PolarHBondContact O-N 3.41Å; L462-T464 VanDerWaalsContact O-N 3.16Å; L462-T464 PolarHBondContact O-OG1 2.96Å; T464-A476 WeakPolarHBondContact CA-O 3.31Å; T464-Q477 HydrophobicContact CG2-CG 3.93Å
465	A	96.5	Very high	94.8	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	145.3	175.6	0	0	0	0	0	111.3	F381 A385 I467 A476 K1001 H1002	F381-A465 HydrophobicContact CE1-CB 4.23Å; A385-A465 HydrophobicContact CB-CB 4.4Å; A465-I467 HydrophobicContact CB-CD1 4.25Å; A465-A476 PolarHBondContact N-O 2.92Å; A465-A476 PolarHBondContact O-N 3.43Å; A465-K1001 CarbonylContact C-O 3.49Å; A465-K1001 WeakPolarHBondContact CA-O 3.37Å; A465-H1002 HydrophobicContact CB-CB 4.44Å
466	I	97.5	Very high	95.2	Very high	1 Å²	1	16.3 Å²	16.3	1%	0.005	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	127	175.4	-56.3	171.5	0	0	0	108.8	T441 L445 R473 V474 V1000 K1001	T441-I466 WeakPolarHBondContact O-CD1 3.15Å; L445-I466 HydrophobicContact CB-CD1 3.78Å; L445-I466 HydrophobicContact CB-CG1 4.48Å; L445-I466 HydrophobicContact CD2-CD1 3.63Å; L445-I466 HydrophobicContact CD2-CG1 3.97Å; L445-I466 HydrophobicContact CG-CD1 4.34Å; I466-R473 HydrophobicContact CG2-CG 3.75Å; I466-V474 WeakPolarHBondContact CA-O 3.4Å; I466-V1000 CarbonylContact O-C 3.52Å; I466-V1000 WeakPolarHBondContact O-CA 3.38Å; I466-K1001 HydrophobicContact CB-CB 4.35Å; I466-K1001 PolarHBondContact N-O 2.88Å; I466-K1001 PolarHBondContact O-N 3.02Å
467	I	97.2	Very high	95.4	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	113.4	179.9	-57.2	81.2	0	0	0	108.4	A389 A465 R473 V474 A476 P998 V1000	A389-I467 HydrophobicContact CB-CB 3.87Å; A389-I467 HydrophobicContact CB-CD1 3.83Å; A389-I467 HydrophobicContact CB-CG1 3.74Å; A389-I467 HydrophobicContact CB-CG2 4.08Å; A465-I467 HydrophobicContact CB-CD1 4.25Å; I467-R473 WeakPolarHBondContact O-CA 3.31Å; I467-V474 HydrophobicContact CB-CB 4.49Å; I467-V474 PolarHBondContact N-O 3.43Å; I467-V474 PolarHBondContact O-N 3.45Å; I467-A476 HydrophobicContact CD1-CB 4.19Å; I467-P998 HydrophobicContact CG2-CB 3.59Å; I467-V1000 HydrophobicContact CG1-CG1 4.33Å
468	D	96.9	Very high	95.5	Very high	16 Å²	16	12 Å²	12	9%	0.086	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	114.2	165.2	-70.6	-46.1	0	0	0	107.8	Y438 F472 R473 I999 K1001	Y438-D468 PolarHBondContact OH-OD1 3.46Å; Y438-D468 VanDerWaalsContact OH-OD1 3.08Å; Y438-D468 PolarHBondContact OH-OD2 3.24Å; D468-F472 CarbonylContact C-O 3.46Å; D468-F472 WeakPolarHBondContact CA-O 3.19Å; D468-R473 VanDerWaalsContact CG-NH2 3.34Å; D468-R473 IonicContact OD1-CZ 3.52Å; D468-R473 VanDerWaalsContact OD1-CZ 3.27Å; D468-R473 IonicContact OD1-NE 3.68Å; D468-R473 PolarHBondContact OD1-NE 3.05Å; D468-R473 IonicContact OD1-NH2 3.64Å; D468-R473 PolarHBondContact OD1-NH2 3.45Å; D468-R473 IonicContact OD2-CZ 2.89Å; D468-R473 IonicContact OD2-NE 3.93Å; D468-R473 IonicContact OD2-NH2 3.44Å; D468-R473 PolarHBondContact OD2-NH2 2.79Å; D468-I999 HydrophobicContact CB-CB 4.37Å; D468-I999 PolarHBondContact N-O 2.84Å; D468-I999 PolarHBondContact O-N 3.05Å; D468-K1001 IonicContact OD2-NZ 2.85Å
469	Y	96	Very high	95.5	Very high	25 Å²	25	12.2 Å²	12.2	10%	0.098	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	136.9	-177.8	177	-114.6	0	0	0	112.5	V390 V393 G471 F472 L996 P998	V390-Y469 HydrophobicContact CB-CD1 4.41Å; V390-Y469 HydrophobicContact CB-CE1 4.14Å; V390-Y469 HydrophobicContact CG1-CE1 3.81Å; V390-Y469 HydrophobicContact CG2-CD1 4.03Å; V390-Y469 HydrophobicContact CG2-CD2 4.36Å; V390-Y469 HydrophobicContact CG2-CE1 4.03Å; V390-Y469 HydrophobicContact CG2-CE2 4.35Å; V390-Y469 HydrophobicContact CG2-CG 4.2Å; V393-Y469 HydrophobicContact CB-CD1 3.82Å; V393-Y469 HydrophobicContact CB-CE1 4.23Å; V393-Y469 HydrophobicContact CG1-CD1 3.81Å; V393-Y469 HydrophobicContact CG1-CE1 4.14Å; V393-Y469 HydrophobicContact CG2-CD1 4.27Å; Y469-G471 PolarHBondContact O-N 3.02Å; Y469-G471 VanDerWaalsContact O-N 3.09Å; Y469-F472 PolarHBondContact N-O 2.99Å; Y469-F472 WeakPolarHBondContact O-CA 3.45Å; Y469-F472 WeakPolarHBondContact O-CB 3.37Å; Y469-F472 PolarHBondContact O-N 3.2Å; Y469-L996 HydrophobicContact CE2-CB 4.17Å; Y469-P998 HydrophobicContact CD2-CB 4.39Å
470	R	93.3	Very high	95.4	Very high	26 Å²	26	11.6 Å²	11.6	10%	0.098	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	47	35	-175.7	-68.9	175.3	57.3	-175.7	-3.2	114.3	V393 N394 F472 L996	V393-R470 HydrophobicContact CG1-CB 3.93Å; N394-R470 PolarHBondContact OD1-NH1 3.13Å; R470-F472 WeakPolarHBondContact O-CD2 3.29Å; R470-F472 PolarHBondContact O-N 3.22Å; R470-L996 HydrophobicContact CG-CD1 3.9Å
471	G	91.8	Very high	95.1	Very high	12 Å²	12	11.6 Å²	11.6	12%	0.124	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.8	-13.4	-176.5	0	0	0	0	0	115.2	Y469 Q852	Y469-G471 PolarHBondContact O-N 3.02Å; Y469-G471 VanDerWaalsContact O-N 3.09Å; G471-Q852 PolarHBondContact O-NE2 3.28Å
472	F	94.4	Very high	94.7	Very high	13 Å²	13	12 Å²	12	6%	0.057	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	151.2	172	-66.8	-91.5	0	0	0	111	V393 L420 F422 D468 Y469 R470 Q852	V393-F472 HydrophobicContact CG1-CB 4.32Å; V393-F472 HydrophobicContact CG1-CD2 3.73Å; V393-F472 HydrophobicContact CG1-CE2 4.46Å; V393-F472 HydrophobicContact CG1-CG 4.2Å; V393-F472 HydrophobicContact CG2-CB 3.96Å; V393-F472 HydrophobicContact CG2-CG 4.43Å; L420-F472 HydrophobicContact CD1-CD1 4.29Å; F422-F472 AromaticContact CE2-CD1 3.76Å; F422-F472 HydrophobicContact CE2-CD1 3.76Å; F422-F472 AromaticContact CE2-CE1 3.95Å; F422-F472 HydrophobicContact CE2-CE1 3.95Å; F422-F472 AromaticContact CZ-CD1 3.84Å; F422-F472 HydrophobicContact CZ-CD1 3.84Å; F422-F472 AromaticContact CZ-CE1 3.92Å; F422-F472 HydrophobicContact CZ-CE1 3.92Å; D468-F472 CarbonylContact C-O 3.46Å; D468-F472 WeakPolarHBondContact CA-O 3.19Å; Y469-F472 PolarHBondContact N-O 2.99Å; Y469-F472 WeakPolarHBondContact O-CA 3.45Å; Y469-F472 WeakPolarHBondContact O-CB 3.37Å; Y469-F472 PolarHBondContact O-N 3.2Å; R470-F472 WeakPolarHBondContact O-CD2 3.29Å; R470-F472 PolarHBondContact O-N 3.22Å; F472-Q852 HydrophobicContact CD1-CG 4.45Å; F472-Q852 HydrophobicContact CD2-CG 4.24Å; F472-Q852 HydrophobicContact CE1-CG 4.15Å; F472-Q852 HydrophobicContact CE2-CB 4.4Å; F472-Q852 HydrophobicContact CE2-CG 3.91Å; F472-Q852 HydrophobicContact CG-CG 4.48Å; F472-Q852 HydrophobicContact CZ-CB 4.19Å; F472-Q852 HydrophobicContact CZ-CG 3.85Å
473	R	96	Very high	94.3	Very high	6 Å²	6	12.7 Å²	12.7	2%	0.023	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	129.5	160.9	169.4	163	-69.3	176.8	-2.5	108.9	L420 G421 Y438 T441 S442 I466 I467 D468	L420-R473 WeakPolarHBondContact CA-O 3.44Å; G421-R473 PolarHBondContact N-O 3.23Å; Y438-R473 HydrophobicContact CD2-CB 4.17Å; Y438-R473 HydrophobicContact CE2-CB 3.83Å; Y438-R473 PolarHBondContact O-NH1 2.91Å; Y438-R473 PolarHBondContact OH-NH2 3.39Å; T441-R473 VanDerWaalsContact OG1-CD 3.25Å; T441-R473 WeakPolarHBondContact OG1-CD 3.37Å; T441-R473 PolarHBondContact OG1-NH1 3.03Å; T441-R473 VanDerWaalsContact OG1-NH1 3.14Å; S442-R473 PolarHBondContact OG-NH1 3.48Å; I466-R473 HydrophobicContact CG2-CG 3.75Å; I467-R473 WeakPolarHBondContact O-CA 3.31Å; D468-R473 VanDerWaalsContact CG-NH2 3.34Å; D468-R473 IonicContact OD1-CZ 3.52Å; D468-R473 VanDerWaalsContact OD1-CZ 3.27Å; D468-R473 IonicContact OD1-NE 3.68Å; D468-R473 PolarHBondContact OD1-NE 3.05Å; D468-R473 IonicContact OD1-NH2 3.64Å; D468-R473 PolarHBondContact OD1-NH2 3.45Å; D468-R473 IonicContact OD2-CZ 2.89Å; D468-R473 IonicContact OD2-NE 3.93Å; D468-R473 IonicContact OD2-NH2 3.44Å; D468-R473 PolarHBondContact OD2-NH2 2.79Å
474	V	97	Very high	93.6	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.1	170.3	-166.3	0	0	0	0	108.3	A389 V393 F418 S419 L420 I466 I467	A389-V474 HydrophobicContact CB-CB 4.01Å; A389-V474 HydrophobicContact CB-CG1 4.05Å; A389-V474 HydrophobicContact CB-CG2 4.15Å; V393-V474 HydrophobicContact CG2-CG2 3.53Å; F418-V474 HydrophobicContact CB-CG1 4.03Å; F418-V474 HydrophobicContact CD1-CG1 3.86Å; F418-V474 HydrophobicContact CG-CG1 4.44Å; S419-V474 CarbonylContact O-C 3.44Å; S419-V474 WeakPolarHBondContact O-CA 3.26Å; L420-V474 HydrophobicContact CD2-CG1 4.48Å; L420-V474 HydrophobicContact CD2-CG2 3.9Å; I466-V474 WeakPolarHBondContact CA-O 3.4Å; I467-V474 HydrophobicContact CB-CB 4.49Å; I467-V474 PolarHBondContact N-O 3.43Å; I467-V474 PolarHBondContact O-N 3.45Å
475	T	97.2	Very high	92.6	Very high	6 Å²	6	25 Å²	25	4%	0.037	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	125.8	164.6	-59.8	0	0	0	0	107.6	F418 S419 T441 Q477	F418-T475 WeakPolarHBondContact CA-O 3.43Å; S419-T475 PolarHBondContact N-O 3.5Å; S419-T475 PolarHBondContact O-N 2.81Å; T441-T475 VanDerWaalsContact CG2-OG1 3.3Å; T441-T475 WeakPolarHBondContact CG2-OG1 3.36Å; T475-Q477 HydrophobicContact CG2-CG 4.18Å
476	A	97	Very high	91	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	128	175.5	0	0	0	0	0	109.3	A385 F417 F418 T464 A465 I467	A385-A476 HydrophobicContact CB-CB 3.85Å; F417-A476 WeakPolarHBondContact O-CA 3.46Å; F418-A476 HydrophobicContact CD1-CB 3.64Å; F418-A476 HydrophobicContact CE1-CB 3.48Å; F418-A476 VanDerWaalsContact CE1-CB 3.48Å; F418-A476 HydrophobicContact CZ-CB 4.33Å; T464-A476 WeakPolarHBondContact CA-O 3.31Å; A465-A476 PolarHBondContact N-O 2.92Å; A465-A476 PolarHBondContact O-N 3.43Å; I467-A476 HydrophobicContact CD1-CB 4.19Å
477	Q	96.6	Very high	89.5	Confident	33 Å²	33	35.7 Å²	35.7	15%	0.154	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	149.3	-177.3	-81.5	169.4	-34.9	0	0	111.7	M416 F417 G463 T464 T475	M416-Q477 WeakPolarHBondContact CA-O 3.47Å; F417-Q477 PolarHBondContact N-O 3.27Å; F417-Q477 PolarHBondContact O-N 3.16Å; G463-Q477 CarbonylContact O-C 3.35Å; G463-Q477 VanDerWaalsContact O-CA 3.26Å; G463-Q477 WeakPolarHBondContact O-CA 3.5Å; T464-Q477 HydrophobicContact CG2-CG 3.93Å; T475-Q477 HydrophobicContact CG2-CG 4.18Å
478	T	95.4	Very high	87.8	Confident	4 Å²	4	42 Å²	42	3%	0.025	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	154.1	168.1	59.9	0	0	0	0	111.7	W349 N350 L353 F381 G463	W349-T478 HydrophobicContact CB-CG2 3.8Å; N350-T478 PolarHBondContact OD1-OG1 3.4Å; L353-T478 HydrophobicContact CD1-CG2 4Å; F381-T478 HydrophobicContact CD2-CG2 4.12Å; F381-T478 HydrophobicContact CE2-CG2 3.6Å; F381-T478 HydrophobicContact CZ-CG2 4.18Å; G463-T478 PolarHBondContact N-OG1 3.21Å; G463-T478 PolarHBondContact O-N 2.9Å
479	I	93	Very high	86	Confident	32 Å²	32	48.4 Å²	48.4	16%	0.164	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-96.1	132.9	-175.4	-58.3	174.4	0	0	0	109.7	N350 I412 N415 F417 I483 L484	N350-I479 WeakPolarHBondContact CB-O 3.36Å; I412-I479 HydrophobicContact CD1-CD1 3.89Å; I412-I479 HydrophobicContact CG1-CD1 3.9Å; I412-I479 HydrophobicContact CG2-CD1 4.05Å; N415-I479 WeakPolarHBondContact O-CD1 3.41Å; N415-I479 WeakPolarHBondContact O-CG1 3.48Å; F417-I479 HydrophobicContact CB-CG1 4.05Å; I479-I483 HydrophobicContact CG2-CG2 3.57Å; I479-L484 HydrophobicContact CG2-CD1 4.43Å
480	I	92.5	Very high	84.5	Confident	10 Å²	10	53.8 Å²	53.8	5%	0.051	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-75.1	129.1	174.8	-63.4	170.4	0	0	0	109.6	L462 G482 I483 I546 Y554 L556	L462-I480 HydrophobicContact CD2-CD1 4.1Å; L462-I480 HydrophobicContact CD2-CG1 3.57Å; I480-G482 PolarHBondContact O-N 2.93Å; I480-I483 HydrophobicContact CB-CB 4.16Å; I480-I483 HydrophobicContact CB-CG2 4.43Å; I480-I483 WeakPolarHBondContact O-CB 3.48Å; I480-I483 WeakPolarHBondContact O-CG2 3.45Å; I480-I483 PolarHBondContact O-N 2.78Å; I480-I483 VanDerWaalsContact O-N 3.09Å; I480-I546 HydrophobicContact CD1-CB 4.23Å; I480-I546 HydrophobicContact CD1-CD1 4.3Å; I480-I546 HydrophobicContact CD1-CG2 4.23Å; I480-I546 HydrophobicContact CG2-CG2 4.18Å; I480-Y554 HydrophobicContact CD1-CD2 4.36Å; I480-Y554 HydrophobicContact CD1-CG 3.95Å; I480-Y554 HydrophobicContact CG1-CD1 4.13Å; I480-Y554 HydrophobicContact CG1-CD2 4.15Å; I480-Y554 HydrophobicContact CG1-CG 3.89Å; I480-Y554 HydrophobicContact CG2-CD2 3.73Å; I480-Y554 HydrophobicContact CG2-CE2 3.94Å; I480-Y554 HydrophobicContact CG2-CG 4.34Å; I480-L556 HydrophobicContact CD1-CD2 4.02Å
481	P	90.1	Very high	84	Confident	35 Å²	35	53.4 Å²	53.4	23%	0.227	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	123	175.7	-29.8	37.4	0	0	0	112.6	G548 N549 D550	P481-G548 WeakPolarHBondContact O-CA 3.25Å; P481-N549 HydrophobicContact CB-CB 4.25Å; P481-N549 PolarHBondContact O-N 3.22Å; P481-D550 HydrophobicContact CB-CB 4.37Å; P481-D550 HydrophobicContact CG-CB 4.19Å
482	G	85.5	Confident	83.8	Confident	14 Å²	14	53.3 Å²	53.3	14%	0.144	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.5	-6.6	-179.5	0	0	0	0	0	116.8	I480 L484 E485 N549	I480-G482 PolarHBondContact O-N 2.93Å; G482-L484 PolarHBondContact O-N 3.42Å; G482-L484 VanDerWaalsContact O-N 3.1Å; G482-E485 PolarHBondContact O-N 3.05Å; G482-E485 VanDerWaalsContact O-N 3.15Å; G482-N549 WeakPolarHBondContact CA-ND2 3.49Å
483	I	84.9	Confident	83.7	Confident	28 Å²	28	54.6 Å²	54.6	14%	0.144	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-15.9	-178.1	-163.2	54.9	0	0	0	114.4	I479 I480 Q488 L491 I546	I479-I483 HydrophobicContact CG2-CG2 3.57Å; I480-I483 HydrophobicContact CB-CB 4.16Å; I480-I483 HydrophobicContact CB-CG2 4.43Å; I480-I483 WeakPolarHBondContact O-CB 3.48Å; I480-I483 WeakPolarHBondContact O-CG2 3.45Å; I480-I483 PolarHBondContact O-N 2.78Å; I480-I483 VanDerWaalsContact O-N 3.09Å; I483-Q488 HydrophobicContact CD1-CG 4.43Å; I483-L491 HydrophobicContact CD1-CD1 3.62Å; I483-I546 HydrophobicContact CD1-CD1 3.97Å
484	L	79.9	Confident	83.6	Confident	124 Å²	124	54.3 Å²	54.3	65%	0.649	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-9	-179.8	-56.6	178.8	0	0	0	113.4	I412 I479 G482	I412-L484 HydrophobicContact CD1-CD1 3.94Å; I412-L484 HydrophobicContact CD1-CD2 4.33Å; I479-L484 HydrophobicContact CG2-CD1 4.43Å; G482-L484 PolarHBondContact O-N 3.42Å; G482-L484 VanDerWaalsContact O-N 3.1Å
485	E	75.6	Confident	83.3	Confident	139 Å²	139	54.3 Å²	54.3	65%	0.65	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-23.8	-175.8	-60.3	177.2	161.5	0	0	113.4	G482 N549	G482-E485 PolarHBondContact O-N 3.05Å; G482-E485 VanDerWaalsContact O-N 3.15Å; E485-N549 PolarHBondContact OE2-ND2 2.86Å
486	K	64.2	Low	83	Confident	92 Å²	92	54.2 Å²	54.2	40%	0.4	27%	0.268	S	S	.	.	S	Bend	trans	-124.8	154.2	-169.1	-64.7	153.4	-176.6	168.4	0	109.4	Q488 L491 N549	K486-Q488 PolarHBondContact O-N 3.34Å; K486-L491 HydrophobicContact CB-CD1 3.99Å; K486-L491 HydrophobicContact CB-CG 4.17Å; K486-L491 HydrophobicContact CD-CD1 4.26Å; K486-L491 HydrophobicContact CD-CD2 3.74Å; K486-L491 HydrophobicContact CD-CG 4.15Å; K486-N549 PolarHBondContact NZ-OD1 3.13Å
487	E	65.7	Low	82.3	Confident	135 Å²	135	57.4 Å²	57.4	63%	0.631	28%	0.284	S	S	*	.			trans	-62.9	125.1	170.6	-64.7	177.4	155.6	0	0	109.2	E489 Q490	E487-E489 PolarHBondContact O-N 3.14Å; E487-E489 VanDerWaalsContact O-N 3.09Å; E487-Q490 HydrophobicContact CB-CG 4.2Å; E487-Q490 WeakPolarHBondContact O-CB 3.47Å; E487-Q490 PolarHBondContact O-N 3.28Å; E487-Q490 PolarHBondContact OE2-NE2 3.2Å
488	Q	60.4	Low	81.7	Confident	133 Å²	133	57.5 Å²	57.5	62%	0.621	29%	0.286	S	S	*	.	G	3₁₀ helix	trans	-57	-31.9	-169.3	-67.8	178.9	-19.3	0	0	113.5	I483 K486 Q490 L491	I483-Q488 HydrophobicContact CD1-CG 4.43Å; K486-Q488 PolarHBondContact O-N 3.34Å; Q488-Q490 PolarHBondContact O-N 2.66Å; Q488-L491 PolarHBondContact O-N 2.86Å; Q488-L491 VanDerWaalsContact O-N 3.15Å
489	E	59.8	Low	80.8	Confident	150 Å²	150	59.6 Å²	59.6	70%	0.701	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-61.3	-24.6	177.5	-54.9	-174.1	171.1	0	0	112.7	E487 I497	E487-E489 PolarHBondContact O-N 3.14Å; E487-E489 VanDerWaalsContact O-N 3.09Å; E489-I497 HydrophobicContact CB-CD1 3.92Å; E489-I497 HydrophobicContact CG-CD1 3.92Å
490	Q	64.4	Low	80.1	Confident	137 Å²	137	58.4 Å²	58.4	64%	0.64	29%	0.29	S	S	*	.	G	3₁₀ helix	trans	-88.5	-4.5	-179.5	-51.8	-174.1	22.7	0	0	113.6	E487 Q488	E487-Q490 HydrophobicContact CB-CG 4.2Å; E487-Q490 WeakPolarHBondContact O-CB 3.47Å; E487-Q490 PolarHBondContact O-N 3.28Å; E487-Q490 PolarHBondContact OE2-NE2 3.2Å; Q488-Q490 PolarHBondContact O-N 2.66Å
491	L	82	Confident	79.7	Confident	18 Å²	18	63.6 Å²	63.6	9%	0.094	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	-18.4	-173.9	-83.4	174.1	0	0	0	114.8	I483 K486 Q488 I546	I483-L491 HydrophobicContact CD1-CD1 3.62Å; K486-L491 HydrophobicContact CB-CD1 3.99Å; K486-L491 HydrophobicContact CB-CG 4.17Å; K486-L491 HydrophobicContact CD-CD1 4.26Å; K486-L491 HydrophobicContact CD-CD2 3.74Å; K486-L491 HydrophobicContact CD-CG 4.15Å; Q488-L491 PolarHBondContact O-N 2.86Å; Q488-L491 VanDerWaalsContact O-N 3.15Å; L491-I546 HydrophobicContact CB-CG2 4.31Å
492	V	87.7	Confident	79.5	Confident	11 Å²	11	64 Å²	64	7%	0.067	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	122.3	175.8	179.8	0	0	0	0	108.9	Y494 I497 L504 K544 I546	V492-Y494 VanDerWaalsContact CG1-O 3.3Å; V492-Y494 WeakPolarHBondContact CG1-O 3.34Å; V492-I497 HydrophobicContact CB-CG2 4.07Å; V492-I497 HydrophobicContact CG1-CG2 4.27Å; V492-I497 HydrophobicContact CG2-CG2 3.72Å; V492-L504 WeakPolarHBondContact O-CD1 3.4Å; V492-K544 HydrophobicContact CG1-CB 4.13Å; V492-K544 HydrophobicContact CG1-CG 4.1Å; V492-K544 HydrophobicContact CG2-CB 4.32Å; V492-K544 HydrophobicContact CG2-CD 4.24Å; V492-K544 HydrophobicContact CG2-CG 4.31Å; V492-I546 HydrophobicContact CG2-CD1 4.19Å; V492-I546 HydrophobicContact CG2-CG1 4.03Å
493	V	92.3	Very high	79.8	Confident	40 Å²	40	63.4 Å²	63.4	24%	0.242	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	-6.7	179.6	-60.5	0	0	0	0	113.2	T505 D506 Y509 G545 V547	V493-T505 CarbonylContact O-C 3.45Å; V493-T505 WeakPolarHBondContact O-CA 3.32Å; V493-T505 PolarHBondContact O-N 3.06Å; V493-D506 HydrophobicContact CB-CB 4.18Å; V493-D506 HydrophobicContact CG2-CB 4.06Å; V493-D506 PolarHBondContact O-N 2.81Å; V493-Y509 HydrophobicContact CG2-CD2 3.97Å; V493-Y509 HydrophobicContact CG2-CE2 3.66Å; V493-G545 PolarHBondContact N-O 2.78Å; V493-V547 HydrophobicContact CG2-CG2 4.13Å
494	Y	93.8	Very high	80.1	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	138	179	-179.2	-87.8	0	0	0	110.5	V492 L504 Y509 L513 L537 Y538 S539 K544 G545	V492-Y494 VanDerWaalsContact CG1-O 3.3Å; V492-Y494 WeakPolarHBondContact CG1-O 3.34Å; Y494-L504 WeakPolarHBondContact CA-O 3.41Å; Y494-Y509 VanDerWaalsContact CD2-CB 3.47Å; Y494-Y509 HydrophobicContact CD2-CG 4.19Å; Y494-Y509 HydrophobicContact CG-CD1 4.44Å; Y494-Y509 HydrophobicContact CG-CD2 4.45Å; Y494-Y509 AromaticContact CG-CG 3.97Å; Y494-Y509 HydrophobicContact CG-CG 3.97Å; Y494-L513 HydrophobicContact CD1-CD1 4.01Å; Y494-L513 HydrophobicContact CE1-CD1 3.44Å; Y494-L513 VanDerWaalsContact CE1-CD1 3.44Å; Y494-L513 HydrophobicContact CE2-CD1 4.08Å; Y494-L513 VanDerWaalsContact CZ-CD1 3.47Å; Y494-L537 HydrophobicContact CE1-CD2 4.38Å; Y494-L537 HydrophobicContact CE2-CD2 4.04Å; Y494-Y538 PolarHBondContact OH-N 3.3Å; Y494-S539 PolarHBondContact OH-N 3.09Å; Y494-K544 WeakPolarHBondContact O-CA 3.38Å; Y494-G545 PolarHBondContact N-O 2.77Å; Y494-G545 PolarHBondContact O-N 3.11Å
495	G	92.3	Very high	80.6	Confident	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	83.2	-148.3	-179.4	0	0	0	0	0	112.9	V503 L504 C543	G495-V503 CarbonylContact O-C 3.6Å; G495-V503 WeakPolarHBondContact O-CA 3.41Å; G495-L504 PolarHBondContact N-O 3.28Å; G495-L504 PolarHBondContact O-N 3.4Å; G495-C543 WeakPolarHBondContact CA-O 3.17Å
496	S	89	Confident	81.4	Confident	4 Å²	4	57.2 Å²	57.2	3%	0.028	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	153.8	-172.5	-169.8	0	0	0	0	114.4	D498 G500 T502 V541 K544	S496-D498 PolarHBondContact OG-N 3.48Å; S496-D498 PolarHBondContact OG-OD1 3.28Å; S496-D498 VanDerWaalsContact OG-OD1 3.13Å; S496-G500 WeakPolarHBondContact OG-CA 3.48Å; S496-G500 PolarHBondContact OG-N 2.86Å; S496-T502 WeakPolarHBondContact CA-O 3.27Å; S496-T502 VanDerWaalsContact CB-O 3.24Å; S496-T502 WeakPolarHBondContact CB-O 3.45Å; S496-T502 PolarHBondContact OG-O 2.92Å; S496-V541 VanDerWaalsContact CB-O 3.32Å; S496-V541 WeakPolarHBondContact CB-O 3.36Å; S496-V541 PolarHBondContact N-O 2.8Å; S496-K544 WeakPolarHBondContact O-CE 3.3Å; S496-K544 WeakPolarHBondContact O-CG 3.47Å
497	I	84.2	Confident	82.7	Confident	66 Å²	66	61 Å²	61	34%	0.338	30%	0.298	S	S	.	.	S	Bend	trans	-109.9	-10.4	173.5	59.3	171.3	0	0	0	113.7	E489 V492 K544	E489-I497 HydrophobicContact CB-CD1 3.92Å; E489-I497 HydrophobicContact CG-CD1 3.92Å; V492-I497 HydrophobicContact CB-CG2 4.07Å; V492-I497 HydrophobicContact CG1-CG2 4.27Å; V492-I497 HydrophobicContact CG2-CG2 3.72Å; I497-K544 HydrophobicContact CG2-CD 4.38Å
498	D	82.4	Confident	84	Confident	36 Å²	36	60 Å²	60	19%	0.193	29%	0.288	C	S	.	.	S	Bend	trans	-132.6	24.2	-166.5	67.4	8	0	0	0	114.2	S496 K501 T502	S496-D498 PolarHBondContact OG-N 3.48Å; S496-D498 PolarHBondContact OG-OD1 3.28Å; S496-D498 VanDerWaalsContact OG-OD1 3.13Å; D498-K501 PolarHBondContact O-NZ 3.26Å; D498-K501 WeakPolarHBondContact OD1-CA 3.5Å; D498-K501 WeakPolarHBondContact OD1-CB 3.41Å; D498-K501 PolarHBondContact OD1-N 2.91Å; D498-K501 WeakPolarHBondContact OD2-CB 3.23Å; D498-T502 PolarHBondContact OD1-N 2.88Å; D498-T502 VanDerWaalsContact OD2-CB 3.29Å; D498-T502 WeakPolarHBondContact OD2-CB 3.3Å; D498-T502 PolarHBondContact OD2-N 2.96Å; D498-T502 PolarHBondContact OD2-OG1 3.33Å
499	F	76.7	Confident	85.7	Confident	48 Å²	48	53.6 Å²	53.6	21%	0.211	26%	0.259	C	S	.	.	S	Bend	trans	65.6	45.5	-175.4	-50	-74.5	0	0	0	114.1	H427 F431 F750	H427-F499 AromaticContact CD2-CZ 3.87Å; H427-F499 AromaticContact CE1-CE2 3.93Å; H427-F499 AromaticContact CE1-CZ 3.37Å; H427-F499 WeakPolarHBondContact CE1-CZ 3.22Å; H427-F499 AromaticContact ND1-CZ 3.82Å; H427-F499 AromaticContact NE2-CE1 3.86Å; H427-F499 AromaticContact NE2-CZ 3.41Å; H427-F499 WeakPolarHBondContact NE2-CZ 3.33Å; F431-F499 HydrophobicContact CE2-CD1 4.25Å; F431-F499 AromaticContact CE2-CE1 3.8Å; F431-F499 HydrophobicContact CE2-CE1 3.8Å; F431-F499 HydrophobicContact CE2-CZ 4.2Å; F431-F499 HydrophobicContact CZ-CD1 4.43Å; F431-F499 HydrophobicContact CZ-CE1 4.41Å; F499-F750 HydrophobicContact CB-CB 4.11Å; F499-F750 HydrophobicContact CB-CD2 4.09Å; F499-F750 HydrophobicContact CB-CG 4.3Å; F499-F750 WeakPolarHBondContact O-CB 3.26Å
500	G	79	Confident	87.3	Confident	6 Å²	6	49.3 Å²	49.3	6%	0.062	24%	0.239	C	C	.	.	S	Bend	trans	87.8	10.1	168.5	0	0	0	0	0	116	S496	S496-G500 WeakPolarHBondContact OG-CA 3.48Å; S496-G500 PolarHBondContact OG-N 2.86Å
501	K	83.1	Confident	88.7	Confident	120 Å²	120	48.3 Å²	48.3	52%	0.522	23%	0.234	S	C	.	.	S	Bend	trans	-79.1	-48.8	171.8	-38.3	178.6	-169.2	87.4	0	109.3	D498 N529 H530	D498-K501 PolarHBondContact O-NZ 3.26Å; D498-K501 WeakPolarHBondContact OD1-CA 3.5Å; D498-K501 WeakPolarHBondContact OD1-CB 3.41Å; D498-K501 PolarHBondContact OD1-N 2.91Å; D498-K501 WeakPolarHBondContact OD2-CB 3.23Å; K501-N529 CarbonylContact O-C 3.5Å; K501-H530 HydrophobicContact CB-CB 4.49Å; K501-H530 WeakPolarHBondContact O-CB 3.39Å; K501-H530 PolarHBondContact O-N 2.96Å
502	T	87.1	Confident	89.3	Confident	43 Å²	43	48.4 Å²	48.4	26%	0.264	23%	0.234	S	C	.	.	S	Bend	trans	-102	107	171.5	-46.9	0	0	0	0	107.1	S496 D498	S496-T502 WeakPolarHBondContact CA-O 3.27Å; S496-T502 VanDerWaalsContact CB-O 3.24Å; S496-T502 WeakPolarHBondContact CB-O 3.45Å; S496-T502 PolarHBondContact OG-O 2.92Å; D498-T502 PolarHBondContact OD1-N 2.88Å; D498-T502 VanDerWaalsContact OD2-CB 3.29Å; D498-T502 WeakPolarHBondContact OD2-CB 3.3Å; D498-T502 PolarHBondContact OD2-N 2.96Å; D498-T502 PolarHBondContact OD2-OG1 3.33Å
503	V	90.4	Very high	89.7	Confident	1 Å²	1	47.9 Å²	47.9	1%	0.006	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	138.9	173.9	-175	0	0	0	0	108	G495 V527 N529 I535 L537 V541	G495-V503 CarbonylContact O-C 3.6Å; G495-V503 WeakPolarHBondContact O-CA 3.41Å; V503-V527 HydrophobicContact CB-CG2 4.4Å; V503-V527 HydrophobicContact CG1-CG2 3.92Å; V503-V527 HydrophobicContact CG2-CG2 4.19Å; V503-N529 HydrophobicContact CB-CB 4.41Å; V503-I535 HydrophobicContact CB-CD1 4.13Å; V503-I535 HydrophobicContact CG1-CB 4.41Å; V503-I535 HydrophobicContact CG1-CD1 4.2Å; V503-I535 HydrophobicContact CG1-CG2 4.07Å; V503-I535 WeakPolarHBondContact O-CD1 3.22Å; V503-L537 HydrophobicContact CG1-CD1 4.31Å; V503-L537 HydrophobicContact CG1-CD2 4.13Å; V503-V541 HydrophobicContact CG2-CG2 3.8Å
504	L	91.3	Very high	89.8	Confident	74 Å²	74	48.2 Å²	48.2	39%	0.387	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	158	179.8	-61.1	174	0	0	0	110.6	V492 Y494 G495	V492-L504 WeakPolarHBondContact O-CD1 3.4Å; Y494-L504 WeakPolarHBondContact CA-O 3.41Å; G495-L504 PolarHBondContact N-O 3.28Å; G495-L504 PolarHBondContact O-N 3.4Å
505	T	90.7	Very high	89.8	Confident	51 Å²	51	52 Å²	52	31%	0.313	25%	0.252	S	S	.	.			trans	-145.7	152.5	170.6	-172.1	0	0	0	0	110.8	V493 E510 I535	V493-T505 CarbonylContact O-C 3.45Å; V493-T505 WeakPolarHBondContact O-CA 3.32Å; V493-T505 PolarHBondContact O-N 3.06Å; T505-E510 VanDerWaalsContact CG2-OE1 3.29Å; T505-E510 WeakPolarHBondContact CG2-OE1 3.26Å; T505-E510 WeakPolarHBondContact OG1-CG 3.26Å; T505-E510 PolarHBondContact OG1-OE1 2.71Å; T505-I535 HydrophobicContact CG2-CG2 3.82Å
506	D	92.1	Very high	89.9	Confident	37 Å²	37	52 Å²	52	20%	0.198	25%	0.252	C	S	.	.			trans	-138.5	136.4	176.5	179.5	-61.5	0	0	0	108.5	V493 R508 Y509 E510	V493-D506 HydrophobicContact CB-CB 4.18Å; V493-D506 HydrophobicContact CG2-CB 4.06Å; V493-D506 PolarHBondContact O-N 2.81Å; D506-R508 PolarHBondContact O-N 3.44Å; D506-R508 VanDerWaalsContact OD1-CB 3.26Å; D506-R508 WeakPolarHBondContact OD1-CB 3.23Å; D506-R508 WeakPolarHBondContact OD1-CG 3.17Å; D506-R508 IonicContact OD1-CZ 2.64Å; D506-R508 PolarHBondContact OD1-N 2.94Å; D506-R508 IonicContact OD1-NE 2.69Å; D506-R508 PolarHBondContact OD1-NE 2.93Å; D506-R508 IonicContact OD1-NH2 3.41Å; D506-R508 IonicContact OD2-CZ 3.31Å; D506-R508 IonicContact OD2-NE 2.7Å; D506-R508 PolarHBondContact OD2-NE 3.22Å; D506-R508 IonicContact OD2-NH2 2.74Å; D506-R508 PolarHBondContact OD2-NH2 3.18Å; D506-Y509 HydrophobicContact CB-CD2 4.27Å; D506-Y509 WeakPolarHBondContact O-CA 3.34Å; D506-Y509 WeakPolarHBondContact O-CB 3.49Å; D506-Y509 PolarHBondContact O-N 2.73Å; D506-E510 PolarHBondContact O-N 3.31Å
507	K	92.9	Very high	90.2	Very high	171 Å²	171	51.9 Å²	51.9	74%	0.743	25%	0.251	S	S	*	.	H	α-helix	trans	-57.2	-27.3	-174.1	-63.7	-175.5	178.2	-176.7	0	114	E510 E511	K507-E510 PolarHBondContact O-N 3.48Å; K507-E511 PolarHBondContact O-N 2.96Å
508	R	93.1	Very high	90.5	Very high	113 Å²	113	55.4 Å²	55.4	43%	0.426	26%	0.264	S	S	.	.	H	α-helix	trans	-65.1	-44.4	175.2	-63.6	170.4	-75.3	-179.2	-2.3	110.7	D506 E511 L512	D506-R508 PolarHBondContact O-N 3.44Å; D506-R508 VanDerWaalsContact OD1-CB 3.26Å; D506-R508 WeakPolarHBondContact OD1-CB 3.23Å; D506-R508 WeakPolarHBondContact OD1-CG 3.17Å; D506-R508 IonicContact OD1-CZ 2.64Å; D506-R508 PolarHBondContact OD1-N 2.94Å; D506-R508 IonicContact OD1-NE 2.69Å; D506-R508 PolarHBondContact OD1-NE 2.93Å; D506-R508 IonicContact OD1-NH2 3.41Å; D506-R508 IonicContact OD2-CZ 3.31Å; D506-R508 IonicContact OD2-NE 2.7Å; D506-R508 PolarHBondContact OD2-NE 3.22Å; D506-R508 IonicContact OD2-NH2 2.74Å; D506-R508 PolarHBondContact OD2-NH2 3.18Å; R508-E511 PolarHBondContact O-N 2.89Å; R508-L512 WeakPolarHBondContact O-CB 3.19Å; R508-L512 VanDerWaalsContact O-CG 3.27Å; R508-L512 WeakPolarHBondContact O-CG 3.12Å; R508-L512 PolarHBondContact O-N 3.08Å
509	Y	95.1	Very high	90.9	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-70.3	-36.5	174.7	-77.6	-75.7	0	0	0	112	L459 V493 Y494 D506 E511 L513 G545 I546 V547 T553 Y554	L459-Y509 HydrophobicContact CD1-CD1 4.37Å; L459-Y509 HydrophobicContact CD1-CE1 4.05Å; V493-Y509 HydrophobicContact CG2-CD2 3.97Å; V493-Y509 HydrophobicContact CG2-CE2 3.66Å; Y494-Y509 VanDerWaalsContact CD2-CB 3.47Å; Y494-Y509 HydrophobicContact CD2-CG 4.19Å; Y494-Y509 HydrophobicContact CG-CD1 4.44Å; Y494-Y509 HydrophobicContact CG-CD2 4.45Å; Y494-Y509 AromaticContact CG-CG 3.97Å; Y494-Y509 HydrophobicContact CG-CG 3.97Å; D506-Y509 HydrophobicContact CB-CD2 4.27Å; D506-Y509 WeakPolarHBondContact O-CA 3.34Å; D506-Y509 WeakPolarHBondContact O-CB 3.49Å; D506-Y509 PolarHBondContact O-N 2.73Å; Y509-E511 VanDerWaalsContact C-N 3.34Å; Y509-E511 PolarHBondContact O-N 3.44Å; Y509-L513 HydrophobicContact CD1-CD1 3.96Å; Y509-L513 HydrophobicContact CD1-CG 4.22Å; Y509-L513 WeakPolarHBondContact O-CA 3.25Å; Y509-L513 WeakPolarHBondContact O-CB 3.47Å; Y509-L513 WeakPolarHBondContact O-CG 3.41Å; Y509-L513 PolarHBondContact O-N 2.88Å; Y509-G545 WeakPolarHBondContact OH-CA 3.44Å; Y509-I546 PolarHBondContact OH-N 3.46Å; Y509-I546 VanDerWaalsContact OH-N 3.14Å; Y509-I546 PolarHBondContact OH-O 2.81Å; Y509-V547 HydrophobicContact CE2-CG2 4.17Å; Y509-T553 VanDerWaalsContact OH-C 3.26Å; Y509-T553 WeakPolarHBondContact OH-CA 3.3Å; Y509-T553 WeakPolarHBondContact OH-CB 3.45Å; Y509-Y554 PolarHBondContact OH-N 3.46Å; Y509-Y554 PolarHBondContact OH-O 2.71Å
510	E	93.4	Very high	91.6	Very high	59 Å²	59	56.7 Å²	56.7	28%	0.276	27%	0.27	S	S	.	.	H	α-helix	trans	-58.6	-45.1	173.3	-64.3	173.6	179.7	0	0	111.6	T505 D506 K507 S514 Y538	T505-E510 VanDerWaalsContact CG2-OE1 3.29Å; T505-E510 WeakPolarHBondContact CG2-OE1 3.26Å; T505-E510 WeakPolarHBondContact OG1-CG 3.26Å; T505-E510 PolarHBondContact OG1-OE1 2.71Å; D506-E510 PolarHBondContact O-N 3.31Å; K507-E510 PolarHBondContact O-N 3.48Å; E510-S514 VanDerWaalsContact O-CB 3.24Å; E510-S514 WeakPolarHBondContact O-CB 3.33Å; E510-S514 PolarHBondContact O-N 3.34Å; E510-S514 VanDerWaalsContact O-N 3.11Å; E510-S514 PolarHBondContact O-OG 3.39Å; E510-Y538 HydrophobicContact CB-CE2 4.02Å; E510-Y538 HydrophobicContact CG-CE2 4.1Å
511	E	93.9	Very high	92.3	Very high	117 Å²	117	59.1 Å²	59.1	55%	0.547	28%	0.279	S	S	.	.	H	α-helix	trans	-68.1	-50.6	177.5	-159.4	-160.3	134.7	0	0	112.4	K507 R508 Y509 S514 K515	K507-E511 PolarHBondContact O-N 2.96Å; R508-E511 PolarHBondContact O-N 2.89Å; Y509-E511 VanDerWaalsContact C-N 3.34Å; Y509-E511 PolarHBondContact O-N 3.44Å; E511-S514 PolarHBondContact O-OG 2.92Å; E511-K515 WeakPolarHBondContact OE1-CE 3.36Å; E511-K515 IonicContact OE1-NZ 3.3Å; E511-K515 PolarHBondContact OE1-NZ 2.83Å
512	L	94.9	Very high	92.8	Very high	19 Å²	19	53.7 Å²	53.7	10%	0.099	26%	0.255	C	S	.	.	H	α-helix	trans	-67	-38.7	-176.6	-69.3	169.9	0	0	0	112.8	Q456 P457 G458 L459 R508 T516 T553	Q456-L512 HydrophobicContact CG-CD2 4.26Å; P457-L512 VanDerWaalsContact O-CD2 3.23Å; P457-L512 WeakPolarHBondContact O-CD2 3.42Å; G458-L512 WeakPolarHBondContact O-CD1 3.31Å; L459-L512 HydrophobicContact CB-CB 4.41Å; L459-L512 HydrophobicContact CB-CD1 4.33Å; L459-L512 HydrophobicContact CB-CD2 4.48Å; L459-L512 HydrophobicContact CD1-CB 4.41Å; L459-L512 HydrophobicContact CD1-CD1 4.47Å; R508-L512 WeakPolarHBondContact O-CB 3.19Å; R508-L512 VanDerWaalsContact O-CG 3.27Å; R508-L512 WeakPolarHBondContact O-CG 3.12Å; R508-L512 PolarHBondContact O-N 3.08Å; L512-T516 PolarHBondContact O-N 3.41Å; L512-T516 PolarHBondContact O-OG1 3.47Å; L512-T553 HydrophobicContact CD1-CG2 4.41Å; L512-T553 VanDerWaalsContact CD1-OG1 3.25Å; L512-T553 WeakPolarHBondContact CD1-OG1 3.27Å
513	L	95.8	Very high	93	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-81.8	-26.4	-178.1	-56.3	-178.6	0	0	0	112.8	Y451 L459 Y494 Y509 K515 T516 A517 Y538 I555	Y451-L513 HydrophobicContact CE1-CD2 4.04Å; L459-L513 HydrophobicContact CD1-CD2 3.91Å; L459-L513 HydrophobicContact CD2-CD2 3.65Å; L459-L513 HydrophobicContact CG-CD2 4.46Å; Y494-L513 HydrophobicContact CD1-CD1 4.01Å; Y494-L513 HydrophobicContact CE1-CD1 3.44Å; Y494-L513 VanDerWaalsContact CE1-CD1 3.44Å; Y494-L513 HydrophobicContact CE2-CD1 4.08Å; Y494-L513 VanDerWaalsContact CZ-CD1 3.47Å; Y509-L513 HydrophobicContact CD1-CD1 3.96Å; Y509-L513 HydrophobicContact CD1-CG 4.22Å; Y509-L513 WeakPolarHBondContact O-CA 3.25Å; Y509-L513 WeakPolarHBondContact O-CB 3.47Å; Y509-L513 WeakPolarHBondContact O-CG 3.41Å; Y509-L513 PolarHBondContact O-N 2.88Å; L513-K515 PolarHBondContact O-N 3.24Å; L513-T516 WeakPolarHBondContact CA-OG1 3.37Å; L513-T516 PolarHBondContact O-N 3.1Å; L513-T516 PolarHBondContact O-OG1 2.88Å; L513-A517 WeakPolarHBondContact O-CB 3.43Å; L513-A517 PolarHBondContact O-N 3.35Å; L513-Y538 HydrophobicContact CB-CG 4.41Å; L513-I555 HydrophobicContact CD1-CD1 4.39Å; L513-I555 HydrophobicContact CD2-CD1 3.72Å
514	S	94.5	Very high	93.2	Very high	47 Å²	47	55.3 Å²	55.3	33%	0.329	26%	0.264	S	S	.	.	H	α-helix	trans	-58.1	-36.2	170.2	71.7	0	0	0	0	112.8	E510 E511	E510-S514 VanDerWaalsContact O-CB 3.24Å; E510-S514 WeakPolarHBondContact O-CB 3.33Å; E510-S514 PolarHBondContact O-N 3.34Å; E510-S514 VanDerWaalsContact O-N 3.11Å; E510-S514 PolarHBondContact O-OG 3.39Å; E511-S514 PolarHBondContact O-OG 2.92Å
515	K	94.1	Very high	93.3	Very high	80 Å²	80	51.8 Å²	51.8	35%	0.348	25%	0.246	S	C	.	.	H	α-helix	trans	-73.2	-41.5	179.5	-61.8	169.1	-168.1	171	0	112.5	E511 L513 Q519	E511-K515 WeakPolarHBondContact OE1-CE 3.36Å; E511-K515 IonicContact OE1-NZ 3.3Å; E511-K515 PolarHBondContact OE1-NZ 2.83Å; L513-K515 PolarHBondContact O-N 3.24Å; K515-Q519 PolarHBondContact O-NE2 2.87Å
516	T	94.5	Very high	93.4	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-78.5	-37	179.6	51.3	0	0	0	0	112.4	Y451 L454 Q456 L459 L512 L513 K518 Q519 L520	Y451-T516 HydrophobicContact CD1-CG2 4.44Å; L454-T516 HydrophobicContact CB-CG2 4.44Å; L454-T516 HydrophobicContact CD1-CG2 3.57Å; Q456-T516 HydrophobicContact CB-CG2 3.62Å; Q456-T516 HydrophobicContact CG-CG2 3.85Å; L459-T516 HydrophobicContact CD2-CG2 3.91Å; L512-T516 PolarHBondContact O-N 3.41Å; L512-T516 PolarHBondContact O-OG1 3.47Å; L513-T516 WeakPolarHBondContact CA-OG1 3.37Å; L513-T516 PolarHBondContact O-N 3.1Å; L513-T516 PolarHBondContact O-OG1 2.88Å; T516-K518 VanDerWaalsContact C-N 3.32Å; T516-K518 PolarHBondContact O-N 3.15Å; T516-Q519 WeakPolarHBondContact O-CB 3.4Å; T516-Q519 PolarHBondContact O-N 3.48Å; T516-L520 PolarHBondContact O-N 3.37Å
517	A	94.3	Very high	93.5	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-56.1	-44.1	176.5	0	0	0	0	0	112.4	L513 Q519 L520 K521 I522	L513-A517 WeakPolarHBondContact O-CB 3.43Å; L513-A517 PolarHBondContact O-N 3.35Å; A517-Q519 PolarHBondContact O-N 3.26Å; A517-L520 PolarHBondContact O-N 3.42Å; A517-K521 PolarHBondContact O-N 3.12Å; A517-I522 HydrophobicContact CB-CB 3.98Å; A517-I522 HydrophobicContact CB-CG2 4.38Å; A517-I522 PolarHBondContact O-N 3.05Å
518	K	90.7	Very high	93.4	Very high	140 Å²	140	43.2 Å²	43.2	61%	0.609	20%	0.204	S	C	*	.	H	α-helix	trans	-60.9	-31.8	176.9	-172.7	174.5	-177.6	178.5	0	113.2	T516	T516-K518 VanDerWaalsContact C-N 3.32Å; T516-K518 PolarHBondContact O-N 3.15Å
519	Q	90.7	Very high	93.2	Very high	99 Å²	99	38.8 Å²	38.8	46%	0.463	19%	0.188	S	C	.	.	H	α-helix	trans	-78.1	-50	177.7	-62.8	-176.1	67.7	0	0	110.8	L454 K515 T516 A517 K521	L454-Q519 HydrophobicContact CD2-CB 3.84Å; K515-Q519 PolarHBondContact O-NE2 2.87Å; T516-Q519 WeakPolarHBondContact O-CB 3.4Å; T516-Q519 PolarHBondContact O-N 3.48Å; A517-Q519 PolarHBondContact O-N 3.26Å; Q519-K521 PolarHBondContact O-N 2.7Å; Q519-K521 VanDerWaalsContact O-N 3.13Å
520	L	92.1	Very high	92.6	Very high	13 Å²	13	45.1 Å²	45.1	7%	0.068	22%	0.218	C	C	.	.	H	α-helix	trans	-70.6	-1.4	177.9	-62.7	176.4	0	0	0	114.8	A450 Y451 L454 T516 A517 I522 T561	A450-L520 HydrophobicContact CB-CD2 4.04Å; Y451-L520 HydrophobicContact CD1-CD1 4.26Å; Y451-L520 HydrophobicContact CD2-CD1 4.05Å; Y451-L520 HydrophobicContact CE1-CD1 3.93Å; Y451-L520 HydrophobicContact CE2-CD1 3.71Å; Y451-L520 HydrophobicContact CG-CD1 4.33Å; L454-L520 HydrophobicContact CD1-CD1 3.95Å; L454-L520 HydrophobicContact CD1-CD2 3.99Å; L454-L520 HydrophobicContact CD1-CG 3.74Å; L454-L520 HydrophobicContact CD2-CD2 4.27Å; L454-L520 HydrophobicContact CG-CD2 4.43Å; T516-L520 PolarHBondContact O-N 3.37Å; A517-L520 PolarHBondContact O-N 3.42Å; L520-I522 VanDerWaalsContact C-N 3.29Å; L520-I522 HydrophobicContact CB-CD1 3.83Å; L520-I522 HydrophobicContact CB-CG1 3.9Å; L520-I522 HydrophobicContact CD1-CD1 3.89Å; L520-I522 PolarHBondContact O-N 3.39Å; L520-T561 HydrophobicContact CD1-CG2 4.04Å
521	K	93.2	Very high	92.2	Very high	57 Å²	57	46 Å²	46	25%	0.248	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	59	36	-173.9	-45	-56.2	175.1	-169.7	0	112.9	A517 Q519 I604 F608 T741 F742	A517-K521 PolarHBondContact O-N 3.12Å; Q519-K521 PolarHBondContact O-N 2.7Å; Q519-K521 VanDerWaalsContact O-N 3.13Å; K521-I604 HydrophobicContact CB-CG2 4.27Å; K521-I604 HydrophobicContact CG-CG2 4.35Å; K521-F608 HydrophobicContact CD-CD2 4.08Å; K521-F608 HydrophobicContact CD-CE2 4.02Å; K521-F608 HydrophobicContact CG-CD2 4.47Å; K521-T741 CarbonylContact O-C 3.58Å; K521-T741 VanDerWaalsContact O-CA 3.24Å; K521-T741 WeakPolarHBondContact O-CA 3.48Å; K521-T741 WeakPolarHBondContact O-CB 3.48Å; K521-F742 PolarHBondContact O-N 2.86Å
522	I	93.4	Very high	91.8	Very high	5 Å²	5	42.8 Å²	42.8	3%	0.026	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-88.5	132	174.9	-62.2	171.6	0	0	0	109.5	A517 L520 Y538 T561 F742 P744	A517-I522 HydrophobicContact CB-CB 3.98Å; A517-I522 HydrophobicContact CB-CG2 4.38Å; A517-I522 PolarHBondContact O-N 3.05Å; L520-I522 VanDerWaalsContact C-N 3.29Å; L520-I522 HydrophobicContact CB-CD1 3.83Å; L520-I522 HydrophobicContact CB-CG1 3.9Å; L520-I522 HydrophobicContact CD1-CD1 3.89Å; L520-I522 PolarHBondContact O-N 3.39Å; I522-Y538 WeakPolarHBondContact CG2-O 3.36Å; I522-T561 HydrophobicContact CD1-CG2 4.25Å; I522-F742 WeakPolarHBondContact CA-O 3.48Å; I522-P744 HydrophobicContact CG2-CG 4.21Å
523	K	92.8	Very high	91.6	Very high	23 Å²	23	46.2 Å²	46.2	10%	0.1	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-84.6	124.9	178.4	-171.9	-173.4	168.9	-170.1	0	110.6	H525 T741 F742 N743 S760 D764	K523-H525 PolarHBondContact O-N 3.4Å; K523-H525 PolarHBondContact O-ND1 3.47Å; K523-T741 WeakPolarHBondContact CA-OG1 3.19Å; K523-T741 VanDerWaalsContact CB-OG1 3.24Å; K523-T741 WeakPolarHBondContact CB-OG1 3.14Å; K523-F742 VanDerWaalsContact CB-C 3.5Å; K523-F742 PolarHBondContact N-O 2.88Å; K523-N743 HydrophobicContact CB-CB 4.43Å; K523-N743 HydrophobicContact CD-CB 4.32Å; K523-S760 PolarHBondContact NZ-O 3.12Å; K523-S760 PolarHBondContact NZ-OG 2.79Å; K523-D764 WeakPolarHBondContact CD-OD1 3.37Å; K523-D764 WeakPolarHBondContact CE-OD1 3.37Å; K523-D764 IonicContact NZ-OD1 3.16Å; K523-D764 PolarHBondContact NZ-OD1 2.91Å; K523-D764 IonicContact NZ-OD2 2.72Å; K523-D764 PolarHBondContact NZ-OD2 2.89Å
524	P	93.7	Very high	91.4	Very high	55 Å²	55	49.7 Å²	49.7	36%	0.357	27%	0.268	S	S	.	.	P	Polyproline II helix	trans	-64.4	131.5	167.3	-17.5	31.2	0	0	0	110.3	L537 Y538	P524-L537 WeakPolarHBondContact CA-O 3.33Å; P524-Y538 HydrophobicContact CB-CD1 3.81Å; P524-Y538 HydrophobicContact CB-CE1 3.76Å; P524-Y538 HydrophobicContact CG-CD1 3.74Å; P524-Y538 HydrophobicContact CG-CE1 3.79Å
525	H	93.3	Very high	91.3	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.005	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	160.9	-171.9	62.7	-87.3	0	0	0	111.1	K523 Q536 L537 S539 D745 F753	K523-H525 PolarHBondContact O-N 3.4Å; K523-H525 PolarHBondContact O-ND1 3.47Å; H525-Q536 CarbonylContact O-C 3.58Å; H525-Q536 WeakPolarHBondContact O-CA 3.49Å; H525-L537 PolarHBondContact N-O 3.32Å; H525-L537 VanDerWaalsContact N-O 3.13Å; H525-L537 PolarHBondContact O-N 3.44Å; H525-S539 PolarHBondContact CE1-O 2.85Å; H525-D745 IonicContact CE1-OD2 3.87Å; H525-D745 IonicContact NE2-OD2 2.73Å; H525-D745 PolarHBondContact NE2-OD2 3.45Å; H525-F753 AromaticContact CD2-CE1 3.82Å
526	K	94.2	Very high	91.3	Very high	63 Å²	63	47.7 Å²	47.7	27%	0.274	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	127.5	-172.6	-67.6	172.3	-167.8	148.2	0	112.9	T534 I535 Q536 F753 C754 E757	K526-T534 HydrophobicContact CB-CG2 3.9Å; K526-T534 HydrophobicContact CD-CG2 4.11Å; K526-T534 HydrophobicContact CG-CG2 4.23Å; K526-I535 WeakPolarHBondContact CA-O 3.18Å; K526-Q536 HydrophobicContact CG-CB 4.08Å; K526-Q536 HydrophobicContact CG-CG 4.16Å; K526-F753 WeakPolarHBondContact O-CA 3.43Å; K526-C754 HydrophobicContact CB-CB 3.72Å; K526-C754 PolarHBondContact O-N 2.89Å; K526-E757 HydrophobicContact CB-CG 3.99Å; K526-E757 WeakPolarHBondContact CD-OE1 3.43Å; K526-E757 IonicContact NZ-OE1 2.9Å
527	V	92.8	Very high	91.3	Very high	3 Å²	3	47.7 Å²	47.7	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	159.9	177.1	-58.1	0	0	0	0	110.6	V503 T534 I535 L537 V751 K752 F753	V503-V527 HydrophobicContact CB-CG2 4.4Å; V503-V527 HydrophobicContact CG1-CG2 3.92Å; V503-V527 HydrophobicContact CG2-CG2 4.19Å; V527-T534 CarbonylContact O-C 3.53Å; V527-T534 WeakPolarHBondContact O-CA 3.3Å; V527-I535 HydrophobicContact CG2-CB 4.45Å; V527-I535 PolarHBondContact N-O 2.85Å; V527-I535 PolarHBondContact O-N 2.8Å; V527-L537 HydrophobicContact CG1-CD1 4.35Å; V527-L537 HydrophobicContact CG2-CD1 3.9Å; V527-L537 HydrophobicContact CG2-CG 4.16Å; V527-V751 HydrophobicContact CB-CG1 4.4Å; V527-V751 HydrophobicContact CG1-CG1 3.6Å; V527-K752 CarbonylContact C-O 3.32Å; V527-K752 VanDerWaalsContact CA-O 3.3Å; V527-K752 WeakPolarHBondContact CA-O 3.38Å; V527-F753 HydrophobicContact CG1-CD1 4.25Å; V527-F753 HydrophobicContact CG1-CE1 4.37Å
528	V	91.5	Very high	91.3	Very high	13 Å²	13	49.6 Å²	49.6	8%	0.079	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	117.9	-177.8	179.5	0	0	0	0	109.1	D533 K752 C754	V528-D533 WeakPolarHBondContact CA-O 3.37Å; V528-K752 HydrophobicContact CB-CD 4.06Å; V528-K752 HydrophobicContact CB-CG 4.3Å; V528-K752 HydrophobicContact CG1-CD 4.23Å; V528-K752 PolarHBondContact N-O 3.04Å; V528-C754 HydrophobicContact CG2-CB 3.97Å
529	N	88.7	Confident	91.5	Very high	19 Å²	19	43 Å²	43	10%	0.102	23%	0.234	C	C	.	.			trans	-73.7	177.2	178.4	76	9.4	0	0	0	112	K501 V503 S531 G532 D533	K501-N529 CarbonylContact O-C 3.5Å; V503-N529 HydrophobicContact CB-CB 4.41Å; N529-S531 PolarHBondContact O-N 3.18Å; N529-S531 VanDerWaalsContact O-N 3.15Å; N529-S531 WeakPolarHBondContact OD1-CA 3.28Å; N529-S531 VanDerWaalsContact OD1-CB 3.27Å; N529-S531 WeakPolarHBondContact OD1-CB 3.45Å; N529-S531 PolarHBondContact OD1-N 3.35Å; N529-G532 PolarHBondContact O-N 2.89Å; N529-G532 PolarHBondContact OD1-N 2.91Å; N529-D533 PolarHBondContact N-O 3.34Å; N529-D533 VanDerWaalsContact N-O 3.08Å; N529-D533 PolarHBondContact ND2-OD2 3.02Å; N529-D533 PolarHBondContact OD1-N 2.76Å; N529-D533 PolarHBondContact OD1-OD2 2.53Å
530	H	83.1	Confident	91.5	Very high	133 Å²	133	38.4 Å²	38.4	62%	0.616	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-20.1	-180	68.7	41.2	0	0	0	114.4	K501	K501-H530 HydrophobicContact CB-CB 4.49Å; K501-H530 WeakPolarHBondContact O-CB 3.39Å; K501-H530 PolarHBondContact O-N 2.96Å
531	S	84.9	Confident	91.6	Very high	79 Å²	79	37.9 Å²	37.9	55%	0.552	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-16.2	178.4	-51.2	0	0	0	0	112.2	N529 D533	N529-S531 PolarHBondContact O-N 3.18Å; N529-S531 VanDerWaalsContact O-N 3.15Å; N529-S531 WeakPolarHBondContact OD1-CA 3.28Å; N529-S531 VanDerWaalsContact OD1-CB 3.27Å; N529-S531 WeakPolarHBondContact OD1-CB 3.45Å; N529-S531 PolarHBondContact OD1-N 3.35Å; S531-D533 WeakPolarHBondContact CB-OD2 3.17Å
532	G	85.8	Confident	91.3	Very high	49 Å²	49	36 Å²	36	51%	0.505	20%	0.203	S	C	.	.	S	Bend	trans	95.2	3.2	-172.7	0	0	0	0	0	114.4	N529	N529-G532 PolarHBondContact O-N 2.89Å; N529-G532 PolarHBondContact OD1-N 2.91Å
533	D	89.3	Confident	91.3	Very high	91 Å²	91	35.9 Å²	35.9	49%	0.487	20%	0.202	S	C	.	.			trans	-72.1	132.6	177.7	-47.2	-59.3	0	0	0	110	V528 N529 S531	V528-D533 WeakPolarHBondContact CA-O 3.37Å; N529-D533 PolarHBondContact N-O 3.34Å; N529-D533 VanDerWaalsContact N-O 3.08Å; N529-D533 PolarHBondContact ND2-OD2 3.02Å; N529-D533 PolarHBondContact OD1-N 2.76Å; N529-D533 PolarHBondContact OD1-OD2 2.53Å; S531-D533 WeakPolarHBondContact CB-OD2 3.17Å
534	T	92	Very high	91.3	Very high	72 Å²	72	36.6 Å²	36.6	44%	0.442	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	120.6	173.6	-62.8	0	0	0	0	110.1	K526 V527 C754	K526-T534 HydrophobicContact CB-CG2 3.9Å; K526-T534 HydrophobicContact CD-CG2 4.11Å; K526-T534 HydrophobicContact CG-CG2 4.23Å; V527-T534 CarbonylContact O-C 3.53Å; V527-T534 WeakPolarHBondContact O-CA 3.3Å; T534-C754 HydrophobicContact CG2-CB 3.83Å; T534-C754 VanDerWaalsContact CG2-SG 3.59Å; T534-C754 PolarHBondContact OG1-SG 3.36Å
535	I	92.5	Very high	91.3	Very high	18 Å²	18	34 Å²	34	9%	0.092	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	137.2	-178.2	-66.9	171	0	0	0	109	V503 T505 K526 V527 L537	V503-I535 HydrophobicContact CB-CD1 4.13Å; V503-I535 HydrophobicContact CG1-CB 4.41Å; V503-I535 HydrophobicContact CG1-CD1 4.2Å; V503-I535 HydrophobicContact CG1-CG2 4.07Å; V503-I535 WeakPolarHBondContact O-CD1 3.22Å; T505-I535 HydrophobicContact CG2-CG2 3.82Å; K526-I535 WeakPolarHBondContact CA-O 3.18Å; V527-I535 HydrophobicContact CG2-CB 4.45Å; V527-I535 PolarHBondContact N-O 2.85Å; V527-I535 PolarHBondContact O-N 2.8Å; I535-L537 HydrophobicContact CG2-CD2 4.12Å
536	Q	94	Very high	91.4	Very high	68 Å²	68	34.4 Å²	34.4	32%	0.318	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	121.6	177.5	-172	170.4	-56.6	0	0	110.7	H525 K526 Y538	H525-Q536 CarbonylContact O-C 3.58Å; H525-Q536 WeakPolarHBondContact O-CA 3.49Å; K526-Q536 HydrophobicContact CG-CB 4.08Å; K526-Q536 HydrophobicContact CG-CG 4.16Å; Q536-Y538 PolarHBondContact NE2-OH 2.83Å; Q536-Y538 VanDerWaalsContact NE2-OH 3.12Å
537	L	94.1	Very high	91.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	161.5	177.5	-60.5	-179.8	0	0	0	111.4	Y494 V503 P524 H525 V527 I535 V541	Y494-L537 HydrophobicContact CE1-CD2 4.38Å; Y494-L537 HydrophobicContact CE2-CD2 4.04Å; V503-L537 HydrophobicContact CG1-CD1 4.31Å; V503-L537 HydrophobicContact CG1-CD2 4.13Å; P524-L537 WeakPolarHBondContact CA-O 3.33Å; H525-L537 PolarHBondContact N-O 3.32Å; H525-L537 VanDerWaalsContact N-O 3.13Å; H525-L537 PolarHBondContact O-N 3.44Å; V527-L537 HydrophobicContact CG1-CD1 4.35Å; V527-L537 HydrophobicContact CG2-CD1 3.9Å; V527-L537 HydrophobicContact CG2-CG 4.16Å; I535-L537 HydrophobicContact CG2-CD2 4.12Å; L537-V541 HydrophobicContact CD1-CB 3.98Å; L537-V541 HydrophobicContact CD1-CG2 4.2Å
538	Y	95	Very high	91.2	Very high	41 Å²	41	32.7 Å²	32.7	16%	0.161	19%	0.186	C	C	.	.	S	Bend	trans	-133.8	5.3	-177.5	-66.1	-88.1	0	0	0	111.2	Y494 E510 L513 I522 P524 Q536	Y494-Y538 PolarHBondContact OH-N 3.3Å; E510-Y538 HydrophobicContact CB-CE2 4.02Å; E510-Y538 HydrophobicContact CG-CE2 4.1Å; L513-Y538 HydrophobicContact CB-CG 4.41Å; I522-Y538 WeakPolarHBondContact CG2-O 3.36Å; P524-Y538 HydrophobicContact CB-CD1 3.81Å; P524-Y538 HydrophobicContact CB-CE1 3.76Å; P524-Y538 HydrophobicContact CG-CD1 3.74Å; P524-Y538 HydrophobicContact CG-CE1 3.79Å; Q536-Y538 PolarHBondContact NE2-OH 2.83Å; Q536-Y538 VanDerWaalsContact NE2-OH 3.12Å
539	S	93.7	Very high	91.2	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.007	20%	0.2	C	C	.	.	S	Bend	trans	-147.4	-174.4	172.3	-160.8	0	0	0	0	107.2	Y451 Y494 H525	Y451-S539 PolarHBondContact OH-OG 2.95Å; Y494-S539 PolarHBondContact OH-N 3.09Å; H525-S539 PolarHBondContact CE1-O 2.85Å
540	S	92.4	Very high	91.3	Very high	3 Å²	3	36.3 Å²	36.3	2%	0.021	21%	0.206	C	C	.	.			trans	-68.9	150.2	173.8	179.9	0	0	0	0	111.8	D542 C543 R560 D745 Q748	S540-D542 PolarHBondContact O-N 2.86Å; S540-D542 PolarHBondContact OG-N 3Å; S540-C543 WeakPolarHBondContact O-CB 3.37Å; S540-C543 PolarHBondContact O-N 3.34Å; S540-C543 VanDerWaalsContact O-N 3.09Å; S540-R560 WeakPolarHBondContact OG-CB 3.46Å; S540-D745 VanDerWaalsContact CA-OD1 3.31Å; S540-D745 WeakPolarHBondContact CA-OD1 3.49Å; S540-D745 VanDerWaalsContact CB-OD1 3.27Å; S540-D745 WeakPolarHBondContact CB-OD1 3.34Å; S540-D745 PolarHBondContact OG-OD1 2.83Å; S540-Q748 PolarHBondContact OG-NE2 2.92Å
541	V	92.3	Very high	91.8	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.006	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-27.2	173.1	73.5	0	0	0	0	113.5	S496 V503 L537 C543 D745 V751	S496-V541 VanDerWaalsContact CB-O 3.32Å; S496-V541 WeakPolarHBondContact CB-O 3.36Å; S496-V541 PolarHBondContact N-O 2.8Å; V503-V541 HydrophobicContact CG2-CG2 3.8Å; L537-V541 HydrophobicContact CD1-CB 3.98Å; L537-V541 HydrophobicContact CD1-CG2 4.2Å; V541-C543 PolarHBondContact O-N 3.26Å; V541-D745 WeakPolarHBondContact CB-OD2 3.41Å; V541-D745 PolarHBondContact N-OD1 3.09Å; V541-D745 PolarHBondContact N-OD2 2.93Å; V541-V751 HydrophobicContact CB-CG2 4.26Å; V541-V751 HydrophobicContact CG1-CG2 3.46Å; V541-V751 VanDerWaalsContact CG1-CG2 3.46Å
542	D	88.3	Confident	92.2	Very high	18 Å²	18	33.5 Å²	33.5	10%	0.096	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	-21	179.2	-72.8	-22.6	0	0	0	111.8	S540 D557 L559 R560	S540-D542 PolarHBondContact O-N 2.86Å; S540-D542 PolarHBondContact OG-N 3Å; D542-D557 WeakPolarHBondContact O-CB 3.23Å; D542-L559 HydrophobicContact CB-CD1 4.23Å; D542-R560 IonicContact OD2-CZ 2.79Å; D542-R560 IonicContact OD2-NE 2.84Å; D542-R560 PolarHBondContact OD2-NE 2.85Å; D542-R560 IonicContact OD2-NH2 3.62Å; D542-R560 PolarHBondContact OD2-NH2 3.4Å
543	C	92.5	Very high	92.7	Very high	2 Å²	2	31.7 Å²	31.7	1%	0.014	17%	0.166	C	C	.	.			trans	-67	144.5	176.4	-177.1	0	0	0	0	110.9	G495 S540 V541 I555	G495-C543 WeakPolarHBondContact CA-O 3.17Å; S540-C543 WeakPolarHBondContact O-CB 3.37Å; S540-C543 PolarHBondContact O-N 3.34Å; S540-C543 VanDerWaalsContact O-N 3.09Å; V541-C543 PolarHBondContact O-N 3.26Å; C543-I555 VanDerWaalsContact SG-CD1 3.52Å; C543-I555 WeakPolarHBondContact SG-CG1 3.4Å
544	K	93.2	Very high	93	Very high	39 Å²	39	27.3 Å²	27.3	17%	0.17	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	131.6	177.3	-66.2	164.7	-164.1	158.4	0	111	V492 Y494 S496 I497 L556 D557	V492-K544 HydrophobicContact CG1-CB 4.13Å; V492-K544 HydrophobicContact CG1-CG 4.1Å; V492-K544 HydrophobicContact CG2-CB 4.32Å; V492-K544 HydrophobicContact CG2-CD 4.24Å; V492-K544 HydrophobicContact CG2-CG 4.31Å; Y494-K544 WeakPolarHBondContact O-CA 3.38Å; S496-K544 WeakPolarHBondContact O-CE 3.3Å; S496-K544 WeakPolarHBondContact O-CG 3.47Å; I497-K544 HydrophobicContact CG2-CD 4.38Å; K544-L556 HydrophobicContact CB-CD1 4.19Å; K544-L556 HydrophobicContact CB-CD2 4.45Å; K544-L556 HydrophobicContact CB-CG 4.02Å; K544-L556 HydrophobicContact CD-CD1 4.49Å; K544-L556 PolarHBondContact N-O 2.79Å; K544-L556 WeakPolarHBondContact O-CD2 3.33Å; K544-L556 PolarHBondContact O-N 3.44Å; K544-D557 WeakPolarHBondContact CD-OD2 3.31Å; K544-D557 VanDerWaalsContact CE-OD2 3.24Å; K544-D557 WeakPolarHBondContact CE-OD2 3.29Å; K544-D557 IonicContact NZ-OD2 3.43Å; K544-D557 PolarHBondContact NZ-OD2 3.08Å
545	G	94.6	Very high	93.2	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	122.7	166.7	0	0	0	0	0	110.8	V493 Y494 Y509 Y554	V493-G545 PolarHBondContact N-O 2.78Å; Y494-G545 PolarHBondContact N-O 2.77Å; Y494-G545 PolarHBondContact O-N 3.11Å; Y509-G545 WeakPolarHBondContact OH-CA 3.44Å; G545-Y554 WeakPolarHBondContact CA-O 3.45Å
546	I	94.1	Very high	93.2	Very high	10 Å²	10	24.3 Å²	24.3	5%	0.051	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	145.2	176.3	-65.8	178.3	0	0	0	108.6	I480 I483 L491 V492 Y509 Y554 L556	I480-I546 HydrophobicContact CD1-CB 4.23Å; I480-I546 HydrophobicContact CD1-CD1 4.3Å; I480-I546 HydrophobicContact CD1-CG2 4.23Å; I480-I546 HydrophobicContact CG2-CG2 4.18Å; I483-I546 HydrophobicContact CD1-CD1 3.97Å; L491-I546 HydrophobicContact CB-CG2 4.31Å; V492-I546 HydrophobicContact CG2-CD1 4.19Å; V492-I546 HydrophobicContact CG2-CG1 4.03Å; Y509-I546 PolarHBondContact OH-N 3.46Å; Y509-I546 VanDerWaalsContact OH-N 3.14Å; Y509-I546 PolarHBondContact OH-O 2.81Å; I546-Y554 PolarHBondContact N-O 3.11Å; I546-Y554 PolarHBondContact O-N 3.06Å; I546-L556 HydrophobicContact CB-CD2 4.35Å; I546-L556 HydrophobicContact CD1-CD1 4.5Å; I546-L556 HydrophobicContact CD1-CD2 3.92Å; I546-L556 HydrophobicContact CG1-CD2 4.08Å
547	V	92.9	Very high	93.1	Very high	24 Å²	24	23.6 Å²	23.6	15%	0.145	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	120.3	170.4	-177.2	0	0	0	0	108.2	V493 Y509 R552 T553	V493-V547 HydrophobicContact CG2-CG2 4.13Å; Y509-V547 HydrophobicContact CE2-CG2 4.17Å; V547-R552 WeakPolarHBondContact CA-O 3.49Å; V547-T553 HydrophobicContact CG2-CG2 4.25Å
548	G	91.2	Very high	93.1	Very high	5 Å²	5	23.7 Å²	23.7	5%	0.052	12%	0.123	C	C	.	.			trans	-71.8	167.2	-178.3	0	0	0	0	0	112.5	P481 D550 N551 R552	P481-G548 WeakPolarHBondContact O-CA 3.25Å; G548-D550 VanDerWaalsContact CA-OD1 3.3Å; G548-D550 WeakPolarHBondContact CA-OD1 3.43Å; G548-D550 PolarHBondContact O-N 3.25Å; G548-N551 WeakPolarHBondContact O-CA 3.33Å; G548-N551 PolarHBondContact O-N 3.46Å; G548-R552 PolarHBondContact N-O 3.03Å; G548-R552 VanDerWaalsContact N-O 3.11Å
549	N	91.1	Very high	92.9	Very high	70 Å²	70	22.7 Å²	22.7	37%	0.374	12%	0.12	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-18.4	169.4	-76.1	1	0	0	0	112.4	P481 G482 E485 K486	P481-N549 HydrophobicContact CB-CB 4.25Å; P481-N549 PolarHBondContact O-N 3.22Å; G482-N549 WeakPolarHBondContact CA-ND2 3.49Å; E485-N549 PolarHBondContact OE2-ND2 2.86Å; K486-N549 PolarHBondContact NZ-OD1 3.13Å
550	D	91.3	Very high	92.8	Very high	39 Å²	39	23.8 Å²	23.8	21%	0.209	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-5.6	170.6	65.3	-12.7	0	0	0	113.6	P481 G548 R552 Y554	P481-D550 HydrophobicContact CB-CB 4.37Å; P481-D550 HydrophobicContact CG-CB 4.19Å; G548-D550 VanDerWaalsContact CA-OD1 3.3Å; G548-D550 WeakPolarHBondContact CA-OD1 3.43Å; G548-D550 PolarHBondContact O-N 3.25Å; D550-R552 VanDerWaalsContact C-N 3.25Å; D550-R552 PolarHBondContact O-N 2.65Å; D550-R552 PolarHBondContact OD1-N 2.79Å; D550-R552 WeakPolarHBondContact OD2-CB 3.24Å; D550-R552 VanDerWaalsContact OD2-CD 3.29Å; D550-R552 WeakPolarHBondContact OD2-CD 3.49Å; D550-R552 WeakPolarHBondContact OD2-CG 3.29Å; D550-R552 IonicContact OD2-CZ 2.79Å; D550-R552 IonicContact OD2-NE 3.08Å; D550-R552 IonicContact OD2-NH1 2.7Å; D550-R552 PolarHBondContact OD2-NH1 3.44Å; D550-Y554 PolarHBondContact OD2-OH 2.89Å
551	N	92.1	Very high	92.7	Very high	130 Å²	130	24 Å²	24	70%	0.695	13%	0.125	S	C	*	.			trans	70.5	4.2	-173.9	-47.8	-90.1	0	0	0	115.6	G548	G548-N551 WeakPolarHBondContact O-CA 3.33Å; G548-N551 PolarHBondContact O-N 3.46Å
552	R	94.5	Very high	92.8	Very high	22 Å²	22	24.9 Å²	24.9	8%	0.083	13%	0.129	C	C	.	.			trans	-73.8	148.9	175	-64.9	-174	-175	106.6	-10.4	110.8	E351 E358 Y460 V547 G548 D550 Y554	E351-R552 IonicContact OE1-CZ 3.46Å; E351-R552 IonicContact OE1-NH1 3.57Å; E351-R552 PolarHBondContact OE1-NH1 3.13Å; E351-R552 IonicContact OE1-NH2 2.75Å; E351-R552 PolarHBondContact OE1-NH2 3.45Å; E351-R552 IonicContact OE2-CZ 3.72Å; E351-R552 IonicContact OE2-NH1 3.31Å; E351-R552 PolarHBondContact OE2-NH1 2.87Å; E351-R552 IonicContact OE2-NH2 3.75Å; E358-R552 IonicContact OE1-CZ 3.39Å; E358-R552 IonicContact OE1-NE 2.71Å; E358-R552 PolarHBondContact OE1-NE 3.26Å; E358-R552 IonicContact OE1-NH2 3.73Å; E358-R552 IonicContact OE2-CZ 2.73Å; E358-R552 IonicContact OE2-NE 3.16Å; E358-R552 PolarHBondContact OE2-NE 2.96Å; E358-R552 IonicContact OE2-NH2 2.9Å; E358-R552 PolarHBondContact OE2-NH2 3.36Å; Y460-R552 HydrophobicContact CD2-CB 3.7Å; Y460-R552 HydrophobicContact CD2-CG 4.25Å; Y460-R552 HydrophobicContact CE1-CG 4.16Å; Y460-R552 HydrophobicContact CE2-CB 3.72Å; Y460-R552 HydrophobicContact CE2-CG 3.86Å; Y460-R552 HydrophobicContact CG-CB 4.14Å; V547-R552 WeakPolarHBondContact CA-O 3.49Å; G548-R552 PolarHBondContact N-O 3.03Å; G548-R552 VanDerWaalsContact N-O 3.11Å; D550-R552 VanDerWaalsContact C-N 3.25Å; D550-R552 PolarHBondContact O-N 2.65Å; D550-R552 PolarHBondContact OD1-N 2.79Å; D550-R552 WeakPolarHBondContact OD2-CB 3.24Å; D550-R552 VanDerWaalsContact OD2-CD 3.29Å; D550-R552 WeakPolarHBondContact OD2-CD 3.49Å; D550-R552 WeakPolarHBondContact OD2-CG 3.29Å; D550-R552 IonicContact OD2-CZ 2.79Å; D550-R552 IonicContact OD2-NE 3.08Å; D550-R552 IonicContact OD2-NH1 2.7Å; D550-R552 PolarHBondContact OD2-NH1 3.44Å; R552-Y554 HydrophobicContact CB-CD2 4.36Å; R552-Y554 HydrophobicContact CB-CE2 3.59Å; R552-Y554 WeakPolarHBondContact O-CD2 3.39Å
553	T	95.1	Very high	93	Very high	11 Å²	11	24.3 Å²	24.3	7%	0.067	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	106.7	-178.3	84.1	0	0	0	0	111	G458 Y460 Y509 L512 V547	G458-T553 PolarHBondContact O-OG1 2.92Å; Y460-T553 WeakPolarHBondContact CD2-O 3.26Å; Y460-T553 PolarHBondContact N-O 3.44Å; Y509-T553 VanDerWaalsContact OH-C 3.26Å; Y509-T553 WeakPolarHBondContact OH-CA 3.3Å; Y509-T553 WeakPolarHBondContact OH-CB 3.45Å; L512-T553 HydrophobicContact CD1-CG2 4.41Å; L512-T553 VanDerWaalsContact CD1-OG1 3.25Å; L512-T553 WeakPolarHBondContact CD1-OG1 3.27Å; V547-T553 HydrophobicContact CG2-CG2 4.25Å
554	Y	95.8	Very high	92.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	124.1	-174.1	-67	-84.6	0	0	0	112.2	N350 Q354 Y460 L462 I480 Y509 G545 I546 D550 R552	N350-Y554 PolarHBondContact ND2-OH 2.89Å; Q354-Y554 HydrophobicContact CG-CE1 4.15Å; Y460-Y554 WeakPolarHBondContact O-CA 3.41Å; L462-Y554 HydrophobicContact CD2-CD1 3.8Å; L462-Y554 HydrophobicContact CD2-CE1 4.28Å; I480-Y554 HydrophobicContact CD1-CD2 4.36Å; I480-Y554 HydrophobicContact CD1-CG 3.95Å; I480-Y554 HydrophobicContact CG1-CD1 4.13Å; I480-Y554 HydrophobicContact CG1-CD2 4.15Å; I480-Y554 HydrophobicContact CG1-CG 3.89Å; I480-Y554 HydrophobicContact CG2-CD2 3.73Å; I480-Y554 HydrophobicContact CG2-CE2 3.94Å; I480-Y554 HydrophobicContact CG2-CG 4.34Å; Y509-Y554 PolarHBondContact OH-N 3.46Å; Y509-Y554 PolarHBondContact OH-O 2.71Å; G545-Y554 WeakPolarHBondContact CA-O 3.45Å; I546-Y554 PolarHBondContact N-O 3.11Å; I546-Y554 PolarHBondContact O-N 3.06Å; D550-Y554 PolarHBondContact OD2-OH 2.89Å; R552-Y554 HydrophobicContact CB-CD2 4.36Å; R552-Y554 HydrophobicContact CB-CE2 3.59Å; R552-Y554 WeakPolarHBondContact O-CD2 3.39Å
555	I	95.5	Very high	92.9	Very high	1 Å²	1	23 Å²	23	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	131.9	172.2	-166.9	178.6	0	0	0	111.1	Y451 L459 Y460 T461 L513 C543 L558	Y451-I555 HydrophobicContact CD1-CD1 4.19Å; Y451-I555 HydrophobicContact CE1-CD1 3.75Å; Y451-I555 HydrophobicContact CE2-CD1 4.25Å; L459-I555 HydrophobicContact CD1-CB 4.09Å; L459-I555 HydrophobicContact CD1-CG2 4.02Å; L459-I555 HydrophobicContact CD2-CG2 4.45Å; L459-I555 HydrophobicContact CG-CG2 4.12Å; Y460-I555 PolarHBondContact O-N 2.76Å; T461-I555 HydrophobicContact CG2-CG2 3.7Å; L513-I555 HydrophobicContact CD1-CD1 4.39Å; L513-I555 HydrophobicContact CD2-CD1 3.72Å; C543-I555 VanDerWaalsContact SG-CD1 3.52Å; C543-I555 WeakPolarHBondContact SG-CG1 3.4Å; I555-L558 HydrophobicContact CD1-CD2 3.85Å; I555-L558 HydrophobicContact CG1-CD2 3.91Å
556	L	94	Very high	92.8	Very high	25 Å²	25	23 Å²	23	13%	0.131	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	177.2	-175	60.4	132.6	0	0	0	112.3	I480 K544 I546	I480-L556 HydrophobicContact CD1-CD2 4.02Å; K544-L556 HydrophobicContact CB-CD1 4.19Å; K544-L556 HydrophobicContact CB-CD2 4.45Å; K544-L556 HydrophobicContact CB-CG 4.02Å; K544-L556 HydrophobicContact CD-CD1 4.49Å; K544-L556 PolarHBondContact N-O 2.79Å; K544-L556 WeakPolarHBondContact O-CD2 3.33Å; K544-L556 PolarHBondContact O-N 3.44Å; I546-L556 HydrophobicContact CB-CD2 4.35Å; I546-L556 HydrophobicContact CD1-CD1 4.5Å; I546-L556 HydrophobicContact CD1-CD2 3.92Å; I546-L556 HydrophobicContact CG1-CD2 4.08Å
557	D	91.8	Very high	92.8	Very high	53 Å²	53	22.6 Å²	22.6	28%	0.283	12%	0.12	S	C	.	.			trans	57.2	51.1	-174.6	-69	-12.5	0	0	0	113	D542 K544 L559	D542-D557 WeakPolarHBondContact O-CB 3.23Å; K544-D557 WeakPolarHBondContact CD-OD2 3.31Å; K544-D557 VanDerWaalsContact CE-OD2 3.24Å; K544-D557 WeakPolarHBondContact CE-OD2 3.29Å; K544-D557 IonicContact NZ-OD2 3.43Å; K544-D557 PolarHBondContact NZ-OD2 3.08Å; D557-L559 PolarHBondContact O-N 3.43Å; D557-L559 VanDerWaalsContact O-N 3.12Å
558	L	93.7	Very high	92.7	Very high	3 Å²	3	21.6 Å²	21.6	2%	0.016	11%	0.113	C	C	.	.			trans	-86.4	25.2	-169.5	-66.7	172.1	0	0	0	113.5	D444 V448 Y451 I555 R560 T561	D444-L558 PolarHBondContact OD1-N 2.75Å; V448-L558 HydrophobicContact CB-CD1 4.47Å; V448-L558 HydrophobicContact CG2-CD1 3.95Å; Y451-L558 HydrophobicContact CD2-CD1 3.82Å; Y451-L558 HydrophobicContact CD2-CD2 3.83Å; Y451-L558 HydrophobicContact CD2-CG 4.43Å; Y451-L558 HydrophobicContact CE2-CD1 4.45Å; Y451-L558 HydrophobicContact CE2-CD2 3.59Å; Y451-L558 HydrophobicContact CG-CD1 4.4Å; I555-L558 HydrophobicContact CD1-CD2 3.85Å; I555-L558 HydrophobicContact CG1-CD2 3.91Å; L558-R560 PolarHBondContact O-N 3.36Å; L558-T561 PolarHBondContact O-N 2.84Å; L558-T561 PolarHBondContact O-OG1 2.92Å
559	L	91	Very high	92.4	Very high	20 Å²	20	21.8 Å²	21.8	11%	0.105	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-8.7	-173	57.9	66.8	0	0	0	115.4	Y428 A440 S443 D542 D557	Y428-L559 HydrophobicContact CE1-CD2 4.16Å; A440-L559 HydrophobicContact CB-CD2 3.85Å; S443-L559 WeakPolarHBondContact CB-O 3.45Å; D542-L559 HydrophobicContact CB-CD1 4.23Å; D557-L559 PolarHBondContact O-N 3.43Å; D557-L559 VanDerWaalsContact O-N 3.12Å
560	R	90.5	Very high	91.4	Very high	24 Å²	24	21 Å²	21	9%	0.091	11%	0.109	C	C	.	.	T	Hydrogen-bonded Turn	trans	-127.5	27	178.2	-86.5	-170.5	-130.3	-87.6	2.5	114.2	S540 D542 L558 F562 P744 Q748	S540-R560 WeakPolarHBondContact OG-CB 3.46Å; D542-R560 IonicContact OD2-CZ 2.79Å; D542-R560 IonicContact OD2-NE 2.84Å; D542-R560 PolarHBondContact OD2-NE 2.85Å; D542-R560 IonicContact OD2-NH2 3.62Å; D542-R560 PolarHBondContact OD2-NH2 3.4Å; L558-R560 PolarHBondContact O-N 3.36Å; R560-F562 PolarHBondContact O-N 2.74Å; R560-F562 VanDerWaalsContact O-N 3.08Å; R560-P744 WeakPolarHBondContact O-CB 3.43Å; R560-Q748 VanDerWaalsContact CD-NE2 3.33Å
561	T	92.2	Very high	89.8	Confident	6 Å²	6	21 Å²	21	4%	0.037	11%	0.109	C	C	.	.	S	Bend	trans	-56	-25.8	174.4	-55.9	0	0	0	0	113.7	A450 Y451 L520 I522 L558	A450-T561 HydrophobicContact CB-CG2 4.46Å; Y451-T561 HydrophobicContact CD2-CG2 4.27Å; Y451-T561 HydrophobicContact CE2-CG2 3.77Å; L520-T561 HydrophobicContact CD1-CG2 4.04Å; I522-T561 HydrophobicContact CD1-CG2 4.25Å; L558-T561 PolarHBondContact O-N 2.84Å; L558-T561 PolarHBondContact O-OG1 2.92Å
562	F	92.7	Very high	88.1	Confident	20 Å²	20	18.6 Å²	18.6	9%	0.088	12%	0.115	C	C	.	.	S	Bend	trans	-119.8	153.1	-179.9	-57.3	-68.9	0	0	0	112.6	A450 R560 T598 L599 Q601	A450-F562 HydrophobicContact CB-CE2 4.09Å; A450-F562 HydrophobicContact CB-CZ 3.7Å; R560-F562 PolarHBondContact O-N 2.74Å; R560-F562 VanDerWaalsContact O-N 3.08Å; F562-T598 VanDerWaalsContact O-CG2 3.31Å; F562-T598 WeakPolarHBondContact O-CG2 3.35Å; F562-L599 VanDerWaalsContact CB-O 3.24Å; F562-L599 WeakPolarHBondContact CB-O 3.31Å; F562-Q601 HydrophobicContact CD1-CB 4.36Å; F562-Q601 HydrophobicContact CE1-CB 3.72Å; F562-Q601 HydrophobicContact CE1-CG 3.85Å; F562-Q601 HydrophobicContact CE2-CB 4.13Å; F562-Q601 HydrophobicContact CZ-CB 3.58Å; F562-Q601 HydrophobicContact CZ-CG 3.87Å
563	P	92.5	Very high	86.1	Confident	6 Å²	6	19.2 Å²	19.2	4%	0.039	12%	0.123	C	C	.	.			trans	-63.6	156.7	-170.3	-22.6	35	0	0	0	114.2	T598 L599 I604 F742 V768	P563-T598 CarbonylContact O-C 3.49Å; P563-T598 VanDerWaalsContact O-CA 3.25Å; P563-T598 WeakPolarHBondContact O-CA 3.23Å; P563-T598 WeakPolarHBondContact O-CB 3.48Å; P563-L599 HydrophobicContact CB-CD1 4.49Å; P563-L599 PolarHBondContact O-N 2.71Å; P563-I604 HydrophobicContact CG-CD1 4.04Å; P563-F742 HydrophobicContact CB-CB 4.49Å; P563-F742 HydrophobicContact CB-CD1 4.4Å; P563-F742 HydrophobicContact CG-CB 3.48Å; P563-F742 VanDerWaalsContact CG-CB 3.48Å; P563-F742 HydrophobicContact CG-CD1 3.8Å; P563-F742 HydrophobicContact CG-CD2 4.34Å; P563-F742 HydrophobicContact CG-CG 3.64Å; P563-V768 HydrophobicContact CB-CG1 4.36Å; P563-V768 HydrophobicContact CB-CG2 4.1Å
564	P	91.9	Very high	84.2	Confident	13 Å²	13	26.9 Å²	26.9	8%	0.084	16%	0.163	C	C	.	.	B	Isolated β-bridge	trans	-65.4	143.9	177.2	27.7	-35.2	0	0	0	112.7	L566 L569 A597 I746 Y747 V768	P564-L566 HydrophobicContact CB-CD2 4.41Å; P564-L566 HydrophobicContact CG-CD2 4.19Å; P564-L566 PolarHBondContact O-N 2.89Å; P564-L569 HydrophobicContact CB-CD2 4.36Å; P564-A597 WeakPolarHBondContact CA-O 3.13Å; P564-I746 HydrophobicContact CG-CG2 4.33Å; P564-Y747 HydrophobicContact CG-CD2 4.41Å; P564-V768 HydrophobicContact CG-CG1 4.48Å; P564-V768 WeakPolarHBondContact O-CG1 3.48Å
565	D	92.8	Very high	82.6	Confident	2 Å²	2	30.6 Å²	30.6	1%	0.011	18%	0.182	C	C	.	.			trans	-86	94.1	173.6	-174.6	-2.8	0	0	0	110.1	N567 Y568 L569 A597 L599 R812 Y813	D565-N567 PolarHBondContact O-N 3Å; D565-N567 VanDerWaalsContact O-N 3.13Å; D565-N567 WeakPolarHBondContact OD1-CB 3.33Å; D565-N567 PolarHBondContact OD1-N 3.22Å; D565-Y568 PolarHBondContact O-N 3.07Å; D565-Y568 WeakPolarHBondContact OD2-CD2 3.43Å; D565-L569 PolarHBondContact O-N 3Å; D565-A597 HydrophobicContact CB-CB 4.2Å; D565-A597 PolarHBondContact N-O 3.44Å; D565-L599 HydrophobicContact CB-CD2 3.8Å; D565-L599 HydrophobicContact CB-CG 4.44Å; D565-R812 IonicContact OD2-NE 2.75Å; D565-Y813 PolarHBondContact OD1-OH 3Å; D565-Y813 VanDerWaalsContact OD2-CE2 3.23Å; D565-Y813 WeakPolarHBondContact OD2-CE2 3.38Å; D565-Y813 PolarHBondContact OD2-OH 3.47Å
566	L	92.3	Very high	81.2	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	21%	0.208	C	C	.	.	G	3₁₀ helix	trans	-63.6	-19.3	-174.9	-54.3	-179.7	0	0	0	113.4	P564 Y568 L569 P577 L579 Y747 V768 C769 C772	P564-L566 HydrophobicContact CB-CD2 4.41Å; P564-L566 HydrophobicContact CG-CD2 4.19Å; P564-L566 PolarHBondContact O-N 2.89Å; L566-Y568 PolarHBondContact O-N 3.41Å; L566-L569 HydrophobicContact CD2-CD2 3.79Å; L566-L569 PolarHBondContact O-N 3.24Å; L566-P577 HydrophobicContact CB-CB 4.18Å; L566-P577 HydrophobicContact CB-CG 4.12Å; L566-P577 HydrophobicContact CD1-CB 3.99Å; L566-P577 HydrophobicContact CD2-CB 4.32Å; L566-P577 HydrophobicContact CD2-CG 4.4Å; L566-P577 HydrophobicContact CG-CB 4.38Å; L566-L579 HydrophobicContact CB-CD2 3.95Å; L566-Y747 HydrophobicContact CD1-CD2 4.49Å; L566-Y747 HydrophobicContact CD1-CE2 3.67Å; L566-Y747 HydrophobicContact CD2-CD1 4.47Å; L566-Y747 HydrophobicContact CD2-CD2 3.53Å; L566-Y747 HydrophobicContact CD2-CE1 4.48Å; L566-Y747 HydrophobicContact CD2-CE2 3.55Å; L566-Y747 HydrophobicContact CD2-CG 4.03Å; L566-Y747 HydrophobicContact CG-CE2 4.26Å; L566-V768 HydrophobicContact CD1-CB 4.14Å; L566-V768 HydrophobicContact CD1-CG1 3.69Å; L566-V768 HydrophobicContact CD2-CG1 4.32Å; L566-V768 HydrophobicContact CG-CG1 3.76Å; L566-C769 HydrophobicContact CD1-CB 4.21Å; L566-C772 HydrophobicContact CB-CB 4.46Å; L566-C772 PolarHBondContact N-SG 3.36Å
567	N	93.4	Very high	80	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-68.2	-14.5	173.4	-65.9	-42.7	0	0	0	112.8	D565 Y588 P589 Y590 C772 Y813	D565-N567 PolarHBondContact O-N 3Å; D565-N567 VanDerWaalsContact O-N 3.13Å; D565-N567 WeakPolarHBondContact OD1-CB 3.33Å; D565-N567 PolarHBondContact OD1-N 3.22Å; N567-Y588 HydrophobicContact CB-CD1 3.59Å; N567-Y588 HydrophobicContact CB-CE1 3.89Å; N567-Y588 HydrophobicContact CB-CG 4.16Å; N567-Y588 WeakPolarHBondContact O-CD1 3.48Å; N567-P589 CarbonylContact O-C 3.59Å; N567-P589 VanDerWaalsContact O-CA 3.29Å; N567-P589 WeakPolarHBondContact O-CA 3.33Å; N567-Y590 PolarHBondContact O-N 3.05Å; N567-C772 PolarHBondContact ND2-O 3.26Å; N567-Y813 WeakPolarHBondContact CB-OH 3.16Å; N567-Y813 PolarHBondContact ND2-OH 3.38Å
568	Y	90.8	Very high	79.3	Confident	3 Å²	3	42.9 Å²	42.9	1%	0.012	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-125.5	14.3	179.2	-70.9	-93.5	0	0	0	113.1	D565 L566 Y588 Y590 H592 R812 Y813 H933	D565-Y568 PolarHBondContact O-N 3.07Å; D565-Y568 WeakPolarHBondContact OD2-CD2 3.43Å; L566-Y568 PolarHBondContact O-N 3.41Å; Y568-Y588 HydrophobicContact CE2-CE1 4.17Å; Y568-Y590 WeakPolarHBondContact CA-O 3.39Å; Y568-Y590 HydrophobicContact CE1-CD2 4.31Å; Y568-H592 HydrophobicContact CD1-CB 4.1Å; Y568-R812 HydrophobicContact CD2-CG 4.11Å; Y568-R812 HydrophobicContact CE1-CB 4.15Å; Y568-R812 HydrophobicContact CE1-CG 4.16Å; Y568-R812 HydrophobicContact CE2-CG 3.71Å; Y568-R812 PolarHBondContact OH-O 3.2Å; Y568-R812 VanDerWaalsContact OH-O 3.1Å; Y568-Y813 HydrophobicContact CD2-CE2 4.26Å; Y568-Y813 HydrophobicContact CE2-CD1 4.37Å; Y568-Y813 HydrophobicContact CE2-CD2 4.24Å; Y568-Y813 AromaticContact CE2-CE1 3.85Å; Y568-Y813 HydrophobicContact CE2-CE1 3.85Å; Y568-Y813 AromaticContact CE2-CE2 3.68Å; Y568-Y813 HydrophobicContact CE2-CE2 3.68Å; Y568-Y813 AromaticContact CE2-CZ 3.47Å; Y568-Y813 VanDerWaalsContact CE2-CZ 3.47Å; Y568-H933 AromaticContact CE1-CD2 3.72Å; Y568-H933 AromaticContact CE1-NE2 3.52Å
569	L	84.5	Confident	78.9	Confident	9 Å²	9	43.6 Å²	43.6	5%	0.047	24%	0.236	C	C	.	.			trans	-110.8	67	-175.5	-163.8	80.1	0	0	0	112.2	P564 D565 L566 N571 M595 Y747	P564-L569 HydrophobicContact CB-CD2 4.36Å; D565-L569 PolarHBondContact O-N 3Å; L566-L569 HydrophobicContact CD2-CD2 3.79Å; L566-L569 PolarHBondContact O-N 3.24Å; L569-N571 PolarHBondContact O-N 3.43Å; L569-N571 VanDerWaalsContact O-N 3.13Å; L569-M595 HydrophobicContact CD1-CB 4.44Å; L569-M595 HydrophobicContact CD1-CE 3.91Å; L569-M595 HydrophobicContact CG-CE 4.27Å; L569-Y747 HydrophobicContact CD2-CG 4.22Å
570	D	71.4	Confident	78.8	Confident	55 Å²	55	43.6 Å²	43.6	29%	0.294	24%	0.238	S	C	.	.			trans	-83.4	84.8	172.6	-161.3	41.2	0	0	0	110.7	G572 R576 P589	D570-G572 PolarHBondContact O-N 2.7Å; D570-R576 IonicContact OD1-CZ 3.32Å; D570-R576 IonicContact OD1-NE 2.65Å; D570-R576 PolarHBondContact OD1-NE 2.73Å; D570-R576 IonicContact OD1-NH2 2.96Å; D570-R576 PolarHBondContact OD1-NH2 3.18Å; D570-R576 VanDerWaalsContact OD1-NH2 3.15Å; D570-P589 HydrophobicContact CB-CG 4.28Å
571	N	58.4	Low	78.8	Confident	38 Å²	38	47.1 Å²	47.1	20%	0.203	26%	0.263	C	S	.	.			trans	-65.8	-4.4	-169.8	-92.7	-16.3	0	0	0	116.4	L569 S573 I575 M595	L569-N571 PolarHBondContact O-N 3.43Å; L569-N571 VanDerWaalsContact O-N 3.13Å; N571-S573 PolarHBondContact O-N 2.86Å; N571-S573 PolarHBondContact O-OG 2.92Å; N571-I575 PolarHBondContact ND2-O 2.9Å; N571-M595 VanDerWaalsContact OD1-CE 3.3Å; N571-M595 WeakPolarHBondContact OD1-CE 3.42Å
572	G	55.7	Low	78.9	Confident	79 Å²	79	51.8 Å²	51.8	81%	0.814	29%	0.285	S	S	*	.	S	Bend	trans	54.1	20.4	178.5	0	0	0	0	0	115.5	D570	D570-G572 PolarHBondContact O-N 2.7Å
573	S	52.5	Low	78.9	Confident	36 Å²	36	50.9 Å²	50.9	25%	0.252	28%	0.281	S	S	.	.	S	Bend	trans	-155.3	175	-170.9	51.3	0	0	0	0	110.3	N571 I575	N571-S573 PolarHBondContact O-N 2.86Å; N571-S573 PolarHBondContact O-OG 2.92Å; S573-I575 PolarHBondContact O-N 2.96Å
574	D	55.8	Low	78.9	Confident	172 Å²	172	54.7 Å²	54.7	92%	0.92	30%	0.304	S	S	*	.	S	Bend	trans	-60.8	-22.3	-161.2	-45.4	-77.1	0	0	0	114.4	R576	D574-R576 VanDerWaalsContact C-N 3.34Å; D574-R576 PolarHBondContact O-N 3.04Å
575	I	61.4	Low	78.9	Confident	77 Å²	77	63 Å²	63	40%	0.395	34%	0.339	S	S	.	.			trans	-89.1	67.4	175.5	-37	178.3	0	0	0	110.5	N571 S573 Y747	N571-I575 PolarHBondContact ND2-O 2.9Å; S573-I575 PolarHBondContact O-N 2.96Å; I575-Y747 HydrophobicContact CG2-CD1 3.7Å; I575-Y747 HydrophobicContact CG2-CE1 4.22Å
576	R	66	Low	79	Confident	143 Å²	143	66 Å²	66	54%	0.54	35%	0.354	S	S	.	.			trans	-92.8	126	172.1	-165.4	178.7	-160.7	-132.5	1.7	110.2	D570 D574 Q578	D570-R576 IonicContact OD1-CZ 3.32Å; D570-R576 IonicContact OD1-NE 2.65Å; D570-R576 PolarHBondContact OD1-NE 2.73Å; D570-R576 IonicContact OD1-NH2 2.96Å; D570-R576 PolarHBondContact OD1-NH2 3.18Å; D570-R576 VanDerWaalsContact OD1-NH2 3.15Å; D574-R576 VanDerWaalsContact C-N 3.34Å; D574-R576 PolarHBondContact O-N 3.04Å; R576-Q578 PolarHBondContact O-N 2.91Å
577	P	68	Low	78.9	Confident	9 Å²	9	67.5 Å²	67.5	6%	0.058	37%	0.37	C	S	.	.			trans	-63.5	134.9	178.3	25.9	-34.2	0	0	0	111.6	L566 L579 Y747	L566-P577 HydrophobicContact CB-CB 4.18Å; L566-P577 HydrophobicContact CB-CG 4.12Å; L566-P577 HydrophobicContact CD1-CB 3.99Å; L566-P577 HydrophobicContact CD2-CB 4.32Å; L566-P577 HydrophobicContact CD2-CG 4.4Å; L566-P577 HydrophobicContact CG-CB 4.38Å; P577-L579 HydrophobicContact CB-CD2 4.25Å; P577-L579 HydrophobicContact CG-CD2 4.46Å; P577-L579 PolarHBondContact O-N 3.45Å; P577-L579 VanDerWaalsContact O-N 3.1Å; P577-Y747 HydrophobicContact CB-CE1 3.75Å; P577-Y747 HydrophobicContact CG-CE1 4.49Å
578	Q	78.2	Confident	78.9	Confident	186 Å²	186	67.9 Å²	67.9	87%	0.869	37%	0.371	S	S	*	.			trans	-80.4	85.8	171.4	-64.9	-168.3	37.9	0	0	109.6	R576	R576-Q578 PolarHBondContact O-N 2.91Å
579	L	84.9	Confident	78.9	Confident	18 Å²	18	68.7 Å²	68.7	9%	0.094	38%	0.377	C	S	.	.			trans	-69.7	150.9	173.3	-56.9	-173.4	0	0	0	111.2	L566 P577 L583 V584 P589	L566-L579 HydrophobicContact CB-CD2 3.95Å; P577-L579 HydrophobicContact CB-CD2 4.25Å; P577-L579 HydrophobicContact CG-CD2 4.46Å; P577-L579 PolarHBondContact O-N 3.45Å; P577-L579 VanDerWaalsContact O-N 3.1Å; L579-L583 HydrophobicContact CB-CB 4.08Å; L579-L583 HydrophobicContact CB-CD1 4.13Å; L579-L583 HydrophobicContact CD1-CB 4.44Å; L579-L583 HydrophobicContact CD2-CD1 4.26Å; L579-V584 HydrophobicContact CB-CG2 4.27Å; L579-P589 HydrophobicContact CD1-CB 4.1Å; L579-P589 HydrophobicContact CD1-CG 4.4Å
580	S	88.5	Confident	79.1	Confident	20 Å²	20	70.3 Å²	70.3	14%	0.14	38%	0.383	C	S	.	.			trans	-63.7	153.1	178.6	52.6	0	0	0	0	113	E582 L583 V584 E773	S580-E582 PolarHBondContact O-N 3.16Å; S580-E582 VanDerWaalsContact O-N 3.11Å; S580-L583 PolarHBondContact O-N 3.26Å; S580-V584 PolarHBondContact O-N 2.72Å; S580-E773 WeakPolarHBondContact CB-OE2 3.17Å; S580-E773 PolarHBondContact OG-OE2 3.29Å
581	P	91.9	Very high	79.9	Confident	98 Å²	98	75.1 Å²	75.1	64%	0.636	40%	0.404	S	S	*	.	H	α-helix	trans	-54.7	-32.7	-179.4	-26.9	35.8	0	0	0	113.6	K585	P581-K585 WeakPolarHBondContact O-CB 3.18Å; P581-K585 PolarHBondContact O-N 2.87Å
582	E	92.7	Very high	81.3	Confident	104 Å²	104	73.9 Å²	73.9	49%	0.486	40%	0.397	S	S	.	.	H	α-helix	trans	-61.5	-47.7	173.9	-74.1	63.3	-149.3	0	0	111.9	S580 K585 L586 L777	S580-E582 PolarHBondContact O-N 3.16Å; S580-E582 VanDerWaalsContact O-N 3.11Å; E582-K585 PolarHBondContact O-N 3.46Å; E582-L586 VanDerWaalsContact O-CG 3.26Å; E582-L586 WeakPolarHBondContact O-CG 3.15Å; E582-L586 PolarHBondContact O-N 2.86Å; E582-L586 VanDerWaalsContact O-N 3.08Å; E582-L777 HydrophobicContact CB-CD1 3.79Å; E582-L777 HydrophobicContact CB-CD2 4.36Å; E582-L777 HydrophobicContact CG-CD1 4.19Å
583	L	93	Very high	82.7	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-65.7	-43.1	176.8	-70.1	176.6	0	0	0	111.6	L579 S580 K585 L586 G587 Y588 E773 V776	L579-L583 HydrophobicContact CB-CB 4.08Å; L579-L583 HydrophobicContact CB-CD1 4.13Å; L579-L583 HydrophobicContact CD1-CB 4.44Å; L579-L583 HydrophobicContact CD2-CD1 4.26Å; S580-L583 PolarHBondContact O-N 3.26Å; L583-K585 VanDerWaalsContact C-N 3.34Å; L583-K585 PolarHBondContact O-N 3.34Å; L583-L586 CarbonylContact O-C 3.57Å; L583-L586 WeakPolarHBondContact O-CA 3.4Å; L583-L586 PolarHBondContact O-N 3.05Å; L583-L586 VanDerWaalsContact O-N 3.09Å; L583-G587 PolarHBondContact O-N 2.83Å; L583-Y588 HydrophobicContact CB-CD2 4.37Å; L583-Y588 HydrophobicContact CD2-CD2 3.98Å; L583-Y588 HydrophobicContact CD2-CE2 4.41Å; L583-Y588 WeakPolarHBondContact O-CD2 3.43Å; L583-Y588 PolarHBondContact O-N 2.98Å; L583-E773 HydrophobicContact CD1-CB 4.05Å; L583-E773 HydrophobicContact CD1-CG 4.42Å; L583-E773 HydrophobicContact CG-CG 4.48Å; L583-V776 HydrophobicContact CD2-CB 3.69Å; L583-V776 HydrophobicContact CD2-CG1 3.87Å; L583-V776 HydrophobicContact CD2-CG2 3.85Å
584	V	92.2	Very high	84.5	Confident	86 Å²	86	70.9 Å²	70.9	52%	0.521	36%	0.356	S	S	.	.	H	α-helix	trans	-62.3	-42.1	176.8	177.6	0	0	0	0	111.1	L579 S580 L586 G587	L579-V584 HydrophobicContact CB-CG2 4.27Å; S580-V584 PolarHBondContact O-N 2.72Å; V584-L586 PolarHBondContact O-N 3.37Å; V584-G587 PolarHBondContact O-N 2.82Å
585	K	93.3	Very high	85.9	Confident	189 Å²	189	64.5 Å²	64.5	82%	0.822	32%	0.321	S	S	*	.	H	α-helix	trans	-63.3	-28.8	174.3	179.7	-179.8	175	-173.9	0	113	P581 E582 L583 G587	P581-K585 WeakPolarHBondContact O-CB 3.18Å; P581-K585 PolarHBondContact O-N 2.87Å; E582-K585 PolarHBondContact O-N 3.46Å; L583-K585 VanDerWaalsContact C-N 3.34Å; L583-K585 PolarHBondContact O-N 3.34Å; K585-G587 VanDerWaalsContact C-N 3.29Å
586	L	93.3	Very high	87.3	Confident	63 Å²	63	61.1 Å²	61.1	33%	0.33	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-1.5	174.1	-68.4	174	0	0	0	113.3	E582 L583 V584 Y588 Y590 V776 L777 R816	E582-L586 VanDerWaalsContact O-CG 3.26Å; E582-L586 WeakPolarHBondContact O-CG 3.15Å; E582-L586 PolarHBondContact O-N 2.86Å; E582-L586 VanDerWaalsContact O-N 3.08Å; L583-L586 CarbonylContact O-C 3.57Å; L583-L586 WeakPolarHBondContact O-CA 3.4Å; L583-L586 PolarHBondContact O-N 3.05Å; L583-L586 VanDerWaalsContact O-N 3.09Å; V584-L586 PolarHBondContact O-N 3.37Å; L586-Y588 HydrophobicContact CB-CD2 4.04Å; L586-Y588 HydrophobicContact CB-CE2 4.1Å; L586-Y590 PolarHBondContact O-OH 3.39Å; L586-V776 HydrophobicContact CD1-CG1 3.67Å; L586-L777 HydrophobicContact CD1-CD2 3.7Å; L586-R816 PolarHBondContact O-NH2 3.37Å
587	G	91.9	Very high	88.5	Confident	33 Å²	33	54.4 Å²	54.4	34%	0.34	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	100	8.2	174	0	0	0	0	0	115.8	L583 V584 K585 Y590	L583-G587 PolarHBondContact O-N 2.83Å; V584-G587 PolarHBondContact O-N 2.82Å; K585-G587 VanDerWaalsContact C-N 3.29Å; G587-Y590 WeakPolarHBondContact O-CE1 3.32Å
588	Y	92.5	Very high	89.6	Confident	7 Å²	7	55 Å²	55	3%	0.027	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-88.1	152.9	-179.8	-62.4	-71.6	0	0	0	112.9	N567 Y568 L583 L586 Y590 V776 Y813 R816	N567-Y588 HydrophobicContact CB-CD1 3.59Å; N567-Y588 HydrophobicContact CB-CE1 3.89Å; N567-Y588 HydrophobicContact CB-CG 4.16Å; N567-Y588 WeakPolarHBondContact O-CD1 3.48Å; Y568-Y588 HydrophobicContact CE2-CE1 4.17Å; L583-Y588 HydrophobicContact CB-CD2 4.37Å; L583-Y588 HydrophobicContact CD2-CD2 3.98Å; L583-Y588 HydrophobicContact CD2-CE2 4.41Å; L583-Y588 WeakPolarHBondContact O-CD2 3.43Å; L583-Y588 PolarHBondContact O-N 2.98Å; L586-Y588 HydrophobicContact CB-CD2 4.04Å; L586-Y588 HydrophobicContact CB-CE2 4.1Å; Y588-Y590 AromaticContact CD1-CD2 3.54Å; Y588-Y590 HydrophobicContact CD1-CD2 3.54Å; Y588-Y590 AromaticContact CD1-CE2 3.83Å; Y588-Y590 HydrophobicContact CD1-CE2 3.83Å; Y588-Y590 HydrophobicContact CD1-CG 4.4Å; Y588-Y590 AromaticContact CE1-CD2 3.44Å; Y588-Y590 HydrophobicContact CE1-CD2 3.44Å; Y588-Y590 VanDerWaalsContact CE1-CD2 3.44Å; Y588-Y590 AromaticContact CE1-CE2 3.53Å; Y588-Y590 HydrophobicContact CE1-CE2 3.53Å; Y588-V776 HydrophobicContact CE2-CB 4.44Å; Y588-V776 HydrophobicContact CE2-CG1 3.7Å; Y588-V776 HydrophobicContact CE2-CG2 3.84Å; Y588-Y813 HydrophobicContact CE1-CE1 4.25Å; Y588-R816 VanDerWaalsContact CZ-NH2 3.31Å; Y588-R816 PolarHBondContact OH-NE 3.34Å; Y588-R816 PolarHBondContact OH-NH2 2.83Å
589	P	90.3	Very high	90.4	Very high	20 Å²	20	46.4 Å²	46.4	13%	0.13	24%	0.242	C	C	.	.	S	Bend	cis	-74.1	142.7	-5.1	32	-34.2	0	0	0	111.4	N567 D570 L579	N567-P589 CarbonylContact O-C 3.59Å; N567-P589 VanDerWaalsContact O-CA 3.29Å; N567-P589 WeakPolarHBondContact O-CA 3.33Å; D570-P589 HydrophobicContact CB-CG 4.28Å; L579-P589 HydrophobicContact CD1-CB 4.1Å; L579-P589 HydrophobicContact CD1-CG 4.4Å
590	Y	90.4	Very high	90.9	Very high	44 Å²	44	48 Å²	48	17%	0.173	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-83.3	139.1	168.6	-72.8	-61.9	0	0	0	110.2	N567 Y568 L586 G587 Y588 H592 H933	N567-Y590 PolarHBondContact O-N 3.05Å; Y568-Y590 WeakPolarHBondContact CA-O 3.39Å; Y568-Y590 HydrophobicContact CE1-CD2 4.31Å; L586-Y590 PolarHBondContact O-OH 3.39Å; G587-Y590 WeakPolarHBondContact O-CE1 3.32Å; Y588-Y590 AromaticContact CD1-CD2 3.54Å; Y588-Y590 HydrophobicContact CD1-CD2 3.54Å; Y588-Y590 AromaticContact CD1-CE2 3.83Å; Y588-Y590 HydrophobicContact CD1-CE2 3.83Å; Y588-Y590 HydrophobicContact CD1-CG 4.4Å; Y588-Y590 AromaticContact CE1-CD2 3.44Å; Y588-Y590 HydrophobicContact CE1-CD2 3.44Å; Y588-Y590 VanDerWaalsContact CE1-CD2 3.44Å; Y588-Y590 AromaticContact CE1-CE2 3.53Å; Y588-Y590 HydrophobicContact CE1-CE2 3.53Å; Y590-H592 PolarHBondContact O-N 3.01Å; Y590-H933 WeakPolarHBondContact CB-NE2 3.29Å; Y590-H933 HydrophobicContact CD1-CB 4.24Å; Y590-H933 AromaticContact CD1-CD2 3.96Å; Y590-H933 AromaticContact CD1-CG 3.81Å; Y590-H933 AromaticContact CD2-CD2 3.62Å; Y590-H933 HydrophobicContact CE1-CB 4.13Å; Y590-H933 HydrophobicContact CE2-CB 4.49Å; Y590-H933 HydrophobicContact CG-CB 4.49Å; Y590-H933 AromaticContact CG-CD2 3.46Å; Y590-H933 VanDerWaalsContact CG-CD2 3.46Å; Y590-H933 AromaticContact CG-CG 3.8Å; Y590-H933 AromaticContact CG-NE2 3.87Å
591	Q	87.1	Confident	91.1	Very high	156 Å²	156	50 Å²	50	73%	0.729	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-68.3	120.3	171.2	-174.3	-176.1	10.6	0	0	109.5	H933	Q591-H933 PolarHBondContact O-CE1 2.5Å
592	H	87.7	Confident	91.2	Very high	11 Å²	11	47.7 Å²	47.7	5%	0.051	24%	0.235	C	C	.	.			trans	-105.9	158.4	176.1	-155.2	50.3	0	0	0	112.1	Y568 Y590 H594 R812 Y931	Y568-H592 HydrophobicContact CD1-CB 4.1Å; Y590-H592 PolarHBondContact O-N 3.01Å; H592-H594 AromaticContact CD2-CD2 3.34Å; H592-H594 PolarHBondContact CD2-CD2 2.82Å; H592-H594 AromaticContact CD2-NE2 3.53Å; H592-H594 AromaticContact NE2-CD2 3.45Å; H592-H594 PolarHBondContact NE2-CD2 3.43Å; H592-H594 AromaticContact NE2-NE2 3.45Å; H592-H594 PolarHBondContact NE2-NE2 3.48Å; H592-H594 PolarHBondContact O-N 3.12Å; H592-R812 PolarHBondContact CD2-NH1 3.45Å; H592-R812 PolarHBondContact NE2-NH1 3.15Å; H592-Y931 AromaticContact CE1-CD2 3.87Å; H592-Y931 AromaticContact CE1-CE1 3.96Å; H592-Y931 AromaticContact CE1-CE2 3.68Å; H592-Y931 AromaticContact CE1-CZ 3.72Å; H592-Y931 AromaticContact NE2-CE2 3.84Å; H592-Y931 AromaticContact NE2-CZ 3.86Å
593	R	86.1	Confident	91.3	Very high	44 Å²	44	42.8 Å²	42.8	17%	0.166	21%	0.212	C	C	.	.	S	Bend	trans	-71.3	-12.5	-179.7	-69.2	-170.6	179.5	158.2	-0.6	114.4	Y435 E927 E930	Y435-R593 HydrophobicContact CD2-CB 4.14Å; Y435-R593 HydrophobicContact CG-CB 4.07Å; Y435-R593 PolarHBondContact OH-NH1 3.15Å; R593-E927 IonicContact CZ-OE1 3.03Å; R593-E927 IonicContact CZ-OE2 3.76Å; R593-E927 IonicContact NH1-OE1 2.66Å; R593-E927 PolarHBondContact NH1-OE1 3.17Å; R593-E927 IonicContact NH1-OE2 2.75Å; R593-E927 PolarHBondContact NH1-OE2 3.07Å; R593-E927 IonicContact NH2-OE1 3.95Å; R593-E927 IonicContact NH2-OE2 3.55Å; R593-E927 PolarHBondContact NH2-OE2 3.32Å; R593-E930 IonicContact CZ-OE2 3.11Å; R593-E930 IonicContact NE-OE2 3.8Å; R593-E930 PolarHBondContact NE-OE2 3.23Å; R593-E930 IonicContact NH2-OE2 3.68Å; R593-E930 PolarHBondContact NH2-OE2 2.83Å
594	H	89	Confident	91.4	Very high	9 Å²	9	43 Å²	43	4%	0.042	21%	0.213	C	C	.	.			trans	-147.7	146.4	176.4	76.5	101	0	0	0	112.3	F431 A436 A439 H592 L596	F431-H594 CarbonylContact O-C 3.57Å; F431-H594 WeakPolarHBondContact O-CA 3.21Å; A436-H594 HydrophobicContact CB-CB 3.91Å; A439-H594 WeakPolarHBondContact CB-CE1 3.35Å; H592-H594 AromaticContact CD2-CD2 3.34Å; H592-H594 PolarHBondContact CD2-CD2 2.82Å; H592-H594 AromaticContact CD2-NE2 3.53Å; H592-H594 AromaticContact NE2-CD2 3.45Å; H592-H594 PolarHBondContact NE2-CD2 3.43Å; H592-H594 AromaticContact NE2-NE2 3.45Å; H592-H594 PolarHBondContact NE2-NE2 3.48Å; H592-H594 PolarHBondContact O-N 3.12Å; H594-L596 VanDerWaalsContact C-N 3.27Å; H594-L596 VanDerWaalsContact CE1-C 3.48Å; H594-L596 PolarHBondContact CE1-O 3.31Å; H594-L596 WeakPolarHBondContact ND1-CB 3.46Å; H594-L596 PolarHBondContact ND1-N 2.98Å; H594-L596 PolarHBondContact O-N 3.28Å
595	M	86.4	Confident	91.4	Very high	38 Å²	38	43.8 Å²	43.8	19%	0.187	21%	0.211	C	C	.	.	S	Bend	trans	-93.7	27.7	-175.7	-48.6	-52.7	-73.9	0	0	112.4	F431 L569 N571	F431-M595 HydrophobicContact CD1-CB 4.37Å; F431-M595 PolarHBondContact O-N 2.86Å; L569-M595 HydrophobicContact CD1-CB 4.44Å; L569-M595 HydrophobicContact CD1-CE 3.91Å; L569-M595 HydrophobicContact CG-CE 4.27Å; N571-M595 VanDerWaalsContact OD1-CE 3.3Å; N571-M595 WeakPolarHBondContact OD1-CE 3.42Å
596	L	89.2	Confident	91.4	Very high	5 Å²	5	36 Å²	36	3%	0.026	18%	0.181	C	C	.	.			trans	-117.4	31.9	176.5	-47.6	177.6	0	0	0	110.6	Y428 F431 A436 A440 H594	Y428-L596 HydrophobicContact CD1-CD1 4.11Å; Y428-L596 HydrophobicContact CE1-CD1 4.06Å; F431-L596 HydrophobicContact CB-CD2 4.11Å; F431-L596 HydrophobicContact CB-CG 4.27Å; F431-L596 HydrophobicContact CD1-CD2 3.99Å; F431-L596 HydrophobicContact CG-CD2 4.08Å; A436-L596 HydrophobicContact CB-CD1 3.96Å; A436-L596 HydrophobicContact CB-CG 4.37Å; A440-L596 HydrophobicContact CB-CD1 4.02Å; H594-L596 VanDerWaalsContact C-N 3.27Å; H594-L596 VanDerWaalsContact CE1-C 3.48Å; H594-L596 PolarHBondContact CE1-O 3.31Å; H594-L596 WeakPolarHBondContact ND1-CB 3.46Å; H594-L596 PolarHBondContact ND1-N 2.98Å; H594-L596 PolarHBondContact O-N 3.28Å
597	A	91.1	Very high	91.5	Very high	2 Å²	2	33 Å²	33	2%	0.017	17%	0.166	C	C	.	.			trans	-78	119.6	172.7	0	0	0	0	0	109.2	P564 D565	P564-A597 WeakPolarHBondContact CA-O 3.13Å; D565-A597 HydrophobicContact CB-CB 4.2Å; D565-A597 PolarHBondContact N-O 3.44Å
598	T	92.9	Very high	91.6	Very high	23 Å²	23	33.5 Å²	33.5	14%	0.141	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-118.5	153.1	177.9	50.7	0	0	0	0	111.7	F562 P563	F562-T598 VanDerWaalsContact O-CG2 3.31Å; F562-T598 WeakPolarHBondContact O-CG2 3.35Å; P563-T598 CarbonylContact O-C 3.49Å; P563-T598 VanDerWaalsContact O-CA 3.25Å; P563-T598 WeakPolarHBondContact O-CA 3.23Å; P563-T598 WeakPolarHBondContact O-CB 3.48Å
599	L	94.5	Very high	91.6	Very high	4 Å²	4	35.8 Å²	35.8	2%	0.021	17%	0.171	C	C	.	.			trans	-67.2	147	166.1	-59.6	-175.8	0	0	0	109.4	F562 P563 D565 L603 I604 A771	F562-L599 VanDerWaalsContact CB-O 3.24Å; F562-L599 WeakPolarHBondContact CB-O 3.31Å; P563-L599 HydrophobicContact CB-CD1 4.49Å; P563-L599 PolarHBondContact O-N 2.71Å; D565-L599 HydrophobicContact CB-CD2 3.8Å; D565-L599 HydrophobicContact CB-CG 4.44Å; L599-L603 HydrophobicContact CB-CD2 4.19Å; L599-L603 HydrophobicContact CD1-CD2 4.43Å; L599-L603 HydrophobicContact CD2-CD2 3.83Å; L599-L603 HydrophobicContact CG-CD2 4.37Å; L599-I604 HydrophobicContact CB-CD1 4.21Å; L599-I604 HydrophobicContact CD1-CD1 4.18Å; L599-A771 HydrophobicContact CD1-CB 3.8Å
600	R	94	Very high	91.7	Very high	53 Å²	53	36.1 Å²	36.1	20%	0.2	17%	0.171	C	C	.	.			trans	-84.9	152.9	179.5	-58.5	-174	54.2	87.1	19.1	112.1	E602 L603 I604 H805 N810	R600-E602 VanDerWaalsContact C-N 3.29Å; R600-E602 WeakPolarHBondContact CB-OE2 3.48Å; R600-E602 IonicContact CZ-OE1 2.78Å; R600-E602 IonicContact CZ-OE2 3.97Å; R600-E602 IonicContact NE-OE1 3.75Å; R600-E602 PolarHBondContact NE-OE1 2.88Å; R600-E602 IonicContact NE-OE2 3.76Å; R600-E602 PolarHBondContact NE-OE2 2.92Å; R600-E602 VanDerWaalsContact NH2-CD 3.29Å; R600-E602 IonicContact NH2-OE1 3.67Å; R600-E602 PolarHBondContact NH2-OE1 2.65Å; R600-E602 IonicContact NH2-OE2 3.54Å; R600-E602 PolarHBondContact NH2-OE2 3.25Å; R600-E602 VanDerWaalsContact NH2-OE2 3.08Å; R600-E602 PolarHBondContact O-N 2.96Å; R600-L603 WeakPolarHBondContact O-CB 3.2Å; R600-L603 PolarHBondContact O-N 2.99Å; R600-I604 PolarHBondContact O-N 2.68Å; R600-H805 PolarHBondContact NH1-CD2 2.84Å; R600-H805 PolarHBondContact NH1-NE2 3.17Å; R600-N810 HydrophobicContact CG-CB 4.47Å
601	Q	93	Very high	91.8	Very high	60 Å²	60	36.5 Å²	36.5	28%	0.28	17%	0.172	S	C	.	.	H	α-helix	trans	-50.2	-47.1	173.2	-174.1	178.5	-25.7	0	0	112.8	F562 L603 I604 E605	F562-Q601 HydrophobicContact CD1-CB 4.36Å; F562-Q601 HydrophobicContact CE1-CB 3.72Å; F562-Q601 HydrophobicContact CE1-CG 3.85Å; F562-Q601 HydrophobicContact CE2-CB 4.13Å; F562-Q601 HydrophobicContact CZ-CB 3.58Å; F562-Q601 HydrophobicContact CZ-CG 3.87Å; Q601-L603 PolarHBondContact O-N 3.11Å; Q601-L603 VanDerWaalsContact O-N 3.13Å; Q601-I604 WeakPolarHBondContact O-CB 3.45Å; Q601-I604 PolarHBondContact O-N 2.89Å; Q601-E605 HydrophobicContact CG-CG 4.49Å; Q601-E605 WeakPolarHBondContact CG-OE1 3.45Å; Q601-E605 PolarHBondContact NE2-OE1 3.45Å; Q601-E605 PolarHBondContact O-N 3.36Å
602	E	94	Very high	92.1	Very high	51 Å²	51	32.1 Å²	32.1	24%	0.238	15%	0.149	C	C	.	.	H	α-helix	trans	-65.1	-21.8	-176.7	-48.3	94.6	144.8	0	0	112.3	R600 A606 H805	R600-E602 VanDerWaalsContact C-N 3.29Å; R600-E602 WeakPolarHBondContact CB-OE2 3.48Å; R600-E602 IonicContact CZ-OE1 2.78Å; R600-E602 IonicContact CZ-OE2 3.97Å; R600-E602 IonicContact NE-OE1 3.75Å; R600-E602 PolarHBondContact NE-OE1 2.88Å; R600-E602 IonicContact NE-OE2 3.76Å; R600-E602 PolarHBondContact NE-OE2 2.92Å; R600-E602 VanDerWaalsContact NH2-CD 3.29Å; R600-E602 IonicContact NH2-OE1 3.67Å; R600-E602 PolarHBondContact NH2-OE1 2.65Å; R600-E602 IonicContact NH2-OE2 3.54Å; R600-E602 PolarHBondContact NH2-OE2 3.25Å; R600-E602 VanDerWaalsContact NH2-OE2 3.08Å; R600-E602 PolarHBondContact O-N 2.96Å; E602-A606 VanDerWaalsContact O-CB 3.3Å; E602-A606 WeakPolarHBondContact O-CB 3.21Å; E602-A606 PolarHBondContact O-N 3.47Å; E602-H805 WeakPolarHBondContact CG-O 3.45Å
603	L	96.2	Very high	92.2	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-79.4	-40.3	171.8	-178.8	64.6	0	0	0	112	L599 R600 Q601 E605 A606 F607 F774 L775 Q779	L599-L603 HydrophobicContact CB-CD2 4.19Å; L599-L603 HydrophobicContact CD1-CD2 4.43Å; L599-L603 HydrophobicContact CD2-CD2 3.83Å; L599-L603 HydrophobicContact CG-CD2 4.37Å; R600-L603 WeakPolarHBondContact O-CB 3.2Å; R600-L603 PolarHBondContact O-N 2.99Å; Q601-L603 PolarHBondContact O-N 3.11Å; Q601-L603 VanDerWaalsContact O-N 3.13Å; L603-E605 VanDerWaalsContact C-N 3.3Å; L603-A606 PolarHBondContact O-N 3.12Å; L603-F607 VanDerWaalsContact O-CB 3.24Å; L603-F607 WeakPolarHBondContact O-CB 3.45Å; L603-F607 PolarHBondContact O-N 3.04Å; L603-F774 HydrophobicContact CD1-CD1 3.79Å; L603-F774 HydrophobicContact CD1-CE1 3.93Å; L603-L775 HydrophobicContact CD1-CB 4.04Å; L603-L775 HydrophobicContact CD1-CD1 3.97Å; L603-L775 HydrophobicContact CD2-CB 3.9Å; L603-L775 HydrophobicContact CD2-CD1 4.16Å; L603-L775 HydrophobicContact CD2-CD2 3.84Å; L603-L775 HydrophobicContact CD2-CG 4.18Å; L603-Q779 HydrophobicContact CD1-CB 4.43Å; L603-Q779 HydrophobicContact CD1-CG 4.21Å
604	I	94.1	Very high	92.4	Very high	5 Å²	5	33.7 Å²	33.7	3%	0.026	16%	0.16	C	C	.	.	H	α-helix	trans	-62.5	-42.4	177.2	-61.6	-57.1	0	0	0	109.8	K521 P563 L599 R600 Q601 F607 F608 F742	K521-I604 HydrophobicContact CB-CG2 4.27Å; K521-I604 HydrophobicContact CG-CG2 4.35Å; P563-I604 HydrophobicContact CG-CD1 4.04Å; L599-I604 HydrophobicContact CB-CD1 4.21Å; L599-I604 HydrophobicContact CD1-CD1 4.18Å; R600-I604 PolarHBondContact O-N 2.68Å; Q601-I604 WeakPolarHBondContact O-CB 3.45Å; Q601-I604 PolarHBondContact O-N 2.89Å; I604-F607 PolarHBondContact O-N 3.41Å; I604-F608 WeakPolarHBondContact O-CB 3.42Å; I604-F608 PolarHBondContact O-N 3.12Å; I604-F742 HydrophobicContact CD1-CD2 4.29Å; I604-F742 HydrophobicContact CD1-CE1 4.43Å; I604-F742 HydrophobicContact CD1-CE2 3.9Å; I604-F742 HydrophobicContact CD1-CZ 3.95Å; I604-F742 HydrophobicContact CG2-CD2 4.1Å; I604-F742 HydrophobicContact CG2-CE2 3.79Å
605	E	92.6	Very high	92.5	Very high	102 Å²	102	33.5 Å²	33.5	48%	0.477	16%	0.159	S	C	.	.	H	α-helix	trans	-63.2	-49.7	173.3	-69.6	168.9	-176.5	0	0	111.9	Q601 L603 F607 F608 D609	Q601-E605 HydrophobicContact CG-CG 4.49Å; Q601-E605 WeakPolarHBondContact CG-OE1 3.45Å; Q601-E605 PolarHBondContact NE2-OE1 3.45Å; Q601-E605 PolarHBondContact O-N 3.36Å; L603-E605 VanDerWaalsContact C-N 3.3Å; E605-F607 VanDerWaalsContact C-N 3.32Å; E605-F607 PolarHBondContact O-N 2.8Å; E605-F608 WeakPolarHBondContact O-CB 3.2Å; E605-F608 PolarHBondContact O-N 3.48Å; E605-D609 PolarHBondContact O-N 2.93Å
606	A	94.1	Very high	92.6	Very high	24 Å²	24	31.9 Å²	31.9	20%	0.198	15%	0.151	C	C	.	.	H	α-helix	trans	-62.4	-35.8	177.5	0	0	0	0	0	113.3	E602 L603 H610 F774	E602-A606 VanDerWaalsContact O-CB 3.3Å; E602-A606 WeakPolarHBondContact O-CB 3.21Å; E602-A606 PolarHBondContact O-N 3.47Å; L603-A606 PolarHBondContact O-N 3.12Å; A606-H610 VanDerWaalsContact O-CB 3.26Å; A606-H610 WeakPolarHBondContact O-CB 3.43Å; A606-H610 PolarHBondContact O-N 2.96Å; A606-F774 HydrophobicContact CB-CE1 4.2Å; A606-F774 HydrophobicContact CB-CZ 4.49Å
607	F	95.2	Very high	92.6	Very high	2 Å²	2	35.2 Å²	35.2	1%	0.009	16%	0.163	C	C	.	.	H	α-helix	trans	-71	-38.5	175.3	178.6	-104.6	0	0	0	112	L603 I604 E605 H610 R611 L740 F742 L767 S770 A771 F774	L603-F607 VanDerWaalsContact O-CB 3.24Å; L603-F607 WeakPolarHBondContact O-CB 3.45Å; L603-F607 PolarHBondContact O-N 3.04Å; I604-F607 PolarHBondContact O-N 3.41Å; E605-F607 VanDerWaalsContact C-N 3.32Å; E605-F607 PolarHBondContact O-N 2.8Å; F607-H610 PolarHBondContact O-N 3.35Å; F607-R611 HydrophobicContact CD1-CG 4.33Å; F607-R611 HydrophobicContact CD2-CG 4.38Å; F607-R611 HydrophobicContact CE1-CG 4.04Å; F607-R611 HydrophobicContact CE2-CG 4.1Å; F607-R611 HydrophobicContact CZ-CG 3.93Å; F607-R611 WeakPolarHBondContact O-CB 3.36Å; F607-R611 VanDerWaalsContact O-CG 3.3Å; F607-R611 WeakPolarHBondContact O-CG 3.49Å; F607-R611 PolarHBondContact O-N 3.36Å; F607-L740 HydrophobicContact CD1-CD1 4.36Å; F607-L740 HydrophobicContact CD1-CD2 4.38Å; F607-L740 HydrophobicContact CE1-CD1 3.98Å; F607-L740 HydrophobicContact CE1-CD2 4.3Å; F607-F742 HydrophobicContact CD1-CE2 4.43Å; F607-F742 AromaticContact CD1-CZ 3.74Å; F607-F742 HydrophobicContact CD1-CZ 3.74Å; F607-F742 HydrophobicContact CE1-CE1 4.48Å; F607-F742 AromaticContact CE1-CZ 3.79Å; F607-F742 HydrophobicContact CE1-CZ 3.79Å; F607-L767 HydrophobicContact CE1-CD1 3.85Å; F607-L767 HydrophobicContact CZ-CD1 4.19Å; F607-S770 WeakPolarHBondContact CE2-O 3.3Å; F607-A771 HydrophobicContact CD1-CB 4.23Å; F607-A771 HydrophobicContact CD2-CB 4.34Å; F607-A771 HydrophobicContact CE1-CB 4.22Å; F607-A771 HydrophobicContact CE2-CB 4.34Å; F607-A771 HydrophobicContact CG-CB 4.27Å; F607-A771 HydrophobicContact CZ-CB 4.27Å; F607-F774 HydrophobicContact CB-CD1 3.99Å; F607-F774 HydrophobicContact CB-CE1 4.18Å; F607-F774 HydrophobicContact CD2-CB 3.6Å; F607-F774 AromaticContact CD2-CD1 3.94Å; F607-F774 HydrophobicContact CD2-CD1 3.94Å; F607-F774 HydrophobicContact CD2-CD2 4.15Å; F607-F774 AromaticContact CD2-CG 3.63Å; F607-F774 HydrophobicContact CD2-CG 3.63Å; F607-F774 HydrophobicContact CE2-CB 3.97Å; F607-F774 HydrophobicContact CE2-CG 4.41Å; F607-F774 HydrophobicContact CG-CD1 4.47Å
608	F	93.3	Very high	92.5	Very high	43 Å²	43	37.9 Å²	37.9	19%	0.189	18%	0.177	C	C	.	.	H	α-helix	trans	-62	-50.2	173.7	-175.8	-82.1	0	0	0	110.9	K521 I604 E605 H610 R611 Y612 F738 L740	K521-F608 HydrophobicContact CD-CD2 4.08Å; K521-F608 HydrophobicContact CD-CE2 4.02Å; K521-F608 HydrophobicContact CG-CD2 4.47Å; I604-F608 WeakPolarHBondContact O-CB 3.42Å; I604-F608 PolarHBondContact O-N 3.12Å; E605-F608 WeakPolarHBondContact O-CB 3.2Å; E605-F608 PolarHBondContact O-N 3.48Å; F608-H610 PolarHBondContact O-N 2.9Å; F608-R611 PolarHBondContact O-N 3.32Å; F608-Y612 WeakPolarHBondContact O-CB 3.33Å; F608-Y612 PolarHBondContact O-N 3.03Å; F608-F738 HydrophobicContact CD1-CE1 4.14Å; F608-F738 AromaticContact CD2-CE1 3.97Å; F608-F738 HydrophobicContact CD2-CE1 3.97Å; F608-F738 HydrophobicContact CE1-CD1 4.3Å; F608-F738 AromaticContact CE1-CE1 3.84Å; F608-F738 HydrophobicContact CE1-CE1 3.84Å; F608-F738 HydrophobicContact CE2-CD1 4.25Å; F608-F738 AromaticContact CE2-CE1 3.65Å; F608-F738 HydrophobicContact CE2-CE1 3.65Å; F608-F738 HydrophobicContact CG-CE1 4.2Å; F608-F738 AromaticContact CZ-CD1 3.89Å; F608-F738 HydrophobicContact CZ-CD1 3.89Å; F608-F738 AromaticContact CZ-CE1 3.57Å; F608-F738 HydrophobicContact CZ-CE1 3.57Å; F608-L740 HydrophobicContact CD2-CB 4.04Å; F608-L740 HydrophobicContact CD2-CD2 4.46Å; F608-L740 HydrophobicContact CE2-CB 4.14Å
609	D	92.2	Very high	92.2	Very high	55 Å²	55	36.8 Å²	36.8	29%	0.294	17%	0.17	S	C	.	.	H	α-helix	trans	-60.4	-42.4	177.4	-119	17.5	0	0	0	111.4	E605 Y612 E613 I686 K1353	E605-D609 PolarHBondContact O-N 2.93Å; D609-Y612 PolarHBondContact O-N 3.13Å; D609-E613 PolarHBondContact O-N 3.19Å; D609-I686 WeakPolarHBondContact OD2-CG2 3.41Å; D609-K1353 IonicContact OD1-NZ 3.35Å; D609-K1353 PolarHBondContact OD1-NZ 3.04Å; D609-K1353 IonicContact OD2-NZ 3.49Å; D609-K1353 PolarHBondContact OD2-NZ 3.46Å
610	H	92.9	Very high	91.8	Very high	27 Å²	27	37.1 Å²	37.1	13%	0.125	17%	0.174	C	C	.	.	H	α-helix	trans	-64.6	-41.9	175.9	175.1	76.4	0	0	0	113.2	A606 F607 F608 I614 F774	A606-H610 VanDerWaalsContact O-CB 3.26Å; A606-H610 WeakPolarHBondContact O-CB 3.43Å; A606-H610 PolarHBondContact O-N 2.96Å; F607-H610 PolarHBondContact O-N 3.35Å; F608-H610 PolarHBondContact O-N 2.9Å; H610-I614 VanDerWaalsContact NE2-CD1 3.28Å; H610-I614 WeakPolarHBondContact NE2-CD1 3.47Å; H610-I614 WeakPolarHBondContact O-CG1 3.41Å; H610-I614 PolarHBondContact O-N 3.46Å; H610-F774 HydrophobicContact CB-CD2 4.43Å; H610-F774 HydrophobicContact CB-CE2 3.6Å; H610-F774 HydrophobicContact CB-CZ 3.94Å; H610-F774 AromaticContact CD2-CD2 3.75Å; H610-F774 AromaticContact CD2-CE2 3.64Å; H610-F774 AromaticContact CG-CD2 3.96Å; H610-F774 AromaticContact CG-CE2 3.35Å; H610-F774 AromaticContact ND1-CE2 3.85Å
611	R	92.7	Very high	91.4	Very high	52 Å²	52	38.8 Å²	38.8	20%	0.196	19%	0.186	C	C	.	.	H	α-helix	trans	-68.2	-36.4	175.6	-76	-83.3	179.1	165.9	-4.8	111.4	F607 F608 I614 F615 V730 F738 L740 S770	F607-R611 HydrophobicContact CD1-CG 4.33Å; F607-R611 HydrophobicContact CD2-CG 4.38Å; F607-R611 HydrophobicContact CE1-CG 4.04Å; F607-R611 HydrophobicContact CE2-CG 4.1Å; F607-R611 HydrophobicContact CZ-CG 3.93Å; F607-R611 WeakPolarHBondContact O-CB 3.36Å; F607-R611 VanDerWaalsContact O-CG 3.3Å; F607-R611 WeakPolarHBondContact O-CG 3.49Å; F607-R611 PolarHBondContact O-N 3.36Å; F608-R611 PolarHBondContact O-N 3.32Å; R611-I614 PolarHBondContact O-N 3.43Å; R611-F615 PolarHBondContact O-N 3.28Å; R611-V730 PolarHBondContact NH1-O 3.47Å; R611-F738 HydrophobicContact CB-CE2 3.87Å; R611-F738 HydrophobicContact CB-CZ 3.61Å; R611-L740 HydrophobicContact CB-CD1 3.91Å; R611-L740 HydrophobicContact CG-CD1 3.89Å; R611-S770 VanDerWaalsContact NH2-CB 3.3Å; R611-S770 PolarHBondContact NH2-OG 3.27Å; R611-S770 VanDerWaalsContact NH2-OG 3.15Å
612	Y	92.1	Very high	91.1	Very high	64 Å²	64	37.4 Å²	37.4	25%	0.251	18%	0.179	S	C	.	.	H	α-helix	trans	-68	-39.1	174.9	-175.8	-123	0	0	0	112.6	F608 D609 I614 F615 L616 F738	F608-Y612 WeakPolarHBondContact O-CB 3.33Å; F608-Y612 PolarHBondContact O-N 3.03Å; D609-Y612 PolarHBondContact O-N 3.13Å; Y612-I614 VanDerWaalsContact C-N 3.33Å; Y612-I614 PolarHBondContact O-N 3.42Å; Y612-F615 HydrophobicContact CD2-CD1 4.02Å; Y612-F615 HydrophobicContact CE2-CD1 4.05Å; Y612-F615 HydrophobicContact CE2-CE1 4.45Å; Y612-F615 WeakPolarHBondContact O-CB 3.23Å; Y612-F615 PolarHBondContact O-N 3.22Å; Y612-L616 HydrophobicContact CD1-CD1 4.23Å; Y612-L616 HydrophobicContact CE1-CD1 3.79Å; Y612-L616 HydrophobicContact CE1-CG 4.34Å; Y612-L616 HydrophobicContact CE2-CD2 4.18Å; Y612-L616 HydrophobicContact CE2-CG 4.19Å; Y612-L616 WeakPolarHBondContact O-CG 3.19Å; Y612-L616 PolarHBondContact O-N 3.39Å; Y612-F738 HydrophobicContact CD2-CB 4.03Å; Y612-F738 AromaticContact CD2-CD1 3.56Å; Y612-F738 HydrophobicContact CD2-CD1 3.56Å; Y612-F738 HydrophobicContact CD2-CE1 4.19Å; Y612-F738 AromaticContact CD2-CG 3.83Å; Y612-F738 HydrophobicContact CD2-CG 3.83Å; Y612-F738 HydrophobicContact CE2-CB 4.39Å; Y612-F738 HydrophobicContact CE2-CD1 4.47Å; Y612-F738 HydrophobicContact CG-CD1 4.13Å; Y612-F738 HydrophobicContact CG-CE1 4.33Å
613	E	89.7	Confident	90.4	Very high	34 Å²	34	35.7 Å²	35.7	16%	0.159	17%	0.172	C	C	.	.	H	α-helix	trans	-60.8	-41.7	173.4	-165.9	-160.4	-163	0	0	111.6	D609 R617 L700	D609-E613 PolarHBondContact O-N 3.19Å; E613-R617 VanDerWaalsContact CD-CZ 3.43Å; E613-R617 WeakPolarHBondContact O-CG 3.42Å; E613-R617 PolarHBondContact O-N 3.08Å; E613-R617 VanDerWaalsContact O-N 3.13Å; E613-R617 IonicContact OE1-CZ 3.76Å; E613-R617 IonicContact OE1-NH1 3.75Å; E613-R617 PolarHBondContact OE1-NH1 2.78Å; E613-R617 IonicContact OE1-NH2 3.58Å; E613-R617 PolarHBondContact OE1-NH2 2.69Å; E613-R617 IonicContact OE2-CZ 3.82Å; E613-R617 IonicContact OE2-NH1 2.71Å; E613-R617 PolarHBondContact OE2-NH1 2.65Å; E613-L700 HydrophobicContact CG-CD2 4.33Å
614	I	91	Very high	89.7	Confident	53 Å²	53	39.8 Å²	39.8	27%	0.272	19%	0.191	S	C	.	.	H	α-helix	trans	-64.4	-43.6	173.6	-65.7	174	0	0	0	110.8	H610 R611 Y612 L616 R617 L618 V730	H610-I614 VanDerWaalsContact NE2-CD1 3.28Å; H610-I614 WeakPolarHBondContact NE2-CD1 3.47Å; H610-I614 WeakPolarHBondContact O-CG1 3.41Å; H610-I614 PolarHBondContact O-N 3.46Å; R611-I614 PolarHBondContact O-N 3.43Å; Y612-I614 VanDerWaalsContact C-N 3.33Å; Y612-I614 PolarHBondContact O-N 3.42Å; I614-L616 PolarHBondContact O-N 2.97Å; I614-R617 PolarHBondContact O-N 3.49Å; I614-L618 HydrophobicContact CG2-CD1 3.77Å; I614-L618 HydrophobicContact CG2-CG 4.09Å; I614-L618 WeakPolarHBondContact O-CB 3.33Å; I614-L618 WeakPolarHBondContact O-CG 3.26Å; I614-L618 PolarHBondContact O-N 2.95Å; I614-V730 HydrophobicContact CB-CG1 4.14Å; I614-V730 HydrophobicContact CG2-CG1 3.69Å
615	F	91	Very high	89.1	Confident	6 Å²	6	45.1 Å²	45.1	3%	0.026	21%	0.214	C	C	.	.	H	α-helix	trans	-57	-49.9	177.3	168.8	-99.1	0	0	0	111.9	R611 Y612 R617 L618 T619 L707 I723 A726 A727 V730 F738	R611-F615 PolarHBondContact O-N 3.28Å; Y612-F615 HydrophobicContact CD2-CD1 4.02Å; Y612-F615 HydrophobicContact CE2-CD1 4.05Å; Y612-F615 HydrophobicContact CE2-CE1 4.45Å; Y612-F615 WeakPolarHBondContact O-CB 3.23Å; Y612-F615 PolarHBondContact O-N 3.22Å; F615-R617 VanDerWaalsContact C-N 3.34Å; F615-R617 PolarHBondContact O-N 2.69Å; F615-L618 PolarHBondContact O-N 3.25Å; F615-T619 PolarHBondContact O-N 3.19Å; F615-T619 PolarHBondContact O-OG1 3.14Å; F615-L707 HydrophobicContact CE1-CD1 4.21Å; F615-I723 HydrophobicContact CE2-CG2 4.2Å; F615-I723 HydrophobicContact CZ-CG2 4.04Å; F615-A726 HydrophobicContact CD2-CB 3.8Å; F615-A726 HydrophobicContact CE2-CB 3.94Å; F615-A727 HydrophobicContact CE2-CB 4.13Å; F615-V730 HydrophobicContact CB-CG1 4.05Å; F615-V730 HydrophobicContact CB-CG2 4.21Å; F615-V730 HydrophobicContact CD2-CG2 4.36Å; F615-F738 HydrophobicContact CB-CD2 3.91Å; F615-F738 HydrophobicContact CB-CE2 4.48Å; F615-F738 HydrophobicContact CB-CG 4.45Å; F615-F738 HydrophobicContact CD1-CB 3.84Å; F615-F738 HydrophobicContact CD1-CG 4.43Å; F615-F738 HydrophobicContact CD2-CB 4.28Å; F615-F738 HydrophobicContact CD2-CD2 4.38Å; F615-F738 HydrophobicContact CE1-CB 4Å; F615-F738 HydrophobicContact CE2-CB 4.43Å; F615-F738 HydrophobicContact CG-CB 3.99Å; F615-F738 HydrophobicContact CG-CD2 4.06Å; F615-F738 HydrophobicContact CG-CG 4.31Å; F615-F738 HydrophobicContact CZ-CB 4.3Å
616	L	89	Confident	88	Confident	4 Å²	4	41.5 Å²	41.5	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-58.6	-44.8	177.5	-69.3	177.3	0	0	0	111.7	Y612 I614 T619 A620 K704 L707	Y612-L616 HydrophobicContact CD1-CD1 4.23Å; Y612-L616 HydrophobicContact CE1-CD1 3.79Å; Y612-L616 HydrophobicContact CE1-CG 4.34Å; Y612-L616 HydrophobicContact CE2-CD2 4.18Å; Y612-L616 HydrophobicContact CE2-CG 4.19Å; Y612-L616 WeakPolarHBondContact O-CG 3.19Å; Y612-L616 PolarHBondContact O-N 3.39Å; I614-L616 PolarHBondContact O-N 2.97Å; L616-T619 PolarHBondContact O-N 2.81Å; L616-A620 WeakPolarHBondContact O-CB 3.4Å; L616-A620 PolarHBondContact O-N 3.46Å; L616-K704 HydrophobicContact CD1-CG 4.17Å; L616-L707 HydrophobicContact CD2-CD1 3.52Å
617	R	88.5	Confident	86.8	Confident	75 Å²	75	47.3 Å²	47.3	28%	0.283	22%	0.22	S	C	.	.	H	α-helix	trans	-62.9	-41.7	176.8	-75.9	175.1	170.7	145.8	7	112.9	E613 I614 F615 L621 L700	E613-R617 VanDerWaalsContact CD-CZ 3.43Å; E613-R617 WeakPolarHBondContact O-CG 3.42Å; E613-R617 PolarHBondContact O-N 3.08Å; E613-R617 VanDerWaalsContact O-N 3.13Å; E613-R617 IonicContact OE1-CZ 3.76Å; E613-R617 IonicContact OE1-NH1 3.75Å; E613-R617 PolarHBondContact OE1-NH1 2.78Å; E613-R617 IonicContact OE1-NH2 3.58Å; E613-R617 PolarHBondContact OE1-NH2 2.69Å; E613-R617 IonicContact OE2-CZ 3.82Å; E613-R617 IonicContact OE2-NH1 2.71Å; E613-R617 PolarHBondContact OE2-NH1 2.65Å; I614-R617 PolarHBondContact O-N 3.49Å; F615-R617 VanDerWaalsContact C-N 3.34Å; F615-R617 PolarHBondContact O-N 2.69Å; R617-L621 VanDerWaalsContact O-CG 3.28Å; R617-L621 WeakPolarHBondContact O-CG 3.32Å; R617-L621 PolarHBondContact O-N 2.8Å; R617-L621 VanDerWaalsContact O-N 3.08Å; R617-L700 HydrophobicContact CG-CD1 4.07Å
618	L	89.7	Confident	85.2	Confident	57 Å²	57	50.8 Å²	50.8	30%	0.298	25%	0.245	S	C	.	.	H	α-helix	trans	-69.4	-42.1	179	-71.2	178.8	0	0	0	111.9	I614 F615 A620 L621 E622 A726 A729 V730	I614-L618 HydrophobicContact CG2-CD1 3.77Å; I614-L618 HydrophobicContact CG2-CG 4.09Å; I614-L618 WeakPolarHBondContact O-CB 3.33Å; I614-L618 WeakPolarHBondContact O-CG 3.26Å; I614-L618 PolarHBondContact O-N 2.95Å; F615-L618 PolarHBondContact O-N 3.25Å; L618-A620 VanDerWaalsContact C-N 3.35Å; L618-A620 PolarHBondContact O-N 3.03Å; L618-L621 PolarHBondContact O-N 2.97Å; L618-E622 PolarHBondContact O-N 2.9Å; L618-A726 HydrophobicContact CB-CB 3.73Å; L618-A729 HydrophobicContact CD1-CB 3.73Å; L618-V730 HydrophobicContact CD1-CG1 4.1Å
619	T	87	Confident	83.4	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-43.9	175	-54.3	0	0	0	0	110.8	F615 L616 L621 E622 I623 M703 A722 I723 A726	F615-T619 PolarHBondContact O-N 3.19Å; F615-T619 PolarHBondContact O-OG1 3.14Å; L616-T619 PolarHBondContact O-N 2.81Å; T619-L621 PolarHBondContact O-N 3.09Å; T619-E622 PolarHBondContact O-N 3.27Å; T619-I623 HydrophobicContact CG2-CD1 3.92Å; T619-I623 WeakPolarHBondContact O-CB 3.15Å; T619-I623 VanDerWaalsContact O-CG1 3.32Å; T619-I623 WeakPolarHBondContact O-CG1 3.15Å; T619-I623 PolarHBondContact O-N 3.39Å; T619-M703 HydrophobicContact CG2-CE 3.58Å; T619-A722 HydrophobicContact CG2-CB 4.28Å; T619-I723 HydrophobicContact CG2-CG1 3.81Å; T619-A726 WeakPolarHBondContact OG1-CB 3.34Å
620	A	84.6	Confident	81.4	Confident	12 Å²	12	57.6 Å²	57.6	10%	0.099	28%	0.282	C	S	.	.	H	α-helix	trans	-56.9	-50.5	175.2	0	0	0	0	0	112.1	L616 L618 E622 I623 Q624 M703	L616-A620 WeakPolarHBondContact O-CB 3.4Å; L616-A620 PolarHBondContact O-N 3.46Å; L618-A620 VanDerWaalsContact C-N 3.35Å; L618-A620 PolarHBondContact O-N 3.03Å; A620-E622 PolarHBondContact O-N 2.96Å; A620-I623 PolarHBondContact O-N 3.32Å; A620-Q624 WeakPolarHBondContact O-CG 3.2Å; A620-Q624 PolarHBondContact O-N 3.3Å; A620-M703 HydrophobicContact CB-CG 3.88Å
621	L	87.3	Confident	79.1	Confident	88 Å²	88	59.4 Å²	59.4	46%	0.461	31%	0.308	S	S	.	.	H	α-helix	trans	-62.6	-40.1	-179.7	-73.7	167.8	0	0	0	112.6	R617 L618 T619 Q624 K625	R617-L621 VanDerWaalsContact O-CG 3.28Å; R617-L621 WeakPolarHBondContact O-CG 3.32Å; R617-L621 PolarHBondContact O-N 2.8Å; R617-L621 VanDerWaalsContact O-N 3.08Å; L618-L621 PolarHBondContact O-N 2.97Å; T619-L621 PolarHBondContact O-N 3.09Å; L621-Q624 PolarHBondContact O-N 3.2Å; L621-K625 WeakPolarHBondContact O-CG 3.43Å; L621-K625 PolarHBondContact O-N 2.86Å
622	E	85	Confident	76.5	Confident	30 Å²	30	65.1 Å²	65.1	14%	0.14	34%	0.337	C	S	.	.	H	α-helix	trans	-74.6	-32	-179	-163.5	66.1	-168.1	0	0	112.3	L618 T619 A620 K625 S626 A722 K725	L618-E622 PolarHBondContact O-N 2.9Å; T619-E622 PolarHBondContact O-N 3.27Å; A620-E622 PolarHBondContact O-N 2.96Å; E622-K625 WeakPolarHBondContact OE2-CD 3.24Å; E622-K625 WeakPolarHBondContact OE2-CE 3.34Å; E622-K625 IonicContact OE2-NZ 3.49Å; E622-K625 PolarHBondContact OE2-NZ 3.16Å; E622-S626 WeakPolarHBondContact O-CB 3.23Å; E622-S626 PolarHBondContact O-N 2.94Å; E622-S626 VanDerWaalsContact O-N 3.07Å; E622-S626 PolarHBondContact O-OG 2.85Å; E622-A722 HydrophobicContact CB-CB 3.81Å; E622-A722 HydrophobicContact CG-CB 3.99Å; E622-K725 HydrophobicContact CG-CD 3.74Å; E622-K725 VanDerWaalsContact OE1-CD 3.24Å; E622-K725 WeakPolarHBondContact OE1-CD 3.36Å; E622-K725 WeakPolarHBondContact OE1-CE 3.5Å; E622-K725 IonicContact OE1-NZ 2.78Å; E622-K725 PolarHBondContact OE1-NZ 3.47Å
623	I	81	Confident	73.6	Confident	15 Å²	15	67.4 Å²	67.4	8%	0.077	36%	0.362	C	S	.	.	H	α-helix	trans	-64.4	-42.5	167.5	-69.9	169.6	0	0	0	110.6	T619 A620 S626 K627 M703 I719 A722	T619-I623 HydrophobicContact CG2-CD1 3.92Å; T619-I623 WeakPolarHBondContact O-CB 3.15Å; T619-I623 VanDerWaalsContact O-CG1 3.32Å; T619-I623 WeakPolarHBondContact O-CG1 3.15Å; T619-I623 PolarHBondContact O-N 3.39Å; A620-I623 PolarHBondContact O-N 3.32Å; I623-S626 PolarHBondContact O-N 2.97Å; I623-K627 HydrophobicContact CG2-CD 4.33Å; I623-K627 WeakPolarHBondContact O-CG 3.48Å; I623-K627 PolarHBondContact O-N 2.86Å; I623-K627 VanDerWaalsContact O-N 3.1Å; I623-M703 HydrophobicContact CD1-CE 3.79Å; I623-M703 HydrophobicContact CD1-SD 3.77Å; I623-I719 HydrophobicContact CD1-CG1 4.27Å; I623-I719 HydrophobicContact CD1-CG2 4.36Å; I623-A722 HydrophobicContact CD1-CB 4.4Å; I623-A722 HydrophobicContact CG1-CB 3.61Å
624	Q	80.4	Confident	70.9	Confident	87 Å²	87	73.4 Å²	73.4	41%	0.407	39%	0.394	S	S	.	.	H	α-helix	trans	-63.2	-44.8	178	-75.1	175.4	0.7	0	0	112.3	A620 L621 S626 K627 S628 D699	A620-Q624 WeakPolarHBondContact O-CG 3.2Å; A620-Q624 PolarHBondContact O-N 3.3Å; L621-Q624 PolarHBondContact O-N 3.2Å; Q624-S626 PolarHBondContact O-N 2.78Å; Q624-K627 PolarHBondContact O-N 3.35Å; Q624-S628 PolarHBondContact O-N 3.17Å; Q624-S628 PolarHBondContact O-OG 3.49Å; Q624-D699 PolarHBondContact NE2-OD2 3.44Å; Q624-D699 VanDerWaalsContact NE2-OD2 3.09Å
625	K	81	Confident	68.2	Low	118 Å²	118	77.1 Å²	77.1	51%	0.513	42%	0.415	S	S	.	.	H	α-helix	trans	-58.4	-46	173	-69.5	176.4	-148.7	161.8	0	112.2	L621 E622 K627 S628 S629	L621-K625 WeakPolarHBondContact O-CG 3.43Å; L621-K625 PolarHBondContact O-N 2.86Å; E622-K625 WeakPolarHBondContact OE2-CD 3.24Å; E622-K625 WeakPolarHBondContact OE2-CE 3.34Å; E622-K625 IonicContact OE2-NZ 3.49Å; E622-K625 PolarHBondContact OE2-NZ 3.16Å; K625-K627 PolarHBondContact O-N 3.19Å; K625-S628 WeakPolarHBondContact CA-OG 3.5Å; K625-S628 PolarHBondContact O-N 3.49Å; K625-S628 VanDerWaalsContact O-N 3.09Å; K625-S628 PolarHBondContact O-OG 3.35Å; K625-S629 PolarHBondContact O-N 3.32Å; K625-S629 PolarHBondContact O-OG 2.96Å
626	S	70.7	Confident	65.4	Low	25 Å²	25	84.7 Å²	84.7	18%	0.175	45%	0.45	C	S	.	.	H	α-helix	trans	-68.7	-21.6	-176.9	-59.8	0	0	0	0	113.6	E622 I623 Q624 S629	E622-S626 WeakPolarHBondContact O-CB 3.23Å; E622-S626 PolarHBondContact O-N 2.94Å; E622-S626 VanDerWaalsContact O-N 3.07Å; E622-S626 PolarHBondContact O-OG 2.85Å; I623-S626 PolarHBondContact O-N 2.97Å; Q624-S626 PolarHBondContact O-N 2.78Å; S626-S629 PolarHBondContact O-OG 3.31Å
627	K	69.4	Low	62.7	Low	146 Å²	146	91.4 Å²	91.4	64%	0.635	49%	0.486	S	S	*	.	H	α-helix	trans	-77.1	-39.9	168.8	-72.7	172.9	-179.8	176.6	0	111.9	I623 Q624 K625 K630	I623-K627 HydrophobicContact CG2-CD 4.33Å; I623-K627 WeakPolarHBondContact O-CG 3.48Å; I623-K627 PolarHBondContact O-N 2.86Å; I623-K627 VanDerWaalsContact O-N 3.1Å; Q624-K627 PolarHBondContact O-N 3.35Å; K625-K627 PolarHBondContact O-N 3.19Å; K627-K630 PolarHBondContact O-N 2.56Å
628	S	60.5	Low	60	Low	76 Å²	76	93.1 Å²	93.1	53%	0.531	51%	0.506	S	S	.	.	H	α-helix	trans	-68.3	-43.3	178.8	18.8	0	0	0	0	111.9	Q624 K625 K630 G631	Q624-S628 PolarHBondContact O-N 3.17Å; Q624-S628 PolarHBondContact O-OG 3.49Å; K625-S628 WeakPolarHBondContact CA-OG 3.5Å; K625-S628 PolarHBondContact O-N 3.49Å; K625-S628 VanDerWaalsContact O-N 3.09Å; K625-S628 PolarHBondContact O-OG 3.35Å; S628-K630 PolarHBondContact O-N 3.23Å; S628-G631 PolarHBondContact O-N 3.07Å
629	S	55.5	Low	57.1	Low	82 Å²	82	97.1 Å²	97.1	57%	0.573	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-0.4	178.3	67.9	0	0	0	0	115.5	K625 S626	K625-S629 PolarHBondContact O-N 3.32Å; K625-S629 PolarHBondContact O-OG 2.96Å; S626-S629 PolarHBondContact O-OG 3.31Å
630	K	50.7	Low	54.5	Low	158 Å²	158	101 Å²	101	69%	0.687	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.4	0	171.6	-74.5	-173.4	174.4	-177.6	0	113.4	K627 S628	K627-K630 PolarHBondContact O-N 2.56Å; S628-K630 PolarHBondContact O-N 3.23Å
631	G	43.8	Very low	52	Low	65 Å²	65	106.9 Å²	106.9	67%	0.67	61%	0.607	S	S	*	*	S	Bend	trans	-94.6	-9.5	179.3	0	0	0	0	0	115.5	S628	S628-G631 PolarHBondContact O-N 3.07Å
632	E	37.5	Very low	49.5	Very low	173 Å²	173	110.7 Å²	110.7	81%	0.808	62%	0.622	S	S	*	*	S	Bend	trans	-112	13.2	-172.3	-62.8	-175	138.7	0	0	113.9
633	C	32.6	Very low	47	Very low	112 Å²	112	115 Å²	115	76%	0.757	65%	0.646	S	S	*	*	S	Bend	trans	-105.4	44.1	179.4	-71.4	0	0	0	0	112.9
634	D	32.7	Very low	44.7	Very low	159 Å²	159	123.9 Å²	123.9	85%	0.85	68%	0.684	S	S	*	*	S	Bend	trans	-148.8	35.6	174.8	-121.1	-14.8	0	0	0	113
635	D	33.3	Very low	42.2	Very low	132 Å²	132	128.4 Å²	128.4	71%	0.706	71%	0.705	S	S	*	*	S	Bend	trans	-156.6	114.3	158	-122.1	-23.8	0	0	0	115.6
636	Q	33.7	Very low	39.9	Very low	164 Å²	164	127.8 Å²	127.8	77%	0.766	72%	0.722	S	S	*	*			trans	42.7	101.9	145.9	-67.4	172.4	77.2	0	0	122.8
637	D	31.3	Very low	37.9	Very low	145 Å²	145	134.3 Å²	134.3	78%	0.775	76%	0.755	S	S	*	*				50.6	123.9	115.9	-81.4	-40.1	0	0	0	124
638	T	32.4	Very low	35.9	Very low	112 Å²	112	133.3 Å²	133.3	69%	0.687	77%	0.765	S	S	*	*			trans	73.6	100.5	138.8	62	0	0	0	0	122.4
639	T	29.4	Very low	34.6	Very low	141 Å²	141	134.3 Å²	134.3	87%	0.865	77%	0.772	S	S	*	*			trans	48.7	113.9	130.7	59.8	0	0	0	0	121.3
640	G	32.1	Very low	33.2	Very low	81 Å²	81	135.3 Å²	135.3	84%	0.835	78%	0.779	S	S	*	*			trans	-171.6	75.1	168.2	0	0	0	0	0	116.5
641	V	31.9	Very low	32.1	Very low	136 Å²	136	134.5 Å²	134.5	82%	0.824	79%	0.788	S	S	*	*			trans	-77.2	137.1	-179.1	174.3	0	0	0	0	112.8
642	Q	35	Very low	31.5	Very low	168 Å²	168	137.8 Å²	137.8	79%	0.785	79%	0.79	S	S	*	*				-177	131	128	-102.3	176.6	69.1	0	0	118.2
643	N	31.5	Very low	31	Very low	120 Å²	120	136.2 Å²	136.2	64%	0.642	79%	0.787	S	S	*	*			trans	59.8	114	139.6	-65.7	-30.8	0	0	0	122.6
644	K	33.3	Very low	30.7	Very low	202 Å²	202	138.5 Å²	138.5	88%	0.878	79%	0.792	S	S	*	*				-160.4	159.1	99.2	-106.6	166.5	-175	173.8	0	113.8
645	Q	28.6	Very low	30.5	Very low	182 Å²	182	136.5 Å²	136.5	85%	0.85	79%	0.787	S	S	*	*			trans	-102.7	150.8	-161.9	-53.5	138.6	-54.4	0	0	114
646	A	31.7	Very low	30.1	Very low	104 Å²	104	139 Å²	139	86%	0.86	80%	0.799	S	S	*	*			trans	-163	144.5	134	0	0	0	0	0	109.1
647	N	28.2	Very low	29.7	Very low	163 Å²	163	134.9 Å²	134.9	87%	0.872	79%	0.789	S	S	*	*			trans	-145.7	138.4	-167.3	-139.9	3.3	0	0	0	112.2
648	C	28.8	Very low	29.5	Very low	124 Å²	124	134.2 Å²	134.2	84%	0.838	79%	0.792	S	S	*	*			trans	-161.5	90.1	164.5	-106.5	0	0	0	0	114.4
649	S	32.1	Very low	29.1	Very low	98 Å²	98	137.3 Å²	137.3	69%	0.685	80%	0.796	S	S	*	*			trans	38.2	89.2	143.5	59.9	0	0	0	0	121.6
650	S	26.3	Very low	29	Very low	102 Å²	102	137.4 Å²	137.4	71%	0.713	79%	0.792	S	S	*	*				46.1	115.9	115.8	63.7	0	0	0	0	122.7
651	T	28.7	Very low	28.5	Very low	142 Å²	142	139 Å²	139	87%	0.871	79%	0.79	S	S	*	*				-145.9	132.5	125.5	48	0	0	0	0	111.1
652	N	29.9	Very low	28.1	Very low	134 Å²	134	140.2 Å²	140.2	72%	0.717	79%	0.791	S	S	*	*			trans	-54.9	161.3	168.5	-67.4	58.3	0	0	0	113.4
653	D	26.6	Very low	27.5	Very low	139 Å²	139	136.9 Å²	136.9	74%	0.743	78%	0.782	S	S	*	*			cis	-158.7	-171.3	-6.8	-104.6	-21.2	0	0	0	110.2
654	D	28	Very low	27	Very low	161 Å²	161	138.3 Å²	138.3	86%	0.861	80%	0.795	S	S	*	*			trans	83.8	112.5	172.4	-79.8	-26.7	0	0	0	120
655	P	27	Very low	26.5	Very low	116 Å²	116	133 Å²	133	75%	0.753	78%	0.78	S	S	*	*			trans	-115.2	112.4	175.6	37.2	-24.6	0	0	0	114.1
656	L	26.2	Very low	26.2	Very low	184 Å²	184	134.3 Å²	134.3	96%	0.963	78%	0.783	S	S	*	*			trans	-175.8	86.3	145.1	-103.8	160.7	0	0	0	111.2
657	S	25.1	Very low	25.7	Very low	79 Å²	79	136.2 Å²	136.2	55%	0.552	77%	0.774	S	S	*	*			trans	-150.7	133.5	161.1	59	0	0	0	0	110.6	K659	S657-K659 PolarHBondContact O-N 3.47Å
658	P	27.4	Very low	25.4	Very low	130 Å²	130	137 Å²	137	84%	0.844	77%	0.772	S	S	*	*			trans	-78.3	69.1	179.1	32.5	-35.2	0	0	0	111	N660	P658-N660 PolarHBondContact O-N 3.26Å
659	K	22.5	Very low	25.2	Very low	177 Å²	177	138.7 Å²	138.7	77%	0.77	77%	0.771	S	S	*	*			trans	-71.9	52.1	169.5	-74.1	-177.8	178.2	172.1	0	111.9	S657 S661	S657-K659 PolarHBondContact O-N 3.47Å; K659-S661 PolarHBondContact O-N 2.96Å
660	N	27.2	Very low	24.7	Very low	143 Å²	143	139.4 Å²	139.4	77%	0.765	77%	0.767	S	S	*	*			trans	-80.9	87.6	173.9	-87.2	-0.4	0	0	0	110.5	P658 L662	P658-N660 PolarHBondContact O-N 3.26Å; N660-L662 PolarHBondContact O-N 3.44Å; N660-L662 VanDerWaalsContact O-N 3.11Å
661	S	21.8	Very low	24.6	Very low	114 Å²	114	138.8 Å²	138.8	80%	0.797	75%	0.753	S	S	*	*			trans	-54.7	106.7	162.7	52.1	0	0	0	0	111.3	K659 V663	K659-S661 PolarHBondContact O-N 2.96Å; S661-V663 PolarHBondContact O-N 3.47Å
662	L	24.3	Very low	24.4	Very low	162 Å²	162	140.8 Å²	140.8	85%	0.848	75%	0.752	S	S	*	*			trans	-97.7	83.5	168.6	-92.4	150.9	0	0	0	110.4	N660	N660-L662 PolarHBondContact O-N 3.44Å; N660-L662 VanDerWaalsContact O-N 3.11Å
663	V	22.9	Very low	24.1	Very low	98 Å²	98	136.1 Å²	136.1	59%	0.594	73%	0.727	S	S	*	*			trans	46.4	102	151.3	-163.1	0	0	0	0	116.9	S661 T665	S661-V663 PolarHBondContact O-N 3.47Å; V663-T665 HydrophobicContact CG1-CG2 3.66Å; V663-T665 WeakPolarHBondContact CG1-OG1 3.08Å; V663-T665 PolarHBondContact O-N 3.26Å; V663-T665 PolarHBondContact O-OG1 3.07Å
664	T	21	Very low	24.1	Very low	150 Å²	150	133.3 Å²	133.3	92%	0.92	72%	0.715	S	S	*	*			trans	-75.9	59.6	166.3	-34.8	0	0	0	0	111.6	K666	T664-K666 PolarHBondContact O-N 3.36Å
665	T	22.1	Very low	24	Very low	91 Å²	91	130 Å²	130	56%	0.558	70%	0.7	S	S	*	*			trans	-71.5	116.5	177.5	12.5	0	0	0	0	110.6	V663 H667	V663-T665 HydrophobicContact CG1-CG2 3.66Å; V663-T665 WeakPolarHBondContact CG1-OG1 3.08Å; V663-T665 PolarHBondContact O-N 3.26Å; V663-T665 PolarHBondContact O-OG1 3.07Å; T665-H667 PolarHBondContact O-N 2.93Å
666	K	22	Very low	23.9	Very low	209 Å²	209	125.5 Å²	125.5	91%	0.909	68%	0.675	S	S	*	*			trans	-73.3	75.7	165.4	-68.7	-178.3	178.4	179.2	0	110	T664	T664-K666 PolarHBondContact O-N 3.36Å
667	H	22.6	Very low	23.9	Very low	145 Å²	145	121.8 Å²	121.8	67%	0.671	65%	0.653	S	S	*	*			trans	-121.8	142.8	168.4	-79.2	-67.1	0	0	0	111.1	T665 I669	T665-H667 PolarHBondContact O-N 2.93Å; H667-I669 PolarHBondContact O-N 3.36Å
668	Q	21.8	Very low	24	Very low	178 Å²	178	119.4 Å²	119.4	83%	0.832	64%	0.636	S	S	*	*			trans	-62.2	129.7	170.4	-66.8	137.3	-64.5	0	0	108
669	I	23.3	Very low	23.9	Very low	160 Å²	160	114.8 Å²	114.8	82%	0.821	61%	0.607	S	S	*	*			trans	-106.9	115.9	167.3	-63	177.6	0	0	0	105	H667	H667-I669 PolarHBondContact O-N 3.36Å
670	D	22.3	Very low	24.1	Very low	114 Å²	114	108.6 Å²	108.6	61%	0.61	58%	0.582	S	S	*	*			trans	-68.4	153.3	-173.2	-82.3	-65.4	0	0	0	113.2	H672 R1211	D670-H672 PolarHBondContact O-N 3.29Å; D670-H672 VanDerWaalsContact O-N 3.15Å; D670-R1211 IonicContact OD1-NH1 3.32Å
671	H	23.5	Very low	24	Very low	89 Å²	89	105.8 Å²	105.8	41%	0.412	58%	0.579	S	S	.	*			trans	-72.7	107	174.5	-66.4	-135.1	0	0	0	107.9	D673 R1211	H671-D673 PolarHBondContact O-N 2.81Å; H671-R1211 PolarHBondContact CD2-NH1 3.02Å; H671-R1211 VanDerWaalsContact CD2-NH1 3.32Å; H671-R1211 PolarHBondContact CD2-NH2 2.67Å; H671-R1211 PolarHBondContact NE2-NH2 3.18Å; H671-R1211 VanDerWaalsContact NE2-NH2 3.15Å
672	H	24.8	Very low	24.1	Very low	183 Å²	183	104.9 Å²	104.9	85%	0.847	57%	0.565	S	S	*	*			trans	-83.4	105	156.7	-98.8	-74.5	0	0	0	108.6	D670 V674	D670-H672 PolarHBondContact O-N 3.29Å; D670-H672 VanDerWaalsContact O-N 3.15Å; H672-V674 PolarHBondContact O-N 3.35Å
673	D	24.8	Very low	24.2	Very low	36 Å²	36	101.6 Å²	101.6	19%	0.193	55%	0.548	C	S	.	.			trans	-63	113.4	-179.2	-75.3	-107.9	0	0	0	112.8	H671 N1174 L1175	H671-D673 PolarHBondContact O-N 2.81Å; D673-N1174 PolarHBondContact OD1-ND2 2.95Å; D673-N1174 PolarHBondContact OD1-OD1 3.18Å; D673-N1174 VanDerWaalsContact OD1-OD1 3.12Å; D673-L1175 HydrophobicContact CB-CB 4.28Å; D673-L1175 HydrophobicContact CB-CD1 3.91Å; D673-L1175 HydrophobicContact CB-CG 4.28Å; D673-L1175 VanDerWaalsContact CG-CG 3.5Å; D673-L1175 VanDerWaalsContact OD1-CB 3.3Å; D673-L1175 WeakPolarHBondContact OD1-CB 3.49Å; D673-L1175 PolarHBondContact OD1-N 3.04Å; D673-L1175 WeakPolarHBondContact OD2-CG 3.45Å
674	V	24.7	Very low	24.2	Very low	81 Å²	81	101.1 Å²	101.1	49%	0.491	55%	0.549	S	S	.	.			trans	-89.8	114.6	165.9	-179.5	0	0	0	0	108.5	H672 H677 K1176	H672-V674 PolarHBondContact O-N 3.35Å; V674-H677 WeakPolarHBondContact CG1-CE1 3.36Å; V674-K1176 WeakPolarHBondContact O-CE 3.32Å; V674-K1176 PolarHBondContact O-NZ 2.96Å
675	T	26.1	Very low	24.4	Very low	91 Å²	91	97 Å²	97	56%	0.558	54%	0.536	S	S	*	.			trans	-67.6	172.1	176.1	41.9	0	0	0	0	112.1	H677	T675-H677 PolarHBondContact O-N 3.15Å; T675-H677 VanDerWaalsContact O-N 3.13Å; T675-H677 PolarHBondContact O-ND1 3.35Å
676	G	25.2	Very low	24.5	Very low	22 Å²	22	98.2 Å²	98.2	23%	0.227	54%	0.538	C	S	.	.			trans	-50.5	117	-165.7	0	0	0	0	0	113.9	S678	G676-S678 PolarHBondContact O-N 3.35Å
677	H	25.9	Very low	24.7	Very low	106 Å²	106	90.5 Å²	90.5	49%	0.491	52%	0.517	S	S	.	.			trans	-78.3	104.7	165.7	-84	30.1	0	0	0	108.2	V674 T675 S679	V674-H677 WeakPolarHBondContact CG1-CE1 3.36Å; T675-H677 PolarHBondContact O-N 3.15Å; T675-H677 VanDerWaalsContact O-N 3.13Å; T675-H677 PolarHBondContact O-ND1 3.35Å; H677-S679 PolarHBondContact O-N 3.4Å
678	S	27.9	Very low	24.9	Very low	29 Å²	29	89.8 Å²	89.8	20%	0.203	52%	0.523	C	S	.	.			trans	-57.2	125.3	160	-179.4	0	0	0	0	108.5	G676 N680 H1099	G676-S678 PolarHBondContact O-N 3.35Å; S678-N680 PolarHBondContact O-N 3.38Å; S678-H1099 PolarHBondContact OG-NE2 3.48Å
679	S	24.5	Very low	25.2	Very low	33 Å²	33	85.9 Å²	85.9	23%	0.231	51%	0.508	C	S	.	.	S	Bend	trans	-44.5	123.1	151.6	34.5	0	0	0	0	108.6	H677 T1095 H1099	H677-S679 PolarHBondContact O-N 3.4Å; S679-T1095 WeakPolarHBondContact OG-CG2 3.3Å; S679-T1095 PolarHBondContact OG-OG1 3.44Å; S679-H1099 PolarHBondContact O-CE1 3.06Å
680	N	26.6	Very low	25.3	Very low	46 Å²	46	86.5 Å²	86.5	25%	0.246	50%	0.504	C	S	.	.			trans	164.5	49.7	167.3	-84.7	-11	0	0	0	111.2	S678 R1056 H1099	S678-N680 PolarHBondContact O-N 3.38Å; N680-R1056 VanDerWaalsContact CG-NE 3.28Å; N680-R1056 VanDerWaalsContact ND2-CD 3.26Å; N680-R1056 WeakPolarHBondContact ND2-CD 3.44Å; N680-R1056 PolarHBondContact ND2-NE 2.64Å; N680-R1056 WeakPolarHBondContact OD1-CD 3.26Å; N680-R1056 PolarHBondContact OD1-NE 3.15Å; N680-R1056 PolarHBondContact OD1-NH1 3.11Å; N680-H1099 PolarHBondContact ND2-CE1 3.1Å; N680-H1099 PolarHBondContact ND2-ND1 2.61Å
681	A	25.9	Very low	25.5	Very low	84 Å²	84	82.5 Å²	82.5	69%	0.694	49%	0.485	S	S	*	.			trans	-147.4	43.2	-178.2	0	0	0	0	0	113.2
682	L	24.3	Very low	25.6	Very low	96 Å²	96	79.3 Å²	79.3	50%	0.503	47%	0.472	S	S	.	.			trans	-83.1	139.5	161.5	-72.3	161.6	0	0	0	108.1
683	N	25.4	Very low	25.7	Very low	92 Å²	92	74.4 Å²	74.4	49%	0.492	46%	0.459	S	S	.	.	S	Bend	trans	78.8	35.7	-178.8	-52.5	-6.7	0	0	0	118.6	Y1011	N683-Y1011 WeakPolarHBondContact CB-OH 3.44Å; N683-Y1011 PolarHBondContact O-OH 3.49Å
684	S	23.8	Very low	26	Very low	89 Å²	89	79.6 Å²	79.6	62%	0.622	48%	0.48	S	S	*	.			trans	-154.5	73.3	154.3	42.3	0	0	0	0	112.3
685	G	24.9	Very low	26.3	Very low	63 Å²	63	82 Å²	82	65%	0.649	49%	0.49	S	S	*	.			trans	-122.3	26.7	-160.2	0	0	0	0	0	118.3	G687	G685-G687 PolarHBondContact O-N 2.96Å; G685-G687 VanDerWaalsContact O-N 3.15Å
686	I	24.7	Very low	26.9	Very low	117 Å²	117	82.1 Å²	82.1	60%	0.6	48%	0.484	S	S	*	.			trans	-64.6	115.5	168.3	-64.9	-180	0	0	0	107.8	D609 T688	D609-I686 WeakPolarHBondContact OD2-CG2 3.41Å; I686-T688 PolarHBondContact O-N 3.3Å
687	G	26.6	Very low	27.8	Very low	46 Å²	46	82 Å²	82	47%	0.474	48%	0.48	S	S	.	.			trans	-65.3	119.6	-166.8	0	0	0	0	0	113.6	G685 I689	G685-G687 PolarHBondContact O-N 2.96Å; G685-G687 VanDerWaalsContact O-N 3.15Å; G687-I689 PolarHBondContact O-N 3.04Å
688	T	25.6	Very low	28.7	Very low	130 Å²	130	81.8 Å²	81.8	80%	0.798	48%	0.482	S	S	*	.			trans	-69	82.9	163.1	31.9	0	0	0	0	110.1	I686 K690	I686-T688 PolarHBondContact O-N 3.3Å; T688-K690 PolarHBondContact O-N 3.14Å
689	I	28	Very low	29.8	Very low	97 Å²	97	83.5 Å²	83.5	50%	0.497	49%	0.489	S	S	.	.			trans	-47.4	132.1	152.6	-65	174.2	0	0	0	106.6	G687 S691	G687-I689 PolarHBondContact O-N 3.04Å; I689-S691 PolarHBondContact O-N 3.16Å; I689-S691 VanDerWaalsContact O-N 3.1Å
690	K	25.9	Very low	31.3	Very low	172 Å²	172	83.3 Å²	83.3	75%	0.748	49%	0.485	S	S	*	.			trans	-38	118.2	-172.5	-74.2	-172.6	170.6	-168	0	111.4	T688	T688-K690 PolarHBondContact O-N 3.14Å
691	S	25.6	Very low	33	Very low	30 Å²	30	83 Å²	83	21%	0.21	49%	0.485	C	S	.	.	P	Polyproline II helix	trans	-49.5	128	176.6	49.4	0	0	0	0	109.3	I689 D1355 T1357	I689-S691 PolarHBondContact O-N 3.16Å; I689-S691 VanDerWaalsContact O-N 3.1Å; S691-D1355 WeakPolarHBondContact CB-OD1 3.2Å; S691-T1357 WeakPolarHBondContact OG-CG2 3.36Å; S691-T1357 PolarHBondContact OG-OG1 3.04Å
692	P	26.1	Very low	34.5	Very low	22 Å²	22	83.7 Å²	83.7	14%	0.143	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-72.1	147.2	177.1	35.5	-37.3	0	0	0	108.2	K694 Q696	P692-K694 PolarHBondContact O-N 3.04Å; P692-K694 VanDerWaalsContact O-N 3.16Å; P692-Q696 HydrophobicContact CB-CB 3.56Å; P692-Q696 HydrophobicContact CB-CG 4.41Å; P692-Q696 HydrophobicContact CG-CB 3.75Å
693	S	27.1	Very low	36.3	Very low	81 Å²	81	79.7 Å²	79.7	57%	0.566	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-48.2	120.6	-171.4	55	0	0	0	0	112.5	N695 Q696	S693-N695 VanDerWaalsContact C-N 3.31Å; S693-N695 CarbonylContact O-C 3.51Å; S693-N695 PolarHBondContact O-N 3.24Å; S693-Q696 PolarHBondContact O-N 3.32Å
694	K	30.2	Very low	38.1	Very low	145 Å²	145	76.7 Å²	76.7	63%	0.63	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	2.6	-71	-174.5	-108.9	164	176.6	156.1	0	115.4	P692 Q696 S697 E1358	P692-K694 PolarHBondContact O-N 3.04Å; P692-K694 VanDerWaalsContact O-N 3.16Å; K694-Q696 PolarHBondContact O-N 3.08Å; K694-S697 WeakPolarHBondContact O-CB 3.42Å; K694-S697 PolarHBondContact O-N 3.15Å; K694-E1358 IonicContact NZ-OE2 3.75Å; K694-E1358 PolarHBondContact NZ-OE2 2.83Å
695	N	32.8	Very low	40.1	Very low	131 Å²	131	77.8 Å²	77.8	70%	0.701	43%	0.432	S	S	*	.	H	α-helix	trans	-43	-25.7	174.6	-53.4	27.3	0	0	0	116.6	S693	S693-N695 VanDerWaalsContact C-N 3.31Å; S693-N695 CarbonylContact O-C 3.51Å; S693-N695 PolarHBondContact O-N 3.24Å
696	Q	37.9	Very low	41.9	Very low	93 Å²	93	78.7 Å²	78.7	44%	0.435	42%	0.421	S	S	.	.	H	α-helix	trans	-93.1	-20.7	-179.9	-71.7	-177.6	35.3	0	0	114.1	P692 S693 K694 L700	P692-Q696 HydrophobicContact CB-CB 3.56Å; P692-Q696 HydrophobicContact CB-CG 4.41Å; P692-Q696 HydrophobicContact CG-CB 3.75Å; S693-Q696 PolarHBondContact O-N 3.32Å; K694-Q696 PolarHBondContact O-N 3.08Å; Q696-L700 WeakPolarHBondContact O-CD1 3.49Å; Q696-L700 PolarHBondContact O-N 3.28Å
697	S	43.1	Very low	43.8	Very low	20 Å²	20	75.8 Å²	75.8	14%	0.14	41%	0.407	C	S	.	.	H	α-helix	trans	-68.7	-43	173.1	137.2	0	0	0	0	110.2	K694 L700 T701	K694-S697 WeakPolarHBondContact O-CB 3.42Å; K694-S697 PolarHBondContact O-N 3.15Å; S697-L700 PolarHBondContact O-N 3.34Å; S697-T701 PolarHBondContact O-N 3.21Å; S697-T701 PolarHBondContact O-OG1 3.04Å
698	D	46.6	Very low	45.5	Very low	102 Å²	102	78.7 Å²	78.7	55%	0.545	41%	0.408	S	S	.	.	H	α-helix	trans	-65.6	-42.1	179.2	-56.2	-30.3	0	0	0	110.8	L700 T701 L702	D698-L700 PolarHBondContact O-N 2.85Å; D698-T701 PolarHBondContact O-N 2.88Å; D698-L702 WeakPolarHBondContact O-CB 3.43Å; D698-L702 PolarHBondContact O-N 3.4Å
699	D	49.9	Very low	46.9	Very low	64 Å²	64	78.4 Å²	78.4	34%	0.342	40%	0.401	S	S	.	.	H	α-helix	trans	-58.1	-43.8	174.2	-101.2	3.7	0	0	0	112.5	Q624 M703	Q624-D699 PolarHBondContact NE2-OD2 3.44Å; Q624-D699 VanDerWaalsContact NE2-OD2 3.09Å; D699-M703 VanDerWaalsContact O-CB 3.31Å; D699-M703 WeakPolarHBondContact O-CB 3.45Å; D699-M703 WeakPolarHBondContact O-CG 3.28Å; D699-M703 PolarHBondContact O-N 3.46Å
700	L	56.8	Low	48	Very low	30 Å²	30	80.5 Å²	80.5	16%	0.157	41%	0.414	C	S	.	.	H	α-helix	trans	-68.5	-38.3	176.8	-96.8	80.9	0	0	0	112.4	E613 R617 Q696 S697 D698 M703 K704	E613-L700 HydrophobicContact CG-CD2 4.33Å; R617-L700 HydrophobicContact CG-CD1 4.07Å; Q696-L700 WeakPolarHBondContact O-CD1 3.49Å; Q696-L700 PolarHBondContact O-N 3.28Å; S697-L700 PolarHBondContact O-N 3.34Å; D698-L700 PolarHBondContact O-N 2.85Å; L700-M703 PolarHBondContact O-N 2.91Å; L700-K704 PolarHBondContact O-N 2.97Å; L700-K704 VanDerWaalsContact O-N 3.11Å
701	T	61.1	Low	48.9	Very low	40 Å²	40	81.1 Å²	81.1	25%	0.245	42%	0.419	C	S	.	.	H	α-helix	trans	-71.6	-38.6	-179.8	-56	0	0	0	0	111.3	S697 D698 K704 K705	S697-T701 PolarHBondContact O-N 3.21Å; S697-T701 PolarHBondContact O-OG1 3.04Å; D698-T701 PolarHBondContact O-N 2.88Å; T701-K704 PolarHBondContact O-N 3.38Å; T701-K705 PolarHBondContact O-N 3.2Å
702	L	57.3	Low	49.9	Very low	98 Å²	98	84 Å²	84	51%	0.513	43%	0.432	S	S	.	.	H	α-helix	trans	-63.2	-42.1	170.7	-175.5	67.1	0	0	0	111.2	D698 K704 K705 L706	D698-L702 WeakPolarHBondContact O-CB 3.43Å; D698-L702 PolarHBondContact O-N 3.4Å; L702-K704 PolarHBondContact O-N 2.88Å; L702-K705 PolarHBondContact O-N 2.89Å; L702-L706 HydrophobicContact CG-CD1 3.99Å; L702-L706 HydrophobicContact CG-CG 4.48Å; L702-L706 WeakPolarHBondContact O-CG 3.41Å; L702-L706 PolarHBondContact O-N 3.24Å
703	M	62.5	Low	50.7	Low	11 Å²	11	88.3 Å²	88.3	5%	0.054	46%	0.458	C	S	.	.	H	α-helix	trans	-65.4	-32.3	178.1	-87.6	-58.8	-47.9	0	0	114.2	T619 A620 I623 D699 L700 L706 L707	T619-M703 HydrophobicContact CG2-CE 3.58Å; A620-M703 HydrophobicContact CB-CG 3.88Å; I623-M703 HydrophobicContact CD1-CE 3.79Å; I623-M703 HydrophobicContact CD1-SD 3.77Å; D699-M703 VanDerWaalsContact O-CB 3.31Å; D699-M703 WeakPolarHBondContact O-CB 3.45Å; D699-M703 WeakPolarHBondContact O-CG 3.28Å; D699-M703 PolarHBondContact O-N 3.46Å; L700-M703 PolarHBondContact O-N 2.91Å; M703-L706 HydrophobicContact SD-CB 4.49Å; M703-L706 HydrophobicContact SD-CD1 4.05Å; M703-L707 HydrophobicContact CE-CD1 3.97Å; M703-L707 HydrophobicContact CE-CD2 4.44Å; M703-L707 HydrophobicContact CE-CG 4.02Å; M703-L707 WeakPolarHBondContact O-CD1 3.48Å; M703-L707 VanDerWaalsContact O-CG 3.23Å; M703-L707 WeakPolarHBondContact O-CG 3.46Å; M703-L707 PolarHBondContact O-N 3.22Å
704	K	64.3	Low	51.6	Low	30 Å²	30	93.3 Å²	93.3	13%	0.13	47%	0.473	C	S	.	.	H	α-helix	trans	-61.4	-50.5	171.4	-71.4	175.1	-171.3	160.3	0	111.1	L616 L700 T701 L702 L706 L707 E708 N1352 K1353	L616-K704 HydrophobicContact CD1-CG 4.17Å; L700-K704 PolarHBondContact O-N 2.97Å; L700-K704 VanDerWaalsContact O-N 3.11Å; T701-K704 PolarHBondContact O-N 3.38Å; L702-K704 PolarHBondContact O-N 2.88Å; K704-L706 VanDerWaalsContact C-N 3.33Å; K704-L706 PolarHBondContact O-N 2.7Å; K704-L707 CarbonylContact O-C 3.17Å; K704-L707 WeakPolarHBondContact O-CA 3.17Å; K704-L707 WeakPolarHBondContact O-CB 3.26Å; K704-L707 PolarHBondContact O-N 2.92Å; K704-E708 VanDerWaalsContact O-CG 3.31Å; K704-E708 WeakPolarHBondContact O-CG 3.38Å; K704-E708 PolarHBondContact O-N 3.12Å; K704-N1352 WeakPolarHBondContact CD-OD1 3.39Å; K704-N1352 PolarHBondContact NZ-OD1 3.15Å; K704-K1353 PolarHBondContact NZ-O 2.91Å
705	K	64.9	Low	52.6	Low	111 Å²	111	93.3 Å²	93.3	48%	0.483	47%	0.473	S	S	.	.	H	α-helix	trans	-58.5	-44.3	177.5	-64.6	-171.8	175.4	-168.2	0	112.1	T701 L702 L707 E708 D709	T701-K705 PolarHBondContact O-N 3.2Å; L702-K705 PolarHBondContact O-N 2.89Å; K705-L707 PolarHBondContact O-N 3.34Å; K705-L707 VanDerWaalsContact O-N 3.08Å; K705-E708 PolarHBondContact O-N 2.75Å; K705-D709 PolarHBondContact O-N 2.94Å
706	L	63.2	Low	54.1	Low	82 Å²	82	88.2 Å²	88.2	43%	0.429	45%	0.446	S	S	.	.	H	α-helix	trans	-63.7	-10.7	174.3	-70	171.4	0	0	0	114.8	L702 M703 K704	L702-L706 HydrophobicContact CG-CD1 3.99Å; L702-L706 HydrophobicContact CG-CG 4.48Å; L702-L706 WeakPolarHBondContact O-CG 3.41Å; L702-L706 PolarHBondContact O-N 3.24Å; M703-L706 HydrophobicContact SD-CB 4.49Å; M703-L706 HydrophobicContact SD-CD1 4.05Å; K704-L706 VanDerWaalsContact C-N 3.33Å; K704-L706 PolarHBondContact O-N 2.7Å
707	L	64.7	Low	55.8	Low	57 Å²	57	89.9 Å²	89.9	30%	0.298	46%	0.457	S	S	.	.	H	α-helix	trans	-106.2	-6.8	172.6	-68	167.7	0	0	0	112.7	F615 L616 M703 K704 K705 I723	F615-L707 HydrophobicContact CE1-CD1 4.21Å; L616-L707 HydrophobicContact CD2-CD1 3.52Å; M703-L707 HydrophobicContact CE-CD1 3.97Å; M703-L707 HydrophobicContact CE-CD2 4.44Å; M703-L707 HydrophobicContact CE-CG 4.02Å; M703-L707 WeakPolarHBondContact O-CD1 3.48Å; M703-L707 VanDerWaalsContact O-CG 3.23Å; M703-L707 WeakPolarHBondContact O-CG 3.46Å; M703-L707 PolarHBondContact O-N 3.22Å; K704-L707 CarbonylContact O-C 3.17Å; K704-L707 WeakPolarHBondContact O-CA 3.17Å; K704-L707 WeakPolarHBondContact O-CB 3.26Å; K704-L707 PolarHBondContact O-N 2.92Å; K705-L707 PolarHBondContact O-N 3.34Å; K705-L707 VanDerWaalsContact O-N 3.08Å; L707-I723 HydrophobicContact CD2-CD1 3.51Å; L707-I723 HydrophobicContact CD2-CG1 3.84Å
708	E	62.3	Low	57.5	Low	107 Å²	107	91 Å²	91	50%	0.5	46%	0.463	S	S	.	.	H	α-helix	trans	-103.8	-31.3	179.2	-71	160.7	-177.2	0	0	111.4	K704 K705 D710	K704-E708 VanDerWaalsContact O-CG 3.31Å; K704-E708 WeakPolarHBondContact O-CG 3.38Å; K704-E708 PolarHBondContact O-N 3.12Å; K705-E708 PolarHBondContact O-N 2.75Å; E708-D710 PolarHBondContact O-N 3.12Å; E708-D710 VanDerWaalsContact O-N 3.08Å
709	D	55.3	Low	59.1	Low	124 Å²	124	88.1 Å²	88.1	66%	0.663	45%	0.448	S	S	*	.			trans	-82.2	66	-178.2	-70.1	-39.8	0	0	0	114	K705 Q711	K705-D709 PolarHBondContact O-N 2.94Å; D709-Q711 VanDerWaalsContact C-N 3.32Å; D709-Q711 PolarHBondContact O-N 3.42Å
710	D	51.1	Low	60.7	Low	141 Å²	141	92 Å²	92	75%	0.754	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	59.8	-174.8	-167.3	25.8	0	0	0	114.8	E708	E708-D710 PolarHBondContact O-N 3.12Å; E708-D710 VanDerWaalsContact O-N 3.08Å
711	Q	44	Very low	62	Low	184 Å²	184	93.8 Å²	93.8	86%	0.86	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.9	-18.4	-176.5	-66.2	-156.8	6.2	0	0	118.6	D709 T713	D709-Q711 VanDerWaalsContact C-N 3.32Å; D709-Q711 PolarHBondContact O-N 3.42Å; Q711-T713 PolarHBondContact O-N 3.31Å
712	D	46.3	Very low	63.2	Low	91 Å²	91	91.9 Å²	91.9	49%	0.487	45%	0.453	S	S	.	.			trans	-103.6	84.3	-171.1	-161.4	13.3	0	0	0	113.7	Q714 K715	D712-Q714 VanDerWaalsContact C-N 3.29Å; D712-Q714 PolarHBondContact O-N 3.19Å; D712-K715 IonicContact OD2-NZ 2.75Å; D712-K715 PolarHBondContact OD2-NZ 3.42Å
713	T	43.5	Very low	64.6	Low	113 Å²	113	88 Å²	88	69%	0.693	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-18.1	-163.7	47.1	0	0	0	0	117.7	Q711	Q711-T713 PolarHBondContact O-N 3.31Å
714	Q	46	Very low	65.8	Low	186 Å²	186	91.9 Å²	91.9	87%	0.869	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-5	-170.8	-67.6	-170.3	-5.5	0	0	116.1	D712	D712-Q714 VanDerWaalsContact C-N 3.29Å; D712-Q714 PolarHBondContact O-N 3.19Å
715	K	51.2	Low	67	Low	144 Å²	144	94.1 Å²	94.1	63%	0.626	46%	0.457	S	S	*	.	S	Bend	trans	-97.9	-1.5	173.3	-68.5	176.9	-169	123.7	0	113.7	D712 D717	D712-K715 IonicContact OD2-NZ 2.75Å; D712-K715 PolarHBondContact OD2-NZ 3.42Å; K715-D717 PolarHBondContact O-N 3.43Å
716	N	63.6	Low	68.1	Low	25 Å²	25	89 Å²	89	13%	0.134	44%	0.435	C	S	.	.	H	α-helix	trans	-70.6	-31.8	-156.4	-85.3	-18	0	0	0	116.7	V718 I719 R720	N716-V718 VanDerWaalsContact C-N 3.28Å; N716-V718 PolarHBondContact O-N 2.99Å; N716-I719 PolarHBondContact O-N 2.89Å; N716-R720 HydrophobicContact CB-CG 4.48Å; N716-R720 WeakPolarHBondContact O-CB 3.37Å; N716-R720 WeakPolarHBondContact O-CG 3.28Å; N716-R720 PolarHBondContact O-N 3.43Å
717	D	73.7	Confident	69.2	Low	127 Å²	127	85.1 Å²	85.1	68%	0.679	42%	0.415	S	S	*	.	H	α-helix	trans	-61.6	-34.6	-169.2	-62.9	-20.5	0	0	0	113.6	K715 E721	K715-D717 PolarHBondContact O-N 3.43Å; D717-E721 VanDerWaalsContact O-CB 3.31Å; D717-E721 WeakPolarHBondContact O-CB 3.31Å; D717-E721 PolarHBondContact O-N 3.04Å
718	V	79.4	Confident	70.2	Confident	43 Å²	43	88.9 Å²	88.9	26%	0.261	43%	0.431	S	S	.	.	H	α-helix	trans	-68.1	-40.8	175.9	173.7	0	0	0	0	111.6	N716 A722	N716-V718 VanDerWaalsContact C-N 3.28Å; N716-V718 PolarHBondContact O-N 2.99Å; V718-A722 VanDerWaalsContact O-CB 3.31Å; V718-A722 WeakPolarHBondContact O-CB 3.32Å; V718-A722 PolarHBondContact O-N 3.37Å
719	I	81.1	Confident	71.4	Confident	43 Å²	43	87 Å²	87	22%	0.221	43%	0.434	C	S	.	.	H	α-helix	trans	-72.5	-42.3	-179.5	-61.5	176.9	0	0	0	109.6	I623 N716 A722 I723	I623-I719 HydrophobicContact CD1-CG1 4.27Å; I623-I719 HydrophobicContact CD1-CG2 4.36Å; N716-I719 PolarHBondContact O-N 2.89Å; I719-A722 PolarHBondContact O-N 2.91Å; I719-I723 HydrophobicContact CG2-CD1 3.82Å; I719-I723 HydrophobicContact CG2-CG1 4.43Å; I719-I723 WeakPolarHBondContact O-CB 3.3Å; I719-I723 VanDerWaalsContact O-CG1 3.25Å; I719-I723 WeakPolarHBondContact O-CG1 3.47Å; I719-I723 PolarHBondContact O-N 3.41Å
720	R	81.9	Confident	72.8	Confident	146 Å²	146	81.1 Å²	81.1	55%	0.551	40%	0.402	S	S	*	.	H	α-helix	trans	-61.9	-44.1	175.7	-71.9	175.3	176	175.2	-3.6	112.5	N716 I723 R724	N716-R720 HydrophobicContact CB-CG 4.48Å; N716-R720 WeakPolarHBondContact O-CB 3.37Å; N716-R720 WeakPolarHBondContact O-CG 3.28Å; N716-R720 PolarHBondContact O-N 3.43Å; R720-I723 PolarHBondContact O-N 3.1Å; R720-R724 WeakPolarHBondContact O-CB 3.26Å; R720-R724 PolarHBondContact O-N 3.41Å
721	E	85.2	Confident	74.3	Confident	66 Å²	66	76 Å²	76	31%	0.308	38%	0.383	S	S	.	.	H	α-helix	trans	-68.4	-34.6	176.5	179.6	60.8	-172.9	0	0	112.2	D717 R724 K725	D717-E721 VanDerWaalsContact O-CB 3.31Å; D717-E721 WeakPolarHBondContact O-CB 3.31Å; D717-E721 PolarHBondContact O-N 3.04Å; E721-R724 PolarHBondContact O-N 3.1Å; E721-R724 IonicContact OE1-CZ 3.85Å; E721-R724 IonicContact OE1-NE 3.79Å; E721-R724 IonicContact OE1-NH2 2.68Å; E721-R724 PolarHBondContact OE1-NH2 3.45Å; E721-R724 IonicContact OE2-CZ 3.71Å; E721-R724 IonicContact OE2-NE 2.76Å; E721-R724 PolarHBondContact OE2-NE 3.27Å; E721-R724 IonicContact OE2-NH2 2.69Å; E721-R724 PolarHBondContact OE2-NH2 2.98Å; E721-R724 VanDerWaalsContact OE2-NH2 3.16Å; E721-K725 HydrophobicContact CG-CD 4.35Å; E721-K725 WeakPolarHBondContact O-CG 3.47Å; E721-K725 PolarHBondContact O-N 3.43Å; E721-K725 VanDerWaalsContact O-N 3.08Å; E721-K725 WeakPolarHBondContact OE1-CE 3.25Å; E721-K725 IonicContact OE1-NZ 3.1Å
722	A	86.3	Confident	76.2	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-65.3	-45	172.3	0	0	0	0	0	112.4	T619 E622 I623 V718 I719 A726	T619-A722 HydrophobicContact CG2-CB 4.28Å; E622-A722 HydrophobicContact CB-CB 3.81Å; E622-A722 HydrophobicContact CG-CB 3.99Å; I623-A722 HydrophobicContact CD1-CB 4.4Å; I623-A722 HydrophobicContact CG1-CB 3.61Å; V718-A722 VanDerWaalsContact O-CB 3.31Å; V718-A722 WeakPolarHBondContact O-CB 3.32Å; V718-A722 PolarHBondContact O-N 3.37Å; I719-A722 PolarHBondContact O-N 2.91Å; A722-A726 VanDerWaalsContact O-CB 3.27Å; A722-A726 WeakPolarHBondContact O-CB 3.36Å; A722-A726 PolarHBondContact O-N 3.41Å
723	I	86.2	Confident	77.8	Confident	17 Å²	17	67.5 Å²	67.5	9%	0.087	34%	0.342	C	S	.	.	H	α-helix	trans	-60.2	-46.6	173.2	-70.6	163.9	0	0	0	110.3	F615 T619 L707 I719 R720 K725 A726 A727 D736	F615-I723 HydrophobicContact CE2-CG2 4.2Å; F615-I723 HydrophobicContact CZ-CG2 4.04Å; T619-I723 HydrophobicContact CG2-CG1 3.81Å; L707-I723 HydrophobicContact CD2-CD1 3.51Å; L707-I723 HydrophobicContact CD2-CG1 3.84Å; I719-I723 HydrophobicContact CG2-CD1 3.82Å; I719-I723 HydrophobicContact CG2-CG1 4.43Å; I719-I723 WeakPolarHBondContact O-CB 3.3Å; I719-I723 VanDerWaalsContact O-CG1 3.25Å; I719-I723 WeakPolarHBondContact O-CG1 3.47Å; I719-I723 PolarHBondContact O-N 3.41Å; R720-I723 PolarHBondContact O-N 3.1Å; I723-K725 PolarHBondContact O-N 3.47Å; I723-A726 PolarHBondContact O-N 2.86Å; I723-A727 WeakPolarHBondContact O-CB 3.36Å; I723-A727 PolarHBondContact O-N 3.23Å; I723-D736 WeakPolarHBondContact CG2-O 3.45Å
724	R	87.7	Confident	79.7	Confident	93 Å²	93	63.2 Å²	63.2	35%	0.351	32%	0.317	S	S	.	.	H	α-helix	trans	-57.5	-51	-178.9	-169	-176.2	71.5	71.8	2.7	111.7	R720 E721 A727 E728 T735	R720-R724 WeakPolarHBondContact O-CB 3.26Å; R720-R724 PolarHBondContact O-N 3.41Å; E721-R724 PolarHBondContact O-N 3.1Å; E721-R724 IonicContact OE1-CZ 3.85Å; E721-R724 IonicContact OE1-NE 3.79Å; E721-R724 IonicContact OE1-NH2 2.68Å; E721-R724 PolarHBondContact OE1-NH2 3.45Å; E721-R724 IonicContact OE2-CZ 3.71Å; E721-R724 IonicContact OE2-NE 2.76Å; E721-R724 PolarHBondContact OE2-NE 3.27Å; E721-R724 IonicContact OE2-NH2 2.69Å; E721-R724 PolarHBondContact OE2-NH2 2.98Å; E721-R724 VanDerWaalsContact OE2-NH2 3.16Å; R724-A727 PolarHBondContact O-N 2.79Å; R724-E728 IonicContact NH1-OE2 3.78Å; R724-E728 PolarHBondContact NH1-OE2 2.91Å; R724-E728 VanDerWaalsContact NH1-OE2 3.08Å; R724-E728 VanDerWaalsContact O-CB 3.28Å; R724-E728 WeakPolarHBondContact O-CB 3.47Å; R724-E728 PolarHBondContact O-N 2.93Å; R724-T735 VanDerWaalsContact CA-O 3.31Å; R724-T735 WeakPolarHBondContact CA-O 3.41Å
725	K	88.8	Confident	81.4	Confident	77 Å²	77	59.3 Å²	59.3	34%	0.335	31%	0.306	S	S	.	.	H	α-helix	trans	-63.2	-40	176.6	-74.3	166.8	169	163.4	0	112.7	E622 E721 I723 A729	E622-K725 HydrophobicContact CG-CD 3.74Å; E622-K725 VanDerWaalsContact OE1-CD 3.24Å; E622-K725 WeakPolarHBondContact OE1-CD 3.36Å; E622-K725 WeakPolarHBondContact OE1-CE 3.5Å; E622-K725 IonicContact OE1-NZ 2.78Å; E622-K725 PolarHBondContact OE1-NZ 3.47Å; E721-K725 HydrophobicContact CG-CD 4.35Å; E721-K725 WeakPolarHBondContact O-CG 3.47Å; E721-K725 PolarHBondContact O-N 3.43Å; E721-K725 VanDerWaalsContact O-N 3.08Å; E721-K725 WeakPolarHBondContact OE1-CE 3.25Å; E721-K725 IonicContact OE1-NZ 3.1Å; I723-K725 PolarHBondContact O-N 3.47Å; K725-A729 WeakPolarHBondContact O-CB 3.33Å; K725-A729 PolarHBondContact O-N 2.67Å
726	A	88.8	Confident	82.9	Confident	3 Å²	3	56.8 Å²	56.8	3%	0.025	30%	0.299	C	S	.	.	H	α-helix	trans	-68.2	-40.8	177.7	0	0	0	0	0	112.1	F615 L618 T619 A722 I723 A729 V730	F615-A726 HydrophobicContact CD2-CB 3.8Å; F615-A726 HydrophobicContact CE2-CB 3.94Å; L618-A726 HydrophobicContact CB-CB 3.73Å; T619-A726 WeakPolarHBondContact OG1-CB 3.34Å; A722-A726 VanDerWaalsContact O-CB 3.27Å; A722-A726 WeakPolarHBondContact O-CB 3.36Å; A722-A726 PolarHBondContact O-N 3.41Å; I723-A726 PolarHBondContact O-N 2.86Å; A726-A729 PolarHBondContact O-N 3.08Å; A726-V730 WeakPolarHBondContact O-CG1 3.23Å; A726-V730 WeakPolarHBondContact O-CG2 3.47Å; A726-V730 PolarHBondContact O-N 3.45Å; A726-V730 VanDerWaalsContact O-N 3.11Å
727	A	87	Confident	83.8	Confident	1 Å²	1	61.3 Å²	61.3	1%	0.008	31%	0.314	C	S	.	.	H	α-helix	trans	-63.7	-48.7	176.9	0	0	0	0	0	111.3	F615 I723 R724 A729 V730 G731 S732	F615-A727 HydrophobicContact CE2-CB 4.13Å; I723-A727 WeakPolarHBondContact O-CB 3.36Å; I723-A727 PolarHBondContact O-N 3.23Å; R724-A727 PolarHBondContact O-N 2.79Å; A727-A729 PolarHBondContact O-N 3.38Å; A727-V730 WeakPolarHBondContact O-CG2 3.35Å; A727-V730 PolarHBondContact O-N 2.68Å; A727-G731 PolarHBondContact O-N 3.27Å; A727-S732 VanDerWaalsContact O-CB 3.22Å; A727-S732 WeakPolarHBondContact O-CB 3.45Å; A727-S732 PolarHBondContact O-N 3.32Å
728	E	85.9	Confident	84.5	Confident	135 Å²	135	56.5 Å²	56.5	63%	0.631	29%	0.287	S	S	*	.	H	α-helix	trans	-56.1	-49.3	173.4	-171.7	173.3	176.1	0	0	110.8	R724 V730 G731	R724-E728 IonicContact NH1-OE2 3.78Å; R724-E728 PolarHBondContact NH1-OE2 2.91Å; R724-E728 VanDerWaalsContact NH1-OE2 3.08Å; R724-E728 VanDerWaalsContact O-CB 3.28Å; R724-E728 WeakPolarHBondContact O-CB 3.47Å; R724-E728 PolarHBondContact O-N 2.93Å; E728-V730 VanDerWaalsContact C-N 3.32Å; E728-V730 PolarHBondContact O-N 2.86Å; E728-G731 PolarHBondContact O-N 3.3Å
729	A	85.9	Confident	84.8	Confident	68 Å²	68	56.6 Å²	56.6	56%	0.562	29%	0.285	S	S	*	.	H	α-helix	trans	-69	-17.9	-178.6	0	0	0	0	0	115.7	L618 K725 A726 A727	L618-A729 HydrophobicContact CD1-CB 3.73Å; K725-A729 WeakPolarHBondContact O-CB 3.33Å; K725-A729 PolarHBondContact O-N 2.67Å; A726-A729 PolarHBondContact O-N 3.08Å; A727-A729 PolarHBondContact O-N 3.38Å
730	V	85.6	Confident	85.2	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.006	28%	0.275	C	S	.	.	H	α-helix	trans	-98.1	-3.8	172.8	-59.8	0	0	0	0	114.1	R611 I614 F615 L618 A726 A727 E728 F738	R611-V730 PolarHBondContact NH1-O 3.47Å; I614-V730 HydrophobicContact CB-CG1 4.14Å; I614-V730 HydrophobicContact CG2-CG1 3.69Å; F615-V730 HydrophobicContact CB-CG1 4.05Å; F615-V730 HydrophobicContact CB-CG2 4.21Å; F615-V730 HydrophobicContact CD2-CG2 4.36Å; L618-V730 HydrophobicContact CD1-CG1 4.1Å; A726-V730 WeakPolarHBondContact O-CG1 3.23Å; A726-V730 WeakPolarHBondContact O-CG2 3.47Å; A726-V730 PolarHBondContact O-N 3.45Å; A726-V730 VanDerWaalsContact O-N 3.11Å; A727-V730 WeakPolarHBondContact O-CG2 3.35Å; A727-V730 PolarHBondContact O-N 2.68Å; E728-V730 VanDerWaalsContact C-N 3.32Å; E728-V730 PolarHBondContact O-N 2.86Å; V730-F738 HydrophobicContact CB-CE2 4.48Å; V730-F738 HydrophobicContact CG2-CD2 3.76Å; V730-F738 HydrophobicContact CG2-CE2 3.75Å
731	G	82.2	Confident	85.8	Confident	33 Å²	33	48.3 Å²	48.3	34%	0.34	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	38	-173.1	0	0	0	0	0	113.1	A727 E728	A727-G731 PolarHBondContact O-N 3.27Å; E728-G731 PolarHBondContact O-N 3.3Å
732	S	85	Confident	86.1	Confident	20 Å²	20	45.4 Å²	45.4	14%	0.14	24%	0.239	C	C	.	.			trans	-68.3	141.6	170.7	-171.9	0	0	0	0	110.7	A727 S734 R737 E739	A727-S732 VanDerWaalsContact O-CB 3.22Å; A727-S732 WeakPolarHBondContact O-CB 3.45Å; A727-S732 PolarHBondContact O-N 3.32Å; S732-S734 VanDerWaalsContact C-N 3.3Å; S732-S734 WeakPolarHBondContact CB-O 3.36Å; S732-S734 PolarHBondContact OG-N 2.76Å; S732-S734 PolarHBondContact OG-O 3.12Å; S732-R737 PolarHBondContact OG-O 3.22Å; S732-E739 CarbonylContact C-O 3.59Å; S732-E739 WeakPolarHBondContact CA-O 3.48Å; S732-E739 PolarHBondContact OG-N 2.98Å; S732-E739 PolarHBondContact OG-O 2.93Å
733	Q	79.6	Confident	86.4	Confident	77 Å²	77	45.5 Å²	45.5	36%	0.36	24%	0.239	S	C	.	.	S	Bend	trans	-76.5	-17.4	173.6	-69.9	172.9	-13.2	0	0	112.9	E739 T741	Q733-E739 PolarHBondContact N-O 2.95Å; Q733-T741 VanDerWaalsContact CD-OG1 3.3Å; Q733-T741 PolarHBondContact NE2-O 3.14Å; Q733-T741 PolarHBondContact NE2-OG1 3.15Å; Q733-T741 VanDerWaalsContact NE2-OG1 3.09Å; Q733-T741 PolarHBondContact OE1-OG1 3.09Å
734	S	82.3	Confident	86.6	Confident	22 Å²	22	44.8 Å²	44.8	15%	0.154	24%	0.236	C	C	.	.			trans	-115.9	140.6	177.1	-147.8	0	0	0	0	110.7	S732 D736	S732-S734 VanDerWaalsContact C-N 3.3Å; S732-S734 WeakPolarHBondContact CB-O 3.36Å; S732-S734 PolarHBondContact OG-N 2.76Å; S732-S734 PolarHBondContact OG-O 3.12Å; S734-D736 VanDerWaalsContact C-N 3.35Å; S734-D736 WeakPolarHBondContact CB-OD1 3.38Å; S734-D736 PolarHBondContact OG-OD1 3.38Å
735	T	83	Confident	86.7	Confident	104 Å²	104	40.4 Å²	40.4	64%	0.638	22%	0.219	S	C	*	.	S	Bend	trans	-86.1	-5.8	-176.9	54.3	0	0	0	0	113.9	R724	R724-T735 VanDerWaalsContact CA-O 3.31Å; R724-T735 WeakPolarHBondContact CA-O 3.41Å
736	D	81	Confident	86.6	Confident	91 Å²	91	36.9 Å²	36.9	49%	0.487	20%	0.204	S	C	.	.	S	Bend	trans	-117.2	-8.8	-173.1	65.8	-27.7	0	0	0	113.4	I723 S734	I723-D736 WeakPolarHBondContact CG2-O 3.45Å; S734-D736 VanDerWaalsContact C-N 3.35Å; S734-D736 WeakPolarHBondContact CB-OD1 3.38Å; S734-D736 PolarHBondContact OG-OD1 3.38Å
737	R	84.3	Confident	86.4	Confident	121 Å²	121	37.8 Å²	37.8	46%	0.457	21%	0.207	S	C	.	.	S	Bend	trans	-157.9	168.2	-179.3	64.8	-177.7	175.5	-100.7	0.1	110.9	S732 E739	S732-R737 PolarHBondContact OG-O 3.22Å; R737-E739 IonicContact CZ-OE2 3.16Å; R737-E739 IonicContact NE-OE2 3.93Å; R737-E739 PolarHBondContact NE-OE2 2.9Å; R737-E739 IonicContact NH2-OE2 3.88Å; R737-E739 PolarHBondContact NH2-OE2 3.45Å; R737-E739 PolarHBondContact O-N 3.06Å
738	F	87.1	Confident	86.2	Confident	25 Å²	25	38.5 Å²	38.5	11%	0.11	21%	0.21	C	C	.	.			trans	-79.4	114.8	168.9	-177.9	-105.1	0	0	0	111	F608 R611 Y612 F615 V730 L740	F608-F738 HydrophobicContact CD1-CE1 4.14Å; F608-F738 AromaticContact CD2-CE1 3.97Å; F608-F738 HydrophobicContact CD2-CE1 3.97Å; F608-F738 HydrophobicContact CE1-CD1 4.3Å; F608-F738 AromaticContact CE1-CE1 3.84Å; F608-F738 HydrophobicContact CE1-CE1 3.84Å; F608-F738 HydrophobicContact CE2-CD1 4.25Å; F608-F738 AromaticContact CE2-CE1 3.65Å; F608-F738 HydrophobicContact CE2-CE1 3.65Å; F608-F738 HydrophobicContact CG-CE1 4.2Å; F608-F738 AromaticContact CZ-CD1 3.89Å; F608-F738 HydrophobicContact CZ-CD1 3.89Å; F608-F738 AromaticContact CZ-CE1 3.57Å; F608-F738 HydrophobicContact CZ-CE1 3.57Å; R611-F738 HydrophobicContact CB-CE2 3.87Å; R611-F738 HydrophobicContact CB-CZ 3.61Å; Y612-F738 HydrophobicContact CD2-CB 4.03Å; Y612-F738 AromaticContact CD2-CD1 3.56Å; Y612-F738 HydrophobicContact CD2-CD1 3.56Å; Y612-F738 HydrophobicContact CD2-CE1 4.19Å; Y612-F738 AromaticContact CD2-CG 3.83Å; Y612-F738 HydrophobicContact CD2-CG 3.83Å; Y612-F738 HydrophobicContact CE2-CB 4.39Å; Y612-F738 HydrophobicContact CE2-CD1 4.47Å; Y612-F738 HydrophobicContact CG-CD1 4.13Å; Y612-F738 HydrophobicContact CG-CE1 4.33Å; F615-F738 HydrophobicContact CB-CD2 3.91Å; F615-F738 HydrophobicContact CB-CE2 4.48Å; F615-F738 HydrophobicContact CB-CG 4.45Å; F615-F738 HydrophobicContact CD1-CB 3.84Å; F615-F738 HydrophobicContact CD1-CG 4.43Å; F615-F738 HydrophobicContact CD2-CB 4.28Å; F615-F738 HydrophobicContact CD2-CD2 4.38Å; F615-F738 HydrophobicContact CE1-CB 4Å; F615-F738 HydrophobicContact CE2-CB 4.43Å; F615-F738 HydrophobicContact CG-CB 3.99Å; F615-F738 HydrophobicContact CG-CD2 4.06Å; F615-F738 HydrophobicContact CG-CG 4.31Å; F615-F738 HydrophobicContact CZ-CB 4.3Å; V730-F738 HydrophobicContact CB-CE2 4.48Å; V730-F738 HydrophobicContact CG2-CD2 3.76Å; V730-F738 HydrophobicContact CG2-CE2 3.75Å; F738-L740 HydrophobicContact CE1-CB 4.41Å; F738-L740 HydrophobicContact CE2-CD1 4.39Å; F738-L740 HydrophobicContact CZ-CB 4.07Å; F738-L740 HydrophobicContact CZ-CD1 3.92Å
739	E	86.6	Confident	85.8	Confident	46 Å²	46	39 Å²	39	22%	0.215	21%	0.21	C	C	.	.			trans	-141	125.2	176.5	-172.4	149.7	-153.7	0	0	110.4	S732 Q733 R737	S732-E739 CarbonylContact C-O 3.59Å; S732-E739 WeakPolarHBondContact CA-O 3.48Å; S732-E739 PolarHBondContact OG-N 2.98Å; S732-E739 PolarHBondContact OG-O 2.93Å; Q733-E739 PolarHBondContact N-O 2.95Å; R737-E739 IonicContact CZ-OE2 3.16Å; R737-E739 IonicContact NE-OE2 3.93Å; R737-E739 PolarHBondContact NE-OE2 2.9Å; R737-E739 IonicContact NH2-OE2 3.88Å; R737-E739 PolarHBondContact NH2-OE2 3.45Å; R737-E739 PolarHBondContact O-N 3.06Å
740	L	89.9	Confident	85.6	Confident	2 Å²	2	39.9 Å²	39.9	1%	0.01	20%	0.201	C	C	.	.			trans	-141.7	115.9	-172.3	-169.9	160.9	0	0	0	108.6	F607 F608 R611 F738 F742 L767	F607-L740 HydrophobicContact CD1-CD1 4.36Å; F607-L740 HydrophobicContact CD1-CD2 4.38Å; F607-L740 HydrophobicContact CE1-CD1 3.98Å; F607-L740 HydrophobicContact CE1-CD2 4.3Å; F608-L740 HydrophobicContact CD2-CB 4.04Å; F608-L740 HydrophobicContact CD2-CD2 4.46Å; F608-L740 HydrophobicContact CE2-CB 4.14Å; R611-L740 HydrophobicContact CB-CD1 3.91Å; R611-L740 HydrophobicContact CG-CD1 3.89Å; F738-L740 HydrophobicContact CE1-CB 4.41Å; F738-L740 HydrophobicContact CE2-CD1 4.39Å; F738-L740 HydrophobicContact CZ-CB 4.07Å; F738-L740 HydrophobicContact CZ-CD1 3.92Å; L740-F742 HydrophobicContact CD2-CD2 4.08Å; L740-F742 HydrophobicContact CD2-CE2 3.37Å; L740-F742 HydrophobicContact CD2-CZ 3.82Å; L740-L767 HydrophobicContact CD1-CD1 4.14Å; L740-L767 HydrophobicContact CD2-CD1 4.32Å; L740-L767 HydrophobicContact CD2-CD2 4.25Å; L740-L767 HydrophobicContact CG-CD1 4.11Å; L740-L767 HydrophobicContact CG-CD2 4.32Å
741	T	92.7	Very high	85.6	Confident	12 Å²	12	40.5 Å²	40.5	7%	0.074	21%	0.205	C	C	.	.			trans	-138.5	154.8	177.8	70.4	0	0	0	0	110.5	K521 K523 Q733 L767	K521-T741 CarbonylContact O-C 3.58Å; K521-T741 VanDerWaalsContact O-CA 3.24Å; K521-T741 WeakPolarHBondContact O-CA 3.48Å; K521-T741 WeakPolarHBondContact O-CB 3.48Å; K523-T741 WeakPolarHBondContact CA-OG1 3.19Å; K523-T741 VanDerWaalsContact CB-OG1 3.24Å; K523-T741 WeakPolarHBondContact CB-OG1 3.14Å; Q733-T741 VanDerWaalsContact CD-OG1 3.3Å; Q733-T741 PolarHBondContact NE2-O 3.14Å; Q733-T741 PolarHBondContact NE2-OG1 3.15Å; Q733-T741 VanDerWaalsContact NE2-OG1 3.09Å; Q733-T741 PolarHBondContact OE1-OG1 3.09Å; T741-L767 VanDerWaalsContact O-CD2 3.25Å; T741-L767 WeakPolarHBondContact O-CD2 3.31Å
742	F	93.2	Very high	85.9	Confident	6 Å²	6	44.7 Å²	44.7	3%	0.026	21%	0.214	C	C	.	.	B	Isolated β-bridge	trans	-115.8	137	-174.9	-66.3	-94.2	0	0	0	111.8	K521 I522 K523 P563 I604 F607 L740 P744 L767 V768 A771	K521-F742 PolarHBondContact O-N 2.86Å; I522-F742 WeakPolarHBondContact CA-O 3.48Å; K523-F742 VanDerWaalsContact CB-C 3.5Å; K523-F742 PolarHBondContact N-O 2.88Å; P563-F742 HydrophobicContact CB-CB 4.49Å; P563-F742 HydrophobicContact CB-CD1 4.4Å; P563-F742 HydrophobicContact CG-CB 3.48Å; P563-F742 VanDerWaalsContact CG-CB 3.48Å; P563-F742 HydrophobicContact CG-CD1 3.8Å; P563-F742 HydrophobicContact CG-CD2 4.34Å; P563-F742 HydrophobicContact CG-CG 3.64Å; I604-F742 HydrophobicContact CD1-CD2 4.29Å; I604-F742 HydrophobicContact CD1-CE1 4.43Å; I604-F742 HydrophobicContact CD1-CE2 3.9Å; I604-F742 HydrophobicContact CD1-CZ 3.95Å; I604-F742 HydrophobicContact CG2-CD2 4.1Å; I604-F742 HydrophobicContact CG2-CE2 3.79Å; F607-F742 HydrophobicContact CD1-CE2 4.43Å; F607-F742 AromaticContact CD1-CZ 3.74Å; F607-F742 HydrophobicContact CD1-CZ 3.74Å; F607-F742 HydrophobicContact CE1-CE1 4.48Å; F607-F742 AromaticContact CE1-CZ 3.79Å; F607-F742 HydrophobicContact CE1-CZ 3.79Å; L740-F742 HydrophobicContact CD2-CD2 4.08Å; L740-F742 HydrophobicContact CD2-CE2 3.37Å; L740-F742 HydrophobicContact CD2-CZ 3.82Å; F742-P744 WeakPolarHBondContact O-CD 3.37Å; F742-L767 HydrophobicContact CD1-CD2 4.09Å; F742-L767 HydrophobicContact CD1-CG 4.08Å; F742-L767 HydrophobicContact CE1-CD2 4.15Å; F742-L767 HydrophobicContact CE1-CG 3.73Å; F742-L767 HydrophobicContact CG-CD2 4.49Å; F742-L767 HydrophobicContact CZ-CG 4.25Å; F742-V768 HydrophobicContact CD1-CG2 3.84Å; F742-V768 HydrophobicContact CE1-CG2 4.38Å; F742-A771 HydrophobicContact CE1-CB 4.04Å; F742-A771 HydrophobicContact CZ-CB 4.16Å
743	N	92	Very high	86.2	Confident	1 Å²	1	45.1 Å²	45.1	1%	0.005	21%	0.214	C	C	.	.			trans	-78	116.2	169	-178.2	-14.9	0	0	0	109.4	K523 D745 I746 D764	K523-N743 HydrophobicContact CB-CB 4.43Å; K523-N743 HydrophobicContact CD-CB 4.32Å; N743-D745 VanDerWaalsContact C-N 3.29Å; N743-D745 PolarHBondContact O-N 2.82Å; N743-D745 PolarHBondContact OD1-N 3.5Å; N743-D745 VanDerWaalsContact OD1-N 3.08Å; N743-I746 HydrophobicContact CB-CB 4.36Å; N743-I746 WeakPolarHBondContact O-CG2 3.5Å; N743-D764 HydrophobicContact CB-CB 4.16Å; N743-D764 WeakPolarHBondContact CB-OD2 3.37Å; N743-D764 PolarHBondContact ND2-OD2 2.93Å
744	P	90.3	Very high	86.7	Confident	3 Å²	3	42.4 Å²	42.4	2%	0.019	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-20.6	-177.2	30.6	-34.7	0	0	0	112.9	I522 R560 F742	I522-P744 HydrophobicContact CG2-CG 4.21Å; R560-P744 WeakPolarHBondContact O-CB 3.43Å; F742-P744 WeakPolarHBondContact O-CD 3.37Å
745	D	89.5	Confident	86.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.2	1.9	-175.3	-70	-16.5	0	0	0	113.5	H525 S540 V541 N743 Q748 V751 F753	H525-D745 IonicContact CE1-OD2 3.87Å; H525-D745 IonicContact NE2-OD2 2.73Å; H525-D745 PolarHBondContact NE2-OD2 3.45Å; S540-D745 VanDerWaalsContact CA-OD1 3.31Å; S540-D745 WeakPolarHBondContact CA-OD1 3.49Å; S540-D745 VanDerWaalsContact CB-OD1 3.27Å; S540-D745 WeakPolarHBondContact CB-OD1 3.34Å; S540-D745 PolarHBondContact OG-OD1 2.83Å; V541-D745 WeakPolarHBondContact CB-OD2 3.41Å; V541-D745 PolarHBondContact N-OD1 3.09Å; V541-D745 PolarHBondContact N-OD2 2.93Å; N743-D745 VanDerWaalsContact C-N 3.29Å; N743-D745 PolarHBondContact O-N 2.82Å; N743-D745 PolarHBondContact OD1-N 3.5Å; N743-D745 VanDerWaalsContact OD1-N 3.08Å; D745-Q748 HydrophobicContact CB-CG 4.4Å; D745-Q748 WeakPolarHBondContact O-CB 3.35Å; D745-Q748 WeakPolarHBondContact O-CG 3.42Å; D745-Q748 PolarHBondContact O-N 2.71Å; D745-Q748 PolarHBondContact OD1-NE2 3.46Å; D745-V751 HydrophobicContact CB-CG1 4.43Å; D745-V751 HydrophobicContact CB-CG2 4.17Å; D745-F753 HydrophobicContact CB-CE1 4.33Å; D745-F753 HydrophobicContact CB-CZ 3.96Å; D745-F753 WeakPolarHBondContact O-CZ 3.21Å
746	I	87.3	Confident	87.2	Confident	4 Å²	4	46.1 Å²	46.1	2%	0.021	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	140.2	176.5	-159	66.2	0	0	0	110.7	P564 N743 Q748 L761 D764 Q765 V768	P564-I746 HydrophobicContact CG-CG2 4.33Å; N743-I746 HydrophobicContact CB-CB 4.36Å; N743-I746 WeakPolarHBondContact O-CG2 3.5Å; I746-Q748 PolarHBondContact O-N 2.71Å; I746-L761 HydrophobicContact CD1-CB 4.28Å; I746-L761 HydrophobicContact CD1-CD2 3.63Å; I746-D764 HydrophobicContact CD1-CB 4.17Å; I746-D764 HydrophobicContact CG1-CB 4.22Å; I746-Q765 HydrophobicContact CD1-CG 3.87Å; I746-Q765 HydrophobicContact CG1-CG 3.73Å; I746-V768 HydrophobicContact CG2-CG2 3.88Å
747	Y	84	Confident	87.5	Confident	22 Å²	22	42.8 Å²	42.8	9%	0.086	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.4	6.3	-168.2	-55.5	-90.6	0	0	0	116.7	P564 L566 L569 I575 P577 K749 Q765	P564-Y747 HydrophobicContact CG-CD2 4.41Å; L566-Y747 HydrophobicContact CD1-CD2 4.49Å; L566-Y747 HydrophobicContact CD1-CE2 3.67Å; L566-Y747 HydrophobicContact CD2-CD1 4.47Å; L566-Y747 HydrophobicContact CD2-CD2 3.53Å; L566-Y747 HydrophobicContact CD2-CE1 4.48Å; L566-Y747 HydrophobicContact CD2-CE2 3.55Å; L566-Y747 HydrophobicContact CD2-CG 4.03Å; L566-Y747 HydrophobicContact CG-CE2 4.26Å; L569-Y747 HydrophobicContact CD2-CG 4.22Å; I575-Y747 HydrophobicContact CG2-CD1 3.7Å; I575-Y747 HydrophobicContact CG2-CE1 4.22Å; P577-Y747 HydrophobicContact CB-CE1 3.75Å; P577-Y747 HydrophobicContact CG-CE1 4.49Å; Y747-K749 PolarHBondContact O-N 3.06Å; Y747-Q765 HydrophobicContact CE1-CG 4.49Å; Y747-Q765 HydrophobicContact CE2-CB 4.34Å; Y747-Q765 HydrophobicContact CE2-CG 3.93Å
748	Q	82.9	Confident	87.4	Confident	16 Å²	16	44 Å²	44	8%	0.075	22%	0.216	C	C	.	.			trans	-72	127.6	169.8	-70.5	-141	59	0	0	112	S540 R560 D745 I746 F750 V751	S540-Q748 PolarHBondContact OG-NE2 2.92Å; R560-Q748 VanDerWaalsContact CD-NE2 3.33Å; D745-Q748 HydrophobicContact CB-CG 4.4Å; D745-Q748 WeakPolarHBondContact O-CB 3.35Å; D745-Q748 WeakPolarHBondContact O-CG 3.42Å; D745-Q748 PolarHBondContact O-N 2.71Å; D745-Q748 PolarHBondContact OD1-NE2 3.46Å; I746-Q748 PolarHBondContact O-N 2.71Å; Q748-F750 PolarHBondContact O-N 2.61Å; Q748-V751 HydrophobicContact CB-CB 4.13Å; Q748-V751 HydrophobicContact CB-CG2 3.73Å; Q748-V751 HydrophobicContact CG-CG2 4.4Å
749	K	78	Confident	87.1	Confident	145 Å²	145	51 Å²	51	63%	0.63	25%	0.249	S	C	*	.	S	Bend	trans	-71.1	-27.4	-175.1	-176.7	169.7	-176.9	169.2	0	114.8	Y747	Y747-K749 PolarHBondContact O-N 3.06Å
750	F	80.9	Confident	87.1	Confident	86 Å²	86	50.2 Å²	50.2	38%	0.377	25%	0.248	S	C	.	.	S	Bend	trans	-100.3	-11.7	-173.2	-53.8	-64.4	0	0	0	113.4	F431 F499 Q748 K752	F431-F750 HydrophobicContact CE2-CE2 4.5Å; F431-F750 HydrophobicContact CZ-CD2 4.2Å; F431-F750 AromaticContact CZ-CE2 3.93Å; F431-F750 HydrophobicContact CZ-CE2 3.93Å; F499-F750 HydrophobicContact CB-CB 4.11Å; F499-F750 HydrophobicContact CB-CD2 4.09Å; F499-F750 HydrophobicContact CB-CG 4.3Å; F499-F750 WeakPolarHBondContact O-CB 3.26Å; Q748-F750 PolarHBondContact O-N 2.61Å; F750-K752 PolarHBondContact O-N 3.5Å
751	V	85.9	Confident	87	Confident	15 Å²	15	51.3 Å²	51.3	9%	0.091	25%	0.254	C	S	.	.			trans	-78.5	118	175.7	174.7	0	0	0	0	109.6	V527 V541 D745 Q748 F753	V527-V751 HydrophobicContact CB-CG1 4.4Å; V527-V751 HydrophobicContact CG1-CG1 3.6Å; V541-V751 HydrophobicContact CB-CG2 4.26Å; V541-V751 HydrophobicContact CG1-CG2 3.46Å; V541-V751 VanDerWaalsContact CG1-CG2 3.46Å; D745-V751 HydrophobicContact CB-CG1 4.43Å; D745-V751 HydrophobicContact CB-CG2 4.17Å; Q748-V751 HydrophobicContact CB-CB 4.13Å; Q748-V751 HydrophobicContact CB-CG2 3.73Å; Q748-V751 HydrophobicContact CG-CG2 4.4Å; V751-F753 HydrophobicContact CB-CE2 4.39Å; V751-F753 HydrophobicContact CB-CZ 4.47Å; V751-F753 HydrophobicContact CG1-CD1 4.15Å; V751-F753 HydrophobicContact CG1-CD2 4.11Å; V751-F753 HydrophobicContact CG1-CE1 3.85Å; V751-F753 HydrophobicContact CG1-CE2 3.8Å; V751-F753 HydrophobicContact CG1-CG 4.28Å; V751-F753 HydrophobicContact CG1-CZ 3.67Å
752	K	88.5	Confident	86.7	Confident	120 Å²	120	54.3 Å²	54.3	52%	0.522	27%	0.272	S	S	.	.			trans	-89.9	113.4	163.8	-172.8	-173.9	172.6	-162.9	0	108.7	V527 V528 F750	V527-K752 CarbonylContact C-O 3.32Å; V527-K752 VanDerWaalsContact CA-O 3.3Å; V527-K752 WeakPolarHBondContact CA-O 3.38Å; V528-K752 HydrophobicContact CB-CD 4.06Å; V528-K752 HydrophobicContact CB-CG 4.3Å; V528-K752 HydrophobicContact CG1-CD 4.23Å; V528-K752 PolarHBondContact N-O 3.04Å; F750-K752 PolarHBondContact O-N 3.5Å
753	F	90.3	Very high	86.4	Confident	30 Å²	30	57.7 Å²	57.7	13%	0.132	29%	0.293	C	S	.	.	B	Isolated β-bridge	trans	-74	159.1	170.3	-66.3	-77.4	0	0	0	111.8	H525 K526 V527 D745 V751 L761	H525-F753 AromaticContact CD2-CE1 3.82Å; K526-F753 WeakPolarHBondContact O-CA 3.43Å; V527-F753 HydrophobicContact CG1-CD1 4.25Å; V527-F753 HydrophobicContact CG1-CE1 4.37Å; D745-F753 HydrophobicContact CB-CE1 4.33Å; D745-F753 HydrophobicContact CB-CZ 3.96Å; D745-F753 WeakPolarHBondContact O-CZ 3.21Å; V751-F753 HydrophobicContact CB-CE2 4.39Å; V751-F753 HydrophobicContact CB-CZ 4.47Å; V751-F753 HydrophobicContact CG1-CD1 4.15Å; V751-F753 HydrophobicContact CG1-CD2 4.11Å; V751-F753 HydrophobicContact CG1-CE1 3.85Å; V751-F753 HydrophobicContact CG1-CE2 3.8Å; V751-F753 HydrophobicContact CG1-CG 4.28Å; V751-F753 HydrophobicContact CG1-CZ 3.67Å; F753-L761 HydrophobicContact CB-CD1 3.73Å; F753-L761 HydrophobicContact CB-CD2 4.36Å; F753-L761 HydrophobicContact CD1-CD2 3.79Å; F753-L761 HydrophobicContact CD2-CD1 3.87Å; F753-L761 HydrophobicContact CD2-CD2 3.74Å; F753-L761 HydrophobicContact CD2-CG 4.49Å; F753-L761 HydrophobicContact CE1-CD2 3.96Å; F753-L761 HydrophobicContact CE2-CD2 3.92Å; F753-L761 HydrophobicContact CG-CD1 3.84Å; F753-L761 HydrophobicContact CG-CD2 3.67Å; F753-L761 HydrophobicContact CG-CG 4.36Å; F753-L761 HydrophobicContact CZ-CD2 4.02Å
754	C	90.4	Very high	86.3	Confident	19 Å²	19	57.7 Å²	57.7	13%	0.128	29%	0.293	C	S	.	.			trans	-72.9	142.8	172.1	-171.9	0	0	0	0	110.9	K526 V528 T534 S756 E757	K526-C754 HydrophobicContact CB-CB 3.72Å; K526-C754 PolarHBondContact O-N 2.89Å; V528-C754 HydrophobicContact CG2-CB 3.97Å; T534-C754 HydrophobicContact CG2-CB 3.83Å; T534-C754 VanDerWaalsContact CG2-SG 3.59Å; T534-C754 PolarHBondContact OG1-SG 3.36Å; C754-S756 PolarHBondContact O-N 3.47Å; C754-S756 PolarHBondContact SG-OG 3.37Å; C754-E757 HydrophobicContact CB-CG 4.41Å; C754-E757 WeakPolarHBondContact O-CB 3.49Å; C754-E757 PolarHBondContact O-N 2.86Å
755	D	87.5	Confident	86.2	Confident	128 Å²	128	60.8 Å²	60.8	68%	0.684	31%	0.307	S	S	*	.	G	3₁₀ helix	trans	-55.5	-26.8	179.2	-51	-7.9	0	0	0	112.2	E757 E758	D755-E757 PolarHBondContact O-N 2.92Å; D755-E758 PolarHBondContact O-N 3.47Å
756	S	88.3	Confident	86.2	Confident	77 Å²	77	66.7 Å²	66.7	54%	0.538	34%	0.335	S	S	.	.	G	3₁₀ helix	trans	-66.1	-16	174	67.7	0	0	0	0	114.7	C754	C754-S756 PolarHBondContact O-N 3.47Å; C754-S756 PolarHBondContact SG-OG 3.37Å
757	E	87.4	Confident	86.4	Confident	20 Å²	20	67 Å²	67	9%	0.093	34%	0.337	C	S	.	.	G	3₁₀ helix	trans	-93.1	-6.8	-179.5	-59.3	-58.8	148	0	0	113.1	K526 C754 D755 Q759 S760 L761	K526-E757 HydrophobicContact CB-CG 3.99Å; K526-E757 WeakPolarHBondContact CD-OE1 3.43Å; K526-E757 IonicContact NZ-OE1 2.9Å; C754-E757 HydrophobicContact CB-CG 4.41Å; C754-E757 WeakPolarHBondContact O-CB 3.49Å; C754-E757 PolarHBondContact O-N 2.86Å; D755-E757 PolarHBondContact O-N 2.92Å; E757-Q759 VanDerWaalsContact C-N 3.31Å; E757-Q759 PolarHBondContact O-N 2.85Å; E757-Q759 VanDerWaalsContact O-N 3.13Å; E757-S760 CarbonylContact O-C 3.57Å; E757-S760 VanDerWaalsContact O-CA 3.28Å; E757-S760 WeakPolarHBondContact O-CA 3.41Å; E757-S760 VanDerWaalsContact O-CB 3.24Å; E757-S760 WeakPolarHBondContact O-CB 3.45Å; E757-S760 PolarHBondContact O-N 3.04Å; E757-S760 WeakPolarHBondContact OE2-CB 3.47Å; E757-S760 PolarHBondContact OE2-OG 3.3Å; E757-L761 HydrophobicContact CB-CD1 4.36Å; E757-L761 HydrophobicContact CB-CG 4.12Å; E757-L761 WeakPolarHBondContact O-CG 3.16Å; E757-L761 PolarHBondContact O-N 2.96Å
758	E	82.6	Confident	86.7	Confident	148 Å²	148	66 Å²	66	69%	0.692	33%	0.333	S	S	*	.	H	α-helix	trans	-51	-45.1	-170.4	-173.1	176.9	-149.5	0	0	113.9	D755	D755-E758 PolarHBondContact O-N 3.47Å
759	Q	81.5	Confident	87.2	Confident	171 Å²	171	66.1 Å²	66.1	80%	0.799	34%	0.335	S	S	*	.	H	α-helix	trans	-69.8	-36.7	175.2	-61.9	178.6	0.6	0	0	112.4	E757 T762	E757-Q759 VanDerWaalsContact C-N 3.31Å; E757-Q759 PolarHBondContact O-N 2.85Å; E757-Q759 VanDerWaalsContact O-N 3.13Å; Q759-T762 PolarHBondContact O-N 3.46Å
760	S	85.5	Confident	87.9	Confident	29 Å²	29	61 Å²	61	20%	0.203	32%	0.317	C	S	.	.	H	α-helix	trans	-68.1	-35.4	-179.7	136.2	0	0	0	0	112.1	K523 E757 V763 D764	K523-S760 PolarHBondContact NZ-O 3.12Å; K523-S760 PolarHBondContact NZ-OG 2.79Å; E757-S760 CarbonylContact O-C 3.57Å; E757-S760 VanDerWaalsContact O-CA 3.28Å; E757-S760 WeakPolarHBondContact O-CA 3.41Å; E757-S760 VanDerWaalsContact O-CB 3.24Å; E757-S760 WeakPolarHBondContact O-CB 3.45Å; E757-S760 PolarHBondContact O-N 3.04Å; E757-S760 WeakPolarHBondContact OE2-CB 3.47Å; E757-S760 PolarHBondContact OE2-OG 3.3Å; S760-V763 PolarHBondContact O-N 3.47Å; S760-D764 VanDerWaalsContact O-CG 3.31Å; S760-D764 PolarHBondContact O-N 2.72Å; S760-D764 VanDerWaalsContact O-N 3.09Å
761	L	87.3	Confident	88.5	Confident	26 Å²	26	56.9 Å²	56.9	14%	0.136	30%	0.299	C	S	.	.	H	α-helix	trans	-67.6	-33.4	177.1	-66.6	169.9	0	0	0	113.1	I746 F753 E757 D764 Q765	I746-L761 HydrophobicContact CD1-CB 4.28Å; I746-L761 HydrophobicContact CD1-CD2 3.63Å; F753-L761 HydrophobicContact CB-CD1 3.73Å; F753-L761 HydrophobicContact CB-CD2 4.36Å; F753-L761 HydrophobicContact CD1-CD2 3.79Å; F753-L761 HydrophobicContact CD2-CD1 3.87Å; F753-L761 HydrophobicContact CD2-CD2 3.74Å; F753-L761 HydrophobicContact CD2-CG 4.49Å; F753-L761 HydrophobicContact CE1-CD2 3.96Å; F753-L761 HydrophobicContact CE2-CD2 3.92Å; F753-L761 HydrophobicContact CG-CD1 3.84Å; F753-L761 HydrophobicContact CG-CD2 3.67Å; F753-L761 HydrophobicContact CG-CG 4.36Å; F753-L761 HydrophobicContact CZ-CD2 4.02Å; E757-L761 HydrophobicContact CB-CD1 4.36Å; E757-L761 HydrophobicContact CB-CG 4.12Å; E757-L761 WeakPolarHBondContact O-CG 3.16Å; E757-L761 PolarHBondContact O-N 2.96Å; L761-D764 PolarHBondContact O-N 3.41Å; L761-Q765 VanDerWaalsContact O-CG 3.26Å; L761-Q765 WeakPolarHBondContact O-CG 3.35Å; L761-Q765 PolarHBondContact O-N 3.07Å
762	T	86.4	Confident	89	Confident	74 Å²	74	56.1 Å²	56.1	45%	0.454	30%	0.295	S	S	.	.	H	α-helix	trans	-65.8	-44	178.3	-56.9	0	0	0	0	110.4	Q759 D764 Q765 E766	Q759-T762 PolarHBondContact O-N 3.46Å; T762-D764 PolarHBondContact O-N 2.65Å; T762-Q765 PolarHBondContact O-N 3.42Å; T762-E766 PolarHBondContact O-N 2.86Å; T762-E766 VanDerWaalsContact O-N 3.09Å
763	V	87.6	Confident	89.3	Confident	77 Å²	77	53.1 Å²	53.1	47%	0.467	28%	0.283	S	S	.	.	H	α-helix	trans	-63.9	-39.8	174.3	-176.6	0	0	0	0	111.6	S760 Q765 E766 L767	S760-V763 PolarHBondContact O-N 3.47Å; V763-Q765 VanDerWaalsContact C-N 3.34Å; V763-Q765 PolarHBondContact O-N 2.58Å; V763-E766 PolarHBondContact O-N 2.84Å; V763-L767 VanDerWaalsContact O-CB 3.32Å; V763-L767 WeakPolarHBondContact O-CB 3.31Å; V763-L767 PolarHBondContact O-N 2.72Å
764	D	89.9	Confident	89.6	Confident	2 Å²	2	52.2 Å²	52.2	1%	0.011	28%	0.279	C	S	.	.	H	α-helix	trans	-61.8	-40.2	175.4	-69.3	-15.4	0	0	0	112.3	K523 N743 I746 S760 L761 T762 L767 V768	K523-D764 WeakPolarHBondContact CD-OD1 3.37Å; K523-D764 WeakPolarHBondContact CE-OD1 3.37Å; K523-D764 IonicContact NZ-OD1 3.16Å; K523-D764 PolarHBondContact NZ-OD1 2.91Å; K523-D764 IonicContact NZ-OD2 2.72Å; K523-D764 PolarHBondContact NZ-OD2 2.89Å; N743-D764 HydrophobicContact CB-CB 4.16Å; N743-D764 WeakPolarHBondContact CB-OD2 3.37Å; N743-D764 PolarHBondContact ND2-OD2 2.93Å; I746-D764 HydrophobicContact CD1-CB 4.17Å; I746-D764 HydrophobicContact CG1-CB 4.22Å; S760-D764 VanDerWaalsContact O-CG 3.31Å; S760-D764 PolarHBondContact O-N 2.72Å; S760-D764 VanDerWaalsContact O-N 3.09Å; L761-D764 PolarHBondContact O-N 3.41Å; T762-D764 PolarHBondContact O-N 2.65Å; D764-L767 PolarHBondContact O-N 3.23Å; D764-V768 WeakPolarHBondContact O-CG2 3.15Å; D764-V768 PolarHBondContact O-N 2.81Å
765	Q	89.2	Confident	89.9	Confident	67 Å²	67	51.4 Å²	51.4	31%	0.313	27%	0.273	S	S	.	.	H	α-helix	trans	-64.9	-45.3	177.4	-72.4	171	25	0	0	111.9	I746 Y747 L761 T762 V763 L767 C769	I746-Q765 HydrophobicContact CD1-CG 3.87Å; I746-Q765 HydrophobicContact CG1-CG 3.73Å; Y747-Q765 HydrophobicContact CE1-CG 4.49Å; Y747-Q765 HydrophobicContact CE2-CB 4.34Å; Y747-Q765 HydrophobicContact CE2-CG 3.93Å; L761-Q765 VanDerWaalsContact O-CG 3.26Å; L761-Q765 WeakPolarHBondContact O-CG 3.35Å; L761-Q765 PolarHBondContact O-N 3.07Å; T762-Q765 PolarHBondContact O-N 3.42Å; V763-Q765 VanDerWaalsContact C-N 3.34Å; V763-Q765 PolarHBondContact O-N 2.58Å; Q765-L767 VanDerWaalsContact C-N 3.32Å; Q765-L767 PolarHBondContact O-N 2.92Å; Q765-C769 WeakPolarHBondContact O-CB 3.33Å; Q765-C769 PolarHBondContact O-N 3.44Å
766	E	88.4	Confident	90.4	Very high	125 Å²	125	45.5 Å²	45.5	58%	0.584	24%	0.242	S	C	*	.	H	α-helix	trans	-64.5	-35.6	176	-71.1	-179.2	-176.7	0	0	112.3	T762 V763 S770	T762-E766 PolarHBondContact O-N 2.86Å; T762-E766 VanDerWaalsContact O-N 3.09Å; V763-E766 PolarHBondContact O-N 2.84Å; E766-S770 VanDerWaalsContact O-CB 3.27Å; E766-S770 WeakPolarHBondContact O-CB 3.43Å; E766-S770 PolarHBondContact O-N 2.78Å; E766-S770 PolarHBondContact O-OG 3.08Å
767	L	91.1	Very high	90.8	Very high	11 Å²	11	44.6 Å²	44.6	6%	0.058	23%	0.23	C	C	.	.	H	α-helix	trans	-69.3	-44.4	178.2	-174.2	64	0	0	0	112.1	F607 L740 T741 F742 V763 D764 Q765 S770 A771	F607-L767 HydrophobicContact CE1-CD1 3.85Å; F607-L767 HydrophobicContact CZ-CD1 4.19Å; L740-L767 HydrophobicContact CD1-CD1 4.14Å; L740-L767 HydrophobicContact CD2-CD1 4.32Å; L740-L767 HydrophobicContact CD2-CD2 4.25Å; L740-L767 HydrophobicContact CG-CD1 4.11Å; L740-L767 HydrophobicContact CG-CD2 4.32Å; T741-L767 VanDerWaalsContact O-CD2 3.25Å; T741-L767 WeakPolarHBondContact O-CD2 3.31Å; F742-L767 HydrophobicContact CD1-CD2 4.09Å; F742-L767 HydrophobicContact CD1-CG 4.08Å; F742-L767 HydrophobicContact CE1-CD2 4.15Å; F742-L767 HydrophobicContact CE1-CG 3.73Å; F742-L767 HydrophobicContact CG-CD2 4.49Å; F742-L767 HydrophobicContact CZ-CG 4.25Å; V763-L767 VanDerWaalsContact O-CB 3.32Å; V763-L767 WeakPolarHBondContact O-CB 3.31Å; V763-L767 PolarHBondContact O-N 2.72Å; D764-L767 PolarHBondContact O-N 3.23Å; Q765-L767 VanDerWaalsContact C-N 3.32Å; Q765-L767 PolarHBondContact O-N 2.92Å; L767-S770 WeakPolarHBondContact O-CB 3.49Å; L767-S770 PolarHBondContact O-N 3.34Å; L767-A771 PolarHBondContact O-N 2.88Å; L767-A771 VanDerWaalsContact O-N 3.08Å
768	V	91.9	Very high	91.2	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.006	25%	0.246	C	C	.	.	H	α-helix	trans	-66.7	-40.8	174.3	179.8	0	0	0	0	110.9	P563 P564 L566 F742 I746 D764 S770 A771 C772	P563-V768 HydrophobicContact CB-CG1 4.36Å; P563-V768 HydrophobicContact CB-CG2 4.1Å; P564-V768 HydrophobicContact CG-CG1 4.48Å; P564-V768 WeakPolarHBondContact O-CG1 3.48Å; L566-V768 HydrophobicContact CD1-CB 4.14Å; L566-V768 HydrophobicContact CD1-CG1 3.69Å; L566-V768 HydrophobicContact CD2-CG1 4.32Å; L566-V768 HydrophobicContact CG-CG1 3.76Å; F742-V768 HydrophobicContact CD1-CG2 3.84Å; F742-V768 HydrophobicContact CE1-CG2 4.38Å; I746-V768 HydrophobicContact CG2-CG2 3.88Å; D764-V768 WeakPolarHBondContact O-CG2 3.15Å; D764-V768 PolarHBondContact O-N 2.81Å; V768-S770 VanDerWaalsContact C-N 3.32Å; V768-S770 PolarHBondContact O-N 2.99Å; V768-A771 PolarHBondContact O-N 2.79Å; V768-A771 VanDerWaalsContact O-N 3.17Å; V768-C772 PolarHBondContact O-N 3.47Å; V768-C772 PolarHBondContact O-SG 3.15Å
769	C	92.3	Very high	91.8	Very high	18 Å²	18	42.2 Å²	42.2	12%	0.122	22%	0.218	C	C	.	.	H	α-helix	trans	-60.5	-42	174.2	-169.7	0	0	0	0	111.7	L566 Q765 A771 C772 E773	L566-C769 HydrophobicContact CD1-CB 4.21Å; Q765-C769 WeakPolarHBondContact O-CB 3.33Å; Q765-C769 PolarHBondContact O-N 3.44Å; C769-A771 VanDerWaalsContact C-N 3.31Å; C769-A771 PolarHBondContact O-N 3.15Å; C769-C772 PolarHBondContact O-N 3.23Å; C769-E773 PolarHBondContact O-N 3.18Å
770	S	93	Very high	92.6	Very high	36 Å²	36	34.1 Å²	34.1	25%	0.252	18%	0.18	S	C	.	.	H	α-helix	trans	-59.8	-36.6	174.2	-72.1	0	0	0	0	113.5	F607 R611 E766 L767 V768 F774	F607-S770 WeakPolarHBondContact CE2-O 3.3Å; R611-S770 VanDerWaalsContact NH2-CB 3.3Å; R611-S770 PolarHBondContact NH2-OG 3.27Å; R611-S770 VanDerWaalsContact NH2-OG 3.15Å; E766-S770 VanDerWaalsContact O-CB 3.27Å; E766-S770 WeakPolarHBondContact O-CB 3.43Å; E766-S770 PolarHBondContact O-N 2.78Å; E766-S770 PolarHBondContact O-OG 3.08Å; L767-S770 WeakPolarHBondContact O-CB 3.49Å; L767-S770 PolarHBondContact O-N 3.34Å; V768-S770 VanDerWaalsContact C-N 3.32Å; V768-S770 PolarHBondContact O-N 2.99Å; S770-F774 WeakPolarHBondContact O-CB 3.35Å; S770-F774 PolarHBondContact O-N 3.13Å
771	A	94.3	Very high	93.2	Very high	0 Å²	0	35 Å²	35	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-73.3	-39.3	176.2	0	0	0	0	0	112	L599 F607 F742 L767 V768 C769 E773 F774 L775	L599-A771 HydrophobicContact CD1-CB 3.8Å; F607-A771 HydrophobicContact CD1-CB 4.23Å; F607-A771 HydrophobicContact CD2-CB 4.34Å; F607-A771 HydrophobicContact CE1-CB 4.22Å; F607-A771 HydrophobicContact CE2-CB 4.34Å; F607-A771 HydrophobicContact CG-CB 4.27Å; F607-A771 HydrophobicContact CZ-CB 4.27Å; F742-A771 HydrophobicContact CE1-CB 4.04Å; F742-A771 HydrophobicContact CZ-CB 4.16Å; L767-A771 PolarHBondContact O-N 2.88Å; L767-A771 VanDerWaalsContact O-N 3.08Å; V768-A771 PolarHBondContact O-N 2.79Å; V768-A771 VanDerWaalsContact O-N 3.17Å; C769-A771 VanDerWaalsContact C-N 3.31Å; C769-A771 PolarHBondContact O-N 3.15Å; A771-E773 VanDerWaalsContact C-N 3.33Å; A771-E773 PolarHBondContact O-N 3.11Å; A771-F774 PolarHBondContact O-N 3.16Å; A771-L775 PolarHBondContact O-N 3.26Å; A771-L775 VanDerWaalsContact O-N 3.13Å
772	C	95	Very high	93.6	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.4	-37.4	173.6	-63.9	0	0	0	0	112.1	L566 N567 V768 C769	L566-C772 HydrophobicContact CB-CB 4.46Å; L566-C772 PolarHBondContact N-SG 3.36Å; N567-C772 PolarHBondContact ND2-O 3.26Å; V768-C772 PolarHBondContact O-N 3.47Å; V768-C772 PolarHBondContact O-SG 3.15Å; C769-C772 PolarHBondContact O-N 3.23Å
773	E	95.8	Very high	94	Very high	56 Å²	56	31.2 Å²	31.2	26%	0.262	17%	0.165	S	C	.	.	H	α-helix	trans	-69.8	-45.8	173.2	-172.2	-174.6	101.9	0	0	112	S580 L583 C769 A771 L775 V776 L777	S580-E773 WeakPolarHBondContact CB-OE2 3.17Å; S580-E773 PolarHBondContact OG-OE2 3.29Å; L583-E773 HydrophobicContact CD1-CB 4.05Å; L583-E773 HydrophobicContact CD1-CG 4.42Å; L583-E773 HydrophobicContact CG-CG 4.48Å; C769-E773 PolarHBondContact O-N 3.18Å; A771-E773 VanDerWaalsContact C-N 3.33Å; A771-E773 PolarHBondContact O-N 3.11Å; E773-L775 PolarHBondContact O-N 3.3Å; E773-V776 PolarHBondContact O-N 2.83Å; E773-V776 VanDerWaalsContact O-N 3.1Å; E773-L777 HydrophobicContact CG-CB 4.35Å; E773-L777 HydrophobicContact CG-CD1 3.42Å; E773-L777 VanDerWaalsContact CG-CD1 3.42Å; E773-L777 HydrophobicContact CG-CG 3.79Å; E773-L777 PolarHBondContact O-N 3.13Å
774	F	96.3	Very high	94.4	Very high	11 Å²	11	28 Å²	28	5%	0.048	15%	0.145	C	C	.	.	H	α-helix	trans	-54.1	-42.5	178.2	171.2	-97.1	0	0	0	111.9	L603 A606 F607 H610 S770 A771 V776 K778 Q779	L603-F774 HydrophobicContact CD1-CD1 3.79Å; L603-F774 HydrophobicContact CD1-CE1 3.93Å; A606-F774 HydrophobicContact CB-CE1 4.2Å; A606-F774 HydrophobicContact CB-CZ 4.49Å; F607-F774 HydrophobicContact CB-CD1 3.99Å; F607-F774 HydrophobicContact CB-CE1 4.18Å; F607-F774 HydrophobicContact CD2-CB 3.6Å; F607-F774 AromaticContact CD2-CD1 3.94Å; F607-F774 HydrophobicContact CD2-CD1 3.94Å; F607-F774 HydrophobicContact CD2-CD2 4.15Å; F607-F774 AromaticContact CD2-CG 3.63Å; F607-F774 HydrophobicContact CD2-CG 3.63Å; F607-F774 HydrophobicContact CE2-CB 3.97Å; F607-F774 HydrophobicContact CE2-CG 4.41Å; F607-F774 HydrophobicContact CG-CD1 4.47Å; H610-F774 HydrophobicContact CB-CD2 4.43Å; H610-F774 HydrophobicContact CB-CE2 3.6Å; H610-F774 HydrophobicContact CB-CZ 3.94Å; H610-F774 AromaticContact CD2-CD2 3.75Å; H610-F774 AromaticContact CD2-CE2 3.64Å; H610-F774 AromaticContact CG-CD2 3.96Å; H610-F774 AromaticContact CG-CE2 3.35Å; H610-F774 AromaticContact ND1-CE2 3.85Å; S770-F774 WeakPolarHBondContact O-CB 3.35Å; S770-F774 PolarHBondContact O-N 3.13Å; A771-F774 PolarHBondContact O-N 3.16Å; F774-V776 PolarHBondContact O-N 2.95Å; F774-K778 HydrophobicContact CD2-CB 3.9Å; F774-K778 HydrophobicContact CD2-CD 3.76Å; F774-K778 HydrophobicContact CD2-CG 4.43Å; F774-K778 HydrophobicContact CE2-CB 4.01Å; F774-K778 HydrophobicContact CE2-CD 4.23Å; F774-K778 WeakPolarHBondContact O-CA 3.22Å; F774-K778 WeakPolarHBondContact O-CB 3.38Å; F774-K778 PolarHBondContact O-N 2.98Å; F774-Q779 HydrophobicContact CD1-CB 4.4Å; F774-Q779 HydrophobicContact CE1-CB 4.06Å; F774-Q779 HydrophobicContact CE1-CG 4.4Å; F774-Q779 PolarHBondContact O-N 3.47Å
775	L	97.2	Very high	94.8	Very high	2 Å²	2	34 Å²	34	1%	0.01	17%	0.168	C	C	.	.	I	π-helix	trans	-55.1	-50.3	175.5	176.8	56.8	0	0	0	112.5	L603 A771 E773 Q779 I780 I809 Y813	L603-L775 HydrophobicContact CD1-CB 4.04Å; L603-L775 HydrophobicContact CD1-CD1 3.97Å; L603-L775 HydrophobicContact CD2-CB 3.9Å; L603-L775 HydrophobicContact CD2-CD1 4.16Å; L603-L775 HydrophobicContact CD2-CD2 3.84Å; L603-L775 HydrophobicContact CD2-CG 4.18Å; A771-L775 PolarHBondContact O-N 3.26Å; A771-L775 VanDerWaalsContact O-N 3.13Å; E773-L775 PolarHBondContact O-N 3.3Å; L775-Q779 HydrophobicContact CD1-CB 4.35Å; L775-Q779 PolarHBondContact O-N 2.86Å; L775-I780 HydrophobicContact CD1-CD1 4.32Å; L775-I780 HydrophobicContact CD1-CG1 4.25Å; L775-I780 HydrophobicContact CG-CD1 4.41Å; L775-I780 WeakPolarHBondContact O-CG1 3.45Å; L775-I780 PolarHBondContact O-N 3.38Å; L775-I809 HydrophobicContact CD1-CB 4.38Å; L775-I809 HydrophobicContact CD1-CG1 3.89Å; L775-Y813 HydrophobicContact CD2-CD1 4.5Å; L775-Y813 HydrophobicContact CD2-CD2 4.18Å; L775-Y813 HydrophobicContact CD2-CE1 3.85Å; L775-Y813 HydrophobicContact CD2-CE2 3.49Å; L775-Y813 VanDerWaalsContact CD2-CE2 3.49Å; L775-Y813 WeakPolarHBondContact CD2-OH 3.35Å; L775-Y813 HydrophobicContact CG-CE1 4.28Å
776	V	97.3	Very high	95	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.03	16%	0.162	C	C	.	.	I	π-helix	trans	-80.1	-44.1	-173	180	0	0	0	0	112.2	L583 L586 Y588 E773 F774 P781 Y813	L583-V776 HydrophobicContact CD2-CB 3.69Å; L583-V776 HydrophobicContact CD2-CG1 3.87Å; L583-V776 HydrophobicContact CD2-CG2 3.85Å; L586-V776 HydrophobicContact CD1-CG1 3.67Å; Y588-V776 HydrophobicContact CE2-CB 4.44Å; Y588-V776 HydrophobicContact CE2-CG1 3.7Å; Y588-V776 HydrophobicContact CE2-CG2 3.84Å; E773-V776 PolarHBondContact O-N 2.83Å; E773-V776 VanDerWaalsContact O-N 3.1Å; F774-V776 PolarHBondContact O-N 2.95Å; V776-P781 WeakPolarHBondContact O-CD 3.26Å; V776-Y813 HydrophobicContact CG2-CE1 3.85Å
777	L	96.5	Very high	95.2	Very high	57 Å²	57	26.5 Å²	26.5	30%	0.298	13%	0.134	S	C	.	.	I	π-helix	trans	-92.3	-15.1	-171.4	-57.4	-169.4	0	0	0	114.1	E582 L586 E773	E582-L777 HydrophobicContact CB-CD1 3.79Å; E582-L777 HydrophobicContact CB-CD2 4.36Å; E582-L777 HydrophobicContact CG-CD1 4.19Å; L586-L777 HydrophobicContact CD1-CD2 3.7Å; E773-L777 HydrophobicContact CG-CB 4.35Å; E773-L777 HydrophobicContact CG-CD1 3.42Å; E773-L777 VanDerWaalsContact CG-CD1 3.42Å; E773-L777 HydrophobicContact CG-CG 3.79Å; E773-L777 PolarHBondContact O-N 3.13Å
778	K	95.7	Very high	95.3	Very high	96 Å²	96	29.1 Å²	29.1	42%	0.417	15%	0.148	S	C	.	.	I	π-helix	trans	-128.5	-50.5	-178.4	-65.3	171.2	-176.3	165.1	0	113.1	F774 A782	F774-K778 HydrophobicContact CD2-CB 3.9Å; F774-K778 HydrophobicContact CD2-CD 3.76Å; F774-K778 HydrophobicContact CD2-CG 4.43Å; F774-K778 HydrophobicContact CE2-CB 4.01Å; F774-K778 HydrophobicContact CE2-CD 4.23Å; F774-K778 WeakPolarHBondContact O-CA 3.22Å; F774-K778 WeakPolarHBondContact O-CB 3.38Å; F774-K778 PolarHBondContact O-N 2.98Å; K778-A782 WeakPolarHBondContact O-CB 3.46Å; K778-A782 PolarHBondContact O-N 3Å
779	Q	96.5	Very high	95.2	Very high	23 Å²	23	32 Å²	32	11%	0.107	17%	0.168	C	C	.	.	I	π-helix	trans	-72.5	-47.9	-172	-165.9	69.5	-12.1	0	0	113.3	L603 F774 L775 A782 F783 R807 I809	L603-Q779 HydrophobicContact CD1-CB 4.43Å; L603-Q779 HydrophobicContact CD1-CG 4.21Å; F774-Q779 HydrophobicContact CD1-CB 4.4Å; F774-Q779 HydrophobicContact CE1-CB 4.06Å; F774-Q779 HydrophobicContact CE1-CG 4.4Å; F774-Q779 PolarHBondContact O-N 3.47Å; L775-Q779 HydrophobicContact CD1-CB 4.35Å; L775-Q779 PolarHBondContact O-N 2.86Å; Q779-A782 WeakPolarHBondContact O-CB 3.44Å; Q779-A782 PolarHBondContact O-N 2.77Å; Q779-A782 VanDerWaalsContact O-N 3.15Å; Q779-F783 PolarHBondContact O-N 3.34Å; Q779-R807 VanDerWaalsContact CG-O 3.24Å; Q779-R807 WeakPolarHBondContact CG-O 3.45Å; Q779-R807 PolarHBondContact NE2-O 3.25Å; Q779-I809 HydrophobicContact CG-CG1 4.36Å
780	I	97.6	Very high	95	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-64.4	-43.6	174.5	-65.4	166.7	0	0	0	111.2	L775 A782 F783 V784 I809 Y813 R816 V817	L775-I780 HydrophobicContact CD1-CD1 4.32Å; L775-I780 HydrophobicContact CD1-CG1 4.25Å; L775-I780 HydrophobicContact CG-CD1 4.41Å; L775-I780 WeakPolarHBondContact O-CG1 3.45Å; L775-I780 PolarHBondContact O-N 3.38Å; I780-A782 VanDerWaalsContact C-N 3.26Å; I780-A782 PolarHBondContact O-N 3.44Å; I780-F783 WeakPolarHBondContact O-CB 3.34Å; I780-F783 PolarHBondContact O-N 3.29Å; I780-V784 WeakPolarHBondContact O-CG2 3.47Å; I780-V784 PolarHBondContact O-N 2.72Å; I780-I809 HydrophobicContact CD1-CG2 4.12Å; I780-I809 HydrophobicContact CG1-CD1 3.83Å; I780-I809 HydrophobicContact CG1-CG1 3.91Å; I780-I809 HydrophobicContact CG1-CG2 3.97Å; I780-Y813 HydrophobicContact CD1-CD1 3.67Å; I780-Y813 HydrophobicContact CD1-CE1 4.48Å; I780-Y813 HydrophobicContact CD1-CG 4.03Å; I780-R816 HydrophobicContact CD1-CB 4.17Å; I780-R816 HydrophobicContact CD1-CG 3.73Å; I780-R816 HydrophobicContact CG2-CG 4.15Å; I780-V817 HydrophobicContact CG2-CG2 4.15Å
781	P	97.1	Very high	94.7	Very high	48 Å²	48	33.5 Å²	33.5	31%	0.312	18%	0.176	S	C	.	.	H	α-helix	trans	-60.8	-26.4	170.1	-29.9	38.3	0	0	0	115.2	V776 R785	V776-P781 WeakPolarHBondContact O-CD 3.26Å; P781-R785 WeakPolarHBondContact O-CB 3.43Å; P781-R785 PolarHBondContact O-N 3.23Å
782	A	96.2	Very high	94.4	Very high	20 Å²	20	34.3 Å²	34.3	17%	0.165	18%	0.18	C	C	.	.	H	α-helix	trans	-73.4	-47.1	171	0	0	0	0	0	111.4	K778 Q779 I780 V784 R785 D786	K778-A782 WeakPolarHBondContact O-CB 3.46Å; K778-A782 PolarHBondContact O-N 3Å; Q779-A782 WeakPolarHBondContact O-CB 3.44Å; Q779-A782 PolarHBondContact O-N 2.77Å; Q779-A782 VanDerWaalsContact O-N 3.15Å; I780-A782 VanDerWaalsContact C-N 3.26Å; I780-A782 PolarHBondContact O-N 3.44Å; A782-V784 VanDerWaalsContact C-N 3.29Å; A782-V784 PolarHBondContact O-N 3.4Å; A782-R785 WeakPolarHBondContact O-CA 3.17Å; A782-R785 VanDerWaalsContact O-CB 3.25Å; A782-R785 WeakPolarHBondContact O-CB 3.46Å; A782-R785 PolarHBondContact O-N 2.8Å; A782-D786 PolarHBondContact O-N 3.17Å
783	F	96	Very high	94.3	Very high	1 Å²	1	36.1 Å²	36.1	0%	0.004	19%	0.192	C	C	.	.	H	α-helix	trans	-53.6	-44.2	173.3	175.6	-87.4	0	0	0	112.2	Q779 I780 R785 D786 A787 I792 L800 L803 M804 R807 I809 V817	Q779-F783 PolarHBondContact O-N 3.34Å; I780-F783 WeakPolarHBondContact O-CB 3.34Å; I780-F783 PolarHBondContact O-N 3.29Å; F783-R785 VanDerWaalsContact C-N 3.34Å; F783-R785 PolarHBondContact O-N 3.34Å; F783-D786 PolarHBondContact O-N 3.49Å; F783-A787 PolarHBondContact O-N 3.41Å; F783-A787 VanDerWaalsContact O-N 3.08Å; F783-I792 HydrophobicContact CD2-CD1 3.63Å; F783-I792 HydrophobicContact CE1-CD1 4.41Å; F783-I792 HydrophobicContact CE2-CD1 3.51Å; F783-I792 HydrophobicContact CG-CD1 4.15Å; F783-I792 HydrophobicContact CZ-CD1 3.92Å; F783-L800 HydrophobicContact CE1-CD1 4.47Å; F783-L800 HydrophobicContact CZ-CD1 3.86Å; F783-L803 HydrophobicContact CE2-CB 4.19Å; F783-M804 HydrophobicContact CE1-CG 4.46Å; F783-M804 HydrophobicContact CE2-CG 3.97Å; F783-M804 HydrophobicContact CZ-CG 3.84Å; F783-R807 HydrophobicContact CD2-CG 4.24Å; F783-I809 HydrophobicContact CB-CD1 3.71Å; F783-I809 HydrophobicContact CD2-CD1 4.08Å; F783-I809 HydrophobicContact CG-CD1 3.9Å; F783-V817 HydrophobicContact CE1-CG1 4.08Å
784	V	96.3	Very high	94.2	Very high	9 Å²	9	33.5 Å²	33.5	6%	0.055	18%	0.179	C	C	.	.	H	α-helix	trans	-67.8	-32.4	176.4	175.7	0	0	0	0	112.2	I780 A782 A787 L788 V821 L827	I780-V784 WeakPolarHBondContact O-CG2 3.47Å; I780-V784 PolarHBondContact O-N 2.72Å; A782-V784 VanDerWaalsContact C-N 3.29Å; A782-V784 PolarHBondContact O-N 3.4Å; V784-A787 PolarHBondContact O-N 2.91Å; V784-L788 WeakPolarHBondContact O-CG 3.38Å; V784-L788 PolarHBondContact O-N 3.13Å; V784-V821 HydrophobicContact CG1-CG1 4.31Å; V784-V821 HydrophobicContact CG2-CG1 3.94Å; V784-L827 HydrophobicContact CG1-CD1 4.01Å
785	R	96.2	Very high	94	Very high	128 Å²	128	34 Å²	34	48%	0.483	18%	0.182	S	C	.	.	H	α-helix	trans	-66.1	-42.9	174.7	-161	-162.9	-33.2	-64	-4.1	111.9	P781 A782 F783 A787 L788 S789	P781-R785 WeakPolarHBondContact O-CB 3.43Å; P781-R785 PolarHBondContact O-N 3.23Å; A782-R785 WeakPolarHBondContact O-CA 3.17Å; A782-R785 VanDerWaalsContact O-CB 3.25Å; A782-R785 WeakPolarHBondContact O-CB 3.46Å; A782-R785 PolarHBondContact O-N 2.8Å; F783-R785 VanDerWaalsContact C-N 3.34Å; F783-R785 PolarHBondContact O-N 3.34Å; R785-A787 VanDerWaalsContact C-N 3.28Å; R785-A787 PolarHBondContact O-N 3.16Å; R785-L788 WeakPolarHBondContact O-CB 3.25Å; R785-L788 PolarHBondContact O-N 2.77Å; R785-L788 VanDerWaalsContact O-N 3.13Å; R785-S789 PolarHBondContact O-N 2.73Å; R785-S789 PolarHBondContact O-OG 2.73Å
786	D	93.6	Very high	93.9	Very high	34 Å²	34	34.4 Å²	34.4	18%	0.182	18%	0.184	C	C	.	.	H	α-helix	trans	-69.8	-29.8	179.8	-63	6.7	0	0	0	111.2	A782 F783 S789 L790 C791 I792 R807	A782-D786 PolarHBondContact O-N 3.17Å; F783-D786 PolarHBondContact O-N 3.49Å; D786-S789 PolarHBondContact O-OG 2.9Å; D786-L790 PolarHBondContact O-N 3.16Å; D786-C791 PolarHBondContact O-N 3.13Å; D786-I792 HydrophobicContact CB-CD1 4.3Å; D786-I792 HydrophobicContact CB-CG1 4.1Å; D786-I792 PolarHBondContact O-N 2.95Å; D786-R807 IonicContact OD2-CZ 2.88Å; D786-R807 IonicContact OD2-NH1 2.69Å; D786-R807 PolarHBondContact OD2-NH1 3.05Å; D786-R807 IonicContact OD2-NH2 3.6Å; D786-R807 PolarHBondContact OD2-NH2 3.33Å
787	A	93.9	Very high	93.7	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-70.4	-39.9	168	0	0	0	0	0	112	F783 V784 R785 S789 L790 I792 L827 L830	F783-A787 PolarHBondContact O-N 3.41Å; F783-A787 VanDerWaalsContact O-N 3.08Å; V784-A787 PolarHBondContact O-N 2.91Å; R785-A787 VanDerWaalsContact C-N 3.28Å; R785-A787 PolarHBondContact O-N 3.16Å; A787-S789 VanDerWaalsContact C-N 3.32Å; A787-S789 PolarHBondContact O-N 2.88Å; A787-L790 WeakPolarHBondContact O-CA 3.28Å; A787-L790 WeakPolarHBondContact O-CD2 3.37Å; A787-L790 PolarHBondContact O-N 3.49Å; A787-I792 HydrophobicContact CB-CD1 4.37Å; A787-I792 HydrophobicContact CB-CG1 4.03Å; A787-L827 HydrophobicContact CB-CD1 4.13Å; A787-L827 HydrophobicContact CB-CD2 3.99Å; A787-L830 HydrophobicContact CB-CD2 3.7Å
788	L	93	Very high	93.5	Very high	67 Å²	67	39.3 Å²	39.3	35%	0.351	20%	0.201	S	C	.	.	H	α-helix	trans	-64	-33.4	175.8	-77.8	171.7	0	0	0	113.3	V784 R785 L790 H824 L827	V784-L788 WeakPolarHBondContact O-CG 3.38Å; V784-L788 PolarHBondContact O-N 3.13Å; R785-L788 WeakPolarHBondContact O-CB 3.25Å; R785-L788 PolarHBondContact O-N 2.77Å; R785-L788 VanDerWaalsContact O-N 3.13Å; L788-L790 VanDerWaalsContact C-N 3.25Å; L788-H824 HydrophobicContact CD2-CB 3.85Å; L788-L827 HydrophobicContact CD2-CD1 3.89Å; L788-L827 HydrophobicContact CD2-CD2 4.42Å; L788-L827 HydrophobicContact CD2-CG 3.9Å; L788-L827 HydrophobicContact CG-CD1 3.94Å; L788-L827 HydrophobicContact CG-CG 4.43Å
789	S	89.2	Confident	93.5	Very high	61 Å²	61	35.5 Å²	35.5	43%	0.427	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.4	-1.7	171.3	57.6	0	0	0	0	113.5	R785 D786 A787 C791	R785-S789 PolarHBondContact O-N 2.73Å; R785-S789 PolarHBondContact O-OG 2.73Å; D786-S789 PolarHBondContact O-OG 2.9Å; A787-S789 VanDerWaalsContact C-N 3.32Å; A787-S789 PolarHBondContact O-N 2.88Å; S789-C791 PolarHBondContact O-N 2.71Å; S789-C791 PolarHBondContact OG-SG 3.46Å
790	L	89.3	Confident	93.5	Very high	17 Å²	17	34.4 Å²	34.4	9%	0.089	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	29.7	-175.2	-59.9	166.8	0	0	0	113.1	D786 A787 L788 I792 T793 Y829 P1133 F1169 Y1170	D786-L790 PolarHBondContact O-N 3.16Å; A787-L790 WeakPolarHBondContact O-CA 3.28Å; A787-L790 WeakPolarHBondContact O-CD2 3.37Å; A787-L790 PolarHBondContact O-N 3.49Å; L788-L790 VanDerWaalsContact C-N 3.25Å; L790-I792 VanDerWaalsContact C-N 3.25Å; L790-T793 HydrophobicContact CB-CG2 4.21Å; L790-T793 HydrophobicContact CD2-CG2 3.82Å; L790-Y829 HydrophobicContact CD2-CE1 4.36Å; L790-P1133 HydrophobicContact CD2-CB 4.42Å; L790-P1133 HydrophobicContact CD2-CG 3.77Å; L790-F1169 HydrophobicContact CD1-CB 4.21Å; L790-Y1170 HydrophobicContact CD1-CD1 4.03Å; L790-Y1170 HydrophobicContact CD1-CE1 3.36Å; L790-Y1170 HydrophobicContact CD1-CE2 4.41Å
791	C	85.2	Confident	93.4	Very high	68 Å²	68	34.8 Å²	34.8	46%	0.459	18%	0.184	S	C	.	.	S	Bend	trans	-75.1	-19.2	167.4	-62.2	0	0	0	0	111.5	D786 S789	D786-C791 PolarHBondContact O-N 3.13Å; S789-C791 PolarHBondContact O-N 2.71Å; S789-C791 PolarHBondContact OG-SG 3.46Å
792	I	89.7	Confident	93.2	Very high	17 Å²	17	36.4 Å²	36.4	9%	0.087	19%	0.187	C	C	.	.			trans	-127.8	127.4	165.7	57.8	171.9	0	0	0	111.6	F783 D786 A787 L790 L803	F783-I792 HydrophobicContact CD2-CD1 3.63Å; F783-I792 HydrophobicContact CE1-CD1 4.41Å; F783-I792 HydrophobicContact CE2-CD1 3.51Å; F783-I792 HydrophobicContact CG-CD1 4.15Å; F783-I792 HydrophobicContact CZ-CD1 3.92Å; D786-I792 HydrophobicContact CB-CD1 4.3Å; D786-I792 HydrophobicContact CB-CG1 4.1Å; D786-I792 PolarHBondContact O-N 2.95Å; A787-I792 HydrophobicContact CB-CD1 4.37Å; A787-I792 HydrophobicContact CB-CG1 4.03Å; L790-I792 VanDerWaalsContact C-N 3.25Å; I792-L803 HydrophobicContact CB-CD1 4.17Å; I792-L803 HydrophobicContact CG2-CD1 4.42Å; I792-L803 HydrophobicContact CG2-CD2 4.27Å
793	T	91.4	Very high	93.2	Very high	39 Å²	39	36.7 Å²	36.7	24%	0.239	19%	0.186	C	C	.	.			trans	-135.4	77.1	178.9	49.9	0	0	0	0	109.4	L790 Q795 P1133	L790-T793 HydrophobicContact CB-CG2 4.21Å; L790-T793 HydrophobicContact CD2-CG2 3.82Å; T793-Q795 PolarHBondContact O-N 3.34Å; T793-P1133 HydrophobicContact CG2-CB 4.12Å; T793-P1133 HydrophobicContact CG2-CG 4.17Å
794	P	94.6	Very high	93.3	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.186	C	C	.	.			trans	-59.8	126.1	179.1	21.3	-30.9	0	0	0	110.9	A799 L800 L803 L830 M833 H1132	P794-A799 HydrophobicContact CB-CB 4.07Å; P794-L800 HydrophobicContact CB-CB 3.95Å; P794-L800 HydrophobicContact CG-CB 4.25Å; P794-L800 HydrophobicContact CG-CD1 4.3Å; P794-L803 HydrophobicContact CB-CD1 3.99Å; P794-L803 HydrophobicContact CG-CD1 4.38Å; P794-L830 HydrophobicContact CG-CD1 3.82Å; P794-M833 HydrophobicContact CB-SD 4.1Å; P794-M833 HydrophobicContact CG-SD 4.22Å; P794-M833 VanDerWaalsContact O-CE 3.26Å; P794-M833 WeakPolarHBondContact O-CE 3.26Å; P794-H1132 PolarHBondContact O-NE2 2.86Å
795	Q	92.5	Very high	93.2	Very high	21 Å²	21	38.3 Å²	38.3	10%	0.098	19%	0.193	C	C	.	.	S	Bend	trans	-80.1	-26	-178.3	-57.3	94.9	-33.2	0	0	113.8	T793 P1091 H1128 E1134	T793-Q795 PolarHBondContact O-N 3.34Å; Q795-P1091 HydrophobicContact CB-CB 3.31Å; Q795-P1091 HydrophobicContact CB-CG 4.02Å; Q795-P1091 HydrophobicContact CG-CB 3.82Å; Q795-H1128 WeakPolarHBondContact O-CB 3.35Å; Q795-H1128 PolarHBondContact O-CD2 2.87Å; Q795-H1128 VanDerWaalsContact O-CD2 3.22Å; Q795-E1134 WeakPolarHBondContact CG-OE2 3.4Å
796	D	93.5	Very high	93.1	Very high	12 Å²	12	36.3 Å²	36.3	6%	0.064	19%	0.189	C	C	.	.	S	Bend	trans	-147.8	176.8	171.1	80.1	8.4	0	0	0	112.7	R798 A799 L800 M833 R957 C1127	D796-R798 PolarHBondContact O-N 2.96Å; D796-R798 WeakPolarHBondContact OD1-CA 3.16Å; D796-R798 VanDerWaalsContact OD1-CB 3.29Å; D796-R798 WeakPolarHBondContact OD1-CB 3.37Å; D796-R798 PolarHBondContact OD1-N 3.11Å; D796-A799 PolarHBondContact O-N 3.45Å; D796-A799 VanDerWaalsContact O-N 3.11Å; D796-A799 PolarHBondContact OD1-N 3.18Å; D796-A799 VanDerWaalsContact OD1-N 3.16Å; D796-L800 PolarHBondContact O-N 3.14Å; D796-M833 VanDerWaalsContact O-SD 3.39Å; D796-R957 IonicContact OD2-CZ 3.08Å; D796-R957 IonicContact OD2-NH1 2.64Å; D796-R957 PolarHBondContact OD2-NH1 3.2Å; D796-R957 IonicContact OD2-NH2 4Å; D796-R957 PolarHBondContact OD2-NH2 3.3Å; D796-C1127 HydrophobicContact CB-CB 4.19Å
797	G	93.8	Very high	93.1	Very high	8 Å²	8	37 Å²	37	8%	0.082	19%	0.189	C	C	.	.	H	α-helix	trans	-58.1	-27.8	-178.5	0	0	0	0	0	113.8	I801	G797-I801 WeakPolarHBondContact O-CG1 3.32Å; G797-I801 PolarHBondContact O-N 3.03Å; G797-I801 VanDerWaalsContact O-N 3.16Å
798	R	93.4	Very high	93.1	Very high	156 Å²	156	37.1 Å²	37.1	59%	0.589	19%	0.19	S	C	*	.	H	α-helix	trans	-71.8	-49	174.3	179.6	179.6	172.5	172.1	-2.6	110.5	D796 L800 I801 E802	D796-R798 PolarHBondContact O-N 2.96Å; D796-R798 WeakPolarHBondContact OD1-CA 3.16Å; D796-R798 VanDerWaalsContact OD1-CB 3.29Å; D796-R798 WeakPolarHBondContact OD1-CB 3.37Å; D796-R798 PolarHBondContact OD1-N 3.11Å; R798-L800 VanDerWaalsContact C-N 3.26Å; R798-L800 PolarHBondContact O-N 3.46Å; R798-I801 PolarHBondContact O-N 3.33Å; R798-I801 VanDerWaalsContact O-N 3.13Å; R798-E802 HydrophobicContact CG-CG 4.44Å; R798-E802 IonicContact CZ-OE1 3.8Å; R798-E802 VanDerWaalsContact CZ-OE1 3.31Å; R798-E802 IonicContact NE-OE1 2.84Å; R798-E802 PolarHBondContact NE-OE1 2.89Å; R798-E802 IonicContact NE-OE2 3.77Å; R798-E802 IonicContact NH2-OE1 2.65Å; R798-E802 PolarHBondContact NH2-OE1 2.69Å; R798-E802 WeakPolarHBondContact O-CG 3.26Å; R798-E802 PolarHBondContact O-N 3.29Å
799	A	94	Very high	93.3	Very high	16 Å²	16	34 Å²	34	13%	0.132	17%	0.173	C	C	.	.	H	α-helix	trans	-58.5	-38.9	176.2	0	0	0	0	0	112	P794 D796 E802 L803	P794-A799 HydrophobicContact CB-CB 4.07Å; D796-A799 PolarHBondContact O-N 3.45Å; D796-A799 VanDerWaalsContact O-N 3.11Å; D796-A799 PolarHBondContact OD1-N 3.18Å; D796-A799 VanDerWaalsContact OD1-N 3.16Å; A799-E802 PolarHBondContact O-N 3.18Å; A799-L803 WeakPolarHBondContact O-CB 3.1Å; A799-L803 WeakPolarHBondContact O-CG 3.34Å; A799-L803 PolarHBondContact O-N 3.24Å
800	L	96.4	Very high	93.6	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-58	-50.1	172.9	171.1	56.5	0	0	0	112	F783 P794 D796 R798 L803 M804 L830 M833 A834	F783-L800 HydrophobicContact CE1-CD1 4.47Å; F783-L800 HydrophobicContact CZ-CD1 3.86Å; P794-L800 HydrophobicContact CB-CB 3.95Å; P794-L800 HydrophobicContact CG-CB 4.25Å; P794-L800 HydrophobicContact CG-CD1 4.3Å; D796-L800 PolarHBondContact O-N 3.14Å; R798-L800 VanDerWaalsContact C-N 3.26Å; R798-L800 PolarHBondContact O-N 3.46Å; L800-L803 PolarHBondContact O-N 2.89Å; L800-M804 HydrophobicContact CD1-CG 4.18Å; L800-M804 HydrophobicContact CD1-SD 4Å; L800-M804 HydrophobicContact CG-SD 4.2Å; L800-M804 WeakPolarHBondContact O-CB 3.2Å; L800-M804 WeakPolarHBondContact O-CG 3.43Å; L800-M804 PolarHBondContact O-N 3.35Å; L800-L830 HydrophobicContact CD1-CD1 3.63Å; L800-L830 HydrophobicContact CD2-CD1 4.34Å; L800-M833 HydrophobicContact CB-SD 4.01Å; L800-M833 HydrophobicContact CD2-CB 4.41Å; L800-M833 HydrophobicContact CD2-CG 3.92Å; L800-M833 HydrophobicContact CD2-SD 4.31Å; L800-A834 HydrophobicContact CD2-CB 3.97Å
801	I	96.5	Very high	93.9	Very high	8 Å²	8	32.3 Å²	32.3	4%	0.041	16%	0.16	C	C	.	.	H	α-helix	trans	-70.1	-33.8	-179	-67.5	-50.6	0	0	0	112.4	G797 R798 M804 H805 V811 L814 E837	G797-I801 WeakPolarHBondContact O-CG1 3.32Å; G797-I801 PolarHBondContact O-N 3.03Å; G797-I801 VanDerWaalsContact O-N 3.16Å; R798-I801 PolarHBondContact O-N 3.33Å; R798-I801 VanDerWaalsContact O-N 3.13Å; I801-M804 HydrophobicContact CD1-CE 4.39Å; I801-M804 HydrophobicContact CD1-SD 3.78Å; I801-M804 PolarHBondContact O-N 2.84Å; I801-H805 VanDerWaalsContact CG2-CE1 3.48Å; I801-H805 WeakPolarHBondContact CG2-CE1 3.35Å; I801-H805 WeakPolarHBondContact O-CB 3.24Å; I801-H805 VanDerWaalsContact O-CG 3.23Å; I801-H805 PolarHBondContact O-N 3.12Å; I801-H805 PolarHBondContact O-ND1 2.68Å; I801-V811 HydrophobicContact CD1-CB 4.43Å; I801-V811 HydrophobicContact CD1-CG1 3.86Å; I801-V811 HydrophobicContact CD1-CG2 4.24Å; I801-V811 HydrophobicContact CG2-CG2 3.78Å; I801-L814 HydrophobicContact CD1-CD1 4.36Å; I801-L814 HydrophobicContact CD1-CD2 4.13Å; I801-L814 HydrophobicContact CD1-CG 4.4Å; I801-E837 HydrophobicContact CD1-CG 4.11Å; I801-E837 HydrophobicContact CG1-CG 3.9Å; I801-E837 WeakPolarHBondContact CG1-OE1 3.49Å
802	E	93.5	Very high	94.3	Very high	83 Å²	83	29.6 Å²	29.6	39%	0.388	14%	0.14	S	C	.	.	H	α-helix	trans	-66.6	-44.1	174.2	-72.5	174.3	174.1	0	0	111.3	R798 A799 H805 Q806	R798-E802 HydrophobicContact CG-CG 4.44Å; R798-E802 IonicContact CZ-OE1 3.8Å; R798-E802 VanDerWaalsContact CZ-OE1 3.31Å; R798-E802 IonicContact NE-OE1 2.84Å; R798-E802 PolarHBondContact NE-OE1 2.89Å; R798-E802 IonicContact NE-OE2 3.77Å; R798-E802 IonicContact NH2-OE1 2.65Å; R798-E802 PolarHBondContact NH2-OE1 2.69Å; R798-E802 WeakPolarHBondContact O-CG 3.26Å; R798-E802 PolarHBondContact O-N 3.29Å; A799-E802 PolarHBondContact O-N 3.18Å; E802-H805 PolarHBondContact O-N 3Å; E802-Q806 WeakPolarHBondContact O-CG 3.44Å; E802-Q806 PolarHBondContact O-N 2.91Å
803	L	95.5	Very high	94.7	Very high	26 Å²	26	28.8 Å²	28.8	14%	0.136	14%	0.136	C	C	.	.	H	α-helix	trans	-64.7	-38.9	173	-71.9	171.6	0	0	0	113.1	F783 I792 P794 A799 L800 Q806 R807	F783-L803 HydrophobicContact CE2-CB 4.19Å; I792-L803 HydrophobicContact CB-CD1 4.17Å; I792-L803 HydrophobicContact CG2-CD1 4.42Å; I792-L803 HydrophobicContact CG2-CD2 4.27Å; P794-L803 HydrophobicContact CB-CD1 3.99Å; P794-L803 HydrophobicContact CG-CD1 4.38Å; A799-L803 WeakPolarHBondContact O-CB 3.1Å; A799-L803 WeakPolarHBondContact O-CG 3.34Å; A799-L803 PolarHBondContact O-N 3.24Å; L800-L803 PolarHBondContact O-N 2.89Å; L803-Q806 PolarHBondContact O-N 2.68Å; L803-R807 PolarHBondContact O-N 3.12Å
804	M	97.3	Very high	94.9	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60	-47.3	173.1	-78.6	176.2	61.9	0	0	110.8	F783 L800 I801 R807 G808 I809 L814 V817	F783-M804 HydrophobicContact CE1-CG 4.46Å; F783-M804 HydrophobicContact CE2-CG 3.97Å; F783-M804 HydrophobicContact CZ-CG 3.84Å; L800-M804 HydrophobicContact CD1-CG 4.18Å; L800-M804 HydrophobicContact CD1-SD 4Å; L800-M804 HydrophobicContact CG-SD 4.2Å; L800-M804 WeakPolarHBondContact O-CB 3.2Å; L800-M804 WeakPolarHBondContact O-CG 3.43Å; L800-M804 PolarHBondContact O-N 3.35Å; I801-M804 HydrophobicContact CD1-CE 4.39Å; I801-M804 HydrophobicContact CD1-SD 3.78Å; I801-M804 PolarHBondContact O-N 2.84Å; M804-R807 CarbonylContact O-C 3.55Å; M804-R807 PolarHBondContact O-N 2.74Å; M804-R807 VanDerWaalsContact O-N 3.14Å; M804-G808 PolarHBondContact O-N 3.47Å; M804-I809 CarbonylContact C-O 3.52Å; M804-I809 VanDerWaalsContact C-O 3.3Å; M804-I809 HydrophobicContact CB-CB 4.18Å; M804-I809 HydrophobicContact CE-CB 4.5Å; M804-I809 HydrophobicContact CE-CG2 3.7Å; M804-I809 WeakPolarHBondContact O-CA 3.34Å; M804-I809 WeakPolarHBondContact O-CB 3.21Å; M804-I809 PolarHBondContact O-N 3.05Å; M804-L814 HydrophobicContact CE-CD2 4.23Å; M804-L814 HydrophobicContact CE-CG 4.35Å; M804-L814 HydrophobicContact SD-CD2 3.99Å; M804-V817 HydrophobicContact CE-CG2 4.03Å; M804-V817 HydrophobicContact SD-CG2 4.4Å
805	H	95.7	Very high	95	Very high	44 Å²	44	27.5 Å²	27.5	20%	0.204	13%	0.128	C	C	.	.	H	α-helix	trans	-63.3	-41.9	177.9	-72.2	158.3	0	0	0	113.2	R600 E602 I801 E802 R807 G808 I809 V811	R600-H805 PolarHBondContact NH1-CD2 2.84Å; R600-H805 PolarHBondContact NH1-NE2 3.17Å; E602-H805 WeakPolarHBondContact CG-O 3.45Å; I801-H805 VanDerWaalsContact CG2-CE1 3.48Å; I801-H805 WeakPolarHBondContact CG2-CE1 3.35Å; I801-H805 WeakPolarHBondContact O-CB 3.24Å; I801-H805 VanDerWaalsContact O-CG 3.23Å; I801-H805 PolarHBondContact O-N 3.12Å; I801-H805 PolarHBondContact O-ND1 2.68Å; E802-H805 PolarHBondContact O-N 3Å; H805-R807 PolarHBondContact O-N 2.7Å; H805-G808 WeakPolarHBondContact O-CA 3.5Å; H805-G808 PolarHBondContact O-N 3.43Å; H805-I809 PolarHBondContact CD2-O 3.41Å; H805-V811 WeakPolarHBondContact NE2-CG2 3.49Å
806	Q	93	Very high	95.2	Very high	86 Å²	86	27 Å²	27	40%	0.402	13%	0.125	S	C	.	.	H	α-helix	trans	-59.9	-25.7	174	-74	172.5	5.5	0	0	113.2	E802 L803	E802-Q806 WeakPolarHBondContact O-CG 3.44Å; E802-Q806 PolarHBondContact O-N 2.91Å; L803-Q806 PolarHBondContact O-N 2.68Å
807	R	92.9	Very high	95.4	Very high	49 Å²	49	26.5 Å²	26.5	19%	0.185	12%	0.122	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	12.5	171.8	-58.4	-53.2	-171.8	85.6	6.7	113.3	Q779 F783 D786 L803 M804 H805 I809	Q779-R807 VanDerWaalsContact CG-O 3.24Å; Q779-R807 WeakPolarHBondContact CG-O 3.45Å; Q779-R807 PolarHBondContact NE2-O 3.25Å; F783-R807 HydrophobicContact CD2-CG 4.24Å; D786-R807 IonicContact OD2-CZ 2.88Å; D786-R807 IonicContact OD2-NH1 2.69Å; D786-R807 PolarHBondContact OD2-NH1 3.05Å; D786-R807 IonicContact OD2-NH2 3.6Å; D786-R807 PolarHBondContact OD2-NH2 3.33Å; L803-R807 PolarHBondContact O-N 3.12Å; M804-R807 CarbonylContact O-C 3.55Å; M804-R807 PolarHBondContact O-N 2.74Å; M804-R807 VanDerWaalsContact O-N 3.14Å; H805-R807 PolarHBondContact O-N 2.7Å; R807-I809 HydrophobicContact CB-CD1 4.11Å; R807-I809 HydrophobicContact CB-CG1 4.37Å; R807-I809 PolarHBondContact O-N 3.32Å
808	G	95.4	Very high	95.6	Very high	2 Å²	2	26.2 Å²	26.2	2%	0.021	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	76.5	3.3	178.9	0	0	0	0	0	115.2	M804 H805 N810	M804-G808 PolarHBondContact O-N 3.47Å; H805-G808 WeakPolarHBondContact O-CA 3.5Å; H805-G808 PolarHBondContact O-N 3.43Å; G808-N810 PolarHBondContact O-N 3.49Å
809	I	97.6	Very high	95.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.109	C	C	.	.			trans	-85.5	115.2	-176.1	-52.9	163	0	0	0	109	L775 Q779 I780 F783 M804 H805 R807 Y813	L775-I809 HydrophobicContact CD1-CB 4.38Å; L775-I809 HydrophobicContact CD1-CG1 3.89Å; Q779-I809 HydrophobicContact CG-CG1 4.36Å; I780-I809 HydrophobicContact CD1-CG2 4.12Å; I780-I809 HydrophobicContact CG1-CD1 3.83Å; I780-I809 HydrophobicContact CG1-CG1 3.91Å; I780-I809 HydrophobicContact CG1-CG2 3.97Å; F783-I809 HydrophobicContact CB-CD1 3.71Å; F783-I809 HydrophobicContact CD2-CD1 4.08Å; F783-I809 HydrophobicContact CG-CD1 3.9Å; M804-I809 CarbonylContact C-O 3.52Å; M804-I809 VanDerWaalsContact C-O 3.3Å; M804-I809 HydrophobicContact CB-CB 4.18Å; M804-I809 HydrophobicContact CE-CB 4.5Å; M804-I809 HydrophobicContact CE-CG2 3.7Å; M804-I809 WeakPolarHBondContact O-CA 3.34Å; M804-I809 WeakPolarHBondContact O-CB 3.21Å; M804-I809 PolarHBondContact O-N 3.05Å; H805-I809 PolarHBondContact CD2-O 3.41Å; R807-I809 HydrophobicContact CB-CD1 4.11Å; R807-I809 HydrophobicContact CB-CG1 4.37Å; R807-I809 PolarHBondContact O-N 3.32Å; I809-Y813 HydrophobicContact CG2-CG 4.43Å
810	N	95.2	Very high	95.8	Very high	29 Å²	29	23 Å²	23	16%	0.155	11%	0.111	C	C	.	.			trans	-75.4	145.5	176.9	-172.7	-58.6	0	0	0	111.3	R600 G808 R812 Y813	R600-N810 HydrophobicContact CG-CB 4.47Å; G808-N810 PolarHBondContact O-N 3.49Å; N810-R812 HydrophobicContact CB-CG 4.14Å; N810-R812 PolarHBondContact O-N 3.07Å; N810-R812 PolarHBondContact OD1-N 3.32Å; N810-R812 VanDerWaalsContact OD1-N 3.11Å; N810-Y813 HydrophobicContact CB-CD2 4.27Å; N810-Y813 WeakPolarHBondContact O-CB 3.37Å; N810-Y813 WeakPolarHBondContact O-CD2 3.31Å; N810-Y813 PolarHBondContact O-N 2.86Å
811	V	94.9	Very high	95.8	Very high	14 Å²	14	23 Å²	23	9%	0.085	11%	0.111	C	C	.	.	G	3₁₀ helix	trans	-46.3	-31.4	176.6	-164.1	0	0	0	0	114	I801 H805 Y813 L814 Y932	I801-V811 HydrophobicContact CD1-CB 4.43Å; I801-V811 HydrophobicContact CD1-CG1 3.86Å; I801-V811 HydrophobicContact CD1-CG2 4.24Å; I801-V811 HydrophobicContact CG2-CG2 3.78Å; H805-V811 WeakPolarHBondContact NE2-CG2 3.49Å; V811-Y813 PolarHBondContact O-N 3.22Å; V811-Y813 VanDerWaalsContact O-N 3.1Å; V811-L814 HydrophobicContact CG1-CD1 3.71Å; V811-L814 HydrophobicContact CG1-CG 4.3Å; V811-L814 WeakPolarHBondContact O-CB 3.25Å; V811-L814 VanDerWaalsContact O-CG 3.31Å; V811-L814 WeakPolarHBondContact O-CG 3.38Å; V811-L814 PolarHBondContact O-N 3.36Å; V811-Y932 HydrophobicContact CG1-CE1 4.01Å
812	R	94.4	Very high	95.7	Very high	11 Å²	11	25 Å²	25	4%	0.042	13%	0.126	C	C	.	.	G	3₁₀ helix	trans	-55.2	-27.6	175.9	70.8	-176.7	86.2	-103.5	4.5	113.2	D565 Y568 H592 N810 L814	D565-R812 IonicContact OD2-NE 2.75Å; Y568-R812 HydrophobicContact CD2-CG 4.11Å; Y568-R812 HydrophobicContact CE1-CB 4.15Å; Y568-R812 HydrophobicContact CE1-CG 4.16Å; Y568-R812 HydrophobicContact CE2-CG 3.71Å; Y568-R812 PolarHBondContact OH-O 3.2Å; Y568-R812 VanDerWaalsContact OH-O 3.1Å; H592-R812 PolarHBondContact CD2-NH1 3.45Å; H592-R812 PolarHBondContact NE2-NH1 3.15Å; N810-R812 HydrophobicContact CB-CG 4.14Å; N810-R812 PolarHBondContact O-N 3.07Å; N810-R812 PolarHBondContact OD1-N 3.32Å; N810-R812 VanDerWaalsContact OD1-N 3.11Å; R812-L814 VanDerWaalsContact C-N 3.28Å; R812-L814 PolarHBondContact O-N 3.27Å
813	Y	96.9	Very high	95.7	Very high	1 Å²	1	27.4 Å²	27.4	0%	0.004	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-79.8	7.9	177.8	-69.7	-94.1	0	0	0	115.2	D565 N567 Y568 Y588 L775 V776 I780 I809 N810 V811 N815 R816 V817	D565-Y813 PolarHBondContact OD1-OH 3Å; D565-Y813 VanDerWaalsContact OD2-CE2 3.23Å; D565-Y813 WeakPolarHBondContact OD2-CE2 3.38Å; D565-Y813 PolarHBondContact OD2-OH 3.47Å; N567-Y813 WeakPolarHBondContact CB-OH 3.16Å; N567-Y813 PolarHBondContact ND2-OH 3.38Å; Y568-Y813 HydrophobicContact CD2-CE2 4.26Å; Y568-Y813 HydrophobicContact CE2-CD1 4.37Å; Y568-Y813 HydrophobicContact CE2-CD2 4.24Å; Y568-Y813 AromaticContact CE2-CE1 3.85Å; Y568-Y813 HydrophobicContact CE2-CE1 3.85Å; Y568-Y813 AromaticContact CE2-CE2 3.68Å; Y568-Y813 HydrophobicContact CE2-CE2 3.68Å; Y568-Y813 AromaticContact CE2-CZ 3.47Å; Y568-Y813 VanDerWaalsContact CE2-CZ 3.47Å; Y588-Y813 HydrophobicContact CE1-CE1 4.25Å; L775-Y813 HydrophobicContact CD2-CD1 4.5Å; L775-Y813 HydrophobicContact CD2-CD2 4.18Å; L775-Y813 HydrophobicContact CD2-CE1 3.85Å; L775-Y813 HydrophobicContact CD2-CE2 3.49Å; L775-Y813 VanDerWaalsContact CD2-CE2 3.49Å; L775-Y813 WeakPolarHBondContact CD2-OH 3.35Å; L775-Y813 HydrophobicContact CG-CE1 4.28Å; V776-Y813 HydrophobicContact CG2-CE1 3.85Å; I780-Y813 HydrophobicContact CD1-CD1 3.67Å; I780-Y813 HydrophobicContact CD1-CE1 4.48Å; I780-Y813 HydrophobicContact CD1-CG 4.03Å; I809-Y813 HydrophobicContact CG2-CG 4.43Å; N810-Y813 HydrophobicContact CB-CD2 4.27Å; N810-Y813 WeakPolarHBondContact O-CB 3.37Å; N810-Y813 WeakPolarHBondContact O-CD2 3.31Å; N810-Y813 PolarHBondContact O-N 2.86Å; V811-Y813 PolarHBondContact O-N 3.22Å; V811-Y813 VanDerWaalsContact O-N 3.1Å; Y813-N815 PolarHBondContact O-N 2.92Å; Y813-N815 VanDerWaalsContact O-N 3.16Å; Y813-R816 HydrophobicContact CD1-CB 4.37Å; Y813-R816 WeakPolarHBondContact O-CB 3.47Å; Y813-R816 PolarHBondContact O-N 2.96Å; Y813-V817 PolarHBondContact O-N 3.24Å; Y813-V817 VanDerWaalsContact O-N 3.11Å
814	L	97	Very high	95.6	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-50.6	-41	179.1	-86.2	169.8	0	0	0	113	I801 M804 V811 R812 R816 V817 I818 A834 E837 V838 Y932	I801-L814 HydrophobicContact CD1-CD1 4.36Å; I801-L814 HydrophobicContact CD1-CD2 4.13Å; I801-L814 HydrophobicContact CD1-CG 4.4Å; M804-L814 HydrophobicContact CE-CD2 4.23Å; M804-L814 HydrophobicContact CE-CG 4.35Å; M804-L814 HydrophobicContact SD-CD2 3.99Å; V811-L814 HydrophobicContact CG1-CD1 3.71Å; V811-L814 HydrophobicContact CG1-CG 4.3Å; V811-L814 WeakPolarHBondContact O-CB 3.25Å; V811-L814 VanDerWaalsContact O-CG 3.31Å; V811-L814 WeakPolarHBondContact O-CG 3.38Å; V811-L814 PolarHBondContact O-N 3.36Å; R812-L814 VanDerWaalsContact C-N 3.28Å; R812-L814 PolarHBondContact O-N 3.27Å; L814-R816 PolarHBondContact O-N 2.89Å; L814-V817 PolarHBondContact O-N 3.09Å; L814-I818 WeakPolarHBondContact O-CB 3.36Å; L814-I818 WeakPolarHBondContact O-CD1 3.43Å; L814-I818 WeakPolarHBondContact O-CG1 3.17Å; L814-I818 PolarHBondContact O-N 2.87Å; L814-A834 HydrophobicContact CD2-CB 4.06Å; L814-E837 HydrophobicContact CD1-CB 4.25Å; L814-E837 HydrophobicContact CD1-CG 3.95Å; L814-V838 HydrophobicContact CB-CG2 3.81Å; L814-V838 HydrophobicContact CD1-CG2 3.84Å; L814-V838 HydrophobicContact CG-CG2 4.4Å; L814-Y932 HydrophobicContact CB-CD1 4.38Å; L814-Y932 HydrophobicContact CD1-CD1 4.2Å; L814-Y932 HydrophobicContact CD1-CE1 4.18Å
815	N	96.4	Very high	95.4	Very high	12 Å²	12	37.2 Å²	37.2	6%	0.064	19%	0.185	C	C	.	.	H	α-helix	trans	-60.4	-44.5	174.7	179	52.7	0	0	0	113	Y813 V817 I818 E819 Y932 Y934	Y813-N815 PolarHBondContact O-N 2.92Å; Y813-N815 VanDerWaalsContact O-N 3.16Å; N815-V817 VanDerWaalsContact C-N 3.25Å; N815-V817 PolarHBondContact O-N 2.99Å; N815-I818 PolarHBondContact O-N 2.98Å; N815-I818 VanDerWaalsContact O-N 3.13Å; N815-E819 PolarHBondContact ND2-OE1 3.49Å; N815-E819 WeakPolarHBondContact O-CB 3.41Å; N815-E819 WeakPolarHBondContact O-CG 3.24Å; N815-E819 PolarHBondContact O-N 3.49Å; N815-Y932 WeakPolarHBondContact CB-O 3.5Å; N815-Y934 WeakPolarHBondContact OD1-CD2 3.42Å
816	R	96.6	Very high	95.2	Very high	11 Å²	11	36.6 Å²	36.6	4%	0.042	19%	0.186	C	C	.	.	H	α-helix	trans	-61.5	-35.4	178.2	-174.2	61.7	58.5	-145.6	-8.5	111.7	L586 Y588 I780 Y813 L814 E819 S820	L586-R816 PolarHBondContact O-NH2 3.37Å; Y588-R816 VanDerWaalsContact CZ-NH2 3.31Å; Y588-R816 PolarHBondContact OH-NE 3.34Å; Y588-R816 PolarHBondContact OH-NH2 2.83Å; I780-R816 HydrophobicContact CD1-CB 4.17Å; I780-R816 HydrophobicContact CD1-CG 3.73Å; I780-R816 HydrophobicContact CG2-CG 4.15Å; Y813-R816 HydrophobicContact CD1-CB 4.37Å; Y813-R816 WeakPolarHBondContact O-CB 3.47Å; Y813-R816 PolarHBondContact O-N 2.96Å; L814-R816 PolarHBondContact O-N 2.89Å; R816-E819 IonicContact CZ-OE2 2.67Å; R816-E819 IonicContact NH1-OE2 3.76Å; R816-E819 PolarHBondContact NH1-OE2 3Å; R816-S820 VanDerWaalsContact O-CB 3.32Å; R816-S820 WeakPolarHBondContact O-CB 3.48Å; R816-S820 PolarHBondContact O-N 3.01Å; R816-S820 PolarHBondContact O-OG 3.27Å
817	V	96.9	Very high	95.3	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-68	-51.2	172	179.9	0	0	0	0	110.2	I780 F783 M804 Y813 L814 N815 E819 S820 V821	I780-V817 HydrophobicContact CG2-CG2 4.15Å; F783-V817 HydrophobicContact CE1-CG1 4.08Å; M804-V817 HydrophobicContact CE-CG2 4.03Å; M804-V817 HydrophobicContact SD-CG2 4.4Å; Y813-V817 PolarHBondContact O-N 3.24Å; Y813-V817 VanDerWaalsContact O-N 3.11Å; L814-V817 PolarHBondContact O-N 3.09Å; N815-V817 VanDerWaalsContact C-N 3.25Å; N815-V817 PolarHBondContact O-N 2.99Å; V817-E819 PolarHBondContact O-N 3.26Å; V817-S820 PolarHBondContact O-N 2.67Å; V817-S820 VanDerWaalsContact O-N 3.08Å; V817-V821 HydrophobicContact CG1-CG1 4.22Å; V817-V821 WeakPolarHBondContact O-CG2 3.08Å; V817-V821 PolarHBondContact O-N 3.15Å
818	I	97.5	Very high	95.3	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.015	17%	0.17	C	C	.	.	H	α-helix	trans	-55.9	-45.7	179.7	-68.8	160.5	0	0	0	111.9	L814 N815 S822 A834 I835 V838 Y934	L814-I818 WeakPolarHBondContact O-CB 3.36Å; L814-I818 WeakPolarHBondContact O-CD1 3.43Å; L814-I818 WeakPolarHBondContact O-CG1 3.17Å; L814-I818 PolarHBondContact O-N 2.87Å; N815-I818 PolarHBondContact O-N 2.98Å; N815-I818 VanDerWaalsContact O-N 3.13Å; I818-S822 WeakPolarHBondContact O-CB 3.26Å; I818-S822 PolarHBondContact O-N 3.01Å; I818-S822 PolarHBondContact O-OG 3.47Å; I818-A834 HydrophobicContact CD1-CB 4.14Å; I818-A834 HydrophobicContact CG1-CB 3.55Å; I818-I835 HydrophobicContact CD1-CG1 3.82Å; I818-I835 HydrophobicContact CG1-CG1 4.04Å; I818-I835 HydrophobicContact CG2-CD1 4.07Å; I818-I835 HydrophobicContact CG2-CG1 3.94Å; I818-V838 HydrophobicContact CD1-CG2 3.94Å; I818-Y934 HydrophobicContact CD1-CD2 4.21Å; I818-Y934 HydrophobicContact CD1-CE2 4.49Å; I818-Y934 HydrophobicContact CD1-CG 4.27Å; I818-Y934 HydrophobicContact CG2-CD2 4.18Å; I818-Y934 HydrophobicContact CG2-CE2 3.67Å
819	E	96.2	Very high	95.3	Very high	78 Å²	78	32 Å²	32	36%	0.364	17%	0.172	S	C	.	.	H	α-helix	trans	-58.7	-47.6	174.9	-75.3	176.8	-169.3	0	0	111.2	N815 R816 V817 S822	N815-E819 PolarHBondContact ND2-OE1 3.49Å; N815-E819 WeakPolarHBondContact O-CB 3.41Å; N815-E819 WeakPolarHBondContact O-CG 3.24Å; N815-E819 PolarHBondContact O-N 3.49Å; R816-E819 IonicContact CZ-OE2 2.67Å; R816-E819 IonicContact NH1-OE2 3.76Å; R816-E819 PolarHBondContact NH1-OE2 3Å; V817-E819 PolarHBondContact O-N 3.26Å; E819-S822 WeakPolarHBondContact O-CB 3.46Å; E819-S822 PolarHBondContact O-N 2.85Å
820	S	96	Very high	95.1	Very high	27 Å²	27	32 Å²	32	19%	0.189	17%	0.172	C	C	.	.	H	α-helix	trans	-70.4	-40.1	-174.2	-55.2	0	0	0	0	112.3	R816 V817	R816-S820 VanDerWaalsContact O-CB 3.32Å; R816-S820 WeakPolarHBondContact O-CB 3.48Å; R816-S820 PolarHBondContact O-N 3.01Å; R816-S820 PolarHBondContact O-OG 3.27Å; V817-S820 PolarHBondContact O-N 2.67Å; V817-S820 VanDerWaalsContact O-N 3.08Å
821	V	96	Very high	95.2	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-75.5	-24.5	174.9	-55.5	0	0	0	0	112.6	V784 V817 I823 H824 L827 L830 K831	V784-V821 HydrophobicContact CG1-CG1 4.31Å; V784-V821 HydrophobicContact CG2-CG1 3.94Å; V817-V821 HydrophobicContact CG1-CG1 4.22Å; V817-V821 WeakPolarHBondContact O-CG2 3.08Å; V817-V821 PolarHBondContact O-N 3.15Å; V821-I823 PolarHBondContact O-N 2.83Å; V821-I823 VanDerWaalsContact O-N 3.11Å; V821-H824 PolarHBondContact O-N 3.11Å; V821-L827 HydrophobicContact CB-CB 4Å; V821-L827 HydrophobicContact CB-CD1 4.1Å; V821-L827 HydrophobicContact CG1-CD1 3.89Å; V821-L830 HydrophobicContact CG1-CD2 3.81Å; V821-L830 HydrophobicContact CG1-CG 4.18Å; V821-K831 HydrophobicContact CG2-CB 3.83Å; V821-K831 HydrophobicContact CG2-CG 4.45Å
822	S	94.6	Very high	95.1	Very high	50 Å²	50	35.1 Å²	35.1	35%	0.35	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-15.5	179.1	-74.5	0	0	0	0	114.6	I818 E819 H824 K831	I818-S822 WeakPolarHBondContact O-CB 3.26Å; I818-S822 PolarHBondContact O-N 3.01Å; I818-S822 PolarHBondContact O-OG 3.47Å; E819-S822 WeakPolarHBondContact O-CB 3.46Å; E819-S822 PolarHBondContact O-N 2.85Å; S822-H824 VanDerWaalsContact C-N 3.27Å; S822-K831 WeakPolarHBondContact OG-CD 3.48Å; S822-K831 WeakPolarHBondContact OG-CE 3.44Å; S822-K831 PolarHBondContact OG-NZ 3.47Å
823	I	94	Very high	95.2	Very high	132 Å²	132	35.5 Å²	35.5	68%	0.677	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.6	-20.3	175	-56.4	170.3	0	0	0	111.1	V821	V821-I823 PolarHBondContact O-N 2.83Å; V821-I823 VanDerWaalsContact O-N 3.11Å
824	H	93.6	Very high	95.2	Very high	65 Å²	65	35.5 Å²	35.5	30%	0.301	19%	0.185	S	C	.	.			trans	-119.4	109.7	-168.9	-60.1	-74	0	0	0	112	L788 V821 S822 S826 L827	L788-H824 HydrophobicContact CD2-CB 3.85Å; V821-H824 PolarHBondContact O-N 3.11Å; S822-H824 VanDerWaalsContact C-N 3.27Å; H824-S826 VanDerWaalsContact C-N 3.26Å; H824-S826 PolarHBondContact O-N 3.19Å; H824-L827 HydrophobicContact CB-CB 4.3Å; H824-L827 HydrophobicContact CB-CD1 4.35Å; H824-L827 HydrophobicContact CB-CG 4.15Å; H824-L827 PolarHBondContact O-N 2.94Å
825	Q	91.9	Very high	95.2	Very high	168 Å²	168	35.5 Å²	35.5	79%	0.785	19%	0.185	S	C	*	.	G	3₁₀ helix	trans	-59.2	-34.2	-179	-174.1	175.5	-3.2	0	0	113.2	L827 G828 L1168	Q825-L827 PolarHBondContact O-N 2.7Å; Q825-G828 PolarHBondContact O-N 2.98Å; Q825-L1168 HydrophobicContact CG-CD1 4.11Å
826	S	92.7	Very high	95.3	Very high	31 Å²	31	35.6 Å²	35.6	22%	0.217	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-62.6	-26.4	174.5	51.2	0	0	0	0	113.4	H824 G828 Y829 L1168 F1169	H824-S826 VanDerWaalsContact C-N 3.26Å; H824-S826 PolarHBondContact O-N 3.19Å; S826-G828 VanDerWaalsContact C-N 3.28Å; S826-G828 PolarHBondContact O-N 2.89Å; S826-Y829 WeakPolarHBondContact O-CD1 3.3Å; S826-L1168 WeakPolarHBondContact CB-O 3.33Å; S826-F1169 WeakPolarHBondContact O-CD1 3.19Å
827	L	94.9	Very high	95.3	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.005	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-91	18	174.3	-58.8	-171.6	0	0	0	113.1	V784 A787 L788 V821 H824 Q825 Y829 L830 K831	V784-L827 HydrophobicContact CG1-CD1 4.01Å; A787-L827 HydrophobicContact CB-CD1 4.13Å; A787-L827 HydrophobicContact CB-CD2 3.99Å; L788-L827 HydrophobicContact CD2-CD1 3.89Å; L788-L827 HydrophobicContact CD2-CD2 4.42Å; L788-L827 HydrophobicContact CD2-CG 3.9Å; L788-L827 HydrophobicContact CG-CD1 3.94Å; L788-L827 HydrophobicContact CG-CG 4.43Å; V821-L827 HydrophobicContact CB-CB 4Å; V821-L827 HydrophobicContact CB-CD1 4.1Å; V821-L827 HydrophobicContact CG1-CD1 3.89Å; H824-L827 HydrophobicContact CB-CB 4.3Å; H824-L827 HydrophobicContact CB-CD1 4.35Å; H824-L827 HydrophobicContact CB-CG 4.15Å; H824-L827 PolarHBondContact O-N 2.94Å; Q825-L827 PolarHBondContact O-N 2.7Å; L827-Y829 HydrophobicContact CD2-CE1 4.06Å; L827-Y829 PolarHBondContact O-N 3.41Å; L827-L830 HydrophobicContact CB-CB 4.43Å; L827-L830 HydrophobicContact CD1-CD2 4.43Å; L827-L830 PolarHBondContact O-N 2.96Å; L827-L830 VanDerWaalsContact O-N 3.12Å; L827-K831 PolarHBondContact O-N 2.94Å
828	G	93.6	Very high	95.3	Very high	25 Å²	25	35.7 Å²	35.7	26%	0.258	19%	0.188	S	C	.	.	H	α-helix	trans	-54.7	-36.1	176.2	0	0	0	0	0	113.4	Q825 S826 K831 K832	Q825-G828 PolarHBondContact O-N 2.98Å; S826-G828 VanDerWaalsContact C-N 3.28Å; S826-G828 PolarHBondContact O-N 2.89Å; G828-K831 PolarHBondContact O-N 3.22Å; G828-K832 VanDerWaalsContact O-CG 3.26Å; G828-K832 WeakPolarHBondContact O-CG 3.32Å; G828-K832 PolarHBondContact O-N 3Å
829	Y	93.6	Very high	95.4	Very high	14 Å²	14	35.6 Å²	35.6	6%	0.055	19%	0.187	C	C	.	.	H	α-helix	trans	-63.4	-47.9	175.4	75.4	-85.4	0	0	0	112.1	L790 S826 L827 K831 K832 M833 C1131 H1132 P1133 F1169	L790-Y829 HydrophobicContact CD2-CE1 4.36Å; S826-Y829 WeakPolarHBondContact O-CD1 3.3Å; L827-Y829 HydrophobicContact CD2-CE1 4.06Å; L827-Y829 PolarHBondContact O-N 3.41Å; Y829-K831 VanDerWaalsContact C-N 3.32Å; Y829-K831 PolarHBondContact O-N 3.45Å; Y829-K832 WeakPolarHBondContact O-CB 3.49Å; Y829-K832 PolarHBondContact O-N 3.29Å; Y829-M833 WeakPolarHBondContact O-CB 3.38Å; Y829-M833 PolarHBondContact O-N 2.88Å; Y829-C1131 WeakPolarHBondContact CB-O 3.23Å; Y829-H1132 AromaticContact CD2-CD2 3.45Å; Y829-H1132 VanDerWaalsContact CD2-CD2 3.45Å; Y829-H1132 WeakPolarHBondContact CD2-CD2 3.14Å; Y829-H1132 AromaticContact CD2-NE2 3.97Å; Y829-H1132 AromaticContact CE2-CD2 3.75Å; Y829-H1132 AromaticContact CE2-NE2 3.82Å; Y829-P1133 HydrophobicContact CD1-CG 4.47Å; Y829-P1133 HydrophobicContact CE1-CG 4.02Å; Y829-F1169 HydrophobicContact CD1-CD1 4.34Å; Y829-F1169 AromaticContact CD1-CE1 3.74Å; Y829-F1169 HydrophobicContact CD1-CE1 3.74Å; Y829-F1169 HydrophobicContact CD1-CZ 4.45Å; Y829-F1169 HydrophobicContact CE1-CE1 4.34Å
830	L	95.4	Very high	95.4	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-66	-36.6	-179.7	-178.5	57.7	0	0	0	111.2	A787 P794 L800 V821 L827 A834	A787-L830 HydrophobicContact CB-CD2 3.7Å; P794-L830 HydrophobicContact CG-CD1 3.82Å; L800-L830 HydrophobicContact CD1-CD1 3.63Å; L800-L830 HydrophobicContact CD2-CD1 4.34Å; V821-L830 HydrophobicContact CG1-CD2 3.81Å; V821-L830 HydrophobicContact CG1-CG 4.18Å; L827-L830 HydrophobicContact CB-CB 4.43Å; L827-L830 HydrophobicContact CD1-CD2 4.43Å; L827-L830 PolarHBondContact O-N 2.96Å; L827-L830 VanDerWaalsContact O-N 3.12Å; L830-A834 WeakPolarHBondContact O-CB 3.29Å; L830-A834 PolarHBondContact O-N 3.09Å
831	K	95.4	Very high	95.5	Very high	68 Å²	68	34.1 Å²	34.1	30%	0.296	18%	0.175	S	C	.	.	H	α-helix	trans	-59.4	-52.1	170.4	-179.8	179.6	176.4	156.8	0	111.9	V821 S822 L827 G828 Y829 M833 A834 I835	V821-K831 HydrophobicContact CG2-CB 3.83Å; V821-K831 HydrophobicContact CG2-CG 4.45Å; S822-K831 WeakPolarHBondContact OG-CD 3.48Å; S822-K831 WeakPolarHBondContact OG-CE 3.44Å; S822-K831 PolarHBondContact OG-NZ 3.47Å; L827-K831 PolarHBondContact O-N 2.94Å; G828-K831 PolarHBondContact O-N 3.22Å; Y829-K831 VanDerWaalsContact C-N 3.32Å; Y829-K831 PolarHBondContact O-N 3.45Å; K831-M833 PolarHBondContact O-N 3.06Å; K831-A834 PolarHBondContact O-N 3.16Å; K831-I835 HydrophobicContact CG-CD1 3.77Å; K831-I835 VanDerWaalsContact O-CG1 3.28Å; K831-I835 WeakPolarHBondContact O-CG1 3.18Å; K831-I835 PolarHBondContact O-N 2.85Å; K831-I835 VanDerWaalsContact O-N 3.08Å
832	K	94.6	Very high	95.5	Very high	41 Å²	41	34.1 Å²	34.1	18%	0.178	18%	0.175	C	C	.	.	H	α-helix	trans	-56.7	-50.9	178.4	-69.4	169.8	178.3	-170.3	0	110.4	G828 Y829 A834 I835 C836 Y948 E949 V950	G828-K832 VanDerWaalsContact O-CG 3.26Å; G828-K832 WeakPolarHBondContact O-CG 3.32Å; G828-K832 PolarHBondContact O-N 3Å; Y829-K832 WeakPolarHBondContact O-CB 3.49Å; Y829-K832 PolarHBondContact O-N 3.29Å; K832-A834 PolarHBondContact O-N 2.91Å; K832-I835 PolarHBondContact O-N 3.16Å; K832-C836 PolarHBondContact O-N 2.66Å; K832-C836 PolarHBondContact O-SG 3.5Å; K832-Y948 WeakPolarHBondContact CD-O 3.43Å; K832-Y948 WeakPolarHBondContact CE-O 3.19Å; K832-Y948 VanDerWaalsContact CG-O 3.24Å; K832-Y948 WeakPolarHBondContact CG-O 3.5Å; K832-E949 WeakPolarHBondContact CE-OE2 3.42Å; K832-E949 IonicContact NZ-OE2 3.94Å; K832-E949 PolarHBondContact NZ-OE2 2.95Å; K832-V950 HydrophobicContact CB-CG2 4.5Å
833	M	95.9	Very high	95.7	Very high	19 Å²	19	31.7 Å²	31.7	9%	0.094	16%	0.158	C	C	.	.	H	α-helix	trans	-58.1	-46.2	-179.8	-172.3	176.3	-69.7	0	0	112.9	P794 D796 L800 Y829 K831 I835 C836 E837 H1128	P794-M833 HydrophobicContact CB-SD 4.1Å; P794-M833 HydrophobicContact CG-SD 4.22Å; P794-M833 VanDerWaalsContact O-CE 3.26Å; P794-M833 WeakPolarHBondContact O-CE 3.26Å; D796-M833 VanDerWaalsContact O-SD 3.39Å; L800-M833 HydrophobicContact CB-SD 4.01Å; L800-M833 HydrophobicContact CD2-CB 4.41Å; L800-M833 HydrophobicContact CD2-CG 3.92Å; L800-M833 HydrophobicContact CD2-SD 4.31Å; Y829-M833 WeakPolarHBondContact O-CB 3.38Å; Y829-M833 PolarHBondContact O-N 2.88Å; K831-M833 PolarHBondContact O-N 3.06Å; M833-I835 PolarHBondContact O-N 2.73Å; M833-C836 WeakPolarHBondContact O-CB 3.33Å; M833-C836 PolarHBondContact O-N 2.97Å; M833-E837 PolarHBondContact O-N 3.37Å; M833-H1128 HydrophobicContact CE-CB 4.05Å
834	A	97.1	Very high	95.8	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-65.2	-36.1	177.7	0	0	0	0	0	112.9	L800 L814 I818 L830 K831 K832 E837 V838	L800-A834 HydrophobicContact CD2-CB 3.97Å; L814-A834 HydrophobicContact CD2-CB 4.06Å; I818-A834 HydrophobicContact CD1-CB 4.14Å; I818-A834 HydrophobicContact CG1-CB 3.55Å; L830-A834 WeakPolarHBondContact O-CB 3.29Å; L830-A834 PolarHBondContact O-N 3.09Å; K831-A834 PolarHBondContact O-N 3.16Å; K832-A834 PolarHBondContact O-N 2.91Å; A834-E837 PolarHBondContact O-N 2.84Å; A834-V838 PolarHBondContact O-N 2.95Å; A834-V838 VanDerWaalsContact O-N 3.13Å
835	I	97.1	Very high	95.9	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-70.9	-39.3	176	-66.8	167.5	0	0	0	111.2	I818 K831 K832 M833 E837 V838 L839 Y934 F944 Y948	I818-I835 HydrophobicContact CD1-CG1 3.82Å; I818-I835 HydrophobicContact CG1-CG1 4.04Å; I818-I835 HydrophobicContact CG2-CD1 4.07Å; I818-I835 HydrophobicContact CG2-CG1 3.94Å; K831-I835 HydrophobicContact CG-CD1 3.77Å; K831-I835 VanDerWaalsContact O-CG1 3.28Å; K831-I835 WeakPolarHBondContact O-CG1 3.18Å; K831-I835 PolarHBondContact O-N 2.85Å; K831-I835 VanDerWaalsContact O-N 3.08Å; K832-I835 PolarHBondContact O-N 3.16Å; M833-I835 PolarHBondContact O-N 2.73Å; I835-E837 VanDerWaalsContact C-N 3.31Å; I835-E837 PolarHBondContact O-N 3.12Å; I835-V838 PolarHBondContact O-N 3.29Å; I835-L839 PolarHBondContact O-N 2.82Å; I835-Y934 HydrophobicContact CD1-CE1 4.46Å; I835-Y934 WeakPolarHBondContact CD1-OH 3.45Å; I835-Y934 HydrophobicContact CG1-CE1 4Å; I835-Y934 HydrophobicContact CG2-CE1 3.93Å; I835-F944 HydrophobicContact CG2-CE2 3.82Å; I835-F944 HydrophobicContact CG2-CZ 3.91Å; I835-Y948 HydrophobicContact CD1-CD1 4Å; I835-Y948 HydrophobicContact CD1-CE1 3.57Å; I835-Y948 HydrophobicContact CG2-CD1 4.36Å; I835-Y948 HydrophobicContact CG2-CD2 4.29Å; I835-Y948 HydrophobicContact CG2-CE1 4.06Å; I835-Y948 HydrophobicContact CG2-CE2 4Å; I835-Y948 HydrophobicContact CG2-CG 4.46Å
836	C	97	Very high	96.1	Very high	15 Å²	15	19.2 Å²	19.2	10%	0.101	10%	0.097	C	C	.	.	H	α-helix	trans	-59.2	-42.2	170.5	-68.7	0	0	0	0	111.8	K832 M833 V838 L839 L840 V950 L955	K832-C836 PolarHBondContact O-N 2.66Å; K832-C836 PolarHBondContact O-SG 3.5Å; M833-C836 WeakPolarHBondContact O-CB 3.33Å; M833-C836 PolarHBondContact O-N 2.97Å; C836-V838 VanDerWaalsContact C-N 3.34Å; C836-V838 PolarHBondContact O-N 3.32Å; C836-L839 PolarHBondContact O-N 3.09Å; C836-L840 HydrophobicContact CB-CD1 4.39Å; C836-L840 VanDerWaalsContact O-CB 3.29Å; C836-L840 WeakPolarHBondContact O-CB 3.4Å; C836-L840 WeakPolarHBondContact O-CD1 3.34Å; C836-L840 VanDerWaalsContact O-CG 3.24Å; C836-L840 WeakPolarHBondContact O-CG 3.26Å; C836-L840 PolarHBondContact O-N 2.59Å; C836-V950 VanDerWaalsContact SG-CG2 3.53Å; C836-L955 HydrophobicContact CB-CD2 4.21Å
837	E	97.4	Very high	96.2	Very high	12 Å²	12	18 Å²	18	6%	0.056	9%	0.088	C	C	.	.	H	α-helix	trans	-65.1	-36.4	179.1	-169.3	66.3	-177.1	0	0	112	I801 L814 M833 A834 I835 R841	I801-E837 HydrophobicContact CD1-CG 4.11Å; I801-E837 HydrophobicContact CG1-CG 3.9Å; I801-E837 WeakPolarHBondContact CG1-OE1 3.49Å; L814-E837 HydrophobicContact CD1-CB 4.25Å; L814-E837 HydrophobicContact CD1-CG 3.95Å; M833-E837 PolarHBondContact O-N 3.37Å; A834-E837 PolarHBondContact O-N 2.84Å; I835-E837 VanDerWaalsContact C-N 3.31Å; I835-E837 PolarHBondContact O-N 3.12Å; E837-R841 VanDerWaalsContact O-CB 3.26Å; E837-R841 WeakPolarHBondContact O-CB 3.39Å; E837-R841 VanDerWaalsContact O-CG 3.22Å; E837-R841 WeakPolarHBondContact O-CG 3.24Å; E837-R841 PolarHBondContact O-N 2.89Å; E837-R841 IonicContact OE1-CZ 3.7Å; E837-R841 IonicContact OE1-NE 3.92Å; E837-R841 PolarHBondContact OE1-NE 2.89Å; E837-R841 IonicContact OE1-NH2 3.66Å; E837-R841 PolarHBondContact OE1-NH2 3.1Å
838	V	97.8	Very high	96.2	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-62.7	-47.4	170.1	172.3	0	0	0	0	111.3	L814 I818 A834 I835 C836 S842 A928 Y932 Y934	L814-V838 HydrophobicContact CB-CG2 3.81Å; L814-V838 HydrophobicContact CD1-CG2 3.84Å; L814-V838 HydrophobicContact CG-CG2 4.4Å; I818-V838 HydrophobicContact CD1-CG2 3.94Å; A834-V838 PolarHBondContact O-N 2.95Å; A834-V838 VanDerWaalsContact O-N 3.13Å; I835-V838 PolarHBondContact O-N 3.29Å; C836-V838 VanDerWaalsContact C-N 3.34Å; C836-V838 PolarHBondContact O-N 3.32Å; V838-S842 WeakPolarHBondContact O-CB 3.41Å; V838-S842 PolarHBondContact O-N 2.67Å; V838-S842 PolarHBondContact O-OG 3.03Å; V838-A928 HydrophobicContact CG1-CB 3.63Å; V838-Y932 HydrophobicContact CG1-CD2 3.97Å; V838-Y932 HydrophobicContact CG1-CG 4.17Å; V838-Y932 HydrophobicContact CG2-CG 4.19Å; V838-Y934 HydrophobicContact CG1-CD1 4.22Å
839	L	97.8	Very high	96.1	Very high	1 Å²	1	21.8 Å²	21.8	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-61.1	-50.2	178.6	-174.8	80.1	0	0	0	111.6	I835 C836 S842 A843 F870 W921 M924 I936 F944 L955	I835-L839 PolarHBondContact O-N 2.82Å; C836-L839 PolarHBondContact O-N 3.09Å; L839-S842 WeakPolarHBondContact O-CB 3.46Å; L839-S842 PolarHBondContact O-N 3.46Å; L839-A843 PolarHBondContact O-N 3.34Å; L839-F870 HydrophobicContact CD2-CE2 4.09Å; L839-F870 HydrophobicContact CD2-CZ 4.38Å; L839-F870 HydrophobicContact CG-CE2 4.37Å; L839-W921 HydrophobicContact CD1-CH2 3.56Å; L839-W921 HydrophobicContact CD1-CZ2 4.29Å; L839-W921 HydrophobicContact CD1-CZ3 3.77Å; L839-W921 HydrophobicContact CD2-CH2 4.15Å; L839-W921 HydrophobicContact CD2-CZ3 4.33Å; L839-M924 HydrophobicContact CD1-CE 3.45Å; L839-M924 VanDerWaalsContact CD1-CE 3.45Å; L839-M924 HydrophobicContact CG-CE 3.7Å; L839-I936 HydrophobicContact CB-CD1 4.26Å; L839-I936 HydrophobicContact CD1-CD1 3.69Å; L839-F944 HydrophobicContact CB-CE2 4.17Å; L839-F944 HydrophobicContact CB-CZ 4.06Å; L839-F944 HydrophobicContact CD1-CD2 4.31Å; L839-F944 HydrophobicContact CD1-CE2 4.16Å; L839-F944 HydrophobicContact CD2-CD1 3.95Å; L839-F944 HydrophobicContact CD2-CD2 4.2Å; L839-F944 HydrophobicContact CD2-CE1 3.67Å; L839-F944 HydrophobicContact CD2-CE2 3.92Å; L839-F944 HydrophobicContact CD2-CG 4.23Å; L839-F944 HydrophobicContact CD2-CZ 3.66Å; L839-F944 HydrophobicContact CG-CE2 4.31Å; L839-F944 HydrophobicContact CG-CZ 4.33Å; L839-L955 HydrophobicContact CD2-CD1 4.29Å; L839-L955 HydrophobicContact CD2-CD2 4.48Å
840	L	97.8	Very high	96.1	Very high	7 Å²	7	21.9 Å²	21.9	4%	0.037	10%	0.104	C	C	.	.	H	α-helix	trans	-68.3	-37	-175.6	-72	165.5	0	0	0	112.2	C836 A843 K844 F870 L955 T958 F959	C836-L840 HydrophobicContact CB-CD1 4.39Å; C836-L840 VanDerWaalsContact O-CB 3.29Å; C836-L840 WeakPolarHBondContact O-CB 3.4Å; C836-L840 WeakPolarHBondContact O-CD1 3.34Å; C836-L840 VanDerWaalsContact O-CG 3.24Å; C836-L840 WeakPolarHBondContact O-CG 3.26Å; C836-L840 PolarHBondContact O-N 2.59Å; L840-A843 PolarHBondContact O-N 3.43Å; L840-K844 VanDerWaalsContact O-CB 3.31Å; L840-K844 WeakPolarHBondContact O-CB 3.22Å; L840-K844 PolarHBondContact O-N 2.65Å; L840-F870 HydrophobicContact CD2-CE1 4.28Å; L840-F870 HydrophobicContact CD2-CZ 4.07Å; L840-L955 HydrophobicContact CD1-CD2 3.94Å; L840-L955 HydrophobicContact CD2-CB 4.29Å; L840-L955 HydrophobicContact CD2-CD2 4.11Å; L840-L955 WeakPolarHBondContact CD2-O 3.46Å; L840-L955 HydrophobicContact CG-CD2 4.03Å; L840-T958 HydrophobicContact CD1-CG2 3.74Å; L840-F959 HydrophobicContact CD2-CB 3.86Å; L840-F959 HydrophobicContact CD2-CD2 4.49Å
841	R	96.5	Very high	96	Very high	67 Å²	67	22 Å²	22	25%	0.253	11%	0.105	S	C	.	.	H	α-helix	trans	-68.6	-38.3	172.4	-72.2	-179.5	180	-89.6	-14.6	112.1	E837 K844 H845 Y932	E837-R841 VanDerWaalsContact O-CB 3.26Å; E837-R841 WeakPolarHBondContact O-CB 3.39Å; E837-R841 VanDerWaalsContact O-CG 3.22Å; E837-R841 WeakPolarHBondContact O-CG 3.24Å; E837-R841 PolarHBondContact O-N 2.89Å; E837-R841 IonicContact OE1-CZ 3.7Å; E837-R841 IonicContact OE1-NE 3.92Å; E837-R841 PolarHBondContact OE1-NE 2.89Å; E837-R841 IonicContact OE1-NH2 3.66Å; E837-R841 PolarHBondContact OE1-NH2 3.1Å; R841-K844 CarbonylContact O-C 3.6Å; R841-K844 PolarHBondContact O-N 3.02Å; R841-H845 PolarHBondContact O-CD2 3.28Å; R841-H845 VanDerWaalsContact O-CG 3.25Å; R841-H845 PolarHBondContact O-N 3.33Å; R841-Y932 HydrophobicContact CB-CE2 4.01Å; R841-Y932 VanDerWaalsContact CB-OH 3.3Å; R841-Y932 WeakPolarHBondContact CB-OH 3.45Å; R841-Y932 WeakPolarHBondContact CD-OH 3.44Å
842	S	97.4	Very high	95.8	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-61.2	-46.9	174	-57.2	0	0	0	0	111.2	V838 L839 K844 H845 L846 A928	V838-S842 WeakPolarHBondContact O-CB 3.41Å; V838-S842 PolarHBondContact O-N 2.67Å; V838-S842 PolarHBondContact O-OG 3.03Å; L839-S842 WeakPolarHBondContact O-CB 3.46Å; L839-S842 PolarHBondContact O-N 3.46Å; S842-K844 PolarHBondContact O-N 2.78Å; S842-H845 PolarHBondContact O-N 3.32Å; S842-H845 VanDerWaalsContact O-N 3.17Å; S842-L846 PolarHBondContact O-N 2.67Å; S842-A928 PolarHBondContact OG-N 3.32Å
843	A	97.8	Very high	95.4	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-57.7	-45.6	171.2	0	0	0	0	0	112	L839 L840 H845 L846 F847 F870 M924 F959	L839-A843 PolarHBondContact O-N 3.34Å; L840-A843 PolarHBondContact O-N 3.43Å; A843-H845 VanDerWaalsContact C-N 3.28Å; A843-H845 PolarHBondContact O-N 2.86Å; A843-L846 PolarHBondContact O-N 2.89Å; A843-F847 VanDerWaalsContact O-CB 3.23Å; A843-F847 WeakPolarHBondContact O-CB 3.43Å; A843-F847 PolarHBondContact O-N 3.41Å; A843-F870 HydrophobicContact CB-CD1 4.28Å; A843-F870 HydrophobicContact CB-CE1 3.95Å; A843-F870 HydrophobicContact CB-CE2 4.45Å; A843-F870 HydrophobicContact CB-CZ 4.06Å; A843-M924 HydrophobicContact CB-CE 3.73Å; A843-M924 HydrophobicContact CB-SD 3.95Å; A843-F959 HydrophobicContact CB-CD2 4.05Å; A843-F959 HydrophobicContact CB-CE2 3.72Å
844	K	96.5	Very high	95	Very high	36 Å²	36	23 Å²	23	16%	0.157	11%	0.114	C	C	.	.	H	α-helix	trans	-64.6	-26.8	177.3	167.6	163.6	180	171.6	0	113	L840 R841 S842 K848 S962 V963	L840-K844 VanDerWaalsContact O-CB 3.31Å; L840-K844 WeakPolarHBondContact O-CB 3.22Å; L840-K844 PolarHBondContact O-N 2.65Å; R841-K844 CarbonylContact O-C 3.6Å; R841-K844 PolarHBondContact O-N 3.02Å; S842-K844 PolarHBondContact O-N 2.78Å; K844-K848 VanDerWaalsContact O-CE 3.25Å; K844-K848 WeakPolarHBondContact O-CE 3.28Å; K844-K848 WeakPolarHBondContact O-CG 3.47Å; K844-S962 WeakPolarHBondContact CE-O 3.24Å; K844-S962 PolarHBondContact NZ-O 3.04Å; K844-V963 HydrophobicContact CB-CG1 3.84Å; K844-V963 HydrophobicContact CD-CG1 3.88Å; K844-V963 HydrophobicContact CG-CG1 3.71Å
845	H	94.9	Very high	94.4	Very high	39 Å²	39	26.8 Å²	26.8	18%	0.181	13%	0.134	C	C	.	.	H	α-helix	trans	-72	-51.6	175.2	-70.7	-174.6	0	0	0	110.4	R841 S842 A843 F847 K848 E927	R841-H845 PolarHBondContact O-CD2 3.28Å; R841-H845 VanDerWaalsContact O-CG 3.25Å; R841-H845 PolarHBondContact O-N 3.33Å; S842-H845 PolarHBondContact O-N 3.32Å; S842-H845 VanDerWaalsContact O-N 3.17Å; A843-H845 VanDerWaalsContact C-N 3.28Å; A843-H845 PolarHBondContact O-N 2.86Å; H845-F847 PolarHBondContact O-N 3.27Å; H845-K848 PolarHBondContact O-N 3.03Å; H845-E927 HydrophobicContact CB-CG 4.2Å; H845-E927 IonicContact CE1-OE1 2.64Å; H845-E927 IonicContact CG-OE1 2.96Å; H845-E927 IonicContact ND1-OE1 3.04Å; H845-E927 PolarHBondContact ND1-OE1 3.27Å
846	L	96	Very high	93.8	Very high	28 Å²	28	30.4 Å²	30.4	15%	0.147	16%	0.158	C	C	.	.	H	α-helix	trans	-65	-37	177.9	-58.9	177.9	0	0	0	112.8	S842 A843 K848 T849 Y850 L920 E923 M924	S842-L846 PolarHBondContact O-N 2.67Å; A843-L846 PolarHBondContact O-N 2.89Å; L846-K848 VanDerWaalsContact C-N 3.26Å; L846-K848 PolarHBondContact O-N 3.03Å; L846-T849 PolarHBondContact O-N 3.21Å; L846-T849 PolarHBondContact O-OG1 3.47Å; L846-Y850 WeakPolarHBondContact O-CB 3.22Å; L846-Y850 PolarHBondContact O-N 2.97Å; L846-L920 HydrophobicContact CB-CD1 4.47Å; L846-L920 HydrophobicContact CD1-CD1 3.94Å; L846-E923 HydrophobicContact CD1-CB 3.85Å; L846-E923 HydrophobicContact CD2-CB 4.48Å; L846-M924 HydrophobicContact CD1-CB 4.41Å; L846-M924 HydrophobicContact CD1-CG 3.57Å
847	F	96.7	Very high	93.1	Very high	5 Å²	5	36.5 Å²	36.5	2%	0.022	19%	0.187	C	C	.	.	H	α-helix	trans	-60.8	-32.5	178.6	-176.9	-108.5	0	0	0	113.1	A843 H845 L851 V863 F866 F959 V963 I965	A843-F847 VanDerWaalsContact O-CB 3.23Å; A843-F847 WeakPolarHBondContact O-CB 3.43Å; A843-F847 PolarHBondContact O-N 3.41Å; H845-F847 PolarHBondContact O-N 3.27Å; F847-L851 HydrophobicContact CE1-CD2 3.79Å; F847-L851 HydrophobicContact CZ-CD2 3.73Å; F847-L851 WeakPolarHBondContact O-CB 3.47Å; F847-L851 PolarHBondContact O-N 3.41Å; F847-V863 HydrophobicContact CE2-CG2 4.34Å; F847-V863 HydrophobicContact CZ-CG2 4.1Å; F847-F866 HydrophobicContact CB-CE1 4.09Å; F847-F866 HydrophobicContact CB-CE2 4.1Å; F847-F866 HydrophobicContact CB-CZ 3.76Å; F847-F866 HydrophobicContact CD2-CB 4.28Å; F847-F866 AromaticContact CD2-CD1 3.65Å; F847-F866 HydrophobicContact CD2-CD1 3.65Å; F847-F866 AromaticContact CD2-CD2 3.93Å; F847-F866 HydrophobicContact CD2-CD2 3.93Å; F847-F866 AromaticContact CD2-CE1 3.89Å; F847-F866 HydrophobicContact CD2-CE1 3.89Å; F847-F866 HydrophobicContact CD2-CE2 4.14Å; F847-F866 AromaticContact CD2-CG 3.68Å; F847-F866 HydrophobicContact CD2-CG 3.68Å; F847-F866 HydrophobicContact CD2-CZ 4.13Å; F847-F866 HydrophobicContact CE2-CB 4.34Å; F847-F866 HydrophobicContact CE2-CD1 4.25Å; F847-F866 HydrophobicContact CE2-CG 4.21Å; F847-F866 HydrophobicContact CG-CE1 4.38Å; F847-F866 HydrophobicContact CG-CZ 4.44Å; F847-F959 HydrophobicContact CB-CE2 4.39Å; F847-F959 HydrophobicContact CB-CZ 3.92Å; F847-F959 HydrophobicContact CD1-CZ 4.23Å; F847-F959 HydrophobicContact CD2-CE1 4.47Å; F847-F959 AromaticContact CD2-CZ 3.97Å; F847-F959 HydrophobicContact CD2-CZ 3.97Å; F847-F959 AromaticContact CG-CZ 3.78Å; F847-F959 HydrophobicContact CG-CZ 3.78Å; F847-V963 HydrophobicContact CD1-CB 3.73Å; F847-V963 HydrophobicContact CD1-CG1 3.8Å; F847-V963 HydrophobicContact CD1-CG2 3.91Å; F847-V963 HydrophobicContact CE1-CB 3.74Å; F847-V963 HydrophobicContact CE1-CG1 4.34Å; F847-V963 HydrophobicContact CE1-CG2 3.66Å; F847-V963 HydrophobicContact CZ-CG2 4.34Å; F847-I965 HydrophobicContact CE1-CD1 4.26Å; F847-I965 HydrophobicContact CE2-CD1 4.32Å; F847-I965 HydrophobicContact CZ-CD1 3.75Å; F847-I965 HydrophobicContact CZ-CG1 4.16Å
848	K	93.5	Very high	92.6	Very high	29 Å²	29	36.7 Å²	36.7	13%	0.126	19%	0.188	C	C	.	.	H	α-helix	trans	-66.1	-50.1	177.9	-69.8	169.1	-149	163	0	111.7	Y438 K844 H845 L846 L851 Q852	Y438-K848 HydrophobicContact CE2-CD 4.36Å; Y438-K848 WeakPolarHBondContact OH-CE 3.16Å; Y438-K848 PolarHBondContact OH-NZ 3.06Å; K844-K848 VanDerWaalsContact O-CE 3.25Å; K844-K848 WeakPolarHBondContact O-CE 3.28Å; K844-K848 WeakPolarHBondContact O-CG 3.47Å; H845-K848 PolarHBondContact O-N 3.03Å; L846-K848 VanDerWaalsContact C-N 3.26Å; L846-K848 PolarHBondContact O-N 3.03Å; K848-L851 PolarHBondContact O-N 2.83Å; K848-Q852 VanDerWaalsContact O-CG 3.28Å; K848-Q852 WeakPolarHBondContact O-CG 3.34Å; K848-Q852 PolarHBondContact O-N 3.37Å; K848-Q852 VanDerWaalsContact O-N 3.17Å
849	T	91.3	Very high	92.3	Very high	76 Å²	76	38.2 Å²	38.2	47%	0.466	20%	0.196	S	C	.	.	H	α-helix	trans	-67.7	-46.8	179.7	45.8	0	0	0	0	110.3	L846 L851 Q852 D853	L846-T849 PolarHBondContact O-N 3.21Å; L846-T849 PolarHBondContact O-OG1 3.47Å; T849-L851 VanDerWaalsContact C-N 3.3Å; T849-L851 PolarHBondContact O-N 3.13Å; T849-Q852 WeakPolarHBondContact O-CB 3.15Å; T849-Q852 PolarHBondContact O-N 2.85Å; T849-D853 PolarHBondContact O-N 2.82Å
850	Y	93.9	Very high	92	Very high	16 Å²	16	40 Å²	40	6%	0.063	21%	0.208	C	C	.	.	H	α-helix	trans	-50.3	-47.5	173.5	174.1	-84.4	0	0	0	112.4	L846 Q852 D853 V854 G862 H865 F866 W912 E915	L846-Y850 WeakPolarHBondContact O-CB 3.22Å; L846-Y850 PolarHBondContact O-N 2.97Å; Y850-Q852 VanDerWaalsContact C-N 3.35Å; Y850-Q852 PolarHBondContact O-N 2.99Å; Y850-D853 PolarHBondContact O-N 2.77Å; Y850-V854 HydrophobicContact CD1-CG2 4.27Å; Y850-V854 HydrophobicContact CE1-CG2 3.98Å; Y850-V854 WeakPolarHBondContact O-CG2 3.39Å; Y850-V854 PolarHBondContact O-N 3.18Å; Y850-G862 VanDerWaalsContact CE1-O 3.26Å; Y850-G862 WeakPolarHBondContact CE1-O 3.37Å; Y850-G862 PolarHBondContact OH-O 3.15Å; Y850-H865 AromaticContact CZ-ND1 3.97Å; Y850-H865 PolarHBondContact OH-ND1 3.3Å; Y850-F866 HydrophobicContact CD1-CB 4.33Å; Y850-F866 AromaticContact CD1-CD2 3.76Å; Y850-F866 HydrophobicContact CD1-CD2 3.76Å; Y850-F866 HydrophobicContact CD1-CG 4.41Å; Y850-F866 AromaticContact CD2-CD2 3.98Å; Y850-F866 HydrophobicContact CD2-CD2 3.98Å; Y850-F866 HydrophobicContact CE1-CB 3.74Å; Y850-F866 AromaticContact CE1-CD2 3.95Å; Y850-F866 HydrophobicContact CE1-CD2 3.95Å; Y850-F866 HydrophobicContact CE1-CG 4.28Å; Y850-F866 HydrophobicContact CE2-CD2 4.13Å; Y850-F866 AromaticContact CG-CD2 3.79Å; Y850-F866 HydrophobicContact CG-CD2 3.79Å; Y850-F866 HydrophobicContact CG-CE2 4.3Å; Y850-F866 PolarHBondContact OH-N 3.4Å; Y850-W912 HydrophobicContact CD2-CB 3.95Å; Y850-W912 HydrophobicContact CE2-CB 3.71Å; Y850-W912 HydrophobicContact CE2-CE3 4.49Å; Y850-E915 HydrophobicContact CE2-CB 4.21Å; Y850-E915 HydrophobicContact CE2-CG 4.47Å
851	L	93.6	Very high	91.7	Very high	4 Å²	4	40 Å²	40	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-77.2	-17.1	-177.3	-167.7	61.4	0	0	0	113.9	F847 K848 T849 D853 V854 L859 V863 L996	F847-L851 HydrophobicContact CE1-CD2 3.79Å; F847-L851 HydrophobicContact CZ-CD2 3.73Å; F847-L851 WeakPolarHBondContact O-CB 3.47Å; F847-L851 PolarHBondContact O-N 3.41Å; K848-L851 PolarHBondContact O-N 2.83Å; T849-L851 VanDerWaalsContact C-N 3.3Å; T849-L851 PolarHBondContact O-N 3.13Å; L851-D853 VanDerWaalsContact C-N 3.32Å; L851-V854 HydrophobicContact CD1-CB 4.27Å; L851-V854 HydrophobicContact CD1-CG2 4.42Å; L851-L859 HydrophobicContact CD1-CD2 3.83Å; L851-V863 HydrophobicContact CD1-CG2 4.04Å; L851-L996 HydrophobicContact CD2-CD1 3.96Å
852	Q	90.5	Very high	91.5	Very high	42 Å²	42	36.8 Å²	36.8	20%	0.196	20%	0.197	C	C	.	.	H	α-helix	trans	-70.2	-30.8	169.1	-71.7	167.8	26.4	0	0	111.7	G471 F472 K848 T849 Y850	G471-Q852 PolarHBondContact O-NE2 3.28Å; F472-Q852 HydrophobicContact CD1-CG 4.45Å; F472-Q852 HydrophobicContact CD2-CG 4.24Å; F472-Q852 HydrophobicContact CE1-CG 4.15Å; F472-Q852 HydrophobicContact CE2-CB 4.4Å; F472-Q852 HydrophobicContact CE2-CG 3.91Å; F472-Q852 HydrophobicContact CG-CG 4.48Å; F472-Q852 HydrophobicContact CZ-CB 4.19Å; F472-Q852 HydrophobicContact CZ-CG 3.85Å; K848-Q852 VanDerWaalsContact O-CG 3.28Å; K848-Q852 WeakPolarHBondContact O-CG 3.34Å; K848-Q852 PolarHBondContact O-N 3.37Å; K848-Q852 VanDerWaalsContact O-N 3.17Å; T849-Q852 WeakPolarHBondContact O-CB 3.15Å; T849-Q852 PolarHBondContact O-N 2.85Å; Y850-Q852 VanDerWaalsContact C-N 3.35Å; Y850-Q852 PolarHBondContact O-N 2.99Å
853	D	86.8	Confident	91.4	Very high	99 Å²	99	36.8 Å²	36.8	53%	0.529	20%	0.197	S	C	.	.	S	Bend	trans	-88.3	-6.5	-179.2	-61.8	-28.5	0	0	0	113.6	T849 Y850 L851 W912	T849-D853 PolarHBondContact O-N 2.82Å; Y850-D853 PolarHBondContact O-N 2.77Å; L851-D853 VanDerWaalsContact C-N 3.32Å; D853-W912 VanDerWaalsContact O-CD1 3.29Å
854	V	88.2	Confident	91.3	Very high	7 Å²	7	36.8 Å²	36.8	4%	0.042	20%	0.197	C	C	.	.	S	Bend	trans	-84.3	124.4	176.8	175.7	0	0	0	0	110.7	Y850 L851 L858 L859 W912	Y850-V854 HydrophobicContact CD1-CG2 4.27Å; Y850-V854 HydrophobicContact CE1-CG2 3.98Å; Y850-V854 WeakPolarHBondContact O-CG2 3.39Å; Y850-V854 PolarHBondContact O-N 3.18Å; L851-V854 HydrophobicContact CD1-CB 4.27Å; L851-V854 HydrophobicContact CD1-CG2 4.42Å; V854-L858 HydrophobicContact CG1-CB 4.22Å; V854-L859 HydrophobicContact CG1-CD2 4.3Å; V854-W912 HydrophobicContact CG1-CZ2 4.2Å; V854-W912 HydrophobicContact CG2-CB 4.46Å; V854-W912 HydrophobicContact CG2-CD2 3.75Å; V854-W912 HydrophobicContact CG2-CE3 4.15Å; V854-W912 HydrophobicContact CG2-CG 3.89Å; V854-W912 HydrophobicContact CG2-CZ2 4.46Å
855	D	83.7	Confident	91.2	Very high	79 Å²	79	35.6 Å²	35.6	42%	0.422	19%	0.192	S	C	.	.			trans	-53.3	137.1	174	-175.8	-72.8	0	0	0	111.6	M857 L858 L859	D855-M857 PolarHBondContact O-N 3.08Å; D855-M857 VanDerWaalsContact O-N 3.09Å; D855-M857 VanDerWaalsContact OD1-CB 3.26Å; D855-M857 WeakPolarHBondContact OD1-CB 3.45Å; D855-M857 PolarHBondContact OD1-N 3.21Å; D855-L858 HydrophobicContact CB-CB 4.35Å; D855-L858 HydrophobicContact CB-CD1 4.24Å; D855-L858 HydrophobicContact CB-CG 4.26Å; D855-L858 CarbonylContact O-C 3.59Å; D855-L858 WeakPolarHBondContact O-CA 3.5Å; D855-L858 PolarHBondContact O-N 2.86Å; D855-L859 PolarHBondContact O-N 3.42Å
856	P	84.1	Confident	91.2	Very high	77 Å²	77	33.8 Å²	33.8	50%	0.5	18%	0.183	S	C	.	.	G	3₁₀ helix	trans	-52.3	-30.8	178.9	-28.3	35.7	0	0	0	115.6	L858 L859	P856-L858 VanDerWaalsContact C-N 3.28Å; P856-L859 WeakPolarHBondContact O-CD1 3.48Å; P856-L859 WeakPolarHBondContact O-CG 3.44Å
857	M	83.7	Confident	91.3	Very high	143 Å²	143	32.4 Å²	32.4	70%	0.704	18%	0.176	S	C	*	.	G	3₁₀ helix	trans	-75.3	-15.6	175.9	-59.2	-174.1	63.3	0	0	113.3	D855 V887	D855-M857 PolarHBondContact O-N 3.08Å; D855-M857 VanDerWaalsContact O-N 3.09Å; D855-M857 VanDerWaalsContact OD1-CB 3.26Å; D855-M857 WeakPolarHBondContact OD1-CB 3.45Å; D855-M857 PolarHBondContact OD1-N 3.21Å; M857-V887 HydrophobicContact CE-CG2 4.3Å
858	L	87.1	Confident	91.2	Very high	15 Å²	15	32.2 Å²	32.2	8%	0.079	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-113.6	7.2	-173.9	-59.9	-178.6	0	0	0	113.4	V854 D855 P856 S860 V861 G862 I883 W912	V854-L858 HydrophobicContact CG1-CB 4.22Å; D855-L858 HydrophobicContact CB-CB 4.35Å; D855-L858 HydrophobicContact CB-CD1 4.24Å; D855-L858 HydrophobicContact CB-CG 4.26Å; D855-L858 CarbonylContact O-C 3.59Å; D855-L858 WeakPolarHBondContact O-CA 3.5Å; D855-L858 PolarHBondContact O-N 2.86Å; P856-L858 VanDerWaalsContact C-N 3.28Å; L858-S860 PolarHBondContact O-N 3.15Å; L858-V861 CarbonylContact O-C 3.53Å; L858-V861 WeakPolarHBondContact O-CA 3.32Å; L858-V861 WeakPolarHBondContact O-CB 3.41Å; L858-V861 PolarHBondContact O-N 2.93Å; L858-G862 PolarHBondContact O-N 3.44Å; L858-I883 HydrophobicContact CD1-CD1 4.2Å; L858-I883 HydrophobicContact CD2-CD1 4.01Å; L858-I883 HydrophobicContact CD2-CG1 3.84Å; L858-I883 HydrophobicContact CD2-CG2 4.37Å; L858-W912 HydrophobicContact CB-CH2 4.23Å; L858-W912 HydrophobicContact CB-CZ2 4.02Å; L858-W912 HydrophobicContact CD1-CH2 4.43Å; L858-W912 HydrophobicContact CD1-CZ2 3.87Å
859	L	90.4	Very high	91.2	Very high	32 Å²	32	31.1 Å²	31.1	17%	0.168	17%	0.171	C	C	.	.	H	α-helix	trans	-50.5	-50.8	-176.5	-68.1	167.3	0	0	0	113.8	L851 V854 D855 P856 V861 G862 V863	L851-L859 HydrophobicContact CD1-CD2 3.83Å; V854-L859 HydrophobicContact CG1-CD2 4.3Å; D855-L859 PolarHBondContact O-N 3.42Å; P856-L859 WeakPolarHBondContact O-CD1 3.48Å; P856-L859 WeakPolarHBondContact O-CG 3.44Å; L859-V861 VanDerWaalsContact C-N 3.33Å; L859-V861 PolarHBondContact O-N 3.06Å; L859-G862 PolarHBondContact O-N 3.08Å; L859-V863 VanDerWaalsContact O-CG2 3.29Å; L859-V863 WeakPolarHBondContact O-CG2 3.44Å; L859-V863 PolarHBondContact O-N 3.27Å
860	S	92.2	Very high	91.3	Very high	38 Å²	38	27.6 Å²	27.6	27%	0.266	15%	0.149	S	C	.	.	H	α-helix	trans	-65.4	-35.3	179.6	45.2	0	0	0	0	112.5	L858 A864 T990 I993	L858-S860 PolarHBondContact O-N 3.15Å; S860-A864 VanDerWaalsContact O-CB 3.26Å; S860-A864 WeakPolarHBondContact O-CB 3.5Å; S860-A864 PolarHBondContact O-N 2.98Å; S860-T990 VanDerWaalsContact OG-CG2 3.25Å; S860-T990 WeakPolarHBondContact OG-CG2 3.3Å; S860-I993 WeakPolarHBondContact O-CG1 3.47Å
861	V	91.8	Very high	91.3	Very high	8 Å²	8	26.8 Å²	26.8	5%	0.048	15%	0.146	C	C	.	.	H	α-helix	trans	-65	-46.2	171.6	-179.7	0	0	0	0	110.3	L858 L859 A864 H865 L880 W912 T990	L858-V861 CarbonylContact O-C 3.53Å; L858-V861 WeakPolarHBondContact O-CA 3.32Å; L858-V861 WeakPolarHBondContact O-CB 3.41Å; L858-V861 PolarHBondContact O-N 2.93Å; L859-V861 VanDerWaalsContact C-N 3.33Å; L859-V861 PolarHBondContact O-N 3.06Å; V861-A864 PolarHBondContact O-N 2.75Å; V861-H865 WeakPolarHBondContact O-CB 3.25Å; V861-H865 PolarHBondContact O-N 3.23Å; V861-L880 HydrophobicContact CG1-CB 4.25Å; V861-W912 HydrophobicContact CG1-CH2 4.24Å; V861-T990 HydrophobicContact CG2-CG2 3.78Å
862	G	92.2	Very high	91.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-63.2	-43.5	178.9	0	0	0	0	0	113.2	Y850 L858 L859 H865 F866	Y850-G862 VanDerWaalsContact CE1-O 3.26Å; Y850-G862 WeakPolarHBondContact CE1-O 3.37Å; Y850-G862 PolarHBondContact OH-O 3.15Å; L858-G862 PolarHBondContact O-N 3.44Å; L859-G862 PolarHBondContact O-N 3.08Å; G862-H865 PolarHBondContact O-N 2.95Å; G862-F866 PolarHBondContact O-N 2.62Å
863	V	95.4	Very high	90.8	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-66.8	-46.5	176.7	175.7	0	0	0	0	110.8	F847 L851 L859 H865 F866 L867 I965 I993 L996	F847-V863 HydrophobicContact CE2-CG2 4.34Å; F847-V863 HydrophobicContact CZ-CG2 4.1Å; L851-V863 HydrophobicContact CD1-CG2 4.04Å; L859-V863 VanDerWaalsContact O-CG2 3.29Å; L859-V863 WeakPolarHBondContact O-CG2 3.44Å; L859-V863 PolarHBondContact O-N 3.27Å; V863-H865 VanDerWaalsContact C-N 3.31Å; V863-H865 PolarHBondContact O-N 3.21Å; V863-F866 PolarHBondContact O-N 3.28Å; V863-L867 HydrophobicContact CG1-CD1 4.06Å; V863-L867 HydrophobicContact CG1-CG 4.46Å; V863-L867 WeakPolarHBondContact O-CG 3.44Å; V863-L867 PolarHBondContact O-N 2.96Å; V863-I965 HydrophobicContact CG1-CD1 3.8Å; V863-I965 HydrophobicContact CG1-CG1 4.01Å; V863-I965 HydrophobicContact CG1-CG2 4.15Å; V863-I993 HydrophobicContact CB-CD1 4.38Å; V863-I993 HydrophobicContact CB-CG1 4.25Å; V863-I993 HydrophobicContact CB-CG2 4.17Å; V863-I993 HydrophobicContact CG1-CD1 3.8Å; V863-I993 HydrophobicContact CG1-CG1 4.17Å; V863-I993 HydrophobicContact CG1-CG2 4.03Å; V863-L996 HydrophobicContact CG2-CD1 4.4Å; V863-L996 HydrophobicContact CG2-CD2 4.22Å
864	A	95.3	Very high	90.7	Very high	0 Å²	0	20 Å²	20	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-60.7	-40.8	174.7	0	0	0	0	0	111.7	S860 V861 L867 N868 L880 F988 I993	S860-A864 VanDerWaalsContact O-CB 3.26Å; S860-A864 WeakPolarHBondContact O-CB 3.5Å; S860-A864 PolarHBondContact O-N 2.98Å; V861-A864 PolarHBondContact O-N 2.75Å; A864-L867 PolarHBondContact O-N 2.61Å; A864-N868 PolarHBondContact O-N 3.17Å; A864-N868 PolarHBondContact O-ND2 3.29Å; A864-L880 HydrophobicContact CB-CD1 4.19Å; A864-L880 HydrophobicContact CB-CD2 4.29Å; A864-F988 HydrophobicContact CB-CB 4.43Å; A864-I993 HydrophobicContact CB-CD1 4.32Å; A864-I993 HydrophobicContact CB-CG1 4.15Å
865	H	94	Very high	90.3	Very high	10 Å²	10	23.7 Å²	23.7	5%	0.046	14%	0.136	C	C	.	.	H	α-helix	trans	-59.8	-50.4	176.2	-178.7	-93.2	0	0	0	111.4	Y850 V861 G862 V863 L867 N868 C869 L877 L880 W912 E915	Y850-H865 AromaticContact CZ-ND1 3.97Å; Y850-H865 PolarHBondContact OH-ND1 3.3Å; V861-H865 WeakPolarHBondContact O-CB 3.25Å; V861-H865 PolarHBondContact O-N 3.23Å; G862-H865 PolarHBondContact O-N 2.95Å; V863-H865 VanDerWaalsContact C-N 3.31Å; V863-H865 PolarHBondContact O-N 3.21Å; H865-L867 PolarHBondContact O-N 3.36Å; H865-N868 PolarHBondContact O-N 2.95Å; H865-C869 PolarHBondContact O-N 3.08Å; H865-L877 WeakPolarHBondContact CD2-CD1 3.32Å; H865-L880 HydrophobicContact CB-CD1 3.98Å; H865-W912 HydrophobicContact CB-CZ3 4.48Å; H865-W912 PolarHBondContact CE1-O 2.93Å; H865-W912 VanDerWaalsContact CE1-O 3.25Å; H865-E915 PolarHBondContact CE1-O 3.04Å
866	F	95.6	Very high	90.1	Very high	1 Å²	1	23.5 Å²	23.5	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-59.9	-47	177.3	-169.1	-82.8	0	0	0	112.3	F847 Y850 G862 V863 N868 C869 F870 L920 F959	F847-F866 HydrophobicContact CB-CE1 4.09Å; F847-F866 HydrophobicContact CB-CE2 4.1Å; F847-F866 HydrophobicContact CB-CZ 3.76Å; F847-F866 HydrophobicContact CD2-CB 4.28Å; F847-F866 AromaticContact CD2-CD1 3.65Å; F847-F866 HydrophobicContact CD2-CD1 3.65Å; F847-F866 AromaticContact CD2-CD2 3.93Å; F847-F866 HydrophobicContact CD2-CD2 3.93Å; F847-F866 AromaticContact CD2-CE1 3.89Å; F847-F866 HydrophobicContact CD2-CE1 3.89Å; F847-F866 HydrophobicContact CD2-CE2 4.14Å; F847-F866 AromaticContact CD2-CG 3.68Å; F847-F866 HydrophobicContact CD2-CG 3.68Å; F847-F866 HydrophobicContact CD2-CZ 4.13Å; F847-F866 HydrophobicContact CE2-CB 4.34Å; F847-F866 HydrophobicContact CE2-CD1 4.25Å; F847-F866 HydrophobicContact CE2-CG 4.21Å; F847-F866 HydrophobicContact CG-CE1 4.38Å; F847-F866 HydrophobicContact CG-CZ 4.44Å; Y850-F866 HydrophobicContact CD1-CB 4.33Å; Y850-F866 AromaticContact CD1-CD2 3.76Å; Y850-F866 HydrophobicContact CD1-CD2 3.76Å; Y850-F866 HydrophobicContact CD1-CG 4.41Å; Y850-F866 AromaticContact CD2-CD2 3.98Å; Y850-F866 HydrophobicContact CD2-CD2 3.98Å; Y850-F866 HydrophobicContact CE1-CB 3.74Å; Y850-F866 AromaticContact CE1-CD2 3.95Å; Y850-F866 HydrophobicContact CE1-CD2 3.95Å; Y850-F866 HydrophobicContact CE1-CG 4.28Å; Y850-F866 HydrophobicContact CE2-CD2 4.13Å; Y850-F866 AromaticContact CG-CD2 3.79Å; Y850-F866 HydrophobicContact CG-CD2 3.79Å; Y850-F866 HydrophobicContact CG-CE2 4.3Å; Y850-F866 PolarHBondContact OH-N 3.4Å; G862-F866 PolarHBondContact O-N 2.62Å; V863-F866 PolarHBondContact O-N 3.28Å; F866-N868 VanDerWaalsContact C-N 3.31Å; F866-N868 PolarHBondContact O-N 2.75Å; F866-C869 PolarHBondContact O-N 3.48Å; F866-F870 HydrophobicContact CD1-CB 4.39Å; F866-F870 HydrophobicContact CE1-CB 4.21Å; F866-F870 HydrophobicContact CE1-CD1 4.34Å; F866-F870 WeakPolarHBondContact O-CB 3.44Å; F866-F870 PolarHBondContact O-N 3.39Å; F866-L920 HydrophobicContact CD2-CD2 4.25Å; F866-L920 HydrophobicContact CE1-CD2 4.45Å; F866-L920 HydrophobicContact CE2-CD1 3.71Å; F866-L920 HydrophobicContact CE2-CD2 4.02Å; F866-L920 HydrophobicContact CZ-CD1 4.01Å; F866-L920 HydrophobicContact CZ-CD2 4.13Å; F866-F959 HydrophobicContact CD1-CE1 4.24Å; F866-F959 AromaticContact CD1-CZ 3.99Å; F866-F959 HydrophobicContact CD1-CZ 3.99Å; F866-F959 HydrophobicContact CE1-CE1 4.15Å; F866-F959 HydrophobicContact CE1-CE2 4.15Å; F866-F959 AromaticContact CE1-CZ 3.5Å; F866-F959 HydrophobicContact CE1-CZ 3.5Å; F866-F959 VanDerWaalsContact CE1-CZ 3.5Å; F866-F959 HydrophobicContact CZ-CZ 4.4Å
867	L	96.4	Very high	90.1	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.3	-36	179.8	-71.4	174.3	0	0	0	112.5	V863 A864 H865 L871 L956 F959 I965 L967 F988 I993	V863-L867 HydrophobicContact CG1-CD1 4.06Å; V863-L867 HydrophobicContact CG1-CG 4.46Å; V863-L867 WeakPolarHBondContact O-CG 3.44Å; V863-L867 PolarHBondContact O-N 2.96Å; A864-L867 PolarHBondContact O-N 2.61Å; H865-L867 PolarHBondContact O-N 3.36Å; L867-L871 HydrophobicContact CD2-CD1 4.28Å; L867-L871 WeakPolarHBondContact O-CB 3.41Å; L867-L871 PolarHBondContact O-N 2.94Å; L867-L956 HydrophobicContact CD2-CD1 4.2Å; L867-F959 HydrophobicContact CD2-CD1 3.73Å; L867-F959 HydrophobicContact CD2-CE1 3.78Å; L867-I965 HydrophobicContact CD2-CD1 4.38Å; L867-L967 HydrophobicContact CD1-CD2 4.03Å; L867-F988 HydrophobicContact CB-CB 4.46Å; L867-F988 HydrophobicContact CB-CD2 3.59Å; L867-F988 HydrophobicContact CB-CE2 3.91Å; L867-F988 HydrophobicContact CB-CG 3.99Å; L867-F988 HydrophobicContact CD1-CD1 4.26Å; L867-F988 HydrophobicContact CD1-CG 4.29Å; L867-I993 HydrophobicContact CD1-CD1 4.08Å
868	N	94.6	Very high	89.6	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.11	C	C	.	.	I	π-helix	trans	-73.5	-38.6	174.8	-73.8	-74.5	0	0	0	113	A864 H865 F866 T872 A873 C874 L877 P986 V987 F988	A864-N868 PolarHBondContact O-N 3.17Å; A864-N868 PolarHBondContact O-ND2 3.29Å; H865-N868 PolarHBondContact O-N 2.95Å; F866-N868 VanDerWaalsContact C-N 3.31Å; F866-N868 PolarHBondContact O-N 2.75Å; N868-T872 VanDerWaalsContact CA-OG1 3.28Å; N868-T872 WeakPolarHBondContact CA-OG1 3.48Å; N868-T872 CarbonylContact O-C 3.5Å; N868-T872 PolarHBondContact O-N 3.11Å; N868-T872 PolarHBondContact O-OG1 2.98Å; N868-T872 PolarHBondContact OD1-OG1 3.47Å; N868-A873 PolarHBondContact O-N 2.98Å; N868-C874 HydrophobicContact CB-CB 4.36Å; N868-L877 HydrophobicContact CB-CD1 4.26Å; N868-L877 HydrophobicContact CB-CD2 3.58Å; N868-P986 WeakPolarHBondContact OD1-CA 3.1Å; N868-V987 PolarHBondContact OD1-N 3.3Å; N868-F988 PolarHBondContact ND2-O 3.23Å; N868-F988 PolarHBondContact OD1-N 3.47Å
869	C	93.5	Very high	88.8	Confident	6 Å²	6	21.4 Å²	21.4	4%	0.041	13%	0.13	C	C	.	.	I	π-helix	trans	-63.5	-43.7	174	-80	0	0	0	0	111.9	H865 F866 L877 E915 H917 L920	H865-C869 PolarHBondContact O-N 3.08Å; F866-C869 PolarHBondContact O-N 3.48Å; C869-L877 WeakPolarHBondContact SG-CD1 3.35Å; C869-E915 PolarHBondContact SG-O 3.16Å; C869-H917 WeakPolarHBondContact O-CA 3.07Å; C869-H917 WeakPolarHBondContact O-CB 3.46Å; C869-L920 HydrophobicContact CB-CD2 3.73Å
870	F	94.7	Very high	88.2	Confident	2 Å²	2	20 Å²	20	1%	0.009	12%	0.123	C	C	.	.	I	π-helix	trans	-72.8	-56.3	-179.5	173.5	-150.1	0	0	0	112.5	L839 L840 A843 F866 L920 W921 M924 F959	L839-F870 HydrophobicContact CD2-CE2 4.09Å; L839-F870 HydrophobicContact CD2-CZ 4.38Å; L839-F870 HydrophobicContact CG-CE2 4.37Å; L840-F870 HydrophobicContact CD2-CE1 4.28Å; L840-F870 HydrophobicContact CD2-CZ 4.07Å; A843-F870 HydrophobicContact CB-CD1 4.28Å; A843-F870 HydrophobicContact CB-CE1 3.95Å; A843-F870 HydrophobicContact CB-CE2 4.45Å; A843-F870 HydrophobicContact CB-CZ 4.06Å; F866-F870 HydrophobicContact CD1-CB 4.39Å; F866-F870 HydrophobicContact CE1-CB 4.21Å; F866-F870 HydrophobicContact CE1-CD1 4.34Å; F866-F870 WeakPolarHBondContact O-CB 3.44Å; F866-F870 PolarHBondContact O-N 3.39Å; F870-L920 HydrophobicContact CB-CD2 3.99Å; F870-W921 HydrophobicContact CE2-CZ3 4.48Å; F870-M924 HydrophobicContact CD2-CE 3.89Å; F870-M924 HydrophobicContact CD2-SD 3.91Å; F870-M924 HydrophobicContact CE2-CE 3.61Å; F870-M924 HydrophobicContact CE2-SD 4.25Å; F870-M924 HydrophobicContact CZ-CE 4.32Å; F870-F959 HydrophobicContact CD1-CD2 4.45Å; F870-F959 HydrophobicContact CD1-CG 4.44Å; F870-F959 HydrophobicContact CE1-CB 4.27Å; F870-F959 AromaticContact CE1-CD2 3.94Å; F870-F959 HydrophobicContact CE1-CD2 3.94Å; F870-F959 HydrophobicContact CE1-CE2 4.45Å; F870-F959 AromaticContact CE1-CG 3.99Å; F870-F959 HydrophobicContact CE1-CG 3.99Å
871	L	93.1	Very high	86.9	Confident	0 Å²	0	22 Å²	22	0%	0	13%	0.13	C	C	.	.	I	π-helix	trans	-96.5	-24	-165.2	-65.2	171.7	0	0	0	114.3	L867 R952 L955 L956 F988	L867-L871 HydrophobicContact CD2-CD1 4.28Å; L867-L871 WeakPolarHBondContact O-CB 3.41Å; L867-L871 PolarHBondContact O-N 2.94Å; L871-R952 PolarHBondContact O-NE 3.34Å; L871-R952 PolarHBondContact O-NH2 2.84Å; L871-L955 HydrophobicContact CD2-CB 3.91Å; L871-L956 HydrophobicContact CD1-CB 3.98Å; L871-L956 HydrophobicContact CD1-CD1 3.48Å; L871-L956 VanDerWaalsContact CD1-CD1 3.48Å; L871-L956 HydrophobicContact CD1-CG 4.33Å; L871-F988 HydrophobicContact CB-CE2 4.44Å; L871-F988 HydrophobicContact CD1-CE2 4.48Å; L871-F988 HydrophobicContact CD1-CZ 4.39Å
872	T	89.4	Confident	85.2	Confident	0 Å²	0	25 Å²	25	0%	0	16%	0.162	C	C	.	.	I	π-helix	trans	-121.5	-1.8	-170.8	71.7	0	0	0	0	114.7	N868 C874 L974 H983 V987 F988	N868-T872 VanDerWaalsContact CA-OG1 3.28Å; N868-T872 WeakPolarHBondContact CA-OG1 3.48Å; N868-T872 CarbonylContact O-C 3.5Å; N868-T872 PolarHBondContact O-N 3.11Å; N868-T872 PolarHBondContact O-OG1 2.98Å; N868-T872 PolarHBondContact OD1-OG1 3.47Å; T872-C874 PolarHBondContact O-N 3.33Å; T872-L974 HydrophobicContact CG2-CD2 4.34Å; T872-H983 PolarHBondContact O-CD2 2.84Å; T872-V987 HydrophobicContact CG2-CB 4Å; T872-V987 HydrophobicContact CG2-CG2 3.9Å; T872-F988 HydrophobicContact CG2-CD2 4.45Å; T872-F988 HydrophobicContact CG2-CE2 3.95Å
873	A	84.7	Confident	83.5	Confident	1 Å²	1	25.9 Å²	25.9	1%	0.008	17%	0.167	C	C	.	.			trans	48.6	29.8	178.5	0	0	0	0	0	114.5	N868 P875 H917 I941	N868-A873 PolarHBondContact O-N 2.98Å; A873-P875 VanDerWaalsContact O-CD 3.3Å; A873-P875 WeakPolarHBondContact O-CD 3.42Å; A873-H917 HydrophobicContact CB-CB 4.17Å; A873-I941 HydrophobicContact CB-CG2 4.04Å
874	C	85	Confident	81.5	Confident	2 Å²	2	29.9 Å²	29.9	1%	0.014	19%	0.188	C	C	.	.			trans	-71.7	117.7	-174.2	179.8	0	0	0	0	110.6	N868 T872 N876 L877 H983	N868-C874 HydrophobicContact CB-CB 4.36Å; T872-C874 PolarHBondContact O-N 3.33Å; C874-N876 VanDerWaalsContact C-N 3.34Å; C874-N876 PolarHBondContact O-N 3.15Å; C874-L877 HydrophobicContact CB-CD2 3.84Å; C874-H983 HydrophobicContact CB-CB 4.27Å; C874-H983 PolarHBondContact SG-O 2.87Å; C874-H983 VanDerWaalsContact SG-O 3.35Å
875	P	79	Confident	79.4	Confident	84 Å²	84	35.9 Å²	35.9	55%	0.545	22%	0.216	S	C	.	.	S	Bend	trans	-82.6	-9.6	-175.1	33.9	-37.5	0	0	0	113.5	A873 H982 H983	A873-P875 VanDerWaalsContact O-CD 3.3Å; A873-P875 WeakPolarHBondContact O-CD 3.42Å; P875-H982 HydrophobicContact CG-CB 4.17Å; P875-H983 WeakPolarHBondContact CD-O 3.48Å
876	N	80.4	Confident	77.4	Confident	74 Å²	74	41.3 Å²	41.3	40%	0.396	24%	0.242	S	C	.	.			trans	-123	85.3	-178.4	-177	11.5	0	0	0	110.9	C874 T878 P879	C874-N876 VanDerWaalsContact C-N 3.34Å; C874-N876 PolarHBondContact O-N 3.15Å; N876-T878 VanDerWaalsContact C-N 3.34Å; N876-T878 VanDerWaalsContact OD1-CB 3.25Å; N876-T878 WeakPolarHBondContact OD1-CB 3.47Å; N876-T878 PolarHBondContact OD1-N 3.3Å; N876-T878 PolarHBondContact OD1-OG1 2.91Å; N876-T878 VanDerWaalsContact OD1-OG1 3.06Å; N876-P879 VanDerWaalsContact O-CD 3.26Å; N876-P879 WeakPolarHBondContact O-CD 3.43Å
877	L	83.3	Confident	75.5	Confident	20 Å²	20	43.2 Å²	43.2	11%	0.105	25%	0.253	C	S	.	.			trans	-90.7	5.9	176.4	-57.9	-175.6	0	0	0	113.4	H865 N868 C869 C874 P879 L880 P986	H865-L877 WeakPolarHBondContact CD2-CD1 3.32Å; N868-L877 HydrophobicContact CB-CD1 4.26Å; N868-L877 HydrophobicContact CB-CD2 3.58Å; C869-L877 WeakPolarHBondContact SG-CD1 3.35Å; C874-L877 HydrophobicContact CB-CD2 3.84Å; L877-P879 VanDerWaalsContact O-N 3.16Å; L877-L880 HydrophobicContact CB-CD1 4.23Å; L877-L880 HydrophobicContact CD2-CD1 4.24Å; L877-L880 WeakPolarHBondContact O-CB 3.33Å; L877-L880 PolarHBondContact O-N 3.17Å; L877-P986 HydrophobicContact CD2-CB 4.43Å; L877-P986 HydrophobicContact CD2-CG 4.03Å
878	T	73.5	Confident	73.5	Confident	94 Å²	94	46.5 Å²	46.5	58%	0.577	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-51.3	-33.4	172.2	-50.6	0	0	0	0	114.1	N876 L880 L881	N876-T878 VanDerWaalsContact C-N 3.34Å; N876-T878 VanDerWaalsContact OD1-CB 3.25Å; N876-T878 WeakPolarHBondContact OD1-CB 3.47Å; N876-T878 PolarHBondContact OD1-N 3.3Å; N876-T878 PolarHBondContact OD1-OG1 2.91Å; N876-T878 VanDerWaalsContact OD1-OG1 3.06Å; T878-L880 PolarHBondContact O-N 3.06Å; T878-L881 HydrophobicContact CG2-CD1 4.35Å; T878-L881 VanDerWaalsContact O-CB 3.28Å; T878-L881 WeakPolarHBondContact O-CB 3.38Å; T878-L881 PolarHBondContact O-N 3.1Å
879	P	70.6	Confident	71.6	Confident	77 Å²	77	50.7 Å²	50.7	50%	0.5	29%	0.288	S	S	.	.	G	3₁₀ helix	trans	-64.2	-19.3	174.4	-23.5	35.8	0	0	0	115	N876 L877 P986	N876-P879 VanDerWaalsContact O-CD 3.26Å; N876-P879 WeakPolarHBondContact O-CD 3.43Å; L877-P879 VanDerWaalsContact O-N 3.16Å; P879-P986 HydrophobicContact CB-CG 4.13Å; P879-P986 HydrophobicContact CG-CG 4.34Å
880	L	78.4	Confident	69.6	Low	3 Å²	3	56.4 Å²	56.4	2%	0.016	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-74.9	-15.7	171.7	-58.2	-177.2	0	0	0	112.5	V861 A864 H865 L877 T878 G882 P986 N989	V861-L880 HydrophobicContact CG1-CB 4.25Å; A864-L880 HydrophobicContact CB-CD1 4.19Å; A864-L880 HydrophobicContact CB-CD2 4.29Å; H865-L880 HydrophobicContact CB-CD1 3.98Å; L877-L880 HydrophobicContact CB-CD1 4.23Å; L877-L880 HydrophobicContact CD2-CD1 4.24Å; L877-L880 WeakPolarHBondContact O-CB 3.33Å; L877-L880 PolarHBondContact O-N 3.17Å; T878-L880 PolarHBondContact O-N 3.06Å; L880-G882 PolarHBondContact O-N 3.1Å; L880-P986 HydrophobicContact CD1-CG 4.47Å; L880-P986 HydrophobicContact CD2-CB 3.72Å; L880-P986 HydrophobicContact CD2-CG 3.82Å; L880-P986 HydrophobicContact CG-CB 4.1Å; L880-P986 HydrophobicContact CG-CG 3.77Å; L880-N989 HydrophobicContact CD2-CB 4.49Å
881	L	64.6	Low	67.5	Low	80 Å²	80	61.1 Å²	61.1	42%	0.419	34%	0.343	S	S	.	.			trans	-77.9	46.3	176.3	-55.7	176.8	0	0	0	111.8	T878 I883 L913	T878-L881 HydrophobicContact CG2-CD1 4.35Å; T878-L881 VanDerWaalsContact O-CB 3.28Å; T878-L881 WeakPolarHBondContact O-CB 3.38Å; T878-L881 PolarHBondContact O-N 3.1Å; L881-I883 HydrophobicContact CD2-CD1 3.9Å; L881-I883 HydrophobicContact CD2-CG1 4.45Å; L881-I883 PolarHBondContact O-N 3.05Å; L881-L913 HydrophobicContact CD2-CD1 4.16Å; L881-L913 HydrophobicContact CD2-CD2 3.91Å
882	G	56.5	Low	65.6	Low	70 Å²	70	71.1 Å²	71.1	72%	0.722	38%	0.381	S	S	*	.			trans	-70.6	25.2	158.9	0	0	0	0	0	112.8	L880 D884	L880-G882 PolarHBondContact O-N 3.1Å; G882-D884 PolarHBondContact O-N 3.24Å
883	I	55.5	Low	63.4	Low	19 Å²	19	77 Å²	77	10%	0.097	41%	0.412	C	S	.	.			trans	-62	118.3	170	-55.8	178.7	0	0	0	106.1	L858 L881 E885 V887 L888	L858-I883 HydrophobicContact CD1-CD1 4.2Å; L858-I883 HydrophobicContact CD2-CD1 4.01Å; L858-I883 HydrophobicContact CD2-CG1 3.84Å; L858-I883 HydrophobicContact CD2-CG2 4.37Å; L881-I883 HydrophobicContact CD2-CD1 3.9Å; L881-I883 HydrophobicContact CD2-CG1 4.45Å; L881-I883 PolarHBondContact O-N 3.05Å; I883-E885 PolarHBondContact O-N 3.11Å; I883-V887 HydrophobicContact CG2-CB 3.87Å; I883-V887 HydrophobicContact CG2-CG1 3.95Å; I883-L888 HydrophobicContact CB-CD1 4.36Å; I883-L888 HydrophobicContact CB-CG 4.47Å; I883-L888 HydrophobicContact CG2-CD1 4.33Å; I883-L888 HydrophobicContact CG2-CD2 4.37Å; I883-L888 HydrophobicContact CG2-CG 3.9Å
884	D	52.7	Low	61.4	Low	85 Å²	85	82.2 Å²	82.2	46%	0.455	44%	0.435	S	S	.	.			trans	-48.4	129.1	179.5	-174.5	-20.4	0	0	0	108.9	G882 Q886 V887 L888	G882-D884 PolarHBondContact O-N 3.24Å; D884-Q886 PolarHBondContact O-N 2.96Å; D884-Q886 WeakPolarHBondContact OD1-CB 3.36Å; D884-Q886 VanDerWaalsContact OD1-CG 3.28Å; D884-Q886 WeakPolarHBondContact OD1-CG 3.44Å; D884-Q886 PolarHBondContact OD1-N 3.48Å; D884-Q886 PolarHBondContact OD1-NE2 3.33Å; D884-Q886 PolarHBondContact OD2-NE2 3.45Å; D884-V887 HydrophobicContact CB-CG2 4.35Å; D884-V887 WeakPolarHBondContact O-CB 3.32Å; D884-V887 PolarHBondContact O-N 3.37Å; D884-L888 PolarHBondContact O-N 3.02Å
885	E	52.5	Low	59.5	Low	125 Å²	125	91.2 Å²	91.2	58%	0.584	47%	0.474	S	S	*	.	H	α-helix	trans	-55.3	-24.1	-178.6	-143	-157.6	150	0	0	110.8	I883 K889	I883-E885 PolarHBondContact O-N 3.11Å; E885-K889 HydrophobicContact CG-CD 4.49Å; E885-K889 WeakPolarHBondContact O-CB 3.49Å; E885-K889 VanDerWaalsContact O-CD 3.31Å; E885-K889 WeakPolarHBondContact O-CD 3.42Å; E885-K889 WeakPolarHBondContact O-CG 3.41Å; E885-K889 PolarHBondContact O-N 2.65Å; E885-K889 WeakPolarHBondContact OE1-CE 3.4Å; E885-K889 IonicContact OE1-NZ 2.93Å; E885-K889 PolarHBondContact OE1-NZ 2.79Å; E885-K889 IonicContact OE2-NZ 2.63Å; E885-K889 PolarHBondContact OE2-NZ 3.48Å
886	Q	51.7	Low	57.9	Low	125 Å²	125	95.1 Å²	95.1	58%	0.584	49%	0.49	S	S	*	.	H	α-helix	trans	-61.5	-43.7	170.3	-63.7	-178.4	88.2	0	0	113.7	D884 K889 L890	D884-Q886 PolarHBondContact O-N 2.96Å; D884-Q886 WeakPolarHBondContact OD1-CB 3.36Å; D884-Q886 VanDerWaalsContact OD1-CG 3.28Å; D884-Q886 WeakPolarHBondContact OD1-CG 3.44Å; D884-Q886 PolarHBondContact OD1-N 3.48Å; D884-Q886 PolarHBondContact OD1-NE2 3.33Å; D884-Q886 PolarHBondContact OD2-NE2 3.45Å; Q886-K889 CarbonylContact O-C 3.58Å; Q886-K889 PolarHBondContact O-N 2.85Å; Q886-K889 VanDerWaalsContact O-N 3.17Å; Q886-L890 WeakPolarHBondContact O-CB 3.43Å; Q886-L890 VanDerWaalsContact O-CG 3.27Å; Q886-L890 WeakPolarHBondContact O-CG 3.45Å; Q886-L890 PolarHBondContact O-N 2.91Å
887	V	56.1	Low	55.9	Low	40 Å²	40	101 Å²	101	24%	0.242	51%	0.512	C	S	.	.	H	α-helix	trans	-63.1	-46.2	177.5	175.2	0	0	0	0	110.1	M857 I883 D884 K889 L890 N891	M857-V887 HydrophobicContact CE-CG2 4.3Å; I883-V887 HydrophobicContact CG2-CB 3.87Å; I883-V887 HydrophobicContact CG2-CG1 3.95Å; D884-V887 HydrophobicContact CB-CG2 4.35Å; D884-V887 WeakPolarHBondContact O-CB 3.32Å; D884-V887 PolarHBondContact O-N 3.37Å; V887-K889 VanDerWaalsContact C-N 3.3Å; V887-K889 PolarHBondContact O-N 2.88Å; V887-L890 PolarHBondContact O-N 3.08Å; V887-N891 PolarHBondContact O-N 2.95Å
888	L	54.6	Low	53.9	Low	69 Å²	69	109.9 Å²	109.9	36%	0.361	55%	0.55	S	S	.	*	H	α-helix	trans	-67.7	-27.4	174.8	-66.2	173.2	0	0	0	113	I883 D884 R892	I883-L888 HydrophobicContact CB-CD1 4.36Å; I883-L888 HydrophobicContact CB-CG 4.47Å; I883-L888 HydrophobicContact CG2-CD1 4.33Å; I883-L888 HydrophobicContact CG2-CD2 4.37Å; I883-L888 HydrophobicContact CG2-CG 3.9Å; D884-L888 PolarHBondContact O-N 3.02Å; L888-R892 WeakPolarHBondContact O-CB 3.47Å; L888-R892 WeakPolarHBondContact O-CD 3.26Å; L888-R892 VanDerWaalsContact O-CG 3.3Å; L888-R892 WeakPolarHBondContact O-CG 3.43Å; L888-R892 PolarHBondContact O-N 3.04Å
889	K	52.9	Low	52.2	Low	88 Å²	88	115.3 Å²	115.3	38%	0.383	57%	0.566	S	S	.	*	H	α-helix	trans	-77.7	-36	174.7	-80.3	165.4	-176.5	166.1	0	113.2	E885 Q886 V887 N891 R892 N893	E885-K889 HydrophobicContact CG-CD 4.49Å; E885-K889 WeakPolarHBondContact O-CB 3.49Å; E885-K889 VanDerWaalsContact O-CD 3.31Å; E885-K889 WeakPolarHBondContact O-CD 3.42Å; E885-K889 WeakPolarHBondContact O-CG 3.41Å; E885-K889 PolarHBondContact O-N 2.65Å; E885-K889 WeakPolarHBondContact OE1-CE 3.4Å; E885-K889 IonicContact OE1-NZ 2.93Å; E885-K889 PolarHBondContact OE1-NZ 2.79Å; E885-K889 IonicContact OE2-NZ 2.63Å; E885-K889 PolarHBondContact OE2-NZ 3.48Å; Q886-K889 CarbonylContact O-C 3.58Å; Q886-K889 PolarHBondContact O-N 2.85Å; Q886-K889 VanDerWaalsContact O-N 3.17Å; V887-K889 VanDerWaalsContact C-N 3.3Å; V887-K889 PolarHBondContact O-N 2.88Å; K889-N891 VanDerWaalsContact C-N 3.34Å; K889-N891 PolarHBondContact O-N 3.46Å; K889-R892 CarbonylContact O-C 3.5Å; K889-R892 PolarHBondContact O-N 3.01Å; K889-R892 VanDerWaalsContact O-N 3.11Å; K889-N893 WeakPolarHBondContact O-CB 3.39Å; K889-N893 VanDerWaalsContact O-CG 3.27Å; K889-N893 PolarHBondContact O-N 3.25Å; K889-N893 PolarHBondContact O-ND2 2.96Å
890	L	52.1	Low	50.7	Low	126 Å²	126	117.5 Å²	117.5	66%	0.66	57%	0.573	S	S	*	*	H	α-helix	trans	-56.5	-50	176.1	-78.1	164	0	0	0	110	Q886 V887 R892 N893	Q886-L890 WeakPolarHBondContact O-CB 3.43Å; Q886-L890 VanDerWaalsContact O-CG 3.27Å; Q886-L890 WeakPolarHBondContact O-CG 3.45Å; Q886-L890 PolarHBondContact O-N 2.91Å; V887-L890 PolarHBondContact O-N 3.08Å; L890-R892 VanDerWaalsContact C-N 3.27Å; L890-R892 PolarHBondContact O-N 3.1Å; L890-N893 PolarHBondContact O-N 2.86Å
891	N	51.2	Low	48.6	Very low	102 Å²	102	126.7 Å²	126.7	55%	0.545	61%	0.612	S	S	.	*	H	α-helix	trans	-69.3	-23	178.2	-67.5	4.9	0	0	0	113.1	V887 K889	V887-N891 PolarHBondContact O-N 2.95Å; K889-N891 VanDerWaalsContact C-N 3.34Å; K889-N891 PolarHBondContact O-N 3.46Å
892	R	52.5	Low	47.3	Very low	209 Å²	209	130 Å²	130	79%	0.789	63%	0.631	S	S	*	*	H	α-helix	trans	-88.3	-14.1	177.7	-76.8	177.8	165.6	-178.9	-2.7	115.1	L888 K889 L890 K894	L888-R892 WeakPolarHBondContact O-CB 3.47Å; L888-R892 WeakPolarHBondContact O-CD 3.26Å; L888-R892 VanDerWaalsContact O-CG 3.3Å; L888-R892 WeakPolarHBondContact O-CG 3.43Å; L888-R892 PolarHBondContact O-N 3.04Å; K889-R892 CarbonylContact O-C 3.5Å; K889-R892 PolarHBondContact O-N 3.01Å; K889-R892 VanDerWaalsContact O-N 3.11Å; L890-R892 VanDerWaalsContact C-N 3.27Å; L890-R892 PolarHBondContact O-N 3.1Å; R892-K894 PolarHBondContact O-N 2.91Å
893	N	43.3	Very low	46.4	Very low	123 Å²	123	131.2 Å²	131.2	66%	0.658	62%	0.62	S	S	*	*			trans	-80.7	27.5	-170.4	-89	-25.7	0	0	0	116.3	K889 L890 K895	K889-N893 WeakPolarHBondContact O-CB 3.39Å; K889-N893 VanDerWaalsContact O-CG 3.27Å; K889-N893 PolarHBondContact O-N 3.25Å; K889-N893 PolarHBondContact O-ND2 2.96Å; L890-N893 PolarHBondContact O-N 2.86Å; N893-K895 PolarHBondContact O-N 2.9Å
894	K	42.4	Very low	45.2	Very low	112 Å²	112	141.6 Å²	141.6	49%	0.487	66%	0.658	S	S	.	*			trans	-89.6	53.2	172.7	-70.5	171.6	-177.3	165.2	0	112.6	R892 L903 E905	R892-K894 PolarHBondContact O-N 2.91Å; K894-L903 PolarHBondContact NZ-O 3.28Å; K894-E905 IonicContact NZ-OE2 2.98Å; K894-E905 PolarHBondContact NZ-OE2 3.22Å
895	K	46.8	Very low	44.9	Very low	191 Å²	191	142 Å²	142	83%	0.83	66%	0.657	S	S	*	*			trans	-76	-14.3	175.9	-98.9	-177.9	179.9	173.9	0	115	N893 K897	N893-K895 PolarHBondContact O-N 2.9Å; K895-K897 VanDerWaalsContact C-N 3.35Å; K895-K897 PolarHBondContact O-N 2.85Å
896	N	44.1	Very low	44.4	Very low	166 Å²	166	137.9 Å²	137.9	89%	0.888	64%	0.642	S	S	*	*			trans	-75.7	79.5	178.1	-81.4	-13.6	0	0	0	112.7	K898	N896-K898 PolarHBondContact O-N 2.81Å
897	K	38.2	Very low	44.3	Very low	198 Å²	198	137.9 Å²	137.9	86%	0.861	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.7	105.4	169.2	-69.7	178.7	176.2	178.4	0	111.2	K895	K895-K897 VanDerWaalsContact C-N 3.35Å; K895-K897 PolarHBondContact O-N 2.85Å
898	K	41.9	Very low	44.4	Very low	206 Å²	206	143.1 Å²	143.1	90%	0.896	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn		176.2	-16.5	129.3	-99.1	168.9	-179.1	-178.6	0	118.3	N896	N896-K898 PolarHBondContact O-N 2.81Å
899	K	38.2	Very low	44.5	Very low	207 Å²	207	144.8 Å²	144.8	90%	0.9	68%	0.681	S	S	*	*	S	Bend	trans	-127.7	-10.3	-169	-89.8	-166.3	173.3	-172.4	0	119.7
900	L	38.2	Very low	45.4	Very low	124 Å²	124	143.9 Å²	143.9	65%	0.649	68%	0.678	S	S	*	*			trans	-99.4	105.7	179.5	-160.8	71.3	0	0	0	110.7	L903	L900-L903 HydrophobicContact CD2-CB 4.13Å
901	K	34.8	Very low	46.7	Very low	196 Å²	196	140.1 Å²	140.1	85%	0.852	67%	0.666	S	S	*	*			trans	-107.5	-11.1	-176.9	-127.7	-172.1	-179.9	-167.8	0	114.8
902	N	37	Very low	48.3	Very low	150 Å²	150	135.7 Å²	135.7	80%	0.802	64%	0.642	S	S	*	*	S	Bend	trans	-117.1	3.8	-168.1	-63.8	29.4	0	0	0	114.6
903	L	37.3	Very low	49.8	Very low	94 Å²	94	128 Å²	128	49%	0.492	62%	0.616	S	S	.	*			trans	-121.1	79.3	168.4	-83	85.7	0	0	0	109.9	K894 L900	K894-L903 PolarHBondContact NZ-O 3.28Å; L900-L903 HydrophobicContact CD2-CB 4.13Å
904	R	31.2	Very low	51.8	Low	238 Å²	238	127.9 Å²	127.9	90%	0.898	62%	0.615	S	S	*	*			trans	-114.7	95.4	155.1	-98.7	-176.4	164	-173	-7.4	106.2
905	E	44.8	Very low	54	Low	93 Å²	93	125 Å²	125	44%	0.435	60%	0.603	S	S	.	*			trans	-47.2	137.5	151.3	-66	83.2	-159.9	0	0	108.7	K894 E909	K894-E905 IonicContact NZ-OE2 2.98Å; K894-E905 PolarHBondContact NZ-OE2 3.22Å; E905-E909 WeakPolarHBondContact CA-OE1 3.45Å; E905-E909 VanDerWaalsContact CB-OE1 3.23Å; E905-E909 WeakPolarHBondContact CB-OE1 3.47Å; E905-E909 WeakPolarHBondContact CB-OE2 3.48Å
906	S	42.5	Very low	56.1	Low	39 Å²	39	119.1 Å²	119.1	27%	0.273	58%	0.583	S	S	.	*			trans	-95.1	165.1	-168.5	73.8	0	0	0	0	112.2	E908 E909	S906-E908 WeakPolarHBondContact CB-OE2 3.44Å; S906-E908 PolarHBondContact O-N 3.42Å; S906-E908 WeakPolarHBondContact OG-CB 3.46Å; S906-E908 PolarHBondContact OG-N 2.99Å; S906-E908 PolarHBondContact OG-OE2 3.41Å; S906-E909 PolarHBondContact N-OE1 3.46Å; S906-E909 PolarHBondContact O-N 2.94Å
907	P	50.4	Low	58.4	Low	125 Å²	125	112.8 Å²	112.8	81%	0.812	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-62.3	-7.3	170.6	-22.1	34.8	0	0	0	114.5
908	E	57.4	Low	61	Low	149 Å²	149	106.3 Å²	106.3	70%	0.696	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-78.2	-28.3	-176.3	-58.6	145	159.8	0	0	111.4	S906 M910 A911	S906-E908 WeakPolarHBondContact CB-OE2 3.44Å; S906-E908 PolarHBondContact O-N 3.42Å; S906-E908 WeakPolarHBondContact OG-CB 3.46Å; S906-E908 PolarHBondContact OG-N 2.99Å; S906-E908 PolarHBondContact OG-OE2 3.41Å; E908-M910 PolarHBondContact O-N 2.84Å; E908-M910 VanDerWaalsContact O-N 3.07Å; E908-A911 WeakPolarHBondContact O-CB 3.22Å; E908-A911 PolarHBondContact O-N 3.47Å
909	E	57.3	Low	63.5	Low	104 Å²	104	98.5 Å²	98.5	49%	0.486	50%	0.499	S	S	.	.	G	3₁₀ helix	trans	-65.4	-11.2	179.1	-66.9	168.4	-146	0	0	114.4	E905 S906	E905-E909 WeakPolarHBondContact CA-OE1 3.45Å; E905-E909 VanDerWaalsContact CB-OE1 3.23Å; E905-E909 WeakPolarHBondContact CB-OE1 3.47Å; E905-E909 WeakPolarHBondContact CB-OE2 3.48Å; S906-E909 PolarHBondContact N-OE1 3.46Å; S906-E909 PolarHBondContact O-N 2.94Å
910	M	71.7	Confident	66.2	Low	69 Å²	69	88.8 Å²	88.8	34%	0.34	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-122.2	23.1	171.2	-67.4	-173.5	-178.7	0	0	112	E908 W912 L913 N914	E908-M910 PolarHBondContact O-N 2.84Å; E908-M910 VanDerWaalsContact O-N 3.07Å; M910-W912 PolarHBondContact O-N 3.17Å; M910-L913 HydrophobicContact CB-CD1 4.34Å; M910-L913 PolarHBondContact O-N 3.1Å; M910-L913 VanDerWaalsContact O-N 3.08Å; M910-L913 HydrophobicContact SD-CD1 4.26Å; M910-N914 PolarHBondContact O-ND2 3.49Å
911	A	79.1	Confident	69	Low	48 Å²	48	83.5 Å²	83.5	40%	0.397	43%	0.429	S	S	.	.	G	3₁₀ helix	trans	-54.5	-38.9	179.4	0	0	0	0	0	112.2	E908 L913 N914	E908-A911 WeakPolarHBondContact O-CB 3.22Å; E908-A911 PolarHBondContact O-N 3.47Å; A911-L913 PolarHBondContact O-N 2.87Å; A911-N914 WeakPolarHBondContact O-CB 3.27Å; A911-N914 PolarHBondContact O-N 3.04Å; A911-N914 PolarHBondContact O-ND2 3.39Å
912	W	85.5	Confident	71.9	Confident	9 Å²	9	77.6 Å²	77.6	3%	0.034	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-58.6	-24.2	178.1	64.3	-96	0	0	0	114.8	Y850 D853 V854 L858 V861 H865 M910 N914 E915	Y850-W912 HydrophobicContact CD2-CB 3.95Å; Y850-W912 HydrophobicContact CE2-CB 3.71Å; Y850-W912 HydrophobicContact CE2-CE3 4.49Å; D853-W912 VanDerWaalsContact O-CD1 3.29Å; V854-W912 HydrophobicContact CG1-CZ2 4.2Å; V854-W912 HydrophobicContact CG2-CB 4.46Å; V854-W912 HydrophobicContact CG2-CD2 3.75Å; V854-W912 HydrophobicContact CG2-CE3 4.15Å; V854-W912 HydrophobicContact CG2-CG 3.89Å; V854-W912 HydrophobicContact CG2-CZ2 4.46Å; L858-W912 HydrophobicContact CB-CH2 4.23Å; L858-W912 HydrophobicContact CB-CZ2 4.02Å; L858-W912 HydrophobicContact CD1-CH2 4.43Å; L858-W912 HydrophobicContact CD1-CZ2 3.87Å; V861-W912 HydrophobicContact CG1-CH2 4.24Å; H865-W912 HydrophobicContact CB-CZ3 4.48Å; H865-W912 PolarHBondContact CE1-O 2.93Å; H865-W912 VanDerWaalsContact CE1-O 3.25Å; M910-W912 PolarHBondContact O-N 3.17Å; W912-N914 PolarHBondContact O-N 2.82Å; W912-E915 VanDerWaalsContact O-CB 3.28Å; W912-E915 WeakPolarHBondContact O-CB 3.46Å; W912-E915 PolarHBondContact O-N 2.88Å
913	L	83.6	Confident	74.8	Confident	47 Å²	47	73.9 Å²	73.9	25%	0.246	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-74.8	-9.4	173.9	-79.6	176.1	0	0	0	113.7	L881 M910 A911	L881-L913 HydrophobicContact CD2-CD1 4.16Å; L881-L913 HydrophobicContact CD2-CD2 3.91Å; M910-L913 HydrophobicContact CB-CD1 4.34Å; M910-L913 PolarHBondContact O-N 3.1Å; M910-L913 VanDerWaalsContact O-N 3.08Å; M910-L913 HydrophobicContact SD-CD1 4.26Å; A911-L913 PolarHBondContact O-N 2.87Å
914	N	85	Confident	77.6	Confident	120 Å²	120	69.4 Å²	69.4	64%	0.642	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-90.4	-4.5	172.3	-51.2	-82.9	0	0	0	112	M910 A911 W912 T916	M910-N914 PolarHBondContact O-ND2 3.49Å; A911-N914 WeakPolarHBondContact O-CB 3.27Å; A911-N914 PolarHBondContact O-N 3.04Å; A911-N914 PolarHBondContact O-ND2 3.39Å; W912-N914 PolarHBondContact O-N 2.82Å; N914-T916 PolarHBondContact O-N 3.04Å
915	E	88	Confident	80.8	Confident	52 Å²	52	59.8 Å²	59.8	24%	0.243	33%	0.333	C	S	.	.			trans	-75	105	-176.6	-168.5	56.4	-96	0	0	110.8	Y850 H865 C869 W912 S919 L920	Y850-E915 HydrophobicContact CE2-CB 4.21Å; Y850-E915 HydrophobicContact CE2-CG 4.47Å; H865-E915 PolarHBondContact CE1-O 3.04Å; C869-E915 PolarHBondContact SG-O 3.16Å; W912-E915 VanDerWaalsContact O-CB 3.28Å; W912-E915 WeakPolarHBondContact O-CB 3.46Å; W912-E915 PolarHBondContact O-N 2.88Å; E915-S919 WeakPolarHBondContact OE1-CB 3.49Å; E915-S919 PolarHBondContact OE1-OG 3.22Å; E915-L920 HydrophobicContact CG-CB 4.14Å; E915-L920 HydrophobicContact CG-CD1 4.42Å; E915-L920 PolarHBondContact OE1-N 3.48Å
916	T	91.8	Very high	83.3	Confident	67 Å²	67	59.4 Å²	59.4	41%	0.411	33%	0.33	S	S	.	.			trans	-92	163.8	-179.5	69.9	0	0	0	0	111.7	N914 S918 S919 L920	N914-T916 PolarHBondContact O-N 3.04Å; T916-S918 PolarHBondContact O-N 3.09Å; T916-S918 PolarHBondContact OG1-N 3.46Å; T916-S919 PolarHBondContact N-OG 3.44Å; T916-S919 PolarHBondContact O-N 3.15Å; T916-S919 PolarHBondContact O-OG 3.48Å; T916-S919 VanDerWaalsContact O-OG 3.13Å; T916-S919 PolarHBondContact OG1-N 3.24Å; T916-S919 VanDerWaalsContact OG1-N 3.12Å; T916-S919 PolarHBondContact OG1-OG 2.86Å; T916-L920 VanDerWaalsContact O-CB 3.24Å; T916-L920 WeakPolarHBondContact O-CB 3.07Å; T916-L920 PolarHBondContact O-N 3.14Å
917	H	91.7	Very high	85.8	Confident	33 Å²	33	57.8 Å²	57.8	15%	0.153	32%	0.318	C	S	.	.	H	α-helix	trans	-55.2	-36.6	171.4	74.2	-89.9	0	0	0	112.6	C869 A873 W921	C869-H917 WeakPolarHBondContact O-CA 3.07Å; C869-H917 WeakPolarHBondContact O-CB 3.46Å; A873-H917 HydrophobicContact CB-CB 4.17Å; H917-W921 WeakPolarHBondContact O-CB 3.39Å; H917-W921 PolarHBondContact O-N 2.82Å
918	S	93.6	Very high	88	Confident	62 Å²	62	51.9 Å²	51.9	43%	0.434	28%	0.279	S	S	.	.	H	α-helix	trans	-74.6	-38.7	-176.8	-36.3	0	0	0	0	112.5	T916 S922	T916-S918 PolarHBondContact O-N 3.09Å; T916-S918 PolarHBondContact OG1-N 3.46Å; S918-S922 WeakPolarHBondContact O-CB 3.31Å; S918-S922 PolarHBondContact O-N 2.85Å; S918-S922 VanDerWaalsContact O-N 3.12Å; S918-S922 PolarHBondContact O-OG 2.96Å
919	S	94.8	Very high	89.8	Confident	42 Å²	42	50.2 Å²	50.2	29%	0.294	27%	0.27	S	S	.	.	H	α-helix	trans	-73.2	-43.7	175.3	48.3	0	0	0	0	111.5	E915 T916 W921 S922 E923	E915-S919 WeakPolarHBondContact OE1-CB 3.49Å; E915-S919 PolarHBondContact OE1-OG 3.22Å; T916-S919 PolarHBondContact N-OG 3.44Å; T916-S919 PolarHBondContact O-N 3.15Å; T916-S919 PolarHBondContact O-OG 3.48Å; T916-S919 VanDerWaalsContact O-OG 3.13Å; T916-S919 PolarHBondContact OG1-N 3.24Å; T916-S919 VanDerWaalsContact OG1-N 3.12Å; T916-S919 PolarHBondContact OG1-OG 2.86Å; S919-W921 PolarHBondContact O-N 3.4Å; S919-S922 WeakPolarHBondContact O-CB 3.37Å; S919-S922 PolarHBondContact O-N 3.34Å; S919-S922 VanDerWaalsContact O-N 3.13Å; S919-E923 PolarHBondContact O-N 3.26Å
920	L	95	Very high	91.5	Very high	4 Å²	4	49.1 Å²	49.1	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-60.7	-44.6	176.2	-177.1	60.4	0	0	0	111.2	L846 F866 C869 F870 E915 T916 S922 E923 M924	L846-L920 HydrophobicContact CB-CD1 4.47Å; L846-L920 HydrophobicContact CD1-CD1 3.94Å; F866-L920 HydrophobicContact CD2-CD2 4.25Å; F866-L920 HydrophobicContact CE1-CD2 4.45Å; F866-L920 HydrophobicContact CE2-CD1 3.71Å; F866-L920 HydrophobicContact CE2-CD2 4.02Å; F866-L920 HydrophobicContact CZ-CD1 4.01Å; F866-L920 HydrophobicContact CZ-CD2 4.13Å; C869-L920 HydrophobicContact CB-CD2 3.73Å; F870-L920 HydrophobicContact CB-CD2 3.99Å; E915-L920 HydrophobicContact CG-CB 4.14Å; E915-L920 HydrophobicContact CG-CD1 4.42Å; E915-L920 PolarHBondContact OE1-N 3.48Å; T916-L920 VanDerWaalsContact O-CB 3.24Å; T916-L920 WeakPolarHBondContact O-CB 3.07Å; T916-L920 PolarHBondContact O-N 3.14Å; L920-S922 VanDerWaalsContact C-N 3.33Å; L920-S922 PolarHBondContact O-N 2.97Å; L920-E923 PolarHBondContact O-N 3.02Å; L920-M924 HydrophobicContact CD1-CG 4.46Å; L920-M924 HydrophobicContact CD1-SD 4.47Å; L920-M924 HydrophobicContact CG-SD 4.16Å; L920-M924 WeakPolarHBondContact O-CB 3.27Å; L920-M924 VanDerWaalsContact O-CG 3.22Å; L920-M924 WeakPolarHBondContact O-CG 3.49Å; L920-M924 PolarHBondContact O-N 3.04Å
921	W	96.2	Very high	92.5	Very high	12 Å²	12	47.9 Å²	47.9	5%	0.045	26%	0.256	C	S	.	.	H	α-helix	trans	-63.6	-38.3	175.4	-165.3	-102.4	0	0	0	112.5	L839 F870 H917 S919 M924 I925 I936 A938 S939 D940 I941 F944	L839-W921 HydrophobicContact CD1-CH2 3.56Å; L839-W921 HydrophobicContact CD1-CZ2 4.29Å; L839-W921 HydrophobicContact CD1-CZ3 3.77Å; L839-W921 HydrophobicContact CD2-CH2 4.15Å; L839-W921 HydrophobicContact CD2-CZ3 4.33Å; F870-W921 HydrophobicContact CE2-CZ3 4.48Å; H917-W921 WeakPolarHBondContact O-CB 3.39Å; H917-W921 PolarHBondContact O-N 2.82Å; S919-W921 PolarHBondContact O-N 3.4Å; W921-M924 HydrophobicContact CZ3-CE 4.42Å; W921-M924 PolarHBondContact O-N 3.34Å; W921-I925 WeakPolarHBondContact O-CG1 3.06Å; W921-I925 PolarHBondContact O-N 2.69Å; W921-I936 HydrophobicContact CZ2-CG2 4.5Å; W921-A938 HydrophobicContact CZ2-CB 4.38Å; W921-A938 PolarHBondContact NE1-O 2.86Å; W921-S939 PolarHBondContact NE1-O 2.93Å; W921-D940 VanDerWaalsContact CZ2-O 3.32Å; W921-D940 WeakPolarHBondContact CZ2-O 3.07Å; W921-I941 HydrophobicContact CE3-CB 4.27Å; W921-I941 HydrophobicContact CH2-CB 4.21Å; W921-I941 HydrophobicContact CH2-CD1 4.17Å; W921-I941 HydrophobicContact CZ3-CB 3.8Å; W921-I941 HydrophobicContact CZ3-CD1 3.97Å; W921-I941 HydrophobicContact CZ3-CG1 4.45Å; W921-F944 HydrophobicContact CH2-CB 3.58Å; W921-F944 AromaticContact CH2-CD2 3.93Å; W921-F944 HydrophobicContact CH2-CD2 3.93Å; W921-F944 AromaticContact CH2-CG 3.84Å; W921-F944 HydrophobicContact CH2-CG 3.84Å; W921-F944 HydrophobicContact CZ2-CB 3.77Å; W921-F944 HydrophobicContact CZ2-CD2 4.12Å; W921-F944 HydrophobicContact CZ2-CG 4.25Å
922	S	97	Very high	93.2	Very high	72 Å²	72	45.7 Å²	45.7	50%	0.503	24%	0.238	S	C	.	.	H	α-helix	trans	-64.4	-45.6	176.3	-61.1	0	0	0	0	112.2	S918 S919 L920 I925 K926	S918-S922 WeakPolarHBondContact O-CB 3.31Å; S918-S922 PolarHBondContact O-N 2.85Å; S918-S922 VanDerWaalsContact O-N 3.12Å; S918-S922 PolarHBondContact O-OG 2.96Å; S919-S922 WeakPolarHBondContact O-CB 3.37Å; S919-S922 PolarHBondContact O-N 3.34Å; S919-S922 VanDerWaalsContact O-N 3.13Å; L920-S922 VanDerWaalsContact C-N 3.33Å; L920-S922 PolarHBondContact O-N 2.97Å; S922-I925 PolarHBondContact O-N 3.38Å; S922-K926 WeakPolarHBondContact O-CB 3.37Å; S922-K926 PolarHBondContact O-N 2.9Å
923	E	96.6	Very high	93.6	Very high	72 Å²	72	47 Å²	47	34%	0.336	24%	0.244	S	C	.	.	H	α-helix	trans	-68.7	-32.5	175.3	-74.4	-67	132.1	0	0	111.8	L846 S919 L920 K926 E927	L846-E923 HydrophobicContact CD1-CB 3.85Å; L846-E923 HydrophobicContact CD2-CB 4.48Å; S919-E923 PolarHBondContact O-N 3.26Å; L920-E923 PolarHBondContact O-N 3.02Å; E923-K926 PolarHBondContact O-N 3.01Å; E923-K926 WeakPolarHBondContact OE1-CD 3.1Å; E923-K926 IonicContact OE1-NZ 3.54Å; E923-K926 PolarHBondContact OE1-NZ 3.33Å; E923-K926 IonicContact OE2-NZ 3.15Å; E923-K926 PolarHBondContact OE2-NZ 2.94Å; E923-E927 VanDerWaalsContact O-CB 3.25Å; E923-E927 WeakPolarHBondContact O-CB 3.5Å; E923-E927 PolarHBondContact O-N 3.49Å
924	M	97.1	Very high	94.2	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-67	-39.7	172.4	-76.2	179.6	53.3	0	0	113.1	L839 A843 L846 F870 L920 W921 K926 A928	L839-M924 HydrophobicContact CD1-CE 3.45Å; L839-M924 VanDerWaalsContact CD1-CE 3.45Å; L839-M924 HydrophobicContact CG-CE 3.7Å; A843-M924 HydrophobicContact CB-CE 3.73Å; A843-M924 HydrophobicContact CB-SD 3.95Å; L846-M924 HydrophobicContact CD1-CB 4.41Å; L846-M924 HydrophobicContact CD1-CG 3.57Å; F870-M924 HydrophobicContact CD2-CE 3.89Å; F870-M924 HydrophobicContact CD2-SD 3.91Å; F870-M924 HydrophobicContact CE2-CE 3.61Å; F870-M924 HydrophobicContact CE2-SD 4.25Å; F870-M924 HydrophobicContact CZ-CE 4.32Å; L920-M924 HydrophobicContact CD1-CG 4.46Å; L920-M924 HydrophobicContact CD1-SD 4.47Å; L920-M924 HydrophobicContact CG-SD 4.16Å; L920-M924 WeakPolarHBondContact O-CB 3.27Å; L920-M924 VanDerWaalsContact O-CG 3.22Å; L920-M924 WeakPolarHBondContact O-CG 3.49Å; L920-M924 PolarHBondContact O-N 3.04Å; W921-M924 HydrophobicContact CZ3-CE 4.42Å; W921-M924 PolarHBondContact O-N 3.34Å; M924-K926 VanDerWaalsContact C-N 3.32Å; M924-A928 WeakPolarHBondContact O-CB 3.33Å; M924-A928 PolarHBondContact O-N 2.93Å
925	I	97.5	Very high	94.7	Very high	36 Å²	36	44.4 Å²	44.4	19%	0.185	23%	0.226	C	C	.	.	H	α-helix	trans	-63.5	-41.6	172.9	-72.2	169.5	0	0	0	110.5	W921 S922 A928 K929 I936	W921-I925 WeakPolarHBondContact O-CG1 3.06Å; W921-I925 PolarHBondContact O-N 2.69Å; S922-I925 PolarHBondContact O-N 3.38Å; I925-A928 PolarHBondContact O-N 3.01Å; I925-K929 WeakPolarHBondContact O-CB 3.26Å; I925-K929 PolarHBondContact O-N 3.06Å; I925-I936 HydrophobicContact CG1-CB 4.32Å
926	K	96.7	Very high	95	Very high	84 Å²	84	42 Å²	42	37%	0.365	22%	0.215	S	C	.	.	H	α-helix	trans	-65.3	-45	177.4	174	-177.8	157.5	-143.5	0	111.7	S922 E923 M924 A928 K929 E930	S922-K926 WeakPolarHBondContact O-CB 3.37Å; S922-K926 PolarHBondContact O-N 2.9Å; E923-K926 PolarHBondContact O-N 3.01Å; E923-K926 WeakPolarHBondContact OE1-CD 3.1Å; E923-K926 IonicContact OE1-NZ 3.54Å; E923-K926 PolarHBondContact OE1-NZ 3.33Å; E923-K926 IonicContact OE2-NZ 3.15Å; E923-K926 PolarHBondContact OE2-NZ 2.94Å; M924-K926 VanDerWaalsContact C-N 3.32Å; K926-A928 PolarHBondContact O-N 3.45Å; K926-K929 PolarHBondContact O-N 2.95Å; K926-K929 VanDerWaalsContact O-N 3.17Å; K926-E930 WeakPolarHBondContact CE-OE1 3.2Å; K926-E930 HydrophobicContact CG-CG 4.32Å; K926-E930 WeakPolarHBondContact CG-OE1 3.41Å; K926-E930 WeakPolarHBondContact O-CB 3.2Å; K926-E930 WeakPolarHBondContact O-CG 3.47Å; K926-E930 PolarHBondContact O-N 3.05Å
927	E	95.4	Very high	95.2	Very high	6 Å²	6	44.1 Å²	44.1	3%	0.028	23%	0.228	C	C	.	.	H	α-helix	trans	-57.6	-46.8	173	-177.4	66	-148.7	0	0	111.6	R593 H845 E923 K929 E930 Y931	R593-E927 IonicContact CZ-OE1 3.03Å; R593-E927 IonicContact CZ-OE2 3.76Å; R593-E927 IonicContact NH1-OE1 2.66Å; R593-E927 PolarHBondContact NH1-OE1 3.17Å; R593-E927 IonicContact NH1-OE2 2.75Å; R593-E927 PolarHBondContact NH1-OE2 3.07Å; R593-E927 IonicContact NH2-OE1 3.95Å; R593-E927 IonicContact NH2-OE2 3.55Å; R593-E927 PolarHBondContact NH2-OE2 3.32Å; H845-E927 HydrophobicContact CB-CG 4.2Å; H845-E927 IonicContact CE1-OE1 2.64Å; H845-E927 IonicContact CG-OE1 2.96Å; H845-E927 IonicContact ND1-OE1 3.04Å; H845-E927 PolarHBondContact ND1-OE1 3.27Å; E923-E927 VanDerWaalsContact O-CB 3.25Å; E923-E927 WeakPolarHBondContact O-CB 3.5Å; E923-E927 PolarHBondContact O-N 3.49Å; E927-K929 VanDerWaalsContact C-N 3.28Å; E927-K929 PolarHBondContact O-N 3.27Å; E927-E930 PolarHBondContact O-N 3.4Å; E927-Y931 WeakPolarHBondContact O-CB 3.42Å; E927-Y931 PolarHBondContact O-N 2.96Å
928	A	96.9	Very high	95.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.8	-38.6	175.3	0	0	0	0	0	112.6	V838 S842 M924 I925 K926 Y932 H933 Y934 I936	V838-A928 HydrophobicContact CG1-CB 3.63Å; S842-A928 PolarHBondContact OG-N 3.32Å; M924-A928 WeakPolarHBondContact O-CB 3.33Å; M924-A928 PolarHBondContact O-N 2.93Å; I925-A928 PolarHBondContact O-N 3.01Å; K926-A928 PolarHBondContact O-N 3.45Å; A928-Y932 CarbonylContact O-C 3.57Å; A928-Y932 WeakPolarHBondContact O-CA 3.41Å; A928-Y932 WeakPolarHBondContact O-CB 3.41Å; A928-Y932 PolarHBondContact O-N 3.37Å; A928-Y932 VanDerWaalsContact O-N 3.16Å; A928-H933 PolarHBondContact O-N 2.96Å; A928-H933 VanDerWaalsContact O-N 3.11Å; A928-Y934 CarbonylContact C-O 3.54Å; A928-Y934 PolarHBondContact O-N 3.24Å; A928-I936 HydrophobicContact CB-CD1 3.87Å; A928-I936 HydrophobicContact CB-CG1 4.18Å
929	K	95.7	Very high	95.3	Very high	115 Å²	115	43.7 Å²	43.7	50%	0.5	23%	0.229	S	C	.	.	H	α-helix	trans	-76.8	-39.2	179.3	-173.2	-179.9	-168.7	154.2	0	113.7	I925 K926 E927 H933 Y934	I925-K929 WeakPolarHBondContact O-CB 3.26Å; I925-K929 PolarHBondContact O-N 3.06Å; K926-K929 PolarHBondContact O-N 2.95Å; K926-K929 VanDerWaalsContact O-N 3.17Å; E927-K929 VanDerWaalsContact C-N 3.28Å; E927-K929 PolarHBondContact O-N 3.27Å; K929-H933 VanDerWaalsContact O-CA 3.26Å; K929-H933 WeakPolarHBondContact O-CA 3.49Å; K929-H933 PolarHBondContact O-N 2.85Å; K929-H933 PolarHBondContact O-ND1 2.78Å; K929-Y934 PolarHBondContact N-O 3.48Å
930	E	92.3	Very high	95.1	Very high	80 Å²	80	44 Å²	44	37%	0.374	23%	0.227	S	C	.	.	H	α-helix	trans	-79.8	-37.6	-177.7	-73.5	177.9	-168.1	0	0	112.7	R593 K926 E927 H933	R593-E930 IonicContact CZ-OE2 3.11Å; R593-E930 IonicContact NE-OE2 3.8Å; R593-E930 PolarHBondContact NE-OE2 3.23Å; R593-E930 IonicContact NH2-OE2 3.68Å; R593-E930 PolarHBondContact NH2-OE2 2.83Å; K926-E930 WeakPolarHBondContact CE-OE1 3.2Å; K926-E930 HydrophobicContact CG-CG 4.32Å; K926-E930 WeakPolarHBondContact CG-OE1 3.41Å; K926-E930 WeakPolarHBondContact O-CB 3.2Å; K926-E930 WeakPolarHBondContact O-CG 3.47Å; K926-E930 PolarHBondContact O-N 3.05Å; E927-E930 PolarHBondContact O-N 3.4Å; E930-H933 PolarHBondContact O-CE1 2.79Å
931	Y	92.1	Very high	95	Very high	43 Å²	43	44 Å²	44	17%	0.169	23%	0.227	C	C	.	.	H	α-helix	trans	-95.5	-40.8	-176.3	-167.4	-74.9	0	0	0	113.3	H592 E927	H592-Y931 AromaticContact CE1-CD2 3.87Å; H592-Y931 AromaticContact CE1-CE1 3.96Å; H592-Y931 AromaticContact CE1-CE2 3.68Å; H592-Y931 AromaticContact CE1-CZ 3.72Å; H592-Y931 AromaticContact NE2-CE2 3.84Å; H592-Y931 AromaticContact NE2-CZ 3.86Å; E927-Y931 WeakPolarHBondContact O-CB 3.42Å; E927-Y931 PolarHBondContact O-N 2.96Å
932	Y	94.7	Very high	94.7	Very high	2 Å²	2	45.4 Å²	45.4	1%	0.008	24%	0.235	C	C	.	.	S	Bend	trans	-107	-7	-175.7	-60.8	-75.6	0	0	0	113.8	V811 L814 N815 V838 R841 A928 Y934	V811-Y932 HydrophobicContact CG1-CE1 4.01Å; L814-Y932 HydrophobicContact CB-CD1 4.38Å; L814-Y932 HydrophobicContact CD1-CD1 4.2Å; L814-Y932 HydrophobicContact CD1-CE1 4.18Å; N815-Y932 WeakPolarHBondContact CB-O 3.5Å; V838-Y932 HydrophobicContact CG1-CD2 3.97Å; V838-Y932 HydrophobicContact CG1-CG 4.17Å; V838-Y932 HydrophobicContact CG2-CG 4.19Å; R841-Y932 HydrophobicContact CB-CE2 4.01Å; R841-Y932 VanDerWaalsContact CB-OH 3.3Å; R841-Y932 WeakPolarHBondContact CB-OH 3.45Å; R841-Y932 WeakPolarHBondContact CD-OH 3.44Å; A928-Y932 CarbonylContact O-C 3.57Å; A928-Y932 WeakPolarHBondContact O-CA 3.41Å; A928-Y932 WeakPolarHBondContact O-CB 3.41Å; A928-Y932 PolarHBondContact O-N 3.37Å; A928-Y932 VanDerWaalsContact O-N 3.16Å; Y932-Y934 PolarHBondContact O-N 3.47Å; Y932-Y934 VanDerWaalsContact O-N 3.15Å
933	H	94.8	Very high	94.4	Very high	37 Å²	37	45.8 Å²	45.8	17%	0.171	23%	0.229	C	C	.	.			trans	57.9	22.9	-176.4	-45.3	-52.9	0	0	0	113.9	Y568 Y590 Q591 A928 K929 E930	Y568-H933 AromaticContact CE1-CD2 3.72Å; Y568-H933 AromaticContact CE1-NE2 3.52Å; Y590-H933 WeakPolarHBondContact CB-NE2 3.29Å; Y590-H933 HydrophobicContact CD1-CB 4.24Å; Y590-H933 AromaticContact CD1-CD2 3.96Å; Y590-H933 AromaticContact CD1-CG 3.81Å; Y590-H933 AromaticContact CD2-CD2 3.62Å; Y590-H933 HydrophobicContact CE1-CB 4.13Å; Y590-H933 HydrophobicContact CE2-CB 4.49Å; Y590-H933 HydrophobicContact CG-CB 4.49Å; Y590-H933 AromaticContact CG-CD2 3.46Å; Y590-H933 VanDerWaalsContact CG-CD2 3.46Å; Y590-H933 AromaticContact CG-CG 3.8Å; Y590-H933 AromaticContact CG-NE2 3.87Å; Q591-H933 PolarHBondContact O-CE1 2.5Å; A928-H933 PolarHBondContact O-N 2.96Å; A928-H933 VanDerWaalsContact O-N 3.11Å; K929-H933 VanDerWaalsContact O-CA 3.26Å; K929-H933 WeakPolarHBondContact O-CA 3.49Å; K929-H933 PolarHBondContact O-N 2.85Å; K929-H933 PolarHBondContact O-ND1 2.78Å; E930-H933 PolarHBondContact O-CE1 2.79Å
934	Y	95.6	Very high	94.3	Very high	30 Å²	30	42.4 Å²	42.4	12%	0.118	21%	0.213	C	C	.	.			trans	-104.5	122.5	177.2	-174.6	-109.1	0	0	0	111.1	N815 I818 I835 V838 A928 K929 Y932 I936 Y948	N815-Y934 WeakPolarHBondContact OD1-CD2 3.42Å; I818-Y934 HydrophobicContact CD1-CD2 4.21Å; I818-Y934 HydrophobicContact CD1-CE2 4.49Å; I818-Y934 HydrophobicContact CD1-CG 4.27Å; I818-Y934 HydrophobicContact CG2-CD2 4.18Å; I818-Y934 HydrophobicContact CG2-CE2 3.67Å; I835-Y934 HydrophobicContact CD1-CE1 4.46Å; I835-Y934 WeakPolarHBondContact CD1-OH 3.45Å; I835-Y934 HydrophobicContact CG1-CE1 4Å; I835-Y934 HydrophobicContact CG2-CE1 3.93Å; V838-Y934 HydrophobicContact CG1-CD1 4.22Å; A928-Y934 CarbonylContact C-O 3.54Å; A928-Y934 PolarHBondContact O-N 3.24Å; K929-Y934 PolarHBondContact N-O 3.48Å; Y932-Y934 PolarHBondContact O-N 3.47Å; Y932-Y934 VanDerWaalsContact O-N 3.15Å; Y934-I936 HydrophobicContact CD1-CG1 3.76Å; Y934-I936 HydrophobicContact CE1-CG1 3.83Å; Y934-I936 PolarHBondContact O-N 2.94Å; Y934-Y948 PolarHBondContact OH-OH 2.88Å
935	Q	95.3	Very high	94.1	Very high	83 Å²	83	43.1 Å²	43.1	39%	0.388	22%	0.219	S	C	.	.			trans	-87.1	98.3	173.9	-177.2	64.7	73.9	0	0	109.6	T937	Q935-T937 PolarHBondContact O-N 3.39Å
936	I	95.2	Very high	93.7	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.01	25%	0.246	C	C	.	.			trans	-60.8	132.5	164.1	-60.3	175.7	0	0	0	107.7	L839 W921 I925 A928 Y934 A938 F944	L839-I936 HydrophobicContact CB-CD1 4.26Å; L839-I936 HydrophobicContact CD1-CD1 3.69Å; W921-I936 HydrophobicContact CZ2-CG2 4.5Å; I925-I936 HydrophobicContact CG1-CB 4.32Å; A928-I936 HydrophobicContact CB-CD1 3.87Å; A928-I936 HydrophobicContact CB-CG1 4.18Å; Y934-I936 HydrophobicContact CD1-CG1 3.76Å; Y934-I936 HydrophobicContact CE1-CG1 3.83Å; Y934-I936 PolarHBondContact O-N 2.94Å; I936-A938 HydrophobicContact CG2-CB 4.45Å; I936-F944 HydrophobicContact CG2-CD2 4.04Å; I936-F944 HydrophobicContact CG2-CE2 4.32Å
937	T	94.6	Very high	93.5	Very high	110 Å²	110	49.2 Å²	49.2	68%	0.675	25%	0.253	S	S	*	.			trans	-103.5	-15.9	-174.1	50.2	0	0	0	0	114.3	Q935	Q935-T937 PolarHBondContact O-N 3.39Å
938	A	94.7	Very high	93.3	Very high	2 Å²	2	50 Å²	50	2%	0.017	26%	0.255	C	S	.	.			trans	-70.5	134	177.3	0	0	0	0	0	111.4	W921 I936 E943 F944	W921-A938 HydrophobicContact CZ2-CB 4.38Å; W921-A938 PolarHBondContact NE1-O 2.86Å; I936-A938 HydrophobicContact CG2-CB 4.45Å; A938-E943 HydrophobicContact CB-CB 4.06Å; A938-E943 HydrophobicContact CB-CG 3.94Å; A938-F944 HydrophobicContact CB-CB 3.88Å; A938-F944 HydrophobicContact CB-CD2 4.47Å
939	S	92.6	Very high	92.9	Very high	85 Å²	85	56.6 Å²	56.6	59%	0.594	29%	0.287	S	S	*	.	S	Bend	trans	-77.5	-22.7	-177.3	58.8	0	0	0	0	114.3	W921 E943	W921-S939 PolarHBondContact NE1-O 2.93Å; S939-E943 WeakPolarHBondContact CB-OE2 3.32Å; S939-E943 PolarHBondContact N-OE2 2.9Å; S939-E943 PolarHBondContact OG-OE2 2.88Å
940	D	91.6	Very high	92.6	Very high	49 Å²	49	51.7 Å²	51.7	26%	0.262	27%	0.266	S	S	.	.	S	Bend	trans	-151	-179.1	171.6	64.2	36.9	0	0	0	111.9	W921 D942 E943 F944	W921-D940 VanDerWaalsContact CZ2-O 3.32Å; W921-D940 WeakPolarHBondContact CZ2-O 3.07Å; D940-D942 VanDerWaalsContact C-N 3.34Å; D940-D942 PolarHBondContact O-N 3.45Å; D940-D942 WeakPolarHBondContact OD1-CA 3.23Å; D940-D942 WeakPolarHBondContact OD1-CB 3.48Å; D940-D942 PolarHBondContact OD1-N 2.9Å; D940-E943 PolarHBondContact OD1-N 3.43Å; D940-F944 WeakPolarHBondContact O-CB 3.45Å; D940-F944 PolarHBondContact O-N 3.34Å
941	I	92	Very high	92.4	Very high	4 Å²	4	49.4 Å²	49.4	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-67.3	-27.6	179.1	-179.5	61.8	0	0	0	113.5	A873 W921 F944 C945 L955	A873-I941 HydrophobicContact CB-CG2 4.04Å; W921-I941 HydrophobicContact CE3-CB 4.27Å; W921-I941 HydrophobicContact CH2-CB 4.21Å; W921-I941 HydrophobicContact CH2-CD1 4.17Å; W921-I941 HydrophobicContact CZ3-CB 3.8Å; W921-I941 HydrophobicContact CZ3-CD1 3.97Å; W921-I941 HydrophobicContact CZ3-CG1 4.45Å; I941-F944 PolarHBondContact O-N 3.08Å; I941-C945 WeakPolarHBondContact O-CB 3.48Å; I941-C945 PolarHBondContact O-N 2.69Å; I941-L955 HydrophobicContact CD1-CD1 3.82Å
942	D	89.5	Confident	92.5	Very high	40 Å²	40	47.8 Å²	47.8	21%	0.214	25%	0.249	C	C	.	.	H	α-helix	trans	-73.9	-43.5	176.5	-79.7	-81.8	0	0	0	110.9	D940 F944 K946 R952 L976	D940-D942 VanDerWaalsContact C-N 3.34Å; D940-D942 PolarHBondContact O-N 3.45Å; D940-D942 WeakPolarHBondContact OD1-CA 3.23Å; D940-D942 WeakPolarHBondContact OD1-CB 3.48Å; D940-D942 PolarHBondContact OD1-N 2.9Å; D942-F944 VanDerWaalsContact C-N 3.33Å; D942-K946 WeakPolarHBondContact O-CB 3.36Å; D942-K946 PolarHBondContact O-N 3.47Å; D942-R952 IonicContact OD1-CZ 3.72Å; D942-R952 IonicContact OD1-NH1 2.78Å; D942-R952 PolarHBondContact OD1-NH1 2.89Å; D942-R952 IonicContact OD1-NH2 3.93Å; D942-R952 PolarHBondContact OD1-NH2 2.76Å; D942-R952 IonicContact OD2-CZ 3.92Å; D942-R952 IonicContact OD2-NH1 3.06Å; D942-R952 IonicContact OD2-NH2 2.86Å; D942-R952 PolarHBondContact OD2-NH2 2.7Å; D942-L976 VanDerWaalsContact OD1-CD1 3.24Å; D942-L976 WeakPolarHBondContact OD1-CD1 3.42Å; D942-L976 WeakPolarHBondContact OD2-CD1 3.45Å
943	E	92.1	Very high	92.4	Very high	81 Å²	81	47.8 Å²	47.8	38%	0.379	25%	0.249	S	C	.	.	H	α-helix	trans	-63.3	-38.7	170.1	-173.1	168.5	-141.8	0	0	111.2	A938 S939 D940 K946 S947	A938-E943 HydrophobicContact CB-CB 4.06Å; A938-E943 HydrophobicContact CB-CG 3.94Å; S939-E943 WeakPolarHBondContact CB-OE2 3.32Å; S939-E943 PolarHBondContact N-OE2 2.9Å; S939-E943 PolarHBondContact OG-OE2 2.88Å; D940-E943 PolarHBondContact OD1-N 3.43Å; E943-K946 PolarHBondContact O-N 3.01Å; E943-S947 WeakPolarHBondContact O-CB 3.21Å; E943-S947 PolarHBondContact O-N 3.19Å; E943-S947 PolarHBondContact O-OG 2.74Å
944	F	94.4	Very high	92.3	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.5	-55.5	176	-175.9	-81.1	0	0	0	112.1	I835 L839 W921 I936 A938 D940 I941 D942 K946 S947 Y948 L955	I835-F944 HydrophobicContact CG2-CE2 3.82Å; I835-F944 HydrophobicContact CG2-CZ 3.91Å; L839-F944 HydrophobicContact CB-CE2 4.17Å; L839-F944 HydrophobicContact CB-CZ 4.06Å; L839-F944 HydrophobicContact CD1-CD2 4.31Å; L839-F944 HydrophobicContact CD1-CE2 4.16Å; L839-F944 HydrophobicContact CD2-CD1 3.95Å; L839-F944 HydrophobicContact CD2-CD2 4.2Å; L839-F944 HydrophobicContact CD2-CE1 3.67Å; L839-F944 HydrophobicContact CD2-CE2 3.92Å; L839-F944 HydrophobicContact CD2-CG 4.23Å; L839-F944 HydrophobicContact CD2-CZ 3.66Å; L839-F944 HydrophobicContact CG-CE2 4.31Å; L839-F944 HydrophobicContact CG-CZ 4.33Å; W921-F944 HydrophobicContact CH2-CB 3.58Å; W921-F944 AromaticContact CH2-CD2 3.93Å; W921-F944 HydrophobicContact CH2-CD2 3.93Å; W921-F944 AromaticContact CH2-CG 3.84Å; W921-F944 HydrophobicContact CH2-CG 3.84Å; W921-F944 HydrophobicContact CZ2-CB 3.77Å; W921-F944 HydrophobicContact CZ2-CD2 4.12Å; W921-F944 HydrophobicContact CZ2-CG 4.25Å; I936-F944 HydrophobicContact CG2-CD2 4.04Å; I936-F944 HydrophobicContact CG2-CE2 4.32Å; A938-F944 HydrophobicContact CB-CB 3.88Å; A938-F944 HydrophobicContact CB-CD2 4.47Å; D940-F944 WeakPolarHBondContact O-CB 3.45Å; D940-F944 PolarHBondContact O-N 3.34Å; I941-F944 PolarHBondContact O-N 3.08Å; D942-F944 VanDerWaalsContact C-N 3.33Å; F944-K946 PolarHBondContact O-N 3.04Å; F944-S947 PolarHBondContact O-N 3.17Å; F944-Y948 HydrophobicContact CD1-CD2 4.07Å; F944-Y948 AromaticContact CD2-CD2 3.58Å; F944-Y948 HydrophobicContact CD2-CD2 3.58Å; F944-Y948 AromaticContact CD2-CE2 3.5Å; F944-Y948 HydrophobicContact CD2-CE2 3.5Å; F944-Y948 VanDerWaalsContact CD2-CE2 3.5Å; F944-Y948 HydrophobicContact CE1-CD2 4.03Å; F944-Y948 AromaticContact CE2-CD2 3.55Å; F944-Y948 HydrophobicContact CE2-CD2 3.55Å; F944-Y948 AromaticContact CE2-CE2 3.51Å; F944-Y948 HydrophobicContact CE2-CE2 3.51Å; F944-Y948 AromaticContact CG-CD2 3.84Å; F944-Y948 HydrophobicContact CG-CD2 3.84Å; F944-Y948 HydrophobicContact CG-CE2 4.16Å; F944-Y948 AromaticContact CZ-CD2 3.77Å; F944-Y948 HydrophobicContact CZ-CD2 3.77Å; F944-Y948 HydrophobicContact CZ-CE2 4.18Å; F944-Y948 WeakPolarHBondContact O-CD2 3.4Å; F944-Y948 PolarHBondContact O-N 3.3Å; F944-L955 HydrophobicContact CD1-CD1 4.48Å; F944-L955 HydrophobicContact CE1-CD1 4.43Å
945	C	92	Very high	92.3	Very high	17 Å²	17	45.5 Å²	45.5	12%	0.115	24%	0.24	C	C	.	.	H	α-helix	trans	-58.4	-35.8	179.8	-81.7	0	0	0	0	111.9	I941 E949 V950	I941-C945 WeakPolarHBondContact O-CB 3.48Å; I941-C945 PolarHBondContact O-N 2.69Å; C945-E949 CarbonylContact O-C 3.59Å; C945-E949 VanDerWaalsContact O-CA 3.24Å; C945-E949 WeakPolarHBondContact O-CA 3.47Å; C945-E949 PolarHBondContact O-N 3.49Å; C945-V950 VanDerWaalsContact CB-O 3.26Å; C945-V950 WeakPolarHBondContact CB-O 3.46Å; C945-V950 PolarHBondContact O-N 2.93Å; C945-V950 PolarHBondContact SG-O 3.09Å
946	K	90.1	Very high	92.3	Very high	175 Å²	175	41.5 Å²	41.5	76%	0.761	22%	0.221	S	C	*	.	H	α-helix	trans	-74.1	-45.7	176.6	-174.8	-178.5	178.1	-174.9	0	113.5	D942 E943 F944	D942-K946 WeakPolarHBondContact O-CB 3.36Å; D942-K946 PolarHBondContact O-N 3.47Å; E943-K946 PolarHBondContact O-N 3.01Å; F944-K946 PolarHBondContact O-N 3.04Å
947	S	92	Very high	92.3	Very high	72 Å²	72	42 Å²	42	50%	0.503	22%	0.223	S	C	.	.	H	α-helix	trans	-74	-25.6	-174.8	-68.8	0	0	0	0	113.7	E943 F944	E943-S947 WeakPolarHBondContact O-CB 3.21Å; E943-S947 PolarHBondContact O-N 3.19Å; E943-S947 PolarHBondContact O-OG 2.74Å; F944-S947 PolarHBondContact O-N 3.17Å
948	Y	90.7	Very high	92.4	Very high	22 Å²	22	37.8 Å²	37.8	9%	0.086	20%	0.197	C	C	.	.	H	α-helix	trans	-106.9	-2.1	175.5	-57.3	-67.4	0	0	0	113.2	K832 I835 Y934 F944	K832-Y948 WeakPolarHBondContact CD-O 3.43Å; K832-Y948 WeakPolarHBondContact CE-O 3.19Å; K832-Y948 VanDerWaalsContact CG-O 3.24Å; K832-Y948 WeakPolarHBondContact CG-O 3.5Å; I835-Y948 HydrophobicContact CD1-CD1 4Å; I835-Y948 HydrophobicContact CD1-CE1 3.57Å; I835-Y948 HydrophobicContact CG2-CD1 4.36Å; I835-Y948 HydrophobicContact CG2-CD2 4.29Å; I835-Y948 HydrophobicContact CG2-CE1 4.06Å; I835-Y948 HydrophobicContact CG2-CE2 4Å; I835-Y948 HydrophobicContact CG2-CG 4.46Å; Y934-Y948 PolarHBondContact OH-OH 2.88Å; F944-Y948 HydrophobicContact CD1-CD2 4.07Å; F944-Y948 AromaticContact CD2-CD2 3.58Å; F944-Y948 HydrophobicContact CD2-CD2 3.58Å; F944-Y948 AromaticContact CD2-CE2 3.5Å; F944-Y948 HydrophobicContact CD2-CE2 3.5Å; F944-Y948 VanDerWaalsContact CD2-CE2 3.5Å; F944-Y948 HydrophobicContact CE1-CD2 4.03Å; F944-Y948 AromaticContact CE2-CD2 3.55Å; F944-Y948 HydrophobicContact CE2-CD2 3.55Å; F944-Y948 AromaticContact CE2-CE2 3.51Å; F944-Y948 HydrophobicContact CE2-CE2 3.51Å; F944-Y948 AromaticContact CG-CD2 3.84Å; F944-Y948 HydrophobicContact CG-CD2 3.84Å; F944-Y948 HydrophobicContact CG-CE2 4.16Å; F944-Y948 AromaticContact CZ-CD2 3.77Å; F944-Y948 HydrophobicContact CZ-CD2 3.77Å; F944-Y948 HydrophobicContact CZ-CE2 4.18Å; F944-Y948 WeakPolarHBondContact O-CD2 3.4Å; F944-Y948 PolarHBondContact O-N 3.3Å
949	E	89	Confident	92.5	Very high	140 Å²	140	37.7 Å²	37.7	65%	0.654	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	54	54.4	-178.7	-53.6	168.8	156.6	0	0	111.9	K832 C945	K832-E949 WeakPolarHBondContact CE-OE2 3.42Å; K832-E949 IonicContact NZ-OE2 3.94Å; K832-E949 PolarHBondContact NZ-OE2 2.95Å; C945-E949 CarbonylContact O-C 3.59Å; C945-E949 VanDerWaalsContact O-CA 3.24Å; C945-E949 WeakPolarHBondContact O-CA 3.47Å; C945-E949 PolarHBondContact O-N 3.49Å
950	V	89.6	Confident	92.7	Very high	12 Å²	12	33.6 Å²	33.6	7%	0.073	17%	0.168	C	C	.	.			trans	-120.6	131.8	-174.5	172.2	0	0	0	0	109.4	K832 C836 C945 L955	K832-V950 HydrophobicContact CB-CG2 4.5Å; C836-V950 VanDerWaalsContact SG-CG2 3.53Å; C945-V950 VanDerWaalsContact CB-O 3.26Å; C945-V950 WeakPolarHBondContact CB-O 3.46Å; C945-V950 PolarHBondContact O-N 2.93Å; C945-V950 PolarHBondContact SG-O 3.09Å; V950-L955 HydrophobicContact CG1-CD1 4.23Å; V950-L955 HydrophobicContact CG1-CD2 3.97Å; V950-L955 HydrophobicContact CG1-CG 3.89Å
951	Q	89	Confident	92.9	Very high	32 Å²	32	33.5 Å²	33.5	15%	0.15	17%	0.169	C	C	.	.			trans	-80.5	139.9	179.1	-62.8	-170.4	-17.6	0	0	112	G184 I953 Q954 L955	G184-Q951 PolarHBondContact O-NE2 3.28Å; Q951-I953 HydrophobicContact CB-CG2 4Å; Q951-I953 PolarHBondContact O-N 3.15Å; Q951-I953 VanDerWaalsContact O-N 3.1Å; Q951-Q954 HydrophobicContact CB-CG 4.12Å; Q951-Q954 WeakPolarHBondContact O-CB 3.35Å; Q951-Q954 PolarHBondContact O-N 2.89Å; Q951-Q954 VanDerWaalsContact O-N 3.09Å; Q951-L955 PolarHBondContact O-N 3.42Å
952	R	92.3	Very high	93	Very high	8 Å²	8	34.8 Å²	34.8	3%	0.03	18%	0.178	C	C	.	.	H	α-helix	trans	-56	-27.8	174	-73	176.3	148	126	-7.2	113.5	L871 D942 L956 L974	L871-R952 PolarHBondContact O-NE 3.34Å; L871-R952 PolarHBondContact O-NH2 2.84Å; D942-R952 IonicContact OD1-CZ 3.72Å; D942-R952 IonicContact OD1-NH1 2.78Å; D942-R952 PolarHBondContact OD1-NH1 2.89Å; D942-R952 IonicContact OD1-NH2 3.93Å; D942-R952 PolarHBondContact OD1-NH2 2.76Å; D942-R952 IonicContact OD2-CZ 3.92Å; D942-R952 IonicContact OD2-NH1 3.06Å; D942-R952 IonicContact OD2-NH2 2.86Å; D942-R952 PolarHBondContact OD2-NH2 2.7Å; R952-L956 WeakPolarHBondContact O-CB 3.37Å; R952-L956 PolarHBondContact O-N 2.98Å; R952-L974 HydrophobicContact CB-CB 3.85Å; R952-L974 HydrophobicContact CB-CD1 3.86Å; R952-L974 HydrophobicContact CB-CG 4.48Å; R952-L974 VanDerWaalsContact CD-O 3.29Å; R952-L974 WeakPolarHBondContact CD-O 3.35Å
953	I	93	Very high	93.4	Very high	2 Å²	2	33.9 Å²	33.9	1%	0.01	17%	0.174	C	C	.	.	H	α-helix	trans	-71.7	-34.6	178.8	-158.6	68.1	0	0	0	113	L189 L191 Q951 L956 R957 L974 L1126	L189-I953 HydrophobicContact CB-CG2 4.39Å; L189-I953 HydrophobicContact CD1-CG2 4.25Å; L191-I953 HydrophobicContact CD1-CD1 4.03Å; L191-I953 HydrophobicContact CD2-CD1 3.91Å; L191-I953 HydrophobicContact CD2-CG1 4.09Å; L191-I953 HydrophobicContact CG-CD1 4.05Å; Q951-I953 HydrophobicContact CB-CG2 4Å; Q951-I953 PolarHBondContact O-N 3.15Å; Q951-I953 VanDerWaalsContact O-N 3.1Å; I953-L956 HydrophobicContact CD1-CD2 4.07Å; I953-L956 PolarHBondContact O-N 3.45Å; I953-R957 PolarHBondContact O-N 3.39Å; I953-L974 HydrophobicContact CB-CD1 4.26Å; I953-L974 HydrophobicContact CD1-CD1 3.77Å; I953-L1126 HydrophobicContact CG1-CD1 3.97Å; I953-L1126 HydrophobicContact CG2-CD1 4.11Å
954	Q	92.9	Very high	93.6	Very high	17 Å²	17	30 Å²	30	8%	0.079	16%	0.156	C	C	.	.	H	α-helix	trans	-66.4	-42.4	174.8	-63	163.2	-24.4	0	0	110.3	Q951 T958 L1125 L1126 G1129	Q951-Q954 HydrophobicContact CB-CG 4.12Å; Q951-Q954 WeakPolarHBondContact O-CB 3.35Å; Q951-Q954 PolarHBondContact O-N 2.89Å; Q951-Q954 VanDerWaalsContact O-N 3.09Å; Q954-T958 WeakPolarHBondContact O-CB 3.42Å; Q954-T958 PolarHBondContact O-N 3.45Å; Q954-T958 VanDerWaalsContact O-N 3.11Å; Q954-T958 PolarHBondContact O-OG1 2.8Å; Q954-L1125 PolarHBondContact NE2-O 3.34Å; Q954-L1126 WeakPolarHBondContact CG-O 3.33Å; Q954-G1129 VanDerWaalsContact NE2-CA 3.31Å; Q954-G1129 VanDerWaalsContact NE2-N 3.13Å
955	L	95.4	Very high	93.7	Very high	2 Å²	2	30 Å²	30	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-64.2	-42.3	173	-61.8	179.1	0	0	0	111.4	C836 L839 L840 L871 I941 F944 V950 Q951 F959	C836-L955 HydrophobicContact CB-CD2 4.21Å; L839-L955 HydrophobicContact CD2-CD1 4.29Å; L839-L955 HydrophobicContact CD2-CD2 4.48Å; L840-L955 HydrophobicContact CD1-CD2 3.94Å; L840-L955 HydrophobicContact CD2-CB 4.29Å; L840-L955 HydrophobicContact CD2-CD2 4.11Å; L840-L955 WeakPolarHBondContact CD2-O 3.46Å; L840-L955 HydrophobicContact CG-CD2 4.03Å; L871-L955 HydrophobicContact CD2-CB 3.91Å; I941-L955 HydrophobicContact CD1-CD1 3.82Å; F944-L955 HydrophobicContact CD1-CD1 4.48Å; F944-L955 HydrophobicContact CE1-CD1 4.43Å; V950-L955 HydrophobicContact CG1-CD1 4.23Å; V950-L955 HydrophobicContact CG1-CD2 3.97Å; V950-L955 HydrophobicContact CG1-CG 3.89Å; Q951-L955 PolarHBondContact O-N 3.42Å; L955-F959 WeakPolarHBondContact O-CB 3.5Å; L955-F959 PolarHBondContact O-N 2.92Å
956	L	95.9	Very high	93.9	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.2	-54.7	177.4	-177.5	65.1	0	0	0	112	W314 L867 L871 R952 I953 T958 F959 C960 L967 L974 F988	W314-L956 HydrophobicContact CH2-CD2 4.43Å; W314-L956 HydrophobicContact CZ3-CD2 3.98Å; W314-L956 HydrophobicContact CZ3-CG 3.94Å; L867-L956 HydrophobicContact CD2-CD1 4.2Å; L871-L956 HydrophobicContact CD1-CB 3.98Å; L871-L956 HydrophobicContact CD1-CD1 3.48Å; L871-L956 VanDerWaalsContact CD1-CD1 3.48Å; L871-L956 HydrophobicContact CD1-CG 4.33Å; R952-L956 WeakPolarHBondContact O-CB 3.37Å; R952-L956 PolarHBondContact O-N 2.98Å; I953-L956 HydrophobicContact CD1-CD2 4.07Å; I953-L956 PolarHBondContact O-N 3.45Å; L956-T958 VanDerWaalsContact C-N 3.34Å; L956-T958 PolarHBondContact O-N 3.35Å; L956-F959 PolarHBondContact O-N 3.42Å; L956-C960 WeakPolarHBondContact O-CB 3.25Å; L956-C960 PolarHBondContact O-N 3.14Å; L956-C960 PolarHBondContact O-SG 3.47Å; L956-L967 HydrophobicContact CD1-CD1 3.93Å; L956-L967 HydrophobicContact CD2-CD1 4.11Å; L956-L967 HydrophobicContact CG-CD1 4.3Å; L956-L974 HydrophobicContact CD2-CD1 4.26Å; L956-F988 HydrophobicContact CD1-CE1 3.9Å; L956-F988 HydrophobicContact CD1-CZ 3.67Å; L956-F988 HydrophobicContact CD2-CE1 3.9Å; L956-F988 HydrophobicContact CD2-CZ 3.95Å; L956-F988 HydrophobicContact CG-CZ 4.45Å
957	R	95.4	Very high	94.3	Very high	11 Å²	11	21.2 Å²	21.2	4%	0.042	12%	0.116	C	C	.	.	H	α-helix	trans	-51.7	-53.9	177.1	170.3	-177.7	171.8	-87.3	8.7	110.8	W314 D796 I953 F959 C960 T961 D1089	W314-R957 HydrophobicContact CH2-CB 4.05Å; W314-R957 HydrophobicContact CZ2-CB 3.62Å; W314-R957 HydrophobicContact CZ2-CG 3.98Å; D796-R957 IonicContact OD2-CZ 3.08Å; D796-R957 IonicContact OD2-NH1 2.64Å; D796-R957 PolarHBondContact OD2-NH1 3.2Å; D796-R957 IonicContact OD2-NH2 4Å; D796-R957 PolarHBondContact OD2-NH2 3.3Å; I953-R957 PolarHBondContact O-N 3.39Å; R957-F959 PolarHBondContact O-N 3.21Å; R957-C960 PolarHBondContact O-N 3.21Å; R957-T961 WeakPolarHBondContact O-CB 3.24Å; R957-T961 WeakPolarHBondContact O-CG2 3.33Å; R957-T961 PolarHBondContact O-N 3.5Å; R957-T961 PolarHBondContact O-OG1 3.38Å; R957-D1089 WeakPolarHBondContact CD-OD2 3.46Å; R957-D1089 IonicContact CZ-OD2 3.39Å; R957-D1089 IonicContact NE-OD2 3Å; R957-D1089 PolarHBondContact NE-OD2 3.05Å; R957-D1089 PolarHBondContact NH2-O 3.42Å
958	T	95.6	Very high	94.4	Very high	22 Å²	22	19.1 Å²	19.1	14%	0.135	10%	0.099	C	C	.	.	H	α-helix	trans	-70.6	-33.7	-173	-48.4	0	0	0	0	111.3	L840 Q954 L956 T961 S962	L840-T958 HydrophobicContact CD1-CG2 3.74Å; Q954-T958 WeakPolarHBondContact O-CB 3.42Å; Q954-T958 PolarHBondContact O-N 3.45Å; Q954-T958 VanDerWaalsContact O-N 3.11Å; Q954-T958 PolarHBondContact O-OG1 2.8Å; L956-T958 VanDerWaalsContact C-N 3.34Å; L956-T958 PolarHBondContact O-N 3.35Å; T958-T961 PolarHBondContact O-OG1 3.18Å; T958-S962 WeakPolarHBondContact O-CB 3.37Å; T958-S962 PolarHBondContact O-N 2.84Å; T958-S962 VanDerWaalsContact O-N 3.15Å; T958-S962 PolarHBondContact O-OG 2.94Å
959	F	97.3	Very high	94.6	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-64	-60	170.8	-174.3	-106.5	0	0	0	111.1	L840 A843 F847 F866 L867 F870 L955 L956 R957 T961 S962 V963 I965	L840-F959 HydrophobicContact CD2-CB 3.86Å; L840-F959 HydrophobicContact CD2-CD2 4.49Å; A843-F959 HydrophobicContact CB-CD2 4.05Å; A843-F959 HydrophobicContact CB-CE2 3.72Å; F847-F959 HydrophobicContact CB-CE2 4.39Å; F847-F959 HydrophobicContact CB-CZ 3.92Å; F847-F959 HydrophobicContact CD1-CZ 4.23Å; F847-F959 HydrophobicContact CD2-CE1 4.47Å; F847-F959 AromaticContact CD2-CZ 3.97Å; F847-F959 HydrophobicContact CD2-CZ 3.97Å; F847-F959 AromaticContact CG-CZ 3.78Å; F847-F959 HydrophobicContact CG-CZ 3.78Å; F866-F959 HydrophobicContact CD1-CE1 4.24Å; F866-F959 AromaticContact CD1-CZ 3.99Å; F866-F959 HydrophobicContact CD1-CZ 3.99Å; F866-F959 HydrophobicContact CE1-CE1 4.15Å; F866-F959 HydrophobicContact CE1-CE2 4.15Å; F866-F959 AromaticContact CE1-CZ 3.5Å; F866-F959 HydrophobicContact CE1-CZ 3.5Å; F866-F959 VanDerWaalsContact CE1-CZ 3.5Å; F866-F959 HydrophobicContact CZ-CZ 4.4Å; L867-F959 HydrophobicContact CD2-CD1 3.73Å; L867-F959 HydrophobicContact CD2-CE1 3.78Å; F870-F959 HydrophobicContact CD1-CD2 4.45Å; F870-F959 HydrophobicContact CD1-CG 4.44Å; F870-F959 HydrophobicContact CE1-CB 4.27Å; F870-F959 AromaticContact CE1-CD2 3.94Å; F870-F959 HydrophobicContact CE1-CD2 3.94Å; F870-F959 HydrophobicContact CE1-CE2 4.45Å; F870-F959 AromaticContact CE1-CG 3.99Å; F870-F959 HydrophobicContact CE1-CG 3.99Å; L955-F959 WeakPolarHBondContact O-CB 3.5Å; L955-F959 PolarHBondContact O-N 2.92Å; L956-F959 PolarHBondContact O-N 3.42Å; R957-F959 PolarHBondContact O-N 3.21Å; F959-T961 PolarHBondContact O-N 2.93Å; F959-S962 WeakPolarHBondContact O-CA 3.47Å; F959-S962 PolarHBondContact O-N 3.3Å; F959-S962 PolarHBondContact O-OG 2.9Å; F959-V963 HydrophobicContact CD1-CG2 4.12Å; F959-V963 HydrophobicContact CD2-CG1 4.47Å; F959-V963 HydrophobicContact CE1-CG2 3.81Å; F959-V963 HydrophobicContact CE2-CG1 4.01Å; F959-V963 HydrophobicContact CE2-CG2 4.45Å; F959-V963 HydrophobicContact CZ-CG1 4.17Å; F959-V963 HydrophobicContact CZ-CG2 3.99Å; F959-V963 WeakPolarHBondContact O-CG2 3.21Å; F959-V963 PolarHBondContact O-N 3.16Å; F959-I965 HydrophobicContact CD1-CD1 4.22Å; F959-I965 HydrophobicContact CE1-CD1 3.8Å
960	C	97.4	Very high	94.8	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-55.1	-47.7	-176.5	-73.6	0	0	0	0	112.7	W314 L956 R957 S962 V963 G964 I965	W314-C960 HydrophobicContact CB-CB 4.24Å; W314-C960 HydrophobicContact CE3-CB 4.03Å; L956-C960 WeakPolarHBondContact O-CB 3.25Å; L956-C960 PolarHBondContact O-N 3.14Å; L956-C960 PolarHBondContact O-SG 3.47Å; R957-C960 PolarHBondContact O-N 3.21Å; C960-S962 VanDerWaalsContact C-N 3.3Å; C960-S962 PolarHBondContact O-N 3.28Å; C960-V963 PolarHBondContact O-N 3.47Å; C960-G964 PolarHBondContact O-N 2.96Å; C960-I965 HydrophobicContact CB-CB 4.15Å; C960-I965 PolarHBondContact O-N 2.87Å
961	T	94.8	Very high	94.9	Very high	47 Å²	47	18.1 Å²	18.1	29%	0.288	9%	0.092	S	C	.	.	H	α-helix	trans	-64.6	-31.2	175.8	53.3	0	0	0	0	113.1	W314 R957 T958 F959 I999	W314-T961 HydrophobicContact CB-CG2 3.82Å; W314-T961 HydrophobicContact CG-CG2 3.8Å; R957-T961 WeakPolarHBondContact O-CB 3.24Å; R957-T961 WeakPolarHBondContact O-CG2 3.33Å; R957-T961 PolarHBondContact O-N 3.5Å; R957-T961 PolarHBondContact O-OG1 3.38Å; T958-T961 PolarHBondContact O-OG1 3.18Å; F959-T961 PolarHBondContact O-N 2.93Å; T961-I999 WeakPolarHBondContact O-CD1 3.06Å
962	S	94.9	Very high	95	Very high	31 Å²	31	16.9 Å²	16.9	22%	0.217	9%	0.086	C	C	.	.	H	α-helix	trans	-78.4	-26.3	177.7	80.7	0	0	0	0	114.2	K844 T958 F959 C960	K844-S962 WeakPolarHBondContact CE-O 3.24Å; K844-S962 PolarHBondContact NZ-O 3.04Å; T958-S962 WeakPolarHBondContact O-CB 3.37Å; T958-S962 PolarHBondContact O-N 2.84Å; T958-S962 VanDerWaalsContact O-N 3.15Å; T958-S962 PolarHBondContact O-OG 2.94Å; F959-S962 WeakPolarHBondContact O-CA 3.47Å; F959-S962 PolarHBondContact O-N 3.3Å; F959-S962 PolarHBondContact O-OG 2.9Å; C960-S962 VanDerWaalsContact C-N 3.3Å; C960-S962 PolarHBondContact O-N 3.28Å
963	V	96.6	Very high	94.8	Very high	20 Å²	20	22.6 Å²	22.6	12%	0.121	12%	0.117	C	C	.	.	H	α-helix	trans	-110.1	-5	-178.1	-60.2	0	0	0	0	114.8	K844 F847 F959 C960 I965	K844-V963 HydrophobicContact CB-CG1 3.84Å; K844-V963 HydrophobicContact CD-CG1 3.88Å; K844-V963 HydrophobicContact CG-CG1 3.71Å; F847-V963 HydrophobicContact CD1-CB 3.73Å; F847-V963 HydrophobicContact CD1-CG1 3.8Å; F847-V963 HydrophobicContact CD1-CG2 3.91Å; F847-V963 HydrophobicContact CE1-CB 3.74Å; F847-V963 HydrophobicContact CE1-CG1 4.34Å; F847-V963 HydrophobicContact CE1-CG2 3.66Å; F847-V963 HydrophobicContact CZ-CG2 4.34Å; F959-V963 HydrophobicContact CD1-CG2 4.12Å; F959-V963 HydrophobicContact CD2-CG1 4.47Å; F959-V963 HydrophobicContact CE1-CG2 3.81Å; F959-V963 HydrophobicContact CE2-CG1 4.01Å; F959-V963 HydrophobicContact CE2-CG2 4.45Å; F959-V963 HydrophobicContact CZ-CG1 4.17Å; F959-V963 HydrophobicContact CZ-CG2 3.99Å; F959-V963 WeakPolarHBondContact O-CG2 3.21Å; F959-V963 PolarHBondContact O-N 3.16Å; C960-V963 PolarHBondContact O-N 3.47Å; V963-I965 HydrophobicContact CG2-CD1 3.46Å; V963-I965 VanDerWaalsContact CG2-CD1 3.46Å; V963-I965 HydrophobicContact CG2-CG1 3.77Å
964	G	96.2	Very high	94.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.6	45	178.3	0	0	0	0	0	113.6	C960 L996 Y997	C960-G964 PolarHBondContact O-N 2.96Å; G964-L996 CarbonylContact O-C 3.57Å; G964-L996 WeakPolarHBondContact O-CA 3.45Å; G964-L996 WeakPolarHBondContact O-CD2 3.43Å; G964-Y997 WeakPolarHBondContact CA-O 3.3Å; G964-Y997 PolarHBondContact O-N 3.48Å
965	I	97.6	Very high	94.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	129.1	172	-63.6	159.7	0	0	0	109.4	F847 V863 L867 F959 C960 V963 L967 L996	F847-I965 HydrophobicContact CE1-CD1 4.26Å; F847-I965 HydrophobicContact CE2-CD1 4.32Å; F847-I965 HydrophobicContact CZ-CD1 3.75Å; F847-I965 HydrophobicContact CZ-CG1 4.16Å; V863-I965 HydrophobicContact CG1-CD1 3.8Å; V863-I965 HydrophobicContact CG1-CG1 4.01Å; V863-I965 HydrophobicContact CG1-CG2 4.15Å; L867-I965 HydrophobicContact CD2-CD1 4.38Å; F959-I965 HydrophobicContact CD1-CD1 4.22Å; F959-I965 HydrophobicContact CE1-CD1 3.8Å; C960-I965 HydrophobicContact CB-CB 4.15Å; C960-I965 PolarHBondContact O-N 2.87Å; V963-I965 HydrophobicContact CG2-CD1 3.46Å; V963-I965 VanDerWaalsContact CG2-CD1 3.46Å; V963-I965 HydrophobicContact CG2-CG1 3.77Å; I965-L967 HydrophobicContact CG2-CD2 3.7Å; I965-L967 HydrophobicContact CG2-CG 3.98Å; I965-L996 HydrophobicContact CB-CD2 4.29Å; I965-L996 HydrophobicContact CG1-CD2 3.66Å
966	Q	96.8	Very high	93.3	Very high	7 Å²	7	26.3 Å²	26.3	3%	0.033	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	122.8	167.4	-177.4	172.8	69.3	0	0	110.3	Y140 S313 W314 A316 I994 S995 Y997	Y140-Q966 PolarHBondContact O-NE2 3.05Å; S313-Q966 WeakPolarHBondContact O-CG 3.42Å; S313-Q966 PolarHBondContact O-NE2 3.23Å; W314-Q966 WeakPolarHBondContact O-CA 3.2Å; A316-Q966 HydrophobicContact CB-CG 4.07Å; Q966-I994 HydrophobicContact CG-CB 4.35Å; Q966-I994 HydrophobicContact CG-CG2 4.39Å; Q966-I994 PolarHBondContact O-N 3.33Å; Q966-S995 VanDerWaalsContact CB-OG 3.31Å; Q966-S995 WeakPolarHBondContact CB-OG 3.35Å; Q966-S995 PolarHBondContact N-O 3.16Å; Q966-S995 PolarHBondContact O-N 2.91Å; Q966-S995 PolarHBondContact OE1-OG 2.8Å; Q966-Y997 HydrophobicContact CB-CD1 4.16Å; Q966-Y997 HydrophobicContact CB-CE1 4.27Å
967	L	97.2	Very high	92	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	160	-179.8	-65	-178.9	0	0	0	112.4	W314 L315 A316 L867 L956 I965 L969 F988 D992 I993	W314-L967 PolarHBondContact O-N 2.93Å; L315-L967 CarbonylContact C-O 3.56Å; L315-L967 VanDerWaalsContact CA-O 3.31Å; L315-L967 WeakPolarHBondContact CA-O 3.45Å; L315-L967 HydrophobicContact CD2-CB 3.94Å; A316-L967 PolarHBondContact N-O 3.38Å; L867-L967 HydrophobicContact CD1-CD2 4.03Å; L956-L967 HydrophobicContact CD1-CD1 3.93Å; L956-L967 HydrophobicContact CD2-CD1 4.11Å; L956-L967 HydrophobicContact CG-CD1 4.3Å; I965-L967 HydrophobicContact CG2-CD2 3.7Å; I965-L967 HydrophobicContact CG2-CG 3.98Å; L967-L969 PolarHBondContact O-N 3.34Å; L967-F988 HydrophobicContact CD1-CD1 4.28Å; L967-F988 HydrophobicContact CD1-CE1 3.95Å; L967-D992 CarbonylContact C-O 3.59Å; L967-D992 VanDerWaalsContact CA-O 3.25Å; L967-D992 WeakPolarHBondContact CA-O 3.06Å; L967-I993 HydrophobicContact CD2-CD1 3.43Å; L967-I993 VanDerWaalsContact CD2-CD1 3.43Å
968	L	95.7	Very high	90.7	Very high	28 Å²	28	37.2 Å²	37.2	15%	0.147	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	127.8	168.4	176	59.3	0	0	0	110.7	A316 L318 R970 Y972 D992 I994	A316-L968 CarbonylContact O-C 3.57Å; L318-L968 HydrophobicContact CB-CD1 3.78Å; L968-R970 HydrophobicContact CD2-CG 4.41Å; L968-R970 HydrophobicContact CG-CG 4.24Å; L968-R970 PolarHBondContact O-N 3.03Å; L968-Y972 VanDerWaalsContact O-CE2 3.31Å; L968-Y972 WeakPolarHBondContact O-CE2 3.49Å; L968-Y972 PolarHBondContact O-OH 2.99Å; L968-D992 PolarHBondContact N-O 2.98Å; L968-I994 HydrophobicContact CB-CD1 4.13Å; L968-I994 HydrophobicContact CB-CG1 4.3Å; L968-I994 HydrophobicContact CD1-CD1 4.07Å
969	L	93.6	Very high	89.3	Confident	16 Å²	16	39.9 Å²	39.9	8%	0.084	23%	0.232	C	C	.	.	S	Bend	trans	-68.6	94.6	171.7	177.2	55.3	0	0	0	110.1	L191 L192 H195 L197 L315 A316 L967	L191-L969 HydrophobicContact CB-CD1 4.31Å; L192-L969 HydrophobicContact CD2-CD1 4.37Å; L192-L969 HydrophobicContact CD2-CG 4.22Å; H195-L969 HydrophobicContact CB-CD2 3.95Å; H195-L969 VanDerWaalsContact CD2-CD1 3.4Å; H195-L969 WeakPolarHBondContact CD2-CD1 3.48Å; H195-L969 WeakPolarHBondContact CD2-CD2 3.25Å; L197-L969 HydrophobicContact CD2-CD2 4.18Å; L315-L969 HydrophobicContact CB-CB 4.45Å; L315-L969 HydrophobicContact CB-CD1 4.45Å; L315-L969 HydrophobicContact CD1-CD1 4.41Å; A316-L969 WeakPolarHBondContact O-CB 3.34Å; A316-L969 PolarHBondContact O-N 3.39Å; L967-L969 PolarHBondContact O-N 3.34Å
970	R	92.5	Very high	88.2	Confident	68 Å²	68	42.6 Å²	42.6	26%	0.257	25%	0.248	S	C	.	.	S	Bend	trans	-154.1	172	170.3	64.9	169.2	-176.4	83	-7.5	109.5	L968 Y972 V987 D992	L968-R970 HydrophobicContact CD2-CG 4.41Å; L968-R970 HydrophobicContact CG-CG 4.24Å; L968-R970 PolarHBondContact O-N 3.03Å; R970-Y972 HydrophobicContact CG-CD2 4.37Å; R970-Y972 HydrophobicContact CG-CE1 4.45Å; R970-Y972 HydrophobicContact CG-CE2 3.79Å; R970-Y972 VanDerWaalsContact NH2-CE1 3.32Å; R970-Y972 WeakPolarHBondContact O-CD2 3.47Å; R970-Y972 VanDerWaalsContact O-CE2 3.23Å; R970-Y972 WeakPolarHBondContact O-CE2 3.35Å; R970-V987 PolarHBondContact NH2-O 2.98Å; R970-D992 IonicContact CZ-OD1 3.23Å; R970-D992 VanDerWaalsContact CZ-OD1 3.23Å; R970-D992 IonicContact CZ-OD2 3.75Å; R970-D992 IonicContact NE-OD1 2.68Å; R970-D992 PolarHBondContact NE-OD1 3.49Å; R970-D992 IonicContact NE-OD2 3.56Å; R970-D992 IonicContact NH2-OD1 3.67Å; R970-D992 PolarHBondContact NH2-OD1 3.22Å; R970-D992 IonicContact NH2-OD2 3.52Å; R970-D992 PolarHBondContact NH2-OD2 2.88Å
971	E	92.3	Very high	86.9	Confident	69 Å²	69	50.6 Å²	50.6	32%	0.322	28%	0.283	S	S	.	.			trans	-75.4	137.3	172.2	-57.2	-54.3	156.7	0	0	111.8	P190 L191 L192	P190-E971 VanDerWaalsContact CA-OE2 3.26Å; P190-E971 WeakPolarHBondContact CA-OE2 3.35Å; L191-E971 VanDerWaalsContact N-CD 3.29Å; L191-E971 PolarHBondContact N-OE1 3.21Å; L191-E971 PolarHBondContact N-OE2 2.94Å; L192-E971 HydrophobicContact CD1-CG 4.27Å; L192-E971 VanDerWaalsContact CG-OE1 3.31Å; L192-E971 WeakPolarHBondContact CG-OE1 3.3Å; L192-E971 PolarHBondContact N-OE1 3.37Å
972	Y	91.5	Very high	85.9	Confident	7 Å²	7	51.5 Å²	51.5	3%	0.027	28%	0.284	C	S	.	.			trans	-116.4	121.9	176.9	-65.2	-97.4	0	0	0	110.3	N188 L191 L968 R970 L974 V987 F988 D992	N188-Y972 PolarHBondContact ND2-O 3Å; L191-Y972 HydrophobicContact CD1-CD2 3.89Å; L191-Y972 HydrophobicContact CD1-CE2 4.26Å; L968-Y972 VanDerWaalsContact O-CE2 3.31Å; L968-Y972 WeakPolarHBondContact O-CE2 3.49Å; L968-Y972 PolarHBondContact O-OH 2.99Å; R970-Y972 HydrophobicContact CG-CD2 4.37Å; R970-Y972 HydrophobicContact CG-CE1 4.45Å; R970-Y972 HydrophobicContact CG-CE2 3.79Å; R970-Y972 VanDerWaalsContact NH2-CE1 3.32Å; R970-Y972 WeakPolarHBondContact O-CD2 3.47Å; R970-Y972 VanDerWaalsContact O-CE2 3.23Å; R970-Y972 WeakPolarHBondContact O-CE2 3.35Å; Y972-L974 PolarHBondContact O-N 2.79Å; Y972-V987 HydrophobicContact CD1-CG1 4.36Å; Y972-F988 AromaticContact CD1-CD1 3.62Å; Y972-F988 HydrophobicContact CD1-CD1 3.62Å; Y972-F988 AromaticContact CD1-CE1 3.6Å; Y972-F988 HydrophobicContact CD1-CE1 3.6Å; Y972-F988 AromaticContact CE1-CD1 3.51Å; Y972-F988 HydrophobicContact CE1-CD1 3.51Å; Y972-F988 AromaticContact CE1-CE1 3.82Å; Y972-F988 HydrophobicContact CE1-CE1 3.82Å; Y972-F988 HydrophobicContact CG-CE1 4.18Å; Y972-D992 HydrophobicContact CE1-CB 4.21Å
973	N	88.8	Confident	85.2	Confident	127 Å²	127	50.8 Å²	50.8	68%	0.679	28%	0.277	S	S	*	.			trans	-77.7	68.9	177.2	-68.5	-38.6	0	0	0	110.7	N975 H983	N973-N975 VanDerWaalsContact C-N 3.32Å; N973-N975 PolarHBondContact O-N 3.11Å; N973-H983 PolarHBondContact O-CE1 2.84Å; N973-H983 PolarHBondContact O-NE2 3.25Å
974	L	89.2	Confident	84.4	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.306	C	S	.	.			trans	-68.4	-30	-176.8	-54.1	177.4	0	0	0	112.6	N188 T872 R952 I953 L956 Y972 H983 V987 F988	N188-L974 PolarHBondContact ND2-N 3.42Å; T872-L974 HydrophobicContact CG2-CD2 4.34Å; R952-L974 HydrophobicContact CB-CB 3.85Å; R952-L974 HydrophobicContact CB-CD1 3.86Å; R952-L974 HydrophobicContact CB-CG 4.48Å; R952-L974 VanDerWaalsContact CD-O 3.29Å; R952-L974 WeakPolarHBondContact CD-O 3.35Å; I953-L974 HydrophobicContact CB-CD1 4.26Å; I953-L974 HydrophobicContact CD1-CD1 3.77Å; L956-L974 HydrophobicContact CD2-CD1 4.26Å; Y972-L974 PolarHBondContact O-N 2.79Å; L974-H983 PolarHBondContact O-NE2 3Å; L974-V987 HydrophobicContact CD2-CG1 4.24Å; L974-F988 HydrophobicContact CD2-CE1 4.33Å; L974-F988 HydrophobicContact CD2-CE2 4.01Å; L974-F988 HydrophobicContact CD2-CZ 3.52Å
975	N	82.2	Confident	83.9	Confident	60 Å²	60	64.9 Å²	64.9	32%	0.321	34%	0.339	S	S	.	.	S	Bend	trans	-82.3	144.3	-179.1	-66.9	-10.2	0	0	0	111.8	N186 N188 N973 H983	N186-N975 PolarHBondContact O-ND2 2.95Å; N188-N975 PolarHBondContact OD1-ND2 2.84Å; N188-N975 VanDerWaalsContact OD1-ND2 3.15Å; N188-N975 PolarHBondContact OD1-OD1 3.44Å; N973-N975 VanDerWaalsContact C-N 3.32Å; N973-N975 PolarHBondContact O-N 3.11Å; N975-H983 PolarHBondContact O-CE1 3.3Å; N975-H983 VanDerWaalsContact O-CE1 3.22Å
976	L	77.8	Confident	83.6	Confident	39 Å²	39	65.5 Å²	65.5	20%	0.204	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-69.8	124	-179.2	-70.1	170.1	0	0	0	111.4	D942 V980 K981 H983	D942-L976 VanDerWaalsContact OD1-CD1 3.24Å; D942-L976 WeakPolarHBondContact OD1-CD1 3.42Å; D942-L976 WeakPolarHBondContact OD2-CD1 3.45Å; L976-V980 WeakPolarHBondContact CD1-O 3.34Å; L976-K981 WeakPolarHBondContact CD1-O 3.28Å; L976-H983 VanDerWaalsContact CD2-N 3.31Å
977	P	69.4	Low	83.4	Confident	73 Å²	73	65.9 Å²	65.9	47%	0.474	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-70.5	136.6	178.2	28.3	-33.9	0	0	0	111.4	G979 V980	P977-G979 VanDerWaalsContact C-N 3.28Å; P977-G979 PolarHBondContact O-N 3.14Å; P977-G979 VanDerWaalsContact O-N 3.07Å; P977-V980 WeakPolarHBondContact O-CG2 3.25Å; P977-V980 PolarHBondContact O-N 2.89Å; P977-V980 VanDerWaalsContact O-N 3.13Å
978	N	68.3	Low	83.3	Confident	168 Å²	168	65.9 Å²	65.9	90%	0.898	35%	0.346	S	S	*	.	G	3₁₀ helix	trans	50.2	37	164	-59.9	-15.7	0	0	0	116	V980	N978-V980 PolarHBondContact O-N 2.88Å
979	G	65.5	Low	83.1	Confident	77 Å²	77	67.2 Å²	67.2	79%	0.794	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	70.7	14.3	176	0	0	0	0	0	115.1	P977	P977-G979 VanDerWaalsContact C-N 3.28Å; P977-G979 PolarHBondContact O-N 3.14Å; P977-G979 VanDerWaalsContact O-N 3.07Å
980	V	74.6	Confident	83	Confident	57 Å²	57	68.8 Å²	68.8	35%	0.345	36%	0.364	S	S	.	.			trans	-66.7	134.1	168.8	-177.6	0	0	0	0	108.6	L976 P977 N978 H982	L976-V980 WeakPolarHBondContact CD1-O 3.34Å; P977-V980 WeakPolarHBondContact O-CG2 3.25Å; P977-V980 PolarHBondContact O-N 2.89Å; P977-V980 VanDerWaalsContact O-N 3.13Å; N978-V980 PolarHBondContact O-N 2.88Å; V980-H982 VanDerWaalsContact C-N 3.32Å; V980-H982 WeakPolarHBondContact CG1-O 3.38Å; V980-H982 PolarHBondContact O-N 3.39Å
981	K	69.8	Low	82.9	Confident	168 Å²	168	73.8 Å²	73.8	73%	0.73	39%	0.39	S	S	*	.	S	Bend	trans	-65.7	-26.5	-173.3	-68.6	-167.6	173.4	-165.8	0	115.8	L976	L976-K981 WeakPolarHBondContact CD1-O 3.28Å
982	H	73.2	Confident	83	Confident	67 Å²	67	70.8 Å²	70.8	31%	0.31	38%	0.376	S	S	.	.	S	Bend	trans	-148	153.9	-176.7	-47.6	-76.5	0	0	0	110.3	P875 V980 Q984	P875-H982 HydrophobicContact CG-CB 4.17Å; V980-H982 VanDerWaalsContact C-N 3.32Å; V980-H982 WeakPolarHBondContact CG1-O 3.38Å; V980-H982 PolarHBondContact O-N 3.39Å; H982-Q984 PolarHBondContact O-N 3.41Å
983	H	81.2	Confident	83.2	Confident	16 Å²	16	71.4 Å²	71.4	7%	0.074	38%	0.379	C	S	.	.			trans	-64.6	131	171.1	-79.4	-75.7	0	0	0	110.5	T872 C874 P875 N973 L974 N975 L976 K985 V987	T872-H983 PolarHBondContact O-CD2 2.84Å; C874-H983 HydrophobicContact CB-CB 4.27Å; C874-H983 PolarHBondContact SG-O 2.87Å; C874-H983 VanDerWaalsContact SG-O 3.35Å; P875-H983 WeakPolarHBondContact CD-O 3.48Å; N973-H983 PolarHBondContact O-CE1 2.84Å; N973-H983 PolarHBondContact O-NE2 3.25Å; L974-H983 PolarHBondContact O-NE2 3Å; N975-H983 PolarHBondContact O-CE1 3.3Å; N975-H983 VanDerWaalsContact O-CE1 3.22Å; L976-H983 VanDerWaalsContact CD2-N 3.31Å; H983-K985 VanDerWaalsContact C-N 3.3Å; H983-K985 PolarHBondContact O-N 2.71Å; H983-V987 HydrophobicContact CB-CG2 4.3Å
984	Q	79.9	Confident	83.4	Confident	156 Å²	156	68.4 Å²	68.4	73%	0.729	36%	0.363	S	S	*	.	S	Bend	trans	-80.4	-11.7	-176.9	-65.2	-174.9	-1.1	0	0	113.8	H982	H982-Q984 PolarHBondContact O-N 3.41Å
985	K	86.1	Confident	83.6	Confident	160 Å²	160	70.3 Å²	70.3	70%	0.696	38%	0.376	S	S	*	.	S	Bend	trans	-142.8	155.9	180	-66.3	-176.6	178.9	-177.9	0	108.6	H983	H983-K985 VanDerWaalsContact C-N 3.3Å; H983-K985 PolarHBondContact O-N 2.71Å
986	P	89.8	Confident	84.2	Confident	12 Å²	12	68.9 Å²	68.9	8%	0.078	37%	0.368	C	S	.	.			trans	-53.8	137.8	167	-22.8	33	0	0	0	111.8	N868 L877 P879 L880 F988	N868-P986 WeakPolarHBondContact OD1-CA 3.1Å; L877-P986 HydrophobicContact CD2-CB 4.43Å; L877-P986 HydrophobicContact CD2-CG 4.03Å; P879-P986 HydrophobicContact CB-CG 4.13Å; P879-P986 HydrophobicContact CG-CG 4.34Å; L880-P986 HydrophobicContact CD1-CG 4.47Å; L880-P986 HydrophobicContact CD2-CB 3.72Å; L880-P986 HydrophobicContact CD2-CG 3.82Å; L880-P986 HydrophobicContact CG-CB 4.1Å; L880-P986 HydrophobicContact CG-CG 3.77Å; P986-F988 WeakPolarHBondContact CB-O 3.35Å
987	V	93.2	Very high	85	Confident	15 Å²	15	67.8 Å²	67.8	9%	0.091	36%	0.362	C	S	.	.	S	Bend	trans	-92.3	-34.8	174.1	-177.3	0	0	0	0	110.4	N868 T872 R970 Y972 L974 H983	N868-V987 PolarHBondContact OD1-N 3.3Å; T872-V987 HydrophobicContact CG2-CB 4Å; T872-V987 HydrophobicContact CG2-CG2 3.9Å; R970-V987 PolarHBondContact NH2-O 2.98Å; Y972-V987 HydrophobicContact CD1-CG1 4.36Å; L974-V987 HydrophobicContact CD2-CG1 4.24Å; H983-V987 HydrophobicContact CB-CG2 4.3Å
988	F	94.2	Very high	86.3	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.343	C	S	.	.	S	Bend	trans	-97.7	142	164.4	-49	-82.7	0	0	0	109.4	A864 L867 N868 L871 T872 L956 L967 Y972 L974 P986 D992	A864-F988 HydrophobicContact CB-CB 4.43Å; L867-F988 HydrophobicContact CB-CB 4.46Å; L867-F988 HydrophobicContact CB-CD2 3.59Å; L867-F988 HydrophobicContact CB-CE2 3.91Å; L867-F988 HydrophobicContact CB-CG 3.99Å; L867-F988 HydrophobicContact CD1-CD1 4.26Å; L867-F988 HydrophobicContact CD1-CG 4.29Å; N868-F988 PolarHBondContact ND2-O 3.23Å; N868-F988 PolarHBondContact OD1-N 3.47Å; L871-F988 HydrophobicContact CB-CE2 4.44Å; L871-F988 HydrophobicContact CD1-CE2 4.48Å; L871-F988 HydrophobicContact CD1-CZ 4.39Å; T872-F988 HydrophobicContact CG2-CD2 4.45Å; T872-F988 HydrophobicContact CG2-CE2 3.95Å; L956-F988 HydrophobicContact CD1-CE1 3.9Å; L956-F988 HydrophobicContact CD1-CZ 3.67Å; L956-F988 HydrophobicContact CD2-CE1 3.9Å; L956-F988 HydrophobicContact CD2-CZ 3.95Å; L956-F988 HydrophobicContact CG-CZ 4.45Å; L967-F988 HydrophobicContact CD1-CD1 4.28Å; L967-F988 HydrophobicContact CD1-CE1 3.95Å; Y972-F988 AromaticContact CD1-CD1 3.62Å; Y972-F988 HydrophobicContact CD1-CD1 3.62Å; Y972-F988 AromaticContact CD1-CE1 3.6Å; Y972-F988 HydrophobicContact CD1-CE1 3.6Å; Y972-F988 AromaticContact CE1-CD1 3.51Å; Y972-F988 HydrophobicContact CE1-CD1 3.51Å; Y972-F988 AromaticContact CE1-CE1 3.82Å; Y972-F988 HydrophobicContact CE1-CE1 3.82Å; Y972-F988 HydrophobicContact CG-CE1 4.18Å; L974-F988 HydrophobicContact CD2-CE1 4.33Å; L974-F988 HydrophobicContact CD2-CE2 4.01Å; L974-F988 HydrophobicContact CD2-CZ 3.52Å; P986-F988 WeakPolarHBondContact CB-O 3.35Å; F988-D992 WeakPolarHBondContact CA-OD2 3.27Å
989	N	92.5	Very high	87.5	Confident	56 Å²	56	58.7 Å²	58.7	30%	0.299	31%	0.31	S	S	.	.			trans	-133.1	169.9	-176.3	-54.6	-91.5	0	0	0	109.3	L880 E991 D992	L880-N989 HydrophobicContact CD2-CB 4.49Å; N989-E991 PolarHBondContact O-N 3.48Å; N989-D992 WeakPolarHBondContact CB-OD2 2.94Å; N989-D992 PolarHBondContact N-OD2 3.06Å; N989-D992 PolarHBondContact ND2-OD2 2.94Å; N989-D992 WeakPolarHBondContact O-CB 3.5Å; N989-D992 PolarHBondContact O-N 3.34Å
990	T	90.9	Very high	88.9	Confident	50 Å²	50	57 Å²	57	31%	0.307	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-55.7	-36.6	179.8	-42.7	0	0	0	0	113	S860 V861 D992	S860-T990 VanDerWaalsContact OG-CG2 3.25Å; S860-T990 WeakPolarHBondContact OG-CG2 3.3Å; V861-T990 HydrophobicContact CG2-CG2 3.78Å; T990-D992 VanDerWaalsContact C-N 3.3Å; T990-D992 PolarHBondContact O-N 3.46Å
991	E	90.7	Very high	89.8	Confident	173 Å²	173	57.9 Å²	57.9	81%	0.808	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-74.6	-15.9	179	-61.6	176.9	169	0	0	113.6	N989 I993	N989-E991 PolarHBondContact O-N 3.48Å; E991-I993 VanDerWaalsContact C-N 3.35Å
992	D	94.7	Very high	91	Very high	6 Å²	6	51.6 Å²	51.6	3%	0.032	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-81.9	-15.2	178.7	-62.1	-50.7	0	0	0	112.6	L967 L968 R970 Y972 F988 N989 T990 I994	L967-D992 CarbonylContact C-O 3.59Å; L967-D992 VanDerWaalsContact CA-O 3.25Å; L967-D992 WeakPolarHBondContact CA-O 3.06Å; L968-D992 PolarHBondContact N-O 2.98Å; R970-D992 IonicContact CZ-OD1 3.23Å; R970-D992 VanDerWaalsContact CZ-OD1 3.23Å; R970-D992 IonicContact CZ-OD2 3.75Å; R970-D992 IonicContact NE-OD1 2.68Å; R970-D992 PolarHBondContact NE-OD1 3.49Å; R970-D992 IonicContact NE-OD2 3.56Å; R970-D992 IonicContact NH2-OD1 3.67Å; R970-D992 PolarHBondContact NH2-OD1 3.22Å; R970-D992 IonicContact NH2-OD2 3.52Å; R970-D992 PolarHBondContact NH2-OD2 2.88Å; Y972-D992 HydrophobicContact CE1-CB 4.21Å; F988-D992 WeakPolarHBondContact CA-OD2 3.27Å; N989-D992 WeakPolarHBondContact CB-OD2 2.94Å; N989-D992 PolarHBondContact N-OD2 3.06Å; N989-D992 PolarHBondContact ND2-OD2 2.94Å; N989-D992 WeakPolarHBondContact O-CB 3.5Å; N989-D992 PolarHBondContact O-N 3.34Å; T990-D992 VanDerWaalsContact C-N 3.3Å; T990-D992 PolarHBondContact O-N 3.46Å; D992-I994 PolarHBondContact O-N 2.77Å
993	I	95.4	Very high	91.8	Very high	19 Å²	19	49.1 Å²	49.1	10%	0.097	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	89.2	-178.7	-46	-51.4	0	0	0	108.7	S860 V863 A864 L867 L967 E991	S860-I993 WeakPolarHBondContact O-CG1 3.47Å; V863-I993 HydrophobicContact CB-CD1 4.38Å; V863-I993 HydrophobicContact CB-CG1 4.25Å; V863-I993 HydrophobicContact CB-CG2 4.17Å; V863-I993 HydrophobicContact CG1-CD1 3.8Å; V863-I993 HydrophobicContact CG1-CG1 4.17Å; V863-I993 HydrophobicContact CG1-CG2 4.03Å; A864-I993 HydrophobicContact CB-CD1 4.32Å; A864-I993 HydrophobicContact CB-CG1 4.15Å; L867-I993 HydrophobicContact CD1-CD1 4.08Å; L967-I993 HydrophobicContact CD2-CD1 3.43Å; L967-I993 VanDerWaalsContact CD2-CD1 3.43Å; E991-I993 VanDerWaalsContact C-N 3.35Å
994	I	93.7	Very high	92	Very high	65 Å²	65	52.9 Å²	52.9	33%	0.333	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	-48.6	-177.4	-71.5	-177.1	0	0	0	111.2	A316 Q966 L968 D992	A316-I994 HydrophobicContact CB-CD1 4.03Å; A316-I994 WeakPolarHBondContact O-CD1 3.33Å; Q966-I994 HydrophobicContact CG-CB 4.35Å; Q966-I994 HydrophobicContact CG-CG2 4.39Å; Q966-I994 PolarHBondContact O-N 3.33Å; L968-I994 HydrophobicContact CB-CD1 4.13Å; L968-I994 HydrophobicContact CB-CG1 4.3Å; L968-I994 HydrophobicContact CD1-CD1 4.07Å; D992-I994 PolarHBondContact O-N 2.77Å
995	S	93.3	Very high	92.4	Very high	40 Å²	40	46.8 Å²	46.8	28%	0.28	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	167.2	179.9	77.2	0	0	0	0	113.1	Q966	Q966-S995 VanDerWaalsContact CB-OG 3.31Å; Q966-S995 WeakPolarHBondContact CB-OG 3.35Å; Q966-S995 PolarHBondContact N-O 3.16Å; Q966-S995 PolarHBondContact O-N 2.91Å; Q966-S995 PolarHBondContact OE1-OG 2.8Å
996	L	95.1	Very high	92.3	Very high	30 Å²	30	42.6 Å²	42.6	16%	0.157	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	140.4	159.9	-65.5	175.8	0	0	0	108	Y469 R470 L851 V863 G964 I965	Y469-L996 HydrophobicContact CE2-CB 4.17Å; R470-L996 HydrophobicContact CG-CD1 3.9Å; L851-L996 HydrophobicContact CD2-CD1 3.96Å; V863-L996 HydrophobicContact CG2-CD1 4.4Å; V863-L996 HydrophobicContact CG2-CD2 4.22Å; G964-L996 CarbonylContact O-C 3.57Å; G964-L996 WeakPolarHBondContact O-CA 3.45Å; G964-L996 WeakPolarHBondContact O-CD2 3.43Å; I965-L996 HydrophobicContact CB-CD2 4.29Å; I965-L996 HydrophobicContact CG1-CD2 3.66Å
997	Y	94.3	Very high	92.3	Very high	15 Å²	15	42 Å²	42	6%	0.059	22%	0.215	C	C	.	.			trans	-126.8	152.1	-178	63.3	-95.9	0	0	0	112.5	H312 G964 Q966 I999	H312-Y997 HydrophobicContact CB-CD1 4.26Å; H312-Y997 HydrophobicContact CB-CD2 3.73Å; H312-Y997 HydrophobicContact CB-CE1 4.22Å; H312-Y997 HydrophobicContact CB-CE2 3.68Å; H312-Y997 HydrophobicContact CB-CG 4.01Å; H312-Y997 VanDerWaalsContact CD2-CB 3.42Å; H312-Y997 WeakPolarHBondContact CD2-CB 3.43Å; H312-Y997 AromaticContact CD2-CD2 3.85Å; H312-Y997 AromaticContact CD2-CG 3.7Å; H312-Y997 AromaticContact CG-CD2 3.52Å; H312-Y997 AromaticContact CG-CE2 3.97Å; H312-Y997 AromaticContact CG-CG 3.8Å; H312-Y997 AromaticContact ND1-CD2 3.67Å; G964-Y997 WeakPolarHBondContact CA-O 3.3Å; G964-Y997 PolarHBondContact O-N 3.48Å; Q966-Y997 HydrophobicContact CB-CD1 4.16Å; Q966-Y997 HydrophobicContact CB-CE1 4.27Å; Y997-I999 HydrophobicContact CD2-CD1 4.04Å; Y997-I999 HydrophobicContact CE2-CD1 3.65Å
998	P	95.2	Very high	92.1	Very high	14 Å²	14	45.5 Å²	45.5	9%	0.091	24%	0.237	C	C	.	.			trans	-72.1	140.8	-178.2	27.3	-33.5	0	0	0	112.4	T386 V390 I467 Y469 V1000	T386-P998 HydrophobicContact CG2-CB 3.87Å; T386-P998 HydrophobicContact CG2-CG 3.45Å; T386-P998 VanDerWaalsContact CG2-CG 3.45Å; V390-P998 HydrophobicContact CG2-CB 4.23Å; V390-P998 HydrophobicContact CG2-CG 4.09Å; I467-P998 HydrophobicContact CG2-CB 3.59Å; Y469-P998 HydrophobicContact CD2-CB 4.39Å; P998-V1000 HydrophobicContact CB-CG2 4.29Å
999	I	95.3	Very high	91.9	Very high	37 Å²	37	47.2 Å²	47.2	19%	0.19	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	109.1	169.1	-56.5	-60.2	0	0	0	108.5	D468 T961 Y997	D468-I999 HydrophobicContact CB-CB 4.37Å; D468-I999 PolarHBondContact N-O 2.84Å; D468-I999 PolarHBondContact O-N 3.05Å; T961-I999 WeakPolarHBondContact O-CD1 3.06Å; Y997-I999 HydrophobicContact CD2-CD1 4.04Å; Y997-I999 HydrophobicContact CE2-CD1 3.65Å
1000	V	94.5	Very high	91.7	Very high	40 Å²	40	44.6 Å²	44.6	24%	0.242	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	147.8	-168.8	-164.3	0	0	0	0	111.7	V382 T386 I466 I467 P998	V382-V1000 HydrophobicContact CG1-CG1 4.02Å; T386-V1000 HydrophobicContact CG2-CG2 3.71Å; T386-V1000 WeakPolarHBondContact OG1-CG2 3.49Å; I466-V1000 CarbonylContact O-C 3.52Å; I466-V1000 WeakPolarHBondContact O-CA 3.38Å; I467-V1000 HydrophobicContact CG1-CG1 4.33Å; P998-V1000 HydrophobicContact CB-CG2 4.29Å
1001	K	93.9	Very high	91.7	Very high	77 Å²	77	43.5 Å²	43.5	34%	0.335	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	134.9	169.9	-54.5	169	-178	169.6	0	109.6	L445 A465 I466 D468	L445-K1001 HydrophobicContact CD2-CB 3.81Å; A465-K1001 CarbonylContact C-O 3.49Å; A465-K1001 WeakPolarHBondContact CA-O 3.37Å; I466-K1001 HydrophobicContact CB-CB 4.35Å; I466-K1001 PolarHBondContact N-O 2.88Å; I466-K1001 PolarHBondContact O-N 3.02Å; D468-K1001 IonicContact OD2-NZ 2.85Å
1002	H	93.3	Very high	91.8	Very high	35 Å²	35	41 Å²	41	16%	0.162	21%	0.21	C	C	.	.			trans	-152.7	-177.6	-176.6	51.8	91.6	0	0	0	111.5	V382 R449 A465 H1004	V382-H1002 HydrophobicContact CG2-CB 3.55Å; R449-H1002 PolarHBondContact NH2-O 3.5Å; A465-H1002 HydrophobicContact CB-CB 4.44Å; H1002-H1004 AromaticContact CE1-CD2 3.98Å; H1002-H1004 AromaticContact CE1-CE1 3.59Å; H1002-H1004 AromaticContact CE1-NE2 3.57Å; H1002-H1004 AromaticContact ND1-CE1 3.8Å; H1002-H1004 AromaticContact ND1-ND1 3.9Å; H1002-H1004 PolarHBondContact O-ND1 2.84Å
1003	L	90.2	Very high	91.7	Very high	15 Å²	15	44.1 Å²	44.1	8%	0.079	22%	0.222	C	C	.	.			trans	-74.8	145.1	164.4	-67.6	86.7	0	0	0	109.6	N378 L445 V448 R449	N378-L1003 PolarHBondContact ND2-O 3.4Å; N378-L1003 VanDerWaalsContact ND2-O 3.16Å; L445-L1003 HydrophobicContact CD1-CD1 3.74Å; V448-L1003 HydrophobicContact CG1-CD1 3.94Å; V448-L1003 HydrophobicContact CG1-CD2 4.29Å; R449-L1003 HydrophobicContact CB-CG 4.42Å
1004	H	85.4	Confident	91.5	Very high	95 Å²	95	43.6 Å²	43.6	44%	0.44	22%	0.219	S	C	.	.			trans	-114.9	98.6	174.3	-62.9	62.9	0	0	0	106.4	H1002	H1002-H1004 AromaticContact CE1-CD2 3.98Å; H1002-H1004 AromaticContact CE1-CE1 3.59Å; H1002-H1004 AromaticContact CE1-NE2 3.57Å; H1002-H1004 AromaticContact ND1-CE1 3.8Å; H1002-H1004 AromaticContact ND1-ND1 3.9Å; H1002-H1004 PolarHBondContact O-ND1 2.84Å
1005	P	88.5	Confident	91.4	Very high	28 Å²	28	42.4 Å²	42.4	18%	0.182	22%	0.215	C	C	.	.			trans	-60.2	151.4	171	-22.6	35.1	0	0	0	110.5	I374 F375 N378	I374-P1005 HydrophobicContact CG2-CB 3.94Å; I374-P1005 HydrophobicContact CG2-CG 4.03Å; F375-P1005 HydrophobicContact CB-CB 4.32Å; F375-P1005 HydrophobicContact CD2-CB 4.49Å; N378-P1005 HydrophobicContact CB-CG 3.79Å; N378-P1005 WeakPolarHBondContact ND2-CD 3.33Å
1006	H	84.6	Confident	91.5	Very high	72 Å²	72	42.5 Å²	42.5	33%	0.333	21%	0.214	S	C	.	.			trans	-142.5	126.7	-166.1	172.2	-87.9	0	0	0	111.1	T1008 Y1011 Y1044	H1006-T1008 PolarHBondContact O-N 3.28Å; H1006-T1008 PolarHBondContact O-OG1 3.48Å; H1006-Y1011 WeakPolarHBondContact CE1-CB 3.24Å; H1006-Y1011 AromaticContact CE1-CD1 3.65Å; H1006-Y1011 AromaticContact CE1-CG 3.45Å; H1006-Y1011 VanDerWaalsContact CE1-CG 3.45Å; H1006-Y1011 AromaticContact NE2-CD1 3.66Å; H1006-Y1011 AromaticContact NE2-CD2 3.62Å; H1006-Y1011 AromaticContact NE2-CG 3.28Å; H1006-Y1011 VanDerWaalsContact NE2-CG 3.28Å; H1006-Y1044 WeakPolarHBondContact CA-OH 3.21Å
1007	A	90.5	Very high	91.3	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.			trans	-67.9	92.6	-177.7	0	0	0	0	0	111.1	D371 A1010 Y1011 L1040 V1043 Y1044	D371-A1007 WeakPolarHBondContact OD2-CA 3.45Å; A1007-A1010 HydrophobicContact CB-CB 3.92Å; A1007-Y1011 VanDerWaalsContact O-CB 3.26Å; A1007-Y1011 WeakPolarHBondContact O-CB 3.47Å; A1007-Y1011 PolarHBondContact O-N 2.97Å; A1007-L1040 HydrophobicContact CB-CD2 3.94Å; A1007-V1043 HydrophobicContact CB-CB 4.04Å; A1007-V1043 HydrophobicContact CB-CG1 3.69Å; A1007-V1043 HydrophobicContact CB-CG2 4.19Å; A1007-Y1044 HydrophobicContact CB-CE1 4.18Å; A1007-Y1044 HydrophobicContact CB-CE2 3.94Å; A1007-Y1044 PolarHBondContact N-OH 3.34Å
1008	T	87.9	Confident	91	Very high	89 Å²	89	43 Å²	43	55%	0.546	22%	0.216	S	C	.	.	H	α-helix	trans	-77.1	-44.8	-158.6	-65.3	0	0	0	0	112.7	D371 H1006 H1012	D371-T1008 PolarHBondContact OD2-N 2.86Å; H1006-T1008 PolarHBondContact O-N 3.28Å; H1006-T1008 PolarHBondContact O-OG1 3.48Å; T1008-H1012 PolarHBondContact O-N 3.39Å
1009	D	89.5	Confident	90.6	Very high	36 Å²	36	44.9 Å²	44.9	19%	0.193	23%	0.233	C	C	.	.	H	α-helix	trans	-62.9	-48.5	171.3	-72.1	-89.9	0	0	0	111	L364 R367 Y1011 H1012 Y1013	L364-D1009 HydrophobicContact CD1-CB 3.51Å; L364-D1009 VanDerWaalsContact CD1-CG 3.48Å; R367-D1009 IonicContact CZ-OD1 2.72Å; R367-D1009 IonicContact CZ-OD2 2.9Å; R367-D1009 IonicContact NE-OD1 2.77Å; R367-D1009 PolarHBondContact NE-OD1 3.41Å; R367-D1009 IonicContact NE-OD2 3.81Å; R367-D1009 PolarHBondContact NE-OD2 3.06Å; R367-D1009 IonicContact NH2-OD1 2.81Å; R367-D1009 PolarHBondContact NH2-OD1 3.04Å; R367-D1009 IonicContact NH2-OD2 3.92Å; D1009-Y1011 VanDerWaalsContact C-N 3.31Å; D1009-Y1011 PolarHBondContact O-N 2.9Å; D1009-H1012 WeakPolarHBondContact O-CA 3.42Å; D1009-H1012 VanDerWaalsContact O-CB 3.28Å; D1009-H1012 WeakPolarHBondContact O-CB 3.14Å; D1009-H1012 PolarHBondContact O-N 3.28Å; D1009-Y1013 WeakPolarHBondContact O-CD2 3.34Å; D1009-Y1013 PolarHBondContact O-N 3.5Å; D1009-Y1013 VanDerWaalsContact O-N 3.08Å
1010	A	89.5	Confident	90.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.4	-39	-176.3	0	0	0	0	0	112.8	L368 A1007 H1012 Y1013 F1014 L1039 L1040	L368-A1010 HydrophobicContact CD2-CB 4.42Å; A1007-A1010 HydrophobicContact CB-CB 3.92Å; A1010-H1012 VanDerWaalsContact C-N 3.34Å; A1010-Y1013 WeakPolarHBondContact O-CB 3.5Å; A1010-Y1013 PolarHBondContact O-N 3.29Å; A1010-F1014 PolarHBondContact O-N 2.97Å; A1010-F1014 VanDerWaalsContact O-N 3.17Å; A1010-L1039 HydrophobicContact CB-CB 3.59Å; A1010-L1039 HydrophobicContact CB-CD1 4.47Å; A1010-L1040 HydrophobicContact CB-CD2 3.77Å; A1010-L1040 HydrophobicContact CB-CG 3.93Å
1011	Y	90	Very high	89.9	Confident	28 Å²	28	47 Å²	47	11%	0.11	24%	0.235	C	C	.	.	H	α-helix	trans	-71.6	-27.2	173.9	-169.1	-97	0	0	0	113.1	N683 H1006 A1007 D1009 F1014 T1015	N683-Y1011 WeakPolarHBondContact CB-OH 3.44Å; N683-Y1011 PolarHBondContact O-OH 3.49Å; H1006-Y1011 WeakPolarHBondContact CE1-CB 3.24Å; H1006-Y1011 AromaticContact CE1-CD1 3.65Å; H1006-Y1011 AromaticContact CE1-CG 3.45Å; H1006-Y1011 VanDerWaalsContact CE1-CG 3.45Å; H1006-Y1011 AromaticContact NE2-CD1 3.66Å; H1006-Y1011 AromaticContact NE2-CD2 3.62Å; H1006-Y1011 AromaticContact NE2-CG 3.28Å; H1006-Y1011 VanDerWaalsContact NE2-CG 3.28Å; A1007-Y1011 VanDerWaalsContact O-CB 3.26Å; A1007-Y1011 WeakPolarHBondContact O-CB 3.47Å; A1007-Y1011 PolarHBondContact O-N 2.97Å; D1009-Y1011 VanDerWaalsContact C-N 3.31Å; D1009-Y1011 PolarHBondContact O-N 2.9Å; Y1011-F1014 HydrophobicContact CD2-CD1 4.04Å; Y1011-F1014 AromaticContact CE2-CD1 3.57Å; Y1011-F1014 HydrophobicContact CE2-CD1 3.57Å; Y1011-F1014 HydrophobicContact CE2-CE1 4.02Å; Y1011-F1014 PolarHBondContact O-N 3Å; Y1011-T1015 HydrophobicContact CD1-CG2 3.95Å; Y1011-T1015 HydrophobicContact CE1-CG2 3.29Å; Y1011-T1015 HydrophobicContact CE2-CG2 4.48Å; Y1011-T1015 PolarHBondContact O-N 2.85Å; Y1011-T1015 PolarHBondContact O-OG1 3.29Å
1012	H	92.5	Very high	89.3	Confident	119 Å²	119	45.9 Å²	45.9	55%	0.551	24%	0.237	S	C	*	.	H	α-helix	trans	-67	-36.5	170.8	-172	-86.3	0	0	0	111.7	T1008 D1009 A1010 T1015 T1016	T1008-H1012 PolarHBondContact O-N 3.39Å; D1009-H1012 WeakPolarHBondContact O-CA 3.42Å; D1009-H1012 VanDerWaalsContact O-CB 3.28Å; D1009-H1012 WeakPolarHBondContact O-CB 3.14Å; D1009-H1012 PolarHBondContact O-N 3.28Å; A1010-H1012 VanDerWaalsContact C-N 3.34Å; H1012-T1015 WeakPolarHBondContact CA-OG1 3.49Å; H1012-T1015 PolarHBondContact O-OG1 3.41Å; H1012-T1016 PolarHBondContact CE1-OG1 3.36Å; H1012-T1016 WeakPolarHBondContact O-CB 3.24Å; H1012-T1016 PolarHBondContact O-N 3.03Å; H1012-T1016 PolarHBondContact O-OG1 3.39Å
1013	Y	92.7	Very high	88.9	Confident	73 Å²	73	46.1 Å²	46.1	29%	0.286	25%	0.245	S	C	.	.	H	α-helix	trans	-61.7	-47	169.1	-81.2	-100.3	0	0	0	111.3	D1009 A1010 T1015 T1016 G1017 L1032 E1035 L1039	D1009-Y1013 WeakPolarHBondContact O-CD2 3.34Å; D1009-Y1013 PolarHBondContact O-N 3.5Å; D1009-Y1013 VanDerWaalsContact O-N 3.08Å; A1010-Y1013 WeakPolarHBondContact O-CB 3.5Å; A1010-Y1013 PolarHBondContact O-N 3.29Å; Y1013-T1015 PolarHBondContact O-N 2.81Å; Y1013-T1016 PolarHBondContact O-N 3.33Å; Y1013-G1017 PolarHBondContact O-N 2.93Å; Y1013-L1032 HydrophobicContact CD1-CD2 3.85Å; Y1013-L1032 HydrophobicContact CE1-CD2 4.35Å; Y1013-E1035 HydrophobicContact CD1-CB 4.34Å; Y1013-E1035 HydrophobicContact CD1-CG 3.83Å; Y1013-E1035 HydrophobicContact CE1-CG 3.87Å; Y1013-L1039 HydrophobicContact CD2-CD1 3.8Å; Y1013-L1039 HydrophobicContact CE2-CD1 3.98Å; Y1013-L1039 HydrophobicContact CG-CD1 4.18Å
1014	F	92	Very high	88.4	Confident	8 Å²	8	46.5 Å²	46.5	4%	0.035	25%	0.252	C	S	.	.	H	α-helix	trans	-57.1	-50.4	177.9	176.9	-109.3	0	0	0	112.7	A1010 Y1011 G1017 Q1018 I1033 A1036 A1053 C1054 L1057	A1010-F1014 PolarHBondContact O-N 2.97Å; A1010-F1014 VanDerWaalsContact O-N 3.17Å; Y1011-F1014 HydrophobicContact CD2-CD1 4.04Å; Y1011-F1014 AromaticContact CE2-CD1 3.57Å; Y1011-F1014 HydrophobicContact CE2-CD1 3.57Å; Y1011-F1014 HydrophobicContact CE2-CE1 4.02Å; Y1011-F1014 PolarHBondContact O-N 3Å; F1014-G1017 PolarHBondContact O-N 3.49Å; F1014-Q1018 HydrophobicContact CE1-CG 4.49Å; F1014-Q1018 HydrophobicContact CZ-CG 4.43Å; F1014-Q1018 WeakPolarHBondContact O-CG 3.37Å; F1014-Q1018 PolarHBondContact O-N 2.94Å; F1014-I1033 HydrophobicContact CD2-CD1 3.63Å; F1014-I1033 HydrophobicContact CE2-CD1 4.15Å; F1014-I1033 HydrophobicContact CG-CD1 4.37Å; F1014-I1033 VanDerWaalsContact O-CD1 3.22Å; F1014-I1033 WeakPolarHBondContact O-CD1 3.35Å; F1014-A1036 HydrophobicContact CB-CB 3.93Å; F1014-A1053 HydrophobicContact CE2-CB 4.34Å; F1014-A1053 HydrophobicContact CZ-CB 3.84Å; F1014-C1054 WeakPolarHBondContact CD2-SG 3.5Å; F1014-L1057 HydrophobicContact CE2-CD2 4.15Å
1015	T	92.2	Very high	88.6	Confident	39 Å²	39	45.6 Å²	45.6	24%	0.239	25%	0.248	C	C	.	.	H	α-helix	trans	-70.2	-33.3	-179.9	45.8	0	0	0	0	113	Y1011 H1012 Y1013 Q1018 A1019	Y1011-T1015 HydrophobicContact CD1-CG2 3.95Å; Y1011-T1015 HydrophobicContact CE1-CG2 3.29Å; Y1011-T1015 HydrophobicContact CE2-CG2 4.48Å; Y1011-T1015 PolarHBondContact O-N 2.85Å; Y1011-T1015 PolarHBondContact O-OG1 3.29Å; H1012-T1015 WeakPolarHBondContact CA-OG1 3.49Å; H1012-T1015 PolarHBondContact O-OG1 3.41Å; Y1013-T1015 PolarHBondContact O-N 2.81Å; T1015-Q1018 PolarHBondContact O-N 2.9Å; T1015-A1019 PolarHBondContact O-N 2.72Å
1016	T	93.6	Very high	88.6	Confident	42 Å²	42	46 Å²	46	26%	0.258	25%	0.248	S	C	.	.	H	α-helix	trans	-65.7	-41.1	171	-58.6	0	0	0	0	111.3	H1012 Y1013 A1019 R1020 L1032	H1012-T1016 PolarHBondContact CE1-OG1 3.36Å; H1012-T1016 WeakPolarHBondContact O-CB 3.24Å; H1012-T1016 PolarHBondContact O-N 3.03Å; H1012-T1016 PolarHBondContact O-OG1 3.39Å; Y1013-T1016 PolarHBondContact O-N 3.33Å; T1016-A1019 WeakPolarHBondContact O-CB 3.25Å; T1016-A1019 PolarHBondContact O-N 2.93Å; T1016-R1020 WeakPolarHBondContact O-CG 3.43Å; T1016-R1020 PolarHBondContact O-N 3.46Å; T1016-L1032 HydrophobicContact CG2-CD1 4.07Å
1017	G	92	Very high	88.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-59.9	-48.3	173.7	0	0	0	0	0	111.9	Y1013 F1014 A1019 R1020 I1021	Y1013-G1017 PolarHBondContact O-N 2.93Å; F1014-G1017 PolarHBondContact O-N 3.49Å; G1017-A1019 VanDerWaalsContact C-N 3.3Å; G1017-A1019 PolarHBondContact O-N 2.9Å; G1017-R1020 PolarHBondContact O-N 3.35Å; G1017-R1020 VanDerWaalsContact O-N 3.17Å; G1017-I1021 WeakPolarHBondContact O-CD1 3.4Å; G1017-I1021 WeakPolarHBondContact O-CG1 3.28Å; G1017-I1021 PolarHBondContact O-N 2.96Å
1018	Q	88.4	Confident	89	Confident	56 Å²	56	51 Å²	51	26%	0.262	27%	0.272	S	S	.	.	H	α-helix	trans	-54.7	-44.4	172.9	-72.3	-175.9	-20.7	0	0	112.4	F1014 T1015 I1021 S1022 L1057	F1014-Q1018 HydrophobicContact CE1-CG 4.49Å; F1014-Q1018 HydrophobicContact CZ-CG 4.43Å; F1014-Q1018 WeakPolarHBondContact O-CG 3.37Å; F1014-Q1018 PolarHBondContact O-N 2.94Å; T1015-Q1018 PolarHBondContact O-N 2.9Å; Q1018-I1021 PolarHBondContact O-N 3.02Å; Q1018-S1022 PolarHBondContact O-N 3.08Å; Q1018-L1057 HydrophobicContact CG-CD2 3.79Å
1019	A	87.2	Confident	89.1	Confident	54 Å²	54	46.8 Å²	46.8	45%	0.446	25%	0.246	S	C	.	.	H	α-helix	trans	-62.5	-44.6	177.1	0	0	0	0	0	112.1	T1015 T1016 G1017 I1021 S1022 A1023	T1015-A1019 PolarHBondContact O-N 2.72Å; T1016-A1019 WeakPolarHBondContact O-CB 3.25Å; T1016-A1019 PolarHBondContact O-N 2.93Å; G1017-A1019 VanDerWaalsContact C-N 3.3Å; G1017-A1019 PolarHBondContact O-N 2.9Å; A1019-I1021 VanDerWaalsContact C-N 3.35Å; A1019-I1021 PolarHBondContact O-N 3.17Å; A1019-S1022 PolarHBondContact O-N 2.88Å; A1019-S1022 PolarHBondContact O-OG 3.2Å; A1019-A1023 PolarHBondContact O-N 2.88Å
1020	R	88.7	Confident	89.3	Confident	107 Å²	107	46.8 Å²	46.8	40%	0.404	24%	0.244	S	C	.	.	H	α-helix	trans	-62.2	-39.2	175.6	-69.7	-62.1	179.5	131.6	-5.6	112.6	T1016 G1017 S1022 A1023 G1024 H1025 E1028 L1032	T1016-R1020 WeakPolarHBondContact O-CG 3.43Å; T1016-R1020 PolarHBondContact O-N 3.46Å; G1017-R1020 PolarHBondContact O-N 3.35Å; G1017-R1020 VanDerWaalsContact O-N 3.17Å; R1020-S1022 PolarHBondContact O-N 2.9Å; R1020-A1023 CarbonylContact O-C 3.53Å; R1020-A1023 WeakPolarHBondContact O-CA 3.46Å; R1020-A1023 WeakPolarHBondContact O-CB 3.45Å; R1020-A1023 PolarHBondContact O-N 2.94Å; R1020-A1023 VanDerWaalsContact O-N 3.11Å; R1020-G1024 PolarHBondContact O-N 3Å; R1020-H1025 HydrophobicContact CB-CB 4.24Å; R1020-H1025 WeakPolarHBondContact O-CB 3.16Å; R1020-H1025 PolarHBondContact O-N 3.33Å; R1020-E1028 WeakPolarHBondContact CD-OE2 3.46Å; R1020-E1028 IonicContact CZ-OE2 2.92Å; R1020-E1028 IonicContact NE-OE2 3.59Å; R1020-E1028 IonicContact NH1-OE1 3.93Å; R1020-E1028 IonicContact NH1-OE2 3.85Å; R1020-E1028 PolarHBondContact NH1-OE2 3.28Å; R1020-L1032 HydrophobicContact CB-CD1 4.43Å; R1020-L1032 HydrophobicContact CG-CD1 3.81Å
1021	I	85.6	Confident	89.5	Confident	13 Å²	13	51.9 Å²	51.9	7%	0.067	27%	0.268	C	S	.	.	H	α-helix	trans	-61.8	-43.4	174.7	-65.1	160	0	0	0	110.7	G1017 Q1018 A1019 A1023 G1024 L1026 I1033 L1057 L1061 I1331	G1017-I1021 WeakPolarHBondContact O-CD1 3.4Å; G1017-I1021 WeakPolarHBondContact O-CG1 3.28Å; G1017-I1021 PolarHBondContact O-N 2.96Å; Q1018-I1021 PolarHBondContact O-N 3.02Å; A1019-I1021 VanDerWaalsContact C-N 3.35Å; A1019-I1021 PolarHBondContact O-N 3.17Å; I1021-A1023 VanDerWaalsContact C-N 3.26Å; I1021-A1023 PolarHBondContact O-N 3.18Å; I1021-G1024 WeakPolarHBondContact O-CA 3.42Å; I1021-G1024 PolarHBondContact O-N 3.45Å; I1021-L1026 HydrophobicContact CG2-CD2 4.23Å; I1021-I1033 HydrophobicContact CD1-CG1 3.97Å; I1021-L1057 HydrophobicContact CD1-CD1 4.14Å; I1021-L1057 HydrophobicContact CD1-CD2 3.92Å; I1021-L1057 HydrophobicContact CD1-CG 4.11Å; I1021-L1061 HydrophobicContact CD1-CD1 3.77Å; I1021-L1061 HydrophobicContact CD1-CD2 4.16Å; I1021-L1061 HydrophobicContact CD1-CG 4.41Å; I1021-L1061 HydrophobicContact CG1-CD1 4.43Å; I1021-L1061 HydrophobicContact CG1-CD2 4.12Å; I1021-L1061 HydrophobicContact CG2-CD2 4.28Å; I1021-I1331 HydrophobicContact CG2-CD1 4.25Å; I1021-I1331 HydrophobicContact CG2-CG2 3.65Å; I1021-I1331 VanDerWaalsContact O-CG2 3.32Å; I1021-I1331 WeakPolarHBondContact O-CG2 3.38Å
1022	S	81	Confident	89.8	Confident	55 Å²	55	52.4 Å²	52.4	39%	0.385	27%	0.273	S	S	.	.	H	α-helix	trans	-69.3	-19.5	174.6	76.8	0	0	0	0	114.5	Q1018 A1019 R1020 G1024 Q1332 I1333 R1334	Q1018-S1022 PolarHBondContact O-N 3.08Å; A1019-S1022 PolarHBondContact O-N 2.88Å; A1019-S1022 PolarHBondContact O-OG 3.2Å; R1020-S1022 PolarHBondContact O-N 2.9Å; S1022-G1024 VanDerWaalsContact C-N 3.27Å; S1022-Q1332 CarbonylContact C-O 3.53Å; S1022-Q1332 WeakPolarHBondContact CA-O 3.4Å; S1022-I1333 WeakPolarHBondContact O-CA 3.29Å; S1022-R1334 PolarHBondContact O-N 2.55Å
1023	A	84.4	Confident	89.9	Confident	40 Å²	40	46.7 Å²	46.7	33%	0.331	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-2.4	167.9	0	0	0	0	0	112.9	A1019 R1020 I1021 H1025	A1019-A1023 PolarHBondContact O-N 2.88Å; R1020-A1023 CarbonylContact O-C 3.53Å; R1020-A1023 WeakPolarHBondContact O-CA 3.46Å; R1020-A1023 WeakPolarHBondContact O-CB 3.45Å; R1020-A1023 PolarHBondContact O-N 2.94Å; R1020-A1023 VanDerWaalsContact O-N 3.11Å; I1021-A1023 VanDerWaalsContact C-N 3.26Å; I1021-A1023 PolarHBondContact O-N 3.18Å; A1023-H1025 VanDerWaalsContact C-N 3.34Å; A1023-H1025 PolarHBondContact O-CD2 2.99Å
1024	G	81.2	Confident	90	Very high	22 Å²	22	46.7 Å²	46.7	23%	0.227	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	4.6	-177.3	0	0	0	0	0	115.3	R1020 I1021 S1022 L1026	R1020-G1024 PolarHBondContact O-N 3Å; I1021-G1024 WeakPolarHBondContact O-CA 3.42Å; I1021-G1024 PolarHBondContact O-N 3.45Å; S1022-G1024 VanDerWaalsContact C-N 3.27Å; G1024-L1026 VanDerWaalsContact C-N 3.26Å; G1024-L1026 PolarHBondContact O-N 3.3Å
1025	H	89.1	Confident	90.1	Very high	77 Å²	77	50.3 Å²	50.3	36%	0.356	27%	0.268	S	S	.	.			trans	-82.5	70.2	178.1	-68.1	-149.1	0	0	0	109.6	R1020 A1023 Q1027 E1028 G1029	R1020-H1025 HydrophobicContact CB-CB 4.24Å; R1020-H1025 WeakPolarHBondContact O-CB 3.16Å; R1020-H1025 PolarHBondContact O-N 3.33Å; A1023-H1025 VanDerWaalsContact C-N 3.34Å; A1023-H1025 PolarHBondContact O-CD2 2.99Å; H1025-Q1027 PolarHBondContact O-N 2.96Å; H1025-E1028 HydrophobicContact CB-CB 4.23Å; H1025-E1028 HydrophobicContact CB-CG 4.3Å; H1025-E1028 WeakPolarHBondContact CB-OE2 3.08Å; H1025-E1028 IonicContact CE1-OE1 2.72Å; H1025-E1028 IonicContact CE1-OE2 3.2Å; H1025-E1028 IonicContact CG-OE1 3.78Å; H1025-E1028 IonicContact CG-OE2 3.99Å; H1025-E1028 IonicContact ND1-OE1 3.73Å; H1025-E1028 PolarHBondContact ND1-OE1 3.2Å; H1025-E1028 IonicContact ND1-OE2 3.3Å; H1025-E1028 PolarHBondContact ND1-OE2 2.84Å; H1025-G1029 PolarHBondContact O-N 2.99Å
1026	L	88.4	Confident	90.2	Very high	36 Å²	36	48.4 Å²	48.4	19%	0.188	26%	0.257	C	S	.	.	H	α-helix	trans	-64.5	-36.9	-168.8	-54.8	-170.6	0	0	0	113.8	I1021 G1024 G1029 F1030 L1061 V1064 I1331 I1363	I1021-L1026 HydrophobicContact CG2-CD2 4.23Å; G1024-L1026 VanDerWaalsContact C-N 3.26Å; G1024-L1026 PolarHBondContact O-N 3.3Å; L1026-G1029 PolarHBondContact O-N 3.3Å; L1026-F1030 PolarHBondContact O-N 2.88Å; L1026-L1061 HydrophobicContact CD2-CD2 4.49Å; L1026-V1064 HydrophobicContact CD1-CG1 3.88Å; L1026-I1331 HydrophobicContact CD1-CD1 4.1Å; L1026-I1331 HydrophobicContact CD2-CD1 3.55Å; L1026-I1331 HydrophobicContact CD2-CG2 4.14Å; L1026-I1331 HydrophobicContact CG-CD1 4.48Å; L1026-I1363 HydrophobicContact CD1-CD1 4.28Å
1027	Q	90.8	Very high	90.3	Very high	106 Å²	106	47 Å²	47	50%	0.495	25%	0.247	S	C	.	.	H	α-helix	trans	-69.8	-52.9	-179.7	-175.4	62.8	34.8	0	0	111.7	H1025 G1029 F1030 E1031	H1025-Q1027 PolarHBondContact O-N 2.96Å; Q1027-G1029 PolarHBondContact O-N 2.74Å; Q1027-F1030 PolarHBondContact O-N 3.17Å; Q1027-E1031 WeakPolarHBondContact CG-OE1 3.33Å; Q1027-E1031 PolarHBondContact NE2-OE1 3.42Å; Q1027-E1031 WeakPolarHBondContact O-CG 3.38Å; Q1027-E1031 PolarHBondContact O-N 2.81Å
1028	E	91.5	Very high	90.4	Very high	72 Å²	72	50.3 Å²	50.3	34%	0.336	27%	0.271	S	S	.	.	H	α-helix	trans	-54.7	-38	171.8	-59.3	175.3	-172.5	0	0	111	R1020 H1025 L1032	R1020-E1028 WeakPolarHBondContact CD-OE2 3.46Å; R1020-E1028 IonicContact CZ-OE2 2.92Å; R1020-E1028 IonicContact NE-OE2 3.59Å; R1020-E1028 IonicContact NH1-OE1 3.93Å; R1020-E1028 IonicContact NH1-OE2 3.85Å; R1020-E1028 PolarHBondContact NH1-OE2 3.28Å; H1025-E1028 HydrophobicContact CB-CB 4.23Å; H1025-E1028 HydrophobicContact CB-CG 4.3Å; H1025-E1028 WeakPolarHBondContact CB-OE2 3.08Å; H1025-E1028 IonicContact CE1-OE1 2.72Å; H1025-E1028 IonicContact CE1-OE2 3.2Å; H1025-E1028 IonicContact CG-OE1 3.78Å; H1025-E1028 IonicContact CG-OE2 3.99Å; H1025-E1028 IonicContact ND1-OE1 3.73Å; H1025-E1028 PolarHBondContact ND1-OE1 3.2Å; H1025-E1028 IonicContact ND1-OE2 3.3Å; H1025-E1028 PolarHBondContact ND1-OE2 2.84Å; E1028-L1032 WeakPolarHBondContact O-CB 3.3Å; E1028-L1032 WeakPolarHBondContact O-CD1 3.45Å; E1028-L1032 WeakPolarHBondContact O-CG 3.41Å; E1028-L1032 PolarHBondContact O-N 2.77Å
1029	G	90.7	Very high	90.6	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-59.6	-52.5	173.3	0	0	0	0	0	112.8	H1025 L1026 Q1027 E1031 L1032 I1033	H1025-G1029 PolarHBondContact O-N 2.99Å; L1026-G1029 PolarHBondContact O-N 3.3Å; Q1027-G1029 PolarHBondContact O-N 2.74Å; G1029-E1031 VanDerWaalsContact C-N 3.35Å; G1029-E1031 PolarHBondContact O-N 2.82Å; G1029-L1032 PolarHBondContact O-N 3.37Å; G1029-I1033 VanDerWaalsContact O-CG1 3.25Å; G1029-I1033 WeakPolarHBondContact O-CG1 3.32Å; G1029-I1033 PolarHBondContact O-N 2.67Å
1030	F	93.1	Very high	90.8	Very high	36 Å²	36	46.2 Å²	46.2	16%	0.158	24%	0.243	C	C	.	.	H	α-helix	trans	-58.7	-46.4	178.6	-174.4	-92.6	0	0	0	111.8	L1026 Q1027 I1033 N1034 L1058 L1061 S1062 M1065	L1026-F1030 PolarHBondContact O-N 2.88Å; Q1027-F1030 PolarHBondContact O-N 3.17Å; F1030-I1033 PolarHBondContact O-N 2.87Å; F1030-N1034 VanDerWaalsContact O-CB 3.3Å; F1030-N1034 WeakPolarHBondContact O-CB 3.36Å; F1030-N1034 PolarHBondContact O-N 2.93Å; F1030-L1058 HydrophobicContact CD2-CD2 3.64Å; F1030-L1058 HydrophobicContact CE2-CB 4.42Å; F1030-L1058 HydrophobicContact CE2-CD2 3.64Å; F1030-L1058 HydrophobicContact CG-CD2 4.22Å; F1030-L1058 HydrophobicContact CZ-CD2 4.21Å; F1030-L1061 HydrophobicContact CB-CD1 4.06Å; F1030-L1061 HydrophobicContact CD2-CB 3.79Å; F1030-L1061 HydrophobicContact CD2-CD1 4.06Å; F1030-S1062 WeakPolarHBondContact CE2-OG 3.19Å; F1030-M1065 HydrophobicContact CB-CE 4.47Å; F1030-M1065 HydrophobicContact CD1-CE 4.45Å; F1030-M1065 HydrophobicContact CD2-CE 3.54Å; F1030-M1065 HydrophobicContact CE2-CE 3.75Å; F1030-M1065 HydrophobicContact CG-CE 3.91Å; F1030-M1065 HydrophobicContact CZ-CE 4.3Å
1031	E	95.3	Very high	91	Very high	106 Å²	106	43.2 Å²	43.2	50%	0.495	24%	0.235	S	C	.	.	H	α-helix	trans	-59.3	-48	177	-71	160.7	-170.1	0	0	111.5	Q1027 G1029 I1033 N1034 E1035	Q1027-E1031 WeakPolarHBondContact CG-OE1 3.33Å; Q1027-E1031 PolarHBondContact NE2-OE1 3.42Å; Q1027-E1031 WeakPolarHBondContact O-CG 3.38Å; Q1027-E1031 PolarHBondContact O-N 2.81Å; G1029-E1031 VanDerWaalsContact C-N 3.35Å; G1029-E1031 PolarHBondContact O-N 2.82Å; E1031-I1033 PolarHBondContact O-N 2.99Å; E1031-N1034 PolarHBondContact O-N 3.45Å; E1031-E1035 WeakPolarHBondContact O-CB 3.38Å; E1031-E1035 PolarHBondContact O-N 3.05Å
1032	L	95.6	Very high	91.1	Very high	39 Å²	39	44.7 Å²	44.7	20%	0.204	25%	0.253	C	S	.	.	H	α-helix	trans	-65.8	-35.6	177.9	-73.7	168.2	0	0	0	113.9	Y1013 T1016 R1020 E1028 G1029 A1036	Y1013-L1032 HydrophobicContact CD1-CD2 3.85Å; Y1013-L1032 HydrophobicContact CE1-CD2 4.35Å; T1016-L1032 HydrophobicContact CG2-CD1 4.07Å; R1020-L1032 HydrophobicContact CB-CD1 4.43Å; R1020-L1032 HydrophobicContact CG-CD1 3.81Å; E1028-L1032 WeakPolarHBondContact O-CB 3.3Å; E1028-L1032 WeakPolarHBondContact O-CD1 3.45Å; E1028-L1032 WeakPolarHBondContact O-CG 3.41Å; E1028-L1032 PolarHBondContact O-N 2.77Å; G1029-L1032 PolarHBondContact O-N 3.37Å; L1032-A1036 VanDerWaalsContact O-CB 3.31Å; L1032-A1036 WeakPolarHBondContact O-CB 3.3Å; L1032-A1036 PolarHBondContact O-N 2.83Å
1033	I	94.7	Very high	91.5	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-75.8	-33.6	176.9	-60.2	-58.9	0	0	0	111.2	F1014 I1021 G1029 F1030 E1031 A1036 L1037 C1054 L1057 L1058	F1014-I1033 HydrophobicContact CD2-CD1 3.63Å; F1014-I1033 HydrophobicContact CE2-CD1 4.15Å; F1014-I1033 HydrophobicContact CG-CD1 4.37Å; F1014-I1033 VanDerWaalsContact O-CD1 3.22Å; F1014-I1033 WeakPolarHBondContact O-CD1 3.35Å; I1021-I1033 HydrophobicContact CD1-CG1 3.97Å; G1029-I1033 VanDerWaalsContact O-CG1 3.25Å; G1029-I1033 WeakPolarHBondContact O-CG1 3.32Å; G1029-I1033 PolarHBondContact O-N 2.67Å; F1030-I1033 PolarHBondContact O-N 2.87Å; E1031-I1033 PolarHBondContact O-N 2.99Å; I1033-A1036 PolarHBondContact O-N 3.11Å; I1033-L1037 WeakPolarHBondContact O-CB 3.39Å; I1033-L1037 PolarHBondContact O-N 2.84Å; I1033-C1054 HydrophobicContact CG2-CB 4.09Å; I1033-L1057 HydrophobicContact CD1-CD2 3.64Å; I1033-L1057 HydrophobicContact CG1-CD2 3.77Å; I1033-L1057 HydrophobicContact CG1-CG 4.28Å; I1033-L1057 HydrophobicContact CG2-CB 4.38Å; I1033-L1057 HydrophobicContact CG2-CD2 4.39Å; I1033-L1057 HydrophobicContact CG2-CG 4.46Å; I1033-L1058 HydrophobicContact CB-CD2 4.01Å; I1033-L1058 HydrophobicContact CB-CG 4.5Å; I1033-L1058 HydrophobicContact CG2-CD1 4.43Å; I1033-L1058 HydrophobicContact CG2-CD2 3.83Å; I1033-L1058 HydrophobicContact CG2-CG 3.77Å
1034	N	94.5	Very high	91.8	Very high	72 Å²	72	41.1 Å²	41.1	39%	0.385	22%	0.223	S	C	.	.	H	α-helix	trans	-71.3	-39.4	175.2	-169.2	74.7	0	0	0	111.6	F1030 E1031 L1037 S1038 L1058	F1030-N1034 VanDerWaalsContact O-CB 3.3Å; F1030-N1034 WeakPolarHBondContact O-CB 3.36Å; F1030-N1034 PolarHBondContact O-N 2.93Å; E1031-N1034 PolarHBondContact O-N 3.45Å; N1034-L1037 WeakPolarHBondContact O-CB 3.33Å; N1034-L1037 PolarHBondContact O-N 3.1Å; N1034-S1038 PolarHBondContact O-N 3.13Å; N1034-L1058 HydrophobicContact CB-CD2 4.22Å
1035	E	94.1	Very high	92.1	Very high	84 Å²	84	41.3 Å²	41.3	39%	0.393	23%	0.225	S	C	.	.	H	α-helix	trans	-60.7	-49.3	169.9	-174.4	64	-171.3	0	0	110.7	Y1013 E1031 L1037 S1038 L1039	Y1013-E1035 HydrophobicContact CD1-CB 4.34Å; Y1013-E1035 HydrophobicContact CD1-CG 3.83Å; Y1013-E1035 HydrophobicContact CE1-CG 3.87Å; E1031-E1035 WeakPolarHBondContact O-CB 3.38Å; E1031-E1035 PolarHBondContact O-N 3.05Å; E1035-L1037 VanDerWaalsContact C-N 3.28Å; E1035-L1037 PolarHBondContact O-N 3.27Å; E1035-S1038 WeakPolarHBondContact O-CB 3.15Å; E1035-S1038 PolarHBondContact O-N 3.26Å; E1035-L1039 HydrophobicContact CG-CD1 4.27Å; E1035-L1039 HydrophobicContact CG-CG 4.5Å; E1035-L1039 WeakPolarHBondContact O-CG 3.3Å; E1035-L1039 PolarHBondContact O-N 2.97Å
1036	A	94.6	Very high	92.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-55.9	-41.7	174.5	0	0	0	0	0	112.3	F1014 L1032 I1033 S1038 L1039 L1040	F1014-A1036 HydrophobicContact CB-CB 3.93Å; L1032-A1036 VanDerWaalsContact O-CB 3.31Å; L1032-A1036 WeakPolarHBondContact O-CB 3.3Å; L1032-A1036 PolarHBondContact O-N 2.83Å; I1033-A1036 PolarHBondContact O-N 3.11Å; A1036-S1038 PolarHBondContact O-N 3.11Å; A1036-L1039 PolarHBondContact O-N 3Å; A1036-L1040 HydrophobicContact CB-CD1 4.46Å; A1036-L1040 VanDerWaalsContact O-CB 3.27Å; A1036-L1040 WeakPolarHBondContact O-CB 3.41Å; A1036-L1040 VanDerWaalsContact O-CD1 3.3Å; A1036-L1040 WeakPolarHBondContact O-CD1 3.47Å; A1036-L1040 WeakPolarHBondContact O-CG 3.4Å; A1036-L1040 PolarHBondContact O-N 3.15Å
1037	L	95	Very high	92.3	Very high	11 Å²	11	37.9 Å²	37.9	6%	0.058	21%	0.212	C	C	.	.	H	α-helix	trans	-59.4	-44.1	175	175.5	59.4	0	0	0	112	I1033 N1034 E1035 N1041 I1051 C1054 N1055 L1058	I1033-L1037 WeakPolarHBondContact O-CB 3.39Å; I1033-L1037 PolarHBondContact O-N 2.84Å; N1034-L1037 WeakPolarHBondContact O-CB 3.33Å; N1034-L1037 PolarHBondContact O-N 3.1Å; E1035-L1037 VanDerWaalsContact C-N 3.28Å; E1035-L1037 PolarHBondContact O-N 3.27Å; L1037-N1041 WeakPolarHBondContact O-CB 3.24Å; L1037-N1041 VanDerWaalsContact O-CG 3.27Å; L1037-N1041 PolarHBondContact O-N 3.01Å; L1037-N1041 PolarHBondContact O-ND2 3.05Å; L1037-I1051 HydrophobicContact CD1-CB 4.43Å; L1037-I1051 HydrophobicContact CD1-CG2 3.64Å; L1037-C1054 HydrophobicContact CB-CB 4.06Å; L1037-C1054 HydrophobicContact CD1-CB 4.2Å; L1037-N1055 WeakPolarHBondContact CD1-ND2 3.22Å; L1037-L1058 HydrophobicContact CD2-CD1 3.61Å
1038	S	93.7	Very high	92.3	Very high	71 Å²	71	33.4 Å²	33.4	50%	0.497	19%	0.191	S	C	.	.	H	α-helix	trans	-60.2	-51.3	175.6	-167.3	0	0	0	0	111.6	N1034 E1035 A1036 L1040 N1041 G1042	N1034-S1038 PolarHBondContact O-N 3.13Å; E1035-S1038 WeakPolarHBondContact O-CB 3.15Å; E1035-S1038 PolarHBondContact O-N 3.26Å; A1036-S1038 PolarHBondContact O-N 3.11Å; S1038-L1040 PolarHBondContact O-N 2.96Å; S1038-N1041 WeakPolarHBondContact O-CB 3.25Å; S1038-N1041 PolarHBondContact O-N 3.28Å; S1038-G1042 PolarHBondContact O-N 3.04Å
1039	L	92.6	Very high	92.3	Very high	23 Å²	23	31.9 Å²	31.9	12%	0.12	19%	0.188	C	C	.	.	H	α-helix	trans	-63	-41.2	-179.6	-60.3	-179.5	0	0	0	112.5	L368 A1010 Y1013 E1035 A1036 G1042 V1043	L368-L1039 HydrophobicContact CD1-CD2 3.72Å; L368-L1039 HydrophobicContact CD2-CB 4.29Å; L368-L1039 HydrophobicContact CD2-CD2 4.42Å; A1010-L1039 HydrophobicContact CB-CB 3.59Å; A1010-L1039 HydrophobicContact CB-CD1 4.47Å; Y1013-L1039 HydrophobicContact CD2-CD1 3.8Å; Y1013-L1039 HydrophobicContact CE2-CD1 3.98Å; Y1013-L1039 HydrophobicContact CG-CD1 4.18Å; E1035-L1039 HydrophobicContact CG-CD1 4.27Å; E1035-L1039 HydrophobicContact CG-CG 4.5Å; E1035-L1039 WeakPolarHBondContact O-CG 3.3Å; E1035-L1039 PolarHBondContact O-N 2.97Å; A1036-L1039 PolarHBondContact O-N 3Å; L1039-G1042 PolarHBondContact O-N 2.95Å; L1039-V1043 WeakPolarHBondContact O-CG2 3.49Å; L1039-V1043 PolarHBondContact O-N 3.13Å; L1039-V1043 VanDerWaalsContact O-N 3.11Å
1040	L	93.1	Very high	92.4	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-67.7	-39.4	177.2	-67.1	163.7	0	0	0	111.7	A1007 A1010 A1036 S1038 G1042 V1043 Y1044 D1050 I1051 C1054	A1007-L1040 HydrophobicContact CB-CD2 3.94Å; A1010-L1040 HydrophobicContact CB-CD2 3.77Å; A1010-L1040 HydrophobicContact CB-CG 3.93Å; A1036-L1040 HydrophobicContact CB-CD1 4.46Å; A1036-L1040 VanDerWaalsContact O-CB 3.27Å; A1036-L1040 WeakPolarHBondContact O-CB 3.41Å; A1036-L1040 VanDerWaalsContact O-CD1 3.3Å; A1036-L1040 WeakPolarHBondContact O-CD1 3.47Å; A1036-L1040 WeakPolarHBondContact O-CG 3.4Å; A1036-L1040 PolarHBondContact O-N 3.15Å; S1038-L1040 PolarHBondContact O-N 2.96Å; L1040-G1042 VanDerWaalsContact C-N 3.33Å; L1040-V1043 PolarHBondContact O-N 3.13Å; L1040-Y1044 HydrophobicContact CB-CD2 4.25Å; L1040-Y1044 HydrophobicContact CD2-CD2 4.06Å; L1040-Y1044 HydrophobicContact CD2-CE2 3.51Å; L1040-Y1044 PolarHBondContact O-N 2.88Å; L1040-D1050 HydrophobicContact CD1-CB 4.07Å; L1040-D1050 HydrophobicContact CD2-CB 4.22Å; L1040-I1051 HydrophobicContact CB-CD1 4.32Å; L1040-I1051 HydrophobicContact CB-CG1 3.72Å; L1040-C1054 WeakPolarHBondContact CD1-SG 3.27Å
1041	N	91.7	Very high	92.5	Very high	45 Å²	45	31 Å²	31	24%	0.241	19%	0.185	C	C	.	.	H	α-helix	trans	-60	-43.1	172.3	-80.8	-27.9	0	0	0	111.3	L1037 S1038 V1043 G1045 I1051	L1037-N1041 WeakPolarHBondContact O-CB 3.24Å; L1037-N1041 VanDerWaalsContact O-CG 3.27Å; L1037-N1041 PolarHBondContact O-N 3.01Å; L1037-N1041 PolarHBondContact O-ND2 3.05Å; S1038-N1041 WeakPolarHBondContact O-CB 3.25Å; S1038-N1041 PolarHBondContact O-N 3.28Å; N1041-V1043 VanDerWaalsContact C-N 3.34Å; N1041-V1043 PolarHBondContact O-N 3.45Å; N1041-G1045 VanDerWaalsContact O-CA 3.24Å; N1041-G1045 WeakPolarHBondContact O-CA 3.46Å; N1041-G1045 PolarHBondContact O-N 3.1Å; N1041-I1051 WeakPolarHBondContact OD1-CD1 3.35Å
1042	G	87.6	Confident	92.4	Very high	44 Å²	44	26.3 Å²	26.3	45%	0.454	16%	0.164	S	C	.	.	H	α-helix	trans	-63.8	-34.6	178	0	0	0	0	0	113.9	R372 S1038 L1039 L1040	R372-G1042 WeakPolarHBondContact CD-O 3.21Å; R372-G1042 WeakPolarHBondContact CG-O 3.08Å; R372-G1042 PolarHBondContact NE-O 3.45Å; S1038-G1042 PolarHBondContact O-N 3.04Å; L1039-G1042 PolarHBondContact O-N 2.95Å; L1040-G1042 VanDerWaalsContact C-N 3.33Å
1043	V	90.2	Very high	92.2	Very high	5 Å²	5	25 Å²	25	3%	0.03	16%	0.159	C	C	.	.	H	α-helix	trans	-82.9	-50	179.6	172	0	0	0	0	112.9	L368 D371 A1007 L1039 L1040 N1041	L368-V1043 HydrophobicContact CB-CG2 4.5Å; L368-V1043 HydrophobicContact CD2-CG2 3.98Å; D371-V1043 HydrophobicContact CB-CG1 3.95Å; D371-V1043 HydrophobicContact CB-CG2 4.26Å; A1007-V1043 HydrophobicContact CB-CB 4.04Å; A1007-V1043 HydrophobicContact CB-CG1 3.69Å; A1007-V1043 HydrophobicContact CB-CG2 4.19Å; L1039-V1043 WeakPolarHBondContact O-CG2 3.49Å; L1039-V1043 PolarHBondContact O-N 3.13Å; L1039-V1043 VanDerWaalsContact O-N 3.11Å; L1040-V1043 PolarHBondContact O-N 3.13Å; N1041-V1043 VanDerWaalsContact C-N 3.34Å; N1041-V1043 PolarHBondContact O-N 3.45Å
1044	Y	90.5	Very high	92.2	Very high	14 Å²	14	25 Å²	25	6%	0.055	16%	0.159	C	C	.	.	H	α-helix	trans	-98.3	-17	-170.7	-57.4	-53.3	0	0	0	114.6	F375 H1006 A1007 L1040 H1048 D1050 I1051	F375-Y1044 HydrophobicContact CB-CD1 4.45Å; F375-Y1044 AromaticContact CD1-CD1 3.88Å; F375-Y1044 HydrophobicContact CD1-CD1 3.88Å; F375-Y1044 AromaticContact CD2-CD1 3.52Å; F375-Y1044 HydrophobicContact CD2-CD1 3.52Å; F375-Y1044 AromaticContact CD2-CE1 3.7Å; F375-Y1044 HydrophobicContact CD2-CE1 3.7Å; F375-Y1044 AromaticContact CE1-CD1 3.92Å; F375-Y1044 HydrophobicContact CE1-CD1 3.92Å; F375-Y1044 HydrophobicContact CE1-CG 4.49Å; F375-Y1044 AromaticContact CE2-CD1 3.55Å; F375-Y1044 HydrophobicContact CE2-CD1 3.55Å; F375-Y1044 AromaticContact CE2-CE1 3.9Å; F375-Y1044 HydrophobicContact CE2-CE1 3.9Å; F375-Y1044 AromaticContact CG-CD1 3.68Å; F375-Y1044 HydrophobicContact CG-CD1 3.68Å; F375-Y1044 HydrophobicContact CG-CE1 4.17Å; F375-Y1044 AromaticContact CZ-CD1 3.75Å; F375-Y1044 HydrophobicContact CZ-CD1 3.75Å; F375-Y1044 HydrophobicContact CZ-CG 4.4Å; H1006-Y1044 WeakPolarHBondContact CA-OH 3.21Å; A1007-Y1044 HydrophobicContact CB-CE1 4.18Å; A1007-Y1044 HydrophobicContact CB-CE2 3.94Å; A1007-Y1044 PolarHBondContact N-OH 3.34Å; L1040-Y1044 HydrophobicContact CB-CD2 4.25Å; L1040-Y1044 HydrophobicContact CD2-CD2 4.06Å; L1040-Y1044 HydrophobicContact CD2-CE2 3.51Å; L1040-Y1044 PolarHBondContact O-N 2.88Å; Y1044-H1048 AromaticContact CD1-CD2 3.76Å; Y1044-H1048 AromaticContact CD1-NE2 3.81Å; Y1044-H1048 HydrophobicContact CD2-CB 3.7Å; Y1044-H1048 AromaticContact CD2-CD2 3.77Å; Y1044-H1048 AromaticContact CD2-CE1 3.82Å; Y1044-H1048 AromaticContact CD2-CG 3.32Å; Y1044-H1048 AromaticContact CD2-ND1 3.35Å; Y1044-H1048 WeakPolarHBondContact CD2-ND1 3.28Å; Y1044-H1048 AromaticContact CE1-CE1 3.76Å; Y1044-H1048 AromaticContact CE1-NE2 3.59Å; Y1044-H1048 HydrophobicContact CE2-CB 4.38Å; Y1044-H1048 AromaticContact CE2-CE1 3.28Å; Y1044-H1048 WeakPolarHBondContact CE2-CE1 3.48Å; Y1044-H1048 AromaticContact CE2-CG 3.61Å; Y1044-H1048 AromaticContact CE2-ND1 3.1Å; Y1044-H1048 WeakPolarHBondContact CE2-ND1 3.4Å; Y1044-H1048 AromaticContact CE2-NE2 3.84Å; Y1044-H1048 HydrophobicContact CG-CB 3.99Å; Y1044-H1048 AromaticContact CG-CD2 3.59Å; Y1044-H1048 AromaticContact CG-CG 3.6Å; Y1044-H1048 AromaticContact CZ-CE1 3.22Å; Y1044-H1048 AromaticContact CZ-ND1 3.6Å; Y1044-H1048 AromaticContact CZ-NE2 3.57Å; Y1044-H1048 PolarHBondContact OH-CE1 2.86Å; Y1044-D1050 HydrophobicContact CE2-CB 4.5Å; Y1044-D1050 WeakPolarHBondContact CE2-OD2 3.48Å; Y1044-D1050 PolarHBondContact OH-OD2 3.15Å; Y1044-I1051 HydrophobicContact CD2-CD1 4.4Å
1045	G	87.4	Confident	92.2	Very high	26 Å²	26	21.8 Å²	21.8	27%	0.268	14%	0.142	S	C	.	.			trans	74.3	177.2	-158.1	0	0	0	0	0	112.1	N1041 L1047 I1051	N1041-G1045 VanDerWaalsContact O-CA 3.24Å; N1041-G1045 WeakPolarHBondContact O-CA 3.46Å; N1041-G1045 PolarHBondContact O-N 3.1Å; G1045-L1047 PolarHBondContact O-N 2.88Å; G1045-I1051 WeakPolarHBondContact O-CD1 3.19Å
1046	P	89.1	Confident	92.1	Very high	39 Å²	39	20.2 Å²	20.2	25%	0.253	13%	0.132	S	C	.	.	S	Bend	trans	-72.9	-0.4	-163.1	28.7	-37.1	0	0	0	116.5	F302 V305	F302-P1046 HydrophobicContact CD1-CB 4.43Å; F302-P1046 HydrophobicContact CE1-CB 3.91Å; V305-P1046 HydrophobicContact CG1-CG 3.99Å
1047	L	91.5	Very high	92	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.01	14%	0.138	C	C	.	.			trans	-126.8	80.7	-171.6	-65.1	-179.9	0	0	0	111.7	F302 V305 T307 G1045 I1081 R1084 V1085	F302-L1047 HydrophobicContact CB-CD2 4.09Å; F302-L1047 HydrophobicContact CD1-CD2 4.43Å; F302-L1047 HydrophobicContact CD2-CD2 4.3Å; F302-L1047 HydrophobicContact CG-CD2 4.04Å; V305-L1047 HydrophobicContact CG1-CD1 4.45Å; V305-L1047 VanDerWaalsContact O-CD1 3.26Å; V305-L1047 WeakPolarHBondContact O-CD1 3.12Å; T307-L1047 HydrophobicContact CG2-CD1 3.82Å; G1045-L1047 PolarHBondContact O-N 2.88Å; L1047-I1081 HydrophobicContact CD2-CG1 4.07Å; L1047-R1084 HydrophobicContact CD2-CB 4.4Å; L1047-V1085 HydrophobicContact CB-CG2 4.22Å
1048	H	92.7	Very high	92	Very high	13 Å²	13	20.9 Å²	20.9	6%	0.06	14%	0.136	C	C	.	.			trans	-137.4	148.9	176.4	-159	-102.2	0	0	0	111.5	Y309 F375 Y1044 D1050 I1051 G1052 I1081	Y309-H1048 AromaticContact CZ-CD2 3.97Å; Y309-H1048 PolarHBondContact OH-CD2 3.06Å; Y309-H1048 PolarHBondContact OH-NE2 3.05Å; F375-H1048 AromaticContact CE2-NE2 3.92Å; F375-H1048 AromaticContact CZ-CD2 4Å; Y1044-H1048 AromaticContact CD1-CD2 3.76Å; Y1044-H1048 AromaticContact CD1-NE2 3.81Å; Y1044-H1048 HydrophobicContact CD2-CB 3.7Å; Y1044-H1048 AromaticContact CD2-CD2 3.77Å; Y1044-H1048 AromaticContact CD2-CE1 3.82Å; Y1044-H1048 AromaticContact CD2-CG 3.32Å; Y1044-H1048 AromaticContact CD2-ND1 3.35Å; Y1044-H1048 WeakPolarHBondContact CD2-ND1 3.28Å; Y1044-H1048 AromaticContact CE1-CE1 3.76Å; Y1044-H1048 AromaticContact CE1-NE2 3.59Å; Y1044-H1048 HydrophobicContact CE2-CB 4.38Å; Y1044-H1048 AromaticContact CE2-CE1 3.28Å; Y1044-H1048 WeakPolarHBondContact CE2-CE1 3.48Å; Y1044-H1048 AromaticContact CE2-CG 3.61Å; Y1044-H1048 AromaticContact CE2-ND1 3.1Å; Y1044-H1048 WeakPolarHBondContact CE2-ND1 3.4Å; Y1044-H1048 AromaticContact CE2-NE2 3.84Å; Y1044-H1048 HydrophobicContact CG-CB 3.99Å; Y1044-H1048 AromaticContact CG-CD2 3.59Å; Y1044-H1048 AromaticContact CG-CG 3.6Å; Y1044-H1048 AromaticContact CZ-CE1 3.22Å; Y1044-H1048 AromaticContact CZ-ND1 3.6Å; Y1044-H1048 AromaticContact CZ-NE2 3.57Å; Y1044-H1048 PolarHBondContact OH-CE1 2.86Å; H1048-D1050 VanDerWaalsContact C-N 3.28Å; H1048-D1050 IonicContact CE1-OD2 3.81Å; H1048-D1050 PolarHBondContact CE1-OD2 3.17Å; H1048-D1050 IonicContact ND1-OD2 2.84Å; H1048-D1050 PolarHBondContact ND1-OD2 2.74Å; H1048-D1050 PolarHBondContact O-N 2.84Å; H1048-I1051 HydrophobicContact CB-CB 4.33Å; H1048-I1051 HydrophobicContact CB-CD1 3.66Å; H1048-I1051 HydrophobicContact CB-CG1 3.96Å; H1048-I1051 WeakPolarHBondContact O-CB 3.49Å; H1048-I1051 PolarHBondContact O-N 2.86Å; H1048-I1051 VanDerWaalsContact O-N 3.14Å; H1048-G1052 PolarHBondContact O-N 3.45Å; H1048-G1052 VanDerWaalsContact O-N 3.16Å; H1048-I1081 WeakPolarHBondContact O-CG2 3.37Å
1049	P	91.5	Very high	91.9	Very high	40 Å²	40	17.5 Å²	17.5	26%	0.26	11%	0.112	S	C	.	.	H	α-helix	trans	-56.4	-39.4	178.1	-26.7	36.3	0	0	0	113.6	Y309 I1051 G1052 A1053 V1085	Y309-P1049 WeakPolarHBondContact OH-CD 3.44Å; P1049-I1051 VanDerWaalsContact C-N 3.34Å; P1049-I1051 PolarHBondContact O-N 3.42Å; P1049-G1052 PolarHBondContact O-N 2.8Å; P1049-A1053 PolarHBondContact O-N 2.81Å; P1049-V1085 HydrophobicContact CG-CG1 3.76Å
1050	D	91.8	Very high	91.7	Very high	16 Å²	16	18.9 Å²	18.9	9%	0.086	12%	0.116	C	C	.	.	H	α-helix	trans	-65.2	-36.8	179.1	-53.2	-34.7	0	0	0	112.1	L1040 Y1044 H1048 G1052 A1053 C1054	L1040-D1050 HydrophobicContact CD1-CB 4.07Å; L1040-D1050 HydrophobicContact CD2-CB 4.22Å; Y1044-D1050 HydrophobicContact CE2-CB 4.5Å; Y1044-D1050 WeakPolarHBondContact CE2-OD2 3.48Å; Y1044-D1050 PolarHBondContact OH-OD2 3.15Å; H1048-D1050 VanDerWaalsContact C-N 3.28Å; H1048-D1050 IonicContact CE1-OD2 3.81Å; H1048-D1050 PolarHBondContact CE1-OD2 3.17Å; H1048-D1050 IonicContact ND1-OD2 2.84Å; H1048-D1050 PolarHBondContact ND1-OD2 2.74Å; H1048-D1050 PolarHBondContact O-N 2.84Å; D1050-G1052 VanDerWaalsContact C-N 3.33Å; D1050-A1053 CarbonylContact O-C 3.55Å; D1050-A1053 WeakPolarHBondContact O-CA 3.44Å; D1050-A1053 WeakPolarHBondContact O-CB 3.36Å; D1050-A1053 PolarHBondContact O-N 3.15Å; D1050-A1053 VanDerWaalsContact O-N 3.1Å; D1050-C1054 PolarHBondContact O-N 3.38Å; D1050-C1054 PolarHBondContact O-SG 3.26Å
1051	I	94.3	Very high	91.5	Very high	2 Å²	2	19 Å²	19	1%	0.01	12%	0.116	C	C	.	.	H	α-helix	trans	-65.8	-39.8	176.2	-65.3	170	0	0	0	109.7	L1037 L1040 N1041 Y1044 G1045 H1048 P1049 A1053 C1054 N1055 I1081	L1037-I1051 HydrophobicContact CD1-CB 4.43Å; L1037-I1051 HydrophobicContact CD1-CG2 3.64Å; L1040-I1051 HydrophobicContact CB-CD1 4.32Å; L1040-I1051 HydrophobicContact CB-CG1 3.72Å; N1041-I1051 WeakPolarHBondContact OD1-CD1 3.35Å; Y1044-I1051 HydrophobicContact CD2-CD1 4.4Å; G1045-I1051 WeakPolarHBondContact O-CD1 3.19Å; H1048-I1051 HydrophobicContact CB-CB 4.33Å; H1048-I1051 HydrophobicContact CB-CD1 3.66Å; H1048-I1051 HydrophobicContact CB-CG1 3.96Å; H1048-I1051 WeakPolarHBondContact O-CB 3.49Å; H1048-I1051 PolarHBondContact O-N 2.86Å; H1048-I1051 VanDerWaalsContact O-N 3.14Å; P1049-I1051 VanDerWaalsContact C-N 3.34Å; P1049-I1051 PolarHBondContact O-N 3.42Å; I1051-A1053 VanDerWaalsContact C-N 3.34Å; I1051-C1054 PolarHBondContact O-N 3.13Å; I1051-N1055 PolarHBondContact O-N 2.77Å; I1051-N1055 PolarHBondContact O-ND2 2.82Å; I1051-I1081 HydrophobicContact CG2-CD1 3.84Å
1052	G	93.2	Very high	91.5	Very high	6 Å²	6	16.8 Å²	16.8	6%	0.062	11%	0.105	C	C	.	.	H	α-helix	trans	-59.9	-43	169.3	0	0	0	0	0	112.2	H1048 P1049 D1050 N1055 R1056	H1048-G1052 PolarHBondContact O-N 3.45Å; H1048-G1052 VanDerWaalsContact O-N 3.16Å; P1049-G1052 PolarHBondContact O-N 2.8Å; D1050-G1052 VanDerWaalsContact C-N 3.33Å; G1052-N1055 PolarHBondContact O-N 2.82Å; G1052-R1056 WeakPolarHBondContact O-CB 3.23Å; G1052-R1056 PolarHBondContact O-N 3.13Å
1053	A	91.9	Very high	91.5	Very high	12 Å²	12	15.5 Å²	15.5	10%	0.099	9%	0.086	C	C	.	.	H	α-helix	trans	-65.7	-37.5	177.3	0	0	0	0	0	113.4	F1014 P1049 D1050 I1051 L1057	F1014-A1053 HydrophobicContact CE2-CB 4.34Å; F1014-A1053 HydrophobicContact CZ-CB 3.84Å; P1049-A1053 PolarHBondContact O-N 2.81Å; D1050-A1053 CarbonylContact O-C 3.55Å; D1050-A1053 WeakPolarHBondContact O-CA 3.44Å; D1050-A1053 WeakPolarHBondContact O-CB 3.36Å; D1050-A1053 PolarHBondContact O-N 3.15Å; D1050-A1053 VanDerWaalsContact O-N 3.1Å; I1051-A1053 VanDerWaalsContact C-N 3.34Å; A1053-L1057 WeakPolarHBondContact O-CB 3.31Å; A1053-L1057 PolarHBondContact O-N 3.43Å
1054	C	94.3	Very high	91.2	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-62.2	-54.5	170.9	-71.6	0	0	0	0	111.4	F1014 I1033 L1037 L1040 D1050 I1051 R1056 L1057 L1058	F1014-C1054 WeakPolarHBondContact CD2-SG 3.5Å; I1033-C1054 HydrophobicContact CG2-CB 4.09Å; L1037-C1054 HydrophobicContact CB-CB 4.06Å; L1037-C1054 HydrophobicContact CD1-CB 4.2Å; L1040-C1054 WeakPolarHBondContact CD1-SG 3.27Å; D1050-C1054 PolarHBondContact O-N 3.38Å; D1050-C1054 PolarHBondContact O-SG 3.26Å; I1051-C1054 PolarHBondContact O-N 3.13Å; C1054-R1056 VanDerWaalsContact C-N 3.33Å; C1054-R1056 PolarHBondContact O-N 3.03Å; C1054-L1057 PolarHBondContact O-N 3.09Å; C1054-L1058 WeakPolarHBondContact O-CG 3.44Å; C1054-L1058 PolarHBondContact O-N 2.81Å
1055	N	95.3	Very high	90.9	Very high	4 Å²	4	19.3 Å²	19.3	2%	0.021	11%	0.107	C	C	.	.	H	α-helix	trans	-54.5	-48.3	179.4	-85	-93.8	0	0	0	111.3	L1037 I1051 G1052 L1057 L1058 A1059 F1074 R1077 A1078	L1037-N1055 WeakPolarHBondContact CD1-ND2 3.22Å; I1051-N1055 PolarHBondContact O-N 2.77Å; I1051-N1055 PolarHBondContact O-ND2 2.82Å; G1052-N1055 PolarHBondContact O-N 2.82Å; N1055-L1057 VanDerWaalsContact C-N 3.26Å; N1055-L1057 PolarHBondContact O-N 3.32Å; N1055-L1058 PolarHBondContact O-N 3.35Å; N1055-A1059 WeakPolarHBondContact O-CB 3.2Å; N1055-A1059 PolarHBondContact O-N 2.79Å; N1055-F1074 WeakPolarHBondContact CB-O 3.48Å; N1055-F1074 WeakPolarHBondContact O-CB 3.46Å; N1055-R1077 WeakPolarHBondContact OD1-CB 3.47Å; N1055-R1077 WeakPolarHBondContact OD1-CD 3.44Å; N1055-A1078 HydrophobicContact CB-CB 3.94Å
1056	R	92.8	Very high	90.8	Very high	52 Å²	52	20.1 Å²	20.1	20%	0.196	12%	0.115	C	C	.	.	H	α-helix	trans	-60.9	-29.4	177.6	-173.3	176.7	68.4	-165	-1	114.1	N680 G1052 C1054 R1060 A1078 E1096	N680-R1056 VanDerWaalsContact CG-NE 3.28Å; N680-R1056 VanDerWaalsContact ND2-CD 3.26Å; N680-R1056 WeakPolarHBondContact ND2-CD 3.44Å; N680-R1056 PolarHBondContact ND2-NE 2.64Å; N680-R1056 WeakPolarHBondContact OD1-CD 3.26Å; N680-R1056 PolarHBondContact OD1-NE 3.15Å; N680-R1056 PolarHBondContact OD1-NH1 3.11Å; G1052-R1056 WeakPolarHBondContact O-CB 3.23Å; G1052-R1056 PolarHBondContact O-N 3.13Å; C1054-R1056 VanDerWaalsContact C-N 3.33Å; C1054-R1056 PolarHBondContact O-N 3.03Å; R1056-R1060 PolarHBondContact O-N 3.29Å; R1056-A1078 HydrophobicContact CB-CB 3.98Å; R1056-E1096 WeakPolarHBondContact CD-OE1 3.35Å; R1056-E1096 WeakPolarHBondContact CD-OE2 3.32Å; R1056-E1096 IonicContact CZ-OE1 3.37Å; R1056-E1096 IonicContact NE-OE1 2.73Å; R1056-E1096 IonicContact NH1-OE1 3.5Å; R1056-E1096 PolarHBondContact NH1-OE1 3.11Å
1057	L	91.3	Very high	90.8	Very high	24 Å²	24	22.5 Å²	22.5	13%	0.126	12%	0.123	C	C	.	.	H	α-helix	trans	-82.4	-40.6	175.4	-175.7	53.2	0	0	0	112	F1014 Q1018 I1021 I1033 A1053 C1054 N1055 A1059 R1060 L1061	F1014-L1057 HydrophobicContact CE2-CD2 4.15Å; Q1018-L1057 HydrophobicContact CG-CD2 3.79Å; I1021-L1057 HydrophobicContact CD1-CD1 4.14Å; I1021-L1057 HydrophobicContact CD1-CD2 3.92Å; I1021-L1057 HydrophobicContact CD1-CG 4.11Å; I1033-L1057 HydrophobicContact CD1-CD2 3.64Å; I1033-L1057 HydrophobicContact CG1-CD2 3.77Å; I1033-L1057 HydrophobicContact CG1-CG 4.28Å; I1033-L1057 HydrophobicContact CG2-CB 4.38Å; I1033-L1057 HydrophobicContact CG2-CD2 4.39Å; I1033-L1057 HydrophobicContact CG2-CG 4.46Å; A1053-L1057 WeakPolarHBondContact O-CB 3.31Å; A1053-L1057 PolarHBondContact O-N 3.43Å; C1054-L1057 PolarHBondContact O-N 3.09Å; N1055-L1057 VanDerWaalsContact C-N 3.26Å; N1055-L1057 PolarHBondContact O-N 3.32Å; L1057-A1059 VanDerWaalsContact C-N 3.3Å; L1057-A1059 PolarHBondContact O-N 3.3Å; L1057-R1060 PolarHBondContact O-N 3.37Å; L1057-L1061 HydrophobicContact CG-CD1 4.47Å; L1057-L1061 WeakPolarHBondContact O-CG 3.48Å; L1057-L1061 PolarHBondContact O-N 3.35Å
1058	L	94.8	Very high	90.5	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.1	-41.8	170.3	-66.5	170.6	0	0	0	111.1	F1030 I1033 N1034 L1037 C1054 N1055 R1060 L1061 S1062 F1074	F1030-L1058 HydrophobicContact CD2-CD2 3.64Å; F1030-L1058 HydrophobicContact CE2-CB 4.42Å; F1030-L1058 HydrophobicContact CE2-CD2 3.64Å; F1030-L1058 HydrophobicContact CG-CD2 4.22Å; F1030-L1058 HydrophobicContact CZ-CD2 4.21Å; I1033-L1058 HydrophobicContact CB-CD2 4.01Å; I1033-L1058 HydrophobicContact CB-CG 4.5Å; I1033-L1058 HydrophobicContact CG2-CD1 4.43Å; I1033-L1058 HydrophobicContact CG2-CD2 3.83Å; I1033-L1058 HydrophobicContact CG2-CG 3.77Å; N1034-L1058 HydrophobicContact CB-CD2 4.22Å; L1037-L1058 HydrophobicContact CD2-CD1 3.61Å; C1054-L1058 WeakPolarHBondContact O-CG 3.44Å; C1054-L1058 PolarHBondContact O-N 2.81Å; N1055-L1058 PolarHBondContact O-N 3.35Å; L1058-R1060 VanDerWaalsContact C-N 3.3Å; L1058-R1060 PolarHBondContact O-N 3.49Å; L1058-L1061 PolarHBondContact O-N 2.91Å; L1058-L1061 VanDerWaalsContact O-N 3.1Å; L1058-S1062 WeakPolarHBondContact O-CB 3.45Å; L1058-S1062 PolarHBondContact O-N 3.08Å; L1058-F1074 HydrophobicContact CB-CD1 4.14Å; L1058-F1074 HydrophobicContact CB-CD2 3.83Å; L1058-F1074 HydrophobicContact CB-CE1 4.25Å; L1058-F1074 HydrophobicContact CB-CE2 3.95Å; L1058-F1074 HydrophobicContact CB-CG 3.94Å; L1058-F1074 HydrophobicContact CB-CZ 4.16Å; L1058-F1074 HydrophobicContact CD1-CD1 4.22Å; L1058-F1074 HydrophobicContact CD1-CE1 3.81Å; L1058-F1074 HydrophobicContact CD1-CZ 4.07Å
1059	A	91.5	Very high	90.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-55.1	-44.8	174.7	0	0	0	0	0	112.4	N1055 L1057 Y1063 A1071 F1074 Q1075 Y1103	N1055-A1059 WeakPolarHBondContact O-CB 3.2Å; N1055-A1059 PolarHBondContact O-N 2.79Å; L1057-A1059 VanDerWaalsContact C-N 3.3Å; L1057-A1059 PolarHBondContact O-N 3.3Å; A1059-Y1063 VanDerWaalsContact O-CB 3.24Å; A1059-Y1063 WeakPolarHBondContact O-CB 3.38Å; A1059-Y1063 PolarHBondContact O-N 3Å; A1059-A1071 WeakPolarHBondContact CB-O 3.36Å; A1059-A1071 WeakPolarHBondContact O-CB 3.37Å; A1059-F1074 HydrophobicContact CB-CB 3.73Å; A1059-Q1075 HydrophobicContact CB-CB 3.91Å; A1059-Y1103 HydrophobicContact CB-CE2 3.86Å
1060	R	88.8	Confident	90.3	Very high	53 Å²	53	32.9 Å²	32.9	20%	0.2	17%	0.173	C	C	.	.	H	α-helix	trans	-65.8	-41.2	176.5	-172.2	-178.4	-66.2	178.8	-4.4	111.9	R1056 L1057 L1058 V1064 Y1103	R1056-R1060 PolarHBondContact O-N 3.29Å; L1057-R1060 PolarHBondContact O-N 3.37Å; L1058-R1060 VanDerWaalsContact C-N 3.3Å; L1058-R1060 PolarHBondContact O-N 3.49Å; R1060-V1064 VanDerWaalsContact O-CG2 3.32Å; R1060-V1064 WeakPolarHBondContact O-CG2 3.33Å; R1060-V1064 PolarHBondContact O-N 3.05Å; R1060-Y1103 WeakPolarHBondContact CA-OH 3.34Å; R1060-Y1103 PolarHBondContact N-OH 2.74Å
1061	L	90.1	Very high	90.2	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-68	-53.8	179.7	-68.1	168.9	0	0	0	111.5	I1021 L1026 F1030 L1057 L1058 Y1063 V1064 M1065 I1331	I1021-L1061 HydrophobicContact CD1-CD1 3.77Å; I1021-L1061 HydrophobicContact CD1-CD2 4.16Å; I1021-L1061 HydrophobicContact CD1-CG 4.41Å; I1021-L1061 HydrophobicContact CG1-CD1 4.43Å; I1021-L1061 HydrophobicContact CG1-CD2 4.12Å; I1021-L1061 HydrophobicContact CG2-CD2 4.28Å; L1026-L1061 HydrophobicContact CD2-CD2 4.49Å; F1030-L1061 HydrophobicContact CB-CD1 4.06Å; F1030-L1061 HydrophobicContact CD2-CB 3.79Å; F1030-L1061 HydrophobicContact CD2-CD1 4.06Å; L1057-L1061 HydrophobicContact CG-CD1 4.47Å; L1057-L1061 WeakPolarHBondContact O-CG 3.48Å; L1057-L1061 PolarHBondContact O-N 3.35Å; L1058-L1061 PolarHBondContact O-N 2.91Å; L1058-L1061 VanDerWaalsContact O-N 3.1Å; L1061-Y1063 PolarHBondContact O-N 3.26Å; L1061-V1064 CarbonylContact O-C 3.56Å; L1061-V1064 WeakPolarHBondContact O-CA 3.36Å; L1061-V1064 PolarHBondContact O-N 3.34Å; L1061-M1065 VanDerWaalsContact O-CG 3.32Å; L1061-M1065 WeakPolarHBondContact O-CG 3.26Å; L1061-M1065 PolarHBondContact O-N 3.02Å; L1061-I1331 HydrophobicContact CD2-CD1 4.32Å
1062	S	90.8	Very high	90.1	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-53.4	-40.9	173.7	-78.4	0	0	0	0	111.6	F1030 L1058 V1064 M1065 G1066 E1067	F1030-S1062 WeakPolarHBondContact CE2-OG 3.19Å; L1058-S1062 WeakPolarHBondContact O-CB 3.45Å; L1058-S1062 PolarHBondContact O-N 3.08Å; S1062-V1064 PolarHBondContact O-N 3.24Å; S1062-M1065 PolarHBondContact O-N 3.11Å; S1062-G1066 PolarHBondContact O-N 3.01Å; S1062-E1067 WeakPolarHBondContact CB-OE2 3.4Å; S1062-E1067 PolarHBondContact O-N 3.46Å; S1062-E1067 PolarHBondContact OG-OE2 2.64Å
1063	Y	87	Confident	90	Very high	17 Å²	17	36.6 Å²	36.6	7%	0.067	19%	0.191	C	C	.	.	H	α-helix	trans	-61.3	-43.4	174.4	-175.2	-104.6	0	0	0	113.4	A1059 L1061 M1065 G1066 H1068 A1071 Y1103 A1106 N1323 I1328 L1329	A1059-Y1063 VanDerWaalsContact O-CB 3.24Å; A1059-Y1063 WeakPolarHBondContact O-CB 3.38Å; A1059-Y1063 PolarHBondContact O-N 3Å; L1061-Y1063 PolarHBondContact O-N 3.26Å; Y1063-M1065 VanDerWaalsContact C-N 3.32Å; Y1063-G1066 PolarHBondContact O-N 2.74Å; Y1063-H1068 AromaticContact CD2-ND1 3.48Å; Y1063-H1068 WeakPolarHBondContact CD2-ND1 3.32Å; Y1063-H1068 AromaticContact CE2-CE1 3.9Å; Y1063-H1068 AromaticContact CE2-ND1 3.65Å; Y1063-A1071 HydrophobicContact CD2-CB 4.43Å; Y1063-Y1103 HydrophobicContact CD1-CD1 4.32Å; Y1063-Y1103 HydrophobicContact CD1-CE1 4.04Å; Y1063-Y1103 AromaticContact CD2-CD1 3.7Å; Y1063-Y1103 HydrophobicContact CD2-CD1 3.7Å; Y1063-Y1103 HydrophobicContact CD2-CE1 4.17Å; Y1063-Y1103 HydrophobicContact CE2-CD1 4.31Å; Y1063-Y1103 AromaticContact CG-CD1 3.73Å; Y1063-Y1103 HydrophobicContact CG-CD1 3.73Å; Y1063-Y1103 AromaticContact CG-CE1 3.69Å; Y1063-Y1103 HydrophobicContact CG-CE1 3.69Å; Y1063-A1106 HydrophobicContact CE2-CB 3.64Å; Y1063-N1323 PolarHBondContact OH-ND2 2.84Å; Y1063-I1328 HydrophobicContact CD1-CG2 3.85Å; Y1063-I1328 HydrophobicContact CE1-CG2 4.05Å; Y1063-L1329 HydrophobicContact CD1-CD2 3.94Å; Y1063-L1329 HydrophobicContact CE1-CD2 3.7Å; Y1063-L1329 HydrophobicContact CE1-CG 4.28Å
1064	V	83.8	Confident	90.1	Very high	30 Å²	30	37.3 Å²	37.3	18%	0.182	19%	0.191	C	C	.	.	H	α-helix	trans	-69.4	-28.6	176.1	170.8	0	0	0	0	112.3	L1026 R1060 L1061 S1062 L1329 I1331 I1363	L1026-V1064 HydrophobicContact CD1-CG1 3.88Å; R1060-V1064 VanDerWaalsContact O-CG2 3.32Å; R1060-V1064 WeakPolarHBondContact O-CG2 3.33Å; R1060-V1064 PolarHBondContact O-N 3.05Å; L1061-V1064 CarbonylContact O-C 3.56Å; L1061-V1064 WeakPolarHBondContact O-CA 3.36Å; L1061-V1064 PolarHBondContact O-N 3.34Å; S1062-V1064 PolarHBondContact O-N 3.24Å; V1064-L1329 HydrophobicContact CG2-CD2 3.84Å; V1064-I1331 HydrophobicContact CG1-CD1 4.43Å; V1064-I1331 HydrophobicContact CG2-CD1 4.28Å; V1064-I1363 HydrophobicContact CG1-CD1 4.43Å
1065	M	85.2	Confident	90.2	Very high	68 Å²	68	37.3 Å²	37.3	34%	0.335	19%	0.191	S	C	.	.	H	α-helix	trans	-82.2	-12.1	176.2	-64	-172.6	-53.2	0	0	113.6	F1030 L1061 S1062 Y1063	F1030-M1065 HydrophobicContact CB-CE 4.47Å; F1030-M1065 HydrophobicContact CD1-CE 4.45Å; F1030-M1065 HydrophobicContact CD2-CE 3.54Å; F1030-M1065 HydrophobicContact CE2-CE 3.75Å; F1030-M1065 HydrophobicContact CG-CE 3.91Å; F1030-M1065 HydrophobicContact CZ-CE 4.3Å; L1061-M1065 VanDerWaalsContact O-CG 3.32Å; L1061-M1065 WeakPolarHBondContact O-CG 3.26Å; L1061-M1065 PolarHBondContact O-N 3.02Å; S1062-M1065 PolarHBondContact O-N 3.11Å; Y1063-M1065 VanDerWaalsContact C-N 3.32Å
1066	G	84.7	Confident	90.1	Very high	43 Å²	43	37.4 Å²	37.4	44%	0.443	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	99.1	0.8	179.2	0	0	0	0	0	115	S1062 Y1063 H1068	S1062-G1066 PolarHBondContact O-N 3.01Å; Y1063-G1066 PolarHBondContact O-N 2.74Å; G1066-H1068 VanDerWaalsContact C-N 3.26Å; G1066-H1068 PolarHBondContact O-N 3.22Å
1067	E	88.6	Confident	90.1	Very high	90 Å²	90	36.5 Å²	36.5	42%	0.421	19%	0.189	S	C	.	.			trans	-82.7	63.7	-179.1	-57.1	175.8	150.9	0	0	111	S1062 E1069 A1070 A1071	S1062-E1067 WeakPolarHBondContact CB-OE2 3.4Å; S1062-E1067 PolarHBondContact O-N 3.46Å; S1062-E1067 PolarHBondContact OG-OE2 2.64Å; E1067-E1069 VanDerWaalsContact C-N 3.32Å; E1067-E1069 PolarHBondContact O-N 2.93Å; E1067-A1070 HydrophobicContact CB-CB 4.06Å; E1067-A1070 PolarHBondContact O-N 2.94Å; E1067-A1070 VanDerWaalsContact O-N 3.15Å; E1067-A1071 PolarHBondContact O-N 2.95Å
1068	H	86.6	Confident	90.3	Very high	71 Å²	71	35.4 Å²	35.4	33%	0.329	18%	0.183	S	C	.	.	H	α-helix	trans	-63.7	-31.6	-169	-56.4	-38.9	0	0	0	114.2	Y1063 G1066 A1071 I1072	Y1063-H1068 AromaticContact CD2-ND1 3.48Å; Y1063-H1068 WeakPolarHBondContact CD2-ND1 3.32Å; Y1063-H1068 AromaticContact CE2-CE1 3.9Å; Y1063-H1068 AromaticContact CE2-ND1 3.65Å; G1066-H1068 VanDerWaalsContact C-N 3.26Å; G1066-H1068 PolarHBondContact O-N 3.22Å; H1068-A1071 PolarHBondContact O-N 3.17Å; H1068-I1072 PolarHBondContact O-N 3.47Å
1069	E	88.5	Confident	90.3	Very high	172 Å²	172	35.4 Å²	35.4	80%	0.804	18%	0.183	S	C	*	.	H	α-helix	trans	-67.3	-41.9	174.2	-64.1	-173.6	171.9	0	0	112	E1067 A1071 I1072 L1073	E1067-E1069 VanDerWaalsContact C-N 3.32Å; E1067-E1069 PolarHBondContact O-N 2.93Å; E1069-A1071 VanDerWaalsContact C-N 3.33Å; E1069-A1071 PolarHBondContact O-N 2.83Å; E1069-I1072 PolarHBondContact O-N 3.17Å; E1069-L1073 PolarHBondContact O-N 2.95Å; E1069-L1073 VanDerWaalsContact O-N 3.08Å
1070	A	90.5	Very high	90.4	Very high	30 Å²	30	35.5 Å²	35.5	25%	0.248	18%	0.183	C	C	.	.	H	α-helix	trans	-65.5	-37.5	175.3	0	0	0	0	0	111.5	E1067 I1072 L1073 F1074	E1067-A1070 HydrophobicContact CB-CB 4.06Å; E1067-A1070 PolarHBondContact O-N 2.94Å; E1067-A1070 VanDerWaalsContact O-N 3.15Å; A1070-I1072 VanDerWaalsContact C-N 3.33Å; A1070-I1072 PolarHBondContact O-N 3.4Å; A1070-L1073 PolarHBondContact O-N 3.41Å; A1070-F1074 HydrophobicContact CB-CD2 4.34Å; A1070-F1074 HydrophobicContact CB-CE2 4.23Å; A1070-F1074 WeakPolarHBondContact O-CB 3.24Å; A1070-F1074 WeakPolarHBondContact O-CD2 3.17Å; A1070-F1074 PolarHBondContact O-N 2.84Å
1071	A	90.6	Very high	90.7	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-60.1	-40.6	174.9	0	0	0	0	0	113	A1059 Y1063 E1067 H1068 E1069 Q1075 Y1103	A1059-A1071 WeakPolarHBondContact CB-O 3.36Å; A1059-A1071 WeakPolarHBondContact O-CB 3.37Å; Y1063-A1071 HydrophobicContact CD2-CB 4.43Å; E1067-A1071 PolarHBondContact O-N 2.95Å; H1068-A1071 PolarHBondContact O-N 3.17Å; E1069-A1071 VanDerWaalsContact C-N 3.33Å; E1069-A1071 PolarHBondContact O-N 2.83Å; A1071-Q1075 WeakPolarHBondContact O-CB 3.22Å; A1071-Q1075 PolarHBondContact O-N 3.03Å; A1071-Q1075 VanDerWaalsContact O-N 3.12Å; A1071-Y1103 HydrophobicContact CB-CD1 4.4Å; A1071-Y1103 HydrophobicContact CB-CG 4.44Å
1072	I	91.7	Very high	91	Very high	26 Å²	26	33.1 Å²	33.1	13%	0.133	18%	0.175	C	C	.	.	H	α-helix	trans	-64.1	-48.6	172.9	-75.9	-176.9	0	0	0	110.8	H1068 E1069 A1070 Q1075 H1076 F1100 V1104 C1107	H1068-I1072 PolarHBondContact O-N 3.47Å; E1069-I1072 PolarHBondContact O-N 3.17Å; A1070-I1072 VanDerWaalsContact C-N 3.33Å; A1070-I1072 PolarHBondContact O-N 3.4Å; I1072-Q1075 PolarHBondContact O-N 3.1Å; I1072-H1076 VanDerWaalsContact O-CB 3.23Å; I1072-H1076 WeakPolarHBondContact O-CB 3.18Å; I1072-H1076 PolarHBondContact O-N 3.34Å; I1072-F1100 HydrophobicContact CG2-CE2 4.1Å; I1072-V1104 HydrophobicContact CD1-CG2 4.29Å; I1072-V1104 HydrophobicContact CG1-CG2 4.35Å; I1072-C1107 HydrophobicContact CD1-CB 3.65Å; I1072-C1107 WeakPolarHBondContact CD1-SG 3.28Å
1073	L	92.2	Very high	91.2	Very high	75 Å²	75	33.1 Å²	33.1	39%	0.393	18%	0.175	S	C	.	.	H	α-helix	trans	-60.4	-48.6	-178.6	179.5	62.7	0	0	0	112.3	E1069 A1070 H1076 R1077	E1069-L1073 PolarHBondContact O-N 2.95Å; E1069-L1073 VanDerWaalsContact O-N 3.08Å; A1070-L1073 PolarHBondContact O-N 3.41Å; L1073-H1076 PolarHBondContact O-N 3.12Å; L1073-R1077 WeakPolarHBondContact O-CG 3.48Å; L1073-R1077 PolarHBondContact O-N 2.95Å
1074	F	94.1	Very high	91.5	Very high	27 Å²	27	32.5 Å²	32.5	12%	0.118	17%	0.172	C	C	.	.	H	α-helix	trans	-63.9	-41.8	178.4	-74.5	-53.3	0	0	0	112.1	N1055 L1058 A1059 A1070 R1077 A1078	N1055-F1074 WeakPolarHBondContact CB-O 3.48Å; N1055-F1074 WeakPolarHBondContact O-CB 3.46Å; L1058-F1074 HydrophobicContact CB-CD1 4.14Å; L1058-F1074 HydrophobicContact CB-CD2 3.83Å; L1058-F1074 HydrophobicContact CB-CE1 4.25Å; L1058-F1074 HydrophobicContact CB-CE2 3.95Å; L1058-F1074 HydrophobicContact CB-CG 3.94Å; L1058-F1074 HydrophobicContact CB-CZ 4.16Å; L1058-F1074 HydrophobicContact CD1-CD1 4.22Å; L1058-F1074 HydrophobicContact CD1-CE1 3.81Å; L1058-F1074 HydrophobicContact CD1-CZ 4.07Å; A1059-F1074 HydrophobicContact CB-CB 3.73Å; A1070-F1074 HydrophobicContact CB-CD2 4.34Å; A1070-F1074 HydrophobicContact CB-CE2 4.23Å; A1070-F1074 WeakPolarHBondContact O-CB 3.24Å; A1070-F1074 WeakPolarHBondContact O-CD2 3.17Å; A1070-F1074 PolarHBondContact O-N 2.84Å; F1074-R1077 PolarHBondContact O-N 3.33Å; F1074-A1078 PolarHBondContact O-N 2.97Å
1075	Q	94.5	Very high	92	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-72.4	-32.5	178.7	-172	57.5	46.4	0	0	112.7	A1059 A1071 I1072 A1078 T1079 E1096 H1099 F1100 Y1103	A1059-Q1075 HydrophobicContact CB-CB 3.91Å; A1071-Q1075 WeakPolarHBondContact O-CB 3.22Å; A1071-Q1075 PolarHBondContact O-N 3.03Å; A1071-Q1075 VanDerWaalsContact O-N 3.12Å; I1072-Q1075 PolarHBondContact O-N 3.1Å; Q1075-A1078 PolarHBondContact O-N 3.21Å; Q1075-T1079 WeakPolarHBondContact O-CB 3.45Å; Q1075-T1079 PolarHBondContact O-N 3.33Å; Q1075-T1079 PolarHBondContact O-OG1 3.33Å; Q1075-E1096 PolarHBondContact NE2-O 2.89Å; Q1075-E1096 PolarHBondContact NE2-OE2 3.21Å; Q1075-H1099 HydrophobicContact CG-CB 4.24Å; Q1075-F1100 HydrophobicContact CB-CD2 4.09Å; Q1075-F1100 VanDerWaalsContact CG-CA 3.48Å; Q1075-F1100 HydrophobicContact CG-CB 3.72Å; Q1075-F1100 HydrophobicContact CG-CD2 3.97Å; Q1075-F1100 HydrophobicContact CG-CG 4.21Å; Q1075-Y1103 HydrophobicContact CB-CD2 3.58Å; Q1075-Y1103 HydrophobicContact CB-CE2 3.77Å; Q1075-Y1103 HydrophobicContact CG-CD2 3.71Å; Q1075-Y1103 HydrophobicContact CG-CE2 3.78Å
1076	H	94.2	Very high	92.3	Very high	7 Å²	7	30.9 Å²	30.9	3%	0.032	16%	0.163	C	C	.	.	H	α-helix	trans	-61.6	-49.6	171.3	175.5	-128	0	0	0	110.8	N152 E159 I1072 L1073 A1078 T1079 M1080 F1100	N152-H1076 PolarHBondContact OD1-NE2 3.06Å; E159-H1076 IonicContact OE1-CE1 3.52Å; E159-H1076 PolarHBondContact OE1-CE1 3.16Å; E159-H1076 VanDerWaalsContact OE1-CE1 3.3Å; E159-H1076 IonicContact OE1-ND1 3.73Å; I1072-H1076 VanDerWaalsContact O-CB 3.23Å; I1072-H1076 WeakPolarHBondContact O-CB 3.18Å; I1072-H1076 PolarHBondContact O-N 3.34Å; L1073-H1076 PolarHBondContact O-N 3.12Å; H1076-A1078 PolarHBondContact O-N 3.31Å; H1076-T1079 WeakPolarHBondContact O-CB 3.2Å; H1076-T1079 PolarHBondContact O-N 2.93Å; H1076-T1079 VanDerWaalsContact O-N 3.12Å; H1076-M1080 WeakPolarHBondContact CE1-CE 3.37Å; H1076-M1080 VanDerWaalsContact ND1-CE 3.32Å; H1076-M1080 WeakPolarHBondContact ND1-CE 3.31Å; H1076-M1080 WeakPolarHBondContact O-CG 3.17Å; H1076-M1080 PolarHBondContact O-N 3.17Å; H1076-M1080 VanDerWaalsContact O-N 3.1Å; H1076-F1100 HydrophobicContact CB-CE1 4.4Å; H1076-F1100 HydrophobicContact CB-CE2 3.67Å; H1076-F1100 HydrophobicContact CB-CZ 3.61Å; H1076-F1100 AromaticContact CD2-CZ 3.83Å; H1076-F1100 AromaticContact CG-CZ 3.99Å
1077	R	93.7	Very high	92.7	Very high	33 Å²	33	29.2 Å²	29.2	13%	0.125	15%	0.145	C	C	.	.	H	α-helix	trans	-52.6	-51.4	171.6	-74.2	174.5	173.7	-156	-3.7	111.8	F302 N1055 L1073 F1074 T1079 M1080 I1081 L1407	F302-R1077 HydrophobicContact CE2-CB 4.06Å; F302-R1077 HydrophobicContact CE2-CG 4.08Å; F302-R1077 HydrophobicContact CZ-CG 4.46Å; N1055-R1077 WeakPolarHBondContact OD1-CB 3.47Å; N1055-R1077 WeakPolarHBondContact OD1-CD 3.44Å; L1073-R1077 WeakPolarHBondContact O-CG 3.48Å; L1073-R1077 PolarHBondContact O-N 2.95Å; F1074-R1077 PolarHBondContact O-N 3.33Å; R1077-T1079 VanDerWaalsContact C-N 3.29Å; R1077-T1079 PolarHBondContact O-N 3.22Å; R1077-M1080 HydrophobicContact CG-CE 4.47Å; R1077-M1080 PolarHBondContact O-N 3.3Å; R1077-I1081 WeakPolarHBondContact O-CD1 3.23Å; R1077-I1081 VanDerWaalsContact O-CG1 3.25Å; R1077-I1081 WeakPolarHBondContact O-CG1 3.35Å; R1077-I1081 PolarHBondContact O-N 2.98Å; R1077-L1407 VanDerWaalsContact NH1-C 3.34Å; R1077-L1407 PolarHBondContact NH1-O 2.83Å; R1077-L1407 PolarHBondContact NH1-OXT 2.94Å; R1077-L1407 VanDerWaalsContact NH1-OXT 3.16Å; R1077-L1407 PolarHBondContact NH2-O 3.46Å; R1077-L1407 PolarHBondContact NH2-OXT 3.47Å
1078	A	94.7	Very high	93	Very high	1 Å²	1	25.1 Å²	25.1	1%	0.008	13%	0.126	C	C	.	.	H	α-helix	trans	-57.6	-40.4	177.2	0	0	0	0	0	112.9	N1055 R1056 F1074 Q1075 H1076 I1081 S1082	N1055-A1078 HydrophobicContact CB-CB 3.94Å; R1056-A1078 HydrophobicContact CB-CB 3.98Å; F1074-A1078 PolarHBondContact O-N 2.97Å; Q1075-A1078 PolarHBondContact O-N 3.21Å; H1076-A1078 PolarHBondContact O-N 3.31Å; A1078-I1081 PolarHBondContact O-N 3.28Å; A1078-S1082 WeakPolarHBondContact O-CB 3.26Å; A1078-S1082 PolarHBondContact O-N 2.84Å
1079	T	95.8	Very high	93.3	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-64	-49.7	-179.8	-54.1	0	0	0	0	111.7	V151 Q1075 H1076 R1077 S1082 E1083 E1096 Y1097	V151-T1079 HydrophobicContact CB-CG2 3.99Å; V151-T1079 HydrophobicContact CG1-CG2 4.45Å; V151-T1079 HydrophobicContact CG2-CG2 3.8Å; Q1075-T1079 WeakPolarHBondContact O-CB 3.45Å; Q1075-T1079 PolarHBondContact O-N 3.33Å; Q1075-T1079 PolarHBondContact O-OG1 3.33Å; H1076-T1079 WeakPolarHBondContact O-CB 3.2Å; H1076-T1079 PolarHBondContact O-N 2.93Å; H1076-T1079 VanDerWaalsContact O-N 3.12Å; R1077-T1079 VanDerWaalsContact C-N 3.29Å; R1077-T1079 PolarHBondContact O-N 3.22Å; T1079-S1082 WeakPolarHBondContact O-CB 3.47Å; T1079-S1082 PolarHBondContact O-N 2.93Å; T1079-E1083 PolarHBondContact O-N 2.95Å; T1079-E1096 HydrophobicContact CG2-CB 4.16Å; T1079-Y1097 HydrophobicContact CG2-CD1 3.58Å; T1079-Y1097 HydrophobicContact CG2-CE1 3.63Å
1080	M	93.6	Very high	93.5	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.005	8%	0.082	C	C	.	.	H	α-helix	trans	-73.5	-28.5	178.2	23.7	175.6	-168.5	0	0	113.6	V151 H300 F302 H1076 R1077 S1082 E1083 R1084	V151-M1080 HydrophobicContact CG1-CB 3.81Å; V151-M1080 HydrophobicContact CG1-CG 3.94Å; H300-M1080 HydrophobicContact CB-SD 4.13Å; H300-M1080 WeakPolarHBondContact CE1-CE 3.35Å; H300-M1080 VanDerWaalsContact ND1-CE 3.34Å; H300-M1080 WeakPolarHBondContact ND1-CE 3.46Å; H300-M1080 PolarHBondContact ND1-SD 2.97Å; H300-M1080 WeakPolarHBondContact NE2-CE 3.41Å; F302-M1080 HydrophobicContact CB-SD 4.48Å; F302-M1080 HydrophobicContact CD2-CE 4.25Å; F302-M1080 HydrophobicContact CD2-CG 4.32Å; F302-M1080 HydrophobicContact CD2-SD 4.27Å; H1076-M1080 WeakPolarHBondContact CE1-CE 3.37Å; H1076-M1080 VanDerWaalsContact ND1-CE 3.32Å; H1076-M1080 WeakPolarHBondContact ND1-CE 3.31Å; H1076-M1080 WeakPolarHBondContact O-CG 3.17Å; H1076-M1080 PolarHBondContact O-N 3.17Å; H1076-M1080 VanDerWaalsContact O-N 3.1Å; R1077-M1080 HydrophobicContact CG-CE 4.47Å; R1077-M1080 PolarHBondContact O-N 3.3Å; M1080-S1082 VanDerWaalsContact C-N 3.28Å; M1080-S1082 PolarHBondContact O-N 3.32Å; M1080-E1083 PolarHBondContact O-N 3.05Å; M1080-R1084 VanDerWaalsContact O-CB 3.26Å; M1080-R1084 WeakPolarHBondContact O-CB 3.42Å; M1080-R1084 WeakPolarHBondContact O-CG 2.99Å; M1080-R1084 PolarHBondContact O-N 3.16Å
1081	I	94.3	Very high	93.6	Very high	1 Å²	1	14.2 Å²	14.2	1%	0.005	7%	0.072	C	C	.	.	H	α-helix	trans	-58.7	-45.1	167.2	-68.3	161.4	0	0	0	109.5	F302 L1047 H1048 I1051 R1077 A1078 R1084 V1085	F302-I1081 HydrophobicContact CD2-CG1 4.01Å; F302-I1081 HydrophobicContact CE2-CD1 3.92Å; F302-I1081 HydrophobicContact CE2-CG1 3.78Å; L1047-I1081 HydrophobicContact CD2-CG1 4.07Å; H1048-I1081 WeakPolarHBondContact O-CG2 3.37Å; I1051-I1081 HydrophobicContact CG2-CD1 3.84Å; R1077-I1081 WeakPolarHBondContact O-CD1 3.23Å; R1077-I1081 VanDerWaalsContact O-CG1 3.25Å; R1077-I1081 WeakPolarHBondContact O-CG1 3.35Å; R1077-I1081 PolarHBondContact O-N 2.98Å; A1078-I1081 PolarHBondContact O-N 3.28Å; I1081-R1084 PolarHBondContact O-N 3Å; I1081-V1085 HydrophobicContact CG2-CG2 4.33Å; I1081-V1085 VanDerWaalsContact O-CB 3.31Å; I1081-V1085 WeakPolarHBondContact O-CB 3.33Å; I1081-V1085 WeakPolarHBondContact O-CG2 3.26Å; I1081-V1085 PolarHBondContact O-N 2.84Å
1082	S	95.7	Very high	93.7	Very high	3 Å²	3	16.5 Å²	16.5	2%	0.021	8%	0.084	C	C	.	.	H	α-helix	trans	-64.4	-43.1	178.1	-166.6	0	0	0	0	112.6	A1078 T1079 M1080 H1086 T1093	A1078-S1082 WeakPolarHBondContact O-CB 3.26Å; A1078-S1082 PolarHBondContact O-N 2.84Å; T1079-S1082 WeakPolarHBondContact O-CB 3.47Å; T1079-S1082 PolarHBondContact O-N 2.93Å; M1080-S1082 VanDerWaalsContact C-N 3.28Å; M1080-S1082 PolarHBondContact O-N 3.32Å; S1082-H1086 WeakPolarHBondContact O-CA 3.47Å; S1082-H1086 WeakPolarHBondContact O-CB 3.25Å; S1082-H1086 PolarHBondContact O-N 2.88Å; S1082-H1086 PolarHBondContact O-ND1 2.88Å; S1082-H1086 PolarHBondContact OG-ND1 3Å; S1082-T1093 PolarHBondContact O-OG1 3.11Å; S1082-T1093 PolarHBondContact OG-N 3.28Å; S1082-T1093 PolarHBondContact OG-OG1 3.37Å
1083	E	95	Very high	93.8	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-58.3	-49	172.8	-72.7	179.6	164.6	0	0	112.3	S149 F150 V151 T1079 M1080 G1087 I1088 T1093 Y1097	S149-E1083 WeakPolarHBondContact CA-OE2 3.41Å; F150-E1083 WeakPolarHBondContact CB-OE1 3.25Å; F150-E1083 VanDerWaalsContact N-CD 3.34Å; F150-E1083 PolarHBondContact N-OE1 2.9Å; F150-E1083 PolarHBondContact N-OE2 3.16Å; V151-E1083 WeakPolarHBondContact CB-OE1 3.28Å; V151-E1083 VanDerWaalsContact N-CD 3.33Å; V151-E1083 PolarHBondContact N-OE1 2.93Å; V151-E1083 PolarHBondContact N-OE2 3.02Å; V151-E1083 VanDerWaalsContact N-OE2 3.08Å; T1079-E1083 PolarHBondContact O-N 2.95Å; M1080-E1083 PolarHBondContact O-N 3.05Å; E1083-G1087 CarbonylContact O-C 3.57Å; E1083-G1087 WeakPolarHBondContact O-CA 3.38Å; E1083-G1087 PolarHBondContact O-N 3.41Å; E1083-I1088 HydrophobicContact CB-CG2 4.04Å; E1083-I1088 HydrophobicContact CG-CG2 4.14Å; E1083-T1093 HydrophobicContact CB-CG2 4.42Å; E1083-T1093 HydrophobicContact CG-CG2 3.45Å; E1083-T1093 VanDerWaalsContact CG-CG2 3.45Å; E1083-Y1097 WeakPolarHBondContact OE1-CE1 3.47Å; E1083-Y1097 VanDerWaalsContact OE1-CZ 3.27Å; E1083-Y1097 PolarHBondContact OE1-OH 3.31Å
1084	R	93.9	Very high	93.9	Very high	4 Å²	4	11.7 Å²	11.7	2%	0.015	6%	0.06	C	C	.	.	H	α-helix	trans	-70.3	-34.1	-173.9	-70.3	-78.2	-72.3	168.6	0.2	112.7	M146 S147 F302 V305 T307 V311 L1047 M1080 I1081	M146-R1084 PolarHBondContact SD-NH2 3.46Å; M146-R1084 VanDerWaalsContact SD-NH2 3.38Å; S147-R1084 WeakPolarHBondContact CB-O 3.28Å; S147-R1084 VanDerWaalsContact N-NH1 3.15Å; S147-R1084 PolarHBondContact O-NH1 2.89Å; S147-R1084 WeakPolarHBondContact OG-CA 3.17Å; S147-R1084 WeakPolarHBondContact OG-CD 3.46Å; S147-R1084 PolarHBondContact OG-O 3.43Å; F302-R1084 PolarHBondContact O-NE 2.96Å; F302-R1084 PolarHBondContact O-NH2 2.85Å; V305-R1084 PolarHBondContact O-NH2 2.83Å; T307-R1084 HydrophobicContact CG2-CB 4.2Å; V311-R1084 WeakPolarHBondContact CG2-O 3.41Å; L1047-R1084 HydrophobicContact CD2-CB 4.4Å; M1080-R1084 VanDerWaalsContact O-CB 3.26Å; M1080-R1084 WeakPolarHBondContact O-CB 3.42Å; M1080-R1084 WeakPolarHBondContact O-CG 2.99Å; M1080-R1084 PolarHBondContact O-N 3.16Å; I1081-R1084 PolarHBondContact O-N 3Å
1085	V	93.6	Very high	93.8	Very high	10 Å²	10	10.6 Å²	10.6	6%	0.061	6%	0.055	C	C	.	.	H	α-helix	trans	-97.1	-31.2	-175.7	176.1	0	0	0	0	113.4	Y309 V311 L1047 P1049 I1081	Y309-V1085 HydrophobicContact CD2-CB 4.34Å; Y309-V1085 HydrophobicContact CD2-CG1 3.53Å; Y309-V1085 HydrophobicContact CD2-CG2 4.13Å; Y309-V1085 HydrophobicContact CE2-CG1 3.67Å; Y309-V1085 HydrophobicContact CE2-CG2 4.44Å; Y309-V1085 HydrophobicContact CG-CG1 4.07Å; V311-V1085 WeakPolarHBondContact CG2-O 3.44Å; L1047-V1085 HydrophobicContact CB-CG2 4.22Å; P1049-V1085 HydrophobicContact CG-CG1 3.76Å; I1081-V1085 HydrophobicContact CG2-CG2 4.33Å; I1081-V1085 VanDerWaalsContact O-CB 3.31Å; I1081-V1085 WeakPolarHBondContact O-CB 3.33Å; I1081-V1085 WeakPolarHBondContact O-CG2 3.26Å; I1081-V1085 PolarHBondContact O-N 2.84Å
1086	H	92	Very high	93.8	Very high	55 Å²	55	10.8 Å²	10.8	26%	0.255	6%	0.056	S	C	.	.	H	α-helix	trans	-107	-20.3	-177.5	-50.7	127.6	0	0	0	114.4	S1082 N1090	S1082-H1086 WeakPolarHBondContact O-CA 3.47Å; S1082-H1086 WeakPolarHBondContact O-CB 3.25Å; S1082-H1086 PolarHBondContact O-N 2.88Å; S1082-H1086 PolarHBondContact O-ND1 2.88Å; S1082-H1086 PolarHBondContact OG-ND1 3Å; H1086-N1090 HydrophobicContact CB-CB 3.76Å; H1086-N1090 WeakPolarHBondContact O-CB 3.24Å; H1086-N1090 PolarHBondContact O-ND2 2.89Å; H1086-N1090 VanDerWaalsContact O-ND2 3.12Å
1087	G	92.8	Very high	93.9	Very high	8 Å²	8	10.5 Å²	10.5	8%	0.082	6%	0.055	C	C	.	.			trans	99.6	144	-175.1	0	0	0	0	0	113.3	E1083 D1089 N1090 T1093	E1083-G1087 CarbonylContact O-C 3.57Å; E1083-G1087 WeakPolarHBondContact O-CA 3.38Å; E1083-G1087 PolarHBondContact O-N 3.41Å; G1087-D1089 PolarHBondContact O-N 3.05Å; G1087-N1090 WeakPolarHBondContact O-CB 3.49Å; G1087-N1090 PolarHBondContact O-N 2.93Å; G1087-T1093 PolarHBondContact O-OG1 3.48Å
1088	I	94.3	Very high	93.9	Very high	4 Å²	4	9 Å²	9	2%	0.021	5%	0.049	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-7.3	-175.2	63.3	169	0	0	0	115.5	L148 F150 L194 E1083 R1119 I1123	L148-I1088 HydrophobicContact CB-CD1 3.94Å; L148-I1088 HydrophobicContact CB-CG1 4.23Å; L148-I1088 HydrophobicContact CB-CG2 3.74Å; L148-I1088 HydrophobicContact CD1-CD1 3.61Å; L148-I1088 HydrophobicContact CD1-CG1 4.22Å; L148-I1088 HydrophobicContact CG-CD1 4.43Å; F150-I1088 HydrophobicContact CB-CB 4.39Å; F150-I1088 HydrophobicContact CB-CG2 4.09Å; L194-I1088 WeakPolarHBondContact O-CD1 3.5Å; E1083-I1088 HydrophobicContact CB-CG2 4.04Å; E1083-I1088 HydrophobicContact CG-CG2 4.14Å; I1088-R1119 PolarHBondContact O-NH2 2.93Å; I1088-I1123 VanDerWaalsContact O-CD1 3.31Å; I1088-I1123 WeakPolarHBondContact O-CD1 3.26Å
1089	D	93.5	Very high	93.7	Very high	16 Å²	16	9.3 Å²	9.3	9%	0.086	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.2	22.5	175.2	78.7	-44.1	0	0	0	113.2	L194 W314 R957 G1087	L194-D1089 HydrophobicContact CD1-CB 3.65Å; L194-D1089 HydrophobicContact CD2-CB 4.17Å; L194-D1089 HydrophobicContact CG-CB 4.18Å; W314-D1089 PolarHBondContact NE1-OD2 3.31Å; R957-D1089 WeakPolarHBondContact CD-OD2 3.46Å; R957-D1089 IonicContact CZ-OD2 3.39Å; R957-D1089 IonicContact NE-OD2 3Å; R957-D1089 PolarHBondContact NE-OD2 3.05Å; R957-D1089 PolarHBondContact NH2-O 3.42Å; G1087-D1089 PolarHBondContact O-N 3.05Å
1090	N	93.7	Very high	93.7	Very high	21 Å²	21	9.3 Å²	9.3	11%	0.112	5%	0.05	C	C	.	.			trans	-84.2	140.3	176.3	-163.8	-72.3	0	0	0	111.7	H1086 G1087 N1092 T1093 A1094	H1086-N1090 HydrophobicContact CB-CB 3.76Å; H1086-N1090 WeakPolarHBondContact O-CB 3.24Å; H1086-N1090 PolarHBondContact O-ND2 2.89Å; H1086-N1090 VanDerWaalsContact O-ND2 3.12Å; G1087-N1090 WeakPolarHBondContact O-CB 3.49Å; G1087-N1090 PolarHBondContact O-N 2.93Å; N1090-N1092 VanDerWaalsContact C-N 3.27Å; N1090-N1092 PolarHBondContact O-N 3.03Å; N1090-N1092 WeakPolarHBondContact OD1-CB 3.43Å; N1090-N1092 PolarHBondContact OD1-N 3.04Å; N1090-T1093 WeakPolarHBondContact O-CB 3.32Å; N1090-T1093 PolarHBondContact O-N 3Å; N1090-A1094 PolarHBondContact O-N 3.42Å; N1090-A1094 VanDerWaalsContact O-N 3.14Å
1091	P	92.6	Very high	93.7	Very high	6 Å²	6	9.3 Å²	9.3	4%	0.039	5%	0.05	C	C	.	.	H	α-helix	trans	-61.1	-30.5	176.1	22.8	-33.9	0	0	0	114.3	Q795 T1093 A1094 T1095	Q795-P1091 HydrophobicContact CB-CB 3.31Å; Q795-P1091 HydrophobicContact CB-CG 4.02Å; Q795-P1091 HydrophobicContact CG-CB 3.82Å; P1091-T1093 VanDerWaalsContact C-N 3.26Å; P1091-T1093 PolarHBondContact O-N 3.24Å; P1091-A1094 WeakPolarHBondContact O-CB 3.24Å; P1091-A1094 PolarHBondContact O-N 3.48Å; P1091-A1094 VanDerWaalsContact O-N 3.16Å; P1091-T1095 PolarHBondContact O-N 3.11Å
1092	N	91.1	Very high	93.5	Very high	48 Å²	48	9.4 Å²	9.4	26%	0.257	5%	0.051	S	C	.	.	H	α-helix	trans	-61.8	-38.4	173.9	-69.6	-17	0	0	0	111	N1090 T1095 E1096	N1090-N1092 VanDerWaalsContact C-N 3.27Å; N1090-N1092 PolarHBondContact O-N 3.03Å; N1090-N1092 WeakPolarHBondContact OD1-CB 3.43Å; N1090-N1092 PolarHBondContact OD1-N 3.04Å; N1092-T1095 WeakPolarHBondContact O-CB 3.46Å; N1092-T1095 PolarHBondContact O-N 2.75Å; N1092-E1096 WeakPolarHBondContact O-CG 3.31Å; N1092-E1096 PolarHBondContact O-N 2.88Å
1093	T	94.7	Very high	93.3	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.051	C	C	.	.	H	α-helix	trans	-68.5	-34.8	175.7	-46.5	0	0	0	0	111.8	S1082 E1083 G1087 N1090 P1091 E1096 Y1097	S1082-T1093 PolarHBondContact O-OG1 3.11Å; S1082-T1093 PolarHBondContact OG-N 3.28Å; S1082-T1093 PolarHBondContact OG-OG1 3.37Å; E1083-T1093 HydrophobicContact CB-CG2 4.42Å; E1083-T1093 HydrophobicContact CG-CG2 3.45Å; E1083-T1093 VanDerWaalsContact CG-CG2 3.45Å; G1087-T1093 PolarHBondContact O-OG1 3.48Å; N1090-T1093 WeakPolarHBondContact O-CB 3.32Å; N1090-T1093 PolarHBondContact O-N 3Å; P1091-T1093 VanDerWaalsContact C-N 3.26Å; P1091-T1093 PolarHBondContact O-N 3.24Å; T1093-E1096 PolarHBondContact O-N 3.13Å; T1093-Y1097 HydrophobicContact CG2-CE2 3.91Å; T1093-Y1097 VanDerWaalsContact O-CD2 3.23Å; T1093-Y1097 WeakPolarHBondContact O-CD2 3.41Å; T1093-Y1097 PolarHBondContact O-N 2.71Å; T1093-Y1097 VanDerWaalsContact O-N 3.08Å
1094	A	94.4	Very high	93	Very high	1 Å²	1	9.5 Å²	9.5	1%	0.008	5%	0.051	C	C	.	.	H	α-helix	trans	-60.7	-44.7	171.3	0	0	0	0	0	111.8	N1090 P1091 Y1097 I1098 I1123	N1090-A1094 PolarHBondContact O-N 3.42Å; N1090-A1094 VanDerWaalsContact O-N 3.14Å; P1091-A1094 WeakPolarHBondContact O-CB 3.24Å; P1091-A1094 PolarHBondContact O-N 3.48Å; P1091-A1094 VanDerWaalsContact O-N 3.16Å; A1094-Y1097 PolarHBondContact O-N 3.08Å; A1094-I1098 WeakPolarHBondContact O-CG1 3.38Å; A1094-I1098 PolarHBondContact O-N 2.96Å; A1094-I1123 HydrophobicContact CB-CB 4.01Å; A1094-I1123 HydrophobicContact CB-CG2 3.89Å
1095	T	92.2	Very high	92.8	Very high	4 Å²	4	9.3 Å²	9.3	3%	0.025	5%	0.05	C	C	.	.	H	α-helix	trans	-57.8	-44.9	171.6	-80.9	0	0	0	0	112	S679 P1091 N1092 Y1097 I1098 H1099 E1134	S679-T1095 WeakPolarHBondContact OG-CG2 3.3Å; S679-T1095 PolarHBondContact OG-OG1 3.44Å; P1091-T1095 PolarHBondContact O-N 3.11Å; N1092-T1095 WeakPolarHBondContact O-CB 3.46Å; N1092-T1095 PolarHBondContact O-N 2.75Å; T1095-Y1097 PolarHBondContact O-N 2.87Å; T1095-I1098 WeakPolarHBondContact O-CB 3.43Å; T1095-I1098 PolarHBondContact O-N 2.91Å; T1095-I1098 VanDerWaalsContact O-N 3.1Å; T1095-H1099 WeakPolarHBondContact CG2-CE1 3.41Å; T1095-H1099 PolarHBondContact O-N 3.05Å; T1095-H1099 VanDerWaalsContact O-N 3.15Å; T1095-E1134 PolarHBondContact OG1-OE1 3.45Å
1096	E	94.2	Very high	92.4	Very high	4 Å²	4	9.9 Å²	9.9	2%	0.019	6%	0.055	C	C	.	.	H	α-helix	trans	-61.1	-39.9	177.9	-62	-49	145.8	0	0	112.9	R1056 Q1075 T1079 N1092 T1093 I1098 H1099 F1100	R1056-E1096 WeakPolarHBondContact CD-OE1 3.35Å; R1056-E1096 WeakPolarHBondContact CD-OE2 3.32Å; R1056-E1096 IonicContact CZ-OE1 3.37Å; R1056-E1096 IonicContact NE-OE1 2.73Å; R1056-E1096 IonicContact NH1-OE1 3.5Å; R1056-E1096 PolarHBondContact NH1-OE1 3.11Å; Q1075-E1096 PolarHBondContact NE2-O 2.89Å; Q1075-E1096 PolarHBondContact NE2-OE2 3.21Å; T1079-E1096 HydrophobicContact CG2-CB 4.16Å; N1092-E1096 WeakPolarHBondContact O-CG 3.31Å; N1092-E1096 PolarHBondContact O-N 2.88Å; T1093-E1096 PolarHBondContact O-N 3.13Å; E1096-I1098 VanDerWaalsContact C-N 3.29Å; E1096-I1098 PolarHBondContact O-N 2.83Å; E1096-H1099 PolarHBondContact O-N 2.83Å; E1096-F1100 WeakPolarHBondContact O-CB 3.37Å; E1096-F1100 PolarHBondContact O-N 3.07Å
1097	Y	95.7	Very high	92	Very high	1 Å²	1	9.4 Å²	9.4	0%	0.004	6%	0.058	C	C	.	.	H	α-helix	trans	-62.8	-34.4	174.9	-64	-49.3	0	0	0	112.4	V151 T1079 E1083 T1093 A1094 T1095 F1100 S1101 L1116 R1119 I1123	V151-Y1097 HydrophobicContact CB-CE1 4.14Å; V151-Y1097 HydrophobicContact CG2-CE1 4.32Å; T1079-Y1097 HydrophobicContact CG2-CD1 3.58Å; T1079-Y1097 HydrophobicContact CG2-CE1 3.63Å; E1083-Y1097 WeakPolarHBondContact OE1-CE1 3.47Å; E1083-Y1097 VanDerWaalsContact OE1-CZ 3.27Å; E1083-Y1097 PolarHBondContact OE1-OH 3.31Å; T1093-Y1097 HydrophobicContact CG2-CE2 3.91Å; T1093-Y1097 VanDerWaalsContact O-CD2 3.23Å; T1093-Y1097 WeakPolarHBondContact O-CD2 3.41Å; T1093-Y1097 PolarHBondContact O-N 2.71Å; T1093-Y1097 VanDerWaalsContact O-N 3.08Å; A1094-Y1097 PolarHBondContact O-N 3.08Å; T1095-Y1097 PolarHBondContact O-N 2.87Å; Y1097-F1100 PolarHBondContact O-N 2.95Å; Y1097-S1101 WeakPolarHBondContact O-CB 3.47Å; Y1097-S1101 PolarHBondContact O-N 3.23Å; Y1097-S1101 PolarHBondContact O-OG 3.06Å; Y1097-L1116 HydrophobicContact CD1-CD2 3.79Å; Y1097-L1116 HydrophobicContact CE1-CD2 4.43Å; Y1097-R1119 HydrophobicContact CD2-CB 4.39Å; Y1097-R1119 HydrophobicContact CD2-CG 3.65Å; Y1097-R1119 HydrophobicContact CE1-CG 4.33Å; Y1097-R1119 HydrophobicContact CE2-CB 4.46Å; Y1097-R1119 HydrophobicContact CE2-CG 3.3Å; Y1097-R1119 HydrophobicContact CG-CG 4.31Å; Y1097-I1123 HydrophobicContact CD2-CD1 4.21Å; Y1097-I1123 HydrophobicContact CE2-CD1 3.62Å
1098	I	93.9	Very high	91.5	Very high	2 Å²	2	10.6 Å²	10.6	1%	0.01	7%	0.07	C	C	.	.	H	α-helix	trans	-62.8	-51	174.4	-61.1	167.2	0	0	0	109.3	A1094 T1095 E1096 F1100 S1101 L1102 A1120 E1134 I1138	A1094-I1098 WeakPolarHBondContact O-CG1 3.38Å; A1094-I1098 PolarHBondContact O-N 2.96Å; T1095-I1098 WeakPolarHBondContact O-CB 3.43Å; T1095-I1098 PolarHBondContact O-N 2.91Å; T1095-I1098 VanDerWaalsContact O-N 3.1Å; E1096-I1098 VanDerWaalsContact C-N 3.29Å; E1096-I1098 PolarHBondContact O-N 2.83Å; I1098-F1100 VanDerWaalsContact C-N 3.33Å; I1098-F1100 PolarHBondContact O-N 2.87Å; I1098-S1101 PolarHBondContact O-N 2.96Å; I1098-S1101 PolarHBondContact O-OG 2.93Å; I1098-L1102 HydrophobicContact CG2-CD1 3.92Å; I1098-L1102 VanDerWaalsContact O-CD1 3.3Å; I1098-L1102 WeakPolarHBondContact O-CD1 3.47Å; I1098-L1102 VanDerWaalsContact O-CG 3.29Å; I1098-L1102 WeakPolarHBondContact O-CG 3.33Å; I1098-L1102 PolarHBondContact O-N 2.89Å; I1098-A1120 HydrophobicContact CG1-CB 3.78Å; I1098-E1134 HydrophobicContact CD1-CG 4.25Å; I1098-I1138 HydrophobicContact CD1-CD1 3.89Å; I1098-I1138 HydrophobicContact CD1-CG1 3.56Å; I1098-I1138 HydrophobicContact CG1-CG1 4.07Å
1099	H	91.6	Very high	91.1	Very high	6 Å²	6	13.1 Å²	13.1	3%	0.028	8%	0.082	C	C	.	.	H	α-helix	trans	-60.9	-42.6	177.9	-59.8	150.3	0	0	0	111.9	S678 S679 N680 Q1075 T1095 E1096 L1102 Y1103	S678-H1099 PolarHBondContact OG-NE2 3.48Å; S679-H1099 PolarHBondContact O-CE1 3.06Å; N680-H1099 PolarHBondContact ND2-CE1 3.1Å; N680-H1099 PolarHBondContact ND2-ND1 2.61Å; Q1075-H1099 HydrophobicContact CG-CB 4.24Å; T1095-H1099 WeakPolarHBondContact CG2-CE1 3.41Å; T1095-H1099 PolarHBondContact O-N 3.05Å; T1095-H1099 VanDerWaalsContact O-N 3.15Å; E1096-H1099 PolarHBondContact O-N 2.83Å; H1099-L1102 PolarHBondContact O-N 2.83Å; H1099-Y1103 VanDerWaalsContact O-CD2 3.31Å; H1099-Y1103 WeakPolarHBondContact O-CD2 3.45Å; H1099-Y1103 PolarHBondContact O-N 2.77Å
1100	F	94.9	Very high	90.9	Very high	1 Å²	1	13.8 Å²	13.8	0%	0.004	9%	0.085	C	C	.	.	H	α-helix	trans	-63.4	-45.2	179	-166.7	-149.9	0	0	0	112.2	V151 A155 L158 I1072 Q1075 H1076 E1096 Y1097 I1098 L1102 Y1103 V1104 L1116	V151-F1100 HydrophobicContact CG2-CD1 3.91Å; V151-F1100 HydrophobicContact CG2-CE1 3.58Å; A155-F1100 HydrophobicContact CB-CE1 3.56Å; A155-F1100 HydrophobicContact CB-CZ 3.92Å; L158-F1100 HydrophobicContact CD1-CZ 4.29Å; I1072-F1100 HydrophobicContact CG2-CE2 4.1Å; Q1075-F1100 HydrophobicContact CB-CD2 4.09Å; Q1075-F1100 VanDerWaalsContact CG-CA 3.48Å; Q1075-F1100 HydrophobicContact CG-CB 3.72Å; Q1075-F1100 HydrophobicContact CG-CD2 3.97Å; Q1075-F1100 HydrophobicContact CG-CG 4.21Å; H1076-F1100 HydrophobicContact CB-CE1 4.4Å; H1076-F1100 HydrophobicContact CB-CE2 3.67Å; H1076-F1100 HydrophobicContact CB-CZ 3.61Å; H1076-F1100 AromaticContact CD2-CZ 3.83Å; H1076-F1100 AromaticContact CG-CZ 3.99Å; E1096-F1100 WeakPolarHBondContact O-CB 3.37Å; E1096-F1100 PolarHBondContact O-N 3.07Å; Y1097-F1100 PolarHBondContact O-N 2.95Å; I1098-F1100 VanDerWaalsContact C-N 3.33Å; I1098-F1100 PolarHBondContact O-N 2.87Å; F1100-L1102 PolarHBondContact O-N 3.16Å; F1100-L1102 VanDerWaalsContact O-N 3.15Å; F1100-Y1103 PolarHBondContact O-N 2.92Å; F1100-V1104 HydrophobicContact CD2-CG2 3.64Å; F1100-V1104 HydrophobicContact CE1-CG2 4.49Å; F1100-V1104 HydrophobicContact CE2-CG2 3.48Å; F1100-V1104 VanDerWaalsContact CE2-CG2 3.48Å; F1100-V1104 HydrophobicContact CG-CG2 4.21Å; F1100-V1104 HydrophobicContact CZ-CG2 3.93Å; F1100-V1104 VanDerWaalsContact O-CB 3.31Å; F1100-V1104 WeakPolarHBondContact O-CB 3.21Å; F1100-V1104 WeakPolarHBondContact O-CG2 3.28Å; F1100-V1104 PolarHBondContact O-N 2.66Å; F1100-L1116 HydrophobicContact CB-CD1 4.29Å; F1100-L1116 HydrophobicContact CD1-CD1 3.45Å; F1100-L1116 VanDerWaalsContact CD1-CD1 3.45Å; F1100-L1116 HydrophobicContact CD1-CD2 3.75Å; F1100-L1116 HydrophobicContact CD1-CG 4.27Å; F1100-L1116 HydrophobicContact CE1-CD1 3.9Å; F1100-L1116 HydrophobicContact CE1-CD2 4.24Å; F1100-L1116 HydrophobicContact CG-CD1 3.94Å
1101	S	93.4	Very high	90.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-55.9	-33.6	177.2	74.3	0	0	0	0	113.2	Y1097 I1098 F1105 A1113 L1117	Y1097-S1101 WeakPolarHBondContact O-CB 3.47Å; Y1097-S1101 PolarHBondContact O-N 3.23Å; Y1097-S1101 PolarHBondContact O-OG 3.06Å; I1098-S1101 PolarHBondContact O-N 2.96Å; I1098-S1101 PolarHBondContact O-OG 2.93Å; S1101-F1105 WeakPolarHBondContact O-CB 3.4Å; S1101-F1105 PolarHBondContact O-N 3.03Å; S1101-A1113 WeakPolarHBondContact CB-O 3.46Å; S1101-A1113 VanDerWaalsContact O-CB 3.28Å; S1101-A1113 WeakPolarHBondContact O-CB 3.43Å; S1101-L1117 WeakPolarHBondContact OG-CD2 3.4Å; S1101-L1117 WeakPolarHBondContact OG-CG 3.34Å
1102	L	90.7	Very high	90.5	Very high	4 Å²	4	14.9 Å²	14.9	2%	0.021	9%	0.094	C	C	.	.	H	α-helix	trans	-78.4	-37.2	-174.2	-66.5	160.8	0	0	0	111.9	I1098 H1099 F1100 A1106 M1145 L1322 N1326 I1328	I1098-L1102 HydrophobicContact CG2-CD1 3.92Å; I1098-L1102 VanDerWaalsContact O-CD1 3.3Å; I1098-L1102 WeakPolarHBondContact O-CD1 3.47Å; I1098-L1102 VanDerWaalsContact O-CG 3.29Å; I1098-L1102 WeakPolarHBondContact O-CG 3.33Å; I1098-L1102 PolarHBondContact O-N 2.89Å; H1099-L1102 PolarHBondContact O-N 2.83Å; F1100-L1102 PolarHBondContact O-N 3.16Å; F1100-L1102 VanDerWaalsContact O-N 3.15Å; L1102-A1106 PolarHBondContact O-N 3.17Å; L1102-A1106 VanDerWaalsContact O-N 3.12Å; L1102-M1145 HydrophobicContact CD2-CE 4.25Å; L1102-L1322 HydrophobicContact CD2-CB 4.09Å; L1102-L1322 HydrophobicContact CD2-CD1 4.17Å; L1102-L1322 HydrophobicContact CD2-CD2 3.92Å; L1102-L1322 HydrophobicContact CD2-CG 4.3Å; L1102-N1326 HydrophobicContact CD1-CB 3.96Å; L1102-N1326 WeakPolarHBondContact CD1-OD1 3.21Å; L1102-I1328 HydrophobicContact CB-CD1 3.55Å; L1102-I1328 HydrophobicContact CD1-CD1 3.63Å; L1102-I1328 HydrophobicContact CD2-CD1 4.49Å; L1102-I1328 HydrophobicContact CG-CD1 4.06Å
1103	Y	90.6	Very high	90.6	Very high	5 Å²	5	12.6 Å²	12.6	2%	0.02	8%	0.081	C	C	.	.	H	α-helix	trans	-72.4	-41.8	170.5	-53.9	-53	0	0	0	111.8	A1059 R1060 Y1063 A1071 Q1075 H1099 F1100 F1105 A1106 C1107 I1328	A1059-Y1103 HydrophobicContact CB-CE2 3.86Å; R1060-Y1103 WeakPolarHBondContact CA-OH 3.34Å; R1060-Y1103 PolarHBondContact N-OH 2.74Å; Y1063-Y1103 HydrophobicContact CD1-CD1 4.32Å; Y1063-Y1103 HydrophobicContact CD1-CE1 4.04Å; Y1063-Y1103 AromaticContact CD2-CD1 3.7Å; Y1063-Y1103 HydrophobicContact CD2-CD1 3.7Å; Y1063-Y1103 HydrophobicContact CD2-CE1 4.17Å; Y1063-Y1103 HydrophobicContact CE2-CD1 4.31Å; Y1063-Y1103 AromaticContact CG-CD1 3.73Å; Y1063-Y1103 HydrophobicContact CG-CD1 3.73Å; Y1063-Y1103 AromaticContact CG-CE1 3.69Å; Y1063-Y1103 HydrophobicContact CG-CE1 3.69Å; A1071-Y1103 HydrophobicContact CB-CD1 4.4Å; A1071-Y1103 HydrophobicContact CB-CG 4.44Å; Q1075-Y1103 HydrophobicContact CB-CD2 3.58Å; Q1075-Y1103 HydrophobicContact CB-CE2 3.77Å; Q1075-Y1103 HydrophobicContact CG-CD2 3.71Å; Q1075-Y1103 HydrophobicContact CG-CE2 3.78Å; H1099-Y1103 VanDerWaalsContact O-CD2 3.31Å; H1099-Y1103 WeakPolarHBondContact O-CD2 3.45Å; H1099-Y1103 PolarHBondContact O-N 2.77Å; F1100-Y1103 PolarHBondContact O-N 2.92Å; Y1103-F1105 VanDerWaalsContact C-N 3.29Å; Y1103-F1105 PolarHBondContact O-N 3Å; Y1103-A1106 WeakPolarHBondContact O-CB 3.47Å; Y1103-A1106 PolarHBondContact O-N 3.35Å; Y1103-C1107 PolarHBondContact O-N 3.35Å; Y1103-I1328 HydrophobicContact CE1-CG2 3.95Å
1104	V	90.1	Very high	90.6	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-60.1	-39.5	176.3	170.4	0	0	0	0	111.2	L158 I1072 F1100 H1109 T1112 A1113 L1116	L158-V1104 HydrophobicContact CD1-CG1 4.07Å; L158-V1104 HydrophobicContact CD1-CG2 3.84Å; I1072-V1104 HydrophobicContact CD1-CG2 4.29Å; I1072-V1104 HydrophobicContact CG1-CG2 4.35Å; F1100-V1104 HydrophobicContact CD2-CG2 3.64Å; F1100-V1104 HydrophobicContact CE1-CG2 4.49Å; F1100-V1104 HydrophobicContact CE2-CG2 3.48Å; F1100-V1104 VanDerWaalsContact CE2-CG2 3.48Å; F1100-V1104 HydrophobicContact CG-CG2 4.21Å; F1100-V1104 HydrophobicContact CZ-CG2 3.93Å; F1100-V1104 VanDerWaalsContact O-CB 3.31Å; F1100-V1104 WeakPolarHBondContact O-CB 3.21Å; F1100-V1104 WeakPolarHBondContact O-CG2 3.28Å; F1100-V1104 PolarHBondContact O-N 2.66Å; V1104-H1109 HydrophobicContact CG1-CB 3.69Å; V1104-H1109 PolarHBondContact O-N 3.25Å; V1104-T1112 HydrophobicContact CG1-CG2 4.09Å; V1104-A1113 HydrophobicContact CG1-CB 4.17Å; V1104-L1116 HydrophobicContact CB-CD1 4.46Å; V1104-L1116 HydrophobicContact CG1-CD1 4.5Å; V1104-L1116 HydrophobicContact CG2-CD1 4.22Å
1105	F	88.4	Confident	90.5	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64.7	-41.1	171.1	178.2	-91.5	0	0	0	112.8	S1101 Y1103 C1107 G1108 I1110 A1113 M1145 L1148 V1315 V1318 L1319 L1322	S1101-F1105 WeakPolarHBondContact O-CB 3.4Å; S1101-F1105 PolarHBondContact O-N 3.03Å; Y1103-F1105 VanDerWaalsContact C-N 3.29Å; Y1103-F1105 PolarHBondContact O-N 3Å; F1105-C1107 PolarHBondContact O-N 2.88Å; F1105-G1108 WeakPolarHBondContact O-CA 3.39Å; F1105-G1108 PolarHBondContact O-N 3.49Å; F1105-I1110 HydrophobicContact CD2-CG1 3.99Å; F1105-I1110 HydrophobicContact CD2-CG2 4.39Å; F1105-I1110 HydrophobicContact CE2-CG1 3.96Å; F1105-I1110 HydrophobicContact CE2-CG2 4.35Å; F1105-A1113 HydrophobicContact CB-CB 3.79Å; F1105-M1145 HydrophobicContact CB-CE 3.64Å; F1105-M1145 HydrophobicContact CB-SD 4.35Å; F1105-M1145 HydrophobicContact CD1-CE 4.43Å; F1105-M1145 HydrophobicContact CD2-CE 3.69Å; F1105-M1145 HydrophobicContact CD2-CG 3.66Å; F1105-M1145 HydrophobicContact CD2-SD 3.58Å; F1105-M1145 VanDerWaalsContact CD2-SD 3.58Å; F1105-M1145 HydrophobicContact CE2-CB 4.35Å; F1105-M1145 HydrophobicContact CE2-CE 4.46Å; F1105-M1145 HydrophobicContact CE2-CG 3.64Å; F1105-M1145 HydrophobicContact CE2-SD 4.2Å; F1105-M1145 HydrophobicContact CG-CE 3.66Å; F1105-M1145 HydrophobicContact CG-CG 4.49Å; F1105-M1145 HydrophobicContact CG-SD 4.18Å; F1105-M1145 HydrophobicContact CZ-CG 4.47Å; F1105-L1148 HydrophobicContact CE2-CD2 3.64Å; F1105-L1148 HydrophobicContact CZ-CD2 3.58Å; F1105-V1315 HydrophobicContact CE1-CG1 4.3Å; F1105-V1315 HydrophobicContact CZ-CG1 4.36Å; F1105-V1318 HydrophobicContact CE1-CB 4.38Å; F1105-V1318 HydrophobicContact CE1-CG1 4.09Å; F1105-V1318 HydrophobicContact CE2-CG1 4.44Å; F1105-V1318 HydrophobicContact CZ-CB 3.96Å; F1105-V1318 HydrophobicContact CZ-CG1 3.57Å; F1105-L1319 HydrophobicContact CD1-CD1 4.13Å; F1105-L1319 HydrophobicContact CE1-CB 4.11Å; F1105-L1319 HydrophobicContact CE1-CD1 4.43Å; F1105-L1322 HydrophobicContact CD1-CD1 3.53Å; F1105-L1322 HydrophobicContact CE1-CD1 3.47Å; F1105-L1322 VanDerWaalsContact CE1-CD1 3.47Å; F1105-L1322 HydrophobicContact CG-CD1 4.13Å; F1105-L1322 HydrophobicContact CZ-CD1 4Å
1106	A	84.9	Confident	90.6	Very high	21 Å²	21	15.3 Å²	15.3	17%	0.174	9%	0.094	C	C	.	.	H	α-helix	trans	-62	-32	-179.8	0	0	0	0	0	113	Y1063 L1102 Y1103 G1108 L1319	Y1063-A1106 HydrophobicContact CE2-CB 3.64Å; L1102-A1106 PolarHBondContact O-N 3.17Å; L1102-A1106 VanDerWaalsContact O-N 3.12Å; Y1103-A1106 WeakPolarHBondContact O-CB 3.47Å; Y1103-A1106 PolarHBondContact O-N 3.35Å; A1106-G1108 VanDerWaalsContact C-N 3.28Å; A1106-L1319 HydrophobicContact CB-CD1 3.71Å; A1106-L1319 HydrophobicContact CB-CD2 3.9Å; A1106-L1319 HydrophobicContact CB-CG 4.48Å
1107	C	83.5	Confident	90.7	Very high	45 Å²	45	15.1 Å²	15.1	30%	0.304	9%	0.093	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	2.4	171.5	-66.4	0	0	0	0	114.3	I1072 Y1103 F1105	I1072-C1107 HydrophobicContact CD1-CB 3.65Å; I1072-C1107 WeakPolarHBondContact CD1-SG 3.28Å; Y1103-C1107 PolarHBondContact O-N 3.35Å; F1105-C1107 PolarHBondContact O-N 2.88Å
1108	G	82.6	Confident	90.7	Very high	33 Å²	33	15.7 Å²	15.7	34%	0.34	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	90	3.9	175.2	0	0	0	0	0	115.8	F1105 A1106 I1110	F1105-G1108 WeakPolarHBondContact O-CA 3.39Å; F1105-G1108 PolarHBondContact O-N 3.49Å; A1106-G1108 VanDerWaalsContact C-N 3.28Å; G1108-I1110 PolarHBondContact O-N 2.96Å
1109	H	86.5	Confident	90.7	Very high	57 Å²	57	16.2 Å²	16.2	26%	0.264	10%	0.097	S	C	.	.			trans	-83.1	58.4	179.8	-57.5	-65.8	0	0	0	112	L158 F163 V1104 S1111 T1112 A1113	L158-H1109 HydrophobicContact CD2-CB 3.95Å; F163-H1109 AromaticContact CZ-CE1 3.71Å; V1104-H1109 HydrophobicContact CG1-CB 3.69Å; V1104-H1109 PolarHBondContact O-N 3.25Å; H1109-S1111 VanDerWaalsContact C-N 3.27Å; H1109-S1111 PolarHBondContact O-N 2.85Å; H1109-T1112 PolarHBondContact O-N 3.17Å; H1109-A1113 PolarHBondContact O-N 3.36Å
1110	I	88.8	Confident	91	Very high	30 Å²	30	15.9 Å²	15.9	15%	0.154	10%	0.095	C	C	.	.	H	α-helix	trans	-57.3	-35.7	-169.3	-58.2	163.8	0	0	0	112.8	F173 F1105 G1108 A1113 L1114 L1148 V1149	F173-I1110 HydrophobicContact CE1-CB 4.28Å; F173-I1110 HydrophobicContact CE1-CG2 4.06Å; F1105-I1110 HydrophobicContact CD2-CG1 3.99Å; F1105-I1110 HydrophobicContact CD2-CG2 4.39Å; F1105-I1110 HydrophobicContact CE2-CG1 3.96Å; F1105-I1110 HydrophobicContact CE2-CG2 4.35Å; G1108-I1110 PolarHBondContact O-N 2.96Å; I1110-A1113 PolarHBondContact O-N 3.43Å; I1110-L1114 HydrophobicContact CG2-CD1 4.26Å; I1110-L1114 PolarHBondContact O-N 3.35Å; I1110-L1148 HydrophobicContact CD1-CD2 3.71Å; I1110-L1148 HydrophobicContact CD1-CG 4.45Å; I1110-L1148 HydrophobicContact CG1-CD2 4.44Å; I1110-V1149 HydrophobicContact CG2-CG2 3.82Å
1111	S	89	Confident	91	Very high	28 Å²	28	15.9 Å²	15.9	20%	0.196	10%	0.095	C	C	.	.	H	α-helix	trans	-63.2	-55.4	179.3	176.2	0	0	0	0	111.4	D172 H1109 A1113 L1114 Q1115	D172-S1111 VanDerWaalsContact CB-OG 3.26Å; D172-S1111 WeakPolarHBondContact CB-OG 3.36Å; H1109-S1111 VanDerWaalsContact C-N 3.27Å; H1109-S1111 PolarHBondContact O-N 2.85Å; S1111-A1113 VanDerWaalsContact C-N 3.28Å; S1111-A1113 PolarHBondContact O-N 3.37Å; S1111-L1114 PolarHBondContact O-N 3.08Å; S1111-Q1115 WeakPolarHBondContact O-CG 3.2Å; S1111-Q1115 PolarHBondContact O-N 3.49Å
1112	T	90.4	Very high	91.1	Very high	23 Å²	23	16 Å²	16	14%	0.141	10%	0.096	C	C	.	.	H	α-helix	trans	-59.9	-38.1	176.3	-47.5	0	0	0	0	111.8	V154 A155 L158 V1104 H1109 Q1115 L1116	V154-T1112 HydrophobicContact CG1-CG2 4.2Å; A155-T1112 HydrophobicContact CB-CG2 4.14Å; L158-T1112 HydrophobicContact CD1-CG2 4.12Å; L158-T1112 HydrophobicContact CG-CG2 4.45Å; V1104-T1112 HydrophobicContact CG1-CG2 4.09Å; H1109-T1112 PolarHBondContact O-N 3.17Å; T1112-Q1115 PolarHBondContact O-N 3.01Å; T1112-L1116 HydrophobicContact CG2-CD1 4.23Å; T1112-L1116 WeakPolarHBondContact O-CB 3.39Å; T1112-L1116 VanDerWaalsContact O-CG 3.24Å; T1112-L1116 WeakPolarHBondContact O-CG 3.46Å; T1112-L1116 PolarHBondContact O-N 3.33Å
1113	A	92.2	Very high	91.3	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-61.3	-45.5	175.2	0	0	0	0	0	112.8	S1101 V1104 F1105 H1109 I1110 S1111 L1116 L1117 M1145	S1101-A1113 WeakPolarHBondContact CB-O 3.46Å; S1101-A1113 VanDerWaalsContact O-CB 3.28Å; S1101-A1113 WeakPolarHBondContact O-CB 3.43Å; V1104-A1113 HydrophobicContact CG1-CB 4.17Å; F1105-A1113 HydrophobicContact CB-CB 3.79Å; H1109-A1113 PolarHBondContact O-N 3.36Å; I1110-A1113 PolarHBondContact O-N 3.43Å; S1111-A1113 VanDerWaalsContact C-N 3.28Å; S1111-A1113 PolarHBondContact O-N 3.37Å; A1113-L1116 PolarHBondContact O-N 2.98Å; A1113-L1117 PolarHBondContact O-N 2.84Å; A1113-M1145 HydrophobicContact CB-CE 4.25Å; A1113-M1145 HydrophobicContact CB-SD 3.87Å
1114	L	94.2	Very high	91.5	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-64.2	-42.4	175	-84.5	169.7	0	0	0	111.8	F173 I1110 S1111 L1116 L1117 Y1118 I1142 M1145 L1146	F173-L1114 HydrophobicContact CB-CD1 4.38Å; F173-L1114 HydrophobicContact CD1-CD1 3.89Å; I1110-L1114 HydrophobicContact CG2-CD1 4.26Å; I1110-L1114 PolarHBondContact O-N 3.35Å; S1111-L1114 PolarHBondContact O-N 3.08Å; L1114-L1116 VanDerWaalsContact C-N 3.32Å; L1114-L1116 PolarHBondContact O-N 3.44Å; L1114-L1117 PolarHBondContact O-N 3.38Å; L1114-L1117 VanDerWaalsContact O-N 3.17Å; L1114-Y1118 HydrophobicContact CB-CE2 4.1Å; L1114-Y1118 HydrophobicContact CD2-CE1 4.01Å; L1114-Y1118 WeakPolarHBondContact O-CB 3.44Å; L1114-Y1118 WeakPolarHBondContact O-CD1 3.32Å; L1114-Y1118 WeakPolarHBondContact O-CD2 3.43Å; L1114-Y1118 PolarHBondContact O-N 3.5Å; L1114-I1142 HydrophobicContact CD2-CG2 4.28Å; L1114-M1145 HydrophobicContact CD1-CB 4.18Å; L1114-M1145 HydrophobicContact CD2-CB 3.65Å; L1114-M1145 HydrophobicContact CD2-SD 4.33Å; L1114-M1145 HydrophobicContact CG-CB 3.85Å; L1114-M1145 HydrophobicContact CG-SD 4.22Å; L1114-L1146 HydrophobicContact CD1-CD2 4.13Å; L1114-L1146 HydrophobicContact CD2-CG 4.3Å
1115	Q	93.1	Very high	91.7	Very high	61 Å²	61	16 Å²	16	29%	0.285	10%	0.097	S	C	.	.	H	α-helix	trans	-61.1	-38.7	176.1	-67.8	174.6	8.1	0	0	112.7	V154 S1111 T1112 Y1118 R1119	V154-Q1115 HydrophobicContact CG1-CB 3.68Å; S1111-Q1115 WeakPolarHBondContact O-CG 3.2Å; S1111-Q1115 PolarHBondContact O-N 3.49Å; T1112-Q1115 PolarHBondContact O-N 3.01Å; Q1115-Y1118 PolarHBondContact O-N 2.83Å; Q1115-R1119 WeakPolarHBondContact O-CB 3.42Å; Q1115-R1119 PolarHBondContact O-N 3.37Å
1116	L	94.6	Very high	91.9	Very high	1 Å²	1	16 Å²	16	1%	0.005	10%	0.097	C	C	.	.	H	α-helix	trans	-65.1	-42	173.3	-70.9	166.6	0	0	0	112	V151 V154 Y1097 F1100 V1104 T1112 A1113 L1114 R1119 A1120	V151-L1116 HydrophobicContact CG2-CD2 4.39Å; V154-L1116 HydrophobicContact CG1-CD2 4.03Å; V154-L1116 HydrophobicContact CG1-CG 4.03Å; Y1097-L1116 HydrophobicContact CD1-CD2 3.79Å; Y1097-L1116 HydrophobicContact CE1-CD2 4.43Å; F1100-L1116 HydrophobicContact CB-CD1 4.29Å; F1100-L1116 HydrophobicContact CD1-CD1 3.45Å; F1100-L1116 VanDerWaalsContact CD1-CD1 3.45Å; F1100-L1116 HydrophobicContact CD1-CD2 3.75Å; F1100-L1116 HydrophobicContact CD1-CG 4.27Å; F1100-L1116 HydrophobicContact CE1-CD1 3.9Å; F1100-L1116 HydrophobicContact CE1-CD2 4.24Å; F1100-L1116 HydrophobicContact CG-CD1 3.94Å; V1104-L1116 HydrophobicContact CB-CD1 4.46Å; V1104-L1116 HydrophobicContact CG1-CD1 4.5Å; V1104-L1116 HydrophobicContact CG2-CD1 4.22Å; T1112-L1116 HydrophobicContact CG2-CD1 4.23Å; T1112-L1116 WeakPolarHBondContact O-CB 3.39Å; T1112-L1116 VanDerWaalsContact O-CG 3.24Å; T1112-L1116 WeakPolarHBondContact O-CG 3.46Å; T1112-L1116 PolarHBondContact O-N 3.33Å; A1113-L1116 PolarHBondContact O-N 2.98Å; L1114-L1116 VanDerWaalsContact C-N 3.32Å; L1114-L1116 PolarHBondContact O-N 3.44Å; L1116-R1119 PolarHBondContact O-N 3.18Å; L1116-A1120 WeakPolarHBondContact O-CB 3.35Å; L1116-A1120 PolarHBondContact O-N 2.64Å
1117	L	96.1	Very high	92.3	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-66	-37.7	173.7	-73.4	170.7	0	0	0	112.7	S1101 A1113 L1114 R1119 A1120 R1121 N1141 I1142 M1145	S1101-L1117 WeakPolarHBondContact OG-CD2 3.4Å; S1101-L1117 WeakPolarHBondContact OG-CG 3.34Å; A1113-L1117 PolarHBondContact O-N 2.84Å; L1114-L1117 PolarHBondContact O-N 3.38Å; L1114-L1117 VanDerWaalsContact O-N 3.17Å; L1117-R1119 VanDerWaalsContact C-N 3.34Å; L1117-A1120 PolarHBondContact O-N 2.94Å; L1117-R1121 WeakPolarHBondContact O-CB 3.39Å; L1117-R1121 PolarHBondContact O-N 3.19Å; L1117-N1141 HydrophobicContact CD1-CB 3.82Å; L1117-N1141 HydrophobicContact CD2-CB 4.02Å; L1117-I1142 HydrophobicContact CB-CD1 4.16Å; L1117-I1142 HydrophobicContact CB-CG1 3.67Å; L1117-I1142 HydrophobicContact CD1-CG1 3.97Å; L1117-I1142 HydrophobicContact CG-CG1 4.36Å; L1117-M1145 HydrophobicContact CD1-CE 3.71Å; L1117-M1145 HydrophobicContact CD1-SD 3.63Å
1118	Y	95.7	Very high	92.6	Very high	13 Å²	13	14.8 Å²	14.8	5%	0.051	8%	0.084	C	C	.	.	H	α-helix	trans	-64	-40	175.2	-63	-19	0	0	0	111.5	F173 P175 V179 L1114 Q1115 Y1122 I1142	F173-Y1118 PolarHBondContact O-OH 2.95Å; P175-Y1118 HydrophobicContact CB-CD1 4.31Å; P175-Y1118 HydrophobicContact CB-CE1 3.78Å; P175-Y1118 HydrophobicContact CB-CE2 4.14Å; P175-Y1118 WeakPolarHBondContact CD-OH 3.41Å; V179-Y1118 HydrophobicContact CG1-CD1 3.78Å; V179-Y1118 HydrophobicContact CG1-CG 4.16Å; L1114-Y1118 HydrophobicContact CB-CE2 4.1Å; L1114-Y1118 HydrophobicContact CD2-CE1 4.01Å; L1114-Y1118 WeakPolarHBondContact O-CB 3.44Å; L1114-Y1118 WeakPolarHBondContact O-CD1 3.32Å; L1114-Y1118 WeakPolarHBondContact O-CD2 3.43Å; L1114-Y1118 PolarHBondContact O-N 3.5Å; Q1115-Y1118 PolarHBondContact O-N 2.83Å; Y1118-Y1122 WeakPolarHBondContact O-CB 3.29Å; Y1118-Y1122 PolarHBondContact O-N 3.08Å; Y1118-I1142 HydrophobicContact CD1-CD1 3.96Å; Y1118-I1142 HydrophobicContact CD1-CG1 4.34Å; Y1118-I1142 HydrophobicContact CE1-CD1 4.17Å; Y1118-I1142 HydrophobicContact CE1-CG1 4.23Å; Y1118-I1142 HydrophobicContact CE1-CG2 3.84Å
1119	R	94.5	Very high	93	Very high	12 Å²	12	13.6 Å²	13.6	5%	0.045	7%	0.072	C	C	.	.	H	α-helix	trans	-64	-45.4	171.7	178.1	62.7	179.3	-171.2	7.8	111.8	F150 P193 L194 I1088 Y1097 Q1115 L1116 L1117 Y1122 I1123	F150-R1119 HydrophobicContact CD1-CG 4.22Å; F150-R1119 VanDerWaalsContact CE1-CD 3.48Å; F150-R1119 HydrophobicContact CE1-CG 3.93Å; F150-R1119 VanDerWaalsContact CE2-NH1 3.27Å; P193-R1119 PolarHBondContact O-NH1 3.22Å; L194-R1119 PolarHBondContact O-NH1 2.93Å; L194-R1119 PolarHBondContact O-NH2 3.12Å; I1088-R1119 PolarHBondContact O-NH2 2.93Å; Y1097-R1119 HydrophobicContact CD2-CB 4.39Å; Y1097-R1119 HydrophobicContact CD2-CG 3.65Å; Y1097-R1119 HydrophobicContact CE1-CG 4.33Å; Y1097-R1119 HydrophobicContact CE2-CB 4.46Å; Y1097-R1119 HydrophobicContact CE2-CG 3.3Å; Y1097-R1119 HydrophobicContact CG-CG 4.31Å; Q1115-R1119 WeakPolarHBondContact O-CB 3.42Å; Q1115-R1119 PolarHBondContact O-N 3.37Å; L1116-R1119 PolarHBondContact O-N 3.18Å; L1117-R1119 VanDerWaalsContact C-N 3.34Å; R1119-Y1122 PolarHBondContact O-N 2.78Å; R1119-I1123 HydrophobicContact CG-CD1 4.45Å; R1119-I1123 PolarHBondContact O-N 2.83Å; R1119-I1123 VanDerWaalsContact O-N 3.14Å
1120	A	95.9	Very high	93.2	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-59.3	-50	176.7	0	0	0	0	0	111.9	I1098 L1116 L1117 Y1122 I1123 A1124	I1098-A1120 HydrophobicContact CG1-CB 3.78Å; L1116-A1120 WeakPolarHBondContact O-CB 3.35Å; L1116-A1120 PolarHBondContact O-N 2.64Å; L1117-A1120 PolarHBondContact O-N 2.94Å; A1120-Y1122 VanDerWaalsContact C-N 3.34Å; A1120-Y1122 PolarHBondContact O-N 3.12Å; A1120-I1123 PolarHBondContact O-N 2.97Å; A1120-A1124 WeakPolarHBondContact O-CB 3.48Å; A1120-A1124 PolarHBondContact O-N 2.78Å
1121	R	96.6	Very high	93.3	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-58.1	-46.4	177.9	-156.4	-165.5	-164.5	-89.8	-20.7	111.4	V179 L1117 I1123 A1124 L1125 E1130 I1135 I1138 D1139 I1142 N1161	V179-R1121 HydrophobicContact CG1-CB 4.13Å; V179-R1121 HydrophobicContact CG1-CG 4.49Å; V179-R1121 WeakPolarHBondContact O-CD 3.39Å; V179-R1121 PolarHBondContact O-NE 3.37Å; V179-R1121 PolarHBondContact O-NH1 2.73Å; L1117-R1121 WeakPolarHBondContact O-CB 3.39Å; L1117-R1121 PolarHBondContact O-N 3.19Å; R1121-I1123 PolarHBondContact O-N 2.98Å; R1121-A1124 WeakPolarHBondContact O-CB 3.43Å; R1121-A1124 PolarHBondContact O-N 2.96Å; R1121-L1125 VanDerWaalsContact O-CG 3.31Å; R1121-L1125 WeakPolarHBondContact O-CG 3.45Å; R1121-L1125 PolarHBondContact O-N 2.92Å; R1121-E1130 IonicContact CZ-OE1 3.8Å; R1121-E1130 IonicContact CZ-OE2 2.7Å; R1121-E1130 IonicContact NH1-OE1 2.65Å; R1121-E1130 PolarHBondContact NH1-OE1 2.85Å; R1121-E1130 VanDerWaalsContact NH1-OE1 3.12Å; R1121-E1130 IonicContact NH1-OE2 3.25Å; R1121-E1130 PolarHBondContact NH1-OE2 3.06Å; R1121-E1130 IonicContact NH2-OE1 3.73Å; R1121-E1130 IonicContact NH2-OE2 2.93Å; R1121-E1130 PolarHBondContact NH2-OE2 2.99Å; R1121-I1135 HydrophobicContact CG-CD1 4.37Å; R1121-I1138 HydrophobicContact CB-CG2 3.72Å; R1121-I1138 HydrophobicContact CG-CG2 3.91Å; R1121-D1139 IonicContact CZ-OD1 3.36Å; R1121-D1139 IonicContact CZ-OD2 3.61Å; R1121-D1139 IonicContact NE-OD1 3.19Å; R1121-D1139 PolarHBondContact NE-OD1 3.47Å; R1121-D1139 IonicContact NE-OD2 2.69Å; R1121-D1139 IonicContact NH2-OD1 2.74Å; R1121-D1139 PolarHBondContact NH2-OD1 2.93Å; R1121-D1139 IonicContact NH2-OD2 3.59Å; R1121-D1139 PolarHBondContact NH2-OD2 3.38Å; R1121-I1142 HydrophobicContact CB-CD1 4.45Å; R1121-N1161 PolarHBondContact NH2-ND2 3.26Å
1122	Y	95.2	Very high	93.5	Very high	2 Å²	2	11.9 Å²	11.9	1%	0.008	7%	0.065	C	C	.	.	H	α-helix	trans	-60.6	-42.7	-179.4	165.8	-103.1	0	0	0	112.8	Y178 L189 P190 P193 L194 Y1118 R1119 A1120 L1125 L1126	Y178-Y1122 AromaticContact CD2-CD2 3.59Å; Y178-Y1122 HydrophobicContact CD2-CD2 3.59Å; Y178-Y1122 HydrophobicContact CD2-CE2 4.21Å; Y178-Y1122 HydrophobicContact CD2-CG 4.25Å; Y178-Y1122 AromaticContact CE2-CD2 3.86Å; Y178-Y1122 HydrophobicContact CE2-CD2 3.86Å; Y178-Y1122 HydrophobicContact CE2-CE2 4.47Å; Y178-Y1122 HydrophobicContact CE2-CG 4.13Å; L189-Y1122 HydrophobicContact CB-CE2 4.43Å; L189-Y1122 HydrophobicContact CD2-CD2 4.29Å; L189-Y1122 HydrophobicContact CD2-CE2 4.48Å; P190-Y1122 WeakPolarHBondContact O-CE2 3.28Å; P190-Y1122 PolarHBondContact O-OH 3.4Å; P193-Y1122 HydrophobicContact CB-CE1 4.44Å; L194-Y1122 HydrophobicContact CB-CE1 4.25Å; L194-Y1122 WeakPolarHBondContact CB-OH 3.35Å; L194-Y1122 HydrophobicContact CD1-CE1 3.59Å; L194-Y1122 PolarHBondContact N-OH 3.03Å; Y1118-Y1122 WeakPolarHBondContact O-CB 3.29Å; Y1118-Y1122 PolarHBondContact O-N 3.08Å; R1119-Y1122 PolarHBondContact O-N 2.78Å; A1120-Y1122 VanDerWaalsContact C-N 3.34Å; A1120-Y1122 PolarHBondContact O-N 3.12Å; Y1122-L1125 PolarHBondContact O-N 3.34Å; Y1122-L1126 PolarHBondContact O-N 2.94Å; Y1122-L1126 VanDerWaalsContact O-N 3.13Å
1123	I	95.3	Very high	93.6	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-66.4	-43	173.7	-63.5	169.9	0	0	0	110.8	I1088 A1094 Y1097 R1119 A1120 R1121 L1125 L1126 C1127	I1088-I1123 VanDerWaalsContact O-CD1 3.31Å; I1088-I1123 WeakPolarHBondContact O-CD1 3.26Å; A1094-I1123 HydrophobicContact CB-CB 4.01Å; A1094-I1123 HydrophobicContact CB-CG2 3.89Å; Y1097-I1123 HydrophobicContact CD2-CD1 4.21Å; Y1097-I1123 HydrophobicContact CE2-CD1 3.62Å; R1119-I1123 HydrophobicContact CG-CD1 4.45Å; R1119-I1123 PolarHBondContact O-N 2.83Å; R1119-I1123 VanDerWaalsContact O-N 3.14Å; A1120-I1123 PolarHBondContact O-N 2.97Å; R1121-I1123 PolarHBondContact O-N 2.98Å; I1123-L1125 VanDerWaalsContact C-N 3.3Å; I1123-L1125 PolarHBondContact O-N 3.06Å; I1123-L1126 CarbonylContact O-C 3.47Å; I1123-L1126 WeakPolarHBondContact O-CA 3.42Å; I1123-L1126 WeakPolarHBondContact O-CB 3.39Å; I1123-L1126 PolarHBondContact O-N 2.98Å; I1123-C1127 PolarHBondContact O-N 3Å; I1123-C1127 PolarHBondContact O-SG 2.72Å
1124	A	94.8	Very high	93.6	Very high	3 Å²	3	12 Å²	12	3%	0.025	6%	0.064	C	C	.	.	H	α-helix	trans	-57.6	-42.4	177.3	0	0	0	0	0	111.6	A1120 R1121 L1126 C1127 H1128 G1129 I1135 I1138	A1120-A1124 WeakPolarHBondContact O-CB 3.48Å; A1120-A1124 PolarHBondContact O-N 2.78Å; R1121-A1124 WeakPolarHBondContact O-CB 3.43Å; R1121-A1124 PolarHBondContact O-N 2.96Å; A1124-L1126 VanDerWaalsContact C-N 3.35Å; A1124-L1126 PolarHBondContact O-N 3.33Å; A1124-C1127 PolarHBondContact O-N 3.36Å; A1124-H1128 PolarHBondContact O-CE1 2.99Å; A1124-H1128 PolarHBondContact O-N 2.67Å; A1124-H1128 PolarHBondContact O-ND1 3.31Å; A1124-G1129 PolarHBondContact O-N 3.08Å; A1124-I1135 HydrophobicContact CB-CD1 3.75Å; A1124-I1138 HydrophobicContact CB-CD1 3.95Å
1125	L	94	Very high	93.6	Very high	7 Å²	7	12 Å²	12	4%	0.037	6%	0.064	C	C	.	.	H	α-helix	trans	-62.2	-39	173	-65.1	176.3	0	0	0	112.7	L189 Q954 R1121 Y1122 I1123 C1127 G1129 E1130 I1135	L189-L1125 HydrophobicContact CD1-CB 3.78Å; L189-L1125 HydrophobicContact CD2-CB 4Å; L189-L1125 HydrophobicContact CD2-CD1 3.97Å; Q954-L1125 PolarHBondContact NE2-O 3.34Å; R1121-L1125 VanDerWaalsContact O-CG 3.31Å; R1121-L1125 WeakPolarHBondContact O-CG 3.45Å; R1121-L1125 PolarHBondContact O-N 2.92Å; Y1122-L1125 PolarHBondContact O-N 3.34Å; I1123-L1125 VanDerWaalsContact C-N 3.3Å; I1123-L1125 PolarHBondContact O-N 3.06Å; L1125-C1127 VanDerWaalsContact C-N 3.34Å; L1125-G1129 WeakPolarHBondContact O-CA 3.46Å; L1125-G1129 PolarHBondContact O-N 2.95Å; L1125-E1130 HydrophobicContact CD2-CB 4.42Å; L1125-E1130 HydrophobicContact CD2-CG 3.82Å; L1125-I1135 HydrophobicContact CD2-CD1 4.19Å
1126	L	92.5	Very high	93.6	Very high	0 Å²	0	9.6 Å²	9.6	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-72	-24.5	177.6	-175.5	61.9	0	0	0	113.4	L189 L194 I953 Q954 Y1122 I1123 A1124	L189-L1126 HydrophobicContact CD1-CB 4.19Å; L189-L1126 HydrophobicContact CD1-CD1 4.47Å; L194-L1126 HydrophobicContact CD1-CD2 3.55Å; L194-L1126 HydrophobicContact CD2-CD2 4.12Å; L194-L1126 HydrophobicContact CG-CD2 4.49Å; I953-L1126 HydrophobicContact CG1-CD1 3.97Å; I953-L1126 HydrophobicContact CG2-CD1 4.11Å; Q954-L1126 WeakPolarHBondContact CG-O 3.33Å; Y1122-L1126 PolarHBondContact O-N 2.94Å; Y1122-L1126 VanDerWaalsContact O-N 3.13Å; I1123-L1126 CarbonylContact O-C 3.47Å; I1123-L1126 WeakPolarHBondContact O-CA 3.42Å; I1123-L1126 WeakPolarHBondContact O-CB 3.39Å; I1123-L1126 PolarHBondContact O-N 2.98Å; A1124-L1126 VanDerWaalsContact C-N 3.35Å; A1124-L1126 PolarHBondContact O-N 3.33Å
1127	C	92.6	Very high	93.4	Very high	10 Å²	10	10.8 Å²	10.8	7%	0.068	6%	0.059	C	C	.	.	H	α-helix	trans	-86.1	-52.4	176.2	-73.5	0	0	0	0	113.3	D796 I1123 A1124 L1125	D796-C1127 HydrophobicContact CB-CB 4.19Å; I1123-C1127 PolarHBondContact O-N 3Å; I1123-C1127 PolarHBondContact O-SG 2.72Å; A1124-C1127 PolarHBondContact O-N 3.36Å; L1125-C1127 VanDerWaalsContact C-N 3.34Å
1128	H	90.9	Very high	93.3	Very high	30 Å²	30	10.8 Å²	10.8	14%	0.139	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.1	-13.7	-173.2	54.4	56.6	0	0	0	115.4	Q795 M833 A1124 H1132 E1134	Q795-H1128 WeakPolarHBondContact O-CB 3.35Å; Q795-H1128 PolarHBondContact O-CD2 2.87Å; Q795-H1128 VanDerWaalsContact O-CD2 3.22Å; M833-H1128 HydrophobicContact CE-CB 4.05Å; A1124-H1128 PolarHBondContact O-CE1 2.99Å; A1124-H1128 PolarHBondContact O-N 2.67Å; A1124-H1128 PolarHBondContact O-ND1 3.31Å; H1128-H1132 HydrophobicContact CB-CB 4.32Å; H1128-H1132 AromaticContact CD2-CE1 3.77Å; H1128-H1132 AromaticContact CD2-CG 3.51Å; H1128-H1132 AromaticContact CD2-ND1 3.2Å; H1128-H1132 PolarHBondContact CD2-ND1 2.93Å; H1128-H1132 WeakPolarHBondContact CE1-CB 3.34Å; H1128-H1132 AromaticContact CE1-CG 3.69Å; H1128-H1132 AromaticContact CE1-ND1 3.52Å; H1128-H1132 AromaticContact CG-CG 3.61Å; H1128-H1132 AromaticContact CG-ND1 3.8Å; H1128-H1132 WeakPolarHBondContact ND1-CB 3.39Å; H1128-H1132 AromaticContact ND1-CG 3.71Å; H1128-H1132 AromaticContact ND1-ND1 3.96Å; H1128-H1132 AromaticContact NE2-CE1 3.86Å; H1128-H1132 AromaticContact NE2-CG 3.56Å; H1128-H1132 AromaticContact NE2-ND1 2.99Å; H1128-H1132 PolarHBondContact NE2-ND1 3.17Å; H1128-E1134 IonicContact NE2-OE2 3.76Å
1129	G	90.6	Very high	93.4	Very high	9 Å²	9	10.1 Å²	10.1	9%	0.093	6%	0.057	C	C	.	.			trans	81.3	-173.4	-179	0	0	0	0	0	114.1	Q954 A1124 L1125 C1131	Q954-G1129 VanDerWaalsContact NE2-CA 3.31Å; Q954-G1129 VanDerWaalsContact NE2-N 3.13Å; A1124-G1129 PolarHBondContact O-N 3.08Å; L1125-G1129 WeakPolarHBondContact O-CA 3.46Å; L1125-G1129 PolarHBondContact O-N 2.95Å; G1129-C1131 VanDerWaalsContact C-N 3.28Å; G1129-C1131 PolarHBondContact O-N 2.85Å
1130	E	90.7	Very high	93.4	Very high	33 Å²	33	9.9 Å²	9.9	15%	0.154	6%	0.057	C	C	.	.	S	Bend	trans	-59.8	-31.9	-172.8	-65.4	-75.3	-174	0	0	114	G182 R1121 L1125 H1132	G182-E1130 PolarHBondContact N-OE1 3.07Å; R1121-E1130 IonicContact CZ-OE1 3.8Å; R1121-E1130 IonicContact CZ-OE2 2.7Å; R1121-E1130 IonicContact NH1-OE1 2.65Å; R1121-E1130 PolarHBondContact NH1-OE1 2.85Å; R1121-E1130 VanDerWaalsContact NH1-OE1 3.12Å; R1121-E1130 IonicContact NH1-OE2 3.25Å; R1121-E1130 PolarHBondContact NH1-OE2 3.06Å; R1121-E1130 IonicContact NH2-OE1 3.73Å; R1121-E1130 IonicContact NH2-OE2 2.93Å; R1121-E1130 PolarHBondContact NH2-OE2 2.99Å; L1125-E1130 HydrophobicContact CD2-CB 4.42Å; L1125-E1130 HydrophobicContact CD2-CG 3.82Å; E1130-H1132 PolarHBondContact O-N 2.86Å; E1130-H1132 VanDerWaalsContact O-N 3.17Å
1131	C	90.8	Very high	93.3	Very high	46 Å²	46	9.9 Å²	9.9	31%	0.311	6%	0.057	S	C	.	.	S	Bend	trans	-91.4	64.6	-172.2	-57.3	0	0	0	0	113.1	Y829 G1129	Y829-C1131 WeakPolarHBondContact CB-O 3.23Å; G1129-C1131 VanDerWaalsContact C-N 3.28Å; G1129-C1131 PolarHBondContact O-N 2.85Å
1132	H	93.3	Very high	93.4	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	6%	0.057	C	C	.	.	S	Bend	trans	-137.5	146.4	175.8	-171.5	-121	0	0	0	111.9	P794 Y829 H1128 E1130 E1134 I1135 F1169	P794-H1132 PolarHBondContact O-NE2 2.86Å; Y829-H1132 AromaticContact CD2-CD2 3.45Å; Y829-H1132 VanDerWaalsContact CD2-CD2 3.45Å; Y829-H1132 WeakPolarHBondContact CD2-CD2 3.14Å; Y829-H1132 AromaticContact CD2-NE2 3.97Å; Y829-H1132 AromaticContact CE2-CD2 3.75Å; Y829-H1132 AromaticContact CE2-NE2 3.82Å; H1128-H1132 HydrophobicContact CB-CB 4.32Å; H1128-H1132 AromaticContact CD2-CE1 3.77Å; H1128-H1132 AromaticContact CD2-CG 3.51Å; H1128-H1132 AromaticContact CD2-ND1 3.2Å; H1128-H1132 PolarHBondContact CD2-ND1 2.93Å; H1128-H1132 WeakPolarHBondContact CE1-CB 3.34Å; H1128-H1132 AromaticContact CE1-CG 3.69Å; H1128-H1132 AromaticContact CE1-ND1 3.52Å; H1128-H1132 AromaticContact CG-CG 3.61Å; H1128-H1132 AromaticContact CG-ND1 3.8Å; H1128-H1132 WeakPolarHBondContact ND1-CB 3.39Å; H1128-H1132 AromaticContact ND1-CG 3.71Å; H1128-H1132 AromaticContact ND1-ND1 3.96Å; H1128-H1132 AromaticContact NE2-CE1 3.86Å; H1128-H1132 AromaticContact NE2-CG 3.56Å; H1128-H1132 AromaticContact NE2-ND1 2.99Å; H1128-H1132 PolarHBondContact NE2-ND1 3.17Å; E1130-H1132 PolarHBondContact O-N 2.86Å; E1130-H1132 VanDerWaalsContact O-N 3.17Å; H1132-E1134 WeakPolarHBondContact ND1-CB 3.27Å; H1132-E1134 PolarHBondContact ND1-N 2.97Å; H1132-E1134 PolarHBondContact O-N 3.17Å; H1132-I1135 HydrophobicContact CB-CG1 4.33Å; H1132-I1135 WeakPolarHBondContact O-CB 3.39Å; H1132-I1135 PolarHBondContact O-N 3.42Å; H1132-I1135 VanDerWaalsContact O-N 3.15Å; H1132-F1169 VanDerWaalsContact C-CE2 3.43Å
1133	P	92.4	Very high	93.4	Very high	10 Å²	10	9.8 Å²	9.8	7%	0.065	6%	0.056	C	C	.	.	H	α-helix	trans	-54.9	-34.4	177.7	-30.7	38.6	0	0	0	114.6	L790 T793 Y829 I1135 T1136 F1169	L790-P1133 HydrophobicContact CD2-CB 4.42Å; L790-P1133 HydrophobicContact CD2-CG 3.77Å; T793-P1133 HydrophobicContact CG2-CB 4.12Å; T793-P1133 HydrophobicContact CG2-CG 4.17Å; Y829-P1133 HydrophobicContact CD1-CG 4.47Å; Y829-P1133 HydrophobicContact CE1-CG 4.02Å; P1133-I1135 PolarHBondContact O-N 2.74Å; P1133-T1136 WeakPolarHBondContact O-CB 3.45Å; P1133-T1136 PolarHBondContact O-N 3.1Å; P1133-T1136 VanDerWaalsContact O-N 3.11Å; P1133-T1136 PolarHBondContact O-OG1 3.41Å; P1133-F1169 HydrophobicContact CB-CD2 4.26Å; P1133-F1169 HydrophobicContact CB-CE2 4.45Å; P1133-F1169 HydrophobicContact CG-CD1 4.14Å; P1133-F1169 HydrophobicContact CG-CD2 3.9Å; P1133-F1169 HydrophobicContact CG-CE1 4.23Å; P1133-F1169 HydrophobicContact CG-CE2 3.97Å; P1133-F1169 HydrophobicContact CG-CG 4Å; P1133-F1169 HydrophobicContact CG-CZ 4.14Å
1134	E	90.8	Very high	93.3	Very high	14 Å²	14	9.9 Å²	9.9	7%	0.065	6%	0.057	C	C	.	.	H	α-helix	trans	-65.2	-33.6	179	-164.3	172.4	-162.5	0	0	112.9	Q795 T1095 I1098 H1128 H1132 T1136 Q1137 I1138	Q795-E1134 WeakPolarHBondContact CG-OE2 3.4Å; T1095-E1134 PolarHBondContact OG1-OE1 3.45Å; I1098-E1134 HydrophobicContact CD1-CG 4.25Å; H1128-E1134 IonicContact NE2-OE2 3.76Å; H1132-E1134 WeakPolarHBondContact ND1-CB 3.27Å; H1132-E1134 PolarHBondContact ND1-N 2.97Å; H1132-E1134 PolarHBondContact O-N 3.17Å; E1134-T1136 PolarHBondContact O-N 3.32Å; E1134-Q1137 WeakPolarHBondContact O-CB 3.3Å; E1134-Q1137 PolarHBondContact O-N 3.4Å; E1134-I1138 HydrophobicContact CG-CD1 4.23Å; E1134-I1138 WeakPolarHBondContact O-CG1 3.34Å; E1134-I1138 PolarHBondContact O-N 2.94Å
1135	I	94.9	Very high	93.2	Very high	0 Å²	0	9.7 Å²	9.7	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-58.8	-34.3	173.7	-61.1	-65.1	0	0	0	110.9	R1121 A1124 L1125 H1132 P1133 Q1137 I1138 D1139 L1165	R1121-I1135 HydrophobicContact CG-CD1 4.37Å; A1124-I1135 HydrophobicContact CB-CD1 3.75Å; L1125-I1135 HydrophobicContact CD2-CD1 4.19Å; H1132-I1135 HydrophobicContact CB-CG1 4.33Å; H1132-I1135 WeakPolarHBondContact O-CB 3.39Å; H1132-I1135 PolarHBondContact O-N 3.42Å; H1132-I1135 VanDerWaalsContact O-N 3.15Å; P1133-I1135 PolarHBondContact O-N 2.74Å; I1135-Q1137 VanDerWaalsContact C-N 3.28Å; I1135-Q1137 PolarHBondContact O-N 2.81Å; I1135-I1138 PolarHBondContact O-N 2.9Å; I1135-D1139 WeakPolarHBondContact CG2-OD2 3.2Å; I1135-D1139 VanDerWaalsContact O-CB 3.26Å; I1135-D1139 WeakPolarHBondContact O-CB 3.47Å; I1135-D1139 VanDerWaalsContact O-CG 3.29Å; I1135-D1139 PolarHBondContact O-N 3.48Å; I1135-L1165 HydrophobicContact CB-CD1 3.84Å; I1135-L1165 HydrophobicContact CG2-CD1 3.67Å
1136	T	93.4	Very high	93.2	Very high	11 Å²	11	9.4 Å²	9.4	7%	0.067	5%	0.054	C	C	.	.	H	α-helix	trans	-58.1	-42.1	175.9	-51.2	0	0	0	0	111.8	P1133 E1134 T1140 A1162 L1165 I1166	P1133-T1136 WeakPolarHBondContact O-CB 3.45Å; P1133-T1136 PolarHBondContact O-N 3.1Å; P1133-T1136 VanDerWaalsContact O-N 3.11Å; P1133-T1136 PolarHBondContact O-OG1 3.41Å; E1134-T1136 PolarHBondContact O-N 3.32Å; T1136-T1140 WeakPolarHBondContact O-CB 3.33Å; T1136-T1140 PolarHBondContact O-N 3.04Å; T1136-T1140 VanDerWaalsContact O-N 3.11Å; T1136-T1140 PolarHBondContact O-OG1 3.46Å; T1136-A1162 HydrophobicContact CG2-CB 4.4Å; T1136-L1165 WeakPolarHBondContact OG1-CB 3.41Å; T1136-I1166 HydrophobicContact CG2-CD1 3.82Å; T1136-I1166 HydrophobicContact CG2-CG1 3.42Å; T1136-I1166 VanDerWaalsContact CG2-CG1 3.42Å
1137	Q	90.6	Very high	93.3	Very high	26 Å²	26	9.6 Å²	9.6	12%	0.121	6%	0.055	C	C	.	.	H	α-helix	trans	-73.4	-45.5	-179.2	-177.6	175.6	-15.3	0	0	110.8	E1134 I1135 T1140 N1141 N1326	E1134-Q1137 WeakPolarHBondContact O-CB 3.3Å; E1134-Q1137 PolarHBondContact O-N 3.4Å; I1135-Q1137 VanDerWaalsContact C-N 3.28Å; I1135-Q1137 PolarHBondContact O-N 2.81Å; Q1137-T1140 PolarHBondContact O-N 3.35Å; Q1137-N1141 PolarHBondContact O-N 2.75Å; Q1137-N1141 PolarHBondContact O-ND2 2.99Å; Q1137-N1141 PolarHBondContact O-OD1 3.5Å; Q1137-N1326 WeakPolarHBondContact CG-OD1 3.42Å; Q1137-N1326 PolarHBondContact NE2-OD1 2.91Å
1138	I	94.5	Very high	93.2	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-59.9	-49.2	177.3	-61.7	167.9	0	0	0	110.8	I1098 R1121 A1124 E1134 I1135 T1140 N1141 I1142	I1098-I1138 HydrophobicContact CD1-CD1 3.89Å; I1098-I1138 HydrophobicContact CD1-CG1 3.56Å; I1098-I1138 HydrophobicContact CG1-CG1 4.07Å; R1121-I1138 HydrophobicContact CB-CG2 3.72Å; R1121-I1138 HydrophobicContact CG-CG2 3.91Å; A1124-I1138 HydrophobicContact CB-CD1 3.95Å; E1134-I1138 HydrophobicContact CG-CD1 4.23Å; E1134-I1138 WeakPolarHBondContact O-CG1 3.34Å; E1134-I1138 PolarHBondContact O-N 2.94Å; I1135-I1138 PolarHBondContact O-N 2.9Å; I1138-T1140 PolarHBondContact O-N 3.05Å; I1138-N1141 WeakPolarHBondContact O-CB 3.21Å; I1138-N1141 PolarHBondContact O-N 3.06Å; I1138-N1141 VanDerWaalsContact O-N 3.16Å; I1138-I1142 HydrophobicContact CG2-CD1 3.74Å; I1138-I1142 HydrophobicContact CG2-CG1 4.39Å; I1138-I1142 WeakPolarHBondContact O-CG1 3.31Å; I1138-I1142 PolarHBondContact O-N 2.88Å
1139	D	97.2	Very high	93.2	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-68.4	-36.1	-177.8	-71.4	4.8	0	0	0	112	R1121 I1135 N1141 I1142 G1143 F1158 N1161 A1162	R1121-D1139 IonicContact CZ-OD1 3.36Å; R1121-D1139 IonicContact CZ-OD2 3.61Å; R1121-D1139 IonicContact NE-OD1 3.19Å; R1121-D1139 PolarHBondContact NE-OD1 3.47Å; R1121-D1139 IonicContact NE-OD2 2.69Å; R1121-D1139 IonicContact NH2-OD1 2.74Å; R1121-D1139 PolarHBondContact NH2-OD1 2.93Å; R1121-D1139 IonicContact NH2-OD2 3.59Å; R1121-D1139 PolarHBondContact NH2-OD2 3.38Å; I1135-D1139 WeakPolarHBondContact CG2-OD2 3.2Å; I1135-D1139 VanDerWaalsContact O-CB 3.26Å; I1135-D1139 WeakPolarHBondContact O-CB 3.47Å; I1135-D1139 VanDerWaalsContact O-CG 3.29Å; I1135-D1139 PolarHBondContact O-N 3.48Å; D1139-N1141 VanDerWaalsContact C-N 3.32Å; D1139-N1141 PolarHBondContact O-N 3.29Å; D1139-I1142 PolarHBondContact O-N 3.36Å; D1139-G1143 PolarHBondContact O-N 2.89Å; D1139-F1158 HydrophobicContact CB-CB 4.19Å; D1139-F1158 HydrophobicContact CB-CD1 4.14Å; D1139-F1158 WeakPolarHBondContact O-CB 3.12Å; D1139-N1161 PolarHBondContact OD2-ND2 3.04Å; D1139-A1162 HydrophobicContact CB-CB 4.13Å
1140	T	94.8	Very high	93.1	Very high	6 Å²	6	12.2 Å²	12.2	4%	0.037	8%	0.076	C	C	.	.	H	α-helix	trans	-63	-40.4	172.2	-57.8	0	0	0	0	111.2	T1136 Q1137 I1138 L1144 L1183 V1325	T1136-T1140 WeakPolarHBondContact O-CB 3.33Å; T1136-T1140 PolarHBondContact O-N 3.04Å; T1136-T1140 VanDerWaalsContact O-N 3.11Å; T1136-T1140 PolarHBondContact O-OG1 3.46Å; Q1137-T1140 PolarHBondContact O-N 3.35Å; I1138-T1140 PolarHBondContact O-N 3.05Å; T1140-L1144 HydrophobicContact CG2-CD1 4.09Å; T1140-L1144 WeakPolarHBondContact O-CB 3.42Å; T1140-L1144 WeakPolarHBondContact O-CD1 3.37Å; T1140-L1144 VanDerWaalsContact O-CG 3.29Å; T1140-L1144 WeakPolarHBondContact O-CG 3.16Å; T1140-L1144 PolarHBondContact O-N 3.46Å; T1140-L1144 VanDerWaalsContact O-N 3.08Å; T1140-L1183 HydrophobicContact CG2-CD1 4.02Å; T1140-V1325 HydrophobicContact CG2-CG1 3.98Å; T1140-V1325 HydrophobicContact CG2-CG2 3.95Å
1141	N	94.5	Very high	93.2	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-67.5	-45.8	177.7	-67.3	-15.3	0	0	0	111.9	L1117 Q1137 I1138 D1139 L1144 M1145 L1322 N1326	L1117-N1141 HydrophobicContact CD1-CB 3.82Å; L1117-N1141 HydrophobicContact CD2-CB 4.02Å; Q1137-N1141 PolarHBondContact O-N 2.75Å; Q1137-N1141 PolarHBondContact O-ND2 2.99Å; Q1137-N1141 PolarHBondContact O-OD1 3.5Å; I1138-N1141 WeakPolarHBondContact O-CB 3.21Å; I1138-N1141 PolarHBondContact O-N 3.06Å; I1138-N1141 VanDerWaalsContact O-N 3.16Å; D1139-N1141 VanDerWaalsContact C-N 3.32Å; D1139-N1141 PolarHBondContact O-N 3.29Å; N1141-L1144 PolarHBondContact O-N 2.64Å; N1141-M1145 WeakPolarHBondContact O-CG 3.49Å; N1141-M1145 PolarHBondContact O-N 3.15Å; N1141-M1145 VanDerWaalsContact O-N 3.09Å; N1141-L1322 HydrophobicContact CB-CD2 3.96Å; N1141-L1322 VanDerWaalsContact OD1-CD2 3.3Å; N1141-L1322 WeakPolarHBondContact OD1-CD2 3.22Å; N1141-N1326 PolarHBondContact ND2-ND2 2.98Å; N1141-N1326 PolarHBondContact ND2-OD1 3.23Å; N1141-N1326 PolarHBondContact OD1-ND2 2.83Å; N1141-N1326 PolarHBondContact OD1-OD1 2.7Å
1142	I	96.9	Very high	93.4	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-60.6	-49.1	176.6	-69.2	169.5	0	0	0	110.4	L1114 L1117 Y1118 R1121 I1138 D1139 L1144 M1145 L1146 F1158	L1114-I1142 HydrophobicContact CD2-CG2 4.28Å; L1117-I1142 HydrophobicContact CB-CD1 4.16Å; L1117-I1142 HydrophobicContact CB-CG1 3.67Å; L1117-I1142 HydrophobicContact CD1-CG1 3.97Å; L1117-I1142 HydrophobicContact CG-CG1 4.36Å; Y1118-I1142 HydrophobicContact CD1-CD1 3.96Å; Y1118-I1142 HydrophobicContact CD1-CG1 4.34Å; Y1118-I1142 HydrophobicContact CE1-CD1 4.17Å; Y1118-I1142 HydrophobicContact CE1-CG1 4.23Å; Y1118-I1142 HydrophobicContact CE1-CG2 3.84Å; R1121-I1142 HydrophobicContact CB-CD1 4.45Å; I1138-I1142 HydrophobicContact CG2-CD1 3.74Å; I1138-I1142 HydrophobicContact CG2-CG1 4.39Å; I1138-I1142 WeakPolarHBondContact O-CG1 3.31Å; I1138-I1142 PolarHBondContact O-N 2.88Å; D1139-I1142 PolarHBondContact O-N 3.36Å; I1142-L1144 VanDerWaalsContact C-N 3.3Å; I1142-L1144 PolarHBondContact O-N 3.25Å; I1142-M1145 PolarHBondContact O-N 3.2Å; I1142-L1146 HydrophobicContact CG2-CD1 3.57Å; I1142-L1146 HydrophobicContact CG2-CG 4.2Å; I1142-L1146 WeakPolarHBondContact O-CB 3.43Å; I1142-L1146 WeakPolarHBondContact O-CG 3.47Å; I1142-L1146 PolarHBondContact O-N 2.87Å; I1142-F1158 HydrophobicContact CB-CD1 4.14Å; I1142-F1158 HydrophobicContact CB-CE1 4.4Å; I1142-F1158 HydrophobicContact CB-CG 4.22Å; I1142-F1158 HydrophobicContact CD1-CD1 4.23Å; I1142-F1158 HydrophobicContact CD1-CE1 3.89Å; I1142-F1158 HydrophobicContact CD1-CZ 4.48Å; I1142-F1158 HydrophobicContact CG2-CB 4.5Å; I1142-F1158 HydrophobicContact CG2-CD1 3.83Å; I1142-F1158 HydrophobicContact CG2-CD2 3.53Å; I1142-F1158 HydrophobicContact CG2-CE1 3.84Å; I1142-F1158 HydrophobicContact CG2-CE2 3.57Å; I1142-F1158 HydrophobicContact CG2-CG 3.69Å; I1142-F1158 HydrophobicContact CG2-CZ 3.73Å
1143	G	95.7	Very high	93.5	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-58.2	-41.1	178.9	0	0	0	0	0	112.7	D1139 L1146 Q1147 A1155 F1159	D1139-G1143 PolarHBondContact O-N 2.89Å; G1143-L1146 PolarHBondContact O-N 3.37Å; G1143-Q1147 VanDerWaalsContact O-CB 3.26Å; G1143-Q1147 WeakPolarHBondContact O-CB 3.27Å; G1143-Q1147 PolarHBondContact O-N 3.36Å; G1143-A1155 WeakPolarHBondContact O-CB 3.37Å; G1143-F1159 WeakPolarHBondContact O-CZ 3.37Å
1144	L	93.7	Very high	93.6	Very high	2 Å²	2	17.3 Å²	17.3	1%	0.01	10%	0.099	C	C	.	.	H	α-helix	trans	-63.6	-41.9	176.1	-81.8	168.8	0	0	0	112.9	T1140 N1141 I1142 L1148 F1159 L1183 V1318 T1321 L1322 V1325	T1140-L1144 HydrophobicContact CG2-CD1 4.09Å; T1140-L1144 WeakPolarHBondContact O-CB 3.42Å; T1140-L1144 WeakPolarHBondContact O-CD1 3.37Å; T1140-L1144 VanDerWaalsContact O-CG 3.29Å; T1140-L1144 WeakPolarHBondContact O-CG 3.16Å; T1140-L1144 PolarHBondContact O-N 3.46Å; T1140-L1144 VanDerWaalsContact O-N 3.08Å; N1141-L1144 PolarHBondContact O-N 2.64Å; I1142-L1144 VanDerWaalsContact C-N 3.3Å; I1142-L1144 PolarHBondContact O-N 3.25Å; L1144-L1148 PolarHBondContact O-N 3.39Å; L1144-F1159 HydrophobicContact CD2-CZ 4.2Å; L1144-F1159 HydrophobicContact CG-CE1 4.04Å; L1144-F1159 HydrophobicContact CG-CZ 4.02Å; L1144-F1159 VanDerWaalsContact N-CZ 3.32Å; L1144-L1183 HydrophobicContact CD1-CD1 4.44Å; L1144-L1183 HydrophobicContact CD2-CD1 4.17Å; L1144-L1183 HydrophobicContact CD2-CD2 3.98Å; L1144-L1183 HydrophobicContact CG-CD1 4.3Å; L1144-V1318 HydrophobicContact CB-CG1 3.98Å; L1144-V1318 HydrophobicContact CD2-CG1 4.47Å; L1144-T1321 HydrophobicContact CD1-CG2 3.87Å; L1144-T1321 HydrophobicContact CD2-CG2 3.74Å; L1144-T1321 HydrophobicContact CG-CG2 4.5Å; L1144-L1322 HydrophobicContact CB-CD2 4.04Å; L1144-L1322 HydrophobicContact CB-CG 4.46Å; L1144-L1322 HydrophobicContact CD1-CD2 3.66Å; L1144-L1322 HydrophobicContact CD1-CG 4.05Å; L1144-V1325 HydrophobicContact CD1-CG2 4.49Å
1145	M	93.2	Very high	93.9	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-72.8	-36.5	178.2	-65	-171.5	-168.7	0	0	112.5	L1102 F1105 A1113 L1114 L1117 N1141 I1142 L1148 V1149 L1322	L1102-M1145 HydrophobicContact CD2-CE 4.25Å; F1105-M1145 HydrophobicContact CB-CE 3.64Å; F1105-M1145 HydrophobicContact CB-SD 4.35Å; F1105-M1145 HydrophobicContact CD1-CE 4.43Å; F1105-M1145 HydrophobicContact CD2-CE 3.69Å; F1105-M1145 HydrophobicContact CD2-CG 3.66Å; F1105-M1145 HydrophobicContact CD2-SD 3.58Å; F1105-M1145 VanDerWaalsContact CD2-SD 3.58Å; F1105-M1145 HydrophobicContact CE2-CB 4.35Å; F1105-M1145 HydrophobicContact CE2-CE 4.46Å; F1105-M1145 HydrophobicContact CE2-CG 3.64Å; F1105-M1145 HydrophobicContact CE2-SD 4.2Å; F1105-M1145 HydrophobicContact CG-CE 3.66Å; F1105-M1145 HydrophobicContact CG-CG 4.49Å; F1105-M1145 HydrophobicContact CG-SD 4.18Å; F1105-M1145 HydrophobicContact CZ-CG 4.47Å; A1113-M1145 HydrophobicContact CB-CE 4.25Å; A1113-M1145 HydrophobicContact CB-SD 3.87Å; L1114-M1145 HydrophobicContact CD1-CB 4.18Å; L1114-M1145 HydrophobicContact CD2-CB 3.65Å; L1114-M1145 HydrophobicContact CD2-SD 4.33Å; L1114-M1145 HydrophobicContact CG-CB 3.85Å; L1114-M1145 HydrophobicContact CG-SD 4.22Å; L1117-M1145 HydrophobicContact CD1-CE 3.71Å; L1117-M1145 HydrophobicContact CD1-SD 3.63Å; N1141-M1145 WeakPolarHBondContact O-CG 3.49Å; N1141-M1145 PolarHBondContact O-N 3.15Å; N1141-M1145 VanDerWaalsContact O-N 3.09Å; I1142-M1145 PolarHBondContact O-N 3.2Å; M1145-L1148 WeakPolarHBondContact O-CB 3.33Å; M1145-L1148 PolarHBondContact O-N 3.08Å; M1145-V1149 WeakPolarHBondContact O-CG2 3.38Å; M1145-V1149 PolarHBondContact O-N 3.15Å; M1145-L1322 HydrophobicContact CE-CD1 3.89Å
1146	L	94.2	Very high	94	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-69.1	-38.3	174.3	-71.4	171.8	0	0	0	112.3	L1114 I1142 G1143 L1148 V1149 G1150 E1151 L1154 A1155 F1158	L1114-L1146 HydrophobicContact CD1-CD2 4.13Å; L1114-L1146 HydrophobicContact CD2-CG 4.3Å; I1142-L1146 HydrophobicContact CG2-CD1 3.57Å; I1142-L1146 HydrophobicContact CG2-CG 4.2Å; I1142-L1146 WeakPolarHBondContact O-CB 3.43Å; I1142-L1146 WeakPolarHBondContact O-CG 3.47Å; I1142-L1146 PolarHBondContact O-N 2.87Å; G1143-L1146 PolarHBondContact O-N 3.37Å; L1146-L1148 PolarHBondContact O-N 3.22Å; L1146-V1149 PolarHBondContact O-N 2.86Å; L1146-G1150 PolarHBondContact O-N 3.18Å; L1146-E1151 HydrophobicContact CB-CB 4.36Å; L1146-E1151 HydrophobicContact CD2-CB 3.96Å; L1146-E1151 HydrophobicContact CD2-CG 4.46Å; L1146-E1151 PolarHBondContact O-N 2.87Å; L1146-L1154 HydrophobicContact CD1-CB 3.86Å; L1146-A1155 HydrophobicContact CB-CB 3.84Å; L1146-F1158 HydrophobicContact CD1-CD2 3.76Å; L1146-F1158 HydrophobicContact CD1-CE2 3.75Å
1147	Q	93.5	Very high	94.2	Very high	5 Å²	5	19.9 Å²	19.9	2%	0.023	11%	0.111	C	C	.	.	H	α-helix	trans	-58.9	-37.3	173.7	-172.6	-165.8	75.6	0	0	111.6	G1143 L1152 A1155 F1159 L1183 T1187 Y1190 M1312 P1313	G1143-Q1147 VanDerWaalsContact O-CB 3.26Å; G1143-Q1147 WeakPolarHBondContact O-CB 3.27Å; G1143-Q1147 PolarHBondContact O-N 3.36Å; Q1147-L1152 HydrophobicContact CG-CD2 4.14Å; Q1147-A1155 HydrophobicContact CB-CB 4.23Å; Q1147-F1159 HydrophobicContact CB-CE2 4.41Å; Q1147-L1183 PolarHBondContact NE2-O 3.37Å; Q1147-T1187 PolarHBondContact NE2-OG1 3.43Å; Q1147-Y1190 HydrophobicContact CG-CD2 4.16Å; Q1147-Y1190 HydrophobicContact CG-CE2 4.34Å; Q1147-M1312 WeakPolarHBondContact O-CE 3.24Å; Q1147-P1313 HydrophobicContact CG-CG 4.26Å
1148	L	90.8	Very high	94.5	Very high	25 Å²	25	18.6 Å²	18.6	13%	0.131	11%	0.106	C	C	.	.	H	α-helix	trans	-66.1	-45.5	175.7	179.1	60.8	0	0	0	113.1	F1105 I1110 L1144 M1145 L1146 G1150 P1313 V1315 V1318	F1105-L1148 HydrophobicContact CE2-CD2 3.64Å; F1105-L1148 HydrophobicContact CZ-CD2 3.58Å; I1110-L1148 HydrophobicContact CD1-CD2 3.71Å; I1110-L1148 HydrophobicContact CD1-CG 4.45Å; I1110-L1148 HydrophobicContact CG1-CD2 4.44Å; L1144-L1148 PolarHBondContact O-N 3.39Å; M1145-L1148 WeakPolarHBondContact O-CB 3.33Å; M1145-L1148 PolarHBondContact O-N 3.08Å; L1146-L1148 PolarHBondContact O-N 3.22Å; L1148-G1150 PolarHBondContact O-N 3.15Å; L1148-P1313 WeakPolarHBondContact CD1-O 3.45Å; L1148-V1315 HydrophobicContact CD2-CG2 4.19Å; L1148-V1318 HydrophobicContact CB-CG2 4.2Å; L1148-V1318 HydrophobicContact CD1-CG2 4.28Å
1149	V	90.5	Very high	94.6	Very high	46 Å²	46	18.6 Å²	18.6	28%	0.279	11%	0.106	S	C	.	.	H	α-helix	trans	-69.3	-24.8	-179.4	174.5	0	0	0	0	111.7	F173 I1110 M1145 L1146 E1151	F173-V1149 HydrophobicContact CB-CG1 4.36Å; F173-V1149 HydrophobicContact CD1-CG1 4.49Å; F173-V1149 HydrophobicContact CD1-CG2 4.09Å; F173-V1149 HydrophobicContact CD2-CG1 3.52Å; F173-V1149 HydrophobicContact CD2-CG2 4.47Å; F173-V1149 HydrophobicContact CE1-CG2 4.04Å; F173-V1149 HydrophobicContact CE2-CG1 3.8Å; F173-V1149 HydrophobicContact CE2-CG2 4.43Å; F173-V1149 HydrophobicContact CG-CG1 3.9Å; F173-V1149 HydrophobicContact CG-CG2 4.3Å; F173-V1149 HydrophobicContact CZ-CG1 4.4Å; F173-V1149 HydrophobicContact CZ-CG2 4.22Å; I1110-V1149 HydrophobicContact CG2-CG2 3.82Å; M1145-V1149 WeakPolarHBondContact O-CG2 3.38Å; M1145-V1149 PolarHBondContact O-N 3.15Å; L1146-V1149 PolarHBondContact O-N 2.86Å; V1149-E1151 HydrophobicContact CG1-CG 4.23Å
1150	G	89.1	Confident	94.6	Very high	32 Å²	32	22 Å²	22	33%	0.33	12%	0.121	S	C	.	.	T	Hydrogen-bonded Turn	trans	102.3	7.2	-179	0	0	0	0	0	114.2	L1146 L1148 L1152	L1146-G1150 PolarHBondContact O-N 3.18Å; L1148-G1150 PolarHBondContact O-N 3.15Å; G1150-L1152 PolarHBondContact O-N 2.75Å
1151	E	93.3	Very high	94.7	Very high	59 Å²	59	23.1 Å²	23.1	28%	0.276	13%	0.127	S	C	.	.			trans	-81.4	57.7	174.9	-64.8	-57	151.4	0	0	110.5	L1146 V1149 D1153 L1154 A1155	L1146-E1151 HydrophobicContact CB-CB 4.36Å; L1146-E1151 HydrophobicContact CD2-CB 3.96Å; L1146-E1151 HydrophobicContact CD2-CG 4.46Å; L1146-E1151 PolarHBondContact O-N 2.87Å; V1149-E1151 HydrophobicContact CG1-CG 4.23Å; E1151-D1153 VanDerWaalsContact C-N 3.3Å; E1151-D1153 PolarHBondContact O-N 3.13Å; E1151-L1154 HydrophobicContact CB-CB 4.49Å; E1151-L1154 HydrophobicContact CB-CD1 4.2Å; E1151-L1154 PolarHBondContact O-N 3.3Å; E1151-A1155 PolarHBondContact O-N 3.49Å
1152	L	94.3	Very high	94.8	Very high	22 Å²	22	23.1 Å²	23.1	12%	0.115	13%	0.127	C	C	.	.	H	α-helix	trans	-59.8	-36.8	-169.4	-59.3	176.2	0	0	0	113.1	Q1147 G1150 A1155 L1156 T1187 R1191 M1312	Q1147-L1152 HydrophobicContact CG-CD2 4.14Å; G1150-L1152 PolarHBondContact O-N 2.75Å; L1152-A1155 PolarHBondContact O-N 3.41Å; L1152-L1156 WeakPolarHBondContact O-CG 3.36Å; L1152-L1156 PolarHBondContact O-N 2.94Å; L1152-T1187 HydrophobicContact CB-CG2 4.06Å; L1152-T1187 HydrophobicContact CD2-CG2 3.99Å; L1152-R1191 HydrophobicContact CD1-CB 4.12Å; L1152-M1312 HydrophobicContact CD2-CE 4.31Å
1153	D	95.1	Very high	94.8	Very high	81 Å²	81	23.5 Å²	23.5	43%	0.433	13%	0.129	S	C	.	.	H	α-helix	trans	-64.5	-41.1	178.5	-84.7	55.1	0	0	0	112.2	E1151 I1157 R1191	E1151-D1153 VanDerWaalsContact C-N 3.3Å; E1151-D1153 PolarHBondContact O-N 3.13Å; D1153-I1157 WeakPolarHBondContact O-CG1 3.28Å; D1153-R1191 VanDerWaalsContact CG-NH2 3.26Å; D1153-R1191 IonicContact OD1-CZ 2.99Å; D1153-R1191 IonicContact OD1-NE 3.59Å; D1153-R1191 IonicContact OD1-NH1 3.05Å; D1153-R1191 PolarHBondContact OD1-NH1 2.99Å; D1153-R1191 IonicContact OD1-NH2 3.09Å; D1153-R1191 PolarHBondContact OD1-NH2 3.34Å; D1153-R1191 VanDerWaalsContact OD1-NH2 3.09Å; D1153-R1191 IonicContact OD2-CZ 3.1Å; D1153-R1191 IonicContact OD2-NH1 2.87Å; D1153-R1191 PolarHBondContact OD2-NH1 3.49Å; D1153-R1191 IonicContact OD2-NH2 2.67Å; D1153-R1191 PolarHBondContact OD2-NH2 3.49Å
1154	L	95.3	Very high	94.8	Very high	35 Å²	35	26.4 Å²	26.4	18%	0.183	15%	0.15	C	C	.	.	H	α-helix	trans	-71.3	-42.8	174.9	-65.7	168.8	0	0	0	110.4	P175 M180 L1146 E1151 L1156 I1157 F1158	P175-L1154 HydrophobicContact CG-CD1 4.27Å; P175-L1154 HydrophobicContact CG-CD2 4.24Å; M180-L1154 HydrophobicContact CE-CD2 3.69Å; M180-L1154 HydrophobicContact SD-CD2 4.13Å; L1146-L1154 HydrophobicContact CD1-CB 3.86Å; E1151-L1154 HydrophobicContact CB-CB 4.49Å; E1151-L1154 HydrophobicContact CB-CD1 4.2Å; E1151-L1154 PolarHBondContact O-N 3.3Å; L1154-L1156 VanDerWaalsContact C-N 3.29Å; L1154-L1156 PolarHBondContact O-N 2.98Å; L1154-I1157 PolarHBondContact O-N 3.09Å; L1154-I1157 VanDerWaalsContact O-N 3.07Å; L1154-F1158 VanDerWaalsContact O-CD2 3.27Å; L1154-F1158 WeakPolarHBondContact O-CD2 3.4Å; L1154-F1158 PolarHBondContact O-N 3.04Å
1155	A	96.3	Very high	94.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-55.7	-41.4	177	0	0	0	0	0	112.8	G1143 L1146 Q1147 E1151 L1152 I1157 F1158 F1159 T1187	G1143-A1155 WeakPolarHBondContact O-CB 3.37Å; L1146-A1155 HydrophobicContact CB-CB 3.84Å; Q1147-A1155 HydrophobicContact CB-CB 4.23Å; E1151-A1155 PolarHBondContact O-N 3.49Å; L1152-A1155 PolarHBondContact O-N 3.41Å; A1155-I1157 PolarHBondContact O-N 2.9Å; A1155-F1158 PolarHBondContact O-N 3.41Å; A1155-F1159 HydrophobicContact CB-CD2 4.44Å; A1155-F1159 HydrophobicContact CB-CE2 4.24Å; A1155-F1159 WeakPolarHBondContact O-CD2 3.32Å; A1155-F1159 WeakPolarHBondContact O-CG 3.34Å; A1155-F1159 PolarHBondContact O-N 3.45Å; A1155-T1187 HydrophobicContact CB-CG2 4.28Å
1156	L	97	Very high	94.9	Very high	5 Å²	5	26.9 Å²	26.9	3%	0.026	15%	0.152	C	C	.	.	H	α-helix	trans	-59	-42.8	175.2	-75.9	170.4	0	0	0	112.5	L1152 L1154 F1158 F1159 E1160 I1184 T1187 Y1188	L1152-L1156 WeakPolarHBondContact O-CG 3.36Å; L1152-L1156 PolarHBondContact O-N 2.94Å; L1154-L1156 VanDerWaalsContact C-N 3.29Å; L1154-L1156 PolarHBondContact O-N 2.98Å; L1156-F1158 PolarHBondContact O-N 3.4Å; L1156-F1159 PolarHBondContact O-N 2.89Å; L1156-E1160 WeakPolarHBondContact O-CB 3.44Å; L1156-E1160 WeakPolarHBondContact O-CG 3.49Å; L1156-E1160 PolarHBondContact O-N 2.87Å; L1156-I1184 HydrophobicContact CD2-CG2 4.1Å; L1156-T1187 HydrophobicContact CD1-CG2 4.43Å; L1156-T1187 HydrophobicContact CD2-CG2 3.77Å; L1156-T1187 HydrophobicContact CG-CG2 3.67Å; L1156-Y1188 HydrophobicContact CD1-CD1 4.07Å; L1156-Y1188 HydrophobicContact CD1-CE1 3.62Å; L1156-Y1188 HydrophobicContact CD1-CE2 4.29Å; L1156-Y1188 HydrophobicContact CD2-CD1 4.49Å; L1156-Y1188 HydrophobicContact CD2-CD2 3.68Å; L1156-Y1188 HydrophobicContact CD2-CE1 4.25Å; L1156-Y1188 HydrophobicContact CD2-CE2 3.39Å; L1156-Y1188 HydrophobicContact CD2-CG 4.22Å; L1156-Y1188 HydrophobicContact CG-CE2 4.45Å
1157	I	97.1	Very high	94.9	Very high	73 Å²	73	30.7 Å²	30.7	37%	0.374	17%	0.169	S	C	.	.	H	α-helix	trans	-62.2	-43.7	-178.6	-62.7	166.1	0	0	0	110.9	M180 P181 D1153 L1154 A1155 N1161	M180-I1157 HydrophobicContact CE-CB 4.38Å; M180-I1157 HydrophobicContact CE-CD1 3.69Å; M180-I1157 HydrophobicContact CE-CG2 4.05Å; P181-I1157 HydrophobicContact CB-CG2 4.21Å; P181-I1157 HydrophobicContact CG-CG2 4.02Å; D1153-I1157 WeakPolarHBondContact O-CG1 3.28Å; L1154-I1157 PolarHBondContact O-N 3.09Å; L1154-I1157 VanDerWaalsContact O-N 3.07Å; A1155-I1157 PolarHBondContact O-N 2.9Å; I1157-N1161 PolarHBondContact O-N 3.34Å; I1157-N1161 VanDerWaalsContact O-N 3.13Å
1158	F	97.4	Very high	94.9	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-67.5	-43.5	175.4	-70	-81.4	0	0	0	112.2	P175 M180 P181 D1139 I1142 L1146 L1154 A1155 L1156 N1161 A1162	P175-F1158 HydrophobicContact CB-CE2 4.45Å; P175-F1158 HydrophobicContact CB-CZ 4.15Å; P175-F1158 HydrophobicContact CG-CE2 4.13Å; P175-F1158 HydrophobicContact CG-CZ 4.3Å; M180-F1158 HydrophobicContact SD-CE2 4.07Å; M180-F1158 HydrophobicContact SD-CZ 4.03Å; P181-F1158 HydrophobicContact CG-CD1 3.61Å; P181-F1158 HydrophobicContact CG-CE1 3.78Å; P181-F1158 HydrophobicContact CG-CG 4.18Å; P181-F1158 HydrophobicContact CG-CZ 4.46Å; D1139-F1158 HydrophobicContact CB-CB 4.19Å; D1139-F1158 HydrophobicContact CB-CD1 4.14Å; D1139-F1158 WeakPolarHBondContact O-CB 3.12Å; I1142-F1158 HydrophobicContact CB-CD1 4.14Å; I1142-F1158 HydrophobicContact CB-CE1 4.4Å; I1142-F1158 HydrophobicContact CB-CG 4.22Å; I1142-F1158 HydrophobicContact CD1-CD1 4.23Å; I1142-F1158 HydrophobicContact CD1-CE1 3.89Å; I1142-F1158 HydrophobicContact CD1-CZ 4.48Å; I1142-F1158 HydrophobicContact CG2-CB 4.5Å; I1142-F1158 HydrophobicContact CG2-CD1 3.83Å; I1142-F1158 HydrophobicContact CG2-CD2 3.53Å; I1142-F1158 HydrophobicContact CG2-CE1 3.84Å; I1142-F1158 HydrophobicContact CG2-CE2 3.57Å; I1142-F1158 HydrophobicContact CG2-CG 3.69Å; I1142-F1158 HydrophobicContact CG2-CZ 3.73Å; L1146-F1158 HydrophobicContact CD1-CD2 3.76Å; L1146-F1158 HydrophobicContact CD1-CE2 3.75Å; L1154-F1158 VanDerWaalsContact O-CD2 3.27Å; L1154-F1158 WeakPolarHBondContact O-CD2 3.4Å; L1154-F1158 PolarHBondContact O-N 3.04Å; A1155-F1158 PolarHBondContact O-N 3.41Å; L1156-F1158 PolarHBondContact O-N 3.4Å; F1158-N1161 PolarHBondContact O-N 2.98Å; F1158-A1162 WeakPolarHBondContact O-CB 3.36Å; F1158-A1162 PolarHBondContact O-N 3.22Å
1159	F	97.3	Very high	95	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-66	-38	178.3	-70.1	-43.5	0	0	0	113.5	G1143 L1144 Q1147 A1155 L1156 A1162 L1163 L1183 I1184 T1187	G1143-F1159 WeakPolarHBondContact O-CZ 3.37Å; L1144-F1159 HydrophobicContact CD2-CZ 4.2Å; L1144-F1159 HydrophobicContact CG-CE1 4.04Å; L1144-F1159 HydrophobicContact CG-CZ 4.02Å; L1144-F1159 VanDerWaalsContact N-CZ 3.32Å; Q1147-F1159 HydrophobicContact CB-CE2 4.41Å; A1155-F1159 HydrophobicContact CB-CD2 4.44Å; A1155-F1159 HydrophobicContact CB-CE2 4.24Å; A1155-F1159 WeakPolarHBondContact O-CD2 3.32Å; A1155-F1159 WeakPolarHBondContact O-CG 3.34Å; A1155-F1159 PolarHBondContact O-N 3.45Å; L1156-F1159 PolarHBondContact O-N 2.89Å; F1159-A1162 PolarHBondContact O-N 3.37Å; F1159-L1163 WeakPolarHBondContact O-CB 3.45Å; F1159-L1163 PolarHBondContact O-N 3.5Å; F1159-L1183 HydrophobicContact CD1-CB 4.34Å; F1159-L1183 HydrophobicContact CD1-CD1 4.32Å; F1159-L1183 HydrophobicContact CE1-CB 4.07Å; F1159-L1183 HydrophobicContact CE1-CD1 3.75Å; F1159-L1183 HydrophobicContact CE2-CB 4.29Å; F1159-L1183 HydrophobicContact CZ-CB 4.01Å; F1159-L1183 HydrophobicContact CZ-CD1 4.25Å; F1159-I1184 HydrophobicContact CB-CD1 4.09Å; F1159-I1184 HydrophobicContact CB-CG1 3.54Å; F1159-I1184 HydrophobicContact CG-CG1 4.32Å; F1159-T1187 WeakPolarHBondContact CE2-OG1 3.32Å
1160	E	97	Very high	94.9	Very high	70 Å²	70	33.3 Å²	33.3	33%	0.327	18%	0.177	S	C	.	.	H	α-helix	trans	-70.5	-34.8	177.9	-71.5	-177.7	174	0	0	111.2	L1156 S1164 I1184 Y1188 Y1200	L1156-E1160 WeakPolarHBondContact O-CB 3.44Å; L1156-E1160 WeakPolarHBondContact O-CG 3.49Å; L1156-E1160 PolarHBondContact O-N 2.87Å; E1160-S1164 PolarHBondContact O-N 3.29Å; E1160-S1164 VanDerWaalsContact O-N 3.12Å; E1160-I1184 HydrophobicContact CG-CD1 4.22Å; E1160-Y1188 PolarHBondContact OE1-OH 2.94Å; E1160-Y1200 PolarHBondContact OE1-OH 3.46Å
1161	N	96.4	Very high	94.8	Very high	31 Å²	31	33 Å²	33	17%	0.166	17%	0.174	C	C	.	.	H	α-helix	trans	-64	-49.9	169.4	-167.3	52.2	0	0	0	111.7	P181 R1121 D1139 I1157 F1158 L1163 S1164 L1165	P181-N1161 HydrophobicContact CB-CB 3.78Å; P181-N1161 HydrophobicContact CG-CB 4.14Å; R1121-N1161 PolarHBondContact NH2-ND2 3.26Å; D1139-N1161 PolarHBondContact OD2-ND2 3.04Å; I1157-N1161 PolarHBondContact O-N 3.34Å; I1157-N1161 VanDerWaalsContact O-N 3.13Å; F1158-N1161 PolarHBondContact O-N 2.98Å; N1161-L1163 VanDerWaalsContact C-N 3.31Å; N1161-L1163 PolarHBondContact O-N 3.45Å; N1161-S1164 WeakPolarHBondContact O-CB 3.26Å; N1161-S1164 PolarHBondContact O-N 3.31Å; N1161-S1164 PolarHBondContact O-OG 3.32Å; N1161-L1165 PolarHBondContact O-N 3.49Å; N1161-L1165 VanDerWaalsContact O-N 3.08Å
1162	A	96.2	Very high	94.7	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-57.5	-41.2	176.6	0	0	0	0	0	112.2	T1136 D1139 F1158 F1159 S1164 L1165 I1166	T1136-A1162 HydrophobicContact CG2-CB 4.4Å; D1139-A1162 HydrophobicContact CB-CB 4.13Å; F1158-A1162 WeakPolarHBondContact O-CB 3.36Å; F1158-A1162 PolarHBondContact O-N 3.22Å; F1159-A1162 PolarHBondContact O-N 3.37Å; A1162-S1164 VanDerWaalsContact C-N 3.3Å; A1162-S1164 PolarHBondContact O-N 2.85Å; A1162-L1165 PolarHBondContact O-N 2.8Å; A1162-I1166 WeakPolarHBondContact O-CB 3.49Å; A1162-I1166 WeakPolarHBondContact O-CD1 3.49Å; A1162-I1166 VanDerWaalsContact O-CG1 3.23Å; A1162-I1166 WeakPolarHBondContact O-CG1 3.29Å; A1162-I1166 PolarHBondContact O-N 2.81Å
1163	L	96.5	Very high	94.4	Very high	8 Å²	8	39.6 Å²	39.6	4%	0.042	20%	0.199	C	C	.	.	H	α-helix	trans	-61.6	-36.8	174.9	-177.3	66.4	0	0	0	112.3	F1159 N1161 K1167 E1177 T1180 I1184 Y1200	F1159-L1163 WeakPolarHBondContact O-CB 3.45Å; F1159-L1163 PolarHBondContact O-N 3.5Å; N1161-L1163 VanDerWaalsContact C-N 3.31Å; N1161-L1163 PolarHBondContact O-N 3.45Å; L1163-K1167 WeakPolarHBondContact O-CG 3.27Å; L1163-K1167 PolarHBondContact O-N 3.06Å; L1163-E1177 HydrophobicContact CD1-CG 3.62Å; L1163-T1180 HydrophobicContact CB-CG2 3.94Å; L1163-T1180 HydrophobicContact CD1-CG2 4.31Å; L1163-I1184 HydrophobicContact CB-CD1 4.07Å; L1163-I1184 HydrophobicContact CD2-CD1 3.74Å; L1163-I1184 HydrophobicContact CG-CD1 4.42Å; L1163-Y1200 HydrophobicContact CD2-CE1 3.86Å
1164	S	95.8	Very high	94	Very high	61 Å²	61	36 Å²	36	43%	0.427	18%	0.18	S	C	.	.	H	α-helix	trans	-67.4	-44.1	177.2	84.6	0	0	0	0	111.9	E1160 N1161 A1162 K1167 L1168	E1160-S1164 PolarHBondContact O-N 3.29Å; E1160-S1164 VanDerWaalsContact O-N 3.12Å; N1161-S1164 WeakPolarHBondContact O-CB 3.26Å; N1161-S1164 PolarHBondContact O-N 3.31Å; N1161-S1164 PolarHBondContact O-OG 3.32Å; A1162-S1164 VanDerWaalsContact C-N 3.3Å; A1162-S1164 PolarHBondContact O-N 2.85Å; S1164-K1167 PolarHBondContact O-N 3.47Å; S1164-L1168 PolarHBondContact O-N 3.47Å
1165	L	94.8	Very high	93.7	Very high	7 Å²	7	36.2 Å²	36.2	4%	0.037	18%	0.181	C	C	.	.	H	α-helix	trans	-66.8	-38.1	177.1	-64.4	179.2	0	0	0	111.7	I1135 T1136 N1161 A1162 K1167 L1168 F1169	I1135-L1165 HydrophobicContact CB-CD1 3.84Å; I1135-L1165 HydrophobicContact CG2-CD1 3.67Å; T1136-L1165 WeakPolarHBondContact OG1-CB 3.41Å; N1161-L1165 PolarHBondContact O-N 3.49Å; N1161-L1165 VanDerWaalsContact O-N 3.08Å; A1162-L1165 PolarHBondContact O-N 2.8Å; L1165-K1167 VanDerWaalsContact C-N 3.34Å; L1165-K1167 PolarHBondContact O-N 2.56Å; L1165-L1168 PolarHBondContact O-N 3.08Å; L1165-F1169 HydrophobicContact CB-CD2 4.08Å; L1165-F1169 HydrophobicContact CB-CE2 3.88Å; L1165-F1169 HydrophobicContact CD2-CE2 3.95Å; L1165-F1169 HydrophobicContact CD2-CZ 4.35Å; L1165-F1169 HydrophobicContact CG-CE2 4.37Å; L1165-F1169 WeakPolarHBondContact O-CD2 3.28Å; L1165-F1169 WeakPolarHBondContact O-CG 3.12Å; L1165-F1169 PolarHBondContact O-N 3.45Å
1166	I	94.2	Very high	93.3	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.021	19%	0.187	C	C	.	.	H	α-helix	trans	-58.7	-46	175.7	-75.2	164.5	0	0	0	111.3	T1136 A1162 L1168 F1169 Y1170 K1176 E1177 T1180	T1136-I1166 HydrophobicContact CG2-CD1 3.82Å; T1136-I1166 HydrophobicContact CG2-CG1 3.42Å; T1136-I1166 VanDerWaalsContact CG2-CG1 3.42Å; A1162-I1166 WeakPolarHBondContact O-CB 3.49Å; A1162-I1166 WeakPolarHBondContact O-CD1 3.49Å; A1162-I1166 VanDerWaalsContact O-CG1 3.23Å; A1162-I1166 WeakPolarHBondContact O-CG1 3.29Å; A1162-I1166 PolarHBondContact O-N 2.81Å; I1166-L1168 VanDerWaalsContact C-N 3.3Å; I1166-L1168 PolarHBondContact O-N 3.24Å; I1166-F1169 PolarHBondContact O-N 3.32Å; I1166-Y1170 HydrophobicContact CB-CD2 4.43Å; I1166-Y1170 HydrophobicContact CG1-CD2 4.39Å; I1166-Y1170 HydrophobicContact CG2-CD2 4.24Å; I1166-Y1170 WeakPolarHBondContact O-CB 3.21Å; I1166-Y1170 PolarHBondContact O-N 3.34Å; I1166-K1176 HydrophobicContact CD1-CB 4.18Å; I1166-K1176 HydrophobicContact CG1-CB 4.37Å; I1166-K1176 HydrophobicContact CG2-CB 3.85Å; I1166-E1177 HydrophobicContact CG2-CB 4.09Å; I1166-T1180 HydrophobicContact CD1-CG2 4.39Å; I1166-T1180 WeakPolarHBondContact CD1-OG1 3.18Å
1167	K	94.7	Very high	93.1	Very high	81 Å²	81	37.4 Å²	37.4	35%	0.352	19%	0.186	S	C	.	.	H	α-helix	trans	-64	-34.7	178	-70.6	170.6	-176.8	179.2	0	112.3	L1163 S1164 L1165 G1171 E1177	L1163-K1167 WeakPolarHBondContact O-CG 3.27Å; L1163-K1167 PolarHBondContact O-N 3.06Å; S1164-K1167 PolarHBondContact O-N 3.47Å; L1165-K1167 VanDerWaalsContact C-N 3.34Å; L1165-K1167 PolarHBondContact O-N 2.56Å; K1167-G1171 CarbonylContact O-C 3.47Å; K1167-G1171 VanDerWaalsContact O-CA 3.25Å; K1167-G1171 WeakPolarHBondContact O-CA 3.33Å; K1167-G1171 PolarHBondContact O-N 3.37Å; K1167-E1177 VanDerWaalsContact CE-CD 3.41Å; K1167-E1177 WeakPolarHBondContact CE-OE1 3.49Å; K1167-E1177 HydrophobicContact CG-CG 4.14Å; K1167-E1177 IonicContact NZ-OE1 3.27Å
1168	L	94	Very high	92.8	Very high	63 Å²	63	33.9 Å²	33.9	33%	0.33	17%	0.168	S	C	.	.	H	α-helix	trans	-70.5	-44.3	176.8	178	62.3	0	0	0	112.7	Q825 S826 S1164 L1165 I1166	Q825-L1168 HydrophobicContact CG-CD1 4.11Å; S826-L1168 WeakPolarHBondContact CB-O 3.33Å; S1164-L1168 PolarHBondContact O-N 3.47Å; L1165-L1168 PolarHBondContact O-N 3.08Å; I1166-L1168 VanDerWaalsContact C-N 3.3Å; I1166-L1168 PolarHBondContact O-N 3.24Å
1169	F	92.2	Very high	92.4	Very high	14 Å²	14	36.3 Å²	36.3	6%	0.061	18%	0.179	C	C	.	.	H	α-helix	trans	-90.7	-40.3	-171.4	-61.1	-47.2	0	0	0	113.9	L790 S826 Y829 H1132 P1133 L1165 I1166	L790-F1169 HydrophobicContact CD1-CB 4.21Å; S826-F1169 WeakPolarHBondContact O-CD1 3.19Å; Y829-F1169 HydrophobicContact CD1-CD1 4.34Å; Y829-F1169 AromaticContact CD1-CE1 3.74Å; Y829-F1169 HydrophobicContact CD1-CE1 3.74Å; Y829-F1169 HydrophobicContact CD1-CZ 4.45Å; Y829-F1169 HydrophobicContact CE1-CE1 4.34Å; H1132-F1169 VanDerWaalsContact C-CE2 3.43Å; P1133-F1169 HydrophobicContact CB-CD2 4.26Å; P1133-F1169 HydrophobicContact CB-CE2 4.45Å; P1133-F1169 HydrophobicContact CG-CD1 4.14Å; P1133-F1169 HydrophobicContact CG-CD2 3.9Å; P1133-F1169 HydrophobicContact CG-CE1 4.23Å; P1133-F1169 HydrophobicContact CG-CE2 3.97Å; P1133-F1169 HydrophobicContact CG-CG 4Å; P1133-F1169 HydrophobicContact CG-CZ 4.14Å; L1165-F1169 HydrophobicContact CB-CD2 4.08Å; L1165-F1169 HydrophobicContact CB-CE2 3.88Å; L1165-F1169 HydrophobicContact CD2-CE2 3.95Å; L1165-F1169 HydrophobicContact CD2-CZ 4.35Å; L1165-F1169 HydrophobicContact CG-CE2 4.37Å; L1165-F1169 WeakPolarHBondContact O-CD2 3.28Å; L1165-F1169 WeakPolarHBondContact O-CG 3.12Å; L1165-F1169 PolarHBondContact O-N 3.45Å; I1166-F1169 PolarHBondContact O-N 3.32Å
1170	Y	88.7	Confident	92.1	Very high	54 Å²	54	36.4 Å²	36.4	21%	0.212	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.9	-6.9	-177.4	-55.9	-78.2	0	0	0	113.8	L790 I1166 N1174 K1176	L790-Y1170 HydrophobicContact CD1-CD1 4.03Å; L790-Y1170 HydrophobicContact CD1-CE1 3.36Å; L790-Y1170 HydrophobicContact CD1-CE2 4.41Å; I1166-Y1170 HydrophobicContact CB-CD2 4.43Å; I1166-Y1170 HydrophobicContact CG1-CD2 4.39Å; I1166-Y1170 HydrophobicContact CG2-CD2 4.24Å; I1166-Y1170 WeakPolarHBondContact O-CB 3.21Å; I1166-Y1170 PolarHBondContact O-N 3.34Å; Y1170-N1174 VanDerWaalsContact CB-CG 3.44Å; Y1170-K1176 HydrophobicContact CD1-CD 4.23Å; Y1170-K1176 HydrophobicContact CD2-CD 3.87Å; Y1170-K1176 HydrophobicContact CE1-CD 4.11Å; Y1170-K1176 HydrophobicContact CE2-CD 3.72Å; Y1170-K1176 HydrophobicContact CG-CD 4.13Å; Y1170-K1176 PolarHBondContact OH-NZ 2.77Å; Y1170-K1176 VanDerWaalsContact OH-NZ 3.14Å
1171	G	88.3	Confident	92	Very high	26 Å²	26	33.1 Å²	33.1	27%	0.268	16%	0.164	S	C	.	.			trans	82.2	167.8	-176.3	0	0	0	0	0	113.7	K1167 N1174	K1167-G1171 CarbonylContact O-C 3.47Å; K1167-G1171 VanDerWaalsContact O-CA 3.25Å; K1167-G1171 WeakPolarHBondContact O-CA 3.33Å; K1167-G1171 PolarHBondContact O-N 3.37Å; G1171-N1174 WeakPolarHBondContact O-CB 3.48Å
1172	E	89.8	Confident	91.9	Very high	115 Å²	115	33.3 Å²	33.3	54%	0.537	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	151.3	172	-83.7	-156.8	-139.4	0	0	112.6	N1174 R1203	E1172-N1174 PolarHBondContact O-N 2.94Å; E1172-R1203 IonicContact OE2-CZ 3.82Å; E1172-R1203 IonicContact OE2-NH1 3.6Å; E1172-R1203 IonicContact OE2-NH2 3.98Å; E1172-R1203 PolarHBondContact OE2-NH2 3.39Å
1173	R	88.3	Confident	91.7	Very high	104 Å²	104	33.5 Å²	33.5	39%	0.392	17%	0.165	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.6	30.2	179.3	-42.7	180	-162.3	-178.7	2.4	112.7	E1177 I1207 E1210 R1211	R1173-E1177 PolarHBondContact N-OE2 3.13Å; R1173-I1207 HydrophobicContact CB-CG1 4.15Å; R1173-I1207 HydrophobicContact CB-CG2 4.29Å; R1173-I1207 HydrophobicContact CG-CG1 4.42Å; R1173-I1207 WeakPolarHBondContact O-CG2 3.42Å; R1173-E1210 WeakPolarHBondContact CD-OE1 3.44Å; R1173-E1210 WeakPolarHBondContact CD-OE2 3.19Å; R1173-E1210 IonicContact CZ-OE1 2.85Å; R1173-E1210 IonicContact CZ-OE2 3.52Å; R1173-E1210 IonicContact NE-OE1 2.87Å; R1173-E1210 IonicContact NE-OE2 2.9Å; R1173-E1210 IonicContact NH1-OE1 3.35Å; R1173-E1210 PolarHBondContact NH1-OE1 3.28Å; R1173-E1210 IonicContact NH1-OE2 3.42Å; R1173-E1210 PolarHBondContact NH1-OE2 2.84Å; R1173-R1211 VanDerWaalsContact O-CG 3.31Å; R1173-R1211 WeakPolarHBondContact O-CG 3.36Å; R1173-R1211 PolarHBondContact O-NE 3.46Å
1174	N	87.2	Confident	91.7	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.027	16%	0.163	C	C	.	.			trans	-78.6	152.2	168.5	-179.2	-95.2	0	0	0	110.4	D673 Y1170 G1171 E1172 K1176 E1177 A1178	D673-N1174 PolarHBondContact OD1-ND2 2.95Å; D673-N1174 PolarHBondContact OD1-OD1 3.18Å; D673-N1174 VanDerWaalsContact OD1-OD1 3.12Å; Y1170-N1174 VanDerWaalsContact CB-CG 3.44Å; G1171-N1174 WeakPolarHBondContact O-CB 3.48Å; E1172-N1174 PolarHBondContact O-N 2.94Å; N1174-K1176 PolarHBondContact O-N 3.39Å; N1174-K1176 WeakPolarHBondContact OD1-CB 3.4Å; N1174-K1176 WeakPolarHBondContact OD1-CG 3.26Å; N1174-K1176 PolarHBondContact OD1-N 3.03Å; N1174-E1177 WeakPolarHBondContact O-CA 3.31Å; N1174-E1177 VanDerWaalsContact O-CB 3.29Å; N1174-E1177 WeakPolarHBondContact O-CB 3.34Å; N1174-E1177 PolarHBondContact O-N 2.65Å; N1174-A1178 PolarHBondContact O-N 2.78Å
1175	L	89.5	Confident	91.6	Very high	39 Å²	39	30.2 Å²	30.2	20%	0.204	14%	0.143	C	C	.	.	H	α-helix	trans	-67.5	-25.4	-178.6	-59.9	177.2	0	0	0	112.5	D673 E1177 A1178 F1179 Y1208 R1211 L1212	D673-L1175 HydrophobicContact CB-CB 4.28Å; D673-L1175 HydrophobicContact CB-CD1 3.91Å; D673-L1175 HydrophobicContact CB-CG 4.28Å; D673-L1175 VanDerWaalsContact CG-CG 3.5Å; D673-L1175 VanDerWaalsContact OD1-CB 3.3Å; D673-L1175 WeakPolarHBondContact OD1-CB 3.49Å; D673-L1175 PolarHBondContact OD1-N 3.04Å; D673-L1175 WeakPolarHBondContact OD2-CG 3.45Å; L1175-E1177 VanDerWaalsContact C-N 3.31Å; L1175-A1178 PolarHBondContact O-N 2.74Å; L1175-F1179 WeakPolarHBondContact O-CB 3.39Å; L1175-F1179 PolarHBondContact O-N 3.21Å; L1175-Y1208 HydrophobicContact CD2-CD1 3.66Å; L1175-Y1208 HydrophobicContact CD2-CE1 3.89Å; L1175-R1211 HydrophobicContact CD2-CB 3.87Å; L1175-R1211 HydrophobicContact CD2-CG 4.36Å; L1175-L1212 HydrophobicContact CD1-CD1 4.37Å; L1175-L1212 HydrophobicContact CD1-CD2 4Å; L1175-L1212 HydrophobicContact CD1-CG 4.43Å; L1175-L1212 HydrophobicContact CD2-CD1 3.9Å; L1175-L1212 HydrophobicContact CD2-CD2 4.37Å; L1175-L1212 HydrophobicContact CD2-CG 3.95Å
1176	K	86.9	Confident	91.5	Very high	30 Å²	30	31.6 Å²	31.6	13%	0.13	15%	0.15	C	C	.	.	H	α-helix	trans	-66.5	-32.9	169.7	-57.5	178.1	-177.9	176.9	0	111.8	V674 I1166 Y1170 N1174 F1179 T1180	V674-K1176 WeakPolarHBondContact O-CE 3.32Å; V674-K1176 PolarHBondContact O-NZ 2.96Å; I1166-K1176 HydrophobicContact CD1-CB 4.18Å; I1166-K1176 HydrophobicContact CG1-CB 4.37Å; I1166-K1176 HydrophobicContact CG2-CB 3.85Å; Y1170-K1176 HydrophobicContact CD1-CD 4.23Å; Y1170-K1176 HydrophobicContact CD2-CD 3.87Å; Y1170-K1176 HydrophobicContact CE1-CD 4.11Å; Y1170-K1176 HydrophobicContact CE2-CD 3.72Å; Y1170-K1176 HydrophobicContact CG-CD 4.13Å; Y1170-K1176 PolarHBondContact OH-NZ 2.77Å; Y1170-K1176 VanDerWaalsContact OH-NZ 3.14Å; N1174-K1176 PolarHBondContact O-N 3.39Å; N1174-K1176 WeakPolarHBondContact OD1-CB 3.4Å; N1174-K1176 WeakPolarHBondContact OD1-CG 3.26Å; N1174-K1176 PolarHBondContact OD1-N 3.03Å; K1176-F1179 PolarHBondContact O-N 3.21Å; K1176-T1180 PolarHBondContact O-N 2.84Å; K1176-T1180 PolarHBondContact O-OG1 2.75Å; K1176-T1180 VanDerWaalsContact O-OG1 3.12Å
1177	E	92.8	Very high	91.4	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.7	-46	173.8	-165.9	-159.4	155.6	0	0	110.1	L1163 I1166 K1167 R1173 N1174 L1175 F1179 T1180 C1181 R1203 I1207	L1163-E1177 HydrophobicContact CD1-CG 3.62Å; I1166-E1177 HydrophobicContact CG2-CB 4.09Å; K1167-E1177 VanDerWaalsContact CE-CD 3.41Å; K1167-E1177 WeakPolarHBondContact CE-OE1 3.49Å; K1167-E1177 HydrophobicContact CG-CG 4.14Å; K1167-E1177 IonicContact NZ-OE1 3.27Å; R1173-E1177 PolarHBondContact N-OE2 3.13Å; N1174-E1177 WeakPolarHBondContact O-CA 3.31Å; N1174-E1177 VanDerWaalsContact O-CB 3.29Å; N1174-E1177 WeakPolarHBondContact O-CB 3.34Å; N1174-E1177 PolarHBondContact O-N 2.65Å; L1175-E1177 VanDerWaalsContact C-N 3.31Å; E1177-F1179 PolarHBondContact O-N 3.42Å; E1177-T1180 PolarHBondContact O-N 2.72Å; E1177-C1181 WeakPolarHBondContact O-CB 3.49Å; E1177-C1181 PolarHBondContact O-N 3.09Å; E1177-C1181 PolarHBondContact O-SG 2.59Å; E1177-R1203 VanDerWaalsContact CD-NH2 3.3Å; E1177-R1203 IonicContact OE1-CZ 3.4Å; E1177-R1203 IonicContact OE1-NE 2.72Å; E1177-R1203 PolarHBondContact OE1-NE 3.45Å; E1177-R1203 IonicContact OE1-NH2 3.71Å; E1177-R1203 PolarHBondContact OE1-NH2 2.94Å; E1177-R1203 IonicContact OE2-CZ 3.4Å; E1177-R1203 IonicContact OE2-NE 3.26Å; E1177-R1203 IonicContact OE2-NH2 3.12Å; E1177-R1203 PolarHBondContact OE2-NH2 2.97Å; E1177-I1207 HydrophobicContact CB-CD1 4.06Å; E1177-I1207 HydrophobicContact CG-CD1 4.1Å
1178	A	90	Very high	91.4	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-61.2	-44.5	176.8	0	0	0	0	0	112.2	N1174 L1175 C1181 H1182 R1204 I1207 Y1208	N1174-A1178 PolarHBondContact O-N 2.78Å; L1175-A1178 PolarHBondContact O-N 2.74Å; A1178-C1181 PolarHBondContact O-N 3.2Å; A1178-H1182 PolarHBondContact O-N 3.17Å; A1178-R1204 HydrophobicContact CB-CG 4.12Å; A1178-R1204 WeakPolarHBondContact O-CG 3.42Å; A1178-I1207 HydrophobicContact CB-CB 3.92Å; A1178-I1207 HydrophobicContact CB-CD1 4.1Å; A1178-I1207 HydrophobicContact CB-CG2 3.85Å; A1178-Y1208 HydrophobicContact CB-CD1 3.74Å; A1178-Y1208 HydrophobicContact CB-CE1 3.39Å; A1178-Y1208 HydrophobicContact CB-CG 4.48Å
1179	F	90	Very high	91.2	Very high	51 Å²	51	26.5 Å²	26.5	22%	0.224	13%	0.125	C	C	.	.	H	α-helix	trans	-61.1	-47.9	176.5	176	-96.7	0	0	0	112.3	L1175 K1176 E1177 C1181 H1182 L1183 T1321 V1325	L1175-F1179 WeakPolarHBondContact O-CB 3.39Å; L1175-F1179 PolarHBondContact O-N 3.21Å; K1176-F1179 PolarHBondContact O-N 3.21Å; E1177-F1179 PolarHBondContact O-N 3.42Å; F1179-C1181 PolarHBondContact O-N 2.84Å; F1179-H1182 WeakPolarHBondContact O-CA 3.21Å; F1179-H1182 VanDerWaalsContact O-CB 3.23Å; F1179-H1182 WeakPolarHBondContact O-CB 3.25Å; F1179-H1182 PolarHBondContact O-N 3.22Å; F1179-L1183 HydrophobicContact CD1-CD1 4.19Å; F1179-L1183 HydrophobicContact CE1-CD1 3.57Å; F1179-L1183 HydrophobicContact CE1-CG 4.19Å; F1179-L1183 HydrophobicContact CZ-CD1 4.03Å; F1179-L1183 HydrophobicContact CZ-CD2 4.33Å; F1179-L1183 HydrophobicContact CZ-CG 4.39Å; F1179-L1183 PolarHBondContact O-N 2.98Å; F1179-L1183 VanDerWaalsContact O-N 3.14Å; F1179-T1321 HydrophobicContact CE2-CG2 4.19Å; F1179-T1321 HydrophobicContact CZ-CG2 3.64Å; F1179-V1325 HydrophobicContact CE1-CG2 3.45Å; F1179-V1325 VanDerWaalsContact CE1-CG2 3.45Å; F1179-V1325 HydrophobicContact CZ-CG2 3.6Å
1180	T	91.6	Very high	91.1	Very high	2 Å²	2	28.2 Å²	28.2	1%	0.012	13%	0.131	C	C	.	.	H	α-helix	trans	-69.7	-33.1	178.8	-55.1	0	0	0	0	112.1	L1163 I1166 K1176 E1177 H1182 L1183 I1184	L1163-T1180 HydrophobicContact CB-CG2 3.94Å; L1163-T1180 HydrophobicContact CD1-CG2 4.31Å; I1166-T1180 HydrophobicContact CD1-CG2 4.39Å; I1166-T1180 WeakPolarHBondContact CD1-OG1 3.18Å; K1176-T1180 PolarHBondContact O-N 2.84Å; K1176-T1180 PolarHBondContact O-OG1 2.75Å; K1176-T1180 VanDerWaalsContact O-OG1 3.12Å; E1177-T1180 PolarHBondContact O-N 2.72Å; T1180-H1182 PolarHBondContact O-N 3.34Å; T1180-L1183 PolarHBondContact O-N 2.75Å; T1180-I1184 HydrophobicContact CG2-CD1 4.08Å; T1180-I1184 VanDerWaalsContact O-CG1 3.32Å; T1180-I1184 WeakPolarHBondContact O-CG1 3.44Å; T1180-I1184 PolarHBondContact O-N 3.44Å
1181	C	94.9	Very high	91.1	Very high	1 Å²	1	31.3 Å²	31.3	1%	0.007	14%	0.143	C	C	.	.	H	α-helix	trans	-59	-35.5	168.4	-69.2	0	0	0	0	112.1	E1177 A1178 F1179 S1185 Y1200 R1204	E1177-C1181 WeakPolarHBondContact O-CB 3.49Å; E1177-C1181 PolarHBondContact O-N 3.09Å; E1177-C1181 PolarHBondContact O-SG 2.59Å; A1178-C1181 PolarHBondContact O-N 3.2Å; F1179-C1181 PolarHBondContact O-N 2.84Å; C1181-S1185 WeakPolarHBondContact O-CB 3.48Å; C1181-S1185 PolarHBondContact O-N 3.47Å; C1181-Y1200 HydrophobicContact CB-CD1 4.2Å; C1181-R1204 HydrophobicContact CB-CB 4.45Å
1182	H	93	Very high	91	Very high	34 Å²	34	32.1 Å²	32.1	16%	0.157	15%	0.151	C	C	.	.	H	α-helix	trans	-66.7	-44.2	174.5	-167.7	52.6	0	0	0	112.4	A1178 F1179 T1180 I1184 S1185 L1186 E1201 R1204	A1178-H1182 PolarHBondContact O-N 3.17Å; F1179-H1182 WeakPolarHBondContact O-CA 3.21Å; F1179-H1182 VanDerWaalsContact O-CB 3.23Å; F1179-H1182 WeakPolarHBondContact O-CB 3.25Å; F1179-H1182 PolarHBondContact O-N 3.22Å; T1180-H1182 PolarHBondContact O-N 3.34Å; H1182-I1184 VanDerWaalsContact C-N 3.3Å; H1182-I1184 PolarHBondContact O-N 3.44Å; H1182-S1185 WeakPolarHBondContact O-CB 3.24Å; H1182-S1185 PolarHBondContact O-N 3.18Å; H1182-L1186 WeakPolarHBondContact O-CG 3.24Å; H1182-L1186 PolarHBondContact O-N 3.19Å; H1182-E1201 IonicContact CE1-OE2 3.83Å; H1182-E1201 IonicContact CG-OE2 2.67Å; H1182-E1201 IonicContact ND1-OE1 2.79Å; H1182-E1201 IonicContact ND1-OE2 3.1Å; H1182-E1201 PolarHBondContact ND1-OE2 3.27Å; H1182-R1204 HydrophobicContact CB-CG 4.46Å; H1182-R1204 PolarHBondContact CE1-NH1 2.73Å; H1182-R1204 PolarHBondContact ND1-NH1 3.05Å
1183	L	92.8	Very high	91	Very high	5 Å²	5	29.4 Å²	29.4	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-61.5	-40.4	176.9	-59	-177.5	0	0	0	111.7	T1140 L1144 Q1147 F1159 F1179 T1180 T1187 T1321	T1140-L1183 HydrophobicContact CG2-CD1 4.02Å; L1144-L1183 HydrophobicContact CD1-CD1 4.44Å; L1144-L1183 HydrophobicContact CD2-CD1 4.17Å; L1144-L1183 HydrophobicContact CD2-CD2 3.98Å; L1144-L1183 HydrophobicContact CG-CD1 4.3Å; Q1147-L1183 PolarHBondContact NE2-O 3.37Å; F1159-L1183 HydrophobicContact CD1-CB 4.34Å; F1159-L1183 HydrophobicContact CD1-CD1 4.32Å; F1159-L1183 HydrophobicContact CE1-CB 4.07Å; F1159-L1183 HydrophobicContact CE1-CD1 3.75Å; F1159-L1183 HydrophobicContact CE2-CB 4.29Å; F1159-L1183 HydrophobicContact CZ-CB 4.01Å; F1159-L1183 HydrophobicContact CZ-CD1 4.25Å; F1179-L1183 HydrophobicContact CD1-CD1 4.19Å; F1179-L1183 HydrophobicContact CE1-CD1 3.57Å; F1179-L1183 HydrophobicContact CE1-CG 4.19Å; F1179-L1183 HydrophobicContact CZ-CD1 4.03Å; F1179-L1183 HydrophobicContact CZ-CD2 4.33Å; F1179-L1183 HydrophobicContact CZ-CG 4.39Å; F1179-L1183 PolarHBondContact O-N 2.98Å; F1179-L1183 VanDerWaalsContact O-N 3.14Å; T1180-L1183 PolarHBondContact O-N 2.75Å; L1183-T1187 PolarHBondContact O-N 3.19Å; L1183-T1187 PolarHBondContact O-OG1 3.15Å; L1183-T1321 HydrophobicContact CD2-CG2 4.05Å
1184	I	96	Very high	91	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.3	-44.5	175.2	-65.8	164.8	0	0	0	111	L1156 F1159 E1160 L1163 T1180 H1182 L1186 T1187 Y1188 Y1200	L1156-I1184 HydrophobicContact CD2-CG2 4.1Å; F1159-I1184 HydrophobicContact CB-CD1 4.09Å; F1159-I1184 HydrophobicContact CB-CG1 3.54Å; F1159-I1184 HydrophobicContact CG-CG1 4.32Å; E1160-I1184 HydrophobicContact CG-CD1 4.22Å; L1163-I1184 HydrophobicContact CB-CD1 4.07Å; L1163-I1184 HydrophobicContact CD2-CD1 3.74Å; L1163-I1184 HydrophobicContact CG-CD1 4.42Å; T1180-I1184 HydrophobicContact CG2-CD1 4.08Å; T1180-I1184 VanDerWaalsContact O-CG1 3.32Å; T1180-I1184 WeakPolarHBondContact O-CG1 3.44Å; T1180-I1184 PolarHBondContact O-N 3.44Å; H1182-I1184 VanDerWaalsContact C-N 3.3Å; H1182-I1184 PolarHBondContact O-N 3.44Å; I1184-L1186 PolarHBondContact O-N 2.89Å; I1184-T1187 PolarHBondContact O-N 3.01Å; I1184-T1187 VanDerWaalsContact O-N 3.14Å; I1184-Y1188 HydrophobicContact CG2-CD2 3.5Å; I1184-Y1188 VanDerWaalsContact CG2-CD2 3.5Å; I1184-Y1188 HydrophobicContact CG2-CE2 3.43Å; I1184-Y1188 VanDerWaalsContact CG2-CE2 3.43Å; I1184-Y1188 WeakPolarHBondContact O-CD2 3.47Å; I1184-Y1188 PolarHBondContact O-N 3.23Å; I1184-Y1200 HydrophobicContact CB-CD1 4.35Å; I1184-Y1200 HydrophobicContact CB-CE1 4.46Å; I1184-Y1200 HydrophobicContact CB-CG 4.38Å; I1184-Y1200 HydrophobicContact CD1-CE1 4.17Å; I1184-Y1200 HydrophobicContact CG2-CD1 4.01Å; I1184-Y1200 HydrophobicContact CG2-CD2 3.55Å; I1184-Y1200 HydrophobicContact CG2-CE1 3.9Å; I1184-Y1200 HydrophobicContact CG2-CE2 3.41Å; I1184-Y1200 VanDerWaalsContact CG2-CE2 3.41Å; I1184-Y1200 HydrophobicContact CG2-CG 3.83Å
1185	S	94.1	Very high	91	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-53.6	-49.5	173.7	166.3	0	0	0	0	112	C1181 H1182 T1187 Y1188 T1189 A1197 E1201	C1181-S1185 WeakPolarHBondContact O-CB 3.48Å; C1181-S1185 PolarHBondContact O-N 3.47Å; H1182-S1185 WeakPolarHBondContact O-CB 3.24Å; H1182-S1185 PolarHBondContact O-N 3.18Å; S1185-T1187 PolarHBondContact O-N 3.05Å; S1185-Y1188 PolarHBondContact O-N 2.95Å; S1185-T1189 WeakPolarHBondContact O-CB 3.36Å; S1185-T1189 PolarHBondContact O-N 3.36Å; S1185-T1189 PolarHBondContact O-OG1 3.1Å; S1185-A1197 VanDerWaalsContact O-CB 3.3Å; S1185-A1197 WeakPolarHBondContact O-CB 3.32Å; S1185-A1197 PolarHBondContact OG-O 2.97Å; S1185-E1201 PolarHBondContact OG-OE2 2.99Å
1186	L	91.7	Very high	91.2	Very high	35 Å²	35	34.8 Å²	34.8	18%	0.183	16%	0.162	C	C	.	.	H	α-helix	trans	-60.3	-45.9	174.6	-69.1	173.3	0	0	0	111.6	H1182 I1184 Y1188 T1189 Y1190	H1182-L1186 WeakPolarHBondContact O-CG 3.24Å; H1182-L1186 PolarHBondContact O-N 3.19Å; I1184-L1186 PolarHBondContact O-N 2.89Å; L1186-Y1188 PolarHBondContact O-N 3.1Å; L1186-T1189 WeakPolarHBondContact O-CA 3.48Å; L1186-T1189 WeakPolarHBondContact O-CB 3.48Å; L1186-T1189 PolarHBondContact O-N 2.74Å; L1186-T1189 VanDerWaalsContact O-N 3.09Å; L1186-Y1190 HydrophobicContact CB-CD2 4.49Å; L1186-Y1190 HydrophobicContact CB-CE2 4.01Å; L1186-Y1190 WeakPolarHBondContact O-CD2 3.47Å; L1186-Y1190 PolarHBondContact O-N 3.25Å
1187	T	93	Very high	91.5	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-61.7	-45.6	-180	-47.1	0	0	0	0	112.4	Q1147 L1152 A1155 L1156 F1159 L1183 I1184 S1185 T1189 Y1190 R1191	Q1147-T1187 PolarHBondContact NE2-OG1 3.43Å; L1152-T1187 HydrophobicContact CB-CG2 4.06Å; L1152-T1187 HydrophobicContact CD2-CG2 3.99Å; A1155-T1187 HydrophobicContact CB-CG2 4.28Å; L1156-T1187 HydrophobicContact CD1-CG2 4.43Å; L1156-T1187 HydrophobicContact CD2-CG2 3.77Å; L1156-T1187 HydrophobicContact CG-CG2 3.67Å; F1159-T1187 WeakPolarHBondContact CE2-OG1 3.32Å; L1183-T1187 PolarHBondContact O-N 3.19Å; L1183-T1187 PolarHBondContact O-OG1 3.15Å; I1184-T1187 PolarHBondContact O-N 3.01Å; I1184-T1187 VanDerWaalsContact O-N 3.14Å; S1185-T1187 PolarHBondContact O-N 3.05Å; T1187-T1189 VanDerWaalsContact C-N 3.28Å; T1187-T1189 PolarHBondContact O-N 3.35Å; T1187-Y1190 PolarHBondContact O-N 3.34Å; T1187-R1191 WeakPolarHBondContact O-CB 3.05Å; T1187-R1191 PolarHBondContact O-N 2.72Å
1188	Y	94.2	Very high	91.5	Very high	34 Å²	34	34.2 Å²	34.2	13%	0.133	16%	0.161	C	C	.	.	H	α-helix	trans	-64.8	-31.8	173.6	-80.5	-68.8	0	0	0	112.4	L1156 E1160 I1184 S1185 L1186 R1191 G1192 D1193 T1196 Y1200	L1156-Y1188 HydrophobicContact CD1-CD1 4.07Å; L1156-Y1188 HydrophobicContact CD1-CE1 3.62Å; L1156-Y1188 HydrophobicContact CD1-CE2 4.29Å; L1156-Y1188 HydrophobicContact CD2-CD1 4.49Å; L1156-Y1188 HydrophobicContact CD2-CD2 3.68Å; L1156-Y1188 HydrophobicContact CD2-CE1 4.25Å; L1156-Y1188 HydrophobicContact CD2-CE2 3.39Å; L1156-Y1188 HydrophobicContact CD2-CG 4.22Å; L1156-Y1188 HydrophobicContact CG-CE2 4.45Å; E1160-Y1188 PolarHBondContact OE1-OH 2.94Å; I1184-Y1188 HydrophobicContact CG2-CD2 3.5Å; I1184-Y1188 VanDerWaalsContact CG2-CD2 3.5Å; I1184-Y1188 HydrophobicContact CG2-CE2 3.43Å; I1184-Y1188 VanDerWaalsContact CG2-CE2 3.43Å; I1184-Y1188 WeakPolarHBondContact O-CD2 3.47Å; I1184-Y1188 PolarHBondContact O-N 3.23Å; S1185-Y1188 PolarHBondContact O-N 2.95Å; L1186-Y1188 PolarHBondContact O-N 3.1Å; Y1188-R1191 CarbonylContact O-C 3.57Å; Y1188-R1191 PolarHBondContact O-N 2.72Å; Y1188-G1192 PolarHBondContact O-N 2.8Å; Y1188-D1193 HydrophobicContact CD1-CB 4.15Å; Y1188-D1193 PolarHBondContact O-N 3.39Å; Y1188-T1196 HydrophobicContact CD1-CG2 3.96Å; Y1188-T1196 HydrophobicContact CD2-CG2 3.69Å; Y1188-T1196 HydrophobicContact CE1-CG2 3.92Å; Y1188-T1196 HydrophobicContact CE2-CG2 3.65Å; Y1188-T1196 HydrophobicContact CG-CG2 3.87Å; Y1188-Y1200 HydrophobicContact CD2-CD2 4.08Å; Y1188-Y1200 HydrophobicContact CD2-CE2 4.04Å; Y1188-Y1200 HydrophobicContact CE2-CD2 4.17Å; Y1188-Y1200 AromaticContact CE2-CE2 3.64Å; Y1188-Y1200 HydrophobicContact CE2-CE2 3.64Å
1189	T	90.3	Very high	91.7	Very high	7 Å²	7	38.2 Å²	38.2	4%	0.043	18%	0.182	C	C	.	.	H	α-helix	trans	-68.7	-42.6	174.7	-52.5	0	0	0	0	112	S1185 L1186 T1187 R1191 G1192 F1194 A1197 L1229 L1310	S1185-T1189 WeakPolarHBondContact O-CB 3.36Å; S1185-T1189 PolarHBondContact O-N 3.36Å; S1185-T1189 PolarHBondContact O-OG1 3.1Å; L1186-T1189 WeakPolarHBondContact O-CA 3.48Å; L1186-T1189 WeakPolarHBondContact O-CB 3.48Å; L1186-T1189 PolarHBondContact O-N 2.74Å; L1186-T1189 VanDerWaalsContact O-N 3.09Å; T1187-T1189 VanDerWaalsContact C-N 3.28Å; T1187-T1189 PolarHBondContact O-N 3.35Å; T1189-R1191 VanDerWaalsContact C-N 3.29Å; T1189-R1191 PolarHBondContact O-N 3.49Å; T1189-G1192 PolarHBondContact O-N 3.08Å; T1189-G1192 VanDerWaalsContact O-N 3.1Å; T1189-F1194 HydrophobicContact CG2-CD1 3.99Å; T1189-F1194 HydrophobicContact CG2-CE1 3.61Å; T1189-F1194 HydrophobicContact CG2-CZ 4.44Å; T1189-A1197 VanDerWaalsContact OG1-CB 3.23Å; T1189-A1197 WeakPolarHBondContact OG1-CB 3.41Å; T1189-L1229 HydrophobicContact CG2-CD2 3.56Å; T1189-L1229 VanDerWaalsContact OG1-CD2 3.29Å; T1189-L1229 WeakPolarHBondContact OG1-CD2 3.24Å; T1189-L1310 HydrophobicContact CG2-CD1 3.56Å; T1189-L1310 HydrophobicContact CG2-CG 4.24Å
1190	Y	89.5	Confident	91.9	Very high	50 Å²	50	38.2 Å²	38.2	20%	0.196	18%	0.181	C	C	.	.	H	α-helix	trans	-63.9	-34.7	172.3	-63.4	-49.2	0	0	0	112.3	Q1147 L1186 T1187 G1192 L1310 P1311 M1312 P1313	Q1147-Y1190 HydrophobicContact CG-CD2 4.16Å; Q1147-Y1190 HydrophobicContact CG-CE2 4.34Å; L1186-Y1190 HydrophobicContact CB-CD2 4.49Å; L1186-Y1190 HydrophobicContact CB-CE2 4.01Å; L1186-Y1190 WeakPolarHBondContact O-CD2 3.47Å; L1186-Y1190 PolarHBondContact O-N 3.25Å; T1187-Y1190 PolarHBondContact O-N 3.34Å; Y1190-G1192 PolarHBondContact O-N 2.95Å; Y1190-L1310 HydrophobicContact CD1-CB 4.21Å; Y1190-L1310 HydrophobicContact CE1-CB 3.81Å; Y1190-L1310 HydrophobicContact CE1-CD1 4.47Å; Y1190-P1311 WeakPolarHBondContact CE1-O 3.34Å; Y1190-P1311 PolarHBondContact OH-O 3.47Å; Y1190-M1312 HydrophobicContact CD1-SD 4.03Å; Y1190-M1312 HydrophobicContact CG-SD 4.05Å; Y1190-P1313 HydrophobicContact CE2-CG 4.19Å
1191	R	89.9	Confident	92	Very high	120 Å²	120	38.1 Å²	38.1	45%	0.453	18%	0.181	S	C	.	.	H	α-helix	trans	-71.4	-17.8	173.4	-171.2	177.5	178.8	142.4	23.4	113.1	L1152 D1153 T1187 Y1188 T1189	L1152-R1191 HydrophobicContact CD1-CB 4.12Å; D1153-R1191 VanDerWaalsContact CG-NH2 3.26Å; D1153-R1191 IonicContact OD1-CZ 2.99Å; D1153-R1191 IonicContact OD1-NE 3.59Å; D1153-R1191 IonicContact OD1-NH1 3.05Å; D1153-R1191 PolarHBondContact OD1-NH1 2.99Å; D1153-R1191 IonicContact OD1-NH2 3.09Å; D1153-R1191 PolarHBondContact OD1-NH2 3.34Å; D1153-R1191 VanDerWaalsContact OD1-NH2 3.09Å; D1153-R1191 IonicContact OD2-CZ 3.1Å; D1153-R1191 IonicContact OD2-NH1 2.87Å; D1153-R1191 PolarHBondContact OD2-NH1 3.49Å; D1153-R1191 IonicContact OD2-NH2 2.67Å; D1153-R1191 PolarHBondContact OD2-NH2 3.49Å; T1187-R1191 WeakPolarHBondContact O-CB 3.05Å; T1187-R1191 PolarHBondContact O-N 2.72Å; Y1188-R1191 CarbonylContact O-C 3.57Å; Y1188-R1191 PolarHBondContact O-N 2.72Å; T1189-R1191 VanDerWaalsContact C-N 3.29Å; T1189-R1191 PolarHBondContact O-N 3.49Å
1192	G	86.4	Confident	92.1	Very high	43 Å²	43	42.3 Å²	42.3	44%	0.443	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	88	8.8	-178.9	0	0	0	0	0	115.5	Y1188 T1189 Y1190 F1194	Y1188-G1192 PolarHBondContact O-N 2.8Å; T1189-G1192 PolarHBondContact O-N 3.08Å; T1189-G1192 VanDerWaalsContact O-N 3.1Å; Y1190-G1192 PolarHBondContact O-N 2.95Å; G1192-F1194 WeakPolarHBondContact O-CD2 3.09Å; G1192-F1194 WeakPolarHBondContact O-CE2 3.49Å; G1192-F1194 PolarHBondContact O-N 3.45Å
1193	D	88.9	Confident	92.1	Very high	58 Å²	58	43.8 Å²	43.8	31%	0.31	20%	0.203	S	C	.	.			trans	-91.3	77.3	169.8	-173.1	-2.4	0	0	0	111.1	Y1188 R1195 T1196 A1197	Y1188-D1193 HydrophobicContact CD1-CB 4.15Å; Y1188-D1193 PolarHBondContact O-N 3.39Å; D1193-R1195 PolarHBondContact O-N 3.09Å; D1193-R1195 WeakPolarHBondContact OD1-CB 3.29Å; D1193-R1195 PolarHBondContact OD1-N 3.18Å; D1193-T1196 VanDerWaalsContact CG-OG1 3.3Å; D1193-T1196 PolarHBondContact O-N 3.27Å; D1193-T1196 PolarHBondContact OD1-N 3.28Å; D1193-T1196 WeakPolarHBondContact OD2-CB 3.24Å; D1193-T1196 PolarHBondContact OD2-OG1 3.11Å; D1193-A1197 WeakPolarHBondContact O-CB 3.44Å; D1193-A1197 PolarHBondContact O-N 3.44Å
1194	F	87.5	Confident	92.2	Very high	24 Å²	24	44.1 Å²	44.1	11%	0.105	20%	0.204	C	C	.	.	H	α-helix	trans	-62.7	-18.9	176.1	-57.6	-90.3	0	0	0	113.4	T1189 G1192 L1198 Q1232 A1233 I1236	T1189-F1194 HydrophobicContact CG2-CD1 3.99Å; T1189-F1194 HydrophobicContact CG2-CE1 3.61Å; T1189-F1194 HydrophobicContact CG2-CZ 4.44Å; G1192-F1194 WeakPolarHBondContact O-CD2 3.09Å; G1192-F1194 WeakPolarHBondContact O-CE2 3.49Å; G1192-F1194 PolarHBondContact O-N 3.45Å; F1194-L1198 VanDerWaalsContact O-CB 3.29Å; F1194-L1198 WeakPolarHBondContact O-CB 3.36Å; F1194-L1198 WeakPolarHBondContact O-CD1 3.45Å; F1194-L1198 WeakPolarHBondContact O-CG 3.01Å; F1194-L1198 PolarHBondContact O-N 2.88Å; F1194-L1198 VanDerWaalsContact O-N 3.13Å; F1194-Q1232 HydrophobicContact CD1-CB 4.09Å; F1194-Q1232 HydrophobicContact CE1-CB 3.99Å; F1194-A1233 HydrophobicContact CB-CB 3.79Å; F1194-A1233 HydrophobicContact CG-CB 4.5Å; F1194-I1236 HydrophobicContact CD2-CD1 3.91Å; F1194-I1236 HydrophobicContact CE1-CD1 4.04Å; F1194-I1236 HydrophobicContact CE2-CD1 3.23Å; F1194-I1236 HydrophobicContact CZ-CD1 3.31Å
1195	R	89	Confident	92.1	Very high	195 Å²	195	46 Å²	46	74%	0.736	21%	0.212	S	C	*	.	H	α-helix	trans	-74.7	-52.7	178.4	179	-179.2	175	172.9	-1.4	109.8	D1193 A1197 L1198 D1199	D1193-R1195 PolarHBondContact O-N 3.09Å; D1193-R1195 WeakPolarHBondContact OD1-CB 3.29Å; D1193-R1195 PolarHBondContact OD1-N 3.18Å; R1195-A1197 VanDerWaalsContact C-N 3.33Å; R1195-L1198 PolarHBondContact O-N 3.28Å; R1195-D1199 PolarHBondContact O-N 3.5Å
1196	T	92.6	Very high	92.1	Very high	41 Å²	41	50.9 Å²	50.9	25%	0.252	24%	0.237	S	C	.	.	H	α-helix	trans	-65.4	-39.8	178.7	-57.6	0	0	0	0	110.7	Y1188 D1193 L1198 D1199 Y1200	Y1188-T1196 HydrophobicContact CD1-CG2 3.96Å; Y1188-T1196 HydrophobicContact CD2-CG2 3.69Å; Y1188-T1196 HydrophobicContact CE1-CG2 3.92Å; Y1188-T1196 HydrophobicContact CE2-CG2 3.65Å; Y1188-T1196 HydrophobicContact CG-CG2 3.87Å; D1193-T1196 VanDerWaalsContact CG-OG1 3.3Å; D1193-T1196 PolarHBondContact O-N 3.27Å; D1193-T1196 PolarHBondContact OD1-N 3.28Å; D1193-T1196 WeakPolarHBondContact OD2-CB 3.24Å; D1193-T1196 PolarHBondContact OD2-OG1 3.11Å; T1196-L1198 PolarHBondContact O-N 2.99Å; T1196-D1199 PolarHBondContact O-N 2.93Å; T1196-Y1200 HydrophobicContact CG2-CD2 3.93Å; T1196-Y1200 HydrophobicContact CG2-CE2 3.79Å; T1196-Y1200 WeakPolarHBondContact O-CD2 3.33Å; T1196-Y1200 PolarHBondContact O-N 3.31Å; T1196-Y1200 VanDerWaalsContact O-N 3.15Å
1197	A	92.5	Very high	92.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-56	-48.1	172.5	0	0	0	0	0	113.1	S1185 T1189 D1193 R1195 D1199 Y1200 E1201	S1185-A1197 VanDerWaalsContact O-CB 3.3Å; S1185-A1197 WeakPolarHBondContact O-CB 3.32Å; S1185-A1197 PolarHBondContact OG-O 2.97Å; T1189-A1197 VanDerWaalsContact OG1-CB 3.23Å; T1189-A1197 WeakPolarHBondContact OG1-CB 3.41Å; D1193-A1197 WeakPolarHBondContact O-CB 3.44Å; D1193-A1197 PolarHBondContact O-N 3.44Å; R1195-A1197 VanDerWaalsContact C-N 3.33Å; A1197-D1199 VanDerWaalsContact C-N 3.27Å; A1197-D1199 PolarHBondContact O-N 3.26Å; A1197-Y1200 PolarHBondContact O-N 3.19Å; A1197-E1201 PolarHBondContact O-N 3.48Å
1198	L	92.9	Very high	92.1	Very high	19 Å²	19	49.9 Å²	49.9	10%	0.099	23%	0.232	C	C	.	.	H	α-helix	trans	-60.8	-32.8	177.9	-84.8	169.6	0	0	0	113.4	F1194 R1195 T1196 K1202 L1226 L1229 T1230 A1233	F1194-L1198 VanDerWaalsContact O-CB 3.29Å; F1194-L1198 WeakPolarHBondContact O-CB 3.36Å; F1194-L1198 WeakPolarHBondContact O-CD1 3.45Å; F1194-L1198 WeakPolarHBondContact O-CG 3.01Å; F1194-L1198 PolarHBondContact O-N 2.88Å; F1194-L1198 VanDerWaalsContact O-N 3.13Å; R1195-L1198 PolarHBondContact O-N 3.28Å; T1196-L1198 PolarHBondContact O-N 2.99Å; L1198-K1202 WeakPolarHBondContact O-CB 3.44Å; L1198-K1202 VanDerWaalsContact O-CD 3.31Å; L1198-K1202 WeakPolarHBondContact O-CD 3.3Å; L1198-K1202 WeakPolarHBondContact O-CE 3.42Å; L1198-K1202 WeakPolarHBondContact O-CG 3.47Å; L1198-K1202 PolarHBondContact O-N 3.45Å; L1198-K1202 VanDerWaalsContact O-N 3.09Å; L1198-L1226 HydrophobicContact CD2-CD2 4.14Å; L1198-L1229 HydrophobicContact CD2-CB 3.57Å; L1198-L1229 HydrophobicContact CG-CB 4.03Å; L1198-T1230 WeakPolarHBondContact CD2-OG1 3.28Å; L1198-A1233 HydrophobicContact CD1-CB 3.93Å
1199	D	94.8	Very high	92	Very high	83 Å²	83	53.3 Å²	53.3	44%	0.444	25%	0.247	S	C	.	.	H	α-helix	trans	-76	-34.1	179	-70.9	-25	0	0	0	111.9	R1195 T1196 A1197 K1202 R1203	R1195-D1199 PolarHBondContact O-N 3.5Å; T1196-D1199 PolarHBondContact O-N 2.93Å; A1197-D1199 VanDerWaalsContact C-N 3.27Å; A1197-D1199 PolarHBondContact O-N 3.26Å; D1199-K1202 IonicContact OD1-NZ 2.63Å; D1199-K1202 PolarHBondContact OD1-NZ 3.35Å; D1199-R1203 PolarHBondContact O-N 3.09Å
1200	Y	95.1	Very high	92.2	Very high	52 Å²	52	58 Å²	58	20%	0.204	27%	0.268	C	S	.	.	H	α-helix	trans	-70.1	-41.4	170.1	-81.9	-73	0	0	0	113.2	E1160 L1163 C1181 I1184 Y1188 T1196 A1197 K1202 R1203 R1204	E1160-Y1200 PolarHBondContact OE1-OH 3.46Å; L1163-Y1200 HydrophobicContact CD2-CE1 3.86Å; C1181-Y1200 HydrophobicContact CB-CD1 4.2Å; I1184-Y1200 HydrophobicContact CB-CD1 4.35Å; I1184-Y1200 HydrophobicContact CB-CE1 4.46Å; I1184-Y1200 HydrophobicContact CB-CG 4.38Å; I1184-Y1200 HydrophobicContact CD1-CE1 4.17Å; I1184-Y1200 HydrophobicContact CG2-CD1 4.01Å; I1184-Y1200 HydrophobicContact CG2-CD2 3.55Å; I1184-Y1200 HydrophobicContact CG2-CE1 3.9Å; I1184-Y1200 HydrophobicContact CG2-CE2 3.41Å; I1184-Y1200 VanDerWaalsContact CG2-CE2 3.41Å; I1184-Y1200 HydrophobicContact CG2-CG 3.83Å; Y1188-Y1200 HydrophobicContact CD2-CD2 4.08Å; Y1188-Y1200 HydrophobicContact CD2-CE2 4.04Å; Y1188-Y1200 HydrophobicContact CE2-CD2 4.17Å; Y1188-Y1200 AromaticContact CE2-CE2 3.64Å; Y1188-Y1200 HydrophobicContact CE2-CE2 3.64Å; T1196-Y1200 HydrophobicContact CG2-CD2 3.93Å; T1196-Y1200 HydrophobicContact CG2-CE2 3.79Å; T1196-Y1200 WeakPolarHBondContact O-CD2 3.33Å; T1196-Y1200 PolarHBondContact O-N 3.31Å; T1196-Y1200 VanDerWaalsContact O-N 3.15Å; A1197-Y1200 PolarHBondContact O-N 3.19Å; Y1200-K1202 VanDerWaalsContact C-N 3.31Å; Y1200-K1202 PolarHBondContact O-N 3.48Å; Y1200-R1203 WeakPolarHBondContact O-CB 3.45Å; Y1200-R1203 PolarHBondContact O-N 3.46Å; Y1200-R1203 VanDerWaalsContact O-N 3.1Å; Y1200-R1204 PolarHBondContact O-N 3.41Å
1201	E	93.7	Very high	92.2	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.6	-33.6	176.9	-163.9	65.2	-152.3	0	0	111.6	H1182 S1185 A1197 R1203 R1204 F1205 S1222 C1225 L1226 L1229	H1182-E1201 IonicContact CE1-OE2 3.83Å; H1182-E1201 IonicContact CG-OE2 2.67Å; H1182-E1201 IonicContact ND1-OE1 2.79Å; H1182-E1201 IonicContact ND1-OE2 3.1Å; H1182-E1201 PolarHBondContact ND1-OE2 3.27Å; S1185-E1201 PolarHBondContact OG-OE2 2.99Å; A1197-E1201 PolarHBondContact O-N 3.48Å; E1201-R1203 VanDerWaalsContact C-N 3.3Å; E1201-R1203 PolarHBondContact O-N 3.11Å; E1201-R1204 WeakPolarHBondContact O-CB 3.16Å; E1201-R1204 PolarHBondContact O-N 3.3Å; E1201-R1204 WeakPolarHBondContact OE1-CD 3.43Å; E1201-R1204 IonicContact OE1-CZ 2.85Å; E1201-R1204 IonicContact OE1-NE 3.98Å; E1201-R1204 IonicContact OE1-NH1 2.96Å; E1201-R1204 PolarHBondContact OE1-NH1 3Å; E1201-F1205 PolarHBondContact O-N 2.89Å; E1201-S1222 PolarHBondContact OE1-OG 3.09Å; E1201-C1225 VanDerWaalsContact CD-SG 3.53Å; E1201-C1225 HydrophobicContact CG-CB 4.14Å; E1201-C1225 WeakPolarHBondContact OE1-CB 3.19Å; E1201-L1226 HydrophobicContact CB-CD2 3.81Å; E1201-L1226 HydrophobicContact CB-CG 4.35Å; E1201-L1226 HydrophobicContact CG-CD2 3.87Å; E1201-L1226 HydrophobicContact CG-CG 3.85Å; E1201-L1229 HydrophobicContact CB-CD1 3.89Å; E1201-L1229 HydrophobicContact CG-CD1 4.01Å
1202	K	95.2	Very high	92.1	Very high	88 Å²	88	55.8 Å²	55.8	38%	0.383	26%	0.264	S	S	.	.	H	α-helix	trans	-60.9	-40.1	170.5	-75.4	162.7	-148.2	159.1	0	111.3	L1198 D1199 Y1200 F1205 L1206 L1226	L1198-K1202 WeakPolarHBondContact O-CB 3.44Å; L1198-K1202 VanDerWaalsContact O-CD 3.31Å; L1198-K1202 WeakPolarHBondContact O-CD 3.3Å; L1198-K1202 WeakPolarHBondContact O-CE 3.42Å; L1198-K1202 WeakPolarHBondContact O-CG 3.47Å; L1198-K1202 PolarHBondContact O-N 3.45Å; L1198-K1202 VanDerWaalsContact O-N 3.09Å; D1199-K1202 IonicContact OD1-NZ 2.63Å; D1199-K1202 PolarHBondContact OD1-NZ 3.35Å; Y1200-K1202 VanDerWaalsContact C-N 3.31Å; Y1200-K1202 PolarHBondContact O-N 3.48Å; K1202-F1205 PolarHBondContact O-N 3.47Å; K1202-L1206 WeakPolarHBondContact O-CB 3.37Å; K1202-L1206 VanDerWaalsContact O-CG 3.24Å; K1202-L1206 WeakPolarHBondContact O-CG 3.24Å; K1202-L1206 PolarHBondContact O-N 3.35Å; K1202-L1226 HydrophobicContact CB-CD2 4.49Å; K1202-L1226 HydrophobicContact CG-CD2 3.74Å
1203	R	94.7	Very high	92.3	Very high	65 Å²	65	54.8 Å²	54.8	25%	0.245	25%	0.254	C	S	.	.	H	α-helix	trans	-64	-43.7	176.5	-179.3	59.4	174.4	-172.9	-0.8	111	E1172 E1177 D1199 Y1200 E1201 L1206 I1207	E1172-R1203 IonicContact OE2-CZ 3.82Å; E1172-R1203 IonicContact OE2-NH1 3.6Å; E1172-R1203 IonicContact OE2-NH2 3.98Å; E1172-R1203 PolarHBondContact OE2-NH2 3.39Å; E1177-R1203 VanDerWaalsContact CD-NH2 3.3Å; E1177-R1203 IonicContact OE1-CZ 3.4Å; E1177-R1203 IonicContact OE1-NE 2.72Å; E1177-R1203 PolarHBondContact OE1-NE 3.45Å; E1177-R1203 IonicContact OE1-NH2 3.71Å; E1177-R1203 PolarHBondContact OE1-NH2 2.94Å; E1177-R1203 IonicContact OE2-CZ 3.4Å; E1177-R1203 IonicContact OE2-NE 3.26Å; E1177-R1203 IonicContact OE2-NH2 3.12Å; E1177-R1203 PolarHBondContact OE2-NH2 2.97Å; D1199-R1203 PolarHBondContact O-N 3.09Å; Y1200-R1203 WeakPolarHBondContact O-CB 3.45Å; Y1200-R1203 PolarHBondContact O-N 3.46Å; Y1200-R1203 VanDerWaalsContact O-N 3.1Å; E1201-R1203 VanDerWaalsContact C-N 3.3Å; E1201-R1203 PolarHBondContact O-N 3.11Å; R1203-L1206 PolarHBondContact O-N 3.39Å; R1203-I1207 HydrophobicContact CG-CD1 4.01Å; R1203-I1207 VanDerWaalsContact O-CG1 3.26Å; R1203-I1207 WeakPolarHBondContact O-CG1 3.47Å; R1203-I1207 PolarHBondContact O-N 3.47Å; R1203-I1207 VanDerWaalsContact O-N 3.13Å
1204	R	93.8	Very high	92.3	Very high	13 Å²	13	55.8 Å²	55.8	5%	0.049	26%	0.264	C	S	.	.	H	α-helix	trans	-56	-54.1	172.9	-177.8	-163	-171.2	-139.2	-4.8	111.7	A1178 C1181 H1182 Y1200 E1201 L1206 I1207 Y1208 D1221 S1222	A1178-R1204 HydrophobicContact CB-CG 4.12Å; A1178-R1204 WeakPolarHBondContact O-CG 3.42Å; C1181-R1204 HydrophobicContact CB-CB 4.45Å; H1182-R1204 HydrophobicContact CB-CG 4.46Å; H1182-R1204 PolarHBondContact CE1-NH1 2.73Å; H1182-R1204 PolarHBondContact ND1-NH1 3.05Å; Y1200-R1204 PolarHBondContact O-N 3.41Å; E1201-R1204 WeakPolarHBondContact O-CB 3.16Å; E1201-R1204 PolarHBondContact O-N 3.3Å; E1201-R1204 WeakPolarHBondContact OE1-CD 3.43Å; E1201-R1204 IonicContact OE1-CZ 2.85Å; E1201-R1204 IonicContact OE1-NE 3.98Å; E1201-R1204 IonicContact OE1-NH1 2.96Å; E1201-R1204 PolarHBondContact OE1-NH1 3Å; R1204-L1206 PolarHBondContact O-N 3.02Å; R1204-I1207 PolarHBondContact O-N 2.81Å; R1204-Y1208 HydrophobicContact CG-CD2 3.93Å; R1204-Y1208 HydrophobicContact CG-CE2 3.62Å; R1204-Y1208 PolarHBondContact O-N 3.43Å; R1204-D1221 IonicContact CZ-OD2 2.93Å; R1204-D1221 VanDerWaalsContact CZ-OD2 3.22Å; R1204-D1221 IonicContact NH1-OD2 2.71Å; R1204-D1221 PolarHBondContact NH1-OD2 2.68Å; R1204-D1221 IonicContact NH2-OD2 2.95Å; R1204-D1221 PolarHBondContact NH2-OD2 2.95Å; R1204-S1222 WeakPolarHBondContact CD-OG 3.43Å
1205	F	94.4	Very high	92.4	Very high	39 Å²	39	60.7 Å²	60.7	17%	0.171	29%	0.291	C	S	.	.	H	α-helix	trans	-56.8	-45.6	179.9	173.4	-107	0	0	0	112.7	E1201 K1202 I1207 Y1208 K1209 T1219 S1222 D1223 L1226	E1201-F1205 PolarHBondContact O-N 2.89Å; K1202-F1205 PolarHBondContact O-N 3.47Å; F1205-I1207 PolarHBondContact O-N 2.75Å; F1205-Y1208 PolarHBondContact O-N 2.76Å; F1205-K1209 HydrophobicContact CE1-CD 4.03Å; F1205-K1209 HydrophobicContact CZ-CD 3.9Å; F1205-K1209 VanDerWaalsContact O-CB 3.23Å; F1205-K1209 WeakPolarHBondContact O-CB 3.3Å; F1205-K1209 PolarHBondContact O-N 2.92Å; F1205-T1219 HydrophobicContact CD2-CG2 3.99Å; F1205-T1219 HydrophobicContact CE2-CG2 3.66Å; F1205-S1222 WeakPolarHBondContact CA-OG 3.46Å; F1205-S1222 WeakPolarHBondContact CB-OG 3.46Å; F1205-S1222 PolarHBondContact N-OG 3.45Å; F1205-D1223 HydrophobicContact CD2-CB 4.06Å; F1205-D1223 HydrophobicContact CE2-CB 3.77Å; F1205-L1226 HydrophobicContact CB-CD1 3.63Å; F1205-L1226 HydrophobicContact CD1-CD1 4.11Å; F1205-L1226 HydrophobicContact CD2-CD1 4.45Å; F1205-L1226 HydrophobicContact CG-CD1 3.81Å
1206	L	94.8	Very high	92.3	Very high	102 Å²	102	52.7 Å²	52.7	53%	0.534	27%	0.265	S	S	.	.	H	α-helix	trans	-61.6	-42.5	178.9	-72.8	169.9	0	0	0	112	K1202 R1203 R1204 E1210	K1202-L1206 WeakPolarHBondContact O-CB 3.37Å; K1202-L1206 VanDerWaalsContact O-CG 3.24Å; K1202-L1206 WeakPolarHBondContact O-CG 3.24Å; K1202-L1206 PolarHBondContact O-N 3.35Å; R1203-L1206 PolarHBondContact O-N 3.39Å; R1204-L1206 PolarHBondContact O-N 3.02Å; L1206-E1210 WeakPolarHBondContact O-CB 3.35Å; L1206-E1210 PolarHBondContact O-N 3.5Å
1207	I	91.7	Very high	92.1	Very high	2 Å²	2	56.3 Å²	56.3	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-66.9	-47.1	179	-63.8	166.8	0	0	0	111.1	R1173 E1177 A1178 R1203 R1204 F1205 K1209 E1210 R1211	R1173-I1207 HydrophobicContact CB-CG1 4.15Å; R1173-I1207 HydrophobicContact CB-CG2 4.29Å; R1173-I1207 HydrophobicContact CG-CG1 4.42Å; R1173-I1207 WeakPolarHBondContact O-CG2 3.42Å; E1177-I1207 HydrophobicContact CB-CD1 4.06Å; E1177-I1207 HydrophobicContact CG-CD1 4.1Å; A1178-I1207 HydrophobicContact CB-CB 3.92Å; A1178-I1207 HydrophobicContact CB-CD1 4.1Å; A1178-I1207 HydrophobicContact CB-CG2 3.85Å; R1203-I1207 HydrophobicContact CG-CD1 4.01Å; R1203-I1207 VanDerWaalsContact O-CG1 3.26Å; R1203-I1207 WeakPolarHBondContact O-CG1 3.47Å; R1203-I1207 PolarHBondContact O-N 3.47Å; R1203-I1207 VanDerWaalsContact O-N 3.13Å; R1204-I1207 PolarHBondContact O-N 2.81Å; F1205-I1207 PolarHBondContact O-N 2.75Å; I1207-K1209 PolarHBondContact O-N 2.76Å; I1207-E1210 PolarHBondContact O-N 2.97Å; I1207-R1211 HydrophobicContact CG2-CG 4.23Å; I1207-R1211 WeakPolarHBondContact O-CB 3.42Å; I1207-R1211 PolarHBondContact O-N 2.85Å
1208	Y	91.9	Very high	91.7	Very high	13 Å²	13	62.7 Å²	62.7	5%	0.051	31%	0.308	C	S	.	.	H	α-helix	trans	-63.2	-42.1	177.8	-69.2	-22.8	0	0	0	111.9	L1175 A1178 R1204 F1205 E1210 R1211 L1212 G1213 Y1218 T1219	L1175-Y1208 HydrophobicContact CD2-CD1 3.66Å; L1175-Y1208 HydrophobicContact CD2-CE1 3.89Å; A1178-Y1208 HydrophobicContact CB-CD1 3.74Å; A1178-Y1208 HydrophobicContact CB-CE1 3.39Å; A1178-Y1208 HydrophobicContact CB-CG 4.48Å; R1204-Y1208 HydrophobicContact CG-CD2 3.93Å; R1204-Y1208 HydrophobicContact CG-CE2 3.62Å; R1204-Y1208 PolarHBondContact O-N 3.43Å; F1205-Y1208 PolarHBondContact O-N 2.76Å; Y1208-E1210 PolarHBondContact O-N 3.34Å; Y1208-R1211 PolarHBondContact O-N 3.03Å; Y1208-L1212 HydrophobicContact CD1-CD1 4.01Å; Y1208-L1212 HydrophobicContact CG-CD1 4.43Å; Y1208-L1212 WeakPolarHBondContact O-CA 3.39Å; Y1208-L1212 WeakPolarHBondContact O-CB 3.41Å; Y1208-L1212 PolarHBondContact O-N 2.81Å; Y1208-G1213 PolarHBondContact O-N 2.93Å; Y1208-Y1218 WeakPolarHBondContact CD2-O 3.37Å; Y1208-Y1218 HydrophobicContact CE2-CD1 4.44Å; Y1208-T1219 VanDerWaalsContact C-OG1 3.27Å; Y1208-T1219 WeakPolarHBondContact CB-OG1 3.38Å; Y1208-T1219 PolarHBondContact O-OG1 3.36Å
1209	K	93.5	Very high	91.5	Very high	105 Å²	105	61.9 Å²	61.9	46%	0.457	30%	0.304	S	S	.	.	H	α-helix	trans	-61.3	-32.6	175	-174	174.9	179	177	0	113.1	F1205 I1207 G1213 T1219	F1205-K1209 HydrophobicContact CE1-CD 4.03Å; F1205-K1209 HydrophobicContact CZ-CD 3.9Å; F1205-K1209 VanDerWaalsContact O-CB 3.23Å; F1205-K1209 WeakPolarHBondContact O-CB 3.3Å; F1205-K1209 PolarHBondContact O-N 2.92Å; I1207-K1209 PolarHBondContact O-N 2.76Å; K1209-G1213 WeakPolarHBondContact O-CA 3.29Å; K1209-G1213 PolarHBondContact O-N 3.09Å; K1209-T1219 HydrophobicContact CB-CG2 3.82Å; K1209-T1219 HydrophobicContact CG-CG2 4.4Å
1210	E	93.1	Very high	91.2	Very high	106 Å²	106	62.7 Å²	62.7	50%	0.495	30%	0.303	S	S	.	.	H	α-helix	trans	-81.2	-40.9	178.6	-171.2	173.6	143.2	0	0	113	R1173 L1206 I1207 Y1208	R1173-E1210 WeakPolarHBondContact CD-OE1 3.44Å; R1173-E1210 WeakPolarHBondContact CD-OE2 3.19Å; R1173-E1210 IonicContact CZ-OE1 2.85Å; R1173-E1210 IonicContact CZ-OE2 3.52Å; R1173-E1210 IonicContact NE-OE1 2.87Å; R1173-E1210 IonicContact NE-OE2 2.9Å; R1173-E1210 IonicContact NH1-OE1 3.35Å; R1173-E1210 PolarHBondContact NH1-OE1 3.28Å; R1173-E1210 IonicContact NH1-OE2 3.42Å; R1173-E1210 PolarHBondContact NH1-OE2 2.84Å; L1206-E1210 WeakPolarHBondContact O-CB 3.35Å; L1206-E1210 PolarHBondContact O-N 3.5Å; I1207-E1210 PolarHBondContact O-N 2.97Å; Y1208-E1210 PolarHBondContact O-N 3.34Å
1211	R	89.3	Confident	90.9	Very high	60 Å²	60	64.2 Å²	64.2	23%	0.226	32%	0.315	C	S	.	.	H	α-helix	trans	-91.3	-31.7	-175.4	-67.2	-60.4	-167.6	178.4	5.6	115.1	D670 H671 R1173 L1175 I1207 Y1208	D670-R1211 IonicContact OD1-NH1 3.32Å; H671-R1211 PolarHBondContact CD2-NH1 3.02Å; H671-R1211 VanDerWaalsContact CD2-NH1 3.32Å; H671-R1211 PolarHBondContact CD2-NH2 2.67Å; H671-R1211 PolarHBondContact NE2-NH2 3.18Å; H671-R1211 VanDerWaalsContact NE2-NH2 3.15Å; R1173-R1211 VanDerWaalsContact O-CG 3.31Å; R1173-R1211 WeakPolarHBondContact O-CG 3.36Å; R1173-R1211 PolarHBondContact O-NE 3.46Å; L1175-R1211 HydrophobicContact CD2-CB 3.87Å; L1175-R1211 HydrophobicContact CD2-CG 4.36Å; I1207-R1211 HydrophobicContact CG2-CG 4.23Å; I1207-R1211 WeakPolarHBondContact O-CB 3.42Å; I1207-R1211 PolarHBondContact O-N 2.85Å; Y1208-R1211 PolarHBondContact O-N 3.03Å
1212	L	89.4	Confident	90.7	Very high	64 Å²	64	64.2 Å²	64.2	34%	0.335	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.6	-6	-174.6	-54.9	174.5	0	0	0	112.6	L1175 Y1208 S1216 Y1218	L1175-L1212 HydrophobicContact CD1-CD1 4.37Å; L1175-L1212 HydrophobicContact CD1-CD2 4Å; L1175-L1212 HydrophobicContact CD1-CG 4.43Å; L1175-L1212 HydrophobicContact CD2-CD1 3.9Å; L1175-L1212 HydrophobicContact CD2-CD2 4.37Å; L1175-L1212 HydrophobicContact CD2-CG 3.95Å; Y1208-L1212 HydrophobicContact CD1-CD1 4.01Å; Y1208-L1212 HydrophobicContact CG-CD1 4.43Å; Y1208-L1212 WeakPolarHBondContact O-CA 3.39Å; Y1208-L1212 WeakPolarHBondContact O-CB 3.41Å; Y1208-L1212 PolarHBondContact O-N 2.81Å; L1212-S1216 WeakPolarHBondContact O-CB 3.31Å; L1212-Y1218 HydrophobicContact CD1-CD2 3.77Å; L1212-Y1218 HydrophobicContact CD1-CG 3.97Å
1213	G	89.5	Confident	90.5	Very high	22 Å²	22	62.6 Å²	62.6	23%	0.227	31%	0.31	C	S	.	.			trans	79.6	171.7	-176.7	0	0	0	0	0	114	Y1208 K1209 D1215 T1219	Y1208-G1213 PolarHBondContact O-N 2.93Å; K1209-G1213 WeakPolarHBondContact O-CA 3.29Å; K1209-G1213 PolarHBondContact O-N 3.09Å; G1213-D1215 VanDerWaalsContact C-N 3.33Å; G1213-D1215 PolarHBondContact O-N 3.13Å; G1213-T1219 WeakPolarHBondContact O-CB 3.41Å; G1213-T1219 PolarHBondContact O-OG1 3.48Å
1214	P	89.3	Confident	90.3	Very high	79 Å²	79	63.2 Å²	63.2	51%	0.513	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69	-30	-178.3	28.6	-34.4	0	0	0	113.2
1215	D	89.5	Confident	90	Very high	127 Å²	127	63.6 Å²	63.6	68%	0.679	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.2	-1.2	-174.7	-64.1	-69	0	0	0	114.1	G1213 K1220	G1213-D1215 VanDerWaalsContact C-N 3.33Å; G1213-D1215 PolarHBondContact O-N 3.13Å; D1215-K1220 WeakPolarHBondContact O-CE 3.36Å; D1215-K1220 PolarHBondContact O-NZ 3.33Å
1216	S	87	Confident	89.7	Confident	27 Å²	27	62.7 Å²	62.7	19%	0.189	32%	0.317	C	S	.	.	S	Bend	trans	-68.4	140.2	173.3	-172.8	0	0	0	0	111.4	L1212 Y1218 T1219 K1220	L1212-S1216 WeakPolarHBondContact O-CB 3.31Å; S1216-Y1218 PolarHBondContact O-N 2.68Å; S1216-T1219 WeakPolarHBondContact O-CA 3.24Å; S1216-T1219 WeakPolarHBondContact O-CB 3.39Å; S1216-T1219 PolarHBondContact O-N 3.04Å; S1216-K1220 PolarHBondContact O-N 3.4Å
1217	D	88.5	Confident	89.5	Confident	117 Å²	117	64.6 Å²	64.6	63%	0.626	32%	0.317	S	S	*	.	H	α-helix	trans	-63.7	-29.2	178.5	-62.1	-29.1	0	0	0	112.4	T1219 K1220 D1221	D1217-T1219 VanDerWaalsContact C-N 3.35Å; D1217-T1219 PolarHBondContact O-N 2.97Å; D1217-K1220 PolarHBondContact O-N 3.43Å; D1217-K1220 IonicContact OD1-NZ 3.2Å; D1217-K1220 PolarHBondContact OD1-NZ 2.88Å; D1217-D1221 VanDerWaalsContact O-CB 3.25Å; D1217-D1221 WeakPolarHBondContact O-CB 3.39Å; D1217-D1221 PolarHBondContact O-N 2.98Å
1218	Y	83.6	Confident	89.3	Confident	134 Å²	134	69.1 Å²	69.1	53%	0.525	34%	0.338	S	S	.	.	H	α-helix	trans	-61.5	-40.7	169.6	-66	-81.1	0	0	0	112.5	Y1208 L1212 S1216 S1222	Y1208-Y1218 WeakPolarHBondContact CD2-O 3.37Å; Y1208-Y1218 HydrophobicContact CE2-CD1 4.44Å; L1212-Y1218 HydrophobicContact CD1-CD2 3.77Å; L1212-Y1218 HydrophobicContact CD1-CG 3.97Å; S1216-Y1218 PolarHBondContact O-N 2.68Å; Y1218-S1222 PolarHBondContact O-N 3.15Å
1219	T	88.1	Confident	89	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.012	34%	0.337	C	S	.	.	H	α-helix	trans	-70.3	-40.5	178.2	-52	0	0	0	0	111.4	F1205 Y1208 K1209 G1213 S1216 D1217 S1222 D1223	F1205-T1219 HydrophobicContact CD2-CG2 3.99Å; F1205-T1219 HydrophobicContact CE2-CG2 3.66Å; Y1208-T1219 VanDerWaalsContact C-OG1 3.27Å; Y1208-T1219 WeakPolarHBondContact CB-OG1 3.38Å; Y1208-T1219 PolarHBondContact O-OG1 3.36Å; K1209-T1219 HydrophobicContact CB-CG2 3.82Å; K1209-T1219 HydrophobicContact CG-CG2 4.4Å; G1213-T1219 WeakPolarHBondContact O-CB 3.41Å; G1213-T1219 PolarHBondContact O-OG1 3.48Å; S1216-T1219 WeakPolarHBondContact O-CA 3.24Å; S1216-T1219 WeakPolarHBondContact O-CB 3.39Å; S1216-T1219 PolarHBondContact O-N 3.04Å; D1217-T1219 VanDerWaalsContact C-N 3.35Å; D1217-T1219 PolarHBondContact O-N 2.97Å; T1219-S1222 PolarHBondContact O-N 3.32Å; T1219-D1223 PolarHBondContact O-N 3.43Å
1220	K	90.3	Very high	88.7	Confident	99 Å²	99	66.9 Å²	66.9	43%	0.43	34%	0.335	S	S	.	.	H	α-helix	trans	-65.6	-43.2	176	-65.2	166.6	-173.3	146.1	0	112.2	D1215 S1216 D1217 S1222 D1223 E1224	D1215-K1220 WeakPolarHBondContact O-CE 3.36Å; D1215-K1220 PolarHBondContact O-NZ 3.33Å; S1216-K1220 PolarHBondContact O-N 3.4Å; D1217-K1220 PolarHBondContact O-N 3.43Å; D1217-K1220 IonicContact OD1-NZ 3.2Å; D1217-K1220 PolarHBondContact OD1-NZ 2.88Å; K1220-S1222 VanDerWaalsContact C-N 3.33Å; K1220-S1222 PolarHBondContact O-N 3.21Å; K1220-D1223 PolarHBondContact O-N 3.3Å; K1220-E1224 PolarHBondContact O-N 3.14Å
1221	D	88.5	Confident	88.4	Confident	84 Å²	84	67.3 Å²	67.3	45%	0.449	34%	0.337	S	S	.	.	H	α-helix	trans	-58.6	-43.1	175.1	175.1	86.3	0	0	0	111.6	R1204 D1217 E1224 C1225	R1204-D1221 IonicContact CZ-OD2 2.93Å; R1204-D1221 VanDerWaalsContact CZ-OD2 3.22Å; R1204-D1221 IonicContact NH1-OD2 2.71Å; R1204-D1221 PolarHBondContact NH1-OD2 2.68Å; R1204-D1221 IonicContact NH2-OD2 2.95Å; R1204-D1221 PolarHBondContact NH2-OD2 2.95Å; D1217-D1221 VanDerWaalsContact O-CB 3.25Å; D1217-D1221 WeakPolarHBondContact O-CB 3.39Å; D1217-D1221 PolarHBondContact O-N 2.98Å; D1221-E1224 PolarHBondContact O-N 2.99Å; D1221-C1225 WeakPolarHBondContact O-CB 3.42Å; D1221-C1225 PolarHBondContact O-N 3.15Å
1222	S	87.9	Confident	88.1	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-71.6	-34.1	177.5	-168.6	0	0	0	0	113.5	E1201 R1204 F1205 Y1218 T1219 K1220 C1225 L1226	E1201-S1222 PolarHBondContact OE1-OG 3.09Å; R1204-S1222 WeakPolarHBondContact CD-OG 3.43Å; F1205-S1222 WeakPolarHBondContact CA-OG 3.46Å; F1205-S1222 WeakPolarHBondContact CB-OG 3.46Å; F1205-S1222 PolarHBondContact N-OG 3.45Å; Y1218-S1222 PolarHBondContact O-N 3.15Å; T1219-S1222 PolarHBondContact O-N 3.32Å; K1220-S1222 VanDerWaalsContact C-N 3.33Å; K1220-S1222 PolarHBondContact O-N 3.21Å; S1222-C1225 PolarHBondContact O-N 2.91Å; S1222-L1226 WeakPolarHBondContact O-CB 3.35Å; S1222-L1226 WeakPolarHBondContact O-CG 3.22Å; S1222-L1226 PolarHBondContact O-N 2.72Å
1223	D	91.8	Very high	87.7	Confident	54 Å²	54	64.8 Å²	64.8	29%	0.289	33%	0.33	S	S	.	.	H	α-helix	trans	-65	-38.9	171.1	-173.4	45.3	0	0	0	111.9	F1205 T1219 K1220 L1226 R1227	F1205-D1223 HydrophobicContact CD2-CB 4.06Å; F1205-D1223 HydrophobicContact CE2-CB 3.77Å; T1219-D1223 PolarHBondContact O-N 3.43Å; K1220-D1223 PolarHBondContact O-N 3.3Å; D1223-L1226 WeakPolarHBondContact O-CB 3.28Å; D1223-L1226 PolarHBondContact O-N 2.95Å; D1223-R1227 WeakPolarHBondContact O-CD 3.13Å; D1223-R1227 VanDerWaalsContact O-CG 3.25Å; D1223-R1227 WeakPolarHBondContact O-CG 3.27Å; D1223-R1227 PolarHBondContact O-N 2.97Å; D1223-R1227 VanDerWaalsContact O-N 3.08Å; D1223-R1227 IonicContact OD1-NE 3.85Å; D1223-R1227 IonicContact OD2-CZ 2.62Å; D1223-R1227 IonicContact OD2-NE 2.65Å; D1223-R1227 PolarHBondContact OD2-NE 2.72Å; D1223-R1227 IonicContact OD2-NH2 3.91Å; D1223-R1227 PolarHBondContact OD2-NH2 2.85Å
1224	E	90.3	Very high	87.5	Confident	79 Å²	79	66.9 Å²	66.9	37%	0.369	34%	0.338	S	S	.	.	H	α-helix	trans	-70.4	-40.8	175.8	-174.6	51.4	-146.8	0	0	112.1	K1220 D1221 L1226 R1227 Q1228	K1220-E1224 PolarHBondContact O-N 3.14Å; D1221-E1224 PolarHBondContact O-N 2.99Å; E1224-L1226 VanDerWaalsContact C-N 3.34Å; E1224-L1226 PolarHBondContact O-N 3.38Å; E1224-R1227 PolarHBondContact O-N 2.99Å; E1224-R1227 WeakPolarHBondContact OE2-CD 3.18Å; E1224-R1227 IonicContact OE2-NH1 3.99Å; E1224-R1227 PolarHBondContact OE2-NH1 3.11Å; E1224-Q1228 WeakPolarHBondContact O-CG 3.24Å; E1224-Q1228 PolarHBondContact O-N 3.06Å; E1224-Q1228 PolarHBondContact OE1-NE2 2.85Å
1225	C	87.4	Confident	87.2	Confident	21 Å²	21	65 Å²	65	14%	0.142	33%	0.325	C	S	.	.	H	α-helix	trans	-58.4	-44.1	171.1	-168.5	0	0	0	0	111.7	E1201 D1221 S1222 R1227 Q1228 L1229	E1201-C1225 VanDerWaalsContact CD-SG 3.53Å; E1201-C1225 HydrophobicContact CG-CB 4.14Å; E1201-C1225 WeakPolarHBondContact OE1-CB 3.19Å; D1221-C1225 WeakPolarHBondContact O-CB 3.42Å; D1221-C1225 PolarHBondContact O-N 3.15Å; S1222-C1225 PolarHBondContact O-N 2.91Å; C1225-R1227 VanDerWaalsContact C-N 3.35Å; C1225-R1227 PolarHBondContact O-N 2.77Å; C1225-Q1228 PolarHBondContact O-N 3.42Å; C1225-L1229 WeakPolarHBondContact O-CB 3.32Å; C1225-L1229 WeakPolarHBondContact O-CG 3.5Å; C1225-L1229 PolarHBondContact O-N 2.9Å
1226	L	89.3	Confident	86.6	Confident	19 Å²	19	61.3 Å²	61.3	10%	0.099	31%	0.305	C	S	.	.	H	α-helix	trans	-57.2	-44.1	174.3	-83	173.3	0	0	0	112.9	L1198 E1201 K1202 F1205 S1222 D1223 E1224 T1230	L1198-L1226 HydrophobicContact CD2-CD2 4.14Å; E1201-L1226 HydrophobicContact CB-CD2 3.81Å; E1201-L1226 HydrophobicContact CB-CG 4.35Å; E1201-L1226 HydrophobicContact CG-CD2 3.87Å; E1201-L1226 HydrophobicContact CG-CG 3.85Å; K1202-L1226 HydrophobicContact CB-CD2 4.49Å; K1202-L1226 HydrophobicContact CG-CD2 3.74Å; F1205-L1226 HydrophobicContact CB-CD1 3.63Å; F1205-L1226 HydrophobicContact CD1-CD1 4.11Å; F1205-L1226 HydrophobicContact CD2-CD1 4.45Å; F1205-L1226 HydrophobicContact CG-CD1 3.81Å; S1222-L1226 WeakPolarHBondContact O-CB 3.35Å; S1222-L1226 WeakPolarHBondContact O-CG 3.22Å; S1222-L1226 PolarHBondContact O-N 2.72Å; D1223-L1226 WeakPolarHBondContact O-CB 3.28Å; D1223-L1226 PolarHBondContact O-N 2.95Å; E1224-L1226 VanDerWaalsContact C-N 3.34Å; E1224-L1226 PolarHBondContact O-N 3.38Å; L1226-T1230 VanDerWaalsContact O-CB 3.25Å; L1226-T1230 WeakPolarHBondContact O-CB 3.4Å; L1226-T1230 PolarHBondContact O-N 2.81Å; L1226-T1230 PolarHBondContact O-OG1 2.67Å
1227	R	89.8	Confident	86.2	Confident	142 Å²	142	63 Å²	63	54%	0.536	32%	0.32	S	S	.	.	H	α-helix	trans	-64.1	-44.7	177.7	-67.3	162	-172	-169.9	-1.9	111.2	D1223 E1224 C1225 T1230 Q1231	D1223-R1227 WeakPolarHBondContact O-CD 3.13Å; D1223-R1227 VanDerWaalsContact O-CG 3.25Å; D1223-R1227 WeakPolarHBondContact O-CG 3.27Å; D1223-R1227 PolarHBondContact O-N 2.97Å; D1223-R1227 VanDerWaalsContact O-N 3.08Å; D1223-R1227 IonicContact OD1-NE 3.85Å; D1223-R1227 IonicContact OD2-CZ 2.62Å; D1223-R1227 IonicContact OD2-NE 2.65Å; D1223-R1227 PolarHBondContact OD2-NE 2.72Å; D1223-R1227 IonicContact OD2-NH2 3.91Å; D1223-R1227 PolarHBondContact OD2-NH2 2.85Å; E1224-R1227 PolarHBondContact O-N 2.99Å; E1224-R1227 WeakPolarHBondContact OE2-CD 3.18Å; E1224-R1227 IonicContact OE2-NH1 3.99Å; E1224-R1227 PolarHBondContact OE2-NH1 3.11Å; C1225-R1227 VanDerWaalsContact C-N 3.35Å; C1225-R1227 PolarHBondContact O-N 2.77Å; R1227-T1230 PolarHBondContact O-N 3.31Å; R1227-Q1231 WeakPolarHBondContact O-CB 3.38Å; R1227-Q1231 PolarHBondContact O-N 2.79Å
1228	Q	86.9	Confident	85.9	Confident	97 Å²	97	64.4 Å²	64.4	45%	0.453	32%	0.317	S	S	.	.	H	α-helix	trans	-64.8	-47.8	179.7	-68.9	177.6	22	0	0	111.7	E1224 C1225 T1230 Q1231 Q1232	E1224-Q1228 WeakPolarHBondContact O-CG 3.24Å; E1224-Q1228 PolarHBondContact O-N 3.06Å; E1224-Q1228 PolarHBondContact OE1-NE2 2.85Å; C1225-Q1228 PolarHBondContact O-N 3.42Å; Q1228-T1230 VanDerWaalsContact C-N 3.32Å; Q1228-T1230 PolarHBondContact O-N 2.58Å; Q1228-Q1231 PolarHBondContact O-N 2.95Å; Q1228-Q1232 WeakPolarHBondContact O-CG 3.31Å; Q1228-Q1232 PolarHBondContact O-N 3.35Å
1229	L	85.9	Confident	85.7	Confident	5 Å²	5	62 Å²	62	3%	0.026	31%	0.309	C	S	.	.	H	α-helix	trans	-60.7	-40	174.4	-70.1	176.3	0	0	0	111.9	T1189 L1198 E1201 C1225 Q1232 A1233	T1189-L1229 HydrophobicContact CG2-CD2 3.56Å; T1189-L1229 VanDerWaalsContact OG1-CD2 3.29Å; T1189-L1229 WeakPolarHBondContact OG1-CD2 3.24Å; L1198-L1229 HydrophobicContact CD2-CB 3.57Å; L1198-L1229 HydrophobicContact CG-CB 4.03Å; E1201-L1229 HydrophobicContact CB-CD1 3.89Å; E1201-L1229 HydrophobicContact CG-CD1 4.01Å; C1225-L1229 WeakPolarHBondContact O-CB 3.32Å; C1225-L1229 WeakPolarHBondContact O-CG 3.5Å; C1225-L1229 PolarHBondContact O-N 2.9Å; L1229-Q1232 PolarHBondContact O-N 2.7Å; L1229-A1233 VanDerWaalsContact O-CB 3.3Å; L1229-A1233 WeakPolarHBondContact O-CB 3.47Å; L1229-A1233 PolarHBondContact O-N 2.86Å
1230	T	88.3	Confident	85.1	Confident	67 Å²	67	65.8 Å²	65.8	41%	0.411	33%	0.332	S	S	.	.	H	α-helix	trans	-64.4	-43.9	176.9	-60.2	0	0	0	0	111	L1198 L1226 R1227 Q1228 A1233 V1234	L1198-T1230 WeakPolarHBondContact CD2-OG1 3.28Å; L1226-T1230 VanDerWaalsContact O-CB 3.25Å; L1226-T1230 WeakPolarHBondContact O-CB 3.4Å; L1226-T1230 PolarHBondContact O-N 2.81Å; L1226-T1230 PolarHBondContact O-OG1 2.67Å; R1227-T1230 PolarHBondContact O-N 3.31Å; Q1228-T1230 VanDerWaalsContact C-N 3.32Å; Q1228-T1230 PolarHBondContact O-N 2.58Å; T1230-A1233 PolarHBondContact O-N 2.75Å; T1230-V1234 WeakPolarHBondContact O-CB 3.4Å; T1230-V1234 VanDerWaalsContact O-CG2 3.3Å; T1230-V1234 WeakPolarHBondContact O-CG2 3.23Å; T1230-V1234 PolarHBondContact O-N 3.49Å
1231	Q	86.7	Confident	84.5	Confident	114 Å²	114	63.4 Å²	63.4	53%	0.533	33%	0.331	S	S	.	.	H	α-helix	trans	-65.9	-38.2	177.6	-178	55.1	47.5	0	0	112.1	R1227 Q1228 T1235	R1227-Q1231 WeakPolarHBondContact O-CB 3.38Å; R1227-Q1231 PolarHBondContact O-N 2.79Å; Q1228-Q1231 PolarHBondContact O-N 2.95Å; Q1231-T1235 PolarHBondContact NE2-OG1 2.89Å; Q1231-T1235 VanDerWaalsContact NE2-OG1 3.17Å; Q1231-T1235 VanDerWaalsContact O-CB 3.31Å; Q1231-T1235 WeakPolarHBondContact O-CB 3.44Å; Q1231-T1235 PolarHBondContact O-N 2.67Å; Q1231-T1235 PolarHBondContact O-OG1 3.01Å
1232	Q	81.9	Confident	84	Confident	48 Å²	48	64.1 Å²	64.1	22%	0.224	33%	0.331	C	S	.	.	H	α-helix	trans	-64.7	-49.8	173.3	-71.4	175.3	14.7	0	0	111.3	F1194 Q1228 L1229 V1234 T1235 I1236	F1194-Q1232 HydrophobicContact CD1-CB 4.09Å; F1194-Q1232 HydrophobicContact CE1-CB 3.99Å; Q1228-Q1232 WeakPolarHBondContact O-CG 3.31Å; Q1228-Q1232 PolarHBondContact O-N 3.35Å; L1229-Q1232 PolarHBondContact O-N 2.7Å; Q1232-V1234 PolarHBondContact O-N 3.25Å; Q1232-T1235 WeakPolarHBondContact O-CB 3.36Å; Q1232-T1235 PolarHBondContact O-N 2.73Å; Q1232-T1235 VanDerWaalsContact O-N 3.09Å; Q1232-I1236 PolarHBondContact O-N 3.49Å
1233	A	80.9	Confident	83.4	Confident	23 Å²	23	69.8 Å²	69.8	19%	0.19	36%	0.361	C	S	.	.	H	α-helix	trans	-55.6	-47.1	177.2	0	0	0	0	0	112.3	F1194 L1198 L1229 T1230 T1235 I1236 A1237	F1194-A1233 HydrophobicContact CB-CB 3.79Å; F1194-A1233 HydrophobicContact CG-CB 4.5Å; L1198-A1233 HydrophobicContact CD1-CB 3.93Å; L1229-A1233 VanDerWaalsContact O-CB 3.3Å; L1229-A1233 WeakPolarHBondContact O-CB 3.47Å; L1229-A1233 PolarHBondContact O-N 2.86Å; T1230-A1233 PolarHBondContact O-N 2.75Å; A1233-T1235 PolarHBondContact O-N 3.03Å; A1233-I1236 PolarHBondContact O-N 3.36Å; A1233-A1237 VanDerWaalsContact O-CB 3.25Å; A1233-A1237 WeakPolarHBondContact O-CB 3.42Å; A1233-A1237 PolarHBondContact O-N 3.07Å
1234	V	85.7	Confident	82.4	Confident	67 Å²	67	71.1 Å²	71.1	41%	0.406	37%	0.372	S	S	.	.	H	α-helix	trans	-64.2	-38.8	176.5	169.6	0	0	0	0	111.8	T1230 Q1232 R1238	T1230-V1234 WeakPolarHBondContact O-CB 3.4Å; T1230-V1234 VanDerWaalsContact O-CG2 3.3Å; T1230-V1234 WeakPolarHBondContact O-CG2 3.23Å; T1230-V1234 PolarHBondContact O-N 3.49Å; Q1232-V1234 PolarHBondContact O-N 3.25Å; V1234-R1238 VanDerWaalsContact O-CB 3.31Å; V1234-R1238 WeakPolarHBondContact O-CB 3.41Å; V1234-R1238 PolarHBondContact O-N 3.39Å
1235	T	83.8	Confident	81.4	Confident	39 Å²	39	71.3 Å²	71.3	24%	0.239	38%	0.378	C	S	.	.	H	α-helix	trans	-66.2	-40.8	178.2	-58.9	0	0	0	0	111.6	Q1231 Q1232 A1233 K1239 L1308	Q1231-T1235 PolarHBondContact NE2-OG1 2.89Å; Q1231-T1235 VanDerWaalsContact NE2-OG1 3.17Å; Q1231-T1235 VanDerWaalsContact O-CB 3.31Å; Q1231-T1235 WeakPolarHBondContact O-CB 3.44Å; Q1231-T1235 PolarHBondContact O-N 2.67Å; Q1231-T1235 PolarHBondContact O-OG1 3.01Å; Q1232-T1235 WeakPolarHBondContact O-CB 3.36Å; Q1232-T1235 PolarHBondContact O-N 2.73Å; Q1232-T1235 VanDerWaalsContact O-N 3.09Å; A1233-T1235 PolarHBondContact O-N 3.03Å; T1235-K1239 WeakPolarHBondContact O-CG 3.37Å; T1235-K1239 PolarHBondContact O-N 3.29Å; T1235-L1308 HydrophobicContact CG2-CD2 4.07Å
1236	I	76.1	Confident	80.3	Confident	49 Å²	49	74.2 Å²	74.2	25%	0.251	40%	0.396	S	S	.	.	H	α-helix	trans	-74.9	-44	179.6	-69.6	169.1	0	0	0	110.9	F1194 Q1232 A1233 R1238 K1239 V1240	F1194-I1236 HydrophobicContact CD2-CD1 3.91Å; F1194-I1236 HydrophobicContact CE1-CD1 4.04Å; F1194-I1236 HydrophobicContact CE2-CD1 3.23Å; F1194-I1236 HydrophobicContact CZ-CD1 3.31Å; Q1232-I1236 PolarHBondContact O-N 3.49Å; A1233-I1236 PolarHBondContact O-N 3.36Å; I1236-R1238 VanDerWaalsContact C-N 3.26Å; I1236-R1238 PolarHBondContact O-N 2.97Å; I1236-K1239 PolarHBondContact O-N 3.09Å; I1236-K1239 VanDerWaalsContact O-N 3.09Å; I1236-V1240 HydrophobicContact CG2-CG2 4.48Å; I1236-V1240 WeakPolarHBondContact O-CG2 3.45Å; I1236-V1240 PolarHBondContact O-N 2.97Å
1237	A	78.3	Confident	78.7	Confident	62 Å²	62	75.9 Å²	75.9	51%	0.512	41%	0.412	S	S	.	.	H	α-helix	trans	-57.3	-39.8	173.9	0	0	0	0	0	112.1	A1233 V1240 A1241	A1233-A1237 VanDerWaalsContact O-CB 3.25Å; A1233-A1237 WeakPolarHBondContact O-CB 3.42Å; A1233-A1237 PolarHBondContact O-N 3.07Å; A1237-V1240 PolarHBondContact O-N 3.33Å; A1237-A1241 PolarHBondContact O-N 2.72Å
1238	R	83.2	Confident	76.9	Confident	148 Å²	148	72.9 Å²	72.9	56%	0.558	41%	0.412	S	S	*	.	H	α-helix	trans	-62.1	-46.3	173.6	-169.8	-175.7	-60.3	167.2	3.5	111.9	V1234 I1236 V1240 A1241 E1242	V1234-R1238 VanDerWaalsContact O-CB 3.31Å; V1234-R1238 WeakPolarHBondContact O-CB 3.41Å; V1234-R1238 PolarHBondContact O-N 3.39Å; I1236-R1238 VanDerWaalsContact C-N 3.26Å; I1236-R1238 PolarHBondContact O-N 2.97Å; R1238-V1240 PolarHBondContact O-N 3.18Å; R1238-A1241 WeakPolarHBondContact O-CB 3.31Å; R1238-A1241 PolarHBondContact O-N 3.39Å; R1238-A1241 VanDerWaalsContact O-N 3.15Å; R1238-E1242 WeakPolarHBondContact CG-OE1 3.43Å; R1238-E1242 WeakPolarHBondContact O-CG 3.21Å; R1238-E1242 PolarHBondContact O-N 3.02Å
1239	K	78.4	Confident	75.2	Confident	83 Å²	83	71.5 Å²	71.5	36%	0.361	42%	0.418	S	S	.	.	H	α-helix	trans	-65.4	-35.3	177.8	-71.9	-175.8	179.4	-166.2	0	113.1	T1235 I1236 A1241 E1242 L1243 L1308	T1235-K1239 WeakPolarHBondContact O-CG 3.37Å; T1235-K1239 PolarHBondContact O-N 3.29Å; I1236-K1239 PolarHBondContact O-N 3.09Å; I1236-K1239 VanDerWaalsContact O-N 3.09Å; K1239-A1241 VanDerWaalsContact C-N 3.34Å; K1239-E1242 PolarHBondContact O-N 2.8Å; K1239-L1243 WeakPolarHBondContact O-CB 3.05Å; K1239-L1243 VanDerWaalsContact O-CG 3.27Å; K1239-L1243 WeakPolarHBondContact O-CG 3.38Å; K1239-L1243 PolarHBondContact O-N 2.99Å; K1239-L1308 HydrophobicContact CD-CD1 4.21Å; K1239-L1308 HydrophobicContact CD-CD2 4.18Å
1240	V	76.4	Confident	73.5	Confident	82 Å²	82	76.8 Å²	76.8	50%	0.497	45%	0.451	S	S	.	.	H	α-helix	trans	-66.4	-36.8	172.6	174.1	0	0	0	0	111.3	I1236 A1237 R1238 T1244	I1236-V1240 HydrophobicContact CG2-CG2 4.48Å; I1236-V1240 WeakPolarHBondContact O-CG2 3.45Å; I1236-V1240 PolarHBondContact O-N 2.97Å; A1237-V1240 PolarHBondContact O-N 3.33Å; R1238-V1240 PolarHBondContact O-N 3.18Å; V1240-T1244 WeakPolarHBondContact O-CB 3.43Å; V1240-T1244 WeakPolarHBondContact O-CG2 3.12Å; V1240-T1244 PolarHBondContact O-N 2.89Å; V1240-T1244 PolarHBondContact O-OG1 2.77Å
1241	A	78	Confident	71.4	Confident	49 Å²	49	82.5 Å²	82.5	41%	0.405	47%	0.47	S	S	.	.	H	α-helix	trans	-66.9	-40.9	172.1	0	0	0	0	0	112.6	A1237 R1238 K1239 T1244 T1245	A1237-A1241 PolarHBondContact O-N 2.72Å; R1238-A1241 WeakPolarHBondContact O-CB 3.31Å; R1238-A1241 PolarHBondContact O-N 3.39Å; R1238-A1241 VanDerWaalsContact O-N 3.15Å; K1239-A1241 VanDerWaalsContact C-N 3.34Å; A1241-T1244 WeakPolarHBondContact CA-OG1 3.48Å; A1241-T1244 PolarHBondContact O-N 3.4Å; A1241-T1244 PolarHBondContact O-OG1 3.21Å; A1241-T1245 WeakPolarHBondContact O-CB 3.3Å; A1241-T1245 WeakPolarHBondContact O-CG2 3.24Å; A1241-T1245 PolarHBondContact O-N 2.99Å; A1241-T1245 PolarHBondContact O-OG1 3.32Å
1242	E	77.5	Confident	69.1	Low	98 Å²	98	81.4 Å²	81.4	46%	0.458	47%	0.474	S	S	.	.	H	α-helix	trans	-63.5	-40.1	174.6	-70.8	162.6	-178.1	0	0	111.7	R1238 K1239 T1245 T1246	R1238-E1242 WeakPolarHBondContact CG-OE1 3.43Å; R1238-E1242 WeakPolarHBondContact O-CG 3.21Å; R1238-E1242 PolarHBondContact O-N 3.02Å; K1239-E1242 PolarHBondContact O-N 2.8Å; E1242-T1245 WeakPolarHBondContact CA-OG1 3.16Å; E1242-T1245 PolarHBondContact O-OG1 3.46Å; E1242-T1245 VanDerWaalsContact O-OG1 3.08Å; E1242-T1246 WeakPolarHBondContact O-CB 3.38Å; E1242-T1246 WeakPolarHBondContact O-CG2 3.48Å; E1242-T1246 PolarHBondContact O-N 3.46Å; E1242-T1246 VanDerWaalsContact O-N 3.08Å; E1242-T1246 PolarHBondContact O-OG1 3.48Å
1243	L	74.7	Confident	67.1	Low	119 Å²	119	87.1 Å²	87.1	62%	0.623	51%	0.505	S	S	*	.	H	α-helix	trans	-71.4	-38.5	176.3	-72.2	168.7	0	0	0	113	K1239 T1246 A1247	K1239-L1243 WeakPolarHBondContact O-CB 3.05Å; K1239-L1243 VanDerWaalsContact O-CG 3.27Å; K1239-L1243 WeakPolarHBondContact O-CG 3.38Å; K1239-L1243 PolarHBondContact O-N 2.99Å; L1243-T1246 WeakPolarHBondContact CA-OG1 3.47Å; L1243-T1246 PolarHBondContact O-OG1 2.95Å; L1243-T1246 VanDerWaalsContact O-OG1 3.11Å; L1243-A1247 WeakPolarHBondContact O-CB 3.25Å; L1243-A1247 PolarHBondContact O-N 2.81Å
1244	T	71.1	Confident	64.8	Low	83 Å²	83	90 Å²	90	51%	0.509	54%	0.536	S	S	.	.	H	α-helix	trans	-74.1	-35.6	177.7	46.2	0	0	0	0	112.5	V1240 A1241 S1248	V1240-T1244 WeakPolarHBondContact O-CB 3.43Å; V1240-T1244 WeakPolarHBondContact O-CG2 3.12Å; V1240-T1244 PolarHBondContact O-N 2.89Å; V1240-T1244 PolarHBondContact O-OG1 2.77Å; A1241-T1244 WeakPolarHBondContact CA-OG1 3.48Å; A1241-T1244 PolarHBondContact O-N 3.4Å; A1241-T1244 PolarHBondContact O-OG1 3.21Å; T1244-S1248 WeakPolarHBondContact O-CB 3.45Å; T1244-S1248 PolarHBondContact O-N 3.5Å; T1244-S1248 PolarHBondContact O-OG 3.35Å
1245	T	70.2	Confident	62.3	Low	83 Å²	83	93 Å²	93	51%	0.509	56%	0.56	S	S	.	*	H	α-helix	trans	-65.8	-44.6	172.3	48.3	0	0	0	0	111.8	A1241 E1242 S1248 A1249	A1241-T1245 WeakPolarHBondContact O-CB 3.3Å; A1241-T1245 WeakPolarHBondContact O-CG2 3.24Å; A1241-T1245 PolarHBondContact O-N 2.99Å; A1241-T1245 PolarHBondContact O-OG1 3.32Å; E1242-T1245 WeakPolarHBondContact CA-OG1 3.16Å; E1242-T1245 PolarHBondContact O-OG1 3.46Å; E1242-T1245 VanDerWaalsContact O-OG1 3.08Å; T1245-S1248 PolarHBondContact O-N 2.84Å; T1245-S1248 PolarHBondContact O-OG 3.35Å; T1245-A1249 WeakPolarHBondContact O-CB 3.49Å; T1245-A1249 PolarHBondContact O-N 2.94Å
1246	T	63.2	Low	59.9	Low	82 Å²	82	94.6 Å²	94.6	50%	0.503	58%	0.584	S	S	.	*	H	α-helix	trans	-66.6	-37	174.5	49.1	0	0	0	0	113.6	E1242 L1243 A1249 T1250	E1242-T1246 WeakPolarHBondContact O-CB 3.38Å; E1242-T1246 WeakPolarHBondContact O-CG2 3.48Å; E1242-T1246 PolarHBondContact O-N 3.46Å; E1242-T1246 VanDerWaalsContact O-N 3.08Å; E1242-T1246 PolarHBondContact O-OG1 3.48Å; L1243-T1246 WeakPolarHBondContact CA-OG1 3.47Å; L1243-T1246 PolarHBondContact O-OG1 2.95Å; L1243-T1246 VanDerWaalsContact O-OG1 3.11Å; T1246-A1249 PolarHBondContact O-N 2.82Å; T1246-T1250 PolarHBondContact O-N 3.48Å; T1246-T1250 VanDerWaalsContact O-N 3.16Å; T1246-T1250 PolarHBondContact O-OG1 2.82Å
1247	A	55.2	Low	58	Low	53 Å²	53	99.5 Å²	99.5	44%	0.438	61%	0.611	S	S	.	*	H	α-helix	trans	-68.4	-30.2	174.3	0	0	0	0	0	113.6	L1243 T1250	L1243-A1247 WeakPolarHBondContact O-CB 3.25Å; L1243-A1247 PolarHBondContact O-N 2.81Å; A1247-T1250 WeakPolarHBondContact CA-OG1 3.27Å; A1247-T1250 PolarHBondContact O-OG1 3.13Å
1248	S	52.7	Low	56	Low	79 Å²	79	101.7 Å²	101.7	55%	0.552	62%	0.623	S	S	*	*	H	α-helix	trans	-76.4	-38.4	173.2	64.8	0	0	0	0	112.3	T1244 T1245 T1250 K1251	T1244-S1248 WeakPolarHBondContact O-CB 3.45Å; T1244-S1248 PolarHBondContact O-N 3.5Å; T1244-S1248 PolarHBondContact O-OG 3.35Å; T1245-S1248 PolarHBondContact O-N 2.84Å; T1245-S1248 PolarHBondContact O-OG 3.35Å; S1248-T1250 PolarHBondContact O-N 2.99Å; S1248-K1251 PolarHBondContact O-N 3.2Å
1249	A	51.9	Low	53.7	Low	69 Å²	69	99.5 Å²	99.5	57%	0.57	63%	0.63	S	S	*	*	H	α-helix	trans	-66.1	-22.2	174.9	0	0	0	0	0	114	T1245 T1246	T1245-A1249 WeakPolarHBondContact O-CB 3.49Å; T1245-A1249 PolarHBondContact O-N 2.94Å; T1246-A1249 PolarHBondContact O-N 2.82Å
1250	T	50.2	Low	51.6	Low	116 Å²	116	101 Å²	101	71%	0.712	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-3.6	178.5	41.9	0	0	0	0	114.5	T1246 A1247 S1248	T1246-T1250 PolarHBondContact O-N 3.48Å; T1246-T1250 VanDerWaalsContact O-N 3.16Å; T1246-T1250 PolarHBondContact O-OG1 2.82Å; A1247-T1250 WeakPolarHBondContact CA-OG1 3.27Å; A1247-T1250 PolarHBondContact O-OG1 3.13Å; S1248-T1250 PolarHBondContact O-N 2.99Å
1251	K	42.9	Very low	49.6	Very low	187 Å²	187	103 Å²	103	81%	0.813	67%	0.669	S	S	*	*	S	Bend	trans	-101.7	6.6	177.5	-89.9	-177.5	172.2	178.9	0	115	S1248	S1248-K1251 PolarHBondContact O-N 3.2Å
1252	S	39.2	Very low	47.3	Very low	90 Å²	90	106.4 Å²	106.4	63%	0.629	69%	0.69	S	S	*	*			trans	-101.7	39.6	-177	64.5	0	0	0	0	114.9
1253	I	38.7	Very low	45.3	Very low	169 Å²	169	106.8 Å²	106.8	87%	0.867	70%	0.703	S	S	*	*	S	Bend	trans	-141.3	125.4	160	-76.6	104.5	0	0	0	107.8
1254	G	34.1	Very low	43.3	Very low	82 Å²	82	109.5 Å²	109.5	85%	0.845	71%	0.712	S	S	*	*			trans	120.3	93.6	175.6	0	0	0	0	0	114
1255	S	32.4	Very low	41.4	Very low	131 Å²	131	113.8 Å²	113.8	92%	0.916	73%	0.731	S	S	*	*			trans	-111.2	142.6	173	50.7	0	0	0	0	110.1
1256	G	33.9	Very low	39.6	Very low	72 Å²	72	116.7 Å²	116.7	74%	0.742	74%	0.744	S	S	*	*			trans	175.9	73.1	-175.2	0	0	0	0	0	116.2
1257	D	35.8	Very low	37.9	Very low	152 Å²	152	117.4 Å²	117.4	81%	0.813	75%	0.752	S	S	*	*			trans	35.1	107.1	142.6	-56.5	-17.8	0	0	0	123.1
1258	S	35.4	Very low	36.6	Very low	109 Å²	109	123.7 Å²	123.7	76%	0.762	77%	0.772	S	S	*	*				88.8	148.2	115.7	81.2	0	0	0	0	124.1
1259	S	36.1	Very low	35.3	Very low	102 Å²	102	127 Å²	127	71%	0.713	78%	0.783	S	S	*	*			trans	86	95	150.6	72.2	0	0	0	0	122.2
1260	S	33.9	Very low	34.3	Very low	114 Å²	114	131.1 Å²	131.1	80%	0.797	79%	0.793	S	S	*	*				44.1	120.8	127.5	61.7	0	0	0	0	122.8
1261	S	34.7	Very low	33.3	Very low	125 Å²	125	131.6 Å²	131.6	87%	0.874	80%	0.796	S	S	*	*				-163.7	160.1	112.6	50.4	0	0	0	0	111.1
1262	S	29.2	Very low	32.6	Very low	120 Å²	120	129 Å²	129	84%	0.839	79%	0.791	S	S	*	*			trans	-147.8	131.7	-169.4	58.5	0	0	0	0	113.3
1263	S	35.3	Very low	32	Very low	105 Å²	105	133.1 Å²	133.1	73%	0.734	80%	0.8	S	S	*	*			trans	-164.1	122.8	160.8	56.9	0	0	0	0	113.6
1264	H	33.5	Very low	31.5	Very low	176 Å²	176	132.5 Å²	132.5	82%	0.815	80%	0.797	S	S	*	*			trans	29.6	123.5	148.5	-49.7	-65.7	0	0	0	121.6
1265	L	30.9	Very low	31.1	Very low	174 Å²	174	133 Å²	133	91%	0.911	79%	0.788	S	S	*	*				-160.7	153.7	106.9	-103.7	163.8	0	0	0	110.5
1266	N	31.6	Very low	30.8	Very low	144 Å²	144	132.9 Å²	132.9	77%	0.77	78%	0.776	S	S	*	*			trans	-105.7	146.3	-169.3	-82.4	-14.1	0	0	0	113.2
1267	S	28.5	Very low	30.5	Very low	96 Å²	96	134 Å²	134	67%	0.671	77%	0.772	S	S	*	*			trans	29.3	102.6	148.7	61.3	0	0	0	0	119
1268	H	27.5	Very low	30.3	Very low	185 Å²	185	134.2 Å²	134.2	86%	0.856	77%	0.768	S	S	*	*				172.2	84.4	122.7	-93.5	-68.2	0	0	0	110.2
1269	L	26.3	Very low	30.2	Very low	150 Å²	150	133 Å²	133	79%	0.785	76%	0.76	S	S	*	*			trans	-162.9	118.6	169.1	-109.1	157.5	0	0	0	108.5
1270	I	30	Very low	29.9	Very low	155 Å²	155	134.8 Å²	134.8	80%	0.795	76%	0.76	S	S	*	*			trans	-104.3	118.9	174.3	-71.9	176.6	0	0	0	107.1
1271	T	29.5	Very low	30	Very low	125 Å²	125	134.2 Å²	134.2	77%	0.767	75%	0.752	S	S	*	*			trans	35.3	85.1	165.4	57.3	0	0	0	0	115.3
1272	N	28.3	Very low	29.9	Very low	134 Å²	134	129.9 Å²	129.9	72%	0.717	72%	0.724	S	S	*	*			cis	63.9	109.3	42.6	-129.5	13.1	0	0	0	113.1
1273	H	27.2	Very low	30	Very low	175 Å²	175	132.1 Å²	132.1	81%	0.81	72%	0.718	S	S	*	*			trans	-57	150.7	179.5	-74.7	-104.1	0	0	0	113.5
1274	I	27.5	Very low	29.7	Very low	156 Å²	156	129.7 Å²	129.7	80%	0.8	71%	0.705	S	S	*	*			trans	-116.5	83.7	152.2	-59.9	-179.2	0	0	0	108	I1276	I1274-I1276 HydrophobicContact CG2-CD1 4.06Å; I1274-I1276 HydrophobicContact CG2-CG1 4.14Å; I1274-I1276 PolarHBondContact O-N 3.38Å; I1274-I1276 VanDerWaalsContact O-N 3.12Å
1275	S	25.1	Very low	29.8	Very low	94 Å²	94	125.4 Å²	125.4	66%	0.657	69%	0.69	S	S	*	*			trans	-78.8	89.6	-179.5	57	0	0	0	0	111.4
1276	I	26.8	Very low	30	Very low	128 Å²	128	122.3 Å²	122.3	66%	0.656	67%	0.674	S	S	*	*			trans	-132.2	112.3	174.1	-56.8	-178.6	0	0	0	110.8	I1274	I1274-I1276 HydrophobicContact CG2-CD1 4.06Å; I1274-I1276 HydrophobicContact CG2-CG1 4.14Å; I1274-I1276 PolarHBondContact O-N 3.38Å; I1274-I1276 VanDerWaalsContact O-N 3.12Å
1277	S	28	Very low	30	Very low	95 Å²	95	119 Å²	119	66%	0.664	66%	0.662	S	S	*	*	S	Bend	trans	78	14.5	161.2	73.5	0	0	0	0	121.7	S1279	S1277-S1279 PolarHBondContact O-N 2.67Å; S1277-S1279 VanDerWaalsContact O-N 3.09Å
1278	E	30.6	Very low	30.1	Very low	157 Å²	157	120.6 Å²	120.6	73%	0.734	66%	0.663	S	S	*	*	H	α-helix	trans	-62.6	-18.2	179.1	-64.4	175.6	128.3	0	0	115.6	L1280	E1278-L1280 PolarHBondContact O-N 2.78Å
1279	S	33.5	Very low	30.5	Very low	84 Å²	84	115.2 Å²	115.2	59%	0.587	65%	0.651	S	S	*	*	H	α-helix	trans	-83.7	-7.8	-168.8	69.8	0	0	0	0	116.7	S1277	S1277-S1279 PolarHBondContact O-N 2.67Å; S1277-S1279 VanDerWaalsContact O-N 3.09Å
1280	L	30.9	Very low	30.7	Very low	138 Å²	138	116.4 Å²	116.4	72%	0.723	65%	0.65	S	S	*	*	H	α-helix	trans	-102.5	-45.2	176.9	-93.1	78.3	0	0	0	113.3	E1278 K1283 A1284	E1278-L1280 PolarHBondContact O-N 2.78Å; L1280-K1283 PolarHBondContact O-N 2.68Å; L1280-A1284 PolarHBondContact O-N 3.09Å
1281	V	34.4	Very low	30.5	Very low	102 Å²	102	112.3 Å²	112.3	62%	0.618	65%	0.646	S	S	*	*	H	α-helix	trans	-65.5	-46.4	-176.9	-176.4	0	0	0	0	110.7	K1283 A1284 V1285	V1281-K1283 PolarHBondContact O-N 2.7Å; V1281-K1283 VanDerWaalsContact O-N 3.15Å; V1281-A1284 PolarHBondContact O-N 2.79Å; V1281-V1285 HydrophobicContact CG1-CG2 4.25Å; V1281-V1285 WeakPolarHBondContact O-CG2 3.39Å; V1281-V1285 PolarHBondContact O-N 3.05Å
1282	A	34.2	Very low	30.6	Very low	35 Å²	35	110.5 Å²	110.5	29%	0.289	65%	0.653	S	S	.	*	H	α-helix	trans	-60.5	-26.1	177.8	0	0	0	0	0	113.7	L1286	A1282-L1286 WeakPolarHBondContact O-CD1 3.44Å; A1282-L1286 WeakPolarHBondContact O-CG 3.23Å; A1282-L1286 PolarHBondContact O-N 2.93Å
1283	K	29.8	Very low	30.5	Very low	167 Å²	167	107.5 Å²	107.5	73%	0.726	65%	0.653	S	S	*	*	H	α-helix	trans	-82.5	-22.2	176	-80.4	-173.1	172.9	-179.7	0	114.1	L1280 V1281	L1280-K1283 PolarHBondContact O-N 2.68Å; V1281-K1283 PolarHBondContact O-N 2.7Å; V1281-K1283 VanDerWaalsContact O-N 3.15Å
1284	A	30.4	Very low	30.5	Very low	54 Å²	54	105.2 Å²	105.2	45%	0.446	65%	0.651	S	S	.	*	H	α-helix	trans	-89.9	-26.8	176.3	0	0	0	0	0	113.2	L1280 V1281 S1287	L1280-A1284 PolarHBondContact O-N 3.09Å; V1281-A1284 PolarHBondContact O-N 2.79Å; A1284-S1287 PolarHBondContact O-OG 2.92Å; A1284-S1287 VanDerWaalsContact O-OG 3.04Å
1285	V	34.6	Very low	30.5	Very low	85 Å²	85	103.5 Å²	103.5	52%	0.515	65%	0.653	S	S	.	*	H	α-helix	trans	-75.6	-46.1	175.9	175.5	0	0	0	0	110.8	V1281 S1287 N1288	V1281-V1285 HydrophobicContact CG1-CG2 4.25Å; V1281-V1285 WeakPolarHBondContact O-CG2 3.39Å; V1281-V1285 PolarHBondContact O-N 3.05Å; V1285-S1287 VanDerWaalsContact C-N 3.28Å; V1285-S1287 PolarHBondContact O-N 3.08Å; V1285-N1288 PolarHBondContact O-N 2.9Å
1286	L	34.8	Very low	30.7	Very low	110 Å²	110	102.4 Å²	102.4	58%	0.576	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.1	-20.2	-179	-69.9	172.6	0	0	0	114.2	A1282	A1282-L1286 WeakPolarHBondContact O-CD1 3.44Å; A1282-L1286 WeakPolarHBondContact O-CG 3.23Å; A1282-L1286 PolarHBondContact O-N 2.93Å
1287	S	31.5	Very low	30.6	Very low	74 Å²	74	105 Å²	105	52%	0.517	67%	0.672	S	S	.	*	T	Hydrogen-bonded Turn	trans	-76.7	-23.9	175.1	58.6	0	0	0	0	113.8	A1284 V1285	A1284-S1287 PolarHBondContact O-OG 2.92Å; A1284-S1287 VanDerWaalsContact O-OG 3.04Å; V1285-S1287 VanDerWaalsContact C-N 3.28Å; V1285-S1287 PolarHBondContact O-N 3.08Å
1288	N	31.9	Very low	30.7	Very low	129 Å²	129	105.2 Å²	105.2	69%	0.69	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-4.8	-169	-67.1	9.4	0	0	0	113.4	V1285	V1285-N1288 PolarHBondContact O-N 2.9Å
1289	A	34.6	Very low	30.4	Very low	73 Å²	73	102.8 Å²	102.8	60%	0.603	68%	0.68	S	S	*	*	S	Bend	trans	-84.8	-9.6	176.6	0	0	0	0	0	114.2
1290	F	30.4	Very low	30.1	Very low	175 Å²	175	104.6 Å²	104.6	77%	0.768	69%	0.688	S	S	*	*	S	Bend	trans	-132.5	30.2	-168.8	-78.4	-77.5	0	0	0	114.6
1291	G	27.3	Very low	30	Very low	68 Å²	68	104.7 Å²	104.7	70%	0.701	69%	0.694	S	S	*	*			trans	-163.1	133.7	176.5	0	0	0	0	0	115.8
1292	G	29.7	Very low	29.6	Very low	88 Å²	88	103.6 Å²	103.6	91%	0.907	70%	0.703	S	S	*	*			trans	132.8	110.8	172.2	0	0	0	0	0	112.5
1293	G	27.9	Very low	29.2	Very low	71 Å²	71	105.9 Å²	105.9	73%	0.732	73%	0.73	S	S	*	*			trans	-119.6	156.5	-177.8	0	0	0	0	0	114.4
1294	V	27.2	Very low	29.1	Very low	126 Å²	126	103.6 Å²	103.6	76%	0.764	74%	0.735	S	S	*	*			trans	66.5	96.3	146	-170.4	0	0	0	0	118.8
1295	S	27.4	Very low	29	Very low	121 Å²	121	107 Å²	107	85%	0.846	76%	0.756	S	S	*	*			trans	71.2	158.9	141.1	82.5	0	0	0	0	120.9
1296	G	28.4	Very low	28.7	Very low	71 Å²	71	105.7 Å²	105.7	73%	0.732	76%	0.76	S	S	*	*			trans	133.7	99.1	158.8	0	0	0	0	0	115	A1298	G1296-A1298 PolarHBondContact O-N 2.79Å
1297	N	25.8	Very low	28.5	Very low	181 Å²	181	105.3 Å²	105.3	97%	0.968	77%	0.767	S	S	*	*			trans	-68.9	115.9	171.1	-81.3	-27.2	0	0	0	111.2
1298	A	29.6	Very low	29	Very low	101 Å²	101	105.7 Å²	105.7	84%	0.835	76%	0.762	S	S	*	*			trans	-144.3	133.9	160.6	0	0	0	0	0	110	G1296	G1296-A1298 PolarHBondContact O-N 2.79Å
1299	S	24.7	Very low	30	Very low	106 Å²	106	104.5 Å²	104.5	74%	0.741	76%	0.76	S	S	*	*			trans	-98.4	176	177.2	57.3	0	0	0	0	111.3
1300	T	27.6	Very low	31.2	Very low	121 Å²	121	103.6 Å²	103.6	74%	0.742	75%	0.745	S	S	*	*			trans	83.3	105	170.1	69.3	0	0	0	0	118.8
1301	T	27.6	Very low	33	Very low	140 Å²	140	100.4 Å²	100.4	86%	0.859	74%	0.741	S	S	*	*			trans	52.8	114.7	132.5	59.7	0	0	0	0	120.8
1302	G	25.9	Very low	35.2	Very low	79 Å²	79	100.4 Å²	100.4	81%	0.814	72%	0.724	S	S	*	*			trans	166.9	73.6	158.9	0	0	0	0	0	117.9
1303	G	25.8	Very low	37.5	Very low	83 Å²	83	96.9 Å²	96.9	86%	0.856	69%	0.685	S	S	*	*			trans	43.7	98.5	155.3	0	0	0	0	0	120.1
1304	S	27.1	Very low	40.1	Very low	119 Å²	119	97.4 Å²	97.4	83%	0.832	67%	0.674	S	S	*	*			trans	-95.1	121.7	164.1	51.1	0	0	0	0	112.2	G1306	S1304-G1306 PolarHBondContact O-N 2.89Å; S1304-G1306 VanDerWaalsContact O-N 3.16Å
1305	S	29.7	Very low	42.7	Very low	125 Å²	125	93.9 Å²	93.9	87%	0.874	65%	0.653	S	S	*	*			trans	-72	100	165.4	54.8	0	0	0	0	109.4	S1307	S1305-S1307 PolarHBondContact O-N 2.86Å
1306	G	27.4	Very low	45.1	Very low	58 Å²	58	91.1 Å²	91.1	60%	0.598	63%	0.633	S	S	*	*			trans	-63.9	130.3	-167.9	0	0	0	0	0	115	S1304	S1304-G1306 PolarHBondContact O-N 2.89Å; S1304-G1306 VanDerWaalsContact O-N 3.16Å
1307	S	30.8	Very low	47.6	Very low	103 Å²	103	89.9 Å²	89.9	72%	0.72	61%	0.614	S	S	*	*			trans	-63	148	158	-169.5	0	0	0	0	109.6	S1305 T1309	S1305-S1307 PolarHBondContact O-N 2.86Å; S1307-T1309 PolarHBondContact OG-OG1 3.13Å
1308	L	42	Very low	50.3	Low	82 Å²	82	81.4 Å²	81.4	43%	0.429	57%	0.568	S	S	.	*	S	Bend	trans	-104.5	12.2	-169.2	-69.2	135.6	0	0	0	113.6	T1235 K1239	T1235-L1308 HydrophobicContact CG2-CD2 4.07Å; K1239-L1308 HydrophobicContact CD-CD1 4.21Å; K1239-L1308 HydrophobicContact CD-CD2 4.18Å
1309	T	52.3	Low	52.8	Low	104 Å²	104	77.8 Å²	77.8	64%	0.638	54%	0.535	S	S	*	.	S	Bend	trans	-109.2	138.1	177.2	53.7	0	0	0	0	109.3	S1307	S1307-T1309 PolarHBondContact OG-OG1 3.13Å
1310	L	61.3	Low	55.3	Low	54 Å²	54	76 Å²	76	28%	0.283	52%	0.515	S	S	.	.	P	Polyproline II helix	trans	-56	144.9	161.6	-76.6	-178.4	0	0	0	109.3	T1189 Y1190 M1312	T1189-L1310 HydrophobicContact CG2-CD1 3.56Å; T1189-L1310 HydrophobicContact CG2-CG 4.24Å; Y1190-L1310 HydrophobicContact CD1-CB 4.21Å; Y1190-L1310 HydrophobicContact CE1-CB 3.81Å; Y1190-L1310 HydrophobicContact CE1-CD1 4.47Å; L1310-M1312 PolarHBondContact O-N 2.78Å
1311	P	66.8	Low	57.9	Low	107 Å²	107	71.7 Å²	71.7	70%	0.695	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-62.7	132.3	169.1	27.9	-33.1	0	0	0	109.1	Y1190	Y1190-P1311 WeakPolarHBondContact CE1-O 3.34Å; Y1190-P1311 PolarHBondContact OH-O 3.47Å
1312	M	74	Confident	60.4	Low	68 Å²	68	65 Å²	65	34%	0.335	45%	0.448	S	S	.	.	P	Polyproline II helix	trans	-49.7	148	169.4	-73.2	-65.1	-72.2	0	0	110.2	Q1147 L1152 Y1190 L1310	Q1147-M1312 WeakPolarHBondContact O-CE 3.24Å; L1152-M1312 HydrophobicContact CD2-CE 4.31Å; Y1190-M1312 HydrophobicContact CD1-SD 4.03Å; Y1190-M1312 HydrophobicContact CG-SD 4.05Å; L1310-M1312 PolarHBondContact O-N 2.78Å
1313	P	79	Confident	62.7	Low	15 Å²	15	61.9 Å²	61.9	10%	0.097	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-63.1	146.6	-176.4	31	-35.6	0	0	0	109.4	Q1147 L1148 Y1190 V1318	Q1147-P1313 HydrophobicContact CG-CG 4.26Å; L1148-P1313 WeakPolarHBondContact CD1-O 3.45Å; Y1190-P1313 HydrophobicContact CE2-CG 4.19Å; P1313-V1318 HydrophobicContact CB-CG2 3.83Å; P1313-V1318 HydrophobicContact CG-CG2 4.15Å
1314	T	82.5	Confident	64.9	Low	82 Å²	82	65 Å²	65	50%	0.503	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-88.8	155.5	177	65.7	0	0	0	0	110.5	S1316 S1317 V1318	T1314-S1316 PolarHBondContact O-N 2.84Å; T1314-S1316 VanDerWaalsContact O-N 3.14Å; T1314-S1317 PolarHBondContact N-OG 3.11Å; T1314-S1317 PolarHBondContact O-N 2.94Å; T1314-S1317 PolarHBondContact O-OG 2.81Å; T1314-S1317 PolarHBondContact OG1-N 3.43Å; T1314-S1317 VanDerWaalsContact OG1-N 3.16Å; T1314-S1317 PolarHBondContact OG1-OG 3.45Å; T1314-V1318 PolarHBondContact O-N 2.93Å
1315	V	80.1	Confident	66.9	Low	51 Å²	51	60.5 Å²	60.5	31%	0.309	37%	0.365	S	S	.	.	H	α-helix	trans	-47.7	-44.1	172.8	-172.7	0	0	0	0	110.8	F1105 L1148 V1318 L1319	F1105-V1315 HydrophobicContact CE1-CG1 4.3Å; F1105-V1315 HydrophobicContact CZ-CG1 4.36Å; L1148-V1315 HydrophobicContact CD2-CG2 4.19Å; V1315-V1318 PolarHBondContact O-N 3.01Å; V1315-L1319 WeakPolarHBondContact O-CB 3.12Å; V1315-L1319 PolarHBondContact O-N 2.89Å
1316	S	78.5	Confident	68.8	Low	63 Å²	63	54.7 Å²	54.7	44%	0.441	32%	0.324	S	S	.	.	H	α-helix	trans	-62.2	-44.3	177.4	-178.6	0	0	0	0	113.3	T1314 L1319 E1320	T1314-S1316 PolarHBondContact O-N 2.84Å; T1314-S1316 VanDerWaalsContact O-N 3.14Å; S1316-L1319 PolarHBondContact O-N 3.21Å; S1316-E1320 WeakPolarHBondContact O-CB 3.34Å; S1316-E1320 PolarHBondContact O-N 3.13Å
1317	S	81.1	Confident	70.4	Confident	46 Å²	46	52.8 Å²	52.8	32%	0.322	31%	0.305	S	S	.	.	H	α-helix	trans	-67	-36.6	177.7	64.1	0	0	0	0	112.9	T1314 T1321	T1314-S1317 PolarHBondContact N-OG 3.11Å; T1314-S1317 PolarHBondContact O-N 2.94Å; T1314-S1317 PolarHBondContact O-OG 2.81Å; T1314-S1317 PolarHBondContact OG1-N 3.43Å; T1314-S1317 VanDerWaalsContact OG1-N 3.16Å; T1314-S1317 PolarHBondContact OG1-OG 3.45Å; S1317-T1321 WeakPolarHBondContact O-CB 3.43Å; S1317-T1321 PolarHBondContact O-N 2.83Å; S1317-T1321 VanDerWaalsContact O-N 3.13Å; S1317-T1321 PolarHBondContact O-OG1 3.29Å
1318	V	82.2	Confident	71.4	Confident	2 Å²	2	48.1 Å²	48.1	1%	0.012	27%	0.272	C	S	.	.	H	α-helix	trans	-72.1	-39.8	176.3	179.7	0	0	0	0	110.4	F1105 L1144 L1148 P1313 T1314 V1315 T1321 L1322	F1105-V1318 HydrophobicContact CE1-CB 4.38Å; F1105-V1318 HydrophobicContact CE1-CG1 4.09Å; F1105-V1318 HydrophobicContact CE2-CG1 4.44Å; F1105-V1318 HydrophobicContact CZ-CB 3.96Å; F1105-V1318 HydrophobicContact CZ-CG1 3.57Å; L1144-V1318 HydrophobicContact CB-CG1 3.98Å; L1144-V1318 HydrophobicContact CD2-CG1 4.47Å; L1148-V1318 HydrophobicContact CB-CG2 4.2Å; L1148-V1318 HydrophobicContact CD1-CG2 4.28Å; P1313-V1318 HydrophobicContact CB-CG2 3.83Å; P1313-V1318 HydrophobicContact CG-CG2 4.15Å; T1314-V1318 PolarHBondContact O-N 2.93Å; V1315-V1318 PolarHBondContact O-N 3.01Å; V1318-T1321 CarbonylContact O-C 3.58Å; V1318-T1321 WeakPolarHBondContact O-CA 3.47Å; V1318-T1321 WeakPolarHBondContact O-CB 3.25Å; V1318-T1321 PolarHBondContact O-N 2.98Å; V1318-T1321 VanDerWaalsContact O-N 3.14Å; V1318-L1322 HydrophobicContact CG1-CD1 4Å; V1318-L1322 HydrophobicContact CG1-CG 4.26Å; V1318-L1322 WeakPolarHBondContact O-CB 3.48Å; V1318-L1322 WeakPolarHBondContact O-CG 3.37Å; V1318-L1322 PolarHBondContact O-N 3.08Å
1319	L	81.5	Confident	71.6	Confident	26 Å²	26	45.6 Å²	45.6	14%	0.136	26%	0.259	C	S	.	.	H	α-helix	trans	-63.6	-43.4	175.2	-176.8	60.4	0	0	0	112.4	F1105 A1106 V1315 S1316 T1321 L1322 N1323	F1105-L1319 HydrophobicContact CD1-CD1 4.13Å; F1105-L1319 HydrophobicContact CE1-CB 4.11Å; F1105-L1319 HydrophobicContact CE1-CD1 4.43Å; A1106-L1319 HydrophobicContact CB-CD1 3.71Å; A1106-L1319 HydrophobicContact CB-CD2 3.9Å; A1106-L1319 HydrophobicContact CB-CG 4.48Å; V1315-L1319 WeakPolarHBondContact O-CB 3.12Å; V1315-L1319 PolarHBondContact O-N 2.89Å; S1316-L1319 PolarHBondContact O-N 3.21Å; L1319-T1321 PolarHBondContact O-N 3.48Å; L1319-L1322 PolarHBondContact O-N 2.78Å; L1319-N1323 WeakPolarHBondContact O-CB 3.31Å; L1319-N1323 PolarHBondContact O-N 2.84Å; L1319-N1323 PolarHBondContact O-ND2 2.92Å
1320	E	78.3	Confident	71.3	Confident	68 Å²	68	43.8 Å²	43.8	32%	0.318	25%	0.247	S	C	.	.	H	α-helix	trans	-61.6	-34.1	173.5	-167.6	175.2	143.7	0	0	111.2	S1316 R1324 K1371	S1316-E1320 WeakPolarHBondContact O-CB 3.34Å; S1316-E1320 PolarHBondContact O-N 3.13Å; E1320-R1324 WeakPolarHBondContact O-CD 3.39Å; E1320-R1324 VanDerWaalsContact O-CG 3.25Å; E1320-R1324 WeakPolarHBondContact O-CG 3.31Å; E1320-R1324 PolarHBondContact O-N 2.98Å; E1320-R1324 IonicContact OE1-CZ 3.81Å; E1320-R1324 IonicContact OE1-NE 3.64Å; E1320-R1324 IonicContact OE1-NH2 3.36Å; E1320-R1324 PolarHBondContact OE1-NH2 3.29Å; E1320-K1371 IonicContact OE2-NZ 3.78Å; E1320-K1371 PolarHBondContact OE2-NZ 2.64Å
1321	T	82.1	Confident	70.7	Confident	31 Å²	31	41.8 Å²	41.8	19%	0.19	24%	0.237	C	C	.	.	H	α-helix	trans	-73	-47	177.2	-55.5	0	0	0	0	112	L1144 F1179 L1183 S1317 V1318 L1319 N1323 R1324 V1325	L1144-T1321 HydrophobicContact CD1-CG2 3.87Å; L1144-T1321 HydrophobicContact CD2-CG2 3.74Å; L1144-T1321 HydrophobicContact CG-CG2 4.5Å; F1179-T1321 HydrophobicContact CE2-CG2 4.19Å; F1179-T1321 HydrophobicContact CZ-CG2 3.64Å; L1183-T1321 HydrophobicContact CD2-CG2 4.05Å; S1317-T1321 WeakPolarHBondContact O-CB 3.43Å; S1317-T1321 PolarHBondContact O-N 2.83Å; S1317-T1321 VanDerWaalsContact O-N 3.13Å; S1317-T1321 PolarHBondContact O-OG1 3.29Å; V1318-T1321 CarbonylContact O-C 3.58Å; V1318-T1321 WeakPolarHBondContact O-CA 3.47Å; V1318-T1321 WeakPolarHBondContact O-CB 3.25Å; V1318-T1321 PolarHBondContact O-N 2.98Å; V1318-T1321 VanDerWaalsContact O-N 3.14Å; L1319-T1321 PolarHBondContact O-N 3.48Å; T1321-N1323 VanDerWaalsContact C-N 3.34Å; T1321-N1323 PolarHBondContact O-N 3.4Å; T1321-R1324 WeakPolarHBondContact O-CB 3.36Å; T1321-R1324 PolarHBondContact O-N 3.1Å; T1321-V1325 WeakPolarHBondContact O-CG2 3.35Å; T1321-V1325 PolarHBondContact O-N 3.45Å
1322	L	80.2	Confident	69.5	Low	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-58.6	-43.3	174.6	-73.5	168.1	0	0	0	111.5	L1102 F1105 N1141 L1144 M1145 V1318 L1319 R1324 V1325 N1326	L1102-L1322 HydrophobicContact CD2-CB 4.09Å; L1102-L1322 HydrophobicContact CD2-CD1 4.17Å; L1102-L1322 HydrophobicContact CD2-CD2 3.92Å; L1102-L1322 HydrophobicContact CD2-CG 4.3Å; F1105-L1322 HydrophobicContact CD1-CD1 3.53Å; F1105-L1322 HydrophobicContact CE1-CD1 3.47Å; F1105-L1322 VanDerWaalsContact CE1-CD1 3.47Å; F1105-L1322 HydrophobicContact CG-CD1 4.13Å; F1105-L1322 HydrophobicContact CZ-CD1 4Å; N1141-L1322 HydrophobicContact CB-CD2 3.96Å; N1141-L1322 VanDerWaalsContact OD1-CD2 3.3Å; N1141-L1322 WeakPolarHBondContact OD1-CD2 3.22Å; L1144-L1322 HydrophobicContact CB-CD2 4.04Å; L1144-L1322 HydrophobicContact CB-CG 4.46Å; L1144-L1322 HydrophobicContact CD1-CD2 3.66Å; L1144-L1322 HydrophobicContact CD1-CG 4.05Å; M1145-L1322 HydrophobicContact CE-CD1 3.89Å; V1318-L1322 HydrophobicContact CG1-CD1 4Å; V1318-L1322 HydrophobicContact CG1-CG 4.26Å; V1318-L1322 WeakPolarHBondContact O-CB 3.48Å; V1318-L1322 WeakPolarHBondContact O-CG 3.37Å; V1318-L1322 PolarHBondContact O-N 3.08Å; L1319-L1322 PolarHBondContact O-N 2.78Å; L1322-R1324 VanDerWaalsContact C-N 3.31Å; L1322-R1324 PolarHBondContact O-N 3.16Å; L1322-V1325 PolarHBondContact O-N 3.08Å; L1322-V1325 VanDerWaalsContact O-N 3.16Å; L1322-N1326 WeakPolarHBondContact O-CB 3.34Å; L1322-N1326 PolarHBondContact O-N 3.46Å; L1322-N1326 PolarHBondContact O-ND2 3.03Å
1323	N	74.1	Confident	67.8	Low	13 Å²	13	41.1 Å²	41.1	7%	0.07	23%	0.225	C	C	.	.	H	α-helix	trans	-64.7	-33.4	178.5	-78.1	-31.8	0	0	0	112.7	Y1063 L1319 T1321 G1327 L1329	Y1063-N1323 PolarHBondContact OH-ND2 2.84Å; L1319-N1323 WeakPolarHBondContact O-CB 3.31Å; L1319-N1323 PolarHBondContact O-N 2.84Å; L1319-N1323 PolarHBondContact O-ND2 2.92Å; T1321-N1323 VanDerWaalsContact C-N 3.34Å; T1321-N1323 PolarHBondContact O-N 3.4Å; N1323-G1327 PolarHBondContact O-N 3.37Å; N1323-G1327 VanDerWaalsContact O-N 3.09Å; N1323-L1329 HydrophobicContact CB-CD1 3.75Å; N1323-L1329 HydrophobicContact CB-CG 4.11Å; N1323-L1329 WeakPolarHBondContact ND2-CD1 3.34Å
1324	R	71.8	Confident	65.8	Low	149 Å²	149	45 Å²	45	56%	0.562	24%	0.237	S	C	*	.	H	α-helix	trans	-70.3	-35.2	171.9	-68.7	167.5	-173.9	-152.8	8	112.9	E1320 T1321 L1322	E1320-R1324 WeakPolarHBondContact O-CD 3.39Å; E1320-R1324 VanDerWaalsContact O-CG 3.25Å; E1320-R1324 WeakPolarHBondContact O-CG 3.31Å; E1320-R1324 PolarHBondContact O-N 2.98Å; E1320-R1324 IonicContact OE1-CZ 3.81Å; E1320-R1324 IonicContact OE1-NE 3.64Å; E1320-R1324 IonicContact OE1-NH2 3.36Å; E1320-R1324 PolarHBondContact OE1-NH2 3.29Å; T1321-R1324 WeakPolarHBondContact O-CB 3.36Å; T1321-R1324 PolarHBondContact O-N 3.1Å; L1322-R1324 VanDerWaalsContact C-N 3.31Å; L1322-R1324 PolarHBondContact O-N 3.16Å
1325	V	70.2	Confident	63.4	Low	23 Å²	23	44.4 Å²	44.4	14%	0.139	25%	0.248	C	C	.	.	H	α-helix	trans	-71.4	-47.4	178.6	169.5	0	0	0	0	111.9	T1140 L1144 F1179 T1321 L1322	T1140-V1325 HydrophobicContact CG2-CG1 3.98Å; T1140-V1325 HydrophobicContact CG2-CG2 3.95Å; L1144-V1325 HydrophobicContact CD1-CG2 4.49Å; F1179-V1325 HydrophobicContact CE1-CG2 3.45Å; F1179-V1325 VanDerWaalsContact CE1-CG2 3.45Å; F1179-V1325 HydrophobicContact CZ-CG2 3.6Å; T1321-V1325 WeakPolarHBondContact O-CG2 3.35Å; T1321-V1325 PolarHBondContact O-N 3.45Å; L1322-V1325 PolarHBondContact O-N 3.08Å; L1322-V1325 VanDerWaalsContact O-N 3.16Å
1326	N	69.1	Low	61.1	Low	3 Å²	3	50.8 Å²	50.8	2%	0.016	27%	0.271	C	S	.	.	H	α-helix	trans	-93	-10	-170.7	-63.8	-88.1	0	0	0	113.8	L1102 Q1137 N1141 L1322 I1328	L1102-N1326 HydrophobicContact CD1-CB 3.96Å; L1102-N1326 WeakPolarHBondContact CD1-OD1 3.21Å; Q1137-N1326 WeakPolarHBondContact CG-OD1 3.42Å; Q1137-N1326 PolarHBondContact NE2-OD1 2.91Å; N1141-N1326 PolarHBondContact ND2-ND2 2.98Å; N1141-N1326 PolarHBondContact ND2-OD1 3.23Å; N1141-N1326 PolarHBondContact OD1-ND2 2.83Å; N1141-N1326 PolarHBondContact OD1-OD1 2.7Å; L1322-N1326 WeakPolarHBondContact O-CB 3.34Å; L1322-N1326 PolarHBondContact O-N 3.46Å; L1322-N1326 PolarHBondContact O-ND2 3.03Å; N1326-I1328 VanDerWaalsContact C-N 3.25Å; N1326-I1328 HydrophobicContact CB-CD1 4.09Å; N1326-I1328 HydrophobicContact CB-CG1 4.04Å; N1326-I1328 PolarHBondContact O-N 3.07Å
1327	G	60.8	Low	59	Low	18 Å²	18	55.3 Å²	55.3	19%	0.186	29%	0.29	C	S	.	.			trans	70	12.8	179.1	0	0	0	0	0	115.4	N1323 L1329 V1330	N1323-G1327 PolarHBondContact O-N 3.37Å; N1323-G1327 VanDerWaalsContact O-N 3.09Å; G1327-L1329 VanDerWaalsContact C-N 3.25Å; G1327-L1329 PolarHBondContact O-N 3.24Å; G1327-V1330 WeakPolarHBondContact O-CB 3.27Å; G1327-V1330 PolarHBondContact O-N 3.04Å
1328	I	52.4	Low	56.4	Low	6 Å²	6	60.4 Å²	60.4	3%	0.031	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-41.7	-174.4	-67.8	162.7	0	0	0	112.6	Y1063 L1102 Y1103 N1326	Y1063-I1328 HydrophobicContact CD1-CG2 3.85Å; Y1063-I1328 HydrophobicContact CE1-CG2 4.05Å; L1102-I1328 HydrophobicContact CB-CD1 3.55Å; L1102-I1328 HydrophobicContact CD1-CD1 3.63Å; L1102-I1328 HydrophobicContact CD2-CD1 4.49Å; L1102-I1328 HydrophobicContact CG-CD1 4.06Å; Y1103-I1328 HydrophobicContact CE1-CG2 3.95Å; N1326-I1328 VanDerWaalsContact C-N 3.25Å; N1326-I1328 HydrophobicContact CB-CD1 4.09Å; N1326-I1328 HydrophobicContact CB-CG1 4.04Å; N1326-I1328 PolarHBondContact O-N 3.07Å
1329	L	45.2	Very low	54	Low	29 Å²	29	67.8 Å²	67.8	15%	0.152	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-6.3	179.9	-66.4	175.8	0	0	0	113.7	Y1063 V1064 N1323 G1327 I1331 I1367	Y1063-L1329 HydrophobicContact CD1-CD2 3.94Å; Y1063-L1329 HydrophobicContact CE1-CD2 3.7Å; Y1063-L1329 HydrophobicContact CE1-CG 4.28Å; V1064-L1329 HydrophobicContact CG2-CD2 3.84Å; N1323-L1329 HydrophobicContact CB-CD1 3.75Å; N1323-L1329 HydrophobicContact CB-CG 4.11Å; N1323-L1329 WeakPolarHBondContact ND2-CD1 3.34Å; G1327-L1329 VanDerWaalsContact C-N 3.25Å; G1327-L1329 PolarHBondContact O-N 3.24Å; L1329-I1331 VanDerWaalsContact C-N 3.31Å; L1329-I1331 PolarHBondContact O-N 2.84Å; L1329-I1367 HydrophobicContact CD1-CD1 3.61Å; L1329-I1367 HydrophobicContact CD2-CD1 3.86Å; L1329-I1367 HydrophobicContact CG-CD1 4.23Å
1330	V	46.1	Very low	51.5	Low	66 Å²	66	74.6 Å²	74.6	40%	0.4	38%	0.384	S	S	.	.			trans	-86	76.3	-179	-171.9	0	0	0	0	109.4	G1327 Q1332	G1327-V1330 WeakPolarHBondContact O-CB 3.27Å; G1327-V1330 PolarHBondContact O-N 3.04Å; V1330-Q1332 HydrophobicContact CG1-CG 4.38Å; V1330-Q1332 PolarHBondContact O-N 3.5Å
1331	I	48.4	Very low	49.3	Very low	11 Å²	11	79.6 Å²	79.6	6%	0.056	41%	0.407	C	S	.	.			trans	-75.2	112.3	157.2	-54.1	179.8	0	0	0	106.1	I1021 L1026 L1061 V1064 L1329 I1333 I1363	I1021-I1331 HydrophobicContact CG2-CD1 4.25Å; I1021-I1331 HydrophobicContact CG2-CG2 3.65Å; I1021-I1331 VanDerWaalsContact O-CG2 3.32Å; I1021-I1331 WeakPolarHBondContact O-CG2 3.38Å; L1026-I1331 HydrophobicContact CD1-CD1 4.1Å; L1026-I1331 HydrophobicContact CD2-CD1 3.55Å; L1026-I1331 HydrophobicContact CD2-CG2 4.14Å; L1026-I1331 HydrophobicContact CG-CD1 4.48Å; L1061-I1331 HydrophobicContact CD2-CD1 4.32Å; V1064-I1331 HydrophobicContact CG1-CD1 4.43Å; V1064-I1331 HydrophobicContact CG2-CD1 4.28Å; L1329-I1331 VanDerWaalsContact C-N 3.31Å; L1329-I1331 PolarHBondContact O-N 2.84Å; I1331-I1333 HydrophobicContact CG2-CG1 4.28Å; I1331-I1333 PolarHBondContact O-N 2.92Å; I1331-I1363 HydrophobicContact CB-CD1 3.77Å; I1331-I1363 HydrophobicContact CD1-CD1 4.06Å; I1331-I1363 HydrophobicContact CG1-CD1 4.07Å
1332	Q	42.2	Very low	46.7	Very low	121 Å²	121	82.6 Å²	82.6	57%	0.565	43%	0.43	S	S	*	.			trans	-67.3	103.8	173.3	-71.5	-177.1	-47.9	0	0	108.7	S1022 V1330	S1022-Q1332 CarbonylContact C-O 3.53Å; S1022-Q1332 WeakPolarHBondContact CA-O 3.4Å; V1330-Q1332 HydrophobicContact CG1-CG 4.38Å; V1330-Q1332 PolarHBondContact O-N 3.5Å
1333	I	37.9	Very low	44.3	Very low	41 Å²	41	90 Å²	90	21%	0.21	46%	0.464	C	S	.	.			trans	-93.1	126.9	176	-62.9	-175.1	0	0	0	109	S1022 I1331 G1335 V1362 I1363	S1022-I1333 WeakPolarHBondContact O-CA 3.29Å; I1331-I1333 HydrophobicContact CG2-CG1 4.28Å; I1331-I1333 PolarHBondContact O-N 2.92Å; I1333-G1335 PolarHBondContact O-N 3.48Å; I1333-G1335 VanDerWaalsContact O-N 3.15Å; I1333-V1362 HydrophobicContact CB-CB 4.17Å; I1333-V1362 HydrophobicContact CB-CG1 4.18Å; I1333-V1362 HydrophobicContact CB-CG2 4.42Å; I1333-V1362 HydrophobicContact CD1-CG1 3.93Å; I1333-V1362 HydrophobicContact CG1-CG1 4.41Å; I1333-I1363 HydrophobicContact CD1-CD1 4.07Å; I1333-I1363 HydrophobicContact CD1-CG1 3.98Å
1334	R	38	Very low	42.1	Very low	96 Å²	96	96.7 Å²	96.7	36%	0.362	50%	0.495	S	S	.	.			trans	-61.9	110.7	163.7	-102.2	178.2	174.3	169.5	1.8	110.6	S1022 K1336 S1354 D1355 L1356	S1022-R1334 PolarHBondContact O-N 2.55Å; R1334-K1336 PolarHBondContact O-N 2.87Å; R1334-S1354 PolarHBondContact NH1-OG 3.08Å; R1334-S1354 PolarHBondContact NH2-O 3.08Å; R1334-S1354 PolarHBondContact NH2-OG 2.91Å; R1334-S1354 VanDerWaalsContact NH2-OG 3.17Å; R1334-D1355 PolarHBondContact NH2-O 2.92Å; R1334-L1356 HydrophobicContact CG-CD1 4.05Å; R1334-L1356 HydrophobicContact CG-CD2 3.76Å; R1334-L1356 HydrophobicContact CG-CG 4.26Å
1335	G	30.8	Very low	40	Very low	70 Å²	70	98 Å²	98	72%	0.722	51%	0.507	S	S	*	.	P	Polyproline II helix	trans	-62.9	129.6	163.7	0	0	0	0	0	110.1	I1333	I1333-G1335 PolarHBondContact O-N 3.48Å; I1333-G1335 VanDerWaalsContact O-N 3.15Å
1336	K	32.8	Very low	38	Very low	184 Å²	184	103.4 Å²	103.4	80%	0.8	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-87.9	131.7	157.8	-78.4	-179.9	173.9	175.8	0	107.5	R1334 D1338	R1334-K1336 PolarHBondContact O-N 2.87Å; K1336-D1338 PolarHBondContact O-N 3.06Å
1337	D	33.1	Very low	36	Very low	158 Å²	158	111.5 Å²	111.5	85%	0.845	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-72	120.7	166.4	-72.3	-49.2	0	0	0	109.2	N1339	D1337-N1339 PolarHBondContact O-N 3.05Å
1338	D	27.9	Very low	34.4	Very low	153 Å²	153	118.4 Å²	118.4	82%	0.818	60%	0.603	S	S	*	*			trans	-72.1	90.7	-179.6	-85.9	-43.5	0	0	0	111.5	K1336	K1336-D1338 PolarHBondContact O-N 3.06Å
1339	N	32.2	Very low	33.1	Very low	157 Å²	157	126.7 Å²	126.7	84%	0.84	65%	0.647	S	S	*	*			trans	-121.2	103.8	160.8	-89.8	-60.2	0	0	0	110.2	D1337	D1337-N1339 PolarHBondContact O-N 3.05Å
1340	Q	28.4	Very low	32.1	Very low	169 Å²	169	129.8 Å²	129.8	79%	0.79	67%	0.671	S	S	*	*			trans	-73.8	128.4	175.3	-59.1	170.5	-3.9	0	0	110
1341	H	31	Very low	31.1	Very low	173 Å²	173	132.4 Å²	132.4	80%	0.801	69%	0.687	S	S	*	*			trans	-174.7	135.4	130	-103.9	57.7	0	0	0	113.4
1342	S	28.5	Very low	30.1	Very low	95 Å²	95	135.4 Å²	135.4	66%	0.664	70%	0.703	S	S	*	*			trans	54.7	113.4	150.9	57.6	0	0	0	0	123.2
1343	H	29.3	Very low	29.3	Very low	155 Å²	155	134.7 Å²	134.7	72%	0.718	70%	0.698	S	S	*	*			trans	80.4	113.5	130.8	-78	-96	0	0	0	123.2
1344	E	29.2	Very low	28.8	Very low	153 Å²	153	135.9 Å²	135.9	72%	0.715	71%	0.71	S	S	*	*			trans	66.8	133.6	131.1	-73.1	163.3	160.9	0	0	123
1345	E	27.1	Very low	28.1	Very low	177 Å²	177	133.9 Å²	133.9	83%	0.827	71%	0.707	S	S	*	*			trans	39.3	129.9	149.1	-52.1	-170.6	141.4	0	0	119.3
1346	D	28.4	Very low	27.9	Very low	137 Å²	137	135.5 Å²	135.5	73%	0.733	70%	0.698	S	S	*	*				-161.2	-171.3	50.9	-154	-13.2	0	0	0	113.4
1347	K	27	Very low	27.5	Very low	172 Å²	172	131.2 Å²	131.2	75%	0.748	69%	0.688	S	S	*	*			trans	-87.5	127.5	-177.9	-53.5	135	-171.6	144.5	0	112.1
1348	N	27.3	Very low	27.1	Very low	163 Å²	163	129.8 Å²	129.8	87%	0.872	68%	0.676	S	S	*	*			trans	-164.2	137.5	143.4	-99.2	-39.9	0	0	0	109.8
1349	L	24.6	Very low	27	Very low	180 Å²	180	127.6 Å²	127.6	94%	0.942	67%	0.67	S	S	*	*			trans	-116.6	85.2	-174.1	-164.3	82.3	0	0	0	111.1
1350	S	24.7	Very low	26.6	Very low	95 Å²	95	127.2 Å²	127.2	66%	0.664	66%	0.663	S	S	*	*			trans	-139	131.9	176.1	48.4	0	0	0	0	112.4
1351	T	25	Very low	26.5	Very low	120 Å²	120	124.4 Å²	124.4	74%	0.736	66%	0.657	S	S	*	*			trans	23.6	105.7	152.6	51.9	0	0	0	0	118.7
1352	N	26.7	Very low	26.3	Very low	75 Å²	75	118.9 Å²	118.9	40%	0.401	64%	0.635	S	S	.	*			trans	-149.3	110.2	147.7	-112.4	-59.3	0	0	0	115.3	K704	K704-N1352 WeakPolarHBondContact CD-OD1 3.39Å; K704-N1352 PolarHBondContact NZ-OD1 3.15Å
1353	K	26.3	Very low	26.3	Very low	106 Å²	106	115.7 Å²	115.7	46%	0.461	61%	0.611	S	S	.	*			trans	-56.7	132.9	162.1	-59.4	175.9	-177.9	173.5	0	108.8	D609 K704	D609-K1353 IonicContact OD1-NZ 3.35Å; D609-K1353 PolarHBondContact OD1-NZ 3.04Å; D609-K1353 IonicContact OD2-NZ 3.49Å; D609-K1353 PolarHBondContact OD2-NZ 3.46Å; K704-K1353 PolarHBondContact NZ-O 2.91Å
1354	S	25.9	Very low	26.3	Very low	65 Å²	65	111.7 Å²	111.7	46%	0.455	60%	0.599	S	S	.	*			trans	-149	147.5	178.9	47.5	0	0	0	0	112.3	R1334	R1334-S1354 PolarHBondContact NH1-OG 3.08Å; R1334-S1354 PolarHBondContact NH2-O 3.08Å; R1334-S1354 PolarHBondContact NH2-OG 2.91Å; R1334-S1354 VanDerWaalsContact NH2-OG 3.17Å
1355	D	24.2	Very low	26.2	Very low	55 Å²	55	109.1 Å²	109.1	29%	0.294	59%	0.59	S	S	.	*			trans	-75.3	153	-164.7	-62.8	-117.1	0	0	0	116.6	S691 R1334	S691-D1355 WeakPolarHBondContact CB-OD1 3.2Å; R1334-D1355 PolarHBondContact NH2-O 2.92Å
1356	L	26.8	Very low	26.4	Very low	103 Å²	103	109 Å²	109	54%	0.539	59%	0.587	S	S	.	*			trans	-141.8	120.4	158.2	-81.9	179.4	0	0	0	111.3	R1334	R1334-L1356 HydrophobicContact CG-CD1 4.05Å; R1334-L1356 HydrophobicContact CG-CD2 3.76Å; R1334-L1356 HydrophobicContact CG-CG 4.26Å
1357	T	23.6	Very low	26.7	Very low	94 Å²	94	105 Å²	105	58%	0.577	57%	0.565	S	S	*	*			trans	-135.2	159.1	160.3	28.5	0	0	0	0	107.8	S691	S691-T1357 WeakPolarHBondContact OG-CG2 3.36Å; S691-T1357 PolarHBondContact OG-OG1 3.04Å
1358	E	25.1	Very low	26.8	Very low	129 Å²	129	105.1 Å²	105.1	60%	0.603	56%	0.561	S	S	*	*	S	Bend	trans	79.4	105.4	-170.1	-49.9	179.2	126	0	0	113.1	K694 H1360	K694-E1358 IonicContact NZ-OE2 3.75Å; K694-E1358 PolarHBondContact NZ-OE2 2.83Å; E1358-H1360 PolarHBondContact O-N 3.34Å
1359	P	24.8	Very low	27	Very low	106 Å²	106	105 Å²	105	69%	0.688	56%	0.555	S	S	*	*			trans	-87.2	103.8	-179.7	33	-32	0	0	0	111.8
1360	H	25.2	Very low	27.4	Very low	150 Å²	150	99.4 Å²	99.4	69%	0.694	53%	0.531	S	S	*	.			trans	-84.3	130.1	166.8	-80.6	-89.5	0	0	0	111.4	E1358 V1362	E1358-H1360 PolarHBondContact O-N 3.34Å; H1360-V1362 HydrophobicContact CB-CG2 4.39Å; H1360-V1362 PolarHBondContact O-N 3.12Å
1361	V	25.9	Very low	27.9	Very low	110 Å²	110	100.1 Å²	100.1	67%	0.667	52%	0.522	S	S	*	.			trans	-76.3	91.3	171.7	-179.4	0	0	0	0	108.9
1362	V	26.5	Very low	28.2	Very low	57 Å²	57	101 Å²	101	35%	0.345	52%	0.522	S	S	.	.			trans	-94.6	154.6	166	-168.1	0	0	0	0	108.1	I1333 H1360	I1333-V1362 HydrophobicContact CB-CB 4.17Å; I1333-V1362 HydrophobicContact CB-CG1 4.18Å; I1333-V1362 HydrophobicContact CB-CG2 4.42Å; I1333-V1362 HydrophobicContact CD1-CG1 3.93Å; I1333-V1362 HydrophobicContact CG1-CG1 4.41Å; H1360-V1362 HydrophobicContact CB-CG2 4.39Å; H1360-V1362 PolarHBondContact O-N 3.12Å
1363	I	27.8	Very low	28.3	Very low	28 Å²	28	103.6 Å²	103.6	14%	0.144	54%	0.536	C	S	.	.	S	Bend	trans	68.8	62.5	-169	-38.1	-178.1	0	0	0	113.4	L1026 V1064 I1331 I1333 I1367	L1026-I1363 HydrophobicContact CD1-CD1 4.28Å; V1064-I1363 HydrophobicContact CG1-CD1 4.43Å; I1331-I1363 HydrophobicContact CB-CD1 3.77Å; I1331-I1363 HydrophobicContact CD1-CD1 4.06Å; I1331-I1363 HydrophobicContact CG1-CD1 4.07Å; I1333-I1363 HydrophobicContact CD1-CD1 4.07Å; I1333-I1363 HydrophobicContact CD1-CG1 3.98Å; I1363-I1367 HydrophobicContact CG2-CD1 3.92Å; I1363-I1367 HydrophobicContact CG2-CG1 4.35Å
1364	C	30.6	Very low	28.6	Very low	71 Å²	71	104.6 Å²	104.6	48%	0.48	55%	0.545	S	S	.	.	S	Bend	trans	-126.2	-39	156.4	-84.2	0	0	0	0	112.3	I1367 R1368	C1364-I1367 PolarHBondContact O-N 3.35Å; C1364-R1368 PolarHBondContact O-N 2.73Å; C1364-R1368 VanDerWaalsContact O-N 3.14Å
1365	D	27.6	Very low	28.7	Very low	99 Å²	99	109 Å²	109	53%	0.529	56%	0.559	S	S	.	*	H	α-helix	trans	-77.5	-23	-172.3	-65.9	-62	0	0	0	115.8	R1368	D1365-R1368 WeakPolarHBondContact O-CB 3.48Å; D1365-R1368 PolarHBondContact O-N 3.04Å; D1365-R1368 WeakPolarHBondContact OD1-CD 3.26Å; D1365-R1368 IonicContact OD1-CZ 3.63Å; D1365-R1368 IonicContact OD1-NE 2.79Å; D1365-R1368 IonicContact OD1-NH1 3.76Å; D1365-R1368 PolarHBondContact OD1-NH1 3.02Å
1366	K	30.3	Very low	29	Very low	174 Å²	174	113.3 Å²	113.3	76%	0.757	58%	0.581	S	S	*	*	H	α-helix	trans	-67.5	-37.4	167	-80.9	-169.9	174.7	-176.8	0	111.8	R1368 Q1369 S1370	K1366-R1368 VanDerWaalsContact C-N 3.28Å; K1366-R1368 PolarHBondContact O-N 3.42Å; K1366-Q1369 WeakPolarHBondContact O-CB 3.47Å; K1366-Q1369 PolarHBondContact O-N 2.9Å; K1366-S1370 PolarHBondContact O-N 2.87Å
1367	I	34.1	Very low	29.1	Very low	52 Å²	52	116.9 Å²	116.9	27%	0.267	60%	0.6	S	S	.	*	H	α-helix	trans	-71.5	-26	178.7	-60.6	178.7	0	0	0	111.1	L1329 I1363 C1364 Q1369 S1370 K1371	L1329-I1367 HydrophobicContact CD1-CD1 3.61Å; L1329-I1367 HydrophobicContact CD2-CD1 3.86Å; L1329-I1367 HydrophobicContact CG-CD1 4.23Å; I1363-I1367 HydrophobicContact CG2-CD1 3.92Å; I1363-I1367 HydrophobicContact CG2-CG1 4.35Å; C1364-I1367 PolarHBondContact O-N 3.35Å; I1367-Q1369 PolarHBondContact O-N 3.48Å; I1367-S1370 PolarHBondContact O-OG 3.33Å; I1367-K1371 WeakPolarHBondContact O-CG 3.4Å
1368	R	30	Very low	29.3	Very low	176 Å²	176	116.5 Å²	116.5	66%	0.664	60%	0.601	S	S	*	*	H	α-helix	trans	-61.3	-26.5	166.2	-93.5	173.2	166.5	159.6	-4.9	113.7	C1364 D1365 K1366	C1364-R1368 PolarHBondContact O-N 2.73Å; C1364-R1368 VanDerWaalsContact O-N 3.14Å; D1365-R1368 WeakPolarHBondContact O-CB 3.48Å; D1365-R1368 PolarHBondContact O-N 3.04Å; D1365-R1368 WeakPolarHBondContact OD1-CD 3.26Å; D1365-R1368 IonicContact OD1-CZ 3.63Å; D1365-R1368 IonicContact OD1-NE 2.79Å; D1365-R1368 IonicContact OD1-NH1 3.76Å; D1365-R1368 PolarHBondContact OD1-NH1 3.02Å; K1366-R1368 VanDerWaalsContact C-N 3.28Å; K1366-R1368 PolarHBondContact O-N 3.42Å
1369	Q	32	Very low	29.3	Very low	159 Å²	159	116.8 Å²	116.8	74%	0.743	61%	0.613	S	S	*	*	H	α-helix	trans	-87.2	-26.1	-177.4	-66.4	179.7	-13.4	0	0	113.1	K1366 I1367 K1371	K1366-Q1369 WeakPolarHBondContact O-CB 3.47Å; K1366-Q1369 PolarHBondContact O-N 2.9Å; I1367-Q1369 PolarHBondContact O-N 3.48Å; Q1369-K1371 VanDerWaalsContact C-N 3.33Å; Q1369-K1371 PolarHBondContact O-N 3.07Å
1370	S	33.2	Very low	29.6	Very low	64 Å²	64	116.8 Å²	116.8	45%	0.448	62%	0.616	S	S	.	*	S	Bend	trans	-84.7	4.7	175	57.2	0	0	0	0	114.8	K1366 I1367 N1372	K1366-S1370 PolarHBondContact O-N 2.87Å; I1367-S1370 PolarHBondContact O-OG 3.33Å; S1370-N1372 PolarHBondContact O-N 2.69Å
1371	K	33.7	Very low	29.7	Very low	109 Å²	109	114.6 Å²	114.6	47%	0.474	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.1	6	-175.4	-74.2	-155.7	169.7	-164.7	0	116.4	E1320 I1367 Q1369	E1320-K1371 IonicContact OE2-NZ 3.78Å; E1320-K1371 PolarHBondContact OE2-NZ 2.64Å; I1367-K1371 WeakPolarHBondContact O-CG 3.4Å; Q1369-K1371 VanDerWaalsContact C-N 3.33Å; Q1369-K1371 PolarHBondContact O-N 3.07Å
1372	N	31.7	Very low	29.8	Very low	139 Å²	139	114.5 Å²	114.5	74%	0.743	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.3	-19.2	-177.6	-69.8	-27.1	0	0	0	115	S1370	S1370-N1372 PolarHBondContact O-N 2.69Å
1373	D	30.1	Very low	30	Very low	130 Å²	130	118.7 Å²	118.7	70%	0.695	64%	0.642	S	S	*	*			trans	-104.2	4.8	-162.8	-60.9	-57.4	0	0	0	115.4	H1375	D1373-H1375 VanDerWaalsContact C-N 3.28Å; D1373-H1375 PolarHBondContact O-N 3.39Å
1374	I	31.4	Very low	30	Very low	126 Å²	126	123.7 Å²	123.7	65%	0.646	67%	0.669	S	S	*	*			trans	-78.7	75.9	178.4	-51.4	179.9	0	0	0	110.5	L1376	I1374-L1376 PolarHBondContact O-N 3.3Å
1375	H	28.2	Very low	30.2	Very low	159 Å²	159	130 Å²	130	74%	0.736	69%	0.689	S	S	*	*			trans	-83.7	104.6	174.8	-104	-74.6	0	0	0	111.8	D1373 L1377	D1373-H1375 VanDerWaalsContact C-N 3.28Å; D1373-H1375 PolarHBondContact O-N 3.39Å; H1375-L1377 PolarHBondContact O-N 2.76Å
1376	L	30.6	Very low	30.3	Very low	145 Å²	145	130.4 Å²	130.4	76%	0.759	70%	0.699	S	S	*	*			trans	-62.1	123.1	171.7	-73.9	162.7	0	0	0	111.2	I1374 S1378	I1374-L1376 PolarHBondContact O-N 3.3Å; L1376-S1378 PolarHBondContact O-N 3.19Å; L1376-S1378 VanDerWaalsContact O-N 3.15Å
1377	L	28.5	Very low	30.6	Very low	178 Å²	178	126.7 Å²	126.7	93%	0.932	69%	0.693	S	S	*	*			trans	-74.4	99.6	177	-74.2	170.7	0	0	0	111.1	H1375	H1375-L1377 PolarHBondContact O-N 2.76Å
1378	S	27.2	Very low	30.4	Very low	86 Å²	86	135.1 Å²	135.1	60%	0.601	72%	0.722	S	S	*	*			trans	-79	137.3	171.1	57.1	0	0	0	0	111.4	L1376 S1380	L1376-S1378 PolarHBondContact O-N 3.19Å; L1376-S1378 VanDerWaalsContact O-N 3.15Å; S1378-S1380 PolarHBondContact O-N 3.41Å
1379	P	26.3	Very low	30.5	Very low	134 Å²	134	130.9 Å²	130.9	87%	0.87	72%	0.719	S	S	*	*			trans	-78.2	94.6	-179.5	30.3	-34.2	0	0	0	111.4
1380	S	30.7	Very low	30.3	Very low	106 Å²	106	131.5 Å²	131.5	74%	0.741	72%	0.719	S	S	*	*			trans	-106.4	122.4	175.2	62	0	0	0	0	112.8	S1378	S1378-S1380 PolarHBondContact O-N 3.41Å
1381	S	27.6	Very low	30.2	Very low	105 Å²	105	133.5 Å²	133.5	73%	0.734	73%	0.731	S	S	*	*			trans	-68.7	146.5	171.8	53.4	0	0	0	0	113
1382	S	27.6	Very low	30	Very low	108 Å²	108	134 Å²	134	76%	0.755	74%	0.743	S	S	*	*			trans	52.9	122.3	164.7	54.4	0	0	0	0	116.5
1383	D	30.4	Very low	29.9	Very low	144 Å²	144	133 Å²	133	77%	0.77	75%	0.747	S	S	*	*				-164.8	-174.6	56.2	-142.6	-38.1	0	0	0	113.4
1384	N	28.4	Very low	29.8	Very low	133 Å²	133	135 Å²	135	71%	0.711	76%	0.757	S	S	*	*			trans	-80.1	123	-171.7	-64.9	-97.5	0	0	0	114.2
1385	K	33.6	Very low	29.7	Very low	203 Å²	203	135.7 Å²	135.7	88%	0.883	76%	0.762	S	S	*	*				173.8	143.2	119.4	-91.7	150.3	-168.3	166.8	0	114.2
1386	S	31	Very low	29.8	Very low	108 Å²	108	134.1 Å²	134.1	76%	0.755	76%	0.759	S	S	*	*			trans	-81.8	174.4	169.7	72.6	0	0	0	0	110.4
1387	P	37	Very low	29.6	Very low	97 Å²	97	134.2 Å²	134.2	63%	0.63	76%	0.76	S	S	*	*			cis	-156	174.8	46.5	45.5	-24.3	0	0	0	120.6
1388	R	29.2	Very low	29.5	Very low	229 Å²	229	132.6 Å²	132.6	86%	0.864	75%	0.753	S	S	*	*			trans	73.9	148.3	153.2	-75.6	160.9	-170.7	-169.2	1.3	118.7
1389	S	31.6	Very low	29.5	Very low	86 Å²	86	134 Å²	134	60%	0.601	76%	0.757	S	S	*	*			cis	177.5	163.8	-15.9	53.3	0	0	0	0	107.9
1390	F	28.3	Very low	29.5	Very low	173 Å²	173	134 Å²	134	76%	0.759	75%	0.75	S	S	*	*			cis	-154	-171.9	11.1	-95.3	-61.7	0	0	0	106.4	T1392	F1390-T1392 HydrophobicContact CD1-CG2 4.31Å
1391	P	31.3	Very low	29.3	Very low	106 Å²	106	134 Å²	134	69%	0.688	74%	0.736	S	S	*	*			cis	-119.6	132.9	-23.9	18.6	3.7	0	0	0	111.8
1392	T	28.8	Very low	29.2	Very low	118 Å²	118	133.1 Å²	133.1	72%	0.724	73%	0.728	S	S	*	*				51	135	87.3	64	0	0	0	0	115.6	F1390	F1390-T1392 HydrophobicContact CD1-CG2 4.31Å
1393	S	29.3	Very low	29.3	Very low	118 Å²	118	134.6 Å²	134.6	83%	0.825	73%	0.732	S	S	*	*			cis	-141.7	150.4	36.1	49.5	0	0	0	0	116.8
1394	L	28.2	Very low	29.1	Very low	174 Å²	174	132.4 Å²	132.4	91%	0.911	72%	0.72	S	S	*	*			trans	-148.6	148.3	167.5	-127.8	173.6	0	0	0	106.8
1395	N	30.9	Very low	28.9	Very low	139 Å²	139	131 Å²	131	74%	0.743	72%	0.718	S	S	*	*			trans	-154.2	101.4	175.6	-155.1	12.8	0	0	0	113.2
1396	N	28.5	Very low	28.7	Very low	127 Å²	127	126.6 Å²	126.6	68%	0.679	71%	0.708	S	S	*	*			trans	21.3	118.5	151.5	-46.9	-48.3	0	0	0	117.4
1397	N	27.1	Very low	28.6	Very low	146 Å²	146	128.7 Å²	128.7	78%	0.781	71%	0.71	S	S	*	*				-159.3	171.4	64.2	-76.1	-49.1	0	0	0	113.4
1398	D	26.5	Very low	28.2	Very low	145 Å²	145	130.3 Å²	130.3	78%	0.775	71%	0.714	S	S	*	*			trans	65.1	110.5	161.4	-65.2	-41.8	0	0	0	121.1
1399	V	26.3	Very low	28.2	Very low	116 Å²	116	125.1 Å²	125.1	70%	0.703	71%	0.706	S	S	*	*			trans	55.5	116.2	130.8	-172.6	0	0	0	0	120
1400	N	27.1	Very low	28	Very low	133 Å²	133	127.3 Å²	127.3	71%	0.711	71%	0.712	S	S	*	*			trans	58	94.3	155	-61.3	-14.3	0	0	0	119.5
1401	K	26.2	Very low	28	Very low	106 Å²	106	124.6 Å²	124.6	46%	0.461	71%	0.709	S	S	.	*			trans	-150.8	148.1	138.4	-110.8	109.4	-145	-179.4	0	112	D50 P51 F52	D50-K1401 PolarHBondContact O-NZ 2.75Å; P51-K1401 PolarHBondContact O-NZ 3.03Å; F52-K1401 HydrophobicContact CB-CD 4.15Å
1402	P	26.8	Very low	27.8	Very low	86 Å²	86	125.8 Å²	125.8	56%	0.558	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-78.4	145.3	170.8	32.8	-33.1	0	0	0	111
1403	V	28.1	Very low	27.7	Very low	140 Å²	140	126.3 Å²	126.3	85%	0.848	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-80	127.1	170.5	176.8	0	0	0	0	108.9
1404	I	26.1	Very low	27.6	Very low	98 Å²	98	126.9 Å²	126.9	50%	0.503	70%	0.701	S	S	.	*	P	Polyproline II helix	trans	-77.4	125.7	174.7	-60.6	170.2	0	0	0	108.3
1405	P	25.8	Very low	27.5	Very low	104 Å²	104	123.2 Å²	123.2	68%	0.675	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-74.1	124.1	165.5	30.6	-30.9	0	0	0	108.9	L1407	P1405-L1407 PolarHBondContact O-N 3.5Å
1406	V	28.4	Very low	27.2	Very low	110 Å²	110	121.9 Å²	121.9	67%	0.667	68%	0.68	S	S	*	*			trans	-73.9	115.2	174.7	179.1	0	0	0	0	108.9
1407	L	30	Very low	27.1	Very low	152 Å²	152	121.5 Å²	121.5	80%	0.796	68%	0.68	S	S	*	*			trans	39	0	162.3	-66.4	166.8	0	0	0	119.2	R1077 P1405	R1077-L1407 VanDerWaalsContact NH1-C 3.34Å; R1077-L1407 PolarHBondContact NH1-O 2.83Å; R1077-L1407 PolarHBondContact NH1-OXT 2.94Å; R1077-L1407 VanDerWaalsContact NH1-OXT 3.16Å; R1077-L1407 PolarHBondContact NH2-O 3.46Å; R1077-L1407 PolarHBondContact NH2-OXT 3.47Å; P1405-L1407 PolarHBondContact O-N 3.5Å

Retrieved 1,407 of 1,407 residues in 1608.2 ms (Link to these results)

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